A0A087YHH1_POEFO Loading...

Calcium dependent secretion activator 2

AlphaFold DB , UniProt , Accession A0A087YHH1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,128 aa.

						>A0A087YHH1_POEFO|A0A087YHH1
MLDPSSSEDTGGESDTEVTREPPRKPSAYSEAEKQGDSGRAGGQQLQPAETPGEGAKDCPSAGDEEKKERERLQKEENERRTKLQIYVFVLRCISYPFNAKQPTDMARRQQKVNKQQLQTVKEHFLAFLNGETQIIADEAFCNAVRSYYEGFLKSERVSRMVQSGGCSANDFREVFKKNIERRVRSLPEIDGLSKETVLSSWITKYDTIYRGEEDMRRQTQRAHLSAVSELILSKEQLYEMFQQILGIRKFEHQLLYNACQLDNVDEQAAQIRRELDGRLQLAEKIARERTNPKFVSTDMEALYIEELRSSVNLLMANLESLPVSKGGPDFKQKLKRSSMNNSFLDIGDEGDVLSKSDVVLTFNLEVVIVEVQGLKSVAPNRIVYCTMEVEGGEKLQTDQAEASRPQWSTQGDFSTTHPLPLVKVKLFTESTGVLALEDKELGRVVLIPTTSGPKQAEFHRMVVPKNSQDTDLQIKLAVRMDKPPNMKHSGYLYAVGHRVWKRWKKRYFLLVQVSQYTFAMCSYRERKAEPQELMQLEGYTVDYCQPQTGLQGGQVFFNAVKEGDLVTFACDDEQDRALWVQALYRATGQSYKPIQPTHNKAANCKGGHRKPSSISLDPCQRQGMEDLISAAPGCFDHAALFSILQKHTLQHRMNDSFSCLGWFSPGQVFVLDEYCARYGVRGCHRHLSYLKDLMDYAENSVLVDPMLLHYSYAFCASHIHGNRPDGTGTVTVEEKEQFEAVRHRLIVLLENQITHFRYCFPFGRPDGALKATLSLLERVLMKDITTPVPSEETKRRVQKCLEKASQINYSQLMDYAQINVDPEEVPEKRLEDMLRLGELCIEVLQQNEEHHSEAFSWWPELMAEHAESFLSLYRADMDSTLQAQPADSWNSFPLFQLLNNFLRADSHLCSGPFHKHLQDLFIPLVVRYIDLMETSIAQSIHRGFEQETWHSVRLLTNNLASVPLPRISSLPLTLPQMPSFSVPAWFGPIYENTLQGVNLPDIFNGSATSEDLFWKLDALQMFVMDLHWPEPEFAKHLKQRLKLMASDMMEACVKRTKSAFEAKMAKTSRSTEFRVPLSVCTMFNVLLDAKKQSSKLCVLDCNQEVNLTRHGNHNTMFGICNLTIMIN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	27.8	Very low	230 Å²	230	135.1 Å²	135.1	100%	1.133	81%	0.807	S	S	*	*				0	126.7	0	-68.6	162.9	59.5	0	0	106.9
2	L	26.4	Very low	27.5	Very low	158 Å²	158	130.3 Å²	130.3	83%	0.827	81%	0.806	S	S	*	*			cis	-170.9	118.7	-14.9	-119.3	171.2	0	0	0	104.4
3	D	30.2	Very low	27.4	Very low	149 Å²	149	135.7 Å²	135.7	80%	0.797	82%	0.816	S	S	*	*			trans	-74.1	158.1	168.2	-55.2	-65.4	0	0	0	110
4	P	36.9	Very low	27.4	Very low	120 Å²	120	134.1 Å²	134.1	78%	0.779	82%	0.815	S	S	*	*				-130.1	158.2	87.7	13.5	9.8	0	0	0	112.5
5	S	24.2	Very low	27.3	Very low	112 Å²	112	136.3 Å²	136.3	78%	0.783	82%	0.82	S	S	*	*			cis	69.7	133.4	48.8	-153.3	0	0	0	0	112.3
6	S	26.7	Very low	27.4	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	82%	0.816	S	S	*	*			cis	-151	-165.6	1.2	49.3	0	0	0	0	107.6
7	S	27.8	Very low	27.3	Very low	84 Å²	84	138.6 Å²	138.6	59%	0.587	82%	0.82	S	S	*	*			cis	-160.4	165.8	11.9	60.1	0	0	0	0	111.8
8	E	25.9	Very low	27.3	Very low	175 Å²	175	138.2 Å²	138.2	82%	0.818	82%	0.818	S	S	*	*				34	147.1	128.3	-59.5	159.8	168.5	0	0	121.2
9	D	25.3	Very low	27.3	Very low	137 Å²	137	137.6 Å²	137.6	73%	0.733	82%	0.816	S	S	*	*			cis	-155.6	167.7	16.2	-151.6	4.9	0	0	0	116.2
10	T	25.8	Very low	27.2	Very low	126 Å²	126	142.7 Å²	142.7	77%	0.773	82%	0.821	S	S	*	*			trans	25.5	132.2	159.9	49.7	0	0	0	0	123
11	G	25	Very low	27.1	Very low	85 Å²	85	143.2 Å²	143.2	88%	0.876	82%	0.816	S	S	*	*			trans	171.5	94	153.4	0	0	0	0	0	111.7
12	G	24.4	Very low	27	Very low	77 Å²	77	137.5 Å²	137.5	79%	0.794	80%	0.795	S	S	*	*			trans	-140.4	142	-173.9	0	0	0	0	0	114.2
13	E	26.6	Very low	27.1	Very low	201 Å²	201	136.3 Å²	136.3	94%	0.939	80%	0.798	S	S	*	*			trans	-135.5	164.8	164.6	-95.6	179.4	175.2	0	0	109.1
14	S	26.6	Very low	26.9	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.7	126.5	-152.6	55.5	0	0	0	0	116.6
15	D	25.7	Very low	26.4	Very low	167 Å²	167	143.2 Å²	143.2	89%	0.893	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-79.8	142.4	154.7	-95.6	-40.3	0	0	0	111.1
16	T	29.5	Very low	26.6	Very low	123 Å²	123	144.3 Å²	144.3	76%	0.755	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-101.3	117.5	166.7	44	0	0	0	0	110.6	V18	T16-V18 PolarHBondContact O-N 3.3Å
17	E	26.1	Very low	26.5	Very low	188 Å²	188	143.8 Å²	143.8	88%	0.879	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.2	128.5	178	-72.4	-170.6	104.7	0	0	112.2
18	V	27.8	Very low	26.4	Very low	132 Å²	132	144.8 Å²	144.8	80%	0.8	82%	0.817	S	S	*	*			trans	-112.1	93.9	166.1	-179.1	0	0	0	0	108.9	T16 R20	T16-V18 PolarHBondContact O-N 3.3Å; V18-R20 PolarHBondContact O-N 3.21Å
19	T	26.1	Very low	26.4	Very low	126 Å²	126	147.2 Å²	147.2	77%	0.773	82%	0.82	S	S	*	*			trans	-64	127.2	179.4	-40.4	0	0	0	0	111.1
20	R	26.3	Very low	26.3	Very low	240 Å²	240	145.9 Å²	145.9	91%	0.906	82%	0.821	S	S	*	*			trans	-89.3	109.9	176.6	-78.2	-179.5	167.1	170.1	-2.3	111.8	V18	V18-R20 PolarHBondContact O-N 3.21Å
21	E	24.8	Very low	26.2	Very low	154 Å²	154	149.5 Å²	149.5	72%	0.72	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-79.9	152.2	162	-77.3	-151.6	138.6	0	0	112.3
22	P	28.9	Very low	26.3	Very low	109 Å²	109	150.1 Å²	150.1	71%	0.708	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-80.5	157.3	173.9	33.5	-35.3	0	0	0	113
23	P	29.4	Very low	26.2	Very low	134 Å²	134	155.1 Å²	155.1	87%	0.87	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-72.5	134.3	-170.1	28.4	-35.7	0	0	0	114.1
24	R	24.5	Very low	26.2	Very low	216 Å²	216	155.2 Å²	155.2	82%	0.815	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-85.3	149.5	170.6	-69	-177.5	-178.6	164.1	6.3	111.7
25	K	27.5	Very low	26.1	Very low	197 Å²	197	159.4 Å²	159.4	86%	0.857	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-77.8	149.3	169.6	-64.5	178.8	-179.8	178.7	0	110.3
26	P	28.2	Very low	26	Very low	136 Å²	136	155.1 Å²	155.1	88%	0.883	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-71.4	134.1	174.4	29.6	-33.9	0	0	0	111.3
27	S	23.9	Very low	25.6	Very low	98 Å²	98	157 Å²	157	69%	0.685	83%	0.834	S	S	*	*			trans	-113.4	127.1	167.7	54.3	0	0	0	0	109
28	A	26.6	Very low	25.5	Very low	106 Å²	106	152.9 Å²	152.9	88%	0.876	83%	0.826	S	S	*	*			trans	-68.1	139.6	177.4	0	0	0	0	0	111.3
29	Y	24.9	Very low	25.3	Very low	225 Å²	225	150.4 Å²	150.4	88%	0.882	83%	0.827	S	S	*	*			trans	-98.7	145.3	159.1	-94	-92.2	0	0	0	108.9
30	S	24.5	Very low	25.3	Very low	109 Å²	109	156.6 Å²	156.6	76%	0.762	84%	0.836	S	S	*	*			trans	-125.4	137	164.6	63.2	0	0	0	0	109.1
31	E	24.1	Very low	25.3	Very low	203 Å²	203	150 Å²	150	95%	0.949	83%	0.833	S	S	*	*			trans	-144.2	160.8	145.1	-128.2	164.9	-160.2	0	0	108.7
32	A	25.5	Very low	25.2	Very low	98 Å²	98	146.7 Å²	146.7	81%	0.81	84%	0.84	S	S	*	*			trans	-143.3	154.4	-156.8	0	0	0	0	0	111.9
33	E	23.6	Very low	25.1	Very low	182 Å²	182	144.7 Å²	144.7	85%	0.85	84%	0.839	S	S	*	*			trans	-154	108.5	162	-138.7	-176.3	-134.1	0	0	113.1
34	K	26.3	Very low	25	Very low	203 Å²	203	147.2 Å²	147.2	88%	0.883	84%	0.84	S	S	*	*				-177.6	153.6	128.1	-99.1	160	-173	172.1	0	113.2
35	Q	24.2	Very low	25.2	Very low	202 Å²	202	144.9 Å²	144.9	94%	0.944	84%	0.838	S	S	*	*			trans	-89.8	160.2	-174.8	-59.9	159.7	-25.1	0	0	111.4
36	G	22.8	Very low	25.3	Very low	77 Å²	77	142.5 Å²	142.5	79%	0.794	83%	0.834	S	S	*	*			trans	-167.2	4.2	-176.2	0	0	0	0	0	122
37	D	22.4	Very low	25.3	Very low	161 Å²	161	144.6 Å²	144.6	86%	0.861	83%	0.832	S	S	*	*			trans	57.1	-164.5	168.7	-157.2	54.6	0	0	0	119.6
38	S	23.5	Very low	25.7	Very low	103 Å²	103	146 Å²	146	72%	0.72	84%	0.839	S	S	*	*			trans	-106.6	159	-132.8	61.1	0	0	0	0	117.1
39	G	24.3	Very low	25.9	Very low	80 Å²	80	144.8 Å²	144.8	83%	0.825	83%	0.828	S	S	*	*			trans	-175.5	106.8	172.7	0	0	0	0	0	116.4
40	R	25.3	Very low	26.1	Very low	255 Å²	255	142.7 Å²	142.7	96%	0.962	83%	0.827	S	S	*	*			trans	-75.7	161.4	170.7	-76.5	170.7	171	168.5	-4.2	111.2
41	A	25.8	Very low	26.4	Very low	102 Å²	102	143.6 Å²	143.6	84%	0.843	83%	0.828	S	S	*	*			cis	-168.9	177.3	-4	0	0	0	0	0	107.5
42	G	24	Very low	27.4	Very low	84 Å²	84	140.1 Å²	140.1	87%	0.866	82%	0.823	S	S	*	*			cis	145.9	127.3	-3.9	0	0	0	0	0	113.1
43	G	25.8	Very low	27.5	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	82%	0.822	S	S	*	*			trans	158.1	111.3	-178.4	0	0	0	0	0	109.6
44	Q	26.8	Very low	28	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.874	83%	0.827	S	S	*	*				60.5	127.2	74.4	-61.4	-172.9	-0.4	0	0	111.9
45	Q	28.9	Very low	28.3	Very low	168 Å²	168	134.6 Å²	134.6	79%	0.785	83%	0.826	S	S	*	*			cis	-148.8	174.7	32.7	-69.8	-180	-19.3	0	0	111
46	L	29.1	Very low	28.6	Very low	147 Å²	147	129.1 Å²	129.1	77%	0.77	82%	0.816	S	S	*	*			cis	-163.1	147.6	-26.2	-102.4	166.7	0	0	0	107.3
47	Q	29	Very low	29.7	Very low	179 Å²	179	135.3 Å²	135.3	84%	0.836	82%	0.821	S	S	*	*			trans	-120.7	153.5	157.3	-71.4	-175.6	4.2	0	0	108.6
48	P	33.2	Very low	30.3	Very low	129 Å²	129	135 Å²	135	84%	0.838	82%	0.819	S	S	*	*			trans	-77.9	139	169.7	-4.5	22.5	0	0	0	111.5
49	A	29.3	Very low	30.9	Very low	79 Å²	79	135.1 Å²	135.1	65%	0.653	82%	0.819	S	S	*	*			trans	-77.2	-177.2	174.1	0	0	0	0	0	111.4
50	E	29	Very low	31.6	Very low	182 Å²	182	136.6 Å²	136.6	85%	0.85	81%	0.814	S	S	*	*			cis	-158.7	168.6	16.5	-151.3	143.5	-121.3	0	0	112.9
51	T	32	Very low	32.6	Very low	127 Å²	127	127.5 Å²	127.5	78%	0.779	79%	0.789	S	S	*	*			trans	-80.1	-176.5	175.7	4.8	0	0	0	0	111.9
52	P	44.8	Very low	33.9	Very low	131 Å²	131	126.1 Å²	126.1	85%	0.851	78%	0.778	S	S	*	*			cis	-144.8	177.4	30.4	43.6	-22.8	0	0	0	118.7
53	G	27.1	Very low	35.2	Very low	76 Å²	76	124 Å²	124	78%	0.784	76%	0.755	S	S	*	*			trans	163.3	118.3	165	0	0	0	0	0	112.9
54	E	34.9	Very low	36.7	Very low	207 Å²	207	124.6 Å²	124.6	97%	0.967	74%	0.743	S	S	*	*			trans	-87.1	154	176.9	-68.6	178.2	95.6	0	0	112.8
55	G	31.5	Very low	38.3	Very low	83 Å²	83	120.4 Å²	120.4	86%	0.856	72%	0.723	S	S	*	*			trans	101.4	71.3	141.9	0	0	0	0	0	118.7
56	A	30.6	Very low	40.2	Very low	88 Å²	88	118.5 Å²	118.5	73%	0.727	72%	0.715	S	S	*	*			trans	-140.8	139.9	153.5	0	0	0	0	0	111.3
57	K	46.6	Very low	42.3	Very low	206 Å²	206	117.1 Å²	117.1	90%	0.896	70%	0.702	S	S	*	*			trans	-92.2	103.3	162.3	-77.5	179.7	176	177.9	0	107.6	C59	K57-C59 PolarHBondContact O-N 2.88Å
58	D	35.7	Very low	44.5	Very low	156 Å²	156	113 Å²	113	83%	0.834	68%	0.681	S	S	*	*			trans	-79.5	107.6	164.9	-76	-39.5	0	0	0	109.5
59	C	35.8	Very low	46.6	Very low	105 Å²	105	112.5 Å²	112.5	71%	0.709	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-61.5	149.8	157.9	-68.1	0	0	0	0	109	K57 S61	K57-C59 PolarHBondContact O-N 2.88Å; C59-S61 PolarHBondContact O-N 3.25Å
60	P	37.8	Very low	48.8	Very low	111 Å²	111	117.7 Å²	117.7	72%	0.721	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-57.7	118.6	174.1	25.4	-33.8	0	0	0	109.3
61	S	47.3	Very low	51.2	Low	63 Å²	63	114.1 Å²	114.1	44%	0.441	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-68	145.4	178.1	83.8	0	0	0	0	109.6	C59 G63 D64	C59-S61 PolarHBondContact O-N 3.25Å; S61-G63 PolarHBondContact O-N 3.47Å; S61-G63 VanDerWaalsContact O-N 3.12Å; S61-D64 PolarHBondContact O-N 3.12Å; S61-D64 PolarHBondContact OG-N 3.33Å; S61-D64 PolarHBondContact OG-OD2 3.05Å
62	A	53.5	Low	53.5	Low	74 Å²	74	115.9 Å²	115.9	61%	0.612	65%	0.646	S	S	*	*	H	α-helix	trans	-55.4	-32	176.4	0	0	0	0	0	111.8	D64 E65 E66	A62-D64 VanDerWaalsContact C-N 3.29Å; A62-D64 PolarHBondContact O-N 2.97Å; A62-E65 PolarHBondContact O-N 3.33Å; A62-E66 WeakPolarHBondContact O-CG 3.1Å; A62-E66 PolarHBondContact O-N 3.05Å
63	G	50.6	Low	55.2	Low	38 Å²	38	114.4 Å²	114.4	39%	0.392	63%	0.631	S	S	.	*	H	α-helix	trans	-62.2	-26.3	176.9	0	0	0	0	0	115	S61 K67	S61-G63 PolarHBondContact O-N 3.47Å; S61-G63 VanDerWaalsContact O-N 3.12Å; G63-K67 WeakPolarHBondContact O-CB 3.44Å; G63-K67 PolarHBondContact O-N 3.02Å
64	D	58.1	Low	57.6	Low	80 Å²	80	116.4 Å²	116.4	43%	0.428	62%	0.62	S	S	.	*	H	α-helix	trans	-80.3	-31.5	176.4	-81	-58.5	0	0	0	112.9	S61 A62 K68	S61-D64 PolarHBondContact O-N 3.12Å; S61-D64 PolarHBondContact OG-N 3.33Å; S61-D64 PolarHBondContact OG-OD2 3.05Å; A62-D64 VanDerWaalsContact C-N 3.29Å; A62-D64 PolarHBondContact O-N 2.97Å; D64-K68 WeakPolarHBondContact O-CD 3.43Å; D64-K68 WeakPolarHBondContact O-CG 3.41Å; D64-K68 PolarHBondContact O-N 3.3Å; D64-K68 VanDerWaalsContact O-N 3.1Å
65	E	60.3	Low	59.9	Low	99 Å²	99	112.7 Å²	112.7	46%	0.463	60%	0.6	S	S	.	*	H	α-helix	trans	-74.4	-43.7	169.2	-69.9	-57.3	122.6	0	0	110.7	A62 K67 K68 E69	A62-E65 PolarHBondContact O-N 3.33Å; E65-K67 VanDerWaalsContact C-N 3.26Å; E65-K67 PolarHBondContact O-N 3.12Å; E65-K68 PolarHBondContact O-N 2.89Å; E65-K68 WeakPolarHBondContact OE1-CD 3.14Å; E65-K68 IonicContact OE1-NZ 2.64Å; E65-K68 PolarHBondContact OE1-NZ 3.26Å; E65-E69 VanDerWaalsContact O-CB 3.31Å; E65-E69 WeakPolarHBondContact O-CB 3.19Å; E65-E69 PolarHBondContact O-N 3.48Å
66	E	67.2	Low	62.4	Low	129 Å²	129	114.4 Å²	114.4	60%	0.603	59%	0.586	S	S	*	*	H	α-helix	trans	-57.5	-37.4	172.3	-75.2	-177.6	179.9	0	0	112.3	A62 R70	A62-E66 WeakPolarHBondContact O-CG 3.1Å; A62-E66 PolarHBondContact O-N 3.05Å; E66-R70 VanDerWaalsContact O-CB 3.31Å; E66-R70 WeakPolarHBondContact O-CB 3.39Å; E66-R70 PolarHBondContact O-N 3.25Å
67	K	74.9	Confident	64.8	Low	118 Å²	118	116.4 Å²	116.4	51%	0.513	58%	0.58	S	S	.	*	H	α-helix	trans	-68.4	-47	175.7	-175.4	-174.3	176.5	-158.2	0	111.6	G63 E65 E69 R70 E71	G63-K67 WeakPolarHBondContact O-CB 3.44Å; G63-K67 PolarHBondContact O-N 3.02Å; E65-K67 VanDerWaalsContact C-N 3.26Å; E65-K67 PolarHBondContact O-N 3.12Å; K67-E69 VanDerWaalsContact C-N 3.28Å; K67-E69 PolarHBondContact O-N 2.91Å; K67-R70 PolarHBondContact O-N 3.29Å; K67-E71 WeakPolarHBondContact CE-OE1 3.47Å; K67-E71 IonicContact NZ-OE1 3.96Å; K67-E71 WeakPolarHBondContact O-CB 3.3Å; K67-E71 WeakPolarHBondContact O-CG 3.4Å; K67-E71 PolarHBondContact O-N 2.89Å
68	K	74.5	Confident	66.6	Low	91 Å²	91	110.9 Å²	110.9	40%	0.396	56%	0.561	S	S	.	*	H	α-helix	trans	-61.7	-37.1	174.3	-71	165.2	-158.7	164.6	0	111.8	D64 E65 E71 R72	D64-K68 WeakPolarHBondContact O-CD 3.43Å; D64-K68 WeakPolarHBondContact O-CG 3.41Å; D64-K68 PolarHBondContact O-N 3.3Å; D64-K68 VanDerWaalsContact O-N 3.1Å; E65-K68 PolarHBondContact O-N 2.89Å; E65-K68 WeakPolarHBondContact OE1-CD 3.14Å; E65-K68 IonicContact OE1-NZ 2.64Å; E65-K68 PolarHBondContact OE1-NZ 3.26Å; K68-E71 PolarHBondContact O-N 2.67Å; K68-R72 WeakPolarHBondContact O-CB 3.33Å; K68-R72 VanDerWaalsContact O-CG 3.27Å; K68-R72 WeakPolarHBondContact O-CG 3.34Å; K68-R72 PolarHBondContact O-N 2.89Å
69	E	78.3	Confident	68.9	Low	119 Å²	119	107.3 Å²	107.3	56%	0.556	54%	0.539	S	S	*	.	H	α-helix	trans	-67.1	-45.4	176	-174.4	170.7	-147.3	0	0	110.8	E65 K67 E71 R72 L73	E65-E69 VanDerWaalsContact O-CB 3.31Å; E65-E69 WeakPolarHBondContact O-CB 3.19Å; E65-E69 PolarHBondContact O-N 3.48Å; K67-E69 VanDerWaalsContact C-N 3.28Å; K67-E69 PolarHBondContact O-N 2.91Å; E69-E71 VanDerWaalsContact C-N 3.34Å; E69-E71 PolarHBondContact O-N 3.16Å; E69-R72 WeakPolarHBondContact O-CB 3.48Å; E69-R72 PolarHBondContact O-N 3.12Å; E69-L73 HydrophobicContact CG-CD1 4.13Å; E69-L73 WeakPolarHBondContact O-CB 3.39Å; E69-L73 VanDerWaalsContact O-CG 3.3Å; E69-L73 WeakPolarHBondContact O-CG 3.41Å; E69-L73 PolarHBondContact O-N 3.44Å
70	R	74.6	Confident	71.3	Confident	189 Å²	189	106.8 Å²	106.8	71%	0.713	52%	0.522	S	S	*	.	H	α-helix	trans	-60.5	-41.3	172.5	-176	178.6	-72.7	-149.2	-1	112.3	E66 K67 L73 Q74	E66-R70 VanDerWaalsContact O-CB 3.31Å; E66-R70 WeakPolarHBondContact O-CB 3.39Å; E66-R70 PolarHBondContact O-N 3.25Å; K67-R70 PolarHBondContact O-N 3.29Å; R70-L73 PolarHBondContact O-N 3.09Å; R70-Q74 WeakPolarHBondContact O-CB 3.32Å; R70-Q74 PolarHBondContact O-N 2.92Å
71	E	79.6	Confident	73.6	Confident	107 Å²	107	107.7 Å²	107.7	50%	0.5	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-38.5	175	-75	172.4	-172	0	0	111.9	K67 K68 E69 K75	K67-E71 WeakPolarHBondContact CE-OE1 3.47Å; K67-E71 IonicContact NZ-OE1 3.96Å; K67-E71 WeakPolarHBondContact O-CB 3.3Å; K67-E71 WeakPolarHBondContact O-CG 3.4Å; K67-E71 PolarHBondContact O-N 2.89Å; K68-E71 PolarHBondContact O-N 2.67Å; E69-E71 VanDerWaalsContact C-N 3.34Å; E69-E71 PolarHBondContact O-N 3.16Å; E71-K75 WeakPolarHBondContact O-CB 3.31Å; E71-K75 PolarHBondContact O-N 3.19Å
72	R	79.4	Confident	75.6	Confident	163 Å²	163	107 Å²	107	62%	0.615	51%	0.505	S	S	*	.	H	α-helix	trans	-64.6	-50.5	171.9	-74.9	173.7	-171.8	-169.5	7.9	111.9	K68 E69 Q74 K75 E76	K68-R72 WeakPolarHBondContact O-CB 3.33Å; K68-R72 VanDerWaalsContact O-CG 3.27Å; K68-R72 WeakPolarHBondContact O-CG 3.34Å; K68-R72 PolarHBondContact O-N 2.89Å; E69-R72 WeakPolarHBondContact O-CB 3.48Å; E69-R72 PolarHBondContact O-N 3.12Å; R72-Q74 VanDerWaalsContact C-N 3.31Å; R72-Q74 PolarHBondContact O-N 3.1Å; R72-K75 CarbonylContact O-C 3.54Å; R72-K75 WeakPolarHBondContact O-CA 3.29Å; R72-K75 WeakPolarHBondContact O-CB 3.31Å; R72-K75 PolarHBondContact O-N 2.85Å; R72-E76 WeakPolarHBondContact O-CG 3.2Å; R72-E76 PolarHBondContact O-N 3.13Å
73	L	81	Confident	77.4	Confident	101 Å²	101	105.8 Å²	105.8	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-58.6	-42.5	178.9	-71.4	168.5	0	0	0	111.5	E69 R70 E76 E77	E69-L73 HydrophobicContact CG-CD1 4.13Å; E69-L73 WeakPolarHBondContact O-CB 3.39Å; E69-L73 VanDerWaalsContact O-CG 3.3Å; E69-L73 WeakPolarHBondContact O-CG 3.41Å; E69-L73 PolarHBondContact O-N 3.44Å; R70-L73 PolarHBondContact O-N 3.09Å; L73-E76 PolarHBondContact O-N 3.43Å; L73-E77 WeakPolarHBondContact O-CB 3.44Å; L73-E77 PolarHBondContact O-N 2.64Å
74	Q	78.6	Confident	79.3	Confident	117 Å²	117	104.4 Å²	104.4	55%	0.547	47%	0.469	S	S	.	.	H	α-helix	trans	-68.5	-33.6	176.1	-168.7	170.6	16.8	0	0	112.3	R70 R72 N78	R70-Q74 WeakPolarHBondContact O-CB 3.32Å; R70-Q74 PolarHBondContact O-N 2.92Å; R72-Q74 VanDerWaalsContact C-N 3.31Å; R72-Q74 PolarHBondContact O-N 3.1Å; Q74-N78 WeakPolarHBondContact O-CB 3.46Å; Q74-N78 VanDerWaalsContact O-CG 3.28Å; Q74-N78 PolarHBondContact O-N 3.45Å; Q74-N78 PolarHBondContact O-ND2 3.39Å
75	K	81.8	Confident	80.8	Confident	129 Å²	129	101.2 Å²	101.2	56%	0.561	45%	0.452	S	S	*	.	H	α-helix	trans	-66.6	-45.6	171.6	-170.8	-170.9	177	-148.1	0	111.6	E71 R72 E77 N78 E79	E71-K75 WeakPolarHBondContact O-CB 3.31Å; E71-K75 PolarHBondContact O-N 3.19Å; R72-K75 CarbonylContact O-C 3.54Å; R72-K75 WeakPolarHBondContact O-CA 3.29Å; R72-K75 WeakPolarHBondContact O-CB 3.31Å; R72-K75 PolarHBondContact O-N 2.85Å; K75-E77 VanDerWaalsContact C-N 3.35Å; K75-E77 PolarHBondContact O-N 3.47Å; K75-N78 PolarHBondContact O-N 2.78Å; K75-E79 WeakPolarHBondContact CE-OE1 2.85Å; K75-E79 IonicContact NZ-OE1 3.94Å; K75-E79 PolarHBondContact NZ-OE1 3.3Å; K75-E79 WeakPolarHBondContact O-CG 3.44Å; K75-E79 PolarHBondContact O-N 3.44Å
76	E	83.8	Confident	82.3	Confident	120 Å²	120	96.5 Å²	96.5	56%	0.561	43%	0.43	S	S	*	.	H	α-helix	trans	-62	-41	177	-73.6	175.9	-161.9	0	0	111.6	R72 L73 E79 R80	R72-E76 WeakPolarHBondContact O-CG 3.2Å; R72-E76 PolarHBondContact O-N 3.13Å; L73-E76 PolarHBondContact O-N 3.43Å; E76-E79 PolarHBondContact O-N 3.29Å; E76-R80 WeakPolarHBondContact O-CB 3.18Å; E76-R80 PolarHBondContact O-N 3.03Å
77	E	82.6	Confident	83.5	Confident	129 Å²	129	90.3 Å²	90.3	60%	0.603	40%	0.401	S	S	*	.	H	α-helix	trans	-63.1	-42.1	173.6	-176.3	168	-144.8	0	0	112.2	L73 K75 R80 R81	L73-E77 WeakPolarHBondContact O-CB 3.44Å; L73-E77 PolarHBondContact O-N 2.64Å; K75-E77 VanDerWaalsContact C-N 3.35Å; K75-E77 PolarHBondContact O-N 3.47Å; E77-R80 WeakPolarHBondContact O-CB 3.3Å; E77-R80 PolarHBondContact O-N 3.1Å; E77-R81 WeakPolarHBondContact O-CB 3.36Å; E77-R81 PolarHBondContact O-N 2.91Å
78	N	82.6	Confident	84.2	Confident	90 Å²	90	84.7 Å²	84.7	48%	0.481	38%	0.376	S	S	.	.	H	α-helix	trans	-64.8	-47.7	175.3	-77.2	-36.8	0	0	0	112.2	Q74 K75 R80 R81 T82	Q74-N78 WeakPolarHBondContact O-CB 3.46Å; Q74-N78 VanDerWaalsContact O-CG 3.28Å; Q74-N78 PolarHBondContact O-N 3.45Å; Q74-N78 PolarHBondContact O-ND2 3.39Å; K75-N78 PolarHBondContact O-N 2.78Å; N78-R80 PolarHBondContact O-N 3.23Å; N78-R81 PolarHBondContact O-N 2.86Å; N78-T82 PolarHBondContact O-N 3.32Å; N78-T82 PolarHBondContact O-OG1 3Å
79	E	85.1	Confident	85	Confident	81 Å²	81	80.4 Å²	80.4	38%	0.379	36%	0.358	S	S	.	.	H	α-helix	trans	-57.8	-38.9	174.4	-74.9	-174.1	-156	0	0	111.5	K75 E76 T82 K83	K75-E79 WeakPolarHBondContact CE-OE1 2.85Å; K75-E79 IonicContact NZ-OE1 3.94Å; K75-E79 PolarHBondContact NZ-OE1 3.3Å; K75-E79 WeakPolarHBondContact O-CG 3.44Å; K75-E79 PolarHBondContact O-N 3.44Å; E76-E79 PolarHBondContact O-N 3.29Å; E79-T82 PolarHBondContact O-N 3.05Å; E79-K83 WeakPolarHBondContact O-CD 3.37Å; E79-K83 VanDerWaalsContact O-CG 3.29Å; E79-K83 WeakPolarHBondContact O-CG 3.34Å; E79-K83 PolarHBondContact O-N 3.36Å; E79-K83 IonicContact OE2-NZ 3.59Å
80	R	85.6	Confident	85.7	Confident	95 Å²	95	74.7 Å²	74.7	36%	0.358	33%	0.331	S	S	.	.	H	α-helix	trans	-69.2	-39.3	177.8	-177.2	174	177.4	-77.4	-35.9	112.5	E76 E77 N78 K83 L84 E252	E76-R80 WeakPolarHBondContact O-CB 3.18Å; E76-R80 PolarHBondContact O-N 3.03Å; E77-R80 WeakPolarHBondContact O-CB 3.3Å; E77-R80 PolarHBondContact O-N 3.1Å; N78-R80 PolarHBondContact O-N 3.23Å; R80-K83 PolarHBondContact O-N 3.17Å; R80-L84 WeakPolarHBondContact O-CG 3.15Å; R80-L84 PolarHBondContact O-N 2.98Å; R80-E252 IonicContact CZ-OE1 3.94Å; R80-E252 IonicContact NH2-OE1 3.64Å; R80-E252 PolarHBondContact NH2-OE1 3.07Å; R80-E252 IonicContact NH2-OE2 3.26Å; R80-E252 PolarHBondContact NH2-OE2 3.09Å
81	R	86.9	Confident	86.4	Confident	129 Å²	129	65.7 Å²	65.7	49%	0.487	30%	0.297	S	S	.	.	H	α-helix	trans	-63.9	-42.2	172.3	-170.6	175.1	-175.5	149.7	6.3	111.2	E77 N78 L84 Q85 L628	E77-R81 WeakPolarHBondContact O-CB 3.36Å; E77-R81 PolarHBondContact O-N 2.91Å; N78-R81 PolarHBondContact O-N 2.86Å; R81-L84 PolarHBondContact O-N 3.4Å; R81-Q85 PolarHBondContact O-N 2.6Å; R81-L628 HydrophobicContact CG-CD2 4.06Å
82	T	89.4	Confident	86.8	Confident	50 Å²	50	61.4 Å²	61.4	31%	0.307	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-44.9	174.3	-65.3	0	0	0	0	112	N78 E79 L84 Q85 I86 L641 I644	N78-T82 PolarHBondContact O-N 3.32Å; N78-T82 PolarHBondContact O-OG1 3Å; E79-T82 PolarHBondContact O-N 3.05Å; T82-L84 VanDerWaalsContact C-N 3.34Å; T82-L84 PolarHBondContact O-N 3.03Å; T82-Q85 PolarHBondContact O-N 2.84Å; T82-I86 HydrophobicContact CG2-CD1 4Å; T82-I86 VanDerWaalsContact O-CG1 3.32Å; T82-I86 WeakPolarHBondContact O-CG1 3.28Å; T82-I86 PolarHBondContact O-N 2.83Å; T82-L641 HydrophobicContact CG2-CD2 3.65Å; T82-I644 HydrophobicContact CG2-CD1 4.03Å
83	K	90.6	Very high	87.3	Confident	47 Å²	47	53.7 Å²	53.7	20%	0.204	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-40.9	174.9	-74.4	160.1	-177.5	158.3	0	112.4	E79 R80 Y87 I248 H648	E79-K83 WeakPolarHBondContact O-CD 3.37Å; E79-K83 VanDerWaalsContact O-CG 3.29Å; E79-K83 WeakPolarHBondContact O-CG 3.34Å; E79-K83 PolarHBondContact O-N 3.36Å; E79-K83 IonicContact OE2-NZ 3.59Å; R80-K83 PolarHBondContact O-N 3.17Å; K83-Y87 WeakPolarHBondContact O-CB 3.45Å; K83-Y87 PolarHBondContact O-N 3.33Å; K83-I248 HydrophobicContact CB-CD1 4.43Å; K83-H648 WeakPolarHBondContact CE-NE2 3.24Å
84	L	90.1	Very high	87.7	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.052	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-44.3	173.6	-75.9	162.9	0	0	0	112.3	R80 R81 T82 Y87 V88 I248 E252 L256 L628	R80-L84 WeakPolarHBondContact O-CG 3.15Å; R80-L84 PolarHBondContact O-N 2.98Å; R81-L84 PolarHBondContact O-N 3.4Å; T82-L84 VanDerWaalsContact C-N 3.34Å; T82-L84 PolarHBondContact O-N 3.03Å; L84-Y87 WeakPolarHBondContact O-CB 3.39Å; L84-Y87 PolarHBondContact O-N 2.94Å; L84-Y87 VanDerWaalsContact O-N 3.13Å; L84-V88 PolarHBondContact O-N 2.94Å; L84-I248 HydrophobicContact CD2-CD1 4.06Å; L84-I248 HydrophobicContact CD2-CG2 4.17Å; L84-I248 HydrophobicContact CG-CD1 4.35Å; L84-E252 HydrophobicContact CD2-CB 4.21Å; L84-L256 HydrophobicContact CD2-CD1 4.2Å; L84-L628 HydrophobicContact CB-CD1 3.99Å
85	Q	89.6	Confident	87.9	Confident	12 Å²	12	43.7 Å²	43.7	6%	0.056	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-41.8	177.4	-170.2	65.3	65.4	0	0	112.3	R81 T82 Y87 V88 F89 L628 F636	R81-Q85 PolarHBondContact O-N 2.6Å; T82-Q85 PolarHBondContact O-N 2.84Å; Q85-Y87 VanDerWaalsContact C-N 3.29Å; Q85-Y87 PolarHBondContact O-N 2.87Å; Q85-V88 PolarHBondContact O-N 3.45Å; Q85-F89 HydrophobicContact CG-CD2 4.45Å; Q85-F89 HydrophobicContact CG-CE2 3.75Å; Q85-F89 HydrophobicContact CG-CZ 4.19Å; Q85-F89 VanDerWaalsContact O-CD2 3.25Å; Q85-F89 WeakPolarHBondContact O-CD2 3.3Å; Q85-F89 PolarHBondContact O-N 2.87Å; Q85-L628 HydrophobicContact CB-CD2 4.25Å; Q85-L628 PolarHBondContact NE2-O 3.02Å; Q85-L628 VanDerWaalsContact NE2-O 3.12Å; Q85-F636 HydrophobicContact CG-CD1 4.29Å; Q85-F636 HydrophobicContact CG-CE1 3.7Å; Q85-F636 HydrophobicContact CG-CZ 3.88Å
86	I	92	Very high	88	Confident	0 Å²	0	38 Å²	38	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-44.4	171.9	-67.4	169.3	0	0	0	109.8	T82 V88 F89 V90 L246 L641 I644 L645	T82-I86 HydrophobicContact CG2-CD1 4Å; T82-I86 VanDerWaalsContact O-CG1 3.32Å; T82-I86 WeakPolarHBondContact O-CG1 3.28Å; T82-I86 PolarHBondContact O-N 2.83Å; I86-V88 PolarHBondContact O-N 3.37Å; I86-F89 PolarHBondContact O-N 2.89Å; I86-V90 HydrophobicContact CG2-CG2 4.29Å; I86-V90 WeakPolarHBondContact O-CG2 3.27Å; I86-V90 PolarHBondContact O-N 2.82Å; I86-L246 HydrophobicContact CB-CD1 4.31Å; I86-L246 HydrophobicContact CG2-CD1 3.77Å; I86-L246 HydrophobicContact CG2-CD2 4.43Å; I86-L641 HydrophobicContact CD1-CB 4.49Å; I86-L641 HydrophobicContact CD1-CD2 4.11Å; I86-L641 HydrophobicContact CG1-CB 4.16Å; I86-L641 HydrophobicContact CG1-CD2 3.88Å; I86-L641 HydrophobicContact CG1-CG 4.47Å; I86-I644 HydrophobicContact CD1-CB 3.91Å; I86-I644 HydrophobicContact CD1-CG2 3.69Å; I86-L645 HydrophobicContact CG2-CB 3.89Å; I86-L645 HydrophobicContact CG2-CD1 3.84Å; I86-L645 HydrophobicContact CG2-CD2 4.18Å; I86-L645 HydrophobicContact CG2-CG 4.18Å
87	Y	92.4	Very high	88	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65	-34.5	179.5	-165.6	-119.7	0	0	0	113.2	K83 L84 Q85 F89 V90 L91 Y239 F242 Q243 L246 I248 H253 L256	K83-Y87 WeakPolarHBondContact O-CB 3.45Å; K83-Y87 PolarHBondContact O-N 3.33Å; L84-Y87 WeakPolarHBondContact O-CB 3.39Å; L84-Y87 PolarHBondContact O-N 2.94Å; L84-Y87 VanDerWaalsContact O-N 3.13Å; Q85-Y87 VanDerWaalsContact C-N 3.29Å; Q85-Y87 PolarHBondContact O-N 2.87Å; Y87-F89 VanDerWaalsContact C-N 3.34Å; Y87-F89 PolarHBondContact O-N 3.2Å; Y87-V90 HydrophobicContact CD2-CG1 4.49Å; Y87-V90 PolarHBondContact O-N 3.07Å; Y87-L91 HydrophobicContact CD1-CD1 3.7Å; Y87-L91 HydrophobicContact CD1-CG 3.96Å; Y87-L91 HydrophobicContact CE1-CD1 3.67Å; Y87-L91 HydrophobicContact CE1-CD2 3.87Å; Y87-L91 HydrophobicContact CE1-CG 3.78Å; Y87-L91 HydrophobicContact CE2-CD2 4.49Å; Y87-L91 HydrophobicContact CE2-CG 4.44Å; Y87-L91 HydrophobicContact CG-CD1 4.47Å; Y87-L91 HydrophobicContact CG-CG 4.38Å; Y87-L91 WeakPolarHBondContact O-CB 3.47Å; Y87-L91 VanDerWaalsContact O-CG 3.23Å; Y87-L91 WeakPolarHBondContact O-CG 3.38Å; Y87-L91 PolarHBondContact O-N 3.38Å; Y87-Y239 PolarHBondContact OH-O 3.05Å; Y87-F242 HydrophobicContact CD2-CB 4.48Å; Y87-F242 HydrophobicContact CE2-CB 3.98Å; Y87-Q243 HydrophobicContact CE2-CB 4.49Å; Y87-L246 HydrophobicContact CD2-CD1 4.03Å; Y87-L246 HydrophobicContact CG-CD1 4.46Å; Y87-I248 HydrophobicContact CD1-CB 4.38Å; Y87-I248 HydrophobicContact CD1-CG1 3.97Å; Y87-I248 HydrophobicContact CD1-CG2 3.99Å; Y87-I248 HydrophobicContact CD2-CG1 4.24Å; Y87-I248 HydrophobicContact CE1-CB 4.48Å; Y87-I248 HydrophobicContact CE1-CG1 4.45Å; Y87-I248 HydrophobicContact CE1-CG2 4.11Å; Y87-I248 HydrophobicContact CG-CG1 3.84Å; Y87-H253 HydrophobicContact CE1-CB 4.17Å; Y87-H253 AromaticContact CE1-ND1 3.77Å; Y87-H253 AromaticContact CZ-ND1 3.73Å; Y87-H253 PolarHBondContact OH-ND1 3.35Å; Y87-L256 HydrophobicContact CD1-CD1 4.14Å
88	V	90.5	Very high	87.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57.7	-46	171.4	174.2	0	0	0	0	111.3	L84 Q85 I86 L91 R92 L256 L628	L84-V88 PolarHBondContact O-N 2.94Å; Q85-V88 PolarHBondContact O-N 3.45Å; I86-V88 PolarHBondContact O-N 3.37Å; V88-L91 PolarHBondContact O-N 3.44Å; V88-R92 WeakPolarHBondContact O-CG 3.25Å; V88-R92 PolarHBondContact O-N 2.61Å; V88-L256 HydrophobicContact CG2-CD1 3.89Å; V88-L256 HydrophobicContact CG2-CD2 3.74Å; V88-L256 HydrophobicContact CG2-CG 4.37Å; V88-L628 HydrophobicContact CG2-CB 4.42Å
89	F	91.3	Very high	87.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.1	-41.5	178.7	-62.7	-45.5	0	0	0	112.4	Q85 I86 Y87 R92 C93 P633 F636 H638 L641 Y675 Y679	Q85-F89 HydrophobicContact CG-CD2 4.45Å; Q85-F89 HydrophobicContact CG-CE2 3.75Å; Q85-F89 HydrophobicContact CG-CZ 4.19Å; Q85-F89 VanDerWaalsContact O-CD2 3.25Å; Q85-F89 WeakPolarHBondContact O-CD2 3.3Å; Q85-F89 PolarHBondContact O-N 2.87Å; I86-F89 PolarHBondContact O-N 2.89Å; Y87-F89 VanDerWaalsContact C-N 3.34Å; Y87-F89 PolarHBondContact O-N 3.2Å; F89-R92 PolarHBondContact O-N 3.15Å; F89-C93 PolarHBondContact O-N 3.42Å; F89-P633 HydrophobicContact CE1-CB 4.01Å; F89-P633 HydrophobicContact CE1-CG 4.01Å; F89-F636 HydrophobicContact CE2-CD2 4.22Å; F89-F636 HydrophobicContact CE2-CG 4.26Å; F89-F636 AromaticContact CZ-CD2 3.63Å; F89-F636 HydrophobicContact CZ-CD2 3.63Å; F89-F636 AromaticContact CZ-CE2 3.83Å; F89-F636 HydrophobicContact CZ-CE2 3.83Å; F89-F636 HydrophobicContact CZ-CG 4.12Å; F89-F636 HydrophobicContact CZ-CZ 4.49Å; F89-H638 AromaticContact CD2-CE1 3.81Å; F89-H638 AromaticContact CE2-CE1 3.7Å; F89-H638 AromaticContact CZ-CE1 3.89Å; F89-L641 HydrophobicContact CD2-CD1 4.4Å; F89-L641 HydrophobicContact CE2-CD1 3.95Å; F89-Y675 HydrophobicContact CB-CD2 4.33Å; F89-Y675 HydrophobicContact CB-CE2 3.63Å; F89-Y679 HydrophobicContact CB-CE2 3.76Å; F89-Y679 HydrophobicContact CD1-CE1 4.05Å; F89-Y679 AromaticContact CD1-CZ 3.86Å; F89-Y679 HydrophobicContact CG-CE2 4.37Å; F89-Y679 PolarHBondContact O-OH 2.96Å
90	V	91.4	Very high	87.8	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-43.2	174.4	170.2	0	0	0	0	111.8	I86 Y87 R92 C93 I94 F242 L645 V671 Y675	I86-V90 HydrophobicContact CG2-CG2 4.29Å; I86-V90 WeakPolarHBondContact O-CG2 3.27Å; I86-V90 PolarHBondContact O-N 2.82Å; Y87-V90 HydrophobicContact CD2-CG1 4.49Å; Y87-V90 PolarHBondContact O-N 3.07Å; V90-R92 VanDerWaalsContact C-N 3.31Å; V90-R92 PolarHBondContact O-N 3.46Å; V90-C93 WeakPolarHBondContact O-CB 3.41Å; V90-C93 PolarHBondContact O-N 3.05Å; V90-C93 VanDerWaalsContact O-N 3.17Å; V90-I94 HydrophobicContact CG1-CD1 3.89Å; V90-I94 WeakPolarHBondContact O-CG1 3.47Å; V90-I94 PolarHBondContact O-N 2.98Å; V90-I94 VanDerWaalsContact O-N 3.08Å; V90-F242 HydrophobicContact CG1-CB 3.79Å; V90-F242 HydrophobicContact CG1-CD1 3.89Å; V90-F242 HydrophobicContact CG1-CD2 4.21Å; V90-F242 HydrophobicContact CG1-CG 3.68Å; V90-L645 HydrophobicContact CG2-CD1 4.02Å; V90-L645 HydrophobicContact CG2-CD2 3.73Å; V90-V671 HydrophobicContact CG1-CG1 3.89Å; V90-Y675 HydrophobicContact CG2-CD2 4.27Å
91	L	90.1	Very high	87.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.5	-45.3	175.6	-79.1	171	0	0	0	111	Y87 V88 C93 I94 S95 Y239 L256 C260	Y87-L91 HydrophobicContact CD1-CD1 3.7Å; Y87-L91 HydrophobicContact CD1-CG 3.96Å; Y87-L91 HydrophobicContact CE1-CD1 3.67Å; Y87-L91 HydrophobicContact CE1-CD2 3.87Å; Y87-L91 HydrophobicContact CE1-CG 3.78Å; Y87-L91 HydrophobicContact CE2-CD2 4.49Å; Y87-L91 HydrophobicContact CE2-CG 4.44Å; Y87-L91 HydrophobicContact CG-CD1 4.47Å; Y87-L91 HydrophobicContact CG-CG 4.38Å; Y87-L91 WeakPolarHBondContact O-CB 3.47Å; Y87-L91 VanDerWaalsContact O-CG 3.23Å; Y87-L91 WeakPolarHBondContact O-CG 3.38Å; Y87-L91 PolarHBondContact O-N 3.38Å; V88-L91 PolarHBondContact O-N 3.44Å; L91-C93 VanDerWaalsContact C-N 3.33Å; L91-C93 PolarHBondContact O-N 3.36Å; L91-I94 PolarHBondContact O-N 2.82Å; L91-S95 WeakPolarHBondContact O-CB 3.48Å; L91-S95 PolarHBondContact O-N 3.04Å; L91-S95 PolarHBondContact O-OG 3.23Å; L91-S95 VanDerWaalsContact O-OG 3.13Å; L91-Y239 HydrophobicContact CD2-CD1 3.54Å; L91-Y239 HydrophobicContact CD2-CE1 3.62Å; L91-L256 HydrophobicContact CD1-CB 3.42Å; L91-L256 VanDerWaalsContact CD1-CB 3.42Å; L91-L256 HydrophobicContact CD1-CD1 4.33Å; L91-C260 HydrophobicContact CB-CB 4.49Å
92	R	88.9	Confident	86.8	Confident	16 Å²	16	24 Å²	24	6%	0.06	12%	0.121	C	C	.	.	H	α-helix	trans	-61.9	-37.5	177.8	-67.4	-177	-165.6	-178.6	10.7	112.8	V88 F89 V90 Y96 E275 I629 R678	V88-R92 WeakPolarHBondContact O-CG 3.25Å; V88-R92 PolarHBondContact O-N 2.61Å; F89-R92 PolarHBondContact O-N 3.15Å; V90-R92 VanDerWaalsContact C-N 3.31Å; V90-R92 PolarHBondContact O-N 3.46Å; R92-Y96 WeakPolarHBondContact CG-OH 3.48Å; R92-Y96 PolarHBondContact O-N 3.47Å; R92-E275 WeakPolarHBondContact CD-OE1 3.49Å; R92-E275 IonicContact CZ-OE1 2.76Å; R92-E275 IonicContact NE-OE1 2.72Å; R92-E275 IonicContact NH1-OE1 2.96Å; R92-E275 PolarHBondContact NH1-OE1 3.16Å; R92-I629 PolarHBondContact NH2-O 3.34Å; R92-R678 PolarHBondContact O-NH1 3.2Å
93	C	89.1	Confident	86	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-65.7	-37.7	174.2	-68.5	0	0	0	0	112.9	F89 V90 L91 P97 E674	F89-C93 PolarHBondContact O-N 3.42Å; V90-C93 WeakPolarHBondContact O-CB 3.41Å; V90-C93 PolarHBondContact O-N 3.05Å; V90-C93 VanDerWaalsContact O-N 3.17Å; L91-C93 VanDerWaalsContact C-N 3.33Å; L91-C93 PolarHBondContact O-N 3.36Å; C93-P97 WeakPolarHBondContact O-CB 3.4Å; C93-E674 HydrophobicContact CB-CB 4.22Å; C93-E674 HydrophobicContact CB-CG 3.87Å
94	I	88.6	Confident	84.6	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-78.8	-36.5	178.4	-58.4	163.6	0	0	0	111.5	V90 L91 K235 L238 Y239 F242 V671	V90-I94 HydrophobicContact CG1-CD1 3.89Å; V90-I94 WeakPolarHBondContact O-CG1 3.47Å; V90-I94 PolarHBondContact O-N 2.98Å; V90-I94 VanDerWaalsContact O-N 3.08Å; L91-I94 PolarHBondContact O-N 2.82Å; I94-K235 HydrophobicContact CG2-CB 4.14Å; I94-K235 HydrophobicContact CG2-CG 4.21Å; I94-K235 WeakPolarHBondContact O-CD 3.46Å; I94-K235 WeakPolarHBondContact O-CE 3.37Å; I94-L238 HydrophobicContact CD1-CB 4Å; I94-L238 HydrophobicContact CG1-CB 4.26Å; I94-L238 HydrophobicContact CG2-CB 3.96Å; I94-L238 HydrophobicContact CG2-CD1 4.29Å; I94-Y239 HydrophobicContact CB-CD1 4.06Å; I94-Y239 HydrophobicContact CB-CE1 3.53Å; I94-Y239 HydrophobicContact CD1-CD1 3.9Å; I94-Y239 HydrophobicContact CD1-CE1 4.23Å; I94-Y239 HydrophobicContact CG1-CE1 4.5Å; I94-Y239 HydrophobicContact CG2-CD1 3.77Å; I94-Y239 HydrophobicContact CG2-CD2 4.43Å; I94-Y239 HydrophobicContact CG2-CE1 3.38Å; I94-Y239 HydrophobicContact CG2-CE2 4.05Å; I94-Y239 HydrophobicContact CG2-CG 4.29Å; I94-F242 HydrophobicContact CD1-CD2 4.16Å; I94-V671 HydrophobicContact CD1-CG2 4.3Å; I94-V671 HydrophobicContact CG1-CG1 4.38Å; I94-V671 HydrophobicContact CG1-CG2 3.79Å
95	S	84.2	Confident	82.9	Confident	7 Å²	7	33 Å²	33	5%	0.049	18%	0.175	C	C	.	.	H	α-helix	trans	-59.8	-49.8	-179.7	-74.8	0	0	0	0	112.3	L91 K235 Y239 C260	L91-S95 WeakPolarHBondContact O-CB 3.48Å; L91-S95 PolarHBondContact O-N 3.04Å; L91-S95 PolarHBondContact O-OG 3.23Å; L91-S95 VanDerWaalsContact O-OG 3.13Å; S95-K235 PolarHBondContact O-NZ 2.73Å; S95-Y239 VanDerWaalsContact CA-OH 3.28Å; S95-Y239 WeakPolarHBondContact CA-OH 3.35Å; S95-Y239 PolarHBondContact N-OH 2.91Å; S95-Y239 PolarHBondContact OG-OH 3.32Å; S95-C260 PolarHBondContact OG-O 3.41Å
96	Y	84.2	Confident	81.3	Confident	9 Å²	9	35.1 Å²	35.1	4%	0.035	19%	0.185	C	C	.	.	S	Bend	trans	-144.2	76.2	-176.4	44.2	-88.2	0	0	0	111.2	R92 L262 Q268 Q271 I272 R678	R92-Y96 WeakPolarHBondContact CG-OH 3.48Å; R92-Y96 PolarHBondContact O-N 3.47Å; Y96-L262 HydrophobicContact CE1-CD1 4.21Å; Y96-Q268 HydrophobicContact CD1-CB 4.48Å; Y96-Q268 HydrophobicContact CD1-CG 4.07Å; Y96-Q268 HydrophobicContact CD2-CB 4.27Å; Y96-Q268 HydrophobicContact CG-CB 3.96Å; Y96-Q268 HydrophobicContact CG-CG 3.96Å; Y96-Q271 HydrophobicContact CE2-CB 4.34Å; Y96-Q271 HydrophobicContact CE2-CG 4.05Å; Y96-Q271 VanDerWaalsContact OH-CG 3.24Å; Y96-Q271 WeakPolarHBondContact OH-CG 3.29Å; Y96-I272 HydrophobicContact CD2-CD1 3.83Å; Y96-I272 HydrophobicContact CD2-CG1 3.72Å; Y96-I272 HydrophobicContact CE2-CD1 4.43Å; Y96-I272 HydrophobicContact CE2-CG1 3.81Å; Y96-R678 VanDerWaalsContact CE2-NH1 3.25Å; Y96-R678 PolarHBondContact OH-NH2 3.05Å; Y96-R678 VanDerWaalsContact OH-NH2 3.09Å
97	P	81.9	Confident	79.5	Confident	45 Å²	45	39.6 Å²	39.6	29%	0.292	22%	0.222	S	C	.	.			trans	-73.7	148.7	174.4	31.1	-35.6	0	0	0	111.4	C93 F670 E674	C93-P97 WeakPolarHBondContact O-CB 3.4Å; P97-F670 HydrophobicContact CB-CE2 4.18Å; P97-F670 HydrophobicContact CB-CZ 3.69Å; P97-F670 HydrophobicContact CG-CZ 3.92Å; P97-E674 VanDerWaalsContact CA-OE1 3.26Å; P97-E674 WeakPolarHBondContact CA-OE1 3.47Å; P97-E674 HydrophobicContact CB-CG 4.42Å
98	F	80.9	Confident	77.6	Confident	20 Å²	20	50 Å²	50	9%	0.088	26%	0.262	C	S	.	.			trans	-139.1	-26	-178.8	68.9	-79.2	0	0	0	115.1	I272 L315 L319 L322 E674 R678	F98-I272 HydrophobicContact CB-CD1 4.26Å; F98-I272 HydrophobicContact CD1-CD1 3.58Å; F98-I272 HydrophobicContact CD1-CG1 4.28Å; F98-I272 HydrophobicContact CD1-CG2 4.22Å; F98-I272 HydrophobicContact CE1-CD1 4.12Å; F98-I272 HydrophobicContact CE1-CG1 4.34Å; F98-I272 HydrophobicContact CE1-CG2 3.73Å; F98-I272 HydrophobicContact CE2-CG2 4.32Å; F98-I272 HydrophobicContact CG-CD1 4.04Å; F98-I272 HydrophobicContact CZ-CG2 3.78Å; F98-L315 HydrophobicContact CE2-CB 4.05Å; F98-L315 HydrophobicContact CE2-CD2 3.87Å; F98-L315 WeakPolarHBondContact CE2-O 3.46Å; F98-L315 HydrophobicContact CZ-CB 4.41Å; F98-L315 HydrophobicContact CZ-CD2 4.09Å; F98-L319 HydrophobicContact CB-CD1 3.37Å; F98-L319 HydrophobicContact CD1-CD1 4.24Å; F98-L319 HydrophobicContact CD2-CB 4.07Å; F98-L319 HydrophobicContact CD2-CD1 3.57Å; F98-L319 HydrophobicContact CD2-CG 4.4Å; F98-L319 HydrophobicContact CE2-CD1 4.38Å; F98-L319 HydrophobicContact CG-CD1 3.48Å; F98-L319 VanDerWaalsContact CG-CD1 3.48Å; F98-L322 HydrophobicContact CB-CD1 4.36Å; F98-E674 WeakPolarHBondContact CD1-OE1 3.47Å; F98-E674 PolarHBondContact N-OE1 2.72Å; F98-R678 HydrophobicContact CE1-CG 4.41Å
99	N	84.1	Confident	76.1	Confident	50 Å²	50	54.2 Å²	54.2	27%	0.267	28%	0.278	S	S	.	.	S	Bend	trans	-103.7	-52.9	-171.9	-178.2	79.6	0	0	0	112.9	L315 N318 E674 A677	N99-L315 HydrophobicContact CB-CD2 3.97Å; N99-L315 WeakPolarHBondContact OD1-CD2 3.44Å; N99-N318 PolarHBondContact OD1-ND2 3.41Å; N99-E674 WeakPolarHBondContact CB-OE2 3.42Å; N99-E674 PolarHBondContact N-OE1 3.46Å; N99-E674 PolarHBondContact N-OE2 2.86Å; N99-A677 HydrophobicContact CB-CB 4.49Å; N99-A677 WeakPolarHBondContact ND2-CB 3.47Å
100	A	81.4	Confident	74.8	Confident	18 Å²	18	58.1 Å²	58.1	15%	0.149	30%	0.296	C	S	.	.			trans	-78.2	160.8	-177.9	0	0	0	0	0	113.1	F670 D673 E674	A100-F670 HydrophobicContact CB-CD2 3.7Å; A100-F670 HydrophobicContact CB-CE2 3.99Å; A100-F670 WeakPolarHBondContact O-CE2 3.3Å; A100-D673 HydrophobicContact CB-CB 4.02Å; A100-E674 HydrophobicContact CB-CB 4.11Å; A100-E674 WeakPolarHBondContact CB-OE2 3.36Å; A100-E674 PolarHBondContact N-OE2 2.95Å
101	K	79.4	Confident	73.7	Confident	180 Å²	180	63.7 Å²	63.7	78%	0.783	32%	0.322	S	S	*	.			trans	-137	142.2	174.5	-65.6	170.8	-173.2	161.9	0	108.4	P103	K101-P103 WeakPolarHBondContact O-CD 3.44Å
102	Q	73.8	Confident	73.2	Confident	39 Å²	39	65.2 Å²	65.2	18%	0.182	33%	0.329	C	S	.	.			trans	-65.8	123.6	-179.8	-68.5	-172.2	34.8	0	0	110.7	T104 L233 F670	Q102-T104 PolarHBondContact O-N 3.35Å; Q102-L233 PolarHBondContact NE2-O 2.82Å; Q102-F670 HydrophobicContact CG-CB 3.79Å; Q102-F670 HydrophobicContact CG-CD1 3.82Å; Q102-F670 HydrophobicContact CG-CD2 4.01Å; Q102-F670 HydrophobicContact CG-CE1 4.43Å; Q102-F670 HydrophobicContact CG-CG 3.59Å
103	P	71.3	Confident	72.7	Confident	40 Å²	40	64.6 Å²	64.6	26%	0.26	33%	0.327	S	S	.	.			trans	-66.5	120.8	-179.6	-23.5	34.7	0	0	0	112.7	K101 M106 P666 V669	K101-P103 WeakPolarHBondContact O-CD 3.44Å; P103-M106 HydrophobicContact CB-CG 4.09Å; P103-M106 HydrophobicContact CB-SD 4.21Å; P103-P666 WeakPolarHBondContact O-CB 3.34Å; P103-V669 HydrophobicContact CG-CG1 4.15Å
104	T	62.3	Low	72.3	Confident	95 Å²	95	68.2 Å²	68.2	58%	0.583	35%	0.346	S	S	*	.	S	Bend	trans	-87.8	-6.4	180	53.2	0	0	0	0	114.3	Q102 L231 I232	Q102-T104 PolarHBondContact O-N 3.35Å; T104-L231 WeakPolarHBondContact O-CD2 3.47Å; T104-I232 HydrophobicContact CG2-CD1 4.19Å; T104-I232 HydrophobicContact CG2-CG1 4.4Å
105	D	54.3	Low	72.1	Confident	160 Å²	160	75 Å²	75	86%	0.856	38%	0.375	S	S	*	.			trans	-106.8	10.5	-168.7	-154.4	29.5	0	0	0	113.5
106	M	56.3	Low	72.1	Confident	56 Å²	56	82.2 Å²	82.2	28%	0.276	41%	0.408	S	S	.	.	S	Bend	trans	-80.9	129.5	175.5	-59.6	-172.4	79.7	0	0	110.2	P103 W663 F664 P666 V669	P103-M106 HydrophobicContact CB-CG 4.09Å; P103-M106 HydrophobicContact CB-SD 4.21Å; M106-W663 HydrophobicContact CE-CE3 4.37Å; M106-F664 WeakPolarHBondContact CE-O 3.25Å; M106-P666 HydrophobicContact CB-CG 4.05Å; M106-P666 HydrophobicContact CG-CG 4.23Å; M106-P666 HydrophobicContact SD-CB 4.37Å; M106-P666 HydrophobicContact SD-CG 3.82Å; M106-V669 HydrophobicContact CE-CG2 4.47Å; M106-V669 HydrophobicContact SD-CG2 4.37Å
107	A	52.3	Low	72	Confident	94 Å²	94	85.1 Å²	85.1	78%	0.777	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-57.7	156.9	-167.9	0	0	0	0	0	115	R109	A107-R109 PolarHBondContact O-N 3.3Å
108	R	53.6	Low	72.1	Confident	219 Å²	219	83.2 Å²	83.2	83%	0.826	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-56.6	123.4	-179.6	-70.8	-174.1	177.5	-171	0.1	111.1	Q110	R108-Q110 PolarHBondContact O-N 2.99Å
109	R	59.3	Low	72.4	Confident	89 Å²	89	86.9 Å²	86.9	34%	0.336	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-67.1	130	177.8	-51.3	-179	-160.3	167.2	15.1	109.5	A107 E230 F658	A107-R109 PolarHBondContact O-N 3.3Å; R109-E230 PolarHBondContact NH2-O 3.36Å; R109-F658 HydrophobicContact CB-CB 4.3Å; R109-F658 HydrophobicContact CB-CD1 3.65Å; R109-F658 HydrophobicContact CB-CE1 4.21Å; R109-F658 HydrophobicContact CB-CG 4.06Å
110	Q	64.4	Low	72.6	Confident	81 Å²	81	87.4 Å²	87.4	38%	0.379	43%	0.432	S	S	.	.			trans	-104.9	140	173.3	-66.6	179	-19.3	0	0	109.5	R108 S168 F658 S659	R108-Q110 PolarHBondContact O-N 2.99Å; Q110-S168 PolarHBondContact OE1-OG 3.1Å; Q110-S168 VanDerWaalsContact OE1-OG 3.12Å; Q110-F658 WeakPolarHBondContact O-CA 3.47Å; Q110-S659 PolarHBondContact O-N 3.33Å
111	Q	67.7	Low	72.9	Confident	117 Å²	117	86.9 Å²	86.9	55%	0.547	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-68.1	134.1	-178.9	-168.5	175.7	-3.1	0	0	110.2	S168	Q111-S168 WeakPolarHBondContact O-CA 3.3Å; Q111-S168 WeakPolarHBondContact O-CB 3.46Å
112	K	79.4	Confident	73.4	Confident	33 Å²	33	79.9 Å²	79.9	14%	0.143	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-70.4	135.9	176.3	171.9	172.9	167.4	170	0	109.6	Q117 G165 M654 S657	K112-Q117 PolarHBondContact O-OE1 3.2Å; K112-G165 WeakPolarHBondContact CD-O 3.14Å; K112-G165 VanDerWaalsContact CE-CA 3.48Å; K112-M654 PolarHBondContact NZ-O 2.96Å; K112-S657 WeakPolarHBondContact CB-O 3.48Å; K112-S657 PolarHBondContact N-O 2.96Å
113	V	78.6	Confident	74.1	Confident	3 Å²	3	82.4 Å²	82.4	2%	0.018	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-79.9	120.7	172	-179.4	0	0	0	0	108.3	Q117 L118 V162 C167 F172	V113-Q117 HydrophobicContact CG1-CB 4.13Å; V113-L118 HydrophobicContact CG1-CB 4.21Å; V113-V162 HydrophobicContact CB-CG2 4.4Å; V113-V162 HydrophobicContact CG1-CG2 4.23Å; V113-C167 PolarHBondContact N-O 3.13Å; V113-F172 HydrophobicContact CB-CE2 4.27Å; V113-F172 HydrophobicContact CG1-CE2 4.32Å; V113-F172 HydrophobicContact CG1-CZ 4.17Å; V113-F172 HydrophobicContact CG2-CD2 4.31Å; V113-F172 HydrophobicContact CG2-CE2 3.99Å
114	N	81.4	Confident	75	Confident	76 Å²	76	83 Å²	83	41%	0.406	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-89.1	160.7	173.5	-75.7	-23.2	0	0	0	111.7	Q116 Q117 L118	N114-Q116 PolarHBondContact O-N 2.91Å; N114-Q116 VanDerWaalsContact O-N 3.15Å; N114-Q117 PolarHBondContact O-N 2.89Å; N114-L118 PolarHBondContact O-N 3.16Å
115	K	83.4	Confident	76.3	Confident	145 Å²	145	78.4 Å²	78.4	63%	0.63	38%	0.379	S	S	*	.	H	α-helix	trans	-53	-37.7	-179.8	-174.9	176.2	178.9	177.9	0	113.7	Q119	K115-Q119 PolarHBondContact O-N 3.01Å
116	Q	83.4	Confident	77.9	Confident	158 Å²	158	73.9 Å²	73.9	74%	0.738	36%	0.355	S	S	*	.	H	α-helix	trans	-66.1	-44.7	174.9	-72.9	170.9	-38.2	0	0	112	N114 L118 Q119 T120	N114-Q116 PolarHBondContact O-N 2.91Å; N114-Q116 VanDerWaalsContact O-N 3.15Å; Q116-L118 PolarHBondContact O-N 3.02Å; Q116-Q119 WeakPolarHBondContact O-CB 3.44Å; Q116-Q119 PolarHBondContact O-N 2.94Å; Q116-Q119 VanDerWaalsContact O-N 3.08Å; Q116-T120 PolarHBondContact O-N 3.48Å; Q116-T120 PolarHBondContact O-OG1 2.83Å
117	Q	82.2	Confident	79.4	Confident	69 Å²	69	72.1 Å²	72.1	32%	0.322	35%	0.349	S	S	.	.	H	α-helix	trans	-65.8	-37.6	178.3	-67.7	168.7	-48.4	0	0	111.9	K112 V113 N114 Q119 T120 V121	K112-Q117 PolarHBondContact O-OE1 3.2Å; V113-Q117 HydrophobicContact CG1-CB 4.13Å; N114-Q117 PolarHBondContact O-N 2.89Å; Q117-Q119 VanDerWaalsContact C-N 3.26Å; Q117-Q119 PolarHBondContact O-N 3.29Å; Q117-T120 PolarHBondContact O-N 2.85Å; Q117-V121 WeakPolarHBondContact O-CB 3.12Å; Q117-V121 VanDerWaalsContact O-CG2 3.28Å; Q117-V121 WeakPolarHBondContact O-CG2 3.42Å; Q117-V121 PolarHBondContact O-N 2.92Å
118	L	85.6	Confident	81.1	Confident	6 Å²	6	68.2 Å²	68.2	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-58.4	-39.8	170.9	170.2	62.7	0	0	0	111.4	V113 N114 Q116 K122 V158 V162 F172	V113-L118 HydrophobicContact CG1-CB 4.21Å; N114-L118 PolarHBondContact O-N 3.16Å; Q116-L118 PolarHBondContact O-N 3.02Å; L118-K122 WeakPolarHBondContact O-CG 3.35Å; L118-K122 PolarHBondContact O-N 3.11Å; L118-V158 HydrophobicContact CD1-CG1 4.37Å; L118-V162 HydrophobicContact CB-CG1 4.17Å; L118-V162 HydrophobicContact CD2-CB 4.08Å; L118-V162 HydrophobicContact CD2-CG1 4.06Å; L118-V162 HydrophobicContact CD2-CG2 4.08Å; L118-F172 HydrophobicContact CD1-CE1 3.88Å; L118-F172 HydrophobicContact CD1-CZ 3.95Å
119	Q	86.5	Confident	82.7	Confident	96 Å²	96	59.8 Å²	59.8	45%	0.449	29%	0.286	S	S	.	.	H	α-helix	trans	-67.7	-47.5	178.5	-176	57.4	31.9	0	0	111.5	K115 Q116 Q117 V121 K122 E123	K115-Q119 PolarHBondContact O-N 3.01Å; Q116-Q119 WeakPolarHBondContact O-CB 3.44Å; Q116-Q119 PolarHBondContact O-N 2.94Å; Q116-Q119 VanDerWaalsContact O-N 3.08Å; Q117-Q119 VanDerWaalsContact C-N 3.26Å; Q117-Q119 PolarHBondContact O-N 3.29Å; Q119-V121 VanDerWaalsContact C-N 3.31Å; Q119-V121 PolarHBondContact O-N 3.47Å; Q119-K122 WeakPolarHBondContact O-CB 3.16Å; Q119-K122 PolarHBondContact O-N 3.44Å; Q119-E123 VanDerWaalsContact CG-OE1 3.3Å; Q119-E123 WeakPolarHBondContact CG-OE1 3.33Å; Q119-E123 PolarHBondContact NE2-OE1 2.87Å; Q119-E123 PolarHBondContact O-N 2.99Å
120	T	87.9	Confident	84	Confident	62 Å²	62	60.8 Å²	60.8	38%	0.38	30%	0.298	S	S	.	.	H	α-helix	trans	-59	-39.2	174.2	-52.2	0	0	0	0	112.6	Q116 Q117 K122 E123 H124	Q116-T120 PolarHBondContact O-N 3.48Å; Q116-T120 PolarHBondContact O-OG1 2.83Å; Q117-T120 PolarHBondContact O-N 2.85Å; T120-K122 VanDerWaalsContact C-N 3.35Å; T120-K122 PolarHBondContact O-N 3.5Å; T120-E123 WeakPolarHBondContact CA-OE2 3.3Å; T120-E123 PolarHBondContact O-N 2.96Å; T120-H124 WeakPolarHBondContact CG2-NE2 3.4Å; T120-H124 PolarHBondContact O-CD2 3.18Å; T120-H124 VanDerWaalsContact O-CG 3.32Å; T120-H124 PolarHBondContact O-N 3.39Å
121	V	87.9	Confident	84.8	Confident	6 Å²	6	59.8 Å²	59.8	4%	0.036	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-36.1	174.4	169	0	0	0	0	111.6	Q117 Q119 F125 L153 Y210	Q117-V121 WeakPolarHBondContact O-CB 3.12Å; Q117-V121 VanDerWaalsContact O-CG2 3.28Å; Q117-V121 WeakPolarHBondContact O-CG2 3.42Å; Q117-V121 PolarHBondContact O-N 2.92Å; Q119-V121 VanDerWaalsContact C-N 3.31Å; Q119-V121 PolarHBondContact O-N 3.47Å; V121-F125 HydrophobicContact CG1-CD2 4.03Å; V121-F125 HydrophobicContact CG1-CE2 4.06Å; V121-F125 WeakPolarHBondContact O-CD2 3.42Å; V121-F125 PolarHBondContact O-N 3.24Å; V121-F125 VanDerWaalsContact O-N 3.13Å; V121-L153 HydrophobicContact CG1-CD1 4.5Å; V121-L153 HydrophobicContact CG1-CD2 4.2Å; V121-Y210 HydrophobicContact CG1-CD2 4.04Å; V121-Y210 HydrophobicContact CG1-CE2 4Å; V121-Y210 HydrophobicContact CG2-CD2 4.04Å; V121-Y210 HydrophobicContact CG2-CE1 4.37Å; V121-Y210 HydrophobicContact CG2-CE2 3.67Å
122	K	89.3	Confident	85.3	Confident	33 Å²	33	60.5 Å²	60.5	14%	0.143	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-44	172.3	-71.1	175	-175.5	-145.5	0	111.5	L118 Q119 T120 F125 L126 Y149 L153	L118-K122 WeakPolarHBondContact O-CG 3.35Å; L118-K122 PolarHBondContact O-N 3.11Å; Q119-K122 WeakPolarHBondContact O-CB 3.16Å; Q119-K122 PolarHBondContact O-N 3.44Å; T120-K122 VanDerWaalsContact C-N 3.35Å; T120-K122 PolarHBondContact O-N 3.5Å; K122-F125 PolarHBondContact O-N 2.68Å; K122-L126 WeakPolarHBondContact O-CG 3.13Å; K122-L126 PolarHBondContact O-N 3.3Å; K122-Y149 HydrophobicContact CB-CE2 4.12Å; K122-Y149 HydrophobicContact CG-CE2 4.3Å; K122-L153 WeakPolarHBondContact CE-O 3.23Å; K122-L153 HydrophobicContact CG-CB 4.42Å; K122-L153 PolarHBondContact NZ-O 2.91Å
123	E	89.3	Confident	85.4	Confident	92 Å²	92	60.4 Å²	60.4	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-62.9	-44.1	179.2	-72.4	151.4	-173.6	0	0	111.6	Q119 T120 F125 L126 A127	Q119-E123 VanDerWaalsContact CG-OE1 3.3Å; Q119-E123 WeakPolarHBondContact CG-OE1 3.33Å; Q119-E123 PolarHBondContact NE2-OE1 2.87Å; Q119-E123 PolarHBondContact O-N 2.99Å; T120-E123 WeakPolarHBondContact CA-OE2 3.3Å; T120-E123 PolarHBondContact O-N 2.96Å; E123-F125 VanDerWaalsContact C-N 3.34Å; E123-F125 PolarHBondContact O-N 3.11Å; E123-L126 PolarHBondContact O-N 3.44Å; E123-A127 WeakPolarHBondContact O-CB 3.36Å; E123-A127 PolarHBondContact O-N 2.82Å
124	H	89.9	Confident	85.2	Confident	52 Å²	52	68.4 Å²	68.4	24%	0.241	35%	0.352	C	S	.	.	H	α-helix	trans	-59.7	-41.3	173.5	-67.3	-179.2	0	0	0	112.9	T120 F128 I209 Y210 R211 G212	T120-H124 WeakPolarHBondContact CG2-NE2 3.4Å; T120-H124 PolarHBondContact O-CD2 3.18Å; T120-H124 VanDerWaalsContact O-CG 3.32Å; T120-H124 PolarHBondContact O-N 3.39Å; H124-F128 PolarHBondContact O-N 3.28Å; H124-F128 VanDerWaalsContact O-N 3.15Å; H124-I209 WeakPolarHBondContact CB-O 3.06Å; H124-I209 PolarHBondContact ND1-O 2.84Å; H124-Y210 PolarHBondContact ND1-O 2.94Å; H124-R211 PolarHBondContact CE1-O 3.47Å; H124-G212 PolarHBondContact ND1-N 2.86Å
125	F	89.1	Confident	85.2	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-73	-32.5	179	-85.4	-112.6	0	0	0	112.4	V121 K122 E123 L129 V145 Y148 Y149 L153 Y206 I209	V121-F125 HydrophobicContact CG1-CD2 4.03Å; V121-F125 HydrophobicContact CG1-CE2 4.06Å; V121-F125 WeakPolarHBondContact O-CD2 3.42Å; V121-F125 PolarHBondContact O-N 3.24Å; V121-F125 VanDerWaalsContact O-N 3.13Å; K122-F125 PolarHBondContact O-N 2.68Å; E123-F125 VanDerWaalsContact C-N 3.34Å; E123-F125 PolarHBondContact O-N 3.11Å; F125-L129 VanDerWaalsContact O-CG 3.3Å; F125-L129 WeakPolarHBondContact O-CG 3.44Å; F125-L129 PolarHBondContact O-N 3.21Å; F125-L129 VanDerWaalsContact O-N 3.1Å; F125-V145 HydrophobicContact CD1-CG1 3.72Å; F125-V145 HydrophobicContact CE1-CG1 4.07Å; F125-Y148 HydrophobicContact CD1-CD1 4.07Å; F125-Y148 HydrophobicContact CD1-CE1 4.29Å; F125-Y148 AromaticContact CE1-CD1 3.59Å; F125-Y148 HydrophobicContact CE1-CD1 3.59Å; F125-Y148 AromaticContact CE1-CE1 3.64Å; F125-Y148 HydrophobicContact CE1-CE1 3.64Å; F125-Y148 HydrophobicContact CZ-CD1 4.37Å; F125-Y148 AromaticContact CZ-CE1 3.97Å; F125-Y148 HydrophobicContact CZ-CE1 3.97Å; F125-Y149 HydrophobicContact CB-CD2 3.92Å; F125-L153 HydrophobicContact CB-CD1 4.01Å; F125-L153 HydrophobicContact CD1-CD1 3.74Å; F125-L153 HydrophobicContact CD2-CD1 4.16Å; F125-L153 HydrophobicContact CE1-CD1 4.29Å; F125-L153 HydrophobicContact CG-CD1 3.68Å; F125-Y206 HydrophobicContact CE1-CD2 4.22Å; F125-Y206 HydrophobicContact CE1-CE2 4.27Å; F125-Y206 AromaticContact CZ-CD2 3.69Å; F125-Y206 HydrophobicContact CZ-CD2 3.69Å; F125-Y206 AromaticContact CZ-CE2 3.58Å; F125-Y206 HydrophobicContact CZ-CE2 3.58Å; F125-I209 HydrophobicContact CD1-CG2 4.35Å; F125-I209 HydrophobicContact CD2-CG2 3.48Å; F125-I209 VanDerWaalsContact CD2-CG2 3.48Å; F125-I209 HydrophobicContact CE1-CG2 4.36Å; F125-I209 HydrophobicContact CE2-CB 4.18Å; F125-I209 HydrophobicContact CE2-CG2 3.53Å; F125-I209 HydrophobicContact CG-CG2 3.92Å; F125-I209 HydrophobicContact CZ-CB 4.36Å; F125-I209 HydrophobicContact CZ-CG2 3.97Å
126	L	88.6	Confident	84.8	Confident	64 Å²	64	67 Å²	67	34%	0.335	35%	0.349	S	S	.	.	H	α-helix	trans	-66.6	-48.6	171.1	-77	172.6	0	0	0	111.7	K122 E123 F128 L129 N130 Y149	K122-L126 WeakPolarHBondContact O-CG 3.13Å; K122-L126 PolarHBondContact O-N 3.3Å; E123-L126 PolarHBondContact O-N 3.44Å; L126-F128 VanDerWaalsContact C-N 3.25Å; L126-F128 PolarHBondContact O-N 2.69Å; L126-L129 CarbonylContact O-C 3.45Å; L126-L129 PolarHBondContact O-N 2.9Å; L126-N130 WeakPolarHBondContact O-CB 3.24Å; L126-N130 VanDerWaalsContact O-CG 3.29Å; L126-N130 PolarHBondContact O-N 2.86Å; L126-N130 PolarHBondContact O-OD1 3.04Å; L126-Y149 HydrophobicContact CD2-CE1 3.86Å; L126-Y149 HydrophobicContact CD2-CE2 4.09Å; L126-Y149 HydrophobicContact CG-CE1 4.48Å; L126-Y149 HydrophobicContact CG-CE2 3.83Å
127	A	87.2	Confident	84.7	Confident	20 Å²	20	61.3 Å²	61.3	17%	0.165	33%	0.33	C	S	.	.	H	α-helix	trans	-56.8	-40.1	177.8	0	0	0	0	0	111.8	E123 N130 G131 E132 T133	E123-A127 WeakPolarHBondContact O-CB 3.36Å; E123-A127 PolarHBondContact O-N 2.82Å; A127-N130 PolarHBondContact O-N 3.14Å; A127-G131 PolarHBondContact O-N 3.14Å; A127-E132 HydrophobicContact CB-CB 4.2Å; A127-E132 WeakPolarHBondContact O-CB 3.25Å; A127-E132 PolarHBondContact O-N 2.91Å; A127-T133 HydrophobicContact CB-CG2 4.18Å
128	F	88.8	Confident	84.7	Confident	12 Å²	12	60.8 Å²	60.8	5%	0.053	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-46.8	171.6	171.8	-92.7	0	0	0	112.6	H124 L126 N130 G131 T133 I135 A137 F141 V145 I209	H124-F128 PolarHBondContact O-N 3.28Å; H124-F128 VanDerWaalsContact O-N 3.15Å; L126-F128 VanDerWaalsContact C-N 3.25Å; L126-F128 PolarHBondContact O-N 2.69Å; F128-N130 VanDerWaalsContact C-N 3.29Å; F128-N130 PolarHBondContact O-N 3.09Å; F128-G131 PolarHBondContact O-N 2.91Å; F128-G131 VanDerWaalsContact O-N 3.11Å; F128-T133 HydrophobicContact CB-CG2 4.25Å; F128-T133 WeakPolarHBondContact CD2-OG1 3.39Å; F128-I135 HydrophobicContact CD2-CB 4.13Å; F128-I135 HydrophobicContact CD2-CD1 4.44Å; F128-I135 HydrophobicContact CD2-CG2 4.41Å; F128-I135 HydrophobicContact CE2-CB 4.08Å; F128-I135 HydrophobicContact CE2-CG2 4.01Å; F128-A137 HydrophobicContact CE2-CB 3.89Å; F128-A137 HydrophobicContact CZ-CB 3.6Å; F128-F141 HydrophobicContact CE1-CD1 4.46Å; F128-F141 HydrophobicContact CE1-CE1 4.2Å; F128-F141 HydrophobicContact CE2-CE1 4.15Å; F128-F141 AromaticContact CZ-CD1 3.79Å; F128-F141 HydrophobicContact CZ-CD1 3.79Å; F128-F141 AromaticContact CZ-CE1 3.6Å; F128-F141 HydrophobicContact CZ-CE1 3.6Å; F128-V145 HydrophobicContact CD1-CB 4.35Å; F128-V145 HydrophobicContact CD1-CG1 3.73Å; F128-V145 HydrophobicContact CE1-CB 3.94Å; F128-V145 HydrophobicContact CE1-CG1 3.84Å; F128-V145 HydrophobicContact CE1-CG2 3.98Å; F128-I209 HydrophobicContact CB-CD1 4.41Å; F128-I209 HydrophobicContact CB-CG1 4.42Å; F128-I209 HydrophobicContact CB-CG2 4.19Å; F128-I209 HydrophobicContact CD1-CD1 3.99Å; F128-I209 HydrophobicContact CD2-CD1 3.73Å; F128-I209 HydrophobicContact CD2-CG1 3.98Å; F128-I209 HydrophobicContact CE1-CD1 4.22Å; F128-I209 HydrophobicContact CE2-CD1 3.99Å; F128-I209 HydrophobicContact CG-CD1 3.74Å; F128-I209 HydrophobicContact CG-CG1 4.14Å; F128-I209 HydrophobicContact CZ-CD1 4.23Å
129	L	87.4	Confident	84.6	Confident	42 Å²	42	67.7 Å²	67.7	22%	0.22	36%	0.361	C	S	.	.	H	α-helix	trans	-68.1	-25.7	179.9	-72.5	170.9	0	0	0	113.6	F125 L126 G131 V145 R146 Y149	F125-L129 VanDerWaalsContact O-CG 3.3Å; F125-L129 WeakPolarHBondContact O-CG 3.44Å; F125-L129 PolarHBondContact O-N 3.21Å; F125-L129 VanDerWaalsContact O-N 3.1Å; L126-L129 CarbonylContact O-C 3.45Å; L126-L129 PolarHBondContact O-N 2.9Å; L129-G131 VanDerWaalsContact C-N 3.34Å; L129-V145 HydrophobicContact CD2-CB 4.45Å; L129-V145 HydrophobicContact CD2-CG1 4.15Å; L129-V145 HydrophobicContact CG-CG1 4.29Å; L129-R146 HydrophobicContact CD2-CB 3.94Å; L129-R146 HydrophobicContact CD2-CG 4.49Å; L129-Y149 HydrophobicContact CD1-CD1 4.46Å; L129-Y149 HydrophobicContact CD1-CG 4.12Å
130	N	86.5	Confident	84.4	Confident	109 Å²	109	64.9 Å²	64.9	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-79.3	-14.2	172.8	-69	-6.1	0	0	0	113.2	L126 A127 F128 E132	L126-N130 WeakPolarHBondContact O-CB 3.24Å; L126-N130 VanDerWaalsContact O-CG 3.29Å; L126-N130 PolarHBondContact O-N 2.86Å; L126-N130 PolarHBondContact O-OD1 3.04Å; A127-N130 PolarHBondContact O-N 3.14Å; F128-N130 VanDerWaalsContact C-N 3.29Å; F128-N130 PolarHBondContact O-N 3.09Å; N130-E132 HydrophobicContact CB-CG 3.95Å; N130-E132 WeakPolarHBondContact CB-OE1 3.25Å; N130-E132 PolarHBondContact ND2-OE1 2.97Å
131	G	81.3	Confident	84.4	Confident	61 Å²	61	62 Å²	62	63%	0.629	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	17.8	-175.9	0	0	0	0	0	114.9	A127 F128 L129	A127-G131 PolarHBondContact O-N 3.14Å; F128-G131 PolarHBondContact O-N 2.91Å; F128-G131 VanDerWaalsContact O-N 3.11Å; L129-G131 VanDerWaalsContact C-N 3.34Å
