A0A087YI45_POEFO Loading...

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AlphaFold DB , UniProt , Accession A0A087YI45, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 653 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	35.6	Very low	27	Very low	249 Å²	249	154.5 Å²	154.5	100%	1.227	88%	0.882	S	S	*	*				0	90.1	0	-92	-177.3	168.8	0	0	107.6
2	E	27.3	Very low	26.7	Very low	196 Å²	196	149.8 Å²	149.8	92%	0.916	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-78.2	140.6	-174.8	-73.3	165.2	131.2	0	0	111.5
3	K	25.6	Very low	26.5	Very low	201 Å²	201	148.2 Å²	148.2	87%	0.874	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-83.6	141.2	166.2	-77.4	177.6	175	176	0	108.9
4	P	29.3	Very low	26.3	Very low	130 Å²	130	145.6 Å²	145.6	84%	0.844	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-78.3	139.4	-177.4	29.8	-29.2	0	0	0	111.8
5	A	27.1	Very low	26.1	Very low	98 Å²	98	146.5 Å²	146.5	81%	0.81	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-70.7	143.5	177.3	0	0	0	0	0	112.5
6	R	24.5	Very low	26.1	Very low	238 Å²	238	145.6 Å²	145.6	90%	0.898	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-81	141.5	167.3	-67.3	179	-178.9	-178.8	-0.4	109.3
7	P	27.3	Very low	25.9	Very low	129 Å²	129	148.1 Å²	148.1	84%	0.838	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-77	136.9	179.2	30.1	-31.5	0	0	0	111.4
8	A	26.6	Very low	26	Very low	101 Å²	101	149.9 Å²	149.9	84%	0.835	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-65.4	131.9	173.7	0	0	0	0	0	111.2	S10	A8-S10 PolarHBondContact O-N 3.34Å
9	S	25.9	Very low	26	Very low	122 Å²	122	149.5 Å²	149.5	85%	0.853	85%	0.846	S	S	*	*			trans	-76.9	111.1	171.3	55.6	0	0	0	0	109.7	C11	S9-C11 PolarHBondContact O-N 3.21Å
10	S	24.7	Very low	26	Very low	107 Å²	107	151.8 Å²	151.8	75%	0.748	85%	0.847	S	S	*	*			trans	-71.7	122.4	174.4	-164.4	0	0	0	0	110.4	A8 S12	A8-S10 PolarHBondContact O-N 3.34Å; S10-S12 PolarHBondContact O-N 2.93Å
11	C	22.8	Very low	26	Very low	128 Å²	128	156.3 Å²	156.3	87%	0.865	85%	0.851	S	S	*	*			trans	-68.8	103.3	163.8	-98	0	0	0	0	108.6	S9 V13	S9-C11 PolarHBondContact O-N 3.21Å; C11-V13 PolarHBondContact O-N 3.46Å
12	S	24.1	Very low	25.4	Very low	99 Å²	99	151.5 Å²	151.5	69%	0.692	83%	0.83	S	S	*	*			trans	-89.5	105	175.4	-58.5	0	0	0	0	110.1	S10 V14	S10-S12 PolarHBondContact O-N 2.93Å; S12-V14 PolarHBondContact O-N 3.13Å
13	V	23.6	Very low	25.6	Very low	128 Å²	128	148.1 Å²	148.1	78%	0.776	83%	0.825	S	S	*	*			trans	-73.1	114.5	165.9	176.6	0	0	0	0	107.8	C11 L15	C11-V13 PolarHBondContact O-N 3.46Å; V13-L15 HydrophobicContact CG1-CG 4.45Å
14	V	24.1	Very low	25.5	Very low	113 Å²	113	145.9 Å²	145.9	69%	0.685	82%	0.822	S	S	*	*			trans	-107.7	100	171.6	-177.6	0	0	0	0	108.2	S12	S12-V14 PolarHBondContact O-N 3.13Å
15	L	23.2	Very low	25.3	Very low	158 Å²	158	146.6 Å²	146.6	83%	0.827	82%	0.818	S	S	*	*			trans	-74.2	121.2	161.7	-73.9	167.4	0	0	0	107.6	V13 E17	V13-L15 HydrophobicContact CG1-CG 4.45Å; L15-E17 PolarHBondContact O-N 2.05Å
16	V	25.3	Very low	25.1	Very low	132 Å²	132	149.4 Å²	149.4	80%	0.8	82%	0.818	S	S	*	*			trans	-71.8	111.7	173.8	175.9	0	0	0	0	108.1	E18	V16-E18 PolarHBondContact O-N 3.32Å
17	E	23.9	Very low	25	Very low	188 Å²	188	143.1 Å²	143.1	88%	0.879	81%	0.811	S	S	*	*			trans	-77.5	111.2	174.6	-156.5	173.8	-169.3	0	0	109.1	L15	L15-E17 PolarHBondContact O-N 2.05Å
18	E	26.8	Very low	24.9	Very low	181 Å²	181	142.9 Å²	142.9	85%	0.846	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-83.4	116.6	-178.3	-135	175.4	-172.2	0	0	110.1	V16 K20	V16-E18 PolarHBondContact O-N 3.32Å; E18-K20 PolarHBondContact O-N 2.85Å
19	T	26.4	Very low	24.7	Very low	142 Å²	142	141.2 Å²	141.2	87%	0.871	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-56	117.2	178.4	-1.5	0	0	0	0	112.3	R21	T19-R21 PolarHBondContact O-N 3.5Å
20	K	25.8	Very low	24.6	Very low	196 Å²	196	145.6 Å²	145.6	85%	0.852	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-56.6	126.9	170	-78.7	175.8	174.8	173.8	0	111.7	E18	E18-K20 PolarHBondContact O-N 2.85Å
21	R	25.7	Very low	24.5	Very low	247 Å²	247	144.4 Å²	144.4	93%	0.932	81%	0.806	S	S	*	*			trans	-115.8	124.3	151.6	-87.2	-175.8	176.2	-180	-1	108.7	T19	T19-R21 PolarHBondContact O-N 3.5Å
22	N	24.5	Very low	24.6	Very low	148 Å²	148	145.6 Å²	145.6	79%	0.791	81%	0.809	S	S	*	*			trans	-62.7	149.1	-179.5	-73	-21.9	0	0	0	112.7
23	P	29.5	Very low	24.6	Very low	125 Å²	125	145 Å²	145	81%	0.812	81%	0.81	S	S	*	*			trans	-92.1	141.1	164.4	34.6	-26.9	0	0	0	110.9
24	L	24.2	Very low	24.7	Very low	153 Å²	153	146.9 Å²	146.9	80%	0.801	82%	0.816	S	S	*	*			trans	-125.9	127.2	166.2	-93.6	166.6	0	0	0	108.7
25	L	24.3	Very low	24.6	Very low	146 Å²	146	144.7 Å²	144.7	76%	0.764	82%	0.816	S	S	*	*			trans	72.2	136.1	153.2	-64.2	157.6	0	0	0	115.8
26	L	24	Very low	24.7	Very low	156 Å²	156	143.2 Å²	143.2	82%	0.817	82%	0.819	S	S	*	*			cis	-159	149.1	26.2	-115.2	140.1	0	0	0	110.4
27	S	22	Very low	24.6	Very low	107 Å²	107	145.2 Å²	145.2	75%	0.748	82%	0.824	S	S	*	*			trans	-81.9	141.4	173.1	65.4	0	0	0	0	113.3
28	S	24.7	Very low	24.7	Very low	123 Å²	123	141.4 Å²	141.4	86%	0.86	83%	0.825	S	S	*	*			trans	-167.5	124.2	139.1	49.9	0	0	0	0	105.5
29	G	22.6	Very low	24.5	Very low	66 Å²	66	136.6 Å²	136.6	68%	0.68	82%	0.824	S	S	*	*			cis	104.8	79.6	31.7	0	0	0	0	0	107.9
30	F	23.5	Very low	24.4	Very low	214 Å²	214	134 Å²	134	94%	0.939	83%	0.825	S	S	*	*			trans	-157.3	114.4	152.3	-107.3	-77.4	0	0	0	109.9
31	A	23.4	Very low	24.3	Very low	83 Å²	83	127.9 Å²	127.9	69%	0.686	82%	0.818	S	S	*	*			trans	-89.2	150.7	164.9	0	0	0	0	0	108.9
32	T	24.2	Very low	24.3	Very low	152 Å²	152	123.3 Å²	123.3	93%	0.933	82%	0.817	S	S	*	*				-172.7	149.1	118.6	28.3	0	0	0	0	112.4
33	A	24	Very low	24.2	Very low	86 Å²	86	121 Å²	121	71%	0.711	82%	0.819	S	S	*	*			trans	-77.9	162.8	-174	0	0	0	0	0	114.4
34	N	26.1	Very low	24	Very low	169 Å²	169	118.9 Å²	118.9	90%	0.904	82%	0.819	S	S	*	*				-167.4	138.4	116.5	-104.2	-14.5	0	0	0	112.2
35	G	23	Very low	24	Very low	66 Å²	66	115.1 Å²	115.1	68%	0.68	82%	0.818	S	S	*	*			trans	-89.6	-175	-177.9	0	0	0	0	0	114
36	S	24.5	Very low	24.1	Very low	127 Å²	127	115.4 Å²	115.4	89%	0.888	83%	0.825	S	S	*	*				176.8	141.6	126.2	-73.5	0	0	0	0	111.4
37	L	24.3	Very low	24.1	Very low	175 Å²	175	111.8 Å²	111.8	92%	0.916	83%	0.826	S	S	*	*			trans	-70.5	155.2	-179.7	-69.7	115	0	0	0	113.9
38	A	26.2	Very low	24.3	Very low	107 Å²	107	116.1 Å²	116.1	88%	0.884	83%	0.834	S	S	*	*			trans	-162.5	130.1	131.8	0	0	0	0	0	110.5
39	G	22.1	Very low	24.4	Very low	81 Å²	81	117 Å²	117	84%	0.835	83%	0.829	S	S	*	*			trans	-124.1	168.4	174.6	0	0	0	0	0	112
40	G	24	Very low	24.6	Very low	87 Å²	87	124 Å²	124	90%	0.897	84%	0.841	S	S	*	*			trans	116.3	127.3	176.1	0	0	0	0	0	111.5
41	G	22.6	Very low	24.7	Very low	67 Å²	67	124.5 Å²	124.5	69%	0.691	84%	0.837	S	S	*	*			cis	148.3	126.4	3.7	0	0	0	0	0	109.5
42	V	25.8	Very low	24.8	Very low	152 Å²	152	124.3 Å²	124.3	92%	0.921	84%	0.842	S	S	*	*			trans	70.6	137.5	149.5	-165.7	0	0	0	0	117.7
43	A	24.3	Very low	24.8	Very low	100 Å²	100	120.9 Å²	120.9	83%	0.826	84%	0.837	S	S	*	*			cis	-165.8	163.7	-8	0	0	0	0	0	110.5
44	G	24.5	Very low	24.8	Very low	79 Å²	79	120 Å²	120	81%	0.814	84%	0.837	S	S	*	*			trans	160.2	110	160.6	0	0	0	0	0	114.4
45	G	23	Very low	25.2	Very low	75 Å²	75	117.2 Å²	117.2	77%	0.773	84%	0.837	S	S	*	*			trans	-62.8	163.8	-173.4	0	0	0	0	0	116.2
46	T	26.8	Very low	25.5	Very low	151 Å²	151	122.1 Å²	122.1	93%	0.926	85%	0.846	S	S	*	*				-163.9	145.2	63.8	32.8	0	0	0	0	109.8
47	G	23.8	Very low	25.6	Very low	80 Å²	80	119.4 Å²	119.4	83%	0.825	84%	0.839	S	S	*	*			trans	-83.7	144.6	-171.4	0	0	0	0	0	115.1
48	Q	27.4	Very low	26.1	Very low	199 Å²	199	118.3 Å²	118.3	93%	0.93	84%	0.839	S	S	*	*			trans	-136.6	114.1	145.3	-111.4	-177.1	3.8	0	0	108.4
49	D	25.6	Very low	26.3	Very low	141 Å²	141	115.8 Å²	115.8	75%	0.754	82%	0.823	S	S	*	*			trans	-62.7	124.6	176.8	-82.4	-52.1	0	0	0	112.4
50	K	27.5	Very low	26.8	Very low	212 Å²	212	118 Å²	118	92%	0.922	82%	0.824	S	S	*	*			trans	-136.5	99.5	138.7	-82.5	-166.3	178.6	177.7	0	108.9	G52	K50-G52 PolarHBondContact O-N 3.21Å
51	R	26.1	Very low	27.4	Very low	226 Å²	226	117.3 Å²	117.3	85%	0.853	82%	0.816	S	S	*	*			trans	-56.7	122.7	178.6	-72.1	175.6	177.9	-176.1	-2.4	111.2	G53	R51-G53 PolarHBondContact O-N 3.2Å
52	G	25.4	Very low	28.6	Very low	78 Å²	78	120.5 Å²	120.5	80%	0.804	81%	0.808	S	S	*	*			trans	-64.8	122.1	153.2	0	0	0	0	0	109.4	K50	K50-G52 PolarHBondContact O-N 3.21Å
53	G	24.6	Very low	29.9	Very low	80 Å²	80	119.5 Å²	119.5	83%	0.825	79%	0.793	S	S	*	*			trans	-80	115.4	168.2	0	0	0	0	0	109.2	R51	R51-G53 PolarHBondContact O-N 3.2Å
54	G	23.7	Very low	32	Very low	68 Å²	68	122.8 Å²	122.8	70%	0.701	79%	0.792	S	S	*	*			trans	-62.7	149.7	-174.6	0	0	0	0	0	114.7	I56	G54-I56 PolarHBondContact O-N 3.02Å
55	A	32.9	Very low	34.6	Very low	111 Å²	111	121.1 Å²	121.1	92%	0.917	76%	0.761	S	S	*	*			trans	-58.1	121.3	164	0	0	0	0	0	110
56	I	29.9	Very low	37.5	Very low	168 Å²	168	121.1 Å²	121.1	86%	0.862	74%	0.741	S	S	*	*			trans	-116.6	124.2	165.8	-64.6	177	0	0	0	107.2	G54	G54-I56 PolarHBondContact O-N 3.02Å
57	G	26.1	Very low	40.5	Very low	71 Å²	71	116.5 Å²	116.5	73%	0.732	71%	0.712	S	S	*	*			trans	90.6	94.3	146.7	0	0	0	0	0	117.2	G59	G57-G59 PolarHBondContact O-N 3.12Å
58	T	35.5	Very low	43.7	Very low	151 Å²	151	113.3 Å²	113.3	93%	0.926	68%	0.675	S	S	*	*			trans	-56.6	105.5	164.5	46.4	0	0	0	0	113.3
59	G	29.9	Very low	46.5	Very low	54 Å²	54	107.5 Å²	107.5	56%	0.557	65%	0.654	S	S	*	*			trans	-105.1	166.8	145.5	0	0	0	0	0	109.3	G57 G61	G57-G59 PolarHBondContact O-N 3.12Å; G59-G61 PolarHBondContact O-N 2.88Å
60	P	33	Very low	49.5	Very low	129 Å²	129	109 Å²	109	84%	0.838	65%	0.649	S	S	*	*			trans	-60.4	107.1	172.2	26.8	-30.6	0	0	0	107.3	Y62	P60-Y62 PolarHBondContact O-N 2.99Å
61	G	37.6	Very low	52.4	Low	72 Å²	72	103.8 Å²	103.8	74%	0.742	63%	0.628	S	S	*	*			trans	-56	105.4	-177.5	0	0	0	0	0	109.4	G59 Q63	G59-G61 PolarHBondContact O-N 2.88Å; G61-Q63 PolarHBondContact O-N 3.47Å
62	Y	46.2	Very low	55.5	Low	134 Å²	134	97.6 Å²	97.6	53%	0.525	61%	0.61	S	S	.	*			trans	-66.5	113.6	169.4	176.6	-101.6	0	0	0	106.5	P60 E64	P60-Y62 PolarHBondContact O-N 2.99Å; Y62-E64 PolarHBondContact O-N 3.46Å
63	Q	55	Low	58.7	Low	130 Å²	130	94.4 Å²	94.4	61%	0.607	57%	0.574	S	S	*	*			trans	-72.5	115.6	170.6	-75.8	-167.6	-22.1	0	0	107.9	G61 R65	G61-Q63 PolarHBondContact O-N 3.47Å; Q63-R65 PolarHBondContact O-N 3.22Å
64	E	66.5	Low	62	Low	170 Å²	170	90.7 Å²	90.7	79%	0.794	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-56.9	134.3	169.8	-73.8	178.8	160.7	0	0	109.8	Y62 E66	Y62-E64 PolarHBondContact O-N 3.46Å; E64-E66 PolarHBondContact O-N 2.61Å
65	R	80.3	Confident	65.4	Low	44 Å²	44	88.1 Å²	88.1	17%	0.166	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-57.5	136.7	174.9	-171.7	178.2	-170.8	109.2	11.1	108.8	Q63 K130 A131 S349 Y350 D451	Q63-R65 PolarHBondContact O-N 3.22Å; R65-K130 WeakPolarHBondContact CD-O 3.34Å; R65-K130 PolarHBondContact NH1-O 3.24Å; R65-A131 VanDerWaalsContact NH1-CA 3.25Å; R65-S349 WeakPolarHBondContact CD-O 3.1Å; R65-S349 PolarHBondContact NE-OG 3.34Å; R65-S349 PolarHBondContact NH2-OG 3.3Å; R65-Y350 HydrophobicContact CG-CD1 4.08Å; R65-Y350 HydrophobicContact CG-CE1 4.09Å; R65-D451 IonicContact CZ-OD2 3.98Å; R65-D451 IonicContact NH1-OD1 3.23Å; R65-D451 IonicContact NH1-OD2 2.61Å; R65-D451 PolarHBondContact NH1-OD2 3.07Å; R65-D451 IonicContact NH2-OD2 2.8Å
66	E	84.3	Confident	68.3	Low	75 Å²	75	84 Å²	84	35%	0.35	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-56	150	173.7	-61.5	-162.9	120.6	0	0	110.8	E64 K275 Y350	E64-E66 PolarHBondContact O-N 2.61Å; E66-K275 IonicContact OE1-NZ 3.66Å; E66-K275 PolarHBondContact OE1-NZ 3.01Å; E66-Y350 VanDerWaalsContact O-CD1 3.28Å; E66-Y350 WeakPolarHBondContact O-CD1 3.43Å
67	T	89.1	Confident	71.4	Confident	54 Å²	54	76.1 Å²	76.1	33%	0.331	43%	0.427	S	S	.	.			trans	-123.1	159.3	176.4	63.2	0	0	0	0	110.8	Y350	T67-Y350 VanDerWaalsContact CA-O 3.25Å; T67-Y350 WeakPolarHBondContact CA-O 3.49Å; T67-Y350 WeakPolarHBondContact CB-O 3.35Å
68	W	90.3	Very high	74.6	Confident	12 Å²	12	72.7 Å²	72.7	5%	0.045	39%	0.392	C	S	.	.			trans	-54.2	142.4	167.3	-61.8	107.2	0	0	0	111.2	D73 F74 S77 V274 L347 Y350 N351	W68-D73 HydrophobicContact CE3-CB 3.82Å; W68-D73 HydrophobicContact CZ3-CB 4.43Å; W68-F74 HydrophobicContact CD2-CB 4.03Å; W68-F74 HydrophobicContact CG-CB 3.88Å; W68-F74 HydrophobicContact CZ2-CD2 4.42Å; W68-F74 AromaticContact NE1-CD2 3.56Å; W68-S77 WeakPolarHBondContact CH2-OG 3.46Å; W68-S77 WeakPolarHBondContact CZ3-OG 3.46Å; W68-V274 HydrophobicContact CD2-CB 4.43Å; W68-V274 HydrophobicContact CE3-CB 3.95Å; W68-V274 HydrophobicContact CH2-CB 3.76Å; W68-V274 HydrophobicContact CH2-CG1 3.65Å; W68-V274 HydrophobicContact CZ2-CB 4.24Å; W68-V274 HydrophobicContact CZ2-CG1 3.88Å; W68-V274 HydrophobicContact CZ3-CB 3.61Å; W68-V274 HydrophobicContact CZ3-CG1 4.06Å; W68-L347 HydrophobicContact CH2-CD2 3.95Å; W68-L347 HydrophobicContact CZ2-CB 4.33Å; W68-L347 HydrophobicContact CZ2-CD2 3.67Å; W68-L347 PolarHBondContact NE1-O 3.29Å; W68-L347 VanDerWaalsContact NE1-O 3.13Å; W68-Y350 VanDerWaalsContact CD1-O 3.26Å; W68-Y350 PolarHBondContact N-O 3.06Å; W68-N351 PolarHBondContact NE1-OD1 3.09Å
69	T	86.8	Confident	77.5	Confident	78 Å²	78	66 Å²	66	48%	0.479	35%	0.351	S	S	.	.	S	Bend	trans	-70.9	-43.9	179.1	-47.1	0	0	0	0	109.6	D73	T69-D73 VanDerWaalsContact CB-OD2 3.31Å; T69-D73 WeakPolarHBondContact CB-OD2 3.34Å; T69-D73 PolarHBondContact N-OD2 3.1Å
70	R	89	Confident	80.4	Confident	173 Å²	173	63.5 Å²	63.5	65%	0.653	33%	0.325	S	S	*	.	S	Bend	trans	-133.8	153.6	176.8	-59.2	177.7	177.8	179.7	-2.1	110.3	M72 D73	R70-M72 PolarHBondContact O-N 3.07Å; R70-D73 PolarHBondContact N-OD2 3Å; R70-D73 VanDerWaalsContact O-CB 3.32Å; R70-D73 WeakPolarHBondContact O-CB 3.03Å; R70-D73 PolarHBondContact O-N 3.46Å
71	Q	89.3	Confident	83.3	Confident	101 Å²	101	57.9 Å²	57.9	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-59.6	-36.1	175.6	-174.7	-179.5	3.5	0	0	112	D73 F74 I75 D360	Q71-D73 PolarHBondContact O-N 3.15Å; Q71-F74 WeakPolarHBondContact O-CB 3.48Å; Q71-F74 PolarHBondContact O-N 3.33Å; Q71-F74 VanDerWaalsContact O-N 3.11Å; Q71-I75 HydrophobicContact CG-CG1 4.41Å; Q71-I75 PolarHBondContact O-N 3.4Å; Q71-D360 PolarHBondContact NE2-OD1 2.94Å; Q71-D360 VanDerWaalsContact NE2-OD1 3.12Å
72	M	90.8	Very high	85.9	Confident	97 Å²	97	54.7 Å²	54.7	48%	0.478	25%	0.254	S	S	.	.	H	α-helix	trans	-63.1	-28.3	176.3	-72.3	-53	-55.5	0	0	113.2	R70 F74 I75 M76 Y282	R70-M72 PolarHBondContact O-N 3.07Å; M72-F74 VanDerWaalsContact C-N 3.29Å; M72-F74 PolarHBondContact O-N 3.24Å; M72-I75 HydrophobicContact CE-CB 4.46Å; M72-I75 HydrophobicContact CE-CG2 4.37Å; M72-I75 PolarHBondContact O-N 3.13Å; M72-M76 HydrophobicContact CE-CG 4.12Å; M72-M76 HydrophobicContact CE-SD 4.15Å; M72-M76 VanDerWaalsContact O-CB 3.32Å; M72-M76 WeakPolarHBondContact O-CB 3.49Å; M72-M76 WeakPolarHBondContact O-CG 3.3Å; M72-M76 PolarHBondContact O-N 3.05Å; M72-Y282 HydrophobicContact CB-CE1 4.35Å; M72-Y282 WeakPolarHBondContact CB-OH 3.02Å
73	D	92.5	Very high	88.1	Confident	11 Å²	11	48.6 Å²	48.6	6%	0.059	23%	0.231	C	C	.	.	H	α-helix	trans	-63.9	-40.2	175.4	-51.7	-13.4	0	0	0	110.2	W68 T69 R70 Q71 S77 Y282	W68-D73 HydrophobicContact CE3-CB 3.82Å; W68-D73 HydrophobicContact CZ3-CB 4.43Å; T69-D73 VanDerWaalsContact CB-OD2 3.31Å; T69-D73 WeakPolarHBondContact CB-OD2 3.34Å; T69-D73 PolarHBondContact N-OD2 3.1Å; R70-D73 PolarHBondContact N-OD2 3Å; R70-D73 VanDerWaalsContact O-CB 3.32Å; R70-D73 WeakPolarHBondContact O-CB 3.03Å; R70-D73 PolarHBondContact O-N 3.46Å; Q71-D73 PolarHBondContact O-N 3.15Å; D73-S77 VanDerWaalsContact O-CB 3.31Å; D73-S77 WeakPolarHBondContact O-CB 3.46Å; D73-S77 PolarHBondContact O-N 2.63Å; D73-S77 PolarHBondContact O-OG 3.33Å; D73-Y282 PolarHBondContact N-OH 2.6Å; D73-Y282 WeakPolarHBondContact OD1-CE2 3.4Å; D73-Y282 PolarHBondContact OD1-OH 3.33Å
74	F	93.6	Very high	89.8	Confident	1 Å²	1	42.6 Å²	42.6	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-50.2	174.4	166.3	-111	0	0	0	111.8	W68 Q71 M72 M76 S77 C78 I123 L347 N351 D360	W68-F74 HydrophobicContact CD2-CB 4.03Å; W68-F74 HydrophobicContact CG-CB 3.88Å; W68-F74 HydrophobicContact CZ2-CD2 4.42Å; W68-F74 AromaticContact NE1-CD2 3.56Å; Q71-F74 WeakPolarHBondContact O-CB 3.48Å; Q71-F74 PolarHBondContact O-N 3.33Å; Q71-F74 VanDerWaalsContact O-N 3.11Å; M72-F74 VanDerWaalsContact C-N 3.29Å; M72-F74 PolarHBondContact O-N 3.24Å; F74-M76 PolarHBondContact O-N 3.3Å; F74-S77 PolarHBondContact O-N 3.42Å; F74-C78 WeakPolarHBondContact CE2-SG 3.44Å; F74-C78 VanDerWaalsContact CZ-SG 3.58Å; F74-C78 PolarHBondContact O-N 3.34Å; F74-C78 PolarHBondContact O-SG 3.22Å; F74-C78 VanDerWaalsContact O-SG 3.34Å; F74-I123 HydrophobicContact CZ-CD1 4.11Å; F74-I123 HydrophobicContact CZ-CG2 3.87Å; F74-L347 HydrophobicContact CD2-CB 4.42Å; F74-L347 HydrophobicContact CE2-CB 4.14Å; F74-N351 WeakPolarHBondContact CD2-OD1 3.42Å; F74-N351 WeakPolarHBondContact CE1-ND2 3.44Å; F74-N351 WeakPolarHBondContact CE2-ND2 3.34Å; F74-N351 WeakPolarHBondContact CG-OD1 3.06Å; F74-N351 WeakPolarHBondContact CZ-ND2 3.17Å; F74-D360 HydrophobicContact CE1-CB 4.16Å; F74-D360 WeakPolarHBondContact CE1-OD2 3.15Å
75	I	94.9	Very high	90.8	Very high	14 Å²	14	34.8 Å²	34.8	7%	0.072	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-47.8	-178.5	-64	-69.4	0	0	0	110.5	Q71 M72 S77 C78 V79 D360 L364	Q71-I75 HydrophobicContact CG-CG1 4.41Å; Q71-I75 PolarHBondContact O-N 3.4Å; M72-I75 HydrophobicContact CE-CB 4.46Å; M72-I75 HydrophobicContact CE-CG2 4.37Å; M72-I75 PolarHBondContact O-N 3.13Å; I75-S77 VanDerWaalsContact C-N 3.32Å; I75-S77 PolarHBondContact O-N 3.16Å; I75-C78 PolarHBondContact O-N 3.36Å; I75-V79 HydrophobicContact CG2-CG2 4.38Å; I75-V79 WeakPolarHBondContact O-CG2 3.47Å; I75-V79 PolarHBondContact O-N 3.16Å; I75-D360 HydrophobicContact CD1-CB 3.79Å; I75-D360 WeakPolarHBondContact CD1-OD1 3.37Å; I75-L364 HydrophobicContact CD1-CD1 4.28Å; I75-L364 HydrophobicContact CD1-CG 4.4Å; I75-L364 HydrophobicContact CG2-CD2 4.15Å
76	M	94.4	Very high	91.2	Very high	26 Å²	26	32.9 Å²	32.9	13%	0.128	16%	0.162	C	C	.	.	H	α-helix	trans	-65.3	-35.2	178.8	-64.2	-58.8	-79.9	0	0	112.1	M72 F74 V79 G80 V281 Y282 A285 T286	M72-M76 HydrophobicContact CE-CG 4.12Å; M72-M76 HydrophobicContact CE-SD 4.15Å; M72-M76 VanDerWaalsContact O-CB 3.32Å; M72-M76 WeakPolarHBondContact O-CB 3.49Å; M72-M76 WeakPolarHBondContact O-CG 3.3Å; M72-M76 PolarHBondContact O-N 3.05Å; F74-M76 PolarHBondContact O-N 3.3Å; M76-V79 PolarHBondContact O-N 2.94Å; M76-G80 PolarHBondContact O-N 3.01Å; M76-V281 HydrophobicContact CB-CB 4.32Å; M76-V281 HydrophobicContact CB-CG2 3.88Å; M76-Y282 HydrophobicContact CG-CD1 4.3Å; M76-Y282 HydrophobicContact CG-CE1 4.14Å; M76-A285 HydrophobicContact CE-CB 4.22Å; M76-T286 HydrophobicContact CE-CG2 3.26Å
77	S	93.9	Very high	91.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-40.2	173.3	-58.7	0	0	0	0	112	W68 D73 F74 I75 F81	W68-S77 WeakPolarHBondContact CH2-OG 3.46Å; W68-S77 WeakPolarHBondContact CZ3-OG 3.46Å; D73-S77 VanDerWaalsContact O-CB 3.31Å; D73-S77 WeakPolarHBondContact O-CB 3.46Å; D73-S77 PolarHBondContact O-N 2.63Å; D73-S77 PolarHBondContact O-OG 3.33Å; F74-S77 PolarHBondContact O-N 3.42Å; I75-S77 VanDerWaalsContact C-N 3.32Å; I75-S77 PolarHBondContact O-N 3.16Å; S77-F81 WeakPolarHBondContact O-CB 3.48Å; S77-F81 PolarHBondContact O-N 3.25Å
78	C	94.6	Very high	91.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-69.3	-38.6	175.2	-66.8	0	0	0	0	112.2	F74 I75 F81 A82 L364	F74-C78 WeakPolarHBondContact CE2-SG 3.44Å; F74-C78 VanDerWaalsContact CZ-SG 3.58Å; F74-C78 PolarHBondContact O-N 3.34Å; F74-C78 PolarHBondContact O-SG 3.22Å; F74-C78 VanDerWaalsContact O-SG 3.34Å; I75-C78 PolarHBondContact O-N 3.36Å; C78-F81 PolarHBondContact O-N 2.53Å; C78-A82 WeakPolarHBondContact O-CB 3.4Å; C78-A82 PolarHBondContact O-N 3.05Å; C78-L364 HydrophobicContact CB-CD1 3.58Å; C78-L364 HydrophobicContact CB-CD2 3.57Å; C78-L364 HydrophobicContact CB-CG 4.22Å
79	V	94.7	Very high	91.4	Very high	9 Å²	9	28.3 Å²	28.3	6%	0.055	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-49.7	173.6	170.8	0	0	0	0	110.1	I75 M76 F81 A82 V83 Y289 L364 I367	I75-V79 HydrophobicContact CG2-CG2 4.38Å; I75-V79 WeakPolarHBondContact O-CG2 3.47Å; I75-V79 PolarHBondContact O-N 3.16Å; M76-V79 PolarHBondContact O-N 2.94Å; V79-F81 PolarHBondContact O-N 2.57Å; V79-A82 PolarHBondContact O-N 3.05Å; V79-V83 HydrophobicContact CG1-CB 4.46Å; V79-V83 HydrophobicContact CG1-CG2 4.07Å; V79-V83 WeakPolarHBondContact O-CA 3.46Å; V79-V83 WeakPolarHBondContact O-CB 3.38Å; V79-V83 WeakPolarHBondContact O-CG2 3.04Å; V79-V83 PolarHBondContact O-N 3.37Å; V79-Y289 HydrophobicContact CG1-CE2 4.41Å; V79-L364 HydrophobicContact CG2-CD2 3.59Å; V79-I367 HydrophobicContact CG1-CG2 3.94Å; V79-I367 HydrophobicContact CG2-CD1 3.89Å; V79-I367 HydrophobicContact CG2-CG2 3.96Å
80	G	92.9	Very high	91.6	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-62.7	-31.5	177.9	0	0	0	0	0	113.1	M76 D436 S437	M76-G80 PolarHBondContact O-N 3.01Å; G80-D436 VanDerWaalsContact C-CB 3.5Å; G80-D436 WeakPolarHBondContact O-CB 3.22Å; G80-S437 PolarHBondContact O-N 3.34Å; G80-S437 PolarHBondContact O-OG 2.9Å
81	F	93.1	Very high	91.8	Very high	11 Å²	11	19.9 Å²	19.9	5%	0.048	10%	0.097	C	C	.	.	H	α-helix	trans	-72.9	-46.6	175.8	-172.8	-127.5	0	0	0	113.1	S77 C78 V79 A338 L341 A343 L344 S437 V440	S77-F81 WeakPolarHBondContact O-CB 3.48Å; S77-F81 PolarHBondContact O-N 3.25Å; C78-F81 PolarHBondContact O-N 2.53Å; V79-F81 PolarHBondContact O-N 2.57Å; F81-A338 HydrophobicContact CD1-CB 3.66Å; F81-A338 HydrophobicContact CE1-CB 3.16Å; F81-A338 HydrophobicContact CE2-CB 4.24Å; F81-A338 HydrophobicContact CG-CB 4.38Å; F81-A338 HydrophobicContact CZ-CB 3.5Å; F81-L341 HydrophobicContact CZ-CD1 3.88Å; F81-A343 HydrophobicContact CE1-CB 3.66Å; F81-A343 HydrophobicContact CE2-CB 4.13Å; F81-A343 HydrophobicContact CZ-CB 3.41Å; F81-A343 VanDerWaalsContact CZ-CB 3.41Å; F81-L344 HydrophobicContact CD1-CD2 3.83Å; F81-L344 HydrophobicContact CD1-CG 4.23Å; F81-L344 HydrophobicContact CE1-CD2 4.21Å; F81-L344 HydrophobicContact CE1-CG 4.08Å; F81-S437 PolarHBondContact O-OG 2.72Å; F81-V440 HydrophobicContact CB-CB 4.04Å; F81-V440 HydrophobicContact CB-CG1 3.79Å; F81-V440 HydrophobicContact CB-CG2 4.15Å; F81-V440 HydrophobicContact CD1-CG1 3.97Å; F81-V440 HydrophobicContact CD2-CB 3.49Å; F81-V440 VanDerWaalsContact CD2-CB 3.49Å; F81-V440 HydrophobicContact CD2-CG1 3.35Å; F81-V440 HydrophobicContact CD2-CG2 4.45Å; F81-V440 HydrophobicContact CE1-CG1 4.38Å; F81-V440 HydrophobicContact CE2-CB 4.15Å; F81-V440 HydrophobicContact CE2-CG1 3.84Å; F81-V440 HydrophobicContact CG-CB 3.92Å; F81-V440 HydrophobicContact CG-CG1 3.42Å; F81-V440 VanDerWaalsContact CG-CG1 3.42Å; F81-V440 HydrophobicContact CZ-CG1 4.33Å
82	A	91.9	Very high	92.1	Very high	5 Å²	5	15.1 Å²	15.1	4%	0.041	7%	0.074	C	C	.	.	H	α-helix	trans	-79.3	-37.3	-176.6	0	0	0	0	0	112.7	C78 V79 G84 N87 S336 N368	C78-A82 WeakPolarHBondContact O-CB 3.4Å; C78-A82 PolarHBondContact O-N 3.05Å; V79-A82 PolarHBondContact O-N 3.05Å; A82-G84 PolarHBondContact O-N 3.32Å; A82-G84 VanDerWaalsContact O-N 3.17Å; A82-N87 PolarHBondContact O-OD1 3.28Å; A82-S336 CarbonylContact C-O 3.52Å; A82-N368 HydrophobicContact CB-CB 4.43Å; A82-N368 PolarHBondContact O-OD1 2.89Å
83	V	93.1	Very high	92.1	Very high	6 Å²	6	13 Å²	13	4%	0.036	6%	0.061	C	C	.	.	S	Bend	trans	-87.4	87.8	177.3	-177.3	0	0	0	0	108.8	V79 I367 N368 T371 L433	V79-V83 HydrophobicContact CG1-CB 4.46Å; V79-V83 HydrophobicContact CG1-CG2 4.07Å; V79-V83 WeakPolarHBondContact O-CA 3.46Å; V79-V83 WeakPolarHBondContact O-CB 3.38Å; V79-V83 WeakPolarHBondContact O-CG2 3.04Å; V79-V83 PolarHBondContact O-N 3.37Å; V83-I367 HydrophobicContact CG2-CG2 4.34Å; V83-N368 HydrophobicContact CG2-CB 4.49Å; V83-T371 HydrophobicContact CG1-CG2 3.55Å; V83-L433 HydrophobicContact CG1-CD2 4.19Å
84	G	89.5	Confident	92	Very high	5 Å²	5	12.9 Å²	12.9	5%	0.052	6%	0.061	C	C	.	.	S	Bend	trans	-114.6	-161.8	179.8	0	0	0	0	0	112.8	A82 G86 N87	A82-G84 PolarHBondContact O-N 3.32Å; A82-G84 VanDerWaalsContact O-N 3.17Å; G84-G86 PolarHBondContact O-N 3.26Å; G84-N87 PolarHBondContact N-OD1 2.92Å; G84-N87 VanDerWaalsContact N-OD1 3.08Å; G84-N87 WeakPolarHBondContact O-CB 3.29Å; G84-N87 PolarHBondContact O-N 3.29Å; G84-N87 PolarHBondContact O-OD1 3.46Å
85	L	88.3	Confident	92.1	Very high	5 Å²	5	12.9 Å²	12.9	3%	0.026	6%	0.061	C	C	.	.	H	α-helix	trans	-58.3	-36.3	177.3	-63.1	169.9	0	0	0	112.2	N87 V88 W89 Y161 V164 L430 L433	L85-N87 PolarHBondContact O-N 3.35Å; L85-N87 VanDerWaalsContact O-N 3.12Å; L85-V88 PolarHBondContact O-N 3.14Å; L85-W89 VanDerWaalsContact C-NE1 3.34Å; L85-W89 HydrophobicContact CB-CD2 4.13Å; L85-W89 HydrophobicContact CB-CZ2 3.81Å; L85-W89 HydrophobicContact CD1-CH2 4.1Å; L85-W89 HydrophobicContact CD1-CZ2 4.01Å; L85-W89 PolarHBondContact O-N 3.03Å; L85-W89 PolarHBondContact O-NE1 2.83Å; L85-Y161 HydrophobicContact CD1-CE1 4.39Å; L85-Y161 HydrophobicContact CD1-CE2 3.86Å; L85-Y161 HydrophobicContact CG-CE2 4.47Å; L85-Y161 WeakPolarHBondContact CG-OH 3.4Å; L85-Y161 PolarHBondContact N-OH 3.41Å; L85-V164 HydrophobicContact CD1-CB 3.92Å; L85-V164 HydrophobicContact CD1-CG1 3.4Å; L85-L430 HydrophobicContact CD2-CD1 4.49Å; L85-L430 HydrophobicContact CD2-CD2 3.71Å; L85-L430 HydrophobicContact CD2-CG 3.55Å; L85-L433 HydrophobicContact CD2-CB 4.42Å
86	G	88.7	Confident	91.9	Very high	4 Å²	4	14.9 Å²	14.9	4%	0.041	7%	0.068	C	C	.	.	H	α-helix	trans	-52.6	-33.7	178.6	0	0	0	0	0	114	G84 V88 R90 F91	G84-G86 PolarHBondContact O-N 3.26Å; G86-V88 VanDerWaalsContact C-N 3.34Å; G86-R90 WeakPolarHBondContact O-CB 3.49Å; G86-R90 PolarHBondContact O-N 3.22Å; G86-F91 PolarHBondContact O-N 3.41Å
87	N	93.4	Very high	91.7	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-68.4	-34.3	177.3	-60.4	66.5	0	0	0	111.7	A82 G84 L85 P92 N368 S372 S375	A82-N87 PolarHBondContact O-OD1 3.28Å; G84-N87 PolarHBondContact N-OD1 2.92Å; G84-N87 VanDerWaalsContact N-OD1 3.08Å; G84-N87 WeakPolarHBondContact O-CB 3.29Å; G84-N87 PolarHBondContact O-N 3.29Å; G84-N87 PolarHBondContact O-OD1 3.46Å; L85-N87 PolarHBondContact O-N 3.35Å; L85-N87 VanDerWaalsContact O-N 3.12Å; N87-P92 WeakPolarHBondContact O-CD 3.24Å; N87-N368 PolarHBondContact ND2-O 3.25Å; N87-N368 VanDerWaalsContact ND2-O 3.09Å; N87-N368 PolarHBondContact ND2-OD1 3.43Å; N87-S372 PolarHBondContact ND2-OG 3.36Å; N87-S375 PolarHBondContact O-OG 3.46Å
88	V	90	Very high	91.7	Very high	14 Å²	14	17.6 Å²	17.6	9%	0.085	8%	0.079	C	C	.	.	H	α-helix	trans	-91.9	-43.1	-175	-176.8	0	0	0	0	111.7	L85 G86 P92 V379 L433	L85-V88 PolarHBondContact O-N 3.14Å; G86-V88 VanDerWaalsContact C-N 3.34Å; V88-P92 WeakPolarHBondContact O-CD 3.23Å; V88-P92 VanDerWaalsContact O-CG 3.29Å; V88-P92 WeakPolarHBondContact O-CG 3.48Å; V88-V379 HydrophobicContact CG1-CG2 4.08Å; V88-V379 WeakPolarHBondContact O-CG2 3.46Å; V88-L433 HydrophobicContact CG2-CD1 3.76Å
89	W	84.5	Confident	91.6	Very high	30 Å²	30	18 Å²	18	11%	0.114	8%	0.082	C	C	.	.	H	α-helix	trans	-108	-5.9	-169	69.6	-0.8	0	0	0	116.1	L85 V164 P402 L404 A405 F406	L85-W89 VanDerWaalsContact C-NE1 3.34Å; L85-W89 HydrophobicContact CB-CD2 4.13Å; L85-W89 HydrophobicContact CB-CZ2 3.81Å; L85-W89 HydrophobicContact CD1-CH2 4.1Å; L85-W89 HydrophobicContact CD1-CZ2 4.01Å; L85-W89 PolarHBondContact O-N 3.03Å; L85-W89 PolarHBondContact O-NE1 2.83Å; W89-V164 HydrophobicContact CH2-CB 4.15Å; W89-V164 HydrophobicContact CH2-CG1 3.41Å; W89-V164 VanDerWaalsContact CH2-CG1 3.41Å; W89-V164 HydrophobicContact CH2-CG2 3.67Å; W89-V164 HydrophobicContact CZ2-CG1 4.39Å; W89-V164 HydrophobicContact CZ2-CG2 4.4Å; W89-V164 HydrophobicContact CZ3-CG1 3.67Å; W89-P402 HydrophobicContact CH2-CG 4.37Å; W89-P402 HydrophobicContact CZ3-CG 4.45Å; W89-L404 HydrophobicContact CB-CB 4.5Å; W89-L404 HydrophobicContact CB-CD2 4.12Å; W89-L404 WeakPolarHBondContact O-CD2 3.28Å; W89-A405 HydrophobicContact CE3-CB 3.59Å; W89-A405 HydrophobicContact CZ3-CB 4.15Å; W89-F406 HydrophobicContact CZ3-CE2 4.06Å
90	R	90.2	Very high	91.6	Very high	74 Å²	74	17.6 Å²	17.6	28%	0.279	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-52.6	-174.7	-174.1	179	174.4	171.6	-0.2	110.3	G86 Y93 L94 Q332	G86-R90 WeakPolarHBondContact O-CB 3.49Å; G86-R90 PolarHBondContact O-N 3.22Å; R90-Y93 PolarHBondContact O-N 3.01Å; R90-L94 HydrophobicContact CG-CD1 3.96Å; R90-L94 HydrophobicContact CG-CG 4.22Å; R90-L94 WeakPolarHBondContact O-CG 3.43Å; R90-L94 PolarHBondContact O-N 3.17Å; R90-Q332 VanDerWaalsContact CG-OE1 3.31Å
91	F	94.6	Very high	91.6	Very high	1 Å²	1	18.5 Å²	18.5	0%	0.004	9%	0.09	C	C	.	.	H	α-helix	trans	-55.3	-48.2	178.8	176.2	-89.2	0	0	0	113.1	G86 Y93 L94 C95 F103 L104 Y107 Y312 Q332 S372	G86-F91 PolarHBondContact O-N 3.41Å; F91-Y93 VanDerWaalsContact C-N 3.33Å; F91-Y93 PolarHBondContact O-N 3.02Å; F91-L94 PolarHBondContact O-N 3.47Å; F91-C95 HydrophobicContact CE1-CB 4.5Å; F91-C95 WeakPolarHBondContact O-CB 3.37Å; F91-C95 PolarHBondContact O-N 3.18Å; F91-F103 HydrophobicContact CD2-CE1 4.41Å; F91-F103 HydrophobicContact CE2-CE1 4.14Å; F91-L104 HydrophobicContact CZ-CD2 3.86Å; F91-Y107 HydrophobicContact CD2-CD2 4.08Å; F91-Y107 AromaticContact CD2-CE2 3.57Å; F91-Y107 HydrophobicContact CD2-CE2 3.57Å; F91-Y107 AromaticContact CD2-CZ 3.96Å; F91-Y107 HydrophobicContact CE2-CD1 4.11Å; F91-Y107 AromaticContact CE2-CD2 3.62Å; F91-Y107 HydrophobicContact CE2-CD2 3.62Å; F91-Y107 AromaticContact CE2-CE1 3.92Å; F91-Y107 HydrophobicContact CE2-CE1 3.92Å; F91-Y107 AromaticContact CE2-CE2 3.38Å; F91-Y107 HydrophobicContact CE2-CE2 3.38Å; F91-Y107 AromaticContact CE2-CG 3.97Å; F91-Y107 HydrophobicContact CE2-CG 3.97Å; F91-Y107 AromaticContact CE2-CZ 3.56Å; F91-Y312 HydrophobicContact CE1-CE2 4.45Å; F91-Y312 WeakPolarHBondContact CE1-OH 3.48Å; F91-Q332 HydrophobicContact CD2-CG 4.25Å; F91-S372 VanDerWaalsContact CD1-C 3.47Å; F91-S372 WeakPolarHBondContact CD1-O 3.44Å; F91-S372 VanDerWaalsContact CE1-O 3.31Å; F91-S372 WeakPolarHBondContact CE1-O 3.41Å
92	P	93.9	Very high	91.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.3	-43.3	-179.6	-28.4	40.8	0	0	0	112.3	N87 V88 C95 Y96 V379 F380	N87-P92 WeakPolarHBondContact O-CD 3.24Å; V88-P92 WeakPolarHBondContact O-CD 3.23Å; V88-P92 VanDerWaalsContact O-CG 3.29Å; V88-P92 WeakPolarHBondContact O-CG 3.48Å; P92-C95 WeakPolarHBondContact O-CB 3.46Å; P92-C95 PolarHBondContact O-N 3.32Å; P92-Y96 PolarHBondContact O-N 2.92Å; P92-Y96 VanDerWaalsContact O-N 3.07Å; P92-V379 HydrophobicContact CB-CB 4.34Å; P92-V379 HydrophobicContact CB-CG1 4.4Å; P92-V379 HydrophobicContact CG-CB 4.5Å; P92-V379 HydrophobicContact CG-CG2 4.41Å; P92-F380 HydrophobicContact CB-CD2 3.95Å; P92-F380 HydrophobicContact CB-CE2 3.62Å; P92-F380 VanDerWaalsContact O-CE2 3.28Å; P92-F380 WeakPolarHBondContact O-CE2 3.48Å
93	Y	90.5	Very high	91.9	Very high	52 Å²	52	17.9 Å²	17.9	20%	0.204	9%	0.087	C	C	.	.	H	α-helix	trans	-60.7	-45.8	176.6	174.5	-93.9	0	0	0	111.8	R90 F91 C95 Y96 K97 A398 E399 S400	R90-Y93 PolarHBondContact O-N 3.01Å; F91-Y93 VanDerWaalsContact C-N 3.33Å; F91-Y93 PolarHBondContact O-N 3.02Å; Y93-C95 VanDerWaalsContact C-N 3.34Å; Y93-C95 PolarHBondContact O-N 3.17Å; Y93-Y96 PolarHBondContact O-N 3.45Å; Y93-K97 HydrophobicContact CE1-CB 4.31Å; Y93-K97 HydrophobicContact CE1-CD 3.72Å; Y93-K97 VanDerWaalsContact O-CB 3.3Å; Y93-K97 WeakPolarHBondContact O-CB 3.25Å; Y93-K97 PolarHBondContact O-N 3.15Å; Y93-A398 WeakPolarHBondContact CE2-O 3.4Å; Y93-E399 WeakPolarHBondContact CD2-O 3.44Å; Y93-S400 VanDerWaalsContact CD1-CB 3.46Å; Y93-S400 VanDerWaalsContact CE1-CB 3.44Å
94	L	92.3	Very high	92	Very high	10 Å²	10	19.5 Å²	19.5	5%	0.052	10%	0.095	C	C	.	.	H	α-helix	trans	-63.9	-39.5	177.9	-70.3	-178.7	0	0	0	112.1	R90 F91 N98 F103 D328 Q332	R90-L94 HydrophobicContact CG-CD1 3.96Å; R90-L94 HydrophobicContact CG-CG 4.22Å; R90-L94 WeakPolarHBondContact O-CG 3.43Å; R90-L94 PolarHBondContact O-N 3.17Å; F91-L94 PolarHBondContact O-N 3.47Å; L94-N98 WeakPolarHBondContact O-CB 3.33Å; L94-N98 PolarHBondContact O-N 3.46Å; L94-N98 PolarHBondContact O-ND2 2.9Å; L94-N98 VanDerWaalsContact O-ND2 3.12Å; L94-F103 HydrophobicContact CB-CE1 4.09Å; L94-F103 HydrophobicContact CB-CZ 3.99Å; L94-D328 HydrophobicContact CD2-CB 4.07Å; L94-Q332 HydrophobicContact CD1-CB 3.8Å; L94-Q332 HydrophobicContact CD1-CG 4.08Å
95	C	94.2	Very high	92.4	Very high	1 Å²	1	23 Å²	23	1%	0.007	11%	0.112	C	C	.	.	H	α-helix	trans	-58.6	-51.8	175.9	-168.4	0	0	0	0	110.5	F91 P92 Y93 N98 G100 F103 Y312	F91-C95 HydrophobicContact CE1-CB 4.5Å; F91-C95 WeakPolarHBondContact O-CB 3.37Å; F91-C95 PolarHBondContact O-N 3.18Å; P92-C95 WeakPolarHBondContact O-CB 3.46Å; P92-C95 PolarHBondContact O-N 3.32Å; Y93-C95 VanDerWaalsContact C-N 3.34Å; Y93-C95 PolarHBondContact O-N 3.17Å; C95-N98 PolarHBondContact O-N 3.35Å; C95-G100 WeakPolarHBondContact O-CA 3.4Å; C95-G100 PolarHBondContact O-N 3.2Å; C95-G100 PolarHBondContact SG-O 3.16Å; C95-F103 HydrophobicContact CB-CD1 4.04Å; C95-Y312 HydrophobicContact CB-CD2 3.91Å; C95-Y312 HydrophobicContact CB-CE2 3.51Å; C95-Y312 WeakPolarHBondContact SG-CE2 2.97Å
96	Y	90.4	Very high	92.7	Very high	55 Å²	55	22.8 Å²	22.8	22%	0.216	11%	0.11	C	C	.	.	H	α-helix	trans	-58.9	-54.6	176.1	153.1	-108.4	0	0	0	112.7	P92 Y93 N98 G99 Y311 F380 S395 A398	P92-Y96 PolarHBondContact O-N 2.92Å; P92-Y96 VanDerWaalsContact O-N 3.07Å; Y93-Y96 PolarHBondContact O-N 3.45Å; Y96-N98 PolarHBondContact O-N 3.04Å; Y96-N98 VanDerWaalsContact O-N 3.17Å; Y96-G99 PolarHBondContact O-N 3.29Å; Y96-Y311 HydrophobicContact CD2-CD1 4.26Å; Y96-Y311 AromaticContact CE2-CD1 3.96Å; Y96-Y311 HydrophobicContact CE2-CD1 3.96Å; Y96-F380 HydrophobicContact CD1-CZ 4.25Å; Y96-F380 HydrophobicContact CD2-CE1 4.34Å; Y96-F380 AromaticContact CG-CE1 3.96Å; Y96-F380 HydrophobicContact CG-CE1 3.96Å; Y96-F380 AromaticContact CG-CZ 3.82Å; Y96-F380 HydrophobicContact CG-CZ 3.82Å; Y96-S395 VanDerWaalsContact OH-CA 3.24Å; Y96-S395 WeakPolarHBondContact OH-CA 3.24Å; Y96-S395 WeakPolarHBondContact OH-CB 3.49Å; Y96-A398 HydrophobicContact CD1-CB 4.11Å; Y96-A398 HydrophobicContact CE1-CB 3.87Å
97	K	91.4	Very high	93.1	Very high	82 Å²	82	22.7 Å²	22.7	36%	0.357	11%	0.109	S	C	.	.	H	α-helix	trans	-57.2	-35.2	-176.8	178.3	-171.8	167.3	-153.3	0	112.4	Y93 D328	Y93-K97 HydrophobicContact CE1-CB 4.31Å; Y93-K97 HydrophobicContact CE1-CD 3.72Å; Y93-K97 VanDerWaalsContact O-CB 3.3Å; Y93-K97 WeakPolarHBondContact O-CB 3.25Å; Y93-K97 PolarHBondContact O-N 3.15Å; K97-D328 IonicContact NZ-OD2 3.82Å; K97-D328 PolarHBondContact NZ-OD2 3.01Å; K97-D328 VanDerWaalsContact NZ-OD2 3.14Å
98	N	93.9	Very high	93.2	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.016	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	29.1	-172.1	-64.8	-42.3	0	0	0	113.6	L94 C95 Y96 F103 V325 D328	L94-N98 WeakPolarHBondContact O-CB 3.33Å; L94-N98 PolarHBondContact O-N 3.46Å; L94-N98 PolarHBondContact O-ND2 2.9Å; L94-N98 VanDerWaalsContact O-ND2 3.12Å; C95-N98 PolarHBondContact O-N 3.35Å; Y96-N98 PolarHBondContact O-N 3.04Å; Y96-N98 VanDerWaalsContact O-N 3.17Å; N98-F103 HydrophobicContact CB-CB 4.18Å; N98-F103 HydrophobicContact CB-CD2 3.44Å; N98-F103 VanDerWaalsContact CB-CD2 3.44Å; N98-F103 HydrophobicContact CB-CE2 4.05Å; N98-F103 HydrophobicContact CB-CG 4.01Å; N98-V325 HydrophobicContact CB-CB 4.41Å; N98-V325 HydrophobicContact CB-CG1 4.15Å; N98-V325 HydrophobicContact CB-CG2 3.86Å; N98-D328 VanDerWaalsContact ND2-CB 3.34Å; N98-D328 WeakPolarHBondContact ND2-CB 3.38Å; N98-D328 PolarHBondContact ND2-OD2 3.46Å
99	G	92.1	Very high	93.5	Very high	7 Å²	7	29.9 Å²	29.9	7%	0.072	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	27.8	170.2	0	0	0	0	0	114.8	Y96 G101 V102 D316	Y96-G99 PolarHBondContact O-N 3.29Å; G99-G101 PolarHBondContact O-N 2.98Å; G99-V102 PolarHBondContact O-N 3.01Å; G99-D316 PolarHBondContact O-N 3.39Å
100	G	93.6	Very high	94	Very high	2 Å²	2	28.6 Å²	28.6	2%	0.021	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	58.4	-128	177	0	0	0	0	0	111.9	C95 V102 F103 Y312	C95-G100 WeakPolarHBondContact O-CA 3.4Å; C95-G100 PolarHBondContact O-N 3.2Å; C95-G100 PolarHBondContact SG-O 3.16Å; G100-V102 PolarHBondContact O-N 3.12Å; G100-F103 VanDerWaalsContact O-CB 3.29Å; G100-F103 WeakPolarHBondContact O-CB 3.28Å; G100-F103 PolarHBondContact O-N 3.01Å; G100-Y312 CarbonylContact C-O 3.49Å; G100-Y312 WeakPolarHBondContact CA-O 3.37Å
101	G	93.6	Very high	94.4	Very high	21 Å²	21	25.4 Å²	25.4	22%	0.216	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-58.4	-20.7	-176.8	0	0	0	0	0	115	G99 F103 L104 I313	G99-G101 PolarHBondContact O-N 2.98Å; G101-F103 VanDerWaalsContact C-N 3.29Å; G101-F103 PolarHBondContact O-N 2.96Å; G101-L104 WeakPolarHBondContact O-CB 3.22Å; G101-L104 WeakPolarHBondContact O-CG 3.17Å; G101-L104 PolarHBondContact O-N 3.24Å; G101-I313 WeakPolarHBondContact CA-O 3.31Å; G101-I313 PolarHBondContact N-O 2.88Å; G101-I313 VanDerWaalsContact N-O 3.14Å
102	V	95.6	Very high	94.4	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.018	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-68	-30.5	176.9	174.2	0	0	0	0	111.9	G99 G100 L104 I105 P106 P315 W317 L320	G99-V102 PolarHBondContact O-N 3.01Å; G100-V102 PolarHBondContact O-N 3.12Å; V102-L104 PolarHBondContact O-N 3.18Å; V102-L104 VanDerWaalsContact O-N 3.13Å; V102-I105 WeakPolarHBondContact O-CB 3.03Å; V102-I105 PolarHBondContact O-N 3.23Å; V102-I105 VanDerWaalsContact O-N 3.07Å; V102-P106 WeakPolarHBondContact O-CD 3.35Å; V102-P315 HydrophobicContact CG2-CB 3.38Å; V102-W317 HydrophobicContact CG1-CE3 4.43Å; V102-W317 HydrophobicContact CG2-CD2 3.98Å; V102-W317 HydrophobicContact CG2-CE3 4.15Å; V102-W317 HydrophobicContact CG2-CG 4.34Å; V102-L320 HydrophobicContact CG1-CD1 3.62Å; V102-L320 HydrophobicContact CG1-CD2 3.52Å; V102-L320 HydrophobicContact CG1-CG 3.27Å
103	F	96.6	Very high	94.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-59.1	-24.8	176.2	179.9	-111.5	0	0	0	113	F91 L94 C95 N98 G100 G101 I105 P106 Y107 V325 D328 A329	F91-F103 HydrophobicContact CD2-CE1 4.41Å; F91-F103 HydrophobicContact CE2-CE1 4.14Å; L94-F103 HydrophobicContact CB-CE1 4.09Å; L94-F103 HydrophobicContact CB-CZ 3.99Å; C95-F103 HydrophobicContact CB-CD1 4.04Å; N98-F103 HydrophobicContact CB-CB 4.18Å; N98-F103 HydrophobicContact CB-CD2 3.44Å; N98-F103 VanDerWaalsContact CB-CD2 3.44Å; N98-F103 HydrophobicContact CB-CE2 4.05Å; N98-F103 HydrophobicContact CB-CG 4.01Å; G100-F103 VanDerWaalsContact O-CB 3.29Å; G100-F103 WeakPolarHBondContact O-CB 3.28Å; G100-F103 PolarHBondContact O-N 3.01Å; G101-F103 VanDerWaalsContact C-N 3.29Å; G101-F103 PolarHBondContact O-N 2.96Å; F103-I105 PolarHBondContact O-N 3.37Å; F103-P106 HydrophobicContact CD2-CG 4.42Å; F103-P106 WeakPolarHBondContact O-CD 3.03Å; F103-P106 VanDerWaalsContact O-CG 3.29Å; F103-P106 WeakPolarHBondContact O-CG 3.47Å; F103-Y107 HydrophobicContact CE1-CD2 4.18Å; F103-Y107 VanDerWaalsContact O-CB 3.25Å; F103-Y107 WeakPolarHBondContact O-CB 3.29Å; F103-Y107 PolarHBondContact O-N 2.04Å; F103-Y107 VanDerWaalsContact O-N 3.12Å; F103-V325 HydrophobicContact CD2-CG1 4.09Å; F103-D328 HydrophobicContact CE2-CB 4.33Å; F103-A329 HydrophobicContact CE2-CB 3.72Å; F103-A329 HydrophobicContact CZ-CB 4Å
104	L	95.6	Very high	94.7	Very high	39 Å²	39	28.7 Å²	28.7	20%	0.204	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-25.3	177.5	-60.1	178.7	0	0	0	112.7	F91 G101 V102 L108 F373	F91-L104 HydrophobicContact CZ-CD2 3.86Å; G101-L104 WeakPolarHBondContact O-CB 3.22Å; G101-L104 WeakPolarHBondContact O-CG 3.17Å; G101-L104 PolarHBondContact O-N 3.24Å; V102-L104 PolarHBondContact O-N 3.18Å; V102-L104 VanDerWaalsContact O-N 3.13Å; L104-L108 VanDerWaalsContact O-CB 3.23Å; L104-L108 WeakPolarHBondContact O-CB 3.09Å; L104-L108 WeakPolarHBondContact O-CG 3.45Å; L104-L108 PolarHBondContact O-N 2.84Å; L104-F373 HydrophobicContact CD1-CD2 4.2Å; L104-F373 HydrophobicContact CD1-CE2 3.73Å; L104-F373 HydrophobicContact CD1-CZ 4.43Å; L104-F373 HydrophobicContact CD2-CD2 4.11Å; L104-F373 HydrophobicContact CD2-CE2 4.42Å
105	I	96.2	Very high	94.9	Very high	79 Å²	79	28.2 Å²	28.2	41%	0.405	14%	0.144	S	C	.	.	H	α-helix	trans	-65.1	-61.8	178.1	-61.4	170.3	0	0	0	111.1	V102 F103 Y107 L108 L109 W317 L320	V102-I105 WeakPolarHBondContact O-CB 3.03Å; V102-I105 PolarHBondContact O-N 3.23Å; V102-I105 VanDerWaalsContact O-N 3.07Å; F103-I105 PolarHBondContact O-N 3.37Å; I105-Y107 VanDerWaalsContact C-N 3.26Å; I105-Y107 PolarHBondContact O-N 3.48Å; I105-L108 PolarHBondContact O-N 2.92Å; I105-L109 WeakPolarHBondContact O-CB 3.39Å; I105-L109 PolarHBondContact O-N 3.42Å; I105-W317 HydrophobicContact CD1-CH2 4.24Å; I105-W317 HydrophobicContact CD1-CZ3 3.86Å; I105-L320 HydrophobicContact CD1-CD1 4.35Å
106	P	95.8	Very high	95	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-35.8	176.9	23.9	-33.2	0	0	0	111.7	V102 F103 L109 I110 L320 V325 W326 A329	V102-P106 WeakPolarHBondContact O-CD 3.35Å; F103-P106 HydrophobicContact CD2-CG 4.42Å; F103-P106 WeakPolarHBondContact O-CD 3.03Å; F103-P106 VanDerWaalsContact O-CG 3.29Å; F103-P106 WeakPolarHBondContact O-CG 3.47Å; P106-L109 PolarHBondContact O-N 3.29Å; P106-I110 WeakPolarHBondContact O-CB 3.1Å; P106-I110 VanDerWaalsContact O-CG1 3.25Å; P106-I110 WeakPolarHBondContact O-CG1 3.46Å; P106-I110 PolarHBondContact O-N 3.44Å; P106-L320 HydrophobicContact CG-CD2 4.33Å; P106-V325 HydrophobicContact CG-CG1 3.83Å; P106-W326 HydrophobicContact CB-CD2 3.85Å; P106-W326 HydrophobicContact CB-CE3 3.54Å; P106-W326 HydrophobicContact CB-CH2 4.04Å; P106-W326 HydrophobicContact CB-CZ2 4.31Å; P106-W326 HydrophobicContact CB-CZ3 3.64Å; P106-A329 HydrophobicContact CB-CB 4Å; P106-A329 HydrophobicContact CG-CB 4.4Å
107	Y	96.3	Very high	95.3	Very high	3 Å²	3	25.9 Å²	25.9	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-59.5	-55.2	176.3	179.7	-92.2	0	0	0	112.4	F91 F103 I105 L109 I110 V111 Q332 I333 S369	F91-Y107 HydrophobicContact CD2-CD2 4.08Å; F91-Y107 AromaticContact CD2-CE2 3.57Å; F91-Y107 HydrophobicContact CD2-CE2 3.57Å; F91-Y107 AromaticContact CD2-CZ 3.96Å; F91-Y107 HydrophobicContact CE2-CD1 4.11Å; F91-Y107 AromaticContact CE2-CD2 3.62Å; F91-Y107 HydrophobicContact CE2-CD2 3.62Å; F91-Y107 AromaticContact CE2-CE1 3.92Å; F91-Y107 HydrophobicContact CE2-CE1 3.92Å; F91-Y107 AromaticContact CE2-CE2 3.38Å; F91-Y107 HydrophobicContact CE2-CE2 3.38Å; F91-Y107 AromaticContact CE2-CG 3.97Å; F91-Y107 HydrophobicContact CE2-CG 3.97Å; F91-Y107 AromaticContact CE2-CZ 3.56Å; F103-Y107 HydrophobicContact CE1-CD2 4.18Å; F103-Y107 VanDerWaalsContact O-CB 3.25Å; F103-Y107 WeakPolarHBondContact O-CB 3.29Å; F103-Y107 PolarHBondContact O-N 2.04Å; F103-Y107 VanDerWaalsContact O-N 3.12Å; I105-Y107 VanDerWaalsContact C-N 3.26Å; I105-Y107 PolarHBondContact O-N 3.48Å; Y107-L109 VanDerWaalsContact C-N 3.33Å; Y107-L109 PolarHBondContact O-N 2.71Å; Y107-I110 PolarHBondContact O-N 3.46Å; Y107-V111 HydrophobicContact CD1-CG2 4.29Å; Y107-V111 HydrophobicContact CE1-CG2 4.02Å; Y107-V111 WeakPolarHBondContact O-CG2 3.46Å; Y107-V111 PolarHBondContact O-N 3.07Å; Y107-Q332 HydrophobicContact CE2-CG 4.05Å; Y107-I333 HydrophobicContact CD1-CD1 4.41Å; Y107-I333 HydrophobicContact CD2-CD1 3.68Å; Y107-I333 HydrophobicContact CD2-CG1 4.01Å; Y107-I333 HydrophobicContact CE1-CD1 3.98Å; Y107-I333 HydrophobicContact CE2-CD1 3.17Å; Y107-I333 HydrophobicContact CE2-CG1 3.93Å; Y107-I333 HydrophobicContact CG-CD1 4.28Å; Y107-S369 PolarHBondContact OH-OG 3.27Å
108	L	96.3	Very high	95.6	Very high	85 Å²	85	22 Å²	22	45%	0.445	12%	0.118	S	C	.	.	H	α-helix	trans	-66.1	-35.4	-179.7	-70.8	173.4	0	0	0	112.1	L104 I105 I110 V111 F112	L104-L108 VanDerWaalsContact O-CB 3.23Å; L104-L108 WeakPolarHBondContact O-CB 3.09Å; L104-L108 WeakPolarHBondContact O-CG 3.45Å; L104-L108 PolarHBondContact O-N 2.84Å; I105-L108 PolarHBondContact O-N 2.92Å; L108-I110 VanDerWaalsContact C-N 3.32Å; L108-I110 PolarHBondContact O-N 2.85Å; L108-V111 WeakPolarHBondContact O-CB 3.41Å; L108-V111 PolarHBondContact O-N 3Å; L108-F112 WeakPolarHBondContact O-CD2 3.42Å; L108-F112 PolarHBondContact O-N 2.99Å
109	L	96.4	Very high	95.7	Very high	80 Å²	80	21.9 Å²	21.9	42%	0.419	12%	0.118	S	C	.	.	H	α-helix	trans	-58.2	-48.7	174	-173.2	151.1	0	0	0	110.3	I105 P106 Y107 V111 F112 V113 W326	I105-L109 WeakPolarHBondContact O-CB 3.39Å; I105-L109 PolarHBondContact O-N 3.42Å; P106-L109 PolarHBondContact O-N 3.29Å; Y107-L109 VanDerWaalsContact C-N 3.33Å; Y107-L109 PolarHBondContact O-N 2.71Å; L109-V111 VanDerWaalsContact C-N 3.32Å; L109-V111 PolarHBondContact O-N 2.86Å; L109-F112 PolarHBondContact O-N 2.92Å; L109-F112 VanDerWaalsContact O-N 3.13Å; L109-V113 HydrophobicContact CD2-CG1 4.14Å; L109-V113 HydrophobicContact CD2-CG2 3.8Å; L109-V113 WeakPolarHBondContact O-CG2 3.32Å; L109-V113 PolarHBondContact O-N 2.62Å; L109-W326 HydrophobicContact CD1-CZ3 4.38Å; L109-W326 HydrophobicContact CD2-CZ3 4.46Å
110	I	95.5	Very high	96	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-65.6	-33.3	179.2	-66.8	175.8	0	0	0	112	P106 Y107 L108 F112 G114 G115 A329 G330 I333 F334 I554	P106-I110 WeakPolarHBondContact O-CB 3.1Å; P106-I110 VanDerWaalsContact O-CG1 3.25Å; P106-I110 WeakPolarHBondContact O-CG1 3.46Å; P106-I110 PolarHBondContact O-N 3.44Å; Y107-I110 PolarHBondContact O-N 3.46Å; L108-I110 VanDerWaalsContact C-N 3.32Å; L108-I110 PolarHBondContact O-N 2.85Å; I110-F112 VanDerWaalsContact C-N 3.32Å; I110-F112 PolarHBondContact O-N 2.89Å; I110-G114 WeakPolarHBondContact O-CA 3.29Å; I110-G114 PolarHBondContact O-N 3.41Å; I110-G115 PolarHBondContact O-N 3.45Å; I110-A329 HydrophobicContact CD1-CB 3.79Å; I110-G330 VanDerWaalsContact CD1-CA 3.48Å; I110-G330 VanDerWaalsContact CD1-N 3.29Å; I110-I333 HydrophobicContact CB-CG1 4.26Å; I110-I333 HydrophobicContact CG2-CB 3.76Å; I110-I333 HydrophobicContact CG2-CG1 3.8Å; I110-I333 HydrophobicContact CG2-CG2 3.96Å; I110-F334 HydrophobicContact CG2-CE2 4.35Å; I110-I554 HydrophobicContact CD1-CD1 4.36Å
111	V	96.7	Very high	96.1	Very high	7 Å²	7	21.4 Å²	21.4	4%	0.042	11%	0.113	C	C	.	.	I	π-helix	trans	-54	-49.3	169.9	171.4	0	0	0	0	110.7	Y107 L108 L109 G115 I116 I333	Y107-V111 HydrophobicContact CD1-CG2 4.29Å; Y107-V111 HydrophobicContact CE1-CG2 4.02Å; Y107-V111 WeakPolarHBondContact O-CG2 3.46Å; Y107-V111 PolarHBondContact O-N 3.07Å; L108-V111 WeakPolarHBondContact O-CB 3.41Å; L108-V111 PolarHBondContact O-N 3Å; L109-V111 VanDerWaalsContact C-N 3.32Å; L109-V111 PolarHBondContact O-N 2.86Å; V111-G115 PolarHBondContact O-N 3Å; V111-I116 HydrophobicContact CG1-CD1 3.74Å; V111-I116 HydrophobicContact CG1-CG1 3.91Å; V111-I116 PolarHBondContact O-N 3.14Å; V111-I333 HydrophobicContact CG2-CD1 3.36Å; V111-I333 HydrophobicContact CG2-CG1 4.21Å
112	F	96.4	Very high	96.3	Very high	108 Å²	108	20.5 Å²	20.5	47%	0.474	10%	0.103	S	C	.	.	I	π-helix	trans	-78.8	-31.4	-175.3	-73.5	-69.9	0	0	0	114.6	L108 L109 I110 I116 P117 W538	L108-F112 WeakPolarHBondContact O-CD2 3.42Å; L108-F112 PolarHBondContact O-N 2.99Å; L109-F112 PolarHBondContact O-N 2.92Å; L109-F112 VanDerWaalsContact O-N 3.13Å; I110-F112 VanDerWaalsContact C-N 3.32Å; I110-F112 PolarHBondContact O-N 2.89Å; F112-I116 HydrophobicContact CD1-CD1 3.95Å; F112-I116 HydrophobicContact CE1-CD1 4.09Å; F112-P117 WeakPolarHBondContact O-CD 3.48Å; F112-P117 WeakPolarHBondContact O-CG 3.47Å; F112-W538 PolarHBondContact O-NE1 3.11Å
113	V	95.6	Very high	96.4	Very high	14 Å²	14	20.3 Å²	20.3	9%	0.085	10%	0.102	C	C	.	.	I	π-helix	trans	-96	-16.2	-176.9	-53.5	0	0	0	0	114	L109 W538 I546 T547 V550	L109-V113 HydrophobicContact CD2-CG1 4.14Å; L109-V113 HydrophobicContact CD2-CG2 3.8Å; L109-V113 WeakPolarHBondContact O-CG2 3.32Å; L109-V113 PolarHBondContact O-N 2.62Å; V113-W538 HydrophobicContact CG1-CH2 4.39Å; V113-W538 HydrophobicContact CG1-CZ2 3.97Å; V113-I546 HydrophobicContact CB-CG2 3.75Å; V113-I546 HydrophobicContact CG1-CG2 4.06Å; V113-I546 HydrophobicContact CG2-CG2 4.4Å; V113-T547 WeakPolarHBondContact O-CB 3.38Å; V113-T547 PolarHBondContact O-OG1 2.88Å; V113-V550 HydrophobicContact CG2-CG2 4.11Å
114	G	94.5	Very high	96.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.	I	π-helix	trans	-135.1	-55.6	-176.4	0	0	0	0	0	113.4	I110 P117 I118	I110-G114 WeakPolarHBondContact O-CA 3.29Å; I110-G114 PolarHBondContact O-N 3.41Å; G114-P117 WeakPolarHBondContact O-CD 3.35Å; G114-I118 WeakPolarHBondContact O-CD1 3.41Å; G114-I118 WeakPolarHBondContact O-CG1 3.16Å; G114-I118 PolarHBondContact O-N 3.18Å
115	G	95.4	Very high	96.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	I	π-helix	trans	-56.2	-66.9	-175.9	0	0	0	0	0	113.4	I110 V111 I118 F119 I339	I110-G115 PolarHBondContact O-N 3.45Å; V111-G115 PolarHBondContact O-N 3Å; G115-I118 PolarHBondContact O-N 3.07Å; G115-F119 WeakPolarHBondContact O-CB 3.19Å; G115-F119 PolarHBondContact O-N 3.13Å; G115-I339 WeakPolarHBondContact O-CD1 3.4Å
116	I	97.1	Very high	96.4	Very high	6 Å²	6	14.8 Å²	14.8	3%	0.031	7%	0.073	C	C	.	.	H	α-helix	trans	-58.2	-48.6	-180	-63.5	167.4	0	0	0	111.5	V111 F112 I118 F119 F120 F362 A365 M539	V111-I116 HydrophobicContact CG1-CD1 3.74Å; V111-I116 HydrophobicContact CG1-CG1 3.91Å; V111-I116 PolarHBondContact O-N 3.14Å; F112-I116 HydrophobicContact CD1-CD1 3.95Å; F112-I116 HydrophobicContact CE1-CD1 4.09Å; I116-I118 PolarHBondContact O-N 2.99Å; I116-F119 PolarHBondContact O-N 3.29Å; I116-F120 WeakPolarHBondContact O-CB 3.37Å; I116-F120 PolarHBondContact O-N 3.3Å; I116-F362 HydrophobicContact CD1-CD1 3.94Å; I116-F362 HydrophobicContact CD1-CE1 3.96Å; I116-F362 HydrophobicContact CG2-CD1 4.37Å; I116-F362 HydrophobicContact CG2-CD2 4.45Å; I116-F362 HydrophobicContact CG2-CE1 4.15Å; I116-F362 HydrophobicContact CG2-CE2 4.2Å; I116-F362 HydrophobicContact CG2-CZ 4.06Å; I116-A365 HydrophobicContact CD1-CB 3.94Å; I116-A365 HydrophobicContact CG1-CB 3.46Å; I116-A365 VanDerWaalsContact CG1-CB 3.46Å; I116-M539 HydrophobicContact CG2-CE 3.63Å
117	P	97.3	Very high	96.4	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-56	-49.3	179.7	-28.2	35.7	0	0	0	113.9	F112 G114 L121 M539 C542 W543	F112-P117 WeakPolarHBondContact O-CD 3.48Å; F112-P117 WeakPolarHBondContact O-CG 3.47Å; G114-P117 WeakPolarHBondContact O-CD 3.35Å; P117-L121 WeakPolarHBondContact O-CB 3.46Å; P117-L121 PolarHBondContact O-N 3.39Å; P117-M539 HydrophobicContact CB-SD 4.22Å; P117-M539 HydrophobicContact CG-SD 4.09Å; P117-C542 HydrophobicContact CB-CB 3.67Å; P117-C542 HydrophobicContact CG-CB 3.57Å; P117-W543 VanDerWaalsContact C-NE1 3.31Å; P117-W543 PolarHBondContact O-NE1 2.73Å
118	I	96.9	Very high	96.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-75.1	-38.9	-176.1	-54.2	159.1	0	0	0	111	G114 G115 I116 F120 L121 E122 F334 I339 T547	G114-I118 WeakPolarHBondContact O-CD1 3.41Å; G114-I118 WeakPolarHBondContact O-CG1 3.16Å; G114-I118 PolarHBondContact O-N 3.18Å; G115-I118 PolarHBondContact O-N 3.07Å; I116-I118 PolarHBondContact O-N 2.99Å; I118-F120 VanDerWaalsContact C-N 3.28Å; I118-F120 PolarHBondContact O-N 3.12Å; I118-L121 WeakPolarHBondContact O-CB 3.28Å; I118-L121 PolarHBondContact O-N 3.3Å; I118-L121 VanDerWaalsContact O-N 3.08Å; I118-E122 PolarHBondContact O-N 3.11Å; I118-F334 HydrophobicContact CD1-CD1 4.35Å; I118-F334 HydrophobicContact CD1-CE1 3.36Å; I118-F334 HydrophobicContact CD1-CZ 3.48Å; I118-F334 VanDerWaalsContact CD1-CZ 3.48Å; I118-I339 HydrophobicContact CB-CD1 4.25Å; I118-I339 HydrophobicContact CB-CG2 3.81Å; I118-I339 HydrophobicContact CD1-CG2 4.24Å; I118-I339 HydrophobicContact CG2-CG2 3.24Å; I118-T547 HydrophobicContact CD1-CG2 3.43Å; I118-T547 VanDerWaalsContact CD1-CG2 3.43Å; I118-T547 HydrophobicContact CG1-CG2 3.65Å
119	F	96.3	Very high	96.1	Very high	1 Å²	1	11.2 Å²	11.2	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-56.3	-45.7	175	-169.8	-84.5	0	0	0	111.5	G115 I116 I123 Y337 I339 L344 A361 L364	G115-F119 WeakPolarHBondContact O-CB 3.19Å; G115-F119 PolarHBondContact O-N 3.13Å; I116-F119 PolarHBondContact O-N 3.29Å; F119-I123 HydrophobicContact CD1-CD1 3.59Å; F119-I123 HydrophobicContact CE1-CD1 3.14Å; F119-I123 HydrophobicContact CE1-CG1 4.39Å; F119-I123 HydrophobicContact CZ-CD1 3.83Å; F119-I123 WeakPolarHBondContact O-CG1 3.33Å; F119-I123 PolarHBondContact O-N 3.37Å; F119-Y337 HydrophobicContact CB-CD1 4.18Å; F119-Y337 AromaticContact CD2-CD1 3.85Å; F119-Y337 HydrophobicContact CD2-CD1 3.85Å; F119-Y337 HydrophobicContact CD2-CG 4.43Å; F119-Y337 HydrophobicContact CG-CD1 4.2Å; F119-I339 HydrophobicContact CB-CD1 4.23Å; F119-I339 HydrophobicContact CB-CG1 4.36Å; F119-I339 HydrophobicContact CD2-CG1 4.41Å; F119-L344 HydrophobicContact CD2-CD1 3.42Å; F119-L344 VanDerWaalsContact CD2-CD1 3.42Å; F119-L344 HydrophobicContact CD2-CD2 4.35Å; F119-L344 HydrophobicContact CE2-CD1 3.53Å; F119-L344 HydrophobicContact CE2-CD2 3.59Å; F119-L344 HydrophobicContact CE2-CG 4.21Å; F119-L344 HydrophobicContact CG-CD1 4.19Å; F119-L344 HydrophobicContact CZ-CD1 4.36Å; F119-L344 HydrophobicContact CZ-CD2 3.82Å; F119-A361 HydrophobicContact CD1-CB 4.09Å; F119-L364 HydrophobicContact CE1-CB 3.82Å; F119-L364 HydrophobicContact CE1-CD1 3.58Å; F119-L364 HydrophobicContact CE1-CG 4.34Å; F119-L364 HydrophobicContact CZ-CB 3.93Å; F119-L364 HydrophobicContact CZ-CD1 3.8Å; F119-L364 HydrophobicContact CZ-CG 4.44Å
120	F	97.6	Very high	95.9	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-63.2	-43.6	173.9	172.3	-131.9	0	0	0	112.1	I116 I118 E122 I123 A124 Y358 A361 V527 P535 M539 W543	I116-F120 WeakPolarHBondContact O-CB 3.37Å; I116-F120 PolarHBondContact O-N 3.3Å; I118-F120 VanDerWaalsContact C-N 3.28Å; I118-F120 PolarHBondContact O-N 3.12Å; F120-E122 PolarHBondContact O-N 3.25Å; F120-I123 PolarHBondContact O-N 3.19Å; F120-A124 HydrophobicContact CD2-CB 4.28Å; F120-A124 HydrophobicContact CE2-CB 4Å; F120-A124 HydrophobicContact CZ-CB 4.49Å; F120-A124 WeakPolarHBondContact O-CB 3.22Å; F120-A124 PolarHBondContact O-N 3.12Å; F120-Y358 HydrophobicContact CD1-CD2 4.14Å; F120-Y358 HydrophobicContact CD2-CD2 4.36Å; F120-Y358 AromaticContact CE1-CD2 3.75Å; F120-Y358 HydrophobicContact CE1-CD2 3.75Å; F120-Y358 HydrophobicContact CE1-CE2 4.37Å; F120-Y358 AromaticContact CE2-CD2 3.98Å; F120-Y358 HydrophobicContact CE2-CD2 3.98Å; F120-Y358 HydrophobicContact CE2-CG 4.39Å; F120-Y358 HydrophobicContact CG-CD2 4.43Å; F120-Y358 AromaticContact CZ-CD2 3.65Å; F120-Y358 HydrophobicContact CZ-CD2 3.65Å; F120-Y358 HydrophobicContact CZ-CG 4.3Å; F120-A361 HydrophobicContact CB-CB 3.76Å; F120-A361 HydrophobicContact CD2-CB 4.3Å; F120-A361 HydrophobicContact CG-CB 4.38Å; F120-V527 HydrophobicContact CZ-CG1 3.94Å; F120-V527 HydrophobicContact CZ-CG2 4.35Å; F120-P535 HydrophobicContact CE1-CB 4.42Å; F120-P535 HydrophobicContact CE1-CG 4.36Å; F120-P535 HydrophobicContact CZ-CB 4.42Å; F120-P535 HydrophobicContact CZ-CG 3.99Å; F120-M539 HydrophobicContact CD1-CB 4.38Å; F120-M539 HydrophobicContact CD1-CG 3.95Å; F120-M539 HydrophobicContact CD1-SD 4.24Å; F120-M539 HydrophobicContact CE1-CB 4.34Å; F120-M539 HydrophobicContact CE1-CG 4.06Å; F120-W543 AromaticContact CD1-CH2 3.7Å; F120-W543 HydrophobicContact CD1-CH2 3.7Å; F120-W543 AromaticContact CD1-CZ2 3.33Å; F120-W543 HydrophobicContact CD1-CZ2 3.33Å; F120-W543 AromaticContact CE1-CH2 3.44Å; F120-W543 HydrophobicContact CE1-CH2 3.44Å; F120-W543 VanDerWaalsContact CE1-CH2 3.44Å; F120-W543 AromaticContact CE1-CZ2 3.62Å; F120-W543 HydrophobicContact CE1-CZ2 3.62Å; F120-W543 HydrophobicContact CG-CZ2 4.3Å; F120-W543 HydrophobicContact CZ-CH2 4.42Å
121	L	97.3	Very high	95.7	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-56.5	-49.2	178.1	-179.6	155.8	0	0	0	111.5	P117 I118 A124 L125 V514 F523 W543	P117-L121 WeakPolarHBondContact O-CB 3.46Å; P117-L121 PolarHBondContact O-N 3.39Å; I118-L121 WeakPolarHBondContact O-CB 3.28Å; I118-L121 PolarHBondContact O-N 3.3Å; I118-L121 VanDerWaalsContact O-N 3.08Å; L121-A124 PolarHBondContact O-N 3.38Å; L121-L125 WeakPolarHBondContact O-CB 3.5Å; L121-L125 PolarHBondContact O-N 2.98Å; L121-V514 HydrophobicContact CD1-CB 4.06Å; L121-V514 HydrophobicContact CD1-CG1 4.12Å; L121-V514 HydrophobicContact CD1-CG2 4.16Å; L121-V514 HydrophobicContact CD2-CG2 4.22Å; L121-V514 HydrophobicContact CG-CG2 4.39Å; L121-F523 HydrophobicContact CG-CE1 4.41Å; L121-W543 HydrophobicContact CB-CZ2 3.95Å; L121-W543 HydrophobicContact CD1-CD2 4.22Å; L121-W543 HydrophobicContact CD1-CG 4Å
122	E	97	Very high	95.3	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.005	4%	0.043	C	C	.	.	H	α-helix	trans	-64.3	-45.5	-178.4	-78.6	-166.2	-132.2	0	0	112.7	I118 F120 L125 G126 G340 L344 T345	I118-E122 PolarHBondContact O-N 3.11Å; F120-E122 PolarHBondContact O-N 3.25Å; E122-L125 PolarHBondContact O-N 3.07Å; E122-G126 PolarHBondContact O-N 3.31Å; E122-G340 PolarHBondContact OE1-N 2.79Å; E122-L344 HydrophobicContact CB-CB 4.13Å; E122-T345 PolarHBondContact OE2-OG1 3.41Å