132	E	78.3	Confident	84.3	Confident	131 Å²	131	63.2 Å²	63.2	61%	0.612	35%	0.345	S	S	*	.			trans	-78.7	-21	-178.4	-62.1	165.5	-147.4	0	0	112.9	A127 N130	A127-E132 HydrophobicContact CB-CB 4.2Å; A127-E132 WeakPolarHBondContact O-CB 3.25Å; A127-E132 PolarHBondContact O-N 2.91Å; N130-E132 HydrophobicContact CB-CG 3.95Å; N130-E132 WeakPolarHBondContact CB-OE1 3.25Å; N130-E132 PolarHBondContact ND2-OE1 2.97Å
133	T	80.1	Confident	84.1	Confident	32 Å²	32	64.2 Å²	64.2	20%	0.196	35%	0.352	C	S	.	.	S	Bend	trans	-94.7	148	-177.7	64.6	0	0	0	0	113.1	A127 F128 I135	A127-T133 HydrophobicContact CB-CG2 4.18Å; F128-T133 HydrophobicContact CB-CG2 4.25Å; F128-T133 WeakPolarHBondContact CD2-OG1 3.39Å; T133-I135 PolarHBondContact O-N 3.28Å
134	Q	75.3	Confident	84	Confident	170 Å²	170	59.9 Å²	59.9	79%	0.794	33%	0.332	S	S	*	.			trans	-76.5	21.2	-178.9	-55.8	-176.8	35.5	0	0	115.4	I136 E213	Q134-I136 PolarHBondContact O-N 3.24Å; Q134-E213 PolarHBondContact N-OE1 3.17Å
135	I	80.8	Confident	83.9	Confident	35 Å²	35	57.4 Å²	57.4	18%	0.179	32%	0.32	C	S	.	.			trans	-90.7	108.6	-169.9	-59.4	173.9	0	0	0	110.7	F128 T133 A137 T208 I209	F128-I135 HydrophobicContact CD2-CB 4.13Å; F128-I135 HydrophobicContact CD2-CD1 4.44Å; F128-I135 HydrophobicContact CD2-CG2 4.41Å; F128-I135 HydrophobicContact CE2-CB 4.08Å; F128-I135 HydrophobicContact CE2-CG2 4.01Å; T133-I135 PolarHBondContact O-N 3.28Å; I135-A137 PolarHBondContact O-N 3.44Å; I135-A137 VanDerWaalsContact O-N 3.12Å; I135-T208 HydrophobicContact CD1-CG2 3.8Å; I135-T208 HydrophobicContact CG1-CG2 4.29Å; I135-I209 HydrophobicContact CD1-CB 4.46Å; I135-I209 HydrophobicContact CD1-CG1 3.54Å
136	I	75.9	Confident	83.8	Confident	156 Å²	156	63.2 Å²	63.2	80%	0.8	34%	0.342	S	S	*	.			trans	-64.4	113.5	-179.3	-57.5	176.3	0	0	0	110.7	Q134 K205	Q134-I136 PolarHBondContact O-N 3.24Å; I136-K205 WeakPolarHBondContact O-CE 3.49Å; I136-K205 PolarHBondContact O-NZ 3.2Å
137	A	81.2	Confident	83.6	Confident	39 Å²	39	62 Å²	62	32%	0.322	34%	0.34	S	S	.	.			trans	-123.4	140.4	-174	0	0	0	0	0	112.7	F128 I135 F141 C142	F128-A137 HydrophobicContact CE2-CB 3.89Å; F128-A137 HydrophobicContact CZ-CB 3.6Å; I135-A137 PolarHBondContact O-N 3.44Å; I135-A137 VanDerWaalsContact O-N 3.12Å; A137-F141 HydrophobicContact CB-CD1 3.96Å; A137-C142 WeakPolarHBondContact CB-SG 3.5Å
138	D	82.8	Confident	83.6	Confident	58 Å²	58	61.1 Å²	61.1	31%	0.31	33%	0.332	S	S	.	.			trans	-87.2	151	169	49.5	-72.4	0	0	0	110.1	A140 F141 C142 W202 K205	D138-A140 VanDerWaalsContact C-N 3.25Å; D138-A140 PolarHBondContact O-N 3.29Å; D138-F141 WeakPolarHBondContact O-CB 3.49Å; D138-F141 PolarHBondContact O-N 3.08Å; D138-F141 WeakPolarHBondContact OD1-CB 3.47Å; D138-F141 WeakPolarHBondContact OD2-CB 3.41Å; D138-F141 PolarHBondContact OD2-N 3.42Å; D138-F141 VanDerWaalsContact OD2-N 3.08Å; D138-C142 PolarHBondContact O-N 3.28Å; D138-W202 WeakPolarHBondContact OD2-CZ2 3.25Å; D138-W202 PolarHBondContact OD2-NE1 3Å; D138-K205 IonicContact OD1-NZ 2.75Å; D138-K205 PolarHBondContact OD1-NZ 3.27Å
139	E	83	Confident	83.5	Confident	151 Å²	151	61.8 Å²	61.8	71%	0.706	33%	0.334	S	S	*	.	H	α-helix	trans	-59.4	-36.9	-174.4	-162.3	-164.6	146.1	0	0	112.5	F141 C142 N143	E139-F141 PolarHBondContact O-N 2.89Å; E139-C142 PolarHBondContact O-N 3.06Å; E139-N143 WeakPolarHBondContact O-CB 3.35Å; E139-N143 VanDerWaalsContact O-CG 3.24Å; E139-N143 PolarHBondContact O-N 3.12Å; E139-N143 PolarHBondContact O-ND2 3.46Å; E139-N143 PolarHBondContact OE1-ND2 3.44Å
140	A	82.8	Confident	83.4	Confident	38 Å²	38	64.2 Å²	64.2	31%	0.314	35%	0.345	S	S	.	.	H	α-helix	trans	-61.3	-43.1	175.5	0	0	0	0	0	112.1	D138 A144 W202	D138-A140 VanDerWaalsContact C-N 3.25Å; D138-A140 PolarHBondContact O-N 3.29Å; A140-A144 WeakPolarHBondContact O-CB 3.41Å; A140-A144 PolarHBondContact O-N 3.08Å; A140-W202 HydrophobicContact CB-CH2 3.92Å; A140-W202 HydrophobicContact CB-CZ2 3.82Å
141	F	86.6	Confident	83	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.1	-45.3	171.7	-176.7	-107.8	0	0	0	112.2	F128 A137 D138 E139 N143 A144 V145 F176 W202 K205 I209	F128-F141 HydrophobicContact CE1-CD1 4.46Å; F128-F141 HydrophobicContact CE1-CE1 4.2Å; F128-F141 HydrophobicContact CE2-CE1 4.15Å; F128-F141 AromaticContact CZ-CD1 3.79Å; F128-F141 HydrophobicContact CZ-CD1 3.79Å; F128-F141 AromaticContact CZ-CE1 3.6Å; F128-F141 HydrophobicContact CZ-CE1 3.6Å; A137-F141 HydrophobicContact CB-CD1 3.96Å; D138-F141 WeakPolarHBondContact O-CB 3.49Å; D138-F141 PolarHBondContact O-N 3.08Å; D138-F141 WeakPolarHBondContact OD1-CB 3.47Å; D138-F141 WeakPolarHBondContact OD2-CB 3.41Å; D138-F141 PolarHBondContact OD2-N 3.42Å; D138-F141 VanDerWaalsContact OD2-N 3.08Å; E139-F141 PolarHBondContact O-N 2.89Å; F141-N143 VanDerWaalsContact C-N 3.31Å; F141-N143 PolarHBondContact O-N 3.29Å; F141-A144 WeakPolarHBondContact O-CB 3.47Å; F141-A144 PolarHBondContact O-N 2.87Å; F141-A144 VanDerWaalsContact O-N 3.11Å; F141-V145 HydrophobicContact CD1-CG2 4.09Å; F141-V145 HydrophobicContact CD2-CG2 4.33Å; F141-V145 HydrophobicContact CE1-CG2 3.69Å; F141-V145 HydrophobicContact CE2-CG2 3.96Å; F141-V145 HydrophobicContact CG-CG2 4.4Å; F141-V145 HydrophobicContact CZ-CG2 3.61Å; F141-V145 WeakPolarHBondContact O-CG2 3.33Å; F141-V145 PolarHBondContact O-N 3.29Å; F141-F176 HydrophobicContact CE2-CE1 4.27Å; F141-F176 AromaticContact CE2-CZ 3.79Å; F141-F176 HydrophobicContact CE2-CZ 3.79Å; F141-F176 HydrophobicContact CZ-CZ 4.46Å; F141-W202 HydrophobicContact CB-CD2 4.29Å; F141-W202 HydrophobicContact CB-CZ2 4.03Å; F141-W202 HydrophobicContact CD2-CB 3.8Å; F141-W202 AromaticContact CD2-CD1 3.72Å; F141-W202 AromaticContact CD2-CD2 3.65Å; F141-W202 HydrophobicContact CD2-CD2 3.65Å; F141-W202 HydrophobicContact CD2-CE3 4.16Å; F141-W202 AromaticContact CD2-CG 3.46Å; F141-W202 HydrophobicContact CD2-CG 3.46Å; F141-W202 VanDerWaalsContact CD2-CG 3.46Å; F141-W202 HydrophobicContact CE2-CB 3.85Å; F141-W202 HydrophobicContact CE2-CG 4.05Å; F141-W202 WeakPolarHBondContact CE2-O 3.14Å; F141-W202 HydrophobicContact CG-CD2 4.44Å; F141-W202 HydrophobicContact CG-CG 4.38Å; F141-K205 HydrophobicContact CD1-CD 3.88Å; F141-K205 HydrophobicContact CD2-CD 4.41Å; F141-K205 HydrophobicContact CE1-CB 3.76Å; F141-K205 HydrophobicContact CE1-CD 3.77Å; F141-K205 HydrophobicContact CE1-CG 4.42Å; F141-K205 HydrophobicContact CE2-CB 3.94Å; F141-K205 HydrophobicContact CE2-CD 4.31Å; F141-K205 HydrophobicContact CG-CD 4.2Å; F141-K205 HydrophobicContact CZ-CB 3.35Å; F141-K205 HydrophobicContact CZ-CD 4.01Å; F141-K205 HydrophobicContact CZ-CG 4.31Å; F141-I209 HydrophobicContact CE1-CD1 3.96Å; F141-I209 HydrophobicContact CZ-CD1 3.98Å
142	C	85.8	Confident	83.3	Confident	32 Å²	32	58 Å²	58	22%	0.216	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-42.7	176.5	-68.7	0	0	0	0	112.3	A137 D138 E139 A144 V145 R146	A137-C142 WeakPolarHBondContact CB-SG 3.5Å; D138-C142 PolarHBondContact O-N 3.28Å; E139-C142 PolarHBondContact O-N 3.06Å; C142-A144 VanDerWaalsContact C-N 3.34Å; C142-A144 PolarHBondContact O-N 2.89Å; C142-V145 PolarHBondContact O-N 3.2Å; C142-R146 WeakPolarHBondContact O-CB 3.14Å; C142-R146 PolarHBondContact O-N 3.23Å
143	N	85.6	Confident	83.6	Confident	55 Å²	55	51.8 Å²	51.8	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-69.5	-30.1	177.4	-69	-20.6	0	0	0	112.2	E139 F141 R146 S147	E139-N143 WeakPolarHBondContact O-CB 3.35Å; E139-N143 VanDerWaalsContact O-CG 3.24Å; E139-N143 PolarHBondContact O-N 3.12Å; E139-N143 PolarHBondContact O-ND2 3.46Å; E139-N143 PolarHBondContact OE1-ND2 3.44Å; F141-N143 VanDerWaalsContact C-N 3.31Å; F141-N143 PolarHBondContact O-N 3.29Å; N143-R146 PolarHBondContact OD1-NH1 3.49Å; N143-S147 WeakPolarHBondContact O-CB 3.42Å; N143-S147 PolarHBondContact O-N 2.86Å
144	A	86.2	Confident	83.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-70.6	-44.8	170.4	0	0	0	0	0	112.7	A140 F141 C142 R146 S147 Y148 I180 W202	A140-A144 WeakPolarHBondContact O-CB 3.41Å; A140-A144 PolarHBondContact O-N 3.08Å; F141-A144 WeakPolarHBondContact O-CB 3.47Å; F141-A144 PolarHBondContact O-N 2.87Å; F141-A144 VanDerWaalsContact O-N 3.11Å; C142-A144 VanDerWaalsContact C-N 3.34Å; C142-A144 PolarHBondContact O-N 2.89Å; A144-R146 PolarHBondContact O-N 3.36Å; A144-S147 PolarHBondContact O-N 3.31Å; A144-Y148 PolarHBondContact O-N 2.9Å; A144-I180 HydrophobicContact CB-CG2 3.97Å; A144-W202 HydrophobicContact CB-CZ3 4.1Å
145	V	88.1	Confident	84.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-40.4	176.7	176	0	0	0	0	111.2	F125 F128 L129 F141 C142 Y148 Y149 F176 I209	F125-V145 HydrophobicContact CD1-CG1 3.72Å; F125-V145 HydrophobicContact CE1-CG1 4.07Å; F128-V145 HydrophobicContact CD1-CB 4.35Å; F128-V145 HydrophobicContact CD1-CG1 3.73Å; F128-V145 HydrophobicContact CE1-CB 3.94Å; F128-V145 HydrophobicContact CE1-CG1 3.84Å; F128-V145 HydrophobicContact CE1-CG2 3.98Å; L129-V145 HydrophobicContact CD2-CB 4.45Å; L129-V145 HydrophobicContact CD2-CG1 4.15Å; L129-V145 HydrophobicContact CG-CG1 4.29Å; F141-V145 HydrophobicContact CD1-CG2 4.09Å; F141-V145 HydrophobicContact CD2-CG2 4.33Å; F141-V145 HydrophobicContact CE1-CG2 3.69Å; F141-V145 HydrophobicContact CE2-CG2 3.96Å; F141-V145 HydrophobicContact CG-CG2 4.4Å; F141-V145 HydrophobicContact CZ-CG2 3.61Å; F141-V145 WeakPolarHBondContact O-CG2 3.33Å; F141-V145 PolarHBondContact O-N 3.29Å; C142-V145 PolarHBondContact O-N 3.2Å; V145-Y148 PolarHBondContact O-N 2.93Å; V145-Y149 WeakPolarHBondContact O-CB 3.49Å; V145-Y149 PolarHBondContact O-N 3.48Å; V145-F176 HydrophobicContact CG2-CE2 4.16Å; V145-F176 HydrophobicContact CG2-CZ 4.21Å; V145-I209 HydrophobicContact CG2-CD1 4.45Å
146	R	87.4	Confident	84.2	Confident	122 Å²	122	52.1 Å²	52.1	46%	0.46	28%	0.276	S	S	.	.	H	α-helix	trans	-62.3	-42.9	175	-164.9	-179.1	-61.9	112.5	2.8	112.1	L129 C142 N143 A144 Y149 E150	L129-R146 HydrophobicContact CD2-CB 3.94Å; L129-R146 HydrophobicContact CD2-CG 4.49Å; C142-R146 WeakPolarHBondContact O-CB 3.14Å; C142-R146 PolarHBondContact O-N 3.23Å; N143-R146 PolarHBondContact OD1-NH1 3.49Å; A144-R146 PolarHBondContact O-N 3.36Å; R146-Y149 PolarHBondContact O-N 2.94Å; R146-E150 PolarHBondContact O-N 3.21Å
147	S	84.1	Confident	84.5	Confident	40 Å²	40	45.9 Å²	45.9	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-40.1	175.4	173	0	0	0	0	112.8	N143 A144 G151 R183	N143-S147 WeakPolarHBondContact O-CB 3.42Å; N143-S147 PolarHBondContact O-N 2.86Å; A144-S147 PolarHBondContact O-N 3.31Å; S147-G151 WeakPolarHBondContact O-CA 3.45Å; S147-G151 PolarHBondContact O-N 2.83Å; S147-R183 PolarHBondContact OG-NH2 3.33Å
148	Y	87.8	Confident	84.7	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.9	-37.5	174.4	175.8	-106.2	0	0	0	112.4	F125 A144 V145 F152 L153 F172 V175 F176 Y206	F125-Y148 HydrophobicContact CD1-CD1 4.07Å; F125-Y148 HydrophobicContact CD1-CE1 4.29Å; F125-Y148 AromaticContact CE1-CD1 3.59Å; F125-Y148 HydrophobicContact CE1-CD1 3.59Å; F125-Y148 AromaticContact CE1-CE1 3.64Å; F125-Y148 HydrophobicContact CE1-CE1 3.64Å; F125-Y148 HydrophobicContact CZ-CD1 4.37Å; F125-Y148 AromaticContact CZ-CE1 3.97Å; F125-Y148 HydrophobicContact CZ-CE1 3.97Å; A144-Y148 PolarHBondContact O-N 2.9Å; V145-Y148 PolarHBondContact O-N 2.93Å; Y148-F152 HydrophobicContact CD2-CB 3.88Å; Y148-F152 HydrophobicContact CD2-CD1 4.04Å; Y148-F152 HydrophobicContact CD2-CG 4.19Å; Y148-F152 HydrophobicContact CE1-CD1 4.43Å; Y148-F152 HydrophobicContact CE2-CB 3.99Å; Y148-F152 AromaticContact CE2-CD1 3.28Å; Y148-F152 HydrophobicContact CE2-CD1 3.28Å; Y148-F152 AromaticContact CE2-CE1 3.88Å; Y148-F152 HydrophobicContact CE2-CE1 3.88Å; Y148-F152 AromaticContact CE2-CG 3.78Å; Y148-F152 HydrophobicContact CE2-CG 3.78Å; Y148-F152 AromaticContact CZ-CD1 3.52Å; Y148-F152 AromaticContact CZ-CE1 3.91Å; Y148-F152 WeakPolarHBondContact O-CA 3.29Å; Y148-F152 VanDerWaalsContact O-CB 3.32Å; Y148-F152 WeakPolarHBondContact O-CB 3.5Å; Y148-F152 PolarHBondContact O-N 3.33Å; Y148-F152 WeakPolarHBondContact OH-CE1 3.37Å; Y148-L153 HydrophobicContact CD1-CD1 3.97Å; Y148-L153 HydrophobicContact CD1-CG 4.07Å; Y148-L153 HydrophobicContact CE1-CD1 3.71Å; Y148-L153 HydrophobicContact CE1-CD2 3.94Å; Y148-L153 HydrophobicContact CE1-CG 3.7Å; Y148-L153 PolarHBondContact O-N 3.12Å; Y148-F172 WeakPolarHBondContact OH-CB 3.15Å; Y148-F172 PolarHBondContact OH-O 3.45Å; Y148-V175 HydrophobicContact CE2-CG1 4.37Å; Y148-F176 AromaticContact CD1-CD2 3.85Å; Y148-F176 HydrophobicContact CD1-CD2 3.85Å; Y148-F176 HydrophobicContact CD2-CB 4.04Å; Y148-F176 AromaticContact CD2-CD2 3.88Å; Y148-F176 HydrophobicContact CD2-CD2 3.88Å; Y148-F176 HydrophobicContact CD2-CG 4.48Å; Y148-F176 HydrophobicContact CE1-CD2 4.32Å; Y148-F176 HydrophobicContact CE2-CB 3.78Å; Y148-F176 HydrophobicContact CE2-CD2 4.37Å; Y148-F176 AromaticContact CG-CD2 3.59Å; Y148-F176 HydrophobicContact CG-CD2 3.59Å; Y148-F176 HydrophobicContact CG-CE2 4.36Å; Y148-Y206 AromaticContact CE1-CE2 3.85Å; Y148-Y206 HydrophobicContact CE1-CE2 3.85Å
149	Y	87.6	Confident	84.7	Confident	27 Å²	27	42.8 Å²	42.8	11%	0.106	22%	0.222	C	C	.	.	I	π-helix	trans	-63.1	-54.2	176.7	-178.3	-94.1	0	0	0	111.8	K122 F125 L126 L129 V145 R146 L153 K154	K122-Y149 HydrophobicContact CB-CE2 4.12Å; K122-Y149 HydrophobicContact CG-CE2 4.3Å; F125-Y149 HydrophobicContact CB-CD2 3.92Å; L126-Y149 HydrophobicContact CD2-CE1 3.86Å; L126-Y149 HydrophobicContact CD2-CE2 4.09Å; L126-Y149 HydrophobicContact CG-CE1 4.48Å; L126-Y149 HydrophobicContact CG-CE2 3.83Å; L129-Y149 HydrophobicContact CD1-CD1 4.46Å; L129-Y149 HydrophobicContact CD1-CG 4.12Å; V145-Y149 WeakPolarHBondContact O-CB 3.49Å; V145-Y149 PolarHBondContact O-N 3.48Å; R146-Y149 PolarHBondContact O-N 2.94Å; Y149-L153 HydrophobicContact CD2-CB 4.26Å; Y149-L153 HydrophobicContact CD2-CD1 3.91Å; Y149-L153 PolarHBondContact O-N 3.12Å; Y149-K154 HydrophobicContact CE1-CD 4.49Å; Y149-K154 WeakPolarHBondContact O-CB 3.37Å; Y149-K154 PolarHBondContact O-N 2.81Å
150	E	83.9	Confident	84.5	Confident	93 Å²	93	41.2 Å²	41.2	44%	0.435	21%	0.21	S	C	.	.	I	π-helix	trans	-71.2	-47	-178.8	-71.6	-67.1	129.4	0	0	112.6	R146 K154	R146-E150 PolarHBondContact O-N 3.21Å; E150-K154 VanDerWaalsContact CD-CD 3.49Å; E150-K154 VanDerWaalsContact OE1-CD 3.27Å; E150-K154 WeakPolarHBondContact OE1-CD 3.47Å; E150-K154 IonicContact OE1-NZ 2.67Å; E150-K154 PolarHBondContact OE1-NZ 2.84Å; E150-K154 VanDerWaalsContact OE2-CD 3.22Å; E150-K154 WeakPolarHBondContact OE2-CD 3.07Å; E150-K154 WeakPolarHBondContact OE2-CE 3.47Å; E150-K154 IonicContact OE2-NZ 3.76Å; E150-K154 PolarHBondContact OE2-NZ 2.74Å
151	G	79.3	Confident	84.3	Confident	35 Å²	35	39.7 Å²	39.7	36%	0.361	20%	0.197	S	C	.	.	I	π-helix	trans	-77.2	-31.3	-174.5	0	0	0	0	0	115	S147 F763	S147-G151 WeakPolarHBondContact O-CA 3.45Å; S147-G151 PolarHBondContact O-N 2.83Å; G151-F763 WeakPolarHBondContact O-CZ 3.3Å
152	F	85.9	Confident	84.1	Confident	5 Å²	5	40 Å²	40	2%	0.022	20%	0.198	C	C	.	.	I	π-helix	trans	-112.7	-66.7	-178.3	-179.7	-98.7	0	0	0	112.3	Y148 K154 S155 V158 M161 F172 V175 F763	Y148-F152 HydrophobicContact CD2-CB 3.88Å; Y148-F152 HydrophobicContact CD2-CD1 4.04Å; Y148-F152 HydrophobicContact CD2-CG 4.19Å; Y148-F152 HydrophobicContact CE1-CD1 4.43Å; Y148-F152 HydrophobicContact CE2-CB 3.99Å; Y148-F152 AromaticContact CE2-CD1 3.28Å; Y148-F152 HydrophobicContact CE2-CD1 3.28Å; Y148-F152 AromaticContact CE2-CE1 3.88Å; Y148-F152 HydrophobicContact CE2-CE1 3.88Å; Y148-F152 AromaticContact CE2-CG 3.78Å; Y148-F152 HydrophobicContact CE2-CG 3.78Å; Y148-F152 AromaticContact CZ-CD1 3.52Å; Y148-F152 AromaticContact CZ-CE1 3.91Å; Y148-F152 WeakPolarHBondContact O-CA 3.29Å; Y148-F152 VanDerWaalsContact O-CB 3.32Å; Y148-F152 WeakPolarHBondContact O-CB 3.5Å; Y148-F152 PolarHBondContact O-N 3.33Å; Y148-F152 WeakPolarHBondContact OH-CE1 3.37Å; F152-K154 VanDerWaalsContact C-N 3.32Å; F152-K154 PolarHBondContact O-N 2.97Å; F152-S155 VanDerWaalsContact O-CB 3.25Å; F152-S155 WeakPolarHBondContact O-CB 3.42Å; F152-S155 PolarHBondContact O-N 3.46Å; F152-V158 HydrophobicContact CD1-CG2 4.22Å; F152-V158 HydrophobicContact CD2-CG2 3.54Å; F152-V158 HydrophobicContact CE1-CG1 4.2Å; F152-V158 HydrophobicContact CE1-CG2 4.16Å; F152-V158 HydrophobicContact CE2-CG2 3.47Å; F152-V158 VanDerWaalsContact CE2-CG2 3.47Å; F152-V158 HydrophobicContact CG-CG2 3.94Å; F152-V158 HydrophobicContact CZ-CG1 4.14Å; F152-V158 HydrophobicContact CZ-CG2 3.8Å; F152-V158 WeakPolarHBondContact O-CG2 3.47Å; F152-M161 HydrophobicContact CE2-CE 4.48Å; F152-M161 HydrophobicContact CZ-CE 4.34Å; F152-F172 HydrophobicContact CE1-CB 4.44Å; F152-F172 AromaticContact CE1-CD1 3.71Å; F152-F172 HydrophobicContact CE1-CD1 3.71Å; F152-F172 HydrophobicContact CE1-CD2 4.44Å; F152-F172 HydrophobicContact CE1-CE1 4.01Å; F152-F172 AromaticContact CE1-CG 3.93Å; F152-F172 HydrophobicContact CE1-CG 3.93Å; F152-F172 HydrophobicContact CZ-CD1 4.49Å; F152-F172 HydrophobicContact CZ-CD2 4.47Å; F152-F172 HydrophobicContact CZ-CG 4.34Å; F152-V175 HydrophobicContact CD2-CB 4.47Å; F152-V175 HydrophobicContact CD2-CG1 3.62Å; F152-V175 HydrophobicContact CE2-CB 4.13Å; F152-V175 HydrophobicContact CE2-CG1 3.74Å; F152-V175 HydrophobicContact CE2-CG2 4.08Å; F152-V175 HydrophobicContact CG-CG1 4.12Å; F152-V175 HydrophobicContact CZ-CB 4.33Å; F152-V175 HydrophobicContact CZ-CG1 4.33Å; F152-V175 HydrophobicContact CZ-CG2 4.41Å; F152-F763 HydrophobicContact CB-CE1 4.49Å; F152-F763 HydrophobicContact CB-CZ 4.47Å; F152-F763 AromaticContact CD2-CD1 3.91Å; F152-F763 HydrophobicContact CD2-CD1 3.91Å; F152-F763 AromaticContact CD2-CD2 3.53Å; F152-F763 HydrophobicContact CD2-CD2 3.53Å; F152-F763 AromaticContact CD2-CE1 3.94Å; F152-F763 HydrophobicContact CD2-CE1 3.94Å; F152-F763 AromaticContact CD2-CE2 3.58Å; F152-F763 HydrophobicContact CD2-CE2 3.58Å; F152-F763 AromaticContact CD2-CG 3.72Å; F152-F763 HydrophobicContact CD2-CG 3.72Å; F152-F763 AromaticContact CD2-CZ 3.77Å; F152-F763 HydrophobicContact CD2-CZ 3.77Å; F152-F763 HydrophobicContact CE2-CB 4.36Å; F152-F763 AromaticContact CE2-CD2 3.59Å; F152-F763 HydrophobicContact CE2-CD2 3.59Å; F152-F763 AromaticContact CE2-CE2 3.98Å; F152-F763 HydrophobicContact CE2-CE2 3.98Å; F152-F763 AromaticContact CE2-CG 3.93Å; F152-F763 HydrophobicContact CE2-CG 3.93Å
153	L	85.5	Confident	83.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-60.6	-39.1	-170.5	-65.8	176.5	0	0	0	113	V121 K122 F125 Y148 Y149 S155 F172	V121-L153 HydrophobicContact CG1-CD1 4.5Å; V121-L153 HydrophobicContact CG1-CD2 4.2Å; K122-L153 WeakPolarHBondContact CE-O 3.23Å; K122-L153 HydrophobicContact CG-CB 4.42Å; K122-L153 PolarHBondContact NZ-O 2.91Å; F125-L153 HydrophobicContact CB-CD1 4.01Å; F125-L153 HydrophobicContact CD1-CD1 3.74Å; F125-L153 HydrophobicContact CD2-CD1 4.16Å; F125-L153 HydrophobicContact CE1-CD1 4.29Å; F125-L153 HydrophobicContact CG-CD1 3.68Å; Y148-L153 HydrophobicContact CD1-CD1 3.97Å; Y148-L153 HydrophobicContact CD1-CG 4.07Å; Y148-L153 HydrophobicContact CE1-CD1 3.71Å; Y148-L153 HydrophobicContact CE1-CD2 3.94Å; Y148-L153 HydrophobicContact CE1-CG 3.7Å; Y148-L153 PolarHBondContact O-N 3.12Å; Y149-L153 HydrophobicContact CD2-CB 4.26Å; Y149-L153 HydrophobicContact CD2-CD1 3.91Å; Y149-L153 PolarHBondContact O-N 3.12Å; L153-S155 VanDerWaalsContact C-N 3.34Å; L153-F172 HydrophobicContact CD2-CD1 3.76Å; L153-F172 HydrophobicContact CD2-CE1 3.62Å
154	K	85.3	Confident	82.9	Confident	110 Å²	110	42.9 Å²	42.9	48%	0.478	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-21.6	178	-164	175.9	-176.7	177.1	0	113.1	Y149 E150 F152	Y149-K154 HydrophobicContact CE1-CD 4.49Å; Y149-K154 WeakPolarHBondContact O-CB 3.37Å; Y149-K154 PolarHBondContact O-N 2.81Å; E150-K154 VanDerWaalsContact CD-CD 3.49Å; E150-K154 VanDerWaalsContact OE1-CD 3.27Å; E150-K154 WeakPolarHBondContact OE1-CD 3.47Å; E150-K154 IonicContact OE1-NZ 2.67Å; E150-K154 PolarHBondContact OE1-NZ 2.84Å; E150-K154 VanDerWaalsContact OE2-CD 3.22Å; E150-K154 WeakPolarHBondContact OE2-CD 3.07Å; E150-K154 WeakPolarHBondContact OE2-CE 3.47Å; E150-K154 IonicContact OE2-NZ 3.76Å; E150-K154 PolarHBondContact OE2-NZ 2.74Å; F152-K154 VanDerWaalsContact C-N 3.32Å; F152-K154 PolarHBondContact O-N 2.97Å
155	S	83.6	Confident	82	Confident	26 Å²	26	43.2 Å²	43.2	18%	0.182	21%	0.213	C	C	.	.			trans	-63.5	133	-173.9	-165.8	0	0	0	0	112.9	F152 L153 R157 V158 S159	F152-S155 VanDerWaalsContact O-CB 3.25Å; F152-S155 WeakPolarHBondContact O-CB 3.42Å; F152-S155 PolarHBondContact O-N 3.46Å; L153-S155 VanDerWaalsContact C-N 3.34Å; S155-R157 PolarHBondContact O-N 3.49Å; S155-V158 PolarHBondContact O-N 2.85Å; S155-S159 PolarHBondContact O-N 2.77Å
156	E	80.8	Confident	81	Confident	108 Å²	108	43.5 Å²	43.5	51%	0.505	22%	0.216	S	C	.	.	H	α-helix	trans	-59.4	-30.4	177.5	-152.4	-137.1	144.3	0	0	112	V158 S159 R160	E156-V158 VanDerWaalsContact C-N 3.32Å; E156-V158 PolarHBondContact O-N 2.65Å; E156-S159 CarbonylContact O-C 3.48Å; E156-S159 WeakPolarHBondContact O-CA 3.41Å; E156-S159 WeakPolarHBondContact O-CB 3.37Å; E156-S159 PolarHBondContact O-N 3.06Å; E156-S159 VanDerWaalsContact O-N 3.09Å; E156-R160 PolarHBondContact O-N 3.03Å; E156-R160 IonicContact OE1-CZ 2.71Å; E156-R160 VanDerWaalsContact OE1-CZ 3.26Å; E156-R160 IonicContact OE1-NE 2.62Å; E156-R160 PolarHBondContact OE1-NE 2.97Å; E156-R160 IonicContact OE1-NH2 2.83Å; E156-R160 PolarHBondContact OE1-NH2 2.9Å; E156-R160 IonicContact OE2-CZ 2.75Å; E156-R160 IonicContact OE2-NE 3.32Å; E156-R160 IonicContact OE2-NH2 3.36Å; E156-R160 PolarHBondContact OE2-NH2 3.15Å
157	R	82.2	Confident	80.3	Confident	24 Å²	24	37.8 Å²	37.8	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-56.4	-42	174.6	-65.3	-173.1	-70.6	171.1	-7.7	112.5	S155 R160 M161 R758 Y759 P762 F763	S155-R157 PolarHBondContact O-N 3.49Å; R157-R160 PolarHBondContact O-N 3.39Å; R157-M161 WeakPolarHBondContact O-CB 3.45Å; R157-M161 PolarHBondContact O-N 2.8Å; R157-R758 VanDerWaalsContact CD-O 3.32Å; R157-R758 WeakPolarHBondContact CD-O 3.41Å; R157-Y759 HydrophobicContact CG-CD1 4.18Å; R157-Y759 HydrophobicContact CG-CE1 4.04Å; R157-P762 HydrophobicContact CB-CB 4.07Å; R157-F763 HydrophobicContact CB-CE2 4.29Å
158	V	84.1	Confident	80.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.7	-37.2	176.5	-179.3	0	0	0	0	110.8	L118 F152 S155 E156 M161 V162 F172 F763	L118-V158 HydrophobicContact CD1-CG1 4.37Å; F152-V158 HydrophobicContact CD1-CG2 4.22Å; F152-V158 HydrophobicContact CD2-CG2 3.54Å; F152-V158 HydrophobicContact CE1-CG1 4.2Å; F152-V158 HydrophobicContact CE1-CG2 4.16Å; F152-V158 HydrophobicContact CE2-CG2 3.47Å; F152-V158 VanDerWaalsContact CE2-CG2 3.47Å; F152-V158 HydrophobicContact CG-CG2 3.94Å; F152-V158 HydrophobicContact CZ-CG1 4.14Å; F152-V158 HydrophobicContact CZ-CG2 3.8Å; F152-V158 WeakPolarHBondContact O-CG2 3.47Å; S155-V158 PolarHBondContact O-N 2.85Å; E156-V158 VanDerWaalsContact C-N 3.32Å; E156-V158 PolarHBondContact O-N 2.65Å; V158-M161 HydrophobicContact CB-CE 4.47Å; V158-M161 HydrophobicContact CG1-CE 4.14Å; V158-M161 HydrophobicContact CG2-CE 4.35Å; V158-M161 PolarHBondContact O-N 3.46Å; V158-V162 HydrophobicContact CG1-CG2 4.44Å; V158-V162 WeakPolarHBondContact O-CB 3.46Å; V158-V162 WeakPolarHBondContact O-CG2 3.28Å; V158-V162 PolarHBondContact O-N 2.94Å; V158-F172 HydrophobicContact CG1-CE1 4.36Å; V158-F172 HydrophobicContact CG1-CZ 3.9Å; V158-F763 HydrophobicContact CG2-CD2 4.21Å; V158-F763 HydrophobicContact CG2-CE2 3.61Å; V158-F763 HydrophobicContact CG2-CZ 4.38Å
159	S	82.4	Confident	79.7	Confident	32 Å²	32	37.9 Å²	37.9	22%	0.224	20%	0.198	C	C	.	.	H	α-helix	trans	-61.2	-44.1	173.7	-169.3	0	0	0	0	112	S155 E156 V162 Q163	S155-S159 PolarHBondContact O-N 2.77Å; E156-S159 CarbonylContact O-C 3.48Å; E156-S159 WeakPolarHBondContact O-CA 3.41Å; E156-S159 WeakPolarHBondContact O-CB 3.37Å; E156-S159 PolarHBondContact O-N 3.06Å; E156-S159 VanDerWaalsContact O-N 3.09Å; S159-V162 PolarHBondContact O-N 3.45Å; S159-Q163 WeakPolarHBondContact O-CB 3.34Å; S159-Q163 VanDerWaalsContact O-CG 3.24Å; S159-Q163 WeakPolarHBondContact O-CG 3.22Å; S159-Q163 PolarHBondContact O-N 2.99Å; S159-Q163 PolarHBondContact O-NE2 3.32Å; S159-Q163 PolarHBondContact OG-NE2 3.2Å; S159-Q163 VanDerWaalsContact OG-NE2 3.12Å
160	R	79.3	Confident	79.4	Confident	119 Å²	119	39.5 Å²	39.5	45%	0.449	21%	0.208	S	C	.	.	H	α-helix	trans	-64.8	-42.2	174.1	-66.1	-172	-166.1	178.1	10.6	111.7	E156 R157 V162 Q163 S164	E156-R160 PolarHBondContact O-N 3.03Å; E156-R160 IonicContact OE1-CZ 2.71Å; E156-R160 VanDerWaalsContact OE1-CZ 3.26Å; E156-R160 IonicContact OE1-NE 2.62Å; E156-R160 PolarHBondContact OE1-NE 2.97Å; E156-R160 IonicContact OE1-NH2 2.83Å; E156-R160 PolarHBondContact OE1-NH2 2.9Å; E156-R160 IonicContact OE2-CZ 2.75Å; E156-R160 IonicContact OE2-NE 3.32Å; E156-R160 IonicContact OE2-NH2 3.36Å; E156-R160 PolarHBondContact OE2-NH2 3.15Å; R157-R160 PolarHBondContact O-N 3.39Å; R160-V162 PolarHBondContact O-N 3.17Å; R160-Q163 PolarHBondContact O-N 3.49Å; R160-S164 PolarHBondContact O-N 2.87Å; R160-S164 PolarHBondContact O-OG 3.01Å
161	M	79.7	Confident	79.4	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.03	19%	0.194	C	C	.	.	H	α-helix	trans	-64.3	-35.6	177.6	-171.4	-173.1	41.6	0	0	113.4	F152 R157 V158 S164 G165 C167 L703 P762 R765	F152-M161 HydrophobicContact CE2-CE 4.48Å; F152-M161 HydrophobicContact CZ-CE 4.34Å; R157-M161 WeakPolarHBondContact O-CB 3.45Å; R157-M161 PolarHBondContact O-N 2.8Å; V158-M161 HydrophobicContact CB-CE 4.47Å; V158-M161 HydrophobicContact CG1-CE 4.14Å; V158-M161 HydrophobicContact CG2-CE 4.35Å; V158-M161 PolarHBondContact O-N 3.46Å; M161-S164 WeakPolarHBondContact CA-OG 3.09Å; M161-S164 PolarHBondContact O-OG 2.74Å; M161-S164 VanDerWaalsContact O-OG 3.11Å; M161-G165 PolarHBondContact O-N 3.29Å; M161-C167 HydrophobicContact CE-CB 4.02Å; M161-C167 WeakPolarHBondContact CE-SG 3.48Å; M161-C167 HydrophobicContact CG-CB 3.91Å; M161-C167 HydrophobicContact SD-CB 3.92Å; M161-L703 HydrophobicContact CG-CD2 4.28Å; M161-P762 HydrophobicContact CB-CG 3.98Å; M161-P762 HydrophobicContact CG-CG 4.02Å; M161-P762 HydrophobicContact SD-CG 3.74Å; M161-R765 HydrophobicContact SD-CB 4.24Å
162	V	81.6	Confident	79.7	Confident	6 Å²	6	34.6 Å²	34.6	4%	0.036	18%	0.177	C	C	.	.	H	α-helix	trans	-73.1	-33.6	173.9	161.6	0	0	0	0	111.4	V113 L118 V158 S159 R160 G165 F172	V113-V162 HydrophobicContact CB-CG2 4.4Å; V113-V162 HydrophobicContact CG1-CG2 4.23Å; L118-V162 HydrophobicContact CB-CG1 4.17Å; L118-V162 HydrophobicContact CD2-CB 4.08Å; L118-V162 HydrophobicContact CD2-CG1 4.06Å; L118-V162 HydrophobicContact CD2-CG2 4.08Å; V158-V162 HydrophobicContact CG1-CG2 4.44Å; V158-V162 WeakPolarHBondContact O-CB 3.46Å; V158-V162 WeakPolarHBondContact O-CG2 3.28Å; V158-V162 PolarHBondContact O-N 2.94Å; S159-V162 PolarHBondContact O-N 3.45Å; R160-V162 PolarHBondContact O-N 3.17Å; V162-G165 PolarHBondContact O-N 3.06Å; V162-F172 HydrophobicContact CG2-CE2 4.17Å; V162-F172 HydrophobicContact CG2-CZ 3.97Å
163	Q	77	Confident	79.7	Confident	122 Å²	122	37.6 Å²	37.6	57%	0.57	19%	0.188	S	C	*	.	H	α-helix	trans	-71.1	-41.9	173.6	-73.3	169.2	74.8	0	0	112.7	S159 R160 G165	S159-Q163 WeakPolarHBondContact O-CB 3.34Å; S159-Q163 VanDerWaalsContact O-CG 3.24Å; S159-Q163 WeakPolarHBondContact O-CG 3.22Å; S159-Q163 PolarHBondContact O-N 2.99Å; S159-Q163 PolarHBondContact O-NE2 3.32Å; S159-Q163 PolarHBondContact OG-NE2 3.2Å; S159-Q163 VanDerWaalsContact OG-NE2 3.12Å; R160-Q163 PolarHBondContact O-N 3.49Å; Q163-G165 PolarHBondContact O-N 3.38Å
164	S	69.6	Low	79.7	Confident	26 Å²	26	39.5 Å²	39.5	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-69.6	-16.3	172.8	70	0	0	0	0	112.7	R160 M161 G166 S701	R160-S164 PolarHBondContact O-N 2.87Å; R160-S164 PolarHBondContact O-OG 3.01Å; M161-S164 WeakPolarHBondContact CA-OG 3.09Å; M161-S164 PolarHBondContact O-OG 2.74Å; M161-S164 VanDerWaalsContact O-OG 3.11Å; S164-G166 PolarHBondContact O-N 2.95Å; S164-S701 WeakPolarHBondContact CB-O 3.2Å
165	G	66.9	Low	79.7	Confident	6 Å²	6	34.8 Å²	34.8	6%	0.062	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	81	12.9	160.9	0	0	0	0	0	115.9	K112 M161 V162 Q163	K112-G165 WeakPolarHBondContact CD-O 3.14Å; K112-G165 VanDerWaalsContact CE-CA 3.48Å; M161-G165 PolarHBondContact O-N 3.29Å; V162-G165 PolarHBondContact O-N 3.06Å; Q163-G165 PolarHBondContact O-N 3.38Å
166	G	66.1	Low	80	Confident	6 Å²	6	33.5 Å²	33.5	6%	0.062	17%	0.168	C	C	.	.			trans	-90	3.4	179	0	0	0	0	0	115.3	S164 S659 L661	S164-G166 PolarHBondContact O-N 2.95Å; G166-S659 PolarHBondContact O-OG 2.85Å; G166-S659 VanDerWaalsContact O-OG 3.05Å; G166-L661 VanDerWaalsContact CA-CD2 3.49Å
167	C	73.6	Confident	80.3	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.014	16%	0.157	C	C	.	.			trans	-104.3	139.1	-175.3	-161.9	0	0	0	0	113.3	V113 M161 F172	V113-C167 PolarHBondContact N-O 3.13Å; M161-C167 HydrophobicContact CE-CB 4.02Å; M161-C167 WeakPolarHBondContact CE-SG 3.48Å; M161-C167 HydrophobicContact CG-CB 3.91Å; M161-C167 HydrophobicContact SD-CB 3.92Å; C167-F172 HydrophobicContact CB-CE2 4.42Å; C167-F172 VanDerWaalsContact SG-CD2 3.57Å; C167-F172 WeakPolarHBondContact SG-CE2 3.41Å
168	S	80.1	Confident	80.3	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.007	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-112.9	166.9	177.3	77.3	0	0	0	0	112.7	Q110 Q111 N170 D171 F172	Q110-S168 PolarHBondContact OE1-OG 3.1Å; Q110-S168 VanDerWaalsContact OE1-OG 3.12Å; Q111-S168 WeakPolarHBondContact O-CA 3.3Å; Q111-S168 WeakPolarHBondContact O-CB 3.46Å; S168-N170 PolarHBondContact O-N 3.22Å; S168-N170 VanDerWaalsContact O-N 3.15Å; S168-N170 PolarHBondContact OG-N 3.21Å; S168-D171 WeakPolarHBondContact CA-OD2 3.47Å; S168-D171 VanDerWaalsContact CB-OD2 3.29Å; S168-D171 WeakPolarHBondContact CB-OD2 3.3Å; S168-D171 PolarHBondContact N-OD2 3.35Å; S168-D171 PolarHBondContact O-N 3.23Å; S168-D171 VanDerWaalsContact O-N 3.15Å; S168-D171 PolarHBondContact OG-N 3.41Å; S168-D171 PolarHBondContact OG-OD2 3.02Å; S168-F172 WeakPolarHBondContact O-CD2 3.21Å; S168-F172 PolarHBondContact O-N 3.14Å
169	A	79.8	Confident	80.3	Confident	41 Å²	41	35 Å²	35	34%	0.339	18%	0.175	S	C	.	.	H	α-helix	trans	-58.7	-24.7	172	0	0	0	0	0	113.3	R173 Y210	A169-R173 PolarHBondContact O-N 3.46Å; A169-Y210 HydrophobicContact CB-CE1 3.93Å; A169-Y210 VanDerWaalsContact CB-OH 3.29Å; A169-Y210 WeakPolarHBondContact CB-OH 3.48Å
170	N	81.3	Confident	80.4	Confident	62 Å²	62	33.4 Å²	33.4	33%	0.332	17%	0.165	S	C	.	.	H	α-helix	trans	-78.2	-33.1	178.6	-171.8	82.6	0	0	0	112.1	S168 R173 E174	S168-N170 PolarHBondContact O-N 3.22Å; S168-N170 VanDerWaalsContact O-N 3.15Å; S168-N170 PolarHBondContact OG-N 3.21Å; N170-R173 WeakPolarHBondContact O-CB 3.19Å; N170-R173 PolarHBondContact O-N 3.03Å; N170-E174 PolarHBondContact O-N 2.87Å
171	D	82.6	Confident	80.6	Confident	25 Å²	25	29.8 Å²	29.8	13%	0.134	15%	0.153	C	C	.	.	H	α-helix	trans	-65	-43	175.8	-61.7	-69.6	0	0	0	111.1	S168 R173 E174 V175 R765	S168-D171 WeakPolarHBondContact CA-OD2 3.47Å; S168-D171 VanDerWaalsContact CB-OD2 3.29Å; S168-D171 WeakPolarHBondContact CB-OD2 3.3Å; S168-D171 PolarHBondContact N-OD2 3.35Å; S168-D171 PolarHBondContact O-N 3.23Å; S168-D171 VanDerWaalsContact O-N 3.15Å; S168-D171 PolarHBondContact OG-N 3.41Å; S168-D171 PolarHBondContact OG-OD2 3.02Å; D171-R173 VanDerWaalsContact C-N 3.33Å; D171-R173 PolarHBondContact O-N 3.42Å; D171-E174 PolarHBondContact O-N 2.75Å; D171-V175 VanDerWaalsContact O-CG2 3.29Å; D171-V175 WeakPolarHBondContact O-CG2 3.28Å; D171-V175 PolarHBondContact O-N 3.11Å; D171-R765 HydrophobicContact CB-CG 4.49Å
172	F	86.6	Confident	80.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-55.2	-48.9	171.9	-80.5	-121.5	0	0	0	110.8	V113 L118 Y148 F152 L153 V158 V162 C167 S168 V175 F176 Y206 Y210	V113-F172 HydrophobicContact CB-CE2 4.27Å; V113-F172 HydrophobicContact CG1-CE2 4.32Å; V113-F172 HydrophobicContact CG1-CZ 4.17Å; V113-F172 HydrophobicContact CG2-CD2 4.31Å; V113-F172 HydrophobicContact CG2-CE2 3.99Å; L118-F172 HydrophobicContact CD1-CE1 3.88Å; L118-F172 HydrophobicContact CD1-CZ 3.95Å; Y148-F172 WeakPolarHBondContact OH-CB 3.15Å; Y148-F172 PolarHBondContact OH-O 3.45Å; F152-F172 HydrophobicContact CE1-CB 4.44Å; F152-F172 AromaticContact CE1-CD1 3.71Å; F152-F172 HydrophobicContact CE1-CD1 3.71Å; F152-F172 HydrophobicContact CE1-CD2 4.44Å; F152-F172 HydrophobicContact CE1-CE1 4.01Å; F152-F172 AromaticContact CE1-CG 3.93Å; F152-F172 HydrophobicContact CE1-CG 3.93Å; F152-F172 HydrophobicContact CZ-CD1 4.49Å; F152-F172 HydrophobicContact CZ-CD2 4.47Å; F152-F172 HydrophobicContact CZ-CG 4.34Å; L153-F172 HydrophobicContact CD2-CD1 3.76Å; L153-F172 HydrophobicContact CD2-CE1 3.62Å; V158-F172 HydrophobicContact CG1-CE1 4.36Å; V158-F172 HydrophobicContact CG1-CZ 3.9Å; V162-F172 HydrophobicContact CG2-CE2 4.17Å; V162-F172 HydrophobicContact CG2-CZ 3.97Å; C167-F172 HydrophobicContact CB-CE2 4.42Å; C167-F172 VanDerWaalsContact SG-CD2 3.57Å; C167-F172 WeakPolarHBondContact SG-CE2 3.41Å; S168-F172 WeakPolarHBondContact O-CD2 3.21Å; S168-F172 PolarHBondContact O-N 3.14Å; F172-V175 PolarHBondContact O-N 2.87Å; F172-F176 PolarHBondContact O-N 3.13Å; F172-Y206 WeakPolarHBondContact CB-OH 3.47Å; F172-Y210 HydrophobicContact CB-CE2 4.39Å; F172-Y210 HydrophobicContact CD1-CE2 4.35Å
173	R	86.4	Confident	79.9	Confident	68 Å²	68	38.5 Å²	38.5	26%	0.257	19%	0.185	S	C	.	.	H	α-helix	trans	-61.8	-45	179.7	-174.4	-177.5	-175.8	-85.7	9.2	113.1	A169 N170 D171 F176 K177 I203 Y206 D207	A169-R173 PolarHBondContact O-N 3.46Å; N170-R173 WeakPolarHBondContact O-CB 3.19Å; N170-R173 PolarHBondContact O-N 3.03Å; D171-R173 VanDerWaalsContact C-N 3.33Å; D171-R173 PolarHBondContact O-N 3.42Å; R173-F176 PolarHBondContact O-N 2.99Å; R173-K177 WeakPolarHBondContact O-CB 3.16Å; R173-K177 PolarHBondContact O-N 3.17Å; R173-I203 VanDerWaalsContact CZ-CG2 3.45Å; R173-Y206 HydrophobicContact CB-CD1 4.47Å; R173-Y206 HydrophobicContact CB-CE1 3.7Å; R173-Y206 HydrophobicContact CG-CD1 4.08Å; R173-Y206 HydrophobicContact CG-CE1 3.79Å; R173-Y206 PolarHBondContact N-OH 3.32Å; R173-D207 WeakPolarHBondContact CD-OD1 3.32Å; R173-D207 IonicContact CZ-OD2 3.61Å; R173-D207 IonicContact NE-OD1 3.4Å; R173-D207 PolarHBondContact NE-OD1 3.22Å; R173-D207 IonicContact NE-OD2 3.04Å; R173-D207 PolarHBondContact NE-OD2 3.44Å; R173-D207 IonicContact NH2-OD2 2.99Å; R173-D207 PolarHBondContact NH2-OD2 3.42Å
174	E	85.3	Confident	80.1	Confident	40 Å²	40	33 Å²	33	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-77.6	-19	179.5	-63.2	-60.4	115	0	0	113	N170 D171 K177 K178	N170-E174 PolarHBondContact O-N 2.87Å; D171-E174 PolarHBondContact O-N 2.75Å; E174-K177 WeakPolarHBondContact OE2-CD 3.41Å; E174-K177 IonicContact OE2-NZ 3.74Å; E174-K177 PolarHBondContact OE2-NZ 3.26Å; E174-K178 PolarHBondContact O-N 3.06Å; E174-K178 VanDerWaalsContact O-N 3.13Å
175	V	85.8	Confident	80.3	Confident	10 Å²	10	39.3 Å²	39.3	6%	0.061	18%	0.179	C	C	.	.	H	α-helix	trans	-74.1	-44.1	165.6	174	0	0	0	0	111	Y148 F152 D171 F172 K177 K178 N179 F763 R765	Y148-V175 HydrophobicContact CE2-CG1 4.37Å; F152-V175 HydrophobicContact CD2-CB 4.47Å; F152-V175 HydrophobicContact CD2-CG1 3.62Å; F152-V175 HydrophobicContact CE2-CB 4.13Å; F152-V175 HydrophobicContact CE2-CG1 3.74Å; F152-V175 HydrophobicContact CE2-CG2 4.08Å; F152-V175 HydrophobicContact CG-CG1 4.12Å; F152-V175 HydrophobicContact CZ-CB 4.33Å; F152-V175 HydrophobicContact CZ-CG1 4.33Å; F152-V175 HydrophobicContact CZ-CG2 4.41Å; D171-V175 VanDerWaalsContact O-CG2 3.29Å; D171-V175 WeakPolarHBondContact O-CG2 3.28Å; D171-V175 PolarHBondContact O-N 3.11Å; F172-V175 PolarHBondContact O-N 2.87Å; V175-K177 VanDerWaalsContact C-N 3.27Å; V175-K177 PolarHBondContact O-N 2.84Å; V175-K178 PolarHBondContact O-N 3.16Å; V175-N179 PolarHBondContact O-N 3.44Å; V175-F763 HydrophobicContact CG1-CB 4.34Å; V175-F763 HydrophobicContact CG2-CB 4.17Å; V175-R765 HydrophobicContact CG2-CG 4.01Å
176	F	88.2	Confident	80.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-56.1	-45.2	172.2	-179.5	-105	0	0	0	111	F141 V145 Y148 F172 R173 N179 I180 I203 Y206	F141-F176 HydrophobicContact CE2-CE1 4.27Å; F141-F176 AromaticContact CE2-CZ 3.79Å; F141-F176 HydrophobicContact CE2-CZ 3.79Å; F141-F176 HydrophobicContact CZ-CZ 4.46Å; V145-F176 HydrophobicContact CG2-CE2 4.16Å; V145-F176 HydrophobicContact CG2-CZ 4.21Å; Y148-F176 AromaticContact CD1-CD2 3.85Å; Y148-F176 HydrophobicContact CD1-CD2 3.85Å; Y148-F176 HydrophobicContact CD2-CB 4.04Å; Y148-F176 AromaticContact CD2-CD2 3.88Å; Y148-F176 HydrophobicContact CD2-CD2 3.88Å; Y148-F176 HydrophobicContact CD2-CG 4.48Å; Y148-F176 HydrophobicContact CE1-CD2 4.32Å; Y148-F176 HydrophobicContact CE2-CB 3.78Å; Y148-F176 HydrophobicContact CE2-CD2 4.37Å; Y148-F176 AromaticContact CG-CD2 3.59Å; Y148-F176 HydrophobicContact CG-CD2 3.59Å; Y148-F176 HydrophobicContact CG-CE2 4.36Å; F172-F176 PolarHBondContact O-N 3.13Å; R173-F176 PolarHBondContact O-N 2.99Å; F176-N179 WeakPolarHBondContact O-CB 3.28Å; F176-N179 PolarHBondContact O-N 2.84Å; F176-I180 HydrophobicContact CD1-CD1 4.32Å; F176-I180 HydrophobicContact CD1-CG2 4.38Å; F176-I180 HydrophobicContact CD2-CG2 4.45Å; F176-I180 HydrophobicContact CE1-CD1 3.96Å; F176-I180 HydrophobicContact CE1-CG1 4.48Å; F176-I180 HydrophobicContact CE1-CG2 3.86Å; F176-I180 HydrophobicContact CE2-CG2 3.93Å; F176-I180 HydrophobicContact CZ-CG2 3.61Å; F176-I180 WeakPolarHBondContact O-CG1 3.12Å; F176-I180 PolarHBondContact O-N 2.76Å; F176-I203 HydrophobicContact CD1-CD1 4.04Å; F176-Y206 HydrophobicContact CB-CD2 3.76Å; F176-Y206 HydrophobicContact CB-CE2 3.66Å; F176-Y206 AromaticContact CD1-CD2 3.37Å; F176-Y206 HydrophobicContact CD1-CD2 3.37Å; F176-Y206 HydrophobicContact CD1-CE2 4.18Å; F176-Y206 AromaticContact CD1-CG 3.64Å; F176-Y206 HydrophobicContact CD1-CG 3.64Å; F176-Y206 AromaticContact CD2-CD2 3.86Å; F176-Y206 HydrophobicContact CD2-CD2 3.86Å; F176-Y206 HydrophobicContact CD2-CE2 4.31Å; F176-Y206 AromaticContact CE1-CD2 3.87Å; F176-Y206 HydrophobicContact CE1-CD2 3.87Å; F176-Y206 HydrophobicContact CE1-CG 4.01Å; F176-Y206 HydrophobicContact CE2-CD2 4.31Å; F176-Y206 AromaticContact CG-CD2 3.36Å; F176-Y206 HydrophobicContact CG-CD2 3.36Å; F176-Y206 AromaticContact CG-CE2 3.79Å; F176-Y206 HydrophobicContact CG-CE2 3.79Å; F176-Y206 HydrophobicContact CG-CG 4.11Å; F176-Y206 HydrophobicContact CZ-CD2 4.32Å
177	K	87.4	Confident	80.7	Confident	62 Å²	62	46.6 Å²	46.6	27%	0.27	22%	0.222	S	C	.	.	H	α-helix	trans	-54.9	-52.2	174	-170.5	-167.3	171.8	-157.6	0	113	R173 E174 V175 N179 I180 E181 I203	R173-K177 WeakPolarHBondContact O-CB 3.16Å; R173-K177 PolarHBondContact O-N 3.17Å; E174-K177 WeakPolarHBondContact OE2-CD 3.41Å; E174-K177 IonicContact OE2-NZ 3.74Å; E174-K177 PolarHBondContact OE2-NZ 3.26Å; V175-K177 VanDerWaalsContact C-N 3.27Å; V175-K177 PolarHBondContact O-N 2.84Å; K177-N179 VanDerWaalsContact C-N 3.29Å; K177-N179 PolarHBondContact O-N 2.84Å; K177-I180 VanDerWaalsContact O-CG1 3.27Å; K177-I180 WeakPolarHBondContact O-CG1 3.34Å; K177-I180 PolarHBondContact O-N 2.82Å; K177-E181 VanDerWaalsContact CE-OE1 3.29Å; K177-E181 WeakPolarHBondContact CE-OE1 3.1Å; K177-E181 HydrophobicContact CG-CG 4.49Å; K177-E181 WeakPolarHBondContact O-CG 3.34Å; K177-E181 PolarHBondContact O-N 3.1Å; K177-I203 HydrophobicContact CB-CD1 3.75Å; K177-I203 HydrophobicContact CG-CD1 4.06Å
178	K	82.4	Confident	80.6	Confident	63 Å²	63	51.4 Å²	51.4	27%	0.274	25%	0.254	S	S	.	.	H	α-helix	trans	-58.1	-39.5	177.1	-80.7	-162	170.9	-166.4	0	111.8	E174 V175 E854	E174-K178 PolarHBondContact O-N 3.06Å; E174-K178 VanDerWaalsContact O-N 3.13Å; V175-K178 PolarHBondContact O-N 3.16Å; K178-E854 IonicContact NZ-OE2 3.45Å; K178-E854 PolarHBondContact NZ-OE2 3.14Å
179	N	83.3	Confident	79.9	Confident	37 Å²	37	59.1 Å²	59.1	20%	0.198	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-48.9	175.5	-174	-54.3	0	0	0	112.1	V175 F176 K177 E181 R183	V175-N179 PolarHBondContact O-N 3.44Å; F176-N179 WeakPolarHBondContact O-CB 3.28Å; F176-N179 PolarHBondContact O-N 2.84Å; K177-N179 VanDerWaalsContact C-N 3.29Å; K177-N179 PolarHBondContact O-N 2.84Å; N179-E181 PolarHBondContact O-N 3.15Å; N179-R183 PolarHBondContact OD1-NE 3.42Å
180	I	86.5	Confident	79.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-72.1	-28.4	-179.1	62.7	165.4	0	0	0	113.6	A144 F176 K177 R182 R183 V184 L199 W202 I203	A144-I180 HydrophobicContact CB-CG2 3.97Å; F176-I180 HydrophobicContact CD1-CD1 4.32Å; F176-I180 HydrophobicContact CD1-CG2 4.38Å; F176-I180 HydrophobicContact CD2-CG2 4.45Å; F176-I180 HydrophobicContact CE1-CD1 3.96Å; F176-I180 HydrophobicContact CE1-CG1 4.48Å; F176-I180 HydrophobicContact CE1-CG2 3.86Å; F176-I180 HydrophobicContact CE2-CG2 3.93Å; F176-I180 HydrophobicContact CZ-CG2 3.61Å; F176-I180 WeakPolarHBondContact O-CG1 3.12Å; F176-I180 PolarHBondContact O-N 2.76Å; K177-I180 VanDerWaalsContact O-CG1 3.27Å; K177-I180 WeakPolarHBondContact O-CG1 3.34Å; K177-I180 PolarHBondContact O-N 2.82Å; I180-R182 PolarHBondContact O-N 2.88Å; I180-R183 PolarHBondContact O-N 3.03Å; I180-V184 WeakPolarHBondContact O-CB 3.4Å; I180-V184 WeakPolarHBondContact O-CG2 3.48Å; I180-V184 PolarHBondContact O-N 2.92Å; I180-L199 HydrophobicContact CD1-CD1 3.59Å; I180-L199 HydrophobicContact CD1-CG 4.31Å; I180-L199 HydrophobicContact CG1-CD1 3.66Å; I180-W202 HydrophobicContact CB-CE3 3.75Å; I180-W202 HydrophobicContact CB-CZ3 4.05Å; I180-W202 HydrophobicContact CD1-CB 3.85Å; I180-W202 HydrophobicContact CD1-CE3 4.17Å; I180-W202 HydrophobicContact CG2-CE3 3.71Å; I180-W202 HydrophobicContact CG2-CZ3 4.02Å; I180-I203 HydrophobicContact CD1-CD1 4.08Å; I180-I203 HydrophobicContact CD1-CG1 3.97Å
181	E	82.8	Confident	78.3	Confident	42 Å²	42	68.4 Å²	68.4	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-58.9	-43.1	177.3	-83.4	-177.3	-154.6	0	0	112.3	K177 N179 R185 L199	K177-E181 VanDerWaalsContact CE-OE1 3.29Å; K177-E181 WeakPolarHBondContact CE-OE1 3.1Å; K177-E181 HydrophobicContact CG-CG 4.49Å; K177-E181 WeakPolarHBondContact O-CG 3.34Å; K177-E181 PolarHBondContact O-N 3.1Å; N179-E181 PolarHBondContact O-N 3.15Å; E181-R185 VanDerWaalsContact O-CG 3.23Å; E181-R185 WeakPolarHBondContact O-CG 3.41Å; E181-R185 PolarHBondContact O-N 3.5Å; E181-R185 IonicContact OE2-CZ 3.77Å; E181-R185 IonicContact OE2-NH1 3.36Å; E181-R185 IonicContact OE2-NH2 3.63Å; E181-R185 PolarHBondContact OE2-NH2 3.28Å; E181-L199 HydrophobicContact CB-CD1 4.46Å; E181-L199 HydrophobicContact CG-CD1 3.66Å; E181-L199 HydrophobicContact CG-CD2 4.05Å
182	R	69.3	Low	77.5	Confident	110 Å²	110	71.6 Å²	71.6	42%	0.415	37%	0.371	S	S	.	.	H	α-helix	trans	-64.6	-43.7	176.9	-159.7	175.8	-170.3	-149.3	0.7	110.9	I180 R185 S186 E850	I180-R182 PolarHBondContact O-N 2.88Å; R182-R185 PolarHBondContact O-N 2.99Å; R182-S186 PolarHBondContact O-N 2.84Å; R182-S186 PolarHBondContact O-OG 3.42Å; R182-E850 WeakPolarHBondContact CD-OE1 3.44Å; R182-E850 IonicContact CZ-OE1 2.71Å; R182-E850 IonicContact NE-OE1 3.16Å; R182-E850 PolarHBondContact NE-OE1 3Å; R182-E850 IonicContact NH1-OE1 2.78Å; R182-E850 PolarHBondContact NH1-OE1 3.15Å
183	R	76.8	Confident	77	Confident	85 Å²	85	76.3 Å²	76.3	32%	0.321	40%	0.396	S	S	.	.	H	α-helix	trans	-61.3	-48.2	177.4	-65	173.9	176.9	-88.7	-16.3	112.3	S147 N179 I180 R185 S186 L187	S147-R183 PolarHBondContact OG-NH2 3.33Å; N179-R183 PolarHBondContact OD1-NE 3.42Å; I180-R183 PolarHBondContact O-N 3.03Å; R183-R185 VanDerWaalsContact C-N 3.33Å; R183-R185 PolarHBondContact O-N 3.2Å; R183-S186 PolarHBondContact O-N 2.98Å; R183-S186 VanDerWaalsContact O-N 3.14Å; R183-S186 PolarHBondContact O-OG 3.43Å; R183-L187 PolarHBondContact O-N 2.99Å
184	V	80.4	Confident	76.8	Confident	6 Å²	6	75.9 Å²	75.9	4%	0.036	40%	0.403	C	S	.	.	H	α-helix	trans	-69.6	-28.8	-179.2	174.5	0	0	0	0	112.1	I180 S186 L187 K195 V198 W202	I180-V184 WeakPolarHBondContact O-CB 3.4Å; I180-V184 WeakPolarHBondContact O-CG2 3.48Å; I180-V184 PolarHBondContact O-N 2.92Å; V184-S186 VanDerWaalsContact C-N 3.35Å; V184-L187 HydrophobicContact CG2-CD1 4.48Å; V184-L187 PolarHBondContact O-N 3.44Å; V184-K195 HydrophobicContact CG1-CB 3.89Å; V184-K195 HydrophobicContact CG1-CG 4.05Å; V184-V198 HydrophobicContact CG1-CB 4.23Å; V184-V198 HydrophobicContact CG1-CG1 4.29Å; V184-V198 HydrophobicContact CG2-CG1 3.94Å; V184-W202 HydrophobicContact CG2-CE3 3.9Å; V184-W202 HydrophobicContact CG2-CH2 4.13Å; V184-W202 HydrophobicContact CG2-CZ3 3.68Å
185	R	74.3	Confident	76.6	Confident	160 Å²	160	77.4 Å²	77.4	60%	0.604	41%	0.409	S	S	*	.	H	α-helix	trans	-64.2	-38	169.2	-73.8	168.6	-169.4	129	12	112.3	E181 R182 R183	E181-R185 VanDerWaalsContact O-CG 3.23Å; E181-R185 WeakPolarHBondContact O-CG 3.41Å; E181-R185 PolarHBondContact O-N 3.5Å; E181-R185 IonicContact OE2-CZ 3.77Å; E181-R185 IonicContact OE2-NH1 3.36Å; E181-R185 IonicContact OE2-NH2 3.63Å; E181-R185 PolarHBondContact OE2-NH2 3.28Å; R182-R185 PolarHBondContact O-N 2.99Å; R183-R185 VanDerWaalsContact C-N 3.33Å; R183-R185 PolarHBondContact O-N 3.2Å
186	S	69.1	Low	76.4	Confident	97 Å²	97	84.1 Å²	84.1	68%	0.678	44%	0.44	S	S	*	.	H	α-helix	trans	-80.9	-8.8	178.8	55.4	0	0	0	0	115.5	R182 R183 V184	R182-S186 PolarHBondContact O-N 2.84Å; R182-S186 PolarHBondContact O-OG 3.42Å; R183-S186 PolarHBondContact O-N 2.98Å; R183-S186 VanDerWaalsContact O-N 3.14Å; R183-S186 PolarHBondContact O-OG 3.43Å; V184-S186 VanDerWaalsContact C-N 3.35Å
187	L	73.7	Confident	76.2	Confident	67 Å²	67	87.8 Å²	87.8	35%	0.351	46%	0.463	S	S	.	.	S	Bend	trans	-71.9	142.5	175.4	-72.6	176.3	0	0	0	111.3	R183 V184 W202	R183-L187 PolarHBondContact O-N 2.99Å; V184-L187 HydrophobicContact CG2-CD1 4.48Å; V184-L187 PolarHBondContact O-N 3.44Å; L187-W202 HydrophobicContact CD1-CH2 4.39Å
188	P	71.5	Confident	76.1	Confident	104 Å²	104	86.4 Å²	86.4	68%	0.675	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-61.3	151.6	170.6	28.6	-35.1	0	0	0	110.4
189	E	65.3	Low	76.3	Confident	162 Å²	162	85 Å²	85	76%	0.757	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-78.6	130.8	-178.6	-59.4	-165.2	156.2	0	0	110.4	K195	E189-K195 VanDerWaalsContact CG-NZ 3.35Å; E189-K195 IonicContact OE1-NZ 3.93Å; E189-K195 PolarHBondContact OE1-NZ 3.46Å
190	I	70.4	Confident	76.4	Confident	127 Å²	127	86.7 Å²	86.7	65%	0.651	47%	0.469	S	S	*	.			trans	-108.8	124.4	-177.8	-57.6	175.5	0	0	0	107.4	G192 L193	I190-G192 PolarHBondContact O-N 3.13Å; I190-L193 PolarHBondContact O-N 3.33Å
191	D	56.5	Low	76.5	Confident	172 Å²	172	89.3 Å²	89.3	92%	0.92	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	124.5	-177.2	-80.7	-46.1	0	0	0	112.1
192	G	66.4	Low	76.9	Confident	92 Å²	92	87.6 Å²	87.6	95%	0.948	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	0.4	175.9	0	0	0	0	0	116.8	I190	I190-G192 PolarHBondContact O-N 3.13Å
193	L	75.6	Confident	77.9	Confident	99 Å²	99	83 Å²	83	52%	0.518	46%	0.463	S	S	.	.			trans	-129.8	109	-175.9	-147.5	160.4	0	0	0	112.4	I190 T197 V198	I190-L193 PolarHBondContact O-N 3.33Å; L193-T197 HydrophobicContact CD2-CG2 4.33Å; L193-V198 HydrophobicContact CD2-CG2 3.47Å; L193-V198 VanDerWaalsContact CD2-CG2 3.47Å
194	S	81.1	Confident	78.4	Confident	59 Å²	59	83.1 Å²	83.1	41%	0.413	47%	0.473	S	S	.	.			trans	-73.9	145.5	-174.6	77.5	0	0	0	0	113.2	E196 T197 V198	S194-E196 PolarHBondContact O-N 3.28Å; S194-T197 WeakPolarHBondContact O-CA 3.42Å; S194-T197 WeakPolarHBondContact O-CB 3.32Å; S194-T197 PolarHBondContact O-N 2.68Å; S194-T197 PolarHBondContact OG-N 2.76Å; S194-T197 PolarHBondContact OG-OG1 3.19Å; S194-V198 PolarHBondContact O-N 3.45Å; S194-V198 VanDerWaalsContact O-N 3.07Å
195	K	81.1	Confident	78.8	Confident	71 Å²	71	84.6 Å²	84.6	31%	0.309	48%	0.479	S	S	.	.	H	α-helix	trans	-55.9	-33.9	176.7	-75.9	169.6	170.8	165	0	112.7	V184 E189 V198 L199	V184-K195 HydrophobicContact CG1-CB 3.89Å; V184-K195 HydrophobicContact CG1-CG 4.05Å; E189-K195 VanDerWaalsContact CG-NZ 3.35Å; E189-K195 IonicContact OE1-NZ 3.93Å; E189-K195 PolarHBondContact OE1-NZ 3.46Å; K195-V198 PolarHBondContact O-N 3.19Å; K195-L199 WeakPolarHBondContact O-CB 3.32Å; K195-L199 PolarHBondContact O-N 2.77Å
196	E	82.8	Confident	79.6	Confident	151 Å²	151	77 Å²	77	71%	0.706	45%	0.451	S	S	*	.	H	α-helix	trans	-67.7	-33.3	173.2	-61.2	-178.5	157.8	0	0	113.3	S194 S200	S194-E196 PolarHBondContact O-N 3.28Å; E196-S200 WeakPolarHBondContact O-CB 3.32Å; E196-S200 PolarHBondContact O-N 3.03Å; E196-S200 PolarHBondContact O-OG 3.28Å
197	T	84.3	Confident	80.5	Confident	78 Å²	78	74 Å²	74	48%	0.479	43%	0.427	S	S	.	.	H	α-helix	trans	-71.5	-40	175.6	-55.2	0	0	0	0	110.8	L193 S194 S200 S201	L193-T197 HydrophobicContact CD2-CG2 4.33Å; S194-T197 WeakPolarHBondContact O-CA 3.42Å; S194-T197 WeakPolarHBondContact O-CB 3.32Å; S194-T197 PolarHBondContact O-N 2.68Å; S194-T197 PolarHBondContact OG-N 2.76Å; S194-T197 PolarHBondContact OG-OG1 3.19Å; T197-S200 PolarHBondContact O-N 2.97Å; T197-S201 VanDerWaalsContact O-CB 3.26Å; T197-S201 WeakPolarHBondContact O-CB 3.24Å; T197-S201 PolarHBondContact O-N 3.36Å
198	V	84.1	Confident	81.1	Confident	32 Å²	32	73.9 Å²	73.9	19%	0.194	43%	0.429	C	S	.	.	H	α-helix	trans	-58.1	-51.6	170.7	-178.5	0	0	0	0	110.1	V184 L193 S194 K195 S200 S201 W202	V184-V198 HydrophobicContact CG1-CB 4.23Å; V184-V198 HydrophobicContact CG1-CG1 4.29Å; V184-V198 HydrophobicContact CG2-CG1 3.94Å; L193-V198 HydrophobicContact CD2-CG2 3.47Å; L193-V198 VanDerWaalsContact CD2-CG2 3.47Å; S194-V198 PolarHBondContact O-N 3.45Å; S194-V198 VanDerWaalsContact O-N 3.07Å; K195-V198 PolarHBondContact O-N 3.19Å; V198-S200 VanDerWaalsContact C-N 3.35Å; V198-S200 PolarHBondContact O-N 3.1Å; V198-S201 WeakPolarHBondContact O-CB 3.37Å; V198-S201 PolarHBondContact O-N 3.49Å; V198-W202 HydrophobicContact CG1-CD2 4.08Å; V198-W202 HydrophobicContact CG1-CG 4.32Å; V198-W202 HydrophobicContact CG1-CZ2 4.23Å; V198-W202 WeakPolarHBondContact O-CB 3.25Å; V198-W202 PolarHBondContact O-N 2.76Å
199	L	86.2	Confident	81.9	Confident	34 Å²	34	69.1 Å²	69.1	18%	0.178	40%	0.398	C	S	.	.	H	α-helix	trans	-56	-47.8	179.3	-165.6	78.7	0	0	0	111.8	I180 E181 K195 W202 I203	I180-L199 HydrophobicContact CD1-CD1 3.59Å; I180-L199 HydrophobicContact CD1-CG 4.31Å; I180-L199 HydrophobicContact CG1-CD1 3.66Å; E181-L199 HydrophobicContact CB-CD1 4.46Å; E181-L199 HydrophobicContact CG-CD1 3.66Å; E181-L199 HydrophobicContact CG-CD2 4.05Å; K195-L199 WeakPolarHBondContact O-CB 3.32Å; K195-L199 PolarHBondContact O-N 2.77Å; L199-W202 PolarHBondContact O-N 3Å; L199-I203 WeakPolarHBondContact O-CB 3.25Å; L199-I203 VanDerWaalsContact O-CG1 3.24Å; L199-I203 WeakPolarHBondContact O-CG1 3.35Å; L199-I203 PolarHBondContact O-N 2.89Å
200	S	86.8	Confident	82.9	Confident	72 Å²	72	63.6 Å²	63.6	50%	0.503	37%	0.37	S	S	.	.	H	α-helix	trans	-66.2	-38.1	179.9	-57.7	0	0	0	0	112.6	E196 T197 V198 T204	E196-S200 WeakPolarHBondContact O-CB 3.32Å; E196-S200 PolarHBondContact O-N 3.03Å; E196-S200 PolarHBondContact O-OG 3.28Å; T197-S200 PolarHBondContact O-N 2.97Å; V198-S200 VanDerWaalsContact C-N 3.35Å; V198-S200 PolarHBondContact O-N 3.1Å; S200-T204 WeakPolarHBondContact O-CB 3.43Å; S200-T204 PolarHBondContact O-N 3.07Å; S200-T204 PolarHBondContact O-OG1 3.46Å
201	S	88.4	Confident	83.4	Confident	55 Å²	55	63.4 Å²	63.4	39%	0.385	36%	0.361	S	S	.	.	H	α-helix	trans	-64.4	-49.3	174.4	-179.9	0	0	0	0	111.4	T197 V198 I203 T204 K205	T197-S201 VanDerWaalsContact O-CB 3.26Å; T197-S201 WeakPolarHBondContact O-CB 3.24Å; T197-S201 PolarHBondContact O-N 3.36Å; V198-S201 WeakPolarHBondContact O-CB 3.37Å; V198-S201 PolarHBondContact O-N 3.49Å; S201-I203 PolarHBondContact O-N 3.12Å; S201-T204 WeakPolarHBondContact O-CA 3.16Å; S201-T204 WeakPolarHBondContact O-CB 3.38Å; S201-T204 PolarHBondContact O-N 3.3Å; S201-K205 WeakPolarHBondContact O-CG 3.49Å; S201-K205 PolarHBondContact O-N 2.99Å
202	W	90.3	Very high	84.2	Confident	7 Å²	7	55.9 Å²	55.9	3%	0.027	32%	0.324	C	S	.	.	H	α-helix	trans	-63.1	-38.2	178	-75.3	11.6	0	0	0	112.8	D138 A140 F141 A144 I180 V184 L187 V198 L199 T204 K205 Y206	D138-W202 WeakPolarHBondContact OD2-CZ2 3.25Å; D138-W202 PolarHBondContact OD2-NE1 3Å; A140-W202 HydrophobicContact CB-CH2 3.92Å; A140-W202 HydrophobicContact CB-CZ2 3.82Å; F141-W202 HydrophobicContact CB-CD2 4.29Å; F141-W202 HydrophobicContact CB-CZ2 4.03Å; F141-W202 HydrophobicContact CD2-CB 3.8Å; F141-W202 AromaticContact CD2-CD1 3.72Å; F141-W202 AromaticContact CD2-CD2 3.65Å; F141-W202 HydrophobicContact CD2-CD2 3.65Å; F141-W202 HydrophobicContact CD2-CE3 4.16Å; F141-W202 AromaticContact CD2-CG 3.46Å; F141-W202 HydrophobicContact CD2-CG 3.46Å; F141-W202 VanDerWaalsContact CD2-CG 3.46Å; F141-W202 HydrophobicContact CE2-CB 3.85Å; F141-W202 HydrophobicContact CE2-CG 4.05Å; F141-W202 WeakPolarHBondContact CE2-O 3.14Å; F141-W202 HydrophobicContact CG-CD2 4.44Å; F141-W202 HydrophobicContact CG-CG 4.38Å; A144-W202 HydrophobicContact CB-CZ3 4.1Å; I180-W202 HydrophobicContact CB-CE3 3.75Å; I180-W202 HydrophobicContact CB-CZ3 4.05Å; I180-W202 HydrophobicContact CD1-CB 3.85Å; I180-W202 HydrophobicContact CD1-CE3 4.17Å; I180-W202 HydrophobicContact CG2-CE3 3.71Å; I180-W202 HydrophobicContact CG2-CZ3 4.02Å; V184-W202 HydrophobicContact CG2-CE3 3.9Å; V184-W202 HydrophobicContact CG2-CH2 4.13Å; V184-W202 HydrophobicContact CG2-CZ3 3.68Å; L187-W202 HydrophobicContact CD1-CH2 4.39Å; V198-W202 HydrophobicContact CG1-CD2 4.08Å; V198-W202 HydrophobicContact CG1-CG 4.32Å; V198-W202 HydrophobicContact CG1-CZ2 4.23Å; V198-W202 WeakPolarHBondContact O-CB 3.25Å; V198-W202 PolarHBondContact O-N 2.76Å; L199-W202 PolarHBondContact O-N 3Å; W202-T204 VanDerWaalsContact C-N 3.33Å; W202-K205 PolarHBondContact O-N 2.8Å; W202-Y206 WeakPolarHBondContact O-CB 3.42Å; W202-Y206 PolarHBondContact O-N 2.95Å
203	I	90.1	Very high	83.7	Confident	13 Å²	13	56.7 Å²	56.7	7%	0.067	30%	0.304	C	S	.	.	H	α-helix	trans	-64.8	-37.6	171.6	-71.3	-72	0	0	0	111.5	R173 F176 K177 I180 L199 S201 Y206 D207	R173-I203 VanDerWaalsContact CZ-CG2 3.45Å; F176-I203 HydrophobicContact CD1-CD1 4.04Å; K177-I203 HydrophobicContact CB-CD1 3.75Å; K177-I203 HydrophobicContact CG-CD1 4.06Å; I180-I203 HydrophobicContact CD1-CD1 4.08Å; I180-I203 HydrophobicContact CD1-CG1 3.97Å; L199-I203 WeakPolarHBondContact O-CB 3.25Å; L199-I203 VanDerWaalsContact O-CG1 3.24Å; L199-I203 WeakPolarHBondContact O-CG1 3.35Å; L199-I203 PolarHBondContact O-N 2.89Å; S201-I203 PolarHBondContact O-N 3.12Å; I203-Y206 WeakPolarHBondContact O-CB 3.32Å; I203-Y206 PolarHBondContact O-N 3.25Å; I203-D207 VanDerWaalsContact O-CB 3.3Å; I203-D207 WeakPolarHBondContact O-CB 3.46Å; I203-D207 PolarHBondContact O-N 3.02Å
204	T	88.2	Confident	82.3	Confident	88 Å²	88	60 Å²	60	54%	0.54	32%	0.316	S	S	.	.	H	α-helix	trans	-66.5	-40.9	175	-54.5	0	0	0	0	111.4	S200 S201 W202 D207 T208	S200-T204 WeakPolarHBondContact O-CB 3.43Å; S200-T204 PolarHBondContact O-N 3.07Å; S200-T204 PolarHBondContact O-OG1 3.46Å; S201-T204 WeakPolarHBondContact O-CA 3.16Å; S201-T204 WeakPolarHBondContact O-CB 3.38Å; S201-T204 PolarHBondContact O-N 3.3Å; W202-T204 VanDerWaalsContact C-N 3.33Å; T204-D207 PolarHBondContact O-N 3.47Å; T204-T208 PolarHBondContact O-N 2.9Å; T204-T208 VanDerWaalsContact O-N 3.14Å; T204-T208 PolarHBondContact O-OG1 3.47Å
205	K	89.5	Confident	80.6	Confident	37 Å²	37	60.7 Å²	60.7	16%	0.161	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-46.2	172.5	-65.7	-176.2	-168.7	-167.6	0	111.4	I136 D138 F141 S201 W202 D207 T208 I209	I136-K205 WeakPolarHBondContact O-CE 3.49Å; I136-K205 PolarHBondContact O-NZ 3.2Å; D138-K205 IonicContact OD1-NZ 2.75Å; D138-K205 PolarHBondContact OD1-NZ 3.27Å; F141-K205 HydrophobicContact CD1-CD 3.88Å; F141-K205 HydrophobicContact CD2-CD 4.41Å; F141-K205 HydrophobicContact CE1-CB 3.76Å; F141-K205 HydrophobicContact CE1-CD 3.77Å; F141-K205 HydrophobicContact CE1-CG 4.42Å; F141-K205 HydrophobicContact CE2-CB 3.94Å; F141-K205 HydrophobicContact CE2-CD 4.31Å; F141-K205 HydrophobicContact CG-CD 4.2Å; F141-K205 HydrophobicContact CZ-CB 3.35Å; F141-K205 HydrophobicContact CZ-CD 4.01Å; F141-K205 HydrophobicContact CZ-CG 4.31Å; S201-K205 WeakPolarHBondContact O-CG 3.49Å; S201-K205 PolarHBondContact O-N 2.99Å; W202-K205 PolarHBondContact O-N 2.8Å; K205-D207 VanDerWaalsContact C-N 3.34Å; K205-D207 PolarHBondContact O-N 3.45Å; K205-T208 WeakPolarHBondContact O-CB 3.49Å; K205-T208 PolarHBondContact O-N 3.01Å; K205-T208 VanDerWaalsContact O-N 3.12Å; K205-I209 WeakPolarHBondContact O-CG1 3.33Å; K205-I209 PolarHBondContact O-N 2.82Å