123	I	96.7	Very high	95.1	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-64.7	-47.1	178.8	-67.1	171.8	0	0	0	110.2	F74 F119 F120 L125 G126 Q127 L344 C357 L364	F74-I123 HydrophobicContact CZ-CD1 4.11Å; F74-I123 HydrophobicContact CZ-CG2 3.87Å; F119-I123 HydrophobicContact CD1-CD1 3.59Å; F119-I123 HydrophobicContact CE1-CD1 3.14Å; F119-I123 HydrophobicContact CE1-CG1 4.39Å; F119-I123 HydrophobicContact CZ-CD1 3.83Å; F119-I123 WeakPolarHBondContact O-CG1 3.33Å; F119-I123 PolarHBondContact O-N 3.37Å; F120-I123 PolarHBondContact O-N 3.19Å; I123-L125 VanDerWaalsContact C-N 3.34Å; I123-L125 PolarHBondContact O-N 3.37Å; I123-G126 PolarHBondContact O-N 3.43Å; I123-Q127 VanDerWaalsContact O-CB 3.26Å; I123-Q127 WeakPolarHBondContact O-CB 3.24Å; I123-Q127 PolarHBondContact O-N 2.82Å; I123-L344 HydrophobicContact CG1-CB 4.37Å; I123-C357 HydrophobicContact CG2-CB 3.68Å; I123-L364 HydrophobicContact CD1-CD1 4.41Å
124	A	97.2	Very high	95	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-62.2	-43.2	179.2	0	0	0	0	0	111.3	F120 L121 Q127 F128 F523 V527 M530	F120-A124 HydrophobicContact CD2-CB 4.28Å; F120-A124 HydrophobicContact CE2-CB 4Å; F120-A124 HydrophobicContact CZ-CB 4.49Å; F120-A124 WeakPolarHBondContact O-CB 3.22Å; F120-A124 PolarHBondContact O-N 3.12Å; L121-A124 PolarHBondContact O-N 3.38Å; A124-Q127 PolarHBondContact O-N 3.46Å; A124-F128 VanDerWaalsContact O-CB 3.23Å; A124-F128 WeakPolarHBondContact O-CB 3.41Å; A124-F128 PolarHBondContact O-N 3.01Å; A124-F523 HydrophobicContact CB-CE1 4.44Å; A124-F523 HydrophobicContact CB-CZ 3.98Å; A124-V527 HydrophobicContact CB-CG2 4.06Å; A124-M530 HydrophobicContact CB-CE 4.25Å
125	L	96.4	Very high	95	Very high	1 Å²	1	5 Å²	5	1%	0.005	3%	0.026	C	C	.	.	H	α-helix	trans	-64.4	-44.3	178.8	-176.1	66.6	0	0	0	111.2	L121 E122 I123 M129 V136 W137 I139 F523	L121-L125 WeakPolarHBondContact O-CB 3.5Å; L121-L125 PolarHBondContact O-N 2.98Å; E122-L125 PolarHBondContact O-N 3.07Å; I123-L125 VanDerWaalsContact C-N 3.34Å; I123-L125 PolarHBondContact O-N 3.37Å; L125-M129 HydrophobicContact CD1-CG 4.12Å; L125-M129 WeakPolarHBondContact O-CB 3.19Å; L125-M129 WeakPolarHBondContact O-CG 3.28Å; L125-M129 PolarHBondContact O-N 2.9Å; L125-V136 HydrophobicContact CB-CG2 4.45Å; L125-V136 HydrophobicContact CD1-CG2 4.31Å; L125-V136 HydrophobicContact CD2-CG1 4.14Å; L125-V136 HydrophobicContact CD2-CG2 3.96Å; L125-V136 HydrophobicContact CG-CG2 3.55Å; L125-W137 HydrophobicContact CD2-CH2 3.96Å; L125-W137 HydrophobicContact CD2-CZ2 4.16Å; L125-W137 HydrophobicContact CD2-CZ3 4.26Å; L125-I139 HydrophobicContact CD1-CD1 3.64Å; L125-I139 HydrophobicContact CD1-CG2 4.23Å; L125-F523 HydrophobicContact CB-CE2 4.34Å; L125-F523 HydrophobicContact CB-CZ 4.1Å; L125-F523 HydrophobicContact CD1-CE2 3.98Å
126	G	95.5	Very high	94.9	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-60.9	-48.3	174.1	0	0	0	0	0	112.7	E122 I123 F128 K130 T345 S349	E122-G126 PolarHBondContact O-N 3.31Å; I123-G126 PolarHBondContact O-N 3.43Å; G126-F128 PolarHBondContact O-N 3.44Å; G126-K130 WeakPolarHBondContact O-CA 3.38Å; G126-K130 PolarHBondContact O-N 3.19Å; G126-T345 WeakPolarHBondContact CA-O 3.43Å; G126-S349 VanDerWaalsContact O-CA 3.23Å; G126-S349 WeakPolarHBondContact O-CA 3.42Å
127	Q	95.8	Very high	94.9	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-62.4	-42	179.7	-176.9	174.8	-55.1	0	0	112.2	I123 A124 K130 G348 N351 R352 F353 N355 M530	I123-Q127 VanDerWaalsContact O-CB 3.26Å; I123-Q127 WeakPolarHBondContact O-CB 3.24Å; I123-Q127 PolarHBondContact O-N 2.82Å; A124-Q127 PolarHBondContact O-N 3.46Å; Q127-K130 WeakPolarHBondContact O-CD 3.48Å; Q127-G348 VanDerWaalsContact CA-O 3.23Å; Q127-G348 WeakPolarHBondContact CA-O 3.38Å; Q127-G348 WeakPolarHBondContact CB-O 3.39Å; Q127-G348 PolarHBondContact N-O 3.49Å; Q127-N351 HydrophobicContact CB-CB 4.47Å; Q127-N351 HydrophobicContact CG-CB 3.97Å; Q127-N351 PolarHBondContact OE1-ND2 3.25Å; Q127-R352 PolarHBondContact NE2-O 3.11Å; Q127-F353 PolarHBondContact NE2-O 3.31Å; Q127-N355 PolarHBondContact NE2-O 3.29Å; Q127-M530 HydrophobicContact CB-SD 4.17Å; Q127-M530 HydrophobicContact CG-SD 3.88Å
128	F	94.6	Very high	94.7	Very high	5 Å²	5	6.9 Å²	6.9	2%	0.022	4%	0.035	C	C	.	.	H	α-helix	trans	-68.2	-51.6	179.2	-176.5	-111.5	0	0	0	111.8	A124 G126 K130 F353 D526 M530 W619 H622 H623 M627	A124-F128 VanDerWaalsContact O-CB 3.23Å; A124-F128 WeakPolarHBondContact O-CB 3.41Å; A124-F128 PolarHBondContact O-N 3.01Å; G126-F128 PolarHBondContact O-N 3.44Å; F128-K130 VanDerWaalsContact C-N 3.29Å; F128-K130 PolarHBondContact O-N 2.89Å; F128-F353 AromaticContact CD2-CE2 3.99Å; F128-F353 HydrophobicContact CD2-CE2 3.99Å; F128-F353 HydrophobicContact CD2-CZ 4.33Å; F128-F353 HydrophobicContact CE2-CE2 4.42Å; F128-F353 HydrophobicContact CE2-CZ 4.47Å; F128-D526 HydrophobicContact CD2-CB 4.02Å; F128-D526 HydrophobicContact CE1-CB 4.23Å; F128-D526 HydrophobicContact CE2-CB 3.6Å; F128-D526 HydrophobicContact CZ-CB 3.71Å; F128-D526 VanDerWaalsContact CZ-CG 3.43Å; F128-D526 WeakPolarHBondContact CZ-OD1 3.35Å; F128-M530 VanDerWaalsContact CA-SD 3.56Å; F128-M530 HydrophobicContact CB-CE 3.87Å; F128-M530 HydrophobicContact CB-SD 3.64Å; F128-M530 HydrophobicContact CD2-CE 4.41Å; F128-M530 HydrophobicContact CD2-CG 4.19Å; F128-M530 HydrophobicContact CD2-SD 4.03Å; F128-M530 HydrophobicContact CG-SD 4.34Å; F128-W619 AromaticContact CE1-CH2 3.94Å; F128-W619 HydrophobicContact CE1-CH2 3.94Å; F128-W619 AromaticContact CE1-CZ3 3.72Å; F128-W619 HydrophobicContact CE1-CZ3 3.72Å; F128-W619 HydrophobicContact CZ-CH2 4.36Å; F128-W619 HydrophobicContact CZ-CZ3 4.26Å; F128-H622 PolarHBondContact O-NE2 3.01Å; F128-H622 VanDerWaalsContact O-NE2 3.13Å; F128-H623 PolarHBondContact O-NE2 3.25Å; F128-M627 HydrophobicContact CZ-CE 3.89Å
129	M	92.6	Very high	94.6	Very high	8 Å²	8	6.9 Å²	6.9	4%	0.039	4%	0.035	C	C	.	.	H	α-helix	trans	-77.6	-15.7	-175.4	-64.7	-59.8	-59	0	0	113.3	L125 A131 V136 N138 I139 W619 H622	L125-M129 HydrophobicContact CD1-CG 4.12Å; L125-M129 WeakPolarHBondContact O-CB 3.19Å; L125-M129 WeakPolarHBondContact O-CG 3.28Å; L125-M129 PolarHBondContact O-N 2.9Å; M129-A131 HydrophobicContact CB-CB 4.26Å; M129-A131 PolarHBondContact O-N 3.13Å; M129-A131 VanDerWaalsContact O-N 3.17Å; M129-V136 HydrophobicContact CB-CG2 3.7Å; M129-V136 HydrophobicContact CG-CG2 3.85Å; M129-N138 HydrophobicContact CE-CB 4.18Å; M129-I139 HydrophobicContact CE-CB 4.38Å; M129-I139 HydrophobicContact SD-CB 4.06Å; M129-I139 HydrophobicContact SD-CD1 4.38Å; M129-I139 HydrophobicContact SD-CG1 4.36Å; M129-W619 HydrophobicContact CE-CZ3 4.41Å; M129-W619 HydrophobicContact SD-CZ3 3.93Å; M129-H622 PolarHBondContact O-CE1 3.37Å
130	K	91.7	Very high	94.5	Very high	38 Å²	38	6.8 Å²	6.8	17%	0.165	4%	0.035	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	38.6	-175.9	-67.3	-67.1	-159.7	146.8	0	112.6	R65 G126 Q127 F128 S349 N351	R65-K130 WeakPolarHBondContact CD-O 3.34Å; R65-K130 PolarHBondContact NH1-O 3.24Å; G126-K130 WeakPolarHBondContact O-CA 3.38Å; G126-K130 PolarHBondContact O-N 3.19Å; Q127-K130 WeakPolarHBondContact O-CD 3.48Å; F128-K130 VanDerWaalsContact C-N 3.29Å; F128-K130 PolarHBondContact O-N 2.89Å; K130-S349 WeakPolarHBondContact CD-O 3.3Å; K130-N351 WeakPolarHBondContact CE-O 3.22Å; K130-N351 PolarHBondContact NZ-O 3.14Å
131	A	90.4	Very high	94.4	Very high	10 Å²	10	7.5 Å²	7.5	8%	0.083	4%	0.04	C	C	.	.			trans	-136.8	148.6	-172.5	0	0	0	0	0	111	R65 M129 N135 S349	R65-A131 VanDerWaalsContact NH1-CA 3.25Å; M129-A131 HydrophobicContact CB-CB 4.26Å; M129-A131 PolarHBondContact O-N 3.13Å; M129-A131 VanDerWaalsContact O-N 3.17Å; A131-N135 HydrophobicContact CB-CB 3.82Å; A131-S349 WeakPolarHBondContact O-CB 3.37Å
132	G	89.8	Confident	94.3	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.04	C	C	.	.			trans	-71.4	177.5	170.1	0	0	0	0	0	112.5	I134 N135 V136 D451	G132-I134 PolarHBondContact O-N 2.98Å; G132-N135 PolarHBondContact O-N 3.02Å; G132-N135 VanDerWaalsContact O-N 3.11Å; G132-V136 WeakPolarHBondContact O-CB 3.44Å; G132-V136 PolarHBondContact O-N 2.85Å; G132-D451 PolarHBondContact N-OD2 3.4Å
133	S	91.8	Very high	94.3	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.007	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-30.5	-163.3	-33.7	0	0	0	0	115.4	V136 W137 G147 S150 G342	S133-V136 WeakPolarHBondContact O-CG1 3.45Å; S133-W137 PolarHBondContact O-NE1 2.88Å; S133-G147 WeakPolarHBondContact O-CA 3.08Å; S133-S150 WeakPolarHBondContact CB-OG 3.44Å; S133-G342 WeakPolarHBondContact OG-CA 3.31Å; S133-G342 PolarHBondContact OG-O 3.43Å
134	I	94.1	Very high	94.2	Very high	3 Å²	3	9 Å²	9	2%	0.015	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-48.5	179	-58.7	170	0	0	0	112.3	G132 V136 K144 Y148 M151 L452	G132-I134 PolarHBondContact O-N 2.98Å; I134-V136 VanDerWaalsContact C-N 3.32Å; I134-V136 PolarHBondContact O-N 3.25Å; I134-K144 HydrophobicContact CG2-CD 4.31Å; I134-K144 HydrophobicContact CG2-CG 4.01Å; I134-K144 WeakPolarHBondContact O-CE 3.43Å; I134-Y148 HydrophobicContact CD1-CD1 3.89Å; I134-Y148 HydrophobicContact CD1-CE1 3.82Å; I134-Y148 HydrophobicContact CG1-CD1 4.29Å; I134-Y148 HydrophobicContact CG1-CE1 4.42Å; I134-Y148 HydrophobicContact CG2-CE1 4.09Å; I134-Y148 HydrophobicContact CG2-CE2 4.3Å; I134-M151 HydrophobicContact CD1-CG 3.91Å; I134-M151 HydrophobicContact CG1-CG 3.75Å; I134-L452 HydrophobicContact CB-CD2 4.21Å; I134-L452 HydrophobicContact CD1-CD1 3.72Å; I134-L452 HydrophobicContact CD1-CD2 4.19Å; I134-L452 HydrophobicContact CD1-CG 4.12Å; I134-L452 HydrophobicContact CG2-CD2 3.79Å
135	N	93	Very high	94.2	Very high	31 Å²	31	9 Å²	9	17%	0.166	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-78.9	-17.8	-174.1	-79.6	-18.7	0	0	0	113.1	A131 G132 W137 N138 K144 D451	A131-N135 HydrophobicContact CB-CB 3.82Å; G132-N135 PolarHBondContact O-N 3.02Å; G132-N135 VanDerWaalsContact O-N 3.11Å; N135-W137 PolarHBondContact O-N 3.12Å; N135-N138 WeakPolarHBondContact O-CB 3.29Å; N135-N138 PolarHBondContact O-N 3.27Å; N135-N138 PolarHBondContact O-ND2 3.15Å; N135-K144 PolarHBondContact OD1-NZ 3.42Å; N135-D451 PolarHBondContact ND2-O 2.87Å
136	V	94.6	Very high	94.3	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-55.4	-36	172.4	86.7	0	0	0	0	111.9	L125 M129 G132 S133 I134 N138 I139 T345	L125-V136 HydrophobicContact CB-CG2 4.45Å; L125-V136 HydrophobicContact CD1-CG2 4.31Å; L125-V136 HydrophobicContact CD2-CG1 4.14Å; L125-V136 HydrophobicContact CD2-CG2 3.96Å; L125-V136 HydrophobicContact CG-CG2 3.55Å; M129-V136 HydrophobicContact CB-CG2 3.7Å; M129-V136 HydrophobicContact CG-CG2 3.85Å; G132-V136 WeakPolarHBondContact O-CB 3.44Å; G132-V136 PolarHBondContact O-N 2.85Å; S133-V136 WeakPolarHBondContact O-CG1 3.45Å; I134-V136 VanDerWaalsContact C-N 3.32Å; I134-V136 PolarHBondContact O-N 3.25Å; V136-N138 PolarHBondContact O-N 3.49Å; V136-N138 VanDerWaalsContact O-N 3.08Å; V136-I139 PolarHBondContact O-N 3.35Å; V136-T345 HydrophobicContact CB-CG2 3.9Å; V136-T345 HydrophobicContact CG1-CG2 3.97Å; V136-T345 HydrophobicContact CG2-CG2 3.61Å
137	W	96.1	Very high	94.3	Very high	5 Å²	5	9 Å²	9	2%	0.019	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-76.1	7.1	179.2	-62.6	105.4	0	0	0	113.9	L125 S133 N135 I139 A140 K144 L146 G147 E510 V513 V514	L125-W137 HydrophobicContact CD2-CH2 3.96Å; L125-W137 HydrophobicContact CD2-CZ2 4.16Å; L125-W137 HydrophobicContact CD2-CZ3 4.26Å; S133-W137 PolarHBondContact O-NE1 2.88Å; N135-W137 PolarHBondContact O-N 3.12Å; W137-I139 HydrophobicContact CE3-CG2 4.29Å; W137-I139 PolarHBondContact O-N 3.35Å; W137-A140 CarbonylContact O-C 3.6Å; W137-A140 PolarHBondContact O-N 2.95Å; W137-A140 VanDerWaalsContact O-O 3.11Å; W137-K144 HydrophobicContact CB-CB 4.42Å; W137-K144 HydrophobicContact CB-CG 4.44Å; W137-L146 HydrophobicContact CD2-CB 3.76Å; W137-L146 HydrophobicContact CD2-CD1 3.97Å; W137-L146 HydrophobicContact CE3-CB 4.4Å; W137-L146 HydrophobicContact CE3-CD1 3.73Å; W137-L146 HydrophobicContact CG-CB 4.12Å; W137-L146 HydrophobicContact CH2-CB 4.45Å; W137-L146 HydrophobicContact CH2-CD1 3.58Å; W137-L146 HydrophobicContact CZ2-CB 3.8Å; W137-L146 HydrophobicContact CZ2-CD1 3.8Å; W137-L146 HydrophobicContact CZ2-CG 4.31Å; W137-L146 HydrophobicContact CZ3-CD1 3.52Å; W137-G147 VanDerWaalsContact CD1-CA 3.44Å; W137-E510 HydrophobicContact CH2-CB 3.93Å; W137-E510 HydrophobicContact CH2-CG 3.71Å; W137-E510 HydrophobicContact CZ2-CB 4.39Å; W137-E510 HydrophobicContact CZ2-CG 3.68Å; W137-V513 HydrophobicContact CE3-CG1 4.09Å; W137-V513 HydrophobicContact CZ3-CB 4.16Å; W137-V513 HydrophobicContact CZ3-CG1 3.85Å; W137-V514 HydrophobicContact CH2-CG2 4.41Å; W137-V514 HydrophobicContact CZ3-CG2 4.19Å
138	N	94.1	Very high	94.4	Very high	40 Å²	40	13.5 Å²	13.5	21%	0.214	6%	0.064	C	C	.	.	G	3₁₀ helix	trans	-62.5	-13.6	163.5	-71	-16.1	0	0	0	111.8	M129 N135 V136 A140 P141 K144 P617 V618	M129-N138 HydrophobicContact CE-CB 4.18Å; N135-N138 WeakPolarHBondContact O-CB 3.29Å; N135-N138 PolarHBondContact O-N 3.27Å; N135-N138 PolarHBondContact O-ND2 3.15Å; V136-N138 PolarHBondContact O-N 3.49Å; V136-N138 VanDerWaalsContact O-N 3.08Å; N138-A140 PolarHBondContact O-N 2.78Å; N138-P141 WeakPolarHBondContact O-CD 3.19Å; N138-K144 PolarHBondContact OD1-NZ 2.64Å; N138-P617 CarbonylContact O-C 3.59Å; N138-P617 WeakPolarHBondContact O-CA 3.31Å; N138-V618 HydrophobicContact CB-CB 4.28Å; N138-V618 PolarHBondContact O-N 3.25Å
139	I	94	Very high	94.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-59.9	-29.3	166.8	-158.9	169.1	0	0	0	113	L125 M129 V136 W137 Y518 F523 P617	L125-I139 HydrophobicContact CD1-CD1 3.64Å; L125-I139 HydrophobicContact CD1-CG2 4.23Å; M129-I139 HydrophobicContact CE-CB 4.38Å; M129-I139 HydrophobicContact SD-CB 4.06Å; M129-I139 HydrophobicContact SD-CD1 4.38Å; M129-I139 HydrophobicContact SD-CG1 4.36Å; V136-I139 PolarHBondContact O-N 3.35Å; W137-I139 HydrophobicContact CE3-CG2 4.29Å; W137-I139 PolarHBondContact O-N 3.35Å; I139-Y518 HydrophobicContact CD1-CD1 3.71Å; I139-Y518 HydrophobicContact CD1-CD2 3.92Å; I139-Y518 HydrophobicContact CD1-CE1 3.64Å; I139-Y518 HydrophobicContact CD1-CE2 3.82Å; I139-Y518 HydrophobicContact CD1-CG 3.84Å; I139-Y518 HydrophobicContact CG1-CD1 4.12Å; I139-Y518 HydrophobicContact CG1-CD2 3.35Å; I139-Y518 HydrophobicContact CG1-CE1 4.14Å; I139-Y518 HydrophobicContact CG1-CE2 3.35Å; I139-Y518 HydrophobicContact CG1-CG 3.73Å; I139-F523 HydrophobicContact CD1-CD2 4.46Å; I139-P617 WeakPolarHBondContact O-CA 3.33Å; I139-P617 WeakPolarHBondContact O-CB 3.45Å
140	A	95.4	Very high	94.7	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	-148.3	80.5	174.6	0	0	0	0	0	109.4	W137 N138 L142 F143 V513 V517	W137-A140 CarbonylContact O-C 3.6Å; W137-A140 PolarHBondContact O-N 2.95Å; W137-A140 VanDerWaalsContact O-O 3.11Å; N138-A140 PolarHBondContact O-N 2.78Å; A140-L142 PolarHBondContact O-N 3Å; A140-F143 HydrophobicContact CB-CD2 4.38Å; A140-F143 PolarHBondContact O-N 3.5Å; A140-V513 HydrophobicContact CB-CG1 3.67Å; A140-V517 HydrophobicContact CB-CG1 4.3Å
141	P	94.8	Very high	94.9	Very high	15 Å²	15	11.6 Å²	11.6	10%	0.097	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-53.6	-29.3	-168.1	-29	34	0	0	0	115.9	N138 F143 K144 K599 L614 S616 V618	N138-P141 WeakPolarHBondContact O-CD 3.19Å; P141-F143 PolarHBondContact O-N 2.94Å; P141-K144 WeakPolarHBondContact O-CB 3.39Å; P141-K144 PolarHBondContact O-N 3Å; P141-K599 WeakPolarHBondContact O-CD 3.11Å; P141-K599 WeakPolarHBondContact O-CE 3.4Å; P141-K599 PolarHBondContact O-NZ 3.28Å; P141-L614 CarbonylContact C-O 3.57Å; P141-L614 WeakPolarHBondContact CD-O 3.18Å; P141-S616 WeakPolarHBondContact CD-O 3.31Å; P141-S616 WeakPolarHBondContact CG-O 3.2Å; P141-V618 HydrophobicContact CG-CG2 3.66Å
142	L	95.7	Very high	95.2	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-54.9	-38.6	174.8	-174.3	58.3	0	0	0	111.8	A140 L596 K599 F600 W611 L614 T615	A140-L142 PolarHBondContact O-N 3Å; L142-L596 HydrophobicContact CD1-CG 4.05Å; L142-L596 HydrophobicContact CD2-CG 4.43Å; L142-L596 HydrophobicContact CG-CG 4.05Å; L142-K599 HydrophobicContact CD1-CB 4.47Å; L142-F600 HydrophobicContact CD1-CB 4.28Å; L142-F600 HydrophobicContact CD1-CD2 4.43Å; L142-W611 HydrophobicContact CD2-CE3 3.96Å; L142-W611 HydrophobicContact CD2-CH2 4.28Å; L142-W611 HydrophobicContact CD2-CZ3 3.79Å; L142-L614 HydrophobicContact CB-CB 3.85Å; L142-L614 WeakPolarHBondContact CB-O 3.14Å; L142-L614 HydrophobicContact CD1-CB 4.17Å; L142-L614 HydrophobicContact CD1-CD1 3.86Å; L142-L614 HydrophobicContact CG-CB 4.47Å; L142-L614 PolarHBondContact N-O 3.31Å; L142-T615 HydrophobicContact CB-CG2 4.5Å; L142-T615 HydrophobicContact CD2-CG2 4.03Å
143	F	96.4	Very high	95.5	Very high	7 Å²	7	13 Å²	13	3%	0.031	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-98.2	19.6	-173.5	-66.1	-85.2	0	0	0	113.7	A140 P141 G145 L146 W509 V513 V517 L596	A140-F143 HydrophobicContact CB-CD2 4.38Å; A140-F143 PolarHBondContact O-N 3.5Å; P141-F143 PolarHBondContact O-N 2.94Å; F143-G145 PolarHBondContact O-N 3.27Å; F143-L146 HydrophobicContact CB-CD1 4.21Å; F143-L146 WeakPolarHBondContact O-CB 3.4Å; F143-L146 PolarHBondContact O-N 3.23Å; F143-W509 HydrophobicContact CE1-CE3 4.11Å; F143-W509 AromaticContact CE1-CZ3 3.85Å; F143-W509 HydrophobicContact CE1-CZ3 3.85Å; F143-V513 HydrophobicContact CB-CG1 4.04Å; F143-V513 HydrophobicContact CB-CG2 3.73Å; F143-V513 HydrophobicContact CD1-CG2 3.44Å; F143-V513 VanDerWaalsContact CD1-CG2 3.44Å; F143-V513 HydrophobicContact CD2-CG1 4.13Å; F143-V513 HydrophobicContact CD2-CG2 3.76Å; F143-V513 HydrophobicContact CE1-CG2 3.9Å; F143-V513 HydrophobicContact CE2-CG2 4.21Å; F143-V513 HydrophobicContact CG-CB 4.44Å; F143-V513 HydrophobicContact CG-CG1 4.17Å; F143-V513 HydrophobicContact CG-CG2 3.35Å; F143-V513 HydrophobicContact CZ-CG2 4.27Å; F143-V517 HydrophobicContact CD2-CG1 4.3Å; F143-V517 HydrophobicContact CD2-CG2 4.47Å; F143-V517 HydrophobicContact CE2-CB 4.37Å; F143-V517 HydrophobicContact CE2-CG1 3.95Å; F143-V517 HydrophobicContact CE2-CG2 3.74Å; F143-V517 HydrophobicContact CZ-CG2 4.13Å; F143-L596 HydrophobicContact CD1-CD1 4.23Å; F143-L596 HydrophobicContact CE1-CD1 3.58Å; F143-L596 HydrophobicContact CZ-CD1 3.98Å
144	K	95.4	Very high	95.7	Very high	25 Å²	25	13 Å²	13	11%	0.109	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-15.5	175.1	-160.9	162.6	-174.4	159.5	0	113.9	I134 N135 W137 N138 P141 L146 G147 Y148	I134-K144 HydrophobicContact CG2-CD 4.31Å; I134-K144 HydrophobicContact CG2-CG 4.01Å; I134-K144 WeakPolarHBondContact O-CE 3.43Å; N135-K144 PolarHBondContact OD1-NZ 3.42Å; W137-K144 HydrophobicContact CB-CB 4.42Å; W137-K144 HydrophobicContact CB-CG 4.44Å; N138-K144 PolarHBondContact OD1-NZ 2.64Å; P141-K144 WeakPolarHBondContact O-CB 3.39Å; P141-K144 PolarHBondContact O-N 3Å; K144-L146 PolarHBondContact O-N 3.44Å; K144-G147 PolarHBondContact O-N 3.11Å; K144-G147 VanDerWaalsContact O-N 3.16Å; K144-Y148 HydrophobicContact CG-CE2 4.24Å; K144-Y148 VanDerWaalsContact O-CD2 3.3Å; K144-Y148 WeakPolarHBondContact O-CD2 3.22Å; K144-Y148 PolarHBondContact O-N 2.86Å
145	G	96.8	Very high	95.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-53.9	-31.7	167.6	0	0	0	0	0	114.6	F143 G147 Y148 A149 C591 S595	F143-G145 PolarHBondContact O-N 3.27Å; G145-G147 VanDerWaalsContact C-N 3.28Å; G145-G147 PolarHBondContact O-N 3.07Å; G145-Y148 PolarHBondContact O-N 2.94Å; G145-A149 WeakPolarHBondContact O-CB 3.26Å; G145-A149 PolarHBondContact O-N 3.49Å; G145-C591 WeakPolarHBondContact CA-O 3.19Å; G145-S595 VanDerWaalsContact CA-CB 3.44Å; G145-S595 PolarHBondContact N-OG 3.1Å
146	L	97.1	Very high	95.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.7	-39.3	175	-81	168	0	0	0	112.3	W137 F143 K144 A149 S150 Q506 W509 E510 V513 I592	W137-L146 HydrophobicContact CD2-CB 3.76Å; W137-L146 HydrophobicContact CD2-CD1 3.97Å; W137-L146 HydrophobicContact CE3-CB 4.4Å; W137-L146 HydrophobicContact CE3-CD1 3.73Å; W137-L146 HydrophobicContact CG-CB 4.12Å; W137-L146 HydrophobicContact CH2-CB 4.45Å; W137-L146 HydrophobicContact CH2-CD1 3.58Å; W137-L146 HydrophobicContact CZ2-CB 3.8Å; W137-L146 HydrophobicContact CZ2-CD1 3.8Å; W137-L146 HydrophobicContact CZ2-CG 4.31Å; W137-L146 HydrophobicContact CZ3-CD1 3.52Å; F143-L146 HydrophobicContact CB-CD1 4.21Å; F143-L146 WeakPolarHBondContact O-CB 3.4Å; F143-L146 PolarHBondContact O-N 3.23Å; K144-L146 PolarHBondContact O-N 3.44Å; L146-A149 PolarHBondContact O-N 2.98Å; L146-S150 PolarHBondContact O-N 2.9Å; L146-S150 PolarHBondContact O-OG 3.4Å; L146-Q506 PolarHBondContact O-NE2 3.28Å; L146-W509 HydrophobicContact CD2-CB 3.65Å; L146-W509 HydrophobicContact CG-CB 4.45Å; L146-E510 HydrophobicContact CD1-CG 4.44Å; L146-E510 HydrophobicContact CD2-CG 3.89Å; L146-V513 HydrophobicContact CD1-CB 4.14Å; L146-V513 HydrophobicContact CD1-CG2 3.81Å; L146-I592 HydrophobicContact CD2-CD1 3.62Å; L146-I592 HydrophobicContact CD2-CG1 4.02Å; L146-I592 HydrophobicContact CG-CD1 4.38Å; L146-I592 HydrophobicContact CG-CG1 4.29Å
147	G	96.8	Very high	95.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-67.7	-43.7	176.5	0	0	0	0	0	112.2	S133 W137 K144 G145 A149 S150 M151	S133-G147 WeakPolarHBondContact O-CA 3.08Å; W137-G147 VanDerWaalsContact CD1-CA 3.44Å; K144-G147 PolarHBondContact O-N 3.11Å; K144-G147 VanDerWaalsContact O-N 3.16Å; G145-G147 VanDerWaalsContact C-N 3.28Å; G145-G147 PolarHBondContact O-N 3.07Å; G147-A149 VanDerWaalsContact C-N 3.34Å; G147-A149 PolarHBondContact O-N 3.46Å; G147-S150 PolarHBondContact O-N 3.32Å; G147-S150 PolarHBondContact O-OG 3.48Å; G147-M151 WeakPolarHBondContact O-CB 3.26Å; G147-M151 WeakPolarHBondContact O-CG 3.44Å; G147-M151 PolarHBondContact O-N 3.48Å; G147-M151 VanDerWaalsContact O-N 3.1Å
148	Y	96.9	Very high	95.9	Very high	95 Å²	95	15.4 Å²	15.4	37%	0.373	7%	0.074	S	C	.	.	H	α-helix	trans	-63.4	-39.6	174.4	-65.3	-67.1	0	0	0	112.1	I134 K144 G145 M151 V152	I134-Y148 HydrophobicContact CD1-CD1 3.89Å; I134-Y148 HydrophobicContact CD1-CE1 3.82Å; I134-Y148 HydrophobicContact CG1-CD1 4.29Å; I134-Y148 HydrophobicContact CG1-CE1 4.42Å; I134-Y148 HydrophobicContact CG2-CE1 4.09Å; I134-Y148 HydrophobicContact CG2-CE2 4.3Å; K144-Y148 HydrophobicContact CG-CE2 4.24Å; K144-Y148 VanDerWaalsContact O-CD2 3.3Å; K144-Y148 WeakPolarHBondContact O-CD2 3.22Å; K144-Y148 PolarHBondContact O-N 2.86Å; G145-Y148 PolarHBondContact O-N 2.94Å; Y148-M151 WeakPolarHBondContact O-CB 3.38Å; Y148-M151 PolarHBondContact O-N 2.81Å; Y148-V152 WeakPolarHBondContact O-CG2 3.38Å; Y148-V152 PolarHBondContact O-N 2.82Å
149	A	97.3	Very high	95.9	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59	-53.5	175.6	0	0	0	0	0	111.2	G145 L146 G147 M151 V152 I153 Q506 S588 C591 I592	G145-A149 WeakPolarHBondContact O-CB 3.26Å; G145-A149 PolarHBondContact O-N 3.49Å; L146-A149 PolarHBondContact O-N 2.98Å; G147-A149 VanDerWaalsContact C-N 3.34Å; G147-A149 PolarHBondContact O-N 3.46Å; A149-M151 PolarHBondContact O-N 3.07Å; A149-V152 PolarHBondContact O-N 3.3Å; A149-V152 VanDerWaalsContact O-N 3.08Å; A149-I153 VanDerWaalsContact O-CG1 3.31Å; A149-I153 WeakPolarHBondContact O-CG1 3.48Å; A149-I153 PolarHBondContact O-N 2.89Å; A149-Q506 VanDerWaalsContact CB-OE1 3.26Å; A149-S588 WeakPolarHBondContact CB-O 3.24Å; A149-C591 HydrophobicContact CB-CB 3.98Å; A149-I592 HydrophobicContact CB-CD1 4.49Å; A149-I592 HydrophobicContact CB-CG1 4.15Å
150	S	95.8	Very high	95.9	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.014	7%	0.065	C	C	.	.	H	α-helix	trans	-56	-38.8	177.4	66.7	0	0	0	0	112.7	S133 L146 G147 I153 V154	S133-S150 WeakPolarHBondContact CB-OG 3.44Å; L146-S150 PolarHBondContact O-N 2.9Å; L146-S150 PolarHBondContact O-OG 3.4Å; G147-S150 PolarHBondContact O-N 3.32Å; G147-S150 PolarHBondContact O-OG 3.48Å; S150-I153 PolarHBondContact O-N 3Å; S150-V154 VanDerWaalsContact O-CG1 3.28Å; S150-V154 WeakPolarHBondContact O-CG1 3.24Å; S150-V154 PolarHBondContact O-N 3.29Å
151	M	95.8	Very high	95.8	Very high	9 Å²	9	14.4 Å²	14.4	4%	0.044	7%	0.068	C	C	.	.	H	α-helix	trans	-66.2	-37.8	177.2	-74.7	-63.7	-65.6	0	0	113.7	I134 G147 Y148 A149 V154 F155 F445 I449	I134-M151 HydrophobicContact CD1-CG 3.91Å; I134-M151 HydrophobicContact CG1-CG 3.75Å; G147-M151 WeakPolarHBondContact O-CB 3.26Å; G147-M151 WeakPolarHBondContact O-CG 3.44Å; G147-M151 PolarHBondContact O-N 3.48Å; G147-M151 VanDerWaalsContact O-N 3.1Å; Y148-M151 WeakPolarHBondContact O-CB 3.38Å; Y148-M151 PolarHBondContact O-N 2.81Å; A149-M151 PolarHBondContact O-N 3.07Å; M151-V154 WeakPolarHBondContact O-CG1 3.37Å; M151-V154 HydrophobicContact SD-CG1 4.44Å; M151-F155 VanDerWaalsContact O-CB 3.28Å; M151-F155 WeakPolarHBondContact O-CB 3.4Å; M151-F155 PolarHBondContact O-N 3.31Å; M151-F155 VanDerWaalsContact O-N 3.13Å; M151-F445 HydrophobicContact CE-CB 4.28Å; M151-F445 HydrophobicContact CE-CD1 4.42Å; M151-F445 HydrophobicContact CE-CD2 3.18Å; M151-F445 HydrophobicContact CE-CE2 3.43Å; M151-F445 VanDerWaalsContact CE-CE2 3.43Å; M151-F445 HydrophobicContact CE-CG 3.73Å; M151-F445 HydrophobicContact CE-CZ 4.18Å; M151-F445 WeakPolarHBondContact CE-O 3.32Å; M151-F445 HydrophobicContact SD-CD2 4.07Å; M151-I449 HydrophobicContact CE-CD1 3.74Å; M151-I449 HydrophobicContact CE-CG1 3.66Å
152	V	96.9	Very high	95.9	Very high	39 Å²	39	13.7 Å²	13.7	24%	0.236	6%	0.063	C	C	.	.	H	α-helix	trans	-68.1	-44.2	173.9	172.2	0	0	0	0	110.2	Y148 A149 F155 F156	Y148-V152 WeakPolarHBondContact O-CG2 3.38Å; Y148-V152 PolarHBondContact O-N 2.82Å; A149-V152 PolarHBondContact O-N 3.3Å; A149-V152 VanDerWaalsContact O-N 3.08Å; V152-F155 PolarHBondContact O-N 2.95Å; V152-F156 HydrophobicContact CG1-CD2 3.89Å; V152-F156 HydrophobicContact CG1-CE2 3.35Å; V152-F156 HydrophobicContact CG1-CZ 3.89Å; V152-F156 WeakPolarHBondContact O-CD2 3.46Å; V152-F156 PolarHBondContact O-N 3.27Å; V152-F156 VanDerWaalsContact O-N 3.09Å
153	I	96	Very high	96	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	6%	0.063	C	C	.	.	H	α-helix	trans	-62.3	-49.3	180	-60.1	166.8	0	0	0	110.6	A149 S150 F155 F156 C157 L341 A498 L503 Q506	A149-I153 VanDerWaalsContact O-CG1 3.31Å; A149-I153 WeakPolarHBondContact O-CG1 3.48Å; A149-I153 PolarHBondContact O-N 2.89Å; S150-I153 PolarHBondContact O-N 3Å; I153-F155 VanDerWaalsContact C-N 3.3Å; I153-F155 PolarHBondContact O-N 3.13Å; I153-F156 PolarHBondContact O-N 3.2Å; I153-C157 WeakPolarHBondContact O-CB 3.37Å; I153-C157 PolarHBondContact O-N 3.19Å; I153-L341 HydrophobicContact CB-CD2 4.3Å; I153-L341 HydrophobicContact CG2-CD2 3.39Å; I153-A498 HydrophobicContact CG2-CB 3.86Å; I153-L503 HydrophobicContact CD1-CD2 4.5Å; I153-L503 HydrophobicContact CG2-CD2 3.87Å; I153-Q506 HydrophobicContact CD1-CB 4.37Å
154	V	95.8	Very high	95.9	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.006	6%	0.062	C	C	.	.	H	α-helix	trans	-66.6	-32	-179.5	68.2	0	0	0	0	112.3	S150 M151 C157 N158 L341 G441 F445	S150-V154 VanDerWaalsContact O-CG1 3.28Å; S150-V154 WeakPolarHBondContact O-CG1 3.24Å; S150-V154 PolarHBondContact O-N 3.29Å; M151-V154 WeakPolarHBondContact O-CG1 3.37Å; M151-V154 HydrophobicContact SD-CG1 4.44Å; V154-C157 PolarHBondContact O-N 3.25Å; V154-N158 WeakPolarHBondContact O-CB 3.21Å; V154-N158 PolarHBondContact O-N 2.97Å; V154-N158 PolarHBondContact O-ND2 2.65Å; V154-L341 HydrophobicContact CB-CB 4.4Å; V154-L341 WeakPolarHBondContact CB-O 3.35Å; V154-G441 WeakPolarHBondContact CG2-O 3.49Å; V154-F445 HydrophobicContact CG1-CB 4.08Å; V154-F445 HydrophobicContact CG1-CD2 3.99Å
155	F	96.6	Very high	96	Very high	42 Å²	42	12.2 Å²	12.2	18%	0.184	6%	0.057	C	C	.	.	H	α-helix	trans	-62.5	-48.7	173.7	178.4	-101	0	0	0	111.6	M151 V152 I153 C157 N158 T159 F445 I477	M151-F155 VanDerWaalsContact O-CB 3.28Å; M151-F155 WeakPolarHBondContact O-CB 3.4Å; M151-F155 PolarHBondContact O-N 3.31Å; M151-F155 VanDerWaalsContact O-N 3.13Å; V152-F155 PolarHBondContact O-N 2.95Å; I153-F155 VanDerWaalsContact C-N 3.3Å; I153-F155 PolarHBondContact O-N 3.13Å; F155-C157 VanDerWaalsContact C-N 3.35Å; F155-C157 PolarHBondContact O-N 2.83Å; F155-N158 PolarHBondContact O-N 3.11Å; F155-T159 PolarHBondContact O-N 3.02Å; F155-T159 VanDerWaalsContact O-N 3.11Å; F155-T159 PolarHBondContact O-OG1 3.13Å; F155-F445 HydrophobicContact CB-CD2 4.02Å; F155-F445 HydrophobicContact CB-CE2 3.73Å; F155-F445 HydrophobicContact CB-CZ 4.44Å; F155-F445 HydrophobicContact CD2-CE1 4.26Å; F155-F445 AromaticContact CD2-CE2 3.96Å; F155-F445 HydrophobicContact CD2-CE2 3.96Å; F155-F445 AromaticContact CD2-CZ 3.8Å; F155-F445 HydrophobicContact CD2-CZ 3.8Å; F155-F445 HydrophobicContact CG-CE2 4.2Å; F155-F445 HydrophobicContact CG-CZ 4.44Å; F155-I477 HydrophobicContact CE1-CD1 3.89Å; F155-I477 HydrophobicContact CZ-CD1 3.59Å
156	F	95.9	Very high	96	Very high	30 Å²	30	12.3 Å²	12.3	13%	0.132	6%	0.057	C	C	.	.	H	α-helix	trans	-64.6	-40.2	175.9	-64	-37.6	0	0	0	112.2	V152 I153 N158 T159 Y160 F493 S497 L584 S587	V152-F156 HydrophobicContact CG1-CD2 3.89Å; V152-F156 HydrophobicContact CG1-CE2 3.35Å; V152-F156 HydrophobicContact CG1-CZ 3.89Å; V152-F156 WeakPolarHBondContact O-CD2 3.46Å; V152-F156 PolarHBondContact O-N 3.27Å; V152-F156 VanDerWaalsContact O-N 3.09Å; I153-F156 PolarHBondContact O-N 3.2Å; F156-N158 PolarHBondContact O-N 3.06Å; F156-T159 WeakPolarHBondContact O-CB 3.16Å; F156-T159 PolarHBondContact O-N 3.36Å; F156-T159 VanDerWaalsContact O-N 3.09Å; F156-Y160 VanDerWaalsContact O-CD1 3.24Å; F156-Y160 WeakPolarHBondContact O-CD1 3.18Å; F156-Y160 PolarHBondContact O-N 3.49Å; F156-Y160 VanDerWaalsContact O-N 3.11Å; F156-F493 HydrophobicContact CB-CD1 4.19Å; F156-F493 HydrophobicContact CB-CE1 4.39Å; F156-F493 HydrophobicContact CD1-CD1 4.38Å; F156-F493 AromaticContact CD1-CE1 3.77Å; F156-F493 HydrophobicContact CD1-CE1 3.77Å; F156-F493 HydrophobicContact CE1-CE1 4.43Å; F156-F493 HydrophobicContact CG-CE1 4.34Å; F156-S497 WeakPolarHBondContact CB-OG 3.28Å; F156-L584 HydrophobicContact CE1-CD2 4.02Å; F156-L584 HydrophobicContact CE2-CD2 4.22Å; F156-L584 HydrophobicContact CZ-CD2 3.83Å; F156-S587 VanDerWaalsContact CE2-OG 3.23Å; F156-S587 WeakPolarHBondContact CE2-OG 3.23Å
157	C	94.3	Very high	96	Very high	15 Å²	15	12.3 Å²	12.3	10%	0.101	6%	0.057	C	C	.	.	H	α-helix	trans	-57.5	-48.3	175.2	-164.2	0	0	0	0	111.6	I153 V154 F155 T159 Y160 Y161 A498	I153-C157 WeakPolarHBondContact O-CB 3.37Å; I153-C157 PolarHBondContact O-N 3.19Å; V154-C157 PolarHBondContact O-N 3.25Å; F155-C157 VanDerWaalsContact C-N 3.35Å; F155-C157 PolarHBondContact O-N 2.83Å; C157-T159 PolarHBondContact O-N 3.07Å; C157-Y160 HydrophobicContact CB-CE1 4.4Å; C157-Y161 WeakPolarHBondContact O-CB 3.43Å; C157-Y161 PolarHBondContact O-N 3.25Å; C157-A498 HydrophobicContact CB-CB 4.05Å
158	N	95.7	Very high	96	Very high	3 Å²	3	12.3 Å²	12.3	2%	0.016	6%	0.057	C	C	.	.	H	α-helix	trans	-60.9	-30.5	176.7	-69.3	-23.8	0	0	0	112.7	V154 F155 F156 Q438 G441 V442	V154-N158 WeakPolarHBondContact O-CB 3.21Å; V154-N158 PolarHBondContact O-N 2.97Å; V154-N158 PolarHBondContact O-ND2 2.65Å; F155-N158 PolarHBondContact O-N 3.11Å; F156-N158 PolarHBondContact O-N 3.06Å; N158-Q438 PolarHBondContact O-NE2 3.39Å; N158-G441 VanDerWaalsContact ND2-C 3.27Å; N158-G441 PolarHBondContact ND2-O 3.36Å; N158-G441 VanDerWaalsContact OD1-C 3.29Å; N158-G441 WeakPolarHBondContact OD1-CA 3.4Å; N158-V442 HydrophobicContact CB-CG2 4.41Å; N158-V442 PolarHBondContact ND2-N 3.36Å; N158-V442 PolarHBondContact OD1-N 3.13Å
159	T	94.3	Very high	96.1	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-71.8	-54.8	-179.3	-54.3	0	0	0	0	110.9	F155 F156 C157 I162 I477 D478 M481 F493	F155-T159 PolarHBondContact O-N 3.02Å; F155-T159 VanDerWaalsContact O-N 3.11Å; F155-T159 PolarHBondContact O-OG1 3.13Å; F156-T159 WeakPolarHBondContact O-CB 3.16Å; F156-T159 PolarHBondContact O-N 3.36Å; F156-T159 VanDerWaalsContact O-N 3.09Å; C157-T159 PolarHBondContact O-N 3.07Å; T159-I162 WeakPolarHBondContact O-CG2 3.2Å; T159-I477 HydrophobicContact CG2-CB 3.98Å; T159-I477 HydrophobicContact CG2-CG2 3.47Å; T159-I477 VanDerWaalsContact CG2-CG2 3.47Å; T159-D478 WeakPolarHBondContact CA-OD1 3.32Å; T159-D478 WeakPolarHBondContact CG2-OD1 3.41Å; T159-M481 HydrophobicContact CG2-CE 4.07Å; T159-F493 HydrophobicContact CG2-CE1 4.06Å
160	Y	93.9	Very high	96.1	Very high	3 Å²	3	10.7 Å²	10.7	1%	0.012	5%	0.052	C	C	.	.	H	α-helix	trans	-82.6	-32.7	-176.5	82.5	-92.8	0	0	0	113.3	F156 C157 I162 M163 F490 F493 D494 A498	F156-Y160 VanDerWaalsContact O-CD1 3.24Å; F156-Y160 WeakPolarHBondContact O-CD1 3.18Å; F156-Y160 PolarHBondContact O-N 3.49Å; F156-Y160 VanDerWaalsContact O-N 3.11Å; C157-Y160 HydrophobicContact CB-CE1 4.4Å; Y160-I162 VanDerWaalsContact C-N 3.3Å; Y160-I162 PolarHBondContact O-N 3.07Å; Y160-M163 VanDerWaalsContact O-CB 3.31Å; Y160-M163 WeakPolarHBondContact O-CB 3.23Å; Y160-M163 PolarHBondContact O-N 3.3Å; Y160-M163 VanDerWaalsContact O-N 3.11Å; Y160-F490 HydrophobicContact CD2-CD2 4.29Å; Y160-F490 AromaticContact CD2-CE2 3.75Å; Y160-F490 HydrophobicContact CD2-CE2 3.75Å; Y160-F490 HydrophobicContact CD2-CZ 4.13Å; Y160-F490 WeakPolarHBondContact O-CE2 3.39Å; Y160-F493 HydrophobicContact CD1-CB 3.89Å; Y160-F493 HydrophobicContact CG-CB 3.9Å; Y160-D494 HydrophobicContact CD2-CB 4.02Å; Y160-D494 HydrophobicContact CE2-CB 3.88Å; Y160-D494 VanDerWaalsContact CE2-OD1 3.29Å; Y160-D494 WeakPolarHBondContact CE2-OD1 3.35Å; Y160-A498 HydrophobicContact CE1-CB 4.07Å
161	Y	94.3	Very high	96.2	Very high	16 Å²	16	10.6 Å²	10.6	6%	0.063	5%	0.051	C	C	.	.	H	α-helix	trans	-64.9	-34.3	-172.9	-171.3	-97.1	0	0	0	112.5	L85 C157 M163 V164 L165 G434 S437 Q438	L85-Y161 HydrophobicContact CD1-CE1 4.39Å; L85-Y161 HydrophobicContact CD1-CE2 3.86Å; L85-Y161 HydrophobicContact CG-CE2 4.47Å; L85-Y161 WeakPolarHBondContact CG-OH 3.4Å; L85-Y161 PolarHBondContact N-OH 3.41Å; C157-Y161 WeakPolarHBondContact O-CB 3.43Å; C157-Y161 PolarHBondContact O-N 3.25Å; Y161-M163 PolarHBondContact O-N 2.98Å; Y161-M163 VanDerWaalsContact O-N 3.17Å; Y161-V164 WeakPolarHBondContact O-CB 3.41Å; Y161-V164 PolarHBondContact O-N 2.77Å; Y161-V164 VanDerWaalsContact O-N 3.07Å; Y161-L165 HydrophobicContact CD1-CD1 3.84Å; Y161-L165 HydrophobicContact CE1-CD1 3.79Å; Y161-L165 WeakPolarHBondContact O-CD1 3.42Å; Y161-G434 WeakPolarHBondContact CE1-O 3Å; Y161-S437 PolarHBondContact OH-OG 3.46Å; Y161-Q438 HydrophobicContact CD1-CB 4.38Å
162	I	96.7	Very high	96.3	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-57.8	-29	176.1	-164	80.6	0	0	0	112.8	T159 Y160 V164 L165 A166 L259 V262 W263 V266 Q438 D478	T159-I162 WeakPolarHBondContact O-CG2 3.2Å; Y160-I162 VanDerWaalsContact C-N 3.3Å; Y160-I162 PolarHBondContact O-N 3.07Å; I162-V164 PolarHBondContact O-N 3.01Å; I162-L165 HydrophobicContact CD1-CD2 4.35Å; I162-L165 WeakPolarHBondContact O-CB 3.25Å; I162-L165 PolarHBondContact O-N 3.38Å; I162-L165 VanDerWaalsContact O-N 3.08Å; I162-A166 PolarHBondContact O-N 3.24Å; I162-L259 HydrophobicContact CG1-CD1 4.04Å; I162-L259 HydrophobicContact CG2-CD1 3.8Å; I162-V262 HydrophobicContact CD1-CB 4.37Å; I162-V262 HydrophobicContact CD1-CG1 3.47Å; I162-V262 VanDerWaalsContact CD1-CG1 3.47Å; I162-V262 HydrophobicContact CG1-CG1 4.08Å; I162-W263 HydrophobicContact CB-CZ2 4.12Å; I162-W263 HydrophobicContact CD1-CD2 4.22Å; I162-W263 HydrophobicContact CD1-CZ2 4.37Å; I162-W263 HydrophobicContact CG1-CD2 4.24Å; I162-W263 HydrophobicContact CG1-CG 4.42Å; I162-W263 HydrophobicContact CG1-CZ2 4.09Å; I162-W263 HydrophobicContact CG2-CZ2 3.99Å; I162-V266 HydrophobicContact CD1-CG2 3.92Å; I162-Q438 HydrophobicContact CD1-CG 3.64Å; I162-D478 VanDerWaalsContact CG2-OD2 3.27Å; I162-D478 WeakPolarHBondContact CG2-OD2 3.17Å
163	M	96.3	Very high	96.3	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.2	-33.6	178.8	-71.2	-57.9	-53.3	0	0	111.7	Y160 Y161 L165 A166 W167 L259 D478 M481 V482 F490	Y160-M163 VanDerWaalsContact O-CB 3.31Å; Y160-M163 WeakPolarHBondContact O-CB 3.23Å; Y160-M163 PolarHBondContact O-N 3.3Å; Y160-M163 VanDerWaalsContact O-N 3.11Å; Y161-M163 PolarHBondContact O-N 2.98Å; Y161-M163 VanDerWaalsContact O-N 3.17Å; M163-L165 VanDerWaalsContact C-N 3.34Å; M163-A166 WeakPolarHBondContact O-CB 3.44Å; M163-A166 PolarHBondContact O-N 3.29Å; M163-W167 HydrophobicContact CB-CZ2 4.42Å; M163-W167 HydrophobicContact CE-CZ2 4.45Å; M163-W167 PolarHBondContact O-N 3.11Å; M163-L259 HydrophobicContact SD-CD1 3.95Å; M163-L259 HydrophobicContact SD-CD2 4.24Å; M163-D478 HydrophobicContact SD-CB 4.34Å; M163-M481 HydrophobicContact CE-CB 4.16Å; M163-M481 HydrophobicContact CG-CB 3.8Å; M163-M481 HydrophobicContact CG-CG 4.46Å; M163-M481 HydrophobicContact CG-SD 3.82Å; M163-M481 HydrophobicContact SD-CB 3.94Å; M163-V482 HydrophobicContact CE-CG2 3.74Å; M163-V482 HydrophobicContact SD-CG2 3.92Å; M163-F490 HydrophobicContact CB-CD2 3.9Å; M163-F490 HydrophobicContact CB-CE2 4.11Å; M163-F490 HydrophobicContact CG-CD2 4.4Å
164	V	95.1	Very high	96.3	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.006	8%	0.076	C	C	.	.	H	α-helix	trans	-66	-40.3	175.6	-175	0	0	0	0	111.4	L85 W89 Y161 I162 A166 W167 G168 F406 L430 F490	L85-V164 HydrophobicContact CD1-CB 3.92Å; L85-V164 HydrophobicContact CD1-CG1 3.4Å; W89-V164 HydrophobicContact CH2-CB 4.15Å; W89-V164 HydrophobicContact CH2-CG1 3.41Å; W89-V164 VanDerWaalsContact CH2-CG1 3.41Å; W89-V164 HydrophobicContact CH2-CG2 3.67Å; W89-V164 HydrophobicContact CZ2-CG1 4.39Å; W89-V164 HydrophobicContact CZ2-CG2 4.4Å; W89-V164 HydrophobicContact CZ3-CG1 3.67Å; Y161-V164 WeakPolarHBondContact O-CB 3.41Å; Y161-V164 PolarHBondContact O-N 2.77Å; Y161-V164 VanDerWaalsContact O-N 3.07Å; I162-V164 PolarHBondContact O-N 3.01Å; V164-A166 VanDerWaalsContact C-N 3.31Å; V164-W167 HydrophobicContact CG2-CE3 4.37Å; V164-W167 HydrophobicContact CG2-CZ3 4.24Å; V164-W167 PolarHBondContact O-N 3.45Å; V164-G168 PolarHBondContact O-N 3.42Å; V164-F406 HydrophobicContact CG1-CE2 3.92Å; V164-F406 HydrophobicContact CG1-CZ 3.93Å; V164-L430 HydrophobicContact CG1-CD2 4.26Å; V164-F490 HydrophobicContact CG2-CE2 3.91Å; V164-F490 HydrophobicContact CG2-CZ 3.88Å
165	L	96.8	Very high	96.3	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-66.2	-37.7	174.8	-74.2	69	0	0	0	110.7	Y161 I162 M163 G168 F169 V262 L431 L435 Q438	Y161-L165 HydrophobicContact CD1-CD1 3.84Å; Y161-L165 HydrophobicContact CE1-CD1 3.79Å; Y161-L165 WeakPolarHBondContact O-CD1 3.42Å; I162-L165 HydrophobicContact CD1-CD2 4.35Å; I162-L165 WeakPolarHBondContact O-CB 3.25Å; I162-L165 PolarHBondContact O-N 3.38Å; I162-L165 VanDerWaalsContact O-N 3.08Å; M163-L165 VanDerWaalsContact C-N 3.34Å; L165-G168 PolarHBondContact O-N 3.01Å; L165-F169 VanDerWaalsContact O-CB 3.28Å; L165-F169 WeakPolarHBondContact O-CB 3.48Å; L165-F169 PolarHBondContact O-N 2.82Å; L165-V262 HydrophobicContact CB-CG1 3.61Å; L165-V262 HydrophobicContact CB-CG2 4.36Å; L165-V262 HydrophobicContact CD2-CG1 3.68Å; L165-V262 HydrophobicContact CG-CG1 4.34Å; L165-L431 HydrophobicContact CB-CD1 4.06Å; L165-L431 HydrophobicContact CG-CD1 4.36Å; L165-L435 HydrophobicContact CD2-CD1 4.34Å; L165-Q438 HydrophobicContact CD2-CB 4.25Å
166	A	97.8	Very high	96.3	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.008	10%	0.1	C	C	.	.	H	α-helix	trans	-62.8	-43.7	176.2	0	0	0	0	0	111.6	I162 M163 V164 F169 Y170 C258 L259	I162-A166 PolarHBondContact O-N 3.24Å; M163-A166 WeakPolarHBondContact O-CB 3.44Å; M163-A166 PolarHBondContact O-N 3.29Å; V164-A166 VanDerWaalsContact C-N 3.31Å; A166-F169 PolarHBondContact O-N 2.99Å; A166-Y170 WeakPolarHBondContact O-CB 3.37Å; A166-Y170 PolarHBondContact O-N 2.86Å; A166-C258 HydrophobicContact CB-CB 4.49Å; A166-L259 HydrophobicContact CB-CB 4.13Å; A166-L259 HydrophobicContact CB-CD1 4.4Å
167	W	97.6	Very high	96.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.5	-45.8	172	-60.9	-34.5	0	0	0	111.6	M163 V164 F169 Y170 Y171 W234 L239 P402 F406 M487 F490	M163-W167 HydrophobicContact CB-CZ2 4.42Å; M163-W167 HydrophobicContact CE-CZ2 4.45Å; M163-W167 PolarHBondContact O-N 3.11Å; V164-W167 HydrophobicContact CG2-CE3 4.37Å; V164-W167 HydrophobicContact CG2-CZ3 4.24Å; V164-W167 PolarHBondContact O-N 3.45Å; W167-F169 VanDerWaalsContact C-N 3.3Å; W167-F169 PolarHBondContact O-N 3.44Å; W167-Y170 WeakPolarHBondContact O-CB 3.25Å; W167-Y170 PolarHBondContact O-N 2.84Å; W167-Y171 WeakPolarHBondContact O-CD2 3.46Å; W167-Y171 PolarHBondContact O-N 3.11Å; W167-W234 HydrophobicContact CB-CH2 4.48Å; W167-W234 HydrophobicContact CB-CZ3 4.32Å; W167-W234 AromaticContact CD2-CH2 3.64Å; W167-W234 HydrophobicContact CD2-CH2 3.64Å; W167-W234 HydrophobicContact CD2-CZ3 4.27Å; W167-W234 AromaticContact CE3-CH2 3.71Å; W167-W234 HydrophobicContact CE3-CH2 3.71Å; W167-W234 AromaticContact CG-CH2 4Å; W167-W234 HydrophobicContact CG-CH2 4Å; W167-W234 HydrophobicContact CG-CZ3 4.13Å; W167-W234 HydrophobicContact CZ2-CH2 4.48Å; W167-W234 HydrophobicContact CZ3-CH2 4.17Å; W167-L239 HydrophobicContact CZ2-CD2 4.04Å; W167-P402 HydrophobicContact CZ3-CB 4.34Å; W167-P402 HydrophobicContact CZ3-CG 4.29Å; W167-F406 HydrophobicContact CB-CD1 4.32Å; W167-F406 HydrophobicContact CB-CE1 3.69Å; W167-F406 HydrophobicContact CB-CE2 4.06Å; W167-F406 HydrophobicContact CB-CZ 3.55Å; W167-F406 HydrophobicContact CE3-CD2 4.31Å; W167-F406 AromaticContact CE3-CE2 3.79Å; W167-F406 HydrophobicContact CE3-CE2 3.79Å; W167-F406 HydrophobicContact CE3-CZ 4.36Å; W167-M487 HydrophobicContact CH2-SD 3.68Å; W167-M487 HydrophobicContact CZ2-SD 4.09Å; W167-F490 HydrophobicContact CH2-CB 4.5Å; W167-F490 AromaticContact CH2-CD1 3.88Å; W167-F490 HydrophobicContact CH2-CD1 3.88Å; W167-F490 AromaticContact CH2-CD2 3.79Å; W167-F490 HydrophobicContact CH2-CD2 3.79Å; W167-F490 HydrophobicContact CH2-CE1 4.01Å; W167-F490 AromaticContact CH2-CE2 3.89Å; W167-F490 HydrophobicContact CH2-CE2 3.89Å; W167-F490 AromaticContact CH2-CG 3.78Å; W167-F490 HydrophobicContact CH2-CG 3.78Å; W167-F490 HydrophobicContact CH2-CZ 4.02Å; W167-F490 HydrophobicContact CZ3-CD1 4.46Å; W167-F490 HydrophobicContact CZ3-CD2 4.33Å; W167-F490 HydrophobicContact CZ3-CE1 4.13Å; W167-F490 AromaticContact CZ3-CE2 3.96Å; W167-F490 HydrophobicContact CZ3-CE2 3.96Å; W167-F490 AromaticContact CZ3-CZ 3.87Å; W167-F490 HydrophobicContact CZ3-CZ 3.87Å
168	G	96.6	Very high	95.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.7	-43.3	175.3	0	0	0	0	0	112.8	V164 L165 Y171 L172	V164-G168 PolarHBondContact O-N 3.42Å; L165-G168 PolarHBondContact O-N 3.01Å; G168-Y171 PolarHBondContact O-N 2.65Å; G168-L172 WeakPolarHBondContact O-CB 3.48Å; G168-L172 PolarHBondContact O-N 3.34Å
169	F	98.1	Very high	95.5	Very high	56 Å²	56	30.2 Å²	30.2	25%	0.246	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-40.2	176.9	-170.3	-119.4	0	0	0	112	L165 A166 W167 L172 I173 C258 A261 V262 L431	L165-F169 VanDerWaalsContact O-CB 3.28Å; L165-F169 WeakPolarHBondContact O-CB 3.48Å; L165-F169 PolarHBondContact O-N 2.82Å; A166-F169 PolarHBondContact O-N 2.99Å; W167-F169 VanDerWaalsContact C-N 3.3Å; W167-F169 PolarHBondContact O-N 3.44Å; F169-L172 HydrophobicContact CD2-CD2 4.45Å; F169-L172 WeakPolarHBondContact O-CB 3.42Å; F169-L172 PolarHBondContact O-N 3.04Å; F169-I173 HydrophobicContact CD1-CD1 3.94Å; F169-I173 HydrophobicContact CE1-CD1 3.66Å; F169-I173 HydrophobicContact CZ-CD1 4.01Å; F169-I173 HydrophobicContact CZ-CG1 4.47Å; F169-I173 WeakPolarHBondContact O-CG1 3.29Å; F169-I173 PolarHBondContact O-N 3.18Å; F169-C258 HydrophobicContact CD1-CB 3.98Å; F169-A261 HydrophobicContact CD1-CB 4.33Å; F169-A261 HydrophobicContact CE1-CB 3.72Å; F169-A261 HydrophobicContact CZ-CB 4.4Å; F169-V262 HydrophobicContact CB-CG2 3.96Å; F169-V262 HydrophobicContact CD1-CG2 4.38Å; F169-V262 HydrophobicContact CG-CG2 4.24Å; F169-L431 HydrophobicContact CB-CD1 4.31Å; F169-L431 HydrophobicContact CD2-CD2 3.94Å
170	Y	97.8	Very high	95.5	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.02	17%	0.168	C	C	.	.	H	α-helix	trans	-58.4	-50.6	173.5	-175.2	-91.8	0	0	0	111.6	A166 W167 L172 I173 K174 F233 V238 E254 L255	A166-Y170 WeakPolarHBondContact O-CB 3.37Å; A166-Y170 PolarHBondContact O-N 2.86Å; W167-Y170 WeakPolarHBondContact O-CB 3.25Å; W167-Y170 PolarHBondContact O-N 2.84Å; Y170-L172 VanDerWaalsContact C-N 3.33Å; Y170-L172 PolarHBondContact O-N 3.12Å; Y170-I173 PolarHBondContact O-N 3.45Å; Y170-K174 HydrophobicContact CD1-CG 4.15Å; Y170-K174 HydrophobicContact CE1-CG 3.81Å; Y170-K174 VanDerWaalsContact CZ-CE 3.46Å; Y170-K174 WeakPolarHBondContact O-CG 3.41Å; Y170-K174 PolarHBondContact O-N 3.42Å; Y170-K174 WeakPolarHBondContact OH-CE 3.29Å; Y170-F233 HydrophobicContact CE1-CE1 4.47Å; Y170-F233 AromaticContact CE1-CZ 3.9Å; Y170-F233 HydrophobicContact CE1-CZ 3.9Å; Y170-V238 HydrophobicContact CD1-CG1 4.46Å; Y170-V238 HydrophobicContact CD1-CG2 4.04Å; Y170-V238 HydrophobicContact CE1-CG2 3.74Å; Y170-E254 HydrophobicContact CD2-CB 4.48Å; Y170-E254 HydrophobicContact CE2-CB 3.8Å; Y170-E254 WeakPolarHBondContact CE2-OE2 3.48Å; Y170-E254 PolarHBondContact OH-OE2 2.9Å; Y170-L255 HydrophobicContact CD2-CD2 3.97Å; Y170-L255 HydrophobicContact CG-CD2 3.97Å
171	Y	97.6	Very high	95.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-35.9	177.8	-89.6	-95	0	0	0	112.7	W167 G168 K174 S175 W182 I230 F233 W234 V238 F406 P410 F427	W167-Y171 WeakPolarHBondContact O-CD2 3.46Å; W167-Y171 PolarHBondContact O-N 3.11Å; G168-Y171 PolarHBondContact O-N 2.65Å; Y171-K174 CarbonylContact O-C 3.51Å; Y171-K174 PolarHBondContact O-N 3.33Å; Y171-S175 PolarHBondContact O-N 3.38Å; Y171-S175 PolarHBondContact O-OG 2.9Å; Y171-W182 HydrophobicContact CD1-CD2 4.42Å; Y171-W182 AromaticContact CD1-CE3 3.88Å; Y171-W182 HydrophobicContact CD1-CE3 3.88Å; Y171-W182 AromaticContact CD1-CH2 3.71Å; Y171-W182 HydrophobicContact CD1-CH2 3.71Å; Y171-W182 HydrophobicContact CD1-CZ2 4.26Å; Y171-W182 AromaticContact CD1-CZ3 3.5Å; Y171-W182 HydrophobicContact CD1-CZ3 3.5Å; Y171-W182 VanDerWaalsContact CD1-CZ3 3.5Å; Y171-W182 HydrophobicContact CE1-CD2 4.19Å; Y171-W182 AromaticContact CE1-CE3 3.83Å; Y171-W182 HydrophobicContact CE1-CE3 3.83Å; Y171-W182 HydrophobicContact CE1-CH2 4.42Å; Y171-W182 AromaticContact CE1-CZ3 3.96Å; Y171-W182 HydrophobicContact CE1-CZ3 3.96Å; Y171-W182 HydrophobicContact CG-CZ3 4.43Å; Y171-I230 HydrophobicContact CE1-CD1 4.2Å; Y171-F233 HydrophobicContact CD1-CE1 4.19Å; Y171-F233 AromaticContact CE1-CD1 3.9Å; Y171-F233 HydrophobicContact CE1-CD1 3.9Å; Y171-F233 AromaticContact CE1-CE1 3.55Å; Y171-F233 HydrophobicContact CE1-CE1 3.55Å; Y171-F233 HydrophobicContact CE2-CE1 4.2Å; Y171-F233 AromaticContact CZ-CD1 3.79Å; Y171-F233 AromaticContact CZ-CE1 3.57Å; Y171-F233 WeakPolarHBondContact OH-CD1 3.29Å; Y171-W234 AromaticContact CE2-CE3 3.86Å; Y171-W234 HydrophobicContact CE2-CE3 3.86Å; Y171-W234 AromaticContact CE2-CZ3 3.91Å; Y171-W234 HydrophobicContact CE2-CZ3 3.91Å; Y171-V238 HydrophobicContact CE2-CG1 4.39Å; Y171-V238 HydrophobicContact CE2-CG2 3.94Å; Y171-F406 AromaticContact CD2-CD1 3.62Å; Y171-F406 HydrophobicContact CD2-CD1 3.62Å; Y171-F406 HydrophobicContact CD2-CE1 4.07Å; Y171-F406 HydrophobicContact CE2-CB 4.19Å; Y171-F406 AromaticContact CE2-CD1 3.61Å; Y171-F406 HydrophobicContact CE2-CD1 3.61Å; Y171-F406 HydrophobicContact CE2-CE1 4.44Å; Y171-F406 HydrophobicContact CE2-CG 4.25Å; Y171-F406 HydrophobicContact CG-CD1 4.25Å; Y171-F406 PolarHBondContact OH-O 3.4Å; Y171-P410 HydrophobicContact CE1-CB 4.47Å; Y171-P410 HydrophobicContact CE1-CG 4.34Å; Y171-F427 VanDerWaalsContact CB-CE1 3.47Å; Y171-F427 VanDerWaalsContact CB-CZ 3.43Å; Y171-F427 HydrophobicContact CD1-CD2 4.49Å; Y171-F427 AromaticContact CD1-CE1 3.95Å; Y171-F427 HydrophobicContact CD1-CE1 3.95Å; Y171-F427 AromaticContact CD1-CE2 3.55Å; Y171-F427 HydrophobicContact CD1-CE2 3.55Å; Y171-F427 AromaticContact CD1-CZ 3.19Å; Y171-F427 HydrophobicContact CD1-CZ 3.19Å; Y171-F427 HydrophobicContact CD2-CE1 4.39Å; Y171-F427 HydrophobicContact CD2-CZ 4.4Å; Y171-F427 AromaticContact CE1-CZ 3.99Å; Y171-F427 HydrophobicContact CE1-CZ 3.99Å; Y171-F427 HydrophobicContact CG-CD1 4.34Å; Y171-F427 AromaticContact CG-CE1 3.71Å; Y171-F427 HydrophobicContact CG-CE1 3.71Å; Y171-F427 AromaticContact CG-CE2 3.93Å; Y171-F427 HydrophobicContact CG-CE2 3.93Å; Y171-F427 AromaticContact CG-CZ 3.44Å; Y171-F427 HydrophobicContact CG-CZ 3.44Å; Y171-F427 VanDerWaalsContact CG-CZ 3.44Å
172	L	97.5	Very high	95.5	Very high	16 Å²	16	30.5 Å²	30.5	8%	0.084	17%	0.172	C	C	.	.	H	α-helix	trans	-60.3	-48.1	173.8	177.7	59.5	0	0	0	111	G168 F169 Y170 K174 S175 F176 A424 F427 F428 L431	G168-L172 WeakPolarHBondContact O-CB 3.48Å; G168-L172 PolarHBondContact O-N 3.34Å; F169-L172 HydrophobicContact CD2-CD2 4.45Å; F169-L172 WeakPolarHBondContact O-CB 3.42Å; F169-L172 PolarHBondContact O-N 3.04Å; Y170-L172 VanDerWaalsContact C-N 3.33Å; Y170-L172 PolarHBondContact O-N 3.12Å; L172-K174 VanDerWaalsContact C-N 3.3Å; L172-K174 PolarHBondContact O-N 2.89Å; L172-S175 WeakPolarHBondContact O-CB 3.11Å; L172-S175 PolarHBondContact O-N 2.94Å; L172-S175 VanDerWaalsContact O-N 3.1Å; L172-F176 HydrophobicContact CD1-CE2 3.92Å; L172-F176 HydrophobicContact CD1-CZ 4.2Å; L172-F176 HydrophobicContact CG-CE2 4.08Å; L172-F176 WeakPolarHBondContact O-CD2 3.12Å; L172-F176 WeakPolarHBondContact O-CE2 3.37Å; L172-A424 HydrophobicContact CD1-CB 4.3Å; L172-A424 WeakPolarHBondContact CD1-O 3.28Å; L172-F427 HydrophobicContact CB-CB 3.98Å; L172-F427 HydrophobicContact CD1-CB 4.47Å; L172-F428 HydrophobicContact CD1-CB 4.07Å; L172-F428 HydrophobicContact CD2-CB 4.33Å; L172-F428 HydrophobicContact CD2-CD2 4.04Å; L172-L431 HydrophobicContact CD2-CD2 4.23Å
173	I	97.3	Very high	95.2	Very high	84 Å²	84	31.9 Å²	31.9	43%	0.431	18%	0.181	S	C	.	.	H	α-helix	trans	-58.6	-45.4	176.3	-67.7	165.8	0	0	0	110.4	F169 Y170 S175 F176	F169-I173 HydrophobicContact CD1-CD1 3.94Å; F169-I173 HydrophobicContact CE1-CD1 3.66Å; F169-I173 HydrophobicContact CZ-CD1 4.01Å; F169-I173 HydrophobicContact CZ-CG1 4.47Å; F169-I173 WeakPolarHBondContact O-CG1 3.29Å; F169-I173 PolarHBondContact O-N 3.18Å; Y170-I173 PolarHBondContact O-N 3.45Å; I173-S175 PolarHBondContact O-N 3.21Å; I173-F176 PolarHBondContact O-N 3.48Å
174	K	96.1	Very high	94.8	Very high	65 Å²	65	34.1 Å²	34.1	28%	0.283	20%	0.195	S	C	.	.	H	α-helix	trans	-71.1	-12	179.3	-66.2	-63.1	-175.8	-178.7	0	114.1	Y170 Y171 L172 F176 S177 P181 W182 F233 E254	Y170-K174 HydrophobicContact CD1-CG 4.15Å; Y170-K174 HydrophobicContact CE1-CG 3.81Å; Y170-K174 VanDerWaalsContact CZ-CE 3.46Å; Y170-K174 WeakPolarHBondContact O-CG 3.41Å; Y170-K174 PolarHBondContact O-N 3.42Å; Y170-K174 WeakPolarHBondContact OH-CE 3.29Å; Y171-K174 CarbonylContact O-C 3.51Å; Y171-K174 PolarHBondContact O-N 3.33Å; L172-K174 VanDerWaalsContact C-N 3.3Å; L172-K174 PolarHBondContact O-N 2.89Å; K174-F176 VanDerWaalsContact C-N 3.31Å; K174-S177 PolarHBondContact O-OG 3.23Å; K174-P181 HydrophobicContact CB-CG 4.2Å; K174-P181 HydrophobicContact CD-CG 4.41Å; K174-P181 WeakPolarHBondContact O-CD 3.46Å; K174-W182 HydrophobicContact CB-CZ3 3.84Å; K174-F233 HydrophobicContact CG-CZ 4.39Å; K174-E254 IonicContact NZ-OE2 3.29Å
175	S	96.8	Very high	94.5	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-16.8	174.6	-58.9	0	0	0	0	112.6	Y171 L172 I173 S177 A423	Y171-S175 PolarHBondContact O-N 3.38Å; Y171-S175 PolarHBondContact O-OG 2.9Å; L172-S175 WeakPolarHBondContact O-CB 3.11Å; L172-S175 PolarHBondContact O-N 2.94Å; L172-S175 VanDerWaalsContact O-N 3.1Å; I173-S175 PolarHBondContact O-N 3.21Å; S175-S177 PolarHBondContact O-N 3.36Å; S175-A423 WeakPolarHBondContact OG-CB 3.34Å
176	F	95.1	Very high	94.1	Very high	159 Å²	159	42.6 Å²	42.6	70%	0.697	24%	0.242	S	C	*	.	S	Bend	trans	-84.8	51.4	176.6	-62.9	-74.7	0	0	0	112.1	L172 I173 K174	L172-F176 HydrophobicContact CD1-CE2 3.92Å; L172-F176 HydrophobicContact CD1-CZ 4.2Å; L172-F176 HydrophobicContact CG-CE2 4.08Å; L172-F176 WeakPolarHBondContact O-CD2 3.12Å; L172-F176 WeakPolarHBondContact O-CE2 3.37Å; I173-F176 PolarHBondContact O-N 3.48Å; K174-F176 VanDerWaalsContact C-N 3.31Å
177	S	91.4	Very high	93.9	Very high	42 Å²	42	44.7 Å²	44.7	29%	0.294	25%	0.253	S	S	.	.	S	Bend	trans	-128.6	158.9	175	61.1	0	0	0	0	110.4	K174 S175 A179 P420	K174-S177 PolarHBondContact O-OG 3.23Å; S175-S177 PolarHBondContact O-N 3.36Å; S177-A179 WeakPolarHBondContact CB-O 3.45Å; S177-A179 PolarHBondContact OG-O 2.93Å; S177-P420 VanDerWaalsContact O-CG 3.26Å; S177-P420 WeakPolarHBondContact O-CG 3.42Å
178	S	88.1	Confident	93.7	Very high	127 Å²	127	54.2 Å²	54.2	89%	0.888	30%	0.298	S	S	*	.	S	Bend	trans	-67.5	-44.6	177.7	50.7	0	0	0	0	112.1
179	A	90.6	Very high	93.5	Very high	58 Å²	58	56.6 Å²	56.6	48%	0.479	31%	0.307	S	S	.	.	S	Bend	trans	-112.1	135.8	169.2	0	0	0	0	0	108.9	S177	S177-A179 WeakPolarHBondContact CB-O 3.45Å; S177-A179 PolarHBondContact OG-O 2.93Å
180	L	94	Very high	93.3	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.302	C	S	.	.			trans	-69	133.4	-180	-69	176.9	0	0	0	109.8	W182 S183 V413 A419 P420 A423	L180-W182 HydrophobicContact CB-CD2 4.24Å; L180-W182 HydrophobicContact CB-CZ2 4.18Å; L180-W182 HydrophobicContact CD1-CZ2 3.85Å; L180-W182 HydrophobicContact CD2-CH2 3.96Å; L180-W182 HydrophobicContact CD2-CZ2 3.67Å; L180-W182 HydrophobicContact CG-CZ2 4.12Å; L180-W182 PolarHBondContact O-N 3.49Å; L180-S183 WeakPolarHBondContact O-CB 3.37Å; L180-S183 PolarHBondContact O-N 2.98Å; L180-S183 PolarHBondContact O-OG 3.33Å; L180-V413 HydrophobicContact CD1-CG1 4.31Å; L180-A419 HydrophobicContact CD1-CB 3.59Å; L180-A419 HydrophobicContact CG-CB 4.3Å; L180-P420 HydrophobicContact CD2-CB 4.46Å; L180-P420 HydrophobicContact CD2-CG 4.36Å; L180-P420 HydrophobicContact CG-CG 4.45Å; L180-A423 HydrophobicContact CD1-CB 4.12Å; L180-A423 HydrophobicContact CD2-CB 4.04Å
181	P	93.5	Very high	92.9	Very high	22 Å²	22	57.6 Å²	57.6	14%	0.143	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.7	-175.3	-27.1	36.7	0	0	0	114.7	K174 N187 W189 F233	K174-P181 HydrophobicContact CB-CG 4.2Å; K174-P181 HydrophobicContact CD-CG 4.41Å; K174-P181 WeakPolarHBondContact O-CD 3.46Å; P181-N187 PolarHBondContact O-ND2 3.29Å; P181-W189 HydrophobicContact CB-CH2 4.24Å; P181-W189 HydrophobicContact CB-CZ2 4.08Å; P181-F233 HydrophobicContact CB-CD2 4.28Å; P181-F233 HydrophobicContact CB-CE2 3.76Å; P181-F233 HydrophobicContact CB-CZ 4.29Å
182	W	93.9	Very high	92.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	7.1	178.5	54.8	83.6	0	0	0	114.1	Y171 K174 L180 I230 F233 P410 A423 F427	Y171-W182 HydrophobicContact CD1-CD2 4.42Å; Y171-W182 AromaticContact CD1-CE3 3.88Å; Y171-W182 HydrophobicContact CD1-CE3 3.88Å; Y171-W182 AromaticContact CD1-CH2 3.71Å; Y171-W182 HydrophobicContact CD1-CH2 3.71Å; Y171-W182 HydrophobicContact CD1-CZ2 4.26Å; Y171-W182 AromaticContact CD1-CZ3 3.5Å; Y171-W182 HydrophobicContact CD1-CZ3 3.5Å; Y171-W182 VanDerWaalsContact CD1-CZ3 3.5Å; Y171-W182 HydrophobicContact CE1-CD2 4.19Å; Y171-W182 AromaticContact CE1-CE3 3.83Å; Y171-W182 HydrophobicContact CE1-CE3 3.83Å; Y171-W182 HydrophobicContact CE1-CH2 4.42Å; Y171-W182 AromaticContact CE1-CZ3 3.96Å; Y171-W182 HydrophobicContact CE1-CZ3 3.96Å; Y171-W182 HydrophobicContact CG-CZ3 4.43Å; K174-W182 HydrophobicContact CB-CZ3 3.84Å; L180-W182 HydrophobicContact CB-CD2 4.24Å; L180-W182 HydrophobicContact CB-CZ2 4.18Å; L180-W182 HydrophobicContact CD1-CZ2 3.85Å; L180-W182 HydrophobicContact CD2-CH2 3.96Å; L180-W182 HydrophobicContact CD2-CZ2 3.67Å; L180-W182 HydrophobicContact CG-CZ2 4.12Å; L180-W182 PolarHBondContact O-N 3.49Å; W182-I230 HydrophobicContact CB-CB 4.29Å; W182-I230 HydrophobicContact CB-CD1 3.37Å; W182-I230 HydrophobicContact CB-CG1 4.39Å; W182-I230 HydrophobicContact CD2-CD1 4.27Å; W182-I230 HydrophobicContact CG-CD1 3.52Å; W182-F233 HydrophobicContact CB-CB 3.93Å; W182-F233 HydrophobicContact CB-CD1 3.9Å; W182-F233 HydrophobicContact CB-CG 3.89Å; W182-F233 HydrophobicContact CD2-CE1 4.5Å; W182-F233 HydrophobicContact CE3-CD1 4.01Å; W182-F233 AromaticContact CE3-CE1 3.56Å; W182-F233 HydrophobicContact CE3-CE1 3.56Å; W182-F233 AromaticContact CE3-CZ 3.88Å; W182-F233 HydrophobicContact CE3-CZ 3.88Å; W182-F233 HydrophobicContact CZ3-CE1 4.15Å; W182-F233 HydrophobicContact CZ3-CZ 4.33Å; W182-P410 HydrophobicContact CZ2-CB 4.38Å; W182-P410 PolarHBondContact NE1-O 3.05Å; W182-A423 HydrophobicContact CZ2-CB 4.01Å; W182-F427 HydrophobicContact CH2-CE2 4.09Å; W182-F427 HydrophobicContact CZ2-CE2 4.06Å
183	S	90.5	Very high	91.5	Very high	29 Å²	29	67.7 Å²	67.7	20%	0.203	38%	0.378	C	S	.	.	S	Bend	trans	-87.1	-26.9	-179.6	63.7	0	0	0	0	113.5	L180	L180-S183 WeakPolarHBondContact O-CB 3.37Å; L180-S183 PolarHBondContact O-N 2.98Å; L180-S183 PolarHBondContact O-OG 3.33Å
184	T	89.3	Confident	90.9	Very high	46 Å²	46	64.1 Å²	64.1	28%	0.282	36%	0.361	S	S	.	.			trans	-120.9	161	-173.2	58.8	0	0	0	0	112.7	N187 N190 E196 P229	T184-N187 PolarHBondContact O-ND2 2.9Å; T184-N187 PolarHBondContact OG1-ND2 2.93Å; T184-N190 PolarHBondContact O-OD1 3.26Å; T184-E196 WeakPolarHBondContact CA-OE1 3.34Å; T184-E196 VanDerWaalsContact CB-OE1 3.31Å; T184-E196 WeakPolarHBondContact CB-OE1 3.45Å; T184-P229 WeakPolarHBondContact O-CB 3.39Å
185	C	88.5	Confident	90.2	Very high	31 Å²	31	61.8 Å²	61.8	21%	0.209	35%	0.352	C	S	.	.	S	Bend	trans	-95.3	4.8	174.3	-72	0	0	0	0	113.9	N187 N190 C194 L195 E196	C185-N187 PolarHBondContact O-N 3.32Å; C185-N190 WeakPolarHBondContact CA-OD1 3.5Å; C185-N190 VanDerWaalsContact O-CB 3.24Å; C185-N190 WeakPolarHBondContact O-CB 3.44Å; C185-N190 PolarHBondContact O-OD1 3.16Å; C185-C194 VanDerWaalsContact CA-SG 3.57Å; C185-C194 HydrophobicContact CB-CB 3.66Å; C185-C194 WeakPolarHBondContact CB-SG 3.36Å; C185-C194 WeakPolarHBondContact SG-CB 3.33Å; C185-C194 PolarHBondContact SG-O 3.16Å; C185-C194 CovalentContact SG-SG 2.04Å; C185-C194 PolarHBondContact SG-SG 3Å; C185-L195 PolarHBondContact SG-N 3.44Å; C185-L195 VanDerWaalsContact SG-N 3.42Å; C185-E196 HydrophobicContact CB-CG 4.11Å; C185-E196 PolarHBondContact N-OE1 2.89Å
186	D	88.9	Confident	89.1	Confident	148 Å²	148	66 Å²	66	79%	0.791	37%	0.371	S	S	*	.			trans	-94.2	55.7	-177.2	-168	27.2	0	0	0	112
187	N	92	Very high	87.8	Confident	45 Å²	45	63 Å²	63	24%	0.241	37%	0.365	C	S	.	.	S	Bend	trans	-132.3	159.7	178.5	-51.3	-88.5	0	0	0	112.1	P181 T184 C185 W189 N190	P181-N187 PolarHBondContact O-ND2 3.29Å; T184-N187 PolarHBondContact O-ND2 2.9Å; T184-N187 PolarHBondContact OG1-ND2 2.93Å; C185-N187 PolarHBondContact O-N 3.32Å; N187-W189 HydrophobicContact CB-CD2 3.69Å; N187-W189 HydrophobicContact CB-CE3 3.99Å; N187-W189 HydrophobicContact CB-CG 4.34Å; N187-W189 HydrophobicContact CB-CH2 3.71Å; N187-W189 HydrophobicContact CB-CZ2 3.37Å; N187-W189 HydrophobicContact CB-CZ3 4Å; N187-W189 PolarHBondContact O-N 3.41Å; N187-W189 VanDerWaalsContact O-N 3.13Å; N187-W189 WeakPolarHBondContact OD1-CZ2 3.31Å; N187-N190 VanDerWaalsContact CB-OD1 3.26Å; N187-N190 WeakPolarHBondContact CB-OD1 3.25Å; N187-N190 PolarHBondContact N-OD1 3.26Å; N187-N190 PolarHBondContact ND2-OD1 3.49Å; N187-N190 WeakPolarHBondContact O-CB 3.31Å; N187-N190 PolarHBondContact O-N 3Å
188	E	93.6	Very high	86.5	Confident	200 Å²	200	62.5 Å²	62.5	94%	0.935	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.3	-177.5	-62.8	-177.5	163.5	0	0	114.7
189	W	93.2	Very high	85.1	Confident	51 Å²	51	59.7 Å²	59.7	19%	0.193	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-4.7	178.9	55.6	80	0	0	0	113.4	P181 N187 F233 N236 K237	P181-W189 HydrophobicContact CB-CH2 4.24Å; P181-W189 HydrophobicContact CB-CZ2 4.08Å; N187-W189 HydrophobicContact CB-CD2 3.69Å; N187-W189 HydrophobicContact CB-CE3 3.99Å; N187-W189 HydrophobicContact CB-CG 4.34Å; N187-W189 HydrophobicContact CB-CH2 3.71Å; N187-W189 HydrophobicContact CB-CZ2 3.37Å; N187-W189 HydrophobicContact CB-CZ3 4Å; N187-W189 PolarHBondContact O-N 3.41Å; N187-W189 VanDerWaalsContact O-N 3.13Å; N187-W189 WeakPolarHBondContact OD1-CZ2 3.31Å; W189-F233 AromaticContact CE2-CD2 3.72Å; W189-F233 HydrophobicContact CH2-CD2 4.49Å; W189-F233 HydrophobicContact CH2-CE2 4.42Å; W189-F233 AromaticContact CZ2-CD2 3.65Å; W189-F233 HydrophobicContact CZ2-CD2 3.65Å; W189-F233 AromaticContact CZ2-CE2 3.98Å; W189-F233 HydrophobicContact CZ2-CE2 3.98Å; W189-F233 AromaticContact NE1-CD2 3.81Å; W189-N236 HydrophobicContact CB-CB 4.2Å; W189-N236 PolarHBondContact O-ND2 3.48Å; W189-N236 VanDerWaalsContact O-ND2 3.13Å; W189-K237 HydrophobicContact CB-CB 3.9Å; W189-K237 HydrophobicContact CD2-CB 3.7Å; W189-K237 HydrophobicContact CD2-CD 4.18Å; W189-K237 HydrophobicContact CD2-CG 3.83Å; W189-K237 HydrophobicContact CE3-CB 4.09Å; W189-K237 HydrophobicContact CE3-CD 3.65Å; W189-K237 HydrophobicContact CE3-CG 3.73Å; W189-K237 HydrophobicContact CG-CB 3.62Å; W189-K237 HydrophobicContact CG-CG 4.29Å; W189-K237 HydrophobicContact CZ3-CD 4.12Å; W189-K237 HydrophobicContact CZ3-CG 4.15Å
190	N	93.4	Very high	83.2	Confident	26 Å²	26	62.6 Å²	62.6	14%	0.139	33%	0.334	C	S	.	.			trans	-81.1	144	-177.8	-70.6	126.9	0	0	0	111.9	T184 C185 N187 C194 E232	T184-N190 PolarHBondContact O-OD1 3.26Å; C185-N190 WeakPolarHBondContact CA-OD1 3.5Å; C185-N190 VanDerWaalsContact O-CB 3.24Å; C185-N190 WeakPolarHBondContact O-CB 3.44Å; C185-N190 PolarHBondContact O-OD1 3.16Å; N187-N190 VanDerWaalsContact CB-OD1 3.26Å; N187-N190 WeakPolarHBondContact CB-OD1 3.25Å; N187-N190 PolarHBondContact N-OD1 3.26Å; N187-N190 PolarHBondContact ND2-OD1 3.49Å; N187-N190 WeakPolarHBondContact O-CB 3.31Å; N187-N190 PolarHBondContact O-N 3Å; N190-C194 HydrophobicContact CB-CB 4.28Å; N190-C194 PolarHBondContact ND2-SG 3.42Å; N190-E232 WeakPolarHBondContact CA-OE2 3.34Å; N190-E232 WeakPolarHBondContact CB-OE2 3.5Å; N190-E232 PolarHBondContact ND2-OE2 3.38Å
191	T	89.1	Confident	81.2	Confident	56 Å²	56	68.5 Å²	68.5	34%	0.344	37%	0.365	S	S	.	.			trans	-94.1	163.1	174.3	78.3	0	0	0	0	110.9	N193 C194 E232	T191-N193 PolarHBondContact O-N 2.96Å; T191-N193 PolarHBondContact OG1-N 3.28Å; T191-C194 VanDerWaalsContact O-CB 3.29Å; T191-C194 WeakPolarHBondContact O-CB 3.41Å; T191-C194 PolarHBondContact O-N 2.89Å; T191-E232 WeakPolarHBondContact CB-OE1 3.21Å; T191-E232 PolarHBondContact N-OE2 3.14Å; T191-E232 PolarHBondContact OG1-OE1 2.7Å
192	P	84.4	Confident	79.4	Confident	131 Å²	131	70.8 Å²	70.8	85%	0.851	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.4	173.6	-25	35.6	0	0	0	114.4	C194	P192-C194 VanDerWaalsContact C-N 3.32Å
193	N	81.2	Confident	77.7	Confident	96 Å²	96	72.9 Å²	72.9	51%	0.513	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	6	180	-62	-7.5	0	0	0	112.9	T191 A226 R227	T191-N193 PolarHBondContact O-N 2.96Å; T191-N193 PolarHBondContact OG1-N 3.28Å; N193-A226 WeakPolarHBondContact O-CA 3.42Å; N193-R227 PolarHBondContact O-N 2.85Å
194	C	85.1	Confident	76.1	Confident	10 Å²	10	76.1 Å²	76.1	7%	0.068	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-73.2	128.7	178.8	-173.2	0	0	0	0	111.5	C185 N190 T191 P192 R227 E232	C185-C194 VanDerWaalsContact CA-SG 3.57Å; C185-C194 HydrophobicContact CB-CB 3.66Å; C185-C194 WeakPolarHBondContact CB-SG 3.36Å; C185-C194 WeakPolarHBondContact SG-CB 3.33Å; C185-C194 PolarHBondContact SG-O 3.16Å; C185-C194 CovalentContact SG-SG 2.04Å; C185-C194 PolarHBondContact SG-SG 3Å; N190-C194 HydrophobicContact CB-CB 4.28Å; N190-C194 PolarHBondContact ND2-SG 3.42Å; T191-C194 VanDerWaalsContact O-CB 3.29Å; T191-C194 WeakPolarHBondContact O-CB 3.41Å; T191-C194 PolarHBondContact O-N 2.89Å; P192-C194 VanDerWaalsContact C-N 3.32Å; C194-R227 WeakPolarHBondContact CA-O 3.44Å; C194-E232 WeakPolarHBondContact CB-OE2 3.17Å
195	L	80.5	Confident	74.5	Confident	16 Å²	16	82.4 Å²	82.4	8%	0.084	44%	0.443	C	S	.	.			trans	-125.7	129.1	175	-62.8	-175.9	0	0	0	112.2	C185 F198 V213 L223 A226 R227 P229	C185-L195 PolarHBondContact SG-N 3.44Å; C185-L195 VanDerWaalsContact SG-N 3.42Å; L195-F198 HydrophobicContact CB-CE2 4.14Å; L195-F198 HydrophobicContact CB-CZ 4.03Å; L195-F198 WeakPolarHBondContact O-CE2 3.29Å; L195-V213 HydrophobicContact CD2-CB 4.19Å; L195-V213 HydrophobicContact CD2-CG1 3.77Å; L195-V213 HydrophobicContact CD2-CG2 3.59Å; L195-L223 HydrophobicContact CD1-CD1 3.61Å; L195-A226 HydrophobicContact CB-CB 4.44Å; L195-A226 HydrophobicContact CD1-CB 3.32Å; L195-A226 HydrophobicContact CG-CB 3.76Å; L195-R227 PolarHBondContact N-O 3.19Å; L195-P229 WeakPolarHBondContact O-CD 3.49Å
196	E	74.9	Confident	73.2	Confident	90 Å²	90	83.4 Å²	83.4	42%	0.421	45%	0.453	S	S	.	.	S	Bend	trans	-72.8	-37.8	-179.2	-63.7	-176.4	170.6	0	0	112.5	T184 C185 P229 K411	T184-E196 WeakPolarHBondContact CA-OE1 3.34Å; T184-E196 VanDerWaalsContact CB-OE1 3.31Å; T184-E196 WeakPolarHBondContact CB-OE1 3.45Å; C185-E196 HydrophobicContact CB-CG 4.11Å; C185-E196 PolarHBondContact N-OE1 2.89Å; E196-P229 HydrophobicContact CG-CG 4.41Å; E196-K411 PolarHBondContact O-NZ 2.95Å
197	T	66.8	Low	71.9	Confident	94 Å²	94	81.3 Å²	81.3	58%	0.577	45%	0.45	S	S	*	.			trans	-122.3	115.9	-175.9	-49	0	0	0	0	110.9	H199	T197-H199 VanDerWaalsContact CG2-CD2 3.48Å; T197-H199 WeakPolarHBondContact CG2-CD2 3.18Å; T197-H199 WeakPolarHBondContact CG2-NE2 3.42Å
198	F	64.1	Low	70.2	Confident	33 Å²	33	83.7 Å²	83.7	15%	0.145	46%	0.462	C	S	.	.			trans	-96.1	95.2	173.1	-72.7	-95.7	0	0	0	109.1	L195 A226 R227 S228	L195-F198 HydrophobicContact CB-CE2 4.14Å; L195-F198 HydrophobicContact CB-CZ 4.03Å; L195-F198 WeakPolarHBondContact O-CE2 3.29Å; F198-A226 HydrophobicContact CE1-CB 3.81Å; F198-A226 WeakPolarHBondContact CE1-O 3.15Å; F198-A226 HydrophobicContact CZ-CB 4.15Å; F198-R227 VanDerWaalsContact CZ-C 3.4Å; F198-S228 VanDerWaalsContact CE2-CA 3.49Å; F198-S228 VanDerWaalsContact CE2-CB 3.44Å
199	H	59.4	Low	68.6	Low	68 Å²	68	74.5 Å²	74.5	32%	0.315	42%	0.42	S	S	.	.			trans	-98.3	95.1	163.4	-74.2	-56.9	0	0	0	108.6	T197 L201 H202 E389	T197-H199 VanDerWaalsContact CG2-CD2 3.48Å; T197-H199 WeakPolarHBondContact CG2-CD2 3.18Å; T197-H199 WeakPolarHBondContact CG2-NE2 3.42Å; H199-L201 PolarHBondContact O-N 3.12Å; H199-H202 VanDerWaalsContact CB-CD2 3.48Å; H199-H202 WeakPolarHBondContact CB-CD2 3.25Å; H199-H202 PolarHBondContact O-N 3.22Å; H199-E389 PolarHBondContact CE1-O 3.33Å; H199-E389 VanDerWaalsContact CE1-O 3.29Å
200	H	51.5	Low	67	Low	119 Å²	119	79 Å²	79	55%	0.551	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-56.4	-18.5	173.1	-77.9	-86.4	0	0	0	112.8	H202 C203 V392	H200-H202 PolarHBondContact O-N 3.32Å; H200-H202 VanDerWaalsContact O-N 3.15Å; H200-C203 PolarHBondContact O-N 2.87Å; H200-V392 HydrophobicContact CB-CG1 4.34Å; H200-V392 WeakPolarHBondContact CD2-CG1 3.37Å
201	L	51.8	Low	65.3	Low	127 Å²	127	79.7 Å²	79.7	67%	0.665	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-61.9	-13.3	173.9	-76.1	155.4	0	0	0	114.5	H199 C203	H199-L201 PolarHBondContact O-N 3.12Å; L201-C203 VanDerWaalsContact C-N 3.29Å; L201-C203 PolarHBondContact O-N 3.36Å
202	H	55.6	Low	63.7	Low	70 Å²	70	81.8 Å²	81.8	32%	0.324	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-85.3	-2.6	-176	-70.4	-145.6	0	0	0	113.6	H199 H200 N210 V211	H199-H202 VanDerWaalsContact CB-CD2 3.48Å; H199-H202 WeakPolarHBondContact CB-CD2 3.25Å; H199-H202 PolarHBondContact O-N 3.22Å; H200-H202 PolarHBondContact O-N 3.32Å; H200-H202 VanDerWaalsContact O-N 3.15Å; H202-N210 PolarHBondContact ND1-O 3.01Å; H202-N210 PolarHBondContact O-N 2.92Å; H202-V211 HydrophobicContact CB-CG2 3.91Å; H202-V211 WeakPolarHBondContact ND1-CG2 3.28Å
203	C	58.8	Low	62.3	Low	44 Å²	44	78.2 Å²	78.2	30%	0.297	44%	0.442	S	S	.	.			trans	-115	64.9	174	-77	0	0	0	0	111.1	H200 L201 N205 C220	H200-C203 PolarHBondContact O-N 2.87Å; L201-C203 VanDerWaalsContact C-N 3.29Å; L201-C203 PolarHBondContact O-N 3.36Å; C203-N205 PolarHBondContact O-N 3.44Å; C203-C220 HydrophobicContact CB-CB 4.04Å; C203-C220 WeakPolarHBondContact CB-SG 3.5Å; C203-C220 VanDerWaalsContact SG-CA 3.51Å; C203-C220 WeakPolarHBondContact SG-CB 3.45Å; C203-C220 CovalentContact SG-SG 2.05Å; C203-C220 PolarHBondContact SG-SG 3.21Å
204	S	55.9	Low	61.1	Low	98 Å²	98	78 Å²	78	69%	0.685	46%	0.462	S	S	*	.	S	Bend	trans	-85.2	89.6	172.9	158.3	0	0	0	0	110.5	A206	S204-A206 PolarHBondContact O-N 2.86Å
205	N	56.8	Low	59.6	Low	178 Å²	178	81.1 Å²	81.1	95%	0.952	50%	0.496	S	S	*	.	S	Bend	trans	51.4	23.2	176.3	-79.3	-15.4	0	0	0	115.2	C203	C203-N205 PolarHBondContact O-N 3.44Å
206	A	60.4	Low	58.5	Low	52 Å²	52	83.3 Å²	83.3	43%	0.43	52%	0.516	S	S	.	.			trans	-111	147.6	179.3	0	0	0	0	0	109.9	S204 L208 C220	S204-A206 PolarHBondContact O-N 2.86Å; A206-L208 VanDerWaalsContact C-N 3.31Å; A206-C220 PolarHBondContact O-SG 3.27Å
207	S	61.3	Low	57.9	Low	104 Å²	104	84.7 Å²	84.7	73%	0.727	53%	0.527	S	S	*	.	S	Bend	trans	-77.1	-19.1	173.4	29.6	0	0	0	0	112.9	C220	S207-C220 PolarHBondContact O-N 2.84Å; S207-C220 VanDerWaalsContact O-N 3.13Å
208	L	57	Low	57.9	Low	94 Å²	94	81.6 Å²	81.6	49%	0.492	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.2	176.7	-74.5	154.9	0	0	0	109.5	A206 N217 T219	A206-L208 VanDerWaalsContact C-N 3.31Å; L208-N217 HydrophobicContact CD2-CB 4.3Å; L208-T219 HydrophobicContact CD2-CG2 4.33Å
209	A	60.4	Low	58.1	Low	7 Å²	7	82.4 Å²	82.4	6%	0.058	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	139.4	171.4	0	0	0	0	0	108.9	V211 L218 L223	A209-V211 PolarHBondContact O-N 3.19Å; A209-L218 WeakPolarHBondContact CB-O 3.48Å; A209-L218 PolarHBondContact N-O 3.4Å; A209-L223 HydrophobicContact CB-CB 4.46Å; A209-L223 HydrophobicContact CB-CD2 4.11Å
210	N	58.3	Low	58.4	Low	147 Å²	147	80.5 Å²	80.5	79%	0.786	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	52.8	176.2	-153.5	19	0	0	0	110.9	H202	H202-N210 PolarHBondContact ND1-O 3.01Å; H202-N210 PolarHBondContact O-N 2.92Å
211	V	58.5	Low	58.9	Low	40 Å²	40	78 Å²	78	24%	0.242	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	128.9	-178.2	-172.4	0	0	0	0	109.5	H202 A209 V213 L218	H202-V211 HydrophobicContact CB-CG2 3.91Å; H202-V211 WeakPolarHBondContact ND1-CG2 3.28Å; A209-V211 PolarHBondContact O-N 3.19Å; V211-V213 HydrophobicContact CG1-CG2 3.61Å; V211-L218 PolarHBondContact O-N 2.95Å
212	T	55.7	Low	59.5	Low	99 Å²	99	75.8 Å²	75.8	61%	0.607	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	115.6	167.5	50.8	0	0	0	0	109.3	A216	T212-A216 WeakPolarHBondContact CA-O 3.36Å
213	V	55.5	Low	59.9	Low	57 Å²	57	73.5 Å²	73.5	35%	0.345	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.5	173.3	-173.1	0	0	0	0	107.3	L195 V211 G215 A216 L218	L195-V213 HydrophobicContact CD2-CB 4.19Å; L195-V213 HydrophobicContact CD2-CG1 3.77Å; L195-V213 HydrophobicContact CD2-CG2 3.59Å; V211-V213 HydrophobicContact CG1-CG2 3.61Å; V213-G215 PolarHBondContact O-N 3.25Å; V213-G215 VanDerWaalsContact O-N 3.16Å; V213-A216 PolarHBondContact N-O 3.03Å; V213-A216 PolarHBondContact O-N 2.63Å; V213-L218 HydrophobicContact CB-CD1 4.18Å; V213-L218 HydrophobicContact CG2-CD1 4.03Å
214	G	54.3	Low	60.1	Low	91 Å²	91	75.2 Å²	75.2	94%	0.938	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	19	-176.6	0	0	0	0	0	115.3
215	G	53.9	Low	60.4	Low	76 Å²	76	76.3 Å²	76.3	78%	0.784	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	7.4	178.9	0	0	0	0	0	115.8	V213	V213-G215 PolarHBondContact O-N 3.25Å; V213-G215 VanDerWaalsContact O-N 3.16Å
216	A	58.3	Low	61	Low	61 Å²	61	68.5 Å²	68.5	50%	0.504	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.9	174.3	0	0	0	0	0	111.7	T212 V213 L218	T212-A216 WeakPolarHBondContact CA-O 3.36Å; V213-A216 PolarHBondContact N-O 3.03Å; V213-A216 PolarHBondContact O-N 2.63Å; A216-L218 PolarHBondContact O-N 3.05Å
217	N	62.2	Low	61.8	Low	120 Å²	120	71.1 Å²	71.1	64%	0.642	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	122.2	170.6	-74.1	-8.4	0	0	0	109	L208	L208-N217 HydrophobicContact CD2-CB 4.3Å
218	L	65.6	Low	63	Low	29 Å²	29	66.7 Å²	66.7	15%	0.152	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	136.1	-176.9	-149	134.5	0	0	0	109.7	A209 V211 V213 A216 D222 L223	A209-L218 WeakPolarHBondContact CB-O 3.48Å; A209-L218 PolarHBondContact N-O 3.4Å; V211-L218 PolarHBondContact O-N 2.95Å; V213-L218 HydrophobicContact CB-CD1 4.18Å; V213-L218 HydrophobicContact CG2-CD1 4.03Å; A216-L218 PolarHBondContact O-N 3.05Å; L218-D222 VanDerWaalsContact CD2-C 3.48Å; L218-D222 HydrophobicContact CD2-CB 3.46Å; L218-D222 VanDerWaalsContact CD2-CB 3.46Å; L218-D222 HydrophobicContact CG-CB 3.71Å; L218-L223 HydrophobicContact CD2-CB 3.64Å; L218-L223 HydrophobicContact CD2-CD1 3.87Å; L218-L223 HydrophobicContact CD2-CG 4.39Å
219	T	69.3	Low	64.6	Low	49 Å²	49	62.2 Å²	62.2	30%	0.301	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	159.5	174.1	70.6	0	0	0	0	110.6	L208 A221 D222 L223	L208-T219 HydrophobicContact CD2-CG2 4.33Å; T219-A221 PolarHBondContact O-N 2.86Å; T219-A221 PolarHBondContact OG1-N 3.48Å; T219-D222 WeakPolarHBondContact CB-OD2 3.3Å; T219-D222 PolarHBondContact N-OD2 2.88Å; T219-D222 PolarHBondContact O-N 3.29Å; T219-D222 VanDerWaalsContact O-N 3.12Å; T219-D222 PolarHBondContact OG1-N 3.38Å; T219-D222 PolarHBondContact OG1-OD2 2.94Å; T219-L223 PolarHBondContact O-N 2.88Å
220	C	66.3	Low	66	Low	28 Å²	28	61.9 Å²	61.9	19%	0.189	41%	0.405	C	S	.	.	H	α-helix	trans	-65.4	-19.7	175.3	-74.4	0	0	0	0	113.4	C203 A206 S207 A224	C203-C220 HydrophobicContact CB-CB 4.04Å; C203-C220 WeakPolarHBondContact CB-SG 3.5Å; C203-C220 VanDerWaalsContact SG-CA 3.51Å; C203-C220 WeakPolarHBondContact SG-CB 3.45Å; C203-C220 CovalentContact SG-SG 2.05Å; C203-C220 PolarHBondContact SG-SG 3.21Å; A206-C220 PolarHBondContact O-SG 3.27Å; S207-C220 PolarHBondContact O-N 2.84Å; S207-C220 VanDerWaalsContact O-N 3.13Å; C220-A224 PolarHBondContact O-N 2.85Å
221	A	61.8	Low	67.5	Low	67 Å²	67	57 Å²	57	55%	0.554	38%	0.378	S	S	*	.	H	α-helix	trans	-71.2	-44.9	170.2	0	0	0	0	0	111.2	T219 L223 A224 D225	T219-A221 PolarHBondContact O-N 2.86Å; T219-A221 PolarHBondContact OG1-N 3.48Å; A221-L223 PolarHBondContact O-N 3.5Å; A221-A224 WeakPolarHBondContact O-CB 3.48Å; A221-A224 PolarHBondContact O-N 3.43Å; A221-A224 VanDerWaalsContact O-N 3.1Å; A221-D225 PolarHBondContact O-N 3.13Å; A221-D225 VanDerWaalsContact O-N 3.13Å
222	D	63.4	Low	69.1	Low	80 Å²	80	55.1 Å²	55.1	43%	0.428	37%	0.367	S	S	.	.	H	α-helix	trans	-63.2	-33.5	176	-54.9	-45.1	0	0	0	111.7	L218 T219 A224 D225 A226	L218-D222 VanDerWaalsContact CD2-C 3.48Å; L218-D222 HydrophobicContact CD2-CB 3.46Å; L218-D222 VanDerWaalsContact CD2-CB 3.46Å; L218-D222 HydrophobicContact CG-CB 3.71Å; T219-D222 WeakPolarHBondContact CB-OD2 3.3Å; T219-D222 PolarHBondContact N-OD2 2.88Å; T219-D222 PolarHBondContact O-N 3.29Å; T219-D222 VanDerWaalsContact O-N 3.12Å; T219-D222 PolarHBondContact OG1-N 3.38Å; T219-D222 PolarHBondContact OG1-OD2 2.94Å; D222-A224 VanDerWaalsContact C-N 3.32Å; D222-D225 PolarHBondContact O-N 3.22Å; D222-A226 PolarHBondContact O-N 3.12Å; D222-A226 VanDerWaalsContact O-N 3.16Å
223	L	65.4	Low	71	Confident	22 Å²	22	50.4 Å²	50.4	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-72.4	-29.1	177.4	-162.9	75.2	0	0	0	111.6	L195 A209 L218 T219 A221 A226	L195-L223 HydrophobicContact CD1-CD1 3.61Å; A209-L223 HydrophobicContact CB-CB 4.46Å; A209-L223 HydrophobicContact CB-CD2 4.11Å; L218-L223 HydrophobicContact CD2-CB 3.64Å; L218-L223 HydrophobicContact CD2-CD1 3.87Å; L218-L223 HydrophobicContact CD2-CG 4.39Å; T219-L223 PolarHBondContact O-N 2.88Å; A221-L223 PolarHBondContact O-N 3.5Å; L223-A226 WeakPolarHBondContact O-CB 3.4Å
224	A	61	Low	72.9	Confident	81 Å²	81	47.9 Å²	47.9	67%	0.669	32%	0.322	S	S	*	.	H	α-helix	trans	-73.4	-30.8	174.7	0	0	0	0	0	112.2	C220 A221 D222 A226	C220-A224 PolarHBondContact O-N 2.85Å; A221-A224 WeakPolarHBondContact O-CB 3.48Å; A221-A224 PolarHBondContact O-N 3.43Å; A221-A224 VanDerWaalsContact O-N 3.1Å; D222-A224 VanDerWaalsContact C-N 3.32Å; A224-A226 VanDerWaalsContact C-N 3.34Å
225	D	63	Low	74.7	Confident	120 Å²	120	44.1 Å²	44.1	64%	0.642	28%	0.28	S	S	*	.	S	Bend	trans	-85.9	-5.1	175.4	-76.9	-14	0	0	0	113.5	A221 D222	A221-D225 PolarHBondContact O-N 3.13Å; A221-D225 VanDerWaalsContact O-N 3.13Å; D222-D225 PolarHBondContact O-N 3.22Å
226	A	68.9	Low	76.6	Confident	14 Å²	14	43 Å²	43	12%	0.116	26%	0.256	C	S	.	.			trans	-67.3	144.5	-179.7	0	0	0	0	0	112.5	N193 L195 F198 D222 L223 A224	N193-A226 WeakPolarHBondContact O-CA 3.42Å; L195-A226 HydrophobicContact CB-CB 4.44Å; L195-A226 HydrophobicContact CD1-CB 3.32Å; L195-A226 HydrophobicContact CG-CB 3.76Å; F198-A226 HydrophobicContact CE1-CB 3.81Å; F198-A226 WeakPolarHBondContact CE1-O 3.15Å; F198-A226 HydrophobicContact CZ-CB 4.15Å; D222-A226 PolarHBondContact O-N 3.12Å; D222-A226 VanDerWaalsContact O-N 3.16Å; L223-A226 WeakPolarHBondContact O-CB 3.4Å; A224-A226 VanDerWaalsContact C-N 3.34Å
227	R	78.9	Confident	78.4	Confident	107 Å²	107	42.5 Å²	42.5	40%	0.404	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-119.8	145.2	-177.5	-73.3	-171.8	150.4	-156.8	-16.4	112.4	N193 C194 L195 F198 E232 E235	N193-R227 PolarHBondContact O-N 2.85Å; C194-R227 WeakPolarHBondContact CA-O 3.44Å; L195-R227 PolarHBondContact N-O 3.19Å; F198-R227 VanDerWaalsContact CZ-C 3.4Å; R227-E232 HydrophobicContact CB-CG 4.05Å; R227-E235 IonicContact CZ-OE2 2.72Å; R227-E235 IonicContact NH1-OE2 3.34Å; R227-E235 PolarHBondContact NH1-OE2 3.36Å; R227-E235 IonicContact NH2-OE2 2.98Å; R227-E235 PolarHBondContact NH2-OE2 3.16Å
228	S	85.2	Confident	79.9	Confident	11 Å²	11	36.8 Å²	36.8	8%	0.077	21%	0.212	C	C	.	.			trans	-81.4	147.4	-179.1	74.6	0	0	0	0	111.6	F198 I230 I231 E232	F198-S228 VanDerWaalsContact CE2-CA 3.49Å; F198-S228 VanDerWaalsContact CE2-CB 3.44Å; S228-I230 PolarHBondContact O-N 2.9Å; S228-I230 VanDerWaalsContact O-N 3.11Å; S228-I230 WeakPolarHBondContact OG-CG2 3.27Å; S228-I231 PolarHBondContact O-N 3.29Å; S228-I231 WeakPolarHBondContact OG-CD1 3.41Å; S228-I231 VanDerWaalsContact OG-CG1 3.28Å; S228-I231 WeakPolarHBondContact OG-CG1 3.41Å; S228-I231 PolarHBondContact OG-N 3.33Å; S228-E232 PolarHBondContact O-N 3.44Å; S228-E232 VanDerWaalsContact O-N 3.07Å
229	P	90.3	Very high	81.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-26.9	-178.4	13.9	-25.9	0	0	0	113.1	T184 L195 E196 F233	T184-P229 WeakPolarHBondContact O-CB 3.39Å; L195-P229 WeakPolarHBondContact O-CD 3.49Å; E196-P229 HydrophobicContact CG-CG 4.41Å; P229-F233 WeakPolarHBondContact O-CB 3.42Å; P229-F233 PolarHBondContact O-N 2.86Å
230	I	90.7	Very high	82.5	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-71.6	-38.2	174.2	-174.4	62.1	0	0	0	112.8	Y171 W182 S228 F233 W234 F406 I407 P410 K411	Y171-I230 HydrophobicContact CE1-CD1 4.2Å; W182-I230 HydrophobicContact CB-CB 4.29Å; W182-I230 HydrophobicContact CB-CD1 3.37Å; W182-I230 HydrophobicContact CB-CG1 4.39Å; W182-I230 HydrophobicContact CD2-CD1 4.27Å; W182-I230 HydrophobicContact CG-CD1 3.52Å; S228-I230 PolarHBondContact O-N 2.9Å; S228-I230 VanDerWaalsContact O-N 3.11Å; S228-I230 WeakPolarHBondContact OG-CG2 3.27Å; I230-F233 HydrophobicContact CD1-CD1 4.38Å; I230-F233 PolarHBondContact O-N 3.25Å; I230-W234 WeakPolarHBondContact O-CB 3.35Å; I230-W234 PolarHBondContact O-N 2.89Å; I230-F406 WeakPolarHBondContact CD1-O 2.96Å; I230-I407 HydrophobicContact CG1-CB 4.48Å; I230-I407 HydrophobicContact CG1-CG2 4.28Å; I230-I407 WeakPolarHBondContact CG1-O 3.33Å; I230-I407 HydrophobicContact CG2-CG2 3.92Å; I230-P410 HydrophobicContact CD1-CB 3.83Å; I230-P410 HydrophobicContact CD1-CG 4.45Å; I230-P410 HydrophobicContact CG1-CB 4.46Å; I230-K411 HydrophobicContact CB-CB 4.49Å; I230-K411 HydrophobicContact CG2-CB 3.92Å; I230-K411 HydrophobicContact CG2-CD 4.17Å; I230-K411 HydrophobicContact CG2-CG 4.26Å
231	I	89.3	Confident	83.7	Confident	43 Å²	43	37.6 Å²	37.6	22%	0.221	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-44.8	177.8	-68.6	168.6	0	0	0	108.7	S228 W234 E235 I407	S228-I231 PolarHBondContact O-N 3.29Å; S228-I231 WeakPolarHBondContact OG-CD1 3.41Å; S228-I231 VanDerWaalsContact OG-CG1 3.28Å; S228-I231 WeakPolarHBondContact OG-CG1 3.41Å; S228-I231 PolarHBondContact OG-N 3.33Å; I231-W234 PolarHBondContact O-N 2.99Å; I231-E235 HydrophobicContact CG2-CG 4.31Å; I231-E235 WeakPolarHBondContact O-CB 3.11Å; I231-E235 PolarHBondContact O-N 3.37Å; I231-I407 HydrophobicContact CG1-CG2 3.69Å
232	E	92.6	Very high	85.3	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-37.4	176.1	-65.7	-165.5	165.5	0	0	112.3	N190 T191 C194 R227 S228 W234 N236 K237	N190-E232 WeakPolarHBondContact CA-OE2 3.34Å; N190-E232 WeakPolarHBondContact CB-OE2 3.5Å; N190-E232 PolarHBondContact ND2-OE2 3.38Å; T191-E232 WeakPolarHBondContact CB-OE1 3.21Å; T191-E232 PolarHBondContact N-OE2 3.14Å; T191-E232 PolarHBondContact OG1-OE1 2.7Å; C194-E232 WeakPolarHBondContact CB-OE2 3.17Å; R227-E232 HydrophobicContact CB-CG 4.05Å; S228-E232 PolarHBondContact O-N 3.44Å; S228-E232 VanDerWaalsContact O-N 3.07Å; E232-W234 VanDerWaalsContact C-N 3.33Å; E232-W234 PolarHBondContact O-N 3.46Å; E232-N236 WeakPolarHBondContact O-CA 3.47Å; E232-N236 WeakPolarHBondContact O-CB 3.41Å; E232-N236 PolarHBondContact O-N 2.92Å; E232-K237 PolarHBondContact O-N 3.32Å
233	F	95.1	Very high	86.6	Confident	1 Å²	1	35 Å²	35	0%	0.004	20%	0.197	C	C	.	.	I	π-helix	trans	-59.9	-45.4	172.2	-179	-103.8	0	0	0	111.2	Y170 Y171 K174 P181 W182 W189 P229 I230 K237 V238	Y170-F233 HydrophobicContact CE1-CE1 4.47Å; Y170-F233 AromaticContact CE1-CZ 3.9Å; Y170-F233 HydrophobicContact CE1-CZ 3.9Å; Y171-F233 HydrophobicContact CD1-CE1 4.19Å; Y171-F233 AromaticContact CE1-CD1 3.9Å; Y171-F233 HydrophobicContact CE1-CD1 3.9Å; Y171-F233 AromaticContact CE1-CE1 3.55Å; Y171-F233 HydrophobicContact CE1-CE1 3.55Å; Y171-F233 HydrophobicContact CE2-CE1 4.2Å; Y171-F233 AromaticContact CZ-CD1 3.79Å; Y171-F233 AromaticContact CZ-CE1 3.57Å; Y171-F233 WeakPolarHBondContact OH-CD1 3.29Å; K174-F233 HydrophobicContact CG-CZ 4.39Å; P181-F233 HydrophobicContact CB-CD2 4.28Å; P181-F233 HydrophobicContact CB-CE2 3.76Å; P181-F233 HydrophobicContact CB-CZ 4.29Å; W182-F233 HydrophobicContact CB-CB 3.93Å; W182-F233 HydrophobicContact CB-CD1 3.9Å; W182-F233 HydrophobicContact CB-CG 3.89Å; W182-F233 HydrophobicContact CD2-CE1 4.5Å; W182-F233 HydrophobicContact CE3-CD1 4.01Å; W182-F233 AromaticContact CE3-CE1 3.56Å; W182-F233 HydrophobicContact CE3-CE1 3.56Å; W182-F233 AromaticContact CE3-CZ 3.88Å; W182-F233 HydrophobicContact CE3-CZ 3.88Å; W182-F233 HydrophobicContact CZ3-CE1 4.15Å; W182-F233 HydrophobicContact CZ3-CZ 4.33Å; W189-F233 AromaticContact CE2-CD2 3.72Å; W189-F233 HydrophobicContact CH2-CD2 4.49Å; W189-F233 HydrophobicContact CH2-CE2 4.42Å; W189-F233 AromaticContact CZ2-CD2 3.65Å; W189-F233 HydrophobicContact CZ2-CD2 3.65Å; W189-F233 AromaticContact CZ2-CE2 3.98Å; W189-F233 HydrophobicContact CZ2-CE2 3.98Å; W189-F233 AromaticContact NE1-CD2 3.81Å; P229-F233 WeakPolarHBondContact O-CB 3.42Å; P229-F233 PolarHBondContact O-N 2.86Å; I230-F233 HydrophobicContact CD1-CD1 4.38Å; I230-F233 PolarHBondContact O-N 3.25Å; F233-K237 HydrophobicContact CD2-CB 4.1Å; F233-K237 HydrophobicContact CD2-CG 4.16Å; F233-K237 HydrophobicContact CE2-CB 4.42Å; F233-K237 HydrophobicContact CE2-CG 4.01Å; F233-K237 WeakPolarHBondContact O-CA 3.42Å; F233-K237 WeakPolarHBondContact O-CB 3.36Å; F233-K237 PolarHBondContact O-N 3.16Å; F233-V238 HydrophobicContact CD1-CG2 3.77Å; F233-V238 HydrophobicContact CE1-CG2 3.44Å; F233-V238 VanDerWaalsContact CE1-CG2 3.44Å; F233-V238 HydrophobicContact CG-CG2 4.45Å; F233-V238 HydrophobicContact CZ-CG2 3.89Å; F233-V238 WeakPolarHBondContact O-CG2 3.25Å; F233-V238 PolarHBondContact O-N 3.41Å
234	W	94.7	Very high	87.8	Confident	3 Å²	3	34 Å²	34	1%	0.011	19%	0.191	C	C	.	.	I	π-helix	trans	-65.4	-53.5	177.7	178.2	-110	0	0	0	112.6	W167 Y171 I230 I231 E232 V238 L239 P402 F406 I407	W167-W234 HydrophobicContact CB-CH2 4.48Å; W167-W234 HydrophobicContact CB-CZ3 4.32Å; W167-W234 AromaticContact CD2-CH2 3.64Å; W167-W234 HydrophobicContact CD2-CH2 3.64Å; W167-W234 HydrophobicContact CD2-CZ3 4.27Å; W167-W234 AromaticContact CE3-CH2 3.71Å; W167-W234 HydrophobicContact CE3-CH2 3.71Å; W167-W234 AromaticContact CG-CH2 4Å; W167-W234 HydrophobicContact CG-CH2 4Å; W167-W234 HydrophobicContact CG-CZ3 4.13Å; W167-W234 HydrophobicContact CZ2-CH2 4.48Å; W167-W234 HydrophobicContact CZ3-CH2 4.17Å; Y171-W234 AromaticContact CE2-CE3 3.86Å; Y171-W234 HydrophobicContact CE2-CE3 3.86Å; Y171-W234 AromaticContact CE2-CZ3 3.91Å; Y171-W234 HydrophobicContact CE2-CZ3 3.91Å; I230-W234 WeakPolarHBondContact O-CB 3.35Å; I230-W234 PolarHBondContact O-N 2.89Å; I231-W234 PolarHBondContact O-N 2.99Å; E232-W234 VanDerWaalsContact C-N 3.33Å; E232-W234 PolarHBondContact O-N 3.46Å; W234-V238 HydrophobicContact CE3-CB 4.11Å; W234-V238 HydrophobicContact CE3-CG1 3.9Å; W234-V238 HydrophobicContact CE3-CG2 4.46Å; W234-V238 HydrophobicContact CZ3-CG1 3.9Å; W234-L239 HydrophobicContact CD2-CD1 4.17Å; W234-L239 HydrophobicContact CD2-CG 4.25Å; W234-L239 HydrophobicContact CG-CD1 4.44Å; W234-L239 HydrophobicContact CH2-CD2 4.34Å; W234-L239 HydrophobicContact CZ2-CD1 3.85Å; W234-L239 HydrophobicContact CZ2-CD2 4.19Å; W234-L239 HydrophobicContact CZ2-CG 4.2Å; W234-L239 WeakPolarHBondContact O-CB 3.11Å; W234-L239 WeakPolarHBondContact O-CG 3.49Å; W234-L239 PolarHBondContact O-N 3.18Å; W234-P402 HydrophobicContact CZ2-CB 4.33Å; W234-F406 HydrophobicContact CD2-CB 4.19Å; W234-F406 HydrophobicContact CE3-CB 3.65Å; W234-F406 HydrophobicContact CE3-CG 4.24Å; W234-F406 HydrophobicContact CH2-CB 3.91Å; W234-F406 AromaticContact CH2-CD2 3.67Å; W234-F406 HydrophobicContact CH2-CD2 3.67Å; W234-F406 HydrophobicContact CH2-CE2 4.39Å; W234-F406 AromaticContact CH2-CG 3.84Å; W234-F406 HydrophobicContact CH2-CG 3.84Å; W234-F406 HydrophobicContact CZ2-CB 4.45Å; W234-F406 HydrophobicContact CZ2-CD2 4.46Å; W234-F406 HydrophobicContact CZ3-CB 3.48Å; W234-F406 VanDerWaalsContact CZ3-CB 3.48Å; W234-F406 HydrophobicContact CZ3-CD1 4.1Å; W234-F406 AromaticContact CZ3-CD2 3.9Å; W234-F406 HydrophobicContact CZ3-CD2 3.9Å; W234-F406 AromaticContact CZ3-CG 3.56Å; W234-F406 HydrophobicContact CZ3-CG 3.56Å; W234-I407 HydrophobicContact CB-CG1 4.23Å; W234-I407 HydrophobicContact CG-CD1 4.21Å; W234-I407 HydrophobicContact CG-CG1 4.1Å
235	E	92.8	Very high	89.3	Confident	13 Å²	13	31 Å²	31	6%	0.061	16%	0.164	C	C	.	.	I	π-helix	trans	-76	-44.8	-173.7	-66.9	-170.6	160.5	0	0	112.5	R227 I231 N240 I241 N568	R227-E235 IonicContact CZ-OE2 2.72Å; R227-E235 IonicContact NH1-OE2 3.34Å; R227-E235 PolarHBondContact NH1-OE2 3.36Å; R227-E235 IonicContact NH2-OE2 2.98Å; R227-E235 PolarHBondContact NH2-OE2 3.16Å; I231-E235 HydrophobicContact CG2-CG 4.31Å; I231-E235 WeakPolarHBondContact O-CB 3.11Å; I231-E235 PolarHBondContact O-N 3.37Å; E235-N240 CarbonylContact O-C 3.52Å; E235-N240 WeakPolarHBondContact O-CA 3.09Å; E235-N240 PolarHBondContact O-N 3.13Å; E235-I241 HydrophobicContact CB-CG2 4.01Å; E235-I241 HydrophobicContact CG-CG2 4.49Å; E235-I241 PolarHBondContact O-N 2.98Å; E235-N568 PolarHBondContact OE1-ND2 3.11Å
236	N	94.3	Very high	90.7	Very high	53 Å²	53	29.8 Å²	29.8	28%	0.283	16%	0.157	S	C	.	.	I	π-helix	trans	-92.7	-32.3	-171.4	-57.8	-14.2	0	0	0	113.2	W189 E232 N240	W189-N236 HydrophobicContact CB-CB 4.2Å; W189-N236 PolarHBondContact O-ND2 3.48Å; W189-N236 VanDerWaalsContact O-ND2 3.13Å; E232-N236 WeakPolarHBondContact O-CA 3.47Å; E232-N236 WeakPolarHBondContact O-CB 3.41Å; E232-N236 PolarHBondContact O-N 2.92Å; N236-N240 WeakPolarHBondContact O-CA 3.31Å
237	K	94.8	Very high	91.9	Very high	50 Å²	50	33.9 Å²	33.9	22%	0.217	17%	0.174	C	C	.	.	I	π-helix	trans	-101.3	-53.8	-177.4	-179.1	58	-175.8	170.6	0	113.6	W189 E232 F233 E254	W189-K237 HydrophobicContact CB-CB 3.9Å; W189-K237 HydrophobicContact CD2-CB 3.7Å; W189-K237 HydrophobicContact CD2-CD 4.18Å; W189-K237 HydrophobicContact CD2-CG 3.83Å; W189-K237 HydrophobicContact CE3-CB 4.09Å; W189-K237 HydrophobicContact CE3-CD 3.65Å; W189-K237 HydrophobicContact CE3-CG 3.73Å; W189-K237 HydrophobicContact CG-CB 3.62Å; W189-K237 HydrophobicContact CG-CG 4.29Å; W189-K237 HydrophobicContact CZ3-CD 4.12Å; W189-K237 HydrophobicContact CZ3-CG 4.15Å; E232-K237 PolarHBondContact O-N 3.32Å; F233-K237 HydrophobicContact CD2-CB 4.1Å; F233-K237 HydrophobicContact CD2-CG 4.16Å; F233-K237 HydrophobicContact CE2-CB 4.42Å; F233-K237 HydrophobicContact CE2-CG 4.01Å; F233-K237 WeakPolarHBondContact O-CA 3.42Å; F233-K237 WeakPolarHBondContact O-CB 3.36Å; F233-K237 PolarHBondContact O-N 3.16Å; K237-E254 IonicContact NZ-OE1 3.71Å; K237-E254 PolarHBondContact NZ-OE1 3.14Å; K237-E254 IonicContact NZ-OE2 2.71Å
238	V	95.4	Very high	92.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.177	C	C	.	.	I	π-helix	trans	-70.9	-59.3	-176.8	178.4	0	0	0	0	109.9	Y170 Y171 F233 W234 N252 L255	Y170-V238 HydrophobicContact CD1-CG1 4.46Å; Y170-V238 HydrophobicContact CD1-CG2 4.04Å; Y170-V238 HydrophobicContact CE1-CG2 3.74Å; Y171-V238 HydrophobicContact CE2-CG1 4.39Å; Y171-V238 HydrophobicContact CE2-CG2 3.94Å; F233-V238 HydrophobicContact CD1-CG2 3.77Å; F233-V238 HydrophobicContact CE1-CG2 3.44Å; F233-V238 VanDerWaalsContact CE1-CG2 3.44Å; F233-V238 HydrophobicContact CG-CG2 4.45Å; F233-V238 HydrophobicContact CZ-CG2 3.89Å; F233-V238 WeakPolarHBondContact O-CG2 3.25Å; F233-V238 PolarHBondContact O-N 3.41Å; W234-V238 HydrophobicContact CE3-CB 4.11Å; W234-V238 HydrophobicContact CE3-CG1 3.9Å; W234-V238 HydrophobicContact CE3-CG2 4.46Å; W234-V238 HydrophobicContact CZ3-CG1 3.9Å; V238-N252 PolarHBondContact O-ND2 3.44Å; V238-L255 HydrophobicContact CG1-CD1 4.28Å; V238-L255 HydrophobicContact CG1-CD2 4.28Å; V238-L255 WeakPolarHBondContact O-CD1 3.46Å
239	L	93.8	Very high	92.9	Very high	9 Å²	9	34 Å²	34	5%	0.047	20%	0.197	C	C	.	.	I	π-helix	trans	-81.6	-37.5	-179.5	-62.5	-178.7	0	0	0	112	W167 W234 I241 M487	W167-L239 HydrophobicContact CZ2-CD2 4.04Å; W234-L239 HydrophobicContact CD2-CD1 4.17Å; W234-L239 HydrophobicContact CD2-CG 4.25Å; W234-L239 HydrophobicContact CG-CD1 4.44Å; W234-L239 HydrophobicContact CH2-CD2 4.34Å; W234-L239 HydrophobicContact CZ2-CD1 3.85Å; W234-L239 HydrophobicContact CZ2-CD2 4.19Å; W234-L239 HydrophobicContact CZ2-CG 4.2Å; W234-L239 WeakPolarHBondContact O-CB 3.11Å; W234-L239 WeakPolarHBondContact O-CG 3.49Å; W234-L239 PolarHBondContact O-N 3.18Å; L239-I241 VanDerWaalsContact C-N 3.27Å; L239-I241 HydrophobicContact CB-CB 4.16Å; L239-I241 HydrophobicContact CD1-CD1 4.45Å; L239-M487 HydrophobicContact CD1-CB 4.08Å; L239-M487 HydrophobicContact CD1-CG 4.03Å; L239-M487 HydrophobicContact CD1-SD 4.31Å
240	N	93.9	Very high	93.2	Very high	75 Å²	75	43.9 Å²	43.9	40%	0.401	23%	0.234	S	C	.	.			trans	50.4	52.5	-167.2	-171.6	3.9	0	0	0	110.2	E235 N236 Q484	E235-N240 CarbonylContact O-C 3.52Å; E235-N240 WeakPolarHBondContact O-CA 3.09Å; E235-N240 PolarHBondContact O-N 3.13Å; N236-N240 WeakPolarHBondContact O-CA 3.31Å; N240-Q484 HydrophobicContact CB-CG 4.32Å; N240-Q484 VanDerWaalsContact CG-NE2 3.25Å; N240-Q484 PolarHBondContact ND2-NE2 2.95Å; N240-Q484 VanDerWaalsContact ND2-NE2 3.16Å; N240-Q484 WeakPolarHBondContact O-CB 3.32Å; N240-Q484 WeakPolarHBondContact O-CG 3.43Å; N240-Q484 PolarHBondContact O-NE2 3.43Å; N240-Q484 PolarHBondContact OD1-NE2 3.27Å; N240-Q484 VanDerWaalsContact OD1-NE2 3.14Å
241	I	92.6	Very high	93.4	Very high	38 Å²	38	47.9 Å²	47.9	20%	0.195	26%	0.255	C	S	.	.			trans	-64.5	135.9	-160.9	-164.6	168.6	0	0	0	112.2	E235 L239 Q484 M487 Y488 Y567	E235-I241 HydrophobicContact CB-CG2 4.01Å; E235-I241 HydrophobicContact CG-CG2 4.49Å; E235-I241 PolarHBondContact O-N 2.98Å; L239-I241 VanDerWaalsContact C-N 3.27Å; L239-I241 HydrophobicContact CB-CB 4.16Å; L239-I241 HydrophobicContact CD1-CD1 4.45Å; I241-Q484 WeakPolarHBondContact CA-O 3.37Å; I241-M487 HydrophobicContact CD1-CB 4.2Å; I241-M487 HydrophobicContact CD1-CG 4.47Å; I241-Y488 HydrophobicContact CD1-CE2 4.48Å; I241-Y488 HydrophobicContact CG1-CE2 4.22Å; I241-Y567 HydrophobicContact CD1-CD1 4.38Å; I241-Y567 HydrophobicContact CD1-CE1 3.55Å
242	S	94.3	Very high	93.7	Very high	18 Å²	18	46.8 Å²	46.8	13%	0.126	25%	0.25	C	C	.	.			trans	-83.1	170.9	175.7	72.6	0	0	0	0	112.5	G244 Q247 Q484 G485 Y488	S242-G244 PolarHBondContact O-N 3.21Å; S242-G244 PolarHBondContact OG-O 3.26Å; S242-G244 VanDerWaalsContact OG-O 3.11Å; S242-Q247 WeakPolarHBondContact CB-O 3.18Å; S242-Q247 PolarHBondContact OG-O 3.44Å; S242-Q484 PolarHBondContact N-O 3.49Å; S242-G485 VanDerWaalsContact OG-CA 3.25Å; S242-G485 WeakPolarHBondContact OG-CA 3.39Å; S242-G485 PolarHBondContact OG-N 3.47Å; S242-Y488 WeakPolarHBondContact O-CE2 3.46Å; S242-Y488 PolarHBondContact O-OH 2.9Å
243	S	91.3	Very high	93.9	Very high	76 Å²	76	54.3 Å²	54.3	53%	0.531	28%	0.278	S	S	.	.	S	Bend	trans	-65	-21.4	179.9	66.6	0	0	0	0	114.1	Q247	S243-Q247 PolarHBondContact OG-NE2 3.4Å; S243-Q247 PolarHBondContact OG-OE1 3.29Å
244	G	91.1	Very high	93.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.285	C	S	.	.			trans	178.9	173.1	-176.8	0	0	0	0	0	114.6	S242 D246 Q247 Y488 Y571	S242-G244 PolarHBondContact O-N 3.21Å; S242-G244 PolarHBondContact OG-O 3.26Å; S242-G244 VanDerWaalsContact OG-O 3.11Å; G244-D246 PolarHBondContact O-N 3.46Å; G244-Q247 CarbonylContact O-C 3.58Å; G244-Q247 PolarHBondContact O-N 2.9Å; G244-Q247 VanDerWaalsContact O-N 3.07Å; G244-Y488 VanDerWaalsContact CA-CE2 3.46Å; G244-Y571 VanDerWaalsContact CA-CE2 3.48Å
245	L	92.7	Very high	94.1	Very high	18 Å²	18	55.9 Å²	55.9	9%	0.094	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.1	179.5	-173.7	70.1	0	0	0	113.4	Q247 Y488 V489 L492 Y571 Y573 P574 W576	L245-Q247 PolarHBondContact O-N 3.36Å; L245-Y488 HydrophobicContact CB-CG 4.48Å; L245-V489 HydrophobicContact CD1-CG2 3.77Å; L245-L492 HydrophobicContact CD1-CD1 4.18Å; L245-L492 HydrophobicContact CD2-CD1 3.81Å; L245-Y571 PolarHBondContact N-OH 2.66Å; L245-Y573 HydrophobicContact CD2-CD1 4.12Å; L245-Y573 HydrophobicContact CD2-CE1 4.3Å; L245-P574 HydrophobicContact CD2-CG 4.38Å; L245-W576 HydrophobicContact CB-CH2 4.18Å; L245-W576 HydrophobicContact CB-CZ2 4.47Å; L245-W576 HydrophobicContact CD2-CE3 4.3Å; L245-W576 HydrophobicContact CD2-CH2 3.41Å; L245-W576 VanDerWaalsContact CD2-CH2 3.41Å; L245-W576 HydrophobicContact CD2-CZ2 4.09Å; L245-W576 HydrophobicContact CD2-CZ3 3.51Å; L245-W576 HydrophobicContact CG-CH2 3.49Å; L245-W576 VanDerWaalsContact CG-CH2 3.49Å; L245-W576 HydrophobicContact CG-CZ2 4.22Å; L245-W576 HydrophobicContact CG-CZ3 4.01Å
246	D	93.1	Very high	94.3	Very high	95 Å²	95	58.1 Å²	58.1	51%	0.508	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.3	176.1	59.6	-58.5	0	0	0	113.3	G244 P248 W576	G244-D246 PolarHBondContact O-N 3.46Å; D246-P248 VanDerWaalsContact O-CD 3.31Å; D246-P248 WeakPolarHBondContact O-CD 3.38Å; D246-W576 HydrophobicContact CB-CZ2 4.23Å
247	Q	93.5	Very high	94.5	Very high	99 Å²	99	59.3 Å²	59.3	46%	0.463	30%	0.303	S	S	.	.			trans	-119.6	79.3	-178.7	-64.9	178.3	23.1	0	0	109.8	S242 S243 G244 L245 G249	S242-Q247 WeakPolarHBondContact CB-O 3.18Å; S242-Q247 PolarHBondContact OG-O 3.44Å; S243-Q247 PolarHBondContact OG-NE2 3.4Å; S243-Q247 PolarHBondContact OG-OE1 3.29Å; G244-Q247 CarbonylContact O-C 3.58Å; G244-Q247 PolarHBondContact O-N 2.9Å; G244-Q247 VanDerWaalsContact O-N 3.07Å; L245-Q247 PolarHBondContact O-N 3.36Å; Q247-G249 PolarHBondContact O-N 3.49Å
248	P	90.5	Very high	94.6	Very high	73 Å²	73	57.4 Å²	57.4	47%	0.474	30%	0.295	S	S	.	.			trans	-61.4	-27.9	-179.6	23.7	-33.4	0	0	0	112.4	D246 T483 Q484 G485	D246-P248 VanDerWaalsContact O-CD 3.31Å; D246-P248 WeakPolarHBondContact O-CD 3.38Å; P248-T483 VanDerWaalsContact O-CB 3.23Å; P248-T483 WeakPolarHBondContact O-CB 3.4Å; P248-T483 PolarHBondContact O-OG1 3.5Å; P248-Q484 PolarHBondContact O-N 2.99Å; P248-Q484 VanDerWaalsContact O-N 3.13Å; P248-G485 PolarHBondContact O-N 3.4Å
249	G	94.8	Very high	94.8	Very high	48 Å²	48	57.4 Å²	57.4	50%	0.495	30%	0.295	S	S	.	.			trans	68.2	-148.7	179.1	0	0	0	0	0	112.7	Q247	Q247-G249 PolarHBondContact O-N 3.49Å
250	R	95.6	Very high	95	Very high	207 Å²	207	61.4 Å²	61.4	78%	0.781	32%	0.315	S	S	*	.			trans	-94.6	159.4	-179.2	-62.7	-178.4	179.9	178.5	0.9	111.6	T483 Q484	R250-T483 CarbonylContact O-C 3.53Å; R250-T483 WeakPolarHBondContact O-CA 3.4Å; R250-Q484 WeakPolarHBondContact O-CG 3.4Å; R250-Q484 PolarHBondContact O-N 3.08Å
251	I	96.1	Very high	95.2	Very high	85 Å²	85	59.6 Å²	59.6	44%	0.436	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-75.5	129	171.8	-64.5	174	0	0	0	109.1	W253 M256 V482 T483	I251-W253 PolarHBondContact O-N 2.97Å; I251-M256 HydrophobicContact CG2-CB 4.2Å; I251-M256 HydrophobicContact CG2-CG 4.49Å; I251-M256 HydrophobicContact CG2-SD 4.13Å; I251-V482 HydrophobicContact CG2-CG1 4Å; I251-T483 HydrophobicContact CG1-CG2 4.03Å
252	N	95.7	Very high	95.4	Very high	20 Å²	20	57.9 Å²	57.9	11%	0.107	30%	0.302	C	S	.	.			trans	-75.9	103	169.8	-172.1	-22.3	0	0	0	109.8	V238 E254 L255 M256 V482	V238-N252 PolarHBondContact O-ND2 3.44Å; N252-E254 VanDerWaalsContact C-N 3.3Å; N252-E254 PolarHBondContact O-N 3.23Å; N252-E254 PolarHBondContact OD1-N 3.11Å; N252-L255 HydrophobicContact CB-CB 4.25Å; N252-L255 HydrophobicContact CB-CD1 4.44Å; N252-L255 PolarHBondContact O-N 2.74Å; N252-M256 PolarHBondContact O-N 2.99Å; N252-V482 HydrophobicContact CB-CG1 4.43Å; N252-V482 PolarHBondContact N-O 3.14Å; N252-V482 WeakPolarHBondContact O-CG1 3.45Å
253	W	95.9	Very high	95.6	Very high	159 Å²	159	57.4 Å²	57.4	60%	0.602	30%	0.298	S	S	*	.	H	α-helix	trans	-64.3	-32.2	-174.5	71.8	-92.8	0	0	0	113.2	I251 M256 L257	I251-W253 PolarHBondContact O-N 2.97Å; W253-M256 PolarHBondContact O-N 2.98Å; W253-L257 HydrophobicContact CE3-CD1 3.63Å; W253-L257 HydrophobicContact CE3-CG 4.36Å; W253-L257 HydrophobicContact CZ3-CD1 3.61Å; W253-L257 WeakPolarHBondContact O-CG 3.48Å; W253-L257 PolarHBondContact O-N 3.22Å
254	E	96.2	Very high	95.9	Very high	34 Å²	34	57.2 Å²	57.2	16%	0.159	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-44.3	179.1	-62.4	-178.2	-154.5	0	0	110.1	Y170 K174 K237 N252 L257 C258	Y170-E254 HydrophobicContact CD2-CB 4.48Å; Y170-E254 HydrophobicContact CE2-CB 3.8Å; Y170-E254 WeakPolarHBondContact CE2-OE2 3.48Å; Y170-E254 PolarHBondContact OH-OE2 2.9Å; K174-E254 IonicContact NZ-OE2 3.29Å; K237-E254 IonicContact NZ-OE1 3.71Å; K237-E254 PolarHBondContact NZ-OE1 3.14Å; K237-E254 IonicContact NZ-OE2 2.71Å; N252-E254 VanDerWaalsContact C-N 3.3Å; N252-E254 PolarHBondContact O-N 3.23Å; N252-E254 PolarHBondContact OD1-N 3.11Å; E254-L257 PolarHBondContact O-N 2.83Å; E254-C258 PolarHBondContact O-N 3.27Å; E254-C258 PolarHBondContact O-SG 3.35Å
255	L	96.8	Very high	96.1	Very high	3 Å²	3	60.3 Å²	60.3	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-68.1	-36.3	174.7	-77.4	-174.4	0	0	0	112.3	Y170 V238 N252 L257 C258 L259 V482	Y170-L255 HydrophobicContact CD2-CD2 3.97Å; Y170-L255 HydrophobicContact CG-CD2 3.97Å; V238-L255 HydrophobicContact CG1-CD1 4.28Å; V238-L255 HydrophobicContact CG1-CD2 4.28Å; V238-L255 WeakPolarHBondContact O-CD1 3.46Å; N252-L255 HydrophobicContact CB-CB 4.25Å; N252-L255 HydrophobicContact CB-CD1 4.44Å; N252-L255 PolarHBondContact O-N 2.74Å; L255-L257 VanDerWaalsContact C-N 3.31Å; L255-L257 PolarHBondContact O-N 3.34Å; L255-C258 WeakPolarHBondContact O-CB 3.43Å; L255-C258 PolarHBondContact O-N 2.94Å; L255-C258 VanDerWaalsContact O-N 3.17Å; L255-L259 WeakPolarHBondContact O-CB 3.35Å; L255-L259 PolarHBondContact O-N 3.41Å; L255-V482 HydrophobicContact CB-CG1 3.82Å
256	M	97.6	Very high	96.3	Very high	61 Å²	61	59.4 Å²	59.4	30%	0.3	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-41.5	176.1	-174.8	-170.8	72	0	0	111.5	I251 N252 W253 L259 M260 F475 L479 V482	I251-M256 HydrophobicContact CG2-CB 4.2Å; I251-M256 HydrophobicContact CG2-CG 4.49Å; I251-M256 HydrophobicContact CG2-SD 4.13Å; N252-M256 PolarHBondContact O-N 2.99Å; W253-M256 PolarHBondContact O-N 2.98Å; M256-L259 PolarHBondContact O-N 2.86Å; M256-M260 WeakPolarHBondContact O-CB 3.32Å; M256-M260 PolarHBondContact O-N 3.5Å; M256-F475 HydrophobicContact CG-CZ 4.49Å; M256-L479 HydrophobicContact CG-CD2 3.82Å; M256-L479 HydrophobicContact SD-CD2 4.13Å; M256-V482 HydrophobicContact CB-CG1 3.91Å
257	L	97.9	Very high	96.5	Very high	78 Å²	78	57.3 Å²	57.3	41%	0.408	29%	0.29	S	S	.	.	H	α-helix	trans	-66	-40	175.2	-69	178.5	0	0	0	111.9	W253 E254 L255 M260 A261	W253-L257 HydrophobicContact CE3-CD1 3.63Å; W253-L257 HydrophobicContact CE3-CG 4.36Å; W253-L257 HydrophobicContact CZ3-CD1 3.61Å; W253-L257 WeakPolarHBondContact O-CG 3.48Å; W253-L257 PolarHBondContact O-N 3.22Å; E254-L257 PolarHBondContact O-N 2.83Å; L255-L257 VanDerWaalsContact C-N 3.31Å; L255-L257 PolarHBondContact O-N 3.34Å; L257-M260 HydrophobicContact CD2-CE 3.7Å; L257-M260 PolarHBondContact O-N 3.07Å; L257-A261 WeakPolarHBondContact O-CB 3.31Å; L257-A261 PolarHBondContact O-N 2.95Å
258	C	98.2	Very high	96.6	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-47	174.8	-65.6	0	0	0	0	111.1	A166 F169 E254 L255 M260 A261 V262	A166-C258 HydrophobicContact CB-CB 4.49Å; F169-C258 HydrophobicContact CD1-CB 3.98Å; E254-C258 PolarHBondContact O-N 3.27Å; E254-C258 PolarHBondContact O-SG 3.35Å; L255-C258 WeakPolarHBondContact O-CB 3.43Å; L255-C258 PolarHBondContact O-N 2.94Å; L255-C258 VanDerWaalsContact O-N 3.17Å; C258-M260 VanDerWaalsContact C-N 3.35Å; C258-M260 PolarHBondContact O-N 2.84Å; C258-A261 PolarHBondContact O-N 3.18Å; C258-V262 WeakPolarHBondContact O-CG2 3.04Å; C258-V262 PolarHBondContact O-N 2.61Å
259	L	98.3	Very high	96.7	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.4	-46.8	175.9	175	66.5	0	0	0	111.6	I162 M163 A166 L255 M256 A261 V262 W263 F475 D478 V482	I162-L259 HydrophobicContact CG1-CD1 4.04Å; I162-L259 HydrophobicContact CG2-CD1 3.8Å; M163-L259 HydrophobicContact SD-CD1 3.95Å; M163-L259 HydrophobicContact SD-CD2 4.24Å; A166-L259 HydrophobicContact CB-CB 4.13Å; A166-L259 HydrophobicContact CB-CD1 4.4Å; L255-L259 WeakPolarHBondContact O-CB 3.35Å; L255-L259 PolarHBondContact O-N 3.41Å; M256-L259 PolarHBondContact O-N 2.86Å; L259-A261 VanDerWaalsContact C-N 3.34Å; L259-A261 PolarHBondContact O-N 2.87Å; L259-V262 PolarHBondContact O-N 3.17Å; L259-W263 PolarHBondContact O-N 3.08Å; L259-F475 HydrophobicContact CD2-CD2 3.88Å; L259-F475 HydrophobicContact CD2-CE2 3.91Å; L259-F475 HydrophobicContact CG-CD2 3.9Å; L259-F475 HydrophobicContact CG-CE2 4.01Å; L259-D478 HydrophobicContact CD1-CB 4.16Å; L259-D478 HydrophobicContact CD2-CB 3.58Å; L259-D478 HydrophobicContact CG-CB 4.46Å; L259-V482 HydrophobicContact CB-CG2 4.45Å; L259-V482 HydrophobicContact CD2-CG2 3.54Å
260	M	98.3	Very high	96.6	Very high	93 Å²	93	51.8 Å²	51.8	46%	0.458	24%	0.244	S	C	.	.	H	α-helix	trans	-59.8	-44.4	176.6	-177.4	176.9	63.4	0	0	111.4	M256 L257 C258 V262 W263 V264 F475	M256-M260 WeakPolarHBondContact O-CB 3.32Å; M256-M260 PolarHBondContact O-N 3.5Å; L257-M260 HydrophobicContact CD2-CE 3.7Å; L257-M260 PolarHBondContact O-N 3.07Å; C258-M260 VanDerWaalsContact C-N 3.35Å; C258-M260 PolarHBondContact O-N 2.84Å; M260-V262 PolarHBondContact O-N 2.83Å; M260-W263 PolarHBondContact O-N 3.29Å; M260-V264 VanDerWaalsContact O-CG2 3.29Å; M260-V264 WeakPolarHBondContact O-CG2 3.42Å; M260-V264 PolarHBondContact O-N 2.96Å; M260-F475 HydrophobicContact CB-CE2 3.89Å; M260-F475 HydrophobicContact CB-CZ 4.31Å
261	A	98.2	Very high	96.4	Very high	38 Å²	38	45 Å²	45	31%	0.314	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-42.7	178.5	0	0	0	0	0	112.3	F169 L257 C258 L259 V264 L265	F169-A261 HydrophobicContact CD1-CB 4.33Å; F169-A261 HydrophobicContact CE1-CB 3.72Å; F169-A261 HydrophobicContact CZ-CB 4.4Å; L257-A261 WeakPolarHBondContact O-CB 3.31Å; L257-A261 PolarHBondContact O-N 2.95Å; C258-A261 PolarHBondContact O-N 3.18Å; L259-A261 VanDerWaalsContact C-N 3.34Å; L259-A261 PolarHBondContact O-N 2.87Å; A261-V264 PolarHBondContact O-N 3.39Å; A261-L265 PolarHBondContact O-N 2.93Å
262	V	98	Very high	96	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-66.8	-41.7	178.1	-179	0	0	0	0	111	I162 L165 F169 C258 L259 M260 V264 L265 V266 L431	I162-V262 HydrophobicContact CD1-CB 4.37Å; I162-V262 HydrophobicContact CD1-CG1 3.47Å; I162-V262 VanDerWaalsContact CD1-CG1 3.47Å; I162-V262 HydrophobicContact CG1-CG1 4.08Å; L165-V262 HydrophobicContact CB-CG1 3.61Å; L165-V262 HydrophobicContact CB-CG2 4.36Å; L165-V262 HydrophobicContact CD2-CG1 3.68Å; L165-V262 HydrophobicContact CG-CG1 4.34Å; F169-V262 HydrophobicContact CB-CG2 3.96Å; F169-V262 HydrophobicContact CD1-CG2 4.38Å; F169-V262 HydrophobicContact CG-CG2 4.24Å; C258-V262 WeakPolarHBondContact O-CG2 3.04Å; C258-V262 PolarHBondContact O-N 2.61Å; L259-V262 PolarHBondContact O-N 3.17Å; M260-V262 PolarHBondContact O-N 2.83Å; V262-V264 VanDerWaalsContact C-N 3.34Å; V262-V264 PolarHBondContact O-N 3.26Å; V262-L265 WeakPolarHBondContact O-CB 3.43Å; V262-L265 PolarHBondContact O-N 3.27Å; V262-L265 VanDerWaalsContact O-N 3.14Å; V262-V266 WeakPolarHBondContact O-CG2 3.36Å; V262-V266 PolarHBondContact O-N 2.82Å; V262-L431 HydrophobicContact CG2-CD1 4.42Å
263	W	98	Very high	95.6	Very high	9 Å²	9	45.8 Å²	45.8	3%	0.034	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-39.2	174.9	-89.9	115.7	0	0	0	113.1	I162 L259 M260 L265 V266 Y267 V442 C471 C474 F475 D478	I162-W263 HydrophobicContact CB-CZ2 4.12Å; I162-W263 HydrophobicContact CD1-CD2 4.22Å; I162-W263 HydrophobicContact CD1-CZ2 4.37Å; I162-W263 HydrophobicContact CG1-CD2 4.24Å; I162-W263 HydrophobicContact CG1-CG 4.42Å; I162-W263 HydrophobicContact CG1-CZ2 4.09Å; I162-W263 HydrophobicContact CG2-CZ2 3.99Å; L259-W263 PolarHBondContact O-N 3.08Å; M260-W263 PolarHBondContact O-N 3.29Å; W263-L265 VanDerWaalsContact C-N 3.31Å; W263-L265 PolarHBondContact O-N 2.83Å; W263-V266 HydrophobicContact CE3-CB 4.33Å; W263-V266 HydrophobicContact CE3-CG1 4.28Å; W263-V266 HydrophobicContact CZ3-CG1 4.18Å; W263-V266 PolarHBondContact O-N 3.33Å; W263-Y267 WeakPolarHBondContact O-CB 3.46Å; W263-Y267 PolarHBondContact O-N 3.5Å; W263-V442 HydrophobicContact CH2-CG2 4.29Å; W263-V442 HydrophobicContact CZ3-CG2 4Å; W263-C471 HydrophobicContact CD2-CB 4.32Å; W263-C471 HydrophobicContact CE3-CB 3.57Å; W263-C471 HydrophobicContact CZ3-CB 3.98Å; W263-C474 HydrophobicContact CH2-CB 3.46Å; W263-C474 VanDerWaalsContact CH2-CB 3.46Å; W263-C474 HydrophobicContact CZ2-CB 3.2Å; W263-C474 HydrophobicContact CZ3-CB 4.42Å; W263-F475 AromaticContact CD1-CD2 3.82Å; W263-F475 HydrophobicContact CG-CB 4.37Å; W263-D478 PolarHBondContact NE1-OD2 3.43Å
264	V	97.6	Very high	95	Very high	72 Å²	72	38.3 Å²	38.3	44%	0.436	19%	0.189	S	C	.	.	H	α-helix	trans	-61.6	-41.5	173.2	169.6	0	0	0	0	110.8	M260 A261 V262 Y267 F268	M260-V264 VanDerWaalsContact O-CG2 3.29Å; M260-V264 WeakPolarHBondContact O-CG2 3.42Å; M260-V264 PolarHBondContact O-N 2.96Å; A261-V264 PolarHBondContact O-N 3.39Å; V262-V264 VanDerWaalsContact C-N 3.34Å; V262-V264 PolarHBondContact O-N 3.26Å; V264-Y267 PolarHBondContact O-N 3.1Å; V264-F268 HydrophobicContact CG1-CD2 3.79Å; V264-F268 HydrophobicContact CG1-CE2 3.45Å; V264-F268 VanDerWaalsContact CG1-CE2 3.45Å; V264-F268 WeakPolarHBondContact O-CD2 3.35Å; V264-F268 PolarHBondContact O-N 3.01Å
265	L	96.1	Very high	94.4	Very high	64 Å²	64	41.3 Å²	41.3	34%	0.335	20%	0.202	S	C	.	.	H	α-helix	trans	-61	-49.3	175.5	-159.5	174.3	0	0	0	111	A261 V262 W263 Y267 F268 C269 L435	A261-L265 PolarHBondContact O-N 2.93Å; V262-L265 WeakPolarHBondContact O-CB 3.43Å; V262-L265 PolarHBondContact O-N 3.27Å; V262-L265 VanDerWaalsContact O-N 3.14Å; W263-L265 VanDerWaalsContact C-N 3.31Å; W263-L265 PolarHBondContact O-N 2.83Å; L265-Y267 VanDerWaalsContact C-N 3.34Å; L265-Y267 PolarHBondContact O-N 3.17Å; L265-F268 PolarHBondContact O-N 3.1Å; L265-C269 WeakPolarHBondContact CD2-SG 3.37Å; L265-C269 PolarHBondContact O-N 3.29Å; L265-C269 VanDerWaalsContact O-N 3.11Å; L265-C269 PolarHBondContact O-SG 3.36Å; L265-L435 HydrophobicContact CD1-CD1 3.78Å; L265-L435 HydrophobicContact CD2-CD1 3.33Å; L265-L435 HydrophobicContact CD2-CD2 3.63Å; L265-L435 HydrophobicContact CD2-CG 3.98Å; L265-L435 HydrophobicContact CG-CD1 4.05Å
266	V	96.6	Very high	93.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.1	-44.3	177.7	171.3	0	0	0	0	111.1	I162 V262 W263 F268 C269 V270 Q438 F439 V442	I162-V266 HydrophobicContact CD1-CG2 3.92Å; V262-V266 WeakPolarHBondContact O-CG2 3.36Å; V262-V266 PolarHBondContact O-N 2.82Å; W263-V266 HydrophobicContact CE3-CB 4.33Å; W263-V266 HydrophobicContact CE3-CG1 4.28Å; W263-V266 HydrophobicContact CZ3-CG1 4.18Å; W263-V266 PolarHBondContact O-N 3.33Å; V266-F268 PolarHBondContact O-N 2.88Å; V266-C269 WeakPolarHBondContact O-CB 3.28Å; V266-C269 PolarHBondContact O-N 2.9Å; V266-C269 VanDerWaalsContact O-N 3.08Å; V266-V270 HydrophobicContact CG1-CG2 4.46Å; V266-V270 WeakPolarHBondContact O-CG2 3.49Å; V266-V270 PolarHBondContact O-N 2.95Å; V266-Q438 HydrophobicContact CG1-CG 4.29Å; V266-Q438 HydrophobicContact CG2-CB 4.42Å; V266-Q438 HydrophobicContact CG2-CG 3.74Å; V266-F439 HydrophobicContact CG1-CB 4.36Å; V266-V442 HydrophobicContact CG1-CG2 4.08Å
267	Y	96.5	Very high	93.4	Very high	50 Å²	50	39.7 Å²	39.7	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-54.3	-51.3	176.8	171.7	-100.4	0	0	0	111.8	W263 V264 L265 C269 V270 W271 V467 A468	W263-Y267 WeakPolarHBondContact O-CB 3.46Å; W263-Y267 PolarHBondContact O-N 3.5Å; V264-Y267 PolarHBondContact O-N 3.1Å; L265-Y267 VanDerWaalsContact C-N 3.34Å; L265-Y267 PolarHBondContact O-N 3.17Å; Y267-C269 PolarHBondContact O-N 3.12Å; Y267-V270 PolarHBondContact O-N 2.98Å; Y267-V270 VanDerWaalsContact O-N 3.14Å; Y267-W271 HydrophobicContact CD1-CE3 4.42Å; Y267-W271 HydrophobicContact CE1-CB 4.3Å; Y267-W271 HydrophobicContact CE1-CD2 4.24Å; Y267-W271 AromaticContact CE1-CE3 3.53Å; Y267-W271 HydrophobicContact CE1-CE3 3.53Å; Y267-W271 HydrophobicContact CE1-CZ3 4.17Å; Y267-W271 HydrophobicContact CE2-CB 4.12Å; Y267-W271 AromaticContact CZ-CE3 3.88Å; Y267-W271 VanDerWaalsContact O-CB 3.29Å; Y267-W271 WeakPolarHBondContact O-CB 3.34Å; Y267-W271 PolarHBondContact O-N 3Å; Y267-V467 HydrophobicContact CD2-CB 4.36Å; Y267-V467 HydrophobicContact CD2-CG1 3.86Å; Y267-V467 HydrophobicContact CE2-CB 4.41Å; Y267-V467 HydrophobicContact CE2-CG1 4.38Å; Y267-A468 HydrophobicContact CD2-CB 4.23Å; Y267-A468 HydrophobicContact CE2-CB 3.7Å
268	F	94.8	Very high	92.8	Very high	98 Å²	98	36 Å²	36	43%	0.43	18%	0.177	S	C	.	.	H	α-helix	trans	-68.5	-20.5	179.9	-69.9	-58	0	0	0	113.8	V264 L265 V266 W271	V264-F268 HydrophobicContact CG1-CD2 3.79Å; V264-F268 HydrophobicContact CG1-CE2 3.45Å; V264-F268 VanDerWaalsContact CG1-CE2 3.45Å; V264-F268 WeakPolarHBondContact O-CD2 3.35Å; V264-F268 PolarHBondContact O-N 3.01Å; L265-F268 PolarHBondContact O-N 3.1Å; V266-F268 PolarHBondContact O-N 2.88Å; F268-W271 AromaticContact CD1-CD2 3.87Å; F268-W271 HydrophobicContact CD1-CD2 3.87Å; F268-W271 AromaticContact CD1-CE2 3.76Å; F268-W271 AromaticContact CD1-CE3 3.74Å; F268-W271 HydrophobicContact CD1-CE3 3.74Å; F268-W271 AromaticContact CD1-CH2 3.46Å; F268-W271 HydrophobicContact CD1-CH2 3.46Å; F268-W271 VanDerWaalsContact CD1-CH2 3.46Å; F268-W271 AromaticContact CD1-CZ2 3.58Å; F268-W271 HydrophobicContact CD1-CZ2 3.58Å; F268-W271 AromaticContact CD1-CZ3 3.55Å; F268-W271 HydrophobicContact CD1-CZ3 3.55Å; F268-W271 AromaticContact CE1-CE3 3.94Å; F268-W271 HydrophobicContact CE1-CE3 3.94Å; F268-W271 AromaticContact CE1-CH2 3.49Å; F268-W271 HydrophobicContact CE1-CH2 3.49Å; F268-W271 VanDerWaalsContact CE1-CH2 3.49Å; F268-W271 HydrophobicContact CE1-CZ2 4.11Å; F268-W271 AromaticContact CE1-CZ3 3.39Å; F268-W271 HydrophobicContact CE1-CZ3 3.39Å; F268-W271 PolarHBondContact O-NE1 3.23Å
269	C	93.1	Very high	92.3	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.041	21%	0.205	C	C	.	.	H	α-helix	trans	-73.8	-32.1	172.3	-66.2	0	0	0	0	112.8	L265 V266 Y267 T277 I280 F439	L265-C269 WeakPolarHBondContact CD2-SG 3.37Å; L265-C269 PolarHBondContact O-N 3.29Å; L265-C269 VanDerWaalsContact O-N 3.11Å; L265-C269 PolarHBondContact O-SG 3.36Å; V266-C269 WeakPolarHBondContact O-CB 3.28Å; V266-C269 PolarHBondContact O-N 2.9Å; V266-C269 VanDerWaalsContact O-N 3.08Å; Y267-C269 PolarHBondContact O-N 3.12Å; C269-T277 PolarHBondContact O-OG1 3.09Å; C269-I280 HydrophobicContact CB-CD1 4.19Å; C269-F439 HydrophobicContact CB-CB 4.12Å; C269-F439 HydrophobicContact CB-CD1 3.96Å; C269-F439 HydrophobicContact CB-CG 4.22Å
270	V	92.3	Very high	92	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-107	-27	-169.6	-174.8	0	0	0	0	113.9	V266 Y267 K272 G273 F439 V442 E443 V467	V266-V270 HydrophobicContact CG1-CG2 4.46Å; V266-V270 WeakPolarHBondContact O-CG2 3.49Å; V266-V270 PolarHBondContact O-N 2.95Å; Y267-V270 PolarHBondContact O-N 2.98Å; Y267-V270 VanDerWaalsContact O-N 3.14Å; V270-K272 PolarHBondContact O-N 3.25Å; V270-G273 WeakPolarHBondContact O-CA 3.48Å; V270-G273 PolarHBondContact O-N 3.04Å; V270-F439 HydrophobicContact CG2-CB 3.47Å; V270-F439 VanDerWaalsContact CG2-CB 3.47Å; V270-F439 WeakPolarHBondContact CG2-O 3.41Å; V270-V442 HydrophobicContact CG1-CG1 4.36Å; V270-E443 HydrophobicContact CG1-CB 4.31Å; V270-E443 VanDerWaalsContact CG1-OE2 3.26Å; V270-E443 WeakPolarHBondContact CG1-OE2 3.37Å; V270-V467 HydrophobicContact CB-CG1 4.04Å; V270-V467 HydrophobicContact CG1-CG1 4.08Å; V270-V467 HydrophobicContact CG1-CG2 3.97Å