206	Y	89.9	Confident	78.9	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	33%	0.329	C	S	.	.	H	α-helix	trans	-55.9	-47.5	173.1	169	-79.9	0	0	0	111.8	F125 Y148 F172 R173 F176 W202 I203 T208 I209 Y210	F125-Y206 HydrophobicContact CE1-CD2 4.22Å; F125-Y206 HydrophobicContact CE1-CE2 4.27Å; F125-Y206 AromaticContact CZ-CD2 3.69Å; F125-Y206 HydrophobicContact CZ-CD2 3.69Å; F125-Y206 AromaticContact CZ-CE2 3.58Å; F125-Y206 HydrophobicContact CZ-CE2 3.58Å; Y148-Y206 AromaticContact CE1-CE2 3.85Å; Y148-Y206 HydrophobicContact CE1-CE2 3.85Å; F172-Y206 WeakPolarHBondContact CB-OH 3.47Å; R173-Y206 HydrophobicContact CB-CD1 4.47Å; R173-Y206 HydrophobicContact CB-CE1 3.7Å; R173-Y206 HydrophobicContact CG-CD1 4.08Å; R173-Y206 HydrophobicContact CG-CE1 3.79Å; R173-Y206 PolarHBondContact N-OH 3.32Å; F176-Y206 HydrophobicContact CB-CD2 3.76Å; F176-Y206 HydrophobicContact CB-CE2 3.66Å; F176-Y206 AromaticContact CD1-CD2 3.37Å; F176-Y206 HydrophobicContact CD1-CD2 3.37Å; F176-Y206 HydrophobicContact CD1-CE2 4.18Å; F176-Y206 AromaticContact CD1-CG 3.64Å; F176-Y206 HydrophobicContact CD1-CG 3.64Å; F176-Y206 AromaticContact CD2-CD2 3.86Å; F176-Y206 HydrophobicContact CD2-CD2 3.86Å; F176-Y206 HydrophobicContact CD2-CE2 4.31Å; F176-Y206 AromaticContact CE1-CD2 3.87Å; F176-Y206 HydrophobicContact CE1-CD2 3.87Å; F176-Y206 HydrophobicContact CE1-CG 4.01Å; F176-Y206 HydrophobicContact CE2-CD2 4.31Å; F176-Y206 AromaticContact CG-CD2 3.36Å; F176-Y206 HydrophobicContact CG-CD2 3.36Å; F176-Y206 AromaticContact CG-CE2 3.79Å; F176-Y206 HydrophobicContact CG-CE2 3.79Å; F176-Y206 HydrophobicContact CG-CG 4.11Å; F176-Y206 HydrophobicContact CZ-CD2 4.32Å; W202-Y206 WeakPolarHBondContact O-CB 3.42Å; W202-Y206 PolarHBondContact O-N 2.95Å; I203-Y206 WeakPolarHBondContact O-CB 3.32Å; I203-Y206 PolarHBondContact O-N 3.25Å; Y206-T208 PolarHBondContact O-N 2.87Å; Y206-T208 VanDerWaalsContact O-N 3.15Å; Y206-I209 PolarHBondContact O-N 2.86Å; Y206-Y210 HydrophobicContact CE1-CD2 4.26Å; Y206-Y210 HydrophobicContact CE1-CG 4.45Å; Y206-Y210 AromaticContact CZ-CD2 3.9Å; Y206-Y210 WeakPolarHBondContact O-CB 3.14Å; Y206-Y210 PolarHBondContact O-N 3.04Å; Y206-Y210 VanDerWaalsContact OH-CD2 3.29Å; Y206-Y210 WeakPolarHBondContact OH-CD2 3.25Å
207	D	88.4	Confident	77.1	Confident	34 Å²	34	67.1 Å²	67.1	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-65.5	-14.7	-179.7	-86.6	-28.2	0	0	0	112.4	R173 I203 T204 K205 R211	R173-D207 WeakPolarHBondContact CD-OD1 3.32Å; R173-D207 IonicContact CZ-OD2 3.61Å; R173-D207 IonicContact NE-OD1 3.4Å; R173-D207 PolarHBondContact NE-OD1 3.22Å; R173-D207 IonicContact NE-OD2 3.04Å; R173-D207 PolarHBondContact NE-OD2 3.44Å; R173-D207 IonicContact NH2-OD2 2.99Å; R173-D207 PolarHBondContact NH2-OD2 3.42Å; I203-D207 VanDerWaalsContact O-CB 3.3Å; I203-D207 WeakPolarHBondContact O-CB 3.46Å; I203-D207 PolarHBondContact O-N 3.02Å; T204-D207 PolarHBondContact O-N 3.47Å; K205-D207 VanDerWaalsContact C-N 3.34Å; K205-D207 PolarHBondContact O-N 3.45Å; D207-R211 VanDerWaalsContact O-CZ 3.27Å; D207-R211 PolarHBondContact O-NE 2.81Å; D207-R211 PolarHBondContact O-NH2 3.21Å; D207-R211 IonicContact OD1-NH2 3.62Å
208	T	87.1	Confident	75.4	Confident	64 Å²	64	72.3 Å²	72.3	39%	0.393	35%	0.349	S	S	.	.	H	α-helix	trans	-87.5	-50.6	167.6	-57.8	0	0	0	0	111.8	I135 T204 K205 Y206 Y210 R211 G212	I135-T208 HydrophobicContact CD1-CG2 3.8Å; I135-T208 HydrophobicContact CG1-CG2 4.29Å; T204-T208 PolarHBondContact O-N 2.9Å; T204-T208 VanDerWaalsContact O-N 3.14Å; T204-T208 PolarHBondContact O-OG1 3.47Å; K205-T208 WeakPolarHBondContact O-CB 3.49Å; K205-T208 PolarHBondContact O-N 3.01Å; K205-T208 VanDerWaalsContact O-N 3.12Å; Y206-T208 PolarHBondContact O-N 2.87Å; Y206-T208 VanDerWaalsContact O-N 3.15Å; T208-Y210 VanDerWaalsContact C-N 3.27Å; T208-Y210 PolarHBondContact O-N 3.13Å; T208-R211 PolarHBondContact O-N 2.92Å; T208-R211 VanDerWaalsContact O-N 3.09Å; T208-G212 PolarHBondContact O-N 2.86Å
209	I	87.5	Confident	73.2	Confident	4 Å²	4	77.3 Å²	77.3	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-55.6	-44.5	178.6	-60.2	164.3	0	0	0	110.4	H124 F125 F128 I135 F141 V145 K205 Y206 R211 G212	H124-I209 WeakPolarHBondContact CB-O 3.06Å; H124-I209 PolarHBondContact ND1-O 2.84Å; F125-I209 HydrophobicContact CD1-CG2 4.35Å; F125-I209 HydrophobicContact CD2-CG2 3.48Å; F125-I209 VanDerWaalsContact CD2-CG2 3.48Å; F125-I209 HydrophobicContact CE1-CG2 4.36Å; F125-I209 HydrophobicContact CE2-CB 4.18Å; F125-I209 HydrophobicContact CE2-CG2 3.53Å; F125-I209 HydrophobicContact CG-CG2 3.92Å; F125-I209 HydrophobicContact CZ-CB 4.36Å; F125-I209 HydrophobicContact CZ-CG2 3.97Å; F128-I209 HydrophobicContact CB-CD1 4.41Å; F128-I209 HydrophobicContact CB-CG1 4.42Å; F128-I209 HydrophobicContact CB-CG2 4.19Å; F128-I209 HydrophobicContact CD1-CD1 3.99Å; F128-I209 HydrophobicContact CD2-CD1 3.73Å; F128-I209 HydrophobicContact CD2-CG1 3.98Å; F128-I209 HydrophobicContact CE1-CD1 4.22Å; F128-I209 HydrophobicContact CE2-CD1 3.99Å; F128-I209 HydrophobicContact CG-CD1 3.74Å; F128-I209 HydrophobicContact CG-CG1 4.14Å; F128-I209 HydrophobicContact CZ-CD1 4.23Å; I135-I209 HydrophobicContact CD1-CB 4.46Å; I135-I209 HydrophobicContact CD1-CG1 3.54Å; F141-I209 HydrophobicContact CE1-CD1 3.96Å; F141-I209 HydrophobicContact CZ-CD1 3.98Å; V145-I209 HydrophobicContact CG2-CD1 4.45Å; K205-I209 WeakPolarHBondContact O-CG1 3.33Å; K205-I209 PolarHBondContact O-N 2.82Å; Y206-I209 PolarHBondContact O-N 2.86Å; I209-R211 PolarHBondContact O-N 3.16Å; I209-G212 PolarHBondContact O-N 3.39Å
210	Y	85.4	Confident	70.7	Confident	46 Å²	46	81.8 Å²	81.8	18%	0.18	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.5	-179.2	-170.2	-83.9	0	0	0	113.1	V121 H124 A169 F172 Y206 T208	V121-Y210 HydrophobicContact CG1-CD2 4.04Å; V121-Y210 HydrophobicContact CG1-CE2 4Å; V121-Y210 HydrophobicContact CG2-CD2 4.04Å; V121-Y210 HydrophobicContact CG2-CE1 4.37Å; V121-Y210 HydrophobicContact CG2-CE2 3.67Å; H124-Y210 PolarHBondContact ND1-O 2.94Å; A169-Y210 HydrophobicContact CB-CE1 3.93Å; A169-Y210 VanDerWaalsContact CB-OH 3.29Å; A169-Y210 WeakPolarHBondContact CB-OH 3.48Å; F172-Y210 HydrophobicContact CB-CE2 4.39Å; F172-Y210 HydrophobicContact CD1-CE2 4.35Å; Y206-Y210 HydrophobicContact CE1-CD2 4.26Å; Y206-Y210 HydrophobicContact CE1-CG 4.45Å; Y206-Y210 AromaticContact CZ-CD2 3.9Å; Y206-Y210 WeakPolarHBondContact O-CB 3.14Å; Y206-Y210 PolarHBondContact O-N 3.04Å; Y206-Y210 VanDerWaalsContact OH-CD2 3.29Å; Y206-Y210 WeakPolarHBondContact OH-CD2 3.25Å; T208-Y210 VanDerWaalsContact C-N 3.27Å; T208-Y210 PolarHBondContact O-N 3.13Å
211	R	82.1	Confident	68.3	Low	123 Å²	123	86.6 Å²	86.6	46%	0.464	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-30.3	179	-76.6	177.3	-113.9	-92.6	-9.3	114	H124 D207 T208 I209	H124-R211 PolarHBondContact CE1-O 3.47Å; D207-R211 VanDerWaalsContact O-CZ 3.27Å; D207-R211 PolarHBondContact O-NE 2.81Å; D207-R211 PolarHBondContact O-NH2 3.21Å; D207-R211 IonicContact OD1-NH2 3.62Å; T208-R211 PolarHBondContact O-N 2.92Å; T208-R211 VanDerWaalsContact O-N 3.09Å; I209-R211 PolarHBondContact O-N 3.16Å
212	G	73.6	Confident	65.8	Low	14 Å²	14	95.2 Å²	95.2	14%	0.144	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	70	173.3	-171.3	0	0	0	0	0	113.3	H124 T208 I209	H124-G212 PolarHBondContact ND1-N 2.86Å; T208-G212 PolarHBondContact O-N 2.86Å; I209-G212 PolarHBondContact O-N 3.39Å
213	E	55.4	Low	63.3	Low	109 Å²	109	99.5 Å²	99.5	51%	0.509	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-22.3	-172.1	-62	-163.7	174.1	0	0	114.1	Q134	Q134-E213 PolarHBondContact N-OE1 3.17Å
214	E	46.2	Very low	60.6	Low	169 Å²	169	107.7 Å²	107.7	79%	0.79	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-45.2	-177.3	-76.2	-129.7	121.3	0	0	113.8	M216 R217	E214-M216 VanDerWaalsContact C-N 3.27Å; E214-M216 PolarHBondContact O-N 2.82Å; E214-R217 PolarHBondContact O-N 3.33Å
215	D	45.4	Very low	57.9	Low	72 Å²	72	111.6 Å²	111.6	39%	0.385	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-75.8	-14.3	-169.8	-110.7	-10.9	0	0	0	113.7	R217 R218	D215-R217 PolarHBondContact O-N 3.45Å; D215-R217 VanDerWaalsContact O-N 3.08Å; D215-R218 PolarHBondContact O-N 3.42Å; D215-R218 WeakPolarHBondContact OD1-CD 3.14Å; D215-R218 IonicContact OD1-CZ 2.78Å; D215-R218 IonicContact OD1-NE 3.53Å; D215-R218 IonicContact OD1-NH1 2.75Å; D215-R218 PolarHBondContact OD1-NH1 2.81Å
216	M	45.6	Very low	55.6	Low	123 Å²	123	112.5 Å²	112.5	61%	0.606	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-54.3	-29.1	174.4	-80.3	-96.1	64.9	0	0	112.8	E214 R218	E214-M216 VanDerWaalsContact C-N 3.27Å; E214-M216 PolarHBondContact O-N 2.82Å; M216-R218 VanDerWaalsContact C-N 3.31Å; M216-R218 PolarHBondContact O-N 3.02Å
217	R	44.3	Very low	53.3	Low	235 Å²	235	114.9 Å²	114.9	89%	0.887	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-75.7	-9.5	179.5	-71.2	-177.8	173.5	171.1	0.4	114.9	E214 D215	E214-R217 PolarHBondContact O-N 3.33Å; D215-R217 PolarHBondContact O-N 3.45Å; D215-R217 VanDerWaalsContact O-N 3.08Å
218	R	48.8	Very low	50.8	Low	187 Å²	187	119.2 Å²	119.2	71%	0.706	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-99.3	-14.7	-175.4	-63.3	-172.5	178.9	131.6	-2.8	114.5	D215 M216 T220	D215-R218 PolarHBondContact O-N 3.42Å; D215-R218 WeakPolarHBondContact OD1-CD 3.14Å; D215-R218 IonicContact OD1-CZ 2.78Å; D215-R218 IonicContact OD1-NE 3.53Å; D215-R218 IonicContact OD1-NH1 2.75Å; D215-R218 PolarHBondContact OD1-NH1 2.81Å; M216-R218 VanDerWaalsContact C-N 3.31Å; M216-R218 PolarHBondContact O-N 3.02Å; R218-T220 PolarHBondContact O-N 2.78Å
219	Q	39	Very low	48.6	Very low	137 Å²	137	120.7 Å²	120.7	64%	0.64	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	56.8	-159.4	-156.8	-176.9	11.9	0	0	115.5
220	T	33.8	Very low	46.8	Very low	128 Å²	128	125.7 Å²	125.7	79%	0.785	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	-30.5	176.9	-43.1	0	0	0	0	115.1	R218	R218-T220 PolarHBondContact O-N 2.78Å
221	Q	36.2	Very low	45.5	Very low	172 Å²	172	125.9 Å²	125.9	80%	0.804	63%	0.627	S	S	*	*	S	Bend	trans	-146.1	107.5	-175.8	-64.4	-175	2.3	0	0	113.6
222	R	36.2	Very low	44.8	Very low	237 Å²	237	124.9 Å²	124.9	89%	0.894	63%	0.63	S	S	*	*	S	Bend	trans	163.1	-22.2	142.3	-92.4	161.6	-174.5	-180	2.3	115.6	H224	R222-H224 VanDerWaalsContact C-N 3.3Å; R222-H224 PolarHBondContact O-N 3.01Å
223	A	36.6	Very low	44.9	Very low	97 Å²	97	125.6 Å²	125.6	80%	0.802	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-25.2	-161.5	0	0	0	0	0	117.3
224	H	33.9	Very low	46.2	Very low	185 Å²	185	122.6 Å²	122.6	86%	0.856	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	5.4	-160.8	-138.2	-67.3	0	0	0	116.8	R222	R222-H224 VanDerWaalsContact C-N 3.3Å; R222-H224 PolarHBondContact O-N 3.01Å
225	L	32.3	Very low	48.1	Very low	170 Å²	170	119.4 Å²	119.4	89%	0.89	60%	0.604	S	S	*	*	S	Bend	trans	-124.1	-10.6	-178	-74.8	169.2	0	0	0	115.3
226	S	39.6	Very low	50	Low	56 Å²	56	122.9 Å²	122.9	39%	0.392	62%	0.618	S	S	.	*	S	Bend	trans	-77.9	-31.9	-176.4	-157.3	0	0	0	0	113.7	V228 S229 E230	S226-V228 PolarHBondContact O-N 3.14Å; S226-S229 PolarHBondContact O-N 2.91Å; S226-E230 WeakPolarHBondContact CB-OE1 3.35Å; S226-E230 PolarHBondContact OG-OE1 2.89Å
227	A	41.7	Very low	52	Low	50 Å²	50	121.2 Å²	121.2	41%	0.413	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	-4.6	-159.1	0	0	0	0	0	117.9	L231	A227-L231 WeakPolarHBondContact O-CD1 3.24Å
228	V	36.8	Very low	54	Low	125 Å²	125	110.1 Å²	110.1	76%	0.758	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-27.9	172.2	-177.8	0	0	0	0	111.5	S226 E230	S226-V228 PolarHBondContact O-N 3.14Å; V228-E230 PolarHBondContact O-N 2.83Å
229	S	41.5	Very low	56	Low	95 Å²	95	101.6 Å²	101.6	66%	0.664	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.8	179.5	-164.8	0	0	0	0	113.7	S226	S226-S229 PolarHBondContact O-N 2.91Å
230	E	49.1	Very low	58.4	Low	109 Å²	109	100.1 Å²	100.1	51%	0.509	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-11.9	-180	-70.7	168.5	-152.6	0	0	113.9	R109 S226 V228	R109-E230 PolarHBondContact NH2-O 3.36Å; S226-E230 WeakPolarHBondContact CB-OE1 3.35Å; S226-E230 PolarHBondContact OG-OE1 2.89Å; V228-E230 PolarHBondContact O-N 2.83Å
231	L	57.7	Low	61.1	Low	51 Å²	51	95.3 Å²	95.3	27%	0.267	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-35.7	179.6	-83.4	82.9	0	0	0	113.1	T104 A227	T104-L231 WeakPolarHBondContact O-CD2 3.47Å; A227-L231 WeakPolarHBondContact O-CD1 3.24Å
232	I	67.1	Low	63.7	Low	101 Å²	101	87.1 Å²	87.1	52%	0.518	46%	0.459	S	S	.	.	S	Bend	trans	-104.8	109.9	180	-57.1	177.8	0	0	0	108.7	T104	T104-I232 HydrophobicContact CG2-CD1 4.19Å; T104-I232 HydrophobicContact CG2-CG1 4.4Å
233	L	76.4	Confident	66.3	Low	30 Å²	30	77 Å²	77	16%	0.157	42%	0.422	C	S	.	.			trans	-82.6	138.9	-178.8	-68.4	168.6	0	0	0	111.2	Q102 Q237 L238 M241	Q102-L233 PolarHBondContact NE2-O 2.82Å; L233-Q237 HydrophobicContact CB-CB 4.32Å; L233-Q237 HydrophobicContact CD2-CB 4.15Å; L233-L238 HydrophobicContact CB-CD2 4.03Å; L233-L238 HydrophobicContact CB-CG 4.2Å; L233-L238 HydrophobicContact CD1-CD2 4.13Å; L233-M241 HydrophobicContact CD1-SD 4.47Å
234	S	82.9	Confident	68.9	Low	46 Å²	46	78.3 Å²	78.3	32%	0.322	41%	0.412	S	S	.	.			trans	-68.7	161.2	174.1	83.9	0	0	0	0	111.5	E236 Q237 L238	S234-E236 PolarHBondContact O-N 2.93Å; S234-E236 PolarHBondContact OG-N 2.8Å; S234-Q237 PolarHBondContact O-N 3.47Å; S234-Q237 WeakPolarHBondContact OG-CG 3.41Å; S234-Q237 PolarHBondContact OG-N 3.34Å; S234-Q237 VanDerWaalsContact OG-N 3.15Å; S234-L238 WeakPolarHBondContact O-CG 3.48Å; S234-L238 PolarHBondContact O-N 3.14Å
235	K	85	Confident	71.6	Confident	101 Å²	101	70.1 Å²	70.1	44%	0.439	37%	0.374	S	S	.	.	H	α-helix	trans	-57.5	-39.7	174.6	-72.7	-172	176.3	-178.6	0	111.7	I94 S95 L238 Y239	I94-K235 HydrophobicContact CG2-CB 4.14Å; I94-K235 HydrophobicContact CG2-CG 4.21Å; I94-K235 WeakPolarHBondContact O-CD 3.46Å; I94-K235 WeakPolarHBondContact O-CE 3.37Å; S95-K235 PolarHBondContact O-NZ 2.73Å; K235-L238 PolarHBondContact O-N 2.93Å; K235-Y239 HydrophobicContact CB-CE2 3.98Å; K235-Y239 WeakPolarHBondContact O-CD2 3.39Å; K235-Y239 VanDerWaalsContact O-CG 3.31Å; K235-Y239 PolarHBondContact O-N 3.42Å
236	E	86.5	Confident	74.4	Confident	145 Å²	145	62.4 Å²	62.4	68%	0.678	33%	0.334	S	S	*	.	H	α-helix	trans	-59.4	-49.2	176.2	-63.2	164.9	168.1	0	0	111.4	S234 L238 Y239 E240	S234-E236 PolarHBondContact O-N 2.93Å; S234-E236 PolarHBondContact OG-N 2.8Å; E236-L238 VanDerWaalsContact C-N 3.31Å; E236-L238 PolarHBondContact O-N 2.83Å; E236-Y239 WeakPolarHBondContact O-CB 3.23Å; E236-Y239 PolarHBondContact O-N 3.45Å; E236-Y239 VanDerWaalsContact O-N 3.13Å; E236-E240 PolarHBondContact O-N 2.98Å
237	Q	86	Confident	76.7	Confident	88 Å²	88	62.7 Å²	62.7	41%	0.411	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-36.8	176.6	-69.5	169.4	-29.2	0	0	112.4	L233 S234 M241	L233-Q237 HydrophobicContact CB-CB 4.32Å; L233-Q237 HydrophobicContact CD2-CB 4.15Å; S234-Q237 PolarHBondContact O-N 3.47Å; S234-Q237 WeakPolarHBondContact OG-CG 3.41Å; S234-Q237 PolarHBondContact OG-N 3.34Å; S234-Q237 VanDerWaalsContact OG-N 3.15Å; Q237-M241 WeakPolarHBondContact O-CB 3.49Å; Q237-M241 PolarHBondContact O-N 3.3Å
238	L	87.8	Confident	79	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-66.7	-39.9	173.7	-67.1	175.5	0	0	0	111.9	I94 L233 S234 K235 E236 M241 F242 F670 V671	I94-L238 HydrophobicContact CD1-CB 4Å; I94-L238 HydrophobicContact CG1-CB 4.26Å; I94-L238 HydrophobicContact CG2-CB 3.96Å; I94-L238 HydrophobicContact CG2-CD1 4.29Å; L233-L238 HydrophobicContact CB-CD2 4.03Å; L233-L238 HydrophobicContact CB-CG 4.2Å; L233-L238 HydrophobicContact CD1-CD2 4.13Å; S234-L238 WeakPolarHBondContact O-CG 3.48Å; S234-L238 PolarHBondContact O-N 3.14Å; K235-L238 PolarHBondContact O-N 2.93Å; E236-L238 VanDerWaalsContact C-N 3.31Å; E236-L238 PolarHBondContact O-N 2.83Å; L238-M241 HydrophobicContact CD2-CE 3.84Å; L238-F242 WeakPolarHBondContact O-CD2 3.04Å; L238-F242 PolarHBondContact O-N 3.4Å; L238-F670 HydrophobicContact CD1-CD1 3.88Å; L238-F670 HydrophobicContact CD1-CE1 3.74Å; L238-V671 HydrophobicContact CD1-CG2 4.34Å; L238-V671 HydrophobicContact CD2-CG2 4.36Å
239	Y	90.7	Very high	81.5	Confident	9 Å²	9	60.2 Å²	60.2	4%	0.035	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-47.7	175.6	-67	-51.6	0	0	0	111.9	Y87 L91 I94 S95 K235 E236 F242 Q243 Y257	Y87-Y239 PolarHBondContact OH-O 3.05Å; L91-Y239 HydrophobicContact CD2-CD1 3.54Å; L91-Y239 HydrophobicContact CD2-CE1 3.62Å; I94-Y239 HydrophobicContact CB-CD1 4.06Å; I94-Y239 HydrophobicContact CB-CE1 3.53Å; I94-Y239 HydrophobicContact CD1-CD1 3.9Å; I94-Y239 HydrophobicContact CD1-CE1 4.23Å; I94-Y239 HydrophobicContact CG1-CE1 4.5Å; I94-Y239 HydrophobicContact CG2-CD1 3.77Å; I94-Y239 HydrophobicContact CG2-CD2 4.43Å; I94-Y239 HydrophobicContact CG2-CE1 3.38Å; I94-Y239 HydrophobicContact CG2-CE2 4.05Å; I94-Y239 HydrophobicContact CG2-CG 4.29Å; S95-Y239 VanDerWaalsContact CA-OH 3.28Å; S95-Y239 WeakPolarHBondContact CA-OH 3.35Å; S95-Y239 PolarHBondContact N-OH 2.91Å; S95-Y239 PolarHBondContact OG-OH 3.32Å; K235-Y239 HydrophobicContact CB-CE2 3.98Å; K235-Y239 WeakPolarHBondContact O-CD2 3.39Å; K235-Y239 VanDerWaalsContact O-CG 3.31Å; K235-Y239 PolarHBondContact O-N 3.42Å; E236-Y239 WeakPolarHBondContact O-CB 3.23Å; E236-Y239 PolarHBondContact O-N 3.45Å; E236-Y239 VanDerWaalsContact O-N 3.13Å; Y239-F242 PolarHBondContact O-N 2.98Å; Y239-Q243 WeakPolarHBondContact O-CB 3.43Å; Y239-Q243 PolarHBondContact O-N 3.3Å; Y239-Y257 HydrophobicContact CD2-CD2 4.29Å; Y239-Y257 AromaticContact CD2-CE2 3.87Å; Y239-Y257 HydrophobicContact CD2-CE2 3.87Å; Y239-Y257 HydrophobicContact CE1-CD2 4.48Å; Y239-Y257 HydrophobicContact CE2-CD2 4.1Å; Y239-Y257 AromaticContact CE2-CE2 3.49Å; Y239-Y257 HydrophobicContact CE2-CE2 3.49Å; Y239-Y257 VanDerWaalsContact CE2-CE2 3.49Å; Y239-Y257 AromaticContact CZ-CE2 3.88Å
240	E	89.1	Confident	83.6	Confident	106 Å²	106	63.2 Å²	63.2	50%	0.495	31%	0.314	S	S	.	.	H	α-helix	trans	-61.9	-44.6	177.2	-69.6	-167.5	137	0	0	111.6	E236 Q243 Q244	E236-E240 PolarHBondContact O-N 2.98Å; E240-Q243 WeakPolarHBondContact O-CB 3.43Å; E240-Q243 PolarHBondContact O-N 2.96Å; E240-Q244 VanDerWaalsContact O-CG 3.31Å; E240-Q244 WeakPolarHBondContact O-CG 3.42Å; E240-Q244 PolarHBondContact O-N 3.21Å
241	M	89.7	Confident	85.3	Confident	27 Å²	27	62.3 Å²	62.3	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-60.7	-49.6	178.1	-176.5	-178.2	69.6	0	0	111.7	L233 Q237 L238 Q243 Q244 I245 Q668	L233-M241 HydrophobicContact CD1-SD 4.47Å; Q237-M241 WeakPolarHBondContact O-CB 3.49Å; Q237-M241 PolarHBondContact O-N 3.3Å; L238-M241 HydrophobicContact CD2-CE 3.84Å; M241-Q243 VanDerWaalsContact C-N 3.33Å; M241-Q243 PolarHBondContact O-N 2.93Å; M241-Q244 PolarHBondContact O-N 2.99Å; M241-I245 HydrophobicContact CG-CD1 3.85Å; M241-I245 WeakPolarHBondContact O-CD1 3.4Å; M241-I245 VanDerWaalsContact O-CG1 3.25Å; M241-I245 WeakPolarHBondContact O-CG1 3.43Å; M241-I245 PolarHBondContact O-N 2.9Å; M241-Q668 HydrophobicContact CE-CG 3.67Å; M241-Q668 HydrophobicContact SD-CG 3.86Å
242	F	91.2	Very high	86.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-73.5	-24.3	178.4	-82.5	-78.9	0	0	0	113.7	Y87 V90 I94 L238 Y239 I245 L246 L645 V671	Y87-F242 HydrophobicContact CD2-CB 4.48Å; Y87-F242 HydrophobicContact CE2-CB 3.98Å; V90-F242 HydrophobicContact CG1-CB 3.79Å; V90-F242 HydrophobicContact CG1-CD1 3.89Å; V90-F242 HydrophobicContact CG1-CD2 4.21Å; V90-F242 HydrophobicContact CG1-CG 3.68Å; I94-F242 HydrophobicContact CD1-CD2 4.16Å; L238-F242 WeakPolarHBondContact O-CD2 3.04Å; L238-F242 PolarHBondContact O-N 3.4Å; Y239-F242 PolarHBondContact O-N 2.98Å; F242-I245 HydrophobicContact CD1-CB 4.49Å; F242-I245 HydrophobicContact CD1-CD1 3.81Å; F242-I245 HydrophobicContact CE1-CD1 3.87Å; F242-I245 HydrophobicContact CG-CD1 4.19Å; F242-I245 HydrophobicContact CZ-CD1 4.3Å; F242-L246 PolarHBondContact O-N 2.85Å; F242-L645 HydrophobicContact CD1-CD1 4.18Å; F242-L645 HydrophobicContact CE1-CD1 4.02Å; F242-V671 HydrophobicContact CD2-CB 4.36Å; F242-V671 HydrophobicContact CD2-CG1 4.14Å; F242-V671 HydrophobicContact CD2-CG2 4.26Å; F242-V671 HydrophobicContact CE1-CG1 4.28Å; F242-V671 HydrophobicContact CE2-CB 3.47Å; F242-V671 VanDerWaalsContact CE2-CB 3.47Å; F242-V671 HydrophobicContact CE2-CG1 3.59Å; F242-V671 HydrophobicContact CE2-CG2 3.64Å; F242-V671 HydrophobicContact CZ-CB 3.69Å; F242-V671 HydrophobicContact CZ-CG1 3.68Å; F242-V671 HydrophobicContact CZ-CG2 4.37Å
243	Q	91.8	Very high	87.6	Confident	24 Å²	24	56.8 Å²	56.8	11%	0.112	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-43.9	168.6	-167.1	-159.4	-28.5	0	0	110.6	Y87 Y239 E240 M241 G247 I248 H253	Y87-Q243 HydrophobicContact CE2-CB 4.49Å; Y239-Q243 WeakPolarHBondContact O-CB 3.43Å; Y239-Q243 PolarHBondContact O-N 3.3Å; E240-Q243 WeakPolarHBondContact O-CB 3.43Å; E240-Q243 PolarHBondContact O-N 2.96Å; M241-Q243 VanDerWaalsContact C-N 3.33Å; M241-Q243 PolarHBondContact O-N 2.93Å; Q243-G247 PolarHBondContact O-N 3.31Å; Q243-G247 VanDerWaalsContact O-N 3.1Å; Q243-I248 HydrophobicContact CG-CB 3.87Å; Q243-I248 HydrophobicContact CG-CG2 4.49Å; Q243-I248 VanDerWaalsContact CG-O 3.25Å; Q243-I248 WeakPolarHBondContact CG-O 3.31Å; Q243-I248 PolarHBondContact NE2-O 3.35Å; Q243-I248 PolarHBondContact O-N 3.47Å; Q243-H253 HydrophobicContact CG-CB 4.25Å
244	Q	90	Very high	88	Confident	125 Å²	125	59.9 Å²	59.9	58%	0.584	29%	0.292	S	S	*	.	H	α-helix	trans	-67.8	-47.2	177.3	-69.8	171.7	29.3	0	0	111.8	E240 M241 L246 G247	E240-Q244 VanDerWaalsContact O-CG 3.31Å; E240-Q244 WeakPolarHBondContact O-CG 3.42Å; E240-Q244 PolarHBondContact O-N 3.21Å; M241-Q244 PolarHBondContact O-N 2.99Å; Q244-L246 VanDerWaalsContact C-N 3.29Å; Q244-L246 PolarHBondContact O-N 2.88Å; Q244-G247 PolarHBondContact O-N 3.09Å
245	I	90.4	Very high	88.1	Confident	13 Å²	13	60.9 Å²	60.9	7%	0.067	29%	0.294	C	S	.	.	H	α-helix	trans	-53	-42.7	178.2	-72.1	162.9	0	0	0	112.5	M241 F242 H648 T649 H652	M241-I245 HydrophobicContact CG-CD1 3.85Å; M241-I245 WeakPolarHBondContact O-CD1 3.4Å; M241-I245 VanDerWaalsContact O-CG1 3.25Å; M241-I245 WeakPolarHBondContact O-CG1 3.43Å; M241-I245 PolarHBondContact O-N 2.9Å; F242-I245 HydrophobicContact CD1-CB 4.49Å; F242-I245 HydrophobicContact CD1-CD1 3.81Å; F242-I245 HydrophobicContact CE1-CD1 3.87Å; F242-I245 HydrophobicContact CG-CD1 4.19Å; F242-I245 HydrophobicContact CZ-CD1 4.3Å; I245-H648 HydrophobicContact CG2-CB 4.03Å; I245-T649 HydrophobicContact CD1-CG2 4.22Å; I245-H652 HydrophobicContact CG1-CB 3.7Å
246	L	90.9	Very high	88.1	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.042	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	1	-176.8	-63.9	177.1	0	0	0	114.1	I86 Y87 F242 Q244 I248 L645 H648	I86-L246 HydrophobicContact CB-CD1 4.31Å; I86-L246 HydrophobicContact CG2-CD1 3.77Å; I86-L246 HydrophobicContact CG2-CD2 4.43Å; Y87-L246 HydrophobicContact CD2-CD1 4.03Å; Y87-L246 HydrophobicContact CG-CD1 4.46Å; F242-L246 PolarHBondContact O-N 2.85Å; Q244-L246 VanDerWaalsContact C-N 3.29Å; Q244-L246 PolarHBondContact O-N 2.88Å; L246-I248 HydrophobicContact CB-CD1 4Å; L246-I248 HydrophobicContact CB-CG1 3.87Å; L246-I248 PolarHBondContact O-N 2.89Å; L246-L645 HydrophobicContact CD1-CD1 4.23Å; L246-L645 HydrophobicContact CD2-CD1 4.19Å; L246-L645 HydrophobicContact CG-CD1 4.48Å; L246-H648 HydrophobicContact CD2-CB 4.24Å
247	G	89	Confident	88	Confident	62 Å²	62	51.9 Å²	51.9	64%	0.639	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	29.1	178.6	0	0	0	0	0	114.9	Q243 Q244	Q243-G247 PolarHBondContact O-N 3.31Å; Q243-G247 VanDerWaalsContact O-N 3.1Å; Q244-G247 PolarHBondContact O-N 3.09Å
248	I	90.6	Very high	87.9	Confident	12 Å²	12	52.6 Å²	52.6	6%	0.062	26%	0.258	C	S	.	.			trans	-77.6	136.4	-173.4	-52	-55.6	0	0	0	110.9	K83 L84 Y87 Q243 L246 E252	K83-I248 HydrophobicContact CB-CD1 4.43Å; L84-I248 HydrophobicContact CD2-CD1 4.06Å; L84-I248 HydrophobicContact CD2-CG2 4.17Å; L84-I248 HydrophobicContact CG-CD1 4.35Å; Y87-I248 HydrophobicContact CD1-CB 4.38Å; Y87-I248 HydrophobicContact CD1-CG1 3.97Å; Y87-I248 HydrophobicContact CD1-CG2 3.99Å; Y87-I248 HydrophobicContact CD2-CG1 4.24Å; Y87-I248 HydrophobicContact CE1-CB 4.48Å; Y87-I248 HydrophobicContact CE1-CG1 4.45Å; Y87-I248 HydrophobicContact CE1-CG2 4.11Å; Y87-I248 HydrophobicContact CG-CG1 3.84Å; Q243-I248 HydrophobicContact CG-CB 3.87Å; Q243-I248 HydrophobicContact CG-CG2 4.49Å; Q243-I248 VanDerWaalsContact CG-O 3.25Å; Q243-I248 WeakPolarHBondContact CG-O 3.31Å; Q243-I248 PolarHBondContact NE2-O 3.35Å; Q243-I248 PolarHBondContact O-N 3.47Å; L246-I248 HydrophobicContact CB-CD1 4Å; L246-I248 HydrophobicContact CB-CG1 3.87Å; L246-I248 PolarHBondContact O-N 2.89Å; I248-E252 HydrophobicContact CG2-CB 4.07Å
249	R	88.3	Confident	87.5	Confident	110 Å²	110	55 Å²	55	42%	0.415	28%	0.278	S	S	.	.			trans	-75.7	143.5	-178.9	-56	-175.8	-69	-177.3	3.2	110.5	F251 E252 H253	R249-F251 VanDerWaalsContact C-N 3.26Å; R249-F251 HydrophobicContact CB-CD1 4.07Å; R249-F251 HydrophobicContact CB-CE1 4.03Å; R249-F251 PolarHBondContact O-N 3.42Å; R249-F251 VanDerWaalsContact O-N 3.12Å; R249-E252 HydrophobicContact CB-CG 4.2Å; R249-E252 WeakPolarHBondContact CB-OE2 3.43Å; R249-E252 WeakPolarHBondContact CG-OE2 3.27Å; R249-E252 IonicContact CZ-OE1 3.74Å; R249-E252 IonicContact CZ-OE2 3.75Å; R249-E252 VanDerWaalsContact NE-CD 3.31Å; R249-E252 IonicContact NE-OE1 3.23Å; R249-E252 PolarHBondContact NE-OE1 2.97Å; R249-E252 IonicContact NE-OE2 3.53Å; R249-E252 PolarHBondContact NE-OE2 3.02Å; R249-E252 IonicContact NH2-OE1 2.68Å; R249-E252 PolarHBondContact NH2-OE1 3.08Å; R249-E252 IonicContact NH2-OE2 2.75Å; R249-E252 WeakPolarHBondContact O-CA 3.18Å; R249-E252 WeakPolarHBondContact O-CB 3.27Å; R249-E252 PolarHBondContact O-N 2.74Å; R249-H253 PolarHBondContact O-N 2.82Å
250	K	86.1	Confident	87.1	Confident	159 Å²	159	54.9 Å²	54.9	69%	0.691	28%	0.278	S	S	*	.	H	α-helix	trans	-53.6	-37.5	-173.9	-75	-170.3	172.5	-167	0	114.2	Q254	K250-Q254 PolarHBondContact O-N 3.03Å
251	F	84.5	Confident	86.6	Confident	89 Å²	89	53 Å²	53	39%	0.39	27%	0.269	S	S	.	.	H	α-helix	trans	-72.8	-27.7	177.9	80.3	-94.5	0	0	0	113.4	R249 Q254 L255	R249-F251 VanDerWaalsContact C-N 3.26Å; R249-F251 HydrophobicContact CB-CD1 4.07Å; R249-F251 HydrophobicContact CB-CE1 4.03Å; R249-F251 PolarHBondContact O-N 3.42Å; R249-F251 VanDerWaalsContact O-N 3.12Å; F251-Q254 PolarHBondContact O-N 3.16Å; F251-L255 WeakPolarHBondContact O-CB 3.39Å; F251-L255 PolarHBondContact O-N 3.41Å
252	E	86.1	Confident	86	Confident	9 Å²	9	54.1 Å²	54.1	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-78.4	-39.2	178.1	-58.8	-178.7	134.6	0	0	109.9	R80 L84 I248 R249 L255 L256 M625	R80-E252 IonicContact CZ-OE1 3.94Å; R80-E252 IonicContact NH2-OE1 3.64Å; R80-E252 PolarHBondContact NH2-OE1 3.07Å; R80-E252 IonicContact NH2-OE2 3.26Å; R80-E252 PolarHBondContact NH2-OE2 3.09Å; L84-E252 HydrophobicContact CD2-CB 4.21Å; I248-E252 HydrophobicContact CG2-CB 4.07Å; R249-E252 HydrophobicContact CB-CG 4.2Å; R249-E252 WeakPolarHBondContact CB-OE2 3.43Å; R249-E252 WeakPolarHBondContact CG-OE2 3.27Å; R249-E252 IonicContact CZ-OE1 3.74Å; R249-E252 IonicContact CZ-OE2 3.75Å; R249-E252 VanDerWaalsContact NE-CD 3.31Å; R249-E252 IonicContact NE-OE1 3.23Å; R249-E252 PolarHBondContact NE-OE1 2.97Å; R249-E252 IonicContact NE-OE2 3.53Å; R249-E252 PolarHBondContact NE-OE2 3.02Å; R249-E252 IonicContact NH2-OE1 2.68Å; R249-E252 PolarHBondContact NH2-OE1 3.08Å; R249-E252 IonicContact NH2-OE2 2.75Å; R249-E252 WeakPolarHBondContact O-CA 3.18Å; R249-E252 WeakPolarHBondContact O-CB 3.27Å; R249-E252 PolarHBondContact O-N 2.74Å; E252-L255 PolarHBondContact O-N 3.18Å; E252-L256 WeakPolarHBondContact O-CB 3.44Å; E252-L256 VanDerWaalsContact O-CG 3.32Å; E252-L256 WeakPolarHBondContact O-CG 3.43Å; E252-L256 PolarHBondContact O-N 3.32Å; E252-L256 VanDerWaalsContact O-N 3.07Å; E252-M625 HydrophobicContact CB-CE 4.08Å; E252-M625 HydrophobicContact CG-CE 4.06Å
253	H	87.4	Confident	85	Confident	27 Å²	27	61.5 Å²	61.5	13%	0.125	32%	0.315	C	S	.	.	H	α-helix	trans	-53.7	-53.6	163.8	165.6	77.3	0	0	0	111	Y87 Q243 R249 L255 L256 Y257	Y87-H253 HydrophobicContact CE1-CB 4.17Å; Y87-H253 AromaticContact CE1-ND1 3.77Å; Y87-H253 AromaticContact CZ-ND1 3.73Å; Y87-H253 PolarHBondContact OH-ND1 3.35Å; Q243-H253 HydrophobicContact CG-CB 4.25Å; R249-H253 PolarHBondContact O-N 2.82Å; H253-L255 VanDerWaalsContact C-N 3.31Å; H253-L255 PolarHBondContact O-N 3.19Å; H253-L256 PolarHBondContact O-N 2.87Å; H253-Y257 AromaticContact CE1-CD2 3.73Å; H253-Y257 AromaticContact NE2-CD2 3.89Å; H253-Y257 WeakPolarHBondContact O-CB 3.41Å; H253-Y257 PolarHBondContact O-N 3.45Å
254	Q	84.5	Confident	84.2	Confident	95 Å²	95	62.9 Å²	62.9	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-59.5	-40.3	-176.8	-168.5	70	69.4	0	0	112.9	K250 F251 N258	K250-Q254 PolarHBondContact O-N 3.03Å; F251-Q254 PolarHBondContact O-N 3.16Å; Q254-N258 PolarHBondContact NE2-OD1 2.86Å; Q254-N258 WeakPolarHBondContact O-CB 3.09Å; Q254-N258 PolarHBondContact O-N 2.99Å; Q254-N258 PolarHBondContact O-OD1 2.84Å
255	L	84.2	Confident	83.3	Confident	68 Å²	68	61 Å²	61	36%	0.356	32%	0.321	S	S	.	.	H	α-helix	trans	-66.5	-44.9	179	-176.8	56.9	0	0	0	111.8	F251 E252 H253 A259 M625	F251-L255 WeakPolarHBondContact O-CB 3.39Å; F251-L255 PolarHBondContact O-N 3.41Å; E252-L255 PolarHBondContact O-N 3.18Å; H253-L255 VanDerWaalsContact C-N 3.31Å; H253-L255 PolarHBondContact O-N 3.19Å; L255-A259 PolarHBondContact O-N 3.45Å; L255-M625 HydrophobicContact CD2-CB 4.09Å; L255-M625 HydrophobicContact CD2-CE 4.2Å; L255-M625 HydrophobicContact CD2-CG 3.79Å; L255-M625 HydrophobicContact CG-CG 4.19Å
256	L	85.4	Confident	82.3	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-71.4	-38.3	178	-66.5	178	0	0	0	112.6	L84 Y87 V88 L91 E252 H253 A259 C260 M625 I629	L84-L256 HydrophobicContact CD2-CD1 4.2Å; Y87-L256 HydrophobicContact CD1-CD1 4.14Å; V88-L256 HydrophobicContact CG2-CD1 3.89Å; V88-L256 HydrophobicContact CG2-CD2 3.74Å; V88-L256 HydrophobicContact CG2-CG 4.37Å; L91-L256 HydrophobicContact CD1-CB 3.42Å; L91-L256 VanDerWaalsContact CD1-CB 3.42Å; L91-L256 HydrophobicContact CD1-CD1 4.33Å; E252-L256 WeakPolarHBondContact O-CB 3.44Å; E252-L256 VanDerWaalsContact O-CG 3.32Å; E252-L256 WeakPolarHBondContact O-CG 3.43Å; E252-L256 PolarHBondContact O-N 3.32Å; E252-L256 VanDerWaalsContact O-N 3.07Å; H253-L256 PolarHBondContact O-N 2.87Å; L256-A259 PolarHBondContact O-N 3.26Å; L256-C260 WeakPolarHBondContact O-CB 3.48Å; L256-C260 PolarHBondContact O-N 2.8Å; L256-C260 PolarHBondContact O-SG 3.17Å; L256-M625 HydrophobicContact CD1-SD 4.19Å; L256-M625 HydrophobicContact CD2-CG 3.67Å; L256-M625 HydrophobicContact CD2-SD 3.59Å; L256-M625 VanDerWaalsContact CD2-SD 3.59Å; L256-M625 HydrophobicContact CG-CG 4.38Å; L256-M625 HydrophobicContact CG-SD 3.92Å; L256-I629 HydrophobicContact CD2-CD1 3.86Å; L256-I629 HydrophobicContact CD2-CG1 3.57Å
257	Y	85.1	Confident	81.5	Confident	56 Å²	56	64.5 Å²	64.5	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-57.6	-54.9	174.2	178.9	-85.8	0	0	0	110.4	Y239 H253 A259 C260 Q261	Y239-Y257 HydrophobicContact CD2-CD2 4.29Å; Y239-Y257 AromaticContact CD2-CE2 3.87Å; Y239-Y257 HydrophobicContact CD2-CE2 3.87Å; Y239-Y257 HydrophobicContact CE1-CD2 4.48Å; Y239-Y257 HydrophobicContact CE2-CD2 4.1Å; Y239-Y257 AromaticContact CE2-CE2 3.49Å; Y239-Y257 HydrophobicContact CE2-CE2 3.49Å; Y239-Y257 VanDerWaalsContact CE2-CE2 3.49Å; Y239-Y257 AromaticContact CZ-CE2 3.88Å; H253-Y257 AromaticContact CE1-CD2 3.73Å; H253-Y257 AromaticContact NE2-CD2 3.89Å; H253-Y257 WeakPolarHBondContact O-CB 3.41Å; H253-Y257 PolarHBondContact O-N 3.45Å; Y257-A259 PolarHBondContact O-N 3.26Å; Y257-A259 VanDerWaalsContact O-N 3.1Å; Y257-C260 PolarHBondContact O-N 2.99Å; Y257-Q261 HydrophobicContact CD1-CG 3.75Å; Y257-Q261 HydrophobicContact CD2-CG 4.49Å; Y257-Q261 VanDerWaalsContact CE1-CD 3.48Å; Y257-Q261 HydrophobicContact CE1-CG 3.53Å; Y257-Q261 HydrophobicContact CE2-CG 4.33Å; Y257-Q261 HydrophobicContact CG-CG 4.22Å; Y257-Q261 WeakPolarHBondContact O-CG 3.39Å; Y257-Q261 PolarHBondContact O-N 3.24Å; Y257-Q261 PolarHBondContact OH-NE2 3.39Å; Y257-Q261 PolarHBondContact OH-OE1 2.95Å; Y257-Q261 VanDerWaalsContact OH-OE1 3.08Å
258	N	84.1	Confident	81.1	Confident	104 Å²	104	63.6 Å²	63.6	56%	0.556	32%	0.317	S	S	*	.	H	α-helix	trans	-58.6	-27	179.8	-70.2	3.9	0	0	0	113.1	Q254	Q254-N258 PolarHBondContact NE2-OD1 2.86Å; Q254-N258 WeakPolarHBondContact O-CB 3.09Å; Q254-N258 PolarHBondContact O-N 2.99Å; Q254-N258 PolarHBondContact O-OD1 2.84Å
259	A	79.3	Confident	80.6	Confident	51 Å²	51	63.7 Å²	63.7	42%	0.421	32%	0.319	S	S	.	.	H	α-helix	trans	-90.2	-19	178.1	0	0	0	0	0	114.4	L255 L256 Y257 I629	L255-A259 PolarHBondContact O-N 3.45Å; L256-A259 PolarHBondContact O-N 3.26Å; Y257-A259 PolarHBondContact O-N 3.26Å; Y257-A259 VanDerWaalsContact O-N 3.1Å; A259-I629 HydrophobicContact CB-CD1 3.55Å; A259-I629 HydrophobicContact CB-CG1 4.21Å; A259-I629 HydrophobicContact CB-CG2 4.15Å
260	C	81.1	Confident	80	Confident	7 Å²	7	58.8 Å²	58.8	5%	0.047	30%	0.302	C	S	.	.	H	α-helix	trans	-105.9	-2.4	-178.9	-66	0	0	0	0	113.8	L91 S95 L256 Y257	L91-C260 HydrophobicContact CB-CB 4.49Å; S95-C260 PolarHBondContact OG-O 3.41Å; L256-C260 WeakPolarHBondContact O-CB 3.48Å; L256-C260 PolarHBondContact O-N 2.8Å; L256-C260 PolarHBondContact O-SG 3.17Å; Y257-C260 PolarHBondContact O-N 2.99Å
261	Q	78.1	Confident	79.8	Confident	66 Å²	66	52.9 Å²	52.9	31%	0.308	28%	0.277	S	S	.	.			trans	-76.9	137.3	169.9	-69.2	-92.7	-72	0	0	110.1	Y257	Y257-Q261 HydrophobicContact CD1-CG 3.75Å; Y257-Q261 HydrophobicContact CD2-CG 4.49Å; Y257-Q261 VanDerWaalsContact CE1-CD 3.48Å; Y257-Q261 HydrophobicContact CE1-CG 3.53Å; Y257-Q261 HydrophobicContact CE2-CG 4.33Å; Y257-Q261 HydrophobicContact CG-CG 4.22Å; Y257-Q261 WeakPolarHBondContact O-CG 3.39Å; Y257-Q261 PolarHBondContact O-N 3.24Å; Y257-Q261 PolarHBondContact OH-NE2 3.39Å; Y257-Q261 PolarHBondContact OH-OE1 2.95Å; Y257-Q261 VanDerWaalsContact OH-OE1 3.08Å
262	L	78.5	Confident	79.8	Confident	51 Å²	51	48.9 Å²	48.9	27%	0.267	26%	0.259	S	S	.	.			trans	-137	111.4	174.1	-67.6	173.4	0	0	0	107.3	Y96 N264 Q268 Q271	Y96-L262 HydrophobicContact CE1-CD1 4.21Å; L262-N264 VanDerWaalsContact C-N 3.34Å; L262-N264 PolarHBondContact O-N 3.32Å; L262-Q268 HydrophobicContact CB-CG 3.88Å; L262-Q268 PolarHBondContact O-NE2 3.37Å; L262-Q271 HydrophobicContact CD1-CB 3.84Å; L262-Q271 HydrophobicContact CD1-CG 4.22Å
263	D	69.6	Low	79.5	Confident	156 Å²	156	49.9 Å²	49.9	83%	0.834	26%	0.263	S	S	*	.			trans	-72.4	-26.9	-171.9	-60.8	-45.6	0	0	0	113.2
264	N	75.3	Confident	79.2	Confident	53 Å²	53	51.3 Å²	51.3	28%	0.283	27%	0.267	S	S	.	.			trans	-94.3	128.8	-178.9	-174.7	11.6	0	0	0	112.1	L262 D266 E267 Q268	L262-N264 VanDerWaalsContact C-N 3.34Å; L262-N264 PolarHBondContact O-N 3.32Å; N264-D266 VanDerWaalsContact C-N 3.28Å; N264-D266 PolarHBondContact ND2-OD2 2.81Å; N264-D266 PolarHBondContact O-N 3.2Å; N264-D266 PolarHBondContact OD1-N 2.83Å; N264-D266 VanDerWaalsContact OD1-N 3.16Å; N264-E267 HydrophobicContact CB-CB 4.27Å; N264-E267 HydrophobicContact CB-CG 4.05Å; N264-E267 PolarHBondContact O-N 3.08Å; N264-Q268 PolarHBondContact O-N 3.39Å
265	V	71.6	Confident	79.3	Confident	86 Å²	86	47.4 Å²	47.4	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-59.1	-36.5	175.7	-175.8	0	0	0	0	112	E267 Q268 A269	V265-E267 PolarHBondContact O-N 3.35Å; V265-Q268 PolarHBondContact O-N 3.03Å; V265-A269 PolarHBondContact O-N 3Å
266	D	68.4	Low	79.4	Confident	36 Å²	36	44.2 Å²	44.2	19%	0.193	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-34.8	175.1	-58	-49.1	0	0	0	111.5	N264 A270 K488	N264-D266 VanDerWaalsContact C-N 3.28Å; N264-D266 PolarHBondContact ND2-OD2 2.81Å; N264-D266 PolarHBondContact O-N 3.2Å; N264-D266 PolarHBondContact OD1-N 2.83Å; N264-D266 VanDerWaalsContact OD1-N 3.16Å; D266-A270 VanDerWaalsContact O-CB 3.28Å; D266-A270 WeakPolarHBondContact O-CB 3.37Å; D266-A270 PolarHBondContact O-N 3.33Å; D266-K488 IonicContact OD1-NZ 3.17Å; D266-K488 PolarHBondContact OD1-NZ 3.13Å; D266-K488 IonicContact OD2-NZ 2.68Å; D266-K488 PolarHBondContact OD2-NZ 3.46Å
267	E	75	Confident	79.3	Confident	57 Å²	57	47.1 Å²	47.1	27%	0.266	25%	0.247	S	C	.	.	H	α-helix	trans	-79.8	-34.3	-179.1	-65.2	-173.9	136.4	0	0	112.2	N264 V265 A270 Q271 R586	N264-E267 HydrophobicContact CB-CB 4.27Å; N264-E267 HydrophobicContact CB-CG 4.05Å; N264-E267 PolarHBondContact O-N 3.08Å; V265-E267 PolarHBondContact O-N 3.35Å; E267-A270 PolarHBondContact O-N 3.33Å; E267-Q271 WeakPolarHBondContact O-CB 3.13Å; E267-Q271 PolarHBondContact O-N 3.38Å; E267-R586 HydrophobicContact CG-CG 4.3Å; E267-R586 IonicContact OE1-CZ 2.81Å; E267-R586 IonicContact OE1-NE 3.52Å; E267-R586 PolarHBondContact OE1-NE 3.37Å; E267-R586 IonicContact OE1-NH2 2.84Å; E267-R586 PolarHBondContact OE1-NH2 3.04Å; E267-R586 IonicContact OE2-NH2 2.69Å
268	Q	80.9	Confident	79.3	Confident	44 Å²	44	45.8 Å²	45.8	21%	0.206	25%	0.251	C	S	.	.	H	α-helix	trans	-59.1	-49.7	168.7	-66	172.2	16.7	0	0	110.6	Y96 L262 N264 V265 Q271 I272	Y96-Q268 HydrophobicContact CD1-CB 4.48Å; Y96-Q268 HydrophobicContact CD1-CG 4.07Å; Y96-Q268 HydrophobicContact CD2-CB 4.27Å; Y96-Q268 HydrophobicContact CG-CB 3.96Å; Y96-Q268 HydrophobicContact CG-CG 3.96Å; L262-Q268 HydrophobicContact CB-CG 3.88Å; L262-Q268 PolarHBondContact O-NE2 3.37Å; N264-Q268 PolarHBondContact O-N 3.39Å; V265-Q268 PolarHBondContact O-N 3.03Å; Q268-Q271 PolarHBondContact O-N 3.16Å; Q268-I272 WeakPolarHBondContact O-CG1 3.39Å; Q268-I272 PolarHBondContact O-N 3.19Å
269	A	78.4	Confident	79.3	Confident	14 Å²	14	42.3 Å²	42.3	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-45.7	176.6	0	0	0	0	0	111.7	V265 Q271 I272 R273	V265-A269 PolarHBondContact O-N 3Å; A269-Q271 VanDerWaalsContact C-N 3.26Å; A269-Q271 PolarHBondContact O-N 2.77Å; A269-I272 PolarHBondContact O-N 2.9Å; A269-R273 WeakPolarHBondContact O-CG 3.45Å; A269-R273 PolarHBondContact O-N 3.18Å
270	A	76.8	Confident	79.6	Confident	6 Å²	6	42.2 Å²	42.2	5%	0.05	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-23.3	176.3	0	0	0	0	0	113.7	D266 E267 R274	D266-A270 VanDerWaalsContact O-CB 3.28Å; D266-A270 WeakPolarHBondContact O-CB 3.37Å; D266-A270 PolarHBondContact O-N 3.33Å; E267-A270 PolarHBondContact O-N 3.33Å; A270-R274 WeakPolarHBondContact O-CG 3.37Å; A270-R274 PolarHBondContact O-NE 3.26Å
271	Q	82.3	Confident	79.8	Confident	36 Å²	36	46.3 Å²	46.3	17%	0.168	24%	0.24	C	C	.	.	H	α-helix	trans	-75.5	-42.1	169.9	179.7	61.9	38.1	0	0	111.6	Y96 L262 E267 Q268 A269 R274 E275	Y96-Q271 HydrophobicContact CE2-CB 4.34Å; Y96-Q271 HydrophobicContact CE2-CG 4.05Å; Y96-Q271 VanDerWaalsContact OH-CG 3.24Å; Y96-Q271 WeakPolarHBondContact OH-CG 3.29Å; L262-Q271 HydrophobicContact CD1-CB 3.84Å; L262-Q271 HydrophobicContact CD1-CG 4.22Å; E267-Q271 WeakPolarHBondContact O-CB 3.13Å; E267-Q271 PolarHBondContact O-N 3.38Å; Q268-Q271 PolarHBondContact O-N 3.16Å; A269-Q271 VanDerWaalsContact C-N 3.26Å; A269-Q271 PolarHBondContact O-N 2.77Å; Q271-R274 PolarHBondContact O-N 3.1Å; Q271-E275 PolarHBondContact NE2-OE1 2.83Å; Q271-E275 PolarHBondContact O-N 3.31Å
272	I	84.2	Confident	80	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-46.9	176	-62.8	162.9	0	0	0	110.8	Y96 F98 Q268 A269 R274 E275 L276 L319	Y96-I272 HydrophobicContact CD2-CD1 3.83Å; Y96-I272 HydrophobicContact CD2-CG1 3.72Å; Y96-I272 HydrophobicContact CE2-CD1 4.43Å; Y96-I272 HydrophobicContact CE2-CG1 3.81Å; F98-I272 HydrophobicContact CB-CD1 4.26Å; F98-I272 HydrophobicContact CD1-CD1 3.58Å; F98-I272 HydrophobicContact CD1-CG1 4.28Å; F98-I272 HydrophobicContact CD1-CG2 4.22Å; F98-I272 HydrophobicContact CE1-CD1 4.12Å; F98-I272 HydrophobicContact CE1-CG1 4.34Å; F98-I272 HydrophobicContact CE1-CG2 3.73Å; F98-I272 HydrophobicContact CE2-CG2 4.32Å; F98-I272 HydrophobicContact CG-CD1 4.04Å; F98-I272 HydrophobicContact CZ-CG2 3.78Å; Q268-I272 WeakPolarHBondContact O-CG1 3.39Å; Q268-I272 PolarHBondContact O-N 3.19Å; A269-I272 PolarHBondContact O-N 2.9Å; I272-R274 VanDerWaalsContact C-N 3.26Å; I272-R274 PolarHBondContact O-N 3.25Å; I272-E275 PolarHBondContact O-N 2.85Å; I272-L276 HydrophobicContact CG2-CD1 3.79Å; I272-L276 HydrophobicContact CG2-CG 4.1Å; I272-L276 PolarHBondContact O-N 3.3Å; I272-L319 HydrophobicContact CB-CD1 4.45Å; I272-L319 HydrophobicContact CB-CD2 3.95Å; I272-L319 HydrophobicContact CD1-CD1 3.47Å; I272-L319 VanDerWaalsContact CD1-CD1 3.47Å; I272-L319 HydrophobicContact CD1-CD2 4.43Å; I272-L319 HydrophobicContact CG2-CD1 4.24Å; I272-L319 HydrophobicContact CG2-CD2 3.8Å
273	R	80	Confident	80.3	Confident	30 Å²	30	44.1 Å²	44.1	11%	0.113	23%	0.231	C	C	.	.	H	α-helix	trans	-50.7	-45.5	177.7	-71.5	177.5	-154.7	-166.1	0.2	112.1	A269 E275 L276 D277 M316 L319 Q516 Y517	A269-R273 WeakPolarHBondContact O-CG 3.45Å; A269-R273 PolarHBondContact O-N 3.18Å; R273-E275 VanDerWaalsContact C-N 3.35Å; R273-E275 PolarHBondContact O-N 3.49Å; R273-L276 PolarHBondContact O-N 3.19Å; R273-D277 VanDerWaalsContact O-CB 3.28Å; R273-D277 WeakPolarHBondContact O-CB 3.47Å; R273-D277 PolarHBondContact O-N 3.45Å; R273-M316 HydrophobicContact CG-CE 4.37Å; R273-M316 HydrophobicContact CG-SD 4.5Å; R273-L319 HydrophobicContact CG-CD2 4.44Å; R273-Q516 PolarHBondContact NH2-O 3.35Å; R273-Y517 HydrophobicContact CG-CE1 4.23Å
274	R	81.4	Confident	81.1	Confident	57 Å²	57	39.6 Å²	39.6	22%	0.215	21%	0.205	C	C	.	.	H	α-helix	trans	-69.6	-28.5	-179.1	-68.3	179.1	-67.7	133	-2.7	113.7	A270 Q271 I272 G278 Y585 G589 Q590	A270-R274 WeakPolarHBondContact O-CG 3.37Å; A270-R274 PolarHBondContact O-NE 3.26Å; Q271-R274 PolarHBondContact O-N 3.1Å; I272-R274 VanDerWaalsContact C-N 3.26Å; I272-R274 PolarHBondContact O-N 3.25Å; R274-G278 PolarHBondContact O-N 3.09Å; R274-G278 VanDerWaalsContact O-N 3.14Å; R274-Y585 PolarHBondContact NH1-OH 2.72Å; R274-G589 WeakPolarHBondContact CG-O 3.33Å; R274-Q590 WeakPolarHBondContact CD-O 3.47Å
275	E	85.6	Confident	81.5	Confident	14 Å²	14	42.2 Å²	42.2	7%	0.065	21%	0.214	C	C	.	.	H	α-helix	trans	-78	-33.6	173.4	-66.8	-178.9	-166.8	0	0	112.1	R92 Q271 I272 R273 R279 P633 R678	R92-E275 WeakPolarHBondContact CD-OE1 3.49Å; R92-E275 IonicContact CZ-OE1 2.76Å; R92-E275 IonicContact NE-OE1 2.72Å; R92-E275 IonicContact NH1-OE1 2.96Å; R92-E275 PolarHBondContact NH1-OE1 3.16Å; Q271-E275 PolarHBondContact NE2-OE1 2.83Å; Q271-E275 PolarHBondContact O-N 3.31Å; I272-E275 PolarHBondContact O-N 2.85Å; R273-E275 VanDerWaalsContact C-N 3.35Å; R273-E275 PolarHBondContact O-N 3.49Å; E275-R279 PolarHBondContact O-N 2.84Å; E275-P633 HydrophobicContact CG-CG 4.08Å; E275-R678 IonicContact OE1-NH2 3.59Å; E275-R678 PolarHBondContact OE1-NH2 3.39Å; E275-R678 IonicContact OE2-CZ 2.74Å; E275-R678 IonicContact OE2-NE 3.82Å; E275-R678 PolarHBondContact OE2-NE 3.3Å; E275-R678 IonicContact OE2-NH2 3.46Å; E275-R678 PolarHBondContact OE2-NH2 2.93Å
276	L	86.6	Confident	82	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-73	-42.6	174.1	-68.7	-179.7	0	0	0	112.4	I272 R273 R279 L280 V312 L315 M316	I272-L276 HydrophobicContact CG2-CD1 3.79Å; I272-L276 HydrophobicContact CG2-CG 4.1Å; I272-L276 PolarHBondContact O-N 3.3Å; R273-L276 PolarHBondContact O-N 3.19Å; L276-R279 WeakPolarHBondContact O-CB 3.39Å; L276-R279 PolarHBondContact O-N 2.93Å; L276-R279 VanDerWaalsContact O-N 3.13Å; L276-L280 PolarHBondContact O-N 3.12Å; L276-V312 HydrophobicContact CB-CG1 4.08Å; L276-L315 HydrophobicContact CD1-CB 4.01Å; L276-L315 HydrophobicContact CD2-CB 4.04Å; L276-L315 HydrophobicContact CD2-CD1 4.06Å; L276-M316 HydrophobicContact CB-SD 4.21Å; L276-M316 HydrophobicContact CD1-CG 4.05Å; L276-M316 HydrophobicContact CD1-SD 3.69Å
277	D	83.6	Confident	82.7	Confident	60 Å²	60	39.6 Å²	39.6	32%	0.321	20%	0.203	S	C	.	.	H	α-helix	trans	-57.6	-47	170.5	170.5	45.9	0	0	0	111.3	R273 R279 L280 Q281	R273-D277 VanDerWaalsContact O-CB 3.28Å; R273-D277 WeakPolarHBondContact O-CB 3.47Å; R273-D277 PolarHBondContact O-N 3.45Å; D277-R279 PolarHBondContact O-N 2.82Å; D277-L280 PolarHBondContact O-N 2.96Å; D277-Q281 WeakPolarHBondContact O-CG 3.49Å; D277-Q281 PolarHBondContact O-N 3.08Å; D277-Q281 PolarHBondContact OD1-NE2 3.43Å; D277-Q281 PolarHBondContact OD2-NE2 3.44Å
278	G	83.9	Confident	83	Confident	28 Å²	28	45.6 Å²	45.6	29%	0.289	22%	0.223	S	C	.	.	H	α-helix	trans	-58.6	-32.5	174	0	0	0	0	0	114.1	R274 L282	R274-G278 PolarHBondContact O-N 3.09Å; R274-G278 VanDerWaalsContact O-N 3.14Å; G278-L282 PolarHBondContact O-N 3.26Å
279	R	85.6	Confident	83.1	Confident	32 Å²	32	48.7 Å²	48.7	12%	0.121	24%	0.237	C	C	.	.	H	α-helix	trans	-72.8	-37.8	171.6	-79.1	179.2	56.6	-160.9	-7.5	112.7	E275 L276 D277 L282 A283 S311 V312 A677 R678	E275-R279 PolarHBondContact O-N 2.84Å; L276-R279 WeakPolarHBondContact O-CB 3.39Å; L276-R279 PolarHBondContact O-N 2.93Å; L276-R279 VanDerWaalsContact O-N 3.13Å; D277-R279 PolarHBondContact O-N 2.82Å; R279-L282 PolarHBondContact O-N 3.03Å; R279-A283 PolarHBondContact O-N 2.9Å; R279-S311 PolarHBondContact NH2-OG 3.48Å; R279-V312 HydrophobicContact CB-CG2 4.13Å; R279-A677 PolarHBondContact NH1-O 2.94Å; R279-R678 VanDerWaalsContact CD-O 3.27Å; R279-R678 WeakPolarHBondContact CD-O 3.28Å; R279-R678 VanDerWaalsContact NH1-C 3.32Å; R279-R678 PolarHBondContact NH1-O 2.87Å
280	L	85.9	Confident	82.9	Confident	48 Å²	48	58 Å²	58	25%	0.251	27%	0.27	S	S	.	.	H	α-helix	trans	-66.5	-44.2	177.4	-169.8	147.7	0	0	0	111	L276 D277 L282 A283 E284 V312	L276-L280 PolarHBondContact O-N 3.12Å; D277-L280 PolarHBondContact O-N 2.96Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 3.44Å; L280-A283 PolarHBondContact O-N 2.91Å; L280-A283 VanDerWaalsContact O-N 3.17Å; L280-E284 HydrophobicContact CD2-CG 4.34Å; L280-E284 PolarHBondContact O-N 3.39Å; L280-V312 HydrophobicContact CB-CG1 4.42Å; L280-V312 HydrophobicContact CD1-CG1 4.38Å
281	Q	84.6	Confident	82.7	Confident	93 Å²	93	61.7 Å²	61.7	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-59.5	-37.5	172.4	-68.3	174.2	26.8	0	0	112.4	D277 E284 K285	D277-Q281 WeakPolarHBondContact O-CG 3.49Å; D277-Q281 PolarHBondContact O-N 3.08Å; D277-Q281 PolarHBondContact OD1-NE2 3.43Å; D277-Q281 PolarHBondContact OD2-NE2 3.44Å; Q281-E284 PolarHBondContact O-N 2.77Å; Q281-K285 WeakPolarHBondContact O-CB 3.34Å; Q281-K285 PolarHBondContact O-N 2.56Å
282	L	82.6	Confident	82.3	Confident	69 Å²	69	61.6 Å²	61.6	36%	0.361	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-43.3	174	-178.2	61.9	0	0	0	111.9	G278 R279 L280 E284 K285 I286	G278-L282 PolarHBondContact O-N 3.26Å; R279-L282 PolarHBondContact O-N 3.03Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 3.44Å; L282-E284 VanDerWaalsContact C-N 3.33Å; L282-E284 PolarHBondContact O-N 2.83Å; L282-K285 WeakPolarHBondContact O-CB 3.37Å; L282-K285 PolarHBondContact O-N 2.8Å; L282-K285 VanDerWaalsContact O-N 3.15Å; L282-I286 HydrophobicContact CG-CD1 4.23Å; L282-I286 WeakPolarHBondContact O-CG1 3.38Å; L282-I286 PolarHBondContact O-N 2.93Å
283	A	84.9	Confident	81.9	Confident	3 Å²	3	63.9 Å²	63.9	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-40	175.1	0	0	0	0	0	112	R279 L280 I286 A287 L308	R279-A283 PolarHBondContact O-N 2.9Å; L280-A283 PolarHBondContact O-N 2.91Å; L280-A283 VanDerWaalsContact O-N 3.17Å; A283-I286 PolarHBondContact O-N 3.14Å; A283-A287 WeakPolarHBondContact O-CB 3.48Å; A283-A287 PolarHBondContact O-N 2.78Å; A283-L308 HydrophobicContact CB-CB 4.02Å; A283-L308 HydrophobicContact CB-CD1 3.94Å
284	E	85	Confident	82	Confident	61 Å²	61	70.7 Å²	70.7	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-66.1	-36.3	172	-70.8	-168.1	174.2	0	0	113.6	L280 Q281 L282 A287 R288	L280-E284 HydrophobicContact CD2-CG 4.34Å; L280-E284 PolarHBondContact O-N 3.39Å; Q281-E284 PolarHBondContact O-N 2.77Å; L282-E284 VanDerWaalsContact C-N 3.33Å; L282-E284 PolarHBondContact O-N 2.83Å; E284-A287 PolarHBondContact O-N 3.44Å; E284-R288 WeakPolarHBondContact O-CB 3.47Å; E284-R288 VanDerWaalsContact O-CG 3.3Å; E284-R288 WeakPolarHBondContact O-CG 3.23Å; E284-R288 PolarHBondContact O-N 3.44Å; E284-R288 PolarHBondContact O-NE 3.29Å; E284-R288 IonicContact OE2-CZ 3.86Å; E284-R288 IonicContact OE2-NH2 2.61Å; E284-R288 PolarHBondContact OE2-NH2 3.03Å
285	K	83.8	Confident	82.1	Confident	107 Å²	107	69 Å²	69	47%	0.465	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-46.6	176.1	-174.6	-175.8	175.4	-170	0	110.5	Q281 L282 A287 R288 E289	Q281-K285 WeakPolarHBondContact O-CB 3.34Å; Q281-K285 PolarHBondContact O-N 2.56Å; L282-K285 WeakPolarHBondContact O-CB 3.37Å; L282-K285 PolarHBondContact O-N 2.8Å; L282-K285 VanDerWaalsContact O-N 3.15Å; K285-A287 VanDerWaalsContact C-N 3.33Å; K285-A287 PolarHBondContact O-N 2.74Å; K285-R288 PolarHBondContact O-N 3.32Å; K285-E289 WeakPolarHBondContact CE-OE1 3.48Å; K285-E289 WeakPolarHBondContact CE-OE2 3.44Å; K285-E289 HydrophobicContact CG-CG 4.31Å; K285-E289 IonicContact NZ-OE1 3.84Å; K285-E289 IonicContact NZ-OE2 3.81Å; K285-E289 WeakPolarHBondContact O-CB 3.34Å; K285-E289 PolarHBondContact O-N 2.9Å
286	I	82.7	Confident	81.8	Confident	26 Å²	26	71.5 Å²	71.5	13%	0.133	35%	0.348	C	S	.	.	H	α-helix	trans	-58.7	-45.6	175.3	-64.2	163.7	0	0	0	110.4	L282 A283 R288 E289 R290 T291 N292 I305	L282-I286 HydrophobicContact CG-CD1 4.23Å; L282-I286 WeakPolarHBondContact O-CG1 3.38Å; L282-I286 PolarHBondContact O-N 2.93Å; A283-I286 PolarHBondContact O-N 3.14Å; I286-R288 VanDerWaalsContact C-N 3.33Å; I286-R288 PolarHBondContact O-N 3.46Å; I286-E289 PolarHBondContact O-N 3.35Å; I286-R290 WeakPolarHBondContact O-CA 2.82Å; I286-R290 PolarHBondContact O-N 3.24Å; I286-T291 PolarHBondContact O-N 3.29Å; I286-N292 VanDerWaalsContact CG2-OD1 3.28Å; I286-N292 WeakPolarHBondContact CG2-OD1 3.44Å; I286-I305 HydrophobicContact CB-CD1 4.3Å; I286-I305 HydrophobicContact CG2-CD1 3.93Å
287	A	83.3	Confident	81.4	Confident	42 Å²	42	73.6 Å²	73.6	35%	0.347	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-34.4	177.1	0	0	0	0	0	113.8	A283 E284 K285 I305	A283-A287 WeakPolarHBondContact O-CB 3.48Å; A283-A287 PolarHBondContact O-N 2.78Å; E284-A287 PolarHBondContact O-N 3.44Å; K285-A287 VanDerWaalsContact C-N 3.33Å; K285-A287 PolarHBondContact O-N 2.74Å; A287-I305 HydrophobicContact CB-CD1 4.06Å; A287-I305 HydrophobicContact CB-CG1 4Å; A287-I305 HydrophobicContact CB-CG2 3.93Å
288	R	81.8	Confident	80.9	Confident	183 Å²	183	75.8 Å²	75.8	69%	0.691	38%	0.378	S	S	*	.	H	α-helix	trans	-77.4	-42.5	177.6	-76.3	-177.3	-109.5	-179.6	-8.7	113	E284 K285 I286	E284-R288 WeakPolarHBondContact O-CB 3.47Å; E284-R288 VanDerWaalsContact O-CG 3.3Å; E284-R288 WeakPolarHBondContact O-CG 3.23Å; E284-R288 PolarHBondContact O-N 3.44Å; E284-R288 PolarHBondContact O-NE 3.29Å; E284-R288 IonicContact OE2-CZ 3.86Å; E284-R288 IonicContact OE2-NH2 2.61Å; E284-R288 PolarHBondContact OE2-NH2 3.03Å; K285-R288 PolarHBondContact O-N 3.32Å; I286-R288 VanDerWaalsContact C-N 3.33Å; I286-R288 PolarHBondContact O-N 3.46Å
289	E	82.4	Confident	80.5	Confident	109 Å²	109	80 Å²	80	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-87.1	-11.1	-176.5	-66.1	179.3	176.9	0	0	113.3	K285 I286 T291	K285-E289 WeakPolarHBondContact CE-OE1 3.48Å; K285-E289 WeakPolarHBondContact CE-OE2 3.44Å; K285-E289 HydrophobicContact CG-CG 4.31Å; K285-E289 IonicContact NZ-OE1 3.84Å; K285-E289 IonicContact NZ-OE2 3.81Å; K285-E289 WeakPolarHBondContact O-CB 3.34Å; K285-E289 PolarHBondContact O-N 2.9Å; I286-E289 PolarHBondContact O-N 3.35Å; E289-T291 HydrophobicContact CB-CG2 3.93Å; E289-T291 PolarHBondContact O-N 3.24Å
290	R	74.4	Confident	80.3	Confident	210 Å²	210	80.5 Å²	80.5	79%	0.792	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	31.5	-172.1	-59.7	-173.5	176.9	-167.5	-2.4	113.5	I286 N292	I286-R290 WeakPolarHBondContact O-CA 2.82Å; I286-R290 PolarHBondContact O-N 3.24Å; R290-N292 PolarHBondContact O-N 3.25Å
291	T	72.9	Confident	80.1	Confident	82 Å²	82	81.8 Å²	81.8	50%	0.503	40%	0.403	S	S	.	.			trans	-79.8	43.3	176.4	41.9	0	0	0	0	111.7	I286 E289	I286-T291 PolarHBondContact O-N 3.29Å; E289-T291 HydrophobicContact CB-CG2 3.93Å; E289-T291 PolarHBondContact O-N 3.24Å
292	N	72.3	Confident	79.8	Confident	35 Å²	35	81 Å²	81	19%	0.187	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-69.5	144.6	-178.6	-78.4	-33.5	0	0	0	111.6	I286 R290 F295 E301	I286-N292 VanDerWaalsContact CG2-OD1 3.28Å; I286-N292 WeakPolarHBondContact CG2-OD1 3.44Å; R290-N292 PolarHBondContact O-N 3.25Å; N292-F295 HydrophobicContact CB-CE2 4.28Å; N292-E301 HydrophobicContact CB-CG 4.22Å; N292-E301 PolarHBondContact ND2-OE2 3.02Å
293	P	77.6	Confident	79.8	Confident	51 Å²	51	80.8 Å²	80.8	33%	0.331	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-54.7	155.3	160.1	-23.1	34	0	0	0	111.2	F295 Y304 T732	P293-F295 HydrophobicContact CB-CE2 4.14Å; P293-F295 HydrophobicContact CB-CZ 4.07Å; P293-F295 HydrophobicContact CG-CE2 4.41Å; P293-F295 HydrophobicContact CG-CZ 4.19Å; P293-F295 WeakPolarHBondContact O-CD2 3.38Å; P293-F295 WeakPolarHBondContact O-CE2 3.32Å; P293-F295 PolarHBondContact O-N 2.89Å; P293-Y304 HydrophobicContact CG-CE1 4.13Å; P293-T732 HydrophobicContact CB-CG2 3.88Å
294	K	81	Confident	79.8	Confident	174 Å²	174	82.1 Å²	82.1	76%	0.757	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-72.6	120.5	173.3	-66.9	180	-179.2	175.9	0	109.6	T732 V733	K294-T732 CarbonylContact O-C 3.19Å; K294-T732 VanDerWaalsContact O-CA 3.31Å; K294-T732 WeakPolarHBondContact O-CA 3.5Å; K294-V733 HydrophobicContact CB-CB 4.26Å; K294-V733 HydrophobicContact CB-CG2 4Å; K294-V733 PolarHBondContact O-N 2.89Å
295	F	84.3	Confident	79.8	Confident	22 Å²	22	79.9 Å²	79.9	10%	0.096	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-100.4	160.5	177.1	-66.8	-79.9	0	0	0	112.8	N292 P293 S297 M300 E301 Y304 V731 T732	N292-F295 HydrophobicContact CB-CE2 4.28Å; P293-F295 HydrophobicContact CB-CE2 4.14Å; P293-F295 HydrophobicContact CB-CZ 4.07Å; P293-F295 HydrophobicContact CG-CE2 4.41Å; P293-F295 HydrophobicContact CG-CZ 4.19Å; P293-F295 WeakPolarHBondContact O-CD2 3.38Å; P293-F295 WeakPolarHBondContact O-CE2 3.32Å; P293-F295 PolarHBondContact O-N 2.89Å; F295-S297 VanDerWaalsContact C-N 3.31Å; F295-S297 WeakPolarHBondContact CB-O 3.47Å; F295-M300 HydrophobicContact CB-CB 3.89Å; F295-M300 HydrophobicContact CB-SD 4.46Å; F295-M300 HydrophobicContact CD1-CB 4.07Å; F295-M300 HydrophobicContact CG-CB 3.99Å; F295-E301 HydrophobicContact CD2-CG 3.75Å; F295-E301 HydrophobicContact CE2-CG 4.32Å; F295-Y304 HydrophobicContact CE1-CD2 4.16Å; F295-Y304 HydrophobicContact CE1-CG 4.15Å; F295-Y304 HydrophobicContact CE2-CD1 4.08Å; F295-Y304 HydrophobicContact CE2-CG 4.09Å; F295-Y304 AromaticContact CZ-CD1 3.66Å; F295-Y304 HydrophobicContact CZ-CD1 3.66Å; F295-Y304 AromaticContact CZ-CD2 3.73Å; F295-Y304 HydrophobicContact CZ-CD2 3.73Å; F295-Y304 HydrophobicContact CZ-CE1 4.24Å; F295-Y304 HydrophobicContact CZ-CE2 4.31Å; F295-Y304 AromaticContact CZ-CG 3.37Å; F295-Y304 HydrophobicContact CZ-CG 3.37Å; F295-V731 WeakPolarHBondContact CD1-O 3.22Å; F295-T732 HydrophobicContact CD1-CG2 4.06Å; F295-T732 HydrophobicContact CE1-CG2 3.67Å; F295-T732 HydrophobicContact CZ-CG2 4.25Å
296	V	78.8	Confident	79.9	Confident	66 Å²	66	80.5 Å²	80.5	40%	0.4	41%	0.41	S	S	.	.	S	Bend	trans	-72.4	-23.4	179	177.2	0	0	0	0	112.5	V731 K736	V296-V731 HydrophobicContact CG2-CB 4.36Å; V296-V731 HydrophobicContact CG2-CG1 4.07Å; V296-V731 WeakPolarHBondContact CG2-O 3.39Å; V296-V731 PolarHBondContact N-O 2.99Å; V296-K736 HydrophobicContact CG1-CD 4.47Å; V296-K736 HydrophobicContact CG2-CB 4.34Å; V296-K736 HydrophobicContact CG2-CD 3.87Å
297	S	78.2	Confident	80	Confident	45 Å²	45	81.3 Å²	81.3	32%	0.315	41%	0.413	S	S	.	.	S	Bend	trans	-133.8	147.7	167.7	178.4	0	0	0	0	110	F295 D299 M300	F295-S297 VanDerWaalsContact C-N 3.31Å; F295-S297 WeakPolarHBondContact CB-O 3.47Å; S297-D299 PolarHBondContact O-N 3.05Å; S297-D299 PolarHBondContact OG-N 3.27Å; S297-M300 WeakPolarHBondContact O-CB 3.43Å; S297-M300 PolarHBondContact O-N 3.35Å
298	T	73.6	Confident	80.1	Confident	106 Å²	106	80.9 Å²	80.9	65%	0.65	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-33.8	175.3	44.1	0	0	0	0	112.6	M300 E301	T298-M300 PolarHBondContact O-N 3.2Å; T298-E301 WeakPolarHBondContact O-CB 3.31Å; T298-E301 PolarHBondContact O-N 3.27Å; T298-E301 VanDerWaalsContact O-N 3.17Å
299	D	75.9	Confident	80.4	Confident	117 Å²	117	77.2 Å²	77.2	63%	0.626	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-18.6	-173.8	-46.9	-27.9	0	0	0	111.7	S297 E301	S297-D299 PolarHBondContact O-N 3.05Å; S297-D299 PolarHBondContact OG-N 3.27Å; D299-E301 VanDerWaalsContact C-N 3.29Å; D299-E301 PolarHBondContact O-N 2.66Å
300	M	80.6	Confident	80.6	Confident	42 Å²	42	75.6 Å²	75.6	21%	0.207	39%	0.392	C	S	.	.	H	α-helix	trans	-71.9	-18.6	176	-65	177.5	173.2	0	0	113.2	F295 S297 T298 A302 L303 Y304 T730 V731	F295-M300 HydrophobicContact CB-CB 3.89Å; F295-M300 HydrophobicContact CB-SD 4.46Å; F295-M300 HydrophobicContact CD1-CB 4.07Å; F295-M300 HydrophobicContact CG-CB 3.99Å; S297-M300 WeakPolarHBondContact O-CB 3.43Å; S297-M300 PolarHBondContact O-N 3.35Å; T298-M300 PolarHBondContact O-N 3.2Å; M300-A302 PolarHBondContact O-N 2.75Å; M300-L303 PolarHBondContact O-N 3.44Å; M300-Y304 WeakPolarHBondContact O-CB 3.12Å; M300-Y304 PolarHBondContact O-N 3.08Å; M300-T730 HydrophobicContact CB-CG2 4.08Å; M300-T730 WeakPolarHBondContact O-CG2 3.32Å; M300-V731 HydrophobicContact SD-CB 4.4Å; M300-V731 PolarHBondContact SD-N 3.32Å
301	E	80.4	Confident	81.1	Confident	75 Å²	75	67.5 Å²	67.5	35%	0.35	37%	0.367	S	S	.	.	H	α-helix	trans	-62.9	-40.5	179.5	-76.8	-173.1	-132.8	0	0	112.4	N292 F295 T298 D299	N292-E301 HydrophobicContact CB-CG 4.22Å; N292-E301 PolarHBondContact ND2-OE2 3.02Å; F295-E301 HydrophobicContact CD2-CG 3.75Å; F295-E301 HydrophobicContact CE2-CG 4.32Å; T298-E301 WeakPolarHBondContact O-CB 3.31Å; T298-E301 PolarHBondContact O-N 3.27Å; T298-E301 VanDerWaalsContact O-N 3.17Å; D299-E301 VanDerWaalsContact C-N 3.29Å; D299-E301 PolarHBondContact O-N 2.66Å
302	A	79.6	Confident	81.8	Confident	75 Å²	75	63.9 Å²	63.9	62%	0.62	35%	0.345	S	S	*	.	H	α-helix	trans	-69.6	-45.3	175.9	0	0	0	0	0	111.3	M300 Y304 I305 E306	M300-A302 PolarHBondContact O-N 2.75Å; A302-Y304 PolarHBondContact O-N 3.4Å; A302-I305 PolarHBondContact O-N 2.59Å; A302-E306 PolarHBondContact O-N 2.92Å
303	L	83.3	Confident	82.5	Confident	66 Å²	66	66.7 Å²	66.7	35%	0.346	36%	0.36	S	S	.	.	H	α-helix	trans	-61.8	-26	178	-62.7	175.4	0	0	0	112.6	M300 E306 E307 T728 T730	M300-L303 PolarHBondContact O-N 3.44Å; L303-E306 PolarHBondContact O-N 3.45Å; L303-E307 VanDerWaalsContact O-CB 3.29Å; L303-E307 WeakPolarHBondContact O-CB 3.17Å; L303-E307 PolarHBondContact O-N 3.46Å; L303-T728 HydrophobicContact CB-CG2 4.12Å; L303-T728 HydrophobicContact CD2-CG2 4.18Å; L303-T730 HydrophobicContact CB-CG2 3.72Å
304	Y	83.9	Confident	82.9	Confident	31 Å²	31	69.1 Å²	69.1	12%	0.122	37%	0.37	C	S	.	.	H	α-helix	trans	-71	-42	178.3	177.5	-120.5	0	0	0	112	P293 F295 M300 A302 E306 E307 L308	P293-Y304 HydrophobicContact CG-CE1 4.13Å; F295-Y304 HydrophobicContact CE1-CD2 4.16Å; F295-Y304 HydrophobicContact CE1-CG 4.15Å; F295-Y304 HydrophobicContact CE2-CD1 4.08Å; F295-Y304 HydrophobicContact CE2-CG 4.09Å; F295-Y304 AromaticContact CZ-CD1 3.66Å; F295-Y304 HydrophobicContact CZ-CD1 3.66Å; F295-Y304 AromaticContact CZ-CD2 3.73Å; F295-Y304 HydrophobicContact CZ-CD2 3.73Å; F295-Y304 HydrophobicContact CZ-CE1 4.24Å; F295-Y304 HydrophobicContact CZ-CE2 4.31Å; F295-Y304 AromaticContact CZ-CG 3.37Å; F295-Y304 HydrophobicContact CZ-CG 3.37Å; M300-Y304 WeakPolarHBondContact O-CB 3.12Å; M300-Y304 PolarHBondContact O-N 3.08Å; A302-Y304 PolarHBondContact O-N 3.4Å; Y304-E306 VanDerWaalsContact C-N 3.26Å; Y304-E306 PolarHBondContact O-N 3.44Å; Y304-E307 PolarHBondContact O-N 2.87Å; Y304-L308 HydrophobicContact CD1-CD1 4.2Å; Y304-L308 HydrophobicContact CD2-CG 4.45Å; Y304-L308 HydrophobicContact CE1-CD1 3.7Å; Y304-L308 HydrophobicContact CE1-CG 4.42Å; Y304-L308 HydrophobicContact CE2-CD1 4.23Å; Y304-L308 HydrophobicContact CE2-CD2 4.28Å; Y304-L308 HydrophobicContact CE2-CG 4.08Å; Y304-L308 WeakPolarHBondContact O-CB 3.44Å; Y304-L308 WeakPolarHBondContact O-CG 3.19Å; Y304-L308 PolarHBondContact O-N 3.35Å
305	I	85.4	Confident	83.2	Confident	13 Å²	13	61.3 Å²	61.3	7%	0.067	34%	0.336	C	S	.	.	H	α-helix	trans	-65.8	-35	175.2	-55	-54.7	0	0	0	110.4	I286 A287 A302 R309	I286-I305 HydrophobicContact CB-CD1 4.3Å; I286-I305 HydrophobicContact CG2-CD1 3.93Å; A287-I305 HydrophobicContact CB-CD1 4.06Å; A287-I305 HydrophobicContact CB-CG1 4Å; A287-I305 HydrophobicContact CB-CG2 3.93Å; A302-I305 PolarHBondContact O-N 2.59Å; I305-R309 WeakPolarHBondContact O-CB 3.38Å; I305-R309 VanDerWaalsContact O-CG 3.27Å; I305-R309 WeakPolarHBondContact O-CG 3.38Å; I305-R309 PolarHBondContact O-N 2.8Å
306	E	85.1	Confident	83.2	Confident	120 Å²	120	62.7 Å²	62.7	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-70.2	-42.8	173.8	-169.4	166.4	-154.2	0	0	112.6	A302 L303 Y304 L308 R309 S310	A302-E306 PolarHBondContact O-N 2.92Å; L303-E306 PolarHBondContact O-N 3.45Å; Y304-E306 VanDerWaalsContact C-N 3.26Å; Y304-E306 PolarHBondContact O-N 3.44Å; E306-L308 PolarHBondContact O-N 2.92Å; E306-R309 PolarHBondContact O-N 2.81Å; E306-S310 WeakPolarHBondContact O-CB 3.31Å; E306-S310 PolarHBondContact O-N 3.32Å
307	E	85.4	Confident	83.3	Confident	43 Å²	43	62 Å²	62	20%	0.201	35%	0.345	C	S	.	.	H	α-helix	trans	-57.4	-46.1	172.5	-174.5	-177.3	155.1	0	0	110.9	L303 Y304 S311 R682 T730	L303-E307 VanDerWaalsContact O-CB 3.29Å; L303-E307 WeakPolarHBondContact O-CB 3.17Å; L303-E307 PolarHBondContact O-N 3.46Å; Y304-E307 PolarHBondContact O-N 2.87Å; E307-S311 WeakPolarHBondContact O-CB 3.37Å; E307-S311 PolarHBondContact O-N 3.42Å; E307-R682 IonicContact OE1-NH1 3.85Å; E307-R682 PolarHBondContact OE1-NH1 3.21Å; E307-R682 IonicContact OE2-NH1 2.89Å; E307-T730 WeakPolarHBondContact OE2-CB 3.32Å; E307-T730 PolarHBondContact OE2-N 3.01Å; E307-T730 PolarHBondContact OE2-OG1 3.16Å
308	L	85.8	Confident	83.5	Confident	33 Å²	33	62.2 Å²	62.2	17%	0.173	34%	0.342	C	S	.	.	H	α-helix	trans	-61.2	-50.4	175.6	-73.8	177.8	0	0	0	112	A283 Y304 E306 S311 V312	A283-L308 HydrophobicContact CB-CB 4.02Å; A283-L308 HydrophobicContact CB-CD1 3.94Å; Y304-L308 HydrophobicContact CD1-CD1 4.2Å; Y304-L308 HydrophobicContact CD2-CG 4.45Å; Y304-L308 HydrophobicContact CE1-CD1 3.7Å; Y304-L308 HydrophobicContact CE1-CG 4.42Å; Y304-L308 HydrophobicContact CE2-CD1 4.23Å; Y304-L308 HydrophobicContact CE2-CD2 4.28Å; Y304-L308 HydrophobicContact CE2-CG 4.08Å; Y304-L308 WeakPolarHBondContact O-CB 3.44Å; Y304-L308 WeakPolarHBondContact O-CG 3.19Å; Y304-L308 PolarHBondContact O-N 3.35Å; E306-L308 PolarHBondContact O-N 2.92Å; L308-S311 PolarHBondContact O-N 2.83Å; L308-S311 PolarHBondContact O-OG 3.23Å; L308-V312 PolarHBondContact O-N 2.82Å; L308-V312 VanDerWaalsContact O-N 3.15Å
309	R	87.7	Confident	83.9	Confident	107 Å²	107	57.3 Å²	57.3	40%	0.404	31%	0.312	S	S	.	.	H	α-helix	trans	-60.8	-48.5	178.5	-76.9	169	169.3	170.4	-5.7	112	I305 E306 S311 V312 N313	I305-R309 WeakPolarHBondContact O-CB 3.38Å; I305-R309 VanDerWaalsContact O-CG 3.27Å; I305-R309 WeakPolarHBondContact O-CG 3.38Å; I305-R309 PolarHBondContact O-N 2.8Å; E306-R309 PolarHBondContact O-N 2.81Å; R309-S311 VanDerWaalsContact C-N 3.31Å; R309-S311 PolarHBondContact O-N 3.45Å; R309-V312 PolarHBondContact O-N 3.34Å; R309-V312 VanDerWaalsContact O-N 3.12Å; R309-N313 VanDerWaalsContact O-CG 3.25Å; R309-N313 PolarHBondContact O-N 3.46Å; R309-N313 PolarHBondContact O-OD1 2.92Å
310	S	85.9	Confident	83.8	Confident	74 Å²	74	56.2 Å²	56.2	52%	0.517	30%	0.303	S	S	.	.	H	α-helix	trans	-58	-42.8	177.1	-174.5	0	0	0	0	111.5	E306 V312 N313 L314	E306-S310 WeakPolarHBondContact O-CB 3.31Å; E306-S310 PolarHBondContact O-N 3.32Å; S310-V312 VanDerWaalsContact C-N 3.33Å; S310-V312 PolarHBondContact O-N 3.2Å; S310-N313 PolarHBondContact O-N 2.73Å; S310-L314 WeakPolarHBondContact O-CB 3.17Å; S310-L314 PolarHBondContact O-N 3Å
311	S	86.4	Confident	83.4	Confident	40 Å²	40	58.5 Å²	58.5	28%	0.28	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-37.5	176	81.6	0	0	0	0	113.2	R279 E307 L308 R309 L315	R279-S311 PolarHBondContact NH2-OG 3.48Å; E307-S311 WeakPolarHBondContact O-CB 3.37Å; E307-S311 PolarHBondContact O-N 3.42Å; L308-S311 PolarHBondContact O-N 2.83Å; L308-S311 PolarHBondContact O-OG 3.23Å; R309-S311 VanDerWaalsContact C-N 3.31Å; R309-S311 PolarHBondContact O-N 3.45Å; S311-L315 VanDerWaalsContact O-CD1 3.29Å; S311-L315 WeakPolarHBondContact O-CD1 3.43Å; S311-L315 WeakPolarHBondContact O-CG 3.48Å; S311-L315 PolarHBondContact O-N 2.72Å
312	V	86.9	Confident	82.8	Confident	6 Å²	6	58.2 Å²	58.2	4%	0.036	32%	0.324	C	S	.	.	H	α-helix	trans	-73.6	-42.2	177	173.7	0	0	0	0	110.8	L276 R279 L280 L308 R309 S310 L314 L315 M316	L276-V312 HydrophobicContact CB-CG1 4.08Å; R279-V312 HydrophobicContact CB-CG2 4.13Å; L280-V312 HydrophobicContact CB-CG1 4.42Å; L280-V312 HydrophobicContact CD1-CG1 4.38Å; L308-V312 PolarHBondContact O-N 2.82Å; L308-V312 VanDerWaalsContact O-N 3.15Å; R309-V312 PolarHBondContact O-N 3.34Å; R309-V312 VanDerWaalsContact O-N 3.12Å; S310-V312 VanDerWaalsContact C-N 3.33Å; S310-V312 PolarHBondContact O-N 3.2Å; V312-L314 PolarHBondContact O-N 2.94Å; V312-L315 PolarHBondContact O-N 3.17Å; V312-L315 VanDerWaalsContact O-N 3.14Å; V312-M316 WeakPolarHBondContact O-CG 3.48Å; V312-M316 PolarHBondContact O-N 3.37Å
313	N	86.6	Confident	81.6	Confident	94 Å²	94	59.4 Å²	59.4	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-63.8	-39.2	178.7	-67.9	-2.4	0	0	0	112	R309 S310 L315 M316 A317	R309-N313 VanDerWaalsContact O-CG 3.25Å; R309-N313 PolarHBondContact O-N 3.46Å; R309-N313 PolarHBondContact O-OD1 2.92Å; S310-N313 PolarHBondContact O-N 2.73Å; N313-L315 VanDerWaalsContact C-N 3.34Å; N313-L315 PolarHBondContact O-N 3.12Å; N313-M316 PolarHBondContact O-N 3.39Å; N313-A317 WeakPolarHBondContact O-CB 3.29Å; N313-A317 PolarHBondContact O-N 2.89Å
314	L	86.8	Confident	79.9	Confident	103 Å²	103	59.5 Å²	59.5	54%	0.539	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-38.4	172.9	179.2	61	0	0	0	112	S310 V312 A317 N318	S310-L314 WeakPolarHBondContact O-CB 3.17Å; S310-L314 PolarHBondContact O-N 3Å; V312-L314 PolarHBondContact O-N 2.94Å; L314-A317 PolarHBondContact O-N 3.3Å; L314-N318 WeakPolarHBondContact O-CB 3.49Å; L314-N318 VanDerWaalsContact O-CG 3.25Å; L314-N318 PolarHBondContact O-N 2.84Å
315	L	86.8	Confident	78.1	Confident	10 Å²	10	62 Å²	62	5%	0.052	35%	0.35	C	S	.	.	H	α-helix	trans	-71.5	-36.4	177.4	-70.5	166.1	0	0	0	112.4	F98 N99 L276 S311 V312 N313 L319 A677	F98-L315 HydrophobicContact CE2-CB 4.05Å; F98-L315 HydrophobicContact CE2-CD2 3.87Å; F98-L315 WeakPolarHBondContact CE2-O 3.46Å; F98-L315 HydrophobicContact CZ-CB 4.41Å; F98-L315 HydrophobicContact CZ-CD2 4.09Å; N99-L315 HydrophobicContact CB-CD2 3.97Å; N99-L315 WeakPolarHBondContact OD1-CD2 3.44Å; L276-L315 HydrophobicContact CD1-CB 4.01Å; L276-L315 HydrophobicContact CD2-CB 4.04Å; L276-L315 HydrophobicContact CD2-CD1 4.06Å; S311-L315 VanDerWaalsContact O-CD1 3.29Å; S311-L315 WeakPolarHBondContact O-CD1 3.43Å; S311-L315 WeakPolarHBondContact O-CG 3.48Å; S311-L315 PolarHBondContact O-N 2.72Å; V312-L315 PolarHBondContact O-N 3.17Å; V312-L315 VanDerWaalsContact O-N 3.14Å; N313-L315 VanDerWaalsContact C-N 3.34Å; N313-L315 PolarHBondContact O-N 3.12Å; L315-L319 WeakPolarHBondContact O-CB 3.35Å; L315-L319 PolarHBondContact O-N 3.15Å; L315-L319 VanDerWaalsContact O-N 3.09Å; L315-A677 WeakPolarHBondContact CD1-O 3.35Å; L315-A677 HydrophobicContact CD2-CB 4.01Å
316	M	83.1	Confident	76.2	Confident	50 Å²	50	71.5 Å²	71.5	25%	0.246	39%	0.391	C	S	.	.	H	α-helix	trans	-58.8	-58.1	167.6	-71.3	-68.1	-69.1	0	0	109.5	R273 L276 V312 N313 N318 L319 E320 Y517	R273-M316 HydrophobicContact CG-CE 4.37Å; R273-M316 HydrophobicContact CG-SD 4.5Å; L276-M316 HydrophobicContact CB-SD 4.21Å; L276-M316 HydrophobicContact CD1-CG 4.05Å; L276-M316 HydrophobicContact CD1-SD 3.69Å; V312-M316 WeakPolarHBondContact O-CG 3.48Å; V312-M316 PolarHBondContact O-N 3.37Å; N313-M316 PolarHBondContact O-N 3.39Å; M316-N318 VanDerWaalsContact C-N 3.29Å; M316-N318 PolarHBondContact O-N 3.34Å; M316-L319 CarbonylContact O-C 3.59Å; M316-L319 VanDerWaalsContact O-CA 3.3Å; M316-L319 WeakPolarHBondContact O-CA 3.22Å; M316-L319 WeakPolarHBondContact O-CB 3.34Å; M316-L319 PolarHBondContact O-N 3.33Å; M316-E320 WeakPolarHBondContact O-CG 3.48Å; M316-E320 PolarHBondContact O-N 3.36Å; M316-Y517 HydrophobicContact CE-CD1 4.5Å
317	A	81.3	Confident	73.7	Confident	51 Å²	51	69.5 Å²	69.5	42%	0.421	40%	0.403	S	S	.	.	H	α-helix	trans	-55.5	-38	-179.8	0	0	0	0	0	113.8	N313 L314 E320 S321	N313-A317 WeakPolarHBondContact O-CB 3.29Å; N313-A317 PolarHBondContact O-N 2.89Å; L314-A317 PolarHBondContact O-N 3.3Å; A317-E320 CarbonylContact O-C 3.53Å; A317-E320 PolarHBondContact O-N 3.3Å; A317-E320 VanDerWaalsContact O-N 3.13Å; A317-S321 PolarHBondContact O-N 3.3Å
318	N	83.5	Confident	71	Confident	50 Å²	50	70.3 Å²	70.3	27%	0.267	42%	0.423	S	S	.	.	H	α-helix	trans	-64.8	-39.8	173.4	-76.6	-12.6	0	0	0	111.8	N99 L314 M316 E320 S321	N99-N318 PolarHBondContact OD1-ND2 3.41Å; L314-N318 WeakPolarHBondContact O-CB 3.49Å; L314-N318 VanDerWaalsContact O-CG 3.25Å; L314-N318 PolarHBondContact O-N 2.84Å; M316-N318 VanDerWaalsContact C-N 3.29Å; M316-N318 PolarHBondContact O-N 3.34Å; N318-E320 VanDerWaalsContact C-N 3.28Å; N318-E320 PolarHBondContact O-N 3.4Å; N318-S321 PolarHBondContact O-N 2.85Å; N318-S321 PolarHBondContact O-OG 3.15Å
319	L	82.4	Confident	68.5	Low	3 Å²	3	74.3 Å²	74.3	2%	0.016	45%	0.451	C	S	.	.	H	α-helix	trans	-66.3	-28.3	171.4	-157.9	74	0	0	0	112.2	F98 I272 R273 L315 M316 L322 Q516 Y517	F98-L319 HydrophobicContact CB-CD1 3.37Å; F98-L319 HydrophobicContact CD1-CD1 4.24Å; F98-L319 HydrophobicContact CD2-CB 4.07Å; F98-L319 HydrophobicContact CD2-CD1 3.57Å; F98-L319 HydrophobicContact CD2-CG 4.4Å; F98-L319 HydrophobicContact CE2-CD1 4.38Å; F98-L319 HydrophobicContact CG-CD1 3.48Å; F98-L319 VanDerWaalsContact CG-CD1 3.48Å; I272-L319 HydrophobicContact CB-CD1 4.45Å; I272-L319 HydrophobicContact CB-CD2 3.95Å; I272-L319 HydrophobicContact CD1-CD1 3.47Å; I272-L319 VanDerWaalsContact CD1-CD1 3.47Å; I272-L319 HydrophobicContact CD1-CD2 4.43Å; I272-L319 HydrophobicContact CG2-CD1 4.24Å; I272-L319 HydrophobicContact CG2-CD2 3.8Å; R273-L319 HydrophobicContact CG-CD2 4.44Å; L315-L319 WeakPolarHBondContact O-CB 3.35Å; L315-L319 PolarHBondContact O-N 3.15Å; L315-L319 VanDerWaalsContact O-N 3.09Å; M316-L319 CarbonylContact O-C 3.59Å; M316-L319 VanDerWaalsContact O-CA 3.3Å; M316-L319 WeakPolarHBondContact O-CA 3.22Å; M316-L319 WeakPolarHBondContact O-CB 3.34Å; M316-L319 PolarHBondContact O-N 3.33Å; L319-L322 HydrophobicContact CD1-CD1 4.16Å; L319-Q516 PolarHBondContact O-OE1 3.29Å; L319-Q516 VanDerWaalsContact O-OE1 3.12Å; L319-Y517 HydrophobicContact CD2-CE1 4.12Å; L319-Y517 WeakPolarHBondContact CD2-OH 3.2Å; L319-Y517 WeakPolarHBondContact CG-OH 3.49Å; L319-Y517 PolarHBondContact O-OH 3.08Å
320	E	73.1	Confident	65.9	Low	95 Å²	95	76.2 Å²	76.2	44%	0.444	47%	0.469	S	S	.	.	H	α-helix	trans	-77.4	-27.1	174.3	-44.4	-151.6	153.7	0	0	114	M316 A317 N318 L322 Y517	M316-E320 WeakPolarHBondContact O-CG 3.48Å; M316-E320 PolarHBondContact O-N 3.36Å; A317-E320 CarbonylContact O-C 3.53Å; A317-E320 PolarHBondContact O-N 3.3Å; A317-E320 VanDerWaalsContact O-N 3.13Å; N318-E320 VanDerWaalsContact C-N 3.28Å; N318-E320 PolarHBondContact O-N 3.4Å; E320-L322 PolarHBondContact O-N 3.29Å; E320-Y517 VanDerWaalsContact CA-CE2 3.4Å; E320-Y517 HydrophobicContact CB-CD2 3.77Å; E320-Y517 HydrophobicContact CB-CE2 3.79Å; E320-Y517 HydrophobicContact CG-CD1 4.09Å; E320-Y517 HydrophobicContact CG-CD2 3.46Å; E320-Y517 VanDerWaalsContact CG-CD2 3.46Å; E320-Y517 HydrophobicContact CG-CE1 4.17Å; E320-Y517 HydrophobicContact CG-CE2 3.63Å; E320-Y517 HydrophobicContact CG-CG 3.83Å; E320-Y517 WeakPolarHBondContact OE1-CB 3.43Å; E320-Y517 VanDerWaalsContact OE1-CD1 3.3Å; E320-Y517 WeakPolarHBondContact OE1-CD1 3.25Å
321	S	72.2	Confident	63.4	Low	90 Å²	90	81 Å²	81	63%	0.629	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.7	178.1	79.3	0	0	0	0	114.7	A317 N318	A317-S321 PolarHBondContact O-N 3.3Å; N318-S321 PolarHBondContact O-N 2.85Å; N318-S321 PolarHBondContact O-OG 3.15Å
322	L	67.2	Low	61	Low	69 Å²	69	88.5 Å²	88.5	36%	0.361	51%	0.508	S	S	.	.	S	Bend	trans	-74.7	145.3	-178.3	-63.2	176.3	0	0	0	111.3	F98 L319 E320 Q516	F98-L322 HydrophobicContact CB-CD1 4.36Å; L319-L322 HydrophobicContact CD1-CD1 4.16Å; E320-L322 PolarHBondContact O-N 3.29Å; L322-Q516 VanDerWaalsContact O-CD 3.23Å; L322-Q516 PolarHBondContact O-NE2 3.24Å
323	P	54.5	Low	58.6	Low	99 Å²	99	95.9 Å²	95.9	64%	0.643	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-75.5	135.1	178.5	29.7	-33.9	0	0	0	111.5	S325 Q516	P323-S325 PolarHBondContact O-N 3.34Å; P323-Q516 VanDerWaalsContact C-NE2 3.32Å; P323-Q516 PolarHBondContact O-NE2 3.18Å
324	V	47.3	Very low	56	Low	68 Å²	68	101 Å²	101	41%	0.412	56%	0.56	S	S	.	*	S	Bend	trans	-61.9	120.3	167.6	-166.5	0	0	0	0	108.8	Q516	V324-Q516 HydrophobicContact CG2-CG 3.63Å
325	S	45.9	Very low	53.4	Low	83 Å²	83	104.4 Å²	104.4	58%	0.58	58%	0.578	S	S	*	*			trans	27.4	100.9	162.4	-61.6	0	0	0	0	118.5	P323 G327	P323-S325 PolarHBondContact O-N 3.34Å; S325-G327 PolarHBondContact O-N 3.45Å
326	K	46.2	Very low	50.6	Low	213 Å²	213	112.7 Å²	112.7	93%	0.926	61%	0.614	S	S	*	*			trans	-65.2	93.3	161.6	-72.5	-177.3	178.4	177	0	110.8
327	G	33.6	Very low	48.3	Very low	79 Å²	79	122.7 Å²	122.7	81%	0.814	65%	0.649	S	S	*	*			trans	-125.5	83.6	176.8	0	0	0	0	0	112.5	S325	S325-G327 PolarHBondContact O-N 3.45Å
328	G	29.1	Very low	45.7	Very low	60 Å²	60	125.6 Å²	125.6	62%	0.619	67%	0.666	S	S	*	*			trans	151.5	136.3	177.4	0	0	0	0	0	112.6	D330	G328-D330 VanDerWaalsContact C-N 3.33Å; G328-D330 PolarHBondContact O-N 2.99Å
329	P	32.5	Very low	43.1	Very low	116 Å²	116	128.4 Å²	128.4	75%	0.753	69%	0.689	S	S	*	*	S	Bend	trans	-66.8	-27.7	-178.7	-23.2	35.3	0	0	0	115.3
330	D	32.2	Very low	40.9	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	73%	0.729	S	S	*	*			trans	-96.8	-4.5	-154.4	-59.5	-70.5	0	0	0	116.3	G328 K332	G328-D330 VanDerWaalsContact C-N 3.33Å; G328-D330 PolarHBondContact O-N 2.99Å; D330-K332 PolarHBondContact O-N 2.8Å
331	F	34.4	Very low	38.8	Very low	176 Å²	176	139.1 Å²	139.1	77%	0.772	75%	0.746	S	S	*	*			trans	-79.8	53.4	-176.8	-141.8	-88.8	0	0	0	114.3	Q333	F331-Q333 VanDerWaalsContact C-N 3.27Å; F331-Q333 HydrophobicContact CD1-CB 4.48Å; F331-Q333 HydrophobicContact CE1-CB 4.07Å; F331-Q333 HydrophobicContact CE1-CG 4.42Å; F331-Q333 PolarHBondContact O-N 2.79Å
332	K	36.1	Very low	36.6	Very low	197 Å²	197	143 Å²	143	86%	0.857	76%	0.76	S	S	*	*			trans	-84.3	57.6	169.9	-73.9	-175	178.4	173.1	0	112	D330	D330-K332 PolarHBondContact O-N 2.8Å
333	Q	35	Very low	34.7	Very low	161 Å²	161	144.6 Å²	144.6	75%	0.752	78%	0.777	S	S	*	*			trans	-89.4	134.5	167.8	-75.1	-155.6	-5.8	0	0	112.6	F331 L335	F331-Q333 VanDerWaalsContact C-N 3.27Å; F331-Q333 HydrophobicContact CD1-CB 4.48Å; F331-Q333 HydrophobicContact CE1-CB 4.07Å; F331-Q333 HydrophobicContact CE1-CG 4.42Å; F331-Q333 PolarHBondContact O-N 2.79Å; Q333-L335 PolarHBondContact O-N 3.29Å
334	K	33.7	Very low	33.7	Very low	200 Å²	200	149.6 Å²	149.6	87%	0.87	79%	0.789	S	S	*	*			trans	-64.2	108.8	-167.7	-64.7	160.6	179.2	169	0	112	K336	K334-K336 PolarHBondContact O-N 2.87Å
335	L	30.5	Very low	33.1	Very low	176 Å²	176	153.3 Å²	153.3	92%	0.921	81%	0.806	S	S	*	*			trans	-70	93	162.3	-164.5	77.1	0	0	0	109	Q333	Q333-L335 PolarHBondContact O-N 3.29Å
336	K	29.9	Very low	32.2	Very low	184 Å²	184	156.5 Å²	156.5	80%	0.8	82%	0.817	S	S	*	*			trans	-65.6	136.2	165.8	-83	-173.5	173.4	-177.4	0	108.5	K334 S338	K334-K336 PolarHBondContact O-N 2.87Å; K336-S338 PolarHBondContact O-N 3.4Å; K336-S338 VanDerWaalsContact O-N 3.1Å
337	R	34.1	Very low	31.7	Very low	260 Å²	260	154.7 Å²	154.7	98%	0.981	82%	0.815	S	S	*	*			trans	-59.6	109.9	158.5	-88.4	178.5	164.9	172.4	-6.2	108.4
338	S	26.4	Very low	31.4	Very low	112 Å²	112	153.6 Å²	153.6	78%	0.783	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-97.5	152	154.5	43.5	0	0	0	0	108.8	K336	K336-S338 PolarHBondContact O-N 3.4Å; K336-S338 VanDerWaalsContact O-N 3.1Å
339	S	29.3	Very low	31.7	Very low	108 Å²	108	158.5 Å²	158.5	76%	0.755	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-66.4	151.5	-169.1	-162.4	0	0	0	0	113	N341	S339-N341 PolarHBondContact O-N 3.14Å
340	M	36.3	Very low	32	Very low	172 Å²	172	162.2 Å²	162.2	85%	0.847	82%	0.824	S	S	*	*	S	Bend	trans	-56.6	119.2	146.6	-79.9	-71.8	176	0	0	108.1
341	N	29	Very low	32.3	Very low	152 Å²	152	158.7 Å²	158.7	81%	0.813	82%	0.822	S	S	*	*			trans	163.5	105.9	154.1	-89.7	-2.9	0	0	0	107.8	S339	S339-N341 PolarHBondContact O-N 3.14Å
342	N	26.1	Very low	32.9	Very low	170 Å²	170	157.7 Å²	157.7	91%	0.909	82%	0.824	S	S	*	*			trans	-142.9	145.7	154.9	-127	14	0	0	0	108.2
343	S	27.1	Very low	34.1	Very low	104 Å²	104	154.2 Å²	154.2	73%	0.727	82%	0.82	S	S	*	*			trans	-78.5	134.9	-163.1	40.2	0	0	0	0	113.9	L345	S343-L345 PolarHBondContact O-N 2.91Å
344	F	32.4	Very low	35.7	Very low	203 Å²	203	148.1 Å²	148.1	89%	0.89	79%	0.792	S	S	*	*	S	Bend	trans	-68.3	13.9	179.2	171.5	-109.9	0	0	0	115.1
345	L	36.1	Very low	37.6	Very low	146 Å²	146	140.6 Å²	140.6	76%	0.764	77%	0.765	S	S	*	*			trans	-141.9	82.5	-172.6	-70	175.2	0	0	0	112.1	S343	S343-L345 PolarHBondContact O-N 2.91Å
346	D	26	Very low	39.9	Very low	151 Å²	151	136.2 Å²	136.2	81%	0.807	74%	0.738	S	S	*	*			trans	-159	89.1	144.8	-159.8	6.9	0	0	0	110.1	G348	D346-G348 PolarHBondContact O-N 2.79Å
347	I	35.3	Very low	41.9	Very low	174 Å²	174	131.4 Å²	131.4	89%	0.892	73%	0.727	S	S	*	*			trans	-93.7	80.2	169.5	-59.9	-179.4	0	0	0	106.9
348	G	28.3	Very low	43.9	Very low	57 Å²	57	123 Å²	123	59%	0.588	70%	0.702	S	S	*	*			trans	-81.9	120.1	171.1	0	0	0	0	0	110.9	D346 E350	D346-G348 PolarHBondContact O-N 2.79Å; G348-E350 PolarHBondContact O-N 3.36Å
349	D	35.3	Very low	46.3	Very low	162 Å²	162	117.7 Å²	117.7	87%	0.866	67%	0.665	S	S	*	*	S	Bend	trans	-78.2	35.5	-168.6	-163.6	31.7	0	0	0	114.8
350	E	38.6	Very low	48.8	Very low	195 Å²	195	115.4 Å²	115.4	91%	0.911	65%	0.646	S	S	*	*			trans	-139.8	111.6	174.3	-71.4	-162.4	164.4	0	0	111.9	G348	G348-E350 PolarHBondContact O-N 3.36Å
351	G	38.7	Very low	51.1	Low	73 Å²	73	107.7 Å²	107.7	75%	0.753	61%	0.609	S	S	*	*			trans	176.5	-20	173.3	0	0	0	0	0	118.4	V353	G351-V353 PolarHBondContact O-N 3.39Å
352	D	47.7	Very low	53.8	Low	154 Å²	154	104.5 Å²	104.5	82%	0.824	60%	0.595	S	S	*	*			trans	-75.9	16.7	-160.5	-138.3	21.4	0	0	0	116.8	Q536	D352-Q536 PolarHBondContact O-NE2 3.27Å
353	V	60.8	Low	56.8	Low	125 Å²	125	96.5 Å²	96.5	76%	0.758	55%	0.552	S	S	*	*	S	Bend	trans	-114.4	107	-176	-176.3	0	0	0	0	110.4	G351 S355	G351-V353 PolarHBondContact O-N 3.39Å; V353-S355 PolarHBondContact O-N 2.75Å
354	L	68.5	Low	59.7	Low	32 Å²	32	95.9 Å²	95.9	17%	0.168	54%	0.54	C	S	.	.			trans	-47.3	128.5	175.9	-77.9	-172.6	0	0	0	111.9	D358 V514 T518 A520 Q536	L354-D358 HydrophobicContact CD2-CB 4.46Å; L354-V514 HydrophobicContact CD1-CB 4.19Å; L354-V514 HydrophobicContact CD1-CG1 4.17Å; L354-V514 HydrophobicContact CD1-CG2 4.02Å; L354-V514 HydrophobicContact CD2-CG1 3.83Å; L354-T518 HydrophobicContact CD1-CG2 3.71Å; L354-T518 HydrophobicContact CD2-CG2 4.25Å; L354-T518 HydrophobicContact CG-CG2 4.03Å; L354-A520 HydrophobicContact CD1-CB 4.26Å; L354-Q536 HydrophobicContact CD1-CG 4.03Å; L354-Q536 HydrophobicContact CG-CG 4.22Å
355	S	74.4	Confident	62.4	Low	43 Å²	43	86.2 Å²	86.2	30%	0.301	50%	0.498	S	S	.	.			trans	-77	162.3	174.7	82.8	0	0	0	0	111.1	V353 S357 D358	V353-S355 PolarHBondContact O-N 2.75Å; S355-S357 PolarHBondContact O-N 3.36Å; S355-S357 PolarHBondContact OG-N 3.05Å; S355-S357 PolarHBondContact OG-OG 3.32Å; S355-D358 WeakPolarHBondContact CA-OD2 3.28Å; S355-D358 VanDerWaalsContact CB-OD2 3.24Å; S355-D358 WeakPolarHBondContact CB-OD2 3.44Å; S355-D358 PolarHBondContact N-OD2 2.71Å; S355-D358 PolarHBondContact O-N 2.83Å; S355-D358 PolarHBondContact OG-N 3.33Å; S355-D358 PolarHBondContact OG-OD1 3.31Å; S355-D358 PolarHBondContact OG-OD2 3.09Å
356	K	76.8	Confident	65	Low	84 Å²	84	81.1 Å²	81.1	37%	0.365	47%	0.47	S	S	.	.	S	Bend	trans	-68.6	-25.2	175.9	-66.6	-167.7	168.6	-150.4	0	113.1	D358 E530 P531 Q532 L534	K356-D358 VanDerWaalsContact C-N 3.35Å; K356-E530 HydrophobicContact CB-CG 4.39Å; K356-P531 PolarHBondContact NZ-O 2.94Å; K356-Q532 PolarHBondContact NZ-O 3.02Å; K356-L534 HydrophobicContact CG-CD2 4.11Å
357	S	73.3	Confident	68	Low	82 Å²	82	74 Å²	74	57%	0.573	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-64.7	-36.3	175.3	7.9	0	0	0	0	112.4	S355 V359 V360	S355-S357 PolarHBondContact O-N 3.36Å; S355-S357 PolarHBondContact OG-N 3.05Å; S355-S357 PolarHBondContact OG-OG 3.32Å; S357-V359 PolarHBondContact O-N 3.26Å; S357-V359 VanDerWaalsContact O-N 3.09Å; S357-V360 PolarHBondContact O-N 3.47Å
358	D	74.8	Confident	70.6	Confident	83 Å²	83	67.4 Å²	67.4	44%	0.444	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-69.8	-10.1	-175.2	-49.4	-39.7	0	0	0	113	L354 S355 K356 V514	L354-D358 HydrophobicContact CD2-CB 4.46Å; S355-D358 WeakPolarHBondContact CA-OD2 3.28Å; S355-D358 VanDerWaalsContact CB-OD2 3.24Å; S355-D358 WeakPolarHBondContact CB-OD2 3.44Å; S355-D358 PolarHBondContact N-OD2 2.71Å; S355-D358 PolarHBondContact O-N 2.83Å; S355-D358 PolarHBondContact OG-N 3.33Å; S355-D358 PolarHBondContact OG-OD1 3.31Å; S355-D358 PolarHBondContact OG-OD2 3.09Å; K356-D358 VanDerWaalsContact C-N 3.35Å; D358-V514 HydrophobicContact CB-CG1 3.83Å
359	V	77.9	Confident	73.6	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.006	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-117.1	22.4	-179.9	-142.7	0	0	0	0	113	S357 V512 V514 A520 C522 Y524	S357-V359 PolarHBondContact O-N 3.26Å; S357-V359 VanDerWaalsContact O-N 3.09Å; V359-V512 HydrophobicContact CG1-CB 3.55Å; V359-V512 HydrophobicContact CG1-CG1 3.6Å; V359-V512 HydrophobicContact CG1-CG2 3.76Å; V359-V514 HydrophobicContact CB-CG2 4.49Å; V359-V514 HydrophobicContact CG1-CG2 4.02Å; V359-V514 HydrophobicContact CG2-CG2 4.01Å; V359-A520 HydrophobicContact CG1-CB 4.48Å; V359-C522 HydrophobicContact CG1-CB 4.48Å; V359-Y524 PolarHBondContact O-OH 2.8Å
360	V	82.4	Confident	76.3	Confident	60 Å²	60	59 Å²	59	36%	0.364	34%	0.343	S	S	.	.			trans	-80.6	130.1	167.4	178.3	0	0	0	0	109.1	S357 T417	S357-V360 PolarHBondContact O-N 3.47Å; V360-T417 HydrophobicContact CG1-CG2 4.16Å
361	L	84	Confident	78.8	Confident	11 Å²	11	51.1 Å²	51.1	6%	0.058	31%	0.306	C	S	.	.			trans	-120.5	140.2	-178.1	-69.4	172.7	0	0	0	110.3	F363 T417 P484 N486 M487 L510 V512	L361-F363 HydrophobicContact CB-CD2 4.43Å; L361-F363 HydrophobicContact CB-CE2 3.57Å; L361-F363 HydrophobicContact CB-CZ 3.67Å; L361-F363 HydrophobicContact CD1-CZ 4.01Å; L361-F363 WeakPolarHBondContact O-CD2 3.27Å; L361-F363 VanDerWaalsContact O-CE2 3.27Å; L361-F363 WeakPolarHBondContact O-CE2 3.49Å; L361-T417 CarbonylContact O-C 3.59Å; L361-T417 VanDerWaalsContact O-CA 3.31Å; L361-T417 WeakPolarHBondContact O-CA 3.36Å; L361-P484 HydrophobicContact CB-CG 4.36Å; L361-P484 HydrophobicContact CD1-CG 4.37Å; L361-N486 HydrophobicContact CD2-CB 3.79Å; L361-M487 HydrophobicContact CD1-CB 4.05Å; L361-L510 HydrophobicContact CD1-CD2 3.87Å; L361-V512 HydrophobicContact CD1-CG1 4Å; L361-V512 HydrophobicContact CD1-CG2 3.81Å; L361-V512 HydrophobicContact CD2-CG1 4.02Å; L361-V512 HydrophobicContact CG-CG1 4.23Å
362	T	86	Confident	81.3	Confident	85 Å²	85	48 Å²	48	52%	0.521	27%	0.273	S	S	.	.			trans	-91.9	131.1	171.5	-51.7	0	0	0	0	109.9	S415 P484	T362-S415 VanDerWaalsContact CG2-OG 3.24Å; T362-S415 WeakPolarHBondContact CG2-OG 2.95Å; T362-P484 WeakPolarHBondContact O-CB 3.33Å
363	F	88.1	Confident	83.2	Confident	2 Å²	2	45 Å²	45	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	138.5	177.9	-56.2	-95.8	0	0	0	109.5	L361 L365 S415 T416 P419 T451 M481 P484 M487 L510	L361-F363 HydrophobicContact CB-CD2 4.43Å; L361-F363 HydrophobicContact CB-CE2 3.57Å; L361-F363 HydrophobicContact CB-CZ 3.67Å; L361-F363 HydrophobicContact CD1-CZ 4.01Å; L361-F363 WeakPolarHBondContact O-CD2 3.27Å; L361-F363 VanDerWaalsContact O-CE2 3.27Å; L361-F363 WeakPolarHBondContact O-CE2 3.49Å; F363-L365 HydrophobicContact CB-CD1 4.21Å; F363-S415 WeakPolarHBondContact O-CA 3.45Å; F363-S415 PolarHBondContact O-OG 2.91Å; F363-T416 HydrophobicContact CB-CG2 4.32Å; F363-T416 PolarHBondContact N-O 3.25Å; F363-T416 PolarHBondContact O-N 2.93Å; F363-P419 HydrophobicContact CE2-CB 3.91Å; F363-P419 HydrophobicContact CE2-CG 3.7Å; F363-P419 HydrophobicContact CZ-CB 3.76Å; F363-P419 HydrophobicContact CZ-CG 3.87Å; F363-T451 HydrophobicContact CD1-CG2 4.4Å; F363-M481 HydrophobicContact CB-CE 3.71Å; F363-M481 HydrophobicContact CD1-CE 3.48Å; F363-M481 VanDerWaalsContact CD1-CE 3.48Å; F363-M481 HydrophobicContact CD2-CE 4.13Å; F363-M481 HydrophobicContact CE1-CE 4.11Å; F363-M481 HydrophobicContact CG-CE 3.49Å; F363-M481 VanDerWaalsContact CG-CE 3.49Å; F363-P484 VanDerWaalsContact CD1-CD 3.47Å; F363-P484 HydrophobicContact CD1-CG 3.8Å; F363-P484 HydrophobicContact CE1-CG 3.6Å; F363-P484 HydrophobicContact CZ-CG 4.19Å; F363-M487 HydrophobicContact CE1-CE 4.37Å; F363-M487 HydrophobicContact CE1-SD 4.07Å; F363-M487 HydrophobicContact CZ-SD 4.5Å; F363-L510 HydrophobicContact CZ-CD2 4.03Å
364	N	89.1	Confident	84.3	Confident	90 Å²	90	40.5 Å²	40.5	48%	0.481	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	139.8	171.2	-63.6	-17.9	0	0	0	109.3	F414 S415 D482	N364-F414 CarbonylContact C-O 3.57Å; N364-F414 WeakPolarHBondContact CA-O 3.36Å; N364-S415 PolarHBondContact OD1-OG 3.24Å; N364-D482 PolarHBondContact O-N 3.05Å
365	L	89.4	Confident	85	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.8	-179.4	-72	86.9	0	0	0	110.3	F363 D413 F414 T416 P421 V423 P449 V479 R480 M481	F363-L365 HydrophobicContact CB-CD1 4.21Å; L365-D413 WeakPolarHBondContact O-CA 3.2Å; L365-F414 HydrophobicContact CB-CB 4.47Å; L365-F414 PolarHBondContact N-O 2.61Å; L365-F414 PolarHBondContact O-N 3.06Å; L365-T416 HydrophobicContact CD1-CG2 3.49Å; L365-T416 VanDerWaalsContact CD1-CG2 3.49Å; L365-P421 HydrophobicContact CD1-CG 4.47Å; L365-P421 HydrophobicContact CD2-CG 3.88Å; L365-V423 HydrophobicContact CD2-CG2 4.03Å; L365-P449 HydrophobicContact CD2-CB 4.45Å; L365-P449 HydrophobicContact CD2-CG 3.55Å; L365-V479 HydrophobicContact CD2-CG1 4.25Å; L365-R480 CarbonylContact C-O 3.6Å; L365-R480 WeakPolarHBondContact CA-O 2.99Å; L365-M481 HydrophobicContact CD1-CG 4.2Å; L365-M481 HydrophobicContact CD2-CB 4.46Å; L365-M481 HydrophobicContact CD2-CG 4.39Å; L365-M481 HydrophobicContact CG-CB 4.12Å; L365-M481 HydrophobicContact CG-CG 3.96Å
366	E	89.1	Confident	85.3	Confident	39 Å²	39	46 Å²	46	18%	0.182	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127	168	-50.2	171.4	-173.9	0	0	108.1	V479 R480	E366-V479 WeakPolarHBondContact O-CA 3.31Å; E366-R480 HydrophobicContact CB-CB 4.25Å; E366-R480 PolarHBondContact N-O 2.82Å; E366-R480 PolarHBondContact O-N 3.45Å; E366-R480 IonicContact OE1-CZ 3.55Å; E366-R480 IonicContact OE1-NE 2.72Å; E366-R480 IonicContact OE1-NH1 2.89Å; E366-R480 PolarHBondContact OE1-NH1 3.44Å; E366-R480 IonicContact OE1-NH2 2.74Å; E366-R480 PolarHBondContact OE1-NH2 2.88Å; E366-R480 WeakPolarHBondContact OE2-CD 3.49Å; E366-R480 IonicContact OE2-CZ 3.99Å; E366-R480 IonicContact OE2-NE 3.51Å; E366-R480 PolarHBondContact OE2-NE 3.47Å; E366-R480 IonicContact OE2-NH1 3.8Å; E366-R480 PolarHBondContact OE2-NH1 2.92Å; E366-R480 IonicContact OE2-NH2 2.82Å
367	V	90.1	Very high	85.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115.8	172.5	-178.4	0	0	0	0	108.6	I369 M388 Q411 G412 F414 V423 V425 V479	V367-I369 HydrophobicContact CG1-CG1 4.5Å; V367-M388 HydrophobicContact CB-SD 3.96Å; V367-M388 HydrophobicContact CG1-CB 4.35Å; V367-M388 HydrophobicContact CG1-CE 4.33Å; V367-M388 HydrophobicContact CG1-SD 4.08Å; V367-Q411 CarbonylContact O-C 3.57Å; V367-Q411 WeakPolarHBondContact O-CA 3.36Å; V367-G412 PolarHBondContact N-O 2.78Å; V367-G412 PolarHBondContact O-N 3.4Å; V367-F414 HydrophobicContact CB-CE2 4.04Å; V367-F414 HydrophobicContact CG2-CD2 4Å; V367-F414 HydrophobicContact CG2-CE2 3.78Å; V367-V423 HydrophobicContact CG2-CG1 4.01Å; V367-V425 HydrophobicContact CG1-CG2 4.4Å; V367-V479 HydrophobicContact CG1-CG2 4.47Å; V367-V479 HydrophobicContact CG2-CG1 4.21Å; V367-V479 HydrophobicContact CG2-CG2 4.39Å
368	V	89.9	Confident	85.7	Confident	37 Å²	37	40.7 Å²	40.7	22%	0.224	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.4	-179.5	-175.8	0	0	0	0	109.3	V370 Q411 L477 A478	V368-V370 HydrophobicContact CG1-CG2 4.42Å; V368-Q411 HydrophobicContact CG2-CB 4.07Å; V368-Q411 HydrophobicContact CG2-CG 3.99Å; V368-L477 CarbonylContact O-C 3.59Å; V368-L477 WeakPolarHBondContact O-CA 3.2Å; V368-L477 VanDerWaalsContact O-CB 3.31Å; V368-L477 WeakPolarHBondContact O-CB 3.35Å; V368-A478 PolarHBondContact N-O 3.46Å; V368-A478 PolarHBondContact O-N 3.1Å
369	I	90.8	Very high	85.9	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130	177	-61.7	175.3	0	0	0	108.8	V367 C386 M388 T398 W408 T410 V425 I475 L477	V367-I369 HydrophobicContact CG1-CG1 4.5Å; I369-C386 HydrophobicContact CD1-CB 3.67Å; I369-C386 HydrophobicContact CG2-CB 4.49Å; I369-M388 HydrophobicContact CD1-CE 3.81Å; I369-M388 HydrophobicContact CG1-CE 4.07Å; I369-T398 HydrophobicContact CB-CG2 4.37Å; I369-T398 HydrophobicContact CD1-CG2 3.85Å; I369-W408 HydrophobicContact CG2-CB 4.47Å; I369-W408 HydrophobicContact CG2-CD2 4.43Å; I369-W408 HydrophobicContact CG2-CE3 3.92Å; I369-W408 CarbonylContact O-C 3.58Å; I369-T410 PolarHBondContact N-O 3.09Å; I369-V425 HydrophobicContact CD1-CG1 3.5Å; I369-V425 VanDerWaalsContact CD1-CG1 3.5Å; I369-V425 HydrophobicContact CD1-CG2 4.37Å; I369-V425 HydrophobicContact CG1-CG1 4.4Å; I369-I475 HydrophobicContact CG2-CD1 4.11Å; I369-I475 HydrophobicContact CG2-CG1 4.47Å; I369-L477 HydrophobicContact CG1-CB 4.3Å
370	V	91.2	Very high	86	Confident	43 Å²	43	43.1 Å²	43.1	26%	0.261	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-51.6	-171.4	-175.5	0	0	0	0	112.3	V368 Q407 W408 A457 K476	V368-V370 HydrophobicContact CG1-CG2 4.42Å; V370-Q407 CarbonylContact O-C 3.54Å; V370-Q407 WeakPolarHBondContact O-CA 3.3Å; V370-W408 WeakPolarHBondContact CA-O 3.34Å; V370-W408 PolarHBondContact O-N 3Å; V370-W408 VanDerWaalsContact O-O 3.05Å; V370-A457 HydrophobicContact CG2-CB 3.75Å; V370-K476 HydrophobicContact CB-CB 4.28Å; V370-K476 HydrophobicContact CB-CD 4.17Å; V370-K476 HydrophobicContact CB-CG 4.22Å; V370-K476 HydrophobicContact CG1-CD 4.05Å; V370-K476 PolarHBondContact N-O 3.43Å
371	E	91.6	Very high	86.1	Confident	28 Å²	28	46.8 Å²	46.8	13%	0.131	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	162.7	179.2	57.7	179.6	-159.7	0	0	112.8	Q373 P406 Q407 F459 K476	E371-Q373 PolarHBondContact OE1-NE2 3.16Å; E371-P406 CarbonylContact C-O 3.57Å; E371-P406 VanDerWaalsContact CA-O 3.3Å; E371-P406 WeakPolarHBondContact CA-O 3.4Å; E371-Q407 HydrophobicContact CB-CB 4.38Å; E371-Q407 HydrophobicContact CB-CG 3.95Å; E371-Q407 PolarHBondContact OE2-NE2 3.41Å; E371-F459 HydrophobicContact CG-CE1 4.43Å; E371-F459 WeakPolarHBondContact OE1-CZ 3.25Å; E371-K476 HydrophobicContact CG-CB 3.7Å; E371-K476 HydrophobicContact CG-CD 3.96Å; E371-K476 PolarHBondContact N-O 2.83Å; E371-K476 PolarHBondContact O-N 3.42Å
372	V	90.9	Very high	86.2	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.055	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.7	167.4	163.5	0	0	0	0	109.9	L375 P406 W408 L427 L473 Q474 I475	V372-L375 HydrophobicContact CG1-CB 4.4Å; V372-P406 HydrophobicContact CB-CB 4.3Å; V372-P406 HydrophobicContact CB-CG 4.13Å; V372-P406 HydrophobicContact CG1-CG 4.48Å; V372-P406 PolarHBondContact N-O 3.15Å; V372-P406 WeakPolarHBondContact O-CG 3.47Å; V372-W408 HydrophobicContact CB-CZ3 4.15Å; V372-W408 HydrophobicContact CG2-CH2 4.37Å; V372-W408 HydrophobicContact CG2-CZ3 3.82Å; V372-L427 HydrophobicContact CG1-CD2 4.04Å; V372-L427 HydrophobicContact CG2-CD1 4.39Å; V372-L427 HydrophobicContact CG2-CD2 4.32Å; V372-L473 HydrophobicContact CG1-CD1 3.66Å; V372-L473 HydrophobicContact CG1-CG 4.39Å; V372-Q474 CarbonylContact C-O 3.59Å; V372-Q474 WeakPolarHBondContact CA-O 3.46Å; V372-I475 HydrophobicContact CG2-CB 3.94Å; V372-I475 HydrophobicContact CG2-CD1 4Å; V372-I475 HydrophobicContact CG2-CG1 3.76Å
373	Q	88.4	Confident	86.3	Confident	90 Å²	90	48.7 Å²	48.7	42%	0.421	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	154.1	174.3	-61.9	-167.9	11.5	0	0	110.6	E371 F459 Q474	E371-Q373 PolarHBondContact OE1-NE2 3.16Å; Q373-F459 HydrophobicContact CG-CE1 3.98Å; Q373-F459 VanDerWaalsContact NE2-CZ 3.33Å; Q373-Q474 PolarHBondContact N-O 3.16Å; Q373-Q474 PolarHBondContact O-N 2.62Å
374	G	82.8	Confident	86.5	Confident	31 Å²	31	48.6 Å²	48.6	32%	0.32	27%	0.265	S	S	.	.			trans	87.1	2.5	177.5	0	0	0	0	0	116.2
375	L	84.5	Confident	86.6	Confident	32 Å²	32	45.4 Å²	45.4	17%	0.168	25%	0.247	C	C	.	.			trans	-69.8	125.2	178.3	-176.1	65.1	0	0	0	112.1	V372 V378 V384 A403 L442 L473	V372-L375 HydrophobicContact CG1-CB 4.4Å; L375-V378 HydrophobicContact CD1-CG2 4.32Å; L375-V384 HydrophobicContact CD2-CG1 4.27Å; L375-A403 HydrophobicContact CD2-CB 4.07Å; L375-L442 HydrophobicContact CD1-CD1 3.95Å; L375-L473 HydrophobicContact CB-CD1 3.9Å; L375-L473 HydrophobicContact CD1-CD1 4.15Å
376	K	80.3	Confident	86.7	Confident	157 Å²	157	45.3 Å²	45.3	68%	0.683	25%	0.246	S	C	*	.			trans	-140.7	-23.7	-177.3	-62.9	175.4	-172.6	172.2	0	114	V378 D470	K376-V378 PolarHBondContact O-N 2.81Å; K376-V378 VanDerWaalsContact O-N 3.14Å; K376-D470 WeakPolarHBondContact CA-OD1 3.21Å; K376-D470 PolarHBondContact N-OD1 2.9Å
377	S	76.5	Confident	86.8	Confident	32 Å²	32	43.5 Å²	43.5	22%	0.224	24%	0.238	C	C	.	.	S	Bend	trans	-74.6	4.1	-176.4	73.9	0	0	0	0	115.5	S468 D470	S377-S468 PolarHBondContact OG-OG 3.2Å; S377-D470 WeakPolarHBondContact CB-OD2 3.36Å; S377-D470 PolarHBondContact N-OD1 3.46Å; S377-D470 PolarHBondContact OG-OD2 2.8Å
378	V	81.9	Confident	86.9	Confident	23 Å²	23	43.6 Å²	43.6	14%	0.139	24%	0.238	C	C	.	.	S	Bend	trans	-131.9	137.5	-172.7	175.3	0	0	0	0	109.2	L375 K376 R382 V384 A403 T429 L442	L375-V378 HydrophobicContact CD1-CG2 4.32Å; K376-V378 PolarHBondContact O-N 2.81Å; K376-V378 VanDerWaalsContact O-N 3.14Å; V378-R382 HydrophobicContact CG1-CB 3.44Å; V378-R382 VanDerWaalsContact CG1-CB 3.44Å; V378-R382 HydrophobicContact CG1-CG 3.85Å; V378-V384 HydrophobicContact CG1-CG1 4.49Å; V378-A403 HydrophobicContact CB-CB 4.42Å; V378-A403 HydrophobicContact CG1-CB 3.73Å; V378-T429 HydrophobicContact CG2-CG2 4.17Å; V378-L442 HydrophobicContact CG2-CD1 3.78Å; V378-L442 HydrophobicContact CG2-CD2 3.76Å; V378-L442 HydrophobicContact CG2-CG 4.44Å
379	A	79.4	Confident	86.9	Confident	48 Å²	48	44.5 Å²	44.5	40%	0.397	24%	0.24	S	C	.	.			trans	-67.4	143.6	-179.9	0	0	0	0	0	111.4	N381 R382	A379-N381 PolarHBondContact O-N 3.41Å; A379-R382 HydrophobicContact CB-CG 4.22Å; A379-R382 VanDerWaalsContact O-CB 3.31Å; A379-R382 WeakPolarHBondContact O-CB 3.31Å; A379-R382 PolarHBondContact O-N 3.36Å
380	P	80.3	Confident	86.7	Confident	88 Å²	88	44.7 Å²	44.7	57%	0.571	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.4	-170.7	-27.8	35.4	0	0	0	115.3	R382 S404	P380-R382 VanDerWaalsContact C-N 3.3Å; P380-R382 PolarHBondContact O-N 2.96Å; P380-S404 WeakPolarHBondContact O-CB 3.3Å; P380-S404 PolarHBondContact O-N 3.37Å
381	N	83.5	Confident	86.2	Confident	136 Å²	136	44.4 Å²	44.4	73%	0.727	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	13.4	-179.4	70.3	-39.8	0	0	0	114.3	A379	A379-N381 PolarHBondContact O-N 3.41Å
382	R	87.1	Confident	85	Confident	85 Å²	85	47 Å²	47	32%	0.321	27%	0.271	S	S	.	.	S	Bend	trans	-89.6	146.7	174.6	-76.8	-84.2	169.3	176.4	-12.8	110.9	V378 A379 P380 A403 E430 T432	V378-R382 HydrophobicContact CG1-CB 3.44Å; V378-R382 VanDerWaalsContact CG1-CB 3.44Å; V378-R382 HydrophobicContact CG1-CG 3.85Å; A379-R382 HydrophobicContact CB-CG 4.22Å; A379-R382 VanDerWaalsContact O-CB 3.31Å; A379-R382 WeakPolarHBondContact O-CB 3.31Å; A379-R382 PolarHBondContact O-N 3.36Å; P380-R382 VanDerWaalsContact C-N 3.3Å; P380-R382 PolarHBondContact O-N 2.96Å; R382-A403 HydrophobicContact CB-CB 4.39Å; R382-A403 WeakPolarHBondContact O-CB 3.46Å; R382-A403 PolarHBondContact O-N 3.43Å; R382-E430 PolarHBondContact NH1-O 2.84Å; R382-E430 VanDerWaalsContact NH1-O 3.12Å; R382-T432 VanDerWaalsContact CZ-OG1 3.3Å; R382-T432 PolarHBondContact NH1-OG1 3.14Å; R382-T432 PolarHBondContact NH2-OG1 3.4Å
383	I	87.7	Confident	84	Confident	52 Å²	52	48.3 Å²	48.3	27%	0.267	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	137.9	170.1	-70.9	168.6	0	0	0	110.2	Q400 A401 T429 E430	I383-Q400 HydrophobicContact CG2-CB 3.67Å; I383-Q400 HydrophobicContact CG2-CG 3.65Å; I383-A401 WeakPolarHBondContact CA-O 3.09Å; I383-T429 WeakPolarHBondContact O-CA 3.32Å; I383-T429 PolarHBondContact O-OG1 2.76Å; I383-E430 HydrophobicContact CB-CB 4.18Å; I383-E430 WeakPolarHBondContact CD1-OE2 3.19Å; I383-E430 HydrophobicContact CG2-CB 4.26Å; I383-E430 PolarHBondContact O-N 2.95Å; I383-E430 VanDerWaalsContact O-N 3.13Å
384	V	91.2	Very high	83.3	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151	170.6	-68.7	0	0	0	0	110.2	L375 V378 A401 A403 P406 W408 L427 F428 L442	L375-V384 HydrophobicContact CD2-CG1 4.27Å; V378-V384 HydrophobicContact CG1-CG1 4.49Å; V384-A401 WeakPolarHBondContact CG2-O 3.2Å; V384-A401 PolarHBondContact N-O 2.75Å; V384-A401 PolarHBondContact O-N 2.78Å; V384-A403 HydrophobicContact CG1-CB 4.18Å; V384-P406 HydrophobicContact CG2-CB 3.92Å; V384-W408 HydrophobicContact CG2-CH2 4.26Å; V384-W408 HydrophobicContact CG2-CZ2 4.16Å; V384-L427 HydrophobicContact CB-CD1 4.26Å; V384-F428 VanDerWaalsContact CA-O 3.23Å; V384-F428 WeakPolarHBondContact CA-O 3.48Å; V384-F428 WeakPolarHBondContact CB-O 3.31Å; V384-L442 HydrophobicContact CG1-CD1 4.1Å
385	Y	91.6	Very high	83.4	Confident	22 Å²	22	56 Å²	56	9%	0.086	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	155.9	174.7	61.9	-93.4	0	0	0	110.1	T387 Q397 F428 D439	Y385-T387 HydrophobicContact CD2-CG2 3.87Å; Y385-T387 HydrophobicContact CE2-CG2 3.68Å; Y385-Q397 HydrophobicContact CD2-CG 3.84Å; Y385-Q397 VanDerWaalsContact CD2-NE2 3.32Å; Y385-Q397 HydrophobicContact CE2-CG 4.32Å; Y385-Q397 HydrophobicContact CG-CG 4.5Å; Y385-F428 HydrophobicContact CD1-CB 4.47Å; Y385-F428 HydrophobicContact CD2-CB 4.21Å; Y385-F428 HydrophobicContact CE1-CB 4.03Å; Y385-F428 HydrophobicContact CE2-CB 3.74Å; Y385-F428 AromaticContact CE2-CD2 3.96Å; Y385-F428 HydrophobicContact CE2-CD2 3.96Å; Y385-F428 HydrophobicContact CE2-CG 4.06Å; Y385-F428 PolarHBondContact N-O 3.32Å; Y385-F428 VanDerWaalsContact N-O 3.13Å; Y385-F428 PolarHBondContact O-N 2.96Å; Y385-D439 VanDerWaalsContact CE1-OD2 3.27Å; Y385-D439 WeakPolarHBondContact CE1-OD2 3.22Å; Y385-D439 WeakPolarHBondContact OH-CB 3.5Å; Y385-D439 PolarHBondContact OH-OD2 2.88Å
386	C	92.3	Very high	83.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	152.7	171	-68.9	0	0	0	0	110.9	I369 T398 V425 K426	I369-C386 HydrophobicContact CD1-CB 3.67Å; I369-C386 HydrophobicContact CG2-CB 4.49Å; C386-T398 HydrophobicContact CB-CG2 3.75Å; C386-T398 PolarHBondContact N-OG1 3.34Å; C386-T398 PolarHBondContact O-N 2.62Å; C386-T398 PolarHBondContact O-OG1 2.88Å; C386-V425 HydrophobicContact CB-CG1 4.32Å; C386-K426 CarbonylContact C-O 3.54Å; C386-K426 VanDerWaalsContact CA-O 3.23Å; C386-K426 WeakPolarHBondContact CA-O 3.49Å
387	T	91.3	Very high	83.9	Confident	1 Å²	1	55 Å²	55	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.8	166.1	70.3	0	0	0	0	110	Y385 K395 L396 Q397 V425 K426 F428	Y385-T387 HydrophobicContact CD2-CG2 3.87Å; Y385-T387 HydrophobicContact CE2-CG2 3.68Å; T387-K395 WeakPolarHBondContact OG1-CE 3.29Å; T387-L396 CarbonylContact C-O 3.39Å; T387-L396 WeakPolarHBondContact CA-O 3.35Å; T387-Q397 HydrophobicContact CG2-CB 4.2Å; T387-Q397 HydrophobicContact CG2-CG 4.19Å; T387-V425 WeakPolarHBondContact O-CA 3.48Å; T387-K426 PolarHBondContact N-O 2.67Å; T387-K426 PolarHBondContact O-N 2.85Å; T387-F428 HydrophobicContact CG2-CD2 4.11Å; T387-F428 HydrophobicContact CG2-CE2 4.17Å
388	M	91.6	Very high	84.5	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	131	-178	45.2	168	99.4	0	0	109.8	V367 I369 L396 T398 F414 K424 V425	V367-M388 HydrophobicContact CB-SD 3.96Å; V367-M388 HydrophobicContact CG1-CB 4.35Å; V367-M388 HydrophobicContact CG1-CE 4.33Å; V367-M388 HydrophobicContact CG1-SD 4.08Å; I369-M388 HydrophobicContact CD1-CE 3.81Å; I369-M388 HydrophobicContact CG1-CE 4.07Å; M388-L396 HydrophobicContact CG-CB 3.89Å; M388-L396 PolarHBondContact N-O 3.2Å; M388-L396 PolarHBondContact O-N 3.48Å; M388-L396 HydrophobicContact SD-CB 4.21Å; M388-T398 HydrophobicContact CE-CG2 4.28Å; M388-F414 HydrophobicContact CB-CZ 4.18Å; M388-F414 HydrophobicContact CG-CE2 4.35Å; M388-F414 HydrophobicContact CG-CZ 3.85Å; M388-F414 HydrophobicContact SD-CE2 3.67Å; M388-F414 HydrophobicContact SD-CZ 3.71Å; M388-K424 WeakPolarHBondContact CA-O 3.44Å; M388-V425 HydrophobicContact CB-CG2 4.11Å
389	E	90	Very high	84.7	Confident	57 Å²	57	57.6 Å²	57.6	27%	0.266	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	114.7	-171.9	-176.8	-159.1	140.5	0	0	108.1	K424	E389-K424 HydrophobicContact CB-CB 4.36Å; E389-K424 PolarHBondContact N-O 2.97Å; E389-K424 PolarHBondContact O-N 2.92Å; E389-K424 IonicContact OE1-NZ 2.76Å; E389-K424 PolarHBondContact OE1-NZ 2.89Å
390	V	87.8	Confident	85.1	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.018	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.3	173.8	-178.2	0	0	0	0	108.9	G392 G393 F414 P421 V423	V390-G392 PolarHBondContact O-N 2.96Å; V390-G392 VanDerWaalsContact O-N 3.12Å; V390-G393 PolarHBondContact O-N 2.8Å; V390-F414 HydrophobicContact CB-CB 4.15Å; V390-F414 HydrophobicContact CB-CD1 3.87Å; V390-F414 HydrophobicContact CB-CE1 4.39Å; V390-F414 HydrophobicContact CB-CG 3.96Å; V390-F414 HydrophobicContact CG1-CB 4.48Å; V390-F414 HydrophobicContact CG2-CB 3.84Å; V390-F414 HydrophobicContact CG2-CD1 3.6Å; V390-F414 HydrophobicContact CG2-CD2 3.51Å; V390-F414 HydrophobicContact CG2-CE1 3.94Å; V390-F414 HydrophobicContact CG2-CE2 3.86Å; V390-F414 HydrophobicContact CG2-CG 3.36Å; V390-F414 HydrophobicContact CG2-CZ 4.06Å; V390-P421 HydrophobicContact CG1-CB 4.32Å; V390-V423 HydrophobicContact CG1-CG2 4.5Å; V390-V423 HydrophobicContact CG2-CG1 4.3Å; V390-V423 HydrophobicContact CG2-CG2 4.11Å
391	E	79.6	Confident	85.5	Confident	37 Å²	37	57 Å²	57	17%	0.173	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	116.2	-179.1	-170.3	162.8	-130.8	0	0	112.8	T416 L422 R527	E391-T416 PolarHBondContact O-OG1 2.99Å; E391-L422 HydrophobicContact CB-CB 4.18Å; E391-L422 PolarHBondContact N-O 2.71Å; E391-L422 PolarHBondContact OE2-N 3.5Å; E391-R527 WeakPolarHBondContact OE1-CB 3.27Å; E391-R527 VanDerWaalsContact OE1-CD 3.22Å; E391-R527 WeakPolarHBondContact OE1-CD 3.32Å; E391-R527 WeakPolarHBondContact OE1-CG 3.36Å; E391-R527 IonicContact OE1-NE 2.65Å; E391-R527 WeakPolarHBondContact OE2-CA 3.1Å; E391-R527 WeakPolarHBondContact OE2-CB 3.24Å; E391-R527 VanDerWaalsContact OE2-CG 3.29Å; E391-R527 WeakPolarHBondContact OE2-CG 3.28Å
392	G	66	Low	85.7	Confident	82 Å²	82	56 Å²	56	85%	0.845	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-8.1	-176.7	0	0	0	0	0	115.6	V390	V390-G392 PolarHBondContact O-N 2.96Å; V390-G392 VanDerWaalsContact O-N 3.12Å
393	G	70.7	Confident	85.6	Confident	38 Å²	38	52.6 Å²	52.6	39%	0.392	29%	0.287	S	S	.	.	S	Bend	trans	-101.7	177.7	-179.8	0	0	0	0	0	114.5	V390	V390-G393 PolarHBondContact O-N 2.8Å
394	E	74	Confident	85.3	Confident	162 Å²	162	53.2 Å²	53.2	76%	0.757	30%	0.296	S	S	*	.			trans	-70.4	164	171.4	-61.6	-171.5	163	0	0	111.7	F414	E394-F414 WeakPolarHBondContact O-CE1 3.34Å
395	K	84.4	Confident	85.1	Confident	119 Å²	119	61.7 Å²	61.7	52%	0.517	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	109.5	178.9	180	-169.5	171.9	-162.8	0	109.5	T387	T387-K395 WeakPolarHBondContact OG1-CE 3.29Å
396	L	87.4	Confident	84.7	Confident	65 Å²	65	61.3 Å²	61.3	34%	0.34	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	153.2	175.3	-58.5	177.9	0	0	0	111	T387 M388 F414	T387-L396 CarbonylContact C-O 3.39Å; T387-L396 WeakPolarHBondContact CA-O 3.35Å; M388-L396 HydrophobicContact CG-CB 3.89Å; M388-L396 PolarHBondContact N-O 3.2Å; M388-L396 PolarHBondContact O-N 3.48Å; M388-L396 HydrophobicContact SD-CB 4.21Å; L396-F414 HydrophobicContact CB-CE1 4.48Å; L396-F414 HydrophobicContact CB-CZ 4.13Å; L396-F414 HydrophobicContact CD1-CE1 3.93Å; L396-F414 HydrophobicContact CD1-CE2 4.24Å; L396-F414 HydrophobicContact CD1-CZ 3.72Å; L396-F414 HydrophobicContact CG-CE1 3.95Å; L396-F414 HydrophobicContact CG-CZ 3.97Å
397	Q	87.5	Confident	84.5	Confident	103 Å²	103	65.3 Å²	65.3	48%	0.481	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.6	-177.3	173.7	166.6	-15.8	0	0	109.6	Y385 T387	Y385-Q397 HydrophobicContact CD2-CG 3.84Å; Y385-Q397 VanDerWaalsContact CD2-NE2 3.32Å; Y385-Q397 HydrophobicContact CE2-CG 4.32Å; Y385-Q397 HydrophobicContact CG-CG 4.5Å; T387-Q397 HydrophobicContact CG2-CB 4.2Å; T387-Q397 HydrophobicContact CG2-CG 4.19Å
398	T	89.4	Confident	84.4	Confident	6 Å²	6	66.3 Å²	66.3	4%	0.037	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-80.5	163.3	173.4	68.8	0	0	0	0	111.2	I369 C386 M388 W408	I369-T398 HydrophobicContact CB-CG2 4.37Å; I369-T398 HydrophobicContact CD1-CG2 3.85Å; C386-T398 HydrophobicContact CB-CG2 3.75Å; C386-T398 PolarHBondContact N-OG1 3.34Å; C386-T398 PolarHBondContact O-N 2.62Å; C386-T398 PolarHBondContact O-OG1 2.88Å; M388-T398 HydrophobicContact CE-CG2 4.28Å; T398-W408 PolarHBondContact OG1-NE1 2.78Å
399	D	86.9	Confident	83.9	Confident	105 Å²	105	71.5 Å²	71.5	56%	0.561	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-54.2	156.3	169	-51.3	-84.2	0	0	0	112.1	W408 T410	D399-W408 PolarHBondContact O-NE1 2.98Å; D399-T410 PolarHBondContact OD2-OG1 3.37Å
400	Q	88	Confident	83.7	Confident	108 Å²	108	70 Å²	70	51%	0.505	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-74.5	129.5	174.6	-73.4	-172.7	-27.7	0	0	110.3	I383 E430	I383-Q400 HydrophobicContact CG2-CB 3.67Å; I383-Q400 HydrophobicContact CG2-CG 3.65Å; Q400-E430 PolarHBondContact NE2-OE1 3.38Å
401	A	87.9	Confident	83.6	Confident	14 Å²	14	74.4 Å²	74.4	12%	0.116	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	155.8	176.8	0	0	0	0	0	111.2	I383 V384 W408	I383-A401 WeakPolarHBondContact CA-O 3.09Å; V384-A401 WeakPolarHBondContact CG2-O 3.2Å; V384-A401 PolarHBondContact N-O 2.75Å; V384-A401 PolarHBondContact O-N 2.78Å; A401-W408 HydrophobicContact CB-CZ2 3.92Å
402	E	87.9	Confident	84.1	Confident	115 Å²	115	72.8 Å²	72.8	54%	0.537	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	141.8	172.3	-70.5	-171.3	-173.2	0	0	111.6	S404 R405	E402-S404 VanDerWaalsContact CB-OG 3.23Å; E402-S404 WeakPolarHBondContact CB-OG 3.49Å; E402-S404 PolarHBondContact O-N 2.79Å; E402-S404 VanDerWaalsContact O-N 3.17Å; E402-S404 PolarHBondContact OE2-OG 2.91Å; E402-R405 CarbonylContact O-C 3.59Å; E402-R405 PolarHBondContact O-N 2.99Å
403	A	84.7	Confident	85.1	Confident	14 Å²	14	73.8 Å²	73.8	12%	0.116	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.4	170.1	0	0	0	0	0	113	L375 V378 R382 V384 R405	L375-A403 HydrophobicContact CD2-CB 4.07Å; V378-A403 HydrophobicContact CB-CB 4.42Å; V378-A403 HydrophobicContact CG1-CB 3.73Å; R382-A403 HydrophobicContact CB-CB 4.39Å; R382-A403 WeakPolarHBondContact O-CB 3.46Å; R382-A403 PolarHBondContact O-N 3.43Å; V384-A403 HydrophobicContact CG1-CB 4.18Å; A403-R405 VanDerWaalsContact C-N 3.27Å; A403-R405 PolarHBondContact O-N 3.34Å
404	S	82.1	Confident	86	Confident	66 Å²	66	72.8 Å²	72.8	46%	0.462	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.6	169.6	72.4	0	0	0	0	112.9	P380 E402	P380-S404 WeakPolarHBondContact O-CB 3.3Å; P380-S404 PolarHBondContact O-N 3.37Å; E402-S404 VanDerWaalsContact CB-OG 3.23Å; E402-S404 WeakPolarHBondContact CB-OG 3.49Å; E402-S404 PolarHBondContact O-N 2.79Å; E402-S404 VanDerWaalsContact O-N 3.17Å; E402-S404 PolarHBondContact OE2-OG 2.91Å
405	R	85.3	Confident	86.6	Confident	177 Å²	177	68.2 Å²	68.2	67%	0.668	35%	0.352	S	S	*	.	S	Bend	trans	-156.8	69.8	-173	-167.6	173.6	-179.5	159.8	1.5	111.2	E402 A403 Q407	E402-R405 CarbonylContact O-C 3.59Å; E402-R405 PolarHBondContact O-N 2.99Å; A403-R405 VanDerWaalsContact C-N 3.27Å; A403-R405 PolarHBondContact O-N 3.34Å; R405-Q407 VanDerWaalsContact C-N 3.31Å; R405-Q407 HydrophobicContact CG-CG 4.1Å; R405-Q407 PolarHBondContact O-N 2.91Å
406	P	84.4	Confident	86.8	Confident	14 Å²	14	63.1 Å²	63.1	9%	0.091	33%	0.331	C	S	.	.			trans	-76	80.4	-176.1	31.8	-36.1	0	0	0	111.2	E371 V372 V384 W408	E371-P406 CarbonylContact C-O 3.57Å; E371-P406 VanDerWaalsContact CA-O 3.3Å; E371-P406 WeakPolarHBondContact CA-O 3.4Å; V372-P406 HydrophobicContact CB-CB 4.3Å; V372-P406 HydrophobicContact CB-CG 4.13Å; V372-P406 HydrophobicContact CG1-CG 4.48Å; V372-P406 PolarHBondContact N-O 3.15Å; V372-P406 WeakPolarHBondContact O-CG 3.47Å; V384-P406 HydrophobicContact CG2-CB 3.92Å; P406-W408 HydrophobicContact CB-CH2 3.65Å; P406-W408 HydrophobicContact CB-CZ2 4.4Å; P406-W408 HydrophobicContact CB-CZ3 3.91Å; P406-W408 WeakPolarHBondContact O-CZ3 3.47Å
407	Q	86.6	Confident	86.8	Confident	85 Å²	85	62.7 Å²	62.7	40%	0.397	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-121.5	140.4	177.8	-56.1	-169.9	-69.2	0	0	109.4	V370 E371 R405	V370-Q407 CarbonylContact O-C 3.54Å; V370-Q407 WeakPolarHBondContact O-CA 3.3Å; E371-Q407 HydrophobicContact CB-CB 4.38Å; E371-Q407 HydrophobicContact CB-CG 3.95Å; E371-Q407 PolarHBondContact OE2-NE2 3.41Å; R405-Q407 VanDerWaalsContact C-N 3.31Å; R405-Q407 HydrophobicContact CG-CG 4.1Å; R405-Q407 PolarHBondContact O-N 2.91Å
408	W	89.6	Confident	86.8	Confident	21 Å²	21	59.3 Å²	59.3	8%	0.08	32%	0.316	C	S	.	.			trans	-135.7	164.3	-176.9	-65	-82	0	0	0	110.5	I369 V370 V372 V384 T398 D399 A401 P406 L427	I369-W408 HydrophobicContact CG2-CB 4.47Å; I369-W408 HydrophobicContact CG2-CD2 4.43Å; I369-W408 HydrophobicContact CG2-CE3 3.92Å; I369-W408 CarbonylContact O-C 3.58Å; V370-W408 WeakPolarHBondContact CA-O 3.34Å; V370-W408 PolarHBondContact O-N 3Å; V370-W408 VanDerWaalsContact O-O 3.05Å; V372-W408 HydrophobicContact CB-CZ3 4.15Å; V372-W408 HydrophobicContact CG2-CH2 4.37Å; V372-W408 HydrophobicContact CG2-CZ3 3.82Å; V384-W408 HydrophobicContact CG2-CH2 4.26Å; V384-W408 HydrophobicContact CG2-CZ2 4.16Å; T398-W408 PolarHBondContact OG1-NE1 2.78Å; D399-W408 PolarHBondContact O-NE1 2.98Å; A401-W408 HydrophobicContact CB-CZ2 3.92Å; P406-W408 HydrophobicContact CB-CH2 3.65Å; P406-W408 HydrophobicContact CB-CZ2 4.4Å; P406-W408 HydrophobicContact CB-CZ3 3.91Å; P406-W408 WeakPolarHBondContact O-CZ3 3.47Å; W408-L427 HydrophobicContact CH2-CD1 3.77Å; W408-L427 HydrophobicContact CZ2-CD1 4.46Å
409	S	81.6	Confident	86.6	Confident	110 Å²	110	59.1 Å²	59.1	77%	0.769	32%	0.315	S	S	*	.			trans	-134.8	23	166.3	65.7	0	0	0	0	111.7	Q411	S409-Q411 PolarHBondContact O-N 2.66Å
410	T	85.6	Confident	86.6	Confident	27 Å²	27	54.3 Å²	54.3	17%	0.166	29%	0.289	C	S	.	.			trans	-76.9	121	-176.5	-32	0	0	0	0	109.9	I369 D399	I369-T410 PolarHBondContact N-O 3.09Å; D399-T410 PolarHBondContact OD2-OG1 3.37Å
411	Q	86.9	Confident	86.7	Confident	94 Å²	94	49.2 Å²	49.2	44%	0.439	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	136.2	167.1	176.6	170.9	-23.8	0	0	109	V367 V368 S409 D413	V367-Q411 CarbonylContact O-C 3.57Å; V367-Q411 WeakPolarHBondContact O-CA 3.36Å; V368-Q411 HydrophobicContact CG2-CB 4.07Å; V368-Q411 HydrophobicContact CG2-CG 3.99Å; S409-Q411 PolarHBondContact O-N 2.66Å; Q411-D413 WeakPolarHBondContact CG-OD1 3.08Å; Q411-D413 PolarHBondContact NE2-OD1 3.19Å
412	G	88	Confident	86.7	Confident	3 Å²	3	49.1 Å²	49.1	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.8	167.3	0	0	0	0	0	110.3	V367 F414	V367-G412 PolarHBondContact N-O 2.78Å; V367-G412 PolarHBondContact O-N 3.4Å; G412-F414 WeakPolarHBondContact O-CD2 3.44Å; G412-F414 WeakPolarHBondContact O-CE2 3.13Å
413	D	88.6	Confident	86.8	Confident	103 Å²	103	43.7 Å²	43.7	55%	0.551	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.2	-179.4	-60.9	-35.1	0	0	0	110.1	L365 Q411	L365-D413 WeakPolarHBondContact O-CA 3.2Å; Q411-D413 WeakPolarHBondContact CG-OD1 3.08Å; Q411-D413 PolarHBondContact NE2-OD1 3.19Å
414	F	89.4	Confident	87.1	Confident	17 Å²	17	45.9 Å²	45.9	8%	0.075	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	152.6	-175.5	-56.1	-93.4	0	0	0	110.4	N364 L365 V367 M388 V390 E394 L396 G412	N364-F414 CarbonylContact C-O 3.57Å; N364-F414 WeakPolarHBondContact CA-O 3.36Å; L365-F414 HydrophobicContact CB-CB 4.47Å; L365-F414 PolarHBondContact N-O 2.61Å; L365-F414 PolarHBondContact O-N 3.06Å; V367-F414 HydrophobicContact CB-CE2 4.04Å; V367-F414 HydrophobicContact CG2-CD2 4Å; V367-F414 HydrophobicContact CG2-CE2 3.78Å; M388-F414 HydrophobicContact CB-CZ 4.18Å; M388-F414 HydrophobicContact CG-CE2 4.35Å; M388-F414 HydrophobicContact CG-CZ 3.85Å; M388-F414 HydrophobicContact SD-CE2 3.67Å; M388-F414 HydrophobicContact SD-CZ 3.71Å; V390-F414 HydrophobicContact CB-CB 4.15Å; V390-F414 HydrophobicContact CB-CD1 3.87Å; V390-F414 HydrophobicContact CB-CE1 4.39Å; V390-F414 HydrophobicContact CB-CG 3.96Å; V390-F414 HydrophobicContact CG1-CB 4.48Å; V390-F414 HydrophobicContact CG2-CB 3.84Å; V390-F414 HydrophobicContact CG2-CD1 3.6Å; V390-F414 HydrophobicContact CG2-CD2 3.51Å; V390-F414 HydrophobicContact CG2-CE1 3.94Å; V390-F414 HydrophobicContact CG2-CE2 3.86Å; V390-F414 HydrophobicContact CG2-CG 3.36Å; V390-F414 HydrophobicContact CG2-CZ 4.06Å; E394-F414 WeakPolarHBondContact O-CE1 3.34Å; L396-F414 HydrophobicContact CB-CE1 4.48Å; L396-F414 HydrophobicContact CB-CZ 4.13Å; L396-F414 HydrophobicContact CD1-CE1 3.93Å; L396-F414 HydrophobicContact CD1-CE2 4.24Å; L396-F414 HydrophobicContact CD1-CZ 3.72Å; L396-F414 HydrophobicContact CG-CE1 3.95Å; L396-F414 HydrophobicContact CG-CZ 3.97Å; G412-F414 WeakPolarHBondContact O-CD2 3.44Å; G412-F414 WeakPolarHBondContact O-CE2 3.13Å