271	W	91.4	Very high	91.7	Very high	66 Å²	66	40.5 Å²	40.5	25%	0.25	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-35.2	-169.3	66.9	-24.1	0	0	0	115.7	Y267 F268 E464	Y267-W271 HydrophobicContact CD1-CE3 4.42Å; Y267-W271 HydrophobicContact CE1-CB 4.3Å; Y267-W271 HydrophobicContact CE1-CD2 4.24Å; Y267-W271 AromaticContact CE1-CE3 3.53Å; Y267-W271 HydrophobicContact CE1-CE3 3.53Å; Y267-W271 HydrophobicContact CE1-CZ3 4.17Å; Y267-W271 HydrophobicContact CE2-CB 4.12Å; Y267-W271 AromaticContact CZ-CE3 3.88Å; Y267-W271 VanDerWaalsContact O-CB 3.29Å; Y267-W271 WeakPolarHBondContact O-CB 3.34Å; Y267-W271 PolarHBondContact O-N 3Å; F268-W271 AromaticContact CD1-CD2 3.87Å; F268-W271 HydrophobicContact CD1-CD2 3.87Å; F268-W271 AromaticContact CD1-CE2 3.76Å; F268-W271 AromaticContact CD1-CE3 3.74Å; F268-W271 HydrophobicContact CD1-CE3 3.74Å; F268-W271 AromaticContact CD1-CH2 3.46Å; F268-W271 HydrophobicContact CD1-CH2 3.46Å; F268-W271 VanDerWaalsContact CD1-CH2 3.46Å; F268-W271 AromaticContact CD1-CZ2 3.58Å; F268-W271 HydrophobicContact CD1-CZ2 3.58Å; F268-W271 AromaticContact CD1-CZ3 3.55Å; F268-W271 HydrophobicContact CD1-CZ3 3.55Å; F268-W271 AromaticContact CE1-CE3 3.94Å; F268-W271 HydrophobicContact CE1-CE3 3.94Å; F268-W271 AromaticContact CE1-CH2 3.49Å; F268-W271 HydrophobicContact CE1-CH2 3.49Å; F268-W271 VanDerWaalsContact CE1-CH2 3.49Å; F268-W271 HydrophobicContact CE1-CZ2 4.11Å; F268-W271 AromaticContact CE1-CZ3 3.39Å; F268-W271 HydrophobicContact CE1-CZ3 3.39Å; F268-W271 PolarHBondContact O-NE1 3.23Å; W271-E464 HydrophobicContact CB-CG 4.41Å; W271-E464 WeakPolarHBondContact O-CG 3.34Å
272	K	88.9	Confident	91.4	Very high	121 Å²	121	42.6 Å²	42.6	53%	0.526	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	6.4	179.6	-71.7	-179.4	-175.9	-179.1	0	113.7	V270	V270-K272 PolarHBondContact O-N 3.25Å
273	G	86.8	Confident	91.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	-163.2	179	0	0	0	0	0	115.2	V270 K275 S276 T277 R463	V270-G273 WeakPolarHBondContact O-CA 3.48Å; V270-G273 PolarHBondContact O-N 3.04Å; G273-K275 PolarHBondContact O-N 2.92Å; G273-S276 PolarHBondContact O-N 3.17Å; G273-T277 PolarHBondContact O-N 3.06Å; G273-T277 VanDerWaalsContact O-N 3.08Å; G273-T277 PolarHBondContact O-OG1 2.94Å; G273-R463 VanDerWaalsContact CA-NE 3.26Å; G273-R463 VanDerWaalsContact CA-NH2 3.28Å
274	V	83.9	Confident	91.1	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-53.4	-25.7	-170.7	-65.1	0	0	0	0	115.3	W68 G278 Y350	W68-V274 HydrophobicContact CD2-CB 4.43Å; W68-V274 HydrophobicContact CE3-CB 3.95Å; W68-V274 HydrophobicContact CH2-CB 3.76Å; W68-V274 HydrophobicContact CH2-CG1 3.65Å; W68-V274 HydrophobicContact CZ2-CB 4.24Å; W68-V274 HydrophobicContact CZ2-CG1 3.88Å; W68-V274 HydrophobicContact CZ3-CB 3.61Å; W68-V274 HydrophobicContact CZ3-CG1 4.06Å; V274-G278 WeakPolarHBondContact O-CA 3.5Å; V274-G278 PolarHBondContact O-N 3.21Å; V274-Y350 HydrophobicContact CG1-CD2 3.49Å; V274-Y350 VanDerWaalsContact CG1-CD2 3.49Å; V274-Y350 HydrophobicContact CG1-CE2 3.59Å; V274-Y350 HydrophobicContact CG1-CG 3.99Å; V274-Y350 HydrophobicContact CG2-CD1 4.42Å; V274-Y350 HydrophobicContact CG2-CG 4.38Å
275	K	83.8	Confident	90.9	Very high	97 Å²	97	44.1 Å²	44.1	42%	0.422	20%	0.198	S	C	.	.	H	α-helix	trans	-71.3	-31.8	176.2	-67	177.6	-176.1	152.9	0	113.5	E66 G273	E66-K275 IonicContact OE1-NZ 3.66Å; E66-K275 PolarHBondContact OE1-NZ 3.01Å; G273-K275 PolarHBondContact O-N 2.92Å
276	S	85.8	Confident	90.8	Very high	27 Å²	27	44 Å²	44	19%	0.189	20%	0.2	C	C	.	.	H	α-helix	trans	-84	-48.6	175	-172	0	0	0	0	109.8	G273 G278 K279 I280	G273-S276 PolarHBondContact O-N 3.17Å; S276-G278 VanDerWaalsContact C-N 3.33Å; S276-G278 PolarHBondContact O-N 3.08Å; S276-K279 PolarHBondContact O-N 3.34Å; S276-I280 PolarHBondContact O-N 2.64Å
277	T	86.6	Confident	90.7	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-55.4	-48	178.4	-50.1	0	0	0	0	111.4	C269 G273 K279 I280 V281 F439	C269-T277 PolarHBondContact O-OG1 3.09Å; G273-T277 PolarHBondContact O-N 3.06Å; G273-T277 VanDerWaalsContact O-N 3.08Å; G273-T277 PolarHBondContact O-OG1 2.94Å; T277-K279 PolarHBondContact O-N 3.22Å; T277-I280 PolarHBondContact O-N 3.08Å; T277-I280 VanDerWaalsContact O-N 3.09Å; T277-V281 HydrophobicContact CG2-CG1 4.31Å; T277-V281 VanDerWaalsContact O-CG1 3.3Å; T277-V281 WeakPolarHBondContact O-CG1 3.46Å; T277-V281 PolarHBondContact O-N 3.08Å; T277-V281 VanDerWaalsContact O-N 3.07Å; T277-F439 HydrophobicContact CG2-CD2 3.41Å; T277-F439 VanDerWaalsContact CG2-CD2 3.41Å; T277-F439 HydrophobicContact CG2-CE2 3.2Å; T277-F439 HydrophobicContact CG2-CG 4.47Å; T277-F439 HydrophobicContact CG2-CZ 4.08Å
278	G	85.6	Confident	90.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-16.7	178.6	0	0	0	0	0	115.1	V274 S276 V281 Y282	V274-G278 WeakPolarHBondContact O-CA 3.5Å; V274-G278 PolarHBondContact O-N 3.21Å; S276-G278 VanDerWaalsContact C-N 3.33Å; S276-G278 PolarHBondContact O-N 3.08Å; G278-V281 WeakPolarHBondContact O-CG2 3.02Å; G278-Y282 WeakPolarHBondContact O-CD2 3.18Å; G278-Y282 WeakPolarHBondContact O-CE2 3.39Å
279	K	88.9	Confident	90.6	Very high	148 Å²	148	42 Å²	42	64%	0.643	19%	0.191	S	C	*	.	H	α-helix	trans	-90.5	-39.2	173.3	-67.4	177.7	-176.9	179.4	0	112.3	S276 T277	S276-K279 PolarHBondContact O-N 3.34Å; T277-K279 PolarHBondContact O-N 3.22Å
280	I	91.1	Very high	90.8	Very high	50 Å²	50	45.2 Å²	45.2	26%	0.256	21%	0.21	S	C	.	.	H	α-helix	trans	-66.4	-41.2	-178.3	-65	167.8	0	0	0	110.1	C269 S276 T277 Y282 F283 T284	C269-I280 HydrophobicContact CB-CD1 4.19Å; S276-I280 PolarHBondContact O-N 2.64Å; T277-I280 PolarHBondContact O-N 3.08Å; T277-I280 VanDerWaalsContact O-N 3.09Å; I280-Y282 PolarHBondContact O-N 2.92Å; I280-F283 PolarHBondContact O-N 2.98Å; I280-T284 HydrophobicContact CG2-CG2 3.71Å; I280-T284 PolarHBondContact O-N 3.05Å; I280-T284 PolarHBondContact O-OG1 3.2Å
281	V	92.5	Very high	90.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-53.9	-28	180	-65.4	0	0	0	0	114.2	M76 T277 G278 F283 T284 A285 F439	M76-V281 HydrophobicContact CB-CB 4.32Å; M76-V281 HydrophobicContact CB-CG2 3.88Å; T277-V281 HydrophobicContact CG2-CG1 4.31Å; T277-V281 VanDerWaalsContact O-CG1 3.3Å; T277-V281 WeakPolarHBondContact O-CG1 3.46Å; T277-V281 PolarHBondContact O-N 3.08Å; T277-V281 VanDerWaalsContact O-N 3.07Å; G278-V281 WeakPolarHBondContact O-CG2 3.02Å; V281-F283 VanDerWaalsContact C-N 3.28Å; V281-F283 PolarHBondContact O-N 3.4Å; V281-T284 VanDerWaalsContact CA-OG1 3.26Å; V281-T284 WeakPolarHBondContact CA-OG1 3.41Å; V281-A285 WeakPolarHBondContact O-CB 3.48Å; V281-A285 PolarHBondContact O-N 2.64Å; V281-F439 HydrophobicContact CG1-CE2 3.72Å; V281-F439 HydrophobicContact CG1-CZ 3.41Å; V281-F439 VanDerWaalsContact CG1-CZ 3.41Å
282	Y	92.4	Very high	91.1	Very high	81 Å²	81	42.2 Å²	42.2	32%	0.318	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-35.7	178.9	-78.6	-87.2	0	0	0	112.2	M72 D73 M76 G278 I280 T286	M72-Y282 HydrophobicContact CB-CE1 4.35Å; M72-Y282 WeakPolarHBondContact CB-OH 3.02Å; D73-Y282 PolarHBondContact N-OH 2.6Å; D73-Y282 WeakPolarHBondContact OD1-CE2 3.4Å; D73-Y282 PolarHBondContact OD1-OH 3.33Å; M76-Y282 HydrophobicContact CG-CD1 4.3Å; M76-Y282 HydrophobicContact CG-CE1 4.14Å; G278-Y282 WeakPolarHBondContact O-CD2 3.18Å; G278-Y282 WeakPolarHBondContact O-CE2 3.39Å; I280-Y282 PolarHBondContact O-N 2.92Å; Y282-T286 WeakPolarHBondContact O-CB 3.46Å; Y282-T286 WeakPolarHBondContact O-CG2 3.29Å; Y282-T286 PolarHBondContact O-OG1 3.02Å
283	F	94.4	Very high	91.5	Very high	106 Å²	106	41 Å²	41	47%	0.465	20%	0.198	S	C	.	.	H	α-helix	trans	-82.5	-51	175.2	175.6	-102.1	0	0	0	110.4	I280 V281 A285 T286 F287 F428 L432	I280-F283 PolarHBondContact O-N 2.98Å; V281-F283 VanDerWaalsContact C-N 3.28Å; V281-F283 PolarHBondContact O-N 3.4Å; F283-A285 VanDerWaalsContact C-N 3.34Å; F283-A285 PolarHBondContact O-N 2.83Å; F283-T286 PolarHBondContact O-N 3.33Å; F283-T286 PolarHBondContact O-OG1 3.49Å; F283-F287 HydrophobicContact CD2-CB 4.49Å; F283-F287 HydrophobicContact CE2-CB 4.17Å; F283-F287 AromaticContact CE2-CD2 3.74Å; F283-F287 HydrophobicContact CE2-CD2 3.74Å; F283-F287 HydrophobicContact CE2-CG 4.18Å; F283-F287 HydrophobicContact CZ-CB 4.23Å; F283-F287 AromaticContact CZ-CD2 3.87Å; F283-F287 HydrophobicContact CZ-CD2 3.87Å; F283-F287 HydrophobicContact CZ-CE2 4.46Å; F283-F287 HydrophobicContact CZ-CG 4.05Å; F283-F287 VanDerWaalsContact O-CB 3.24Å; F283-F287 WeakPolarHBondContact O-CB 3.15Å; F283-F287 PolarHBondContact O-N 3.12Å; F283-F428 HydrophobicContact CE1-CE1 4.42Å; F283-F428 HydrophobicContact CE1-CZ 4.05Å; F283-F428 HydrophobicContact CZ-CE1 4.12Å; F283-F428 HydrophobicContact CZ-CZ 4.11Å; F283-L432 HydrophobicContact CD1-CD1 4.42Å; F283-L432 HydrophobicContact CE1-CD1 3.81Å; F283-L432 HydrophobicContact CE1-CD2 4.43Å; F283-L432 HydrophobicContact CZ-CD1 4.35Å
284	T	94.4	Very high	91.9	Very high	6 Å²	6	44.4 Å²	44.4	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-32.7	-170.6	54.8	0	0	0	0	112.8	I280 V281 P288 L432 L435 D436	I280-T284 HydrophobicContact CG2-CG2 3.71Å; I280-T284 PolarHBondContact O-N 3.05Å; I280-T284 PolarHBondContact O-OG1 3.2Å; V281-T284 VanDerWaalsContact CA-OG1 3.26Å; V281-T284 WeakPolarHBondContact CA-OG1 3.41Å; T284-P288 WeakPolarHBondContact O-CD 3.06Å; T284-P288 VanDerWaalsContact O-CG 3.28Å; T284-P288 WeakPolarHBondContact O-CG 3.3Å; T284-L432 HydrophobicContact CG2-CD2 3.96Å; T284-L435 HydrophobicContact CG2-CD2 4.16Å; T284-D436 WeakPolarHBondContact CB-OD1 3.33Å; T284-D436 PolarHBondContact OG1-OD1 3.43Å; T284-D436 PolarHBondContact OG1-OD2 3.01Å
285	A	92.9	Very high	92.4	Very high	3 Å²	3	44.5 Å²	44.5	3%	0.025	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-25.6	176.9	0	0	0	0	0	113.6	M76 V281 F283 Y289 D436	M76-A285 HydrophobicContact CE-CB 4.22Å; V281-A285 WeakPolarHBondContact O-CB 3.48Å; V281-A285 PolarHBondContact O-N 2.64Å; F283-A285 VanDerWaalsContact C-N 3.34Å; F283-A285 PolarHBondContact O-N 2.83Å; A285-Y289 WeakPolarHBondContact O-CD2 3.22Å; A285-Y289 WeakPolarHBondContact O-CE2 3.2Å; A285-D436 WeakPolarHBondContact CA-OD2 3.44Å; A285-D436 WeakPolarHBondContact CB-OD2 3.41Å; A285-D436 PolarHBondContact N-OD2 3.41Å
286	T	94.1	Very high	92.9	Very high	61 Å²	61	41.7 Å²	41.7	37%	0.374	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-37.3	-178.9	60.6	0	0	0	0	113.2	M76 Y282 F283 P288 Y289 V290	M76-T286 HydrophobicContact CE-CG2 3.26Å; Y282-T286 WeakPolarHBondContact O-CB 3.46Å; Y282-T286 WeakPolarHBondContact O-CG2 3.29Å; Y282-T286 PolarHBondContact O-OG1 3.02Å; F283-T286 PolarHBondContact O-N 3.33Å; F283-T286 PolarHBondContact O-OG1 3.49Å; T286-P288 VanDerWaalsContact C-N 3.34Å; T286-Y289 WeakPolarHBondContact O-CB 3.35Å; T286-Y289 PolarHBondContact O-N 2.92Å; T286-V290 PolarHBondContact O-N 3.19Å
287	F	94.9	Very high	93.4	Very high	45 Å²	45	44.8 Å²	44.8	20%	0.197	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-39.1	-175.9	-174.3	-87.5	0	0	0	113.2	F283 Y289 V290 V291 F428 L432	F283-F287 HydrophobicContact CD2-CB 4.49Å; F283-F287 HydrophobicContact CE2-CB 4.17Å; F283-F287 AromaticContact CE2-CD2 3.74Å; F283-F287 HydrophobicContact CE2-CD2 3.74Å; F283-F287 HydrophobicContact CE2-CG 4.18Å; F283-F287 HydrophobicContact CZ-CB 4.23Å; F283-F287 AromaticContact CZ-CD2 3.87Å; F283-F287 HydrophobicContact CZ-CD2 3.87Å; F283-F287 HydrophobicContact CZ-CE2 4.46Å; F283-F287 HydrophobicContact CZ-CG 4.05Å; F283-F287 VanDerWaalsContact O-CB 3.24Å; F283-F287 WeakPolarHBondContact O-CB 3.15Å; F283-F287 PolarHBondContact O-N 3.12Å; F287-Y289 VanDerWaalsContact C-N 3.25Å; F287-Y289 PolarHBondContact O-N 3.4Å; F287-V290 WeakPolarHBondContact O-CB 3.46Å; F287-V290 PolarHBondContact O-N 2.79Å; F287-V291 HydrophobicContact CD1-CG2 3.78Å; F287-V291 HydrophobicContact CE1-CG2 3.24Å; F287-V291 HydrophobicContact CZ-CG2 3.78Å; F287-V291 PolarHBondContact O-N 3.2Å; F287-F428 HydrophobicContact CD1-CD1 4.02Å; F287-F428 AromaticContact CD1-CE1 3.91Å; F287-F428 HydrophobicContact CD1-CE1 3.91Å; F287-F428 AromaticContact CE1-CD1 3.28Å; F287-F428 HydrophobicContact CE1-CD1 3.28Å; F287-F428 AromaticContact CE1-CE1 3.48Å; F287-F428 HydrophobicContact CE1-CE1 3.48Å; F287-F428 VanDerWaalsContact CE1-CE1 3.48Å; F287-F428 HydrophobicContact CE1-CG 4.5Å; F287-F428 HydrophobicContact CE2-CE1 4.33Å; F287-F428 HydrophobicContact CG-CE1 4.48Å; F287-F428 AromaticContact CZ-CD1 3.71Å; F287-F428 HydrophobicContact CZ-CD1 3.71Å; F287-F428 AromaticContact CZ-CE1 3.71Å; F287-F428 HydrophobicContact CZ-CE1 3.71Å; F287-L432 HydrophobicContact CB-CD1 3.8Å; F287-L432 HydrophobicContact CD1-CD1 3.54Å; F287-L432 HydrophobicContact CE1-CD1 4.41Å; F287-L432 HydrophobicContact CG-CD1 3.9Å
288	P	94.7	Very high	93.8	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-55.4	-37.2	173.3	-30.3	38	0	0	0	114.2	T284 T286 V290 V291 L292 M429 L432 L433	T284-P288 WeakPolarHBondContact O-CD 3.06Å; T284-P288 VanDerWaalsContact O-CG 3.28Å; T284-P288 WeakPolarHBondContact O-CG 3.3Å; T286-P288 VanDerWaalsContact C-N 3.34Å; P288-V290 VanDerWaalsContact C-N 3.35Å; P288-V290 PolarHBondContact O-N 2.81Å; P288-V291 PolarHBondContact O-N 3.23Å; P288-L292 WeakPolarHBondContact O-CB 3.26Å; P288-L292 VanDerWaalsContact O-CG 3.25Å; P288-L292 WeakPolarHBondContact O-CG 3.47Å; P288-L292 PolarHBondContact O-N 2.84Å; P288-M429 HydrophobicContact CB-CG 3.85Å; P288-M429 HydrophobicContact CG-CG 4.41Å; P288-L432 HydrophobicContact CG-CB 4.12Å; P288-L433 HydrophobicContact CB-CD1 4.27Å; P288-L433 HydrophobicContact CB-CD2 3.54Å; P288-L433 HydrophobicContact CB-CG 3.74Å; P288-L433 HydrophobicContact CG-CD2 3.7Å; P288-L433 HydrophobicContact CG-CG 3.78Å
289	Y	95.1	Very high	94.3	Very high	59 Å²	59	47.3 Å²	47.3	23%	0.231	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-38.7	176.1	-68	-85.7	0	0	0	112.3	V79 A285 T286 F287 V291 L292 I293 I367 T371	V79-Y289 HydrophobicContact CG1-CE2 4.41Å; A285-Y289 WeakPolarHBondContact O-CD2 3.22Å; A285-Y289 WeakPolarHBondContact O-CE2 3.2Å; T286-Y289 WeakPolarHBondContact O-CB 3.35Å; T286-Y289 PolarHBondContact O-N 2.92Å; F287-Y289 VanDerWaalsContact C-N 3.25Å; F287-Y289 PolarHBondContact O-N 3.4Å; Y289-V291 VanDerWaalsContact C-N 3.33Å; Y289-V291 PolarHBondContact O-N 3.21Å; Y289-L292 PolarHBondContact O-N 2.87Å; Y289-I293 WeakPolarHBondContact O-CD1 2.94Å; Y289-I293 VanDerWaalsContact O-CG1 3.25Å; Y289-I293 WeakPolarHBondContact O-CG1 3.43Å; Y289-I293 PolarHBondContact O-N 2.83Å; Y289-I367 WeakPolarHBondContact OH-CG2 3.46Å; Y289-T371 HydrophobicContact CE1-CG2 3.8Å; Y289-T371 WeakPolarHBondContact CE1-OG1 3.31Å; Y289-T371 PolarHBondContact OH-OG1 3.43Å
290	V	96.3	Very high	94.6	Very high	74 Å²	74	43.9 Å²	43.9	45%	0.448	22%	0.223	S	C	.	.	H	α-helix	trans	-59.9	-47.2	174.8	179.7	0	0	0	0	109.9	T286 F287 P288 I293 I294	T286-V290 PolarHBondContact O-N 3.19Å; F287-V290 WeakPolarHBondContact O-CB 3.46Å; F287-V290 PolarHBondContact O-N 2.79Å; P288-V290 VanDerWaalsContact C-N 3.35Å; P288-V290 PolarHBondContact O-N 2.81Å; V290-I293 PolarHBondContact O-N 3.39Å; V290-I294 HydrophobicContact CG1-CD1 3.99Å; V290-I294 WeakPolarHBondContact O-CG1 3.29Å; V290-I294 PolarHBondContact O-N 3.13Å
291	V	95.4	Very high	94.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-43.2	179.3	178.7	0	0	0	0	111.7	F287 P288 Y289 I293 I294 L295 L425 M429	F287-V291 HydrophobicContact CD1-CG2 3.78Å; F287-V291 HydrophobicContact CE1-CG2 3.24Å; F287-V291 HydrophobicContact CZ-CG2 3.78Å; F287-V291 PolarHBondContact O-N 3.2Å; P288-V291 PolarHBondContact O-N 3.23Å; Y289-V291 VanDerWaalsContact C-N 3.33Å; Y289-V291 PolarHBondContact O-N 3.21Å; V291-I293 VanDerWaalsContact C-N 3.29Å; V291-I293 PolarHBondContact O-N 3.05Å; V291-I294 PolarHBondContact O-N 2.98Å; V291-L295 HydrophobicContact CG1-CD1 3.62Å; V291-L295 HydrophobicContact CG1-CG 3.97Å; V291-L295 WeakPolarHBondContact O-CB 3.35Å; V291-L295 VanDerWaalsContact O-CG 3.28Å; V291-L295 WeakPolarHBondContact O-CG 3.36Å; V291-L295 PolarHBondContact O-N 3.2Å; V291-L425 HydrophobicContact CG1-CB 4.24Å; V291-M429 HydrophobicContact CB-CB 4.01Å; V291-M429 HydrophobicContact CB-CG 4.23Å; V291-M429 HydrophobicContact CB-SD 3.88Å; V291-M429 HydrophobicContact CG1-CB 3.84Å; V291-M429 HydrophobicContact CG1-CG 4.27Å; V291-M429 HydrophobicContact CG1-SD 3.69Å; V291-M429 HydrophobicContact CG2-CB 4.24Å
292	L	94.6	Very high	94.9	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-59.4	-39.1	176.5	-71.7	172.4	0	0	0	111.8	P288 Y289 L296 T371 F374 V378 M429	P288-L292 WeakPolarHBondContact O-CB 3.26Å; P288-L292 VanDerWaalsContact O-CG 3.25Å; P288-L292 WeakPolarHBondContact O-CG 3.47Å; P288-L292 PolarHBondContact O-N 2.84Å; Y289-L292 PolarHBondContact O-N 2.87Å; L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 PolarHBondContact O-N 3.38Å; L292-T371 HydrophobicContact CD1-CG2 4.31Å; L292-F374 HydrophobicContact CB-CD1 4.27Å; L292-F374 HydrophobicContact CB-CE1 3.7Å; L292-F374 HydrophobicContact CD1-CD1 4.43Å; L292-V378 HydrophobicContact CB-CG2 4.36Å; L292-V378 HydrophobicContact CD2-CB 4.42Å; L292-V378 HydrophobicContact CD2-CG1 4.32Å; L292-V378 HydrophobicContact CD2-CG2 4.14Å; L292-V378 WeakPolarHBondContact O-CG2 3.27Å; L292-M429 HydrophobicContact CD2-CE 4.17Å; L292-M429 HydrophobicContact CD2-SD 3.74Å; L292-M429 HydrophobicContact CG-SD 3.76Å
293	I	96.5	Very high	95	Very high	96 Å²	96	46.1 Å²	46.1	49%	0.492	25%	0.248	S	C	.	.	H	α-helix	trans	-65.3	-46.1	175.1	-68.8	164.5	0	0	0	110.9	Y289 V290 V291 L295 L296 V297 F374	Y289-I293 WeakPolarHBondContact O-CD1 2.94Å; Y289-I293 VanDerWaalsContact O-CG1 3.25Å; Y289-I293 WeakPolarHBondContact O-CG1 3.43Å; Y289-I293 PolarHBondContact O-N 2.83Å; V290-I293 PolarHBondContact O-N 3.39Å; V291-I293 VanDerWaalsContact C-N 3.29Å; V291-I293 PolarHBondContact O-N 3.05Å; I293-L295 VanDerWaalsContact C-N 3.35Å; I293-L295 PolarHBondContact O-N 3.18Å; I293-L296 PolarHBondContact O-N 3.42Å; I293-V297 WeakPolarHBondContact O-CG2 3.5Å; I293-V297 PolarHBondContact O-N 2.82Å; I293-F374 HydrophobicContact CG1-CE1 4.3Å; I293-F374 HydrophobicContact CG1-CZ 3.94Å
294	I	96	Very high	94.9	Very high	70 Å²	70	42 Å²	42	36%	0.359	24%	0.236	S	C	.	.	H	α-helix	trans	-60.4	-46.2	177.6	-70.2	167.5	0	0	0	110.7	V290 V291 L296 V297 R298 W422	V290-I294 HydrophobicContact CG1-CD1 3.99Å; V290-I294 WeakPolarHBondContact O-CG1 3.29Å; V290-I294 PolarHBondContact O-N 3.13Å; V291-I294 PolarHBondContact O-N 2.98Å; I294-L296 VanDerWaalsContact C-N 3.34Å; I294-V297 PolarHBondContact O-N 3.39Å; I294-R298 WeakPolarHBondContact O-CB 3.33Å; I294-R298 PolarHBondContact O-N 2.84Å; I294-W422 HydrophobicContact CG2-CZ3 3.97Å
295	L	93.8	Very high	94.9	Very high	4 Å²	4	42 Å²	42	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-67.4	-33.2	178.3	-70	173.5	0	0	0	112.1	V291 I293 G299 V378 Y409 W422 F426 M429	V291-L295 HydrophobicContact CG1-CD1 3.62Å; V291-L295 HydrophobicContact CG1-CG 3.97Å; V291-L295 WeakPolarHBondContact O-CB 3.35Å; V291-L295 VanDerWaalsContact O-CG 3.28Å; V291-L295 WeakPolarHBondContact O-CG 3.36Å; V291-L295 PolarHBondContact O-N 3.2Å; I293-L295 VanDerWaalsContact C-N 3.35Å; I293-L295 PolarHBondContact O-N 3.18Å; L295-G299 WeakPolarHBondContact O-CA 3.35Å; L295-G299 PolarHBondContact O-N 3Å; L295-V378 HydrophobicContact CB-CG1 3.58Å; L295-V378 HydrophobicContact CD1-CG1 4.4Å; L295-Y409 WeakPolarHBondContact CD1-OH 3.35Å; L295-Y409 WeakPolarHBondContact CD2-OH 3.19Å; L295-W422 HydrophobicContact CD2-CE3 4.1Å; L295-F426 HydrophobicContact CD1-CD2 4.38Å; L295-M429 HydrophobicContact CD1-CE 4.28Å; L295-M429 HydrophobicContact CD1-SD 4.42Å
296	L	95.6	Very high	95	Very high	38 Å²	38	49.6 Å²	49.6	20%	0.199	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-53	173	-176.1	61.2	0	0	0	110.6	L292 I293 I294 R298 G299 V300 F374 F377 V378	L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 PolarHBondContact O-N 3.38Å; I293-L296 PolarHBondContact O-N 3.42Å; I294-L296 VanDerWaalsContact C-N 3.34Å; L296-R298 PolarHBondContact O-N 3.44Å; L296-G299 PolarHBondContact O-N 3.35Å; L296-G299 VanDerWaalsContact O-N 3.14Å; L296-V300 HydrophobicContact CD1-CG1 3.86Å; L296-V300 HydrophobicContact CG-CG1 4.35Å; L296-V300 WeakPolarHBondContact O-CG1 3.18Å; L296-V300 WeakPolarHBondContact O-CG2 3.22Å; L296-V300 PolarHBondContact O-N 3.48Å; L296-F374 HydrophobicContact CB-CZ 4.43Å; L296-F374 HydrophobicContact CD2-CD2 4.38Å; L296-F374 HydrophobicContact CD2-CE2 3.41Å; L296-F374 VanDerWaalsContact CD2-CE2 3.41Å; L296-F374 HydrophobicContact CD2-CZ 3.69Å; L296-F377 HydrophobicContact CD1-CB 3.82Å; L296-V378 HydrophobicContact CB-CG2 3.96Å; L296-V378 HydrophobicContact CD1-CG2 4.26Å
297	V	96.3	Very high	94.9	Very high	91 Å²	91	51 Å²	51	55%	0.552	27%	0.271	S	S	*	.	H	α-helix	trans	-56.7	-44.8	179.4	172.4	0	0	0	0	109.8	I293 I294 V300 T301	I293-V297 WeakPolarHBondContact O-CG2 3.5Å; I293-V297 PolarHBondContact O-N 2.82Å; I294-V297 PolarHBondContact O-N 3.39Å; V297-V300 WeakPolarHBondContact O-CG2 3.26Å; V297-T301 WeakPolarHBondContact O-CG2 3.42Å; V297-T301 PolarHBondContact O-N 3.07Å; V297-T301 PolarHBondContact O-OG1 3.4Å
298	R	94.9	Very high	94.9	Very high	56 Å²	56	48.9 Å²	48.9	21%	0.211	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-50.2	175.5	-179	57.1	-177.7	146.5	-2.7	111.6	I294 L296 V300 T301 L302 M416 W422	I294-R298 WeakPolarHBondContact O-CB 3.33Å; I294-R298 PolarHBondContact O-N 2.84Å; L296-R298 PolarHBondContact O-N 3.44Å; R298-V300 PolarHBondContact O-N 2.81Å; R298-T301 PolarHBondContact NH1-OG1 3.24Å; R298-T301 PolarHBondContact O-N 3.18Å; R298-T301 VanDerWaalsContact O-N 3.11Å; R298-T301 PolarHBondContact O-OG1 3.38Å; R298-L302 VanDerWaalsContact CZ-CD2 3.47Å; R298-L302 PolarHBondContact O-N 3.31Å; R298-M416 HydrophobicContact CG-SD 4.41Å; R298-W422 HydrophobicContact CB-CH2 3.79Å; R298-W422 HydrophobicContact CB-CZ3 3.78Å; R298-W422 HydrophobicContact CG-CD2 4.46Å; R298-W422 HydrophobicContact CG-CE3 4.24Å; R298-W422 HydrophobicContact CG-CH2 3.58Å; R298-W422 HydrophobicContact CG-CZ2 3.82Å; R298-W422 HydrophobicContact CG-CZ3 3.8Å
299	G	94.6	Very high	94.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57.1	-46.5	-176.5	0	0	0	0	0	113	L295 L296 T301 L302 A305 S381	L295-G299 WeakPolarHBondContact O-CA 3.35Å; L295-G299 PolarHBondContact O-N 3Å; L296-G299 PolarHBondContact O-N 3.35Å; L296-G299 VanDerWaalsContact O-N 3.14Å; G299-T301 PolarHBondContact O-N 3.24Å; G299-L302 WeakPolarHBondContact O-CB 3.38Å; G299-L302 PolarHBondContact O-N 2.84Å; G299-A305 WeakPolarHBondContact O-CB 3.46Å; G299-S381 WeakPolarHBondContact CA-OG 3.38Å
300	V	96.7	Very high	94.9	Very high	76 Å²	76	50.7 Å²	50.7	46%	0.461	27%	0.273	S	S	.	.	H	α-helix	trans	-70.9	-17.7	179.4	-57.2	0	0	0	0	113.9	L296 V297 R298 I309	L296-V300 HydrophobicContact CD1-CG1 3.86Å; L296-V300 HydrophobicContact CG-CG1 4.35Å; L296-V300 WeakPolarHBondContact O-CG1 3.18Å; L296-V300 WeakPolarHBondContact O-CG2 3.22Å; L296-V300 PolarHBondContact O-N 3.48Å; V297-V300 WeakPolarHBondContact O-CG2 3.26Å; R298-V300 PolarHBondContact O-N 2.81Å; V300-I309 HydrophobicContact CG1-CD1 4.13Å
301	T	95.3	Very high	94.6	Very high	89 Å²	89	51.2 Å²	51.2	55%	0.546	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.4	174.8	64.8	0	0	0	0	113.5	V297 R298 G299	V297-T301 WeakPolarHBondContact O-CG2 3.42Å; V297-T301 PolarHBondContact O-N 3.07Å; V297-T301 PolarHBondContact O-OG1 3.4Å; R298-T301 PolarHBondContact NH1-OG1 3.24Å; R298-T301 PolarHBondContact O-N 3.18Å; R298-T301 VanDerWaalsContact O-N 3.11Å; R298-T301 PolarHBondContact O-OG1 3.38Å; G299-T301 PolarHBondContact O-N 3.24Å
302	L	94.4	Very high	94.6	Very high	13 Å²	13	51.2 Å²	51.2	7%	0.068	27%	0.268	C	S	.	.	S	Bend	trans	-81.1	149	180	-68.6	168.6	0	0	0	111.3	R298 G299 A305 F385 M416	R298-L302 VanDerWaalsContact CZ-CD2 3.47Å; R298-L302 PolarHBondContact O-N 3.31Å; G299-L302 WeakPolarHBondContact O-CB 3.38Å; G299-L302 PolarHBondContact O-N 2.84Å; L302-A305 WeakPolarHBondContact O-CB 3.41Å; L302-A305 PolarHBondContact O-N 3.48Å; L302-F385 HydrophobicContact CB-CB 3.78Å; L302-F385 HydrophobicContact CB-CD2 3.74Å; L302-F385 HydrophobicContact CB-CE2 4.49Å; L302-F385 HydrophobicContact CB-CG 3.8Å; L302-F385 HydrophobicContact CD1-CB 3.98Å; L302-F385 HydrophobicContact CD1-CD1 3.76Å; L302-F385 HydrophobicContact CD1-CD2 4.32Å; L302-F385 HydrophobicContact CD1-CE1 4.3Å; L302-F385 HydrophobicContact CD1-CG 3.75Å; L302-F385 HydrophobicContact CD2-CD2 4.07Å; L302-F385 HydrophobicContact CD2-CE1 4.44Å; L302-F385 HydrophobicContact CD2-CE2 4Å; L302-F385 HydrophobicContact CD2-CG 4.31Å; L302-F385 HydrophobicContact CD2-CZ 4.2Å; L302-F385 HydrophobicContact CG-CB 4.46Å; L302-F385 HydrophobicContact CG-CD2 4.26Å; L302-F385 HydrophobicContact CG-CG 4.16Å; L302-M416 HydrophobicContact CD1-CE 3.52Å; L302-M416 HydrophobicContact CD1-CG 4.34Å; L302-M416 HydrophobicContact CD1-SD 3.84Å
303	P	93.9	Very high	94.6	Very high	76 Å²	76	54.1 Å²	54.1	49%	0.494	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	147.1	173.8	27	-32.5	0	0	0	110.1	A305 F385	P303-A305 PolarHBondContact O-N 3.09Å; P303-F385 HydrophobicContact CG-CD2 3.79Å; P303-F385 HydrophobicContact CG-CE2 3.92Å; P303-F385 VanDerWaalsContact O-CA 3.24Å; P303-F385 WeakPolarHBondContact O-CA 3.48Å; P303-F385 WeakPolarHBondContact O-CB 3.5Å
304	G	92.8	Very high	94.4	Very high	21 Å²	21	56.2 Å²	56.2	22%	0.216	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	-9.7	179.7	0	0	0	0	0	116.1	Y306 N307 G308 G384	G304-Y306 PolarHBondContact O-N 3.3Å; G304-N307 WeakPolarHBondContact O-CB 3.41Å; G304-N307 PolarHBondContact O-N 2.88Å; G304-G308 PolarHBondContact O-N 2.84Å; G304-G384 CarbonylContact O-C 3.46Å
305	A	94.7	Very high	94.4	Very high	4 Å²	4	56.2 Å²	56.2	3%	0.033	29%	0.293	C	S	.	.	H	α-helix	trans	-55.5	-37.2	-179.2	0	0	0	0	0	113.6	G299 L302 P303 N307 G308 I309	G299-A305 WeakPolarHBondContact O-CB 3.46Å; L302-A305 WeakPolarHBondContact O-CB 3.41Å; L302-A305 PolarHBondContact O-N 3.48Å; P303-A305 PolarHBondContact O-N 3.09Å; A305-N307 VanDerWaalsContact C-N 3.33Å; A305-N307 PolarHBondContact O-N 3.35Å; A305-G308 PolarHBondContact O-N 3Å; A305-I309 WeakPolarHBondContact O-CG1 3.41Å; A305-I309 PolarHBondContact O-N 3.33Å
306	Y	94.5	Very high	94.4	Very high	163 Å²	163	59.4 Å²	59.4	64%	0.639	31%	0.31	S	S	*	.	H	α-helix	trans	-58.1	-43.1	176.3	178.4	-96.8	0	0	0	112.6	G304 I309 M310	G304-Y306 PolarHBondContact O-N 3.3Å; Y306-I309 PolarHBondContact O-N 3.01Å; Y306-M310 HydrophobicContact CE1-CE 4.16Å; Y306-M310 HydrophobicContact CE2-CE 4.15Å; Y306-M310 WeakPolarHBondContact O-CB 3.35Å; Y306-M310 PolarHBondContact O-N 2.6Å; Y306-M310 VanDerWaalsContact OH-CE 3.22Å; Y306-M310 WeakPolarHBondContact OH-CE 3.11Å
307	N	92.8	Very high	94.3	Very high	92 Å²	92	65.6 Å²	65.6	49%	0.492	33%	0.331	S	S	.	.	H	α-helix	trans	-64.3	-45.6	-179.9	-67.1	-22	0	0	0	110.4	G304 A305 M310 Y311	G304-N307 WeakPolarHBondContact O-CB 3.41Å; G304-N307 PolarHBondContact O-N 2.88Å; A305-N307 VanDerWaalsContact C-N 3.33Å; A305-N307 PolarHBondContact O-N 3.35Å; N307-M310 WeakPolarHBondContact O-CB 3.41Å; N307-M310 PolarHBondContact O-N 2.92Å; N307-Y311 VanDerWaalsContact O-CD2 3.29Å; N307-Y311 WeakPolarHBondContact O-CD2 3.42Å; N307-Y311 PolarHBondContact O-N 3.25Å
308	G	94	Very high	94.3	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.8	-47.2	176.3	0	0	0	0	0	112.9	G304 A305 M310 Y311 Y312 F380	G304-G308 PolarHBondContact O-N 2.84Å; A305-G308 PolarHBondContact O-N 3Å; G308-M310 VanDerWaalsContact C-N 3.29Å; G308-M310 PolarHBondContact O-N 2.9Å; G308-Y311 WeakPolarHBondContact O-CB 3.35Å; G308-Y311 PolarHBondContact O-N 2.93Å; G308-Y311 VanDerWaalsContact O-N 3.14Å; G308-Y312 PolarHBondContact O-N 3.09Å; G308-Y312 VanDerWaalsContact O-N 3.12Å; G308-F380 CarbonylContact C-O 3.6Å; G308-F380 VanDerWaalsContact CA-O 3.28Å; G308-F380 WeakPolarHBondContact CA-O 3.48Å; G308-F380 WeakPolarHBondContact O-CB 3.48Å; G308-F380 WeakPolarHBondContact O-CD1 3.23Å
309	I	95.7	Very high	94.1	Very high	33 Å²	33	64.7 Å²	64.7	17%	0.169	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-40.4	176.1	-67.2	168.3	0	0	0	111	V300 A305 Y306 Y311 Y312 I313 F377	V300-I309 HydrophobicContact CG1-CD1 4.13Å; A305-I309 WeakPolarHBondContact O-CG1 3.41Å; A305-I309 PolarHBondContact O-N 3.33Å; Y306-I309 PolarHBondContact O-N 3.01Å; I309-Y311 VanDerWaalsContact C-N 3.32Å; I309-Y311 PolarHBondContact O-N 3.06Å; I309-Y312 WeakPolarHBondContact O-CB 3.49Å; I309-Y312 PolarHBondContact O-N 2.82Å; I309-Y312 VanDerWaalsContact O-N 3.12Å; I309-I313 HydrophobicContact CG2-CD1 4.21Å; I309-I313 WeakPolarHBondContact O-CG1 3.25Å; I309-I313 PolarHBondContact O-N 3.05Å; I309-I313 VanDerWaalsContact O-N 3.11Å; I309-F377 HydrophobicContact CG1-CD1 4.39Å; I309-F377 HydrophobicContact CG2-CD1 3.87Å; I309-F377 HydrophobicContact CG2-CE1 3.86Å
310	M	94.2	Very high	94	Very high	64 Å²	64	66.9 Å²	66.9	32%	0.315	34%	0.342	S	S	.	.	H	α-helix	trans	-61.1	-42.5	175.7	-170.1	58.6	62.1	0	0	111.2	Y306 N307 G308 Y312 I313 K314	Y306-M310 HydrophobicContact CE1-CE 4.16Å; Y306-M310 HydrophobicContact CE2-CE 4.15Å; Y306-M310 WeakPolarHBondContact O-CB 3.35Å; Y306-M310 PolarHBondContact O-N 2.6Å; Y306-M310 VanDerWaalsContact OH-CE 3.22Å; Y306-M310 WeakPolarHBondContact OH-CE 3.11Å; N307-M310 WeakPolarHBondContact O-CB 3.41Å; N307-M310 PolarHBondContact O-N 2.92Å; G308-M310 VanDerWaalsContact C-N 3.29Å; G308-M310 PolarHBondContact O-N 2.9Å; M310-Y312 PolarHBondContact O-N 3.2Å; M310-I313 PolarHBondContact O-N 3.27Å; M310-K314 HydrophobicContact CG-CB 4.34Å; M310-K314 WeakPolarHBondContact O-CA 3.35Å; M310-K314 WeakPolarHBondContact O-CB 3.23Å; M310-K314 PolarHBondContact O-N 2.76Å; M310-K314 HydrophobicContact SD-CB 4.17Å
311	Y	90.5	Very high	93.7	Very high	86 Å²	86	66.8 Å²	66.8	34%	0.337	36%	0.357	S	S	.	.	H	α-helix	trans	-58.1	-34.4	173.8	-94.5	-78.8	0	0	0	113.3	Y96 N307 G308 I309 D393 V394	Y96-Y311 HydrophobicContact CD2-CD1 4.26Å; Y96-Y311 AromaticContact CE2-CD1 3.96Å; Y96-Y311 HydrophobicContact CE2-CD1 3.96Å; N307-Y311 VanDerWaalsContact O-CD2 3.29Å; N307-Y311 WeakPolarHBondContact O-CD2 3.42Å; N307-Y311 PolarHBondContact O-N 3.25Å; G308-Y311 WeakPolarHBondContact O-CB 3.35Å; G308-Y311 PolarHBondContact O-N 2.93Å; G308-Y311 VanDerWaalsContact O-N 3.14Å; I309-Y311 VanDerWaalsContact C-N 3.32Å; I309-Y311 PolarHBondContact O-N 3.06Å; Y311-D393 VanDerWaalsContact CZ-OD2 3.28Å; Y311-D393 VanDerWaalsContact OH-CG 3.22Å; Y311-D393 PolarHBondContact OH-OD1 3.43Å; Y311-D393 PolarHBondContact OH-OD2 3.34Å; Y311-V394 HydrophobicContact CD1-CB 4.42Å; Y311-V394 HydrophobicContact CD2-CB 3.59Å; Y311-V394 HydrophobicContact CD2-CG1 4.27Å; Y311-V394 HydrophobicContact CD2-CG2 3.55Å; Y311-V394 HydrophobicContact CE2-CB 3.93Å; Y311-V394 HydrophobicContact CE2-CG2 3.9Å; Y311-V394 HydrophobicContact CG-CB 3.87Å; Y311-V394 HydrophobicContact CG-CG1 4.17Å; Y311-V394 HydrophobicContact CG-CG2 4.28Å
312	Y	94.3	Very high	93.5	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-72.8	-39.9	178.3	173.9	-129.9	0	0	0	113.4	F91 C95 G100 G308 I309 M310 F373 F377 F380	F91-Y312 HydrophobicContact CE1-CE2 4.45Å; F91-Y312 WeakPolarHBondContact CE1-OH 3.48Å; C95-Y312 HydrophobicContact CB-CD2 3.91Å; C95-Y312 HydrophobicContact CB-CE2 3.51Å; C95-Y312 WeakPolarHBondContact SG-CE2 2.97Å; G100-Y312 CarbonylContact C-O 3.49Å; G100-Y312 WeakPolarHBondContact CA-O 3.37Å; G308-Y312 PolarHBondContact O-N 3.09Å; G308-Y312 VanDerWaalsContact O-N 3.12Å; I309-Y312 WeakPolarHBondContact O-CB 3.49Å; I309-Y312 PolarHBondContact O-N 2.82Å; I309-Y312 VanDerWaalsContact O-N 3.12Å; M310-Y312 PolarHBondContact O-N 3.2Å; Y312-F373 HydrophobicContact CE1-CD2 4.38Å; Y312-F373 HydrophobicContact CE1-CE2 4.18Å; Y312-F373 WeakPolarHBondContact OH-CA 3.46Å; Y312-F373 WeakPolarHBondContact OH-CD2 3.34Å; Y312-F373 PolarHBondContact OH-O 2.88Å; Y312-F377 HydrophobicContact CD1-CD1 4.37Å; Y312-F377 HydrophobicContact CD1-CE1 4.38Å; Y312-F377 HydrophobicContact CD1-CG 4.46Å; Y312-F377 HydrophobicContact CD1-CZ 4.47Å; Y312-F377 HydrophobicContact CE1-CD1 4.46Å; Y312-F377 AromaticContact CE1-CD2 3.89Å; Y312-F377 HydrophobicContact CE1-CD2 3.89Å; Y312-F377 HydrophobicContact CE1-CE1 4.43Å; Y312-F377 AromaticContact CE1-CE2 3.85Å; Y312-F377 HydrophobicContact CE1-CE2 3.85Å; Y312-F377 HydrophobicContact CE1-CG 4.2Å; Y312-F377 HydrophobicContact CE1-CZ 4.14Å; Y312-F380 AromaticContact CD2-CD2 3.99Å; Y312-F380 HydrophobicContact CD2-CD2 3.99Å; Y312-F380 HydrophobicContact CD2-CE2 4.19Å; Y312-F380 HydrophobicContact CG-CB 4.46Å; Y312-F380 HydrophobicContact CG-CD2 4.06Å; Y312-F380 HydrophobicContact CG-CG 4.23Å
313	I	94.9	Very high	93.1	Very high	65 Å²	65	67.9 Å²	67.9	33%	0.333	36%	0.364	S	S	.	.	H	α-helix	trans	-103.6	-18.4	-171	69.1	-177.5	0	0	0	114.4	G101 I309 M310 P315 F377	G101-I313 WeakPolarHBondContact CA-O 3.31Å; G101-I313 PolarHBondContact N-O 2.88Å; G101-I313 VanDerWaalsContact N-O 3.14Å; I309-I313 HydrophobicContact CG2-CD1 4.21Å; I309-I313 WeakPolarHBondContact O-CG1 3.25Å; I309-I313 PolarHBondContact O-N 3.05Å; I309-I313 VanDerWaalsContact O-N 3.11Å; M310-I313 PolarHBondContact O-N 3.27Å; I313-P315 WeakPolarHBondContact O-CD 3.33Å; I313-F377 HydrophobicContact CG2-CE1 4.06Å; I313-F377 HydrophobicContact CG2-CZ 4.07Å
314	K	93	Very high	92.9	Very high	139 Å²	139	68.2 Å²	68.2	60%	0.604	36%	0.358	S	S	*	.			trans	-62.5	121.8	-173.8	-175.9	179.1	-178.1	-176	0	110.1	M310	M310-K314 HydrophobicContact CG-CB 4.34Å; M310-K314 WeakPolarHBondContact O-CA 3.35Å; M310-K314 WeakPolarHBondContact O-CB 3.23Å; M310-K314 PolarHBondContact O-N 2.76Å; M310-K314 HydrophobicContact SD-CB 4.17Å
315	P	94.8	Very high	92.9	Very high	71 Å²	71	67.2 Å²	67.2	46%	0.461	35%	0.348	S	S	.	.			trans	-77.3	128.2	-174.7	28.8	-33.6	0	0	0	111.8	V102 I313	V102-P315 HydrophobicContact CG2-CB 3.38Å; I313-P315 WeakPolarHBondContact O-CD 3.33Å
316	D	93.8	Very high	92.7	Very high	70 Å²	70	71.4 Å²	71.4	37%	0.374	36%	0.363	S	S	.	.			trans	-113.5	100.8	164.3	-176	-3.2	0	0	0	110.1	G99 S318 K319	G99-D316 PolarHBondContact O-N 3.39Å; D316-S318 VanDerWaalsContact CG-OG 3.24Å; D316-S318 PolarHBondContact O-N 3.23Å; D316-S318 WeakPolarHBondContact OD1-CB 3.47Å; D316-S318 PolarHBondContact OD1-N 3.22Å; D316-S318 PolarHBondContact OD1-OG 3.38Å; D316-S318 PolarHBondContact OD2-OG 2.83Å; D316-K319 HydrophobicContact CB-CG 4.3Å; D316-K319 PolarHBondContact O-N 3.41Å
317	W	95.1	Very high	92.4	Very high	168 Å²	168	63.9 Å²	63.9	64%	0.636	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-68.3	-20.7	-176.2	-64.1	95.8	0	0	0	113.6	V102 I105 K319 L320	V102-W317 HydrophobicContact CG1-CE3 4.43Å; V102-W317 HydrophobicContact CG2-CD2 3.98Å; V102-W317 HydrophobicContact CG2-CE3 4.15Å; V102-W317 HydrophobicContact CG2-CG 4.34Å; I105-W317 HydrophobicContact CD1-CH2 4.24Å; I105-W317 HydrophobicContact CD1-CZ3 3.86Å; W317-K319 PolarHBondContact O-N 3.33Å; W317-L320 HydrophobicContact CE3-CD1 3.91Å; W317-L320 HydrophobicContact CZ3-CD1 4.19Å; W317-L320 PolarHBondContact O-N 3.08Å
318	S	94.9	Very high	92.3	Very high	78 Å²	78	60.1 Å²	60.1	55%	0.545	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-62.6	-29.7	178.8	70.6	0	0	0	0	111.7	D316 L320 G321	D316-S318 VanDerWaalsContact CG-OG 3.24Å; D316-S318 PolarHBondContact O-N 3.23Å; D316-S318 WeakPolarHBondContact OD1-CB 3.47Å; D316-S318 PolarHBondContact OD1-N 3.22Å; D316-S318 PolarHBondContact OD1-OG 3.38Å; D316-S318 PolarHBondContact OD2-OG 2.83Å; S318-L320 VanDerWaalsContact C-N 3.33Å; S318-L320 PolarHBondContact O-N 3.26Å; S318-G321 PolarHBondContact O-N 3.28Å
319	K	92.3	Very high	92.2	Very high	51 Å²	51	60.1 Å²	60.1	22%	0.222	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-66.5	-25.4	-177.9	-68.6	-56.2	-166.3	178.7	0	114.6	D316 W317 G321 E322 V325	D316-K319 HydrophobicContact CB-CG 4.3Å; D316-K319 PolarHBondContact O-N 3.41Å; W317-K319 PolarHBondContact O-N 3.33Å; K319-G321 PolarHBondContact O-N 3.27Å; K319-G321 VanDerWaalsContact O-N 3.17Å; K319-E322 VanDerWaalsContact CD-OE1 3.24Å; K319-E322 WeakPolarHBondContact CD-OE1 3.41Å; K319-E322 IonicContact NZ-OE1 3.5Å; K319-E322 PolarHBondContact NZ-OE1 2.97Å; K319-E322 IonicContact NZ-OE2 3.73Å; K319-E322 PolarHBondContact NZ-OE2 3.01Å; K319-E322 WeakPolarHBondContact O-CB 3.49Å; K319-E322 PolarHBondContact O-N 2.95Å; K319-V325 HydrophobicContact CB-CG2 4.2Å; K319-V325 VanDerWaalsContact O-CG2 3.23Å; K319-V325 WeakPolarHBondContact O-CG2 3.5Å
320	L	92.4	Very high	92	Very high	45 Å²	45	58.6 Å²	58.6	24%	0.236	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-63.4	-24.4	178.3	-72.6	175.2	0	0	0	113.8	V102 I105 P106 W317 S318 E322 W326	V102-L320 HydrophobicContact CG1-CD1 3.62Å; V102-L320 HydrophobicContact CG1-CD2 3.52Å; V102-L320 HydrophobicContact CG1-CG 3.27Å; I105-L320 HydrophobicContact CD1-CD1 4.35Å; P106-L320 HydrophobicContact CG-CD2 4.33Å; W317-L320 HydrophobicContact CE3-CD1 3.91Å; W317-L320 HydrophobicContact CZ3-CD1 4.19Å; W317-L320 PolarHBondContact O-N 3.08Å; S318-L320 VanDerWaalsContact C-N 3.33Å; S318-L320 PolarHBondContact O-N 3.26Å; L320-E322 PolarHBondContact O-N 3.43Å; L320-W326 PolarHBondContact O-NE1 3.48Å
321	G	90.1	Very high	91.7	Very high	75 Å²	75	56 Å²	56	77%	0.773	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-73.6	-14.2	175.7	0	0	0	0	0	113.8	S318 K319	S318-G321 PolarHBondContact O-N 3.28Å; K319-G321 PolarHBondContact O-N 3.27Å; K319-G321 VanDerWaalsContact O-N 3.17Å
322	E	90	Very high	91.8	Very high	77 Å²	77	51.9 Å²	51.9	36%	0.36	28%	0.278	S	S	.	.			trans	-86.7	123.4	-177.8	-64.5	178.7	-164.3	0	0	111	K319 L320 Q324 V325	K319-E322 VanDerWaalsContact CD-OE1 3.24Å; K319-E322 WeakPolarHBondContact CD-OE1 3.41Å; K319-E322 IonicContact NZ-OE1 3.5Å; K319-E322 PolarHBondContact NZ-OE1 2.97Å; K319-E322 IonicContact NZ-OE2 3.73Å; K319-E322 PolarHBondContact NZ-OE2 3.01Å; K319-E322 WeakPolarHBondContact O-CB 3.49Å; K319-E322 PolarHBondContact O-N 2.95Å; L320-E322 PolarHBondContact O-N 3.43Å; E322-Q324 PolarHBondContact O-N 2.99Å; E322-V325 HydrophobicContact CB-CG2 4.07Å; E322-V325 WeakPolarHBondContact O-CB 2.99Å; E322-V325 PolarHBondContact O-N 3.42Å; E322-V325 VanDerWaalsContact O-N 3.16Å
323	A	87.3	Confident	91.7	Very high	48 Å²	48	51.9 Å²	51.9	40%	0.397	28%	0.278	S	S	.	.	H	α-helix	trans	-59.2	-32.4	178.6	0	0	0	0	0	112.9	V325 W326 I327	A323-V325 PolarHBondContact O-N 3.36Å; A323-W326 PolarHBondContact O-N 3.11Å; A323-W326 VanDerWaalsContact O-N 3.13Å; A323-I327 WeakPolarHBondContact O-CG1 3.32Å; A323-I327 PolarHBondContact O-N 3Å
324	Q	88.4	Confident	91.5	Very high	82 Å²	82	48.8 Å²	48.8	38%	0.383	26%	0.262	S	S	.	.	H	α-helix	trans	-59.1	-33.5	179.5	-169.1	62.4	44.7	0	0	112.5	E322 W326 I327 D328	E322-Q324 PolarHBondContact O-N 2.99Å; Q324-W326 VanDerWaalsContact C-N 3.28Å; Q324-W326 PolarHBondContact O-N 3.28Å; Q324-I327 PolarHBondContact O-N 3.26Å; Q324-D328 PolarHBondContact NE2-OD1 3.32Å; Q324-D328 WeakPolarHBondContact O-CB 3.19Å; Q324-D328 PolarHBondContact O-N 3.08Å
325	V	92.2	Very high	91.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-40	178.8	171	0	0	0	0	111.2	N98 F103 P106 K319 E322 A323 A329	N98-V325 HydrophobicContact CB-CB 4.41Å; N98-V325 HydrophobicContact CB-CG1 4.15Å; N98-V325 HydrophobicContact CB-CG2 3.86Å; F103-V325 HydrophobicContact CD2-CG1 4.09Å; P106-V325 HydrophobicContact CG-CG1 3.83Å; K319-V325 HydrophobicContact CB-CG2 4.2Å; K319-V325 VanDerWaalsContact O-CG2 3.23Å; K319-V325 WeakPolarHBondContact O-CG2 3.5Å; E322-V325 HydrophobicContact CB-CG2 4.07Å; E322-V325 WeakPolarHBondContact O-CB 2.99Å; E322-V325 PolarHBondContact O-N 3.42Å; E322-V325 VanDerWaalsContact O-N 3.16Å; A323-V325 PolarHBondContact O-N 3.36Å; V325-A329 WeakPolarHBondContact O-CB 3.44Å; V325-A329 PolarHBondContact O-N 2.89Å
326	W	90.9	Very high	91.1	Very high	92 Å²	92	40.9 Å²	40.9	35%	0.348	22%	0.221	S	C	.	.	H	α-helix	trans	-74.4	-35.9	178.6	-63.5	87.5	0	0	0	112.3	P106 L109 L320 A323 Q324 G330	P106-W326 HydrophobicContact CB-CD2 3.85Å; P106-W326 HydrophobicContact CB-CE3 3.54Å; P106-W326 HydrophobicContact CB-CH2 4.04Å; P106-W326 HydrophobicContact CB-CZ2 4.31Å; P106-W326 HydrophobicContact CB-CZ3 3.64Å; L109-W326 HydrophobicContact CD1-CZ3 4.38Å; L109-W326 HydrophobicContact CD2-CZ3 4.46Å; L320-W326 PolarHBondContact O-NE1 3.48Å; A323-W326 PolarHBondContact O-N 3.11Å; A323-W326 VanDerWaalsContact O-N 3.13Å; Q324-W326 VanDerWaalsContact C-N 3.28Å; Q324-W326 PolarHBondContact O-N 3.28Å; W326-G330 PolarHBondContact O-N 2.98Å
327	I	88	Confident	91	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-65.1	-46.6	174.1	-60.9	169.9	0	0	0	110.1	A323 Q324 A329 G330 T331 I554 F557	A323-I327 WeakPolarHBondContact O-CG1 3.32Å; A323-I327 PolarHBondContact O-N 3Å; Q324-I327 PolarHBondContact O-N 3.26Å; I327-A329 PolarHBondContact O-N 3.38Å; I327-G330 PolarHBondContact O-N 3.49Å; I327-T331 HydrophobicContact CG2-CG2 4.23Å; I327-T331 WeakPolarHBondContact O-CB 3.25Å; I327-T331 WeakPolarHBondContact O-CG2 3.48Å; I327-T331 PolarHBondContact O-N 3.48Å; I327-T331 PolarHBondContact O-OG1 2.92Å; I327-I554 HydrophobicContact CB-CG2 4.37Å; I327-I554 HydrophobicContact CG1-CG2 4.27Å; I327-I554 HydrophobicContact CG2-CG2 4.17Å; I327-F557 HydrophobicContact CD1-CB 3.94Å; I327-F557 HydrophobicContact CG1-CB 4.36Å
328	D	90.7	Very high	90.8	Very high	13 Å²	13	30 Å²	30	7%	0.07	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-43.3	178.7	-76.3	2.7	0	0	0	110.6	L94 K97 N98 F103 Q324 T331 Q332	L94-D328 HydrophobicContact CD2-CB 4.07Å; K97-D328 IonicContact NZ-OD2 3.82Å; K97-D328 PolarHBondContact NZ-OD2 3.01Å; K97-D328 VanDerWaalsContact NZ-OD2 3.14Å; N98-D328 VanDerWaalsContact ND2-CB 3.34Å; N98-D328 WeakPolarHBondContact ND2-CB 3.38Å; N98-D328 PolarHBondContact ND2-OD2 3.46Å; F103-D328 HydrophobicContact CE2-CB 4.33Å; Q324-D328 PolarHBondContact NE2-OD1 3.32Å; Q324-D328 WeakPolarHBondContact O-CB 3.19Å; Q324-D328 PolarHBondContact O-N 3.08Å; D328-T331 PolarHBondContact O-OG1 3.44Å; D328-Q332 WeakPolarHBondContact O-CB 3.19Å; D328-Q332 PolarHBondContact O-N 3.17Å
329	A	93.1	Very high	90.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-45.3	174.8	0	0	0	0	0	112.3	F103 P106 I110 V325 I327 I333	F103-A329 HydrophobicContact CE2-CB 3.72Å; F103-A329 HydrophobicContact CZ-CB 4Å; P106-A329 HydrophobicContact CB-CB 4Å; P106-A329 HydrophobicContact CG-CB 4.4Å; I110-A329 HydrophobicContact CD1-CB 3.79Å; V325-A329 WeakPolarHBondContact O-CB 3.44Å; V325-A329 PolarHBondContact O-N 2.89Å; I327-A329 PolarHBondContact O-N 3.38Å; A329-I333 WeakPolarHBondContact O-CG1 3.33Å; A329-I333 PolarHBondContact O-N 2.71Å; A329-I333 VanDerWaalsContact O-N 3.1Å
330	G	91.1	Very high	90.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.4	-59.4	177.8	0	0	0	0	0	113	I110 W326 I327 Q332 I333 F334	I110-G330 VanDerWaalsContact CD1-CA 3.48Å; I110-G330 VanDerWaalsContact CD1-N 3.29Å; W326-G330 PolarHBondContact O-N 2.98Å; I327-G330 PolarHBondContact O-N 3.49Å; G330-Q332 VanDerWaalsContact C-N 3.26Å; G330-Q332 PolarHBondContact O-N 2.93Å; G330-I333 PolarHBondContact O-N 3.05Å; G330-I333 VanDerWaalsContact O-N 3.17Å; G330-F334 WeakPolarHBondContact O-CD2 3.49Å; G330-F334 PolarHBondContact O-N 3.48Å; G330-F334 VanDerWaalsContact O-N 3.1Å
331	T	88	Confident	90.6	Very high	9 Å²	9	22.3 Å²	22.3	6%	0.055	13%	0.131	C	C	.	.	H	α-helix	trans	-61.8	-35.9	-178.6	57.8	0	0	0	0	112	I327 D328 F335 L504	I327-T331 HydrophobicContact CG2-CG2 4.23Å; I327-T331 WeakPolarHBondContact O-CB 3.25Å; I327-T331 WeakPolarHBondContact O-CG2 3.48Å; I327-T331 PolarHBondContact O-N 3.48Å; I327-T331 PolarHBondContact O-OG1 2.92Å; D328-T331 PolarHBondContact O-OG1 3.44Å; T331-F335 WeakPolarHBondContact O-CB 3.25Å; T331-F335 PolarHBondContact O-N 3.47Å; T331-L504 HydrophobicContact CG2-CD1 4.32Å
332	Q	92.4	Very high	90.6	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-45.1	174.4	178.9	60.7	26.6	0	0	112.2	R90 F91 L94 Y107 D328 G330 S336	R90-Q332 VanDerWaalsContact CG-OE1 3.31Å; F91-Q332 HydrophobicContact CD2-CG 4.25Å; L94-Q332 HydrophobicContact CD1-CB 3.8Å; L94-Q332 HydrophobicContact CD1-CG 4.08Å; Y107-Q332 HydrophobicContact CE2-CG 4.05Å; D328-Q332 WeakPolarHBondContact O-CB 3.19Å; D328-Q332 PolarHBondContact O-N 3.17Å; G330-Q332 VanDerWaalsContact C-N 3.26Å; G330-Q332 PolarHBondContact O-N 2.93Å; Q332-S336 WeakPolarHBondContact O-CB 3.39Å; Q332-S336 PolarHBondContact O-N 2.9Å
333	I	93.1	Very high	90.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.9	-47.7	179.5	-70.9	-61.4	0	0	0	111.3	Y107 I110 V111 A329 G330 F335 S336 Y337	Y107-I333 HydrophobicContact CD1-CD1 4.41Å; Y107-I333 HydrophobicContact CD2-CD1 3.68Å; Y107-I333 HydrophobicContact CD2-CG1 4.01Å; Y107-I333 HydrophobicContact CE1-CD1 3.98Å; Y107-I333 HydrophobicContact CE2-CD1 3.17Å; Y107-I333 HydrophobicContact CE2-CG1 3.93Å; Y107-I333 HydrophobicContact CG-CD1 4.28Å; I110-I333 HydrophobicContact CB-CG1 4.26Å; I110-I333 HydrophobicContact CG2-CB 3.76Å; I110-I333 HydrophobicContact CG2-CG1 3.8Å; I110-I333 HydrophobicContact CG2-CG2 3.96Å; V111-I333 HydrophobicContact CG2-CD1 3.36Å; V111-I333 HydrophobicContact CG2-CG1 4.21Å; A329-I333 WeakPolarHBondContact O-CG1 3.33Å; A329-I333 PolarHBondContact O-N 2.71Å; A329-I333 VanDerWaalsContact O-N 3.1Å; G330-I333 PolarHBondContact O-N 3.05Å; G330-I333 VanDerWaalsContact O-N 3.17Å; I333-F335 VanDerWaalsContact C-N 3.32Å; I333-F335 PolarHBondContact O-N 3.05Å; I333-S336 PolarHBondContact O-N 3.34Å; I333-Y337 HydrophobicContact CD1-CD2 4.42Å; I333-Y337 HydrophobicContact CD1-CE2 3.95Å; I333-Y337 HydrophobicContact CG2-CD2 4.14Å; I333-Y337 HydrophobicContact CG2-CE2 4.39Å; I333-Y337 VanDerWaalsContact O-CB 3.32Å; I333-Y337 WeakPolarHBondContact O-CB 3.32Å; I333-Y337 WeakPolarHBondContact O-CD2 3.43Å; I333-Y337 PolarHBondContact O-N 3.08Å
334	F	90.7	Very high	91.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.9	-41.1	-177	-80	-116.4	0	0	0	111.3	I110 I118 G330 A338 I339 L504 S507 C551	I110-F334 HydrophobicContact CG2-CE2 4.35Å; I118-F334 HydrophobicContact CD1-CD1 4.35Å; I118-F334 HydrophobicContact CD1-CE1 3.36Å; I118-F334 HydrophobicContact CD1-CZ 3.48Å; I118-F334 VanDerWaalsContact CD1-CZ 3.48Å; G330-F334 WeakPolarHBondContact O-CD2 3.49Å; G330-F334 PolarHBondContact O-N 3.48Å; G330-F334 VanDerWaalsContact O-N 3.1Å; F334-A338 PolarHBondContact O-N 2.98Å; F334-I339 HydrophobicContact CD1-CG2 4.44Å; F334-I339 PolarHBondContact O-N 3.45Å; F334-L504 HydrophobicContact CD1-CD2 3.95Å; F334-L504 HydrophobicContact CD2-CD2 4.2Å; F334-L504 HydrophobicContact CE1-CD2 3.86Å; F334-L504 HydrophobicContact CE2-CD2 4.11Å; F334-L504 HydrophobicContact CG-CD2 4.12Å; F334-L504 HydrophobicContact CZ-CD2 3.95Å; F334-S507 WeakPolarHBondContact CE1-OG 3.49Å; F334-C551 VanDerWaalsContact CE1-SG 3.53Å; F334-C551 WeakPolarHBondContact CZ-SG 3.32Å
335	F	87.3	Confident	91.4	Very high	41 Å²	41	9.2 Å²	9.2	18%	0.18	4%	0.042	C	C	.	.	H	α-helix	trans	-70	-47.8	175.9	-171.4	-95.8	0	0	0	112.4	T331 I333 Y337 A338 L503	T331-F335 WeakPolarHBondContact O-CB 3.25Å; T331-F335 PolarHBondContact O-N 3.47Å; I333-F335 VanDerWaalsContact C-N 3.32Å; I333-F335 PolarHBondContact O-N 3.05Å; F335-Y337 VanDerWaalsContact C-N 3.32Å; F335-Y337 PolarHBondContact O-N 3.07Å; F335-A338 WeakPolarHBondContact O-CA 3.48Å; F335-A338 PolarHBondContact O-N 3.25Å; F335-L503 HydrophobicContact CB-CD1 4.48Å; F335-L503 HydrophobicContact CD2-CD1 4.32Å
336	S	91.9	Very high	91.5	Very high	4 Å²	4	9.2 Å²	9.2	3%	0.028	4%	0.042	C	C	.	.	H	α-helix	trans	-67.7	-29.6	-177.7	-179.9	0	0	0	0	113	A82 Q332 I333 N368	A82-S336 CarbonylContact C-O 3.52Å; Q332-S336 WeakPolarHBondContact O-CB 3.39Å; Q332-S336 PolarHBondContact O-N 2.9Å; I333-S336 PolarHBondContact O-N 3.34Å; S336-N368 PolarHBondContact O-ND2 3.1Å; S336-N368 PolarHBondContact OG-ND2 3.36Å; S336-N368 PolarHBondContact OG-OD1 2.92Å
337	Y	91.6	Very high	91.6	Very high	2 Å²	2	5 Å²	5	1%	0.008	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-4.7	174.7	-78.6	-127.9	0	0	0	111.6	F119 I333 F335 I339 A365 N368 S369	F119-Y337 HydrophobicContact CB-CD1 4.18Å; F119-Y337 AromaticContact CD2-CD1 3.85Å; F119-Y337 HydrophobicContact CD2-CD1 3.85Å; F119-Y337 HydrophobicContact CD2-CG 4.43Å; F119-Y337 HydrophobicContact CG-CD1 4.2Å; I333-Y337 HydrophobicContact CD1-CD2 4.42Å; I333-Y337 HydrophobicContact CD1-CE2 3.95Å; I333-Y337 HydrophobicContact CG2-CD2 4.14Å; I333-Y337 HydrophobicContact CG2-CE2 4.39Å; I333-Y337 VanDerWaalsContact O-CB 3.32Å; I333-Y337 WeakPolarHBondContact O-CB 3.32Å; I333-Y337 WeakPolarHBondContact O-CD2 3.43Å; I333-Y337 PolarHBondContact O-N 3.08Å; F335-Y337 VanDerWaalsContact C-N 3.32Å; F335-Y337 PolarHBondContact O-N 3.07Å; Y337-I339 VanDerWaalsContact CB-CD1 3.44Å; Y337-I339 HydrophobicContact CD1-CD1 4.27Å; Y337-I339 HydrophobicContact CG-CD1 4.17Å; Y337-I339 PolarHBondContact O-N 3.17Å; Y337-A365 HydrophobicContact CE1-CB 3.64Å; Y337-A365 VanDerWaalsContact OH-CA 3.32Å; Y337-A365 WeakPolarHBondContact OH-CA 3.38Å; Y337-A365 WeakPolarHBondContact OH-CB 3.24Å; Y337-A365 PolarHBondContact OH-O 3.45Å; Y337-A365 VanDerWaalsContact OH-O 3.13Å; Y337-N368 WeakPolarHBondContact CD2-ND2 3.48Å; Y337-N368 HydrophobicContact CE2-CB 4.26Å; Y337-N368 WeakPolarHBondContact CE2-ND2 3.32Å; Y337-S369 PolarHBondContact OH-OG 3.36Å
338	A	90.2	Very high	91.9	Very high	6 Å²	6	4.7 Å²	4.7	5%	0.05	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	36	-179.7	0	0	0	0	0	113	F81 F334 F335 L341	F81-A338 HydrophobicContact CD1-CB 3.66Å; F81-A338 HydrophobicContact CE1-CB 3.16Å; F81-A338 HydrophobicContact CE2-CB 4.24Å; F81-A338 HydrophobicContact CG-CB 4.38Å; F81-A338 HydrophobicContact CZ-CB 3.5Å; F334-A338 PolarHBondContact O-N 2.98Å; F335-A338 WeakPolarHBondContact O-CA 3.48Å; F335-A338 PolarHBondContact O-N 3.25Å; A338-L341 HydrophobicContact CB-CD1 3.95Å
339	I	92.9	Very high	92.1	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.021	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	143.2	-178.8	-70.1	163	0	0	0	109.8	G115 I118 F119 F334 Y337 L341 L344 L503 S507	G115-I339 WeakPolarHBondContact O-CD1 3.4Å; I118-I339 HydrophobicContact CB-CD1 4.25Å; I118-I339 HydrophobicContact CB-CG2 3.81Å; I118-I339 HydrophobicContact CD1-CG2 4.24Å; I118-I339 HydrophobicContact CG2-CG2 3.24Å; F119-I339 HydrophobicContact CB-CD1 4.23Å; F119-I339 HydrophobicContact CB-CG1 4.36Å; F119-I339 HydrophobicContact CD2-CG1 4.41Å; F334-I339 HydrophobicContact CD1-CG2 4.44Å; F334-I339 PolarHBondContact O-N 3.45Å; Y337-I339 VanDerWaalsContact CB-CD1 3.44Å; Y337-I339 HydrophobicContact CD1-CD1 4.27Å; Y337-I339 HydrophobicContact CG-CD1 4.17Å; Y337-I339 PolarHBondContact O-N 3.17Å; I339-L341 VanDerWaalsContact C-N 3.29Å; I339-L344 HydrophobicContact CG1-CD1 4.4Å; I339-L503 WeakPolarHBondContact O-CD2 3.5Å; I339-S507 WeakPolarHBondContact CG2-OG 3.48Å
340	G	90.7	Very high	92.1	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.024	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	1	178.9	0	0	0	0	0	114.1	E122	E122-G340 PolarHBondContact OE1-N 2.79Å
341	L	91.5	Very high	92.3	Very high	14 Å²	14	4.7 Å²	4.7	7%	0.073	2%	0.024	C	C	.	.	S	Bend	trans	-86.7	-13.4	178.3	-59.5	-177.1	0	0	0	112.8	F81 I153 V154 A338 I339 A343 L503	F81-L341 HydrophobicContact CZ-CD1 3.88Å; I153-L341 HydrophobicContact CB-CD2 4.3Å; I153-L341 HydrophobicContact CG2-CD2 3.39Å; V154-L341 HydrophobicContact CB-CB 4.4Å; V154-L341 WeakPolarHBondContact CB-O 3.35Å; A338-L341 HydrophobicContact CB-CD1 3.95Å; I339-L341 VanDerWaalsContact C-N 3.29Å; L341-A343 PolarHBondContact O-N 3.31Å; L341-A343 VanDerWaalsContact O-N 3.07Å; L341-L503 HydrophobicContact CD2-CD2 3.8Å; L341-L503 HydrophobicContact CG-CD2 4.47Å
342	G	90.5	Very high	92.5	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.01	5%	0.048	C	C	.	.	S	Bend	trans	72.2	-8.2	-177.1	0	0	0	0	0	114.7	S133 T345 A346	S133-G342 WeakPolarHBondContact OG-CA 3.31Å; S133-G342 PolarHBondContact OG-O 3.43Å; G342-T345 WeakPolarHBondContact O-CB 3.48Å; G342-T345 PolarHBondContact O-N 2.85Å; G342-A346 PolarHBondContact O-N 3.45Å
343	A	93.1	Very high	92.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-65.9	-39.4	174.9	0	0	0	0	0	112.1	F81 L341 T345 A346 L347 V440	F81-A343 HydrophobicContact CE1-CB 3.66Å; F81-A343 HydrophobicContact CE2-CB 4.13Å; F81-A343 HydrophobicContact CZ-CB 3.41Å; F81-A343 VanDerWaalsContact CZ-CB 3.41Å; L341-A343 PolarHBondContact O-N 3.31Å; L341-A343 VanDerWaalsContact O-N 3.07Å; A343-T345 VanDerWaalsContact C-N 3.33Å; A343-T345 PolarHBondContact O-N 3.17Å; A343-A346 CarbonylContact O-C 3.06Å; A343-A346 WeakPolarHBondContact O-CB 3.32Å; A343-A346 PolarHBondContact O-N 3.32Å; A343-A346 VanDerWaalsContact O-N 3.13Å; A343-L347 WeakPolarHBondContact O-CG 3.36Å; A343-L347 PolarHBondContact O-N 3.29Å; A343-V440 HydrophobicContact CB-CG1 4.18Å
344	L	94.7	Very high	92.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.1	-41.9	173.9	-67.6	173.6	0	0	0	111.8	F81 F119 E122 I123 I339 A346 L347 G348	F81-L344 HydrophobicContact CD1-CD2 3.83Å; F81-L344 HydrophobicContact CD1-CG 4.23Å; F81-L344 HydrophobicContact CE1-CD2 4.21Å; F81-L344 HydrophobicContact CE1-CG 4.08Å; F119-L344 HydrophobicContact CD2-CD1 3.42Å; F119-L344 VanDerWaalsContact CD2-CD1 3.42Å; F119-L344 HydrophobicContact CD2-CD2 4.35Å; F119-L344 HydrophobicContact CE2-CD1 3.53Å; F119-L344 HydrophobicContact CE2-CD2 3.59Å; F119-L344 HydrophobicContact CE2-CG 4.21Å; F119-L344 HydrophobicContact CG-CD1 4.19Å; F119-L344 HydrophobicContact CZ-CD1 4.36Å; F119-L344 HydrophobicContact CZ-CD2 3.82Å; E122-L344 HydrophobicContact CB-CB 4.13Å; I123-L344 HydrophobicContact CG1-CB 4.37Å; I339-L344 HydrophobicContact CG1-CD1 4.4Å; L344-A346 VanDerWaalsContact C-N 3.3Å; L344-A346 PolarHBondContact O-N 2.88Å; L344-L347 PolarHBondContact O-N 3.01Å; L344-G348 PolarHBondContact O-N 3.4Å
345	T	95.3	Very high	92.5	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-58.2	-44	173	-59.5	0	0	0	0	111	E122 G126 V136 G342 A343 G348 S349	E122-T345 PolarHBondContact OE2-OG1 3.41Å; G126-T345 WeakPolarHBondContact CA-O 3.43Å; V136-T345 HydrophobicContact CB-CG2 3.9Å; V136-T345 HydrophobicContact CG1-CG2 3.97Å; V136-T345 HydrophobicContact CG2-CG2 3.61Å; G342-T345 WeakPolarHBondContact O-CB 3.48Å; G342-T345 PolarHBondContact O-N 2.85Å; A343-T345 VanDerWaalsContact C-N 3.33Å; A343-T345 PolarHBondContact O-N 3.17Å; T345-G348 PolarHBondContact O-N 3.3Å; T345-S349 PolarHBondContact O-N 2.94Å
346	A	93.5	Very high	93	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.8	-45.4	175.2	0	0	0	0	0	112.3	G342 A343 L344 G348 S349 Y350 T447	G342-A346 PolarHBondContact O-N 3.45Å; A343-A346 CarbonylContact O-C 3.06Å; A343-A346 WeakPolarHBondContact O-CB 3.32Å; A343-A346 PolarHBondContact O-N 3.32Å; A343-A346 VanDerWaalsContact O-N 3.13Å; L344-A346 VanDerWaalsContact C-N 3.3Å; L344-A346 PolarHBondContact O-N 2.88Å; A346-G348 PolarHBondContact O-N 3.27Å; A346-S349 WeakPolarHBondContact O-CB 3.44Å; A346-S349 PolarHBondContact O-N 3.44Å; A346-S349 PolarHBondContact O-OG 3.03Å; A346-Y350 WeakPolarHBondContact O-CD2 3.49Å; A346-T447 HydrophobicContact CB-CG2 4.06Å
347	L	93.8	Very high	93.2	Very high	3 Å²	3	17.7 Å²	17.7	2%	0.016	8%	0.083	C	C	.	.	H	α-helix	trans	-61.6	-43	176.3	-64.3	-174.9	0	0	0	112.1	W68 F74 A343 L344 S349 Y350 V440	W68-L347 HydrophobicContact CH2-CD2 3.95Å; W68-L347 HydrophobicContact CZ2-CB 4.33Å; W68-L347 HydrophobicContact CZ2-CD2 3.67Å; W68-L347 PolarHBondContact NE1-O 3.29Å; W68-L347 VanDerWaalsContact NE1-O 3.13Å; F74-L347 HydrophobicContact CD2-CB 4.42Å; F74-L347 HydrophobicContact CE2-CB 4.14Å; A343-L347 WeakPolarHBondContact O-CG 3.36Å; A343-L347 PolarHBondContact O-N 3.29Å; L344-L347 PolarHBondContact O-N 3.01Å; L347-S349 VanDerWaalsContact C-N 3.28Å; L347-S349 PolarHBondContact O-N 3.1Å; L347-Y350 PolarHBondContact O-N 2.9Å; L347-V440 HydrophobicContact CD1-CG1 3.73Å; L347-V440 HydrophobicContact CD2-CG1 4.12Å; L347-V440 HydrophobicContact CG-CG1 4.07Å
348	G	95	Very high	93.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.5	-34.8	176.7	0	0	0	0	0	112.6	Q127 L344 T345 A346 Y350 N351	Q127-G348 VanDerWaalsContact CA-O 3.23Å; Q127-G348 WeakPolarHBondContact CA-O 3.38Å; Q127-G348 WeakPolarHBondContact CB-O 3.39Å; Q127-G348 PolarHBondContact N-O 3.49Å; L344-G348 PolarHBondContact O-N 3.4Å; T345-G348 PolarHBondContact O-N 3.3Å; A346-G348 PolarHBondContact O-N 3.27Å; G348-Y350 PolarHBondContact O-N 3.22Å; G348-Y350 VanDerWaalsContact O-N 3.16Å; G348-N351 VanDerWaalsContact O-CB 3.24Å; G348-N351 WeakPolarHBondContact O-CB 3.02Å; G348-N351 PolarHBondContact O-N 3.46Å
349	S	94.3	Very high	93.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.4	-23.2	177.6	77.9	0	0	0	0	114.4	R65 G126 K130 A131 T345 A346 L347	R65-S349 WeakPolarHBondContact CD-O 3.1Å; R65-S349 PolarHBondContact NE-OG 3.34Å; R65-S349 PolarHBondContact NH2-OG 3.3Å; G126-S349 VanDerWaalsContact O-CA 3.23Å; G126-S349 WeakPolarHBondContact O-CA 3.42Å; K130-S349 WeakPolarHBondContact CD-O 3.3Å; A131-S349 WeakPolarHBondContact O-CB 3.37Å; T345-S349 PolarHBondContact O-N 2.94Å; A346-S349 WeakPolarHBondContact O-CB 3.44Å; A346-S349 PolarHBondContact O-N 3.44Å; A346-S349 PolarHBondContact O-OG 3.03Å; L347-S349 VanDerWaalsContact C-N 3.28Å; L347-S349 PolarHBondContact O-N 3.1Å