415	S	86.4	Confident	87.6	Confident	66 Å²	66	42.8 Å²	42.8	46%	0.462	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.1	168.3	-157.3	0	0	0	0	109.7	T362 F363 N364	T362-S415 VanDerWaalsContact CG2-OG 3.24Å; T362-S415 WeakPolarHBondContact CG2-OG 2.95Å; F363-S415 WeakPolarHBondContact O-CA 3.45Å; F363-S415 PolarHBondContact O-OG 2.91Å; N364-S415 PolarHBondContact OD1-OG 3.24Å
416	T	88.1	Confident	88	Confident	12 Å²	12	37 Å²	37	7%	0.074	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.5	-177.4	-170.9	0	0	0	0	111.1	F363 L365 E391 H418 P421	F363-T416 HydrophobicContact CB-CG2 4.32Å; F363-T416 PolarHBondContact N-O 3.25Å; F363-T416 PolarHBondContact O-N 2.93Å; L365-T416 HydrophobicContact CD1-CG2 3.49Å; L365-T416 VanDerWaalsContact CD1-CG2 3.49Å; E391-T416 PolarHBondContact O-OG1 2.99Å; T416-H418 PolarHBondContact OG1-N 3.5Å; T416-P421 HydrophobicContact CG2-CB 3.97Å; T416-P421 HydrophobicContact CG2-CG 4.15Å
417	T	87.2	Confident	88.3	Confident	56 Å²	56	36.4 Å²	36.4	34%	0.344	20%	0.198	S	C	.	.	S	Bend	trans	-95.7	6	174.2	54.8	0	0	0	0	113.1	V360 L361 P419 A529	V360-T417 HydrophobicContact CG1-CG2 4.16Å; L361-T417 CarbonylContact O-C 3.59Å; L361-T417 VanDerWaalsContact O-CA 3.31Å; L361-T417 WeakPolarHBondContact O-CA 3.36Å; T417-P419 WeakPolarHBondContact O-CD 3.44Å; T417-A529 WeakPolarHBondContact O-CA 3.43Å; T417-A529 VanDerWaalsContact O-CB 3.3Å; T417-A529 WeakPolarHBondContact O-CB 3.41Å
418	H	87.4	Confident	88.5	Confident	33 Å²	33	33.4 Å²	33.4	15%	0.153	18%	0.184	C	C	.	.			trans	-95.1	118.6	-179.4	-60	-32	0	0	0	111.3	T416 L420 P421 A529	T416-H418 PolarHBondContact OG1-N 3.5Å; H418-L420 PolarHBondContact O-N 3.13Å; H418-P421 HydrophobicContact CB-CB 4.12Å; H418-P421 WeakPolarHBondContact O-CD 3.34Å; H418-A529 PolarHBondContact ND1-N 2.97Å; H418-A529 VanDerWaalsContact ND1-N 3.14Å
419	P	85.4	Confident	88.4	Confident	2 Å²	2	33 Å²	33	1%	0.013	18%	0.184	C	C	.	.	S	Bend	trans	-68.9	-14.6	175.8	-21.5	33.7	0	0	0	115.1	F363 T417 L510 Y524 K528	F363-P419 HydrophobicContact CE2-CB 3.91Å; F363-P419 HydrophobicContact CE2-CG 3.7Å; F363-P419 HydrophobicContact CZ-CB 3.76Å; F363-P419 HydrophobicContact CZ-CG 3.87Å; T417-P419 WeakPolarHBondContact O-CD 3.44Å; P419-L510 HydrophobicContact CB-CD1 4.07Å; P419-L510 HydrophobicContact CB-CD2 3.87Å; P419-L510 HydrophobicContact CG-CD2 4.11Å; P419-Y524 HydrophobicContact CB-CG 4.48Å; P419-Y524 HydrophobicContact CG-CD1 3.68Å; P419-Y524 HydrophobicContact CG-CE1 3.75Å; P419-Y524 HydrophobicContact CG-CG 4.08Å; P419-K528 WeakPolarHBondContact CD-O 3.46Å
420	L	87.8	Confident	88.5	Confident	4 Å²	4	31 Å²	31	2%	0.021	16%	0.162	C	C	.	.	S	Bend	trans	-133.8	75.9	171.2	-70.8	176.9	0	0	0	108.1	H418 I448 T450 Y508 E526 R527	H418-L420 PolarHBondContact O-N 3.13Å; L420-I448 HydrophobicContact CB-CG2 4.22Å; L420-I448 HydrophobicContact CD2-CG2 3.96Å; L420-T450 HydrophobicContact CD2-CG2 3.94Å; L420-Y508 HydrophobicContact CD1-CD1 3.7Å; L420-Y508 HydrophobicContact CD1-CE1 4.49Å; L420-Y508 HydrophobicContact CD1-CG 3.86Å; L420-Y508 HydrophobicContact CD2-CD1 3.7Å; L420-Y508 HydrophobicContact CD2-CD2 4.46Å; L420-Y508 HydrophobicContact CD2-CE1 3.67Å; L420-Y508 HydrophobicContact CD2-CE2 4.46Å; L420-Y508 HydrophobicContact CD2-CG 4.1Å; L420-Y508 HydrophobicContact CG-CD1 3.57Å; L420-Y508 HydrophobicContact CG-CE1 3.9Å; L420-Y508 HydrophobicContact CG-CG 4.16Å; L420-E526 HydrophobicContact CD1-CG 4.43Å; L420-R527 PolarHBondContact O-N 2.91Å
421	P	88.9	Confident	88	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.006	17%	0.168	C	C	.	.			trans	-78.2	153.1	-178.8	33.3	-31.8	0	0	0	110.2	L365 V390 T416 H418 P449 M481	L365-P421 HydrophobicContact CD1-CG 4.47Å; L365-P421 HydrophobicContact CD2-CG 3.88Å; V390-P421 HydrophobicContact CG1-CB 4.32Å; T416-P421 HydrophobicContact CG2-CB 3.97Å; T416-P421 HydrophobicContact CG2-CG 4.15Å; H418-P421 HydrophobicContact CB-CB 4.12Å; H418-P421 WeakPolarHBondContact O-CD 3.34Å; P421-P449 HydrophobicContact CG-CG 3.95Å; P421-P449 WeakPolarHBondContact O-CD 3.48Å; P421-M481 HydrophobicContact CG-CE 4.19Å; P421-M481 HydrophobicContact CG-SD 4.41Å
422	L	89	Confident	86.9	Confident	12 Å²	12	31.9 Å²	31.9	6%	0.063	18%	0.176	C	C	.	.			trans	-93.7	114.8	171.1	-160.3	86.7	0	0	0	110.5	E391 K424 V446 I448	E391-L422 HydrophobicContact CB-CB 4.18Å; E391-L422 PolarHBondContact N-O 2.71Å; E391-L422 PolarHBondContact OE2-N 3.5Å; L422-K424 HydrophobicContact CD2-CD 4.45Å; L422-K424 HydrophobicContact CD2-CG 4.12Å; L422-V446 HydrophobicContact CD1-CG1 3.52Å; L422-V446 HydrophobicContact CD2-CG1 3.79Å; L422-V446 HydrophobicContact CG-CG1 3.57Å; L422-I448 HydrophobicContact CD1-CG1 4.05Å
423	V	89.9	Confident	85.8	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.7	174.2	-176.4	0	0	0	0	109	L365 V367 V390 V446 L447 P449 V479	L365-V423 HydrophobicContact CD2-CG2 4.03Å; V367-V423 HydrophobicContact CG2-CG1 4.01Å; V390-V423 HydrophobicContact CG1-CG2 4.5Å; V390-V423 HydrophobicContact CG2-CG1 4.3Å; V390-V423 HydrophobicContact CG2-CG2 4.11Å; V423-V446 CarbonylContact O-C 3.55Å; V423-V446 WeakPolarHBondContact O-CA 3.46Å; V423-L447 PolarHBondContact N-O 3.01Å; V423-L447 PolarHBondContact O-N 2.83Å; V423-P449 HydrophobicContact CG2-CG 3.8Å; V423-V479 HydrophobicContact CG1-CG2 4.46Å; V423-V479 HydrophobicContact CG2-CG1 4.32Å
424	K	91.4	Very high	84.2	Confident	60 Å²	60	36.1 Å²	36.1	26%	0.261	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.6	177.1	-50.6	168.5	-160.6	157.3	0	108.6	M388 E389 L422 V446	M388-K424 WeakPolarHBondContact CA-O 3.44Å; E389-K424 HydrophobicContact CB-CB 4.36Å; E389-K424 PolarHBondContact N-O 2.97Å; E389-K424 PolarHBondContact O-N 2.92Å; E389-K424 IonicContact OE1-NZ 2.76Å; E389-K424 PolarHBondContact OE1-NZ 2.89Å; L422-K424 HydrophobicContact CD2-CD 4.45Å; L422-K424 HydrophobicContact CD2-CG 4.12Å; K424-V446 HydrophobicContact CG-CG2 4.39Å
425	V	92	Very high	82.7	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.6	168.8	179.8	0	0	0	0	108.9	V367 I369 C386 T387 M388 R444 V445 I475 L477	V367-V425 HydrophobicContact CG1-CG2 4.4Å; I369-V425 HydrophobicContact CD1-CG1 3.5Å; I369-V425 VanDerWaalsContact CD1-CG1 3.5Å; I369-V425 HydrophobicContact CD1-CG2 4.37Å; I369-V425 HydrophobicContact CG1-CG1 4.4Å; C386-V425 HydrophobicContact CB-CG1 4.32Å; T387-V425 WeakPolarHBondContact O-CA 3.48Å; M388-V425 HydrophobicContact CB-CG2 4.11Å; V425-R444 CarbonylContact O-C 3.54Å; V425-R444 VanDerWaalsContact O-CA 3.31Å; V425-R444 WeakPolarHBondContact O-CA 3.41Å; V425-V445 HydrophobicContact CB-CG1 3.76Å; V425-V445 PolarHBondContact N-O 3.49Å; V425-V445 PolarHBondContact O-N 3.17Å; V425-I475 HydrophobicContact CG1-CD1 3.78Å; V425-L477 HydrophobicContact CB-CD2 4.38Å; V425-L477 HydrophobicContact CG2-CD2 4.19Å
426	K	92.7	Very high	81.4	Confident	56 Å²	56	42.5 Å²	42.5	24%	0.243	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.1	-179.2	-66.9	-175.2	171.2	-156.8	0	110.4	C386 T387 F428 E441 R444	C386-K426 CarbonylContact C-O 3.54Å; C386-K426 VanDerWaalsContact CA-O 3.23Å; C386-K426 WeakPolarHBondContact CA-O 3.49Å; T387-K426 PolarHBondContact N-O 2.67Å; T387-K426 PolarHBondContact O-N 2.85Å; K426-F428 HydrophobicContact CB-CD2 4.15Å; K426-F428 HydrophobicContact CB-CE2 3.51Å; K426-F428 HydrophobicContact CB-CZ 4.19Å; K426-F428 HydrophobicContact CD-CE2 3.85Å; K426-F428 HydrophobicContact CD-CZ 3.78Å; K426-F428 HydrophobicContact CG-CE2 4.37Å; K426-E441 WeakPolarHBondContact CD-OE2 3.36Å; K426-E441 WeakPolarHBondContact CE-OE2 3.42Å; K426-E441 IonicContact NZ-OE2 3.05Å; K426-E441 PolarHBondContact NZ-OE2 3.3Å; K426-R444 HydrophobicContact CG-CB 3.99Å
427	L	91.1	Very high	80.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.1	171.9	178.8	70.9	0	0	0	109.7	V372 V384 W408 L442 G443 M462 L473	V372-L427 HydrophobicContact CG1-CD2 4.04Å; V372-L427 HydrophobicContact CG2-CD1 4.39Å; V372-L427 HydrophobicContact CG2-CD2 4.32Å; V384-L427 HydrophobicContact CB-CD1 4.26Å; W408-L427 HydrophobicContact CH2-CD1 3.77Å; W408-L427 HydrophobicContact CZ2-CD1 4.46Å; L427-L442 HydrophobicContact CD2-CB 4.08Å; L427-L442 HydrophobicContact CD2-CD1 4.02Å; L427-L442 HydrophobicContact CG-CB 4.21Å; L427-L442 HydrophobicContact CG-CD1 4.1Å; L427-L442 PolarHBondContact O-N 3.36Å; L427-G443 PolarHBondContact N-O 2.85Å; L427-M462 HydrophobicContact CB-CE 3.94Å; L427-M462 HydrophobicContact CB-SD 4.36Å; L427-L473 HydrophobicContact CD2-CD1 4.49Å; L427-L473 HydrophobicContact CD2-CD2 4.13Å
428	F	90.4	Very high	79.5	Confident	22 Å²	22	55.8 Å²	55.8	10%	0.096	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	159.8	178.4	-71	-88.6	0	0	0	111.6	V384 Y385 T387 K426 D439 K440 E441	V384-F428 VanDerWaalsContact CA-O 3.23Å; V384-F428 WeakPolarHBondContact CA-O 3.48Å; V384-F428 WeakPolarHBondContact CB-O 3.31Å; Y385-F428 HydrophobicContact CD1-CB 4.47Å; Y385-F428 HydrophobicContact CD2-CB 4.21Å; Y385-F428 HydrophobicContact CE1-CB 4.03Å; Y385-F428 HydrophobicContact CE2-CB 3.74Å; Y385-F428 AromaticContact CE2-CD2 3.96Å; Y385-F428 HydrophobicContact CE2-CD2 3.96Å; Y385-F428 HydrophobicContact CE2-CG 4.06Å; Y385-F428 PolarHBondContact N-O 3.32Å; Y385-F428 VanDerWaalsContact N-O 3.13Å; Y385-F428 PolarHBondContact O-N 2.96Å; T387-F428 HydrophobicContact CG2-CD2 4.11Å; T387-F428 HydrophobicContact CG2-CE2 4.17Å; K426-F428 HydrophobicContact CB-CD2 4.15Å; K426-F428 HydrophobicContact CB-CE2 3.51Å; K426-F428 HydrophobicContact CB-CZ 4.19Å; K426-F428 HydrophobicContact CD-CE2 3.85Å; K426-F428 HydrophobicContact CD-CZ 3.78Å; K426-F428 HydrophobicContact CG-CE2 4.37Å; F428-D439 HydrophobicContact CB-CB 4.4Å; F428-D439 HydrophobicContact CD1-CB 4.08Å; F428-D439 WeakPolarHBondContact CD1-O 3.5Å; F428-K440 WeakPolarHBondContact CA-O 3.29Å; F428-E441 HydrophobicContact CD1-CB 4.21Å; F428-E441 HydrophobicContact CE1-CB 3.8Å; F428-E441 HydrophobicContact CE1-CG 4.49Å; F428-E441 HydrophobicContact CZ-CB 4.33Å
429	T	89.1	Confident	79.3	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.08	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.8	163.5	-173.6	0	0	0	0	111.1	V378 I383 K440 L442	V378-T429 HydrophobicContact CG2-CG2 4.17Å; I383-T429 WeakPolarHBondContact O-CA 3.32Å; I383-T429 PolarHBondContact O-OG1 2.76Å; T429-K440 HydrophobicContact CG2-CB 4.07Å; T429-K440 HydrophobicContact CG2-CD 4.45Å; T429-K440 PolarHBondContact N-O 2.83Å; T429-K440 PolarHBondContact O-N 2.84Å; T429-L442 HydrophobicContact CG2-CD1 4.18Å; T429-L442 HydrophobicContact CG2-CD2 3.87Å; T429-L442 HydrophobicContact CG2-CG 4.19Å
430	E	82.9	Confident	79.3	Confident	67 Å²	67	61.7 Å²	61.7	31%	0.313	34%	0.337	S	S	.	.			trans	-70.5	128.6	-173.4	-169.5	178.8	-126.5	0	0	112.7	R382 I383 Q400 T432 D439	R382-E430 PolarHBondContact NH1-O 2.84Å; R382-E430 VanDerWaalsContact NH1-O 3.12Å; I383-E430 HydrophobicContact CB-CB 4.18Å; I383-E430 WeakPolarHBondContact CD1-OE2 3.19Å; I383-E430 HydrophobicContact CG2-CB 4.26Å; I383-E430 PolarHBondContact O-N 2.95Å; I383-E430 VanDerWaalsContact O-N 3.13Å; Q400-E430 PolarHBondContact NE2-OE1 3.38Å; E430-T432 PolarHBondContact O-N 2.79Å; E430-D439 WeakPolarHBondContact CA-OD1 3.33Å
431	S	76.4	Confident	79.3	Confident	43 Å²	43	63.8 Å²	63.8	30%	0.301	35%	0.347	S	S	.	.			trans	-89.5	88.5	-174	56.7	0	0	0	0	112.1	G433 D439	S431-G433 PolarHBondContact O-N 3.26Å; S431-D439 VanDerWaalsContact CB-OD1 3.29Å; S431-D439 WeakPolarHBondContact CB-OD1 3.27Å; S431-D439 PolarHBondContact N-OD1 2.95Å; S431-D439 PolarHBondContact OG-OD1 2.92Å
432	T	63.3	Low	79.2	Confident	97 Å²	97	63.9 Å²	63.9	60%	0.595	35%	0.347	S	S	*	.			trans	-69.5	34.3	177.4	68.5	0	0	0	0	114.6	R382 E430	R382-T432 VanDerWaalsContact CZ-OG1 3.3Å; R382-T432 PolarHBondContact NH1-OG1 3.14Å; R382-T432 PolarHBondContact NH2-OG1 3.4Å; E430-T432 PolarHBondContact O-N 2.79Å
433	G	63.4	Low	79.2	Confident	40 Å²	40	63.3 Å²	63.3	41%	0.412	34%	0.344	S	S	.	.			trans	-112.8	125.6	-179.6	0	0	0	0	0	110.5	S431 L435 A436	S431-G433 PolarHBondContact O-N 3.26Å; G433-L435 PolarHBondContact O-N 2.62Å; G433-A436 WeakPolarHBondContact O-CB 3.26Å; G433-A436 PolarHBondContact O-N 2.89Å
434	V	55.4	Low	79.3	Confident	155 Å²	155	68.9 Å²	68.9	94%	0.939	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-6.6	-176.2	-172.4	0	0	0	0	113.8
435	L	58.8	Low	79.3	Confident	169 Å²	169	66.4 Å²	66.4	89%	0.885	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.7	11.4	177.4	-61.5	173.9	0	0	0	113.1	G433	G433-L435 PolarHBondContact O-N 2.62Å
436	A	58.9	Low	79.3	Confident	49 Å²	49	69.8 Å²	69.8	41%	0.405	38%	0.376	S	S	.	.			trans	-82.4	124.7	174.8	0	0	0	0	0	110	G433	G433-A436 WeakPolarHBondContact O-CB 3.26Å; G433-A436 PolarHBondContact O-N 2.89Å
437	L	61.1	Low	79.1	Confident	174 Å²	174	68.6 Å²	68.6	91%	0.911	37%	0.372	S	S	*	.			trans	-96.1	-18.4	-179.9	-68.7	170.5	0	0	0	113.3
438	E	73.6	Confident	78.9	Confident	172 Å²	172	71.9 Å²	71.9	80%	0.804	39%	0.389	S	S	*	.	S	Bend	trans	-144.5	144.7	-179.4	-65.1	-173.8	175.7	0	0	110.6
439	D	83.6	Confident	78.7	Confident	41 Å²	41	71.4 Å²	71.4	22%	0.219	39%	0.388	C	S	.	.			trans	-75.1	153.5	174.5	-80.4	-23.7	0	0	0	112.9	Y385 F428 E430 S431 E441	Y385-D439 VanDerWaalsContact CE1-OD2 3.27Å; Y385-D439 WeakPolarHBondContact CE1-OD2 3.22Å; Y385-D439 WeakPolarHBondContact OH-CB 3.5Å; Y385-D439 PolarHBondContact OH-OD2 2.88Å; F428-D439 HydrophobicContact CB-CB 4.4Å; F428-D439 HydrophobicContact CD1-CB 4.08Å; F428-D439 WeakPolarHBondContact CD1-O 3.5Å; E430-D439 WeakPolarHBondContact CA-OD1 3.33Å; S431-D439 VanDerWaalsContact CB-OD1 3.29Å; S431-D439 WeakPolarHBondContact CB-OD1 3.27Å; S431-D439 PolarHBondContact N-OD1 2.95Å; S431-D439 PolarHBondContact OG-OD1 2.92Å; D439-E441 PolarHBondContact O-N 3.28Å
440	K	85.4	Confident	78.5	Confident	119 Å²	119	72.3 Å²	72.3	52%	0.517	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	111.7	-172.1	-177.2	-173.4	174.1	-165	0	111.6	F428 T429 L442	F428-K440 WeakPolarHBondContact CA-O 3.29Å; T429-K440 HydrophobicContact CG2-CB 4.07Å; T429-K440 HydrophobicContact CG2-CD 4.45Å; T429-K440 PolarHBondContact N-O 2.83Å; T429-K440 PolarHBondContact O-N 2.84Å; K440-L442 HydrophobicContact CD-CD2 4.2Å; K440-L442 HydrophobicContact CG-CD2 4.35Å; K440-L442 PolarHBondContact O-N 2.83Å
441	E	88.1	Confident	78.4	Confident	47 Å²	47	70.7 Å²	70.7	22%	0.22	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	119	168.4	-173.4	176.2	135.6	0	0	109.9	K426 F428 D439 R444	K426-E441 WeakPolarHBondContact CD-OE2 3.36Å; K426-E441 WeakPolarHBondContact CE-OE2 3.42Å; K426-E441 IonicContact NZ-OE2 3.05Å; K426-E441 PolarHBondContact NZ-OE2 3.3Å; F428-E441 HydrophobicContact CD1-CB 4.21Å; F428-E441 HydrophobicContact CE1-CB 3.8Å; F428-E441 HydrophobicContact CE1-CG 4.49Å; F428-E441 HydrophobicContact CZ-CB 4.33Å; D439-E441 PolarHBondContact O-N 3.28Å; E441-R444 WeakPolarHBondContact OE1-CD 3.23Å; E441-R444 IonicContact OE1-NH1 3.22Å
442	L	86.9	Confident	78.3	Confident	3 Å²	3	73 Å²	73	2%	0.016	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-32.2	179.2	-61.4	179.4	0	0	0	112.1	L375 V378 V384 L427 T429 K440 P465	L375-L442 HydrophobicContact CD1-CD1 3.95Å; V378-L442 HydrophobicContact CG2-CD1 3.78Å; V378-L442 HydrophobicContact CG2-CD2 3.76Å; V378-L442 HydrophobicContact CG2-CG 4.44Å; V384-L442 HydrophobicContact CG1-CD1 4.1Å; L427-L442 HydrophobicContact CD2-CB 4.08Å; L427-L442 HydrophobicContact CD2-CD1 4.02Å; L427-L442 HydrophobicContact CG-CB 4.21Å; L427-L442 HydrophobicContact CG-CD1 4.1Å; L427-L442 PolarHBondContact O-N 3.36Å; T429-L442 HydrophobicContact CG2-CD1 4.18Å; T429-L442 HydrophobicContact CG2-CD2 3.87Å; T429-L442 HydrophobicContact CG2-CG 4.19Å; K440-L442 HydrophobicContact CD-CD2 4.2Å; K440-L442 HydrophobicContact CG-CD2 4.35Å; K440-L442 PolarHBondContact O-N 2.83Å; L442-P465 WeakPolarHBondContact O-CD 3.4Å
443	G	88.7	Confident	78.6	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.3	164.5	177.3	0	0	0	0	0	111.9	L427 V463	L427-G443 PolarHBondContact N-O 2.85Å; G443-V463 VanDerWaalsContact CA-O 3.32Å; G443-V463 WeakPolarHBondContact CA-O 3.28Å
444	R	91.6	Very high	78.8	Confident	118 Å²	118	71.4 Å²	71.4	45%	0.445	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	146.7	179.7	69	-175.1	-174.6	-146.7	7.5	112.6	V425 K426 E441 V463	V425-R444 CarbonylContact O-C 3.54Å; V425-R444 VanDerWaalsContact O-CA 3.31Å; V425-R444 WeakPolarHBondContact O-CA 3.41Å; K426-R444 HydrophobicContact CG-CB 3.99Å; E441-R444 WeakPolarHBondContact OE1-CD 3.23Å; E441-R444 IonicContact OE1-NH1 3.22Å; R444-V463 HydrophobicContact CG-CB 4.23Å; R444-V463 PolarHBondContact N-O 2.98Å; R444-V463 PolarHBondContact O-N 3.38Å
445	V	92.3	Very high	79.5	Confident	8 Å²	8	72.3 Å²	72.3	5%	0.048	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	148.9	166.8	65.2	0	0	0	0	109	V425 L447 H460 I475 L477	V425-V445 HydrophobicContact CB-CG1 3.76Å; V425-V445 PolarHBondContact N-O 3.49Å; V425-V445 PolarHBondContact O-N 3.17Å; V445-L447 HydrophobicContact CG2-CD2 3.83Å; V445-L447 HydrophobicContact CG2-CG 4.07Å; V445-H460 HydrophobicContact CG2-CB 3.84Å; V445-I475 HydrophobicContact CB-CG2 4.17Å; V445-I475 HydrophobicContact CG1-CG2 3.7Å; V445-L477 HydrophobicContact CG1-CD2 3.99Å
446	V	90.6	Very high	80.5	Confident	73 Å²	73	71.8 Å²	71.8	44%	0.442	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	124.2	179.2	-177.3	0	0	0	0	107.8	L422 V423 K424	L422-V446 HydrophobicContact CD1-CG1 3.52Å; L422-V446 HydrophobicContact CD2-CG1 3.79Å; L422-V446 HydrophobicContact CG-CG1 3.57Å; V423-V446 CarbonylContact O-C 3.55Å; V423-V446 WeakPolarHBondContact O-CA 3.46Å; K424-V446 HydrophobicContact CG-CG2 4.39Å
447	L	88.9	Confident	81.7	Confident	31 Å²	31	70.9 Å²	70.9	16%	0.162	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151.1	-172.8	-56.7	176.6	0	0	0	110.6	V423 V445 H460 L477 V479	V423-L447 PolarHBondContact N-O 3.01Å; V423-L447 PolarHBondContact O-N 2.83Å; V445-L447 HydrophobicContact CG2-CD2 3.83Å; V445-L447 HydrophobicContact CG2-CG 4.07Å; L447-H460 WeakPolarHBondContact CD2-CD2 3.28Å; L447-L477 HydrophobicContact CD1-CD1 3.65Å; L447-L477 HydrophobicContact CD1-CD2 4.42Å; L447-L477 HydrophobicContact CD1-CG 4.47Å; L447-V479 HydrophobicContact CD1-CG2 4.02Å
448	I	87.5	Confident	83	Confident	68 Å²	68	67.1 Å²	67.1	35%	0.349	35%	0.348	S	S	.	.			trans	-121.3	90	175.3	-56.9	169.5	0	0	0	106.1	L420 L422 E526	L420-I448 HydrophobicContact CB-CG2 4.22Å; L420-I448 HydrophobicContact CD2-CG2 3.96Å; L422-I448 HydrophobicContact CD1-CG1 4.05Å; I448-E526 HydrophobicContact CD1-CG 4.11Å
449	P	86.6	Confident	83.8	Confident	13 Å²	13	63.1 Å²	63.1	8%	0.084	33%	0.328	C	S	.	.			trans	-68	158.4	-179.9	30.3	-36.2	0	0	0	111.3	L365 P421 V423 V479 M481	L365-P449 HydrophobicContact CD2-CB 4.45Å; L365-P449 HydrophobicContact CD2-CG 3.55Å; P421-P449 HydrophobicContact CG-CG 3.95Å; P421-P449 WeakPolarHBondContact O-CD 3.48Å; V423-P449 HydrophobicContact CG2-CG 3.8Å; P449-V479 HydrophobicContact CB-CB 4.29Å; P449-V479 HydrophobicContact CB-CG1 3.62Å; P449-V479 HydrophobicContact CG-CG1 3.85Å; P449-M481 HydrophobicContact CB-CB 4.31Å; P449-M481 HydrophobicContact CB-SD 4.37Å; P449-M481 HydrophobicContact CG-SD 4.28Å
450	T	84.1	Confident	84	Confident	31 Å²	31	63.3 Å²	63.3	19%	0.19	33%	0.328	C	S	.	.			trans	-139.4	156.8	172.5	55.6	0	0	0	0	108.8	L420 S452 G453 Y508	L420-T450 HydrophobicContact CD2-CG2 3.94Å; T450-S452 PolarHBondContact O-N 3.06Å; T450-S452 VanDerWaalsContact O-N 3.09Å; T450-G453 PolarHBondContact O-N 2.62Å; T450-Y508 HydrophobicContact CG2-CE2 4.17Å
451	T	81.1	Confident	84.3	Confident	34 Å²	34	65.5 Å²	65.5	21%	0.209	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-4.9	-177.1	60.7	0	0	0	0	114.5	F363 M481 K483 M487 S490	F363-T451 HydrophobicContact CD1-CG2 4.4Å; T451-M481 WeakPolarHBondContact CA-O 3.47Å; T451-M481 HydrophobicContact CG2-CB 4.48Å; T451-M481 HydrophobicContact CG2-CG 3.95Å; T451-M481 HydrophobicContact CG2-SD 4.32Å; T451-K483 HydrophobicContact CG2-CB 4.42Å; T451-M487 HydrophobicContact CG2-CE 3.71Å; T451-M487 WeakPolarHBondContact OG1-CE 3.4Å; T451-S490 PolarHBondContact OG1-OG 2.89Å
452	S	74.2	Confident	84.3	Confident	92 Å²	92	63.7 Å²	63.7	64%	0.643	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	9.2	171.8	53.1	0	0	0	0	113.6	T450	T450-S452 PolarHBondContact O-N 3.06Å; T450-S452 VanDerWaalsContact O-N 3.09Å
453	G	68.8	Low	84.4	Confident	28 Å²	28	68 Å²	68	29%	0.289	35%	0.35	S	S	.	.	S	Bend	trans	-67.3	164.6	-179.5	0	0	0	0	0	114.9	T450 K455	T450-G453 PolarHBondContact O-N 2.62Å; G453-K455 PolarHBondContact O-N 2.97Å
454	P	69.1	Low	84.4	Confident	75 Å²	75	69.7 Å²	69.7	49%	0.487	36%	0.361	S	S	.	.			trans	-63.5	133.4	178.4	26.9	-33.9	0	0	0	111.3	Q456 E458	P454-Q456 VanDerWaalsContact C-N 3.28Å; P454-Q456 PolarHBondContact O-N 2.95Å; P454-E458 VanDerWaalsContact CB-OE1 3.24Å; P454-E458 WeakPolarHBondContact CB-OE1 3.3Å; P454-E458 WeakPolarHBondContact CG-OE1 3.43Å
455	K	69.8	Low	83.9	Confident	173 Å²	173	67.1 Å²	67.1	75%	0.752	36%	0.359	S	S	*	.	S	Bend	trans	-85.2	6.4	179.9	-62.5	-170.8	177.7	-171.4	0	114.1	G453	G453-K455 PolarHBondContact O-N 2.97Å
456	Q	79.7	Confident	83	Confident	158 Å²	158	76.7 Å²	76.7	74%	0.738	40%	0.401	S	S	*	.	S	Bend	trans	-112.3	157.4	-177.7	-62.4	-172	7.6	0	0	110.5	P454 E458	P454-Q456 VanDerWaalsContact C-N 3.28Å; P454-Q456 PolarHBondContact O-N 2.95Å; Q456-E458 PolarHBondContact O-N 3.36Å
457	A	84.3	Confident	81.8	Confident	31 Å²	31	81 Å²	81	26%	0.256	42%	0.421	S	S	.	.			trans	-82.1	110.3	-178.8	0	0	0	0	0	111.4	V370 K476 L477 A478	V370-A457 HydrophobicContact CG2-CB 3.75Å; A457-K476 HydrophobicContact CB-CG 4.17Å; A457-K476 VanDerWaalsContact O-CE 3.23Å; A457-K476 WeakPolarHBondContact O-CE 3.48Å; A457-L477 CarbonylContact C-O 3.49Å; A457-L477 WeakPolarHBondContact CA-O 3.29Å; A457-A478 HydrophobicContact CB-CB 4.06Å
458	E	88.8	Confident	81	Confident	95 Å²	95	81.2 Å²	81.2	44%	0.444	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	154.2	-175.2	-68	-178.6	-176.3	0	0	111.9	P454 Q456 H460 K476 L477	P454-E458 VanDerWaalsContact CB-OE1 3.24Å; P454-E458 WeakPolarHBondContact CB-OE1 3.3Å; P454-E458 WeakPolarHBondContact CG-OE1 3.43Å; Q456-E458 PolarHBondContact O-N 3.36Å; E458-H460 PolarHBondContact O-CE1 3.04Å; E458-H460 PolarHBondContact O-ND1 2.78Å; E458-K476 WeakPolarHBondContact O-CA 3.5Å; E458-L477 PolarHBondContact N-O 2.87Å; E458-L477 PolarHBondContact O-N 3.36Å; E458-L477 VanDerWaalsContact O-N 3.13Å
459	F	89.3	Confident	80.2	Confident	87 Å²	87	85.1 Å²	85.1	38%	0.382	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	117.2	176.4	-73.3	-82	0	0	0	110.8	E371 Q373 K476	E371-F459 HydrophobicContact CG-CE1 4.43Å; E371-F459 WeakPolarHBondContact OE1-CZ 3.25Å; Q373-F459 HydrophobicContact CG-CE1 3.98Å; Q373-F459 VanDerWaalsContact NE2-CZ 3.33Å; F459-K476 HydrophobicContact CD1-CB 3.8Å; F459-K476 HydrophobicContact CD1-CG 4.28Å; F459-K476 HydrophobicContact CD2-CG 4.48Å; F459-K476 HydrophobicContact CE1-CB 3.66Å; F459-K476 HydrophobicContact CE1-CD 4.07Å; F459-K476 HydrophobicContact CE1-CG 4.12Å; F459-K476 HydrophobicContact CE2-CD 3.99Å; F459-K476 HydrophobicContact CE2-CG 4.33Å; F459-K476 HydrophobicContact CG-CB 4.4Å; F459-K476 HydrophobicContact CG-CG 4.46Å; F459-K476 HydrophobicContact CZ-CB 4.17Å; F459-K476 HydrophobicContact CZ-CD 3.69Å; F459-K476 HydrophobicContact CZ-CG 4.14Å
460	H	88.9	Confident	79.8	Confident	46 Å²	46	84.7 Å²	84.7	21%	0.213	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.8	178.2	-59.1	80.2	0	0	0	109.8	V445 L447 E458 M462 Q474 I475	V445-H460 HydrophobicContact CG2-CB 3.84Å; L447-H460 WeakPolarHBondContact CD2-CD2 3.28Å; E458-H460 PolarHBondContact O-CE1 3.04Å; E458-H460 PolarHBondContact O-ND1 2.78Å; H460-M462 PolarHBondContact O-N 3.38Å; H460-Q474 CarbonylContact O-C 3.49Å; H460-Q474 WeakPolarHBondContact O-CA 3.49Å; H460-I475 HydrophobicContact CB-CG2 4.32Å; H460-I475 PolarHBondContact N-O 3.35Å; H460-I475 PolarHBondContact O-N 3.45Å
461	R	90.3	Very high	79.3	Confident	165 Å²	165	88.7 Å²	88.7	62%	0.623	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	129.5	177.5	-169.1	176.4	-176.1	-177.6	3.6	110.8	T471 D472	R461-T471 PolarHBondContact NH2-O 2.74Å; R461-D472 IonicContact NE-OD1 3.62Å
462	M	89.7	Confident	79.3	Confident	8 Å²	8	91 Å²	91	4%	0.039	48%	0.475	C	S	.	.			trans	-83.8	143.8	178.4	-56.3	-167.6	90.5	0	0	111.2	L427 H460 L473 I475	L427-M462 HydrophobicContact CB-CE 3.94Å; L427-M462 HydrophobicContact CB-SD 4.36Å; H460-M462 PolarHBondContact O-N 3.38Å; M462-L473 HydrophobicContact CB-CB 4.31Å; M462-L473 HydrophobicContact CB-CD2 4.05Å; M462-L473 HydrophobicContact CB-CG 4.22Å; M462-L473 HydrophobicContact CG-CD2 4.33Å; M462-L473 HydrophobicContact CG-CG 4.28Å; M462-L473 PolarHBondContact N-O 3.43Å; M462-L473 HydrophobicContact SD-CD2 3.66Å; M462-L473 HydrophobicContact SD-CG 3.89Å; M462-I475 HydrophobicContact CE-CB 4.31Å; M462-I475 HydrophobicContact CE-CD1 4.14Å; M462-I475 HydrophobicContact CE-CG2 4.09Å; M462-I475 HydrophobicContact CG-CB 4.02Å; M462-I475 HydrophobicContact CG-CG2 3.64Å; M462-I475 HydrophobicContact SD-CB 3.85Å; M462-I475 HydrophobicContact SD-CG2 3.99Å
463	V	88.8	Confident	80	Confident	93 Å²	93	86.7 Å²	86.7	56%	0.564	44%	0.444	S	S	*	.	B	Isolated β-bridge	trans	-81	114.7	167.2	-178.1	0	0	0	0	108.1	G443 R444	G443-V463 VanDerWaalsContact CA-O 3.32Å; G443-V463 WeakPolarHBondContact CA-O 3.28Å; R444-V463 HydrophobicContact CG-CB 4.23Å; R444-V463 PolarHBondContact N-O 2.98Å; R444-V463 PolarHBondContact O-N 3.38Å
464	V	87.4	Confident	81	Confident	37 Å²	37	88 Å²	88	22%	0.224	44%	0.443	C	S	.	.			trans	-102.4	145.2	-174.5	176.3	0	0	0	0	110.6	D470 L473	V464-D470 HydrophobicContact CG1-CB 4.29Å; V464-D470 WeakPolarHBondContact CG2-O 3.21Å; V464-L473 HydrophobicContact CG2-CB 3.67Å; V464-L473 HydrophobicContact CG2-CD2 3.81Å; V464-L473 HydrophobicContact CG2-CG 4.4Å
465	P	81.2	Confident	82.1	Confident	63 Å²	63	84.4 Å²	84.4	41%	0.409	42%	0.42	S	S	.	.			trans	-58.8	145.6	175.2	-25.3	35.4	0	0	0	113.4	L442 N467 S468	L442-P465 WeakPolarHBondContact O-CD 3.4Å; P465-N467 PolarHBondContact O-N 3.19Å; P465-S468 PolarHBondContact O-N 2.77Å; P465-S468 VanDerWaalsContact O-N 3.12Å
466	K	74.3	Confident	83.2	Confident	210 Å²	210	79 Å²	79	91%	0.913	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-12.2	-171.7	-66.7	-174.2	177	-177.5	0	116.5
467	N	65.2	Low	83.7	Confident	162 Å²	162	71.5 Å²	71.5	87%	0.866	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	16.9	-175.4	-60.4	11.5	0	0	0	112.8	P465	P465-N467 PolarHBondContact O-N 3.19Å
468	S	71.5	Confident	84	Confident	36 Å²	36	70.7 Å²	70.7	25%	0.252	35%	0.354	S	S	.	.			trans	-90.2	161.5	177	-164.9	0	0	0	0	113.1	S377 P465 D470	S377-S468 PolarHBondContact OG-OG 3.2Å; P465-S468 PolarHBondContact O-N 2.77Å; P465-S468 VanDerWaalsContact O-N 3.12Å; S468-D470 PolarHBondContact OG-N 3.49Å; S468-D470 PolarHBondContact OG-OD2 3.42Å
469	Q	71.2	Confident	84	Confident	151 Å²	151	67.2 Å²	67.2	71%	0.706	34%	0.339	S	S	*	.	S	Bend	trans	-85.8	-10.3	168.5	-63.3	-177.9	-4.1	0	0	112.7	T471	Q469-T471 PolarHBondContact O-N 3.44Å; Q469-T471 VanDerWaalsContact O-N 3.16Å
470	D	78.1	Confident	83.9	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.016	34%	0.336	C	S	.	.			trans	-86	80.8	-174.8	-50	-46.6	0	0	0	111.8	K376 S377 V464 S468 L473	K376-D470 WeakPolarHBondContact CA-OD1 3.21Å; K376-D470 PolarHBondContact N-OD1 2.9Å; S377-D470 WeakPolarHBondContact CB-OD2 3.36Å; S377-D470 PolarHBondContact N-OD1 3.46Å; S377-D470 PolarHBondContact OG-OD2 2.8Å; V464-D470 HydrophobicContact CG1-CB 4.29Å; V464-D470 WeakPolarHBondContact CG2-O 3.21Å; S468-D470 PolarHBondContact OG-N 3.49Å; S468-D470 PolarHBondContact OG-OD2 3.42Å; D470-L473 HydrophobicContact CB-CB 4.21Å
471	T	73.1	Confident	83.9	Confident	116 Å²	116	65.4 Å²	65.4	71%	0.712	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-15.2	-177.4	48	0	0	0	0	114.9	R461 Q469	R461-T471 PolarHBondContact NH2-O 2.74Å; Q469-T471 PolarHBondContact O-N 3.44Å; Q469-T471 VanDerWaalsContact O-N 3.16Å
472	D	82.2	Confident	83.7	Confident	82 Å²	82	61.4 Å²	61.4	44%	0.439	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.1	51.2	-179.2	-163.6	19.5	0	0	0	111.6	R461 Q474	R461-D472 IonicContact NE-OD1 3.62Å; D472-Q474 PolarHBondContact OD1-NE2 3.04Å
473	L	88.7	Confident	83.5	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	34%	0.342	C	S	.	.			trans	-74.5	126.8	173.7	-168.7	71.1	0	0	0	109.9	V372 L375 L427 M462 V464 D470	V372-L473 HydrophobicContact CG1-CD1 3.66Å; V372-L473 HydrophobicContact CG1-CG 4.39Å; L375-L473 HydrophobicContact CB-CD1 3.9Å; L375-L473 HydrophobicContact CD1-CD1 4.15Å; L427-L473 HydrophobicContact CD2-CD1 4.49Å; L427-L473 HydrophobicContact CD2-CD2 4.13Å; M462-L473 HydrophobicContact CB-CB 4.31Å; M462-L473 HydrophobicContact CB-CD2 4.05Å; M462-L473 HydrophobicContact CB-CG 4.22Å; M462-L473 HydrophobicContact CG-CD2 4.33Å; M462-L473 HydrophobicContact CG-CG 4.28Å; M462-L473 PolarHBondContact N-O 3.43Å; M462-L473 HydrophobicContact SD-CD2 3.66Å; M462-L473 HydrophobicContact SD-CG 3.89Å; V464-L473 HydrophobicContact CG2-CB 3.67Å; V464-L473 HydrophobicContact CG2-CD2 3.81Å; V464-L473 HydrophobicContact CG2-CG 4.4Å; D470-L473 HydrophobicContact CB-CB 4.21Å
474	Q	90.6	Very high	83.3	Confident	56 Å²	56	63 Å²	63	26%	0.262	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.8	-178.5	-55.2	-173.9	16.1	0	0	110.3	V372 Q373 H460 D472	V372-Q474 CarbonylContact C-O 3.59Å; V372-Q474 WeakPolarHBondContact CA-O 3.46Å; Q373-Q474 PolarHBondContact N-O 3.16Å; Q373-Q474 PolarHBondContact O-N 2.62Å; H460-Q474 CarbonylContact O-C 3.49Å; H460-Q474 WeakPolarHBondContact O-CA 3.49Å; D472-Q474 PolarHBondContact OD1-NE2 3.04Å
475	I	91.2	Very high	82.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.9	179	-174.3	167.9	0	0	0	110.3	I369 V372 V425 V445 H460 M462 L477	I369-I475 HydrophobicContact CG2-CD1 4.11Å; I369-I475 HydrophobicContact CG2-CG1 4.47Å; V372-I475 HydrophobicContact CG2-CB 3.94Å; V372-I475 HydrophobicContact CG2-CD1 4Å; V372-I475 HydrophobicContact CG2-CG1 3.76Å; V425-I475 HydrophobicContact CG1-CD1 3.78Å; V445-I475 HydrophobicContact CB-CG2 4.17Å; V445-I475 HydrophobicContact CG1-CG2 3.7Å; H460-I475 HydrophobicContact CB-CG2 4.32Å; H460-I475 PolarHBondContact N-O 3.35Å; H460-I475 PolarHBondContact O-N 3.45Å; M462-I475 HydrophobicContact CE-CB 4.31Å; M462-I475 HydrophobicContact CE-CD1 4.14Å; M462-I475 HydrophobicContact CE-CG2 4.09Å; M462-I475 HydrophobicContact CG-CB 4.02Å; M462-I475 HydrophobicContact CG-CG2 3.64Å; M462-I475 HydrophobicContact SD-CB 3.85Å; M462-I475 HydrophobicContact SD-CG2 3.99Å; I475-L477 HydrophobicContact CD1-CD2 4.19Å; I475-L477 HydrophobicContact CG1-CD2 4.18Å; I475-L477 HydrophobicContact CG2-CD2 4.02Å
476	K	92.4	Very high	82.9	Confident	59 Å²	59	66.3 Å²	66.3	26%	0.257	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118	174.5	-165.5	-177.1	-172.1	175.1	0	109.5	V370 E371 A457 E458 F459	V370-K476 HydrophobicContact CB-CB 4.28Å; V370-K476 HydrophobicContact CB-CD 4.17Å; V370-K476 HydrophobicContact CB-CG 4.22Å; V370-K476 HydrophobicContact CG1-CD 4.05Å; V370-K476 PolarHBondContact N-O 3.43Å; E371-K476 HydrophobicContact CG-CB 3.7Å; E371-K476 HydrophobicContact CG-CD 3.96Å; E371-K476 PolarHBondContact N-O 2.83Å; E371-K476 PolarHBondContact O-N 3.42Å; A457-K476 HydrophobicContact CB-CG 4.17Å; A457-K476 VanDerWaalsContact O-CE 3.23Å; A457-K476 WeakPolarHBondContact O-CE 3.48Å; E458-K476 WeakPolarHBondContact O-CA 3.5Å; F459-K476 HydrophobicContact CD1-CB 3.8Å; F459-K476 HydrophobicContact CD1-CG 4.28Å; F459-K476 HydrophobicContact CD2-CG 4.48Å; F459-K476 HydrophobicContact CE1-CB 3.66Å; F459-K476 HydrophobicContact CE1-CD 4.07Å; F459-K476 HydrophobicContact CE1-CG 4.12Å; F459-K476 HydrophobicContact CE2-CD 3.99Å; F459-K476 HydrophobicContact CE2-CG 4.33Å; F459-K476 HydrophobicContact CG-CB 4.4Å; F459-K476 HydrophobicContact CG-CG 4.46Å; F459-K476 HydrophobicContact CZ-CB 4.17Å; F459-K476 HydrophobicContact CZ-CD 3.69Å; F459-K476 HydrophobicContact CZ-CG 4.14Å
477	L	91.4	Very high	83.5	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	157.4	178.7	69.4	88.5	0	0	0	111.1	V368 I369 V425 V445 L447 A457 E458 I475 V479	V368-L477 CarbonylContact O-C 3.59Å; V368-L477 WeakPolarHBondContact O-CA 3.2Å; V368-L477 VanDerWaalsContact O-CB 3.31Å; V368-L477 WeakPolarHBondContact O-CB 3.35Å; I369-L477 HydrophobicContact CG1-CB 4.3Å; V425-L477 HydrophobicContact CB-CD2 4.38Å; V425-L477 HydrophobicContact CG2-CD2 4.19Å; V445-L477 HydrophobicContact CG1-CD2 3.99Å; L447-L477 HydrophobicContact CD1-CD1 3.65Å; L447-L477 HydrophobicContact CD1-CD2 4.42Å; L447-L477 HydrophobicContact CD1-CG 4.47Å; A457-L477 CarbonylContact C-O 3.49Å; A457-L477 WeakPolarHBondContact CA-O 3.29Å; E458-L477 PolarHBondContact N-O 2.87Å; E458-L477 PolarHBondContact O-N 3.36Å; E458-L477 VanDerWaalsContact O-N 3.13Å; I475-L477 HydrophobicContact CD1-CD2 4.19Å; I475-L477 HydrophobicContact CG1-CD2 4.18Å; I475-L477 HydrophobicContact CG2-CD2 4.02Å; L477-V479 HydrophobicContact CD1-CG2 3.53Å
478	A	89.6	Confident	84.5	Confident	13 Å²	13	50.8 Å²	50.8	11%	0.107	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	142.8	166.2	0	0	0	0	0	109.7	V368 A457	V368-A478 PolarHBondContact N-O 3.46Å; V368-A478 PolarHBondContact O-N 3.1Å; A457-A478 HydrophobicContact CB-CB 4.06Å
479	V	88.8	Confident	85.4	Confident	22 Å²	22	50.3 Å²	50.3	13%	0.133	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	110.6	163.9	-173.8	0	0	0	0	107.8	L365 E366 V367 V423 L447 P449 L477	L365-V479 HydrophobicContact CD2-CG1 4.25Å; E366-V479 WeakPolarHBondContact O-CA 3.31Å; V367-V479 HydrophobicContact CG1-CG2 4.47Å; V367-V479 HydrophobicContact CG2-CG1 4.21Å; V367-V479 HydrophobicContact CG2-CG2 4.39Å; V423-V479 HydrophobicContact CG1-CG2 4.46Å; V423-V479 HydrophobicContact CG2-CG1 4.32Å; L447-V479 HydrophobicContact CD1-CG2 4.02Å; P449-V479 HydrophobicContact CB-CB 4.29Å; P449-V479 HydrophobicContact CB-CG1 3.62Å; P449-V479 HydrophobicContact CG-CG1 3.85Å; L477-V479 HydrophobicContact CD1-CG2 3.53Å
480	R	87.1	Confident	86.3	Confident	85 Å²	85	43.7 Å²	43.7	32%	0.321	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.4	171.7	-69.3	175.9	48.7	-149.4	-18.2	108.8	L365 E366 D482	L365-R480 CarbonylContact C-O 3.6Å; L365-R480 WeakPolarHBondContact CA-O 2.99Å; E366-R480 HydrophobicContact CB-CB 4.25Å; E366-R480 PolarHBondContact N-O 2.82Å; E366-R480 PolarHBondContact O-N 3.45Å; E366-R480 IonicContact OE1-CZ 3.55Å; E366-R480 IonicContact OE1-NE 2.72Å; E366-R480 IonicContact OE1-NH1 2.89Å; E366-R480 PolarHBondContact OE1-NH1 3.44Å; E366-R480 IonicContact OE1-NH2 2.74Å; E366-R480 PolarHBondContact OE1-NH2 2.88Å; E366-R480 WeakPolarHBondContact OE2-CD 3.49Å; E366-R480 IonicContact OE2-CZ 3.99Å; E366-R480 IonicContact OE2-NE 3.51Å; E366-R480 PolarHBondContact OE2-NE 3.47Å; E366-R480 IonicContact OE2-NH1 3.8Å; E366-R480 PolarHBondContact OE2-NH1 2.92Å; E366-R480 IonicContact OE2-NH2 2.82Å; R480-D482 IonicContact NH2-OD1 2.72Å
481	M	88.3	Confident	86.8	Confident	11 Å²	11	43.9 Å²	43.9	5%	0.054	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	114.1	176	-177	177.3	-175.3	0	0	107.8	F363 L365 P421 P449 T451	F363-M481 HydrophobicContact CB-CE 3.71Å; F363-M481 HydrophobicContact CD1-CE 3.48Å; F363-M481 VanDerWaalsContact CD1-CE 3.48Å; F363-M481 HydrophobicContact CD2-CE 4.13Å; F363-M481 HydrophobicContact CE1-CE 4.11Å; F363-M481 HydrophobicContact CG-CE 3.49Å; F363-M481 VanDerWaalsContact CG-CE 3.49Å; L365-M481 HydrophobicContact CD1-CG 4.2Å; L365-M481 HydrophobicContact CD2-CB 4.46Å; L365-M481 HydrophobicContact CD2-CG 4.39Å; L365-M481 HydrophobicContact CG-CB 4.12Å; L365-M481 HydrophobicContact CG-CG 3.96Å; P421-M481 HydrophobicContact CG-CE 4.19Å; P421-M481 HydrophobicContact CG-SD 4.41Å; P449-M481 HydrophobicContact CB-CB 4.31Å; P449-M481 HydrophobicContact CB-SD 4.37Å; P449-M481 HydrophobicContact CG-SD 4.28Å; T451-M481 WeakPolarHBondContact CA-O 3.47Å; T451-M481 HydrophobicContact CG2-CB 4.48Å; T451-M481 HydrophobicContact CG2-CG 3.95Å; T451-M481 HydrophobicContact CG2-SD 4.32Å
482	D	86.4	Confident	87.6	Confident	80 Å²	80	43.1 Å²	43.1	43%	0.428	22%	0.216	S	C	.	.			trans	-78.1	146.5	-175.1	-81.6	-12.5	0	0	0	111.7	N364 R480 P484	N364-D482 PolarHBondContact O-N 3.05Å; R480-D482 IonicContact NH2-OD1 2.72Å; D482-P484 VanDerWaalsContact O-CD 3.29Å; D482-P484 WeakPolarHBondContact O-CD 3.43Å
483	K	85.6	Confident	88.1	Confident	118 Å²	118	39.2 Å²	39.2	51%	0.513	20%	0.195	S	C	.	.			trans	-83.5	111.6	-179.7	173.9	176.6	-179.4	-175.9	0	109.7	T451 M487 K488	T451-K483 HydrophobicContact CG2-CB 4.42Å; K483-M487 HydrophobicContact CB-CE 4.38Å; K483-M487 WeakPolarHBondContact CE-O 3.23Å; K483-M487 HydrophobicContact CG-CE 3.86Å; K483-K488 WeakPolarHBondContact CE-O 3.48Å; K483-K488 PolarHBondContact NZ-O 2.87Å
484	P	85.3	Confident	88.2	Confident	17 Å²	17	41.5 Å²	41.5	11%	0.11	20%	0.204	C	C	.	.			trans	-65.4	148.2	176	25.4	-33.1	0	0	0	111.2	L361 T362 F363 D482 N486 M487	L361-P484 HydrophobicContact CB-CG 4.36Å; L361-P484 HydrophobicContact CD1-CG 4.37Å; T362-P484 WeakPolarHBondContact O-CB 3.33Å; F363-P484 VanDerWaalsContact CD1-CD 3.47Å; F363-P484 HydrophobicContact CD1-CG 3.8Å; F363-P484 HydrophobicContact CE1-CG 3.6Å; F363-P484 HydrophobicContact CZ-CG 4.19Å; D482-P484 VanDerWaalsContact O-CD 3.29Å; D482-P484 WeakPolarHBondContact O-CD 3.43Å; P484-N486 PolarHBondContact O-N 3.09Å; P484-M487 HydrophobicContact CG-CB 4.03Å; P484-M487 PolarHBondContact O-N 3.33Å
485	P	76.3	Confident	88.2	Confident	106 Å²	106	38.9 Å²	38.9	69%	0.688	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-31	-171.1	24	-34.5	0	0	0	113.6	M487	P485-M487 VanDerWaalsContact C-N 3.27Å; P485-M487 PolarHBondContact O-N 3.5Å
486	N	82.9	Confident	88.2	Confident	64 Å²	64	40.7 Å²	40.7	34%	0.342	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-17	179.1	-64.4	16.8	0	0	0	112.5	L361 P484 K488 Q513	L361-N486 HydrophobicContact CD2-CB 3.79Å; P484-N486 PolarHBondContact O-N 3.09Å; N486-K488 PolarHBondContact O-N 3.2Å; N486-Q513 WeakPolarHBondContact O-CB 3.41Å; N486-Q513 PolarHBondContact O-N 2.72Å
487	M	87.2	Confident	88	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	107.3	175.2	-171.8	173.7	77.8	0	0	109.9	L361 F363 T451 K483 P484 P485 S490 L510	L361-M487 HydrophobicContact CD1-CB 4.05Å; F363-M487 HydrophobicContact CE1-CE 4.37Å; F363-M487 HydrophobicContact CE1-SD 4.07Å; F363-M487 HydrophobicContact CZ-SD 4.5Å; T451-M487 HydrophobicContact CG2-CE 3.71Å; T451-M487 WeakPolarHBondContact OG1-CE 3.4Å; K483-M487 HydrophobicContact CB-CE 4.38Å; K483-M487 WeakPolarHBondContact CE-O 3.23Å; K483-M487 HydrophobicContact CG-CE 3.86Å; P484-M487 HydrophobicContact CG-CB 4.03Å; P484-M487 PolarHBondContact O-N 3.33Å; P485-M487 VanDerWaalsContact C-N 3.27Å; P485-M487 PolarHBondContact O-N 3.5Å; M487-S490 WeakPolarHBondContact CE-OG 3.3Å; M487-L510 HydrophobicContact CG-CB 4.43Å; M487-L510 HydrophobicContact CG-CD2 4.18Å; M487-L510 HydrophobicContact CG-CG 4.26Å; M487-L510 HydrophobicContact SD-CB 4.31Å; M487-L510 HydrophobicContact SD-CD2 3.34Å; M487-L510 WeakPolarHBondContact SD-CD2 3.39Å; M487-L510 HydrophobicContact SD-CG 3.52Å; M487-L510 VanDerWaalsContact SD-CG 3.52Å
488	K	87.3	Confident	87.6	Confident	44 Å²	44	45.4 Å²	45.4	19%	0.191	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-42.7	179.5	-62.1	-57.9	-173.5	-178.4	0	111.9	D266 K483 N486 L511 Q513 F519	D266-K488 IonicContact OD1-NZ 3.17Å; D266-K488 PolarHBondContact OD1-NZ 3.13Å; D266-K488 IonicContact OD2-NZ 2.68Å; D266-K488 PolarHBondContact OD2-NZ 3.46Å; K483-K488 WeakPolarHBondContact CE-O 3.48Å; K483-K488 PolarHBondContact NZ-O 2.87Å; N486-K488 PolarHBondContact O-N 3.2Å; K488-L511 HydrophobicContact CB-CD2 3.99Å; K488-L511 HydrophobicContact CB-CG 4.07Å; K488-L511 PolarHBondContact N-O 2.85Å; K488-Q513 VanDerWaalsContact CE-CD 3.47Å; K488-Q513 HydrophobicContact CG-CB 4.43Å; K488-F519 HydrophobicContact CD-CE1 4.49Å; K488-F519 HydrophobicContact CG-CD1 4.37Å; K488-F519 HydrophobicContact CG-CE1 3.9Å
489	H	88.9	Confident	87.2	Confident	26 Å²	26	53.6 Å²	53.6	12%	0.12	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	162.9	179.3	-164.4	34.4	0	0	0	111.9	L510 L511 D576 L579 W580 A583	H489-L510 WeakPolarHBondContact O-CA 3.42Å; H489-L511 HydrophobicContact CB-CB 4.39Å; H489-L511 PolarHBondContact O-N 3.43Å; H489-D576 IonicContact NE2-OD1 3.69Å; H489-L579 WeakPolarHBondContact NE2-CB 3.46Å; H489-W580 AromaticContact CD2-CD1 3.96Å; H489-W580 AromaticContact CD2-CD2 3.35Å; H489-W580 AromaticContact CD2-CE2 3.54Å; H489-W580 AromaticContact CD2-CE3 3.66Å; H489-W580 AromaticContact CD2-CG 3.68Å; H489-W580 AromaticContact CD2-NE1 3.87Å; H489-W580 AromaticContact NE2-CD1 3.54Å; H489-W580 AromaticContact NE2-CD2 3.77Å; H489-W580 AromaticContact NE2-CE2 3.7Å; H489-W580 AromaticContact NE2-CG 3.7Å; H489-W580 AromaticContact NE2-NE1 3.53Å; H489-A583 HydrophobicContact CB-CB 3.9Å
490	S	90.4	Very high	87	Confident	11 Å²	11	53.9 Å²	53.9	8%	0.077	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	141.5	-172.3	55.8	0	0	0	0	111.9	T451 M487 F509	T451-S490 PolarHBondContact OG1-OG 2.89Å; M487-S490 WeakPolarHBondContact CE-OG 3.3Å; S490-F509 CarbonylContact C-O 3.58Å; S490-F509 VanDerWaalsContact CA-O 3.25Å; S490-F509 WeakPolarHBondContact CA-O 3.38Å
491	G	89.7	Confident	87.2	Confident	8 Å²	8	49.9 Å²	49.9	8%	0.082	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.4	179	-175.1	0	0	0	0	0	113.8	Y508 F509	G491-Y508 WeakPolarHBondContact O-CD2 3.45Å; G491-F509 PolarHBondContact N-O 2.69Å; G491-F509 PolarHBondContact O-N 2.87Å
492	Y	90	Very high	87.1	Confident	100 Å²	100	56.7 Å²	56.7	39%	0.392	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	109.3	179.5	-76.4	-84.1	0	0	0	112	R507 Y508	Y492-R507 WeakPolarHBondContact CA-O 3.18Å; Y492-Y508 HydrophobicContact CD1-CD2 4.01Å; Y492-Y508 AromaticContact CD2-CD2 3.66Å; Y492-Y508 HydrophobicContact CD2-CD2 3.66Å; Y492-Y508 HydrophobicContact CD2-CE2 4.1Å; Y492-Y508 AromaticContact CE1-CD2 3.92Å; Y492-Y508 HydrophobicContact CE1-CD2 3.92Å; Y492-Y508 HydrophobicContact CE1-CG 4.23Å; Y492-Y508 AromaticContact CE2-CD2 3.55Å; Y492-Y508 HydrophobicContact CE2-CD2 3.55Å; Y492-Y508 AromaticContact CE2-CE2 3.95Å; Y492-Y508 HydrophobicContact CE2-CE2 3.95Å; Y492-Y508 HydrophobicContact CE2-CG 4.49Å; Y492-Y508 AromaticContact CG-CD2 3.88Å; Y492-Y508 HydrophobicContact CG-CD2 3.88Å; Y492-Y508 AromaticContact CZ-CD2 3.69Å
493	L	91.1	Very high	87.2	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	148.5	176.4	-58	177	0	0	0	111.7	K506 R507 F509 M521 F558 F569 C571 W580	L493-K506 CarbonylContact O-C 3.57Å; L493-K506 WeakPolarHBondContact O-CA 3.44Å; L493-R507 PolarHBondContact N-O 3.46Å; L493-R507 VanDerWaalsContact N-O 3.08Å; L493-R507 PolarHBondContact O-N 2.91Å; L493-F509 HydrophobicContact CB-CD2 3.66Å; L493-F509 HydrophobicContact CB-CE2 3.9Å; L493-F509 HydrophobicContact CD1-CB 4.45Å; L493-F509 HydrophobicContact CD1-CD2 4.3Å; L493-F509 HydrophobicContact CD1-CG 4.4Å; L493-F509 HydrophobicContact CG-CD2 4.22Å; L493-M521 HydrophobicContact CD1-CE 3.56Å; L493-F558 HydrophobicContact CD1-CZ 3.9Å; L493-F558 HydrophobicContact CD2-CE1 4.27Å; L493-F558 HydrophobicContact CD2-CZ 4.31Å; L493-F569 HydrophobicContact CB-CD1 4.43Å; L493-F569 HydrophobicContact CD1-CD1 3.76Å; L493-F569 HydrophobicContact CD1-CE1 4.36Å; L493-F569 HydrophobicContact CD1-CG 4.4Å; L493-C571 HydrophobicContact CD2-CB 3.76Å; L493-W580 HydrophobicContact CD1-CD2 3.9Å; L493-W580 HydrophobicContact CD1-CE3 4.16Å; L493-W580 HydrophobicContact CD1-CG 4.41Å; L493-W580 HydrophobicContact CD1-CH2 4.33Å; L493-W580 HydrophobicContact CD1-CZ2 4.05Å; L493-W580 HydrophobicContact CD1-CZ3 4.38Å; L493-W580 HydrophobicContact CD2-CD2 4.42Å; L493-W580 HydrophobicContact CD2-CG 4.3Å; L493-W580 HydrophobicContact CG-CD2 4.48Å; L493-W580 HydrophobicContact CG-CZ2 4.19Å
494	Y	91.4	Very high	87.4	Confident	49 Å²	49	59.4 Å²	59.4	19%	0.192	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140.5	152.6	-66.3	-100.6	0	0	0	108.7	W504 K506 F569 A570	Y494-W504 HydrophobicContact CD1-CD2 4.47Å; Y494-W504 AromaticContact CD1-CE2 3.85Å; Y494-W504 HydrophobicContact CD1-CZ2 4.27Å; Y494-W504 AromaticContact CD1-NE1 3.52Å; Y494-W504 AromaticContact CG-CZ2 3.99Å; Y494-W504 HydrophobicContact CG-CZ2 3.99Å; Y494-K506 HydrophobicContact CD1-CB 4.06Å; Y494-K506 HydrophobicContact CD2-CB 4.28Å; Y494-K506 HydrophobicContact CD2-CD 4.27Å; Y494-K506 HydrophobicContact CD2-CG 4.15Å; Y494-K506 HydrophobicContact CE1-CB 3.84Å; Y494-K506 HydrophobicContact CE2-CB 4.07Å; Y494-K506 HydrophobicContact CE2-CD 3.61Å; Y494-K506 HydrophobicContact CE2-CG 3.95Å; Y494-K506 HydrophobicContact CG-CB 4.26Å; Y494-F569 CarbonylContact O-C 3.44Å; Y494-F569 VanDerWaalsContact O-CA 3.3Å; Y494-F569 WeakPolarHBondContact O-CA 3.41Å; Y494-A570 PolarHBondContact N-O 2.87Å; Y494-A570 PolarHBondContact O-N 3.41Å
495	A	91.5	Very high	87.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	144.1	176.6	0	0	0	0	0	111.9	W501 R507 F509 T568 F569	A495-W501 HydrophobicContact CB-CB 4.41Å; A495-R507 PolarHBondContact O-NH1 3.4Å; A495-R507 VanDerWaalsContact O-NH1 3.09Å; A495-F509 HydrophobicContact CB-CE2 3.96Å; A495-F509 HydrophobicContact CB-CZ 3.53Å; A495-T568 WeakPolarHBondContact CA-O 3.2Å; A495-F569 HydrophobicContact CB-CD1 3.65Å; A495-F569 HydrophobicContact CB-CE1 3.77Å
496	V	90.8	Very high	88.2	Confident	39 Å²	39	63.8 Å²	63.8	24%	0.236	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	137.1	163.3	64.1	0	0	0	0	110.1	W501 W504 L551 V567 T568	V496-W501 WeakPolarHBondContact CA-O 3.49Å; V496-W504 HydrophobicContact CB-CB 4.46Å; V496-W504 HydrophobicContact CB-CE3 3.85Å; V496-W504 HydrophobicContact CG1-CE3 3.63Å; V496-W504 HydrophobicContact CG1-CZ3 4.05Å; V496-L551 HydrophobicContact CG1-CD1 4.47Å; V496-V567 CarbonylContact O-C 3.57Å; V496-V567 WeakPolarHBondContact O-CA 3.31Å; V496-T568 PolarHBondContact N-O 2.98Å; V496-T568 PolarHBondContact O-N 2.98Å
497	G	87.3	Confident	88.7	Confident	10 Å²	10	62.1 Å²	62.1	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	168.7	177.1	0	0	0	0	0	113	V500 W501 L566	G497-V500 CarbonylContact C-O 3.58Å; G497-V500 WeakPolarHBondContact CA-O 3.46Å; G497-V500 PolarHBondContact N-O 3.21Å; G497-V500 VanDerWaalsContact O-O 3.13Å; G497-W501 PolarHBondContact N-O 2.91Å; G497-L566 VanDerWaalsContact CA-O 3.3Å; G497-L566 WeakPolarHBondContact CA-O 3.45Å
498	H	83.3	Confident	88.9	Confident	149 Å²	149	62.4 Å²	62.4	69%	0.69	27%	0.27	S	S	*	.	S	Bend	trans	-82.9	-46.1	-175.3	-152.7	-106.9	0	0	0	111.9	K502 D565 L566	H498-K502 WeakPolarHBondContact O-CE 3.42Å; H498-D565 WeakPolarHBondContact CB-OD1 3.23Å; H498-D565 PolarHBondContact N-OD1 3.23Å; H498-L566 PolarHBondContact N-O 3.33Å
499	R	82.9	Confident	89.1	Confident	184 Å²	184	60.3 Å²	60.3	69%	0.694	26%	0.261	S	S	*	.	S	Bend	trans	-80.8	-52.1	170.7	-63.2	178	168.5	-160.5	-4.1	112.3	K502 D565	R499-K502 WeakPolarHBondContact O-CE 3.24Å; R499-D565 WeakPolarHBondContact CB-OD2 3.45Å; R499-D565 VanDerWaalsContact CD-OD2 3.22Å; R499-D565 WeakPolarHBondContact CD-OD2 3.44Å; R499-D565 HydrophobicContact CG-CB 4.47Å; R499-D565 WeakPolarHBondContact CG-OD2 3.16Å; R499-D565 PolarHBondContact N-OD1 3.13Å
500	V	83.3	Confident	89.2	Confident	29 Å²	29	59.1 Å²	59.1	18%	0.176	26%	0.255	C	S	.	.	S	Bend	trans	-108.7	156.1	-174.4	-70.2	0	0	0	0	112.4	G497 K502 M535 V567	G497-V500 CarbonylContact C-O 3.58Å; G497-V500 WeakPolarHBondContact CA-O 3.46Å; G497-V500 PolarHBondContact N-O 3.21Å; G497-V500 VanDerWaalsContact O-O 3.13Å; V500-K502 PolarHBondContact O-N 3.09Å; V500-M535 HydrophobicContact CG2-CB 4.18Å; V500-M535 HydrophobicContact CG2-CG 4.09Å; V500-M535 HydrophobicContact CG2-SD 3.64Å; V500-V567 HydrophobicContact CG2-CG2 4.11Å
501	W	90.6	Very high	89.3	Confident	1 Å²	1	58.6 Å²	58.6	0%	0.004	25%	0.252	C	S	.	.			trans	52.9	43.7	177.5	-54.9	-55.8	0	0	0	115.1	A495 V496 G497 R503 F509 M521 S523 E533 M535 V567 F569	A495-W501 HydrophobicContact CB-CB 4.41Å; V496-W501 WeakPolarHBondContact CA-O 3.49Å; G497-W501 PolarHBondContact N-O 2.91Å; W501-R503 PolarHBondContact O-N 3.29Å; W501-F509 AromaticContact CD2-CE1 3.94Å; W501-F509 HydrophobicContact CD2-CE1 3.94Å; W501-F509 HydrophobicContact CD2-CZ 4.05Å; W501-F509 AromaticContact CE2-CE1 3.53Å; W501-F509 AromaticContact CE2-CZ 3.96Å; W501-F509 HydrophobicContact CE3-CE1 4.22Å; W501-F509 HydrophobicContact CG-CZ 4.41Å; W501-F509 AromaticContact CH2-CE1 3.83Å; W501-F509 HydrophobicContact CH2-CE1 3.83Å; W501-F509 HydrophobicContact CZ2-CD1 4.32Å; W501-F509 AromaticContact CZ2-CE1 3.51Å; W501-F509 HydrophobicContact CZ2-CE1 3.51Å; W501-F509 HydrophobicContact CZ2-CZ 4.38Å; W501-F509 HydrophobicContact CZ3-CE1 4.17Å; W501-F509 AromaticContact NE1-CE1 3.98Å; W501-M521 HydrophobicContact CH2-CB 4.2Å; W501-M521 HydrophobicContact CH2-CG 3.9Å; W501-M521 WeakPolarHBondContact CH2-O 3.3Å; W501-M521 HydrophobicContact CZ3-CG 4.4Å; W501-S523 PolarHBondContact NE1-OG 2.73Å; W501-E533 VanDerWaalsContact CA-OE2 3.25Å; W501-E533 WeakPolarHBondContact CA-OE2 3.28Å; W501-E533 PolarHBondContact N-OE2 3.46Å; W501-E533 VanDerWaalsContact N-OE2 3.11Å; W501-M535 HydrophobicContact CH2-CB 3.52Å; W501-M535 HydrophobicContact CH2-SD 4.46Å; W501-M535 HydrophobicContact CZ2-CB 4.49Å; W501-M535 HydrophobicContact CZ3-CB 3.86Å; W501-M535 HydrophobicContact CZ3-CE 4.25Å; W501-M535 HydrophobicContact CZ3-CG 4.49Å; W501-M535 HydrophobicContact CZ3-SD 3.85Å; W501-V567 HydrophobicContact CE3-CG1 3.92Å; W501-V567 HydrophobicContact CZ3-CG1 4.26Å; W501-F569 HydrophobicContact CE3-CZ 4.48Å; W501-F569 HydrophobicContact CZ3-CE1 4.38Å; W501-F569 HydrophobicContact CZ3-CZ 4.08Å
502	K	87.6	Confident	89.3	Confident	153 Å²	153	58.3 Å²	58.3	67%	0.665	25%	0.248	S	C	*	.			trans	-57.6	11.7	-176.5	-57.2	-173.8	179.5	-173.6	0	117.6	H498 R499 V500	H498-K502 WeakPolarHBondContact O-CE 3.42Å; R499-K502 WeakPolarHBondContact O-CE 3.24Å; V500-K502 PolarHBondContact O-N 3.09Å
503	R	87.1	Confident	89	Confident	204 Å²	204	54 Å²	54	77%	0.77	23%	0.232	S	C	*	.	S	Bend	trans	-142.6	129.9	172.5	-65.3	-174.7	-178	179.3	0.9	109.4	W501 K505 R507	W501-R503 PolarHBondContact O-N 3.29Å; R503-K505 PolarHBondContact O-N 2.86Å; R503-K505 VanDerWaalsContact O-N 3.17Å; R503-R507 PolarHBondContact O-NH1 2.86Å; R503-R507 VanDerWaalsContact O-NH1 3.14Å; R503-R507 PolarHBondContact O-NH2 3.12Å
504	W	90	Very high	88.4	Confident	52 Å²	52	56 Å²	56	20%	0.197	24%	0.243	C	C	.	.			trans	-59.3	113.6	170.3	-171.5	-111.8	0	0	0	110.1	Y494 V496 L551 Q552 G553 F557 T568 A570	Y494-W504 HydrophobicContact CD1-CD2 4.47Å; Y494-W504 AromaticContact CD1-CE2 3.85Å; Y494-W504 HydrophobicContact CD1-CZ2 4.27Å; Y494-W504 AromaticContact CD1-NE1 3.52Å; Y494-W504 AromaticContact CG-CZ2 3.99Å; Y494-W504 HydrophobicContact CG-CZ2 3.99Å; V496-W504 HydrophobicContact CB-CB 4.46Å; V496-W504 HydrophobicContact CB-CE3 3.85Å; V496-W504 HydrophobicContact CG1-CE3 3.63Å; V496-W504 HydrophobicContact CG1-CZ3 4.05Å; W504-L551 HydrophobicContact CB-CD2 4.16Å; W504-L551 HydrophobicContact CD2-CB 4.33Å; W504-L551 HydrophobicContact CD2-CD1 4.09Å; W504-L551 HydrophobicContact CD2-CD2 4Å; W504-L551 HydrophobicContact CD2-CG 4.37Å; W504-L551 HydrophobicContact CE3-CD1 3.95Å; W504-L551 HydrophobicContact CE3-CD2 4.42Å; W504-L551 HydrophobicContact CG-CD2 3.91Å; W504-L551 HydrophobicContact CH2-CD1 3.92Å; W504-L551 HydrophobicContact CZ2-CB 3.99Å; W504-L551 HydrophobicContact CZ2-CD1 4.07Å; W504-L551 HydrophobicContact CZ3-CD1 3.87Å; W504-Q552 PolarHBondContact NE1-O 3.21Å; W504-G553 WeakPolarHBondContact CZ2-O 3.38Å; W504-F557 HydrophobicContact CH2-CD1 4.38Å; W504-F557 AromaticContact CH2-CE1 3.77Å; W504-F557 HydrophobicContact CH2-CE1 3.77Å; W504-F557 AromaticContact CZ2-CE1 3.99Å; W504-F557 HydrophobicContact CZ2-CE1 3.99Å; W504-F557 HydrophobicContact CZ2-CZ 4.35Å; W504-T568 HydrophobicContact CZ3-CG2 4.32Å; W504-A570 HydrophobicContact CH2-CB 3.62Å; W504-A570 HydrophobicContact CZ2-CB 3.98Å
505	K	88.8	Confident	87.3	Confident	136 Å²	136	55.7 Å²	55.7	59%	0.591	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-159.4	139.7	178.4	-168.7	-175.6	173	-179.9	0	109.8	R503 R507	R503-K505 PolarHBondContact O-N 2.86Å; R503-K505 VanDerWaalsContact O-N 3.17Å; K505-R507 PolarHBondContact O-N 3.47Å; K505-R507 PolarHBondContact O-NH1 3.17Å
506	K	90.5	Very high	85.6	Confident	78 Å²	78	57 Å²	57	34%	0.339	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	125.6	167.4	-156.8	167.4	-172.5	163.5	0	109.9	L493 Y494 D572	L493-K506 CarbonylContact O-C 3.57Å; L493-K506 WeakPolarHBondContact O-CA 3.44Å; Y494-K506 HydrophobicContact CD1-CB 4.06Å; Y494-K506 HydrophobicContact CD2-CB 4.28Å; Y494-K506 HydrophobicContact CD2-CD 4.27Å; Y494-K506 HydrophobicContact CD2-CG 4.15Å; Y494-K506 HydrophobicContact CE1-CB 3.84Å; Y494-K506 HydrophobicContact CE2-CB 4.07Å; Y494-K506 HydrophobicContact CE2-CD 3.61Å; Y494-K506 HydrophobicContact CE2-CG 3.95Å; Y494-K506 HydrophobicContact CG-CB 4.26Å; K506-D572 IonicContact NZ-OD2 2.71Å; K506-D572 PolarHBondContact NZ-OD2 2.87Å
507	R	92.4	Very high	84.2	Confident	29 Å²	29	56.4 Å²	56.4	11%	0.109	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	159.1	177.1	-57.7	169.6	-179.2	86.4	-14	108.1	Y492 L493 A495 R503 K505 F509	Y492-R507 WeakPolarHBondContact CA-O 3.18Å; L493-R507 PolarHBondContact N-O 3.46Å; L493-R507 VanDerWaalsContact N-O 3.08Å; L493-R507 PolarHBondContact O-N 2.91Å; A495-R507 PolarHBondContact O-NH1 3.4Å; A495-R507 VanDerWaalsContact O-NH1 3.09Å; R503-R507 PolarHBondContact O-NH1 2.86Å; R503-R507 VanDerWaalsContact O-NH1 3.14Å; R503-R507 PolarHBondContact O-NH2 3.12Å; K505-R507 PolarHBondContact O-N 3.47Å; K505-R507 PolarHBondContact O-NH1 3.17Å; R507-F509 HydrophobicContact CB-CD2 4.12Å; R507-F509 HydrophobicContact CB-CE2 3.67Å; R507-F509 HydrophobicContact CB-CZ 4.3Å; R507-F509 HydrophobicContact CG-CE2 4.45Å; R507-F509 WeakPolarHBondContact O-CD2 3.25Å
508	Y	91.3	Very high	83.6	Confident	9 Å²	9	57.6 Å²	57.6	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.2	168	-166.1	-118.8	0	0	0	109.1	L420 T450 G491 Y492 L510 S523 Y524	L420-Y508 HydrophobicContact CD1-CD1 3.7Å; L420-Y508 HydrophobicContact CD1-CE1 4.49Å; L420-Y508 HydrophobicContact CD1-CG 3.86Å; L420-Y508 HydrophobicContact CD2-CD1 3.7Å; L420-Y508 HydrophobicContact CD2-CD2 4.46Å; L420-Y508 HydrophobicContact CD2-CE1 3.67Å; L420-Y508 HydrophobicContact CD2-CE2 4.46Å; L420-Y508 HydrophobicContact CD2-CG 4.1Å; L420-Y508 HydrophobicContact CG-CD1 3.57Å; L420-Y508 HydrophobicContact CG-CE1 3.9Å; L420-Y508 HydrophobicContact CG-CG 4.16Å; T450-Y508 HydrophobicContact CG2-CE2 4.17Å; G491-Y508 WeakPolarHBondContact O-CD2 3.45Å; Y492-Y508 HydrophobicContact CD1-CD2 4.01Å; Y492-Y508 AromaticContact CD2-CD2 3.66Å; Y492-Y508 HydrophobicContact CD2-CD2 3.66Å; Y492-Y508 HydrophobicContact CD2-CE2 4.1Å; Y492-Y508 AromaticContact CE1-CD2 3.92Å; Y492-Y508 HydrophobicContact CE1-CD2 3.92Å; Y492-Y508 HydrophobicContact CE1-CG 4.23Å; Y492-Y508 AromaticContact CE2-CD2 3.55Å; Y492-Y508 HydrophobicContact CE2-CD2 3.55Å; Y492-Y508 AromaticContact CE2-CE2 3.95Å; Y492-Y508 HydrophobicContact CE2-CE2 3.95Å; Y492-Y508 HydrophobicContact CE2-CG 4.49Å; Y492-Y508 AromaticContact CG-CD2 3.88Å; Y492-Y508 HydrophobicContact CG-CD2 3.88Å; Y492-Y508 AromaticContact CZ-CD2 3.69Å; Y508-L510 HydrophobicContact CD1-CD1 3.6Å; Y508-L510 HydrophobicContact CE1-CD1 3.46Å; Y508-L510 VanDerWaalsContact CE1-CD1 3.46Å; Y508-S523 WeakPolarHBondContact O-CA 3.43Å; Y508-Y524 PolarHBondContact O-N 2.71Å
509	F	92.5	Very high	83.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.6	-177	-77.7	-91.8	0	0	0	110.7	S490 G491 L493 A495 W501 R507 M521 C522 F569 W580	S490-F509 CarbonylContact C-O 3.58Å; S490-F509 VanDerWaalsContact CA-O 3.25Å; S490-F509 WeakPolarHBondContact CA-O 3.38Å; G491-F509 PolarHBondContact N-O 2.69Å; G491-F509 PolarHBondContact O-N 2.87Å; L493-F509 HydrophobicContact CB-CD2 3.66Å; L493-F509 HydrophobicContact CB-CE2 3.9Å; L493-F509 HydrophobicContact CD1-CB 4.45Å; L493-F509 HydrophobicContact CD1-CD2 4.3Å; L493-F509 HydrophobicContact CD1-CG 4.4Å; L493-F509 HydrophobicContact CG-CD2 4.22Å; A495-F509 HydrophobicContact CB-CE2 3.96Å; A495-F509 HydrophobicContact CB-CZ 3.53Å; W501-F509 AromaticContact CD2-CE1 3.94Å; W501-F509 HydrophobicContact CD2-CE1 3.94Å; W501-F509 HydrophobicContact CD2-CZ 4.05Å; W501-F509 AromaticContact CE2-CE1 3.53Å; W501-F509 AromaticContact CE2-CZ 3.96Å; W501-F509 HydrophobicContact CE3-CE1 4.22Å; W501-F509 HydrophobicContact CG-CZ 4.41Å; W501-F509 AromaticContact CH2-CE1 3.83Å; W501-F509 HydrophobicContact CH2-CE1 3.83Å; W501-F509 HydrophobicContact CZ2-CD1 4.32Å; W501-F509 AromaticContact CZ2-CE1 3.51Å; W501-F509 HydrophobicContact CZ2-CE1 3.51Å; W501-F509 HydrophobicContact CZ2-CZ 4.38Å; W501-F509 HydrophobicContact CZ3-CE1 4.17Å; W501-F509 AromaticContact NE1-CE1 3.98Å; R507-F509 HydrophobicContact CB-CD2 4.12Å; R507-F509 HydrophobicContact CB-CE2 3.67Å; R507-F509 HydrophobicContact CB-CZ 4.3Å; R507-F509 HydrophobicContact CG-CE2 4.45Å; R507-F509 WeakPolarHBondContact O-CD2 3.25Å; F509-M521 HydrophobicContact CB-CE 3.84Å; F509-M521 HydrophobicContact CB-SD 4.2Å; F509-M521 HydrophobicContact CD1-CE 3.56Å; F509-M521 HydrophobicContact CD1-CG 3.98Å; F509-M521 HydrophobicContact CD1-SD 3.86Å; F509-M521 HydrophobicContact CE1-CE 4.24Å; F509-M521 HydrophobicContact CE1-CG 4.34Å; F509-M521 HydrophobicContact CG-CE 3.84Å; F509-M521 HydrophobicContact CG-SD 4.43Å; F509-C522 CarbonylContact C-O 3.58Å; F509-C522 WeakPolarHBondContact CA-O 3.48Å; F509-F569 HydrophobicContact CE1-CE1 4.05Å; F509-F569 HydrophobicContact CZ-CE1 4.17Å; F509-W580 HydrophobicContact CB-CH2 3.89Å; F509-W580 HydrophobicContact CB-CZ2 4.33Å