350	Y	92.6	Very high	93.8	Very high	11 Å²	11	25.2 Å²	25.2	4%	0.043	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-7.1	176.1	-61.8	-60.3	0	0	0	113.1	R65 E66 T67 W68 V274 A346 L347 G348 T447	R65-Y350 HydrophobicContact CG-CD1 4.08Å; R65-Y350 HydrophobicContact CG-CE1 4.09Å; E66-Y350 VanDerWaalsContact O-CD1 3.28Å; E66-Y350 WeakPolarHBondContact O-CD1 3.43Å; T67-Y350 VanDerWaalsContact CA-O 3.25Å; T67-Y350 WeakPolarHBondContact CA-O 3.49Å; T67-Y350 WeakPolarHBondContact CB-O 3.35Å; W68-Y350 VanDerWaalsContact CD1-O 3.26Å; W68-Y350 PolarHBondContact N-O 3.06Å; V274-Y350 HydrophobicContact CG1-CD2 3.49Å; V274-Y350 VanDerWaalsContact CG1-CD2 3.49Å; V274-Y350 HydrophobicContact CG1-CE2 3.59Å; V274-Y350 HydrophobicContact CG1-CG 3.99Å; V274-Y350 HydrophobicContact CG2-CD1 4.42Å; V274-Y350 HydrophobicContact CG2-CG 4.38Å; A346-Y350 WeakPolarHBondContact O-CD2 3.49Å; L347-Y350 PolarHBondContact O-N 2.9Å; G348-Y350 PolarHBondContact O-N 3.22Å; G348-Y350 VanDerWaalsContact O-N 3.16Å; Y350-T447 HydrophobicContact CE2-CG2 4.26Å; Y350-T447 WeakPolarHBondContact OH-CG2 3.22Å; Y350-T447 PolarHBondContact OH-OG1 2.84Å
351	N	94.7	Very high	94	Very high	3 Å²	3	25.2 Å²	25.2	2%	0.016	12%	0.115	C	C	.	.	S	Bend	trans	-68	152.1	173.6	-72.1	-11.9	0	0	0	111.2	W68 F74 Q127 K130 G348 N355	W68-N351 PolarHBondContact NE1-OD1 3.09Å; F74-N351 WeakPolarHBondContact CD2-OD1 3.42Å; F74-N351 WeakPolarHBondContact CE1-ND2 3.44Å; F74-N351 WeakPolarHBondContact CE2-ND2 3.34Å; F74-N351 WeakPolarHBondContact CG-OD1 3.06Å; F74-N351 WeakPolarHBondContact CZ-ND2 3.17Å; Q127-N351 HydrophobicContact CB-CB 4.47Å; Q127-N351 HydrophobicContact CG-CB 3.97Å; Q127-N351 PolarHBondContact OE1-ND2 3.25Å; K130-N351 WeakPolarHBondContact CE-O 3.22Å; K130-N351 PolarHBondContact NZ-O 3.14Å; G348-N351 VanDerWaalsContact O-CB 3.24Å; G348-N351 WeakPolarHBondContact O-CB 3.02Å; G348-N351 PolarHBondContact O-N 3.46Å; N351-N355 HydrophobicContact CB-CB 4.12Å; N351-N355 PolarHBondContact ND2-ND2 2.94Å
352	R	92.1	Very high	94.3	Very high	147 Å²	147	28 Å²	28	56%	0.555	13%	0.126	S	C	*	.			trans	-63.7	149.9	167.4	-61.8	-178.6	-173.8	174.6	2.1	109.4	Q127 N354 N355	Q127-R352 PolarHBondContact NE2-O 3.11Å; R352-N354 PolarHBondContact O-N 2.97Å; R352-N355 VanDerWaalsContact O-CB 3.3Å; R352-N355 WeakPolarHBondContact O-CB 3.42Å; R352-N355 PolarHBondContact O-N 3.11Å; R352-N355 VanDerWaalsContact O-N 3.09Å
353	F	90.8	Very high	94.6	Very high	17 Å²	17	31.4 Å²	31.4	8%	0.075	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-35.8	-175.7	-174.3	-98.9	0	0	0	112.2	Q127 F128 M530 Y626	Q127-F353 PolarHBondContact NE2-O 3.31Å; F128-F353 AromaticContact CD2-CE2 3.99Å; F128-F353 HydrophobicContact CD2-CE2 3.99Å; F128-F353 HydrophobicContact CD2-CZ 4.33Å; F128-F353 HydrophobicContact CE2-CE2 4.42Å; F128-F353 HydrophobicContact CE2-CZ 4.47Å; F353-M530 HydrophobicContact CD1-CG 4.29Å; F353-M530 HydrophobicContact CD2-CG 4.12Å; F353-M530 HydrophobicContact CE1-CB 4.44Å; F353-M530 HydrophobicContact CE1-CG 3.88Å; F353-M530 HydrophobicContact CE2-CG 3.7Å; F353-M530 HydrophobicContact CE2-SD 4.33Å; F353-M530 HydrophobicContact CG-CG 4.41Å; F353-M530 HydrophobicContact CZ-CG 3.57Å; F353-M530 VanDerWaalsContact O-CB 3.31Å; F353-M530 WeakPolarHBondContact O-CB 3.45Å; F353-Y626 HydrophobicContact CB-CE2 4.47Å; F353-Y626 AromaticContact CD1-CD1 3.69Å; F353-Y626 HydrophobicContact CD1-CD1 3.69Å; F353-Y626 HydrophobicContact CD1-CD2 4.23Å; F353-Y626 AromaticContact CD1-CE1 3.75Å; F353-Y626 HydrophobicContact CD1-CE1 3.75Å; F353-Y626 HydrophobicContact CD1-CE2 4.34Å; F353-Y626 AromaticContact CD1-CG 3.95Å; F353-Y626 HydrophobicContact CD1-CG 3.95Å; F353-Y626 HydrophobicContact CD2-CD2 4.2Å; F353-Y626 HydrophobicContact CD2-CE2 4.33Å; F353-Y626 AromaticContact CE1-CD1 3.64Å; F353-Y626 HydrophobicContact CE1-CD1 3.64Å; F353-Y626 HydrophobicContact CE1-CD2 4.18Å; F353-Y626 HydrophobicContact CE1-CE1 4.19Å; F353-Y626 AromaticContact CE1-CG 3.63Å; F353-Y626 HydrophobicContact CE1-CG 3.63Å; F353-Y626 HydrophobicContact CE2-CD2 4.14Å; F353-Y626 HydrophobicContact CE2-CG 4.32Å; F353-Y626 HydrophobicContact CG-CD1 4.42Å; F353-Y626 HydrophobicContact CG-CD2 4.24Å; F353-Y626 HydrophobicContact CG-CE1 4.24Å; F353-Y626 HydrophobicContact CG-CE2 4.13Å; F353-Y626 HydrophobicContact CG-CG 4.42Å; F353-Y626 HydrophobicContact CZ-CD1 4.31Å; F353-Y626 HydrophobicContact CZ-CD2 4.13Å; F353-Y626 AromaticContact CZ-CG 3.83Å; F353-Y626 HydrophobicContact CZ-CG 3.83Å
354	N	92.3	Very high	94.7	Very high	118 Å²	118	31.7 Å²	31.7	63%	0.631	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	11.6	-179.2	65.5	-16.5	0	0	0	115.5	R352 M530	R352-N354 PolarHBondContact O-N 2.97Å; N354-M530 VanDerWaalsContact CA-O 3.25Å; N354-M530 WeakPolarHBondContact CA-O 3.43Å
355	N	94.6	Very high	94.7	Very high	19 Å²	19	31.8 Å²	31.8	10%	0.102	15%	0.149	C	C	.	.			trans	-70.1	136.7	177.7	-178.8	78.3	0	0	0	110.9	Q127 N351 R352 C357 D360 I531	Q127-N355 PolarHBondContact NE2-O 3.29Å; N351-N355 HydrophobicContact CB-CB 4.12Å; N351-N355 PolarHBondContact ND2-ND2 2.94Å; R352-N355 VanDerWaalsContact O-CB 3.3Å; R352-N355 WeakPolarHBondContact O-CB 3.42Å; R352-N355 PolarHBondContact O-N 3.11Å; R352-N355 VanDerWaalsContact O-N 3.09Å; N355-C357 VanDerWaalsContact C-N 3.25Å; N355-C357 PolarHBondContact O-N 2.94Å; N355-D360 PolarHBondContact ND2-OD2 3.24Å; N355-I531 WeakPolarHBondContact O-CG2 3.36Å
356	D	96.3	Very high	94.8	Very high	26 Å²	26	37.9 Å²	37.9	14%	0.139	18%	0.181	C	C	.	.			trans	-78.8	71.8	-177.4	-165.3	-19.8	0	0	0	111.8	Y358 K359 D360 Y533	D356-Y358 PolarHBondContact O-N 2.94Å; D356-Y358 VanDerWaalsContact O-N 3.14Å; D356-Y358 PolarHBondContact OD1-N 3.27Å; D356-K359 PolarHBondContact O-N 3.26Å; D356-K359 PolarHBondContact OD1-N 3.44Å; D356-K359 WeakPolarHBondContact OD2-CD 3.39Å; D356-K359 WeakPolarHBondContact OD2-CE 3.28Å; D356-K359 WeakPolarHBondContact OD2-CG 3.44Å; D356-K359 IonicContact OD2-NZ 3.86Å; D356-K359 PolarHBondContact OD2-NZ 3.35Å; D356-D360 VanDerWaalsContact O-CG 3.26Å; D356-D360 PolarHBondContact O-N 3.22Å; D356-D360 VanDerWaalsContact O-N 3.15Å; D356-Y533 VanDerWaalsContact CG-OH 3.26Å; D356-Y533 PolarHBondContact OD1-OH 2.95Å; D356-Y533 WeakPolarHBondContact OD2-CE1 3.36Å; D356-Y533 PolarHBondContact OD2-OH 3.11Å
357	C	95.8	Very high	94.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-20.8	-179.5	56.1	0	0	0	0	113.7	I123 N355 A361	I123-C357 HydrophobicContact CG2-CB 3.68Å; N355-C357 VanDerWaalsContact C-N 3.25Å; N355-C357 PolarHBondContact O-N 2.94Å; C357-A361 WeakPolarHBondContact O-CB 3.3Å; C357-A361 PolarHBondContact O-N 2.81Å; C357-A361 VanDerWaalsContact O-N 3.13Å
358	Y	96.8	Very high	95	Very high	36 Å²	36	40.3 Å²	40.3	14%	0.141	19%	0.193	C	C	.	.	H	α-helix	trans	-70.3	-49.2	176.4	-179.2	-108.8	0	0	0	111.2	F120 D356 D360 A361 F362 Y533 P535 F536 M539	F120-Y358 HydrophobicContact CD1-CD2 4.14Å; F120-Y358 HydrophobicContact CD2-CD2 4.36Å; F120-Y358 AromaticContact CE1-CD2 3.75Å; F120-Y358 HydrophobicContact CE1-CD2 3.75Å; F120-Y358 HydrophobicContact CE1-CE2 4.37Å; F120-Y358 AromaticContact CE2-CD2 3.98Å; F120-Y358 HydrophobicContact CE2-CD2 3.98Å; F120-Y358 HydrophobicContact CE2-CG 4.39Å; F120-Y358 HydrophobicContact CG-CD2 4.43Å; F120-Y358 AromaticContact CZ-CD2 3.65Å; F120-Y358 HydrophobicContact CZ-CD2 3.65Å; F120-Y358 HydrophobicContact CZ-CG 4.3Å; D356-Y358 PolarHBondContact O-N 2.94Å; D356-Y358 VanDerWaalsContact O-N 3.14Å; D356-Y358 PolarHBondContact OD1-N 3.27Å; Y358-D360 VanDerWaalsContact C-N 3.35Å; Y358-A361 PolarHBondContact O-N 2.9Å; Y358-F362 HydrophobicContact CD2-CE2 4.23Å; Y358-F362 HydrophobicContact CE1-CD2 4.48Å; Y358-F362 HydrophobicContact CE1-CE2 4Å; Y358-F362 HydrophobicContact CE2-CD2 4.48Å; Y358-F362 AromaticContact CE2-CE2 3.61Å; Y358-F362 HydrophobicContact CE2-CE2 3.61Å; Y358-F362 HydrophobicContact CE2-CZ 4.47Å; Y358-F362 AromaticContact CZ-CE2 3.47Å; Y358-F362 VanDerWaalsContact CZ-CE2 3.47Å; Y358-F362 WeakPolarHBondContact O-CD2 3.36Å; Y358-Y533 HydrophobicContact CD1-CE2 4.07Å; Y358-Y533 WeakPolarHBondContact CD1-OH 3.49Å; Y358-P535 HydrophobicContact CD2-CB 3.82Å; Y358-P535 HydrophobicContact CD2-CG 4.42Å; Y358-P535 HydrophobicContact CE2-CB 3.79Å; Y358-P535 HydrophobicContact CG-CB 4.28Å; Y358-F536 WeakPolarHBondContact OH-CB 3.24Å; Y358-M539 HydrophobicContact CE2-CE 3.74Å; Y358-M539 HydrophobicContact CE2-CG 3.88Å
359	K	95.8	Very high	95.1	Very high	121 Å²	121	41 Å²	41	53%	0.526	20%	0.198	S	C	.	.	H	α-helix	trans	-63.9	-42.1	174.8	-71.7	-176.2	-171	128.8	0	111.8	D356 A361 F362 V363	D356-K359 PolarHBondContact O-N 3.26Å; D356-K359 PolarHBondContact OD1-N 3.44Å; D356-K359 WeakPolarHBondContact OD2-CD 3.39Å; D356-K359 WeakPolarHBondContact OD2-CE 3.28Å; D356-K359 WeakPolarHBondContact OD2-CG 3.44Å; D356-K359 IonicContact OD2-NZ 3.86Å; D356-K359 PolarHBondContact OD2-NZ 3.35Å; K359-A361 VanDerWaalsContact C-N 3.26Å; K359-A361 PolarHBondContact O-N 2.69Å; K359-F362 PolarHBondContact O-N 3.09Å; K359-V363 WeakPolarHBondContact O-CG2 3.42Å; K359-V363 PolarHBondContact O-N 3.17Å; K359-V363 VanDerWaalsContact O-N 3.12Å
360	D	95.5	Very high	95.2	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-56.2	-43.3	179.1	-65.5	-19.4	0	0	0	111	Q71 F74 I75 N355 D356 Y358 F362 V363 L364	Q71-D360 PolarHBondContact NE2-OD1 2.94Å; Q71-D360 VanDerWaalsContact NE2-OD1 3.12Å; F74-D360 HydrophobicContact CE1-CB 4.16Å; F74-D360 WeakPolarHBondContact CE1-OD2 3.15Å; I75-D360 HydrophobicContact CD1-CB 3.79Å; I75-D360 WeakPolarHBondContact CD1-OD1 3.37Å; N355-D360 PolarHBondContact ND2-OD2 3.24Å; D356-D360 VanDerWaalsContact O-CG 3.26Å; D356-D360 PolarHBondContact O-N 3.22Å; D356-D360 VanDerWaalsContact O-N 3.15Å; Y358-D360 VanDerWaalsContact C-N 3.35Å; D360-F362 PolarHBondContact O-N 3.33Å; D360-V363 PolarHBondContact O-N 3.42Å; D360-L364 HydrophobicContact CB-CD1 4.43Å; D360-L364 WeakPolarHBondContact O-CB 3.5Å; D360-L364 WeakPolarHBondContact O-CD1 3.35Å; D360-L364 WeakPolarHBondContact O-CG 3.35Å; D360-L364 PolarHBondContact O-N 3.45Å
361	A	96.1	Very high	95.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-41.3	179.2	0	0	0	0	0	113.5	F119 F120 C357 Y358 K359 A365	F119-A361 HydrophobicContact CD1-CB 4.09Å; F120-A361 HydrophobicContact CB-CB 3.76Å; F120-A361 HydrophobicContact CD2-CB 4.3Å; F120-A361 HydrophobicContact CG-CB 4.38Å; C357-A361 WeakPolarHBondContact O-CB 3.3Å; C357-A361 PolarHBondContact O-N 2.81Å; C357-A361 VanDerWaalsContact O-N 3.13Å; Y358-A361 PolarHBondContact O-N 2.9Å; K359-A361 VanDerWaalsContact C-N 3.26Å; K359-A361 PolarHBondContact O-N 2.69Å; A361-A365 VanDerWaalsContact O-CB 3.27Å; A361-A365 WeakPolarHBondContact O-CB 3.33Å; A361-A365 PolarHBondContact O-N 3.19Å
362	F	96.7	Very high	95.4	Very high	72 Å²	72	42.5 Å²	42.5	32%	0.316	22%	0.216	S	C	.	.	H	α-helix	trans	-69.8	-41	177	-80.9	-86.3	0	0	0	112.6	I116 Y358 K359 D360 A365 L366 M539	I116-F362 HydrophobicContact CD1-CD1 3.94Å; I116-F362 HydrophobicContact CD1-CE1 3.96Å; I116-F362 HydrophobicContact CG2-CD1 4.37Å; I116-F362 HydrophobicContact CG2-CD2 4.45Å; I116-F362 HydrophobicContact CG2-CE1 4.15Å; I116-F362 HydrophobicContact CG2-CE2 4.2Å; I116-F362 HydrophobicContact CG2-CZ 4.06Å; Y358-F362 HydrophobicContact CD2-CE2 4.23Å; Y358-F362 HydrophobicContact CE1-CD2 4.48Å; Y358-F362 HydrophobicContact CE1-CE2 4Å; Y358-F362 HydrophobicContact CE2-CD2 4.48Å; Y358-F362 AromaticContact CE2-CE2 3.61Å; Y358-F362 HydrophobicContact CE2-CE2 3.61Å; Y358-F362 HydrophobicContact CE2-CZ 4.47Å; Y358-F362 AromaticContact CZ-CE2 3.47Å; Y358-F362 VanDerWaalsContact CZ-CE2 3.47Å; Y358-F362 WeakPolarHBondContact O-CD2 3.36Å; K359-F362 PolarHBondContact O-N 3.09Å; D360-F362 PolarHBondContact O-N 3.33Å; F362-A365 PolarHBondContact O-N 2.94Å; F362-L366 WeakPolarHBondContact O-CB 3.27Å; F362-L366 PolarHBondContact O-N 2.83Å; F362-M539 HydrophobicContact CE1-CE 4.45Å; F362-M539 HydrophobicContact CE2-CE 3.52Å; F362-M539 HydrophobicContact CZ-CE 3.37Å
363	V	96.5	Very high	95.6	Very high	73 Å²	73	39.4 Å²	39.4	44%	0.442	21%	0.206	S	C	.	.	H	α-helix	trans	-62.9	-46.3	177.4	172.8	0	0	0	0	110.2	K359 D360 A365 L366 I367	K359-V363 WeakPolarHBondContact O-CG2 3.42Å; K359-V363 PolarHBondContact O-N 3.17Å; K359-V363 VanDerWaalsContact O-N 3.12Å; D360-V363 PolarHBondContact O-N 3.42Å; V363-A365 PolarHBondContact O-N 3.31Å; V363-L366 PolarHBondContact O-N 3.02Å; V363-I367 HydrophobicContact CG1-CD1 3.82Å; V363-I367 HydrophobicContact CG1-CG1 4.5Å; V363-I367 WeakPolarHBondContact O-CG1 3.46Å; V363-I367 PolarHBondContact O-N 3.2Å
364	L	95.5	Very high	95.9	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-40	179.5	-70.3	166.9	0	0	0	111.9	I75 C78 V79 F119 I123 D360 I367 N368	I75-L364 HydrophobicContact CD1-CD1 4.28Å; I75-L364 HydrophobicContact CD1-CG 4.4Å; I75-L364 HydrophobicContact CG2-CD2 4.15Å; C78-L364 HydrophobicContact CB-CD1 3.58Å; C78-L364 HydrophobicContact CB-CD2 3.57Å; C78-L364 HydrophobicContact CB-CG 4.22Å; V79-L364 HydrophobicContact CG2-CD2 3.59Å; F119-L364 HydrophobicContact CE1-CB 3.82Å; F119-L364 HydrophobicContact CE1-CD1 3.58Å; F119-L364 HydrophobicContact CE1-CG 4.34Å; F119-L364 HydrophobicContact CZ-CB 3.93Å; F119-L364 HydrophobicContact CZ-CD1 3.8Å; F119-L364 HydrophobicContact CZ-CG 4.44Å; I123-L364 HydrophobicContact CD1-CD1 4.41Å; D360-L364 HydrophobicContact CB-CD1 4.43Å; D360-L364 WeakPolarHBondContact O-CB 3.5Å; D360-L364 WeakPolarHBondContact O-CD1 3.35Å; D360-L364 WeakPolarHBondContact O-CG 3.35Å; D360-L364 PolarHBondContact O-N 3.45Å; L364-I367 PolarHBondContact O-N 3.37Å; L364-N368 VanDerWaalsContact O-CB 3.3Å; L364-N368 WeakPolarHBondContact O-CB 3.2Å; L364-N368 PolarHBondContact O-N 3.15Å
365	A	95.4	Very high	96.1	Very high	2 Å²	2	35.9 Å²	35.9	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-45.4	174	0	0	0	0	0	112.6	I116 Y337 A361 F362 V363 N368 S369	I116-A365 HydrophobicContact CD1-CB 3.94Å; I116-A365 HydrophobicContact CG1-CB 3.46Å; I116-A365 VanDerWaalsContact CG1-CB 3.46Å; Y337-A365 HydrophobicContact CE1-CB 3.64Å; Y337-A365 VanDerWaalsContact OH-CA 3.32Å; Y337-A365 WeakPolarHBondContact OH-CA 3.38Å; Y337-A365 WeakPolarHBondContact OH-CB 3.24Å; Y337-A365 PolarHBondContact OH-O 3.45Å; Y337-A365 VanDerWaalsContact OH-O 3.13Å; A361-A365 VanDerWaalsContact O-CB 3.27Å; A361-A365 WeakPolarHBondContact O-CB 3.33Å; A361-A365 PolarHBondContact O-N 3.19Å; F362-A365 PolarHBondContact O-N 2.94Å; V363-A365 PolarHBondContact O-N 3.31Å; A365-N368 PolarHBondContact O-N 3.34Å; A365-S369 WeakPolarHBondContact O-CB 3.28Å; A365-S369 PolarHBondContact O-N 2.64Å
366	L	96.5	Very high	96.1	Very high	134 Å²	134	35 Å²	35	70%	0.702	18%	0.18	S	C	*	.	H	α-helix	trans	-62.2	-45.1	177.4	179.3	64.8	0	0	0	111.6	F362 V363 G370	F362-L366 WeakPolarHBondContact O-CB 3.27Å; F362-L366 PolarHBondContact O-N 2.83Å; V363-L366 PolarHBondContact O-N 3.02Å; L366-G370 WeakPolarHBondContact O-CA 3.31Å; L366-G370 PolarHBondContact O-N 3.09Å
367	I	96.5	Very high	96.1	Very high	53 Å²	53	36.1 Å²	36.1	27%	0.272	18%	0.184	S	C	.	.	H	α-helix	trans	-61.6	-49.5	176.7	-67.5	168	0	0	0	109.5	V79 V83 Y289 V363 L364 G370 T371	V79-I367 HydrophobicContact CG1-CG2 3.94Å; V79-I367 HydrophobicContact CG2-CD1 3.89Å; V79-I367 HydrophobicContact CG2-CG2 3.96Å; V83-I367 HydrophobicContact CG2-CG2 4.34Å; Y289-I367 WeakPolarHBondContact OH-CG2 3.46Å; V363-I367 HydrophobicContact CG1-CD1 3.82Å; V363-I367 HydrophobicContact CG1-CG1 4.5Å; V363-I367 WeakPolarHBondContact O-CG1 3.46Å; V363-I367 PolarHBondContact O-N 3.2Å; L364-I367 PolarHBondContact O-N 3.37Å; I367-G370 PolarHBondContact O-N 3.45Å; I367-T371 WeakPolarHBondContact O-CB 3.18Å; I367-T371 PolarHBondContact O-N 2.99Å; I367-T371 PolarHBondContact O-OG1 3.45Å
368	N	95.9	Very high	96.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-52.4	-176	-169.4	21.2	0	0	0	113	A82 V83 N87 S336 Y337 L364 A365 T371 S372	A82-N368 HydrophobicContact CB-CB 4.43Å; A82-N368 PolarHBondContact O-OD1 2.89Å; V83-N368 HydrophobicContact CG2-CB 4.49Å; N87-N368 PolarHBondContact ND2-O 3.25Å; N87-N368 VanDerWaalsContact ND2-O 3.09Å; N87-N368 PolarHBondContact ND2-OD1 3.43Å; S336-N368 PolarHBondContact O-ND2 3.1Å; S336-N368 PolarHBondContact OG-ND2 3.36Å; S336-N368 PolarHBondContact OG-OD1 2.92Å; Y337-N368 WeakPolarHBondContact CD2-ND2 3.48Å; Y337-N368 HydrophobicContact CE2-CB 4.26Å; Y337-N368 WeakPolarHBondContact CE2-ND2 3.32Å; L364-N368 VanDerWaalsContact O-CB 3.3Å; L364-N368 WeakPolarHBondContact O-CB 3.2Å; L364-N368 PolarHBondContact O-N 3.15Å; A365-N368 PolarHBondContact O-N 3.34Å; N368-T371 PolarHBondContact O-N 2.95Å; N368-S372 PolarHBondContact O-N 3.13Å; N368-S372 PolarHBondContact O-OG 2.98Å
369	S	95.6	Very high	95.9	Very high	15 Å²	15	34.7 Å²	34.7	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-70.2	-35.5	179.1	-69.4	0	0	0	0	112.2	Y107 Y337 A365 S372 F373	Y107-S369 PolarHBondContact OH-OG 3.27Å; Y337-S369 PolarHBondContact OH-OG 3.36Å; A365-S369 WeakPolarHBondContact O-CB 3.28Å; A365-S369 PolarHBondContact O-N 2.64Å; S369-S372 WeakPolarHBondContact O-CB 3.23Å; S369-S372 PolarHBondContact O-N 3.15Å; S369-F373 PolarHBondContact O-N 3.13Å
370	G	96.6	Very high	95.9	Very high	36 Å²	36	29 Å²	29	37%	0.371	16%	0.155	S	C	.	.	H	α-helix	trans	-61.9	-44	173.6	0	0	0	0	0	112.2	L366 I367 F373 F374	L366-G370 WeakPolarHBondContact O-CA 3.31Å; L366-G370 PolarHBondContact O-N 3.09Å; I367-G370 PolarHBondContact O-N 3.45Å; G370-F373 PolarHBondContact O-N 3.48Å; G370-F374 VanDerWaalsContact O-CB 3.31Å; G370-F374 WeakPolarHBondContact O-CB 3.23Å; G370-F374 PolarHBondContact O-N 3.42Å
371	T	96.1	Very high	95.9	Very high	9 Å²	9	28.6 Å²	28.6	6%	0.055	15%	0.152	C	C	.	.	H	α-helix	trans	-66	-40.8	176.7	-55.5	0	0	0	0	112	V83 Y289 L292 I367 N368 F373 F374 S375	V83-T371 HydrophobicContact CG1-CG2 3.55Å; Y289-T371 HydrophobicContact CE1-CG2 3.8Å; Y289-T371 WeakPolarHBondContact CE1-OG1 3.31Å; Y289-T371 PolarHBondContact OH-OG1 3.43Å; L292-T371 HydrophobicContact CD1-CG2 4.31Å; I367-T371 WeakPolarHBondContact O-CB 3.18Å; I367-T371 PolarHBondContact O-N 2.99Å; I367-T371 PolarHBondContact O-OG1 3.45Å; N368-T371 PolarHBondContact O-N 2.95Å; T371-F373 VanDerWaalsContact C-N 3.34Å; T371-F373 PolarHBondContact O-N 2.84Å; T371-F374 PolarHBondContact O-N 2.68Å; T371-S375 WeakPolarHBondContact O-CB 3.19Å; T371-S375 PolarHBondContact O-N 2.97Å; T371-S375 PolarHBondContact O-OG 2.93Å
372	S	96	Very high	95.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.8	-45.8	172.4	-74.8	0	0	0	0	111.9	N87 F91 N368 S369 S375 G376	N87-S372 PolarHBondContact ND2-OG 3.36Å; F91-S372 VanDerWaalsContact CD1-C 3.47Å; F91-S372 WeakPolarHBondContact CD1-O 3.44Å; F91-S372 VanDerWaalsContact CE1-O 3.31Å; F91-S372 WeakPolarHBondContact CE1-O 3.41Å; N368-S372 PolarHBondContact O-N 3.13Å; N368-S372 PolarHBondContact O-OG 2.98Å; S369-S372 WeakPolarHBondContact O-CB 3.23Å; S369-S372 PolarHBondContact O-N 3.15Å; S372-S375 PolarHBondContact O-OG 2.77Å; S372-G376 PolarHBondContact O-N 3.29Å
373	F	96.4	Very high	95.4	Very high	82 Å²	82	25.3 Å²	25.3	36%	0.36	14%	0.138	S	C	.	.	H	α-helix	trans	-66.9	-41.3	179.2	-175.3	-118.2	0	0	0	112.3	L104 Y312 S369 G370 T371 G376 F377	L104-F373 HydrophobicContact CD1-CD2 4.2Å; L104-F373 HydrophobicContact CD1-CE2 3.73Å; L104-F373 HydrophobicContact CD1-CZ 4.43Å; L104-F373 HydrophobicContact CD2-CD2 4.11Å; L104-F373 HydrophobicContact CD2-CE2 4.42Å; Y312-F373 HydrophobicContact CE1-CD2 4.38Å; Y312-F373 HydrophobicContact CE1-CE2 4.18Å; Y312-F373 WeakPolarHBondContact OH-CA 3.46Å; Y312-F373 WeakPolarHBondContact OH-CD2 3.34Å; Y312-F373 PolarHBondContact OH-O 2.88Å; S369-F373 PolarHBondContact O-N 3.13Å; G370-F373 PolarHBondContact O-N 3.48Å; T371-F373 VanDerWaalsContact C-N 3.34Å; T371-F373 PolarHBondContact O-N 2.84Å; F373-G376 PolarHBondContact O-N 3.49Å; F373-F377 HydrophobicContact CD1-CE2 4.04Å; F373-F377 HydrophobicContact CD2-CE2 4.46Å; F373-F377 AromaticContact CE1-CE2 3.56Å; F373-F377 HydrophobicContact CE1-CE2 3.56Å; F373-F377 HydrophobicContact CE1-CZ 4.12Å; F373-F377 AromaticContact CE2-CE2 3.98Å; F373-F377 HydrophobicContact CE2-CE2 3.98Å; F373-F377 HydrophobicContact CE2-CZ 4.36Å; F373-F377 HydrophobicContact CG-CE2 4.47Å; F373-F377 AromaticContact CZ-CE2 3.52Å; F373-F377 HydrophobicContact CZ-CE2 3.52Å; F373-F377 AromaticContact CZ-CZ 3.77Å; F373-F377 HydrophobicContact CZ-CZ 3.77Å; F373-F377 WeakPolarHBondContact O-CD2 3.32Å
374	F	97	Very high	95.3	Very high	60 Å²	60	21.9 Å²	21.9	26%	0.263	12%	0.118	S	C	.	.	H	α-helix	trans	-66.2	-45.9	178.8	180	-106.4	0	0	0	112.9	L292 I293 L296 G370 T371 G376 F377 V378	L292-F374 HydrophobicContact CB-CD1 4.27Å; L292-F374 HydrophobicContact CB-CE1 3.7Å; L292-F374 HydrophobicContact CD1-CD1 4.43Å; I293-F374 HydrophobicContact CG1-CE1 4.3Å; I293-F374 HydrophobicContact CG1-CZ 3.94Å; L296-F374 HydrophobicContact CB-CZ 4.43Å; L296-F374 HydrophobicContact CD2-CD2 4.38Å; L296-F374 HydrophobicContact CD2-CE2 3.41Å; L296-F374 VanDerWaalsContact CD2-CE2 3.41Å; L296-F374 HydrophobicContact CD2-CZ 3.69Å; G370-F374 VanDerWaalsContact O-CB 3.31Å; G370-F374 WeakPolarHBondContact O-CB 3.23Å; G370-F374 PolarHBondContact O-N 3.42Å; T371-F374 PolarHBondContact O-N 2.68Å; F374-G376 PolarHBondContact O-N 3.47Å; F374-F377 PolarHBondContact O-N 2.96Å; F374-F377 VanDerWaalsContact O-N 3.11Å; F374-V378 HydrophobicContact CE1-CG2 4.37Å; F374-V378 PolarHBondContact O-N 3.48Å
375	S	95.4	Very high	95.1	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.7	-30.3	177.2	65	0	0	0	0	111.9	N87 T371 S372 F377 V378 V379	N87-S375 PolarHBondContact O-OG 3.46Å; T371-S375 WeakPolarHBondContact O-CB 3.19Å; T371-S375 PolarHBondContact O-N 2.97Å; T371-S375 PolarHBondContact O-OG 2.93Å; S372-S375 PolarHBondContact O-OG 2.77Å; S375-F377 VanDerWaalsContact C-N 3.33Å; S375-F377 PolarHBondContact O-N 2.92Å; S375-V378 WeakPolarHBondContact O-CB 3.34Å; S375-V378 PolarHBondContact O-N 3.43Å; S375-V378 VanDerWaalsContact O-N 3.11Å; S375-V379 WeakPolarHBondContact O-CG2 3.33Å; S375-V379 PolarHBondContact O-N 2.99Å
376	G	95.3	Very high	94.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.9	-39.8	175.2	0	0	0	0	0	113.4	S372 F373 F374 F380	S372-G376 PolarHBondContact O-N 3.29Å; F373-G376 PolarHBondContact O-N 3.49Å; F374-G376 PolarHBondContact O-N 3.47Å; G376-F380 WeakPolarHBondContact O-CB 3.38Å; G376-F380 WeakPolarHBondContact O-CD2 3.4Å; G376-F380 PolarHBondContact O-N 3.45Å
377	F	96.6	Very high	94.4	Very high	51 Å²	51	16.3 Å²	16.3	22%	0.224	9%	0.088	C	C	.	.	H	α-helix	trans	-65	-39.9	172.8	-69.7	-83.7	0	0	0	112.1	L296 I309 Y312 I313 F373 F374 S375 S381	L296-F377 HydrophobicContact CD1-CB 3.82Å; I309-F377 HydrophobicContact CG1-CD1 4.39Å; I309-F377 HydrophobicContact CG2-CD1 3.87Å; I309-F377 HydrophobicContact CG2-CE1 3.86Å; Y312-F377 HydrophobicContact CD1-CD1 4.37Å; Y312-F377 HydrophobicContact CD1-CE1 4.38Å; Y312-F377 HydrophobicContact CD1-CG 4.46Å; Y312-F377 HydrophobicContact CD1-CZ 4.47Å; Y312-F377 HydrophobicContact CE1-CD1 4.46Å; Y312-F377 AromaticContact CE1-CD2 3.89Å; Y312-F377 HydrophobicContact CE1-CD2 3.89Å; Y312-F377 HydrophobicContact CE1-CE1 4.43Å; Y312-F377 AromaticContact CE1-CE2 3.85Å; Y312-F377 HydrophobicContact CE1-CE2 3.85Å; Y312-F377 HydrophobicContact CE1-CG 4.2Å; Y312-F377 HydrophobicContact CE1-CZ 4.14Å; I313-F377 HydrophobicContact CG2-CE1 4.06Å; I313-F377 HydrophobicContact CG2-CZ 4.07Å; F373-F377 HydrophobicContact CD1-CE2 4.04Å; F373-F377 HydrophobicContact CD2-CE2 4.46Å; F373-F377 AromaticContact CE1-CE2 3.56Å; F373-F377 HydrophobicContact CE1-CE2 3.56Å; F373-F377 HydrophobicContact CE1-CZ 4.12Å; F373-F377 AromaticContact CE2-CE2 3.98Å; F373-F377 HydrophobicContact CE2-CE2 3.98Å; F373-F377 HydrophobicContact CE2-CZ 4.36Å; F373-F377 HydrophobicContact CG-CE2 4.47Å; F373-F377 AromaticContact CZ-CE2 3.52Å; F373-F377 HydrophobicContact CZ-CE2 3.52Å; F373-F377 AromaticContact CZ-CZ 3.77Å; F373-F377 HydrophobicContact CZ-CZ 3.77Å; F373-F377 WeakPolarHBondContact O-CD2 3.32Å; F374-F377 PolarHBondContact O-N 2.96Å; F374-F377 VanDerWaalsContact O-N 3.11Å; S375-F377 VanDerWaalsContact C-N 3.33Å; S375-F377 PolarHBondContact O-N 2.92Å; F377-S381 WeakPolarHBondContact O-CB 3.23Å; F377-S381 PolarHBondContact O-N 3.01Å; F377-S381 PolarHBondContact O-OG 3.29Å
378	V	95.4	Very high	93.9	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.012	10%	0.095	C	C	.	.	H	α-helix	trans	-59.6	-55	176.5	-176.4	0	0	0	0	110.1	L292 L295 L296 F374 S375 S381 I382	L292-V378 HydrophobicContact CB-CG2 4.36Å; L292-V378 HydrophobicContact CD2-CB 4.42Å; L292-V378 HydrophobicContact CD2-CG1 4.32Å; L292-V378 HydrophobicContact CD2-CG2 4.14Å; L292-V378 WeakPolarHBondContact O-CG2 3.27Å; L295-V378 HydrophobicContact CB-CG1 3.58Å; L295-V378 HydrophobicContact CD1-CG1 4.4Å; L296-V378 HydrophobicContact CB-CG2 3.96Å; L296-V378 HydrophobicContact CD1-CG2 4.26Å; F374-V378 HydrophobicContact CE1-CG2 4.37Å; F374-V378 PolarHBondContact O-N 3.48Å; S375-V378 WeakPolarHBondContact O-CB 3.34Å; S375-V378 PolarHBondContact O-N 3.43Å; S375-V378 VanDerWaalsContact O-N 3.11Å; V378-S381 PolarHBondContact O-OG 3.07Å; V378-I382 HydrophobicContact CG1-CD1 4.41Å; V378-I382 PolarHBondContact O-N 3.48Å
379	V	93.7	Very high	93.4	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.018	11%	0.114	C	C	.	.	H	α-helix	trans	-62.3	-51.3	-176.9	171.7	0	0	0	0	111.3	V88 P92 S375 S381 I382 L383 L404	V88-V379 HydrophobicContact CG1-CG2 4.08Å; V88-V379 WeakPolarHBondContact O-CG2 3.46Å; P92-V379 HydrophobicContact CB-CB 4.34Å; P92-V379 HydrophobicContact CB-CG1 4.4Å; P92-V379 HydrophobicContact CG-CB 4.5Å; P92-V379 HydrophobicContact CG-CG2 4.41Å; S375-V379 WeakPolarHBondContact O-CG2 3.33Å; S375-V379 PolarHBondContact O-N 2.99Å; V379-S381 PolarHBondContact O-N 2.89Å; V379-I382 PolarHBondContact O-N 3.05Å; V379-L383 HydrophobicContact CG1-CD1 3.79Å; V379-L383 HydrophobicContact CG1-CG 4.16Å; V379-L383 WeakPolarHBondContact O-CG 3.33Å; V379-L383 PolarHBondContact O-N 3.42Å; V379-L404 HydrophobicContact CG1-CD1 4.27Å; V379-L404 HydrophobicContact CG1-CD2 4.2Å
380	F	94.4	Very high	92.6	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.009	11%	0.114	C	C	.	.	H	α-helix	trans	-72.9	-26.4	-175.1	-85.4	-94.4	0	0	0	113.7	P92 Y96 G308 Y312 G376 I382 G384 V394	P92-F380 HydrophobicContact CB-CD2 3.95Å; P92-F380 HydrophobicContact CB-CE2 3.62Å; P92-F380 VanDerWaalsContact O-CE2 3.28Å; P92-F380 WeakPolarHBondContact O-CE2 3.48Å; Y96-F380 HydrophobicContact CD1-CZ 4.25Å; Y96-F380 HydrophobicContact CD2-CE1 4.34Å; Y96-F380 AromaticContact CG-CE1 3.96Å; Y96-F380 HydrophobicContact CG-CE1 3.96Å; Y96-F380 AromaticContact CG-CZ 3.82Å; Y96-F380 HydrophobicContact CG-CZ 3.82Å; G308-F380 CarbonylContact C-O 3.6Å; G308-F380 VanDerWaalsContact CA-O 3.28Å; G308-F380 WeakPolarHBondContact CA-O 3.48Å; G308-F380 WeakPolarHBondContact O-CB 3.48Å; G308-F380 WeakPolarHBondContact O-CD1 3.23Å; Y312-F380 AromaticContact CD2-CD2 3.99Å; Y312-F380 HydrophobicContact CD2-CD2 3.99Å; Y312-F380 HydrophobicContact CD2-CE2 4.19Å; Y312-F380 HydrophobicContact CG-CB 4.46Å; Y312-F380 HydrophobicContact CG-CD2 4.06Å; Y312-F380 HydrophobicContact CG-CG 4.23Å; G376-F380 WeakPolarHBondContact O-CB 3.38Å; G376-F380 WeakPolarHBondContact O-CD2 3.4Å; G376-F380 PolarHBondContact O-N 3.45Å; F380-I382 VanDerWaalsContact C-N 3.31Å; F380-G384 PolarHBondContact O-N 2.95Å; F380-V394 HydrophobicContact CD1-CG1 4.25Å; F380-V394 HydrophobicContact CE1-CG1 4.26Å
381	S	95.7	Very high	91.7	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63	-40.3	170.5	68.2	0	0	0	0	111.7	G299 F377 V378 V379 F385	G299-S381 WeakPolarHBondContact CA-OG 3.38Å; F377-S381 WeakPolarHBondContact O-CB 3.23Å; F377-S381 PolarHBondContact O-N 3.01Å; F377-S381 PolarHBondContact O-OG 3.29Å; V378-S381 PolarHBondContact O-OG 3.07Å; V379-S381 PolarHBondContact O-N 2.89Å; S381-F385 PolarHBondContact O-N 2.87Å
382	I	92.6	Very high	91	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-75.7	-40.6	179.2	-67.5	173.4	0	0	0	111.7	V378 V379 F380 G384 F385 M386 Y409 A412 M416	V378-I382 HydrophobicContact CG1-CD1 4.41Å; V378-I382 PolarHBondContact O-N 3.48Å; V379-I382 PolarHBondContact O-N 3.05Å; F380-I382 VanDerWaalsContact C-N 3.31Å; I382-G384 VanDerWaalsContact C-N 3.32Å; I382-G384 PolarHBondContact O-N 3.24Å; I382-F385 WeakPolarHBondContact O-CB 3.22Å; I382-F385 PolarHBondContact O-N 2.93Å; I382-M386 PolarHBondContact O-N 3.08Å; I382-Y409 HydrophobicContact CD1-CE2 3.65Å; I382-Y409 WeakPolarHBondContact CD1-OH 3.46Å; I382-Y409 HydrophobicContact CG2-CE2 4.28Å; I382-A412 HydrophobicContact CG2-CB 3.41Å; I382-A412 VanDerWaalsContact CG2-CB 3.41Å; I382-M416 HydrophobicContact CB-CE 4.45Å; I382-M416 HydrophobicContact CD1-CE 4.42Å; I382-M416 HydrophobicContact CG1-CE 4.12Å; I382-M416 HydrophobicContact CG2-CE 3.7Å
383	L	91.1	Very high	90.5	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-36.6	173.9	-68.9	-179.5	0	0	0	111.9	V379 F385 M386 A387 V397 A398 L404 A408	V379-L383 HydrophobicContact CG1-CD1 3.79Å; V379-L383 HydrophobicContact CG1-CG 4.16Å; V379-L383 WeakPolarHBondContact O-CG 3.33Å; V379-L383 PolarHBondContact O-N 3.42Å; L383-F385 VanDerWaalsContact C-N 3.29Å; L383-F385 PolarHBondContact O-N 3.25Å; L383-M386 PolarHBondContact O-N 3.03Å; L383-A387 WeakPolarHBondContact O-CB 3.45Å; L383-A387 PolarHBondContact O-N 3.28Å; L383-V397 HydrophobicContact CB-CG2 4.4Å; L383-V397 HydrophobicContact CD2-CG2 4.5Å; L383-A398 HydrophobicContact CD1-CB 4.41Å; L383-L404 HydrophobicContact CD1-CD1 4.03Å; L383-L404 HydrophobicContact CD2-CD1 4.22Å; L383-A408 HydrophobicContact CD2-CB 4.04Å
384	G	92.9	Very high	89.9	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-38.5	173.5	0	0	0	0	0	112.6	G304 F380 I382 A388	G304-G384 CarbonylContact O-C 3.46Å; F380-G384 PolarHBondContact O-N 2.95Å; I382-G384 VanDerWaalsContact C-N 3.32Å; I382-G384 PolarHBondContact O-N 3.24Å; G384-A388 WeakPolarHBondContact O-CB 3.14Å; G384-A388 PolarHBondContact O-N 3.38Å
385	F	91.7	Very high	89.2	Confident	7 Å²	7	20 Å²	20	3%	0.031	12%	0.122	C	C	.	.	H	α-helix	trans	-63.5	-49.2	171.3	165.8	-110.3	0	0	0	112.5	L302 P303 S381 I382 L383 A387 A388 E389 L415 M416	L302-F385 HydrophobicContact CB-CB 3.78Å; L302-F385 HydrophobicContact CB-CD2 3.74Å; L302-F385 HydrophobicContact CB-CE2 4.49Å; L302-F385 HydrophobicContact CB-CG 3.8Å; L302-F385 HydrophobicContact CD1-CB 3.98Å; L302-F385 HydrophobicContact CD1-CD1 3.76Å; L302-F385 HydrophobicContact CD1-CD2 4.32Å; L302-F385 HydrophobicContact CD1-CE1 4.3Å; L302-F385 HydrophobicContact CD1-CG 3.75Å; L302-F385 HydrophobicContact CD2-CD2 4.07Å; L302-F385 HydrophobicContact CD2-CE1 4.44Å; L302-F385 HydrophobicContact CD2-CE2 4Å; L302-F385 HydrophobicContact CD2-CG 4.31Å; L302-F385 HydrophobicContact CD2-CZ 4.2Å; L302-F385 HydrophobicContact CG-CB 4.46Å; L302-F385 HydrophobicContact CG-CD2 4.26Å; L302-F385 HydrophobicContact CG-CG 4.16Å; P303-F385 HydrophobicContact CG-CD2 3.79Å; P303-F385 HydrophobicContact CG-CE2 3.92Å; P303-F385 VanDerWaalsContact O-CA 3.24Å; P303-F385 WeakPolarHBondContact O-CA 3.48Å; P303-F385 WeakPolarHBondContact O-CB 3.5Å; S381-F385 PolarHBondContact O-N 2.87Å; I382-F385 WeakPolarHBondContact O-CB 3.22Å; I382-F385 PolarHBondContact O-N 2.93Å; L383-F385 VanDerWaalsContact C-N 3.29Å; L383-F385 PolarHBondContact O-N 3.25Å; F385-A387 VanDerWaalsContact C-N 3.29Å; F385-A387 PolarHBondContact O-N 3.17Å; F385-A388 PolarHBondContact O-N 2.77Å; F385-A388 VanDerWaalsContact O-N 3.15Å; F385-E389 HydrophobicContact CD2-CG 3.8Å; F385-E389 HydrophobicContact CE1-CG 4.29Å; F385-E389 HydrophobicContact CE2-CG 3.31Å; F385-E389 WeakPolarHBondContact CE2-OE1 3.17Å; F385-E389 HydrophobicContact CG-CG 4.47Å; F385-E389 HydrophobicContact CZ-CG 3.6Å; F385-E389 WeakPolarHBondContact O-CG 3.3Å; F385-E389 PolarHBondContact O-N 3.49Å; F385-L415 HydrophobicContact CE1-CB 3.74Å; F385-L415 HydrophobicContact CZ-CB 3.95Å; F385-M416 HydrophobicContact CD1-CE 4.1Å; F385-M416 HydrophobicContact CD1-CG 4.43Å; F385-M416 HydrophobicContact CE1-CE 4.28Å; F385-M416 HydrophobicContact CE1-CG 3.74Å; F385-M416 HydrophobicContact CZ-CG 4.37Å
386	M	88.7	Confident	88.5	Confident	14 Å²	14	27.2 Å²	27.2	7%	0.069	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-43.9	177.1	178.6	-179.9	163.4	0	0	112	I382 L383 E389 Q390 V397 K411 A412	I382-M386 PolarHBondContact O-N 3.08Å; L383-M386 PolarHBondContact O-N 3.03Å; M386-E389 PolarHBondContact O-N 3.43Å; M386-Q390 WeakPolarHBondContact O-CB 3.41Å; M386-Q390 WeakPolarHBondContact O-CG 3.45Å; M386-Q390 PolarHBondContact O-N 3.19Å; M386-V397 HydrophobicContact CE-CB 3.85Å; M386-V397 HydrophobicContact CE-CG1 3.69Å; M386-V397 HydrophobicContact CG-CG1 4.31Å; M386-V397 HydrophobicContact SD-CB 4.09Å; M386-V397 HydrophobicContact SD-CG1 4.29Å; M386-K411 HydrophobicContact CE-CB 4.2Å; M386-K411 HydrophobicContact CE-CG 3.79Å; M386-K411 HydrophobicContact SD-CB 4.32Å; M386-K411 HydrophobicContact SD-CG 4.24Å; M386-A412 HydrophobicContact CB-CB 3.9Å; M386-A412 HydrophobicContact CG-CB 4.42Å; M386-A412 HydrophobicContact SD-CB 4.18Å
387	A	87.8	Confident	87.8	Confident	3 Å²	3	27.5 Å²	27.5	3%	0.025	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-42.3	177.2	0	0	0	0	0	112	L383 F385 Q390 G391 V392 V394 V397	L383-A387 WeakPolarHBondContact O-CB 3.45Å; L383-A387 PolarHBondContact O-N 3.28Å; F385-A387 VanDerWaalsContact C-N 3.29Å; F385-A387 PolarHBondContact O-N 3.17Å; A387-Q390 PolarHBondContact O-N 2.92Å; A387-G391 WeakPolarHBondContact O-CA 3.19Å; A387-G391 PolarHBondContact O-N 3.44Å; A387-V392 HydrophobicContact CB-CG2 4.43Å; A387-V392 WeakPolarHBondContact CB-O 3.14Å; A387-V392 PolarHBondContact O-N 3.42Å; A387-V394 HydrophobicContact CB-CB 4.44Å; A387-V394 HydrophobicContact CB-CG2 3.75Å; A387-V397 HydrophobicContact CB-CG2 4.13Å
388	A	87.7	Confident	86.9	Confident	51 Å²	51	25.7 Å²	25.7	42%	0.421	15%	0.152	S	C	.	.	H	α-helix	trans	-66.4	-42.8	177.7	0	0	0	0	0	112.8	G384 F385 Q390 G391	G384-A388 WeakPolarHBondContact O-CB 3.14Å; G384-A388 PolarHBondContact O-N 3.38Å; F385-A388 PolarHBondContact O-N 2.77Å; F385-A388 VanDerWaalsContact O-N 3.15Å; A388-Q390 VanDerWaalsContact C-N 3.34Å; A388-G391 PolarHBondContact O-N 2.94Å
389	E	84.3	Confident	85.9	Confident	87 Å²	87	28.9 Å²	28.9	41%	0.407	17%	0.166	S	C	.	.	H	α-helix	trans	-65.6	-36.3	176.7	-71	-63	140.6	0	0	112.2	H199 F385 M386 L415	H199-E389 PolarHBondContact CE1-O 3.33Å; H199-E389 VanDerWaalsContact CE1-O 3.29Å; F385-E389 HydrophobicContact CD2-CG 3.8Å; F385-E389 HydrophobicContact CE1-CG 4.29Å; F385-E389 HydrophobicContact CE2-CG 3.31Å; F385-E389 WeakPolarHBondContact CE2-OE1 3.17Å; F385-E389 HydrophobicContact CG-CG 4.47Å; F385-E389 HydrophobicContact CZ-CG 3.6Å; F385-E389 WeakPolarHBondContact O-CG 3.3Å; F385-E389 PolarHBondContact O-N 3.49Å; M386-E389 PolarHBondContact O-N 3.43Å; E389-L415 HydrophobicContact CB-CD1 3.99Å; E389-L415 HydrophobicContact CG-CD1 4.41Å
390	Q	79.9	Confident	84.9	Confident	23 Å²	23	31.9 Å²	31.9	11%	0.107	19%	0.188	C	C	.	.	H	α-helix	trans	-84.3	-13.9	178.7	-68.4	176	0.7	0	0	113.2	M386 A387 A388 V392	M386-Q390 WeakPolarHBondContact O-CB 3.41Å; M386-Q390 WeakPolarHBondContact O-CG 3.45Å; M386-Q390 PolarHBondContact O-N 3.19Å; A387-Q390 PolarHBondContact O-N 2.92Å; A388-Q390 VanDerWaalsContact C-N 3.34Å; Q390-V392 VanDerWaalsContact C-N 3.3Å; Q390-V392 HydrophobicContact CB-CG1 4.28Å; Q390-V392 HydrophobicContact CB-CG2 3.9Å
391	G	77.3	Confident	84.2	Confident	39 Å²	39	32.7 Å²	32.7	40%	0.402	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	32.5	-174.5	0	0	0	0	0	112.9	A387 A388	A387-G391 WeakPolarHBondContact O-CA 3.19Å; A387-G391 PolarHBondContact O-N 3.44Å; A388-G391 PolarHBondContact O-N 2.94Å
392	V	80.9	Confident	83.7	Confident	29 Å²	29	33.4 Å²	33.4	18%	0.176	20%	0.201	C	C	.	.			trans	-115.3	166.1	178.8	-60.3	0	0	0	0	111.2	H200 A387 Q390 V397	H200-V392 HydrophobicContact CB-CG1 4.34Å; H200-V392 WeakPolarHBondContact CD2-CG1 3.37Å; A387-V392 HydrophobicContact CB-CG2 4.43Å; A387-V392 WeakPolarHBondContact CB-O 3.14Å; A387-V392 PolarHBondContact O-N 3.42Å; Q390-V392 VanDerWaalsContact C-N 3.3Å; Q390-V392 HydrophobicContact CB-CG1 4.28Å; Q390-V392 HydrophobicContact CB-CG2 3.9Å; V392-V397 HydrophobicContact CG2-CG1 3.62Å
393	D	85.4	Confident	83.3	Confident	63 Å²	63	33.9 Å²	33.9	34%	0.337	21%	0.206	S	C	.	.			trans	-74	146.9	172	-169.5	-101	0	0	0	111.6	Y311 S395 Q396	Y311-D393 VanDerWaalsContact CZ-OD2 3.28Å; Y311-D393 VanDerWaalsContact OH-CG 3.22Å; Y311-D393 PolarHBondContact OH-OD1 3.43Å; Y311-D393 PolarHBondContact OH-OD2 3.34Å; D393-S395 PolarHBondContact O-N 2.96Å; D393-S395 VanDerWaalsContact O-N 3.12Å; D393-S395 WeakPolarHBondContact OD1-CB 3.13Å; D393-S395 PolarHBondContact OD1-N 3.41Å; D393-S395 PolarHBondContact OD1-OG 2.91Å; D393-Q396 PolarHBondContact O-N 2.8Å
394	V	84	Confident	83.1	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.024	21%	0.208	C	C	.	.	H	α-helix	trans	-58	-29.7	179.8	-179.8	0	0	0	0	111.7	Y311 F380 A387 Q396 V397 A398	Y311-V394 HydrophobicContact CD1-CB 4.42Å; Y311-V394 HydrophobicContact CD2-CB 3.59Å; Y311-V394 HydrophobicContact CD2-CG1 4.27Å; Y311-V394 HydrophobicContact CD2-CG2 3.55Å; Y311-V394 HydrophobicContact CE2-CB 3.93Å; Y311-V394 HydrophobicContact CE2-CG2 3.9Å; Y311-V394 HydrophobicContact CG-CB 3.87Å; Y311-V394 HydrophobicContact CG-CG1 4.17Å; Y311-V394 HydrophobicContact CG-CG2 4.28Å; F380-V394 HydrophobicContact CD1-CG1 4.25Å; F380-V394 HydrophobicContact CE1-CG1 4.26Å; A387-V394 HydrophobicContact CB-CB 4.44Å; A387-V394 HydrophobicContact CB-CG2 3.75Å; V394-Q396 PolarHBondContact O-N 2.71Å; V394-V397 VanDerWaalsContact O-CG2 3.25Å; V394-V397 WeakPolarHBondContact O-CG2 3.45Å; V394-V397 PolarHBondContact O-N 3.49Å; V394-A398 WeakPolarHBondContact O-CB 3.48Å; V394-A398 PolarHBondContact O-N 2.99Å
395	S	83.3	Confident	83	Confident	38 Å²	38	34.3 Å²	34.3	27%	0.266	21%	0.209	S	C	.	.	H	α-helix	trans	-60.4	-27.6	176.6	60	0	0	0	0	114.4	Y96 D393	Y96-S395 VanDerWaalsContact OH-CA 3.24Å; Y96-S395 WeakPolarHBondContact OH-CA 3.24Å; Y96-S395 WeakPolarHBondContact OH-CB 3.49Å; D393-S395 PolarHBondContact O-N 2.96Å; D393-S395 VanDerWaalsContact O-N 3.12Å; D393-S395 WeakPolarHBondContact OD1-CB 3.13Å; D393-S395 PolarHBondContact OD1-N 3.41Å; D393-S395 PolarHBondContact OD1-OG 2.91Å
396	Q	79.3	Confident	83.1	Confident	150 Å²	150	34 Å²	34	70%	0.701	21%	0.207	S	C	*	.	H	α-helix	trans	-83.5	-16.9	-178	-60.4	-60.7	-43.6	0	0	112.9	D393 V394	D393-Q396 PolarHBondContact O-N 2.8Å; V394-Q396 PolarHBondContact O-N 2.71Å
397	V	80.4	Confident	83.2	Confident	7 Å²	7	34.1 Å²	34.1	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-107.2	-8.5	-179.5	-57.8	0	0	0	0	112.8	L383 M386 A387 V392 V394 E399	L383-V397 HydrophobicContact CB-CG2 4.4Å; L383-V397 HydrophobicContact CD2-CG2 4.5Å; M386-V397 HydrophobicContact CE-CB 3.85Å; M386-V397 HydrophobicContact CE-CG1 3.69Å; M386-V397 HydrophobicContact CG-CG1 4.31Å; M386-V397 HydrophobicContact SD-CB 4.09Å; M386-V397 HydrophobicContact SD-CG1 4.29Å; A387-V397 HydrophobicContact CB-CG2 4.13Å; V392-V397 HydrophobicContact CG2-CG1 3.62Å; V394-V397 VanDerWaalsContact O-CG2 3.25Å; V394-V397 WeakPolarHBondContact O-CG2 3.45Å; V394-V397 PolarHBondContact O-N 3.49Å; V397-E399 PolarHBondContact O-N 3.46Å
398	A	78.5	Confident	83.2	Confident	13 Å²	13	34 Å²	34	11%	0.107	21%	0.208	C	C	.	.			trans	-84.8	93.7	179.1	0	0	0	0	0	111	Y93 Y96 L383 V394	Y93-A398 WeakPolarHBondContact CE2-O 3.4Å; Y96-A398 HydrophobicContact CD1-CB 4.11Å; Y96-A398 HydrophobicContact CE1-CB 3.87Å; L383-A398 HydrophobicContact CD1-CB 4.41Å; V394-A398 WeakPolarHBondContact O-CB 3.48Å; V394-A398 PolarHBondContact O-N 2.99Å
399	E	75.3	Confident	83.3	Confident	69 Å²	69	32 Å²	32	32%	0.322	19%	0.189	S	C	.	.			trans	-91.6	167.5	171.8	-66.6	-174.2	-169.1	0	0	112.2	Y93 V397 G403 L404	Y93-E399 WeakPolarHBondContact CD2-O 3.44Å; V397-E399 PolarHBondContact O-N 3.46Å; E399-G403 WeakPolarHBondContact OE2-CA 3.35Å; E399-L404 WeakPolarHBondContact O-CB 3.38Å
400	S	72.7	Confident	83.7	Confident	66 Å²	66	27.9 Å²	27.9	46%	0.462	17%	0.17	S	C	.	.			trans	-114.4	150.3	176.8	70.8	0	0	0	0	112.4	Y93	Y93-S400 VanDerWaalsContact CD1-CB 3.46Å; Y93-S400 VanDerWaalsContact CE1-CB 3.44Å
401	G	79.6	Confident	84.2	Confident	18 Å²	18	27.2 Å²	27.2	19%	0.186	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	-140.2	171.8	0	0	0	0	0	112.5	G403 L404	G401-G403 PolarHBondContact O-N 3.32Å; G401-L404 PolarHBondContact O-N 3.14Å; G401-L404 VanDerWaalsContact O-N 3.12Å
402	P	83.9	Confident	84.7	Confident	16 Å²	16	25.3 Å²	25.3	10%	0.104	15%	0.147	C	C	.	.	H	α-helix	trans	-55.9	-34.1	-179.3	-27.6	36	0	0	0	114.2	W89 W167 W234 L404 A405 F406 M487 F490	W89-P402 HydrophobicContact CH2-CG 4.37Å; W89-P402 HydrophobicContact CZ3-CG 4.45Å; W167-P402 HydrophobicContact CZ3-CB 4.34Å; W167-P402 HydrophobicContact CZ3-CG 4.29Å; W234-P402 HydrophobicContact CZ2-CB 4.33Å; P402-L404 VanDerWaalsContact C-N 3.3Å; P402-L404 PolarHBondContact O-N 2.82Å; P402-A405 PolarHBondContact O-N 3.4Å; P402-F406 HydrophobicContact CB-CD2 4.05Å; P402-F406 WeakPolarHBondContact O-CB 3.2Å; P402-F406 VanDerWaalsContact O-CD2 3.3Å; P402-F406 WeakPolarHBondContact O-CD2 3.45Å; P402-F406 PolarHBondContact O-N 3.42Å; P402-M487 HydrophobicContact CB-CE 4.43Å; P402-M487 HydrophobicContact CG-CE 4.35Å; P402-F490 HydrophobicContact CG-CE1 4.05Å; P402-F490 HydrophobicContact CG-CZ 4.39Å
403	G	85.8	Confident	85.3	Confident	12 Å²	12	24 Å²	24	12%	0.124	14%	0.14	C	C	.	.	H	α-helix	trans	-59.4	-39.4	177.5	0	0	0	0	0	112.7	E399 G401 A405 I407 A408	E399-G403 WeakPolarHBondContact OE2-CA 3.35Å; G401-G403 PolarHBondContact O-N 3.32Å; G403-A405 PolarHBondContact O-N 3.02Å; G403-I407 VanDerWaalsContact O-CA 3.29Å; G403-I407 WeakPolarHBondContact O-CA 3.19Å; G403-I407 WeakPolarHBondContact O-CB 3.46Å; G403-I407 PolarHBondContact O-N 3.44Å; G403-A408 PolarHBondContact O-N 3.18Å
404	L	86.1	Confident	85.5	Confident	7 Å²	7	22.2 Å²	22.2	4%	0.037	13%	0.132	C	C	.	.	I	π-helix	trans	-62.7	-46.5	177.2	-176.1	56	0	0	0	112.5	W89 V379 L383 E399 G401 P402 A408 Y409	W89-L404 HydrophobicContact CB-CB 4.5Å; W89-L404 HydrophobicContact CB-CD2 4.12Å; W89-L404 WeakPolarHBondContact O-CD2 3.28Å; V379-L404 HydrophobicContact CG1-CD1 4.27Å; V379-L404 HydrophobicContact CG1-CD2 4.2Å; L383-L404 HydrophobicContact CD1-CD1 4.03Å; L383-L404 HydrophobicContact CD2-CD1 4.22Å; E399-L404 WeakPolarHBondContact O-CB 3.38Å; G401-L404 PolarHBondContact O-N 3.14Å; G401-L404 VanDerWaalsContact O-N 3.12Å; P402-L404 VanDerWaalsContact C-N 3.3Å; P402-L404 PolarHBondContact O-N 2.82Å; L404-A408 HydrophobicContact CD1-CB 4.02Å; L404-Y409 VanDerWaalsContact O-CB 3.31Å; L404-Y409 WeakPolarHBondContact O-CB 3.4Å; L404-Y409 PolarHBondContact O-N 3.32Å
405	A	90.1	Very high	85.7	Confident	4 Å²	4	25 Å²	25	3%	0.033	15%	0.146	C	C	.	.	I	π-helix	trans	-82.5	-29.3	-175.5	0	0	0	0	0	114.2	W89 P402 G403 P410 F426 L430	W89-A405 HydrophobicContact CE3-CB 3.59Å; W89-A405 HydrophobicContact CZ3-CB 4.15Å; P402-A405 PolarHBondContact O-N 3.4Å; G403-A405 PolarHBondContact O-N 3.02Å; A405-P410 VanDerWaalsContact O-CD 3.25Å; A405-P410 WeakPolarHBondContact O-CD 3.49Å; A405-P410 VanDerWaalsContact O-CG 3.28Å; A405-P410 WeakPolarHBondContact O-CG 3.26Å; A405-F426 HydrophobicContact CB-CZ 4.25Å; A405-L430 HydrophobicContact CB-CD1 3.81Å
406	F	93.3	Very high	86	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	I	π-helix	trans	-109.4	-7	-174.9	-59.6	-67.7	0	0	0	114.1	W89 V164 W167 Y171 I230 W234 P402 F427 L430	W89-F406 HydrophobicContact CZ3-CE2 4.06Å; V164-F406 HydrophobicContact CG1-CE2 3.92Å; V164-F406 HydrophobicContact CG1-CZ 3.93Å; W167-F406 HydrophobicContact CB-CD1 4.32Å; W167-F406 HydrophobicContact CB-CE1 3.69Å; W167-F406 HydrophobicContact CB-CE2 4.06Å; W167-F406 HydrophobicContact CB-CZ 3.55Å; W167-F406 HydrophobicContact CE3-CD2 4.31Å; W167-F406 AromaticContact CE3-CE2 3.79Å; W167-F406 HydrophobicContact CE3-CE2 3.79Å; W167-F406 HydrophobicContact CE3-CZ 4.36Å; Y171-F406 AromaticContact CD2-CD1 3.62Å; Y171-F406 HydrophobicContact CD2-CD1 3.62Å; Y171-F406 HydrophobicContact CD2-CE1 4.07Å; Y171-F406 HydrophobicContact CE2-CB 4.19Å; Y171-F406 AromaticContact CE2-CD1 3.61Å; Y171-F406 HydrophobicContact CE2-CD1 3.61Å; Y171-F406 HydrophobicContact CE2-CE1 4.44Å; Y171-F406 HydrophobicContact CE2-CG 4.25Å; Y171-F406 HydrophobicContact CG-CD1 4.25Å; Y171-F406 PolarHBondContact OH-O 3.4Å; I230-F406 WeakPolarHBondContact CD1-O 2.96Å; W234-F406 HydrophobicContact CD2-CB 4.19Å; W234-F406 HydrophobicContact CE3-CB 3.65Å; W234-F406 HydrophobicContact CE3-CG 4.24Å; W234-F406 HydrophobicContact CH2-CB 3.91Å; W234-F406 AromaticContact CH2-CD2 3.67Å; W234-F406 HydrophobicContact CH2-CD2 3.67Å; W234-F406 HydrophobicContact CH2-CE2 4.39Å; W234-F406 AromaticContact CH2-CG 3.84Å; W234-F406 HydrophobicContact CH2-CG 3.84Å; W234-F406 HydrophobicContact CZ2-CB 4.45Å; W234-F406 HydrophobicContact CZ2-CD2 4.46Å; W234-F406 HydrophobicContact CZ3-CB 3.48Å; W234-F406 VanDerWaalsContact CZ3-CB 3.48Å; W234-F406 HydrophobicContact CZ3-CD1 4.1Å; W234-F406 AromaticContact CZ3-CD2 3.9Å; W234-F406 HydrophobicContact CZ3-CD2 3.9Å; W234-F406 AromaticContact CZ3-CG 3.56Å; W234-F406 HydrophobicContact CZ3-CG 3.56Å; P402-F406 HydrophobicContact CB-CD2 4.05Å; P402-F406 WeakPolarHBondContact O-CB 3.2Å; P402-F406 VanDerWaalsContact O-CD2 3.3Å; P402-F406 WeakPolarHBondContact O-CD2 3.45Å; P402-F406 PolarHBondContact O-N 3.42Å; F406-F427 AromaticContact CD1-CE1 3.81Å; F406-F427 HydrophobicContact CD1-CE1 3.81Å; F406-F427 HydrophobicContact CD1-CZ 4.49Å; F406-F427 HydrophobicContact CE1-CD1 4.4Å; F406-F427 AromaticContact CE1-CE1 3.86Å; F406-F427 HydrophobicContact CE1-CE1 3.86Å; F406-L430 HydrophobicContact CE1-CD1 4.41Å; F406-L430 HydrophobicContact CZ-CD1 4.29Å; F406-L430 HydrophobicContact CZ-CD2 4.36Å
407	I	90.8	Very high	86.5	Confident	17 Å²	17	20.5 Å²	20.5	9%	0.087	13%	0.128	C	C	.	.	I	π-helix	trans	-122.3	-65.2	176.2	-53.9	176.4	0	0	0	110.8	I230 I231 W234 G403 P410 K411	I230-I407 HydrophobicContact CG1-CB 4.48Å; I230-I407 HydrophobicContact CG1-CG2 4.28Å; I230-I407 WeakPolarHBondContact CG1-O 3.33Å; I230-I407 HydrophobicContact CG2-CG2 3.92Å; I231-I407 HydrophobicContact CG1-CG2 3.69Å; W234-I407 HydrophobicContact CB-CG1 4.23Å; W234-I407 HydrophobicContact CG-CD1 4.21Å; W234-I407 HydrophobicContact CG-CG1 4.1Å; G403-I407 VanDerWaalsContact O-CA 3.29Å; G403-I407 WeakPolarHBondContact O-CA 3.19Å; G403-I407 WeakPolarHBondContact O-CB 3.46Å; G403-I407 PolarHBondContact O-N 3.44Å; I407-P410 WeakPolarHBondContact O-CD 3.39Å; I407-K411 VanDerWaalsContact O-CB 3.29Å; I407-K411 WeakPolarHBondContact O-CB 3.47Å; I407-K411 PolarHBondContact O-N 3.45Å
408	A	89.2	Confident	87.1	Confident	2 Å²	2	25.1 Å²	25.1	2%	0.017	16%	0.156	C	C	.	.	I	π-helix	trans	-66.5	-48.5	-173.2	0	0	0	0	0	112.5	L383 G403 L404 K411 A412	L383-A408 HydrophobicContact CD2-CB 4.04Å; G403-A408 PolarHBondContact O-N 3.18Å; L404-A408 HydrophobicContact CD1-CB 4.02Å; A408-K411 PolarHBondContact O-N 3.04Å; A408-A412 PolarHBondContact O-N 3.46Å
409	Y	89.8	Confident	87.9	Confident	7 Å²	7	25.1 Å²	25.1	3%	0.027	16%	0.156	C	C	.	.	H	α-helix	trans	-65.3	-47.9	-178.2	-160.6	-79.7	0	0	0	113.4	L295 I382 L404 K411 A412 V413 F426	L295-Y409 WeakPolarHBondContact CD1-OH 3.35Å; L295-Y409 WeakPolarHBondContact CD2-OH 3.19Å; I382-Y409 HydrophobicContact CD1-CE2 3.65Å; I382-Y409 WeakPolarHBondContact CD1-OH 3.46Å; I382-Y409 HydrophobicContact CG2-CE2 4.28Å; L404-Y409 VanDerWaalsContact O-CB 3.31Å; L404-Y409 WeakPolarHBondContact O-CB 3.4Å; L404-Y409 PolarHBondContact O-N 3.32Å; Y409-K411 PolarHBondContact O-N 3Å; Y409-A412 PolarHBondContact O-N 3.23Å; Y409-A412 VanDerWaalsContact O-N 3.16Å; Y409-V413 HydrophobicContact CD1-CG2 3.66Å; Y409-V413 HydrophobicContact CE1-CG2 3.37Å; Y409-V413 WeakPolarHBondContact O-CG2 3.43Å; Y409-V413 PolarHBondContact O-N 2.98Å; Y409-F426 HydrophobicContact CD1-CB 4.27Å; Y409-F426 AromaticContact CD1-CD1 3.48Å; Y409-F426 HydrophobicContact CD1-CD1 3.48Å; Y409-F426 VanDerWaalsContact CD1-CD1 3.48Å; Y409-F426 AromaticContact CD1-CD2 3.59Å; Y409-F426 HydrophobicContact CD1-CD2 3.59Å; Y409-F426 AromaticContact CD1-CE1 3.55Å; Y409-F426 HydrophobicContact CD1-CE1 3.55Å; Y409-F426 AromaticContact CD1-CE2 3.65Å; Y409-F426 HydrophobicContact CD1-CE2 3.65Å; Y409-F426 AromaticContact CD1-CG 3.49Å; Y409-F426 HydrophobicContact CD1-CG 3.49Å; Y409-F426 VanDerWaalsContact CD1-CG 3.49Å; Y409-F426 AromaticContact CD1-CZ 3.63Å; Y409-F426 HydrophobicContact CD1-CZ 3.63Å; Y409-F426 HydrophobicContact CD2-CD2 4.28Å; Y409-F426 AromaticContact CD2-CE2 3.78Å; Y409-F426 HydrophobicContact CD2-CE2 3.78Å; Y409-F426 HydrophobicContact CD2-CZ 4.03Å; Y409-F426 HydrophobicContact CE1-CB 3.62Å; Y409-F426 AromaticContact CE1-CD1 3.71Å; Y409-F426 HydrophobicContact CE1-CD1 3.71Å; Y409-F426 AromaticContact CE1-CD2 3.15Å; Y409-F426 HydrophobicContact CE1-CD2 3.15Å; Y409-F426 HydrophobicContact CE1-CE1 4.14Å; Y409-F426 AromaticContact CE1-CE2 3.64Å; Y409-F426 HydrophobicContact CE1-CE2 3.64Å; Y409-F426 AromaticContact CE1-CG 3.18Å; Y409-F426 HydrophobicContact CE1-CG 3.18Å; Y409-F426 HydrophobicContact CE1-CZ 4.1Å; Y409-F426 AromaticContact CE2-CD2 3.9Å; Y409-F426 HydrophobicContact CE2-CD2 3.9Å; Y409-F426 AromaticContact CE2-CE2 3.74Å; Y409-F426 HydrophobicContact CE2-CE2 3.74Å; Y409-F426 HydrophobicContact CE2-CZ 4.44Å; Y409-F426 HydrophobicContact CG-CD1 4.29Å; Y409-F426 HydrophobicContact CG-CD2 4.14Å; Y409-F426 AromaticContact CG-CE1 3.9Å; Y409-F426 HydrophobicContact CG-CE1 3.9Å; Y409-F426 AromaticContact CG-CE2 3.73Å; Y409-F426 HydrophobicContact CG-CE2 3.73Å; Y409-F426 HydrophobicContact CG-CG 4.39Å; Y409-F426 AromaticContact CG-CZ 3.59Å; Y409-F426 HydrophobicContact CG-CZ 3.59Å; Y409-F426 AromaticContact CZ-CD2 3.32Å; Y409-F426 AromaticContact CZ-CE2 3.67Å; Y409-F426 AromaticContact CZ-CG 3.87Å
410	P	92.1	Very high	88.8	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.006	15%	0.151	C	C	.	.	H	α-helix	trans	-65	-31	179.2	-24	38.9	0	0	0	112.3	Y171 W182 I230 A405 I407 S414 F427	Y171-P410 HydrophobicContact CE1-CB 4.47Å; Y171-P410 HydrophobicContact CE1-CG 4.34Å; W182-P410 HydrophobicContact CZ2-CB 4.38Å; W182-P410 PolarHBondContact NE1-O 3.05Å; I230-P410 HydrophobicContact CD1-CB 3.83Å; I230-P410 HydrophobicContact CD1-CG 4.45Å; I230-P410 HydrophobicContact CG1-CB 4.46Å; A405-P410 VanDerWaalsContact O-CD 3.25Å; A405-P410 WeakPolarHBondContact O-CD 3.49Å; A405-P410 VanDerWaalsContact O-CG 3.28Å; A405-P410 WeakPolarHBondContact O-CG 3.26Å; I407-P410 WeakPolarHBondContact O-CD 3.39Å; P410-S414 PolarHBondContact O-N 3.08Å; P410-F427 HydrophobicContact CB-CE2 4.48Å; P410-F427 HydrophobicContact CB-CZ 4.25Å; P410-F427 HydrophobicContact CG-CE1 4.46Å; P410-F427 HydrophobicContact CG-CE2 4.17Å; P410-F427 HydrophobicContact CG-CZ 3.51Å
411	K	89.6	Confident	89.9	Confident	9 Å²	9	24.5 Å²	24.5	4%	0.039	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-49.6	171	-176.1	56.5	177	179.6	0	111.4	E196 I230 M386 I407 A408 Y409 V413 S414 L415	E196-K411 PolarHBondContact O-NZ 2.95Å; I230-K411 HydrophobicContact CB-CB 4.49Å; I230-K411 HydrophobicContact CG2-CB 3.92Å; I230-K411 HydrophobicContact CG2-CD 4.17Å; I230-K411 HydrophobicContact CG2-CG 4.26Å; M386-K411 HydrophobicContact CE-CB 4.2Å; M386-K411 HydrophobicContact CE-CG 3.79Å; M386-K411 HydrophobicContact SD-CB 4.32Å; M386-K411 HydrophobicContact SD-CG 4.24Å; I407-K411 VanDerWaalsContact O-CB 3.29Å; I407-K411 WeakPolarHBondContact O-CB 3.47Å; I407-K411 PolarHBondContact O-N 3.45Å; A408-K411 PolarHBondContact O-N 3.04Å; Y409-K411 PolarHBondContact O-N 3Å; K411-V413 VanDerWaalsContact C-N 3.28Å; K411-V413 PolarHBondContact O-N 3.44Å; K411-S414 PolarHBondContact O-N 3.17Å; K411-S414 VanDerWaalsContact O-N 3.15Å; K411-S414 PolarHBondContact O-OG 3.1Å; K411-L415 PolarHBondContact O-N 3.28Å
412	A	89.6	Confident	90.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.9	-41.8	177.5	0	0	0	0	0	111.7	I382 M386 A408 Y409 S414 L415	I382-A412 HydrophobicContact CG2-CB 3.41Å; I382-A412 VanDerWaalsContact CG2-CB 3.41Å; M386-A412 HydrophobicContact CB-CB 3.9Å; M386-A412 HydrophobicContact CG-CB 4.42Å; M386-A412 HydrophobicContact SD-CB 4.18Å; A408-A412 PolarHBondContact O-N 3.46Å; Y409-A412 PolarHBondContact O-N 3.23Å; Y409-A412 VanDerWaalsContact O-N 3.16Å; A412-S414 PolarHBondContact O-N 3.49Å; A412-L415 PolarHBondContact O-N 2.85Å
413	V	91.8	Very high	91.2	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-63.5	-38.8	176.3	165.9	0	0	0	0	112.7	L180 Y409 K411 L415 M416 A419 W422 A423	L180-V413 HydrophobicContact CD1-CG1 4.31Å; Y409-V413 HydrophobicContact CD1-CG2 3.66Å; Y409-V413 HydrophobicContact CE1-CG2 3.37Å; Y409-V413 WeakPolarHBondContact O-CG2 3.43Å; Y409-V413 PolarHBondContact O-N 2.98Å; K411-V413 VanDerWaalsContact C-N 3.28Å; K411-V413 PolarHBondContact O-N 3.44Å; V413-L415 PolarHBondContact O-N 3.39Å; V413-L415 VanDerWaalsContact O-N 3.16Å; V413-M416 WeakPolarHBondContact O-CB 3.4Å; V413-M416 PolarHBondContact O-N 3.35Å; V413-A419 HydrophobicContact CG1-CB 4.45Å; V413-A419 WeakPolarHBondContact CG1-O 3.35Å; V413-A419 VanDerWaalsContact O-CB 3.31Å; V413-A419 WeakPolarHBondContact O-CB 3.32Å; V413-W422 HydrophobicContact CG1-CB 3.77Å; V413-W422 HydrophobicContact CG2-CB 4.32Å; V413-A423 HydrophobicContact CG1-CB 3.85Å
414	S	90.9	Very high	91.7	Very high	24 Å²	24	25 Å²	25	17%	0.168	15%	0.146	C	C	.	.	H	α-helix	trans	-62.6	-20.5	178.3	69.2	0	0	0	0	114	P410 K411 A412 M416	P410-S414 PolarHBondContact O-N 3.08Å; K411-S414 PolarHBondContact O-N 3.17Å; K411-S414 VanDerWaalsContact O-N 3.15Å; K411-S414 PolarHBondContact O-OG 3.1Å; A412-S414 PolarHBondContact O-N 3.49Å; S414-M416 VanDerWaalsContact C-N 3.35Å
415	L	88.3	Confident	92.1	Very high	63 Å²	63	26.6 Å²	26.6	33%	0.33	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-9.8	177.2	-59.3	172.3	0	0	0	112.4	F385 E389 K411 A412 V413	F385-L415 HydrophobicContact CE1-CB 3.74Å; F385-L415 HydrophobicContact CZ-CB 3.95Å; E389-L415 HydrophobicContact CB-CD1 3.99Å; E389-L415 HydrophobicContact CG-CD1 4.41Å; K411-L415 PolarHBondContact O-N 3.28Å; A412-L415 PolarHBondContact O-N 2.85Å; V413-L415 PolarHBondContact O-N 3.39Å; V413-L415 VanDerWaalsContact O-N 3.16Å
416	M	89.6	Confident	92.3	Very high	11 Å²	11	26.7 Å²	26.7	5%	0.054	15%	0.154	C	C	.	.	S	Bend	trans	-88.7	146.6	-178.8	-58.5	-174.5	-160.3	0	0	111.6	R298 L302 I382 F385 V413 S414 V418 A419 W422	R298-M416 HydrophobicContact CG-SD 4.41Å; L302-M416 HydrophobicContact CD1-CE 3.52Å; L302-M416 HydrophobicContact CD1-CG 4.34Å; L302-M416 HydrophobicContact CD1-SD 3.84Å; I382-M416 HydrophobicContact CB-CE 4.45Å; I382-M416 HydrophobicContact CD1-CE 4.42Å; I382-M416 HydrophobicContact CG1-CE 4.12Å; I382-M416 HydrophobicContact CG2-CE 3.7Å; F385-M416 HydrophobicContact CD1-CE 4.1Å; F385-M416 HydrophobicContact CD1-CG 4.43Å; F385-M416 HydrophobicContact CE1-CE 4.28Å; F385-M416 HydrophobicContact CE1-CG 3.74Å; F385-M416 HydrophobicContact CZ-CG 4.37Å; V413-M416 WeakPolarHBondContact O-CB 3.4Å; V413-M416 PolarHBondContact O-N 3.35Å; S414-M416 VanDerWaalsContact C-N 3.35Å; M416-V418 PolarHBondContact O-N 2.9Å; M416-A419 WeakPolarHBondContact O-CB 3.32Å; M416-A419 PolarHBondContact O-N 3.13Å; M416-W422 HydrophobicContact SD-CG 4.45Å
417	P	90	Very high	92.5	Very high	83 Å²	83	26.7 Å²	26.7	54%	0.539	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	141.2	168.9	26.7	-35.1	0	0	0	110.4	A419 W422	P417-A419 VanDerWaalsContact C-N 3.32Å; P417-W422 PolarHBondContact O-NE1 2.89Å
418	V	92.9	Very high	92.8	Very high	103 Å²	103	29 Å²	29	62%	0.624	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	40.3	-175.4	-156.2	0	0	0	0	112	M416 P420 L421 W422	M416-V418 PolarHBondContact O-N 2.9Å; V418-P420 VanDerWaalsContact C-N 3.31Å; V418-P420 VanDerWaalsContact O-N 3.14Å; V418-L421 HydrophobicContact CG1-CB 3.86Å; V418-L421 HydrophobicContact CG1-CD2 4.42Å; V418-L421 WeakPolarHBondContact O-CB 3.39Å; V418-L421 PolarHBondContact O-N 2.9Å; V418-W422 VanDerWaalsContact O-CD1 3.27Å
419	A	93.7	Very high	93	Very high	13 Å²	13	29 Å²	29	11%	0.107	16%	0.163	C	C	.	.	H	α-helix	trans	-46.4	-41.4	-177.9	0	0	0	0	0	115.3	L180 V413 M416 P417 L421 W422 A423	L180-A419 HydrophobicContact CD1-CB 3.59Å; L180-A419 HydrophobicContact CG-CB 4.3Å; V413-A419 HydrophobicContact CG1-CB 4.45Å; V413-A419 WeakPolarHBondContact CG1-O 3.35Å; V413-A419 VanDerWaalsContact O-CB 3.31Å; V413-A419 WeakPolarHBondContact O-CB 3.32Å; M416-A419 WeakPolarHBondContact O-CB 3.32Å; M416-A419 PolarHBondContact O-N 3.13Å; P417-A419 VanDerWaalsContact C-N 3.32Å; A419-L421 VanDerWaalsContact C-N 3.28Å; A419-L421 PolarHBondContact O-N 3.29Å; A419-W422 PolarHBondContact O-N 3.02Å; A419-A423 WeakPolarHBondContact O-CB 3.44Å; A419-A423 PolarHBondContact O-N 3.25Å