510	L	91.9	Very high	84.1	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.1	165.6	-74.7	66	0	0	0	108.6	L361 F363 P419 M487 H489 Y508 V512 C522 Y524	L361-L510 HydrophobicContact CD1-CD2 3.87Å; F363-L510 HydrophobicContact CZ-CD2 4.03Å; P419-L510 HydrophobicContact CB-CD1 4.07Å; P419-L510 HydrophobicContact CB-CD2 3.87Å; P419-L510 HydrophobicContact CG-CD2 4.11Å; M487-L510 HydrophobicContact CG-CB 4.43Å; M487-L510 HydrophobicContact CG-CD2 4.18Å; M487-L510 HydrophobicContact CG-CG 4.26Å; M487-L510 HydrophobicContact SD-CB 4.31Å; M487-L510 HydrophobicContact SD-CD2 3.34Å; M487-L510 WeakPolarHBondContact SD-CD2 3.39Å; M487-L510 HydrophobicContact SD-CG 3.52Å; M487-L510 VanDerWaalsContact SD-CG 3.52Å; H489-L510 WeakPolarHBondContact O-CA 3.42Å; Y508-L510 HydrophobicContact CD1-CD1 3.6Å; Y508-L510 HydrophobicContact CE1-CD1 3.46Å; Y508-L510 VanDerWaalsContact CE1-CD1 3.46Å; L510-V512 HydrophobicContact CB-CG2 3.77Å; L510-V512 HydrophobicContact CD2-CG2 4.43Å; L510-C522 PolarHBondContact N-O 3.32Å; L510-C522 PolarHBondContact O-N 3.34Å; L510-Y524 HydrophobicContact CB-CD2 4.49Å; L510-Y524 HydrophobicContact CB-CE2 4Å; L510-Y524 HydrophobicContact CD1-CD2 3.72Å; L510-Y524 HydrophobicContact CD1-CE2 4Å; L510-Y524 HydrophobicContact CD2-CE2 4.1Å; L510-Y524 HydrophobicContact CG-CD2 4.46Å; L510-Y524 HydrophobicContact CG-CE2 4.25Å
511	L	91.5	Very high	84.5	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	111.1	162.8	176	62.3	0	0	0	108.1	K488 H489 F519 L537 W580 A583 L584 A587	K488-L511 HydrophobicContact CB-CD2 3.99Å; K488-L511 HydrophobicContact CB-CG 4.07Å; K488-L511 PolarHBondContact N-O 2.85Å; H489-L511 HydrophobicContact CB-CB 4.39Å; H489-L511 PolarHBondContact O-N 3.43Å; L511-F519 HydrophobicContact CD1-CB 4.36Å; L511-L537 HydrophobicContact CD1-CD1 3.22Å; L511-W580 HydrophobicContact CB-CZ3 4.11Å; L511-A583 HydrophobicContact CD2-CB 3.71Å; L511-A583 WeakPolarHBondContact CD2-O 3.5Å; L511-L584 HydrophobicContact CD1-CD2 4.12Å; L511-L584 HydrophobicContact CD2-CD2 4.39Å; L511-A587 HydrophobicContact CD1-CB 4.1Å; L511-A587 HydrophobicContact CD2-CB 4.16Å
512	V	89.3	Confident	84.6	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.2	-173.9	-171.4	0	0	0	0	110.5	V359 L361 L510 V514 F519 A520	V359-V512 HydrophobicContact CG1-CB 3.55Å; V359-V512 HydrophobicContact CG1-CG1 3.6Å; V359-V512 HydrophobicContact CG1-CG2 3.76Å; L361-V512 HydrophobicContact CD1-CG1 4Å; L361-V512 HydrophobicContact CD1-CG2 3.81Å; L361-V512 HydrophobicContact CD2-CG1 4.02Å; L361-V512 HydrophobicContact CG-CG1 4.23Å; L510-V512 HydrophobicContact CB-CG2 3.77Å; L510-V512 HydrophobicContact CD2-CG2 4.43Å; V512-V514 HydrophobicContact CG1-CG2 4.38Å; V512-F519 CarbonylContact O-C 3.6Å; V512-F519 WeakPolarHBondContact O-CA 3.37Å; V512-A520 PolarHBondContact N-O 3.44Å; V512-A520 PolarHBondContact O-N 3.03Å
513	Q	83.9	Confident	84.8	Confident	9 Å²	9	33.4 Å²	33.4	4%	0.042	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	110.4	167.8	-172.9	171.1	36.4	0	0	107.9	N486 K488 S515 Q516 F519	N486-Q513 WeakPolarHBondContact O-CB 3.41Å; N486-Q513 PolarHBondContact O-N 2.72Å; K488-Q513 VanDerWaalsContact CE-CD 3.47Å; K488-Q513 HydrophobicContact CG-CB 4.43Å; Q513-S515 WeakPolarHBondContact CG-O 3.3Å; Q513-Q516 PolarHBondContact NE2-O 3.48Å; Q513-F519 HydrophobicContact CB-CD1 3.89Å; Q513-F519 HydrophobicContact CB-CE1 3.62Å; Q513-F519 HydrophobicContact CB-CZ 4.48Å; Q513-F519 HydrophobicContact CG-CD1 4.17Å; Q513-F519 HydrophobicContact CG-CE1 3.63Å; Q513-F519 HydrophobicContact CG-CZ 4Å
514	V	78.3	Confident	84.9	Confident	41 Å²	41	24.1 Å²	24.1	25%	0.248	11%	0.114	C	C	.	.	S	Bend	trans	-92.5	-46.9	-177.6	178	0	0	0	0	110.1	L354 D358 V359 V512 T518 A520	L354-V514 HydrophobicContact CD1-CB 4.19Å; L354-V514 HydrophobicContact CD1-CG1 4.17Å; L354-V514 HydrophobicContact CD1-CG2 4.02Å; L354-V514 HydrophobicContact CD2-CG1 3.83Å; D358-V514 HydrophobicContact CB-CG1 3.83Å; V359-V514 HydrophobicContact CB-CG2 4.49Å; V359-V514 HydrophobicContact CG1-CG2 4.02Å; V359-V514 HydrophobicContact CG2-CG2 4.01Å; V512-V514 HydrophobicContact CG1-CG2 4.38Å; V514-T518 PolarHBondContact N-O 2.92Å; V514-A520 HydrophobicContact CG2-CB 4.12Å
515	S	68.4	Low	84.8	Confident	44 Å²	44	28.3 Å²	28.3	31%	0.308	13%	0.13	S	C	.	.	S	Bend	trans	-118.8	-178.8	162	82.1	0	0	0	0	109	Q513 Y517 T518	Q513-S515 WeakPolarHBondContact CG-O 3.3Å; S515-Y517 PolarHBondContact O-N 3.12Å; S515-Y517 VanDerWaalsContact O-N 3.16Å; S515-Y517 PolarHBondContact OG-N 3.18Å; S515-Y517 VanDerWaalsContact OG-N 3.15Å; S515-T518 PolarHBondContact N-O 3.23Å; S515-T518 WeakPolarHBondContact OG-CB 3.19Å; S515-T518 PolarHBondContact OG-N 3.46Å; S515-T518 PolarHBondContact OG-OG1 2.97Å
516	Q	56.5	Low	84.7	Confident	28 Å²	28	26.7 Å²	26.7	13%	0.131	13%	0.125	C	C	.	.	S	Bend	trans	-58.2	-26.5	172.9	-79.5	-159.3	-7	0	0	113.4	R273 L319 L322 P323 V324 Q513	R273-Q516 PolarHBondContact NH2-O 3.35Å; L319-Q516 PolarHBondContact O-OE1 3.29Å; L319-Q516 VanDerWaalsContact O-OE1 3.12Å; L322-Q516 VanDerWaalsContact O-CD 3.23Å; L322-Q516 PolarHBondContact O-NE2 3.24Å; P323-Q516 VanDerWaalsContact C-NE2 3.32Å; P323-Q516 PolarHBondContact O-NE2 3.18Å; V324-Q516 HydrophobicContact CG2-CG 3.63Å; Q513-Q516 PolarHBondContact NE2-O 3.48Å
517	Y	60.4	Low	84.2	Confident	26 Å²	26	29.9 Å²	29.9	10%	0.102	14%	0.135	C	C	.	.	S	Bend	trans	-112.3	-38.2	-170.9	-65.7	-95.8	0	0	0	111.8	R273 M316 L319 E320 S515 F519	R273-Y517 HydrophobicContact CG-CE1 4.23Å; M316-Y517 HydrophobicContact CE-CD1 4.5Å; L319-Y517 HydrophobicContact CD2-CE1 4.12Å; L319-Y517 WeakPolarHBondContact CD2-OH 3.2Å; L319-Y517 WeakPolarHBondContact CG-OH 3.49Å; L319-Y517 PolarHBondContact O-OH 3.08Å; E320-Y517 VanDerWaalsContact CA-CE2 3.4Å; E320-Y517 HydrophobicContact CB-CD2 3.77Å; E320-Y517 HydrophobicContact CB-CE2 3.79Å; E320-Y517 HydrophobicContact CG-CD1 4.09Å; E320-Y517 HydrophobicContact CG-CD2 3.46Å; E320-Y517 VanDerWaalsContact CG-CD2 3.46Å; E320-Y517 HydrophobicContact CG-CE1 4.17Å; E320-Y517 HydrophobicContact CG-CE2 3.63Å; E320-Y517 HydrophobicContact CG-CG 3.83Å; E320-Y517 WeakPolarHBondContact OE1-CB 3.43Å; E320-Y517 VanDerWaalsContact OE1-CD1 3.3Å; E320-Y517 WeakPolarHBondContact OE1-CD1 3.25Å; S515-Y517 PolarHBondContact O-N 3.12Å; S515-Y517 VanDerWaalsContact O-N 3.16Å; S515-Y517 PolarHBondContact OG-N 3.18Å; S515-Y517 VanDerWaalsContact OG-N 3.15Å; Y517-F519 VanDerWaalsContact O-CD2 3.29Å; Y517-F519 WeakPolarHBondContact O-CD2 3.21Å; Y517-F519 PolarHBondContact O-N 3.26Å
518	T	75.6	Confident	83.8	Confident	34 Å²	34	34.6 Å²	34.6	21%	0.209	16%	0.156	C	C	.	.			trans	-81.5	100.1	-179.7	-28.7	0	0	0	0	110.3	L354 V514 S515	L354-T518 HydrophobicContact CD1-CG2 3.71Å; L354-T518 HydrophobicContact CD2-CG2 4.25Å; L354-T518 HydrophobicContact CG-CG2 4.03Å; V514-T518 PolarHBondContact N-O 2.92Å; S515-T518 PolarHBondContact N-O 3.23Å; S515-T518 WeakPolarHBondContact OG-CB 3.19Å; S515-T518 PolarHBondContact OG-N 3.46Å; S515-T518 PolarHBondContact OG-OG1 2.97Å
519	F	87.4	Confident	83.4	Confident	8 Å²	8	35 Å²	35	4%	0.035	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.1	169.2	-66.6	-90.7	0	0	0	110.6	K488 L511 V512 Q513 Y517 L537 A587	K488-F519 HydrophobicContact CD-CE1 4.49Å; K488-F519 HydrophobicContact CG-CD1 4.37Å; K488-F519 HydrophobicContact CG-CE1 3.9Å; L511-F519 HydrophobicContact CD1-CB 4.36Å; V512-F519 CarbonylContact O-C 3.6Å; V512-F519 WeakPolarHBondContact O-CA 3.37Å; Q513-F519 HydrophobicContact CB-CD1 3.89Å; Q513-F519 HydrophobicContact CB-CE1 3.62Å; Q513-F519 HydrophobicContact CB-CZ 4.48Å; Q513-F519 HydrophobicContact CG-CD1 4.17Å; Q513-F519 HydrophobicContact CG-CE1 3.63Å; Q513-F519 HydrophobicContact CG-CZ 4Å; Y517-F519 VanDerWaalsContact O-CD2 3.29Å; Y517-F519 WeakPolarHBondContact O-CD2 3.21Å; Y517-F519 PolarHBondContact O-N 3.26Å; F519-L537 HydrophobicContact CB-CB 4.35Å; F519-L537 HydrophobicContact CB-CD1 4.07Å; F519-L537 PolarHBondContact O-N 3.23Å; F519-A587 HydrophobicContact CB-CB 3.77Å; F519-A587 HydrophobicContact CD1-CB 3.75Å; F519-A587 HydrophobicContact CD2-CB 3.85Å; F519-A587 WeakPolarHBondContact CD2-O 3.36Å; F519-A587 HydrophobicContact CE1-CB 4.27Å; F519-A587 HydrophobicContact CE2-CB 4.36Å; F519-A587 HydrophobicContact CG-CB 3.51Å
520	A	89.5	Confident	82.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.3	177.3	0	0	0	0	0	110.8	L354 V359 V512 V514 M535	L354-A520 HydrophobicContact CD1-CB 4.26Å; V359-A520 HydrophobicContact CG1-CB 4.48Å; V512-A520 PolarHBondContact N-O 3.44Å; V512-A520 PolarHBondContact O-N 3.03Å; V514-A520 HydrophobicContact CG2-CB 4.12Å; A520-M535 CarbonylContact C-O 3.49Å; A520-M535 WeakPolarHBondContact CA-O 3.5Å
521	M	92.1	Very high	82.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	110.6	166.8	-176	57.2	156.5	0	0	107.9	L493 W501 F509 M535 L537 F569 W580	L493-M521 HydrophobicContact CD1-CE 3.56Å; W501-M521 HydrophobicContact CH2-CB 4.2Å; W501-M521 HydrophobicContact CH2-CG 3.9Å; W501-M521 WeakPolarHBondContact CH2-O 3.3Å; W501-M521 HydrophobicContact CZ3-CG 4.4Å; F509-M521 HydrophobicContact CB-CE 3.84Å; F509-M521 HydrophobicContact CB-SD 4.2Å; F509-M521 HydrophobicContact CD1-CE 3.56Å; F509-M521 HydrophobicContact CD1-CG 3.98Å; F509-M521 HydrophobicContact CD1-SD 3.86Å; F509-M521 HydrophobicContact CE1-CE 4.24Å; F509-M521 HydrophobicContact CE1-CG 4.34Å; F509-M521 HydrophobicContact CG-CE 3.84Å; F509-M521 HydrophobicContact CG-SD 4.43Å; M521-M535 HydrophobicContact CB-CE 4.31Å; M521-M535 PolarHBondContact N-O 2.91Å; M521-M535 PolarHBondContact O-N 3.24Å; M521-L537 HydrophobicContact CB-CD1 4.14Å; M521-L537 HydrophobicContact CB-CD2 4.38Å; M521-L537 HydrophobicContact CB-CG 4.24Å; M521-F569 HydrophobicContact CE-CD1 4.28Å; M521-F569 HydrophobicContact CE-CE1 3.69Å; M521-F569 HydrophobicContact CE-CZ 4.08Å; M521-F569 HydrophobicContact CG-CE1 4.48Å; M521-F569 HydrophobicContact CG-CZ 4.24Å; M521-W580 HydrophobicContact CE-CE3 3.98Å; M521-W580 HydrophobicContact CE-CH2 3.97Å; M521-W580 HydrophobicContact CE-CZ3 3.48Å; M521-W580 VanDerWaalsContact CE-CZ3 3.48Å; M521-W580 HydrophobicContact SD-CH2 4.31Å; M521-W580 HydrophobicContact SD-CZ3 3.78Å
522	C	91.8	Very high	82.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.9	-167.4	-77	0	0	0	0	111.8	V359 F509 L510 Y524 P531 L534	V359-C522 HydrophobicContact CG1-CB 4.48Å; F509-C522 CarbonylContact C-O 3.58Å; F509-C522 WeakPolarHBondContact CA-O 3.48Å; L510-C522 PolarHBondContact N-O 3.32Å; L510-C522 PolarHBondContact O-N 3.34Å; C522-Y524 HydrophobicContact CB-CD2 4.3Å; C522-Y524 HydrophobicContact CB-CE2 3.4Å; C522-P531 HydrophobicContact CB-CB 4.01Å; C522-L534 WeakPolarHBondContact SG-CB 3.4Å
523	S	91.9	Very high	82.3	Confident	1 Å²	1	46 Å²	46	1%	0.007	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.1	-180	65.3	0	0	0	0	111.6	W501 Y508 P531 Q532 E533	W501-S523 PolarHBondContact NE1-OG 2.73Å; Y508-S523 WeakPolarHBondContact O-CA 3.43Å; S523-P531 CarbonylContact O-C 3.58Å; S523-P531 WeakPolarHBondContact O-CA 3.47Å; S523-Q532 PolarHBondContact O-N 3.3Å; S523-E533 PolarHBondContact N-O 2.76Å; S523-E533 PolarHBondContact OG-N 3.2Å; S523-E533 PolarHBondContact OG-O 3.45Å
524	Y	89.3	Confident	82.5	Confident	8 Å²	8	47.3 Å²	47.3	3%	0.031	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	166	-173.3	-64.7	-99.6	0	0	0	112	V359 P419 Y508 L510 C522 A529 P531	V359-Y524 PolarHBondContact O-OH 2.8Å; P419-Y524 HydrophobicContact CB-CG 4.48Å; P419-Y524 HydrophobicContact CG-CD1 3.68Å; P419-Y524 HydrophobicContact CG-CE1 3.75Å; P419-Y524 HydrophobicContact CG-CG 4.08Å; Y508-Y524 PolarHBondContact O-N 2.71Å; L510-Y524 HydrophobicContact CB-CD2 4.49Å; L510-Y524 HydrophobicContact CB-CE2 4Å; L510-Y524 HydrophobicContact CD1-CD2 3.72Å; L510-Y524 HydrophobicContact CD1-CE2 4Å; L510-Y524 HydrophobicContact CD2-CE2 4.1Å; L510-Y524 HydrophobicContact CG-CD2 4.46Å; L510-Y524 HydrophobicContact CG-CE2 4.25Å; C522-Y524 HydrophobicContact CB-CD2 4.3Å; C522-Y524 HydrophobicContact CB-CE2 3.4Å; Y524-A529 WeakPolarHBondContact CE1-O 3.3Å; Y524-P531 HydrophobicContact CD1-CB 4.34Å; Y524-P531 HydrophobicContact CE1-CB 3.93Å; Y524-P531 HydrophobicContact CE1-CG 4.41Å; Y524-P531 HydrophobicContact CE2-CB 4.26Å
525	R	87.4	Confident	83	Confident	140 Å²	140	45.7 Å²	45.7	53%	0.528	21%	0.21	S	C	.	.			trans	-119.6	158.3	166.8	-65.2	-168	-172.6	179.2	8.4	109.1	Q532	R525-Q532 VanDerWaalsContact CZ-OE1 3.27Å; R525-Q532 VanDerWaalsContact NH2-CD 3.3Å
526	E	86.1	Confident	84	Confident	103 Å²	103	46.5 Å²	46.5	48%	0.481	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.8	142.5	160.3	-60.9	161.7	-132.3	0	0	110.8	L420 I448 K528	L420-E526 HydrophobicContact CD1-CG 4.43Å; I448-E526 HydrophobicContact CD1-CG 4.11Å; E526-K528 VanDerWaalsContact C-N 3.29Å; E526-K528 PolarHBondContact O-N 3.19Å
527	R	80.9	Confident	85.4	Confident	144 Å²	144	45.3 Å²	45.3	54%	0.543	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	26.9	173.6	-36.6	-170.4	-177.3	-170.9	3.5	115.3	E391 L420	E391-R527 WeakPolarHBondContact OE1-CB 3.27Å; E391-R527 VanDerWaalsContact OE1-CD 3.22Å; E391-R527 WeakPolarHBondContact OE1-CD 3.32Å; E391-R527 WeakPolarHBondContact OE1-CG 3.36Å; E391-R527 IonicContact OE1-NE 2.65Å; E391-R527 WeakPolarHBondContact OE2-CA 3.1Å; E391-R527 WeakPolarHBondContact OE2-CB 3.24Å; E391-R527 VanDerWaalsContact OE2-CG 3.29Å; E391-R527 WeakPolarHBondContact OE2-CG 3.28Å; L420-R527 PolarHBondContact O-N 2.91Å
528	K	84.3	Confident	86.4	Confident	128 Å²	128	50 Å²	50	56%	0.557	23%	0.226	S	C	*	.			trans	-135.9	134.2	174.6	-69.6	-157.5	167.3	-138	0	112.2	P419 E526	P419-K528 WeakPolarHBondContact CD-O 3.46Å; E526-K528 VanDerWaalsContact C-N 3.29Å; E526-K528 PolarHBondContact O-N 3.19Å
529	A	81.4	Confident	86.4	Confident	19 Å²	19	50.9 Å²	50.9	16%	0.157	24%	0.242	C	C	.	.	S	Bend	trans	-81.1	-36.4	172	0	0	0	0	0	112.3	T417 H418 Y524	T417-A529 WeakPolarHBondContact O-CA 3.43Å; T417-A529 VanDerWaalsContact O-CB 3.3Å; T417-A529 WeakPolarHBondContact O-CB 3.41Å; H418-A529 PolarHBondContact ND1-N 2.97Å; H418-A529 VanDerWaalsContact ND1-N 3.14Å; Y524-A529 WeakPolarHBondContact CE1-O 3.3Å
530	E	83.6	Confident	86.4	Confident	110 Å²	110	51.4 Å²	51.4	51%	0.514	24%	0.244	S	C	.	.	S	Bend	trans	-81.4	147.1	178.4	-71.1	176.8	-153.9	0	0	113.1	K356	K356-E530 HydrophobicContact CB-CG 4.39Å
531	P	86.6	Confident	86.2	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.013	26%	0.257	C	S	.	.			trans	-67.8	139.8	170	28.4	-34	0	0	0	112.2	K356 C522 S523 Y524 L534	K356-P531 PolarHBondContact NZ-O 2.94Å; C522-P531 HydrophobicContact CB-CB 4.01Å; S523-P531 CarbonylContact O-C 3.58Å; S523-P531 WeakPolarHBondContact O-CA 3.47Å; Y524-P531 HydrophobicContact CD1-CB 4.34Å; Y524-P531 HydrophobicContact CE1-CB 3.93Å; Y524-P531 HydrophobicContact CE1-CG 4.41Å; Y524-P531 HydrophobicContact CE2-CB 4.26Å; P531-L534 HydrophobicContact CG-CB 4.45Å; P531-L534 HydrophobicContact CG-CD2 4.15Å
532	Q	85.4	Confident	86.1	Confident	66 Å²	66	53.5 Å²	53.5	31%	0.308	26%	0.257	S	S	.	.	S	Bend	trans	-65.3	-56.1	172.9	179.3	-171.9	-38.1	0	0	110.4	K356 S523 R525	K356-Q532 PolarHBondContact NZ-O 3.02Å; S523-Q532 PolarHBondContact O-N 3.3Å; R525-Q532 VanDerWaalsContact CZ-OE1 3.27Å; R525-Q532 VanDerWaalsContact NH2-CD 3.3Å
533	E	86.9	Confident	86	Confident	56 Å²	56	55.9 Å²	55.9	26%	0.262	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.8	179.8	-74.2	157	-113.7	0	0	107	W501 S523	W501-E533 VanDerWaalsContact CA-OE2 3.25Å; W501-E533 WeakPolarHBondContact CA-OE2 3.28Å; W501-E533 PolarHBondContact N-OE2 3.46Å; W501-E533 VanDerWaalsContact N-OE2 3.11Å; S523-E533 PolarHBondContact N-O 2.76Å; S523-E533 PolarHBondContact OG-N 3.2Å; S523-E533 PolarHBondContact OG-O 3.45Å
534	L	88.6	Confident	85.9	Confident	36 Å²	36	57.4 Å²	57.4	19%	0.188	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	156.1	179.4	69.3	86.7	0	0	0	110.6	K356 C522 P531	K356-L534 HydrophobicContact CG-CD2 4.11Å; C522-L534 WeakPolarHBondContact SG-CB 3.4Å; P531-L534 HydrophobicContact CG-CB 4.45Å; P531-L534 HydrophobicContact CG-CD2 4.15Å
535	M	89.8	Confident	85.6	Confident	7 Å²	7	58.3 Å²	58.3	3%	0.034	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	119.9	175.2	-173.7	-178	80.3	0	0	109.4	V500 W501 A520 M521 L537 Y540 V567	V500-M535 HydrophobicContact CG2-CB 4.18Å; V500-M535 HydrophobicContact CG2-CG 4.09Å; V500-M535 HydrophobicContact CG2-SD 3.64Å; W501-M535 HydrophobicContact CH2-CB 3.52Å; W501-M535 HydrophobicContact CH2-SD 4.46Å; W501-M535 HydrophobicContact CZ2-CB 4.49Å; W501-M535 HydrophobicContact CZ3-CB 3.86Å; W501-M535 HydrophobicContact CZ3-CE 4.25Å; W501-M535 HydrophobicContact CZ3-CG 4.49Å; W501-M535 HydrophobicContact CZ3-SD 3.85Å; A520-M535 CarbonylContact C-O 3.49Å; A520-M535 WeakPolarHBondContact CA-O 3.5Å; M521-M535 HydrophobicContact CB-CE 4.31Å; M521-M535 PolarHBondContact N-O 2.91Å; M521-M535 PolarHBondContact O-N 3.24Å; M535-L537 HydrophobicContact CE-CD2 3.65Å; M535-L537 HydrophobicContact CE-CG 4.49Å; M535-Y540 HydrophobicContact CE-CE1 4.31Å; M535-Y540 HydrophobicContact CG-CE2 4.3Å; M535-Y540 HydrophobicContact SD-CE1 4.04Å; M535-Y540 HydrophobicContact SD-CE2 4.37Å; M535-V567 HydrophobicContact SD-CG2 3.71Å
536	Q	87.6	Confident	85.2	Confident	61 Å²	61	59.4 Å²	59.4	29%	0.285	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	137.3	165.6	-68.7	165.5	-23.8	0	0	109	D352 L354 Y540	D352-Q536 PolarHBondContact O-NE2 3.27Å; L354-Q536 HydrophobicContact CD1-CG 4.03Å; L354-Q536 HydrophobicContact CG-CG 4.22Å; Q536-Y540 WeakPolarHBondContact O-CE2 3.43Å
537	L	86.1	Confident	84.7	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.016	30%	0.298	C	S	.	.			trans	-93.6	2.7	-177.5	-76.1	162.9	0	0	0	114.3	L511 F519 M521 M535 G539 Y540 L584 A587 T588	L511-L537 HydrophobicContact CD1-CD1 3.22Å; F519-L537 HydrophobicContact CB-CB 4.35Å; F519-L537 HydrophobicContact CB-CD1 4.07Å; F519-L537 PolarHBondContact O-N 3.23Å; M521-L537 HydrophobicContact CB-CD1 4.14Å; M521-L537 HydrophobicContact CB-CD2 4.38Å; M521-L537 HydrophobicContact CB-CG 4.24Å; M535-L537 HydrophobicContact CE-CD2 3.65Å; M535-L537 HydrophobicContact CE-CG 4.49Å; L537-G539 PolarHBondContact O-N 3.39Å; L537-Y540 PolarHBondContact O-N 3.12Å; L537-L584 HydrophobicContact CD1-CD2 3.64Å; L537-L584 HydrophobicContact CD2-CD2 3.84Å; L537-L584 HydrophobicContact CG-CD2 4.42Å; L537-A587 HydrophobicContact CD1-CB 4.25Å; L537-T588 HydrophobicContact CB-CG2 4.38Å; L537-T588 HydrophobicContact CD2-CG2 4.48Å
538	E	81.4	Confident	84.2	Confident	124 Å²	124	55.2 Å²	55.2	58%	0.579	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	130	-179.7	-167.8	-175	141.8	0	0	111.7	Y540 K562	E538-Y540 PolarHBondContact O-N 3.38Å; E538-K562 WeakPolarHBondContact O-CD 3.2Å; E538-K562 WeakPolarHBondContact O-CE 3.36Å; E538-K562 PolarHBondContact O-NZ 2.93Å
539	G	77	Confident	83	Confident	53 Å²	53	56.4 Å²	56.4	55%	0.546	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	14.5	-178	0	0	0	0	0	115.1	L537 K562	L537-G539 PolarHBondContact O-N 3.39Å; G539-K562 VanDerWaalsContact O-CG 3.3Å; G539-K562 WeakPolarHBondContact O-CG 3.19Å
540	Y	86.2	Confident	82.3	Confident	18 Å²	18	59 Å²	59	7%	0.071	34%	0.335	C	S	.	.			trans	-89.8	145.3	166.6	-75.1	-97.7	0	0	0	110.8	M535 Q536 L537 E538 A560 V561 K562 D565 T588	M535-Y540 HydrophobicContact CE-CE1 4.31Å; M535-Y540 HydrophobicContact CG-CE2 4.3Å; M535-Y540 HydrophobicContact SD-CE1 4.04Å; M535-Y540 HydrophobicContact SD-CE2 4.37Å; Q536-Y540 WeakPolarHBondContact O-CE2 3.43Å; L537-Y540 PolarHBondContact O-N 3.12Å; E538-Y540 PolarHBondContact O-N 3.38Å; Y540-A560 HydrophobicContact CD1-CB 4.03Å; Y540-V561 CarbonylContact C-O 3.53Å; Y540-V561 VanDerWaalsContact CA-O 3.24Å; Y540-V561 WeakPolarHBondContact CA-O 3.42Å; Y540-K562 HydrophobicContact CD1-CB 3.69Å; Y540-K562 HydrophobicContact CD2-CB 4.14Å; Y540-K562 HydrophobicContact CD2-CD 3.91Å; Y540-K562 HydrophobicContact CE1-CB 3.67Å; Y540-K562 HydrophobicContact CE2-CB 4.14Å; Y540-K562 HydrophobicContact CE2-CD 3.77Å; Y540-K562 HydrophobicContact CG-CB 3.93Å; Y540-D565 PolarHBondContact OH-OD2 3.39Å; Y540-T588 WeakPolarHBondContact O-CB 3.23Å; Y540-T588 WeakPolarHBondContact O-CG2 3.45Å
541	T	85.8	Confident	82	Confident	44 Å²	44	56.3 Å²	56.3	27%	0.27	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	153.1	160.6	60.1	0	0	0	0	109.4	A560 V561 Q590 Y592	T541-A560 CarbonylContact O-C 3.58Å; T541-A560 VanDerWaalsContact O-CA 3.25Å; T541-A560 WeakPolarHBondContact O-CA 3.5Å; T541-V561 PolarHBondContact N-O 2.83Å; T541-V561 PolarHBondContact O-N 2.92Å; T541-Q590 HydrophobicContact CG2-CB 4.02Å; T541-Y592 HydrophobicContact CG2-CE1 4.23Å
542	V	90.7	Very high	81.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.7	177.4	176.9	0	0	0	0	110.6	F558 N559 A560 V581 L584 T588 Q590 P594	V542-F558 HydrophobicContact CG1-CD2 4.17Å; V542-N559 VanDerWaalsContact CA-O 3.24Å; V542-N559 WeakPolarHBondContact CA-O 3.49Å; V542-N559 WeakPolarHBondContact CG1-O 3.43Å; V542-A560 HydrophobicContact CG2-CB 3.89Å; V542-V581 HydrophobicContact CG1-CG1 4.27Å; V542-V581 HydrophobicContact CG1-CG2 4.32Å; V542-L584 HydrophobicContact CB-CB 4.28Å; V542-L584 HydrophobicContact CG1-CB 4.18Å; V542-L584 HydrophobicContact CG1-CD1 4.23Å; V542-L584 HydrophobicContact CG2-CB 3.85Å; V542-L584 HydrophobicContact CG2-CD1 4.35Å; V542-T588 HydrophobicContact CG2-CG2 4.26Å; V542-Q590 PolarHBondContact O-NE2 3.17Å; V542-Q590 PolarHBondContact O-OE1 3.02Å; V542-P594 WeakPolarHBondContact O-CG 3.34Å
543	D	88.6	Confident	80.4	Confident	51 Å²	51	62.9 Å²	62.9	27%	0.273	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	156.5	179.5	-93.2	-55	0	0	0	113.2	F558 N559 Y592	D543-F558 CarbonylContact O-C 3.55Å; D543-F558 VanDerWaalsContact O-CA 3.28Å; D543-F558 WeakPolarHBondContact O-CA 3.42Å; D543-F558 WeakPolarHBondContact O-CB 3.4Å; D543-N559 PolarHBondContact N-O 2.96Å; D543-N559 PolarHBondContact O-N 2.88Å; D543-Y592 WeakPolarHBondContact OD2-CE2 3.45Å; D543-Y592 VanDerWaalsContact OD2-CZ 3.31Å; D543-Y592 PolarHBondContact OD2-OH 3.02Å
544	Y	89.3	Confident	79.9	Confident	32 Å²	32	60.9 Å²	60.9	13%	0.125	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	131.7	173.3	-65.2	-88	0	0	0	110.7	R577 V581 P594 I595 Q596 P597	Y544-R577 HydrophobicContact CD1-CG 4.14Å; Y544-R577 HydrophobicContact CE1-CG 3.99Å; Y544-V581 HydrophobicContact CD1-CG2 4.17Å; Y544-V581 HydrophobicContact CD2-CG1 4.21Å; Y544-V581 HydrophobicContact CE1-CB 4.11Å; Y544-V581 HydrophobicContact CE1-CG1 4.3Å; Y544-V581 HydrophobicContact CE1-CG2 3.88Å; Y544-V581 HydrophobicContact CE2-CB 4.32Å; Y544-V581 HydrophobicContact CE2-CG1 3.64Å; Y544-P594 HydrophobicContact CD2-CB 3.91Å; Y544-P594 HydrophobicContact CE2-CB 3.76Å; Y544-I595 WeakPolarHBondContact CD2-O 3.49Å; Y544-Q596 HydrophobicContact CE1-CG 3.9Å; Y544-Q596 HydrophobicContact CE2-CB 4.45Å; Y544-Q596 HydrophobicContact CE2-CG 3.71Å; Y544-Q596 VanDerWaalsContact OH-CG 3.29Å; Y544-Q596 WeakPolarHBondContact OH-CG 3.48Å; Y544-Q596 PolarHBondContact OH-NE2 2.9Å; Y544-P597 HydrophobicContact CG-CG 4.42Å
545	C	84.8	Confident	79.5	Confident	27 Å²	27	66.1 Å²	66.1	18%	0.182	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	153.9	179.6	-168.3	0	0	0	0	111.1	F557 N559	C545-F557 HydrophobicContact CB-CB 4.12Å; C545-F557 PolarHBondContact N-O 3.43Å; C545-F557 VanDerWaalsContact N-O 3.09Å; C545-F557 VanDerWaalsContact O-O 3.14Å; C545-N559 WeakPolarHBondContact CB-OD1 3.46Å; C545-N559 PolarHBondContact SG-ND2 3.25Å; C545-N559 VanDerWaalsContact SG-ND2 3.44Å
546	Q	78	Confident	79.3	Confident	163 Å²	163	66.9 Å²	66.9	76%	0.762	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-75.7	154.7	165.6	-63.9	-172.5	7.8	0	0	110.3	Q548	Q546-Q548 PolarHBondContact O-N 2.85Å
547	P	75.1	Confident	79.4	Confident	88 Å²	88	64.3 Å²	64.3	57%	0.571	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-58.8	126.3	178	-24.9	35.3	0	0	0	112.8	F557	P547-F557 HydrophobicContact CB-CD2 3.85Å; P547-F557 HydrophobicContact CB-CE2 3.82Å; P547-F557 HydrophobicContact CG-CD2 4.11Å; P547-F557 HydrophobicContact CG-CE2 4.43Å
548	Q	70.3	Confident	79.7	Confident	71 Å²	71	64.1 Å²	64.1	33%	0.332	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-83.4	121.5	-179.3	-69.4	-179.6	2	0	0	111	Q546 G550 L551 T568	Q546-Q548 PolarHBondContact O-N 2.85Å; Q548-G550 PolarHBondContact O-N 3.09Å; Q548-G550 VanDerWaalsContact O-N 3.12Å; Q548-L551 HydrophobicContact CB-CD1 4.24Å; Q548-L551 PolarHBondContact O-N 3.36Å; Q548-T568 PolarHBondContact NE2-OG1 3.37Å
549	T	59.2	Low	80.2	Confident	153 Å²	153	59.4 Å²	59.4	94%	0.939	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	109.1	180	49.9	0	0	0	0	111.3
550	G	67.6	Low	80.9	Confident	75 Å²	75	57 Å²	57	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.4	-16.2	176.1	0	0	0	0	0	114	Q548	Q548-G550 PolarHBondContact O-N 3.09Å; Q548-G550 VanDerWaalsContact O-N 3.12Å
551	L	77.6	Confident	81	Confident	53 Å²	53	59 Å²	59	28%	0.277	34%	0.34	S	S	.	.			trans	-90.6	132.4	174.2	-60.7	179.4	0	0	0	110.4	V496 W504 Q548 F557 T568	V496-L551 HydrophobicContact CG1-CD1 4.47Å; W504-L551 HydrophobicContact CB-CD2 4.16Å; W504-L551 HydrophobicContact CD2-CB 4.33Å; W504-L551 HydrophobicContact CD2-CD1 4.09Å; W504-L551 HydrophobicContact CD2-CD2 4Å; W504-L551 HydrophobicContact CD2-CG 4.37Å; W504-L551 HydrophobicContact CE3-CD1 3.95Å; W504-L551 HydrophobicContact CE3-CD2 4.42Å; W504-L551 HydrophobicContact CG-CD2 3.91Å; W504-L551 HydrophobicContact CH2-CD1 3.92Å; W504-L551 HydrophobicContact CZ2-CB 3.99Å; W504-L551 HydrophobicContact CZ2-CD1 4.07Å; W504-L551 HydrophobicContact CZ3-CD1 3.87Å; Q548-L551 HydrophobicContact CB-CD1 4.24Å; Q548-L551 PolarHBondContact O-N 3.36Å; L551-F557 HydrophobicContact CB-CE1 4.48Å; L551-F557 HydrophobicContact CD1-CE1 4.17Å; L551-T568 HydrophobicContact CD1-CG2 4.48Å
552	Q	70.8	Confident	81	Confident	175 Å²	175	61 Å²	61	82%	0.818	35%	0.345	S	S	*	.			trans	-105.5	131.8	177.6	-67.4	-174.5	-4.2	0	0	111	W504	W504-Q552 PolarHBondContact NE1-O 3.21Å
553	G	68.1	Low	80.3	Confident	30 Å²	30	70.5 Å²	70.5	31%	0.309	39%	0.389	S	S	.	.	S	Bend	trans	91.8	144.2	-175.2	0	0	0	0	0	112.8	W504	W504-G553 WeakPolarHBondContact CZ2-O 3.38Å
554	G	75.3	Confident	79.6	Confident	15 Å²	15	71.7 Å²	71.7	16%	0.155	41%	0.414	C	S	.	.			trans	80	132.9	-163.1	0	0	0	0	0	111.9	C571 D572	G554-C571 CarbonylContact C-O 3.57Å; G554-C571 WeakPolarHBondContact CA-O 3.43Å; G554-D572 VanDerWaalsContact CA-OD1 3.3Å; G554-D572 WeakPolarHBondContact CA-OD1 3.33Å; G554-D572 PolarHBondContact N-OD1 2.86Å; G554-D572 VanDerWaalsContact N-OD1 3.13Å
555	Q	79.6	Confident	79.4	Confident	146 Å²	146	70.5 Å²	70.5	68%	0.682	41%	0.41	S	S	*	.	S	Bend	trans	-99.1	-31.3	174.1	-62.1	-166.5	31	0	0	112	C571	Q555-C571 PolarHBondContact N-O 3.32Å
556	V	86.8	Confident	79.6	Confident	22 Å²	22	73 Å²	73	13%	0.133	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.3	-172.6	-68.9	0	0	0	0	110.9	A570 C571 D573 E574 R577	V556-A570 VanDerWaalsContact O-CA 3.25Å; V556-A570 WeakPolarHBondContact O-CA 3.4Å; V556-A570 WeakPolarHBondContact O-CB 3.36Å; V556-C571 WeakPolarHBondContact CG2-O 3.35Å; V556-C571 PolarHBondContact N-O 2.76Å; V556-C571 VanDerWaalsContact N-O 3.16Å; V556-C571 PolarHBondContact O-N 3.49Å; V556-C571 VanDerWaalsContact O-N 3.12Å; V556-D573 WeakPolarHBondContact CG2-O 3.31Å; V556-E574 HydrophobicContact CG1-CB 4.27Å; V556-R577 HydrophobicContact CG2-CB 3.9Å
557	F	90.2	Very high	80.2	Confident	7 Å²	7	65.2 Å²	65.2	3%	0.031	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	150.3	-165	-71	-110.2	0	0	0	111.9	W504 C545 P547 L551 T568 F569 A570 R577	W504-F557 HydrophobicContact CH2-CD1 4.38Å; W504-F557 AromaticContact CH2-CE1 3.77Å; W504-F557 HydrophobicContact CH2-CE1 3.77Å; W504-F557 AromaticContact CZ2-CE1 3.99Å; W504-F557 HydrophobicContact CZ2-CE1 3.99Å; W504-F557 HydrophobicContact CZ2-CZ 4.35Å; C545-F557 HydrophobicContact CB-CB 4.12Å; C545-F557 PolarHBondContact N-O 3.43Å; C545-F557 VanDerWaalsContact N-O 3.09Å; C545-F557 VanDerWaalsContact O-O 3.14Å; P547-F557 HydrophobicContact CB-CD2 3.85Å; P547-F557 HydrophobicContact CB-CE2 3.82Å; P547-F557 HydrophobicContact CG-CD2 4.11Å; P547-F557 HydrophobicContact CG-CE2 4.43Å; L551-F557 HydrophobicContact CB-CE1 4.48Å; L551-F557 HydrophobicContact CD1-CE1 4.17Å; F557-T568 HydrophobicContact CD1-CG2 3.99Å; F557-F569 WeakPolarHBondContact CA-O 3.36Å; F557-A570 HydrophobicContact CD1-CB 3.75Å; F557-A570 HydrophobicContact CD2-CB 4.13Å; F557-A570 HydrophobicContact CE1-CB 3.75Å; F557-A570 HydrophobicContact CE2-CB 4.12Å; F557-A570 HydrophobicContact CG-CB 3.94Å; F557-A570 HydrophobicContact CZ-CB 3.94Å; F557-R577 WeakPolarHBondContact O-CD 3.45Å; F557-R577 PolarHBondContact O-NH1 2.95Å
558	F	92.4	Very high	80.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	151.8	171.4	65.4	-85.8	0	0	0	109.8	L493 V542 D543 F569 R577 W580 V581 L584	L493-F558 HydrophobicContact CD1-CZ 3.9Å; L493-F558 HydrophobicContact CD2-CE1 4.27Å; L493-F558 HydrophobicContact CD2-CZ 4.31Å; V542-F558 HydrophobicContact CG1-CD2 4.17Å; D543-F558 CarbonylContact O-C 3.55Å; D543-F558 VanDerWaalsContact O-CA 3.28Å; D543-F558 WeakPolarHBondContact O-CA 3.42Å; D543-F558 WeakPolarHBondContact O-CB 3.4Å; F558-F569 HydrophobicContact CD1-CB 4.11Å; F558-F569 HydrophobicContact CD2-CB 3.95Å; F558-F569 HydrophobicContact CD2-CD2 4.15Å; F558-F569 HydrophobicContact CD2-CG 4.39Å; F558-F569 HydrophobicContact CE1-CB 3.72Å; F558-F569 HydrophobicContact CE2-CB 3.52Å; F558-F569 AromaticContact CE2-CD2 3.73Å; F558-F569 HydrophobicContact CE2-CD2 3.73Å; F558-F569 AromaticContact CE2-CG 3.75Å; F558-F569 HydrophobicContact CE2-CG 3.75Å; F558-F569 HydrophobicContact CG-CB 4.23Å; F558-F569 HydrophobicContact CZ-CB 3.42Å; F558-F569 VanDerWaalsContact CZ-CB 3.42Å; F558-F569 HydrophobicContact CZ-CD2 4.39Å; F558-F569 AromaticContact CZ-CG 3.94Å; F558-F569 HydrophobicContact CZ-CG 3.94Å; F558-F569 PolarHBondContact N-O 3.22Å; F558-F569 WeakPolarHBondContact O-CA 3.32Å; F558-F569 PolarHBondContact O-N 3.15Å; F558-F569 VanDerWaalsContact O-O 3.06Å; F558-R577 HydrophobicContact CD1-CG 3.91Å; F558-W580 HydrophobicContact CE1-CB 4.02Å; F558-W580 HydrophobicContact CE1-CG 4.46Å; F558-W580 HydrophobicContact CE2-CB 4.27Å; F558-W580 HydrophobicContact CZ-CB 3.65Å; F558-W580 HydrophobicContact CZ-CG 4.04Å; F558-V581 HydrophobicContact CB-CG2 3.65Å; F558-V581 HydrophobicContact CD1-CG2 4.34Å; F558-V581 HydrophobicContact CD2-CG2 3.99Å; F558-V581 HydrophobicContact CG-CG2 3.75Å; F558-L584 HydrophobicContact CD2-CD1 4.26Å; F558-L584 HydrophobicContact CE2-CD1 3.54Å; F558-L584 HydrophobicContact CZ-CD1 4.4Å
559	N	91.6	Very high	82	Confident	25 Å²	25	58 Å²	58	13%	0.134	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.6	-174.9	-62	-10.1	0	0	0	110.7	V542 D543 C545 V561 L566 V567	V542-N559 VanDerWaalsContact CA-O 3.24Å; V542-N559 WeakPolarHBondContact CA-O 3.49Å; V542-N559 WeakPolarHBondContact CG1-O 3.43Å; D543-N559 PolarHBondContact N-O 2.96Å; D543-N559 PolarHBondContact O-N 2.88Å; C545-N559 WeakPolarHBondContact CB-OD1 3.46Å; C545-N559 PolarHBondContact SG-ND2 3.25Å; C545-N559 VanDerWaalsContact SG-ND2 3.44Å; N559-V561 HydrophobicContact CB-CG2 4.37Å; N559-L566 HydrophobicContact CB-CD1 4.01Å; N559-V567 CarbonylContact C-O 3.46Å; N559-V567 WeakPolarHBondContact CA-O 3.49Å
560	A	91.4	Very high	83.5	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.3	159.4	0	0	0	0	0	109.4	Y540 T541 V542 V567 F569	Y540-A560 HydrophobicContact CD1-CB 4.03Å; T541-A560 CarbonylContact O-C 3.58Å; T541-A560 VanDerWaalsContact O-CA 3.25Å; T541-A560 WeakPolarHBondContact O-CA 3.5Å; V542-A560 HydrophobicContact CG2-CB 3.89Å; A560-V567 PolarHBondContact N-O 2.85Å; A560-V567 PolarHBondContact O-N 2.83Å; A560-F569 HydrophobicContact CB-CE2 4.04Å
561	V	87.6	Confident	84.6	Confident	60 Å²	60	47.1 Å²	47.1	36%	0.364	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.2	-172.6	-162.5	0	0	0	0	110.3	Y540 T541 N559 L566	Y540-V561 CarbonylContact C-O 3.53Å; Y540-V561 VanDerWaalsContact CA-O 3.24Å; Y540-V561 WeakPolarHBondContact CA-O 3.42Å; T541-V561 PolarHBondContact N-O 2.83Å; T541-V561 PolarHBondContact O-N 2.92Å; N559-V561 HydrophobicContact CB-CG2 4.37Å; V561-L566 HydrophobicContact CG2-CD1 3.85Å
562	K	85.4	Confident	85	Confident	88 Å²	88	47.9 Å²	47.9	38%	0.383	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	164.1	167.9	-177.7	161.7	-172.2	173	0	108.1	E538 G539 Y540 G564 D565	E538-K562 WeakPolarHBondContact O-CD 3.2Å; E538-K562 WeakPolarHBondContact O-CE 3.36Å; E538-K562 PolarHBondContact O-NZ 2.93Å; G539-K562 VanDerWaalsContact O-CG 3.3Å; G539-K562 WeakPolarHBondContact O-CG 3.19Å; Y540-K562 HydrophobicContact CD1-CB 3.69Å; Y540-K562 HydrophobicContact CD2-CB 4.14Å; Y540-K562 HydrophobicContact CD2-CD 3.91Å; Y540-K562 HydrophobicContact CE1-CB 3.67Å; Y540-K562 HydrophobicContact CE2-CB 4.14Å; Y540-K562 HydrophobicContact CE2-CD 3.77Å; Y540-K562 HydrophobicContact CG-CB 3.93Å; K562-G564 PolarHBondContact O-N 3.42Å; K562-D565 PolarHBondContact N-O 3.23Å; K562-D565 PolarHBondContact O-N 2.91Å
563	E	77.3	Confident	85.7	Confident	198 Å²	198	43.9 Å²	43.9	93%	0.925	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	112.3	177.8	-63	-166.3	148.2	0	0	111.4
564	G	74.1	Confident	86.5	Confident	76 Å²	76	46.4 Å²	46.4	78%	0.784	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	6.9	-178.3	0	0	0	0	0	116.9	K562	K562-G564 PolarHBondContact O-N 3.42Å
565	D	84.8	Confident	87	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.043	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.7	171.6	-158.4	3	0	0	0	112.6	H498 R499 Y540 K562	H498-D565 WeakPolarHBondContact CB-OD1 3.23Å; H498-D565 PolarHBondContact N-OD1 3.23Å; R499-D565 WeakPolarHBondContact CB-OD2 3.45Å; R499-D565 VanDerWaalsContact CD-OD2 3.22Å; R499-D565 WeakPolarHBondContact CD-OD2 3.44Å; R499-D565 HydrophobicContact CG-CB 4.47Å; R499-D565 WeakPolarHBondContact CG-OD2 3.16Å; R499-D565 PolarHBondContact N-OD1 3.13Å; Y540-D565 PolarHBondContact OH-OD2 3.39Å; K562-D565 PolarHBondContact N-O 3.23Å; K562-D565 PolarHBondContact O-N 2.91Å
566	L	88.3	Confident	87.3	Confident	78 Å²	78	46.2 Å²	46.2	41%	0.408	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	125.6	-177.3	171.1	63.9	0	0	0	108.3	G497 H498 N559 V561	G497-L566 VanDerWaalsContact CA-O 3.3Å; G497-L566 WeakPolarHBondContact CA-O 3.45Å; H498-L566 PolarHBondContact N-O 3.33Å; N559-L566 HydrophobicContact CB-CD1 4.01Å; V561-L566 HydrophobicContact CG2-CD1 3.85Å
567	V	90.8	Very high	87.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	112.3	174.5	-169.5	0	0	0	0	109.3	V496 V500 W501 M535 N559 A560 F569	V496-V567 CarbonylContact O-C 3.57Å; V496-V567 WeakPolarHBondContact O-CA 3.31Å; V500-V567 HydrophobicContact CG2-CG2 4.11Å; W501-V567 HydrophobicContact CE3-CG1 3.92Å; W501-V567 HydrophobicContact CZ3-CG1 4.26Å; M535-V567 HydrophobicContact SD-CG2 3.71Å; N559-V567 CarbonylContact C-O 3.46Å; N559-V567 WeakPolarHBondContact CA-O 3.49Å; A560-V567 PolarHBondContact N-O 2.85Å; A560-V567 PolarHBondContact O-N 2.83Å; V567-F569 HydrophobicContact CB-CE2 3.94Å; V567-F569 HydrophobicContact CB-CZ 4.31Å; V567-F569 HydrophobicContact CG1-CD2 4.17Å; V567-F569 HydrophobicContact CG1-CE1 4.13Å; V567-F569 HydrophobicContact CG1-CE2 3.53Å; V567-F569 HydrophobicContact CG1-CZ 3.5Å
568	T	90.6	Very high	87.3	Confident	6 Å²	6	45.6 Å²	45.6	4%	0.037	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	129.5	174	-59.9	0	0	0	0	109.2	A495 V496 W504 Q548 L551 F557	A495-T568 WeakPolarHBondContact CA-O 3.2Å; V496-T568 PolarHBondContact N-O 2.98Å; V496-T568 PolarHBondContact O-N 2.98Å; W504-T568 HydrophobicContact CZ3-CG2 4.32Å; Q548-T568 PolarHBondContact NE2-OG1 3.37Å; L551-T568 HydrophobicContact CD1-CG2 4.48Å; F557-T568 HydrophobicContact CD1-CG2 3.99Å
569	F	92.6	Very high	87.1	Confident	1 Å²	1	49.2 Å²	49.2	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	151.6	174	-63	-87.5	0	0	0	111.1	L493 Y494 A495 W501 F509 M521 F557 F558 A560 V567	L493-F569 HydrophobicContact CB-CD1 4.43Å; L493-F569 HydrophobicContact CD1-CD1 3.76Å; L493-F569 HydrophobicContact CD1-CE1 4.36Å; L493-F569 HydrophobicContact CD1-CG 4.4Å; Y494-F569 CarbonylContact O-C 3.44Å; Y494-F569 VanDerWaalsContact O-CA 3.3Å; Y494-F569 WeakPolarHBondContact O-CA 3.41Å; A495-F569 HydrophobicContact CB-CD1 3.65Å; A495-F569 HydrophobicContact CB-CE1 3.77Å; W501-F569 HydrophobicContact CE3-CZ 4.48Å; W501-F569 HydrophobicContact CZ3-CE1 4.38Å; W501-F569 HydrophobicContact CZ3-CZ 4.08Å; F509-F569 HydrophobicContact CE1-CE1 4.05Å; F509-F569 HydrophobicContact CZ-CE1 4.17Å; M521-F569 HydrophobicContact CE-CD1 4.28Å; M521-F569 HydrophobicContact CE-CE1 3.69Å; M521-F569 HydrophobicContact CE-CZ 4.08Å; M521-F569 HydrophobicContact CG-CE1 4.48Å; M521-F569 HydrophobicContact CG-CZ 4.24Å; F557-F569 WeakPolarHBondContact CA-O 3.36Å; F558-F569 HydrophobicContact CD1-CB 4.11Å; F558-F569 HydrophobicContact CD2-CB 3.95Å; F558-F569 HydrophobicContact CD2-CD2 4.15Å; F558-F569 HydrophobicContact CD2-CG 4.39Å; F558-F569 HydrophobicContact CE1-CB 3.72Å; F558-F569 HydrophobicContact CE2-CB 3.52Å; F558-F569 AromaticContact CE2-CD2 3.73Å; F558-F569 HydrophobicContact CE2-CD2 3.73Å; F558-F569 AromaticContact CE2-CG 3.75Å; F558-F569 HydrophobicContact CE2-CG 3.75Å; F558-F569 HydrophobicContact CG-CB 4.23Å; F558-F569 HydrophobicContact CZ-CB 3.42Å; F558-F569 VanDerWaalsContact CZ-CB 3.42Å; F558-F569 HydrophobicContact CZ-CD2 4.39Å; F558-F569 AromaticContact CZ-CG 3.94Å; F558-F569 HydrophobicContact CZ-CG 3.94Å; F558-F569 PolarHBondContact N-O 3.22Å; F558-F569 WeakPolarHBondContact O-CA 3.32Å; F558-F569 PolarHBondContact O-N 3.15Å; F558-F569 VanDerWaalsContact O-O 3.06Å; A560-F569 HydrophobicContact CB-CE2 4.04Å; V567-F569 HydrophobicContact CB-CE2 3.94Å; V567-F569 HydrophobicContact CB-CZ 4.31Å; V567-F569 HydrophobicContact CG1-CD2 4.17Å; V567-F569 HydrophobicContact CG1-CE1 4.13Å; V567-F569 HydrophobicContact CG1-CE2 3.53Å; V567-F569 HydrophobicContact CG1-CZ 3.5Å
570	A	91.7	Very high	87.1	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	150.1	167.5	0	0	0	0	0	113	Y494 W504 V556 F557	Y494-A570 PolarHBondContact N-O 2.87Å; Y494-A570 PolarHBondContact O-N 3.41Å; W504-A570 HydrophobicContact CH2-CB 3.62Å; W504-A570 HydrophobicContact CZ2-CB 3.98Å; V556-A570 VanDerWaalsContact O-CA 3.25Å; V556-A570 WeakPolarHBondContact O-CA 3.4Å; V556-A570 WeakPolarHBondContact O-CB 3.36Å; F557-A570 HydrophobicContact CD1-CB 3.75Å; F557-A570 HydrophobicContact CD2-CB 4.13Å; F557-A570 HydrophobicContact CE1-CB 3.75Å; F557-A570 HydrophobicContact CE2-CB 4.12Å; F557-A570 HydrophobicContact CG-CB 3.94Å; F557-A570 HydrophobicContact CZ-CB 3.94Å
571	C	89	Confident	87.1	Confident	1 Å²	1	48 Å²	48	1%	0.007	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	170.2	171.8	45.8	0	0	0	0	110.6	L493 G554 Q555 V556 D573	L493-C571 HydrophobicContact CD2-CB 3.76Å; G554-C571 CarbonylContact C-O 3.57Å; G554-C571 WeakPolarHBondContact CA-O 3.43Å; Q555-C571 PolarHBondContact N-O 3.32Å; V556-C571 WeakPolarHBondContact CG2-O 3.35Å; V556-C571 PolarHBondContact N-O 2.76Å; V556-C571 VanDerWaalsContact N-O 3.16Å; V556-C571 PolarHBondContact O-N 3.49Å; V556-C571 VanDerWaalsContact O-N 3.12Å; C571-D573 PolarHBondContact SG-O 2.93Å
572	D	86.3	Confident	87.1	Confident	69 Å²	69	49.2 Å²	49.2	37%	0.369	26%	0.261	S	S	.	.	S	Bend	trans	-92.7	-5.7	-175.4	-55.8	-57.5	0	0	0	112.9	K506 G554	K506-D572 IonicContact NZ-OD2 2.71Å; K506-D572 PolarHBondContact NZ-OD2 2.87Å; G554-D572 VanDerWaalsContact CA-OD1 3.3Å; G554-D572 WeakPolarHBondContact CA-OD1 3.33Å; G554-D572 PolarHBondContact N-OD1 2.86Å; G554-D572 VanDerWaalsContact N-OD1 3.13Å
573	D	86.1	Confident	87.2	Confident	90 Å²	90	45.6 Å²	45.6	48%	0.481	25%	0.248	S	C	.	.			trans	-132.3	135.2	-178.9	-179.1	5	0	0	0	111.4	V556 C571 Q575 D576 R577	V556-D573 WeakPolarHBondContact CG2-O 3.31Å; C571-D573 PolarHBondContact SG-O 2.93Å; D573-Q575 PolarHBondContact OD1-N 2.85Å; D573-D576 HydrophobicContact CB-CB 4.19Å; D573-R577 PolarHBondContact O-N 3.3Å; D573-R577 VanDerWaalsContact O-N 3.1Å
574	E	84.6	Confident	87.7	Confident	83 Å²	83	36.2 Å²	36.2	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-70	-30.9	177	-178.3	151.7	-126.5	0	0	113.3	V556 R577 A578	V556-E574 HydrophobicContact CG1-CB 4.27Å; E574-R577 WeakPolarHBondContact O-CB 3.21Å; E574-R577 PolarHBondContact O-N 2.89Å; E574-R577 IonicContact OE1-CZ 3.73Å; E574-R577 IonicContact OE1-NH2 2.67Å; E574-R577 PolarHBondContact OE1-NH2 3.44Å; E574-A578 PolarHBondContact O-N 2.75Å
575	Q	85.5	Confident	88.3	Confident	120 Å²	120	34.1 Å²	34.1	56%	0.561	17%	0.173	S	C	*	.	H	α-helix	trans	-68.9	-39	176.3	-174.7	59.5	41.6	0	0	111.1	D573 A578 L579	D573-Q575 PolarHBondContact OD1-N 2.85Å; Q575-A578 PolarHBondContact O-N 3.21Å; Q575-L579 WeakPolarHBondContact O-CG 3.41Å; Q575-L579 PolarHBondContact O-N 2.88Å
576	D	86	Confident	88.2	Confident	37 Å²	37	37.7 Å²	37.7	20%	0.198	19%	0.185	C	C	.	.	H	α-helix	trans	-64.8	-43	172.1	-168.4	58.5	0	0	0	111	H489 D573 A578 L579 W580	H489-D576 IonicContact NE2-OD1 3.69Å; D573-D576 HydrophobicContact CB-CB 4.19Å; D576-A578 VanDerWaalsContact C-N 3.29Å; D576-A578 PolarHBondContact O-N 2.9Å; D576-L579 PolarHBondContact O-N 3.13Å; D576-L579 VanDerWaalsContact O-N 3.12Å; D576-W580 VanDerWaalsContact O-CD1 3.27Å; D576-W580 PolarHBondContact O-N 3.13Å; D576-W580 VanDerWaalsContact OD2-CD1 3.27Å; D576-W580 PolarHBondContact OD2-NE1 2.89Å
577	R	89.3	Confident	88	Confident	9 Å²	9	34.3 Å²	34.3	3%	0.034	17%	0.168	C	C	.	.	H	α-helix	trans	-53.8	-45.4	172.5	-179.2	170.1	69.8	158.5	-3	112.1	Y544 V556 F557 F558 D573 E574 L579 W580 V581	Y544-R577 HydrophobicContact CD1-CG 4.14Å; Y544-R577 HydrophobicContact CE1-CG 3.99Å; V556-R577 HydrophobicContact CG2-CB 3.9Å; F557-R577 WeakPolarHBondContact O-CD 3.45Å; F557-R577 PolarHBondContact O-NH1 2.95Å; F558-R577 HydrophobicContact CD1-CG 3.91Å; D573-R577 PolarHBondContact O-N 3.3Å; D573-R577 VanDerWaalsContact O-N 3.1Å; E574-R577 WeakPolarHBondContact O-CB 3.21Å; E574-R577 PolarHBondContact O-N 2.89Å; E574-R577 IonicContact OE1-CZ 3.73Å; E574-R577 IonicContact OE1-NH2 2.67Å; E574-R577 PolarHBondContact OE1-NH2 3.44Å; R577-L579 VanDerWaalsContact C-N 3.32Å; R577-L579 PolarHBondContact O-N 3.35Å; R577-W580 PolarHBondContact O-N 3.18Å; R577-V581 HydrophobicContact CG-CG2 4.26Å; R577-V581 WeakPolarHBondContact O-CG2 3.46Å; R577-V581 PolarHBondContact O-N 3.37Å
578	A	87.5	Confident	87.6	Confident	7 Å²	7	35.3 Å²	35.3	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-39.4	179.9	0	0	0	0	0	112	E574 Q575 D576 Q582	E574-A578 PolarHBondContact O-N 2.75Å; Q575-A578 PolarHBondContact O-N 3.21Å; D576-A578 VanDerWaalsContact C-N 3.29Å; D576-A578 PolarHBondContact O-N 2.9Å; A578-Q582 WeakPolarHBondContact O-CB 3.42Å; A578-Q582 VanDerWaalsContact O-CG 3.23Å; A578-Q582 WeakPolarHBondContact O-CG 3.33Å; A578-Q582 PolarHBondContact O-N 2.83Å; A578-Q582 VanDerWaalsContact O-N 3.08Å
579	L	89.1	Confident	86.7	Confident	76 Å²	76	35.5 Å²	35.5	40%	0.398	18%	0.177	S	C	.	.	H	α-helix	trans	-68.3	-43.7	176.1	-66.1	172.2	0	0	0	111.9	H489 Q575 D576 R577 Q582 A583	H489-L579 WeakPolarHBondContact NE2-CB 3.46Å; Q575-L579 WeakPolarHBondContact O-CG 3.41Å; Q575-L579 PolarHBondContact O-N 2.88Å; D576-L579 PolarHBondContact O-N 3.13Å; D576-L579 VanDerWaalsContact O-N 3.12Å; R577-L579 VanDerWaalsContact C-N 3.32Å; R577-L579 PolarHBondContact O-N 3.35Å; L579-Q582 PolarHBondContact O-N 2.93Å; L579-A583 VanDerWaalsContact O-CB 3.25Å; L579-A583 WeakPolarHBondContact O-CB 3.4Å; L579-A583 PolarHBondContact O-N 3.15Å
580	W	91.4	Very high	85.9	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-50	174.9	-83.1	104.9	0	0	0	113	H489 L493 F509 L511 M521 F558 D576 R577 Q582 A583 L584	H489-W580 AromaticContact CD2-CD1 3.96Å; H489-W580 AromaticContact CD2-CD2 3.35Å; H489-W580 AromaticContact CD2-CE2 3.54Å; H489-W580 AromaticContact CD2-CE3 3.66Å; H489-W580 AromaticContact CD2-CG 3.68Å; H489-W580 AromaticContact CD2-NE1 3.87Å; H489-W580 AromaticContact NE2-CD1 3.54Å; H489-W580 AromaticContact NE2-CD2 3.77Å; H489-W580 AromaticContact NE2-CE2 3.7Å; H489-W580 AromaticContact NE2-CG 3.7Å; H489-W580 AromaticContact NE2-NE1 3.53Å; L493-W580 HydrophobicContact CD1-CD2 3.9Å; L493-W580 HydrophobicContact CD1-CE3 4.16Å; L493-W580 HydrophobicContact CD1-CG 4.41Å; L493-W580 HydrophobicContact CD1-CH2 4.33Å; L493-W580 HydrophobicContact CD1-CZ2 4.05Å; L493-W580 HydrophobicContact CD1-CZ3 4.38Å; L493-W580 HydrophobicContact CD2-CD2 4.42Å; L493-W580 HydrophobicContact CD2-CG 4.3Å; L493-W580 HydrophobicContact CG-CD2 4.48Å; L493-W580 HydrophobicContact CG-CZ2 4.19Å; F509-W580 HydrophobicContact CB-CH2 3.89Å; F509-W580 HydrophobicContact CB-CZ2 4.33Å; L511-W580 HydrophobicContact CB-CZ3 4.11Å; M521-W580 HydrophobicContact CE-CE3 3.98Å; M521-W580 HydrophobicContact CE-CH2 3.97Å; M521-W580 HydrophobicContact CE-CZ3 3.48Å; M521-W580 VanDerWaalsContact CE-CZ3 3.48Å; M521-W580 HydrophobicContact SD-CH2 4.31Å; M521-W580 HydrophobicContact SD-CZ3 3.78Å; F558-W580 HydrophobicContact CE1-CB 4.02Å; F558-W580 HydrophobicContact CE1-CG 4.46Å; F558-W580 HydrophobicContact CE2-CB 4.27Å; F558-W580 HydrophobicContact CZ-CB 3.65Å; F558-W580 HydrophobicContact CZ-CG 4.04Å; D576-W580 VanDerWaalsContact O-CD1 3.27Å; D576-W580 PolarHBondContact O-N 3.13Å; D576-W580 VanDerWaalsContact OD2-CD1 3.27Å; D576-W580 PolarHBondContact OD2-NE1 2.89Å; R577-W580 PolarHBondContact O-N 3.18Å; W580-Q582 VanDerWaalsContact C-N 3.35Å; W580-Q582 PolarHBondContact O-N 3.43Å; W580-A583 PolarHBondContact O-N 2.81Å; W580-L584 HydrophobicContact CE3-CD1 4.44Å; W580-L584 WeakPolarHBondContact O-CB 3.37Å; W580-L584 WeakPolarHBondContact O-CG 3.36Å; W580-L584 PolarHBondContact O-N 3.12Å
581	V	90.3	Very high	84.4	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-65.2	-38.6	-179.7	175.1	0	0	0	0	111.1	V542 Y544 F558 R577 Y585 P594	V542-V581 HydrophobicContact CG1-CG1 4.27Å; V542-V581 HydrophobicContact CG1-CG2 4.32Å; Y544-V581 HydrophobicContact CD1-CG2 4.17Å; Y544-V581 HydrophobicContact CD2-CG1 4.21Å; Y544-V581 HydrophobicContact CE1-CB 4.11Å; Y544-V581 HydrophobicContact CE1-CG1 4.3Å; Y544-V581 HydrophobicContact CE1-CG2 3.88Å; Y544-V581 HydrophobicContact CE2-CB 4.32Å; Y544-V581 HydrophobicContact CE2-CG1 3.64Å; F558-V581 HydrophobicContact CB-CG2 3.65Å; F558-V581 HydrophobicContact CD1-CG2 4.34Å; F558-V581 HydrophobicContact CD2-CG2 3.99Å; F558-V581 HydrophobicContact CG-CG2 3.75Å; R577-V581 HydrophobicContact CG-CG2 4.26Å; R577-V581 WeakPolarHBondContact O-CG2 3.46Å; R577-V581 PolarHBondContact O-N 3.37Å; V581-Y585 WeakPolarHBondContact O-CB 3.23Å; V581-Y585 PolarHBondContact O-N 2.79Å; V581-P594 HydrophobicContact CG1-CB 3.63Å; V581-P594 HydrophobicContact CG1-CG 3.89Å
582	Q	87.6	Confident	83.5	Confident	84 Å²	84	43.6 Å²	43.6	39%	0.393	22%	0.219	S	C	.	.	H	α-helix	trans	-67.2	-40.2	174.4	-74.1	178.2	22.7	0	0	113.1	A578 L579 W580 R586	A578-Q582 WeakPolarHBondContact O-CB 3.42Å; A578-Q582 VanDerWaalsContact O-CG 3.23Å; A578-Q582 WeakPolarHBondContact O-CG 3.33Å; A578-Q582 PolarHBondContact O-N 2.83Å; A578-Q582 VanDerWaalsContact O-N 3.08Å; L579-Q582 PolarHBondContact O-N 2.93Å; W580-Q582 VanDerWaalsContact C-N 3.35Å; W580-Q582 PolarHBondContact O-N 3.43Å; Q582-R586 WeakPolarHBondContact O-CG 3.42Å; Q582-R586 PolarHBondContact O-N 3.04Å; Q582-R586 VanDerWaalsContact O-N 3.15Å
583	A	87.7	Confident	83	Confident	12 Å²	12	47.7 Å²	47.7	10%	0.099	23%	0.233	C	C	.	.	H	α-helix	trans	-68	-41.2	178.9	0	0	0	0	0	111.5	H489 L511 L579 W580 R586 A587	H489-A583 HydrophobicContact CB-CB 3.9Å; L511-A583 HydrophobicContact CD2-CB 3.71Å; L511-A583 WeakPolarHBondContact CD2-O 3.5Å; L579-A583 VanDerWaalsContact O-CB 3.25Å; L579-A583 WeakPolarHBondContact O-CB 3.4Å; L579-A583 PolarHBondContact O-N 3.15Å; W580-A583 PolarHBondContact O-N 2.81Å; A583-R586 PolarHBondContact O-N 2.94Å; A583-A587 WeakPolarHBondContact O-CB 3.44Å; A583-A587 PolarHBondContact O-N 3.45Å; A583-A587 VanDerWaalsContact O-N 3.1Å
584	L	89	Confident	82.8	Confident	1 Å²	1	44 Å²	44	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-70.1	-38.3	175.3	-71.3	165.2	0	0	0	112.8	L511 L537 V542 F558 W580 R586 A587 T588	L511-L584 HydrophobicContact CD1-CD2 4.12Å; L511-L584 HydrophobicContact CD2-CD2 4.39Å; L537-L584 HydrophobicContact CD1-CD2 3.64Å; L537-L584 HydrophobicContact CD2-CD2 3.84Å; L537-L584 HydrophobicContact CG-CD2 4.42Å; V542-L584 HydrophobicContact CB-CB 4.28Å; V542-L584 HydrophobicContact CG1-CB 4.18Å; V542-L584 HydrophobicContact CG1-CD1 4.23Å; V542-L584 HydrophobicContact CG2-CB 3.85Å; V542-L584 HydrophobicContact CG2-CD1 4.35Å; F558-L584 HydrophobicContact CD2-CD1 4.26Å; F558-L584 HydrophobicContact CE2-CD1 3.54Å; F558-L584 HydrophobicContact CZ-CD1 4.4Å; W580-L584 HydrophobicContact CE3-CD1 4.44Å; W580-L584 WeakPolarHBondContact O-CB 3.37Å; W580-L584 WeakPolarHBondContact O-CG 3.36Å; W580-L584 PolarHBondContact O-N 3.12Å; L584-R586 VanDerWaalsContact C-N 3.33Å; L584-R586 PolarHBondContact O-N 3.4Å; L584-A587 PolarHBondContact O-N 2.92Å; L584-A587 VanDerWaalsContact O-N 3.16Å; L584-T588 WeakPolarHBondContact O-CB 3.49Å; L584-T588 WeakPolarHBondContact O-CG2 3.44Å; L584-T588 PolarHBondContact O-N 3.28Å; L584-T588 PolarHBondContact O-OG1 2.88Å
585	Y	86.3	Confident	82.5	Confident	33 Å²	33	47 Å²	47	13%	0.129	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-44.1	172.7	167.9	-105.6	0	0	0	111.9	R274 V581 T588 G589 Q590 Y592 K593 P594	R274-Y585 PolarHBondContact NH1-OH 2.72Å; V581-Y585 WeakPolarHBondContact O-CB 3.23Å; V581-Y585 PolarHBondContact O-N 2.79Å; Y585-T588 PolarHBondContact O-OG1 3.48Å; Y585-G589 PolarHBondContact O-N 2.89Å; Y585-Q590 HydrophobicContact CD2-CG 3.47Å; Y585-Q590 VanDerWaalsContact CD2-CG 3.47Å; Y585-Q590 HydrophobicContact CE2-CG 3.81Å; Y585-Q590 WeakPolarHBondContact CE2-O 3.39Å; Y585-Y592 WeakPolarHBondContact CE2-O 3.26Å; Y585-K593 HydrophobicContact CE1-CG 4.44Å; Y585-K593 HydrophobicContact CE2-CB 4.24Å; Y585-P594 HydrophobicContact CD2-CG 4.15Å
586	R	82.2	Confident	82	Confident	83 Å²	83	46 Å²	46	31%	0.313	23%	0.226	S	C	.	.	H	α-helix	trans	-65.9	-35.9	174.6	-70.5	171.2	178.4	148.7	-4.6	112.8	E267 Q582 A583 L584	E267-R586 HydrophobicContact CG-CG 4.3Å; E267-R586 IonicContact OE1-CZ 2.81Å; E267-R586 IonicContact OE1-NE 3.52Å; E267-R586 PolarHBondContact OE1-NE 3.37Å; E267-R586 IonicContact OE1-NH2 2.84Å; E267-R586 PolarHBondContact OE1-NH2 3.04Å; E267-R586 IonicContact OE2-NH2 2.69Å; Q582-R586 WeakPolarHBondContact O-CG 3.42Å; Q582-R586 PolarHBondContact O-N 3.04Å; Q582-R586 VanDerWaalsContact O-N 3.15Å; A583-R586 PolarHBondContact O-N 2.94Å; L584-R586 VanDerWaalsContact C-N 3.33Å; L584-R586 PolarHBondContact O-N 3.4Å
587	A	84.1	Confident	81.1	Confident	6 Å²	6	46.9 Å²	46.9	5%	0.05	23%	0.234	C	C	.	.	H	α-helix	trans	-75.3	-40.9	-178.8	0	0	0	0	0	113.5	L511 F519 L537 A583 L584	L511-A587 HydrophobicContact CD1-CB 4.1Å; L511-A587 HydrophobicContact CD2-CB 4.16Å; F519-A587 HydrophobicContact CB-CB 3.77Å; F519-A587 HydrophobicContact CD1-CB 3.75Å; F519-A587 HydrophobicContact CD2-CB 3.85Å; F519-A587 WeakPolarHBondContact CD2-O 3.36Å; F519-A587 HydrophobicContact CE1-CB 4.27Å; F519-A587 HydrophobicContact CE2-CB 4.36Å; F519-A587 HydrophobicContact CG-CB 3.51Å; L537-A587 HydrophobicContact CD1-CB 4.25Å; A583-A587 WeakPolarHBondContact O-CB 3.44Å; A583-A587 PolarHBondContact O-N 3.45Å; A583-A587 VanDerWaalsContact O-N 3.1Å; L584-A587 PolarHBondContact O-N 2.92Å; L584-A587 VanDerWaalsContact O-N 3.16Å
588	T	83.6	Confident	79.2	Confident	22 Å²	22	52.7 Å²	52.7	14%	0.135	27%	0.271	C	S	.	.	H	α-helix	trans	-74.8	-34.7	177.3	52.5	0	0	0	0	112.5	L537 Y540 V542 L584 Y585 Q590	L537-T588 HydrophobicContact CB-CG2 4.38Å; L537-T588 HydrophobicContact CD2-CG2 4.48Å; Y540-T588 WeakPolarHBondContact O-CB 3.23Å; Y540-T588 WeakPolarHBondContact O-CG2 3.45Å; V542-T588 HydrophobicContact CG2-CG2 4.26Å; L584-T588 WeakPolarHBondContact O-CB 3.49Å; L584-T588 WeakPolarHBondContact O-CG2 3.44Å; L584-T588 PolarHBondContact O-N 3.28Å; L584-T588 PolarHBondContact O-OG1 2.88Å; Y585-T588 PolarHBondContact O-OG1 3.48Å; T588-Q590 PolarHBondContact O-N 3.25Å; T588-Q590 PolarHBondContact OG1-OE1 3.42Å
589	G	71.3	Confident	77.3	Confident	9 Å²	9	59.2 Å²	59.2	9%	0.093	30%	0.3	C	S	.	.			trans	71.7	15.2	-176.1	0	0	0	0	0	114.2	R274 Y585	R274-G589 WeakPolarHBondContact CG-O 3.33Å; Y585-G589 PolarHBondContact O-N 2.89Å
590	Q	75.7	Confident	74.8	Confident	11 Å²	11	63.3 Å²	63.3	5%	0.051	32%	0.322	C	S	.	.			trans	-50.3	139.5	-179.3	64.9	-173.4	87	0	0	113.1	R274 T541 V542 Y585 T588 Y592	R274-Q590 WeakPolarHBondContact CD-O 3.47Å; T541-Q590 HydrophobicContact CG2-CB 4.02Å; V542-Q590 PolarHBondContact O-NE2 3.17Å; V542-Q590 PolarHBondContact O-OE1 3.02Å; Y585-Q590 HydrophobicContact CD2-CG 3.47Å; Y585-Q590 VanDerWaalsContact CD2-CG 3.47Å; Y585-Q590 HydrophobicContact CE2-CG 3.81Å; Y585-Q590 WeakPolarHBondContact CE2-O 3.39Å; T588-Q590 PolarHBondContact O-N 3.25Å; T588-Q590 PolarHBondContact OG1-OE1 3.42Å; Q590-Y592 PolarHBondContact NE2-O 2.97Å; Q590-Y592 PolarHBondContact O-N 3.24Å
591	S	59.4	Low	72.1	Confident	62 Å²	62	72.9 Å²	72.9	43%	0.434	36%	0.364	S	S	.	.	S	Bend	trans	-56.7	-41.1	-171.8	57.1	0	0	0	0	114.8
592	Y	70.3	Confident	69.6	Low	100 Å²	100	76.9 Å²	76.9	39%	0.392	40%	0.398	S	S	.	.	S	Bend	trans	-102.6	141.6	-176.7	68.1	-86.6	0	0	0	112.8	T541 D543 Y585 Q590	T541-Y592 HydrophobicContact CG2-CE1 4.23Å; D543-Y592 WeakPolarHBondContact OD2-CE2 3.45Å; D543-Y592 VanDerWaalsContact OD2-CZ 3.31Å; D543-Y592 PolarHBondContact OD2-OH 3.02Å; Y585-Y592 WeakPolarHBondContact CE2-O 3.26Å; Q590-Y592 PolarHBondContact NE2-O 2.97Å; Q590-Y592 PolarHBondContact O-N 3.24Å
593	K	76.1	Confident	67.3	Low	154 Å²	154	77.3 Å²	77.3	67%	0.67	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-80.4	127.4	-179.5	-172.2	179.4	-179.1	178.5	0	111.2	Y585 I595	Y585-K593 HydrophobicContact CE1-CG 4.44Å; Y585-K593 HydrophobicContact CE2-CB 4.24Å; K593-I595 PolarHBondContact O-N 3.45Å
594	P	82.9	Confident	64.6	Low	14 Å²	14	84.3 Å²	84.3	9%	0.091	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-60.5	127.4	178.4	-27.7	37.2	0	0	0	112.4	V542 Y544 V581 Y585	V542-P594 WeakPolarHBondContact O-CG 3.34Å; Y544-P594 HydrophobicContact CD2-CB 3.91Å; Y544-P594 HydrophobicContact CE2-CB 3.76Å; V581-P594 HydrophobicContact CG1-CB 3.63Å; V581-P594 HydrophobicContact CG1-CG 3.89Å; Y585-P594 HydrophobicContact CD2-CG 4.15Å
595	I	76.9	Confident	61.6	Low	146 Å²	146	89.9 Å²	89.9	75%	0.749	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-92.3	124.4	-177.4	-57.1	178	0	0	0	109.4	Y544 K593	Y544-I595 WeakPolarHBondContact CD2-O 3.49Å; K593-I595 PolarHBondContact O-N 3.45Å
596	Q	75.7	Confident	59.2	Low	97 Å²	97	98.2 Å²	98.2	45%	0.453	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-64.3	131.6	175.1	-78.9	179.9	-15.6	0	0	110.7	Y544 T598	Y544-Q596 HydrophobicContact CE1-CG 3.9Å; Y544-Q596 HydrophobicContact CE2-CB 4.45Å; Y544-Q596 HydrophobicContact CE2-CG 3.71Å; Y544-Q596 VanDerWaalsContact OH-CG 3.29Å; Y544-Q596 WeakPolarHBondContact OH-CG 3.48Å; Y544-Q596 PolarHBondContact OH-NE2 2.9Å; Q596-T598 PolarHBondContact O-N 3.4Å
597	P	67.6	Low	56.9	Low	56 Å²	56	98.4 Å²	98.4	36%	0.364	55%	0.553	S	S	.	*			trans	-62	111	175.5	-22.5	33.7	0	0	0	110.5	Y544 H599	Y544-P597 HydrophobicContact CG-CG 4.42Å; P597-H599 PolarHBondContact O-N 3.26Å
598	T	48.3	Very low	54.3	Low	131 Å²	131	101.9 Å²	101.9	80%	0.804	59%	0.59	S	S	*	*			trans	-68.6	101	175.1	41.5	0	0	0	0	110	Q596 N600	Q596-T598 PolarHBondContact O-N 3.4Å; T598-N600 PolarHBondContact O-N 3.36Å
599	H	48.9	Very low	51.9	Low	145 Å²	145	110.5 Å²	110.5	67%	0.671	63%	0.628	S	S	*	*			trans	-53.5	122.3	167.7	-88.5	-86.1	0	0	0	110.2	P597 K601	P597-H599 PolarHBondContact O-N 3.26Å; H599-K601 PolarHBondContact O-N 3.12Å