420	P	95.7	Very high	93.2	Very high	34 Å²	34	29 Å²	29	22%	0.221	16%	0.163	C	C	.	.	H	α-helix	trans	-55.9	-37.4	177.5	-29.2	38.1	0	0	0	114.6	S177 L180 V418 A424	S177-P420 VanDerWaalsContact O-CG 3.26Å; S177-P420 WeakPolarHBondContact O-CG 3.42Å; L180-P420 HydrophobicContact CD2-CB 4.46Å; L180-P420 HydrophobicContact CD2-CG 4.36Å; L180-P420 HydrophobicContact CG-CG 4.45Å; V418-P420 VanDerWaalsContact C-N 3.31Å; V418-P420 VanDerWaalsContact O-N 3.14Å; P420-A424 VanDerWaalsContact O-CB 3.31Å; P420-A424 WeakPolarHBondContact O-CB 3.43Å; P420-A424 PolarHBondContact O-N 3.33Å
421	L	94.9	Very high	93.4	Very high	89 Å²	89	29.3 Å²	29.3	47%	0.466	17%	0.165	S	C	.	.	H	α-helix	trans	-65	-48.5	178.8	174.9	64.3	0	0	0	111.2	V418 A419 A423 A424 L425	V418-L421 HydrophobicContact CG1-CB 3.86Å; V418-L421 HydrophobicContact CG1-CD2 4.42Å; V418-L421 WeakPolarHBondContact O-CB 3.39Å; V418-L421 PolarHBondContact O-N 2.9Å; A419-L421 VanDerWaalsContact C-N 3.28Å; A419-L421 PolarHBondContact O-N 3.29Å; L421-A423 VanDerWaalsContact C-N 3.34Å; L421-A424 PolarHBondContact O-N 3.09Å; L421-L425 HydrophobicContact CD1-CD1 4.14Å; L421-L425 HydrophobicContact CD1-CG 4.33Å; L421-L425 HydrophobicContact CG-CD1 4.18Å; L421-L425 WeakPolarHBondContact O-CB 3.31Å; L421-L425 WeakPolarHBondContact O-CG 3.39Å; L421-L425 PolarHBondContact O-N 3.5Å
422	W	95.1	Very high	93.7	Very high	39 Å²	39	29.4 Å²	29.4	15%	0.148	17%	0.166	C	C	.	.	H	α-helix	trans	-66.4	-38.6	-178.7	-55.3	111.5	0	0	0	111.6	I294 L295 R298 V413 M416 P417 V418 A419 F426	I294-W422 HydrophobicContact CG2-CZ3 3.97Å; L295-W422 HydrophobicContact CD2-CE3 4.1Å; R298-W422 HydrophobicContact CB-CH2 3.79Å; R298-W422 HydrophobicContact CB-CZ3 3.78Å; R298-W422 HydrophobicContact CG-CD2 4.46Å; R298-W422 HydrophobicContact CG-CE3 4.24Å; R298-W422 HydrophobicContact CG-CH2 3.58Å; R298-W422 HydrophobicContact CG-CZ2 3.82Å; R298-W422 HydrophobicContact CG-CZ3 3.8Å; V413-W422 HydrophobicContact CG1-CB 3.77Å; V413-W422 HydrophobicContact CG2-CB 4.32Å; M416-W422 HydrophobicContact SD-CG 4.45Å; P417-W422 PolarHBondContact O-NE1 2.89Å; V418-W422 VanDerWaalsContact O-CD1 3.27Å; A419-W422 PolarHBondContact O-N 3.02Å; W422-F426 WeakPolarHBondContact O-CB 3.28Å; W422-F426 PolarHBondContact O-N 3.37Å
423	A	95.6	Very high	93.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-49	176	0	0	0	0	0	110.9	S175 L180 W182 V413 A419 L421 L425 F426 F427	S175-A423 WeakPolarHBondContact OG-CB 3.34Å; L180-A423 HydrophobicContact CD1-CB 4.12Å; L180-A423 HydrophobicContact CD2-CB 4.04Å; W182-A423 HydrophobicContact CZ2-CB 4.01Å; V413-A423 HydrophobicContact CG1-CB 3.85Å; A419-A423 WeakPolarHBondContact O-CB 3.44Å; A419-A423 PolarHBondContact O-N 3.25Å; L421-A423 VanDerWaalsContact C-N 3.34Å; A423-L425 PolarHBondContact O-N 3.39Å; A423-F426 PolarHBondContact O-N 3.11Å; A423-F427 HydrophobicContact CB-CD2 4.43Å; A423-F427 WeakPolarHBondContact O-CD2 3.35Å; A423-F427 PolarHBondContact O-N 3.19Å
424	A	96.6	Very high	94.1	Very high	18 Å²	18	29.6 Å²	29.6	15%	0.149	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-44.5	178.5	0	0	0	0	0	112	L172 P420 L421 F428	L172-A424 HydrophobicContact CD1-CB 4.3Å; L172-A424 WeakPolarHBondContact CD1-O 3.28Å; P420-A424 VanDerWaalsContact O-CB 3.31Å; P420-A424 WeakPolarHBondContact O-CB 3.43Å; P420-A424 PolarHBondContact O-N 3.33Å; L421-A424 PolarHBondContact O-N 3.09Å; A424-F428 WeakPolarHBondContact O-CB 3.44Å; A424-F428 PolarHBondContact O-N 3.45Å
425	L	95.4	Very high	94.3	Very high	39 Å²	39	28.6 Å²	28.6	20%	0.204	16%	0.16	C	C	.	.	H	α-helix	trans	-61.6	-45.4	176.4	-73.8	173.7	0	0	0	112	V291 L421 A423 M429	V291-L425 HydrophobicContact CG1-CB 4.24Å; L421-L425 HydrophobicContact CD1-CD1 4.14Å; L421-L425 HydrophobicContact CD1-CG 4.33Å; L421-L425 HydrophobicContact CG-CD1 4.18Å; L421-L425 WeakPolarHBondContact O-CB 3.31Å; L421-L425 WeakPolarHBondContact O-CG 3.39Å; L421-L425 PolarHBondContact O-N 3.5Å; A423-L425 PolarHBondContact O-N 3.39Å; L425-M429 WeakPolarHBondContact O-CB 3.46Å; L425-M429 PolarHBondContact O-N 2.76Å
426	F	94.6	Very high	94.6	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-50.1	179.9	174.5	-103.5	0	0	0	112.3	L295 A405 Y409 W422 A423 F428 M429 L430	L295-F426 HydrophobicContact CD1-CD2 4.38Å; A405-F426 HydrophobicContact CB-CZ 4.25Å; Y409-F426 HydrophobicContact CD1-CB 4.27Å; Y409-F426 AromaticContact CD1-CD1 3.48Å; Y409-F426 HydrophobicContact CD1-CD1 3.48Å; Y409-F426 VanDerWaalsContact CD1-CD1 3.48Å; Y409-F426 AromaticContact CD1-CD2 3.59Å; Y409-F426 HydrophobicContact CD1-CD2 3.59Å; Y409-F426 AromaticContact CD1-CE1 3.55Å; Y409-F426 HydrophobicContact CD1-CE1 3.55Å; Y409-F426 AromaticContact CD1-CE2 3.65Å; Y409-F426 HydrophobicContact CD1-CE2 3.65Å; Y409-F426 AromaticContact CD1-CG 3.49Å; Y409-F426 HydrophobicContact CD1-CG 3.49Å; Y409-F426 VanDerWaalsContact CD1-CG 3.49Å; Y409-F426 AromaticContact CD1-CZ 3.63Å; Y409-F426 HydrophobicContact CD1-CZ 3.63Å; Y409-F426 HydrophobicContact CD2-CD2 4.28Å; Y409-F426 AromaticContact CD2-CE2 3.78Å; Y409-F426 HydrophobicContact CD2-CE2 3.78Å; Y409-F426 HydrophobicContact CD2-CZ 4.03Å; Y409-F426 HydrophobicContact CE1-CB 3.62Å; Y409-F426 AromaticContact CE1-CD1 3.71Å; Y409-F426 HydrophobicContact CE1-CD1 3.71Å; Y409-F426 AromaticContact CE1-CD2 3.15Å; Y409-F426 HydrophobicContact CE1-CD2 3.15Å; Y409-F426 HydrophobicContact CE1-CE1 4.14Å; Y409-F426 AromaticContact CE1-CE2 3.64Å; Y409-F426 HydrophobicContact CE1-CE2 3.64Å; Y409-F426 AromaticContact CE1-CG 3.18Å; Y409-F426 HydrophobicContact CE1-CG 3.18Å; Y409-F426 HydrophobicContact CE1-CZ 4.1Å; Y409-F426 AromaticContact CE2-CD2 3.9Å; Y409-F426 HydrophobicContact CE2-CD2 3.9Å; Y409-F426 AromaticContact CE2-CE2 3.74Å; Y409-F426 HydrophobicContact CE2-CE2 3.74Å; Y409-F426 HydrophobicContact CE2-CZ 4.44Å; Y409-F426 HydrophobicContact CG-CD1 4.29Å; Y409-F426 HydrophobicContact CG-CD2 4.14Å; Y409-F426 AromaticContact CG-CE1 3.9Å; Y409-F426 HydrophobicContact CG-CE1 3.9Å; Y409-F426 AromaticContact CG-CE2 3.73Å; Y409-F426 HydrophobicContact CG-CE2 3.73Å; Y409-F426 HydrophobicContact CG-CG 4.39Å; Y409-F426 AromaticContact CG-CZ 3.59Å; Y409-F426 HydrophobicContact CG-CZ 3.59Å; Y409-F426 AromaticContact CZ-CD2 3.32Å; Y409-F426 AromaticContact CZ-CE2 3.67Å; Y409-F426 AromaticContact CZ-CG 3.87Å; W422-F426 WeakPolarHBondContact O-CB 3.28Å; W422-F426 PolarHBondContact O-N 3.37Å; A423-F426 PolarHBondContact O-N 3.11Å; F426-F428 VanDerWaalsContact C-N 3.34Å; F426-F428 PolarHBondContact O-N 3.22Å; F426-M429 HydrophobicContact CD2-CE 3.64Å; F426-M429 HydrophobicContact CE2-CE 3.9Å; F426-M429 WeakPolarHBondContact O-CB 3.32Å; F426-M429 PolarHBondContact O-N 2.84Å; F426-L430 HydrophobicContact CE1-CD1 3.93Å; F426-L430 HydrophobicContact CZ-CD1 4.08Å; F426-L430 WeakPolarHBondContact O-CB 3.42Å; F426-L430 PolarHBondContact O-N 2.96Å
427	F	96.4	Very high	94.8	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	15%	0.146	C	C	.	.	H	α-helix	trans	-71.5	-29.5	-178.5	-73.1	-63.1	0	0	0	112.9	Y171 L172 W182 F406 P410 A423 L430 L431	Y171-F427 VanDerWaalsContact CB-CE1 3.47Å; Y171-F427 VanDerWaalsContact CB-CZ 3.43Å; Y171-F427 HydrophobicContact CD1-CD2 4.49Å; Y171-F427 AromaticContact CD1-CE1 3.95Å; Y171-F427 HydrophobicContact CD1-CE1 3.95Å; Y171-F427 AromaticContact CD1-CE2 3.55Å; Y171-F427 HydrophobicContact CD1-CE2 3.55Å; Y171-F427 AromaticContact CD1-CZ 3.19Å; Y171-F427 HydrophobicContact CD1-CZ 3.19Å; Y171-F427 HydrophobicContact CD2-CE1 4.39Å; Y171-F427 HydrophobicContact CD2-CZ 4.4Å; Y171-F427 AromaticContact CE1-CZ 3.99Å; Y171-F427 HydrophobicContact CE1-CZ 3.99Å; Y171-F427 HydrophobicContact CG-CD1 4.34Å; Y171-F427 AromaticContact CG-CE1 3.71Å; Y171-F427 HydrophobicContact CG-CE1 3.71Å; Y171-F427 AromaticContact CG-CE2 3.93Å; Y171-F427 HydrophobicContact CG-CE2 3.93Å; Y171-F427 AromaticContact CG-CZ 3.44Å; Y171-F427 HydrophobicContact CG-CZ 3.44Å; Y171-F427 VanDerWaalsContact CG-CZ 3.44Å; L172-F427 HydrophobicContact CB-CB 3.98Å; L172-F427 HydrophobicContact CD1-CB 4.47Å; W182-F427 HydrophobicContact CH2-CE2 4.09Å; W182-F427 HydrophobicContact CZ2-CE2 4.06Å; F406-F427 AromaticContact CD1-CE1 3.81Å; F406-F427 HydrophobicContact CD1-CE1 3.81Å; F406-F427 HydrophobicContact CD1-CZ 4.49Å; F406-F427 HydrophobicContact CE1-CD1 4.4Å; F406-F427 AromaticContact CE1-CE1 3.86Å; F406-F427 HydrophobicContact CE1-CE1 3.86Å; P410-F427 HydrophobicContact CB-CE2 4.48Å; P410-F427 HydrophobicContact CB-CZ 4.25Å; P410-F427 HydrophobicContact CG-CE1 4.46Å; P410-F427 HydrophobicContact CG-CE2 4.17Å; P410-F427 HydrophobicContact CG-CZ 3.51Å; A423-F427 HydrophobicContact CB-CD2 4.43Å; A423-F427 WeakPolarHBondContact O-CD2 3.35Å; A423-F427 PolarHBondContact O-N 3.19Å; F427-L430 HydrophobicContact CD1-CD1 4.27Å; F427-L430 HydrophobicContact CE1-CD1 4.49Å; F427-L430 PolarHBondContact O-N 2.89Å; F427-L431 WeakPolarHBondContact O-CB 3.27Å; F427-L431 PolarHBondContact O-N 3.44Å
428	F	96.5	Very high	95.1	Very high	65 Å²	65	21.9 Å²	21.9	29%	0.285	12%	0.121	S	C	.	.	H	α-helix	trans	-67.7	-44.1	170.5	-174.2	-121.4	0	0	0	111.3	L172 F283 F287 A424 F426 L430 L431 L432	L172-F428 HydrophobicContact CD1-CB 4.07Å; L172-F428 HydrophobicContact CD2-CB 4.33Å; L172-F428 HydrophobicContact CD2-CD2 4.04Å; F283-F428 HydrophobicContact CE1-CE1 4.42Å; F283-F428 HydrophobicContact CE1-CZ 4.05Å; F283-F428 HydrophobicContact CZ-CE1 4.12Å; F283-F428 HydrophobicContact CZ-CZ 4.11Å; F287-F428 HydrophobicContact CD1-CD1 4.02Å; F287-F428 AromaticContact CD1-CE1 3.91Å; F287-F428 HydrophobicContact CD1-CE1 3.91Å; F287-F428 AromaticContact CE1-CD1 3.28Å; F287-F428 HydrophobicContact CE1-CD1 3.28Å; F287-F428 AromaticContact CE1-CE1 3.48Å; F287-F428 HydrophobicContact CE1-CE1 3.48Å; F287-F428 VanDerWaalsContact CE1-CE1 3.48Å; F287-F428 HydrophobicContact CE1-CG 4.5Å; F287-F428 HydrophobicContact CE2-CE1 4.33Å; F287-F428 HydrophobicContact CG-CE1 4.48Å; F287-F428 AromaticContact CZ-CD1 3.71Å; F287-F428 HydrophobicContact CZ-CD1 3.71Å; F287-F428 AromaticContact CZ-CE1 3.71Å; F287-F428 HydrophobicContact CZ-CE1 3.71Å; A424-F428 WeakPolarHBondContact O-CB 3.44Å; A424-F428 PolarHBondContact O-N 3.45Å; F426-F428 VanDerWaalsContact C-N 3.34Å; F426-F428 PolarHBondContact O-N 3.22Å; F428-L430 PolarHBondContact O-N 2.98Å; F428-L431 PolarHBondContact O-N 2.94Å; F428-L432 HydrophobicContact CD1-CD1 4.39Å; F428-L432 HydrophobicContact CE1-CD1 3.88Å; F428-L432 HydrophobicContact CE2-CD2 4.29Å; F428-L432 HydrophobicContact CE2-CG 4.4Å; F428-L432 HydrophobicContact CZ-CD1 3.96Å; F428-L432 HydrophobicContact CZ-CD2 4.31Å; F428-L432 HydrophobicContact CZ-CG 4.3Å; F428-L432 WeakPolarHBondContact O-CG 3.08Å; F428-L432 PolarHBondContact O-N 3.19Å
429	M	95	Very high	95.1	Very high	2 Å²	2	17 Å²	17	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-57.7	-46.9	171.1	171	-171	80.1	0	0	111.8	P288 V291 L292 L295 L425 F426 L431 L432 L433	P288-M429 HydrophobicContact CB-CG 3.85Å; P288-M429 HydrophobicContact CG-CG 4.41Å; V291-M429 HydrophobicContact CB-CB 4.01Å; V291-M429 HydrophobicContact CB-CG 4.23Å; V291-M429 HydrophobicContact CB-SD 3.88Å; V291-M429 HydrophobicContact CG1-CB 3.84Å; V291-M429 HydrophobicContact CG1-CG 4.27Å; V291-M429 HydrophobicContact CG1-SD 3.69Å; V291-M429 HydrophobicContact CG2-CB 4.24Å; L292-M429 HydrophobicContact CD2-CE 4.17Å; L292-M429 HydrophobicContact CD2-SD 3.74Å; L292-M429 HydrophobicContact CG-SD 3.76Å; L295-M429 HydrophobicContact CD1-CE 4.28Å; L295-M429 HydrophobicContact CD1-SD 4.42Å; L425-M429 WeakPolarHBondContact O-CB 3.46Å; L425-M429 PolarHBondContact O-N 2.76Å; F426-M429 HydrophobicContact CD2-CE 3.64Å; F426-M429 HydrophobicContact CE2-CE 3.9Å; F426-M429 WeakPolarHBondContact O-CB 3.32Å; F426-M429 PolarHBondContact O-N 2.84Å; M429-L431 VanDerWaalsContact C-N 3.31Å; M429-L431 PolarHBondContact O-N 2.94Å; M429-L432 PolarHBondContact O-N 3.07Å; M429-L433 HydrophobicContact CG-CD1 3.99Å; M429-L433 HydrophobicContact CG-CG 4.4Å; M429-L433 WeakPolarHBondContact O-CG 3.19Å; M429-L433 PolarHBondContact O-N 3.46Å
430	L	93.8	Very high	95.2	Very high	6 Å²	6	16.4 Å²	16.4	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-58.4	-45.2	179	-169.4	159.5	0	0	0	110.7	L85 V164 A405 F406 F426 F427 F428 L432 L433 G434	L85-L430 HydrophobicContact CD2-CD1 4.49Å; L85-L430 HydrophobicContact CD2-CD2 3.71Å; L85-L430 HydrophobicContact CD2-CG 3.55Å; V164-L430 HydrophobicContact CG1-CD2 4.26Å; A405-L430 HydrophobicContact CB-CD1 3.81Å; F406-L430 HydrophobicContact CE1-CD1 4.41Å; F406-L430 HydrophobicContact CZ-CD1 4.29Å; F406-L430 HydrophobicContact CZ-CD2 4.36Å; F426-L430 HydrophobicContact CE1-CD1 3.93Å; F426-L430 HydrophobicContact CZ-CD1 4.08Å; F426-L430 WeakPolarHBondContact O-CB 3.42Å; F426-L430 PolarHBondContact O-N 2.96Å; F427-L430 HydrophobicContact CD1-CD1 4.27Å; F427-L430 HydrophobicContact CE1-CD1 4.49Å; F427-L430 PolarHBondContact O-N 2.89Å; F428-L430 PolarHBondContact O-N 2.98Å; L430-L432 PolarHBondContact O-N 3.32Å; L430-L433 PolarHBondContact O-N 3.16Å; L430-G434 PolarHBondContact O-N 2.85Å
431	L	95.7	Very high	95.2	Very high	8 Å²	8	14.9 Å²	14.9	4%	0.042	8%	0.076	C	C	.	.	H	α-helix	trans	-59.2	-45.5	175.9	-177.6	66.2	0	0	0	111.6	L165 F169 L172 V262 F427 F428 M429 G434 L435	L165-L431 HydrophobicContact CB-CD1 4.06Å; L165-L431 HydrophobicContact CG-CD1 4.36Å; F169-L431 HydrophobicContact CB-CD1 4.31Å; F169-L431 HydrophobicContact CD2-CD2 3.94Å; L172-L431 HydrophobicContact CD2-CD2 4.23Å; V262-L431 HydrophobicContact CG2-CD1 4.42Å; F427-L431 WeakPolarHBondContact O-CB 3.27Å; F427-L431 PolarHBondContact O-N 3.44Å; F428-L431 PolarHBondContact O-N 2.94Å; M429-L431 VanDerWaalsContact C-N 3.31Å; M429-L431 PolarHBondContact O-N 2.94Å; L431-G434 PolarHBondContact O-N 2.94Å; L431-L435 VanDerWaalsContact O-CB 3.32Å; L431-L435 WeakPolarHBondContact O-CB 3.21Å; L431-L435 PolarHBondContact O-N 2.95Å
432	L	95.5	Very high	95.2	Very high	11 Å²	11	10.6 Å²	10.6	6%	0.058	5%	0.054	C	C	.	.	H	α-helix	trans	-67.1	-43.6	-179.7	-65.3	-173.6	0	0	0	112.9	F283 T284 F287 P288 F428 M429 L430 G434 L435 D436	F283-L432 HydrophobicContact CD1-CD1 4.42Å; F283-L432 HydrophobicContact CE1-CD1 3.81Å; F283-L432 HydrophobicContact CE1-CD2 4.43Å; F283-L432 HydrophobicContact CZ-CD1 4.35Å; T284-L432 HydrophobicContact CG2-CD2 3.96Å; F287-L432 HydrophobicContact CB-CD1 3.8Å; F287-L432 HydrophobicContact CD1-CD1 3.54Å; F287-L432 HydrophobicContact CE1-CD1 4.41Å; F287-L432 HydrophobicContact CG-CD1 3.9Å; P288-L432 HydrophobicContact CG-CB 4.12Å; F428-L432 HydrophobicContact CD1-CD1 4.39Å; F428-L432 HydrophobicContact CE1-CD1 3.88Å; F428-L432 HydrophobicContact CE2-CD2 4.29Å; F428-L432 HydrophobicContact CE2-CG 4.4Å; F428-L432 HydrophobicContact CZ-CD1 3.96Å; F428-L432 HydrophobicContact CZ-CD2 4.31Å; F428-L432 HydrophobicContact CZ-CG 4.3Å; F428-L432 WeakPolarHBondContact O-CG 3.08Å; F428-L432 PolarHBondContact O-N 3.19Å; M429-L432 PolarHBondContact O-N 3.07Å; L430-L432 PolarHBondContact O-N 3.32Å; L432-G434 VanDerWaalsContact C-N 3.29Å; L432-G434 PolarHBondContact O-N 3.4Å; L432-L435 WeakPolarHBondContact O-CB 3.2Å; L432-L435 PolarHBondContact O-N 3.05Å; L432-L435 VanDerWaalsContact O-N 3.14Å; L432-D436 PolarHBondContact O-N 2.73Å
433	L	93.9	Very high	95.1	Very high	6 Å²	6	8.8 Å²	8.8	3%	0.031	5%	0.047	C	C	.	.	H	α-helix	trans	-59.6	-40.9	174.3	-73.6	173.5	0	0	0	111.7	V83 L85 V88 P288 M429 L430 S437	V83-L433 HydrophobicContact CG1-CD2 4.19Å; L85-L433 HydrophobicContact CD2-CB 4.42Å; V88-L433 HydrophobicContact CG2-CD1 3.76Å; P288-L433 HydrophobicContact CB-CD1 4.27Å; P288-L433 HydrophobicContact CB-CD2 3.54Å; P288-L433 HydrophobicContact CB-CG 3.74Å; P288-L433 HydrophobicContact CG-CD2 3.7Å; P288-L433 HydrophobicContact CG-CG 3.78Å; M429-L433 HydrophobicContact CG-CD1 3.99Å; M429-L433 HydrophobicContact CG-CG 4.4Å; M429-L433 WeakPolarHBondContact O-CG 3.19Å; M429-L433 PolarHBondContact O-N 3.46Å; L430-L433 PolarHBondContact O-N 3.16Å; L433-S437 PolarHBondContact O-OG 3.12Å
434	G	95.1	Very high	95	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-67.5	-40.4	174	0	0	0	0	0	112.4	Y161 L430 L431 L432 D436 S437 Q438	Y161-G434 WeakPolarHBondContact CE1-O 3Å; L430-G434 PolarHBondContact O-N 2.85Å; L431-G434 PolarHBondContact O-N 2.94Å; L432-G434 VanDerWaalsContact C-N 3.29Å; L432-G434 PolarHBondContact O-N 3.4Å; G434-D436 VanDerWaalsContact C-N 3.34Å; G434-D436 PolarHBondContact O-N 3.45Å; G434-S437 PolarHBondContact O-N 3.29Å; G434-Q438 WeakPolarHBondContact O-CB 3.46Å; G434-Q438 PolarHBondContact O-N 3.44Å
435	L	95.5	Very high	95	Very high	4 Å²	4	9.6 Å²	9.6	2%	0.021	5%	0.048	C	C	.	.	H	α-helix	trans	-58.8	-47	-175.7	-155.4	94.7	0	0	0	111.9	L165 L265 T284 L431 L432 Q438 F439	L165-L435 HydrophobicContact CD2-CD1 4.34Å; L265-L435 HydrophobicContact CD1-CD1 3.78Å; L265-L435 HydrophobicContact CD2-CD1 3.33Å; L265-L435 HydrophobicContact CD2-CD2 3.63Å; L265-L435 HydrophobicContact CD2-CG 3.98Å; L265-L435 HydrophobicContact CG-CD1 4.05Å; T284-L435 HydrophobicContact CG2-CD2 4.16Å; L431-L435 VanDerWaalsContact O-CB 3.32Å; L431-L435 WeakPolarHBondContact O-CB 3.21Å; L431-L435 PolarHBondContact O-N 2.95Å; L432-L435 WeakPolarHBondContact O-CB 3.2Å; L432-L435 PolarHBondContact O-N 3.05Å; L432-L435 VanDerWaalsContact O-N 3.14Å; L435-Q438 PolarHBondContact O-N 3.29Å; L435-F439 HydrophobicContact CD2-CD1 3.97Å; L435-F439 HydrophobicContact CD2-CE1 4.03Å; L435-F439 HydrophobicContact CG-CD1 4.12Å; L435-F439 HydrophobicContact CG-CE1 4.5Å; L435-F439 WeakPolarHBondContact O-CD1 3.49Å; L435-F439 WeakPolarHBondContact O-CG 3.46Å; L435-F439 PolarHBondContact O-N 3.27Å
436	D	94.4	Very high	94.9	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-62.4	-47.2	-176.9	-73.6	-14.8	0	0	0	112	G80 T284 A285 L432 G434 Q438 F439 V440	G80-D436 VanDerWaalsContact C-CB 3.5Å; G80-D436 WeakPolarHBondContact O-CB 3.22Å; T284-D436 WeakPolarHBondContact CB-OD1 3.33Å; T284-D436 PolarHBondContact OG1-OD1 3.43Å; T284-D436 PolarHBondContact OG1-OD2 3.01Å; A285-D436 WeakPolarHBondContact CA-OD2 3.44Å; A285-D436 WeakPolarHBondContact CB-OD2 3.41Å; A285-D436 PolarHBondContact N-OD2 3.41Å; L432-D436 PolarHBondContact O-N 2.73Å; G434-D436 VanDerWaalsContact C-N 3.34Å; G434-D436 PolarHBondContact O-N 3.45Å; D436-Q438 VanDerWaalsContact C-N 3.31Å; D436-Q438 PolarHBondContact O-N 3.47Å; D436-F439 VanDerWaalsContact CA-CE1 3.44Å; D436-F439 HydrophobicContact CB-CE1 4.23Å; D436-F439 HydrophobicContact CB-CZ 4.06Å; D436-F439 WeakPolarHBondContact OD1-CE1 3.47Å; D436-F439 WeakPolarHBondContact OD1-CZ 3.47Å; D436-V440 WeakPolarHBondContact O-CG2 3.08Å; D436-V440 PolarHBondContact O-N 3.43Å
437	S	94.6	Very high	94.7	Very high	14 Å²	14	7.7 Å²	7.7	10%	0.098	4%	0.038	C	C	.	.	H	α-helix	trans	-61.2	-43.4	176.3	-46.7	0	0	0	0	111.5	G80 F81 Y161 L433 G434 G441	G80-S437 PolarHBondContact O-N 3.34Å; G80-S437 PolarHBondContact O-OG 2.9Å; F81-S437 PolarHBondContact O-OG 2.72Å; Y161-S437 PolarHBondContact OH-OG 3.46Å; L433-S437 PolarHBondContact O-OG 3.12Å; G434-S437 PolarHBondContact O-N 3.29Å; S437-G441 PolarHBondContact O-N 2.69Å
438	Q	96.3	Very high	94.5	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.009	4%	0.038	C	C	.	.	H	α-helix	trans	-66.1	-49.4	-176.2	-175.7	67.7	16.4	0	0	112.4	N158 Y161 I162 L165 V266 G434 L435 D436 V440 G441 V442	N158-Q438 PolarHBondContact O-NE2 3.39Å; Y161-Q438 HydrophobicContact CD1-CB 4.38Å; I162-Q438 HydrophobicContact CD1-CG 3.64Å; L165-Q438 HydrophobicContact CD2-CB 4.25Å; V266-Q438 HydrophobicContact CG1-CG 4.29Å; V266-Q438 HydrophobicContact CG2-CB 4.42Å; V266-Q438 HydrophobicContact CG2-CG 3.74Å; G434-Q438 WeakPolarHBondContact O-CB 3.46Å; G434-Q438 PolarHBondContact O-N 3.44Å; L435-Q438 PolarHBondContact O-N 3.29Å; D436-Q438 VanDerWaalsContact C-N 3.31Å; D436-Q438 PolarHBondContact O-N 3.47Å; Q438-V440 VanDerWaalsContact C-N 3.3Å; Q438-V440 PolarHBondContact O-N 3.2Å; Q438-G441 PolarHBondContact O-N 2.69Å; Q438-V442 WeakPolarHBondContact O-CG2 3.05Å; Q438-V442 PolarHBondContact O-N 2.83Å
439	F	93.5	Very high	94.2	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-69.8	-30.4	-176.7	69.2	-125.6	0	0	0	112.1	V266 C269 V270 T277 V281 L435 D436 E443	V266-F439 HydrophobicContact CG1-CB 4.36Å; C269-F439 HydrophobicContact CB-CB 4.12Å; C269-F439 HydrophobicContact CB-CD1 3.96Å; C269-F439 HydrophobicContact CB-CG 4.22Å; V270-F439 HydrophobicContact CG2-CB 3.47Å; V270-F439 VanDerWaalsContact CG2-CB 3.47Å; V270-F439 WeakPolarHBondContact CG2-O 3.41Å; T277-F439 HydrophobicContact CG2-CD2 3.41Å; T277-F439 VanDerWaalsContact CG2-CD2 3.41Å; T277-F439 HydrophobicContact CG2-CE2 3.2Å; T277-F439 HydrophobicContact CG2-CG 4.47Å; T277-F439 HydrophobicContact CG2-CZ 4.08Å; V281-F439 HydrophobicContact CG1-CE2 3.72Å; V281-F439 HydrophobicContact CG1-CZ 3.41Å; V281-F439 VanDerWaalsContact CG1-CZ 3.41Å; L435-F439 HydrophobicContact CD2-CD1 3.97Å; L435-F439 HydrophobicContact CD2-CE1 4.03Å; L435-F439 HydrophobicContact CG-CD1 4.12Å; L435-F439 HydrophobicContact CG-CE1 4.5Å; L435-F439 WeakPolarHBondContact O-CD1 3.49Å; L435-F439 WeakPolarHBondContact O-CG 3.46Å; L435-F439 PolarHBondContact O-N 3.27Å; D436-F439 VanDerWaalsContact CA-CE1 3.44Å; D436-F439 HydrophobicContact CB-CE1 4.23Å; D436-F439 HydrophobicContact CB-CZ 4.06Å; D436-F439 WeakPolarHBondContact OD1-CE1 3.47Å; D436-F439 WeakPolarHBondContact OD1-CZ 3.47Å; F439-E443 VanDerWaalsContact O-CB 3.24Å; F439-E443 WeakPolarHBondContact O-CB 3.43Å; F439-E443 PolarHBondContact O-N 3.42Å
440	V	94.4	Very high	93.9	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-71.3	-38.4	173.9	171	0	0	0	0	110.9	F81 A343 L347 D436 Q438 V442 E443 G444	F81-V440 HydrophobicContact CB-CB 4.04Å; F81-V440 HydrophobicContact CB-CG1 3.79Å; F81-V440 HydrophobicContact CB-CG2 4.15Å; F81-V440 HydrophobicContact CD1-CG1 3.97Å; F81-V440 HydrophobicContact CD2-CB 3.49Å; F81-V440 VanDerWaalsContact CD2-CB 3.49Å; F81-V440 HydrophobicContact CD2-CG1 3.35Å; F81-V440 HydrophobicContact CD2-CG2 4.45Å; F81-V440 HydrophobicContact CE1-CG1 4.38Å; F81-V440 HydrophobicContact CE2-CB 4.15Å; F81-V440 HydrophobicContact CE2-CG1 3.84Å; F81-V440 HydrophobicContact CG-CB 3.92Å; F81-V440 HydrophobicContact CG-CG1 3.42Å; F81-V440 VanDerWaalsContact CG-CG1 3.42Å; F81-V440 HydrophobicContact CZ-CG1 4.33Å; A343-V440 HydrophobicContact CB-CG1 4.18Å; L347-V440 HydrophobicContact CD1-CG1 3.73Å; L347-V440 HydrophobicContact CD2-CG1 4.12Å; L347-V440 HydrophobicContact CG-CG1 4.07Å; D436-V440 WeakPolarHBondContact O-CG2 3.08Å; D436-V440 PolarHBondContact O-N 3.43Å; Q438-V440 VanDerWaalsContact C-N 3.3Å; Q438-V440 PolarHBondContact O-N 3.2Å; V440-V442 PolarHBondContact O-N 3.18Å; V440-E443 WeakPolarHBondContact O-CB 3.42Å; V440-E443 PolarHBondContact O-N 2.89Å; V440-G444 PolarHBondContact O-N 3.32Å
441	G	95.5	Very high	93.6	Very high	2 Å²	2	10.4 Å²	10.4	2%	0.021	6%	0.055	C	C	.	.	H	α-helix	trans	-59.9	-44.2	172.7	0	0	0	0	0	112.3	V154 N158 S437 Q438 G444 F445	V154-G441 WeakPolarHBondContact CG2-O 3.49Å; N158-G441 VanDerWaalsContact ND2-C 3.27Å; N158-G441 PolarHBondContact ND2-O 3.36Å; N158-G441 VanDerWaalsContact OD1-C 3.29Å; N158-G441 WeakPolarHBondContact OD1-CA 3.4Å; S437-G441 PolarHBondContact O-N 2.69Å; Q438-G441 PolarHBondContact O-N 2.69Å; G441-G444 PolarHBondContact O-N 3.44Å; G441-F445 PolarHBondContact O-N 2.94Å; G441-F445 VanDerWaalsContact O-N 3.08Å
442	V	96.1	Very high	93.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.7	-42.7	174.8	175.3	0	0	0	0	111.3	N158 W263 V266 V270 Q438 V440 G444 F445 V446 V467	N158-V442 HydrophobicContact CB-CG2 4.41Å; N158-V442 PolarHBondContact ND2-N 3.36Å; N158-V442 PolarHBondContact OD1-N 3.13Å; W263-V442 HydrophobicContact CH2-CG2 4.29Å; W263-V442 HydrophobicContact CZ3-CG2 4Å; V266-V442 HydrophobicContact CG1-CG2 4.08Å; V270-V442 HydrophobicContact CG1-CG1 4.36Å; Q438-V442 WeakPolarHBondContact O-CG2 3.05Å; Q438-V442 PolarHBondContact O-N 2.83Å; V440-V442 PolarHBondContact O-N 3.18Å; V442-G444 PolarHBondContact O-N 2.59Å; V442-F445 PolarHBondContact O-N 3Å; V442-V446 HydrophobicContact CG1-CG2 4.17Å; V442-V446 WeakPolarHBondContact O-CB 3.48Å; V442-V446 WeakPolarHBondContact O-CG2 3.47Å; V442-V446 PolarHBondContact O-N 3.02Å; V442-V467 HydrophobicContact CG1-CG1 4.37Å
443	E	93.4	Very high	92.5	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-57.2	-47.7	175.4	176.7	64.5	-163.8	0	0	111.5	V270 F439 V440 V446 T447 R463	V270-E443 HydrophobicContact CG1-CB 4.31Å; V270-E443 VanDerWaalsContact CG1-OE2 3.26Å; V270-E443 WeakPolarHBondContact CG1-OE2 3.37Å; F439-E443 VanDerWaalsContact O-CB 3.24Å; F439-E443 WeakPolarHBondContact O-CB 3.43Å; F439-E443 PolarHBondContact O-N 3.42Å; V440-E443 WeakPolarHBondContact O-CB 3.42Å; V440-E443 PolarHBondContact O-N 2.89Å; E443-V446 PolarHBondContact O-N 3.31Å; E443-T447 WeakPolarHBondContact O-CB 3.18Å; E443-T447 PolarHBondContact O-N 2.96Å; E443-T447 PolarHBondContact O-OG1 3.42Å; E443-R463 IonicContact OE1-CZ 3.09Å; E443-R463 IonicContact OE1-NH1 2.85Å; E443-R463 IonicContact OE1-NH2 2.7Å; E443-R463 PolarHBondContact OE1-NH2 2.93Å; E443-R463 IonicContact OE2-CZ 3.92Å; E443-R463 IonicContact OE2-NH2 3.95Å; E443-R463 PolarHBondContact OE2-NH2 3.27Å
444	G	93.4	Very high	91.2	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.01	11%	0.113	C	C	.	.	H	α-helix	trans	-60.5	-45.8	178	0	0	0	0	0	112.3	V440 G441 V442 G448	V440-G444 PolarHBondContact O-N 3.32Å; G441-G444 PolarHBondContact O-N 3.44Å; V442-G444 PolarHBondContact O-N 2.59Å; G444-G448 PolarHBondContact O-N 2.89Å
445	F	95.8	Very high	89.6	Confident	34 Å²	34	24.4 Å²	24.4	15%	0.149	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-53.7	176.7	-176.3	-97.2	0	0	0	111.8	M151 V154 F155 G441 V442 T447 G448 I449 C470	M151-F445 HydrophobicContact CE-CB 4.28Å; M151-F445 HydrophobicContact CE-CD1 4.42Å; M151-F445 HydrophobicContact CE-CD2 3.18Å; M151-F445 HydrophobicContact CE-CE2 3.43Å; M151-F445 VanDerWaalsContact CE-CE2 3.43Å; M151-F445 HydrophobicContact CE-CG 3.73Å; M151-F445 HydrophobicContact CE-CZ 4.18Å; M151-F445 WeakPolarHBondContact CE-O 3.32Å; M151-F445 HydrophobicContact SD-CD2 4.07Å; V154-F445 HydrophobicContact CG1-CB 4.08Å; V154-F445 HydrophobicContact CG1-CD2 3.99Å; F155-F445 HydrophobicContact CB-CD2 4.02Å; F155-F445 HydrophobicContact CB-CE2 3.73Å; F155-F445 HydrophobicContact CB-CZ 4.44Å; F155-F445 HydrophobicContact CD2-CE1 4.26Å; F155-F445 AromaticContact CD2-CE2 3.96Å; F155-F445 HydrophobicContact CD2-CE2 3.96Å; F155-F445 AromaticContact CD2-CZ 3.8Å; F155-F445 HydrophobicContact CD2-CZ 3.8Å; F155-F445 HydrophobicContact CG-CE2 4.2Å; F155-F445 HydrophobicContact CG-CZ 4.44Å; G441-F445 PolarHBondContact O-N 2.94Å; G441-F445 VanDerWaalsContact O-N 3.08Å; V442-F445 PolarHBondContact O-N 3Å; F445-T447 VanDerWaalsContact C-N 3.28Å; F445-T447 PolarHBondContact O-N 2.86Å; F445-G448 PolarHBondContact O-N 3.49Å; F445-G448 VanDerWaalsContact O-N 3.13Å; F445-I449 HydrophobicContact CD1-CG1 4.43Å; F445-I449 HydrophobicContact CE1-CG1 4.04Å; F445-I449 HydrophobicContact CZ-CD1 4.42Å; F445-I449 HydrophobicContact CZ-CG1 4.15Å; F445-I449 PolarHBondContact O-N 3.45Å; F445-C470 VanDerWaalsContact CD1-SG 3.51Å
446	V	93.5	Very high	87.7	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-39.9	-178.4	171.3	0	0	0	0	110.9	V442 E443 I449 L450 A466 V467 C470	V442-V446 HydrophobicContact CG1-CG2 4.17Å; V442-V446 WeakPolarHBondContact O-CB 3.48Å; V442-V446 WeakPolarHBondContact O-CG2 3.47Å; V442-V446 PolarHBondContact O-N 3.02Å; E443-V446 PolarHBondContact O-N 3.31Å; V446-I449 PolarHBondContact O-N 3.26Å; V446-L450 HydrophobicContact CG1-CD1 3.62Å; V446-L450 HydrophobicContact CG1-CG 4Å; V446-L450 WeakPolarHBondContact O-CB 3.48Å; V446-L450 VanDerWaalsContact O-CG 3.29Å; V446-L450 WeakPolarHBondContact O-CG 3.35Å; V446-L450 PolarHBondContact O-N 2.89Å; V446-A466 HydrophobicContact CG1-CB 4.24Å; V446-V467 HydrophobicContact CB-CG2 4.45Å; V446-V467 HydrophobicContact CG1-CG2 3.93Å; V446-V467 HydrophobicContact CG2-CG2 4.1Å; V446-C470 HydrophobicContact CG2-CB 4.06Å
447	T	91.3	Very high	85.8	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-47.1	174.8	-62.7	0	0	0	0	111.9	A346 Y350 E443 F445 I449 L450 D451	A346-T447 HydrophobicContact CB-CG2 4.06Å; Y350-T447 HydrophobicContact CE2-CG2 4.26Å; Y350-T447 WeakPolarHBondContact OH-CG2 3.22Å; Y350-T447 PolarHBondContact OH-OG1 2.84Å; E443-T447 WeakPolarHBondContact O-CB 3.18Å; E443-T447 PolarHBondContact O-N 2.96Å; E443-T447 PolarHBondContact O-OG1 3.42Å; F445-T447 VanDerWaalsContact C-N 3.28Å; F445-T447 PolarHBondContact O-N 2.86Å; T447-I449 VanDerWaalsContact C-N 3.3Å; T447-I449 PolarHBondContact O-N 3.46Å; T447-L450 PolarHBondContact O-N 3.41Å; T447-D451 WeakPolarHBondContact O-CB 3.11Å; T447-D451 PolarHBondContact O-N 2.91Å; T447-D451 VanDerWaalsContact O-N 3.09Å
448	G	90.9	Very high	84	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59	-38.9	177.2	0	0	0	0	0	113.3	G444 F445	G444-G448 PolarHBondContact O-N 2.89Å; F445-G448 PolarHBondContact O-N 3.49Å; F445-G448 VanDerWaalsContact O-N 3.13Å
449	I	91.2	Very high	82.3	Confident	56 Å²	56	53.4 Å²	53.4	29%	0.287	26%	0.263	S	S	.	.	H	α-helix	trans	-72.5	-46.6	176.5	-65.3	-57.4	0	0	0	112	M151 F445 V446 T447 D451 L452 F453	M151-I449 HydrophobicContact CE-CD1 3.74Å; M151-I449 HydrophobicContact CE-CG1 3.66Å; F445-I449 HydrophobicContact CD1-CG1 4.43Å; F445-I449 HydrophobicContact CE1-CG1 4.04Å; F445-I449 HydrophobicContact CZ-CD1 4.42Å; F445-I449 HydrophobicContact CZ-CG1 4.15Å; F445-I449 PolarHBondContact O-N 3.45Å; V446-I449 PolarHBondContact O-N 3.26Å; T447-I449 VanDerWaalsContact C-N 3.3Å; T447-I449 PolarHBondContact O-N 3.46Å; I449-D451 VanDerWaalsContact C-N 3.25Å; I449-D451 PolarHBondContact O-N 3Å; I449-L452 WeakPolarHBondContact O-CB 3.35Å; I449-L452 PolarHBondContact O-N 2.89Å; I449-L452 VanDerWaalsContact O-N 3.08Å; I449-F453 HydrophobicContact CG2-CE2 3.79Å; I449-F453 WeakPolarHBondContact O-CD2 3.24Å
450	L	88.8	Confident	81	Confident	26 Å²	26	63.9 Å²	63.9	14%	0.136	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-34.4	-176.7	-73.6	178.2	0	0	0	112.1	V446 T447 L452 F453 K462 R463 A466	V446-L450 HydrophobicContact CG1-CD1 3.62Å; V446-L450 HydrophobicContact CG1-CG 4Å; V446-L450 WeakPolarHBondContact O-CB 3.48Å; V446-L450 VanDerWaalsContact O-CG 3.29Å; V446-L450 WeakPolarHBondContact O-CG 3.35Å; V446-L450 PolarHBondContact O-N 2.89Å; T447-L450 PolarHBondContact O-N 3.41Å; L450-L452 PolarHBondContact O-N 3.37Å; L450-F453 PolarHBondContact O-N 3.35Å; L450-K462 HydrophobicContact CD2-CD 4.2Å; L450-K462 HydrophobicContact CD2-CG 4.03Å; L450-R463 HydrophobicContact CD1-CB 4.24Å; L450-R463 HydrophobicContact CD1-CG 4.06Å; L450-A466 HydrophobicContact CD2-CB 3.96Å; L450-A466 HydrophobicContact CG-CB 4.48Å
451	D	87.1	Confident	79.8	Confident	49 Å²	49	69.8 Å²	69.8	26%	0.262	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.5	177.1	-78.1	4.9	0	0	0	113.1	R65 G132 N135 T447 I449 F453	R65-D451 IonicContact CZ-OD2 3.98Å; R65-D451 IonicContact NH1-OD1 3.23Å; R65-D451 IonicContact NH1-OD2 2.61Å; R65-D451 PolarHBondContact NH1-OD2 3.07Å; R65-D451 IonicContact NH2-OD2 2.8Å; G132-D451 PolarHBondContact N-OD2 3.4Å; N135-D451 PolarHBondContact ND2-O 2.87Å; T447-D451 WeakPolarHBondContact O-CB 3.11Å; T447-D451 PolarHBondContact O-N 2.91Å; T447-D451 VanDerWaalsContact O-N 3.09Å; I449-D451 VanDerWaalsContact C-N 3.25Å; I449-D451 PolarHBondContact O-N 3Å; D451-F453 VanDerWaalsContact C-N 3.34Å
452	L	85.8	Confident	79.1	Confident	73 Å²	73	71.3 Å²	71.3	38%	0.382	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-23.7	174.9	-66.8	178.5	0	0	0	113.2	I134 I449 L450	I134-L452 HydrophobicContact CB-CD2 4.21Å; I134-L452 HydrophobicContact CD1-CD1 3.72Å; I134-L452 HydrophobicContact CD1-CD2 4.19Å; I134-L452 HydrophobicContact CD1-CG 4.12Å; I134-L452 HydrophobicContact CG2-CD2 3.79Å; I449-L452 WeakPolarHBondContact O-CB 3.35Å; I449-L452 PolarHBondContact O-N 2.89Å; I449-L452 VanDerWaalsContact O-N 3.08Å; L450-L452 PolarHBondContact O-N 3.37Å
453	F	81	Confident	78.7	Confident	111 Å²	111	73.4 Å²	73.4	49%	0.487	34%	0.34	S	S	.	.	S	Bend	trans	-87.7	131.6	-176.2	-69.4	-73.7	0	0	0	110.9	I449 L450 D451	I449-F453 HydrophobicContact CG2-CE2 3.79Å; I449-F453 WeakPolarHBondContact O-CD2 3.24Å; L450-F453 PolarHBondContact O-N 3.35Å; D451-F453 VanDerWaalsContact C-N 3.34Å
454	P	67.1	Low	78.7	Confident	75 Å²	75	76 Å²	76	49%	0.487	35%	0.352	S	S	.	.			trans	-63.3	140	179.6	18.2	-24	0	0	0	111.8	K456 Y457	P454-K456 PolarHBondContact O-N 2.51Å; P454-Y457 HydrophobicContact CG-CD2 3.89Å; P454-Y457 HydrophobicContact CG-CE2 3.99Å; P454-Y457 PolarHBondContact O-N 3.21Å; P454-Y457 VanDerWaalsContact O-N 3.14Å
455	G	62.3	Low	78.6	Confident	61 Å²	61	80.6 Å²	80.6	63%	0.629	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-58.8	-12.4	-175.4	0	0	0	0	0	115.7	Y457	G455-Y457 VanDerWaalsContact C-N 3.26Å; G455-Y457 PolarHBondContact O-N 3.19Å
456	K	56	Low	78.4	Confident	196 Å²	196	80.1 Å²	80.1	85%	0.852	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-67.3	-21.1	174.9	-72.1	-177.5	178.1	176.9	0	113.9	P454	P454-K456 PolarHBondContact O-N 2.51Å
457	Y	54.9	Low	78.5	Confident	154 Å²	154	80 Å²	80	60%	0.604	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-101.8	39.9	179.3	-59.8	-84.5	0	0	0	112.5	P454 G455 H459	P454-Y457 HydrophobicContact CG-CD2 3.89Å; P454-Y457 HydrophobicContact CG-CE2 3.99Å; P454-Y457 PolarHBondContact O-N 3.21Å; P454-Y457 VanDerWaalsContact O-N 3.14Å; G455-Y457 VanDerWaalsContact C-N 3.26Å; G455-Y457 PolarHBondContact O-N 3.19Å; Y457-H459 PolarHBondContact O-N 2.87Å; Y457-H459 VanDerWaalsContact O-N 3.09Å
458	Y	56.3	Low	78.7	Confident	146 Å²	146	81.8 Å²	81.8	57%	0.573	39%	0.391	S	S	*	.			trans	-79.9	89.2	179.1	-130.3	-91.6	0	0	0	110.6
459	H	60.3	Low	78.9	Confident	133 Å²	133	86.1 Å²	86.1	62%	0.616	41%	0.414	S	S	*	.			trans	-76.1	141.3	165.7	-64.6	-67.8	0	0	0	110	Y457 Y461 K462	Y457-H459 PolarHBondContact O-N 2.87Å; Y457-H459 VanDerWaalsContact O-N 3.09Å; H459-Y461 PolarHBondContact O-N 3.15Å; H459-K462 HydrophobicContact CB-CB 4.29Å; H459-K462 WeakPolarHBondContact O-CB 3.42Å; H459-K462 PolarHBondContact O-N 3.37Å
460	R	65.1	Low	79.1	Confident	220 Å²	220	83.8 Å²	83.8	83%	0.83	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-31.3	-178.1	-174.6	173.3	178.6	161.4	-0.6	114.2
461	Y	69.4	Low	79.5	Confident	123 Å²	123	83 Å²	83	48%	0.482	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	14.7	-177.3	-54.2	-66.6	0	0	0	113.9	H459 R463 E464 I465	H459-Y461 PolarHBondContact O-N 3.15Å; Y461-R463 VanDerWaalsContact C-N 3.26Å; Y461-R463 PolarHBondContact O-N 3.46Å; Y461-E464 VanDerWaalsContact CD1-OE2 3.31Å; Y461-E464 WeakPolarHBondContact CD1-OE2 3.06Å; Y461-E464 PolarHBondContact O-N 3.02Å; Y461-I465 VanDerWaalsContact O-CG1 3.3Å; Y461-I465 WeakPolarHBondContact O-CG1 3.48Å; Y461-I465 PolarHBondContact O-N 3.44Å
462	K	81.6	Confident	80	Confident	35 Å²	35	85.5 Å²	85.5	15%	0.152	41%	0.411	C	S	.	.	H	α-helix	trans	-56	-40.6	-175.6	-177.6	-177.4	176.9	-173.1	0	112.6	L450 H459 A466	L450-K462 HydrophobicContact CD2-CD 4.2Å; L450-K462 HydrophobicContact CD2-CG 4.03Å; H459-K462 HydrophobicContact CB-CB 4.29Å; H459-K462 WeakPolarHBondContact O-CB 3.42Å; H459-K462 PolarHBondContact O-N 3.37Å; K462-A466 VanDerWaalsContact O-CB 3.28Å; K462-A466 WeakPolarHBondContact O-CB 3.39Å; K462-A466 PolarHBondContact O-N 3.44Å
463	R	87.8	Confident	80.5	Confident	43 Å²	43	86.4 Å²	86.4	16%	0.162	42%	0.416	C	S	.	.	H	α-helix	trans	-65.8	-54.3	179.2	-175.8	-174.2	-172.5	102.6	18.6	111.5	G273 E443 L450 Y461 I465 A466 V467	G273-R463 VanDerWaalsContact CA-NE 3.26Å; G273-R463 VanDerWaalsContact CA-NH2 3.28Å; E443-R463 IonicContact OE1-CZ 3.09Å; E443-R463 IonicContact OE1-NH1 2.85Å; E443-R463 IonicContact OE1-NH2 2.7Å; E443-R463 PolarHBondContact OE1-NH2 2.93Å; E443-R463 IonicContact OE2-CZ 3.92Å; E443-R463 IonicContact OE2-NH2 3.95Å; E443-R463 PolarHBondContact OE2-NH2 3.27Å; L450-R463 HydrophobicContact CD1-CB 4.24Å; L450-R463 HydrophobicContact CD1-CG 4.06Å; Y461-R463 VanDerWaalsContact C-N 3.26Å; Y461-R463 PolarHBondContact O-N 3.46Å; R463-I465 VanDerWaalsContact C-N 3.26Å; R463-I465 PolarHBondContact O-N 3.37Å; R463-A466 WeakPolarHBondContact O-CB 3.33Å; R463-A466 PolarHBondContact O-N 3.27Å; R463-V467 HydrophobicContact CG-CG2 4.41Å; R463-V467 WeakPolarHBondContact O-CG2 3.42Å; R463-V467 PolarHBondContact O-N 3.43Å
464	E	92.3	Very high	81.3	Confident	57 Å²	57	81.1 Å²	81.1	27%	0.266	39%	0.393	S	S	.	.	H	α-helix	trans	-55.5	-44.3	-179.5	-63.7	173.6	-173.4	0	0	110.8	W271 Y461 V467 A468	W271-E464 HydrophobicContact CB-CG 4.41Å; W271-E464 WeakPolarHBondContact O-CG 3.34Å; Y461-E464 VanDerWaalsContact CD1-OE2 3.31Å; Y461-E464 WeakPolarHBondContact CD1-OE2 3.06Å; Y461-E464 PolarHBondContact O-N 3.02Å; E464-V467 PolarHBondContact O-N 2.77Å; E464-A468 WeakPolarHBondContact O-CB 3.49Å; E464-A468 PolarHBondContact O-N 2.99Å
465	I	92	Very high	82.8	Confident	97 Å²	97	79.5 Å²	79.5	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-64.4	-43.9	175.6	-64.7	167.5	0	0	0	111.4	Y461 R463 V467 A468 I469	Y461-I465 VanDerWaalsContact O-CG1 3.3Å; Y461-I465 WeakPolarHBondContact O-CG1 3.48Å; Y461-I465 PolarHBondContact O-N 3.44Å; R463-I465 VanDerWaalsContact C-N 3.26Å; R463-I465 PolarHBondContact O-N 3.37Å; I465-V467 PolarHBondContact O-N 3.07Å; I465-A468 PolarHBondContact O-N 3.5Å; I465-I469 HydrophobicContact CG2-CD1 3.7Å; I465-I469 HydrophobicContact CG2-CG1 4.3Å; I465-I469 VanDerWaalsContact O-CG1 3.29Å; I465-I469 WeakPolarHBondContact O-CG1 3.17Å; I465-I469 PolarHBondContact O-N 3.45Å
466	A	92.4	Very high	84.4	Confident	24 Å²	24	81 Å²	81	20%	0.198	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-41.7	178.7	0	0	0	0	0	112.4	V446 L450 K462 R463 C470	V446-A466 HydrophobicContact CG1-CB 4.24Å; L450-A466 HydrophobicContact CD2-CB 3.96Å; L450-A466 HydrophobicContact CG-CB 4.48Å; K462-A466 VanDerWaalsContact O-CB 3.28Å; K462-A466 WeakPolarHBondContact O-CB 3.39Å; K462-A466 PolarHBondContact O-N 3.44Å; R463-A466 WeakPolarHBondContact O-CB 3.33Å; R463-A466 PolarHBondContact O-N 3.27Å; A466-C470 WeakPolarHBondContact O-CB 3.09Å; A466-C470 PolarHBondContact O-N 3.35Å
467	V	94.8	Very high	86.4	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-64.3	-44.8	174.5	-178.4	0	0	0	0	110.2	Y267 V270 V442 V446 R463 E464 I465 I469 C470 C471	Y267-V467 HydrophobicContact CD2-CB 4.36Å; Y267-V467 HydrophobicContact CD2-CG1 3.86Å; Y267-V467 HydrophobicContact CE2-CB 4.41Å; Y267-V467 HydrophobicContact CE2-CG1 4.38Å; V270-V467 HydrophobicContact CB-CG1 4.04Å; V270-V467 HydrophobicContact CG1-CG1 4.08Å; V270-V467 HydrophobicContact CG1-CG2 3.97Å; V442-V467 HydrophobicContact CG1-CG1 4.37Å; V446-V467 HydrophobicContact CB-CG2 4.45Å; V446-V467 HydrophobicContact CG1-CG2 3.93Å; V446-V467 HydrophobicContact CG2-CG2 4.1Å; R463-V467 HydrophobicContact CG-CG2 4.41Å; R463-V467 WeakPolarHBondContact O-CG2 3.42Å; R463-V467 PolarHBondContact O-N 3.43Å; E464-V467 PolarHBondContact O-N 2.77Å; I465-V467 PolarHBondContact O-N 3.07Å; V467-I469 PolarHBondContact O-N 3.39Å; V467-C470 WeakPolarHBondContact O-CB 3.26Å; V467-C470 PolarHBondContact O-N 2.99Å; V467-C471 PolarHBondContact O-N 3.46Å; V467-C471 PolarHBondContact O-SG 3.27Å
468	A	96	Very high	88.4	Confident	38 Å²	38	67.2 Å²	67.2	31%	0.314	32%	0.317	S	S	.	.	H	α-helix	trans	-60.2	-45.3	178	0	0	0	0	0	112.2	Y267 E464 I465 C471 L472	Y267-A468 HydrophobicContact CD2-CB 4.23Å; Y267-A468 HydrophobicContact CE2-CB 3.7Å; E464-A468 WeakPolarHBondContact O-CB 3.49Å; E464-A468 PolarHBondContact O-N 2.99Å; I465-A468 PolarHBondContact O-N 3.5Å; A468-C471 PolarHBondContact O-N 3.2Å; A468-L472 VanDerWaalsContact O-CB 3.29Å; A468-L472 WeakPolarHBondContact O-CB 3.21Å; A468-L472 PolarHBondContact O-N 3.01Å
469	I	95.5	Very high	90.3	Very high	91 Å²	91	62.4 Å²	62.4	47%	0.467	30%	0.3	S	S	.	.	H	α-helix	trans	-62.1	-45.1	175.9	-68.8	168.5	0	0	0	110.3	I465 V467 L472 L473	I465-I469 HydrophobicContact CG2-CD1 3.7Å; I465-I469 HydrophobicContact CG2-CG1 4.3Å; I465-I469 VanDerWaalsContact O-CG1 3.29Å; I465-I469 WeakPolarHBondContact O-CG1 3.17Å; I465-I469 PolarHBondContact O-N 3.45Å; V467-I469 PolarHBondContact O-N 3.39Å; I469-L472 PolarHBondContact O-N 2.85Å; I469-L473 HydrophobicContact CG2-CD1 3.79Å; I469-L473 HydrophobicContact CG2-CG 4.21Å; I469-L473 WeakPolarHBondContact O-CB 3.48Å; I469-L473 VanDerWaalsContact O-CG 3.28Å; I469-L473 WeakPolarHBondContact O-CG 3.4Å; I469-L473 PolarHBondContact O-N 3.41Å
470	C	95.6	Very high	92	Very high	7 Å²	7	58.2 Å²	58.2	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-58.3	-50.1	177.3	-175.4	0	0	0	0	111.5	F445 V446 A466 V467 L472 L473 C474	F445-C470 VanDerWaalsContact CD1-SG 3.51Å; V446-C470 HydrophobicContact CG2-CB 4.06Å; A466-C470 WeakPolarHBondContact O-CB 3.09Å; A466-C470 PolarHBondContact O-N 3.35Å; V467-C470 WeakPolarHBondContact O-CB 3.26Å; V467-C470 PolarHBondContact O-N 2.99Å; C470-L472 PolarHBondContact O-N 3.31Å; C470-L473 PolarHBondContact O-N 3.08Å; C470-C474 PolarHBondContact O-N 3.21Å; C470-C474 PolarHBondContact O-SG 2.93Å
471	C	97.3	Very high	93.5	Very high	9 Å²	9	47.9 Å²	47.9	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-42.3	179	-62.2	0	0	0	0	111.5	W263 V467 A468 C474 F475	W263-C471 HydrophobicContact CD2-CB 4.32Å; W263-C471 HydrophobicContact CE3-CB 3.57Å; W263-C471 HydrophobicContact CZ3-CB 3.98Å; V467-C471 PolarHBondContact O-N 3.46Å; V467-C471 PolarHBondContact O-SG 3.27Å; A468-C471 PolarHBondContact O-N 3.2Å; C471-C474 PolarHBondContact O-N 3.03Å; C471-F475 VanDerWaalsContact O-CB 3.24Å; C471-F475 WeakPolarHBondContact O-CB 3.04Å; C471-F475 PolarHBondContact O-N 3.32Å
472	L	97.3	Very high	94.8	Very high	102 Å²	102	42.1 Å²	42.1	53%	0.534	23%	0.225	S	C	.	.	H	α-helix	trans	-65.3	-43	178.8	-178.9	64.6	0	0	0	112.1	A468 I469 C470 F475 I476	A468-L472 VanDerWaalsContact O-CB 3.29Å; A468-L472 WeakPolarHBondContact O-CB 3.21Å; A468-L472 PolarHBondContact O-N 3.01Å; I469-L472 PolarHBondContact O-N 2.85Å; C470-L472 PolarHBondContact O-N 3.31Å; L472-F475 PolarHBondContact O-N 3.24Å; L472-I476 HydrophobicContact CD1-CD1 4.31Å; L472-I476 HydrophobicContact CG-CD1 4.1Å; L472-I476 WeakPolarHBondContact O-CD1 3.3Å; L472-I476 VanDerWaalsContact O-CG1 3.25Å; L472-I476 WeakPolarHBondContact O-CG1 3.38Å; L472-I476 PolarHBondContact O-N 3.47Å
473	L	96.7	Very high	95.5	Very high	93 Å²	93	41.5 Å²	41.5	49%	0.487	22%	0.224	S	C	.	.	H	α-helix	trans	-64.5	-44	177.5	-72.3	174.7	0	0	0	111.6	I469 C470 I476 I477	I469-L473 HydrophobicContact CG2-CD1 3.79Å; I469-L473 HydrophobicContact CG2-CG 4.21Å; I469-L473 WeakPolarHBondContact O-CB 3.48Å; I469-L473 VanDerWaalsContact O-CG 3.28Å; I469-L473 WeakPolarHBondContact O-CG 3.4Å; I469-L473 PolarHBondContact O-N 3.41Å; C470-L473 PolarHBondContact O-N 3.08Å; L473-I476 PolarHBondContact O-N 3.4Å; L473-I477 WeakPolarHBondContact O-CG1 3.44Å; L473-I477 PolarHBondContact O-N 3.16Å
474	C	96.9	Very high	95.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-49.3	175.3	-60.2	0	0	0	0	110.3	W263 C470 C471 I476 I477 D478	W263-C474 HydrophobicContact CH2-CB 3.46Å; W263-C474 VanDerWaalsContact CH2-CB 3.46Å; W263-C474 HydrophobicContact CZ2-CB 3.2Å; W263-C474 HydrophobicContact CZ3-CB 4.42Å; C470-C474 PolarHBondContact O-N 3.21Å; C470-C474 PolarHBondContact O-SG 2.93Å; C471-C474 PolarHBondContact O-N 3.03Å; C474-I476 VanDerWaalsContact C-N 3.28Å; C474-I476 PolarHBondContact O-N 2.92Å; C474-I477 WeakPolarHBondContact O-CA 3.01Å; C474-I477 WeakPolarHBondContact O-CB 2.99Å; C474-I477 PolarHBondContact O-N 3.25Å; C474-D478 PolarHBondContact O-N 3.35Å
475	F	97.8	Very high	96	Very high	40 Å²	40	38.7 Å²	38.7	18%	0.175	21%	0.213	C	C	.	.	H	α-helix	trans	-52	-43.3	176.7	174.4	-100.6	0	0	0	113.2	M256 L259 M260 W263 C471 L472 I477 D478 L479	M256-F475 HydrophobicContact CG-CZ 4.49Å; L259-F475 HydrophobicContact CD2-CD2 3.88Å; L259-F475 HydrophobicContact CD2-CE2 3.91Å; L259-F475 HydrophobicContact CG-CD2 3.9Å; L259-F475 HydrophobicContact CG-CE2 4.01Å; M260-F475 HydrophobicContact CB-CE2 3.89Å; M260-F475 HydrophobicContact CB-CZ 4.31Å; W263-F475 AromaticContact CD1-CD2 3.82Å; W263-F475 HydrophobicContact CG-CB 4.37Å; C471-F475 VanDerWaalsContact O-CB 3.24Å; C471-F475 WeakPolarHBondContact O-CB 3.04Å; C471-F475 PolarHBondContact O-N 3.32Å; L472-F475 PolarHBondContact O-N 3.24Å; F475-I477 VanDerWaalsContact C-N 3.33Å; F475-I477 PolarHBondContact O-N 3.33Å; F475-D478 PolarHBondContact O-N 3.35Å; F475-L479 HydrophobicContact CE1-CD1 4.47Å; F475-L479 HydrophobicContact CE1-CD2 4.28Å; F475-L479 HydrophobicContact CE1-CG 4.49Å; F475-L479 HydrophobicContact CE2-CD2 4.4Å; F475-L479 HydrophobicContact CZ-CD2 3.97Å; F475-L479 WeakPolarHBondContact O-CG 3.47Å; F475-L479 PolarHBondContact O-N 3.37Å; F475-L479 VanDerWaalsContact O-N 3.15Å
476	I	97.5	Very high	96.2	Very high	94 Å²	94	34.1 Å²	34.1	48%	0.482	19%	0.19	S	C	.	.	H	α-helix	trans	-63.4	-39.7	178	-70.1	164	0	0	0	111.4	L472 L473 C474 L479	L472-I476 HydrophobicContact CD1-CD1 4.31Å; L472-I476 HydrophobicContact CG-CD1 4.1Å; L472-I476 WeakPolarHBondContact O-CD1 3.3Å; L472-I476 VanDerWaalsContact O-CG1 3.25Å; L472-I476 WeakPolarHBondContact O-CG1 3.38Å; L472-I476 PolarHBondContact O-N 3.47Å; L473-I476 PolarHBondContact O-N 3.4Å; C474-I476 VanDerWaalsContact C-N 3.28Å; C474-I476 PolarHBondContact O-N 2.92Å; I476-L479 WeakPolarHBondContact O-CB 3.09Å
477	I	96.4	Very high	96.2	Very high	59 Å²	59	33.3 Å²	33.3	30%	0.303	18%	0.182	S	C	.	.	H	α-helix	trans	-68.6	-42	176.5	-62.6	167	0	0	0	110	F155 T159 L473 C474 F475 L479 S480 F493	F155-I477 HydrophobicContact CE1-CD1 3.89Å; F155-I477 HydrophobicContact CZ-CD1 3.59Å; T159-I477 HydrophobicContact CG2-CB 3.98Å; T159-I477 HydrophobicContact CG2-CG2 3.47Å; T159-I477 VanDerWaalsContact CG2-CG2 3.47Å; L473-I477 WeakPolarHBondContact O-CG1 3.44Å; L473-I477 PolarHBondContact O-N 3.16Å; C474-I477 WeakPolarHBondContact O-CA 3.01Å; C474-I477 WeakPolarHBondContact O-CB 2.99Å; C474-I477 PolarHBondContact O-N 3.25Å; F475-I477 VanDerWaalsContact C-N 3.33Å; F475-I477 PolarHBondContact O-N 3.33Å; I477-L479 PolarHBondContact O-N 3.31Å; I477-S480 VanDerWaalsContact O-CB 3.32Å; I477-S480 WeakPolarHBondContact O-CB 3.37Å; I477-S480 PolarHBondContact O-N 3.1Å; I477-S480 PolarHBondContact O-OG 3.01Å; I477-F493 HydrophobicContact CG2-CZ 4.43Å
478	D	96.6	Very high	96.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-24	-178.8	-58.6	-19.3	0	0	0	112.9	T159 I162 M163 L259 W263 C474 F475 S480 M481 V482	T159-D478 WeakPolarHBondContact CA-OD1 3.32Å; T159-D478 WeakPolarHBondContact CG2-OD1 3.41Å; I162-D478 VanDerWaalsContact CG2-OD2 3.27Å; I162-D478 WeakPolarHBondContact CG2-OD2 3.17Å; M163-D478 HydrophobicContact SD-CB 4.34Å; L259-D478 HydrophobicContact CD1-CB 4.16Å; L259-D478 HydrophobicContact CD2-CB 3.58Å; L259-D478 HydrophobicContact CG-CB 4.46Å; W263-D478 PolarHBondContact NE1-OD2 3.43Å; C474-D478 PolarHBondContact O-N 3.35Å; F475-D478 PolarHBondContact O-N 3.35Å; D478-S480 PolarHBondContact O-N 2.9Å; D478-S480 VanDerWaalsContact O-N 3.09Å; D478-M481 WeakPolarHBondContact O-CA 3.47Å; D478-M481 WeakPolarHBondContact O-CB 3.36Å; D478-M481 PolarHBondContact O-N 2.89Å; D478-V482 PolarHBondContact O-N 3.49Å
479	L	96.8	Very high	96.2	Very high	45 Å²	45	33.6 Å²	33.6	24%	0.236	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-54.4	-29.3	171.9	-68.6	178.6	0	0	0	112.3	M256 F475 I476 I477 M481 V482 T483	M256-L479 HydrophobicContact CG-CD2 3.82Å; M256-L479 HydrophobicContact SD-CD2 4.13Å; F475-L479 HydrophobicContact CE1-CD1 4.47Å; F475-L479 HydrophobicContact CE1-CD2 4.28Å; F475-L479 HydrophobicContact CE1-CG 4.49Å; F475-L479 HydrophobicContact CE2-CD2 4.4Å; F475-L479 HydrophobicContact CZ-CD2 3.97Å; F475-L479 WeakPolarHBondContact O-CG 3.47Å; F475-L479 PolarHBondContact O-N 3.37Å; F475-L479 VanDerWaalsContact O-N 3.15Å; I476-L479 WeakPolarHBondContact O-CB 3.09Å; I477-L479 PolarHBondContact O-N 3.31Å; L479-M481 VanDerWaalsContact C-N 3.28Å; L479-M481 PolarHBondContact O-N 3.39Å; L479-V482 PolarHBondContact O-N 2.99Å; L479-T483 WeakPolarHBondContact O-CG2 3.49Å
480	S	95.7	Very high	96.2	Very high	45 Å²	45	29.4 Å²	29.4	32%	0.315	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-63.5	-33.3	172.9	68.1	0	0	0	0	112.8	I477 D478 T483 G486	I477-S480 VanDerWaalsContact O-CB 3.32Å; I477-S480 WeakPolarHBondContact O-CB 3.37Å; I477-S480 PolarHBondContact O-N 3.1Å; I477-S480 PolarHBondContact O-OG 3.01Å; D478-S480 PolarHBondContact O-N 2.9Å; D478-S480 VanDerWaalsContact O-N 3.09Å; S480-T483 PolarHBondContact O-OG1 3.33Å; S480-G486 WeakPolarHBondContact O-CA 3.3Å
481	M	96.3	Very high	96	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.02	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-86	-9.5	-179.6	-57.6	-176.7	-165.8	0	0	113.6	T159 M163 D478 L479 G486 V489 F490 F493	T159-M481 HydrophobicContact CG2-CE 4.07Å; M163-M481 HydrophobicContact CE-CB 4.16Å; M163-M481 HydrophobicContact CG-CB 3.8Å; M163-M481 HydrophobicContact CG-CG 4.46Å; M163-M481 HydrophobicContact CG-SD 3.82Å; M163-M481 HydrophobicContact SD-CB 3.94Å; D478-M481 WeakPolarHBondContact O-CA 3.47Å; D478-M481 WeakPolarHBondContact O-CB 3.36Å; D478-M481 PolarHBondContact O-N 2.89Å; L479-M481 VanDerWaalsContact C-N 3.28Å; L479-M481 PolarHBondContact O-N 3.39Å; M481-G486 WeakPolarHBondContact O-CA 3.35Å; M481-V489 HydrophobicContact CE-CG1 4.31Å; M481-V489 HydrophobicContact CG-CB 4.23Å; M481-V489 HydrophobicContact CG-CG1 3.93Å; M481-F490 HydrophobicContact CG-CB 4.49Å; M481-F490 HydrophobicContact SD-CB 4.21Å; M481-F490 HydrophobicContact SD-CD2 4.36Å; M481-F493 HydrophobicContact CE-CB 4.08Å; M481-F493 HydrophobicContact CE-CD1 3.94Å; M481-F493 HydrophobicContact CE-CD2 3.4Å; M481-F493 VanDerWaalsContact CE-CD2 3.4Å; M481-F493 HydrophobicContact CE-CE1 4.18Å; M481-F493 HydrophobicContact CE-CE2 3.68Å; M481-F493 HydrophobicContact CE-CG 3.54Å; M481-F493 HydrophobicContact CE-CZ 4.06Å
482	V	97.1	Very high	95.8	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.012	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-92.1	-4.9	174.4	-177.7	0	0	0	0	112.2	M163 I251 N252 L255 M256 L259 D478 L479	M163-V482 HydrophobicContact CE-CG2 3.74Å; M163-V482 HydrophobicContact SD-CG2 3.92Å; I251-V482 HydrophobicContact CG2-CG1 4Å; N252-V482 HydrophobicContact CB-CG1 4.43Å; N252-V482 PolarHBondContact N-O 3.14Å; N252-V482 WeakPolarHBondContact O-CG1 3.45Å; L255-V482 HydrophobicContact CB-CG1 3.82Å; M256-V482 HydrophobicContact CB-CG1 3.91Å; L259-V482 HydrophobicContact CB-CG2 4.45Å; L259-V482 HydrophobicContact CD2-CG2 3.54Å; D478-V482 PolarHBondContact O-N 3.49Å; L479-V482 PolarHBondContact O-N 2.99Å
483	T	96.9	Very high	95.7	Very high	21 Å²	21	26.8 Å²	26.8	13%	0.129	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-71.9	166.6	173.8	68.1	0	0	0	0	111.9	P248 R250 I251 L479 S480 G485 G486	P248-T483 VanDerWaalsContact O-CB 3.23Å; P248-T483 WeakPolarHBondContact O-CB 3.4Å; P248-T483 PolarHBondContact O-OG1 3.5Å; R250-T483 CarbonylContact O-C 3.53Å; R250-T483 WeakPolarHBondContact O-CA 3.4Å; I251-T483 HydrophobicContact CG1-CG2 4.03Å; L479-T483 WeakPolarHBondContact O-CG2 3.49Å; S480-T483 PolarHBondContact O-OG1 3.33Å; T483-G485 PolarHBondContact O-N 2.98Å; T483-G486 WeakPolarHBondContact O-CA 3.21Å; T483-G486 PolarHBondContact O-N 2.86Å; T483-G486 PolarHBondContact OG1-N 3.46Å
484	Q	96	Very high	95.4	Very high	41 Å²	41	25.2 Å²	25.2	19%	0.192	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33.6	173.6	-65.8	179.6	-76.5	0	0	112.5	N240 I241 S242 P248 R250 G486	N240-Q484 HydrophobicContact CB-CG 4.32Å; N240-Q484 VanDerWaalsContact CG-NE2 3.25Å; N240-Q484 PolarHBondContact ND2-NE2 2.95Å; N240-Q484 VanDerWaalsContact ND2-NE2 3.16Å; N240-Q484 WeakPolarHBondContact O-CB 3.32Å; N240-Q484 WeakPolarHBondContact O-CG 3.43Å; N240-Q484 PolarHBondContact O-NE2 3.43Å; N240-Q484 PolarHBondContact OD1-NE2 3.27Å; N240-Q484 VanDerWaalsContact OD1-NE2 3.14Å; I241-Q484 WeakPolarHBondContact CA-O 3.37Å; S242-Q484 PolarHBondContact N-O 3.49Å; P248-Q484 PolarHBondContact O-N 2.99Å; P248-Q484 VanDerWaalsContact O-N 3.13Å; R250-Q484 WeakPolarHBondContact O-CG 3.4Å; R250-Q484 PolarHBondContact O-N 3.08Å; Q484-G486 VanDerWaalsContact C-N 3.27Å
485	G	94.8	Very high	95	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.01	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	4.9	170.9	0	0	0	0	0	114.2	S242 P248 T483 M487 Y488	S242-G485 VanDerWaalsContact OG-CA 3.25Å; S242-G485 WeakPolarHBondContact OG-CA 3.39Å; S242-G485 PolarHBondContact OG-N 3.47Å; P248-G485 PolarHBondContact O-N 3.4Å; T483-G485 PolarHBondContact O-N 2.98Å; G485-M487 VanDerWaalsContact C-N 3.33Å; G485-M487 PolarHBondContact O-N 3.15Å; G485-Y488 PolarHBondContact O-N 3.01Å; G485-Y488 VanDerWaalsContact O-N 3.16Å
486	G	95.4	Very high	94.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.2	-29.5	-168.9	0	0	0	0	0	114.4	S480 M481 T483 Q484 Y488 V489 F490	S480-G486 WeakPolarHBondContact O-CA 3.3Å; M481-G486 WeakPolarHBondContact O-CA 3.35Å; T483-G486 WeakPolarHBondContact O-CA 3.21Å; T483-G486 PolarHBondContact O-N 2.86Å; T483-G486 PolarHBondContact OG1-N 3.46Å; Q484-G486 VanDerWaalsContact C-N 3.27Å; G486-Y488 VanDerWaalsContact C-N 3.27Å; G486-Y488 PolarHBondContact O-N 3.48Å; G486-V489 PolarHBondContact O-N 3.35Å; G486-F490 WeakPolarHBondContact O-CB 3.48Å; G486-F490 PolarHBondContact O-N 3.4Å
487	M	93.4	Very high	94.4	Very high	8 Å²	8	22.7 Å²	22.7	4%	0.039	12%	0.116	C	C	.	.	H	α-helix	trans	-61	-36.9	174.8	-172.6	60.2	-176.1	0	0	111.8	W167 L239 I241 P402 G485 F490 Q491 Y567	W167-M487 HydrophobicContact CH2-SD 3.68Å; W167-M487 HydrophobicContact CZ2-SD 4.09Å; L239-M487 HydrophobicContact CD1-CB 4.08Å; L239-M487 HydrophobicContact CD1-CG 4.03Å; L239-M487 HydrophobicContact CD1-SD 4.31Å; I241-M487 HydrophobicContact CD1-CB 4.2Å; I241-M487 HydrophobicContact CD1-CG 4.47Å; P402-M487 HydrophobicContact CB-CE 4.43Å; P402-M487 HydrophobicContact CG-CE 4.35Å; G485-M487 VanDerWaalsContact C-N 3.33Å; G485-M487 PolarHBondContact O-N 3.15Å; M487-F490 HydrophobicContact CE-CD1 4.33Å; M487-F490 PolarHBondContact O-N 3.48Å; M487-F490 HydrophobicContact SD-CD1 4.08Å; M487-Q491 HydrophobicContact CE-CG 4.27Å; M487-Q491 WeakPolarHBondContact O-CG 3.28Å; M487-Q491 PolarHBondContact O-N 3.15Å; M487-Y567 HydrophobicContact CE-CE2 3.84Å; M487-Y567 HydrophobicContact CG-CE2 3.85Å
488	Y	94.7	Very high	93.6	Very high	12 Å²	12	19.9 Å²	19.9	5%	0.047	10%	0.102	C	C	.	.	H	α-helix	trans	-68.4	-37.7	177.9	-56.9	-65.9	0	0	0	112	I241 S242 G244 L245 G485 G486 L492 Y567 Y571 Y573	I241-Y488 HydrophobicContact CD1-CE2 4.48Å; I241-Y488 HydrophobicContact CG1-CE2 4.22Å; S242-Y488 WeakPolarHBondContact O-CE2 3.46Å; S242-Y488 PolarHBondContact O-OH 2.9Å; G244-Y488 VanDerWaalsContact CA-CE2 3.46Å; L245-Y488 HydrophobicContact CB-CG 4.48Å; G485-Y488 PolarHBondContact O-N 3.01Å; G485-Y488 VanDerWaalsContact O-N 3.16Å; G486-Y488 VanDerWaalsContact C-N 3.27Å; G486-Y488 PolarHBondContact O-N 3.48Å; Y488-L492 PolarHBondContact O-N 2.77Å; Y488-Y567 HydrophobicContact CD1-CG 4.47Å; Y488-Y567 AromaticContact CE1-CD1 3.82Å; Y488-Y567 HydrophobicContact CE1-CD1 3.82Å; Y488-Y567 HydrophobicContact CE1-CG 4.07Å; Y488-Y571 AromaticContact CD1-CD1 3.77Å; Y488-Y571 HydrophobicContact CD1-CD1 3.77Å; Y488-Y571 AromaticContact CD1-CE1 3.67Å; Y488-Y571 HydrophobicContact CD1-CE1 3.67Å; Y488-Y571 HydrophobicContact CD1-CG 4.48Å; Y488-Y571 AromaticContact CE1-CD1 3.5Å; Y488-Y571 HydrophobicContact CE1-CD1 3.5Å; Y488-Y571 HydrophobicContact CE1-CD2 4.22Å; Y488-Y571 AromaticContact CE1-CE1 3.74Å; Y488-Y571 HydrophobicContact CE1-CE1 3.74Å; Y488-Y571 HydrophobicContact CE1-CE2 4.43Å; Y488-Y571 AromaticContact CE1-CG 3.76Å; Y488-Y571 HydrophobicContact CE1-CG 3.76Å; Y488-Y571 HydrophobicContact CG-CE1 4.39Å; Y488-Y573 WeakPolarHBondContact CA-OH 3.31Å; Y488-Y573 PolarHBondContact O-OH 3.41Å
489	V	95.6	Very high	92.7	Very high	31 Å²	31	20.4 Å²	20.4	19%	0.188	11%	0.106	C	C	.	.	H	α-helix	trans	-67	-46.3	175.4	-177.4	0	0	0	0	110.4	L245 M481 G486 Q491 L492 F493	L245-V489 HydrophobicContact CD1-CG2 3.77Å; M481-V489 HydrophobicContact CE-CG1 4.31Å; M481-V489 HydrophobicContact CG-CB 4.23Å; M481-V489 HydrophobicContact CG-CG1 3.93Å; G486-V489 PolarHBondContact O-N 3.35Å; V489-Q491 VanDerWaalsContact C-N 3.28Å; V489-Q491 PolarHBondContact O-N 2.92Å; V489-L492 WeakPolarHBondContact O-CB 3.45Å; V489-L492 PolarHBondContact O-N 2.72Å; V489-L492 VanDerWaalsContact O-N 3.13Å; V489-F493 HydrophobicContact CG1-CD2 4.27Å; V489-F493 HydrophobicContact CG1-CE2 4.18Å; V489-F493 WeakPolarHBondContact O-CD2 3.2Å; V489-F493 PolarHBondContact O-N 2.91Å
490	F	94.8	Very high	91.9	Very high	3 Å²	3	18.9 Å²	18.9	1%	0.013	10%	0.101	C	C	.	.	H	α-helix	trans	-52.4	-47.8	175.2	169.5	-89.4	0	0	0	111.3	Y160 M163 V164 W167 P402 M481 G486 M487 L492 F493 D494	Y160-F490 HydrophobicContact CD2-CD2 4.29Å; Y160-F490 AromaticContact CD2-CE2 3.75Å; Y160-F490 HydrophobicContact CD2-CE2 3.75Å; Y160-F490 HydrophobicContact CD2-CZ 4.13Å; Y160-F490 WeakPolarHBondContact O-CE2 3.39Å; M163-F490 HydrophobicContact CB-CD2 3.9Å; M163-F490 HydrophobicContact CB-CE2 4.11Å; M163-F490 HydrophobicContact CG-CD2 4.4Å; V164-F490 HydrophobicContact CG2-CE2 3.91Å; V164-F490 HydrophobicContact CG2-CZ 3.88Å; W167-F490 HydrophobicContact CH2-CB 4.5Å; W167-F490 AromaticContact CH2-CD1 3.88Å; W167-F490 HydrophobicContact CH2-CD1 3.88Å; W167-F490 AromaticContact CH2-CD2 3.79Å; W167-F490 HydrophobicContact CH2-CD2 3.79Å; W167-F490 HydrophobicContact CH2-CE1 4.01Å; W167-F490 AromaticContact CH2-CE2 3.89Å; W167-F490 HydrophobicContact CH2-CE2 3.89Å; W167-F490 AromaticContact CH2-CG 3.78Å; W167-F490 HydrophobicContact CH2-CG 3.78Å; W167-F490 HydrophobicContact CH2-CZ 4.02Å; W167-F490 HydrophobicContact CZ3-CD1 4.46Å; W167-F490 HydrophobicContact CZ3-CD2 4.33Å; W167-F490 HydrophobicContact CZ3-CE1 4.13Å; W167-F490 AromaticContact CZ3-CE2 3.96Å; W167-F490 HydrophobicContact CZ3-CE2 3.96Å; W167-F490 AromaticContact CZ3-CZ 3.87Å; W167-F490 HydrophobicContact CZ3-CZ 3.87Å; P402-F490 HydrophobicContact CG-CE1 4.05Å; P402-F490 HydrophobicContact CG-CZ 4.39Å; M481-F490 HydrophobicContact CG-CB 4.49Å; M481-F490 HydrophobicContact SD-CB 4.21Å; M481-F490 HydrophobicContact SD-CD2 4.36Å; G486-F490 WeakPolarHBondContact O-CB 3.48Å; G486-F490 PolarHBondContact O-N 3.4Å; M487-F490 HydrophobicContact CE-CD1 4.33Å; M487-F490 PolarHBondContact O-N 3.48Å; M487-F490 HydrophobicContact SD-CD1 4.08Å; F490-L492 PolarHBondContact O-N 3.48Å; F490-F493 PolarHBondContact O-N 3.2Å; F490-D494 HydrophobicContact CE1-CB 4.35Å; F490-D494 WeakPolarHBondContact O-CB 3.39Å; F490-D494 PolarHBondContact O-N 3.23Å
491	Q	92.4	Very high	91.5	Very high	34 Å²	34	17 Å²	17	16%	0.159	9%	0.087	C	C	.	.	H	α-helix	trans	-66.9	-31.9	179.9	-75.6	-158.8	-26.9	0	0	114.1	M487 V489 F493 Y495 L565 Y567 Y573	M487-Q491 HydrophobicContact CE-CG 4.27Å; M487-Q491 WeakPolarHBondContact O-CG 3.28Å; M487-Q491 PolarHBondContact O-N 3.15Å; V489-Q491 VanDerWaalsContact C-N 3.28Å; V489-Q491 PolarHBondContact O-N 2.92Å; Q491-F493 VanDerWaalsContact C-N 3.32Å; Q491-Y495 WeakPolarHBondContact O-CB 3.24Å; Q491-Y495 PolarHBondContact O-N 2.9Å; Q491-L565 HydrophobicContact CB-CD2 4.28Å; Q491-Y567 VanDerWaalsContact NE2-CD2 3.32Å; Q491-Y573 VanDerWaalsContact CB-OH 3.27Å; Q491-Y573 WeakPolarHBondContact CB-OH 3.49Å; Q491-Y573 PolarHBondContact OE1-OH 2.97Å
492	L	93.6	Very high	91.3	Very high	7 Å²	7	16.8 Å²	16.8	4%	0.037	9%	0.086	C	C	.	.	H	α-helix	trans	-63.1	-41.8	172.9	-75.2	172.2	0	0	0	111.3	L245 Y488 V489 F490 Y496 L565 Y573 G577	L245-L492 HydrophobicContact CD1-CD1 4.18Å; L245-L492 HydrophobicContact CD2-CD1 3.81Å; Y488-L492 PolarHBondContact O-N 2.77Å; V489-L492 WeakPolarHBondContact O-CB 3.45Å; V489-L492 PolarHBondContact O-N 2.72Å; V489-L492 VanDerWaalsContact O-N 3.13Å; F490-L492 PolarHBondContact O-N 3.48Å; L492-Y496 HydrophobicContact CD2-CD2 4.08Å; L492-Y496 HydrophobicContact CD2-CE2 3.98Å; L492-Y496 WeakPolarHBondContact O-CB 3.29Å; L492-Y496 PolarHBondContact O-N 3.17Å; L492-Y496 VanDerWaalsContact O-N 3.08Å; L492-L565 HydrophobicContact CD2-CD2 4.05Å; L492-Y573 HydrophobicContact CD1-CD1 4.46Å; L492-Y573 HydrophobicContact CD1-CE1 4.14Å; L492-Y573 HydrophobicContact CD2-CD1 3.91Å; L492-Y573 HydrophobicContact CD2-CE1 3.86Å; L492-Y573 HydrophobicContact CG-CD1 4.2Å; L492-Y573 HydrophobicContact CG-CE1 3.7Å; L492-G577 WeakPolarHBondContact CD2-O 3.45Å
493	F	93.8	Very high	91.1	Very high	23 Å²	23	16.8 Å²	16.8	10%	0.101	9%	0.086	C	C	.	.	I	π-helix	trans	-65.9	-51.1	175.5	-85.8	-106.9	0	0	0	111.5	F156 T159 Y160 I477 M481 V489 F490 Q491 Y495 S497 L584	F156-F493 HydrophobicContact CB-CD1 4.19Å; F156-F493 HydrophobicContact CB-CE1 4.39Å; F156-F493 HydrophobicContact CD1-CD1 4.38Å; F156-F493 AromaticContact CD1-CE1 3.77Å; F156-F493 HydrophobicContact CD1-CE1 3.77Å; F156-F493 HydrophobicContact CE1-CE1 4.43Å; F156-F493 HydrophobicContact CG-CE1 4.34Å; T159-F493 HydrophobicContact CG2-CE1 4.06Å; Y160-F493 HydrophobicContact CD1-CB 3.89Å; Y160-F493 HydrophobicContact CG-CB 3.9Å; I477-F493 HydrophobicContact CG2-CZ 4.43Å; M481-F493 HydrophobicContact CE-CB 4.08Å; M481-F493 HydrophobicContact CE-CD1 3.94Å; M481-F493 HydrophobicContact CE-CD2 3.4Å; M481-F493 VanDerWaalsContact CE-CD2 3.4Å; M481-F493 HydrophobicContact CE-CE1 4.18Å; M481-F493 HydrophobicContact CE-CE2 3.68Å; M481-F493 HydrophobicContact CE-CG 3.54Å; M481-F493 HydrophobicContact CE-CZ 4.06Å; V489-F493 HydrophobicContact CG1-CD2 4.27Å; V489-F493 HydrophobicContact CG1-CE2 4.18Å; V489-F493 WeakPolarHBondContact O-CD2 3.2Å; V489-F493 PolarHBondContact O-N 2.91Å; F490-F493 PolarHBondContact O-N 3.2Å; Q491-F493 VanDerWaalsContact C-N 3.32Å; F493-Y495 VanDerWaalsContact C-N 3.33Å; F493-Y495 PolarHBondContact O-N 3.09Å; F493-S497 WeakPolarHBondContact O-CB 3.43Å; F493-S497 PolarHBondContact O-N 3.25Å; F493-S497 PolarHBondContact O-OG 3.48Å; F493-L584 HydrophobicContact CD2-CD1 4.12Å; F493-L584 HydrophobicContact CE1-CD2 4.45Å; F493-L584 HydrophobicContact CE2-CD1 4.24Å; F493-L584 HydrophobicContact CG-CD1 4.4Å; F493-L584 HydrophobicContact CZ-CD2 4.3Å
494	D	90.7	Very high	91	Very high	60 Å²	60	15.9 Å²	15.9	32%	0.321	8%	0.08	S	C	.	.	I	π-helix	trans	-58.4	-44.3	-179.4	-175.6	48.6	0	0	0	111.7	Y160 F490	Y160-D494 HydrophobicContact CD2-CB 4.02Å; Y160-D494 HydrophobicContact CE2-CB 3.88Å; Y160-D494 VanDerWaalsContact CE2-OD1 3.29Å; Y160-D494 WeakPolarHBondContact CE2-OD1 3.35Å; F490-D494 HydrophobicContact CE1-CB 4.35Å; F490-D494 WeakPolarHBondContact O-CB 3.39Å; F490-D494 PolarHBondContact O-N 3.23Å
495	Y	89.8	Confident	90.9	Very high	76 Å²	76	16.3 Å²	16.3	30%	0.298	8%	0.08	S	C	.	.	I	π-helix	trans	-80.5	-32.7	-174.9	-169.8	-97.8	0	0	0	114.6	Q491 F493 S499 Y562 K563 L565	Q491-Y495 WeakPolarHBondContact O-CB 3.24Å; Q491-Y495 PolarHBondContact O-N 2.9Å; F493-Y495 VanDerWaalsContact C-N 3.33Å; F493-Y495 PolarHBondContact O-N 3.09Å; Y495-S499 WeakPolarHBondContact O-CB 3.42Å; Y495-Y562 HydrophobicContact CE1-CE2 4.46Å; Y495-K563 PolarHBondContact OH-O 3.2Å; Y495-L565 HydrophobicContact CD1-CB 4.3Å; Y495-L565 HydrophobicContact CD1-CD1 4.15Å; Y495-L565 HydrophobicContact CD1-CD2 4.5Å; Y495-L565 HydrophobicContact CD2-CD1 3.77Å; Y495-L565 HydrophobicContact CE1-CB 4.41Å; Y495-L565 HydrophobicContact CE2-CD1 4.25Å; Y495-L565 HydrophobicContact CG-CD1 3.7Å; Y495-L565 HydrophobicContact CG-CD2 4.39Å; Y495-L565 HydrophobicContact CG-CG 4.46Å
496	Y	91.6	Very high	91	Very high	4 Å²	4	16.3 Å²	16.3	2%	0.016	8%	0.08	C	C	.	.	I	π-helix	trans	-110	-42	-174.5	-70.4	-82.3	0	0	0	114.8	L492 S499 Y562 L565 G581	L492-Y496 HydrophobicContact CD2-CD2 4.08Å; L492-Y496 HydrophobicContact CD2-CE2 3.98Å; L492-Y496 WeakPolarHBondContact O-CB 3.29Å; L492-Y496 PolarHBondContact O-N 3.17Å; L492-Y496 VanDerWaalsContact O-N 3.08Å; Y496-S499 PolarHBondContact O-OG 3.12Å; Y496-S499 VanDerWaalsContact O-OG 3.08Å; Y496-Y562 HydrophobicContact CE1-CE2 4.11Å; Y496-Y562 PolarHBondContact OH-OH 2.96Å; Y496-L565 HydrophobicContact CE2-CB 4.33Å; Y496-L565 HydrophobicContact CE2-CD2 4.23Å; Y496-G581 WeakPolarHBondContact CB-O 3.32Å; Y496-G581 VanDerWaalsContact CD2-CA 3.41Å; Y496-G581 VanDerWaalsContact CG-C 3.49Å; Y496-G581 VanDerWaalsContact CG-CA 3.43Å
497	S	89.2	Confident	91	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.08	C	C	.	.	I	π-helix	trans	-76.9	-50.5	-162.3	74.8	0	0	0	0	114	F156 F493 T502	F156-S497 WeakPolarHBondContact CB-OG 3.28Å; F493-S497 WeakPolarHBondContact O-CB 3.43Å; F493-S497 PolarHBondContact O-N 3.25Å; F493-S497 PolarHBondContact O-OG 3.48Å; S497-T502 PolarHBondContact O-OG1 3.49Å
498	A	80	Confident	91.1	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.008	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	44.5	173.7	0	0	0	0	0	110.2	I153 C157 Y160	I153-A498 HydrophobicContact CG2-CB 3.86Å; C157-A498 HydrophobicContact CB-CB 4.05Å; Y160-A498 HydrophobicContact CE1-CB 4.07Å
499	S	78.6	Confident	91.3	Very high	11 Å²	11	20 Å²	20	8%	0.077	9%	0.094	C	C	.	.			trans	-81	164.4	-175.8	69.9	0	0	0	0	112	Y495 Y496 M501 T502 L503	Y495-S499 WeakPolarHBondContact O-CB 3.42Å; Y496-S499 PolarHBondContact O-OG 3.12Å; Y496-S499 VanDerWaalsContact O-OG 3.08Å; S499-M501 PolarHBondContact O-N 3.17Å; S499-M501 VanDerWaalsContact O-N 3.09Å; S499-T502 PolarHBondContact N-OG1 3.49Å; S499-T502 PolarHBondContact O-N 3.19Å; S499-T502 VanDerWaalsContact O-N 3.17Å; S499-T502 PolarHBondContact O-OG1 3.14Å; S499-T502 VanDerWaalsContact O-OG1 3.08Å; S499-L503 WeakPolarHBondContact O-CG 3.49Å; S499-L503 PolarHBondContact O-N 3.15Å
500	G	80.3	Confident	91.4	Very high	13 Å²	13	18.6 Å²	18.6	13%	0.134	9%	0.086	C	C	.	.	H	α-helix	trans	-53	-34.1	174	0	0	0	0	0	112.7	L504	G500-L504 WeakPolarHBondContact O-CB 3.45Å; G500-L504 VanDerWaalsContact O-CD1 3.3Å; G500-L504 WeakPolarHBondContact O-CD1 3.18Å; G500-L504 WeakPolarHBondContact O-CG 3.49Å; G500-L504 PolarHBondContact O-N 2.88Å
501	M	87.1	Confident	91.5	Very high	4 Å²	4	18.5 Å²	18.5	2%	0.02	9%	0.085	C	C	.	.	H	α-helix	trans	-65.6	-45.7	179.7	-177.3	-179.7	65.2	0	0	113.1	S499 W505 F555 L559 W582 A585 M589	S499-M501 PolarHBondContact O-N 3.17Å; S499-M501 VanDerWaalsContact O-N 3.09Å; M501-W505 WeakPolarHBondContact O-CB 3.25Å; M501-W505 PolarHBondContact O-N 3.49Å; M501-F555 HydrophobicContact CG-CD2 3.58Å; M501-F555 HydrophobicContact CG-CE2 3.32Å; M501-F555 HydrophobicContact CG-CZ 4.37Å; M501-F555 HydrophobicContact SD-CE2 4.13Å; M501-L559 HydrophobicContact SD-CD2 3.72Å; M501-W582 HydrophobicContact CE-CE3 4.3Å; M501-W582 HydrophobicContact CE-CH2 3.95Å; M501-W582 HydrophobicContact CE-CZ3 3.56Å; M501-W582 HydrophobicContact SD-CH2 3.96Å; M501-W582 HydrophobicContact SD-CZ3 3.99Å; M501-A585 HydrophobicContact CE-CB 3.85Å; M501-M589 HydrophobicContact CE-SD 4.37Å
502	T	92.4	Very high	91.7	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.006	9%	0.087	C	C	.	.	H	α-helix	trans	-69.2	-37.7	-179.7	57.1	0	0	0	0	111.2	S497 S499 W505 Q506 A585 M589	S497-T502 PolarHBondContact O-OG1 3.49Å; S499-T502 PolarHBondContact N-OG1 3.49Å; S499-T502 PolarHBondContact O-N 3.19Å; S499-T502 VanDerWaalsContact O-N 3.17Å; S499-T502 PolarHBondContact O-OG1 3.14Å; S499-T502 VanDerWaalsContact O-OG1 3.08Å; T502-W505 PolarHBondContact O-N 2.91Å; T502-Q506 WeakPolarHBondContact O-CB 3.18Å; T502-Q506 PolarHBondContact O-N 3.4Å; T502-A585 HydrophobicContact CG2-CB 3.95Å; T502-M589 HydrophobicContact CG2-CG 4.17Å; T502-M589 HydrophobicContact CG2-SD 4.22Å
503	L	92.6	Very high	91.9	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-65.5	-44.9	175.3	-59.4	-177.1	0	0	0	112.2	I153 F335 I339 L341 S499 W505 Q506 S507	I153-L503 HydrophobicContact CD1-CD2 4.5Å; I153-L503 HydrophobicContact CG2-CD2 3.87Å; F335-L503 HydrophobicContact CB-CD1 4.48Å; F335-L503 HydrophobicContact CD2-CD1 4.32Å; I339-L503 WeakPolarHBondContact O-CD2 3.5Å; L341-L503 HydrophobicContact CD2-CD2 3.8Å; L341-L503 HydrophobicContact CG-CD2 4.47Å; S499-L503 WeakPolarHBondContact O-CG 3.49Å; S499-L503 PolarHBondContact O-N 3.15Å; L503-W505 VanDerWaalsContact C-N 3.33Å; L503-W505 PolarHBondContact O-N 2.96Å; L503-Q506 PolarHBondContact O-N 3.28Å; L503-S507 WeakPolarHBondContact O-CB 3.42Å; L503-S507 PolarHBondContact O-N 2.86Å; L503-S507 PolarHBondContact O-OG 3.03Å; L503-S507 VanDerWaalsContact O-OG 3.11Å
504	L	93.3	Very high	92.1	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-62.6	-40.3	177	-69.7	164.9	0	0	0	111.7	T331 F334 G500 F508 C551 I554 F555	T331-L504 HydrophobicContact CG2-CD1 4.32Å; F334-L504 HydrophobicContact CD1-CD2 3.95Å; F334-L504 HydrophobicContact CD2-CD2 4.2Å; F334-L504 HydrophobicContact CE1-CD2 3.86Å; F334-L504 HydrophobicContact CE2-CD2 4.11Å; F334-L504 HydrophobicContact CG-CD2 4.12Å; F334-L504 HydrophobicContact CZ-CD2 3.95Å; G500-L504 WeakPolarHBondContact O-CB 3.45Å; G500-L504 VanDerWaalsContact O-CD1 3.3Å; G500-L504 WeakPolarHBondContact O-CD1 3.18Å; G500-L504 WeakPolarHBondContact O-CG 3.49Å; G500-L504 PolarHBondContact O-N 2.88Å; L504-F508 WeakPolarHBondContact O-CB 3.21Å; L504-F508 PolarHBondContact O-N 3.39Å; L504-C551 HydrophobicContact CD2-CB 4.35Å; L504-I554 HydrophobicContact CD1-CB 4Å; L504-I554 HydrophobicContact CD1-CG2 3.49Å; L504-I554 VanDerWaalsContact CD1-CG2 3.49Å; L504-F555 HydrophobicContact CB-CB 4.43Å
505	W	95	Very high	92.4	Very high	50 Å²	50	14.8 Å²	14.8	19%	0.189	7%	0.068	C	C	.	.	H	α-helix	trans	-62.6	-45.3	175	178.4	-101.4	0	0	0	112.1	M501 T502 L503 W509 M552 F555 M589	M501-W505 WeakPolarHBondContact O-CB 3.25Å; M501-W505 PolarHBondContact O-N 3.49Å; T502-W505 PolarHBondContact O-N 2.91Å; L503-W505 VanDerWaalsContact C-N 3.33Å; L503-W505 PolarHBondContact O-N 2.96Å; W505-W509 AromaticContact CD2-NE1 3.99Å; W505-W509 AromaticContact CE2-CD1 3.63Å; W505-W509 AromaticContact CE2-NE1 3.38Å; W505-W509 AromaticContact CH2-NE1 3.45Å; W505-W509 AromaticContact CZ2-CD1 3.86Å; W505-W509 AromaticContact CZ2-NE1 3.09Å; W505-W509 AromaticContact NE1-CD1 3.83Å; W505-W509 AromaticContact NE1-NE1 3.96Å; W505-W509 PolarHBondContact O-N 3.48Å; W505-M552 HydrophobicContact CZ3-CE 4.41Å; W505-F555 HydrophobicContact CB-CD2 4.4Å; W505-F555 HydrophobicContact CB-CE2 4.13Å; W505-F555 HydrophobicContact CE3-CE1 4.22Å; W505-F555 HydrophobicContact CE3-CE2 4.23Å; W505-F555 AromaticContact CE3-CZ 3.95Å; W505-F555 HydrophobicContact CE3-CZ 3.95Å; W505-F555 HydrophobicContact CZ3-CE1 4.48Å; W505-F555 HydrophobicContact CZ3-CZ 4.49Å; W505-M589 HydrophobicContact CB-CE 4.17Å; W505-M589 HydrophobicContact CB-CG 4.36Å; W505-M589 HydrophobicContact CD2-CE 3.89Å; W505-M589 HydrophobicContact CE3-CE 4.28Å; W505-M589 HydrophobicContact CG-CB 4.41Å; W505-M589 HydrophobicContact CG-CE 3.83Å; W505-M589 HydrophobicContact CG-CG 4.02Å; W505-M589 PolarHBondContact NE1-O 2.98Å
506	Q	95.9	Very high	92.7	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-59.2	-56.6	175.8	176.8	68.7	9.9	0	0	110.6	L146 A149 I153 T502 L503 F508 W509 E510	L146-Q506 PolarHBondContact O-NE2 3.28Å; A149-Q506 VanDerWaalsContact CB-OE1 3.26Å; I153-Q506 HydrophobicContact CD1-CB 4.37Å; T502-Q506 WeakPolarHBondContact O-CB 3.18Å; T502-Q506 PolarHBondContact O-N 3.4Å; L503-Q506 PolarHBondContact O-N 3.28Å; Q506-F508 VanDerWaalsContact C-N 3.28Å; Q506-F508 PolarHBondContact O-N 2.88Å; Q506-W509 PolarHBondContact O-N 3.46Å; Q506-E510 HydrophobicContact CG-CG 4.33Å; Q506-E510 WeakPolarHBondContact CG-OE1 3.46Å; Q506-E510 PolarHBondContact NE2-OE1 2.85Å; Q506-E510 WeakPolarHBondContact O-CG 3.35Å; Q506-E510 PolarHBondContact O-N 2.88Å
507	S	95.6	Very high	92.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62	-32.9	-176.8	-61.5	0	0	0	0	113.9	F334 I339 L503 C511	F334-S507 WeakPolarHBondContact CE1-OG 3.49Å; I339-S507 WeakPolarHBondContact CG2-OG 3.48Å; L503-S507 WeakPolarHBondContact O-CB 3.42Å; L503-S507 PolarHBondContact O-N 2.86Å; L503-S507 PolarHBondContact O-OG 3.03Å; L503-S507 VanDerWaalsContact O-OG 3.11Å; S507-C511 WeakPolarHBondContact O-CB 3.4Å; S507-C511 PolarHBondContact O-N 2.75Å; S507-C511 VanDerWaalsContact O-N 3.08Å; S507-C511 PolarHBondContact O-SG 2.9Å
508	F	97.1	Very high	93.3	Very high	36 Å²	36	20.3 Å²	20.3	16%	0.158	9%	0.093	C	C	.	.	H	α-helix	trans	-56.7	-53.4	171.4	168.5	-98	0	0	0	110.6	L504 Q506 C511 I512 P548 C551 M552	L504-F508 WeakPolarHBondContact O-CB 3.21Å; L504-F508 PolarHBondContact O-N 3.39Å; Q506-F508 VanDerWaalsContact C-N 3.28Å; Q506-F508 PolarHBondContact O-N 2.88Å; F508-C511 PolarHBondContact O-N 3.47Å; F508-I512 HydrophobicContact CD1-CG1 4.44Å; F508-I512 HydrophobicContact CD2-CG1 4.35Å; F508-I512 HydrophobicContact CE1-CG1 4.02Å; F508-I512 HydrophobicContact CE2-CD1 4.16Å; F508-I512 HydrophobicContact CE2-CG1 3.92Å; F508-I512 HydrophobicContact CZ-CD1 4.2Å; F508-I512 HydrophobicContact CZ-CG1 3.74Å; F508-I512 VanDerWaalsContact O-CG1 3.32Å; F508-I512 WeakPolarHBondContact O-CG1 3.14Å; F508-I512 PolarHBondContact O-N 3.45Å; F508-P548 HydrophobicContact CD2-CB 3.92Å; F508-P548 HydrophobicContact CE2-CB 4.07Å; F508-C551 HydrophobicContact CB-CB 4.05Å; F508-M552 HydrophobicContact CD1-CE 3.73Å; F508-M552 HydrophobicContact CD2-CB 4.12Å; F508-M552 HydrophobicContact CD2-CE 3.77Å; F508-M552 HydrophobicContact CE1-CE 3.62Å; F508-M552 HydrophobicContact CE2-CB 4.27Å; F508-M552 HydrophobicContact CE2-CE 3.66Å; F508-M552 HydrophobicContact CG-CE 3.81Å; F508-M552 HydrophobicContact CZ-CE 3.58Å
509	W	97.8	Very high	94.1	Very high	61 Å²	61	21.3 Å²	21.3	23%	0.231	10%	0.103	C	C	.	.	H	α-helix	trans	-68.9	-34.7	-178.2	-80.9	107.5	0	0	0	113	F143 L146 W505 Q506 C511 I512 V513 I592	F143-W509 HydrophobicContact CE1-CE3 4.11Å; F143-W509 AromaticContact CE1-CZ3 3.85Å; F143-W509 HydrophobicContact CE1-CZ3 3.85Å; L146-W509 HydrophobicContact CD2-CB 3.65Å; L146-W509 HydrophobicContact CG-CB 4.45Å; W505-W509 AromaticContact CD2-NE1 3.99Å; W505-W509 AromaticContact CE2-CD1 3.63Å; W505-W509 AromaticContact CE2-NE1 3.38Å; W505-W509 AromaticContact CH2-NE1 3.45Å; W505-W509 AromaticContact CZ2-CD1 3.86Å; W505-W509 AromaticContact CZ2-NE1 3.09Å; W505-W509 AromaticContact NE1-CD1 3.83Å; W505-W509 AromaticContact NE1-NE1 3.96Å; W505-W509 PolarHBondContact O-N 3.48Å; Q506-W509 PolarHBondContact O-N 3.46Å; W509-C511 VanDerWaalsContact C-N 3.35Å; W509-C511 PolarHBondContact O-N 3.38Å; W509-I512 HydrophobicContact CE3-CG2 4.41Å; W509-I512 HydrophobicContact CZ3-CG2 4.43Å; W509-I512 PolarHBondContact O-N 3.46Å; W509-V513 WeakPolarHBondContact O-CB 3.36Å; W509-V513 VanDerWaalsContact O-CG2 3.26Å; W509-V513 WeakPolarHBondContact O-CG2 3.48Å; W509-V513 PolarHBondContact O-N 3.46Å; W509-I592 HydrophobicContact CB-CD1 4.01Å; W509-I592 HydrophobicContact CD2-CG2 4.09Å; W509-I592 HydrophobicContact CG-CD1 4Å; W509-I592 HydrophobicContact CG-CG2 4.08Å
510	E	97.1	Very high	94.9	Very high	3 Å²	3	21 Å²	21	1%	0.014	10%	0.101	C	C	.	.	H	α-helix	trans	-58.5	-48	173.5	-67.4	-178.7	164.8	0	0	111.4	W137 L146 Q506 V513 V514	W137-E510 HydrophobicContact CH2-CB 3.93Å; W137-E510 HydrophobicContact CH2-CG 3.71Å; W137-E510 HydrophobicContact CZ2-CB 4.39Å; W137-E510 HydrophobicContact CZ2-CG 3.68Å; L146-E510 HydrophobicContact CD1-CG 4.44Å; L146-E510 HydrophobicContact CD2-CG 3.89Å; Q506-E510 HydrophobicContact CG-CG 4.33Å; Q506-E510 WeakPolarHBondContact CG-OE1 3.46Å; Q506-E510 PolarHBondContact NE2-OE1 2.85Å; Q506-E510 WeakPolarHBondContact O-CG 3.35Å; Q506-E510 PolarHBondContact O-N 2.88Å; E510-V513 PolarHBondContact O-N 3.34Å; E510-V514 WeakPolarHBondContact O-CB 3.18Å; E510-V514 WeakPolarHBondContact O-CG2 3.49Å; E510-V514 PolarHBondContact O-N 3.41Å
511	C	97.7	Very high	95.6	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.2	-46.1	176.8	-69.4	0	0	0	0	111.5	S507 F508 W509 V513 A515 W543 P548	S507-C511 WeakPolarHBondContact O-CB 3.4Å; S507-C511 PolarHBondContact O-N 2.75Å; S507-C511 VanDerWaalsContact O-N 3.08Å; S507-C511 PolarHBondContact O-SG 2.9Å; F508-C511 PolarHBondContact O-N 3.47Å; W509-C511 VanDerWaalsContact C-N 3.35Å; W509-C511 PolarHBondContact O-N 3.38Å; C511-V513 PolarHBondContact O-N 3.23Å; C511-A515 WeakPolarHBondContact O-CB 3.32Å; C511-A515 PolarHBondContact O-N 2.65Å; C511-W543 WeakPolarHBondContact CB-O 3.27Å; C511-P548 HydrophobicContact CB-CG 3.66Å
512	I	97.8	Very high	96	Very high	39 Å²	39	28.5 Å²	28.5	20%	0.2	13%	0.131	C	C	.	.	H	α-helix	trans	-60	-45.4	178.9	-67.5	-60.7	0	0	0	111.4	F508 W509 W516 V517 P548	F508-I512 HydrophobicContact CD1-CG1 4.44Å; F508-I512 HydrophobicContact CD2-CG1 4.35Å; F508-I512 HydrophobicContact CE1-CG1 4.02Å; F508-I512 HydrophobicContact CE2-CD1 4.16Å; F508-I512 HydrophobicContact CE2-CG1 3.92Å; F508-I512 HydrophobicContact CZ-CD1 4.2Å; F508-I512 HydrophobicContact CZ-CG1 3.74Å; F508-I512 VanDerWaalsContact O-CG1 3.32Å; F508-I512 WeakPolarHBondContact O-CG1 3.14Å; F508-I512 PolarHBondContact O-N 3.45Å; W509-I512 HydrophobicContact CE3-CG2 4.41Å; W509-I512 HydrophobicContact CZ3-CG2 4.43Å; W509-I512 PolarHBondContact O-N 3.46Å; I512-W516 WeakPolarHBondContact O-CB 3.48Å; I512-W516 PolarHBondContact O-N 3.06Å; I512-V517 PolarHBondContact O-N 2.84Å; I512-P548 HydrophobicContact CD1-CB 4.22Å; I512-P548 HydrophobicContact CD1-CG 4.37Å
513	V	97.3	Very high	96.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.131	C	C	.	.	I	π-helix	trans	-67.9	-47.6	-177.9	173.3	0	0	0	0	111.1	W137 A140 F143 L146 W509 E510 C511 V517 Y518	W137-V513 HydrophobicContact CE3-CG1 4.09Å; W137-V513 HydrophobicContact CZ3-CB 4.16Å; W137-V513 HydrophobicContact CZ3-CG1 3.85Å; A140-V513 HydrophobicContact CB-CG1 3.67Å; F143-V513 HydrophobicContact CB-CG1 4.04Å; F143-V513 HydrophobicContact CB-CG2 3.73Å; F143-V513 HydrophobicContact CD1-CG2 3.44Å; F143-V513 VanDerWaalsContact CD1-CG2 3.44Å; F143-V513 HydrophobicContact CD2-CG1 4.13Å; F143-V513 HydrophobicContact CD2-CG2 3.76Å; F143-V513 HydrophobicContact CE1-CG2 3.9Å; F143-V513 HydrophobicContact CE2-CG2 4.21Å; F143-V513 HydrophobicContact CG-CB 4.44Å; F143-V513 HydrophobicContact CG-CG1 4.17Å; F143-V513 HydrophobicContact CG-CG2 3.35Å; F143-V513 HydrophobicContact CZ-CG2 4.27Å; L146-V513 HydrophobicContact CD1-CB 4.14Å; L146-V513 HydrophobicContact CD1-CG2 3.81Å; W509-V513 WeakPolarHBondContact O-CB 3.36Å; W509-V513 VanDerWaalsContact O-CG2 3.26Å; W509-V513 WeakPolarHBondContact O-CG2 3.48Å; W509-V513 PolarHBondContact O-N 3.46Å; E510-V513 PolarHBondContact O-N 3.34Å; C511-V513 PolarHBondContact O-N 3.23Å; V513-V517 HydrophobicContact CG1-CB 4.42Å; V513-V517 WeakPolarHBondContact O-CA 3.29Å; V513-V517 VanDerWaalsContact O-CB 3.3Å; V513-V517 WeakPolarHBondContact O-CB 3.23Å; V513-V517 PolarHBondContact O-N 3.05Å; V513-V517 VanDerWaalsContact O-N 3.15Å; V513-Y518 PolarHBondContact O-N 3.37Å
514	V	97.3	Very high	96.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.131	C	C	.	.	I	π-helix	trans	-67.5	-45.4	-179.4	174.2	0	0	0	0	111.1	L121 W137 E510 G519 F523	L121-V514 HydrophobicContact CD1-CB 4.06Å; L121-V514 HydrophobicContact CD1-CG1 4.12Å; L121-V514 HydrophobicContact CD1-CG2 4.16Å; L121-V514 HydrophobicContact CD2-CG2 4.22Å; L121-V514 HydrophobicContact CG-CG2 4.39Å; W137-V514 HydrophobicContact CH2-CG2 4.41Å; W137-V514 HydrophobicContact CZ3-CG2 4.19Å; E510-V514 WeakPolarHBondContact O-CB 3.18Å; E510-V514 WeakPolarHBondContact O-CG2 3.49Å; E510-V514 PolarHBondContact O-N 3.41Å; V514-G519 CarbonylContact O-C 3.59Å; V514-G519 PolarHBondContact O-N 3.02Å; V514-F523 HydrophobicContact CG1-CB 4.08Å; V514-F523 HydrophobicContact CG1-CD1 3.57Å; V514-F523 HydrophobicContact CG1-CD2 4.2Å; V514-F523 HydrophobicContact CG1-CE1 4.01Å; V514-F523 HydrophobicContact CG1-CG 3.69Å; V514-F523 HydrophobicContact CG1-CZ 4.49Å
515	A	96.9	Very high	96.4	Very high	7 Å²	7	31.2 Å²	31.2	6%	0.058	15%	0.146	C	C	.	.	I	π-helix	trans	-78.2	-39	-173	0	0	0	0	0	113.9	C511 G519 A520 W543	C511-A515 WeakPolarHBondContact O-CB 3.32Å; C511-A515 PolarHBondContact O-N 2.65Å; A515-G519 CarbonylContact O-C 3.39Å; A515-G519 WeakPolarHBondContact O-CA 3.42Å; A515-A520 HydrophobicContact CB-CB 4.1Å; A515-A520 PolarHBondContact O-N 3.02Å; A515-W543 HydrophobicContact CB-CB 4.21Å
516	W	96.9	Very high	96.4	Very high	146 Å²	146	29 Å²	29	55%	0.553	14%	0.137	S	C	*	.	I	π-helix	trans	-110.8	-31.1	-170.5	-64.8	96	0	0	0	114.7	I512 S544 F545	I512-W516 WeakPolarHBondContact O-CB 3.48Å; I512-W516 PolarHBondContact O-N 3.06Å; W516-S544 PolarHBondContact NE1-O 3.07Å; W516-F545 AromaticContact CH2-CE1 3.67Å; W516-F545 HydrophobicContact CH2-CE1 3.67Å; W516-F545 AromaticContact CH2-CZ 3.59Å; W516-F545 HydrophobicContact CH2-CZ 3.59Å; W516-F545 HydrophobicContact CZ2-CD1 4.01Å; W516-F545 AromaticContact CZ2-CE1 3.32Å; W516-F545 HydrophobicContact CZ2-CE1 3.32Å; W516-F545 HydrophobicContact CZ2-CE2 4.27Å; W516-F545 AromaticContact CZ2-CZ 3.47Å; W516-F545 HydrophobicContact CZ2-CZ 3.47Å; W516-F545 VanDerWaalsContact CZ2-CZ 3.47Å
517	V	96.4	Very high	96.3	Very high	39 Å²	39	28.9 Å²	28.9	24%	0.236	14%	0.137	C	C	.	.	I	π-helix	trans	-87.5	-53.5	178.9	-177.8	0	0	0	0	110.3	A140 F143 I512 V513 T615	A140-V517 HydrophobicContact CB-CG1 4.3Å; F143-V517 HydrophobicContact CD2-CG1 4.3Å; F143-V517 HydrophobicContact CD2-CG2 4.47Å; F143-V517 HydrophobicContact CE2-CB 4.37Å; F143-V517 HydrophobicContact CE2-CG1 3.95Å; F143-V517 HydrophobicContact CE2-CG2 3.74Å; F143-V517 HydrophobicContact CZ-CG2 4.13Å; I512-V517 PolarHBondContact O-N 2.84Å; V513-V517 HydrophobicContact CG1-CB 4.42Å; V513-V517 WeakPolarHBondContact O-CA 3.29Å; V513-V517 VanDerWaalsContact O-CB 3.3Å; V513-V517 WeakPolarHBondContact O-CB 3.23Å; V513-V517 PolarHBondContact O-N 3.05Å; V513-V517 VanDerWaalsContact O-N 3.15Å; V517-T615 HydrophobicContact CG1-CG2 3.64Å
518	Y	96.3	Very high	96.3	Very high	12 Å²	12	30 Å²	30	5%	0.047	15%	0.146	C	C	.	.	I	π-helix	trans	-77.4	-39.6	176.8	-178.1	-110.1	0	0	0	112.3	I139 V513 R522 F523 D526 P617 W619	I139-Y518 HydrophobicContact CD1-CD1 3.71Å; I139-Y518 HydrophobicContact CD1-CD2 3.92Å; I139-Y518 HydrophobicContact CD1-CE1 3.64Å; I139-Y518 HydrophobicContact CD1-CE2 3.82Å; I139-Y518 HydrophobicContact CD1-CG 3.84Å; I139-Y518 HydrophobicContact CG1-CD1 4.12Å; I139-Y518 HydrophobicContact CG1-CD2 3.35Å; I139-Y518 HydrophobicContact CG1-CE1 4.14Å; I139-Y518 HydrophobicContact CG1-CE2 3.35Å; I139-Y518 HydrophobicContact CG1-CG 3.73Å; V513-Y518 PolarHBondContact O-N 3.37Å; Y518-R522 HydrophobicContact CE1-CB 4.17Å; Y518-R522 HydrophobicContact CE1-CG 3.76Å; Y518-R522 HydrophobicContact CE2-CG 4.48Å; Y518-R522 VanDerWaalsContact CZ-NE 3.3Å; Y518-R522 WeakPolarHBondContact OH-CD 3.46Å; Y518-R522 PolarHBondContact OH-NE 2.98Å; Y518-F523 HydrophobicContact CD1-CB 4.03Å; Y518-F523 HydrophobicContact CD1-CD2 4.42Å; Y518-F523 HydrophobicContact CE1-CB 4.04Å; Y518-F523 HydrophobicContact CE1-CD2 4.18Å; Y518-D526 VanDerWaalsContact CE1-OD2 3.29Å; Y518-D526 WeakPolarHBondContact CE1-OD2 3.26Å; Y518-D526 VanDerWaalsContact CZ-OD2 3.29Å; Y518-D526 PolarHBondContact OH-OD2 3.07Å; Y518-P617 HydrophobicContact CE2-CB 4.13Å; Y518-P617 HydrophobicContact CE2-CG 4.1Å; Y518-W619 HydrophobicContact CE2-CH2 4.02Å; Y518-W619 HydrophobicContact CE2-CZ2 4.4Å; Y518-W619 WeakPolarHBondContact OH-CH2 3.2Å
519	G	96.6	Very high	96.1	Very high	22 Å²	22	34.7 Å²	34.7	23%	0.227	16%	0.163	C	C	.	.	I	π-helix	trans	107.6	119	176.8	0	0	0	0	0	112.1	V514 A515 D521 R522 F523	V514-G519 CarbonylContact O-C 3.59Å; V514-G519 PolarHBondContact O-N 3.02Å; A515-G519 CarbonylContact O-C 3.39Å; A515-G519 WeakPolarHBondContact O-CA 3.42Å; G519-D521 VanDerWaalsContact C-N 3.34Å; G519-D521 PolarHBondContact O-N 2.56Å; G519-R522 WeakPolarHBondContact O-CB 3.28Å; G519-R522 PolarHBondContact O-N 3.17Å; G519-F523 PolarHBondContact O-N 2.98Å
520	A	95.8	Very high	95.9	Very high	4 Å²	4	32 Å²	32	3%	0.033	15%	0.153	C	C	.	.	H	α-helix	trans	-63.3	-36.9	-176.4	0	0	0	0	0	113.3	A515 F523 M524 K540	A515-A520 HydrophobicContact CB-CB 4.1Å; A515-A520 PolarHBondContact O-N 3.02Å; A520-F523 PolarHBondContact O-N 3.26Å; A520-M524 WeakPolarHBondContact O-CB 3.1Å; A520-M524 VanDerWaalsContact O-CG 3.22Å; A520-M524 WeakPolarHBondContact O-CG 3.19Å; A520-M524 PolarHBondContact O-N 2.85Å; A520-K540 HydrophobicContact CB-CD 4.38Å; A520-K540 HydrophobicContact CB-CG 3.8Å
521	D	95.6	Very high	95.8	Very high	75 Å²	75	32.9 Å²	32.9	40%	0.401	16%	0.157	S	C	.	.	H	α-helix	trans	-63.4	-44	175.6	-76	-60.5	0	0	0	111.6	G519 F523 M524 D525 R534 K540	G519-D521 VanDerWaalsContact C-N 3.34Å; G519-D521 PolarHBondContact O-N 2.56Å; D521-F523 VanDerWaalsContact C-N 3.35Å; D521-F523 PolarHBondContact O-N 3.23Å; D521-M524 PolarHBondContact O-N 3.43Å; D521-D525 PolarHBondContact O-N 3.13Å; D521-R534 PolarHBondContact O-NH2 3.34Å; D521-R534 IonicContact OD1-NH2 2.69Å; D521-R534 PolarHBondContact OD1-NH2 3.47Å; D521-K540 IonicContact OD1-NZ 3.14Å; D521-K540 PolarHBondContact OD1-NZ 3.39Å; D521-K540 WeakPolarHBondContact OD2-CE 3.3Å; D521-K540 IonicContact OD2-NZ 2.59Å; D521-K540 PolarHBondContact OD2-NZ 2.99Å
522	R	94.5	Very high	95.6	Very high	99 Å²	99	36.2 Å²	36.2	37%	0.374	19%	0.192	S	C	.	.	H	α-helix	trans	-60.8	-46.4	177.3	-175.6	-176.7	-175.7	170.7	12.8	111	Y518 G519 M524 D525 D526	Y518-R522 HydrophobicContact CE1-CB 4.17Å; Y518-R522 HydrophobicContact CE1-CG 3.76Å; Y518-R522 HydrophobicContact CE2-CG 4.48Å; Y518-R522 VanDerWaalsContact CZ-NE 3.3Å; Y518-R522 WeakPolarHBondContact OH-CD 3.46Å; Y518-R522 PolarHBondContact OH-NE 2.98Å; G519-R522 WeakPolarHBondContact O-CB 3.28Å; G519-R522 PolarHBondContact O-N 3.17Å; R522-M524 PolarHBondContact O-N 3.31Å; R522-D525 PolarHBondContact O-N 3.44Å; R522-D525 VanDerWaalsContact O-N 3.17Å; R522-D526 VanDerWaalsContact O-CG 3.26Å; R522-D526 PolarHBondContact O-N 2.64Å; R522-D526 VanDerWaalsContact O-OD2 3.11Å
523	F	95.9	Very high	95.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-40.2	177.9	-168.9	-117.4	0	0	0	112.4	L121 A124 L125 I139 V514 Y518 G519 A520 D521 D525 D526 V527 W543	L121-F523 HydrophobicContact CG-CE1 4.41Å; A124-F523 HydrophobicContact CB-CE1 4.44Å; A124-F523 HydrophobicContact CB-CZ 3.98Å; L125-F523 HydrophobicContact CB-CE2 4.34Å; L125-F523 HydrophobicContact CB-CZ 4.1Å; L125-F523 HydrophobicContact CD1-CE2 3.98Å; I139-F523 HydrophobicContact CD1-CD2 4.46Å; V514-F523 HydrophobicContact CG1-CB 4.08Å; V514-F523 HydrophobicContact CG1-CD1 3.57Å; V514-F523 HydrophobicContact CG1-CD2 4.2Å; V514-F523 HydrophobicContact CG1-CE1 4.01Å; V514-F523 HydrophobicContact CG1-CG 3.69Å; V514-F523 HydrophobicContact CG1-CZ 4.49Å; Y518-F523 HydrophobicContact CD1-CB 4.03Å; Y518-F523 HydrophobicContact CD1-CD2 4.42Å; Y518-F523 HydrophobicContact CE1-CB 4.04Å; Y518-F523 HydrophobicContact CE1-CD2 4.18Å; G519-F523 PolarHBondContact O-N 2.98Å; A520-F523 PolarHBondContact O-N 3.26Å; D521-F523 VanDerWaalsContact C-N 3.35Å; D521-F523 PolarHBondContact O-N 3.23Å; F523-D525 VanDerWaalsContact C-N 3.28Å; F523-D525 PolarHBondContact O-N 3.44Å; F523-D526 WeakPolarHBondContact O-CB 3.4Å; F523-D526 PolarHBondContact O-N 3.44Å; F523-V527 HydrophobicContact CE1-CG2 4.36Å; F523-V527 HydrophobicContact CZ-CG2 4.48Å; F523-V527 WeakPolarHBondContact O-CG2 3.31Å; F523-V527 PolarHBondContact O-N 2.89Å; F523-W543 HydrophobicContact CD1-CE3 4.26Å; F523-W543 AromaticContact CD1-CH2 3.85Å; F523-W543 HydrophobicContact CD1-CH2 3.85Å; F523-W543 AromaticContact CD1-CZ3 3.61Å; F523-W543 HydrophobicContact CD1-CZ3 3.61Å; F523-W543 AromaticContact CE1-CH2 3.74Å; F523-W543 HydrophobicContact CE1-CH2 3.74Å; F523-W543 HydrophobicContact CE1-CZ2 4.32Å; F523-W543 AromaticContact CE1-CZ3 3.99Å; F523-W543 HydrophobicContact CE1-CZ3 3.99Å
524	M	96.3	Very high	95.3	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.015	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-35.1	173.7	-72.2	-73.7	-70.9	0	0	112.4	A520 D521 R522 A528 R534 P535 K540 W543	A520-M524 WeakPolarHBondContact O-CB 3.1Å; A520-M524 VanDerWaalsContact O-CG 3.22Å; A520-M524 WeakPolarHBondContact O-CG 3.19Å; A520-M524 PolarHBondContact O-N 2.85Å; D521-M524 PolarHBondContact O-N 3.43Å; R522-M524 PolarHBondContact O-N 3.31Å; M524-A528 WeakPolarHBondContact O-CB 3.38Å; M524-A528 PolarHBondContact O-N 2.98Å; M524-R534 HydrophobicContact CE-CG 4.23Å; M524-P535 HydrophobicContact CE-CB 3.73Å; M524-P535 HydrophobicContact CE-CG 4.08Å; M524-P535 WeakPolarHBondContact CE-O 3.07Å; M524-P535 HydrophobicContact SD-CB 4.22Å; M524-P535 HydrophobicContact SD-CG 4.22Å; M524-K540 HydrophobicContact CG-CB 4.24Å; M524-W543 HydrophobicContact CG-CZ3 4.25Å; M524-W543 HydrophobicContact SD-CH2 4.25Å; M524-W543 HydrophobicContact SD-CZ3 3.72Å
525	D	94.9	Very high	95.2	Very high	59 Å²	59	44.3 Å²	44.3	32%	0.316	22%	0.221	S	C	.	.	H	α-helix	trans	-73	-37.8	176.5	-61	-13.2	0	0	0	111.2	D521 R522 F523 V527 A528 R529 R534	D521-D525 PolarHBondContact O-N 3.13Å; R522-D525 PolarHBondContact O-N 3.44Å; R522-D525 VanDerWaalsContact O-N 3.17Å; F523-D525 VanDerWaalsContact C-N 3.28Å; F523-D525 PolarHBondContact O-N 3.44Å; D525-V527 VanDerWaalsContact C-N 3.33Å; D525-A528 WeakPolarHBondContact O-CB 3.35Å; D525-A528 PolarHBondContact O-N 3.01Å; D525-A528 VanDerWaalsContact O-N 3.16Å; D525-R529 WeakPolarHBondContact O-CG 3.35Å; D525-R529 PolarHBondContact O-N 3.19Å; D525-R534 IonicContact OD1-CZ 2.81Å; D525-R534 IonicContact OD1-NE 2.72Å; D525-R534 PolarHBondContact OD1-NE 3.01Å; D525-R534 VanDerWaalsContact OD1-NE 3.09Å; D525-R534 IonicContact OD1-NH1 2.69Å; D525-R534 IonicContact OD1-NH2 3.82Å; D525-R534 PolarHBondContact OD1-NH2 3.48Å
526	D	94.3	Very high	95.1	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.011	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-41.8	171.9	-68	-36.6	0	0	0	111.8	F128 Y518 R522 F523 A528 R529 M530	F128-D526 HydrophobicContact CD2-CB 4.02Å; F128-D526 HydrophobicContact CE1-CB 4.23Å; F128-D526 HydrophobicContact CE2-CB 3.6Å; F128-D526 HydrophobicContact CZ-CB 3.71Å; F128-D526 VanDerWaalsContact CZ-CG 3.43Å; F128-D526 WeakPolarHBondContact CZ-OD1 3.35Å; Y518-D526 VanDerWaalsContact CE1-OD2 3.29Å; Y518-D526 WeakPolarHBondContact CE1-OD2 3.26Å; Y518-D526 VanDerWaalsContact CZ-OD2 3.29Å; Y518-D526 PolarHBondContact OH-OD2 3.07Å; R522-D526 VanDerWaalsContact O-CG 3.26Å; R522-D526 PolarHBondContact O-N 2.64Å; R522-D526 VanDerWaalsContact O-OD2 3.11Å; F523-D526 WeakPolarHBondContact O-CB 3.4Å; F523-D526 PolarHBondContact O-N 3.44Å; D526-A528 VanDerWaalsContact C-N 3.34Å; D526-R529 WeakPolarHBondContact O-CB 3.4Å; D526-R529 PolarHBondContact O-N 3.31Å; D526-R529 IonicContact OD1-CZ 3.09Å; D526-R529 IonicContact OD1-NH1 2.91Å; D526-R529 PolarHBondContact OD1-NH1 3.08Å; D526-M530 PolarHBondContact O-N 3.4Å; D526-M530 VanDerWaalsContact O-N 3.13Å
527	V	95.4	Very high	95	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-42.9	171.7	173.5	0	0	0	0	111.2	F120 A124 F523 D525 R529 M530 I531 P535	F120-V527 HydrophobicContact CZ-CG1 3.94Å; F120-V527 HydrophobicContact CZ-CG2 4.35Å; A124-V527 HydrophobicContact CB-CG2 4.06Å; F523-V527 HydrophobicContact CE1-CG2 4.36Å; F523-V527 HydrophobicContact CZ-CG2 4.48Å; F523-V527 WeakPolarHBondContact O-CG2 3.31Å; F523-V527 PolarHBondContact O-N 2.89Å; D525-V527 VanDerWaalsContact C-N 3.33Å; V527-R529 PolarHBondContact O-N 3.01Å; V527-M530 HydrophobicContact CB-CE 4.25Å; V527-M530 HydrophobicContact CG2-CE 3.86Å; V527-M530 WeakPolarHBondContact O-CA 3.1Å; V527-M530 WeakPolarHBondContact O-CB 3.41Å; V527-M530 PolarHBondContact O-N 3.24Å; V527-I531 HydrophobicContact CG1-CD1 3.77Å; V527-I531 HydrophobicContact CG1-CG1 4.18Å; V527-I531 HydrophobicContact CG1-CG2 4.45Å; V527-I531 WeakPolarHBondContact O-CG1 3.41Å; V527-I531 PolarHBondContact O-N 3.5Å; V527-P535 HydrophobicContact CB-CG 4.2Å; V527-P535 HydrophobicContact CG1-CG 3.43Å; V527-P535 VanDerWaalsContact CG1-CG 3.43Å
528	A	95	Very high	94.9	Very high	24 Å²	24	49.3 Å²	49.3	20%	0.198	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-34.9	177.9	0	0	0	0	0	112.3	M524 D525 D526 M530 G532 Y533 R534	M524-A528 WeakPolarHBondContact O-CB 3.38Å; M524-A528 PolarHBondContact O-N 2.98Å; D525-A528 WeakPolarHBondContact O-CB 3.35Å; D525-A528 PolarHBondContact O-N 3.01Å; D525-A528 VanDerWaalsContact O-N 3.16Å; D526-A528 VanDerWaalsContact C-N 3.34Å; A528-M530 VanDerWaalsContact C-N 3.35Å; A528-G532 CarbonylContact O-C 3.56Å; A528-G532 VanDerWaalsContact O-CA 3.24Å; A528-G532 WeakPolarHBondContact O-CA 3.38Å; A528-G532 PolarHBondContact O-N 3.38Å; A528-Y533 WeakPolarHBondContact CA-O 3.44Å; A528-R534 HydrophobicContact CB-CB 4.18Å; A528-R534 HydrophobicContact CB-CG 4.47Å
529	R	92.6	Very high	94.9	Very high	134 Å²	134	48.8 Å²	48.8	51%	0.506	25%	0.245	S	C	.	.	H	α-helix	trans	-66.1	-34.8	171.9	-67.8	176.4	-171.5	106.4	9.8	112.8	D525 D526 V527	D525-R529 WeakPolarHBondContact O-CG 3.35Å; D525-R529 PolarHBondContact O-N 3.19Å; D526-R529 WeakPolarHBondContact O-CB 3.4Å; D526-R529 PolarHBondContact O-N 3.31Å; D526-R529 IonicContact OD1-CZ 3.09Å; D526-R529 IonicContact OD1-NH1 2.91Å; D526-R529 PolarHBondContact OD1-NH1 3.08Å; V527-R529 PolarHBondContact O-N 3.01Å
530	M	94	Very high	94.9	Very high	5 Å²	5	50.2 Å²	50.2	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-69.7	-58.6	175	-71.2	-169.7	-67.2	0	0	111.3	A124 Q127 F128 F353 N354 D526 V527 A528	A124-M530 HydrophobicContact CB-CE 4.25Å; Q127-M530 HydrophobicContact CB-SD 4.17Å; Q127-M530 HydrophobicContact CG-SD 3.88Å; F128-M530 VanDerWaalsContact CA-SD 3.56Å; F128-M530 HydrophobicContact CB-CE 3.87Å; F128-M530 HydrophobicContact CB-SD 3.64Å; F128-M530 HydrophobicContact CD2-CE 4.41Å; F128-M530 HydrophobicContact CD2-CG 4.19Å; F128-M530 HydrophobicContact CD2-SD 4.03Å; F128-M530 HydrophobicContact CG-SD 4.34Å; F353-M530 HydrophobicContact CD1-CG 4.29Å; F353-M530 HydrophobicContact CD2-CG 4.12Å; F353-M530 HydrophobicContact CE1-CB 4.44Å; F353-M530 HydrophobicContact CE1-CG 3.88Å; F353-M530 HydrophobicContact CE2-CG 3.7Å; F353-M530 HydrophobicContact CE2-SD 4.33Å; F353-M530 HydrophobicContact CG-CG 4.41Å; F353-M530 HydrophobicContact CZ-CG 3.57Å; F353-M530 VanDerWaalsContact O-CB 3.31Å; F353-M530 WeakPolarHBondContact O-CB 3.45Å; N354-M530 VanDerWaalsContact CA-O 3.25Å; N354-M530 WeakPolarHBondContact CA-O 3.43Å; D526-M530 PolarHBondContact O-N 3.4Å; D526-M530 VanDerWaalsContact O-N 3.13Å; V527-M530 HydrophobicContact CB-CE 4.25Å; V527-M530 HydrophobicContact CG2-CE 3.86Å; V527-M530 WeakPolarHBondContact O-CA 3.1Å; V527-M530 WeakPolarHBondContact O-CB 3.41Å; V527-M530 PolarHBondContact O-N 3.24Å; A528-M530 VanDerWaalsContact C-N 3.35Å
531	I	95.2	Very high	95	Very high	21 Å²	21	56.8 Å²	56.8	11%	0.108	27%	0.268	C	S	.	.	H	α-helix	trans	-93.5	-6.2	-167	73.5	-176.9	0	0	0	114	N355 V527 Y533 P535	N355-I531 WeakPolarHBondContact O-CG2 3.36Å; V527-I531 HydrophobicContact CG1-CD1 3.77Å; V527-I531 HydrophobicContact CG1-CG1 4.18Å; V527-I531 HydrophobicContact CG1-CG2 4.45Å; V527-I531 WeakPolarHBondContact O-CG1 3.41Å; V527-I531 PolarHBondContact O-N 3.5Å; I531-Y533 VanDerWaalsContact C-N 3.33Å; I531-Y533 HydrophobicContact CB-CD1 4.38Å; I531-Y533 HydrophobicContact CB-CE1 4.05Å; I531-Y533 HydrophobicContact CD1-CD1 4.13Å; I531-Y533 HydrophobicContact CD1-CD2 4.09Å; I531-Y533 HydrophobicContact CD1-CE1 3.69Å; I531-Y533 HydrophobicContact CD1-CE2 3.67Å; I531-Y533 HydrophobicContact CD1-CG 4.31Å; I531-Y533 VanDerWaalsContact CD1-CZ 3.46Å; I531-Y533 WeakPolarHBondContact CD1-O 3.21Å; I531-Y533 HydrophobicContact CG1-CD1 3.79Å; I531-Y533 HydrophobicContact CG1-CD2 4.45Å; I531-Y533 HydrophobicContact CG1-CE1 3.7Å; I531-Y533 HydrophobicContact CG1-CE2 4.39Å; I531-Y533 HydrophobicContact CG1-CG 4.18Å; I531-Y533 WeakPolarHBondContact CG1-O 3.07Å; I531-Y533 WeakPolarHBondContact O-CD1 3.44Å; I531-Y533 PolarHBondContact O-N 3Å; I531-P535 HydrophobicContact CD1-CG 4.1Å
532	G	93.4	Very high	95.1	Very high	70 Å²	70	53.2 Å²	53.2	72%	0.722	25%	0.249	S	C	*	.	S	Bend	trans	83.6	-0.1	178.8	0	0	0	0	0	115.2	A528	A528-G532 CarbonylContact O-C 3.56Å; A528-G532 VanDerWaalsContact O-CA 3.24Å; A528-G532 WeakPolarHBondContact O-CA 3.38Å; A528-G532 PolarHBondContact O-N 3.38Å
533	Y	94.6	Very high	95.2	Very high	79 Å²	79	48.5 Å²	48.5	31%	0.31	23%	0.232	S	C	.	.	S	Bend	trans	-148.4	152.2	176	65.1	-85.5	0	0	0	111	D356 Y358 A528 I531 P535	D356-Y533 VanDerWaalsContact CG-OH 3.26Å; D356-Y533 PolarHBondContact OD1-OH 2.95Å; D356-Y533 WeakPolarHBondContact OD2-CE1 3.36Å; D356-Y533 PolarHBondContact OD2-OH 3.11Å; Y358-Y533 HydrophobicContact CD1-CE2 4.07Å; Y358-Y533 WeakPolarHBondContact CD1-OH 3.49Å; A528-Y533 WeakPolarHBondContact CA-O 3.44Å; I531-Y533 VanDerWaalsContact C-N 3.33Å; I531-Y533 HydrophobicContact CB-CD1 4.38Å; I531-Y533 HydrophobicContact CB-CE1 4.05Å; I531-Y533 HydrophobicContact CD1-CD1 4.13Å; I531-Y533 HydrophobicContact CD1-CD2 4.09Å; I531-Y533 HydrophobicContact CD1-CE1 3.69Å; I531-Y533 HydrophobicContact CD1-CE2 3.67Å; I531-Y533 HydrophobicContact CD1-CG 4.31Å; I531-Y533 VanDerWaalsContact CD1-CZ 3.46Å; I531-Y533 WeakPolarHBondContact CD1-O 3.21Å; I531-Y533 HydrophobicContact CG1-CD1 3.79Å; I531-Y533 HydrophobicContact CG1-CD2 4.45Å; I531-Y533 HydrophobicContact CG1-CE1 3.7Å; I531-Y533 HydrophobicContact CG1-CE2 4.39Å; I531-Y533 HydrophobicContact CG1-CG 4.18Å; I531-Y533 WeakPolarHBondContact CG1-O 3.07Å; I531-Y533 WeakPolarHBondContact O-CD1 3.44Å; I531-Y533 PolarHBondContact O-N 3Å; Y533-P535 WeakPolarHBondContact O-CD 3.17Å
534	R	93.8	Very high	95.3	Very high	126 Å²	126	49 Å²	49	48%	0.475	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-78.4	126.5	178.6	-161.1	170.2	-163.4	-165.8	1.9	110.1	D521 M524 D525 A528	D521-R534 PolarHBondContact O-NH2 3.34Å; D521-R534 IonicContact OD1-NH2 2.69Å; D521-R534 PolarHBondContact OD1-NH2 3.47Å; M524-R534 HydrophobicContact CE-CG 4.23Å; D525-R534 IonicContact OD1-CZ 2.81Å; D525-R534 IonicContact OD1-NE 2.72Å; D525-R534 PolarHBondContact OD1-NE 3.01Å; D525-R534 VanDerWaalsContact OD1-NE 3.09Å; D525-R534 IonicContact OD1-NH1 2.69Å; D525-R534 IonicContact OD1-NH2 3.82Å; D525-R534 PolarHBondContact OD1-NH2 3.48Å; A528-R534 HydrophobicContact CB-CB 4.18Å; A528-R534 HydrophobicContact CB-CG 4.47Å
535	P	94.4	Very high	95.3	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.019	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-60.8	164.9	176.9	-19.8	28.5	0	0	0	112.7	F120 Y358 M524 V527 I531 Y533	F120-P535 HydrophobicContact CE1-CB 4.42Å; F120-P535 HydrophobicContact CE1-CG 4.36Å; F120-P535 HydrophobicContact CZ-CB 4.42Å; F120-P535 HydrophobicContact CZ-CG 3.99Å; Y358-P535 HydrophobicContact CD2-CB 3.82Å; Y358-P535 HydrophobicContact CD2-CG 4.42Å; Y358-P535 HydrophobicContact CE2-CB 3.79Å; Y358-P535 HydrophobicContact CG-CB 4.28Å; M524-P535 HydrophobicContact CE-CB 3.73Å; M524-P535 HydrophobicContact CE-CG 4.08Å; M524-P535 WeakPolarHBondContact CE-O 3.07Å; M524-P535 HydrophobicContact SD-CB 4.22Å; M524-P535 HydrophobicContact SD-CG 4.22Å; V527-P535 HydrophobicContact CB-CG 4.2Å; V527-P535 HydrophobicContact CG1-CG 3.43Å; V527-P535 VanDerWaalsContact CG1-CG 3.43Å; I531-P535 HydrophobicContact CD1-CG 4.1Å; Y533-P535 WeakPolarHBondContact O-CD 3.17Å
536	F	94.8	Very high	95.4	Very high	136 Å²	136	52.8 Å²	52.8	60%	0.596	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-61.9	132	178.7	-172.4	-127.8	0	0	0	110.7	Y358 W538 M539	Y358-F536 WeakPolarHBondContact OH-CB 3.24Å; F536-W538 HydrophobicContact CD1-CB 3.31Å; F536-W538 HydrophobicContact CD1-CG 4.38Å; F536-W538 HydrophobicContact CE1-CB 3.55Å; F536-W538 HydrophobicContact CE1-CG 4.48Å; F536-W538 HydrophobicContact CG-CB 4.3Å; F536-W538 PolarHBondContact O-N 2.87Å; F536-M539 PolarHBondContact O-N 3.4Å; F536-M539 VanDerWaalsContact O-N 3.13Å
537	P	94.9	Very high	95.5	Very high	68 Å²	68	52.7 Å²	52.7	44%	0.442	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-15.5	-175.5	-29.3	36.6	0	0	0	115.6	M539 K540 W541	P537-M539 PolarHBondContact O-N 3.28Å; P537-K540 WeakPolarHBondContact O-CB 3.45Å; P537-K540 PolarHBondContact O-N 2.68Å; P537-K540 VanDerWaalsContact O-N 3.09Å; P537-W541 PolarHBondContact O-N 2.89Å; P537-W541 VanDerWaalsContact O-N 3.15Å
538	W	95.7	Very high	95.6	Very high	93 Å²	93	53 Å²	53	35%	0.352	25%	0.253	S	S	.	.	H	α-helix	trans	-48.8	-42.2	170.5	177.7	-109.8	0	0	0	113	F112 V113 F536 K540 W541 C542 I546	F112-W538 PolarHBondContact O-NE1 3.11Å; V113-W538 HydrophobicContact CG1-CH2 4.39Å; V113-W538 HydrophobicContact CG1-CZ2 3.97Å; F536-W538 HydrophobicContact CD1-CB 3.31Å; F536-W538 HydrophobicContact CD1-CG 4.38Å; F536-W538 HydrophobicContact CE1-CB 3.55Å; F536-W538 HydrophobicContact CE1-CG 4.48Å; F536-W538 HydrophobicContact CG-CB 4.3Å; F536-W538 PolarHBondContact O-N 2.87Å; W538-K540 VanDerWaalsContact C-N 3.31Å; W538-K540 PolarHBondContact O-N 3.18Å; W538-W541 PolarHBondContact O-N 3.14Å; W538-W541 VanDerWaalsContact O-N 3.1Å; W538-C542 PolarHBondContact NE1-SG 3.29Å; W538-C542 VanDerWaalsContact NE1-SG 3.38Å; W538-C542 PolarHBondContact O-N 3.22Å; W538-C542 PolarHBondContact O-SG 3.08Å; W538-I546 HydrophobicContact CE3-CD1 4.45Å; W538-I546 HydrophobicContact CH2-CD1 3.56Å; W538-I546 HydrophobicContact CZ2-CD1 4.25Å; W538-I546 HydrophobicContact CZ3-CD1 3.68Å
539	M	96.3	Very high	95.6	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-42.8	179.1	-64.4	-54.6	172.6	0	0	111.8	I116 P117 F120 Y358 F362 F536 P537 W541 C542 W543	I116-M539 HydrophobicContact CG2-CE 3.63Å; P117-M539 HydrophobicContact CB-SD 4.22Å; P117-M539 HydrophobicContact CG-SD 4.09Å; F120-M539 HydrophobicContact CD1-CB 4.38Å; F120-M539 HydrophobicContact CD1-CG 3.95Å; F120-M539 HydrophobicContact CD1-SD 4.24Å; F120-M539 HydrophobicContact CE1-CB 4.34Å; F120-M539 HydrophobicContact CE1-CG 4.06Å; Y358-M539 HydrophobicContact CE2-CE 3.74Å; Y358-M539 HydrophobicContact CE2-CG 3.88Å; F362-M539 HydrophobicContact CE1-CE 4.45Å; F362-M539 HydrophobicContact CE2-CE 3.52Å; F362-M539 HydrophobicContact CZ-CE 3.37Å; F536-M539 PolarHBondContact O-N 3.4Å; F536-M539 VanDerWaalsContact O-N 3.13Å; P537-M539 PolarHBondContact O-N 3.28Å; M539-W541 PolarHBondContact O-N 2.97Å; M539-C542 WeakPolarHBondContact O-CB 3.42Å; M539-C542 PolarHBondContact O-N 2.85Å; M539-W543 HydrophobicContact CB-CE3 4.49Å; M539-W543 HydrophobicContact CB-CH2 4.05Å; M539-W543 HydrophobicContact CB-CZ2 4.05Å; M539-W543 HydrophobicContact CB-CZ3 4.25Å; M539-W543 PolarHBondContact O-N 2.93Å
540	K	95.9	Very high	95.6	Very high	51 Å²	51	51.4 Å²	51.4	22%	0.222	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-47	174	169.8	-178.5	-178.3	-174.7	0	111.6	A520 D521 M524 P537 W538 C542 W543 S544	A520-K540 HydrophobicContact CB-CD 4.38Å; A520-K540 HydrophobicContact CB-CG 3.8Å; D521-K540 IonicContact OD1-NZ 3.14Å; D521-K540 PolarHBondContact OD1-NZ 3.39Å; D521-K540 WeakPolarHBondContact OD2-CE 3.3Å; D521-K540 IonicContact OD2-NZ 2.59Å; D521-K540 PolarHBondContact OD2-NZ 2.99Å; M524-K540 HydrophobicContact CG-CB 4.24Å; P537-K540 WeakPolarHBondContact O-CB 3.45Å; P537-K540 PolarHBondContact O-N 2.68Å; P537-K540 VanDerWaalsContact O-N 3.09Å; W538-K540 VanDerWaalsContact C-N 3.31Å; W538-K540 PolarHBondContact O-N 3.18Å; K540-C542 VanDerWaalsContact C-N 3.34Å; K540-W543 PolarHBondContact O-N 2.79Å; K540-S544 VanDerWaalsContact O-CB 3.23Å; K540-S544 WeakPolarHBondContact O-CB 3.21Å; K540-S544 PolarHBondContact O-N 3.42Å; K540-S544 PolarHBondContact O-OG 3.36Å
541	W	97.3	Very high	95.6	Very high	142 Å²	142	51.2 Å²	51.2	54%	0.538	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-38.9	179.5	-69.6	109.3	0	0	0	112.3	P537 W538 M539 F545 I546	P537-W541 PolarHBondContact O-N 2.89Å; P537-W541 VanDerWaalsContact O-N 3.15Å; W538-W541 PolarHBondContact O-N 3.14Å; W538-W541 VanDerWaalsContact O-N 3.1Å; M539-W541 PolarHBondContact O-N 2.97Å; W541-F545 AromaticContact CE3-CD2 3.68Å; W541-F545 HydrophobicContact CE3-CD2 3.68Å; W541-F545 AromaticContact CE3-CE2 3.74Å; W541-F545 HydrophobicContact CE3-CE2 3.74Å; W541-F545 HydrophobicContact CZ3-CD2 4.01Å; W541-F545 AromaticContact CZ3-CE2 3.64Å; W541-F545 HydrophobicContact CZ3-CE2 3.64Å; W541-F545 PolarHBondContact O-N 2.91Å; W541-I546 HydrophobicContact CB-CD1 4.5Å; W541-I546 PolarHBondContact O-N 3.29Å
542	C	97.6	Very high	95.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.263	C	S	.	.	I	π-helix	trans	-59	-57	173.6	-73.1	0	0	0	0	111.4	P117 W538 M539 K540 S544 F545 I546 T547 P548	P117-C542 HydrophobicContact CB-CB 3.67Å; P117-C542 HydrophobicContact CG-CB 3.57Å; W538-C542 PolarHBondContact NE1-SG 3.29Å; W538-C542 VanDerWaalsContact NE1-SG 3.38Å; W538-C542 PolarHBondContact O-N 3.22Å; W538-C542 PolarHBondContact O-SG 3.08Å; M539-C542 WeakPolarHBondContact O-CB 3.42Å; M539-C542 PolarHBondContact O-N 2.85Å; K540-C542 VanDerWaalsContact C-N 3.34Å; C542-S544 VanDerWaalsContact C-N 3.29Å; C542-S544 PolarHBondContact O-N 3.47Å; C542-F545 PolarHBondContact O-N 3.19Å; C542-I546 PolarHBondContact O-N 3.13Å; C542-T547 VanDerWaalsContact C-OG1 3.31Å; C542-T547 WeakPolarHBondContact CB-OG1 3.45Å; C542-T547 WeakPolarHBondContact O-CB 3.26Å; C542-T547 PolarHBondContact O-N 3.38Å; C542-T547 PolarHBondContact O-OG1 3.46Å; C542-T547 VanDerWaalsContact O-OG1 3.09Å; C542-P548 VanDerWaalsContact O-CD 3.23Å; C542-P548 WeakPolarHBondContact O-CD 3.43Å
543	W	97.5	Very high	95.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.241	C	C	.	.	I	π-helix	trans	-62.2	-35.4	-179.7	-56.3	-34.9	0	0	0	113.5	P117 F120 L121 C511 A515 F523 M524 M539 K540 P548	P117-W543 VanDerWaalsContact C-NE1 3.31Å; P117-W543 PolarHBondContact O-NE1 2.73Å; F120-W543 AromaticContact CD1-CH2 3.7Å; F120-W543 HydrophobicContact CD1-CH2 3.7Å; F120-W543 AromaticContact CD1-CZ2 3.33Å; F120-W543 HydrophobicContact CD1-CZ2 3.33Å; F120-W543 AromaticContact CE1-CH2 3.44Å; F120-W543 HydrophobicContact CE1-CH2 3.44Å; F120-W543 VanDerWaalsContact CE1-CH2 3.44Å; F120-W543 AromaticContact CE1-CZ2 3.62Å; F120-W543 HydrophobicContact CE1-CZ2 3.62Å; F120-W543 HydrophobicContact CG-CZ2 4.3Å; F120-W543 HydrophobicContact CZ-CH2 4.42Å; L121-W543 HydrophobicContact CB-CZ2 3.95Å; L121-W543 HydrophobicContact CD1-CD2 4.22Å; L121-W543 HydrophobicContact CD1-CG 4Å; C511-W543 WeakPolarHBondContact CB-O 3.27Å; A515-W543 HydrophobicContact CB-CB 4.21Å; F523-W543 HydrophobicContact CD1-CE3 4.26Å; F523-W543 AromaticContact CD1-CH2 3.85Å; F523-W543 HydrophobicContact CD1-CH2 3.85Å; F523-W543 AromaticContact CD1-CZ3 3.61Å; F523-W543 HydrophobicContact CD1-CZ3 3.61Å; F523-W543 AromaticContact CE1-CH2 3.74Å; F523-W543 HydrophobicContact CE1-CH2 3.74Å; F523-W543 HydrophobicContact CE1-CZ2 4.32Å; F523-W543 AromaticContact CE1-CZ3 3.99Å; F523-W543 HydrophobicContact CE1-CZ3 3.99Å; M524-W543 HydrophobicContact CG-CZ3 4.25Å; M524-W543 HydrophobicContact SD-CH2 4.25Å; M524-W543 HydrophobicContact SD-CZ3 3.72Å; M539-W543 HydrophobicContact CB-CE3 4.49Å; M539-W543 HydrophobicContact CB-CH2 4.05Å; M539-W543 HydrophobicContact CB-CZ2 4.05Å; M539-W543 HydrophobicContact CB-CZ3 4.25Å; M539-W543 PolarHBondContact O-N 2.93Å; K540-W543 PolarHBondContact O-N 2.79Å; W543-P548 WeakPolarHBondContact O-CD 3.34Å; W543-P548 VanDerWaalsContact O-CG 3.25Å; W543-P548 WeakPolarHBondContact O-CG 3.22Å
544	S	97.2	Very high	95.3	Very high	10 Å²	10	47.3 Å²	47.3	7%	0.07	23%	0.23	C	C	.	.	I	π-helix	trans	-78	-36.9	-175	-54.5	0	0	0	0	112.5	W516 K540 C542	W516-S544 PolarHBondContact NE1-O 3.07Å; K540-S544 VanDerWaalsContact O-CB 3.23Å; K540-S544 WeakPolarHBondContact O-CB 3.21Å; K540-S544 PolarHBondContact O-N 3.42Å; K540-S544 PolarHBondContact O-OG 3.36Å; C542-S544 VanDerWaalsContact C-N 3.29Å; C542-S544 PolarHBondContact O-N 3.47Å
545	F	96.8	Very high	95.2	Very high	92 Å²	92	42.1 Å²	42.1	40%	0.404	21%	0.211	S	C	.	.	I	π-helix	trans	-137.4	-57.1	-169.2	-56	-79.8	0	0	0	113.5	W516 W541 C542 P548 C549	W516-F545 AromaticContact CH2-CE1 3.67Å; W516-F545 HydrophobicContact CH2-CE1 3.67Å; W516-F545 AromaticContact CH2-CZ 3.59Å; W516-F545 HydrophobicContact CH2-CZ 3.59Å; W516-F545 HydrophobicContact CZ2-CD1 4.01Å; W516-F545 AromaticContact CZ2-CE1 3.32Å; W516-F545 HydrophobicContact CZ2-CE1 3.32Å; W516-F545 HydrophobicContact CZ2-CE2 4.27Å; W516-F545 AromaticContact CZ2-CZ 3.47Å; W516-F545 HydrophobicContact CZ2-CZ 3.47Å; W516-F545 VanDerWaalsContact CZ2-CZ 3.47Å; W541-F545 AromaticContact CE3-CD2 3.68Å; W541-F545 HydrophobicContact CE3-CD2 3.68Å; W541-F545 AromaticContact CE3-CE2 3.74Å; W541-F545 HydrophobicContact CE3-CE2 3.74Å; W541-F545 HydrophobicContact CZ3-CD2 4.01Å; W541-F545 AromaticContact CZ3-CE2 3.64Å; W541-F545 HydrophobicContact CZ3-CE2 3.64Å; W541-F545 PolarHBondContact O-N 2.91Å; C542-F545 PolarHBondContact O-N 3.19Å; F545-P548 WeakPolarHBondContact O-CD 3.26Å; F545-C549 WeakPolarHBondContact O-CB 3.1Å; F545-C549 PolarHBondContact O-N 3.18Å; F545-C549 VanDerWaalsContact O-N 3.08Å; F545-C549 PolarHBondContact O-SG 2.78Å
546	I	96.9	Very high	95	Very high	51 Å²	51	46.2 Å²	46.2	26%	0.262	23%	0.232	S	C	.	.	I	π-helix	trans	-67.5	-52.6	-165.5	-52.4	168.9	0	0	0	110.6	V113 W538 W541 C542 C549 V550	V113-I546 HydrophobicContact CB-CG2 3.75Å; V113-I546 HydrophobicContact CG1-CG2 4.06Å; V113-I546 HydrophobicContact CG2-CG2 4.4Å; W538-I546 HydrophobicContact CE3-CD1 4.45Å; W538-I546 HydrophobicContact CH2-CD1 3.56Å; W538-I546 HydrophobicContact CZ2-CD1 4.25Å; W538-I546 HydrophobicContact CZ3-CD1 3.68Å; W541-I546 HydrophobicContact CB-CD1 4.5Å; W541-I546 PolarHBondContact O-N 3.29Å; C542-I546 PolarHBondContact O-N 3.13Å; I546-C549 PolarHBondContact O-N 3.41Å; I546-V550 HydrophobicContact CG2-CG2 4.38Å; I546-V550 WeakPolarHBondContact O-CG2 3.28Å; I546-V550 PolarHBondContact O-N 3.07Å
547	T	96.3	Very high	94.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-48.8	-178	-45.1	0	0	0	0	112.1	V113 I118 C542 C549 V550 C551	V113-T547 WeakPolarHBondContact O-CB 3.38Å; V113-T547 PolarHBondContact O-OG1 2.88Å; I118-T547 HydrophobicContact CD1-CG2 3.43Å; I118-T547 VanDerWaalsContact CD1-CG2 3.43Å; I118-T547 HydrophobicContact CG1-CG2 3.65Å; C542-T547 VanDerWaalsContact C-OG1 3.31Å; C542-T547 WeakPolarHBondContact CB-OG1 3.45Å; C542-T547 WeakPolarHBondContact O-CB 3.26Å; C542-T547 PolarHBondContact O-N 3.38Å; C542-T547 PolarHBondContact O-OG1 3.46Å; C542-T547 VanDerWaalsContact O-OG1 3.09Å; T547-C549 VanDerWaalsContact C-N 3.28Å; T547-C549 PolarHBondContact O-N 2.95Å; T547-V550 PolarHBondContact O-N 3.09Å; T547-C551 WeakPolarHBondContact O-CB 3.46Å; T547-C551 PolarHBondContact O-N 2.95Å; T547-C551 PolarHBondContact O-SG 3.31Å
548	P	96.7	Very high	94.1	Very high	7 Å²	7	44 Å²	44	5%	0.045	22%	0.216	C	C	.	.	H	α-helix	trans	-54.5	-41.7	173.4	-25.9	32.1	0	0	0	113.8	F508 C511 I512 C542 W543 F545 C551 M552	F508-P548 HydrophobicContact CD2-CB 3.92Å; F508-P548 HydrophobicContact CE2-CB 4.07Å; C511-P548 HydrophobicContact CB-CG 3.66Å; I512-P548 HydrophobicContact CD1-CB 4.22Å; I512-P548 HydrophobicContact CD1-CG 4.37Å; C542-P548 VanDerWaalsContact O-CD 3.23Å; C542-P548 WeakPolarHBondContact O-CD 3.43Å; W543-P548 WeakPolarHBondContact O-CD 3.34Å; W543-P548 VanDerWaalsContact O-CG 3.25Å; W543-P548 WeakPolarHBondContact O-CG 3.22Å; F545-P548 WeakPolarHBondContact O-CD 3.26Å; P548-C551 PolarHBondContact O-N 3.42Å; P548-M552 VanDerWaalsContact O-CB 3.29Å; P548-M552 WeakPolarHBondContact O-CB 3.48Å; P548-M552 PolarHBondContact O-N 3.15Å
549	C	96	Very high	93.7	Very high	89 Å²	89	42.8 Å²	42.8	60%	0.601	22%	0.216	S	C	*	.	H	α-helix	trans	-66.2	-42.4	178.5	-69.3	0	0	0	0	111.7	F545 I546 T547 G553	F545-C549 WeakPolarHBondContact O-CB 3.1Å; F545-C549 PolarHBondContact O-N 3.18Å; F545-C549 VanDerWaalsContact O-N 3.08Å; F545-C549 PolarHBondContact O-SG 2.78Å; I546-C549 PolarHBondContact O-N 3.41Å; T547-C549 VanDerWaalsContact C-N 3.28Å; T547-C549 PolarHBondContact O-N 2.95Å; C549-G553 WeakPolarHBondContact O-CA 3.35Å; C549-G553 PolarHBondContact O-N 2.82Å
550	V	92.8	Very high	93.3	Very high	35 Å²	35	48.3 Å²	48.3	21%	0.212	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-47.5	175.9	171.3	0	0	0	0	110.6	V113 I546 T547 G553 I554	V113-V550 HydrophobicContact CG2-CG2 4.11Å; I546-V550 HydrophobicContact CG2-CG2 4.38Å; I546-V550 WeakPolarHBondContact O-CG2 3.28Å; I546-V550 PolarHBondContact O-N 3.07Å; T547-V550 PolarHBondContact O-N 3.09Å; V550-G553 PolarHBondContact O-N 3.04Å; V550-I554 HydrophobicContact CG1-CD1 3.69Å; V550-I554 HydrophobicContact CG1-CG1 4.43Å; V550-I554 WeakPolarHBondContact O-CB 3.44Å; V550-I554 VanDerWaalsContact O-CG1 3.29Å; V550-I554 WeakPolarHBondContact O-CG1 3.29Å; V550-I554 PolarHBondContact O-N 3.39Å
551	C	94	Very high	92.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.6	-51.2	178.2	-67.7	0	0	0	0	111.7	F334 L504 F508 T547 P548 F555	F334-C551 VanDerWaalsContact CE1-SG 3.53Å; F334-C551 WeakPolarHBondContact CZ-SG 3.32Å; L504-C551 HydrophobicContact CD2-CB 4.35Å; F508-C551 HydrophobicContact CB-CB 4.05Å; T547-C551 WeakPolarHBondContact O-CB 3.46Å; T547-C551 PolarHBondContact O-N 2.95Å; T547-C551 PolarHBondContact O-SG 3.31Å; P548-C551 PolarHBondContact O-N 3.42Å; C551-F555 WeakPolarHBondContact O-CB 3.13Å; C551-F555 PolarHBondContact O-N 3.48Å