600	N	36.1	Very low	49.8	Very low	161 Å²	161	121.4 Å²	121.4	86%	0.861	67%	0.666	S	S	*	*			trans	-56.1	98.9	-174.4	-83.2	-30.8	0	0	0	112.6	T598	T598-N600 PolarHBondContact O-N 3.36Å
601	K	34.9	Very low	47.7	Very low	201 Å²	201	130.4 Å²	130.4	87%	0.874	71%	0.705	S	S	*	*			trans	-102.7	54.1	164	-74.1	-172.6	176.5	176.6	0	111.2	H599	H599-K601 PolarHBondContact O-N 3.12Å
602	A	37.9	Very low	46.5	Very low	87 Å²	87	133.4 Å²	133.4	72%	0.719	72%	0.723	S	S	*	*			trans	-74.1	144.8	154.9	0	0	0	0	0	109
603	A	39.4	Very low	44.6	Very low	93 Å²	93	134.1 Å²	134.1	77%	0.769	74%	0.743	S	S	*	*	S	Bend	trans	66.5	76.5	178	0	0	0	0	0	117.2
604	N	29.7	Very low	42.8	Very low	158 Å²	158	132.3 Å²	132.3	85%	0.845	75%	0.75	S	S	*	*			trans	155.4	133.3	143.8	-84.5	-21	0	0	0	109.7
605	C	26.8	Very low	40.8	Very low	118 Å²	118	138.3 Å²	138.3	80%	0.797	78%	0.78	S	S	*	*			cis	-131.4	165.8	8	-76.2	0	0	0	0	112.5
606	K	35.2	Very low	38.7	Very low	209 Å²	209	137.3 Å²	137.3	91%	0.909	79%	0.785	S	S	*	*			trans	-77.4	147.5	159.7	-70.3	179.1	176.7	178	0	110.5
607	G	33.7	Very low	37	Very low	86 Å²	86	137.4 Å²	137.4	89%	0.887	79%	0.789	S	S	*	*			trans	87.6	120.6	158.7	0	0	0	0	0	115.9
608	G	29	Very low	35.4	Very low	79 Å²	79	139 Å²	139	81%	0.814	79%	0.794	S	S	*	*			trans	167.4	78.2	176	0	0	0	0	0	113.1	R610	G608-R610 PolarHBondContact O-N 3.14Å
609	H	33.8	Very low	35.2	Very low	204 Å²	204	137.8 Å²	137.8	94%	0.944	79%	0.788	S	S	*	*			trans	-64.9	119.4	174.7	-88.7	-73.9	0	0	0	111.2
610	R	28.6	Very low	34.6	Very low	237 Å²	237	135.4 Å²	135.4	89%	0.894	79%	0.787	S	S	*	*			trans	-126.2	114.3	162.2	-147.7	174.2	-172.3	-176.1	1.1	107.8	G608 P612	G608-R610 PolarHBondContact O-N 3.14Å; R610-P612 WeakPolarHBondContact O-CD 3.2Å
611	K	30.6	Very low	35.2	Very low	201 Å²	201	132.9 Å²	132.9	87%	0.874	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-66.8	128.5	-177.4	-68.7	-175.7	177.8	-177.6	0	110.1
612	P	34.2	Very low	36	Very low	124 Å²	124	130.3 Å²	130.3	81%	0.805	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-64	149.6	161	-17.7	32.1	0	0	0	110.4	R610	R610-P612 WeakPolarHBondContact O-CD 3.2Å
613	S	31.5	Very low	36.8	Very low	116 Å²	116	131.5 Å²	131.5	81%	0.811	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-74.5	155.8	169.8	42.8	0	0	0	0	111.5	I615	S613-I615 PolarHBondContact O-N 3.05Å
614	S	37.3	Very low	37.8	Very low	116 Å²	116	128.4 Å²	128.4	81%	0.811	72%	0.723	S	S	*	*	S	Bend	trans	-79.6	87.3	-170.2	53.2	0	0	0	0	113.7
615	I	40.5	Very low	39.5	Very low	140 Å²	140	121.5 Å²	121.5	72%	0.718	69%	0.686	S	S	*	*			trans	-146.4	99.6	137	-76.9	113.4	0	0	0	106.2	S613 L617	S613-I615 PolarHBondContact O-N 3.05Å; I615-L617 HydrophobicContact CG2-CG 4.48Å
616	S	33.2	Very low	41.3	Very low	124 Å²	124	121.1 Å²	121.1	87%	0.867	67%	0.672	S	S	*	*			trans	-103.3	86.4	173.9	56.5	0	0	0	0	109.9
617	L	39.4	Very low	43	Very low	100 Å²	100	114.5 Å²	114.5	52%	0.524	65%	0.647	S	S	.	*			trans	-76.7	153.6	159.3	-78.6	168.1	0	0	0	109.7	I615	I615-L617 HydrophobicContact CG2-CG 4.48Å
618	D	35.3	Very low	45	Very low	90 Å²	90	110.8 Å²	110.8	48%	0.481	61%	0.606	S	S	.	*			trans	-57.1	124.9	-174.7	-169.6	-24.7	0	0	0	111.8	C620 Q621	D618-C620 PolarHBondContact O-N 3Å; D618-C620 VanDerWaalsContact O-N 3.1Å; D618-C620 WeakPolarHBondContact OD1-CB 3.3Å; D618-C620 PolarHBondContact OD1-N 3.24Å; D618-Q621 HydrophobicContact CB-CG 4.45Å; D618-Q621 PolarHBondContact O-N 3.42Å
619	P	42.7	Very low	47.2	Very low	104 Å²	104	108.8 Å²	108.8	68%	0.675	58%	0.577	S	S	*	*	H	α-helix	trans	-51.4	-32.6	177.1	-28.6	35.9	0	0	0	114.1	Q621 R622 Q623	P619-Q621 VanDerWaalsContact C-N 3.29Å; P619-Q621 PolarHBondContact O-N 3.31Å; P619-R622 PolarHBondContact O-N 3.34Å; P619-Q623 PolarHBondContact O-N 3.46Å
620	C	37.5	Very low	49	Very low	96 Å²	96	103.5 Å²	103.5	65%	0.649	56%	0.563	S	S	*	*	H	α-helix	trans	-61.1	-37.4	179.7	-166.4	0	0	0	0	112.3	D618 G624	D618-C620 PolarHBondContact O-N 3Å; D618-C620 VanDerWaalsContact O-N 3.1Å; D618-C620 WeakPolarHBondContact OD1-CB 3.3Å; D618-C620 PolarHBondContact OD1-N 3.24Å; C620-G624 PolarHBondContact O-N 2.93Å
621	Q	48	Very low	51.2	Low	107 Å²	107	93.4 Å²	93.4	50%	0.5	53%	0.53	S	S	.	.	H	α-helix	trans	-76.2	-21.9	-179.9	-65.5	-174.1	11.3	0	0	113.6	D618 P619	D618-Q621 HydrophobicContact CB-CG 4.45Å; D618-Q621 PolarHBondContact O-N 3.42Å; P619-Q621 VanDerWaalsContact C-N 3.29Å; P619-Q621 PolarHBondContact O-N 3.31Å
622	R	52.4	Low	53.2	Low	148 Å²	148	86.5 Å²	86.5	56%	0.558	51%	0.511	S	S	*	.	H	α-helix	trans	-72.5	-48.4	170.6	-84.9	-170.8	176.5	156.1	2.1	111.3	P619 G624 M625 E626	P619-R622 PolarHBondContact O-N 3.34Å; R622-G624 VanDerWaalsContact C-N 3.35Å; R622-G624 PolarHBondContact O-N 2.89Å; R622-M625 PolarHBondContact O-N 3.37Å; R622-E626 PolarHBondContact O-N 3.36Å
623	Q	54.5	Low	55.3	Low	111 Å²	111	81.5 Å²	81.5	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-56.8	-50	-177.6	-167.1	61.7	68.4	0	0	111.2	P619 M625 E626 D627	P619-Q623 PolarHBondContact O-N 3.46Å; Q623-M625 PolarHBondContact O-N 2.86Å; Q623-M625 VanDerWaalsContact O-N 3.11Å; Q623-E626 PolarHBondContact O-N 3.11Å; Q623-E626 VanDerWaalsContact O-N 3.16Å; Q623-D627 VanDerWaalsContact O-CG 3.24Å; Q623-D627 PolarHBondContact O-N 3.41Å
624	G	59.8	Low	57.3	Low	29 Å²	29	77.6 Å²	77.6	30%	0.299	46%	0.456	S	S	.	.	H	α-helix	trans	-64.2	-15.1	178.1	0	0	0	0	0	115.4	C620 R622 L628	C620-G624 PolarHBondContact O-N 2.93Å; R622-G624 VanDerWaalsContact C-N 3.35Å; R622-G624 PolarHBondContact O-N 2.89Å; G624-L628 WeakPolarHBondContact O-CG 3.44Å
625	M	65.8	Low	59.2	Low	12 Å²	12	77.2 Å²	77.2	6%	0.059	45%	0.452	C	S	.	.	H	α-helix	trans	-90.9	-37.1	173.2	-161.4	78.3	78.1	0	0	111.8	E252 L255 L256 R622 Q623 D627 L628 I629	E252-M625 HydrophobicContact CB-CE 4.08Å; E252-M625 HydrophobicContact CG-CE 4.06Å; L255-M625 HydrophobicContact CD2-CB 4.09Å; L255-M625 HydrophobicContact CD2-CE 4.2Å; L255-M625 HydrophobicContact CD2-CG 3.79Å; L255-M625 HydrophobicContact CG-CG 4.19Å; L256-M625 HydrophobicContact CD1-SD 4.19Å; L256-M625 HydrophobicContact CD2-CG 3.67Å; L256-M625 HydrophobicContact CD2-SD 3.59Å; L256-M625 VanDerWaalsContact CD2-SD 3.59Å; L256-M625 HydrophobicContact CG-CG 4.38Å; L256-M625 HydrophobicContact CG-SD 3.92Å; R622-M625 PolarHBondContact O-N 3.37Å; Q623-M625 PolarHBondContact O-N 2.86Å; Q623-M625 VanDerWaalsContact O-N 3.11Å; M625-D627 PolarHBondContact O-N 3.14Å; M625-L628 PolarHBondContact O-N 3.04Å; M625-L628 VanDerWaalsContact O-N 3.15Å; M625-L628 HydrophobicContact SD-CD1 3.97Å; M625-I629 HydrophobicContact CG-CD1 4.36Å; M625-I629 WeakPolarHBondContact O-CD1 3.32Å; M625-I629 WeakPolarHBondContact O-CG1 3.44Å; M625-I629 PolarHBondContact O-N 3.25Å; M625-I629 VanDerWaalsContact O-N 3.12Å
626	E	65.1	Low	61.2	Low	110 Å²	110	73.8 Å²	73.8	51%	0.514	43%	0.432	S	S	.	.	H	α-helix	trans	-61.6	-35.2	172.1	-70.8	179.4	-174	0	0	111.3	R622 Q623 I629 S630	R622-E626 PolarHBondContact O-N 3.36Å; Q623-E626 PolarHBondContact O-N 3.11Å; Q623-E626 VanDerWaalsContact O-N 3.16Å; E626-I629 PolarHBondContact O-N 2.87Å; E626-S630 VanDerWaalsContact O-CB 3.3Å; E626-S630 WeakPolarHBondContact O-CB 3.49Å; E626-S630 PolarHBondContact O-N 3.18Å; E626-S630 PolarHBondContact O-OG 2.91Å
627	D	70.9	Confident	63.7	Low	70 Å²	70	72.7 Å²	72.7	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-58.4	-45.5	170.9	-61.6	-12.6	0	0	0	112.1	Q623 M625 I629 S630 A631	Q623-D627 VanDerWaalsContact O-CG 3.24Å; Q623-D627 PolarHBondContact O-N 3.41Å; M625-D627 PolarHBondContact O-N 3.14Å; D627-I629 VanDerWaalsContact C-N 3.34Å; D627-I629 PolarHBondContact O-N 3.14Å; D627-S630 PolarHBondContact O-N 3.14Å; D627-S630 PolarHBondContact O-OG 3.18Å; D627-A631 WeakPolarHBondContact O-CB 3.45Å; D627-A631 PolarHBondContact O-N 3.01Å
628	L	75.8	Confident	66.1	Low	8 Å²	8	68.8 Å²	68.8	4%	0.042	40%	0.396	C	S	.	.	H	α-helix	trans	-68.2	-32	-179.5	-63.5	169.9	0	0	0	112.7	R81 L84 Q85 V88 G624 M625	R81-L628 HydrophobicContact CG-CD2 4.06Å; L84-L628 HydrophobicContact CB-CD1 3.99Å; Q85-L628 HydrophobicContact CB-CD2 4.25Å; Q85-L628 PolarHBondContact NE2-O 3.02Å; Q85-L628 VanDerWaalsContact NE2-O 3.12Å; V88-L628 HydrophobicContact CG2-CB 4.42Å; G624-L628 WeakPolarHBondContact O-CG 3.44Å; M625-L628 PolarHBondContact O-N 3.04Å; M625-L628 VanDerWaalsContact O-N 3.15Å; M625-L628 HydrophobicContact SD-CD1 3.97Å
629	I	75.4	Confident	68.6	Low	37 Å²	37	66 Å²	66	19%	0.19	39%	0.386	C	S	.	.	H	α-helix	trans	-76	-42.5	177.4	-64.7	156.7	0	0	0	110.8	R92 L256 A259 M625 E626 D627	R92-I629 PolarHBondContact NH2-O 3.34Å; L256-I629 HydrophobicContact CD2-CD1 3.86Å; L256-I629 HydrophobicContact CD2-CG1 3.57Å; A259-I629 HydrophobicContact CB-CD1 3.55Å; A259-I629 HydrophobicContact CB-CG1 4.21Å; A259-I629 HydrophobicContact CB-CG2 4.15Å; M625-I629 HydrophobicContact CG-CD1 4.36Å; M625-I629 WeakPolarHBondContact O-CD1 3.32Å; M625-I629 WeakPolarHBondContact O-CG1 3.44Å; M625-I629 PolarHBondContact O-N 3.25Å; M625-I629 VanDerWaalsContact O-N 3.12Å; E626-I629 PolarHBondContact O-N 2.87Å; D627-I629 VanDerWaalsContact C-N 3.34Å; D627-I629 PolarHBondContact O-N 3.14Å
630	S	70.3	Confident	70.9	Confident	93 Å²	93	63.3 Å²	63.3	65%	0.65	37%	0.372	S	S	*	.	H	α-helix	trans	-81.3	-16.7	-175.1	59.1	0	0	0	0	114.3	E626 D627 A632	E626-S630 VanDerWaalsContact O-CB 3.3Å; E626-S630 WeakPolarHBondContact O-CB 3.49Å; E626-S630 PolarHBondContact O-N 3.18Å; E626-S630 PolarHBondContact O-OG 2.91Å; D627-S630 PolarHBondContact O-N 3.14Å; D627-S630 PolarHBondContact O-OG 3.18Å; S630-A632 PolarHBondContact O-N 3.2Å
631	A	75.5	Confident	73.5	Confident	26 Å²	26	59.7 Å²	59.7	22%	0.215	35%	0.346	C	S	.	.	S	Bend	trans	-56.9	133.1	178.5	0	0	0	0	0	113	D627 F636	D627-A631 WeakPolarHBondContact O-CB 3.45Å; D627-A631 PolarHBondContact O-N 3.01Å; A631-F636 HydrophobicContact CB-CE2 3.67Å; A631-F636 HydrophobicContact CB-CZ 3.72Å
632	A	72.1	Confident	75.7	Confident	56 Å²	56	54.6 Å²	54.6	46%	0.463	32%	0.322	S	S	.	.			trans	-73.8	127.6	179.4	0	0	0	0	0	110.9	S630 G634 C635 F636	S630-A632 PolarHBondContact O-N 3.2Å; A632-G634 VanDerWaalsContact C-N 3.31Å; A632-G634 PolarHBondContact O-N 3.02Å; A632-C635 WeakPolarHBondContact O-CB 3.33Å; A632-C635 PolarHBondContact O-N 2.79Å; A632-C635 VanDerWaalsContact O-N 3.14Å; A632-F636 WeakPolarHBondContact O-CD2 3.49Å; A632-F636 WeakPolarHBondContact O-CE2 3.31Å
633	P	78.8	Confident	77.6	Confident	18 Å²	18	48.8 Å²	48.8	12%	0.117	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-57.4	-40.2	-177.8	-25.7	33.8	0	0	0	113.7	F89 E275 C635 F636 H638 Y679	F89-P633 HydrophobicContact CE1-CB 4.01Å; F89-P633 HydrophobicContact CE1-CG 4.01Å; E275-P633 HydrophobicContact CG-CG 4.08Å; P633-C635 PolarHBondContact O-N 2.82Å; P633-F636 PolarHBondContact O-N 3.13Å; P633-H638 PolarHBondContact O-NE2 3.44Å; P633-H638 VanDerWaalsContact O-NE2 3.13Å; P633-Y679 HydrophobicContact CB-CD1 4.07Å; P633-Y679 HydrophobicContact CB-CE1 3.93Å; P633-Y679 HydrophobicContact CG-CE1 4.24Å
634	G	73.3	Confident	79.4	Confident	34 Å²	34	46.6 Å²	46.6	35%	0.351	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-63.8	0.5	178.8	0	0	0	0	0	116	A632	A632-G634 VanDerWaalsContact C-N 3.31Å; A632-G634 PolarHBondContact O-N 3.02Å
635	C	76.2	Confident	81	Confident	109 Å²	109	45.2 Å²	45.2	74%	0.736	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-96.5	0.1	172.4	-62.1	0	0	0	0	113.9	A632 P633	A632-C635 WeakPolarHBondContact O-CB 3.33Å; A632-C635 PolarHBondContact O-N 2.79Å; A632-C635 VanDerWaalsContact O-N 3.14Å; P633-C635 PolarHBondContact O-N 2.82Å
636	F	83.1	Confident	82.3	Confident	68 Å²	68	44.6 Å²	44.6	30%	0.298	28%	0.278	S	S	.	.	S	Bend	trans	-113.9	144.7	-176.7	-64.3	-91.1	0	0	0	113	Q85 F89 A631 A632 P633 H638 L641	Q85-F636 HydrophobicContact CG-CD1 4.29Å; Q85-F636 HydrophobicContact CG-CE1 3.7Å; Q85-F636 HydrophobicContact CG-CZ 3.88Å; F89-F636 HydrophobicContact CE2-CD2 4.22Å; F89-F636 HydrophobicContact CE2-CG 4.26Å; F89-F636 AromaticContact CZ-CD2 3.63Å; F89-F636 HydrophobicContact CZ-CD2 3.63Å; F89-F636 AromaticContact CZ-CE2 3.83Å; F89-F636 HydrophobicContact CZ-CE2 3.83Å; F89-F636 HydrophobicContact CZ-CG 4.12Å; F89-F636 HydrophobicContact CZ-CZ 4.49Å; A631-F636 HydrophobicContact CB-CE2 3.67Å; A631-F636 HydrophobicContact CB-CZ 3.72Å; A632-F636 WeakPolarHBondContact O-CD2 3.49Å; A632-F636 WeakPolarHBondContact O-CE2 3.31Å; P633-F636 PolarHBondContact O-N 3.13Å; F636-H638 PolarHBondContact O-N 3.38Å; F636-L641 HydrophobicContact CB-CD1 3.91Å; F636-L641 HydrophobicContact CD1-CD1 4.2Å; F636-L641 HydrophobicContact CG-CD1 4.33Å
637	D	85.8	Confident	83.7	Confident	101 Å²	101	43.2 Å²	43.2	54%	0.54	27%	0.27	S	S	.	.			trans	-73	92	164.6	178.4	1.2	0	0	0	110.1	A639 A640 L641	D637-A639 PolarHBondContact O-N 2.88Å; D637-A639 WeakPolarHBondContact OD1-CA 3.41Å; D637-A639 WeakPolarHBondContact OD1-CB 3.39Å; D637-A639 PolarHBondContact OD1-N 2.83Å; D637-A640 HydrophobicContact CB-CB 4.36Å; D637-A640 PolarHBondContact OD1-N 3.34Å; D637-A640 WeakPolarHBondContact OD2-CB 3.46Å; D637-L641 VanDerWaalsContact O-CG 3.28Å; D637-L641 WeakPolarHBondContact O-CG 3.12Å; D637-L641 PolarHBondContact O-N 3.17Å; D637-L641 VanDerWaalsContact O-N 3.11Å
638	H	89.8	Confident	84.7	Confident	18 Å²	18	41.8 Å²	41.8	8%	0.083	26%	0.261	C	S	.	.	H	α-helix	trans	-67.9	-17.1	176	-76.6	-76	0	0	0	113.9	F89 P633 F636 F642 Y675 Y679 V681	F89-H638 AromaticContact CD2-CE1 3.81Å; F89-H638 AromaticContact CE2-CE1 3.7Å; F89-H638 AromaticContact CZ-CE1 3.89Å; P633-H638 PolarHBondContact O-NE2 3.44Å; P633-H638 VanDerWaalsContact O-NE2 3.13Å; F636-H638 PolarHBondContact O-N 3.38Å; H638-F642 WeakPolarHBondContact O-CB 3.19Å; H638-F642 PolarHBondContact O-N 2.71Å; H638-Y675 HydrophobicContact CB-CE1 4.48Å; H638-Y675 AromaticContact ND1-CE1 3.92Å; H638-Y675 AromaticContact ND1-CZ 3.64Å; H638-Y675 PolarHBondContact ND1-OH 3.06Å; H638-Y679 AromaticContact CE1-CD1 3.41Å; H638-Y679 VanDerWaalsContact CE1-CD1 3.41Å; H638-Y679 WeakPolarHBondContact CE1-CD1 3.24Å; H638-Y679 AromaticContact CE1-CG 3.48Å; H638-Y679 VanDerWaalsContact CE1-CG 3.48Å; H638-Y679 AromaticContact ND1-CG 3.66Å; H638-Y679 AromaticContact NE2-CD1 3.55Å; H638-Y679 AromaticContact NE2-CG 3.9Å; H638-V681 HydrophobicContact CB-CG2 4.15Å
639	A	87.8	Confident	85.5	Confident	32 Å²	32	41.4 Å²	41.4	26%	0.264	26%	0.259	S	S	.	.	H	α-helix	trans	-75.2	-46.1	176.2	0	0	0	0	0	111.1	D637 F642 S643 H685	D637-A639 PolarHBondContact O-N 2.88Å; D637-A639 WeakPolarHBondContact OD1-CA 3.41Å; D637-A639 WeakPolarHBondContact OD1-CB 3.39Å; D637-A639 PolarHBondContact OD1-N 2.83Å; A639-F642 PolarHBondContact O-N 3.35Å; A639-S643 PolarHBondContact O-N 2.91Å; A639-S643 VanDerWaalsContact O-N 3.14Å; A639-S643 PolarHBondContact O-OG 3Å; A639-H685 PolarHBondContact O-NE2 2.99Å
640	A	90.2	Very high	86.2	Confident	46 Å²	46	39.7 Å²	39.7	38%	0.38	25%	0.25	S	S	.	.	H	α-helix	trans	-65.8	-43.7	173.2	0	0	0	0	0	112.4	D637 F642 S643 I644	D637-A640 HydrophobicContact CB-CB 4.36Å; D637-A640 PolarHBondContact OD1-N 3.34Å; D637-A640 WeakPolarHBondContact OD2-CB 3.46Å; A640-F642 VanDerWaalsContact C-N 3.31Å; A640-F642 PolarHBondContact O-N 3.49Å; A640-S643 PolarHBondContact O-N 3.42Å; A640-I644 PolarHBondContact O-N 3.16Å
641	L	92.2	Very high	87.1	Confident	20 Å²	20	38.3 Å²	38.3	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-37.7	176.1	-68.7	-179.3	0	0	0	112.2	T82 I86 F89 F636 D637 I644 L645	T82-L641 HydrophobicContact CG2-CD2 3.65Å; I86-L641 HydrophobicContact CD1-CB 4.49Å; I86-L641 HydrophobicContact CD1-CD2 4.11Å; I86-L641 HydrophobicContact CG1-CB 4.16Å; I86-L641 HydrophobicContact CG1-CD2 3.88Å; I86-L641 HydrophobicContact CG1-CG 4.47Å; F89-L641 HydrophobicContact CD2-CD1 4.4Å; F89-L641 HydrophobicContact CE2-CD1 3.95Å; F636-L641 HydrophobicContact CB-CD1 3.91Å; F636-L641 HydrophobicContact CD1-CD1 4.2Å; F636-L641 HydrophobicContact CG-CD1 4.33Å; D637-L641 VanDerWaalsContact O-CG 3.28Å; D637-L641 WeakPolarHBondContact O-CG 3.12Å; D637-L641 PolarHBondContact O-N 3.17Å; D637-L641 VanDerWaalsContact O-N 3.11Å; L641-I644 PolarHBondContact O-N 3.43Å; L641-L645 PolarHBondContact O-N 3.15Å; L641-L645 VanDerWaalsContact O-N 3.08Å
642	F	93.9	Very high	87.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-40.4	177	-178.5	-92.4	0	0	0	112.5	H638 A639 A640 I644 L645 Q646 L672 Y675 C676 V681 R686	H638-F642 WeakPolarHBondContact O-CB 3.19Å; H638-F642 PolarHBondContact O-N 2.71Å; A639-F642 PolarHBondContact O-N 3.35Å; A640-F642 VanDerWaalsContact C-N 3.31Å; A640-F642 PolarHBondContact O-N 3.49Å; F642-I644 VanDerWaalsContact C-N 3.28Å; F642-I644 PolarHBondContact O-N 2.6Å; F642-L645 WeakPolarHBondContact O-CB 3.27Å; F642-L645 PolarHBondContact O-N 2.99Å; F642-L645 VanDerWaalsContact O-N 3.16Å; F642-Q646 HydrophobicContact CD1-CB 4.39Å; F642-Q646 HydrophobicContact CE1-CB 3.99Å; F642-Q646 HydrophobicContact CE1-CG 4.27Å; F642-Q646 HydrophobicContact CZ-CB 4.35Å; F642-Q646 VanDerWaalsContact O-CB 3.31Å; F642-Q646 WeakPolarHBondContact O-CB 3.47Å; F642-Q646 PolarHBondContact O-N 3.3Å; F642-L672 HydrophobicContact CD2-CD2 4.49Å; F642-L672 HydrophobicContact CE2-CB 4.11Å; F642-L672 HydrophobicContact CE2-CD2 3.61Å; F642-L672 HydrophobicContact CE2-CG 4.42Å; F642-L672 HydrophobicContact CZ-CB 4.33Å; F642-L672 HydrophobicContact CZ-CD2 4.02Å; F642-Y675 HydrophobicContact CB-CE1 4.1Å; F642-Y675 AromaticContact CD2-CD1 3.68Å; F642-Y675 HydrophobicContact CD2-CD1 3.68Å; F642-Y675 HydrophobicContact CD2-CE1 4.08Å; F642-Y675 HydrophobicContact CD2-CG 4.38Å; F642-Y675 HydrophobicContact CE2-CD1 4.47Å; F642-C676 WeakPolarHBondContact CE2-SG 3.4Å; F642-C676 VanDerWaalsContact CZ-SG 3.56Å; F642-V681 HydrophobicContact CB-CG1 4.09Å; F642-V681 HydrophobicContact CB-CG2 4Å; F642-V681 HydrophobicContact CD1-CG1 4.04Å; F642-V681 HydrophobicContact CD2-CG2 4.5Å; F642-V681 HydrophobicContact CG-CG1 4.01Å; F642-V681 HydrophobicContact CG-CG2 4.3Å; F642-R686 HydrophobicContact CE1-CB 3.86Å; F642-R686 HydrophobicContact CE1-CG 3.74Å; F642-R686 HydrophobicContact CZ-CB 4.47Å; F642-R686 HydrophobicContact CZ-CG 4.01Å
643	S	92.6	Very high	88.3	Confident	26 Å²	26	37.6 Å²	37.6	18%	0.182	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-39.1	175	-72.4	0	0	0	0	112.2	A639 A640 K647 H685 S689	A639-S643 PolarHBondContact O-N 2.91Å; A639-S643 VanDerWaalsContact O-N 3.14Å; A639-S643 PolarHBondContact O-OG 3Å; A640-S643 PolarHBondContact O-N 3.42Å; S643-K647 WeakPolarHBondContact O-CB 3.48Å; S643-K647 PolarHBondContact O-N 3.12Å; S643-H685 PolarHBondContact OG-NE2 3.4Å; S643-H685 VanDerWaalsContact OG-NE2 3.14Å; S643-S689 WeakPolarHBondContact CB-OG 3.24Å; S643-S689 PolarHBondContact OG-OG 3.04Å
644	I	92.8	Very high	88.4	Confident	65 Å²	65	37.5 Å²	37.5	33%	0.333	21%	0.214	S	C	.	.	H	α-helix	trans	-64.9	-45.7	174.3	-63.2	168.8	0	0	0	111.2	T82 I86 A640 L641 F642 H648	T82-I644 HydrophobicContact CG2-CD1 4.03Å; I86-I644 HydrophobicContact CD1-CB 3.91Å; I86-I644 HydrophobicContact CD1-CG2 3.69Å; A640-I644 PolarHBondContact O-N 3.16Å; L641-I644 PolarHBondContact O-N 3.43Å; F642-I644 VanDerWaalsContact C-N 3.28Å; F642-I644 PolarHBondContact O-N 2.6Å; I644-H648 PolarHBondContact O-CD2 2.78Å; I644-H648 PolarHBondContact O-N 2.64Å; I644-H648 VanDerWaalsContact O-N 3.09Å
645	L	93.9	Very high	88.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.6	-45.5	177.1	177	59.2	0	0	0	111.8	I86 V90 F242 L246 L641 F642 T649 L672 Y675	I86-L645 HydrophobicContact CG2-CB 3.89Å; I86-L645 HydrophobicContact CG2-CD1 3.84Å; I86-L645 HydrophobicContact CG2-CD2 4.18Å; I86-L645 HydrophobicContact CG2-CG 4.18Å; V90-L645 HydrophobicContact CG2-CD1 4.02Å; V90-L645 HydrophobicContact CG2-CD2 3.73Å; F242-L645 HydrophobicContact CD1-CD1 4.18Å; F242-L645 HydrophobicContact CE1-CD1 4.02Å; L246-L645 HydrophobicContact CD1-CD1 4.23Å; L246-L645 HydrophobicContact CD2-CD1 4.19Å; L246-L645 HydrophobicContact CG-CD1 4.48Å; L641-L645 PolarHBondContact O-N 3.15Å; L641-L645 VanDerWaalsContact O-N 3.08Å; F642-L645 WeakPolarHBondContact O-CB 3.27Å; F642-L645 PolarHBondContact O-N 2.99Å; F642-L645 VanDerWaalsContact O-N 3.16Å; L645-T649 VanDerWaalsContact O-CB 3.3Å; L645-T649 WeakPolarHBondContact O-CB 3.26Å; L645-T649 PolarHBondContact O-N 3.48Å; L645-T649 PolarHBondContact O-OG1 3.29Å; L645-L672 HydrophobicContact CD2-CD2 3.94Å; L645-L672 HydrophobicContact CG-CD2 3.91Å; L645-Y675 HydrophobicContact CD2-CD2 3.91Å; L645-Y675 HydrophobicContact CD2-CE2 4.12Å; L645-Y675 HydrophobicContact CD2-CG 4.29Å
646	Q	93.8	Very high	89	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.6	-46.8	-179.8	-172.6	175.4	40.1	0	0	111.3	F642 H648 T649 L650 F664 R686	F642-Q646 HydrophobicContact CD1-CB 4.39Å; F642-Q646 HydrophobicContact CE1-CB 3.99Å; F642-Q646 HydrophobicContact CE1-CG 4.27Å; F642-Q646 HydrophobicContact CZ-CB 4.35Å; F642-Q646 VanDerWaalsContact O-CB 3.31Å; F642-Q646 WeakPolarHBondContact O-CB 3.47Å; F642-Q646 PolarHBondContact O-N 3.3Å; Q646-H648 PolarHBondContact O-N 2.77Å; Q646-T649 PolarHBondContact O-N 2.86Å; Q646-L650 WeakPolarHBondContact O-CB 3.29Å; Q646-L650 PolarHBondContact O-N 2.76Å; Q646-F664 HydrophobicContact CG-CE2 4.5Å; Q646-F664 HydrophobicContact CG-CZ 4Å; Q646-R686 PolarHBondContact NE2-O 3.47Å; Q646-R686 VanDerWaalsContact NE2-O 3.12Å; Q646-R686 PolarHBondContact OE1-O 2.8Å
647	K	92.9	Very high	88.2	Confident	80 Å²	80	38.6 Å²	38.6	35%	0.348	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-44.6	178.5	-166.3	173.6	-169.1	96	0	111.8	S643 L650 Q651 D693 D696	S643-K647 WeakPolarHBondContact O-CB 3.48Å; S643-K647 PolarHBondContact O-N 3.12Å; K647-L650 PolarHBondContact O-N 2.67Å; K647-Q651 WeakPolarHBondContact O-CB 3.49Å; K647-Q651 VanDerWaalsContact O-CG 3.28Å; K647-Q651 WeakPolarHBondContact O-CG 3.24Å; K647-Q651 PolarHBondContact O-N 3.28Å; K647-D693 WeakPolarHBondContact CD-OD1 3.46Å; K647-D693 WeakPolarHBondContact CE-OD1 3.43Å; K647-D693 WeakPolarHBondContact CG-OD1 3.48Å; K647-D693 IonicContact NZ-OD1 3.96Å; K647-D693 PolarHBondContact NZ-OD1 3.49Å; K647-D696 IonicContact NZ-OD2 2.67Å; K647-D696 PolarHBondContact NZ-OD2 3.3Å
648	H	92.2	Very high	87.6	Confident	41 Å²	41	37 Å²	37	19%	0.19	20%	0.201	C	C	.	.	H	α-helix	trans	-67.3	-37.8	174.3	-75.5	-41.7	0	0	0	112.9	K83 I245 L246 I644 Q646 L650 Q651 H652	K83-H648 WeakPolarHBondContact CE-NE2 3.24Å; I245-H648 HydrophobicContact CG2-CB 4.03Å; L246-H648 HydrophobicContact CD2-CB 4.24Å; I644-H648 PolarHBondContact O-CD2 2.78Å; I644-H648 PolarHBondContact O-N 2.64Å; I644-H648 VanDerWaalsContact O-N 3.09Å; Q646-H648 PolarHBondContact O-N 2.77Å; H648-L650 VanDerWaalsContact C-N 3.29Å; H648-L650 PolarHBondContact O-N 3.29Å; H648-Q651 PolarHBondContact ND1-OE1 2.85Å; H648-Q651 PolarHBondContact O-N 3.24Å; H648-H652 WeakPolarHBondContact O-CB 3.49Å; H648-H652 PolarHBondContact O-N 3.1Å
649	T	92.3	Very high	86.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-38	175.4	-57	0	0	0	0	111.2	I245 L645 Q646 R653 F664 Q668 L672	I245-T649 HydrophobicContact CD1-CG2 4.22Å; L645-T649 VanDerWaalsContact O-CB 3.3Å; L645-T649 WeakPolarHBondContact O-CB 3.26Å; L645-T649 PolarHBondContact O-N 3.48Å; L645-T649 PolarHBondContact O-OG1 3.29Å; Q646-T649 PolarHBondContact O-N 2.86Å; T649-R653 WeakPolarHBondContact O-CB 3.16Å; T649-R653 PolarHBondContact O-N 3.4Å; T649-R653 VanDerWaalsContact O-N 3.09Å; T649-F664 HydrophobicContact CG2-CD1 3.81Å; T649-F664 HydrophobicContact CG2-CE1 3.72Å; T649-Q668 HydrophobicContact CG2-CB 3.95Å; T649-Q668 HydrophobicContact CG2-CG 3.71Å; T649-Q668 VanDerWaalsContact CG2-NE2 3.35Å; T649-Q668 PolarHBondContact O-NE2 2.98Å; T649-L672 HydrophobicContact CG2-CD1 4.25Å
650	L	90	Very high	85.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-73.3	-42.1	176.5	-174.4	60.4	0	0	0	112.1	Q646 K647 H648 H652 R653 M654 G662 F664 Y690 D693 L694 Y697	Q646-L650 WeakPolarHBondContact O-CB 3.29Å; Q646-L650 PolarHBondContact O-N 2.76Å; K647-L650 PolarHBondContact O-N 2.67Å; H648-L650 VanDerWaalsContact C-N 3.29Å; H648-L650 PolarHBondContact O-N 3.29Å; L650-H652 VanDerWaalsContact C-N 3.35Å; L650-H652 PolarHBondContact O-N 3.25Å; L650-R653 CarbonylContact O-C 3.51Å; L650-R653 WeakPolarHBondContact O-CA 3.28Å; L650-R653 PolarHBondContact O-N 2.75Å; L650-M654 HydrophobicContact CD1-CE 4.12Å; L650-M654 HydrophobicContact CD1-CG 4.25Å; L650-M654 HydrophobicContact CD1-SD 4.49Å; L650-M654 HydrophobicContact CG-CG 4.37Å; L650-M654 WeakPolarHBondContact O-CG 3.41Å; L650-M654 PolarHBondContact O-N 3.07Å; L650-G662 WeakPolarHBondContact CD1-O 3.47Å; L650-F664 HydrophobicContact CB-CE1 3.97Å; L650-F664 HydrophobicContact CB-CZ 4.26Å; L650-F664 HydrophobicContact CD1-CE1 4.23Å; L650-Y690 HydrophobicContact CD1-CE2 4.23Å; L650-Y690 HydrophobicContact CD2-CD2 4.37Å; L650-Y690 HydrophobicContact CD2-CE2 4.21Å; L650-D693 HydrophobicContact CD2-CB 3.82Å; L650-L694 HydrophobicContact CD1-CD2 4.18Å; L650-L694 HydrophobicContact CD2-CD2 3.92Å; L650-L694 HydrophobicContact CD2-CG 4.26Å; L650-Y697 HydrophobicContact CD2-CD2 3.98Å; L650-Y697 HydrophobicContact CD2-CE2 3.92Å; L650-Y697 HydrophobicContact CG-CD2 4.36Å; L650-Y697 HydrophobicContact CG-CE2 3.96Å
651	Q	89.9	Confident	85.1	Confident	65 Å²	65	35.5 Å²	35.5	30%	0.304	19%	0.185	S	C	.	.	H	α-helix	trans	-55.2	-48.9	173.1	-77.5	168.6	-8	0	0	111.7	K647 H648 R653 N655 Y697	K647-Q651 WeakPolarHBondContact O-CB 3.49Å; K647-Q651 VanDerWaalsContact O-CG 3.28Å; K647-Q651 WeakPolarHBondContact O-CG 3.24Å; K647-Q651 PolarHBondContact O-N 3.28Å; H648-Q651 PolarHBondContact ND1-OE1 2.85Å; H648-Q651 PolarHBondContact O-N 3.24Å; Q651-R653 VanDerWaalsContact C-N 3.27Å; Q651-R653 PolarHBondContact O-N 3.41Å; Q651-N655 WeakPolarHBondContact O-CB 3.32Å; Q651-N655 VanDerWaalsContact O-CG 3.28Å; Q651-N655 PolarHBondContact O-N 3.22Å; Q651-N655 PolarHBondContact O-ND2 2.93Å; Q651-Y697 WeakPolarHBondContact CA-OH 3.3Å; Q651-Y697 VanDerWaalsContact CG-OH 3.23Å; Q651-Y697 WeakPolarHBondContact CG-OH 2.89Å
652	H	88.1	Confident	84.5	Confident	54 Å²	54	34.6 Å²	34.6	25%	0.25	18%	0.18	C	C	.	.	H	α-helix	trans	-59.6	-39	174	-178.4	-79.5	0	0	0	111.9	I245 H648 L650 D656	I245-H652 HydrophobicContact CG1-CB 3.7Å; H648-H652 WeakPolarHBondContact O-CB 3.49Å; H648-H652 PolarHBondContact O-N 3.1Å; L650-H652 VanDerWaalsContact C-N 3.35Å; L650-H652 PolarHBondContact O-N 3.25Å; H652-D656 PolarHBondContact O-N 3.41Å
653	R	84.1	Confident	84	Confident	13 Å²	13	38.9 Å²	38.9	5%	0.049	20%	0.197	C	C	.	.	H	α-helix	trans	-73.5	-36.2	-177.6	-171	56.7	169.7	140.1	13.4	113.7	T649 L650 Q651 N655 D656 C660 W663	T649-R653 WeakPolarHBondContact O-CB 3.16Å; T649-R653 PolarHBondContact O-N 3.4Å; T649-R653 VanDerWaalsContact O-N 3.09Å; L650-R653 CarbonylContact O-C 3.51Å; L650-R653 WeakPolarHBondContact O-CA 3.28Å; L650-R653 PolarHBondContact O-N 2.75Å; Q651-R653 VanDerWaalsContact C-N 3.27Å; Q651-R653 PolarHBondContact O-N 3.41Å; R653-N655 VanDerWaalsContact C-N 3.31Å; R653-D656 IonicContact CZ-OD2 3.17Å; R653-D656 IonicContact NH1-OD2 3.96Å; R653-D656 PolarHBondContact NH1-OD2 2.88Å; R653-D656 WeakPolarHBondContact O-CB 3.46Å; R653-D656 PolarHBondContact O-N 2.7Å; R653-C660 HydrophobicContact CG-CB 4.05Å; R653-C660 PolarHBondContact O-SG 2.91Å; R653-W663 PolarHBondContact NE-O 3.13Å; R653-W663 PolarHBondContact NH2-O 3.36Å
654	M	81.9	Confident	83.8	Confident	15 Å²	15	38.1 Å²	38.1	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-70.4	-28.9	174.6	-66.4	-57.1	-155.2	0	0	112.5	K112 L650 D656 L694 Y697 V702 V704	K112-M654 PolarHBondContact NZ-O 2.96Å; L650-M654 HydrophobicContact CD1-CE 4.12Å; L650-M654 HydrophobicContact CD1-CG 4.25Å; L650-M654 HydrophobicContact CD1-SD 4.49Å; L650-M654 HydrophobicContact CG-CG 4.37Å; L650-M654 WeakPolarHBondContact O-CG 3.41Å; L650-M654 PolarHBondContact O-N 3.07Å; M654-D656 VanDerWaalsContact C-N 3.29Å; M654-L694 HydrophobicContact CE-CD2 4.23Å; M654-Y697 HydrophobicContact CB-CE1 4.34Å; M654-Y697 HydrophobicContact CE-CD2 4.02Å; M654-Y697 HydrophobicContact CE-CG 4Å; M654-Y697 HydrophobicContact CG-CD1 4.36Å; M654-Y697 HydrophobicContact CG-CD2 4.32Å; M654-Y697 HydrophobicContact CG-CE1 4.1Å; M654-Y697 HydrophobicContact CG-CE2 4.07Å; M654-Y697 HydrophobicContact CG-CG 4.48Å; M654-V702 HydrophobicContact CE-CG1 4.49Å; M654-V704 HydrophobicContact CE-CG2 3.97Å
655	N	82.4	Confident	83.3	Confident	135 Å²	135	35.3 Å²	35.3	72%	0.722	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	0.4	175.9	-67.3	-19.6	0	0	0	113.7	Q651 R653	Q651-N655 WeakPolarHBondContact O-CB 3.32Å; Q651-N655 VanDerWaalsContact O-CG 3.28Å; Q651-N655 PolarHBondContact O-N 3.22Å; Q651-N655 PolarHBondContact O-ND2 2.93Å; R653-N655 VanDerWaalsContact C-N 3.31Å
656	D	78.6	Confident	82.7	Confident	38 Å²	38	35.5 Å²	35.5	20%	0.203	18%	0.177	C	C	.	.	S	Bend	trans	-69.3	158.3	179.6	-166.1	-3	0	0	0	112.1	H652 R653 M654 F658	H652-D656 PolarHBondContact O-N 3.41Å; R653-D656 IonicContact CZ-OD2 3.17Å; R653-D656 IonicContact NH1-OD2 3.96Å; R653-D656 PolarHBondContact NH1-OD2 2.88Å; R653-D656 WeakPolarHBondContact O-CB 3.46Å; R653-D656 PolarHBondContact O-N 2.7Å; M654-D656 VanDerWaalsContact C-N 3.29Å; D656-F658 VanDerWaalsContact C-N 3.25Å; D656-F658 PolarHBondContact O-N 3.39Å
657	S	67.9	Low	82.2	Confident	62 Å²	62	35.5 Å²	35.5	43%	0.434	18%	0.177	S	C	.	.	S	Bend	trans	-74.6	-7.6	176.2	62.5	0	0	0	0	114.5	K112	K112-S657 WeakPolarHBondContact CB-O 3.48Å; K112-S657 PolarHBondContact N-O 2.96Å
658	F	73.2	Confident	82.1	Confident	68 Å²	68	31.8 Å²	31.8	30%	0.298	16%	0.161	S	C	.	.	B	Isolated β-bridge	trans	-107.3	141.1	177.5	-63.9	-82.5	0	0	0	110.7	R109 Q110 D656 C660	R109-F658 HydrophobicContact CB-CB 4.3Å; R109-F658 HydrophobicContact CB-CD1 3.65Å; R109-F658 HydrophobicContact CB-CE1 4.21Å; R109-F658 HydrophobicContact CB-CG 4.06Å; Q110-F658 WeakPolarHBondContact O-CA 3.47Å; D656-F658 VanDerWaalsContact C-N 3.25Å; D656-F658 PolarHBondContact O-N 3.39Å; F658-C660 PolarHBondContact O-N 3.35Å; F658-C660 VanDerWaalsContact O-N 3.17Å
659	S	69.8	Low	81.9	Confident	25 Å²	25	31 Å²	31	18%	0.175	16%	0.159	C	C	.	.			trans	-65.8	119.6	171.6	-171.4	0	0	0	0	108.5	Q110 G166	Q110-S659 PolarHBondContact O-N 3.33Å; G166-S659 PolarHBondContact O-OG 2.85Å; G166-S659 VanDerWaalsContact O-OG 3.05Å
660	C	67.6	Low	81.8	Confident	12 Å²	12	31.7 Å²	31.7	8%	0.081	16%	0.162	C	C	.	.			trans	-117.3	-26.3	-174.5	65.1	0	0	0	0	113.1	R653 F658 G662 W663	R653-C660 HydrophobicContact CG-CB 4.05Å; R653-C660 PolarHBondContact O-SG 2.91Å; F658-C660 PolarHBondContact O-N 3.35Å; F658-C660 VanDerWaalsContact O-N 3.17Å; C660-G662 PolarHBondContact O-N 3.19Å; C660-W663 WeakPolarHBondContact O-CB 3.31Å; C660-W663 PolarHBondContact O-N 3.2Å
661	L	76.1	Confident	81.9	Confident	27 Å²	27	31.7 Å²	31.7	14%	0.141	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	27	-177.1	-55.6	173	0	0	0	114	G166 L703 D705 P766	G166-L661 VanDerWaalsContact CA-CD2 3.49Å; L661-L703 HydrophobicContact CD2-CB 4.28Å; L661-L703 HydrophobicContact CD2-CD2 4.3Å; L661-L703 HydrophobicContact CD2-CG 3.97Å; L661-L703 WeakPolarHBondContact CD2-O 3.35Å; L661-D705 HydrophobicContact CB-CB 3.77Å; L661-D705 HydrophobicContact CD1-CB 4.38Å; L661-D705 PolarHBondContact O-N 3.42Å; L661-P766 HydrophobicContact CD1-CB 4Å; L661-P766 HydrophobicContact CD1-CG 3.76Å; L661-P766 HydrophobicContact CD2-CG 4.15Å
662	G	80.8	Confident	82	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.4	-23.2	-173.5	0	0	0	0	0	115.6	L650 C660 F664 Y690 L708	L650-G662 WeakPolarHBondContact CD1-O 3.47Å; C660-G662 PolarHBondContact O-N 3.19Å; G662-F664 PolarHBondContact O-N 2.85Å; G662-Y690 PolarHBondContact O-OH 3.42Å; G662-L708 VanDerWaalsContact C-CD2 3.47Å
663	W	84.3	Confident	82.1	Confident	91 Å²	91	28.4 Å²	28.4	35%	0.345	15%	0.149	S	C	.	.	P	Polyproline II helix	trans	-64.5	116.5	-175.6	-68.2	96.4	0	0	0	113.1	M106 R653 C660 D705 L708	M106-W663 HydrophobicContact CE-CE3 4.37Å; R653-W663 PolarHBondContact NE-O 3.13Å; R653-W663 PolarHBondContact NH2-O 3.36Å; C660-W663 WeakPolarHBondContact O-CB 3.31Å; C660-W663 PolarHBondContact O-N 3.2Å; W663-D705 PolarHBondContact NE1-OD2 3.45Å; W663-L708 HydrophobicContact CD2-CB 4.45Å; W663-L708 HydrophobicContact CD2-CD1 3.9Å; W663-L708 HydrophobicContact CD2-CD2 4.35Å; W663-L708 HydrophobicContact CD2-CG 4.47Å; W663-L708 HydrophobicContact CE3-CD1 3.77Å; W663-L708 HydrophobicContact CG-CD2 4.29Å; W663-L708 HydrophobicContact CH2-CB 4.48Å; W663-L708 HydrophobicContact CH2-CD1 3.95Å; W663-L708 HydrophobicContact CZ2-CB 3.87Å; W663-L708 HydrophobicContact CZ2-CD1 4.08Å; W663-L708 HydrophobicContact CZ3-CD1 3.79Å
664	F	86.6	Confident	82.4	Confident	10 Å²	10	27.8 Å²	27.8	4%	0.044	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-54.3	151.7	168.7	-65.1	-54	0	0	0	112.8	M106 Q646 T649 L650 G662 Q668 V669 L672 Y690	M106-F664 WeakPolarHBondContact CE-O 3.25Å; Q646-F664 HydrophobicContact CG-CE2 4.5Å; Q646-F664 HydrophobicContact CG-CZ 4Å; T649-F664 HydrophobicContact CG2-CD1 3.81Å; T649-F664 HydrophobicContact CG2-CE1 3.72Å; L650-F664 HydrophobicContact CB-CE1 3.97Å; L650-F664 HydrophobicContact CB-CZ 4.26Å; L650-F664 HydrophobicContact CD1-CE1 4.23Å; G662-F664 PolarHBondContact O-N 2.85Å; F664-Q668 HydrophobicContact CB-CB 4.02Å; F664-Q668 HydrophobicContact CD1-CB 4.44Å; F664-V669 HydrophobicContact CB-CG2 3.7Å; F664-L672 HydrophobicContact CD2-CD1 4.16Å; F664-L672 HydrophobicContact CE1-CD1 4.43Å; F664-L672 HydrophobicContact CE2-CD1 4.04Å; F664-L672 HydrophobicContact CG-CD1 4.41Å; F664-L672 HydrophobicContact CZ-CD1 4.19Å; F664-Y690 HydrophobicContact CD2-CE1 4.47Å; F664-Y690 HydrophobicContact CD2-CE2 4.16Å; F664-Y690 AromaticContact CD2-CZ 3.8Å; F664-Y690 WeakPolarHBondContact CD2-OH 3.3Å; F664-Y690 HydrophobicContact CE1-CE2 4.4Å; F664-Y690 AromaticContact CE2-CD2 3.95Å; F664-Y690 HydrophobicContact CE2-CD2 3.95Å; F664-Y690 HydrophobicContact CE2-CE1 4.04Å; F664-Y690 AromaticContact CE2-CE2 3.29Å; F664-Y690 HydrophobicContact CE2-CE2 3.29Å; F664-Y690 AromaticContact CE2-CZ 3.33Å; F664-Y690 WeakPolarHBondContact CE2-OH 3.15Å; F664-Y690 HydrophobicContact CZ-CD2 4.03Å; F664-Y690 AromaticContact CZ-CE2 3.44Å; F664-Y690 HydrophobicContact CZ-CE2 3.44Å; F664-Y690 VanDerWaalsContact CZ-CE2 3.44Å; F664-Y690 AromaticContact CZ-CZ 3.96Å
665	S	82.2	Confident	82.9	Confident	5 Å²	5	27.1 Å²	27.1	4%	0.035	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-75	157.7	172.9	81	0	0	0	0	111.9	G667 Q668 V669	S665-G667 PolarHBondContact O-N 3.4Å; S665-G667 VanDerWaalsContact O-N 3.13Å; S665-Q668 WeakPolarHBondContact O-CA 3.29Å; S665-Q668 WeakPolarHBondContact O-CB 3.49Å; S665-Q668 PolarHBondContact O-N 3.46Å; S665-Q668 WeakPolarHBondContact OG-CG 3.42Å; S665-Q668 PolarHBondContact OG-N 3.36Å; S665-V669 WeakPolarHBondContact O-CG2 3.31Å; S665-V669 PolarHBondContact O-N 3.08Å
666	P	81.9	Confident	83.3	Confident	5 Å²	5	21.3 Å²	21.3	3%	0.032	11%	0.113	C	C	.	.	H	α-helix	trans	-50.3	-37.5	175.6	-31.6	36.1	0	0	0	114.9	P103 M106 F670	P103-P666 WeakPolarHBondContact O-CB 3.34Å; M106-P666 HydrophobicContact CB-CG 4.05Å; M106-P666 HydrophobicContact CG-CG 4.23Å; M106-P666 HydrophobicContact SD-CB 4.37Å; M106-P666 HydrophobicContact SD-CG 3.82Å; P666-F670 WeakPolarHBondContact O-CB 3.36Å; P666-F670 PolarHBondContact O-N 3.24Å
667	G	84.1	Confident	83.8	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-75	-32.8	176.5	0	0	0	0	0	114.1	S665 V671	S665-G667 PolarHBondContact O-N 3.4Å; S665-G667 VanDerWaalsContact O-N 3.13Å; G667-V671 WeakPolarHBondContact O-CG2 3.36Å; G667-V671 PolarHBondContact O-N 2.96Å
668	Q	89.3	Confident	84.8	Confident	2 Å²	2	17.7 Å²	17.7	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-67	-48.3	171.3	-72.7	175	-37.4	0	0	110.3	M241 T649 F664 S665 F670 V671 L672	M241-Q668 HydrophobicContact CE-CG 3.67Å; M241-Q668 HydrophobicContact SD-CG 3.86Å; T649-Q668 HydrophobicContact CG2-CB 3.95Å; T649-Q668 HydrophobicContact CG2-CG 3.71Å; T649-Q668 VanDerWaalsContact CG2-NE2 3.35Å; T649-Q668 PolarHBondContact O-NE2 2.98Å; F664-Q668 HydrophobicContact CB-CB 4.02Å; F664-Q668 HydrophobicContact CD1-CB 4.44Å; S665-Q668 WeakPolarHBondContact O-CA 3.29Å; S665-Q668 WeakPolarHBondContact O-CB 3.49Å; S665-Q668 PolarHBondContact O-N 3.46Å; S665-Q668 WeakPolarHBondContact OG-CG 3.42Å; S665-Q668 PolarHBondContact OG-N 3.36Å; Q668-F670 PolarHBondContact O-N 2.88Å; Q668-V671 PolarHBondContact O-N 3.03Å; Q668-L672 WeakPolarHBondContact O-CB 3.49Å; Q668-L672 VanDerWaalsContact O-CG 3.23Å; Q668-L672 WeakPolarHBondContact O-CG 3.37Å; Q668-L672 PolarHBondContact O-N 2.75Å
669	V	89.1	Confident	85.5	Confident	23 Å²	23	15.1 Å²	15.1	14%	0.139	8%	0.08	C	C	.	.	H	α-helix	trans	-55.4	-53.1	175.6	174.4	0	0	0	0	110.4	P103 M106 F664 S665 V671 L672 D673	P103-V669 HydrophobicContact CG-CG1 4.15Å; M106-V669 HydrophobicContact CE-CG2 4.47Å; M106-V669 HydrophobicContact SD-CG2 4.37Å; F664-V669 HydrophobicContact CB-CG2 3.7Å; S665-V669 WeakPolarHBondContact O-CG2 3.31Å; S665-V669 PolarHBondContact O-N 3.08Å; V669-V671 PolarHBondContact O-N 2.83Å; V669-L672 PolarHBondContact O-N 2.96Å; V669-D673 VanDerWaalsContact CG1-OD2 3.31Å; V669-D673 WeakPolarHBondContact CG1-OD2 3.36Å; V669-D673 WeakPolarHBondContact O-CB 3.36Å; V669-D673 PolarHBondContact O-N 3.18Å
670	F	90.3	Very high	86.3	Confident	15 Å²	15	15.4 Å²	15.4	7%	0.066	9%	0.087	C	C	.	.	H	α-helix	trans	-52	-47.1	178.5	165.4	-111	0	0	0	114	P97 A100 Q102 L238 P666 Q668 E674	P97-F670 HydrophobicContact CB-CE2 4.18Å; P97-F670 HydrophobicContact CB-CZ 3.69Å; P97-F670 HydrophobicContact CG-CZ 3.92Å; A100-F670 HydrophobicContact CB-CD2 3.7Å; A100-F670 HydrophobicContact CB-CE2 3.99Å; A100-F670 WeakPolarHBondContact O-CE2 3.3Å; Q102-F670 HydrophobicContact CG-CB 3.79Å; Q102-F670 HydrophobicContact CG-CD1 3.82Å; Q102-F670 HydrophobicContact CG-CD2 4.01Å; Q102-F670 HydrophobicContact CG-CE1 4.43Å; Q102-F670 HydrophobicContact CG-CG 3.59Å; L238-F670 HydrophobicContact CD1-CD1 3.88Å; L238-F670 HydrophobicContact CD1-CE1 3.74Å; P666-F670 WeakPolarHBondContact O-CB 3.36Å; P666-F670 PolarHBondContact O-N 3.24Å; Q668-F670 PolarHBondContact O-N 2.88Å; F670-E674 WeakPolarHBondContact O-CB 3.32Å; F670-E674 PolarHBondContact O-N 2.96Å
671	V	91.1	Very high	87.3	Confident	1 Å²	1	15.5 Å²	15.5	1%	0.006	9%	0.087	C	C	.	.	H	α-helix	trans	-74.6	-36	-179.4	174.8	0	0	0	0	112.1	V90 I94 L238 F242 G667 Q668 V669 Y675	V90-V671 HydrophobicContact CG1-CG1 3.89Å; I94-V671 HydrophobicContact CD1-CG2 4.3Å; I94-V671 HydrophobicContact CG1-CG1 4.38Å; I94-V671 HydrophobicContact CG1-CG2 3.79Å; L238-V671 HydrophobicContact CD1-CG2 4.34Å; L238-V671 HydrophobicContact CD2-CG2 4.36Å; F242-V671 HydrophobicContact CD2-CB 4.36Å; F242-V671 HydrophobicContact CD2-CG1 4.14Å; F242-V671 HydrophobicContact CD2-CG2 4.26Å; F242-V671 HydrophobicContact CE1-CG1 4.28Å; F242-V671 HydrophobicContact CE2-CB 3.47Å; F242-V671 VanDerWaalsContact CE2-CB 3.47Å; F242-V671 HydrophobicContact CE2-CG1 3.59Å; F242-V671 HydrophobicContact CE2-CG2 3.64Å; F242-V671 HydrophobicContact CZ-CB 3.69Å; F242-V671 HydrophobicContact CZ-CG1 3.68Å; F242-V671 HydrophobicContact CZ-CG2 4.37Å; G667-V671 WeakPolarHBondContact O-CG2 3.36Å; G667-V671 PolarHBondContact O-N 2.96Å; Q668-V671 PolarHBondContact O-N 3.03Å; V669-V671 PolarHBondContact O-N 2.83Å; V671-Y675 WeakPolarHBondContact O-CB 3.33Å; V671-Y675 PolarHBondContact O-N 2.87Å
672	L	91.9	Very high	87.7	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.2	-38.4	174.4	-67.5	173.2	0	0	0	111.7	F642 L645 T649 F664 Q668 V669 Y675 C676	F642-L672 HydrophobicContact CD2-CD2 4.49Å; F642-L672 HydrophobicContact CE2-CB 4.11Å; F642-L672 HydrophobicContact CE2-CD2 3.61Å; F642-L672 HydrophobicContact CE2-CG 4.42Å; F642-L672 HydrophobicContact CZ-CB 4.33Å; F642-L672 HydrophobicContact CZ-CD2 4.02Å; L645-L672 HydrophobicContact CD2-CD2 3.94Å; L645-L672 HydrophobicContact CG-CD2 3.91Å; T649-L672 HydrophobicContact CG2-CD1 4.25Å; F664-L672 HydrophobicContact CD2-CD1 4.16Å; F664-L672 HydrophobicContact CE1-CD1 4.43Å; F664-L672 HydrophobicContact CE2-CD1 4.04Å; F664-L672 HydrophobicContact CG-CD1 4.41Å; F664-L672 HydrophobicContact CZ-CD1 4.19Å; Q668-L672 WeakPolarHBondContact O-CB 3.49Å; Q668-L672 VanDerWaalsContact O-CG 3.23Å; Q668-L672 WeakPolarHBondContact O-CG 3.37Å; Q668-L672 PolarHBondContact O-N 2.75Å; V669-L672 PolarHBondContact O-N 2.96Å; L672-Y675 PolarHBondContact O-N 3.32Å; L672-C676 WeakPolarHBondContact O-CB 3.43Å; L672-C676 PolarHBondContact O-N 3.36Å; L672-C676 PolarHBondContact O-SG 3.11Å
673	D	91.1	Very high	88	Confident	50 Å²	50	17.4 Å²	17.4	27%	0.267	10%	0.1	S	C	.	.	H	α-helix	trans	-64.4	-48.9	175.1	-69.2	-10	0	0	0	111.1	A100 V669 Y675 C676 A677 R686	A100-D673 HydrophobicContact CB-CB 4.02Å; V669-D673 VanDerWaalsContact CG1-OD2 3.31Å; V669-D673 WeakPolarHBondContact CG1-OD2 3.36Å; V669-D673 WeakPolarHBondContact O-CB 3.36Å; V669-D673 PolarHBondContact O-N 3.18Å; D673-Y675 VanDerWaalsContact C-N 3.31Å; D673-Y675 PolarHBondContact O-N 2.76Å; D673-C676 PolarHBondContact O-N 3.09Å; D673-A677 VanDerWaalsContact O-CB 3.32Å; D673-A677 WeakPolarHBondContact O-CB 3.41Å; D673-A677 PolarHBondContact O-N 3.33Å; D673-R686 IonicContact OD1-CZ 3.23Å; D673-R686 IonicContact OD1-NH1 3.94Å; D673-R686 PolarHBondContact OD1-NH1 3.09Å; D673-R686 IonicContact OD1-NH2 2.82Å; D673-R686 PolarHBondContact OD1-NH2 2.84Å
674	E	90.4	Very high	88.2	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62	-39	177.3	-167.6	70.4	175.4	0	0	111.6	C93 P97 F98 N99 A100 F670 R678	C93-E674 HydrophobicContact CB-CB 4.22Å; C93-E674 HydrophobicContact CB-CG 3.87Å; P97-E674 VanDerWaalsContact CA-OE1 3.26Å; P97-E674 WeakPolarHBondContact CA-OE1 3.47Å; P97-E674 HydrophobicContact CB-CG 4.42Å; F98-E674 WeakPolarHBondContact CD1-OE1 3.47Å; F98-E674 PolarHBondContact N-OE1 2.72Å; N99-E674 WeakPolarHBondContact CB-OE2 3.42Å; N99-E674 PolarHBondContact N-OE1 3.46Å; N99-E674 PolarHBondContact N-OE2 2.86Å; A100-E674 HydrophobicContact CB-CB 4.11Å; A100-E674 WeakPolarHBondContact CB-OE2 3.36Å; A100-E674 PolarHBondContact N-OE2 2.95Å; F670-E674 WeakPolarHBondContact O-CB 3.32Å; F670-E674 PolarHBondContact O-N 2.96Å; E674-R678 WeakPolarHBondContact O-CB 3.46Å; E674-R678 PolarHBondContact O-N 3.5Å
675	Y	92.8	Very high	88.3	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.9	-49.9	173.6	-171.1	-71.6	0	0	0	111.4	F89 V90 H638 F642 L645 V671 L672 D673 A677 R678 Y679 V681	F89-Y675 HydrophobicContact CB-CD2 4.33Å; F89-Y675 HydrophobicContact CB-CE2 3.63Å; V90-Y675 HydrophobicContact CG2-CD2 4.27Å; H638-Y675 HydrophobicContact CB-CE1 4.48Å; H638-Y675 AromaticContact ND1-CE1 3.92Å; H638-Y675 AromaticContact ND1-CZ 3.64Å; H638-Y675 PolarHBondContact ND1-OH 3.06Å; F642-Y675 HydrophobicContact CB-CE1 4.1Å; F642-Y675 AromaticContact CD2-CD1 3.68Å; F642-Y675 HydrophobicContact CD2-CD1 3.68Å; F642-Y675 HydrophobicContact CD2-CE1 4.08Å; F642-Y675 HydrophobicContact CD2-CG 4.38Å; F642-Y675 HydrophobicContact CE2-CD1 4.47Å; L645-Y675 HydrophobicContact CD2-CD2 3.91Å; L645-Y675 HydrophobicContact CD2-CE2 4.12Å; L645-Y675 HydrophobicContact CD2-CG 4.29Å; V671-Y675 WeakPolarHBondContact O-CB 3.33Å; V671-Y675 PolarHBondContact O-N 2.87Å; L672-Y675 PolarHBondContact O-N 3.32Å; D673-Y675 VanDerWaalsContact C-N 3.31Å; D673-Y675 PolarHBondContact O-N 2.76Å; Y675-A677 VanDerWaalsContact C-N 3.34Å; Y675-A677 PolarHBondContact O-N 3.46Å; Y675-R678 PolarHBondContact O-N 2.88Å; Y675-Y679 AromaticContact CD1-CD2 3.84Å; Y675-Y679 HydrophobicContact CD1-CD2 3.84Å; Y675-Y679 AromaticContact CD2-CD2 3.78Å; Y675-Y679 HydrophobicContact CD2-CD2 3.78Å; Y675-Y679 AromaticContact CD2-CE2 3.87Å; Y675-Y679 HydrophobicContact CD2-CE2 3.87Å; Y675-Y679 AromaticContact CE1-CD2 3.9Å; Y675-Y679 HydrophobicContact CE1-CD2 3.9Å; Y675-Y679 HydrophobicContact CE1-CG 4.48Å; Y675-Y679 AromaticContact CE2-CD2 3.88Å; Y675-Y679 HydrophobicContact CE2-CD2 3.88Å; Y675-Y679 HydrophobicContact CE2-CE2 4.02Å; Y675-Y679 AromaticContact CG-CD2 3.75Å; Y675-Y679 HydrophobicContact CG-CD2 3.75Å; Y675-Y679 HydrophobicContact CG-CE2 4.23Å; Y675-Y679 AromaticContact CZ-CD2 3.92Å; Y675-Y679 WeakPolarHBondContact O-CB 3.17Å; Y675-Y679 WeakPolarHBondContact O-CD2 3.46Å; Y675-Y679 PolarHBondContact O-N 3.36Å; Y675-V681 HydrophobicContact CD1-CG2 4.1Å; Y675-V681 HydrophobicContact CE1-CG2 4Å
676	C	91.1	Very high	88.7	Confident	14 Å²	14	15.9 Å²	15.9	10%	0.095	10%	0.095	C	C	.	.	H	α-helix	trans	-59.6	-46.7	-179.5	-69.4	0	0	0	0	111.4	F642 L672 D673 G680 V681	F642-C676 WeakPolarHBondContact CE2-SG 3.4Å; F642-C676 VanDerWaalsContact CZ-SG 3.56Å; L672-C676 WeakPolarHBondContact O-CB 3.43Å; L672-C676 PolarHBondContact O-N 3.36Å; L672-C676 PolarHBondContact O-SG 3.11Å; D673-C676 PolarHBondContact O-N 3.09Å; C676-G680 CarbonylContact O-C 3.59Å; C676-G680 WeakPolarHBondContact O-CA 3.3Å; C676-G680 PolarHBondContact O-N 3.35Å; C676-V681 HydrophobicContact CB-CB 4.19Å; C676-V681 PolarHBondContact O-N 3.35Å
677	A	88.1	Confident	89.2	Confident	22 Å²	22	16.6 Å²	16.6	18%	0.182	10%	0.098	C	C	.	.	H	α-helix	trans	-61.2	-56.9	177.6	0	0	0	0	0	111.4	N99 R279 L315 D673 Y675 Y679	N99-A677 HydrophobicContact CB-CB 4.49Å; N99-A677 WeakPolarHBondContact ND2-CB 3.47Å; R279-A677 PolarHBondContact NH1-O 2.94Å; L315-A677 WeakPolarHBondContact CD1-O 3.35Å; L315-A677 HydrophobicContact CD2-CB 4.01Å; D673-A677 VanDerWaalsContact O-CB 3.32Å; D673-A677 WeakPolarHBondContact O-CB 3.41Å; D673-A677 PolarHBondContact O-N 3.33Å; Y675-A677 VanDerWaalsContact C-N 3.34Å; Y675-A677 PolarHBondContact O-N 3.46Å; A677-Y679 PolarHBondContact O-N 2.99Å
678	R	88.9	Confident	89.5	Confident	2 Å²	2	16.6 Å²	16.6	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-63.2	-39.2	-173.9	-174.6	172.7	177.3	159.3	-9.6	113.3	R92 Y96 F98 E275 R279 E674 Y675	R92-R678 PolarHBondContact O-NH1 3.2Å; Y96-R678 VanDerWaalsContact CE2-NH1 3.25Å; Y96-R678 PolarHBondContact OH-NH2 3.05Å; Y96-R678 VanDerWaalsContact OH-NH2 3.09Å; F98-R678 HydrophobicContact CE1-CG 4.41Å; E275-R678 IonicContact OE1-NH2 3.59Å; E275-R678 PolarHBondContact OE1-NH2 3.39Å; E275-R678 IonicContact OE2-CZ 2.74Å; E275-R678 IonicContact OE2-NE 3.82Å; E275-R678 PolarHBondContact OE2-NE 3.3Å; E275-R678 IonicContact OE2-NH2 3.46Å; E275-R678 PolarHBondContact OE2-NH2 2.93Å; R279-R678 VanDerWaalsContact CD-O 3.27Å; R279-R678 WeakPolarHBondContact CD-O 3.28Å; R279-R678 VanDerWaalsContact NH1-C 3.32Å; R279-R678 PolarHBondContact NH1-O 2.87Å; E674-R678 WeakPolarHBondContact O-CB 3.46Å; E674-R678 PolarHBondContact O-N 3.5Å; Y675-R678 PolarHBondContact O-N 2.88Å
679	Y	88.9	Confident	89.7	Confident	14 Å²	14	17.1 Å²	17.1	6%	0.055	10%	0.101	C	C	.	.	H	α-helix	trans	-101.6	-3.9	-176.5	-57.3	-63.1	0	0	0	114.8	F89 P633 H638 Y675 A677	F89-Y679 HydrophobicContact CB-CE2 3.76Å; F89-Y679 HydrophobicContact CD1-CE1 4.05Å; F89-Y679 AromaticContact CD1-CZ 3.86Å; F89-Y679 HydrophobicContact CG-CE2 4.37Å; F89-Y679 PolarHBondContact O-OH 2.96Å; P633-Y679 HydrophobicContact CB-CD1 4.07Å; P633-Y679 HydrophobicContact CB-CE1 3.93Å; P633-Y679 HydrophobicContact CG-CE1 4.24Å; H638-Y679 AromaticContact CE1-CD1 3.41Å; H638-Y679 VanDerWaalsContact CE1-CD1 3.41Å; H638-Y679 WeakPolarHBondContact CE1-CD1 3.24Å; H638-Y679 AromaticContact CE1-CG 3.48Å; H638-Y679 VanDerWaalsContact CE1-CG 3.48Å; H638-Y679 AromaticContact ND1-CG 3.66Å; H638-Y679 AromaticContact NE2-CD1 3.55Å; H638-Y679 AromaticContact NE2-CG 3.9Å; Y675-Y679 AromaticContact CD1-CD2 3.84Å; Y675-Y679 HydrophobicContact CD1-CD2 3.84Å; Y675-Y679 AromaticContact CD2-CD2 3.78Å; Y675-Y679 HydrophobicContact CD2-CD2 3.78Å; Y675-Y679 AromaticContact CD2-CE2 3.87Å; Y675-Y679 HydrophobicContact CD2-CE2 3.87Å; Y675-Y679 AromaticContact CE1-CD2 3.9Å; Y675-Y679 HydrophobicContact CE1-CD2 3.9Å; Y675-Y679 HydrophobicContact CE1-CG 4.48Å; Y675-Y679 AromaticContact CE2-CD2 3.88Å; Y675-Y679 HydrophobicContact CE2-CD2 3.88Å; Y675-Y679 HydrophobicContact CE2-CE2 4.02Å; Y675-Y679 AromaticContact CG-CD2 3.75Å; Y675-Y679 HydrophobicContact CG-CD2 3.75Å; Y675-Y679 HydrophobicContact CG-CE2 4.23Å; Y675-Y679 AromaticContact CZ-CD2 3.92Å; Y675-Y679 WeakPolarHBondContact O-CB 3.17Å; Y675-Y679 WeakPolarHBondContact O-CD2 3.46Å; Y675-Y679 PolarHBondContact O-N 3.36Å; A677-Y679 PolarHBondContact O-N 2.99Å
680	G	85.4	Confident	89.9	Confident	31 Å²	31	16.7 Å²	16.7	32%	0.32	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	28.2	172.2	0	0	0	0	0	115.4	C676 R682	C676-G680 CarbonylContact O-C 3.59Å; C676-G680 WeakPolarHBondContact O-CA 3.3Å; C676-G680 PolarHBondContact O-N 3.35Å; G680-R682 PolarHBondContact O-N 2.92Å
681	V	88.2	Confident	90	Very high	13 Å²	13	16 Å²	16	8%	0.079	9%	0.094	C	C	.	.			trans	-71.4	120	178.3	-174.1	0	0	0	0	109.8	H638 F642 Y675 C676 G683	H638-V681 HydrophobicContact CB-CG2 4.15Å; F642-V681 HydrophobicContact CB-CG1 4.09Å; F642-V681 HydrophobicContact CB-CG2 4Å; F642-V681 HydrophobicContact CD1-CG1 4.04Å; F642-V681 HydrophobicContact CD2-CG2 4.5Å; F642-V681 HydrophobicContact CG-CG1 4.01Å; F642-V681 HydrophobicContact CG-CG2 4.3Å; Y675-V681 HydrophobicContact CD1-CG2 4.1Å; Y675-V681 HydrophobicContact CE1-CG2 4Å; C676-V681 HydrophobicContact CB-CB 4.19Å; C676-V681 PolarHBondContact O-N 3.35Å; V681-G683 PolarHBondContact O-N 2.9Å
682	R	85.7	Confident	90.1	Very high	42 Å²	42	18.9 Å²	18.9	16%	0.158	11%	0.107	C	C	.	.			trans	-61.8	132.2	-179.6	-73.8	172.8	60.7	98.8	-16.2	111.4	E307 G680 C684 H685 R686 H719 T730 E735	E307-R682 IonicContact OE1-NH1 3.85Å; E307-R682 PolarHBondContact OE1-NH1 3.21Å; E307-R682 IonicContact OE2-NH1 2.89Å; G680-R682 PolarHBondContact O-N 2.92Å; R682-C684 VanDerWaalsContact C-N 3.27Å; R682-C684 PolarHBondContact O-N 2.88Å; R682-H685 PolarHBondContact O-N 2.96Å; R682-R686 PolarHBondContact O-N 3.22Å; R682-R686 VanDerWaalsContact O-N 3.15Å; R682-H719 PolarHBondContact NH2-NE2 3.08Å; R682-T730 PolarHBondContact NH1-OG1 3.18Å; R682-T730 PolarHBondContact NH2-O 2.84Å; R682-E735 IonicContact CZ-OE1 2.73Å; R682-E735 IonicContact CZ-OE2 3.82Å; R682-E735 IonicContact NE-OE1 2.63Å; R682-E735 PolarHBondContact NE-OE1 3.39Å; R682-E735 IonicContact NE-OE2 3.74Å; R682-E735 PolarHBondContact NE-OE2 3.06Å; R682-E735 IonicContact NH2-OE1 3.94Å; R682-E735 PolarHBondContact NH2-OE1 3.43Å; R682-E735 IonicContact NH2-OE2 2.66Å; R682-E735 PolarHBondContact NH2-OE2 3.17Å
683	G	86.6	Confident	90.1	Very high	25 Å²	25	19.3 Å²	19.3	26%	0.258	11%	0.109	S	C	.	.	H	α-helix	trans	-59.7	-32.8	-178.4	0	0	0	0	0	114.1	V681 R686 H687	V681-G683 PolarHBondContact O-N 2.9Å; G683-R686 PolarHBondContact O-N 2.69Å; G683-H687 PolarHBondContact O-CD2 3.4Å; G683-H687 PolarHBondContact O-N 3.38Å; G683-H687 VanDerWaalsContact O-N 3.09Å
684	C	87.7	Confident	90.1	Very high	1 Å²	1	17 Å²	17	1%	0.007	10%	0.096	C	C	.	.	H	α-helix	trans	-67.4	-49.5	178.2	-168.7	0	0	0	0	111.3	R682 R686 H687 L688 H719	R682-C684 VanDerWaalsContact C-N 3.27Å; R682-C684 PolarHBondContact O-N 2.88Å; C684-R686 VanDerWaalsContact C-N 3.28Å; C684-R686 PolarHBondContact O-N 3.29Å; C684-H687 PolarHBondContact O-N 2.95Å; C684-L688 WeakPolarHBondContact O-CB 3.23Å; C684-L688 WeakPolarHBondContact O-CG 3.48Å; C684-L688 PolarHBondContact O-N 3.15Å; C684-H719 HydrophobicContact CB-CB 4.39Å; C684-H719 WeakPolarHBondContact CB-CD2 3.12Å; C684-H719 PolarHBondContact SG-CD2 3.47Å
685	H	89.2	Confident	90.1	Very high	36 Å²	36	17 Å²	17	17%	0.167	10%	0.097	C	C	.	.	H	α-helix	trans	-50.8	-46.3	171.3	-179.7	73.6	0	0	0	112.4	A639 S643 R682 H687 L688 S689	A639-H685 PolarHBondContact O-NE2 2.99Å; S643-H685 PolarHBondContact OG-NE2 3.4Å; S643-H685 VanDerWaalsContact OG-NE2 3.14Å; R682-H685 PolarHBondContact O-N 2.96Å; H685-H687 PolarHBondContact O-N 2.95Å; H685-L688 PolarHBondContact O-N 2.56Å; H685-S689 VanDerWaalsContact O-CB 3.31Å; H685-S689 WeakPolarHBondContact O-CB 3.4Å; H685-S689 PolarHBondContact O-N 2.75Å
686	R	91.3	Very high	90	Very high	38 Å²	38	19.4 Å²	19.4	14%	0.143	11%	0.11	C	C	.	.	H	α-helix	trans	-56.9	-43.9	175.5	164.2	172.8	177.6	-177.2	-1.6	113.2	F642 Q646 D673 R682 G683 C684 Y690	F642-R686 HydrophobicContact CE1-CB 3.86Å; F642-R686 HydrophobicContact CE1-CG 3.74Å; F642-R686 HydrophobicContact CZ-CB 4.47Å; F642-R686 HydrophobicContact CZ-CG 4.01Å; Q646-R686 PolarHBondContact NE2-O 3.47Å; Q646-R686 VanDerWaalsContact NE2-O 3.12Å; Q646-R686 PolarHBondContact OE1-O 2.8Å; D673-R686 IonicContact OD1-CZ 3.23Å; D673-R686 IonicContact OD1-NH1 3.94Å; D673-R686 PolarHBondContact OD1-NH1 3.09Å; D673-R686 IonicContact OD1-NH2 2.82Å; D673-R686 PolarHBondContact OD1-NH2 2.84Å; R682-R686 PolarHBondContact O-N 3.22Å; R682-R686 VanDerWaalsContact O-N 3.15Å; G683-R686 PolarHBondContact O-N 2.69Å; C684-R686 VanDerWaalsContact C-N 3.28Å; C684-R686 PolarHBondContact O-N 3.29Å; R686-Y690 VanDerWaalsContact O-CB 3.28Å; R686-Y690 WeakPolarHBondContact O-CB 3.38Å; R686-Y690 PolarHBondContact O-N 3.17Å
687	H	92	Very high	89.8	Confident	20 Å²	20	21.1 Å²	21.1	9%	0.093	11%	0.114	C	C	.	.	H	α-helix	trans	-79.2	-31.4	179.5	-78.7	-79.9	0	0	0	112.8	G683 C684 H685 Y690 L691 Y711 S712 F715 C716	G683-H687 PolarHBondContact O-CD2 3.4Å; G683-H687 PolarHBondContact O-N 3.38Å; G683-H687 VanDerWaalsContact O-N 3.09Å; C684-H687 PolarHBondContact O-N 2.95Å; H685-H687 PolarHBondContact O-N 2.95Å; H687-Y690 PolarHBondContact O-N 3.41Å; H687-L691 WeakPolarHBondContact O-CB 3.29Å; H687-L691 VanDerWaalsContact O-CG 3.25Å; H687-L691 WeakPolarHBondContact O-CG 3.47Å; H687-L691 PolarHBondContact O-N 3.37Å; H687-Y711 AromaticContact CE1-CE1 3.82Å; H687-S712 WeakPolarHBondContact ND1-CB 3.46Å; H687-S712 PolarHBondContact ND1-OG 2.86Å; H687-S712 VanDerWaalsContact ND1-OG 3.14Å; H687-F715 HydrophobicContact CB-CD1 4.29Å; H687-F715 AromaticContact CD2-CD1 3.44Å; H687-F715 VanDerWaalsContact CD2-CD1 3.44Å; H687-F715 WeakPolarHBondContact CD2-CD1 3.43Å; H687-F715 AromaticContact CD2-CE1 3.82Å; H687-F715 AromaticContact CD2-CG 3.82Å; H687-C716 WeakPolarHBondContact CB-SG 3.4Å
688	L	91.3	Very high	89.7	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.4	-44.6	173.1	-71.1	174.6	0	0	0	112.1	C684 H685 Y690 L691 K692 C716 E735 Q738 F739	C684-L688 WeakPolarHBondContact O-CB 3.23Å; C684-L688 WeakPolarHBondContact O-CG 3.48Å; C684-L688 PolarHBondContact O-N 3.15Å; H685-L688 PolarHBondContact O-N 2.56Å; L688-Y690 VanDerWaalsContact C-N 3.33Å; L688-L691 PolarHBondContact O-N 2.84Å; L688-K692 VanDerWaalsContact O-CG 3.3Å; L688-K692 WeakPolarHBondContact O-CG 3.4Å; L688-K692 PolarHBondContact O-N 3.24Å; L688-K692 VanDerWaalsContact O-N 3.1Å; L688-C716 HydrophobicContact CD2-CB 4.18Å; L688-E735 HydrophobicContact CD1-CB 4.25Å; L688-E735 HydrophobicContact CD1-CG 4.39Å; L688-E735 WeakPolarHBondContact CD1-O 3.44Å; L688-Q738 HydrophobicContact CD1-CB 4.17Å; L688-F739 HydrophobicContact CD2-CB 3.93Å; L688-F739 HydrophobicContact CD2-CD2 4.13Å
689	S	92	Very high	89.5	Confident	12 Å²	12	25 Å²	25	8%	0.084	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-44.8	173.4	-167.9	0	0	0	0	110.6	S643 H685 K692 D693	S643-S689 WeakPolarHBondContact CB-OG 3.24Å; S643-S689 PolarHBondContact OG-OG 3.04Å; H685-S689 VanDerWaalsContact O-CB 3.31Å; H685-S689 WeakPolarHBondContact O-CB 3.4Å; H685-S689 PolarHBondContact O-N 2.75Å; S689-K692 PolarHBondContact O-N 2.98Å; S689-D693 PolarHBondContact O-N 3.09Å
690	Y	93.3	Very high	89.3	Confident	14 Å²	14	30.3 Å²	30.3	6%	0.055	16%	0.16	C	C	.	.	H	α-helix	trans	-63.2	-44.8	178.1	-163.8	-154.4	0	0	0	113.3	L650 G662 F664 R686 H687 L688 K692 D693 L694 L708	L650-Y690 HydrophobicContact CD1-CE2 4.23Å; L650-Y690 HydrophobicContact CD2-CD2 4.37Å; L650-Y690 HydrophobicContact CD2-CE2 4.21Å; G662-Y690 PolarHBondContact O-OH 3.42Å; F664-Y690 HydrophobicContact CD2-CE1 4.47Å; F664-Y690 HydrophobicContact CD2-CE2 4.16Å; F664-Y690 AromaticContact CD2-CZ 3.8Å; F664-Y690 WeakPolarHBondContact CD2-OH 3.3Å; F664-Y690 HydrophobicContact CE1-CE2 4.4Å; F664-Y690 AromaticContact CE2-CD2 3.95Å; F664-Y690 HydrophobicContact CE2-CD2 3.95Å; F664-Y690 HydrophobicContact CE2-CE1 4.04Å; F664-Y690 AromaticContact CE2-CE2 3.29Å; F664-Y690 HydrophobicContact CE2-CE2 3.29Å; F664-Y690 AromaticContact CE2-CZ 3.33Å; F664-Y690 WeakPolarHBondContact CE2-OH 3.15Å; F664-Y690 HydrophobicContact CZ-CD2 4.03Å; F664-Y690 AromaticContact CZ-CE2 3.44Å; F664-Y690 HydrophobicContact CZ-CE2 3.44Å; F664-Y690 VanDerWaalsContact CZ-CE2 3.44Å; F664-Y690 AromaticContact CZ-CZ 3.96Å; R686-Y690 VanDerWaalsContact O-CB 3.28Å; R686-Y690 WeakPolarHBondContact O-CB 3.38Å; R686-Y690 PolarHBondContact O-N 3.17Å; H687-Y690 PolarHBondContact O-N 3.41Å; L688-Y690 VanDerWaalsContact C-N 3.33Å; Y690-K692 VanDerWaalsContact C-N 3.33Å; Y690-K692 PolarHBondContact O-N 3.38Å; Y690-D693 PolarHBondContact O-N 3.47Å; Y690-L694 HydrophobicContact CD1-CD1 4.01Å; Y690-L694 HydrophobicContact CD2-CD1 3.82Å; Y690-L694 HydrophobicContact CD2-CG 3.89Å; Y690-L694 HydrophobicContact CE1-CD1 3.97Å; Y690-L694 HydrophobicContact CE2-CD1 3.77Å; Y690-L694 HydrophobicContact CE2-CD2 4.02Å; Y690-L694 HydrophobicContact CE2-CG 3.87Å; Y690-L694 HydrophobicContact CG-CD1 3.94Å; Y690-L694 HydrophobicContact CG-CG 4.43Å; Y690-L694 WeakPolarHBondContact O-CB 3.44Å; Y690-L694 VanDerWaalsContact O-CG 3.24Å; Y690-L694 WeakPolarHBondContact O-CG 3.4Å; Y690-L694 PolarHBondContact O-N 3.06Å; Y690-L708 HydrophobicContact CE1-CD1 3.81Å; Y690-L708 HydrophobicContact CE1-CG 4.32Å