552	M	94.4	Very high	92.2	Very high	48 Å²	48	45.9 Å²	45.9	24%	0.236	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-39.6	-179.6	-172.9	58.6	64.9	0	0	111.7	W505 F508 P548 F555 L556	W505-M552 HydrophobicContact CZ3-CE 4.41Å; F508-M552 HydrophobicContact CD1-CE 3.73Å; F508-M552 HydrophobicContact CD2-CB 4.12Å; F508-M552 HydrophobicContact CD2-CE 3.77Å; F508-M552 HydrophobicContact CE1-CE 3.62Å; F508-M552 HydrophobicContact CE2-CB 4.27Å; F508-M552 HydrophobicContact CE2-CE 3.66Å; F508-M552 HydrophobicContact CG-CE 3.81Å; F508-M552 HydrophobicContact CZ-CE 3.58Å; P548-M552 VanDerWaalsContact O-CB 3.29Å; P548-M552 WeakPolarHBondContact O-CB 3.48Å; P548-M552 PolarHBondContact O-N 3.15Å; M552-F555 PolarHBondContact O-N 2.89Å; M552-F555 HydrophobicContact SD-CD1 4.15Å; M552-L556 HydrophobicContact CG-CD1 4.03Å; M552-L556 HydrophobicContact CG-CG 4.33Å; M552-L556 WeakPolarHBondContact O-CB 3.25Å; M552-L556 VanDerWaalsContact O-CG 3.25Å; M552-L556 WeakPolarHBondContact O-CG 3.36Å; M552-L556 PolarHBondContact O-N 3.24Å; M552-L556 HydrophobicContact SD-CD1 4.33Å; M552-L556 HydrophobicContact SD-CG 4.13Å
553	G	92.1	Very high	91.6	Very high	26 Å²	26	53.3 Å²	53.3	27%	0.268	28%	0.278	S	S	.	.	H	α-helix	trans	-59.7	-53.2	176.8	0	0	0	0	0	111.9	C549 V550 F555 L556 F557	C549-G553 WeakPolarHBondContact O-CA 3.35Å; C549-G553 PolarHBondContact O-N 2.82Å; V550-G553 PolarHBondContact O-N 3.04Å; G553-F555 VanDerWaalsContact C-N 3.33Å; G553-F555 PolarHBondContact O-N 3.06Å; G553-L556 PolarHBondContact O-N 3.47Å; G553-F557 WeakPolarHBondContact O-CD2 3.44Å; G553-F557 PolarHBondContact O-N 3.5Å
554	I	89.8	Confident	91.1	Very high	15 Å²	15	56.3 Å²	56.3	8%	0.077	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-41.2	178.8	-63.1	172.1	0	0	0	110.8	I110 I327 L504 V550 F557 H558	I110-I554 HydrophobicContact CD1-CD1 4.36Å; I327-I554 HydrophobicContact CB-CG2 4.37Å; I327-I554 HydrophobicContact CG1-CG2 4.27Å; I327-I554 HydrophobicContact CG2-CG2 4.17Å; L504-I554 HydrophobicContact CD1-CB 4Å; L504-I554 HydrophobicContact CD1-CG2 3.49Å; L504-I554 VanDerWaalsContact CD1-CG2 3.49Å; V550-I554 HydrophobicContact CG1-CD1 3.69Å; V550-I554 HydrophobicContact CG1-CG1 4.43Å; V550-I554 WeakPolarHBondContact O-CB 3.44Å; V550-I554 VanDerWaalsContact O-CG1 3.29Å; V550-I554 WeakPolarHBondContact O-CG1 3.29Å; V550-I554 PolarHBondContact O-N 3.39Å; I554-F557 PolarHBondContact O-N 3.29Å; I554-H558 WeakPolarHBondContact O-CB 3.47Å; I554-H558 PolarHBondContact O-N 2.88Å
555	F	91.1	Very high	90.6	Very high	16 Å²	16	56.6 Å²	56.6	7%	0.07	30%	0.298	C	S	.	.	H	α-helix	trans	-58.9	-48.5	176.2	176.4	-91.7	0	0	0	112	M501 L504 W505 C551 M552 G553 H558 L559 M589	M501-F555 HydrophobicContact CG-CD2 3.58Å; M501-F555 HydrophobicContact CG-CE2 3.32Å; M501-F555 HydrophobicContact CG-CZ 4.37Å; M501-F555 HydrophobicContact SD-CE2 4.13Å; L504-F555 HydrophobicContact CB-CB 4.43Å; W505-F555 HydrophobicContact CB-CD2 4.4Å; W505-F555 HydrophobicContact CB-CE2 4.13Å; W505-F555 HydrophobicContact CE3-CE1 4.22Å; W505-F555 HydrophobicContact CE3-CE2 4.23Å; W505-F555 AromaticContact CE3-CZ 3.95Å; W505-F555 HydrophobicContact CE3-CZ 3.95Å; W505-F555 HydrophobicContact CZ3-CE1 4.48Å; W505-F555 HydrophobicContact CZ3-CZ 4.49Å; C551-F555 WeakPolarHBondContact O-CB 3.13Å; C551-F555 PolarHBondContact O-N 3.48Å; M552-F555 PolarHBondContact O-N 2.89Å; M552-F555 HydrophobicContact SD-CD1 4.15Å; G553-F555 VanDerWaalsContact C-N 3.33Å; G553-F555 PolarHBondContact O-N 3.06Å; F555-H558 WeakPolarHBondContact O-CB 3.35Å; F555-H558 PolarHBondContact O-N 2.96Å; F555-L559 HydrophobicContact CD1-CD1 3.95Å; F555-L559 HydrophobicContact CD1-CG 4.47Å; F555-L559 HydrophobicContact CE1-CD1 3.32Å; F555-L559 HydrophobicContact CE1-CG 4.12Å; F555-L559 HydrophobicContact CZ-CD1 3.73Å; F555-L559 HydrophobicContact CZ-CG 4.29Å; F555-L559 WeakPolarHBondContact O-CG 3.24Å; F555-L559 PolarHBondContact O-N 2.89Å; F555-M589 HydrophobicContact CE2-CE 3.69Å; F555-M589 HydrophobicContact CZ-CE 3.68Å
556	L	91.1	Very high	90.1	Very high	90 Å²	90	55.1 Å²	55.1	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-64	-42.2	177.5	-70.6	173.7	0	0	0	111.9	M552 G553 H558 L559 V560	M552-L556 HydrophobicContact CG-CD1 4.03Å; M552-L556 HydrophobicContact CG-CG 4.33Å; M552-L556 WeakPolarHBondContact O-CB 3.25Å; M552-L556 VanDerWaalsContact O-CG 3.25Å; M552-L556 WeakPolarHBondContact O-CG 3.36Å; M552-L556 PolarHBondContact O-N 3.24Å; M552-L556 HydrophobicContact SD-CD1 4.33Å; M552-L556 HydrophobicContact SD-CG 4.13Å; G553-L556 PolarHBondContact O-N 3.47Å; L556-H558 VanDerWaalsContact C-N 3.3Å; L556-H558 PolarHBondContact O-N 3.31Å; L556-L559 PolarHBondContact O-N 3.16Å; L556-V560 WeakPolarHBondContact O-CG2 3.49Å; L556-V560 PolarHBondContact O-N 2.95Å
557	F	86.9	Confident	89.5	Confident	112 Å²	112	53.3 Å²	53.3	49%	0.491	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-37.6	175.6	-80.4	-60.6	0	0	0	112.7	I327 G553 I554 V560 N561	I327-F557 HydrophobicContact CD1-CB 3.94Å; I327-F557 HydrophobicContact CG1-CB 4.36Å; G553-F557 WeakPolarHBondContact O-CD2 3.44Å; G553-F557 PolarHBondContact O-N 3.5Å; I554-F557 PolarHBondContact O-N 3.29Å; F557-V560 PolarHBondContact O-N 2.9Å; F557-N561 WeakPolarHBondContact O-CB 3.25Å; F557-N561 PolarHBondContact O-N 2.7Å; F557-N561 PolarHBondContact O-ND2 2.98Å
558	H	83.6	Confident	88.5	Confident	44 Å²	44	57.5 Å²	57.5	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-40	175.2	-172.4	-80.9	0	0	0	111.8	I554 F555 L556 Y562	I554-H558 WeakPolarHBondContact O-CB 3.47Å; I554-H558 PolarHBondContact O-N 2.88Å; F555-H558 WeakPolarHBondContact O-CB 3.35Å; F555-H558 PolarHBondContact O-N 2.96Å; L556-H558 VanDerWaalsContact C-N 3.3Å; L556-H558 PolarHBondContact O-N 3.31Å; H558-Y562 WeakPolarHBondContact O-CA 3.48Å; H558-Y562 PolarHBondContact O-N 2.81Å; H558-Y562 VanDerWaalsContact O-N 3.1Å
559	L	87.1	Confident	87.3	Confident	68 Å²	68	63.3 Å²	63.3	36%	0.356	35%	0.345	S	S	.	.	H	α-helix	trans	-66.3	-43.2	175.3	-71.8	-179	0	0	0	112.5	M501 F555 L556 Y562 W582	M501-L559 HydrophobicContact SD-CD2 3.72Å; F555-L559 HydrophobicContact CD1-CD1 3.95Å; F555-L559 HydrophobicContact CD1-CG 4.47Å; F555-L559 HydrophobicContact CE1-CD1 3.32Å; F555-L559 HydrophobicContact CE1-CG 4.12Å; F555-L559 HydrophobicContact CZ-CD1 3.73Å; F555-L559 HydrophobicContact CZ-CG 4.29Å; F555-L559 WeakPolarHBondContact O-CG 3.24Å; F555-L559 PolarHBondContact O-N 2.89Å; L556-L559 PolarHBondContact O-N 3.16Å; L559-Y562 WeakPolarHBondContact O-CB 3.45Å; L559-Y562 PolarHBondContact O-N 3.09Å; L559-W582 HydrophobicContact CD2-CH2 3.84Å; L559-W582 HydrophobicContact CD2-CZ3 4.48Å
560	V	88.3	Confident	86.6	Confident	118 Å²	118	65.1 Å²	65.1	72%	0.715	35%	0.353	S	S	*	.	H	α-helix	trans	-67.9	-38.4	-179.3	171.5	0	0	0	0	111.6	L556 F557 Y562	L556-V560 WeakPolarHBondContact O-CG2 3.49Å; L556-V560 PolarHBondContact O-N 2.95Å; F557-V560 PolarHBondContact O-N 2.9Å; V560-Y562 VanDerWaalsContact C-N 3.34Å
561	N	85.1	Confident	86.3	Confident	84 Å²	84	65.3 Å²	65.3	45%	0.449	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	21.8	179.9	-62	-66.6	0	0	0	113	F557 K563	F557-N561 WeakPolarHBondContact O-CB 3.25Å; F557-N561 PolarHBondContact O-N 2.7Å; F557-N561 PolarHBondContact O-ND2 2.98Å; N561-K563 PolarHBondContact O-N 3.13Å
562	Y	85.7	Confident	86.2	Confident	58 Å²	58	69.7 Å²	69.7	23%	0.227	38%	0.376	C	S	.	.			trans	-58.6	132.8	-178.9	172	-99.3	0	0	0	110.9	Y495 Y496 H558 L559 V560 W582	Y495-Y562 HydrophobicContact CE1-CE2 4.46Å; Y496-Y562 HydrophobicContact CE1-CE2 4.11Å; Y496-Y562 PolarHBondContact OH-OH 2.96Å; H558-Y562 WeakPolarHBondContact O-CA 3.48Å; H558-Y562 PolarHBondContact O-N 2.81Å; H558-Y562 VanDerWaalsContact O-N 3.1Å; L559-Y562 WeakPolarHBondContact O-CB 3.45Å; L559-Y562 PolarHBondContact O-N 3.09Å; V560-Y562 VanDerWaalsContact C-N 3.34Å; Y562-W582 HydrophobicContact CD2-CZ2 4Å; Y562-W582 HydrophobicContact CE1-CZ2 4.5Å; Y562-W582 AromaticContact CE2-CZ2 3.8Å; Y562-W582 HydrophobicContact CE2-CZ2 3.8Å; Y562-W582 HydrophobicContact CG-CZ2 4.43Å; Y562-W582 AromaticContact CZ-NE1 3.68Å; Y562-W582 PolarHBondContact OH-NE1 3.45Å
563	K	84.1	Confident	86.1	Confident	157 Å²	157	67.7 Å²	67.7	68%	0.683	37%	0.366	S	S	*	.			trans	-122.5	140.1	172.8	-67.6	-177	-179.2	-179.8	0	109.4	Y495 N561	Y495-K563 PolarHBondContact OH-O 3.2Å; N561-K563 PolarHBondContact O-N 3.13Å
564	P	86.4	Confident	86.2	Confident	63 Å²	63	68 Å²	68	41%	0.409	36%	0.363	S	S	.	.			trans	-51	143.4	170.2	-30	38	0	0	0	111.9	E578	P564-E578 WeakPolarHBondContact CB-OE1 3.19Å
565	L	86.9	Confident	86.4	Confident	15 Å²	15	76.7 Å²	76.7	8%	0.079	40%	0.396	C	S	.	.			trans	-66.6	138	175	-179.9	62.9	0	0	0	109.5	Q491 L492 Y495 Y496 Y573	Q491-L565 HydrophobicContact CB-CD2 4.28Å; L492-L565 HydrophobicContact CD2-CD2 4.05Å; Y495-L565 HydrophobicContact CD1-CB 4.3Å; Y495-L565 HydrophobicContact CD1-CD1 4.15Å; Y495-L565 HydrophobicContact CD1-CD2 4.5Å; Y495-L565 HydrophobicContact CD2-CD1 3.77Å; Y495-L565 HydrophobicContact CE1-CB 4.41Å; Y495-L565 HydrophobicContact CE2-CD1 4.25Å; Y495-L565 HydrophobicContact CG-CD1 3.7Å; Y495-L565 HydrophobicContact CG-CD2 4.39Å; Y495-L565 HydrophobicContact CG-CG 4.46Å; Y496-L565 HydrophobicContact CE2-CB 4.33Å; Y496-L565 HydrophobicContact CE2-CD2 4.23Å; L565-Y573 HydrophobicContact CB-CD2 4.07Å; L565-Y573 HydrophobicContact CB-CE2 4.38Å; L565-Y573 HydrophobicContact CD2-CD1 4.5Å; L565-Y573 HydrophobicContact CD2-CD2 4.06Å; L565-Y573 HydrophobicContact CD2-CE1 4.14Å; L565-Y573 HydrophobicContact CD2-CE2 3.65Å; L565-Y573 HydrophobicContact CD2-CG 4.44Å; L565-Y573 HydrophobicContact CG-CD2 3.81Å; L565-Y573 HydrophobicContact CG-CE2 3.61Å; L565-Y573 VanDerWaalsContact O-CD2 3.26Å; L565-Y573 WeakPolarHBondContact O-CD2 3.39Å
566	T	87.3	Confident	86.5	Confident	62 Å²	62	80.2 Å²	80.2	38%	0.38	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.2	175.8	59.8	0	0	0	0	110.4	Y571 V572	T566-Y571 CarbonylContact C-O 3.5Å; T566-Y571 VanDerWaalsContact CA-O 3.22Å; T566-Y571 WeakPolarHBondContact CA-O 3.46Å; T566-Y571 WeakPolarHBondContact CB-O 3.41Å; T566-V572 HydrophobicContact CG2-CG2 4.25Å
567	Y	84.5	Confident	86.7	Confident	13 Å²	13	75.9 Å²	75.9	5%	0.051	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.9	172.7	179.4	-107.3	0	0	0	110.7	I241 M487 Y488 Q491 T569 V570 Y571	I241-Y567 HydrophobicContact CD1-CD1 4.38Å; I241-Y567 HydrophobicContact CD1-CE1 3.55Å; M487-Y567 HydrophobicContact CE-CE2 3.84Å; M487-Y567 HydrophobicContact CG-CE2 3.85Å; Y488-Y567 HydrophobicContact CD1-CG 4.47Å; Y488-Y567 AromaticContact CE1-CD1 3.82Å; Y488-Y567 HydrophobicContact CE1-CD1 3.82Å; Y488-Y567 HydrophobicContact CE1-CG 4.07Å; Q491-Y567 VanDerWaalsContact NE2-CD2 3.32Å; Y567-T569 PolarHBondContact O-N 3.32Å; Y567-V570 PolarHBondContact O-N 3.28Å; Y567-Y571 PolarHBondContact N-O 3.28Å; Y567-Y571 PolarHBondContact O-N 3.49Å
568	N	74.8	Confident	86.9	Confident	88 Å²	88	72.8 Å²	72.8	47%	0.471	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	27.9	-177.8	-74	-7.5	0	0	0	114.6	E235 V570	E235-N568 PolarHBondContact OE1-ND2 3.11Å; N568-V570 PolarHBondContact O-N 3.05Å
569	T	72	Confident	87.5	Confident	129 Å²	129	74.2 Å²	74.2	79%	0.791	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	-12	-174.7	67.6	0	0	0	0	116.6	Y567	Y567-T569 PolarHBondContact O-N 3.32Å
570	V	80.9	Confident	87.9	Confident	127 Å²	127	74.7 Å²	74.7	77%	0.77	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-42.4	-177.7	177.3	0	0	0	0	111.3	Y567 N568	Y567-V570 PolarHBondContact O-N 3.28Å; N568-V570 PolarHBondContact O-N 3.05Å
571	Y	86.6	Confident	88.2	Confident	39 Å²	39	69.1 Å²	69.1	15%	0.153	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.4	-177.9	-179.9	-93.1	0	0	0	110.7	G244 L245 Y488 T566 Y567 Y573	G244-Y571 VanDerWaalsContact CA-CE2 3.48Å; L245-Y571 PolarHBondContact N-OH 2.66Å; Y488-Y571 AromaticContact CD1-CD1 3.77Å; Y488-Y571 HydrophobicContact CD1-CD1 3.77Å; Y488-Y571 AromaticContact CD1-CE1 3.67Å; Y488-Y571 HydrophobicContact CD1-CE1 3.67Å; Y488-Y571 HydrophobicContact CD1-CG 4.48Å; Y488-Y571 AromaticContact CE1-CD1 3.5Å; Y488-Y571 HydrophobicContact CE1-CD1 3.5Å; Y488-Y571 HydrophobicContact CE1-CD2 4.22Å; Y488-Y571 AromaticContact CE1-CE1 3.74Å; Y488-Y571 HydrophobicContact CE1-CE1 3.74Å; Y488-Y571 HydrophobicContact CE1-CE2 4.43Å; Y488-Y571 AromaticContact CE1-CG 3.76Å; Y488-Y571 HydrophobicContact CE1-CG 3.76Å; Y488-Y571 HydrophobicContact CG-CE1 4.39Å; T566-Y571 CarbonylContact C-O 3.5Å; T566-Y571 VanDerWaalsContact CA-O 3.22Å; T566-Y571 WeakPolarHBondContact CA-O 3.46Å; T566-Y571 WeakPolarHBondContact CB-O 3.41Å; Y567-Y571 PolarHBondContact N-O 3.28Å; Y567-Y571 PolarHBondContact O-N 3.49Å; Y571-Y573 HydrophobicContact CD1-CD2 4.06Å; Y571-Y573 HydrophobicContact CD1-CE2 4.1Å; Y571-Y573 HydrophobicContact CE1-CD1 4.38Å; Y571-Y573 AromaticContact CE1-CD2 3.95Å; Y571-Y573 HydrophobicContact CE1-CD2 3.95Å; Y571-Y573 HydrophobicContact CE1-CE2 4.12Å; Y571-Y573 HydrophobicContact CE1-CG 4.12Å
572	V	90.5	Very high	88.6	Confident	91 Å²	91	68.4 Å²	68.4	55%	0.552	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	130	174.1	-176.9	0	0	0	0	108.5	T566	T566-V572 HydrophobicContact CG2-CG2 4.25Å
573	Y	93.1	Very high	89.1	Confident	6 Å²	6	69.3 Å²	69.3	2%	0.024	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-64.9	142.5	-179.9	-83	-105.5	0	0	0	111.3	L245 Y488 Q491 L492 L565 Y571	L245-Y573 HydrophobicContact CD2-CD1 4.12Å; L245-Y573 HydrophobicContact CD2-CE1 4.3Å; Y488-Y573 WeakPolarHBondContact CA-OH 3.31Å; Y488-Y573 PolarHBondContact O-OH 3.41Å; Q491-Y573 VanDerWaalsContact CB-OH 3.27Å; Q491-Y573 WeakPolarHBondContact CB-OH 3.49Å; Q491-Y573 PolarHBondContact OE1-OH 2.97Å; L492-Y573 HydrophobicContact CD1-CD1 4.46Å; L492-Y573 HydrophobicContact CD1-CE1 4.14Å; L492-Y573 HydrophobicContact CD2-CD1 3.91Å; L492-Y573 HydrophobicContact CD2-CE1 3.86Å; L492-Y573 HydrophobicContact CG-CD1 4.2Å; L492-Y573 HydrophobicContact CG-CE1 3.7Å; L565-Y573 HydrophobicContact CB-CD2 4.07Å; L565-Y573 HydrophobicContact CB-CE2 4.38Å; L565-Y573 HydrophobicContact CD2-CD1 4.5Å; L565-Y573 HydrophobicContact CD2-CD2 4.06Å; L565-Y573 HydrophobicContact CD2-CE1 4.14Å; L565-Y573 HydrophobicContact CD2-CE2 3.65Å; L565-Y573 HydrophobicContact CD2-CG 4.44Å; L565-Y573 HydrophobicContact CG-CD2 3.81Å; L565-Y573 HydrophobicContact CG-CE2 3.61Å; L565-Y573 VanDerWaalsContact O-CD2 3.26Å; L565-Y573 WeakPolarHBondContact O-CD2 3.39Å; Y571-Y573 HydrophobicContact CD1-CD2 4.06Å; Y571-Y573 HydrophobicContact CD1-CE2 4.1Å; Y571-Y573 HydrophobicContact CE1-CD1 4.38Å; Y571-Y573 AromaticContact CE1-CD2 3.95Å; Y571-Y573 HydrophobicContact CE1-CD2 3.95Å; Y571-Y573 HydrophobicContact CE1-CE2 4.12Å; Y571-Y573 HydrophobicContact CE1-CG 4.12Å
574	P	93.8	Very high	89.6	Confident	32 Å²	32	62.9 Å²	62.9	21%	0.208	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-68.4	153.9	173.6	30.2	-35.3	0	0	0	110.4	L245 W576 G577 E578	L245-P574 HydrophobicContact CD2-CG 4.38Å; P574-W576 HydrophobicContact CB-CG 4.4Å; P574-W576 HydrophobicContact CG-CD2 4.06Å; P574-W576 VanDerWaalsContact CG-CE2 3.43Å; P574-W576 HydrophobicContact CG-CG 4.4Å; P574-W576 HydrophobicContact CG-CZ2 3.72Å; P574-W576 PolarHBondContact O-N 3.03Å; P574-G577 WeakPolarHBondContact O-CA 3.46Å; P574-G577 PolarHBondContact O-N 2.5Å; P574-E578 PolarHBondContact O-N 3.13Å
575	W	93.7	Very high	90.1	Very high	199 Å²	199	59.9 Å²	59.9	75%	0.754	31%	0.311	S	S	*	.	H	α-helix	trans	-52.4	-36.7	-177.5	69.3	-91.9	0	0	0	113.4	G577 E578 V579	W575-G577 VanDerWaalsContact C-N 3.32Å; W575-G577 PolarHBondContact O-N 3.45Å; W575-E578 PolarHBondContact O-N 3.41Å; W575-V579 HydrophobicContact CE3-CG2 4.05Å; W575-V579 HydrophobicContact CZ3-CG2 4.27Å; W575-V579 WeakPolarHBondContact O-CG2 3.3Å; W575-V579 PolarHBondContact O-N 3.49Å
576	W	94.8	Very high	90.5	Very high	89 Å²	89	62.3 Å²	62.3	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-71.6	-28.2	178.9	62.8	-100.5	0	0	0	112.3	L245 D246 P574 V579 I580	L245-W576 HydrophobicContact CB-CH2 4.18Å; L245-W576 HydrophobicContact CB-CZ2 4.47Å; L245-W576 HydrophobicContact CD2-CE3 4.3Å; L245-W576 HydrophobicContact CD2-CH2 3.41Å; L245-W576 VanDerWaalsContact CD2-CH2 3.41Å; L245-W576 HydrophobicContact CD2-CZ2 4.09Å; L245-W576 HydrophobicContact CD2-CZ3 3.51Å; L245-W576 HydrophobicContact CG-CH2 3.49Å; L245-W576 VanDerWaalsContact CG-CH2 3.49Å; L245-W576 HydrophobicContact CG-CZ2 4.22Å; L245-W576 HydrophobicContact CG-CZ3 4.01Å; D246-W576 HydrophobicContact CB-CZ2 4.23Å; P574-W576 HydrophobicContact CB-CG 4.4Å; P574-W576 HydrophobicContact CG-CD2 4.06Å; P574-W576 VanDerWaalsContact CG-CE2 3.43Å; P574-W576 HydrophobicContact CG-CG 4.4Å; P574-W576 HydrophobicContact CG-CZ2 3.72Å; P574-W576 PolarHBondContact O-N 3.03Å; W576-V579 PolarHBondContact O-N 3.29Å; W576-I580 HydrophobicContact CE3-CD1 3.57Å; W576-I580 HydrophobicContact CZ3-CD1 3.64Å; W576-I580 WeakPolarHBondContact O-CG1 3.36Å; W576-I580 PolarHBondContact O-N 3.16Å
577	G	94.6	Very high	90.9	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-68	-40	173.2	0	0	0	0	0	111.3	L492 P574 W575 I580 G581	L492-G577 WeakPolarHBondContact CD2-O 3.45Å; P574-G577 WeakPolarHBondContact O-CA 3.46Å; P574-G577 PolarHBondContact O-N 2.5Å; W575-G577 VanDerWaalsContact C-N 3.32Å; W575-G577 PolarHBondContact O-N 3.45Å; G577-I580 PolarHBondContact O-N 3.2Å; G577-G581 PolarHBondContact O-N 3.38Å
578	E	92.1	Very high	91.5	Very high	46 Å²	46	61.1 Å²	61.1	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-41.7	171.2	-66.6	-179.4	-156.4	0	0	111.9	P564 P574 W575 I580 G581 W582	P564-E578 WeakPolarHBondContact CB-OE1 3.19Å; P574-E578 PolarHBondContact O-N 3.13Å; W575-E578 PolarHBondContact O-N 3.41Å; E578-I580 VanDerWaalsContact C-N 3.31Å; E578-I580 PolarHBondContact O-N 3.48Å; E578-G581 WeakPolarHBondContact O-CA 3.22Å; E578-G581 PolarHBondContact O-N 3.13Å; E578-G581 VanDerWaalsContact O-N 3.12Å; E578-W582 PolarHBondContact O-N 3.09Å
579	V	95.1	Very high	92.5	Very high	75 Å²	75	57.8 Å²	57.8	46%	0.455	30%	0.302	S	S	.	.	H	α-helix	trans	-59	-43.4	174.4	172.7	0	0	0	0	111	W575 W576 G581 W582 C583	W575-V579 HydrophobicContact CE3-CG2 4.05Å; W575-V579 HydrophobicContact CZ3-CG2 4.27Å; W575-V579 WeakPolarHBondContact O-CG2 3.3Å; W575-V579 PolarHBondContact O-N 3.49Å; W576-V579 PolarHBondContact O-N 3.29Å; V579-G581 VanDerWaalsContact C-N 3.34Å; V579-G581 PolarHBondContact O-N 3.49Å; V579-W582 PolarHBondContact O-N 3.05Å; V579-C583 WeakPolarHBondContact O-CB 3.32Å; V579-C583 PolarHBondContact O-N 2.97Å; V579-C583 PolarHBondContact O-SG 3.18Å
580	I	95.3	Very high	93.7	Very high	78 Å²	78	55.8 Å²	55.8	40%	0.4	29%	0.286	S	S	.	.	H	α-helix	trans	-60.1	-45.8	174	-69.2	170.1	0	0	0	110.6	W576 G577 E578 W582 C583 L584	W576-I580 HydrophobicContact CE3-CD1 3.57Å; W576-I580 HydrophobicContact CZ3-CD1 3.64Å; W576-I580 WeakPolarHBondContact O-CG1 3.36Å; W576-I580 PolarHBondContact O-N 3.16Å; G577-I580 PolarHBondContact O-N 3.2Å; E578-I580 VanDerWaalsContact C-N 3.31Å; E578-I580 PolarHBondContact O-N 3.48Å; I580-W582 PolarHBondContact O-N 3.05Å; I580-C583 WeakPolarHBondContact O-CB 3.09Å; I580-C583 PolarHBondContact O-N 3.17Å; I580-L584 HydrophobicContact CG2-CD1 4.4Å; I580-L584 WeakPolarHBondContact O-CG 3.37Å; I580-L584 PolarHBondContact O-N 2.78Å
581	G	94.1	Very high	94.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-55	-51.1	175.5	0	0	0	0	0	112.6	Y496 G577 E578 V579 C583 L584 A585	Y496-G581 WeakPolarHBondContact CB-O 3.32Å; Y496-G581 VanDerWaalsContact CD2-CA 3.41Å; Y496-G581 VanDerWaalsContact CG-C 3.49Å; Y496-G581 VanDerWaalsContact CG-CA 3.43Å; G577-G581 PolarHBondContact O-N 3.38Å; E578-G581 WeakPolarHBondContact O-CA 3.22Å; E578-G581 PolarHBondContact O-N 3.13Å; E578-G581 VanDerWaalsContact O-N 3.12Å; V579-G581 VanDerWaalsContact C-N 3.34Å; V579-G581 PolarHBondContact O-N 3.49Å; G581-C583 VanDerWaalsContact C-N 3.33Å; G581-C583 PolarHBondContact O-N 3.24Å; G581-L584 WeakPolarHBondContact O-CB 3.16Å; G581-L584 PolarHBondContact O-N 2.89Å; G581-L584 VanDerWaalsContact O-N 3.12Å; G581-A585 PolarHBondContact O-N 3.01Å
582	W	94.4	Very high	94.9	Very high	69 Å²	69	49.3 Å²	49.3	26%	0.261	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-36.6	176.5	-80.8	106.4	0	0	0	113	M501 L559 Y562 E578 V579 I580 L584 A585 L586	M501-W582 HydrophobicContact CE-CE3 4.3Å; M501-W582 HydrophobicContact CE-CH2 3.95Å; M501-W582 HydrophobicContact CE-CZ3 3.56Å; M501-W582 HydrophobicContact SD-CH2 3.96Å; M501-W582 HydrophobicContact SD-CZ3 3.99Å; L559-W582 HydrophobicContact CD2-CH2 3.84Å; L559-W582 HydrophobicContact CD2-CZ3 4.48Å; Y562-W582 HydrophobicContact CD2-CZ2 4Å; Y562-W582 HydrophobicContact CE1-CZ2 4.5Å; Y562-W582 AromaticContact CE2-CZ2 3.8Å; Y562-W582 HydrophobicContact CE2-CZ2 3.8Å; Y562-W582 HydrophobicContact CG-CZ2 4.43Å; Y562-W582 AromaticContact CZ-NE1 3.68Å; Y562-W582 PolarHBondContact OH-NE1 3.45Å; E578-W582 PolarHBondContact O-N 3.09Å; V579-W582 PolarHBondContact O-N 3.05Å; I580-W582 PolarHBondContact O-N 3.05Å; W582-L584 VanDerWaalsContact C-N 3.34Å; W582-L584 PolarHBondContact O-N 3.22Å; W582-A585 PolarHBondContact O-N 2.79Å; W582-L586 VanDerWaalsContact O-CB 3.26Å; W582-L586 WeakPolarHBondContact O-CB 3.49Å; W582-L586 VanDerWaalsContact O-CG 3.22Å; W582-L586 WeakPolarHBondContact O-CG 3.45Å; W582-L586 PolarHBondContact O-N 2.84Å
583	C	96.3	Very high	95.2	Very high	78 Å²	78	47.2 Å²	47.2	53%	0.527	24%	0.24	S	C	.	.	H	α-helix	trans	-61.1	-41.6	172.2	-75	0	0	0	0	111.8	V579 I580 G581 S587	V579-C583 WeakPolarHBondContact O-CB 3.32Å; V579-C583 PolarHBondContact O-N 2.97Å; V579-C583 PolarHBondContact O-SG 3.18Å; I580-C583 WeakPolarHBondContact O-CB 3.09Å; I580-C583 PolarHBondContact O-N 3.17Å; G581-C583 VanDerWaalsContact C-N 3.33Å; G581-C583 PolarHBondContact O-N 3.24Å; C583-S587 VanDerWaalsContact O-CB 3.31Å; C583-S587 WeakPolarHBondContact O-CB 3.48Å; C583-S587 PolarHBondContact O-N 3.15Å
584	L	95.6	Very high	95.4	Very high	21 Å²	21	51 Å²	51	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-48.6	174.5	-68.5	170.8	0	0	0	110.9	F156 F493 I580 G581 W582 S587	F156-L584 HydrophobicContact CE1-CD2 4.02Å; F156-L584 HydrophobicContact CE2-CD2 4.22Å; F156-L584 HydrophobicContact CZ-CD2 3.83Å; F493-L584 HydrophobicContact CD2-CD1 4.12Å; F493-L584 HydrophobicContact CE1-CD2 4.45Å; F493-L584 HydrophobicContact CE2-CD1 4.24Å; F493-L584 HydrophobicContact CG-CD1 4.4Å; F493-L584 HydrophobicContact CZ-CD2 4.3Å; I580-L584 HydrophobicContact CG2-CD1 4.4Å; I580-L584 WeakPolarHBondContact O-CG 3.37Å; I580-L584 PolarHBondContact O-N 2.78Å; G581-L584 WeakPolarHBondContact O-CB 3.16Å; G581-L584 PolarHBondContact O-N 2.89Å; G581-L584 VanDerWaalsContact O-N 3.12Å; W582-L584 VanDerWaalsContact C-N 3.34Å; W582-L584 PolarHBondContact O-N 3.22Å; L584-S587 PolarHBondContact O-N 3.01Å; L584-S587 PolarHBondContact O-OG 2.9Å
585	A	95	Very high	95.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-48.8	178.2	0	0	0	0	0	112.3	M501 T502 G581 W582 S587 S588 M589	M501-A585 HydrophobicContact CE-CB 3.85Å; T502-A585 HydrophobicContact CG2-CB 3.95Å; G581-A585 PolarHBondContact O-N 3.01Å; W582-A585 PolarHBondContact O-N 2.79Å; A585-S587 VanDerWaalsContact C-N 3.29Å; A585-S587 PolarHBondContact O-N 3.08Å; A585-S588 PolarHBondContact O-N 2.97Å; A585-S588 PolarHBondContact O-OG 3.22Å; A585-S588 VanDerWaalsContact O-OG 3.06Å; A585-M589 WeakPolarHBondContact O-CG 3.25Å; A585-M589 PolarHBondContact O-N 2.72Å
586	L	95.9	Very high	95.6	Very high	67 Å²	67	42.3 Å²	42.3	35%	0.351	23%	0.231	S	C	.	.	H	α-helix	trans	-67.2	-28.5	-177.7	-71.5	172.5	0	0	0	113	W582 S588 M589 L590	W582-L586 VanDerWaalsContact O-CB 3.26Å; W582-L586 WeakPolarHBondContact O-CB 3.49Å; W582-L586 VanDerWaalsContact O-CG 3.22Å; W582-L586 WeakPolarHBondContact O-CG 3.45Å; W582-L586 PolarHBondContact O-N 2.84Å; L586-S588 PolarHBondContact O-N 3.38Å; L586-M589 PolarHBondContact O-N 2.85Å; L586-L590 HydrophobicContact CB-CD1 4.06Å; L586-L590 HydrophobicContact CB-CG 4.31Å; L586-L590 HydrophobicContact CD2-CG 4.39Å; L586-L590 VanDerWaalsContact O-CB 3.23Å; L586-L590 WeakPolarHBondContact O-CB 3.42Å; L586-L590 VanDerWaalsContact O-CG 3.28Å; L586-L590 WeakPolarHBondContact O-CG 3.49Å; L586-L590 PolarHBondContact O-N 2.59Å
587	S	96.6	Very high	95.6	Very high	47 Å²	47	42.3 Å²	42.3	33%	0.329	24%	0.237	S	C	.	.	H	α-helix	trans	-58.9	-34.8	-179.7	71.1	0	0	0	0	113	F156 C583 L584 A585 C591	F156-S587 VanDerWaalsContact CE2-OG 3.23Å; F156-S587 WeakPolarHBondContact CE2-OG 3.23Å; C583-S587 VanDerWaalsContact O-CB 3.31Å; C583-S587 WeakPolarHBondContact O-CB 3.48Å; C583-S587 PolarHBondContact O-N 3.15Å; L584-S587 PolarHBondContact O-N 3.01Å; L584-S587 PolarHBondContact O-OG 2.9Å; A585-S587 VanDerWaalsContact C-N 3.29Å; A585-S587 PolarHBondContact O-N 3.08Å; S587-C591 PolarHBondContact O-SG 2.61Å
588	S	96.4	Very high	95.6	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.014	26%	0.262	C	S	.	.	H	α-helix	trans	-85.6	-46	173.6	60.6	0	0	0	0	111.9	A149 A585 L586 L590 C591	A149-S588 WeakPolarHBondContact CB-O 3.24Å; A585-S588 PolarHBondContact O-N 2.97Å; A585-S588 PolarHBondContact O-OG 3.22Å; A585-S588 VanDerWaalsContact O-OG 3.06Å; L586-S588 PolarHBondContact O-N 3.38Å; S588-L590 VanDerWaalsContact C-N 3.29Å; S588-L590 PolarHBondContact O-N 2.7Å; S588-C591 VanDerWaalsContact O-CB 3.28Å; S588-C591 WeakPolarHBondContact O-CB 3.49Å; S588-C591 PolarHBondContact O-N 2.82Å; S588-C591 VanDerWaalsContact O-N 3.1Å
589	M	96.1	Very high	95.7	Very high	19 Å²	19	48.9 Å²	48.9	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-37.6	-175.7	-66.6	173.2	65.9	0	0	112.8	M501 T502 W505 F555 A585 L586 C591 P593	M501-M589 HydrophobicContact CE-SD 4.37Å; T502-M589 HydrophobicContact CG2-CG 4.17Å; T502-M589 HydrophobicContact CG2-SD 4.22Å; W505-M589 HydrophobicContact CB-CE 4.17Å; W505-M589 HydrophobicContact CB-CG 4.36Å; W505-M589 HydrophobicContact CD2-CE 3.89Å; W505-M589 HydrophobicContact CE3-CE 4.28Å; W505-M589 HydrophobicContact CG-CB 4.41Å; W505-M589 HydrophobicContact CG-CE 3.83Å; W505-M589 HydrophobicContact CG-CG 4.02Å; W505-M589 PolarHBondContact NE1-O 2.98Å; F555-M589 HydrophobicContact CE2-CE 3.69Å; F555-M589 HydrophobicContact CZ-CE 3.68Å; A585-M589 WeakPolarHBondContact O-CG 3.25Å; A585-M589 PolarHBondContact O-N 2.72Å; L586-M589 PolarHBondContact O-N 2.85Å; M589-C591 VanDerWaalsContact C-N 3.33Å; M589-P593 VanDerWaalsContact O-CD 3.27Å; M589-P593 WeakPolarHBondContact O-CD 3.4Å
590	L	96.8	Very high	95.6	Very high	86 Å²	86	46.9 Å²	46.9	45%	0.45	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-16.4	-179.8	-66.6	177.4	0	0	0	113.3	L586 S588 I592 P593 V594	L586-L590 HydrophobicContact CB-CD1 4.06Å; L586-L590 HydrophobicContact CB-CG 4.31Å; L586-L590 HydrophobicContact CD2-CG 4.39Å; L586-L590 VanDerWaalsContact O-CB 3.23Å; L586-L590 WeakPolarHBondContact O-CB 3.42Å; L586-L590 VanDerWaalsContact O-CG 3.28Å; L586-L590 WeakPolarHBondContact O-CG 3.49Å; L586-L590 PolarHBondContact O-N 2.59Å; S588-L590 VanDerWaalsContact C-N 3.29Å; S588-L590 PolarHBondContact O-N 2.7Å; L590-I592 PolarHBondContact O-N 2.78Å; L590-I592 VanDerWaalsContact O-N 3.17Å; L590-P593 HydrophobicContact CD2-CG 4.22Å; L590-P593 VanDerWaalsContact O-CD 3.3Å; L590-P593 WeakPolarHBondContact O-CD 3.28Å; L590-P593 WeakPolarHBondContact O-CG 3.43Å; L590-V594 HydrophobicContact CB-CG2 4.28Å; L590-V594 WeakPolarHBondContact O-CB 3.38Å; L590-V594 WeakPolarHBondContact O-CG2 3.31Å; L590-V594 PolarHBondContact O-N 2.86Å
591	C	97.3	Very high	95.6	Very high	30 Å²	30	50 Å²	50	20%	0.203	26%	0.258	C	S	.	.	H	α-helix	trans	-55.4	-34.9	174.9	-70.2	0	0	0	0	112.1	G145 A149 S587 S588 M589 S595	G145-C591 WeakPolarHBondContact CA-O 3.19Å; A149-C591 HydrophobicContact CB-CB 3.98Å; S587-C591 PolarHBondContact O-SG 2.61Å; S588-C591 VanDerWaalsContact O-CB 3.28Å; S588-C591 WeakPolarHBondContact O-CB 3.49Å; S588-C591 PolarHBondContact O-N 2.82Å; S588-C591 VanDerWaalsContact O-N 3.1Å; M589-C591 VanDerWaalsContact C-N 3.33Å; C591-S595 WeakPolarHBondContact O-CB 3.23Å; C591-S595 PolarHBondContact O-N 2.78Å; C591-S595 VanDerWaalsContact O-N 3.07Å
592	I	96.4	Very high	95.6	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-67	-64.7	-179.6	-57.1	168.6	0	0	0	111.2	L146 A149 W509 L590 V594 S595 L596	L146-I592 HydrophobicContact CD2-CD1 3.62Å; L146-I592 HydrophobicContact CD2-CG1 4.02Å; L146-I592 HydrophobicContact CG-CD1 4.38Å; L146-I592 HydrophobicContact CG-CG1 4.29Å; A149-I592 HydrophobicContact CB-CD1 4.49Å; A149-I592 HydrophobicContact CB-CG1 4.15Å; W509-I592 HydrophobicContact CB-CD1 4.01Å; W509-I592 HydrophobicContact CD2-CG2 4.09Å; W509-I592 HydrophobicContact CG-CD1 4Å; W509-I592 HydrophobicContact CG-CG2 4.08Å; L590-I592 PolarHBondContact O-N 2.78Å; L590-I592 VanDerWaalsContact O-N 3.17Å; I592-V594 PolarHBondContact O-N 2.98Å; I592-S595 PolarHBondContact O-N 2.85Å; I592-L596 WeakPolarHBondContact O-CB 3.19Å; I592-L596 PolarHBondContact O-N 2.97Å
593	P	96.9	Very high	95.5	Very high	46 Å²	46	56.4 Å²	56.4	30%	0.299	29%	0.286	S	S	.	.	H	α-helix	trans	-64.9	-37.4	-178.8	25.8	-35.4	0	0	0	112.8	M589 L590 L596 L597	M589-P593 VanDerWaalsContact O-CD 3.27Å; M589-P593 WeakPolarHBondContact O-CD 3.4Å; L590-P593 HydrophobicContact CD2-CG 4.22Å; L590-P593 VanDerWaalsContact O-CD 3.3Å; L590-P593 WeakPolarHBondContact O-CD 3.28Å; L590-P593 WeakPolarHBondContact O-CG 3.43Å; P593-L596 PolarHBondContact O-N 2.91Å; P593-L597 WeakPolarHBondContact O-CG 3.35Å; P593-L597 PolarHBondContact O-N 3.09Å
594	V	96.6	Very high	95.3	Very high	86 Å²	86	62 Å²	62	52%	0.521	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-45.1	179.6	173.8	0	0	0	0	111	L590 I592 L596 L597 Y598	L590-V594 HydrophobicContact CB-CG2 4.28Å; L590-V594 WeakPolarHBondContact O-CB 3.38Å; L590-V594 WeakPolarHBondContact O-CG2 3.31Å; L590-V594 PolarHBondContact O-N 2.86Å; I592-V594 PolarHBondContact O-N 2.98Å; V594-L596 VanDerWaalsContact C-N 3.32Å; V594-L596 PolarHBondContact O-N 3.31Å; V594-L597 PolarHBondContact O-N 3.32Å; V594-Y598 WeakPolarHBondContact O-CB 3.42Å; V594-Y598 PolarHBondContact O-N 3.08Å
595	S	95.5	Very high	95.1	Very high	14 Å²	14	62.9 Å²	62.9	10%	0.098	32%	0.316	C	S	.	.	H	α-helix	trans	-63	-40.7	175.7	175.2	0	0	0	0	111.7	G145 C591 I592 K599	G145-S595 VanDerWaalsContact CA-CB 3.44Å; G145-S595 PolarHBondContact N-OG 3.1Å; C591-S595 WeakPolarHBondContact O-CB 3.23Å; C591-S595 PolarHBondContact O-N 2.78Å; C591-S595 VanDerWaalsContact O-N 3.07Å; I592-S595 PolarHBondContact O-N 2.85Å; S595-K599 WeakPolarHBondContact O-CB 3.46Å; S595-K599 WeakPolarHBondContact O-CG 3.43Å; S595-K599 PolarHBondContact O-N 3.36Å
596	L	94.9	Very high	95.1	Very high	34 Å²	34	66.6 Å²	66.6	18%	0.178	34%	0.339	C	S	.	.	H	α-helix	trans	-58.7	-54	177.9	-176.3	159.5	0	0	0	110.2	L142 F143 I592 P593 V594 K599 F600	L142-L596 HydrophobicContact CD1-CG 4.05Å; L142-L596 HydrophobicContact CD2-CG 4.43Å; L142-L596 HydrophobicContact CG-CG 4.05Å; F143-L596 HydrophobicContact CD1-CD1 4.23Å; F143-L596 HydrophobicContact CE1-CD1 3.58Å; F143-L596 HydrophobicContact CZ-CD1 3.98Å; I592-L596 WeakPolarHBondContact O-CB 3.19Å; I592-L596 PolarHBondContact O-N 2.97Å; P593-L596 PolarHBondContact O-N 2.91Å; V594-L596 VanDerWaalsContact C-N 3.32Å; V594-L596 PolarHBondContact O-N 3.31Å; L596-K599 PolarHBondContact O-N 2.85Å; L596-F600 WeakPolarHBondContact O-CB 3.29Å; L596-F600 PolarHBondContact O-N 2.94Å
597	L	95.6	Very high	94.9	Very high	89 Å²	89	69.6 Å²	69.6	47%	0.466	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-47.4	179.9	-67.8	176.2	0	0	0	111.5	P593 V594 K599 F600 F601	P593-L597 WeakPolarHBondContact O-CG 3.35Å; P593-L597 PolarHBondContact O-N 3.09Å; V594-L597 PolarHBondContact O-N 3.32Å; L597-K599 PolarHBondContact O-N 2.9Å; L597-F600 PolarHBondContact O-N 3.48Å; L597-F601 HydrophobicContact CB-CD2 4.22Å; L597-F601 HydrophobicContact CB-CE2 4.08Å; L597-F601 HydrophobicContact CD2-CE2 3.98Å; L597-F601 WeakPolarHBondContact O-CD2 3.37Å; L597-F601 PolarHBondContact O-N 2.95Å
598	Y	95.6	Very high	94.7	Very high	136 Å²	136	75.7 Å²	75.7	53%	0.533	37%	0.374	S	S	.	.	H	α-helix	trans	-57.3	-47.9	179.8	173	-108.7	0	0	0	112.2	V594 R602	V594-Y598 WeakPolarHBondContact O-CB 3.42Å; V594-Y598 PolarHBondContact O-N 3.08Å; Y598-R602 WeakPolarHBondContact O-CB 3.41Å; Y598-R602 PolarHBondContact O-N 3.01Å; Y598-R602 VanDerWaalsContact O-N 3.15Å; Y598-R602 PolarHBondContact OH-NH1 3Å
599	K	94.2	Very high	94.5	Very high	49 Å²	49	81 Å²	81	21%	0.213	40%	0.399	C	S	.	.	H	α-helix	trans	-68.2	-40.9	178.7	-72.2	-173.2	175.7	-152.1	0	112.2	P141 L142 S595 L596 L597 R602 A603 L614	P141-K599 WeakPolarHBondContact O-CD 3.11Å; P141-K599 WeakPolarHBondContact O-CE 3.4Å; P141-K599 PolarHBondContact O-NZ 3.28Å; L142-K599 HydrophobicContact CD1-CB 4.47Å; S595-K599 WeakPolarHBondContact O-CB 3.46Å; S595-K599 WeakPolarHBondContact O-CG 3.43Å; S595-K599 PolarHBondContact O-N 3.36Å; L596-K599 PolarHBondContact O-N 2.85Å; L597-K599 PolarHBondContact O-N 2.9Å; K599-R602 PolarHBondContact O-N 3.04Å; K599-A603 PolarHBondContact O-N 3.31Å; K599-L614 HydrophobicContact CB-CD1 4.39Å
600	F	93.1	Very high	94.4	Very high	33 Å²	33	82.9 Å²	82.9	15%	0.145	41%	0.405	C	S	.	.	H	α-helix	trans	-64.4	-41.6	-179.7	-166.9	-94	0	0	0	112.3	L142 L596 L597 I607 R610 W611	L142-F600 HydrophobicContact CD1-CB 4.28Å; L142-F600 HydrophobicContact CD1-CD2 4.43Å; L596-F600 WeakPolarHBondContact O-CB 3.29Å; L596-F600 PolarHBondContact O-N 2.94Å; L597-F600 PolarHBondContact O-N 3.48Å; F600-I607 HydrophobicContact CZ-CB 4.38Å; F600-I607 HydrophobicContact CZ-CG1 4.47Å; F600-I607 HydrophobicContact CZ-CG2 3.96Å; F600-R610 HydrophobicContact CD2-CB 4.4Å; F600-R610 HydrophobicContact CE2-CB 3.99Å; F600-R610 HydrophobicContact CZ-CB 4.36Å; F600-R610 WeakPolarHBondContact O-CD 3.39Å; F600-R610 PolarHBondContact O-NH1 3.46Å; F600-R610 VanDerWaalsContact O-NH1 3.08Å; F600-W611 HydrophobicContact CE2-CB 4.47Å; F600-W611 HydrophobicContact CE2-CE3 4.28Å
601	F	94.2	Very high	94.2	Very high	144 Å²	144	84.9 Å²	84.9	63%	0.632	41%	0.406	S	S	*	.	H	α-helix	trans	-73.7	-30.1	178	-71.1	-57	0	0	0	113.3	L597 R610	L597-F601 HydrophobicContact CB-CD2 4.22Å; L597-F601 HydrophobicContact CB-CE2 4.08Å; L597-F601 HydrophobicContact CD2-CE2 3.98Å; L597-F601 WeakPolarHBondContact O-CD2 3.37Å; L597-F601 PolarHBondContact O-N 2.95Å; F601-R610 PolarHBondContact O-NH1 3.43Å
602	R	94.3	Very high	94	Very high	184 Å²	184	86.2 Å²	86.2	69%	0.694	42%	0.42	S	S	*	.	H	α-helix	trans	-80	-26.5	179.2	-163.8	178.9	-177.7	-168.2	-0.9	113.6	Y598 K599	Y598-R602 WeakPolarHBondContact O-CB 3.41Å; Y598-R602 PolarHBondContact O-N 3.01Å; Y598-R602 VanDerWaalsContact O-N 3.15Å; Y598-R602 PolarHBondContact OH-NH1 3Å; K599-R602 PolarHBondContact O-N 3.04Å
603	A	92.2	Very high	93.8	Very high	18 Å²	18	92 Å²	92	15%	0.149	45%	0.446	C	S	.	.	S	Bend	trans	-65.1	139.7	177.3	0	0	0	0	0	111.4	K599 R610 L614	K599-A603 PolarHBondContact O-N 3.31Å; A603-R610 HydrophobicContact CB-CB 4.27Å; A603-R610 HydrophobicContact CB-CG 3.86Å; A603-R610 PolarHBondContact O-NE 3.45Å; A603-R610 VanDerWaalsContact O-NE 3.07Å; A603-R610 PolarHBondContact O-NH1 3.22Å; A603-R610 PolarHBondContact O-NH2 3.23Å; A603-L614 HydrophobicContact CB-CD1 3.81Å; A603-L614 HydrophobicContact CB-CD2 4.46Å; A603-L614 HydrophobicContact CB-CG 4.28Å
604	K	91.3	Very high	93.6	Very high	196 Å²	196	90.8 Å²	90.8	85%	0.852	44%	0.437	S	S	*	.			trans	-85.1	157.1	176.5	-64	-178	179.6	179.4	0	110.3
605	G	93	Very high	93.5	Very high	39 Å²	39	87.8 Å²	87.8	40%	0.402	42%	0.419	S	S	.	.	S	Bend	trans	104.6	-173.6	179.1	0	0	0	0	0	113.6	E609 R610	G605-E609 WeakPolarHBondContact CA-OE2 3.29Å; G605-R610 PolarHBondContact O-NE 3.19Å; G605-R610 PolarHBondContact O-NH2 2.86Å; G605-R610 VanDerWaalsContact O-NH2 3.09Å
606	T	94.3	Very high	93.3	Very high	79 Å²	79	89.3 Å²	89.3	49%	0.485	43%	0.43	S	S	.	.			trans	-74.3	163.1	176.3	63.3	0	0	0	0	111.8	K608 E609 R610	T606-K608 PolarHBondContact O-N 3.43Å; T606-E609 PolarHBondContact N-OE2 3.09Å; T606-E609 PolarHBondContact O-N 3.38Å; T606-E609 VanDerWaalsContact OG1-CD 3.23Å; T606-E609 VanDerWaalsContact OG1-CG 3.27Å; T606-E609 WeakPolarHBondContact OG1-CG 3.5Å; T606-E609 PolarHBondContact OG1-N 3.49Å; T606-E609 PolarHBondContact OG1-OE2 3.34Å; T606-R610 VanDerWaalsContact O-CG 3.25Å; T606-R610 WeakPolarHBondContact O-CG 3.37Å; T606-R610 PolarHBondContact O-N 3.21Å
607	I	92.4	Very high	93.2	Very high	129 Å²	129	88.8 Å²	88.8	66%	0.662	43%	0.429	S	S	*	.	H	α-helix	trans	-51.7	-43	177.6	-69	175.3	0	0	0	111.4	F600 W611	F600-I607 HydrophobicContact CZ-CB 4.38Å; F600-I607 HydrophobicContact CZ-CG1 4.47Å; F600-I607 HydrophobicContact CZ-CG2 3.96Å; I607-W611 WeakPolarHBondContact O-CB 3.28Å; I607-W611 PolarHBondContact O-N 3.25Å
608	K	92.1	Very high	92.9	Very high	175 Å²	175	88.4 Å²	88.4	76%	0.761	43%	0.429	S	S	*	.	H	α-helix	trans	-69	-43	-178.8	-169.9	178.1	-179.6	-178.6	0	112.4	T606 W611 A612	T606-K608 PolarHBondContact O-N 3.43Å; K608-W611 PolarHBondContact O-N 2.59Å; K608-A612 WeakPolarHBondContact O-CB 3.29Å; K608-A612 PolarHBondContact O-N 3.09Å
609	E	92.3	Very high	92.5	Very high	113 Å²	113	85.2 Å²	85.2	53%	0.528	42%	0.417	S	S	.	.	H	α-helix	trans	-65.7	-43.4	177.1	-71.2	163.9	161.5	0	0	111.5	G605 T606 W611 A612 H613	G605-E609 WeakPolarHBondContact CA-OE2 3.29Å; T606-E609 PolarHBondContact N-OE2 3.09Å; T606-E609 PolarHBondContact O-N 3.38Å; T606-E609 VanDerWaalsContact OG1-CD 3.23Å; T606-E609 VanDerWaalsContact OG1-CG 3.27Å; T606-E609 WeakPolarHBondContact OG1-CG 3.5Å; T606-E609 PolarHBondContact OG1-N 3.49Å; T606-E609 PolarHBondContact OG1-OE2 3.34Å; E609-W611 VanDerWaalsContact C-N 3.34Å; E609-W611 PolarHBondContact O-N 3.19Å; E609-A612 PolarHBondContact O-N 3.12Å; E609-H613 WeakPolarHBondContact O-CB 3.5Å; E609-H613 PolarHBondContact O-N 2.99Å
610	R	93.4	Very high	91.6	Very high	59 Å²	59	84 Å²	84	22%	0.223	42%	0.418	C	S	.	.	H	α-helix	trans	-59.3	-46.6	175.9	-67.9	175.8	-163.7	-151.4	1.5	111.2	F600 F601 A603 G605 T606 L614	F600-R610 HydrophobicContact CD2-CB 4.4Å; F600-R610 HydrophobicContact CE2-CB 3.99Å; F600-R610 HydrophobicContact CZ-CB 4.36Å; F600-R610 WeakPolarHBondContact O-CD 3.39Å; F600-R610 PolarHBondContact O-NH1 3.46Å; F600-R610 VanDerWaalsContact O-NH1 3.08Å; F601-R610 PolarHBondContact O-NH1 3.43Å; A603-R610 HydrophobicContact CB-CB 4.27Å; A603-R610 HydrophobicContact CB-CG 3.86Å; A603-R610 PolarHBondContact O-NE 3.45Å; A603-R610 VanDerWaalsContact O-NE 3.07Å; A603-R610 PolarHBondContact O-NH1 3.22Å; A603-R610 PolarHBondContact O-NH2 3.23Å; G605-R610 PolarHBondContact O-NE 3.19Å; G605-R610 PolarHBondContact O-NH2 2.86Å; G605-R610 VanDerWaalsContact O-NH2 3.09Å; T606-R610 VanDerWaalsContact O-CG 3.25Å; T606-R610 WeakPolarHBondContact O-CG 3.37Å; T606-R610 PolarHBondContact O-N 3.21Å; R610-L614 VanDerWaalsContact O-CB 3.28Å; R610-L614 WeakPolarHBondContact O-CB 3.38Å; R610-L614 VanDerWaalsContact O-CG 3.26Å; R610-L614 WeakPolarHBondContact O-CG 3.17Å; R610-L614 PolarHBondContact O-N 3.4Å
611	W	93.2	Very high	90.7	Very high	129 Å²	129	86.6 Å²	86.6	49%	0.489	44%	0.438	S	S	.	.	H	α-helix	trans	-60.8	-52.1	177.7	-174.4	-88.5	0	0	0	111.2	L142 F600 I607 K608 E609 H613 L614 T615	L142-W611 HydrophobicContact CD2-CE3 3.96Å; L142-W611 HydrophobicContact CD2-CH2 4.28Å; L142-W611 HydrophobicContact CD2-CZ3 3.79Å; F600-W611 HydrophobicContact CE2-CB 4.47Å; F600-W611 HydrophobicContact CE2-CE3 4.28Å; I607-W611 WeakPolarHBondContact O-CB 3.28Å; I607-W611 PolarHBondContact O-N 3.25Å; K608-W611 PolarHBondContact O-N 2.59Å; E609-W611 VanDerWaalsContact C-N 3.34Å; E609-W611 PolarHBondContact O-N 3.19Å; W611-H613 VanDerWaalsContact C-N 3.35Å; W611-H613 PolarHBondContact O-N 3.3Å; W611-L614 PolarHBondContact O-N 3.02Å; W611-T615 HydrophobicContact CD2-CG2 4.29Å; W611-T615 HydrophobicContact CG-CG2 4.49Å; W611-T615 HydrophobicContact CZ2-CG2 4.33Å; W611-T615 WeakPolarHBondContact O-CB 3.21Å; W611-T615 WeakPolarHBondContact O-CG2 3.36Å; W611-T615 PolarHBondContact O-N 3.38Å; W611-T615 PolarHBondContact O-OG1 3.46Å
612	A	92.4	Very high	89.8	Confident	58 Å²	58	81 Å²	81	48%	0.479	41%	0.414	S	S	.	.	H	α-helix	trans	-60.4	-42.9	-179.8	0	0	0	0	0	112.3	K608 E609 T615 S616	K608-A612 WeakPolarHBondContact O-CB 3.29Å; K608-A612 PolarHBondContact O-N 3.09Å; E609-A612 PolarHBondContact O-N 3.12Å; A612-T615 PolarHBondContact O-OG1 3.28Å; A612-S616 WeakPolarHBondContact O-CB 3.4Å; A612-S616 PolarHBondContact O-N 2.8Å; A612-S616 VanDerWaalsContact O-N 3.17Å
613	H	91.9	Very high	89.1	Confident	122 Å²	122	72.5 Å²	72.5	57%	0.565	38%	0.382	S	S	*	.	H	α-helix	trans	-67.9	-46.8	179.8	-176.7	58.6	0	0	0	112.2	E609 W611 T615 S616	E609-H613 WeakPolarHBondContact O-CB 3.5Å; E609-H613 PolarHBondContact O-N 2.99Å; W611-H613 VanDerWaalsContact C-N 3.35Å; W611-H613 PolarHBondContact O-N 3.3Å; H613-T615 VanDerWaalsContact C-N 3.32Å; H613-T615 PolarHBondContact O-N 3.11Å; H613-S616 PolarHBondContact O-N 3.49Å; H613-S616 PolarHBondContact O-OG 3.42Å
614	L	93.1	Very high	88.2	Confident	20 Å²	20	76.9 Å²	76.9	11%	0.105	40%	0.402	C	S	.	.	H	α-helix	trans	-77.4	-16.1	-176.8	-64.3	173.4	0	0	0	113.6	P141 L142 K599 A603 R610 W611	P141-L614 CarbonylContact C-O 3.57Å; P141-L614 WeakPolarHBondContact CD-O 3.18Å; L142-L614 HydrophobicContact CB-CB 3.85Å; L142-L614 WeakPolarHBondContact CB-O 3.14Å; L142-L614 HydrophobicContact CD1-CB 4.17Å; L142-L614 HydrophobicContact CD1-CD1 3.86Å; L142-L614 HydrophobicContact CG-CB 4.47Å; L142-L614 PolarHBondContact N-O 3.31Å; K599-L614 HydrophobicContact CB-CD1 4.39Å; A603-L614 HydrophobicContact CB-CD1 3.81Å; A603-L614 HydrophobicContact CB-CD2 4.46Å; A603-L614 HydrophobicContact CB-CG 4.28Å; R610-L614 VanDerWaalsContact O-CB 3.28Å; R610-L614 WeakPolarHBondContact O-CB 3.38Å; R610-L614 VanDerWaalsContact O-CG 3.26Å; R610-L614 WeakPolarHBondContact O-CG 3.17Å; R610-L614 PolarHBondContact O-N 3.4Å; W611-L614 PolarHBondContact O-N 3.02Å
615	T	93.8	Very high	87.2	Confident	23 Å²	23	74 Å²	74	14%	0.141	39%	0.392	C	S	.	.	H	α-helix	trans	-94.9	-8	172.5	56.1	0	0	0	0	112.9	L142 V517 W611 A612 H613	L142-T615 HydrophobicContact CB-CG2 4.5Å; L142-T615 HydrophobicContact CD2-CG2 4.03Å; V517-T615 HydrophobicContact CG1-CG2 3.64Å; W611-T615 HydrophobicContact CD2-CG2 4.29Å; W611-T615 HydrophobicContact CG-CG2 4.49Å; W611-T615 HydrophobicContact CZ2-CG2 4.33Å; W611-T615 WeakPolarHBondContact O-CB 3.21Å; W611-T615 WeakPolarHBondContact O-CG2 3.36Å; W611-T615 PolarHBondContact O-N 3.38Å; W611-T615 PolarHBondContact O-OG1 3.46Å; A612-T615 PolarHBondContact O-OG1 3.28Å; H613-T615 VanDerWaalsContact C-N 3.32Å; H613-T615 PolarHBondContact O-N 3.11Å
616	S	92.6	Very high	86.1	Confident	47 Å²	47	77.2 Å²	77.2	33%	0.329	39%	0.392	S	S	.	.	S	Bend	trans	-75.7	134.5	173.7	69.8	0	0	0	0	111.3	P141 A612 H613	P141-S616 WeakPolarHBondContact CD-O 3.31Å; P141-S616 WeakPolarHBondContact CG-O 3.2Å; A612-S616 WeakPolarHBondContact O-CB 3.4Å; A612-S616 PolarHBondContact O-N 2.8Å; A612-S616 VanDerWaalsContact O-N 3.17Å; H613-S616 PolarHBondContact O-N 3.49Å; H613-S616 PolarHBondContact O-OG 3.42Å
617	P	92.4	Very high	84.7	Confident	23 Å²	23	76.4 Å²	76.4	15%	0.149	38%	0.384	C	S	.	.			trans	-68.1	143.8	-179.8	27.6	-35.3	0	0	0	111.5	N138 I139 Y518 W619	N138-P617 CarbonylContact O-C 3.59Å; N138-P617 WeakPolarHBondContact O-CA 3.31Å; I139-P617 WeakPolarHBondContact O-CA 3.33Å; I139-P617 WeakPolarHBondContact O-CB 3.45Å; Y518-P617 HydrophobicContact CE2-CB 4.13Å; Y518-P617 HydrophobicContact CE2-CG 4.1Å; P617-W619 HydrophobicContact CB-CD2 4.26Å; P617-W619 HydrophobicContact CB-CE3 4.41Å; P617-W619 HydrophobicContact CB-CH2 3.54Å; P617-W619 HydrophobicContact CB-CZ2 3.36Å; P617-W619 HydrophobicContact CB-CZ3 4.08Å; P617-W619 HydrophobicContact CG-CH2 3.89Å; P617-W619 HydrophobicContact CG-CZ2 3.22Å
618	V	89.4	Confident	82.5	Confident	80 Å²	80	73.6 Å²	73.6	49%	0.485	38%	0.38	S	S	.	.			trans	-103.4	110.9	175	178.7	0	0	0	0	108.9	N138 P141	N138-V618 HydrophobicContact CB-CB 4.28Å; N138-V618 PolarHBondContact O-N 3.25Å; P141-V618 HydrophobicContact CG-CG2 3.66Å
619	W	86.1	Confident	80.3	Confident	70 Å²	70	70.8 Å²	70.8	27%	0.265	38%	0.38	S	S	.	.			trans	-86.8	130	-176.5	-57.1	128.9	0	0	0	112.7	F128 M129 Y518 P617 H623 M627	F128-W619 AromaticContact CE1-CH2 3.94Å; F128-W619 HydrophobicContact CE1-CH2 3.94Å; F128-W619 AromaticContact CE1-CZ3 3.72Å; F128-W619 HydrophobicContact CE1-CZ3 3.72Å; F128-W619 HydrophobicContact CZ-CH2 4.36Å; F128-W619 HydrophobicContact CZ-CZ3 4.26Å; M129-W619 HydrophobicContact CE-CZ3 4.41Å; M129-W619 HydrophobicContact SD-CZ3 3.93Å; Y518-W619 HydrophobicContact CE2-CH2 4.02Å; Y518-W619 HydrophobicContact CE2-CZ2 4.4Å; Y518-W619 WeakPolarHBondContact OH-CH2 3.2Å; P617-W619 HydrophobicContact CB-CD2 4.26Å; P617-W619 HydrophobicContact CB-CE3 4.41Å; P617-W619 HydrophobicContact CB-CH2 3.54Å; P617-W619 HydrophobicContact CB-CZ2 3.36Å; P617-W619 HydrophobicContact CB-CZ3 4.08Å; P617-W619 HydrophobicContact CG-CH2 3.89Å; P617-W619 HydrophobicContact CG-CZ2 3.22Å; W619-H623 HydrophobicContact CB-CB 4.2Å; W619-H623 HydrophobicContact CD2-CB 4.43Å; W619-H623 HydrophobicContact CE3-CB 4.09Å; W619-H623 AromaticContact CE3-CD2 3.71Å; W619-H623 AromaticContact CE3-CE1 3.97Å; W619-H623 AromaticContact CE3-CG 3.67Å; W619-H623 AromaticContact CE3-ND1 3.87Å; W619-H623 AromaticContact CE3-NE2 3.91Å; W619-H623 AromaticContact CZ3-CD2 3.95Å; W619-M627 HydrophobicContact CD2-CE 3.79Å; W619-M627 HydrophobicContact CD2-SD 4.23Å; W619-M627 HydrophobicContact CE3-CE 3.87Å; W619-M627 HydrophobicContact CG-SD 4.39Å; W619-M627 HydrophobicContact CH2-CE 3.76Å; W619-M627 HydrophobicContact CZ2-CE 3.62Å; W619-M627 HydrophobicContact CZ3-CE 3.88Å
620	G	76.9	Confident	77.9	Confident	23 Å²	23	73 Å²	73	24%	0.237	40%	0.395	C	S	.	.			trans	-78	164.8	162.3	0	0	0	0	0	112.7	H622 H623	G620-H622 VanDerWaalsContact C-N 3.27Å; G620-H622 PolarHBondContact O-N 2.93Å; G620-H623 PolarHBondContact N-ND1 3.16Å; G620-H623 PolarHBondContact O-N 3.09Å; G620-H623 VanDerWaalsContact O-N 3.09Å; G620-H623 PolarHBondContact O-ND1 2.7Å
621	P	72.4	Confident	75.1	Confident	87 Å²	87	77.4 Å²	77.4	57%	0.565	42%	0.422	S	S	*	.	H	α-helix	trans	-54.6	-36.7	-178	-26.5	34.6	0	0	0	114.6	H623 L624	P621-H623 VanDerWaalsContact C-N 3.28Å; P621-H623 PolarHBondContact O-N 3.36Å; P621-L624 WeakPolarHBondContact O-CB 3.33Å; P621-L624 PolarHBondContact O-N 3.15Å; P621-L624 VanDerWaalsContact O-N 3.11Å
622	H	75.8	Confident	72.3	Confident	27 Å²	27	73.2 Å²	73.2	13%	0.125	42%	0.419	C	S	.	.	H	α-helix	trans	-64.3	-32.3	-179.7	74.4	-82.2	0	0	0	112.5	F128 M129 G620 L624 E625 Y626	F128-H622 PolarHBondContact O-NE2 3.01Å; F128-H622 VanDerWaalsContact O-NE2 3.13Å; M129-H622 PolarHBondContact O-CE1 3.37Å; G620-H622 VanDerWaalsContact C-N 3.27Å; G620-H622 PolarHBondContact O-N 2.93Å; H622-L624 VanDerWaalsContact C-N 3.25Å; H622-L624 PolarHBondContact O-N 3.14Å; H622-E625 WeakPolarHBondContact O-CB 3.3Å; H622-E625 PolarHBondContact O-N 3.49Å; H622-Y626 WeakPolarHBondContact O-CD2 3.14Å
623	H	79.3	Confident	69.6	Low	6 Å²	6	75.3 Å²	75.3	3%	0.028	43%	0.427	C	S	.	.	H	α-helix	trans	-65.9	-32.9	176.7	-54.1	99.3	0	0	0	111.4	F128 W619 G620 P621 E625 Y626 M627	F128-H623 PolarHBondContact O-NE2 3.25Å; W619-H623 HydrophobicContact CB-CB 4.2Å; W619-H623 HydrophobicContact CD2-CB 4.43Å; W619-H623 HydrophobicContact CE3-CB 4.09Å; W619-H623 AromaticContact CE3-CD2 3.71Å; W619-H623 AromaticContact CE3-CE1 3.97Å; W619-H623 AromaticContact CE3-CG 3.67Å; W619-H623 AromaticContact CE3-ND1 3.87Å; W619-H623 AromaticContact CE3-NE2 3.91Å; W619-H623 AromaticContact CZ3-CD2 3.95Å; G620-H623 PolarHBondContact N-ND1 3.16Å; G620-H623 PolarHBondContact O-N 3.09Å; G620-H623 VanDerWaalsContact O-N 3.09Å; G620-H623 PolarHBondContact O-ND1 2.7Å; P621-H623 VanDerWaalsContact C-N 3.28Å; P621-H623 PolarHBondContact O-N 3.36Å; H623-E625 VanDerWaalsContact C-N 3.27Å; H623-E625 PolarHBondContact O-N 3.02Å; H623-Y626 PolarHBondContact O-N 3.45Å; H623-M627 HydrophobicContact CB-CE 3.99Å; H623-M627 HydrophobicContact CB-SD 4.24Å; H623-M627 WeakPolarHBondContact O-CB 3.4Å; H623-M627 WeakPolarHBondContact O-CG 3.4Å; H623-M627 PolarHBondContact O-N 3.24Å
624	L	73.5	Confident	67	Low	110 Å²	110	76.8 Å²	76.8	58%	0.576	44%	0.439	S	S	*	.	H	α-helix	trans	-68.5	-29.1	-179.7	-60.9	173.8	0	0	0	112	P621 H622 Y626 A628	P621-L624 WeakPolarHBondContact O-CB 3.33Å; P621-L624 PolarHBondContact O-N 3.15Å; P621-L624 VanDerWaalsContact O-N 3.11Å; H622-L624 VanDerWaalsContact C-N 3.25Å; H622-L624 PolarHBondContact O-N 3.14Å; L624-Y626 VanDerWaalsContact C-N 3.32Å; L624-A628 PolarHBondContact O-N 3.41Å
625	E	71.5	Confident	64.3	Low	134 Å²	134	81.1 Å²	81.1	63%	0.626	47%	0.47	S	S	*	.	H	α-helix	trans	-62.8	-39.8	173.9	-169.7	179.9	-176.6	0	0	111.5	H622 H623	H622-E625 WeakPolarHBondContact O-CB 3.3Å; H622-E625 PolarHBondContact O-N 3.49Å; H623-E625 VanDerWaalsContact C-N 3.27Å; H623-E625 PolarHBondContact O-N 3.02Å
626	Y	68.9	Low	61.4	Low	107 Å²	107	84.1 Å²	84.1	42%	0.42	49%	0.492	S	S	.	.	H	α-helix	trans	-97.4	-8.4	-178.1	-57.4	-78.4	0	0	0	114.2	F353 H622 H623 L624	F353-Y626 HydrophobicContact CB-CE2 4.47Å; F353-Y626 AromaticContact CD1-CD1 3.69Å; F353-Y626 HydrophobicContact CD1-CD1 3.69Å; F353-Y626 HydrophobicContact CD1-CD2 4.23Å; F353-Y626 AromaticContact CD1-CE1 3.75Å; F353-Y626 HydrophobicContact CD1-CE1 3.75Å; F353-Y626 HydrophobicContact CD1-CE2 4.34Å; F353-Y626 AromaticContact CD1-CG 3.95Å; F353-Y626 HydrophobicContact CD1-CG 3.95Å; F353-Y626 HydrophobicContact CD2-CD2 4.2Å; F353-Y626 HydrophobicContact CD2-CE2 4.33Å; F353-Y626 AromaticContact CE1-CD1 3.64Å; F353-Y626 HydrophobicContact CE1-CD1 3.64Å; F353-Y626 HydrophobicContact CE1-CD2 4.18Å; F353-Y626 HydrophobicContact CE1-CE1 4.19Å; F353-Y626 AromaticContact CE1-CG 3.63Å; F353-Y626 HydrophobicContact CE1-CG 3.63Å; F353-Y626 HydrophobicContact CE2-CD2 4.14Å; F353-Y626 HydrophobicContact CE2-CG 4.32Å; F353-Y626 HydrophobicContact CG-CD1 4.42Å; F353-Y626 HydrophobicContact CG-CD2 4.24Å; F353-Y626 HydrophobicContact CG-CE1 4.24Å; F353-Y626 HydrophobicContact CG-CE2 4.13Å; F353-Y626 HydrophobicContact CG-CG 4.42Å; F353-Y626 HydrophobicContact CZ-CD1 4.31Å; F353-Y626 HydrophobicContact CZ-CD2 4.13Å; F353-Y626 AromaticContact CZ-CG 3.83Å; F353-Y626 HydrophobicContact CZ-CG 3.83Å; H622-Y626 WeakPolarHBondContact O-CD2 3.14Å; H623-Y626 PolarHBondContact O-N 3.45Å; L624-Y626 VanDerWaalsContact C-N 3.32Å
627	M	64.8	Low	58.6	Low	62 Å²	62	87.7 Å²	87.7	31%	0.305	51%	0.507	S	S	.	.	S	Bend	trans	-96.3	1.7	174.3	-73.2	-179.4	-172.6	0	0	113.2	F128 W619 H623	F128-M627 HydrophobicContact CZ-CE 3.89Å; W619-M627 HydrophobicContact CD2-CE 3.79Å; W619-M627 HydrophobicContact CD2-SD 4.23Å; W619-M627 HydrophobicContact CE3-CE 3.87Å; W619-M627 HydrophobicContact CG-SD 4.39Å; W619-M627 HydrophobicContact CH2-CE 3.76Å; W619-M627 HydrophobicContact CZ2-CE 3.62Å; W619-M627 HydrophobicContact CZ3-CE 3.88Å; H623-M627 HydrophobicContact CB-CE 3.99Å; H623-M627 HydrophobicContact CB-SD 4.24Å; H623-M627 WeakPolarHBondContact O-CB 3.4Å; H623-M627 WeakPolarHBondContact O-CG 3.4Å; H623-M627 PolarHBondContact O-N 3.24Å
628	A	47.2	Very low	55.8	Low	70 Å²	70	92.9 Å²	92.9	58%	0.579	54%	0.538	S	S	*	.			trans	-56.3	138.7	177.2	0	0	0	0	0	110.7	L624	L624-A628 PolarHBondContact O-N 3.41Å
629	P	45.5	Very low	53.2	Low	117 Å²	117	95.5 Å²	95.5	76%	0.76	56%	0.557	S	S	*	*			trans	-72	148.6	-158.4	-12.3	27.3	0	0	0	113	I631	P629-I631 PolarHBondContact O-N 2.88Å; P629-I631 VanDerWaalsContact O-N 3.09Å
630	D	41.2	Very low	50.6	Low	159 Å²	159	95.6 Å²	95.6	85%	0.85	58%	0.58	S	S	*	*			trans	-41.8	115.6	151	-71.4	-48.1	0	0	0	109.1	G632	D630-G632 PolarHBondContact O-N 3.33Å; D630-G632 VanDerWaalsContact O-N 3.12Å
631	I	35.8	Very low	48.2	Very low	152 Å²	152	100 Å²	100	78%	0.779	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-57.1	120.1	160.8	-61.6	166.8	0	0	0	104.7	P629	P629-I631 PolarHBondContact O-N 2.88Å; P629-I631 VanDerWaalsContact O-N 3.09Å
632	G	32.9	Very low	46.4	Very low	41 Å²	41	103.8 Å²	103.8	42%	0.423	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-52.3	171.8	-173.9	0	0	0	0	0	113.9	D630 L634	D630-G632 PolarHBondContact O-N 3.33Å; D630-G632 VanDerWaalsContact O-N 3.12Å; G632-L634 PolarHBondContact O-N 3.46Å; G632-L634 VanDerWaalsContact O-N 3.15Å
633	P	35.6	Very low	44.4	Very low	101 Å²	101	110 Å²	110	66%	0.656	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-52.4	128.4	-176.2	22.7	-31.7	0	0	0	109.8	S635 S636	P633-S635 PolarHBondContact O-N 3.4Å; P633-S636 PolarHBondContact O-N 3.23Å; P633-S636 VanDerWaalsContact O-N 3.16Å; P633-S636 PolarHBondContact O-OG 3.2Å
634	L	37.9	Very low	42	Very low	154 Å²	154	116.7 Å²	116.7	81%	0.806	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-52.3	-5.3	-174.6	-147.8	78.3	0	0	0	114.6	G632	G632-L634 PolarHBondContact O-N 3.46Å; G632-L634 VanDerWaalsContact O-N 3.15Å
635	S	36.4	Very low	39.8	Very low	111 Å²	111	121.4 Å²	121.4	78%	0.776	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-79.6	-7.7	176.5	54.9	0	0	0	0	115.5	P633	P633-S635 PolarHBondContact O-N 3.4Å
636	S	33.5	Very low	37.7	Very low	85 Å²	85	120.5 Å²	120.5	59%	0.594	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-106.4	8	-177.5	69	0	0	0	0	115.6	P633 T638	P633-S636 PolarHBondContact O-N 3.23Å; P633-S636 VanDerWaalsContact O-N 3.16Å; P633-S636 PolarHBondContact O-OG 3.2Å; S636-T638 PolarHBondContact O-N 2.85Å
637	L	33.8	Very low	35.8	Very low	123 Å²	123	122.1 Å²	122.1	64%	0.644	73%	0.726	S	S	*	*			trans	-92.7	97.1	176.9	-69.7	167.2	0	0	0	109.9
638	T	32.8	Very low	33.9	Very low	131 Å²	131	125.5 Å²	125.5	80%	0.804	74%	0.744	S	S	*	*			trans	-72.6	136.6	165.2	41.4	0	0	0	0	110.3	S636 G640	S636-T638 PolarHBondContact O-N 2.85Å; T638-G640 PolarHBondContact O-N 3.45Å
639	P	34.6	Very low	32.9	Very low	136 Å²	136	131.4 Å²	131.4	88%	0.883	76%	0.757	S	S	*	*			trans	-81	119.6	-179.5	30.5	-29.6	0	0	0	110.3
640	G	31.3	Very low	31.9	Very low	72 Å²	72	133.6 Å²	133.6	74%	0.742	76%	0.757	S	S	*	*			trans	144	90.2	161.8	0	0	0	0	0	115.6	T638	T638-G640 PolarHBondContact O-N 3.45Å
641	S	27.7	Very low	31.3	Very low	115 Å²	115	131.7 Å²	131.7	80%	0.804	76%	0.756	S	S	*	*				169.2	134.4	126.5	58.5	0	0	0	0	109.6	D643	S641-D643 PolarHBondContact O-N 3.13Å
642	D	35.3	Very low	30.9	Very low	166 Å²	166	130.5 Å²	130.5	89%	0.888	76%	0.756	S	S	*	*	S	Bend	trans	-62.4	87.8	-167	-67.1	-54.2	0	0	0	116
643	D	32.6	Very low	30.8	Very low	157 Å²	157	140.8 Å²	140.8	84%	0.84	80%	0.796	S	S	*	*			trans	-155.9	47.8	160.2	-105.1	-21.6	0	0	0	112.9	S641	S641-D643 PolarHBondContact O-N 3.13Å
644	N	30	Very low	30.5	Very low	148 Å²	148	142.8 Å²	142.8	79%	0.791	80%	0.803	S	S	*	*			trans	-118.6	88.1	174.9	-81.8	-20	0	0	0	111.2	V646	N644-V646 PolarHBondContact O-N 3.04Å; N644-V646 VanDerWaalsContact O-N 3.13Å
645	K	27.1	Very low	30.1	Very low	208 Å²	208	142.2 Å²	142.2	90%	0.904	80%	0.803	S	S	*	*			trans	-75.7	93.7	157.5	-86.1	-178.4	177.9	173.6	0	108.6	I647	K645-I647 PolarHBondContact O-N 3.29Å
646	V	26.8	Very low	29.8	Very low	115 Å²	115	143.9 Å²	143.9	70%	0.697	81%	0.805	S	S	*	*			trans	-61.7	115.1	165.7	-178	0	0	0	0	108.2	N644 I648	N644-V646 PolarHBondContact O-N 3.04Å; N644-V646 VanDerWaalsContact O-N 3.13Å; V646-I648 HydrophobicContact CG1-CD1 4.48Å; V646-I648 HydrophobicContact CG1-CG1 3.66Å
647	I	28	Very low	29.6	Very low	142 Å²	142	147.4 Å²	147.4	73%	0.728	82%	0.817	S	S	*	*			trans	-89.3	101.8	164.4	-59.8	177.6	0	0	0	106.2	K645 F649	K645-I647 PolarHBondContact O-N 3.29Å; I647-F649 HydrophobicContact CG2-CD2 4.25Å; I647-F649 HydrophobicContact CG2-CE2 4.24Å
648	I	25.3	Very low	29.3	Very low	132 Å²	132	148.9 Å²	148.9	68%	0.677	83%	0.828	S	S	*	*			trans	-78.5	114.8	171	-57.1	178	0	0	0	106.9	V646 E650	V646-I648 HydrophobicContact CG1-CD1 4.48Å; V646-I648 HydrophobicContact CG1-CG1 3.66Å; I648-E650 HydrophobicContact CG2-CG 4.24Å; I648-E650 PolarHBondContact O-N 3.48Å
649	F	27.2	Very low	29.1	Very low	194 Å²	194	150.1 Å²	150.1	85%	0.851	83%	0.829	S	S	*	*			trans	-83.8	97.8	159.5	-93.1	-86	0	0	0	107.6	I647 S651	I647-F649 HydrophobicContact CG2-CD2 4.25Å; I647-F649 HydrophobicContact CG2-CE2 4.24Å; F649-S651 PolarHBondContact O-N 3.35Å
650	E	24.8	Very low	28.7	Very low	163 Å²	163	151.1 Å²	151.1	76%	0.762	83%	0.826	S	S	*	*			trans	-66.3	117.4	162	-89.6	-175.9	150.8	0	0	108.7	I648 V652	I648-E650 HydrophobicContact CG2-CG 4.24Å; I648-E650 PolarHBondContact O-N 3.48Å; E650-V652 PolarHBondContact O-N 3.4Å
651	S	27.9	Very low	28.5	Very low	119 Å²	119	157.2 Å²	157.2	83%	0.832	83%	0.832	S	S	*	*			trans	-71.5	112.2	158.2	59	0	0	0	0	108.2	F649	F649-S651 PolarHBondContact O-N 3.35Å
652	V	27.2	Very low	28.5	Very low	128 Å²	128	160.8 Å²	160.8	78%	0.776	83%	0.834	S	S	*	*			trans	-97.9	128	162.9	-175.8	0	0	0	0	107.8	E650	E650-V652 PolarHBondContact O-N 3.4Å
653	M	30.2	Very low	27.9	Very low	257 Å²	257	160.3 Å²	160.3	100%	1.266	83%	0.829	S	S	*	*			trans	-44.5	0	-177.4	-74.4	175.1	-94.2	0	0	116.1

Retrieved 653 of 653 residues in 219.6 ms (Link to these results)

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