691	L	92.8	Very high	88.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-43.8	176.5	-78.3	166.7	0	0	0	111	H687 L688 L694 M695 L709 V742	H687-L691 WeakPolarHBondContact O-CB 3.29Å; H687-L691 VanDerWaalsContact O-CG 3.25Å; H687-L691 WeakPolarHBondContact O-CG 3.47Å; H687-L691 PolarHBondContact O-N 3.37Å; L688-L691 PolarHBondContact O-N 2.84Å; L691-L694 PolarHBondContact O-N 3.17Å; L691-M695 HydrophobicContact CB-SD 4.37Å; L691-M695 VanDerWaalsContact O-CB 3.27Å; L691-M695 WeakPolarHBondContact O-CB 3.44Å; L691-M695 WeakPolarHBondContact O-CG 3.43Å; L691-M695 PolarHBondContact O-N 3.25Å; L691-M695 VanDerWaalsContact O-SD 3.38Å; L691-L709 HydrophobicContact CD2-CD2 3.92Å; L691-V742 HydrophobicContact CB-CG1 4Å; L691-V742 HydrophobicContact CD1-CG1 4.07Å
692	K	92.9	Very high	88.4	Confident	63 Å²	63	34.8 Å²	34.8	27%	0.274	19%	0.185	S	C	.	.	H	α-helix	trans	-58.8	-51	175.7	-69.5	168.6	-176.3	-178.6	0	111.5	L688 S689 Y690 L694 M695 D696 V742	L688-K692 VanDerWaalsContact O-CG 3.3Å; L688-K692 WeakPolarHBondContact O-CG 3.4Å; L688-K692 PolarHBondContact O-N 3.24Å; L688-K692 VanDerWaalsContact O-N 3.1Å; S689-K692 PolarHBondContact O-N 2.98Å; Y690-K692 VanDerWaalsContact C-N 3.33Å; Y690-K692 PolarHBondContact O-N 3.38Å; K692-L694 PolarHBondContact O-N 3.22Å; K692-M695 PolarHBondContact O-N 2.93Å; K692-D696 VanDerWaalsContact O-CG 3.26Å; K692-D696 PolarHBondContact O-N 3.05Å; K692-V742 HydrophobicContact CD-CG2 4.29Å; K692-V742 HydrophobicContact CG-CG2 3.64Å
693	D	92.1	Very high	88	Confident	9 Å²	9	33.7 Å²	33.7	5%	0.048	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-41	179.1	-71.1	-37.4	0	0	0	112.5	K647 L650 S689 Y690 D696 Y697	K647-D693 WeakPolarHBondContact CD-OD1 3.46Å; K647-D693 WeakPolarHBondContact CE-OD1 3.43Å; K647-D693 WeakPolarHBondContact CG-OD1 3.48Å; K647-D693 IonicContact NZ-OD1 3.96Å; K647-D693 PolarHBondContact NZ-OD1 3.49Å; L650-D693 HydrophobicContact CD2-CB 3.82Å; S689-D693 PolarHBondContact O-N 3.09Å; Y690-D693 PolarHBondContact O-N 3.47Å; D693-D696 WeakPolarHBondContact O-CB 3.35Å; D693-D696 PolarHBondContact O-N 3.41Å; D693-Y697 WeakPolarHBondContact O-CD2 3.49Å; D693-Y697 PolarHBondContact O-N 2.85Å
694	L	91.6	Very high	88	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.3	-36.2	176.8	-71.3	170.8	0	0	0	112.3	L650 M654 Y690 L691 K692 Y697 A698 V704 L708 L709	L650-L694 HydrophobicContact CD1-CD2 4.18Å; L650-L694 HydrophobicContact CD2-CD2 3.92Å; L650-L694 HydrophobicContact CD2-CG 4.26Å; M654-L694 HydrophobicContact CE-CD2 4.23Å; Y690-L694 HydrophobicContact CD1-CD1 4.01Å; Y690-L694 HydrophobicContact CD2-CD1 3.82Å; Y690-L694 HydrophobicContact CD2-CG 3.89Å; Y690-L694 HydrophobicContact CE1-CD1 3.97Å; Y690-L694 HydrophobicContact CE2-CD1 3.77Å; Y690-L694 HydrophobicContact CE2-CD2 4.02Å; Y690-L694 HydrophobicContact CE2-CG 3.87Å; Y690-L694 HydrophobicContact CG-CD1 3.94Å; Y690-L694 HydrophobicContact CG-CG 4.43Å; Y690-L694 WeakPolarHBondContact O-CB 3.44Å; Y690-L694 VanDerWaalsContact O-CG 3.24Å; Y690-L694 WeakPolarHBondContact O-CG 3.4Å; Y690-L694 PolarHBondContact O-N 3.06Å; L691-L694 PolarHBondContact O-N 3.17Å; K692-L694 PolarHBondContact O-N 3.22Å; L694-Y697 WeakPolarHBondContact O-CB 3.48Å; L694-Y697 PolarHBondContact O-N 3Å; L694-A698 PolarHBondContact O-N 3.03Å; L694-V704 HydrophobicContact CB-CG1 4.32Å; L694-V704 HydrophobicContact CD2-CG1 3.93Å; L694-L708 HydrophobicContact CD1-CD2 3.97Å; L694-L708 HydrophobicContact CD1-CG 3.96Å; L694-L708 HydrophobicContact CD2-CD2 4.09Å; L694-L709 HydrophobicContact CB-CD2 3.77Å; L694-L709 HydrophobicContact CD1-CD2 4.08Å
695	M	90.3	Very high	87.8	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-71.8	-37.2	176	-70.5	162.3	59.6	0	0	111.7	L691 K692 Y697 A698 E699 V742 R745 L746 L749	L691-M695 HydrophobicContact CB-SD 4.37Å; L691-M695 VanDerWaalsContact O-CB 3.27Å; L691-M695 WeakPolarHBondContact O-CB 3.44Å; L691-M695 WeakPolarHBondContact O-CG 3.43Å; L691-M695 PolarHBondContact O-N 3.25Å; L691-M695 VanDerWaalsContact O-SD 3.38Å; K692-M695 PolarHBondContact O-N 2.93Å; M695-Y697 PolarHBondContact O-N 2.9Å; M695-A698 PolarHBondContact O-N 3.43Å; M695-E699 WeakPolarHBondContact O-CB 3.14Å; M695-E699 WeakPolarHBondContact O-CG 3.48Å; M695-E699 PolarHBondContact O-N 2.84Å; M695-V742 HydrophobicContact SD-CG1 3.98Å; M695-R745 HydrophobicContact CE-CB 3.61Å; M695-R745 HydrophobicContact CE-CG 3.47Å; M695-R745 VanDerWaalsContact CE-CG 3.47Å; M695-L746 HydrophobicContact CE-CB 3.9Å; M695-L746 HydrophobicContact SD-CB 4.21Å; M695-L746 HydrophobicContact SD-CD1 4.31Å; M695-L749 HydrophobicContact CB-CD2 4.25Å; M695-L749 HydrophobicContact CG-CD2 3.9Å
696	D	90.7	Very high	87.6	Confident	51 Å²	51	32.2 Å²	32.2	27%	0.273	17%	0.171	S	C	.	.	H	α-helix	trans	-55.3	-41.7	169.1	-67.2	-5.9	0	0	0	110.6	K647 K692 D693 N700 R745	K647-D696 IonicContact NZ-OD2 2.67Å; K647-D696 PolarHBondContact NZ-OD2 3.3Å; K692-D696 VanDerWaalsContact O-CG 3.26Å; K692-D696 PolarHBondContact O-N 3.05Å; D693-D696 WeakPolarHBondContact O-CB 3.35Å; D693-D696 PolarHBondContact O-N 3.41Å; D696-N700 PolarHBondContact O-N 3.43Å; D696-N700 PolarHBondContact O-ND2 3.3Å; D696-R745 IonicContact OD1-CZ 3.72Å; D696-R745 VanDerWaalsContact OD1-CZ 3.28Å; D696-R745 IonicContact OD1-NH1 3.14Å; D696-R745 PolarHBondContact OD1-NH1 2.74Å; D696-R745 IonicContact OD1-NH2 3.94Å; D696-R745 PolarHBondContact OD1-NH2 2.69Å
697	Y	87.6	Confident	87.3	Confident	49 Å²	49	35.4 Å²	35.4	19%	0.192	19%	0.188	C	C	.	.	H	α-helix	trans	-67.5	-45.9	175.2	-83.8	-66.1	0	0	0	113.2	L650 Q651 M654 D693 L694 M695 E699 N700 S701 V702	L650-Y697 HydrophobicContact CD2-CD2 3.98Å; L650-Y697 HydrophobicContact CD2-CE2 3.92Å; L650-Y697 HydrophobicContact CG-CD2 4.36Å; L650-Y697 HydrophobicContact CG-CE2 3.96Å; Q651-Y697 WeakPolarHBondContact CA-OH 3.3Å; Q651-Y697 VanDerWaalsContact CG-OH 3.23Å; Q651-Y697 WeakPolarHBondContact CG-OH 2.89Å; M654-Y697 HydrophobicContact CB-CE1 4.34Å; M654-Y697 HydrophobicContact CE-CD2 4.02Å; M654-Y697 HydrophobicContact CE-CG 4Å; M654-Y697 HydrophobicContact CG-CD1 4.36Å; M654-Y697 HydrophobicContact CG-CD2 4.32Å; M654-Y697 HydrophobicContact CG-CE1 4.1Å; M654-Y697 HydrophobicContact CG-CE2 4.07Å; M654-Y697 HydrophobicContact CG-CG 4.48Å; D693-Y697 WeakPolarHBondContact O-CD2 3.49Å; D693-Y697 PolarHBondContact O-N 2.85Å; L694-Y697 WeakPolarHBondContact O-CB 3.48Å; L694-Y697 PolarHBondContact O-N 3Å; M695-Y697 PolarHBondContact O-N 2.9Å; Y697-E699 PolarHBondContact O-N 3.01Å; Y697-N700 CarbonylContact O-C 3.6Å; Y697-N700 PolarHBondContact O-N 3.04Å; Y697-S701 PolarHBondContact O-N 2.9Å; Y697-V702 HydrophobicContact CD1-CB 4.1Å; Y697-V702 HydrophobicContact CD1-CG1 4.18Å; Y697-V702 HydrophobicContact CD1-CG2 4.02Å; Y697-V702 WeakPolarHBondContact O-CB 3.42Å; Y697-V702 PolarHBondContact O-N 3.25Å
698	A	85.7	Confident	87.1	Confident	13 Å²	13	34.6 Å²	34.6	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-36.7	-178.7	0	0	0	0	0	112.9	L694 M695 S701 V704 L749	L694-A698 PolarHBondContact O-N 3.03Å; M695-A698 PolarHBondContact O-N 3.43Å; A698-S701 PolarHBondContact O-N 3.41Å; A698-V704 HydrophobicContact CB-CG2 4.29Å; A698-L749 HydrophobicContact CB-CD1 4.12Å; A698-L749 HydrophobicContact CB-CD2 3.82Å
699	E	85.6	Confident	87.1	Confident	93 Å²	93	34.6 Å²	34.6	44%	0.435	19%	0.185	S	C	.	.	H	α-helix	trans	-68.1	-35	173.4	-73	173.7	-167.7	0	0	112	M695 Y697 S701 R745 L749	M695-E699 WeakPolarHBondContact O-CB 3.14Å; M695-E699 WeakPolarHBondContact O-CG 3.48Å; M695-E699 PolarHBondContact O-N 2.84Å; Y697-E699 PolarHBondContact O-N 3.01Å; E699-S701 PolarHBondContact O-N 3.45Å; E699-S701 VanDerWaalsContact O-N 3.08Å; E699-R745 WeakPolarHBondContact OE1-CG 3.47Å; E699-R745 IonicContact OE1-CZ 3.17Å; E699-R745 IonicContact OE1-NE 3.47Å; E699-R745 PolarHBondContact OE1-NE 2.84Å; E699-R745 IonicContact OE1-NH2 3.95Å; E699-R745 PolarHBondContact OE1-NH2 3.12Å; E699-R745 IonicContact OE2-CZ 2.76Å; E699-R745 IonicContact OE2-NE 3.92Å; E699-R745 PolarHBondContact OE2-NE 3.16Å; E699-R745 IonicContact OE2-NH2 3.52Å; E699-R745 PolarHBondContact OE2-NH2 2.92Å; E699-L749 HydrophobicContact CG-CD1 4.06Å
700	N	83	Confident	86.9	Confident	125 Å²	125	36 Å²	36	67%	0.668	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	19.4	170.6	-76	-77.1	0	0	0	113.5	D696 Y697 V702	D696-N700 PolarHBondContact O-N 3.43Å; D696-N700 PolarHBondContact O-ND2 3.3Å; Y697-N700 CarbonylContact O-C 3.6Å; Y697-N700 PolarHBondContact O-N 3.04Å; N700-V702 PolarHBondContact O-N 2.98Å
701	S	74.8	Confident	86.7	Confident	98 Å²	98	41.7 Å²	41.7	69%	0.685	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	21	178.2	-57	0	0	0	0	115.5	S164 Y697 A698 E699	S164-S701 WeakPolarHBondContact CB-O 3.2Å; Y697-S701 PolarHBondContact O-N 2.9Å; A698-S701 PolarHBondContact O-N 3.41Å; E699-S701 PolarHBondContact O-N 3.45Å; E699-S701 VanDerWaalsContact O-N 3.08Å
702	V	80.9	Confident	86.6	Confident	40 Å²	40	41.8 Å²	41.8	24%	0.242	21%	0.212	C	C	.	.			trans	-81.6	136.4	169.3	177	0	0	0	0	109.2	M654 Y697 N700 V704	M654-V702 HydrophobicContact CE-CG1 4.49Å; Y697-V702 HydrophobicContact CD1-CB 4.1Å; Y697-V702 HydrophobicContact CD1-CG1 4.18Å; Y697-V702 HydrophobicContact CD1-CG2 4.02Å; Y697-V702 WeakPolarHBondContact O-CB 3.42Å; Y697-V702 PolarHBondContact O-N 3.25Å; N700-V702 PolarHBondContact O-N 2.98Å; V702-V704 PolarHBondContact O-N 2.9Å
703	L	77.6	Confident	86.5	Confident	19 Å²	19	38.8 Å²	38.8	10%	0.099	20%	0.2	C	C	.	.			trans	-79.6	109.8	-173.6	-167.4	56.8	0	0	0	110.6	M161 L661 C760 P766	M161-L703 HydrophobicContact CG-CD2 4.28Å; L661-L703 HydrophobicContact CD2-CB 4.28Å; L661-L703 HydrophobicContact CD2-CD2 4.3Å; L661-L703 HydrophobicContact CD2-CG 3.97Å; L661-L703 WeakPolarHBondContact CD2-O 3.35Å; L703-C760 WeakPolarHBondContact CD1-O 3.36Å; L703-P766 HydrophobicContact CD2-CG 4.09Å; L703-P766 HydrophobicContact CG-CG 4.27Å
704	V	85.3	Confident	86.3	Confident	6 Å²	6	39.2 Å²	39.2	4%	0.036	20%	0.204	C	C	.	.			trans	-108.6	141.4	178.3	179.4	0	0	0	0	109.3	M654 L694 A698 V702 P706 L709	M654-V704 HydrophobicContact CE-CG2 3.97Å; L694-V704 HydrophobicContact CB-CG1 4.32Å; L694-V704 HydrophobicContact CD2-CG1 3.93Å; A698-V704 HydrophobicContact CB-CG2 4.29Å; V702-V704 PolarHBondContact O-N 2.9Å; V704-P706 VanDerWaalsContact O-CD 3.31Å; V704-P706 WeakPolarHBondContact O-CD 3.3Å; V704-L709 HydrophobicContact CG1-CD1 4.43Å; V704-L709 HydrophobicContact CG1-CD2 4.43Å; V704-L709 HydrophobicContact CG1-CG 4.21Å
705	D	83.9	Confident	86.1	Confident	25 Å²	25	41.9 Å²	41.9	13%	0.134	22%	0.216	C	C	.	.			trans	-69.5	119.4	177.7	-177.6	-2.1	0	0	0	111.4	L661 W663 M707 L708 L709	L661-D705 HydrophobicContact CB-CB 3.77Å; L661-D705 HydrophobicContact CD1-CB 4.38Å; L661-D705 PolarHBondContact O-N 3.42Å; W663-D705 PolarHBondContact NE1-OD2 3.45Å; D705-M707 PolarHBondContact O-N 2.86Å; D705-M707 VanDerWaalsContact OD1-CB 3.3Å; D705-M707 WeakPolarHBondContact OD1-CB 3.23Å; D705-M707 PolarHBondContact OD1-N 2.57Å; D705-L708 HydrophobicContact CB-CB 4.14Å; D705-L708 WeakPolarHBondContact O-CB 3.4Å; D705-L708 PolarHBondContact O-N 3.03Å; D705-L708 VanDerWaalsContact O-N 3.08Å; D705-L709 PolarHBondContact O-N 3Å
706	P	85.3	Confident	86.1	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-23.9	175.9	-22.1	35.3	0	0	0	113.6	V704 L708 L709 H710 F761 A769 A772 T773	V704-P706 VanDerWaalsContact O-CD 3.31Å; V704-P706 WeakPolarHBondContact O-CD 3.3Å; P706-L708 VanDerWaalsContact C-N 3.33Å; P706-L709 PolarHBondContact O-N 2.87Å; P706-H710 VanDerWaalsContact O-CB 3.3Å; P706-H710 WeakPolarHBondContact O-CB 3.42Å; P706-H710 PolarHBondContact O-N 3.45Å; P706-F761 HydrophobicContact CG-CE1 3.96Å; P706-F761 HydrophobicContact CG-CZ 4.28Å; P706-A769 HydrophobicContact CG-CB 4.04Å; P706-A772 HydrophobicContact CB-CB 3.95Å; P706-T773 WeakPolarHBondContact CB-OG1 3.48Å; P706-T773 VanDerWaalsContact CG-OG1 3.3Å; P706-T773 WeakPolarHBondContact CG-OG1 3.3Å
707	M	85.3	Confident	85.9	Confident	104 Å²	104	39.6 Å²	39.6	51%	0.512	20%	0.204	S	C	.	.	H	α-helix	trans	-66.9	-33.6	173.5	-67.5	-65.1	-67	0	0	112.3	D705 H710 Y711 A772	D705-M707 PolarHBondContact O-N 2.86Å; D705-M707 VanDerWaalsContact OD1-CB 3.3Å; D705-M707 WeakPolarHBondContact OD1-CB 3.23Å; D705-M707 PolarHBondContact OD1-N 2.57Å; M707-H710 PolarHBondContact O-N 3.34Å; M707-Y711 WeakPolarHBondContact O-CB 3.4Å; M707-Y711 PolarHBondContact O-N 2.96Å; M707-A772 HydrophobicContact CG-CB 3.83Å; M707-A772 HydrophobicContact SD-CB 3.46Å; M707-A772 WeakPolarHBondContact SD-CB 3.49Å
708	L	88.2	Confident	85.7	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-70.4	-41.1	176.8	179.3	59.8	0	0	0	111.7	G662 W663 Y690 L694 D705 P706 S712	G662-L708 VanDerWaalsContact C-CD2 3.47Å; W663-L708 HydrophobicContact CD2-CB 4.45Å; W663-L708 HydrophobicContact CD2-CD1 3.9Å; W663-L708 HydrophobicContact CD2-CD2 4.35Å; W663-L708 HydrophobicContact CD2-CG 4.47Å; W663-L708 HydrophobicContact CE3-CD1 3.77Å; W663-L708 HydrophobicContact CG-CD2 4.29Å; W663-L708 HydrophobicContact CH2-CB 4.48Å; W663-L708 HydrophobicContact CH2-CD1 3.95Å; W663-L708 HydrophobicContact CZ2-CB 3.87Å; W663-L708 HydrophobicContact CZ2-CD1 4.08Å; W663-L708 HydrophobicContact CZ3-CD1 3.79Å; Y690-L708 HydrophobicContact CE1-CD1 3.81Å; Y690-L708 HydrophobicContact CE1-CG 4.32Å; L694-L708 HydrophobicContact CD1-CD2 3.97Å; L694-L708 HydrophobicContact CD1-CG 3.96Å; L694-L708 HydrophobicContact CD2-CD2 4.09Å; D705-L708 HydrophobicContact CB-CB 4.14Å; D705-L708 WeakPolarHBondContact O-CB 3.4Å; D705-L708 PolarHBondContact O-N 3.03Å; D705-L708 VanDerWaalsContact O-N 3.08Å; P706-L708 VanDerWaalsContact C-N 3.33Å; L708-S712 PolarHBondContact O-N 3.36Å; L708-S712 VanDerWaalsContact O-N 3.14Å; L708-S712 PolarHBondContact O-OG 3.12Å
709	L	89.9	Confident	85.7	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-45.3	170.2	-65.3	176	0	0	0	110.5	L691 L694 V704 D705 P706 S712 Y713 L776	L691-L709 HydrophobicContact CD2-CD2 3.92Å; L694-L709 HydrophobicContact CB-CD2 3.77Å; L694-L709 HydrophobicContact CD1-CD2 4.08Å; V704-L709 HydrophobicContact CG1-CD1 4.43Å; V704-L709 HydrophobicContact CG1-CD2 4.43Å; V704-L709 HydrophobicContact CG1-CG 4.21Å; D705-L709 PolarHBondContact O-N 3Å; P706-L709 PolarHBondContact O-N 2.87Å; L709-S712 PolarHBondContact O-N 3.05Å; L709-Y713 VanDerWaalsContact O-CB 3.3Å; L709-Y713 WeakPolarHBondContact O-CB 3.3Å; L709-Y713 PolarHBondContact O-N 3.32Å; L709-L776 HydrophobicContact CB-CD2 3.69Å
710	H	88.9	Confident	85.6	Confident	41 Å²	41	34.8 Å²	34.8	19%	0.19	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-46.1	179.6	-179.3	-73.4	0	0	0	112.5	P706 M707 A714 L776 R779	P706-H710 VanDerWaalsContact O-CB 3.3Å; P706-H710 WeakPolarHBondContact O-CB 3.42Å; P706-H710 PolarHBondContact O-N 3.45Å; M707-H710 PolarHBondContact O-N 3.34Å; H710-A714 WeakPolarHBondContact O-CB 3.4Å; H710-A714 PolarHBondContact O-N 3.32Å; H710-L776 HydrophobicContact CB-CB 4.36Å; H710-L776 HydrophobicContact CB-CD1 3.94Å; H710-L776 HydrophobicContact CB-CD2 4.22Å; H710-L776 HydrophobicContact CB-CG 4.4Å; H710-R779 VanDerWaalsContact NE2-CD 3.32Å; H710-R779 WeakPolarHBondContact NE2-CD 3.45Å
711	Y	89.6	Confident	85.4	Confident	134 Å²	134	31.4 Å²	31.4	53%	0.525	17%	0.165	S	C	.	.	H	α-helix	trans	-58.6	-48.8	175.9	175.4	-105.8	0	0	0	111.8	H687 M707 A714 F715	H687-Y711 AromaticContact CE1-CE1 3.82Å; M707-Y711 WeakPolarHBondContact O-CB 3.4Å; M707-Y711 PolarHBondContact O-N 2.96Å; Y711-A714 PolarHBondContact O-N 2.99Å; Y711-F715 PolarHBondContact O-N 2.97Å; Y711-F715 VanDerWaalsContact O-N 3.11Å
712	S	90.1	Very high	85.1	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-68.2	-40.9	-178.4	-61.4	0	0	0	0	112.6	H687 L708 L709 F715 C716	H687-S712 WeakPolarHBondContact ND1-CB 3.46Å; H687-S712 PolarHBondContact ND1-OG 2.86Å; H687-S712 VanDerWaalsContact ND1-OG 3.14Å; L708-S712 PolarHBondContact O-N 3.36Å; L708-S712 VanDerWaalsContact O-N 3.14Å; L708-S712 PolarHBondContact O-OG 3.12Å; L709-S712 PolarHBondContact O-N 3.05Å; S712-F715 PolarHBondContact O-N 2.99Å; S712-C716 PolarHBondContact O-N 3.32Å; S712-C716 VanDerWaalsContact O-N 3.12Å; S712-C716 PolarHBondContact O-SG 3.18Å
713	Y	90.9	Very high	84.1	Confident	1 Å²	1	31.7 Å²	31.7	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-40.8	175.3	-178.1	-94.2	0	0	0	111.6	L709 F715 C716 A717 F739 R743 L746 L776 R779 V780	L709-Y713 VanDerWaalsContact O-CB 3.3Å; L709-Y713 WeakPolarHBondContact O-CB 3.3Å; L709-Y713 PolarHBondContact O-N 3.32Å; Y713-F715 VanDerWaalsContact C-N 3.29Å; Y713-F715 PolarHBondContact O-N 3.02Å; Y713-C716 PolarHBondContact O-N 3.37Å; Y713-A717 HydrophobicContact CE1-CB 4.4Å; Y713-A717 WeakPolarHBondContact O-CB 3.25Å; Y713-A717 PolarHBondContact O-N 3.07Å; Y713-F739 AromaticContact CD2-CE2 3.94Å; Y713-F739 HydrophobicContact CD2-CE2 3.94Å; Y713-F739 HydrophobicContact CE2-CD2 4.36Å; Y713-F739 AromaticContact CE2-CE2 3.41Å; Y713-F739 HydrophobicContact CE2-CE2 3.41Å; Y713-F739 VanDerWaalsContact CE2-CE2 3.41Å; Y713-F739 AromaticContact CE2-CZ 3.69Å; Y713-F739 HydrophobicContact CE2-CZ 3.69Å; Y713-F739 AromaticContact CZ-CE2 3.87Å; Y713-F739 AromaticContact CZ-CZ 3.7Å; Y713-F739 WeakPolarHBondContact OH-CZ 3.33Å; Y713-R743 HydrophobicContact CE2-CB 4.38Å; Y713-R743 HydrophobicContact CE2-CG 4.34Å; Y713-L746 HydrophobicContact CD2-CD2 3.82Å; Y713-L746 HydrophobicContact CE2-CD2 4.42Å; Y713-L746 HydrophobicContact CG-CD2 4.19Å; Y713-L776 HydrophobicContact CD1-CD1 4.11Å; Y713-L776 HydrophobicContact CG-CD1 4.34Å; Y713-R779 HydrophobicContact CD1-CG 4.47Å; Y713-R779 HydrophobicContact CE1-CG 4.42Å; Y713-V780 HydrophobicContact CD1-CG2 3.81Å; Y713-V780 HydrophobicContact CD2-CG2 4.23Å; Y713-V780 HydrophobicContact CE1-CB 4.22Å; Y713-V780 HydrophobicContact CE1-CG2 3.6Å; Y713-V780 HydrophobicContact CE2-CG2 4.03Å; Y713-V780 HydrophobicContact CG-CG2 4.14Å
714	A	87.8	Confident	83.3	Confident	18 Å²	18	33.2 Å²	33.2	15%	0.149	18%	0.175	C	C	.	.	H	α-helix	trans	-61.3	-35.5	176.5	0	0	0	0	0	112.9	H710 Y711 S718	H710-A714 WeakPolarHBondContact O-CB 3.4Å; H710-A714 PolarHBondContact O-N 3.32Å; Y711-A714 PolarHBondContact O-N 2.99Å; A714-S718 WeakPolarHBondContact O-CB 3.49Å; A714-S718 PolarHBondContact O-N 3.3Å; A714-S718 PolarHBondContact O-OG 3.31Å
715	F	88	Confident	81.5	Confident	55 Å²	55	38.8 Å²	38.8	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-70.3	-42.3	174.4	-173.7	-82	0	0	0	112.7	H687 Y711 S712 Y713 S718 H719	H687-F715 HydrophobicContact CB-CD1 4.29Å; H687-F715 AromaticContact CD2-CD1 3.44Å; H687-F715 VanDerWaalsContact CD2-CD1 3.44Å; H687-F715 WeakPolarHBondContact CD2-CD1 3.43Å; H687-F715 AromaticContact CD2-CE1 3.82Å; H687-F715 AromaticContact CD2-CG 3.82Å; Y711-F715 PolarHBondContact O-N 2.97Å; Y711-F715 VanDerWaalsContact O-N 3.11Å; S712-F715 PolarHBondContact O-N 2.99Å; Y713-F715 VanDerWaalsContact C-N 3.29Å; Y713-F715 PolarHBondContact O-N 3.02Å; F715-S718 PolarHBondContact O-N 2.95Å; F715-S718 PolarHBondContact O-OG 3.05Å; F715-S718 VanDerWaalsContact O-OG 3.05Å; F715-H719 PolarHBondContact O-N 3.09Å; F715-H719 VanDerWaalsContact O-N 3.14Å
716	C	88.3	Confident	80	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.1	-42.5	175.1	-66.5	0	0	0	0	111.7	H687 L688 S712 Y713 H719 I720 F739	H687-C716 WeakPolarHBondContact CB-SG 3.4Å; L688-C716 HydrophobicContact CD2-CB 4.18Å; S712-C716 PolarHBondContact O-N 3.32Å; S712-C716 VanDerWaalsContact O-N 3.12Å; S712-C716 PolarHBondContact O-SG 3.18Å; Y713-C716 PolarHBondContact O-N 3.37Å; C716-H719 PolarHBondContact O-N 3.35Å; C716-I720 WeakPolarHBondContact O-CG1 3.47Å; C716-I720 PolarHBondContact O-N 2.79Å; C716-F739 HydrophobicContact CB-CD2 3.71Å; C716-F739 HydrophobicContact CB-CE2 3.85Å
717	A	87.1	Confident	78.2	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.033	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-41.7	176.3	0	0	0	0	0	112.5	Y713 H719 I720 H721 F739 I785	Y713-A717 HydrophobicContact CE1-CB 4.4Å; Y713-A717 WeakPolarHBondContact O-CB 3.25Å; Y713-A717 PolarHBondContact O-N 3.07Å; A717-H719 VanDerWaalsContact C-N 3.32Å; A717-H719 PolarHBondContact O-N 3.39Å; A717-I720 PolarHBondContact O-N 2.75Å; A717-H721 WeakPolarHBondContact O-CB 3.29Å; A717-H721 PolarHBondContact O-N 3.24Å; A717-F739 HydrophobicContact CB-CE2 4.38Å; A717-F739 HydrophobicContact CB-CZ 4.11Å; A717-I785 WeakPolarHBondContact O-CD1 3.06Å
718	S	84.3	Confident	76.7	Confident	26 Å²	26	44.2 Å²	44.2	18%	0.182	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-32.5	178.2	66.3	0	0	0	0	113.3	A714 F715 G722 N723 I785	A714-S718 WeakPolarHBondContact O-CB 3.49Å; A714-S718 PolarHBondContact O-N 3.3Å; A714-S718 PolarHBondContact O-OG 3.31Å; F715-S718 PolarHBondContact O-N 2.95Å; F715-S718 PolarHBondContact O-OG 3.05Å; F715-S718 VanDerWaalsContact O-OG 3.05Å; S718-G722 PolarHBondContact O-N 3.36Å; S718-N723 CarbonylContact O-C 3.56Å; S718-N723 PolarHBondContact O-N 3.06Å; S718-I785 VanDerWaalsContact CA-CD1 3.47Å
719	H	84.4	Confident	75.6	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.009	28%	0.275	C	S	.	.	H	α-helix	trans	-66.9	-51.4	170.8	-179	63.7	0	0	0	112.3	R682 C684 F715 C716 A717 G722 R724 T730 E735	R682-H719 PolarHBondContact NH2-NE2 3.08Å; C684-H719 HydrophobicContact CB-CB 4.39Å; C684-H719 WeakPolarHBondContact CB-CD2 3.12Å; C684-H719 PolarHBondContact SG-CD2 3.47Å; F715-H719 PolarHBondContact O-N 3.09Å; F715-H719 VanDerWaalsContact O-N 3.14Å; C716-H719 PolarHBondContact O-N 3.35Å; A717-H719 VanDerWaalsContact C-N 3.32Å; A717-H719 PolarHBondContact O-N 3.39Å; H719-G722 PolarHBondContact O-N 3.21Å; H719-R724 VanDerWaalsContact ND1-CZ 3.31Å; H719-R724 PolarHBondContact ND1-NH2 3.05Å; H719-T730 PolarHBondContact CE1-O 3.32Å; H719-T730 PolarHBondContact NE2-O 3.34Å; H719-E735 IonicContact NE2-OE1 2.76Å; H719-E735 IonicContact NE2-OE2 2.71Å
720	I	83.4	Confident	75.1	Confident	26 Å²	26	45.4 Å²	45.4	13%	0.133	28%	0.275	C	S	.	.	H	α-helix	trans	-77.5	-28.9	-169.6	-68.3	168.5	0	0	0	112.7	C716 A717 V731 K736 F739	C716-I720 WeakPolarHBondContact O-CG1 3.47Å; C716-I720 PolarHBondContact O-N 2.79Å; A717-I720 PolarHBondContact O-N 2.75Å; I720-V731 HydrophobicContact CG1-CG1 4.06Å; I720-K736 HydrophobicContact CG2-CG 4.41Å; I720-F739 HydrophobicContact CD1-CB 3.25Å; I720-F739 HydrophobicContact CD1-CD1 3.76Å; I720-F739 HydrophobicContact CD1-CD2 3.88Å; I720-F739 HydrophobicContact CD1-CG 3.36Å; I720-F739 HydrophobicContact CG2-CD1 4.36Å
721	H	80.1	Confident	74.9	Confident	55 Å²	55	43.8 Å²	43.8	26%	0.255	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	12.3	174.8	-55.3	155	0	0	0	113.3	A717 N723 I785	A717-H721 WeakPolarHBondContact O-CB 3.29Å; A717-H721 PolarHBondContact O-N 3.24Å; H721-N723 VanDerWaalsContact C-N 3.29Å; H721-N723 PolarHBondContact O-N 2.87Å; H721-N723 VanDerWaalsContact O-N 3.15Å; H721-I785 HydrophobicContact CB-CD1 3.92Å; H721-I785 HydrophobicContact CB-CG1 4.05Å
722	G	68.2	Low	74.6	Confident	56 Å²	56	38.1 Å²	38.1	58%	0.577	25%	0.248	S	C	*	.	S	Bend	trans	79	-13.6	168.3	0	0	0	0	0	117.4	S718 H719 R724	S718-G722 PolarHBondContact O-N 3.36Å; H719-G722 PolarHBondContact O-N 3.21Å; G722-R724 PolarHBondContact O-N 2.95Å
723	N	59.4	Low	74.4	Confident	88 Å²	88	40.2 Å²	40.2	47%	0.471	26%	0.26	S	S	.	.			trans	-78.4	63.9	179.8	-74.8	-18.2	0	0	0	112.8	S718 H721 I785	S718-N723 CarbonylContact O-C 3.56Å; S718-N723 PolarHBondContact O-N 3.06Å; H721-N723 VanDerWaalsContact C-N 3.29Å; H721-N723 PolarHBondContact O-N 2.87Å; H721-N723 VanDerWaalsContact O-N 3.15Å; N723-I785 HydrophobicContact CB-CD1 4.15Å; N723-I785 HydrophobicContact CB-CG2 4.5Å; N723-I785 WeakPolarHBondContact ND2-CG2 3.32Å
724	R	61.1	Low	74.2	Confident	51 Å²	51	46.1 Å²	46.1	19%	0.192	29%	0.288	C	S	.	.			trans	-91.3	140.1	167.7	-96.2	-169	173.1	170.2	-3	111.6	H719 G722 D726	H719-R724 VanDerWaalsContact ND1-CZ 3.31Å; H719-R724 PolarHBondContact ND1-NH2 3.05Å; G722-R724 PolarHBondContact O-N 2.95Å; R724-D726 PolarHBondContact O-N 3.23Å
725	P	48	Very low	74.2	Confident	122 Å²	122	45.7 Å²	45.7	79%	0.792	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-19.3	168.4	31.1	-34.1	0	0	0	112.4	G727	P725-G727 VanDerWaalsContact C-N 3.25Å; P725-G727 PolarHBondContact O-N 3.32Å
726	D	51.1	Low	74.1	Confident	113 Å²	113	47.6 Å²	47.6	60%	0.604	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	13.2	-171.4	-39.6	-61.9	0	0	0	114.4	R724 T728	R724-D726 PolarHBondContact O-N 3.23Å; D726-T728 PolarHBondContact O-N 3.22Å
727	G	48.9	Very low	74.2	Confident	74 Å²	74	54 Å²	54	76%	0.763	32%	0.321	S	S	*	.	S	Bend	trans	76.9	-40	169.2	0	0	0	0	0	117	P725	P725-G727 VanDerWaalsContact C-N 3.25Å; P725-G727 PolarHBondContact O-N 3.32Å
728	T	53.4	Low	74.3	Confident	57 Å²	57	55.5 Å²	55.5	35%	0.35	33%	0.327	S	S	.	.			trans	-127.6	128	-175.5	-34.9	0	0	0	0	111.3	L303 D726	L303-T728 HydrophobicContact CB-CG2 4.12Å; L303-T728 HydrophobicContact CD2-CG2 4.18Å; D726-T728 PolarHBondContact O-N 3.22Å
729	G	64.8	Low	74.7	Confident	29 Å²	29	54.3 Å²	54.3	30%	0.299	32%	0.319	S	S	.	.			trans	-143.4	90.4	-176.9	0	0	0	0	0	112
730	T	78.9	Confident	75	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.331	C	S	.	.			trans	-73.3	140.7	168	62.6	0	0	0	0	109.9	M300 L303 E307 R682 H719	M300-T730 HydrophobicContact CB-CG2 4.08Å; M300-T730 WeakPolarHBondContact O-CG2 3.32Å; L303-T730 HydrophobicContact CB-CG2 3.72Å; E307-T730 WeakPolarHBondContact OE2-CB 3.32Å; E307-T730 PolarHBondContact OE2-N 3.01Å; E307-T730 PolarHBondContact OE2-OG1 3.16Å; R682-T730 PolarHBondContact NH1-OG1 3.18Å; R682-T730 PolarHBondContact NH2-O 2.84Å; H719-T730 PolarHBondContact CE1-O 3.32Å; H719-T730 PolarHBondContact NE2-O 3.34Å
731	V	84.2	Confident	75.4	Confident	8 Å²	8	58.6 Å²	58.6	5%	0.048	35%	0.349	C	S	.	.			trans	-127	119.6	-179.4	-177.4	0	0	0	0	109.2	F295 V296 M300 I720	F295-V731 WeakPolarHBondContact CD1-O 3.22Å; V296-V731 HydrophobicContact CG2-CB 4.36Å; V296-V731 HydrophobicContact CG2-CG1 4.07Å; V296-V731 WeakPolarHBondContact CG2-O 3.39Å; V296-V731 PolarHBondContact N-O 2.99Å; M300-V731 HydrophobicContact SD-CB 4.4Å; M300-V731 PolarHBondContact SD-N 3.32Å; I720-V731 HydrophobicContact CG1-CG1 4.06Å
732	T	85	Confident	76	Confident	15 Å²	15	56.1 Å²	56.1	9%	0.092	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-76.6	153.6	176	64.4	0	0	0	0	111.4	P293 K294 F295 E734 E735 K736	P293-T732 HydrophobicContact CB-CG2 3.88Å; K294-T732 CarbonylContact O-C 3.19Å; K294-T732 VanDerWaalsContact O-CA 3.31Å; K294-T732 WeakPolarHBondContact O-CA 3.5Å; F295-T732 HydrophobicContact CD1-CG2 4.06Å; F295-T732 HydrophobicContact CE1-CG2 3.67Å; F295-T732 HydrophobicContact CZ-CG2 4.25Å; T732-E734 PolarHBondContact O-N 3.02Å; T732-E735 WeakPolarHBondContact CB-OE2 3.38Å; T732-E735 WeakPolarHBondContact CG2-OE2 3.22Å; T732-E735 PolarHBondContact N-OE2 3.23Å; T732-E735 VanDerWaalsContact N-OE2 3.08Å; T732-E735 PolarHBondContact O-N 3.18Å; T732-E735 WeakPolarHBondContact OG1-CB 3.5Å; T732-E735 VanDerWaalsContact OG1-CD 3.25Å; T732-E735 WeakPolarHBondContact OG1-CG 3.5Å; T732-E735 PolarHBondContact OG1-N 2.99Å; T732-E735 PolarHBondContact OG1-OE2 3.34Å; T732-K736 PolarHBondContact O-N 2.6Å
733	V	85.9	Confident	77.1	Confident	45 Å²	45	54.7 Å²	54.7	27%	0.273	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-39.8	172.5	176.9	0	0	0	0	110.1	K294 K736 E737	K294-V733 HydrophobicContact CB-CB 4.26Å; K294-V733 HydrophobicContact CB-CG2 4Å; K294-V733 PolarHBondContact O-N 2.89Å; V733-K736 PolarHBondContact O-N 2.83Å; V733-E737 HydrophobicContact CG1-CG 4.29Å; V733-E737 WeakPolarHBondContact CG1-OE1 3.43Å; V733-E737 WeakPolarHBondContact O-CG 3.48Å; V733-E737 PolarHBondContact O-N 2.82Å
734	E	85.3	Confident	78.6	Confident	124 Å²	124	56.1 Å²	56.1	58%	0.579	32%	0.318	S	S	*	.	H	α-helix	trans	-64.6	-47.1	178.6	-176	174.7	179.7	0	0	112.5	T732 K736 E737 Q738	T732-E734 PolarHBondContact O-N 3.02Å; E734-K736 PolarHBondContact O-N 3.12Å; E734-E737 PolarHBondContact O-N 3Å; E734-Q738 HydrophobicContact CG-CG 4.09Å; E734-Q738 VanDerWaalsContact O-CB 3.27Å; E734-Q738 WeakPolarHBondContact O-CB 3.25Å; E734-Q738 VanDerWaalsContact O-CG 3.25Å; E734-Q738 WeakPolarHBondContact O-CG 3.46Å; E734-Q738 PolarHBondContact O-N 3.46Å; E734-Q738 PolarHBondContact OE1-NE2 3.47Å
735	E	87.6	Confident	80.2	Confident	10 Å²	10	57.3 Å²	57.3	5%	0.047	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-36.7	175.4	-76	160	138.3	0	0	111.7	R682 L688 H719 T732 F739	R682-E735 IonicContact CZ-OE1 2.73Å; R682-E735 IonicContact CZ-OE2 3.82Å; R682-E735 IonicContact NE-OE1 2.63Å; R682-E735 PolarHBondContact NE-OE1 3.39Å; R682-E735 IonicContact NE-OE2 3.74Å; R682-E735 PolarHBondContact NE-OE2 3.06Å; R682-E735 IonicContact NH2-OE1 3.94Å; R682-E735 PolarHBondContact NH2-OE1 3.43Å; R682-E735 IonicContact NH2-OE2 2.66Å; R682-E735 PolarHBondContact NH2-OE2 3.17Å; L688-E735 HydrophobicContact CD1-CB 4.25Å; L688-E735 HydrophobicContact CD1-CG 4.39Å; L688-E735 WeakPolarHBondContact CD1-O 3.44Å; H719-E735 IonicContact NE2-OE1 2.76Å; H719-E735 IonicContact NE2-OE2 2.71Å; T732-E735 WeakPolarHBondContact CB-OE2 3.38Å; T732-E735 WeakPolarHBondContact CG2-OE2 3.22Å; T732-E735 PolarHBondContact N-OE2 3.23Å; T732-E735 VanDerWaalsContact N-OE2 3.08Å; T732-E735 PolarHBondContact O-N 3.18Å; T732-E735 WeakPolarHBondContact OG1-CB 3.5Å; T732-E735 VanDerWaalsContact OG1-CD 3.25Å; T732-E735 WeakPolarHBondContact OG1-CG 3.5Å; T732-E735 PolarHBondContact OG1-N 2.99Å; T732-E735 PolarHBondContact OG1-OE2 3.34Å; E735-F739 WeakPolarHBondContact O-CB 3.29Å; E735-F739 PolarHBondContact O-N 3.15Å
736	K	87.3	Confident	82.3	Confident	94 Å²	94	51.5 Å²	51.5	41%	0.409	29%	0.285	S	S	.	.	H	α-helix	trans	-70.2	-45.7	177.2	-174.2	175.5	178.1	177.9	0	112.8	V296 I720 T732 V733 E734 F739 E740	V296-K736 HydrophobicContact CG1-CD 4.47Å; V296-K736 HydrophobicContact CG2-CB 4.34Å; V296-K736 HydrophobicContact CG2-CD 3.87Å; I720-K736 HydrophobicContact CG2-CG 4.41Å; T732-K736 PolarHBondContact O-N 2.6Å; V733-K736 PolarHBondContact O-N 2.83Å; E734-K736 PolarHBondContact O-N 3.12Å; K736-F739 PolarHBondContact O-N 3.25Å; K736-E740 PolarHBondContact O-N 3.47Å
737	E	90.3	Very high	84.2	Confident	134 Å²	134	47.2 Å²	47.2	63%	0.626	26%	0.262	S	S	*	.	H	α-helix	trans	-63.9	-44.1	175.8	-73.7	176.3	-179.8	0	0	111.3	V733 E734 F739 E740 A741	V733-E737 HydrophobicContact CG1-CG 4.29Å; V733-E737 WeakPolarHBondContact CG1-OE1 3.43Å; V733-E737 WeakPolarHBondContact O-CG 3.48Å; V733-E737 PolarHBondContact O-N 2.82Å; E734-E737 PolarHBondContact O-N 3Å; E737-F739 VanDerWaalsContact C-N 3.34Å; E737-F739 PolarHBondContact O-N 3.27Å; E737-E740 PolarHBondContact O-N 3.25Å; E737-A741 WeakPolarHBondContact O-CB 3.38Å; E737-A741 PolarHBondContact O-N 2.87Å
738	Q	89.8	Confident	86.3	Confident	37 Å²	37	48.5 Å²	48.5	17%	0.173	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-37.5	175.2	-70.7	-165.8	29.7	0	0	112.2	L688 E734 V742	L688-Q738 HydrophobicContact CD1-CB 4.17Å; E734-Q738 HydrophobicContact CG-CG 4.09Å; E734-Q738 VanDerWaalsContact O-CB 3.27Å; E734-Q738 WeakPolarHBondContact O-CB 3.25Å; E734-Q738 VanDerWaalsContact O-CG 3.25Å; E734-Q738 WeakPolarHBondContact O-CG 3.46Å; E734-Q738 PolarHBondContact O-N 3.46Å; E734-Q738 PolarHBondContact OE1-NE2 3.47Å; Q738-V742 WeakPolarHBondContact O-CB 3.15Å; Q738-V742 VanDerWaalsContact O-CG2 3.28Å; Q738-V742 WeakPolarHBondContact O-CG2 3.36Å; Q738-V742 PolarHBondContact O-N 3.15Å
739	F	91	Very high	88.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-47.3	175.4	173	-104.9	0	0	0	112.5	L688 Y713 C716 A717 I720 E735 K736 E737 A741 V742 R743	L688-F739 HydrophobicContact CD2-CB 3.93Å; L688-F739 HydrophobicContact CD2-CD2 4.13Å; Y713-F739 AromaticContact CD2-CE2 3.94Å; Y713-F739 HydrophobicContact CD2-CE2 3.94Å; Y713-F739 HydrophobicContact CE2-CD2 4.36Å; Y713-F739 AromaticContact CE2-CE2 3.41Å; Y713-F739 HydrophobicContact CE2-CE2 3.41Å; Y713-F739 VanDerWaalsContact CE2-CE2 3.41Å; Y713-F739 AromaticContact CE2-CZ 3.69Å; Y713-F739 HydrophobicContact CE2-CZ 3.69Å; Y713-F739 AromaticContact CZ-CE2 3.87Å; Y713-F739 AromaticContact CZ-CZ 3.7Å; Y713-F739 WeakPolarHBondContact OH-CZ 3.33Å; C716-F739 HydrophobicContact CB-CD2 3.71Å; C716-F739 HydrophobicContact CB-CE2 3.85Å; A717-F739 HydrophobicContact CB-CE2 4.38Å; A717-F739 HydrophobicContact CB-CZ 4.11Å; I720-F739 HydrophobicContact CD1-CB 3.25Å; I720-F739 HydrophobicContact CD1-CD1 3.76Å; I720-F739 HydrophobicContact CD1-CD2 3.88Å; I720-F739 HydrophobicContact CD1-CG 3.36Å; I720-F739 HydrophobicContact CG2-CD1 4.36Å; E735-F739 WeakPolarHBondContact O-CB 3.29Å; E735-F739 PolarHBondContact O-N 3.15Å; K736-F739 PolarHBondContact O-N 3.25Å; E737-F739 VanDerWaalsContact C-N 3.34Å; E737-F739 PolarHBondContact O-N 3.27Å; F739-A741 VanDerWaalsContact C-N 3.31Å; F739-A741 PolarHBondContact O-N 2.88Å; F739-V742 CarbonylContact O-C 3.58Å; F739-V742 PolarHBondContact O-N 3.06Å; F739-R743 VanDerWaalsContact O-CB 3.28Å; F739-R743 WeakPolarHBondContact O-CB 3.28Å; F739-R743 PolarHBondContact O-N 3.02Å
740	E	90.4	Very high	89.4	Confident	56 Å²	56	44.8 Å²	44.8	26%	0.262	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-35.7	177.9	-77.6	-63.4	156.5	0	0	111.8	K736 E737 R743 H744	K736-E740 PolarHBondContact O-N 3.47Å; E737-E740 PolarHBondContact O-N 3.25Å; E740-R743 WeakPolarHBondContact O-CB 3.36Å; E740-R743 PolarHBondContact O-N 3.48Å; E740-R743 IonicContact OE1-CZ 3.41Å; E740-R743 IonicContact OE1-NH1 2.99Å; E740-R743 PolarHBondContact OE1-NH1 3.19Å; E740-R743 WeakPolarHBondContact OE2-CD 2.95Å; E740-R743 IonicContact OE2-NH1 2.79Å; E740-H744 PolarHBondContact O-N 3.4Å; E740-H744 PolarHBondContact O-ND1 3.37Å; E740-H744 IonicContact OE2-CE1 3.48Å; E740-H744 PolarHBondContact OE2-CE1 3.17Å; E740-H744 IonicContact OE2-ND1 2.81Å
741	A	92.1	Very high	90	Very high	62 Å²	62	47 Å²	47	51%	0.512	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-44.7	171.3	0	0	0	0	0	112.6	E737 F739 R745	E737-A741 WeakPolarHBondContact O-CB 3.38Å; E737-A741 PolarHBondContact O-N 2.87Å; F739-A741 VanDerWaalsContact C-N 3.31Å; F739-A741 PolarHBondContact O-N 2.88Å; A741-R745 WeakPolarHBondContact O-CB 3.44Å; A741-R745 PolarHBondContact O-N 2.86Å
742	V	93.2	Very high	90.3	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.024	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-43	174.4	164	0	0	0	0	111	L691 K692 M695 Q738 F739 R745 L746	L691-V742 HydrophobicContact CB-CG1 4Å; L691-V742 HydrophobicContact CD1-CG1 4.07Å; K692-V742 HydrophobicContact CD-CG2 4.29Å; K692-V742 HydrophobicContact CG-CG2 3.64Å; M695-V742 HydrophobicContact SD-CG1 3.98Å; Q738-V742 WeakPolarHBondContact O-CB 3.15Å; Q738-V742 VanDerWaalsContact O-CG2 3.28Å; Q738-V742 WeakPolarHBondContact O-CG2 3.36Å; Q738-V742 PolarHBondContact O-N 3.15Å; F739-V742 CarbonylContact O-C 3.58Å; F739-V742 PolarHBondContact O-N 3.06Å; V742-R745 PolarHBondContact O-N 3.49Å; V742-L746 WeakPolarHBondContact O-CB 3.29Å; V742-L746 PolarHBondContact O-N 3.26Å
743	R	91.5	Very high	90.5	Very high	26 Å²	26	50.7 Å²	50.7	10%	0.098	26%	0.255	C	S	.	.	H	α-helix	trans	-57.8	-52	178.6	-174.9	-165	-171.2	156.4	7.5	111.9	Y713 F739 E740 L746 I747 V780 M782	Y713-R743 HydrophobicContact CE2-CB 4.38Å; Y713-R743 HydrophobicContact CE2-CG 4.34Å; F739-R743 VanDerWaalsContact O-CB 3.28Å; F739-R743 WeakPolarHBondContact O-CB 3.28Å; F739-R743 PolarHBondContact O-N 3.02Å; E740-R743 WeakPolarHBondContact O-CB 3.36Å; E740-R743 PolarHBondContact O-N 3.48Å; E740-R743 IonicContact OE1-CZ 3.41Å; E740-R743 IonicContact OE1-NH1 2.99Å; E740-R743 PolarHBondContact OE1-NH1 3.19Å; E740-R743 WeakPolarHBondContact OE2-CD 2.95Å; E740-R743 IonicContact OE2-NH1 2.79Å; R743-L746 PolarHBondContact O-N 3.03Å; R743-I747 WeakPolarHBondContact O-CG1 3.31Å; R743-I747 PolarHBondContact O-N 3.34Å; R743-V780 HydrophobicContact CG-CG1 3.83Å; R743-V780 PolarHBondContact NE-O 2.9Å; R743-V780 PolarHBondContact NH2-O 2.92Å; R743-M782 PolarHBondContact NH2-O 3.35Å
744	H	91.3	Very high	90.7	Very high	117 Å²	117	48.6 Å²	48.6	54%	0.542	24%	0.242	S	C	.	.	H	α-helix	trans	-63.5	-44	-179.4	-74.2	79.1	0	0	0	111.9	E740 L746 I747 V748	E740-H744 PolarHBondContact O-N 3.4Å; E740-H744 PolarHBondContact O-ND1 3.37Å; E740-H744 IonicContact OE2-CE1 3.48Å; E740-H744 PolarHBondContact OE2-CE1 3.17Å; E740-H744 IonicContact OE2-ND1 2.81Å; H744-L746 VanDerWaalsContact C-N 3.32Å; H744-L746 PolarHBondContact O-N 3.4Å; H744-I747 PolarHBondContact O-N 3.46Å; H744-V748 PolarHBondContact O-N 3.03Å
745	R	93.8	Very high	91	Very high	77 Å²	77	43.2 Å²	43.2	29%	0.291	22%	0.217	S	C	.	.	H	α-helix	trans	-62.9	-37.7	175.2	-174.3	-178	174.8	-159.5	5.2	111.7	M695 D696 E699 A741 V742 V748 L749	M695-R745 HydrophobicContact CE-CB 3.61Å; M695-R745 HydrophobicContact CE-CG 3.47Å; M695-R745 VanDerWaalsContact CE-CG 3.47Å; D696-R745 IonicContact OD1-CZ 3.72Å; D696-R745 VanDerWaalsContact OD1-CZ 3.28Å; D696-R745 IonicContact OD1-NH1 3.14Å; D696-R745 PolarHBondContact OD1-NH1 2.74Å; D696-R745 IonicContact OD1-NH2 3.94Å; D696-R745 PolarHBondContact OD1-NH2 2.69Å; E699-R745 WeakPolarHBondContact OE1-CG 3.47Å; E699-R745 IonicContact OE1-CZ 3.17Å; E699-R745 IonicContact OE1-NE 3.47Å; E699-R745 PolarHBondContact OE1-NE 2.84Å; E699-R745 IonicContact OE1-NH2 3.95Å; E699-R745 PolarHBondContact OE1-NH2 3.12Å; E699-R745 IonicContact OE2-CZ 2.76Å; E699-R745 IonicContact OE2-NE 3.92Å; E699-R745 PolarHBondContact OE2-NE 3.16Å; E699-R745 IonicContact OE2-NH2 3.52Å; E699-R745 PolarHBondContact OE2-NH2 2.92Å; A741-R745 WeakPolarHBondContact O-CB 3.44Å; A741-R745 PolarHBondContact O-N 2.86Å; V742-R745 PolarHBondContact O-N 3.49Å; R745-V748 PolarHBondContact O-N 3.4Å; R745-L749 PolarHBondContact O-N 3.06Å
746	L	92.6	Very high	91	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-38.3	177.6	-177	59	0	0	0	112.5	M695 Y713 V742 R743 H744 V748 L749 L750 V780	M695-L746 HydrophobicContact CE-CB 3.9Å; M695-L746 HydrophobicContact SD-CB 4.21Å; M695-L746 HydrophobicContact SD-CD1 4.31Å; Y713-L746 HydrophobicContact CD2-CD2 3.82Å; Y713-L746 HydrophobicContact CE2-CD2 4.42Å; Y713-L746 HydrophobicContact CG-CD2 4.19Å; V742-L746 WeakPolarHBondContact O-CB 3.29Å; V742-L746 PolarHBondContact O-N 3.26Å; R743-L746 PolarHBondContact O-N 3.03Å; H744-L746 VanDerWaalsContact C-N 3.32Å; H744-L746 PolarHBondContact O-N 3.4Å; L746-V748 VanDerWaalsContact C-N 3.35Å; L746-V748 PolarHBondContact O-N 3.13Å; L746-L749 HydrophobicContact CD1-CD2 4.34Å; L746-L749 PolarHBondContact O-N 3.42Å; L746-L750 HydrophobicContact CD1-CD1 4.07Å; L746-L750 HydrophobicContact CD1-CD2 4.39Å; L746-L750 HydrophobicContact CD1-CG 4.01Å; L746-L750 HydrophobicContact CG-CD1 3.87Å; L746-L750 HydrophobicContact CG-CG 4.29Å; L746-L750 WeakPolarHBondContact O-CB 3.5Å; L746-L750 WeakPolarHBondContact O-CG 3.35Å; L746-L750 PolarHBondContact O-N 2.93Å; L746-V780 HydrophobicContact CD2-CG2 3.69Å; L746-V780 HydrophobicContact CG-CG2 4.23Å
747	I	91.5	Very high	91.1	Very high	23 Å²	23	41 Å²	41	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-57.2	-49.5	173	-66.2	169.2	0	0	0	110.3	R743 H744 L749 L750 E751 V780 L781	R743-I747 WeakPolarHBondContact O-CG1 3.31Å; R743-I747 PolarHBondContact O-N 3.34Å; H744-I747 PolarHBondContact O-N 3.46Å; I747-L749 VanDerWaalsContact C-N 3.33Å; I747-L749 PolarHBondContact O-N 3.12Å; I747-L750 PolarHBondContact O-N 3.23Å; I747-E751 HydrophobicContact CG2-CG 4.26Å; I747-E751 WeakPolarHBondContact O-CB 3.46Å; I747-E751 WeakPolarHBondContact O-CG 3.41Å; I747-E751 PolarHBondContact O-N 3.37Å; I747-V780 HydrophobicContact CD1-CG1 4.04Å; I747-V780 HydrophobicContact CG1-CG1 3.4Å; I747-V780 VanDerWaalsContact CG1-CG1 3.4Å; I747-L781 HydrophobicContact CD1-CD2 4.39Å
748	V	92.4	Very high	90.9	Very high	100 Å²	100	35.5 Å²	35.5	61%	0.606	18%	0.182	S	C	*	.	H	α-helix	trans	-62	-41.2	-179.7	177.5	0	0	0	0	111.4	H744 R745 L746 N752	H744-V748 PolarHBondContact O-N 3.03Å; R745-V748 PolarHBondContact O-N 3.4Å; L746-V748 VanDerWaalsContact C-N 3.35Å; L746-V748 PolarHBondContact O-N 3.13Å; V748-N752 VanDerWaalsContact O-CB 3.26Å; V748-N752 WeakPolarHBondContact O-CB 3.28Å; V748-N752 PolarHBondContact O-N 3.24Å
749	L	91.1	Very high	90.5	Very high	8 Å²	8	37 Å²	37	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-62.4	-44.2	175.7	179.3	61.9	0	0	0	112.3	M695 A698 E699 R745 L746 I747 N752 Q753	M695-L749 HydrophobicContact CB-CD2 4.25Å; M695-L749 HydrophobicContact CG-CD2 3.9Å; A698-L749 HydrophobicContact CB-CD1 4.12Å; A698-L749 HydrophobicContact CB-CD2 3.82Å; E699-L749 HydrophobicContact CG-CD1 4.06Å; R745-L749 PolarHBondContact O-N 3.06Å; L746-L749 HydrophobicContact CD1-CD2 4.34Å; L746-L749 PolarHBondContact O-N 3.42Å; I747-L749 VanDerWaalsContact C-N 3.33Å; I747-L749 PolarHBondContact O-N 3.12Å; L749-N752 PolarHBondContact O-N 3.43Å; L749-Q753 HydrophobicContact CD1-CG 4.46Å; L749-Q753 WeakPolarHBondContact O-CB 3.23Å; L749-Q753 VanDerWaalsContact O-CG 3.32Å; L749-Q753 WeakPolarHBondContact O-CG 3.37Å; L749-Q753 PolarHBondContact O-N 3.4Å
750	L	91.6	Very high	90.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.8	-44.4	180	-65.4	168.2	0	0	0	111.9	L746 I747 N752 Q753 I754 T773 L776 L777 V780	L746-L750 HydrophobicContact CD1-CD1 4.07Å; L746-L750 HydrophobicContact CD1-CD2 4.39Å; L746-L750 HydrophobicContact CD1-CG 4.01Å; L746-L750 HydrophobicContact CG-CD1 3.87Å; L746-L750 HydrophobicContact CG-CG 4.29Å; L746-L750 WeakPolarHBondContact O-CB 3.5Å; L746-L750 WeakPolarHBondContact O-CG 3.35Å; L746-L750 PolarHBondContact O-N 2.93Å; I747-L750 PolarHBondContact O-N 3.23Å; L750-N752 PolarHBondContact O-N 3.1Å; L750-Q753 PolarHBondContact O-N 3.39Å; L750-I754 WeakPolarHBondContact O-CD1 3.37Å; L750-I754 VanDerWaalsContact O-CG1 3.29Å; L750-I754 WeakPolarHBondContact O-CG1 3.43Å; L750-I754 PolarHBondContact O-N 3.2Å; L750-T773 HydrophobicContact CD2-CG2 3.64Å; L750-L776 HydrophobicContact CD1-CB 4.43Å; L750-L776 HydrophobicContact CD1-CD2 4.36Å; L750-L776 HydrophobicContact CD1-CG 3.94Å; L750-L776 HydrophobicContact CD2-CD2 4.15Å; L750-L776 HydrophobicContact CD2-CG 4.42Å; L750-L777 HydrophobicContact CB-CD1 4.35Å; L750-L777 HydrophobicContact CD1-CB 4.31Å; L750-L777 HydrophobicContact CD1-CD1 4.49Å; L750-V780 HydrophobicContact CD1-CG2 4.26Å
751	E	91.4	Very high	89.8	Confident	47 Å²	47	36.2 Å²	36.2	22%	0.22	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-37	174.2	-72	-175.7	175.6	0	0	110.9	I747 T755 R797	I747-E751 HydrophobicContact CG2-CG 4.26Å; I747-E751 WeakPolarHBondContact O-CB 3.46Å; I747-E751 WeakPolarHBondContact O-CG 3.41Å; I747-E751 PolarHBondContact O-N 3.37Å; E751-T755 VanDerWaalsContact O-CB 3.31Å; E751-T755 WeakPolarHBondContact O-CB 3.44Å; E751-T755 PolarHBondContact O-N 2.87Å; E751-T755 PolarHBondContact O-OG1 3Å; E751-R797 IonicContact OE1-CZ 3.2Å; E751-R797 IonicContact OE1-NH1 3.41Å; E751-R797 PolarHBondContact OE1-NH1 2.84Å
752	N	90.7	Very high	89.4	Confident	81 Å²	81	33.4 Å²	33.4	43%	0.433	16%	0.163	S	C	.	.	H	α-helix	trans	-68.1	-43	173.6	-173.1	39.7	0	0	0	113.1	V748 L749 L750 T755 H756	V748-N752 VanDerWaalsContact O-CB 3.26Å; V748-N752 WeakPolarHBondContact O-CB 3.28Å; V748-N752 PolarHBondContact O-N 3.24Å; L749-N752 PolarHBondContact O-N 3.43Å; L750-N752 PolarHBondContact O-N 3.1Å; N752-T755 PolarHBondContact O-N 2.74Å; N752-H756 PolarHBondContact O-N 3.23Å; N752-H756 PolarHBondContact O-ND1 2.81Å; N752-H756 VanDerWaalsContact O-ND1 3.13Å; N752-H756 PolarHBondContact OD1-CE1 2.98Å; N752-H756 PolarHBondContact OD1-ND1 2.91Å
753	Q	89.6	Confident	88.8	Confident	20 Å²	20	33.8 Å²	33.8	9%	0.093	16%	0.164	C	C	.	.	H	α-helix	trans	-65.6	-35.6	177.2	-76.8	177.2	-2.3	0	0	113	L749 L750 H756 F757 C760 F761 T773	L749-Q753 HydrophobicContact CD1-CG 4.46Å; L749-Q753 WeakPolarHBondContact O-CB 3.23Å; L749-Q753 VanDerWaalsContact O-CG 3.32Å; L749-Q753 WeakPolarHBondContact O-CG 3.37Å; L749-Q753 PolarHBondContact O-N 3.4Å; L750-Q753 PolarHBondContact O-N 3.39Å; Q753-H756 CarbonylContact O-C 3.56Å; Q753-F757 WeakPolarHBondContact O-CA 3.35Å; Q753-F757 PolarHBondContact O-N 3.04Å; Q753-C760 HydrophobicContact CB-CB 4.44Å; Q753-C760 HydrophobicContact CG-CB 4.43Å; Q753-F761 HydrophobicContact CB-CE2 4.15Å; Q753-F761 HydrophobicContact CB-CZ 4.3Å; Q753-T773 HydrophobicContact CB-CG2 4.34Å
754	I	90.6	Very high	88.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-72.2	-41.4	174	-64.5	160.9	0	0	0	110.1	L750 H756 F757 T773 L774 L777 V798 C801	L750-I754 WeakPolarHBondContact O-CD1 3.37Å; L750-I754 VanDerWaalsContact O-CG1 3.29Å; L750-I754 WeakPolarHBondContact O-CG1 3.43Å; L750-I754 PolarHBondContact O-N 3.2Å; I754-H756 VanDerWaalsContact C-N 3.27Å; I754-H756 PolarHBondContact O-N 3.2Å; I754-F757 WeakPolarHBondContact O-CB 3.5Å; I754-F757 WeakPolarHBondContact O-CD1 3.38Å; I754-F757 PolarHBondContact O-N 3.32Å; I754-T773 HydrophobicContact CD1-CG2 4.35Å; I754-T773 HydrophobicContact CG1-CG2 3.97Å; I754-L774 HydrophobicContact CD1-CD2 3.85Å; I754-L774 HydrophobicContact CG1-CD2 4.23Å; I754-L777 HydrophobicContact CD1-CD2 3.67Å; I754-V798 HydrophobicContact CG2-CG1 4.5Å; I754-C801 HydrophobicContact CB-CB 4.19Å; I754-C801 HydrophobicContact CG2-CB 3.65Å
755	T	90.9	Very high	87.5	Confident	11 Å²	11	28.7 Å²	28.7	7%	0.067	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-37.3	175.1	-60	0	0	0	0	111.9	E751 N752 K804 A805 I808	E751-T755 VanDerWaalsContact O-CB 3.31Å; E751-T755 WeakPolarHBondContact O-CB 3.44Å; E751-T755 PolarHBondContact O-N 2.87Å; E751-T755 PolarHBondContact O-OG1 3Å; N752-T755 PolarHBondContact O-N 2.74Å; T755-K804 HydrophobicContact CG2-CB 3.72Å; T755-K804 HydrophobicContact CG2-CD 4.35Å; T755-A805 WeakPolarHBondContact O-CB 3.37Å; T755-I808 HydrophobicContact CG2-CD1 3.53Å
756	H	88.7	Confident	86.7	Confident	57 Å²	57	25.8 Å²	25.8	26%	0.264	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	31.1	-179.9	-63.3	97.6	0	0	0	113.6	N752 Q753 I754 R758 Y759 C760	N752-H756 PolarHBondContact O-N 3.23Å; N752-H756 PolarHBondContact O-ND1 2.81Å; N752-H756 VanDerWaalsContact O-ND1 3.13Å; N752-H756 PolarHBondContact OD1-CE1 2.98Å; N752-H756 PolarHBondContact OD1-ND1 2.91Å; Q753-H756 CarbonylContact O-C 3.56Å; I754-H756 VanDerWaalsContact C-N 3.27Å; I754-H756 PolarHBondContact O-N 3.2Å; H756-R758 PolarHBondContact O-N 3.37Å; H756-Y759 PolarHBondContact O-N 2.97Å; H756-C760 PolarHBondContact O-N 3.23Å
757	F	88.6	Confident	85.9	Confident	1 Å²	1	31.2 Å²	31.2	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-52.9	-35.6	-168.4	71.2	-93.9	0	0	0	114.9	Q753 I754 Y759 F761 L770 L802 A805 H852	Q753-F757 WeakPolarHBondContact O-CA 3.35Å; Q753-F757 PolarHBondContact O-N 3.04Å; I754-F757 WeakPolarHBondContact O-CB 3.5Å; I754-F757 WeakPolarHBondContact O-CD1 3.38Å; I754-F757 PolarHBondContact O-N 3.32Å; F757-Y759 PolarHBondContact O-N 3.5Å; F757-F761 PolarHBondContact O-N 2.66Å; F757-L770 HydrophobicContact CB-CD1 4.26Å; F757-L770 HydrophobicContact CB-CD2 4.25Å; F757-L802 HydrophobicContact CD1-CD2 4.34Å; F757-L802 HydrophobicContact CE1-CD2 4.03Å; F757-A805 HydrophobicContact CD1-CB 4.05Å; F757-A805 HydrophobicContact CE1-CB 3.83Å; F757-H852 HydrophobicContact CD2-CB 4.35Å; F757-H852 AromaticContact CD2-CD2 3.89Å; F757-H852 AromaticContact CD2-CE1 3.69Å; F757-H852 AromaticContact CD2-CG 3.71Å; F757-H852 AromaticContact CD2-ND1 3.6Å; F757-H852 AromaticContact CD2-NE2 3.87Å; F757-H852 HydrophobicContact CE2-CB 4.21Å; F757-H852 AromaticContact CE2-CD2 3.74Å; F757-H852 AromaticContact CE2-CG 3.8Å
758	R	85.3	Confident	85.4	Confident	18 Å²	18	32.3 Å²	32.3	7%	0.068	18%	0.182	C	C	.	.	H	α-helix	trans	-67.7	-18.4	178.3	-58.1	-175.9	87.9	-147.1	6.6	114.3	R157 H756 N809 N848	R157-R758 VanDerWaalsContact CD-O 3.32Å; R157-R758 WeakPolarHBondContact CD-O 3.41Å; H756-R758 PolarHBondContact O-N 3.37Å; R758-N809 VanDerWaalsContact CD-CG 3.46Å; R758-N809 WeakPolarHBondContact CD-ND2 3.42Å; R758-N809 WeakPolarHBondContact CD-OD1 3.35Å; R758-N848 VanDerWaalsContact CD-OD1 3.31Å; R758-N848 WeakPolarHBondContact CD-OD1 3.3Å; R758-N848 PolarHBondContact NE-OD1 3.48Å
759	Y	82.8	Confident	85	Confident	70 Å²	70	27.6 Å²	27.6	28%	0.275	15%	0.154	S	C	.	.	H	α-helix	trans	-108.8	-35	-179.3	-69.5	-94.5	0	0	0	112.5	R157 H756 F757 Q812	R157-Y759 HydrophobicContact CG-CD1 4.18Å; R157-Y759 HydrophobicContact CG-CE1 4.04Å; H756-Y759 PolarHBondContact O-N 2.97Å; F757-Y759 PolarHBondContact O-N 3.5Å; Y759-Q812 PolarHBondContact OH-OE1 3.08Å
760	C	82.4	Confident	84.8	Confident	36 Å²	36	27.7 Å²	27.7	24%	0.243	16%	0.155	C	C	.	.	H	α-helix	trans	-75.1	-32.1	174.4	-65.2	0	0	0	0	112.5	L703 Q753 H756	L703-C760 WeakPolarHBondContact CD1-O 3.36Å; Q753-C760 HydrophobicContact CB-CB 4.44Å; Q753-C760 HydrophobicContact CG-CB 4.43Å; H756-C760 PolarHBondContact O-N 3.23Å
761	F	84.8	Confident	84.7	Confident	3 Å²	3	31 Å²	31	1%	0.013	17%	0.169	C	C	.	.	S	Bend	trans	-129.4	55.1	-179.2	-50.5	-69.1	0	0	0	112	P706 Q753 F757 F763 G764 R765 A769 L770 T773 H852	P706-F761 HydrophobicContact CG-CE1 3.96Å; P706-F761 HydrophobicContact CG-CZ 4.28Å; Q753-F761 HydrophobicContact CB-CE2 4.15Å; Q753-F761 HydrophobicContact CB-CZ 4.3Å; F757-F761 PolarHBondContact O-N 2.66Å; F761-F763 PolarHBondContact O-N 3.08Å; F761-G764 PolarHBondContact O-N 3.1Å; F761-R765 CarbonylContact C-O 3.49Å; F761-R765 VanDerWaalsContact CA-O 3.22Å; F761-R765 WeakPolarHBondContact CA-O 3.49Å; F761-A769 HydrophobicContact CD1-CB 3.69Å; F761-A769 HydrophobicContact CE1-CB 3.82Å; F761-L770 HydrophobicContact CD2-CB 3.99Å; F761-L770 HydrophobicContact CD2-CD1 3.85Å; F761-L770 HydrophobicContact CD2-CG 4.41Å; F761-L770 HydrophobicContact CE2-CB 4.46Å; F761-L770 HydrophobicContact CE2-CD1 3.93Å; F761-L770 HydrophobicContact CG-CB 4.21Å; F761-T773 HydrophobicContact CE2-CG2 4.43Å; F761-T773 HydrophobicContact CZ-CG2 4.32Å; F761-T773 VanDerWaalsContact CZ-OG1 3.23Å; F761-T773 WeakPolarHBondContact CZ-OG1 3.29Å; F761-H852 PolarHBondContact O-CE1 3.03Å
762	P	82.6	Confident	84.5	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.019	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-61.1	131.7	-168	28	-34.9	0	0	0	111.4	R157 M161 G764 R765	R157-P762 HydrophobicContact CB-CB 4.07Å; M161-P762 HydrophobicContact CB-CG 3.98Å; M161-P762 HydrophobicContact CG-CG 4.02Å; M161-P762 HydrophobicContact SD-CG 3.74Å; P762-G764 PolarHBondContact O-N 2.71Å; P762-R765 PolarHBondContact O-N 2.73Å
763	F	81.1	Confident	84.4	Confident	12 Å²	12	25.3 Å²	25.3	5%	0.053	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	56.1	29	-175.1	-48.9	-92	0	0	0	113.9	G151 F152 R157 V158 V175 F761 R765 H851	G151-F763 WeakPolarHBondContact O-CZ 3.3Å; F152-F763 HydrophobicContact CB-CE1 4.49Å; F152-F763 HydrophobicContact CB-CZ 4.47Å; F152-F763 AromaticContact CD2-CD1 3.91Å; F152-F763 HydrophobicContact CD2-CD1 3.91Å; F152-F763 AromaticContact CD2-CD2 3.53Å; F152-F763 HydrophobicContact CD2-CD2 3.53Å; F152-F763 AromaticContact CD2-CE1 3.94Å; F152-F763 HydrophobicContact CD2-CE1 3.94Å; F152-F763 AromaticContact CD2-CE2 3.58Å; F152-F763 HydrophobicContact CD2-CE2 3.58Å; F152-F763 AromaticContact CD2-CG 3.72Å; F152-F763 HydrophobicContact CD2-CG 3.72Å; F152-F763 AromaticContact CD2-CZ 3.77Å; F152-F763 HydrophobicContact CD2-CZ 3.77Å; F152-F763 HydrophobicContact CE2-CB 4.36Å; F152-F763 AromaticContact CE2-CD2 3.59Å; F152-F763 HydrophobicContact CE2-CD2 3.59Å; F152-F763 AromaticContact CE2-CE2 3.98Å; F152-F763 HydrophobicContact CE2-CE2 3.98Å; F152-F763 AromaticContact CE2-CG 3.93Å; F152-F763 HydrophobicContact CE2-CG 3.93Å; R157-F763 HydrophobicContact CB-CE2 4.29Å; V158-F763 HydrophobicContact CG2-CD2 4.21Å; V158-F763 HydrophobicContact CG2-CE2 3.61Å; V158-F763 HydrophobicContact CG2-CZ 4.38Å; V175-F763 HydrophobicContact CG1-CB 4.34Å; V175-F763 HydrophobicContact CG2-CB 4.17Å; F761-F763 PolarHBondContact O-N 3.08Å; F763-R765 VanDerWaalsContact C-N 3.33Å; F763-R765 PolarHBondContact O-N 2.93Å; F763-H851 AromaticContact CD1-CD2 3.73Å; F763-H851 AromaticContact CD1-NE2 3.58Å
764	G	76.1	Confident	84.4	Confident	17 Å²	17	24.8 Å²	24.8	18%	0.175	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	73.2	21.1	-179.8	0	0	0	0	0	114.1	F761 P762 P766 H851	F761-G764 PolarHBondContact O-N 3.1Å; P762-G764 PolarHBondContact O-N 2.71Å; G764-P766 CarbonylContact O-C 3.56Å; G764-H851 WeakPolarHBondContact CA-O 3.18Å
765	R	79.9	Confident	84.3	Confident	18 Å²	18	26.6 Å²	26.6	7%	0.068	15%	0.152	C	C	.	.			trans	-106.3	138.4	-180	-60.4	-66.1	170.2	-147	-6.4	111.8	M161 D171 V175 F761 P762 F763 D767	M161-R765 HydrophobicContact SD-CB 4.24Å; D171-R765 HydrophobicContact CB-CG 4.49Å; V175-R765 HydrophobicContact CG2-CG 4.01Å; F761-R765 CarbonylContact C-O 3.49Å; F761-R765 VanDerWaalsContact CA-O 3.22Å; F761-R765 WeakPolarHBondContact CA-O 3.49Å; P762-R765 PolarHBondContact O-N 2.73Å; F763-R765 VanDerWaalsContact C-N 3.33Å; F763-R765 PolarHBondContact O-N 2.93Å; R765-D767 IonicContact CZ-OD1 2.69Å; R765-D767 IonicContact NH1-OD1 3.33Å; R765-D767 PolarHBondContact NH1-OD1 3.41Å
766	P	76.9	Confident	84.2	Confident	16 Å²	16	26.1 Å²	26.1	10%	0.104	15%	0.148	C	C	.	.	S	Bend	cis	-67.8	154.9	-2	-15.9	32	0	0	0	112.3	L661 L703 G764 G768 A769	L661-P766 HydrophobicContact CD1-CB 4Å; L661-P766 HydrophobicContact CD1-CG 3.76Å; L661-P766 HydrophobicContact CD2-CG 4.15Å; L703-P766 HydrophobicContact CD2-CG 4.09Å; L703-P766 HydrophobicContact CG-CG 4.27Å; G764-P766 CarbonylContact O-C 3.56Å; P766-G768 PolarHBondContact O-N 3.45Å; P766-A769 HydrophobicContact CB-CB 4.16Å; P766-A769 HydrophobicContact CG-CB 4.3Å; P766-A769 WeakPolarHBondContact O-CB 3.49Å; P766-A769 PolarHBondContact O-N 2.87Å
767	D	75.8	Confident	84.3	Confident	115 Å²	115	23.4 Å²	23.4	62%	0.615	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	131	-173.6	-155.4	74.2	0	0	0	111.5	R765 A769	R765-D767 IonicContact CZ-OD1 2.69Å; R765-D767 IonicContact NH1-OD1 3.33Å; R765-D767 PolarHBondContact NH1-OD1 3.41Å; D767-A769 PolarHBondContact O-N 3.06Å; D767-A769 VanDerWaalsContact O-N 3.09Å
768	G	79.8	Confident	84.2	Confident	45 Å²	45	26.2 Å²	26.2	46%	0.464	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-3.9	-176.6	0	0	0	0	0	116.2	P766 L770 K771 A772	P766-G768 PolarHBondContact O-N 3.45Å; G768-L770 PolarHBondContact O-N 3.03Å; G768-K771 WeakPolarHBondContact O-CA 3.48Å; G768-K771 WeakPolarHBondContact O-CB 3.33Å; G768-K771 PolarHBondContact O-N 3.2Å; G768-A772 PolarHBondContact O-N 3.36Å
769	A	84.3	Confident	84.3	Confident	2 Å²	2	28.6 Å²	28.6	2%	0.017	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-44.2	-172.7	0	0	0	0	0	113.2	P706 F761 P766 D767 K771 A772 T773	P706-A769 HydrophobicContact CG-CB 4.04Å; F761-A769 HydrophobicContact CD1-CB 3.69Å; F761-A769 HydrophobicContact CE1-CB 3.82Å; P766-A769 HydrophobicContact CB-CB 4.16Å; P766-A769 HydrophobicContact CG-CB 4.3Å; P766-A769 WeakPolarHBondContact O-CB 3.49Å; P766-A769 PolarHBondContact O-N 2.87Å; D767-A769 PolarHBondContact O-N 3.06Å; D767-A769 VanDerWaalsContact O-N 3.09Å; A769-K771 VanDerWaalsContact C-N 3.28Å; A769-K771 PolarHBondContact O-N 3.29Å; A769-A772 CarbonylContact O-C 3.14Å; A769-A772 WeakPolarHBondContact O-CB 3.31Å; A769-A772 PolarHBondContact O-N 3.28Å; A769-A772 VanDerWaalsContact O-N 3.12Å; A769-T773 PolarHBondContact O-N 3.34Å; A769-T773 PolarHBondContact O-OG1 2.9Å
770	L	87.8	Confident	84.5	Confident	10 Å²	10	25.2 Å²	25.2	5%	0.052	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-35	176.6	179.3	58.9	0	0	0	112.5	F757 F761 G768 T773 L774 H852 A855 F856	F757-L770 HydrophobicContact CB-CD1 4.26Å; F757-L770 HydrophobicContact CB-CD2 4.25Å; F761-L770 HydrophobicContact CD2-CB 3.99Å; F761-L770 HydrophobicContact CD2-CD1 3.85Å; F761-L770 HydrophobicContact CD2-CG 4.41Å; F761-L770 HydrophobicContact CE2-CB 4.46Å; F761-L770 HydrophobicContact CE2-CD1 3.93Å; F761-L770 HydrophobicContact CG-CB 4.21Å; G768-L770 PolarHBondContact O-N 3.03Å; L770-T773 WeakPolarHBondContact O-CB 3.4Å; L770-T773 PolarHBondContact O-N 2.93Å; L770-L774 WeakPolarHBondContact O-CG 3.39Å; L770-L774 PolarHBondContact O-N 2.63Å; L770-H852 HydrophobicContact CD2-CB 4.13Å; L770-A855 HydrophobicContact CB-CB 4.03Å; L770-A855 HydrophobicContact CD2-CB 3.93Å; L770-A855 HydrophobicContact CG-CB 3.81Å; L770-F856 HydrophobicContact CD2-CE2 3.87Å; L770-F856 HydrophobicContact CD2-CZ 4.21Å
771	K	88.5	Confident	84.6	Confident	69 Å²	69	24.4 Å²	24.4	30%	0.3	14%	0.138	S	C	.	.	H	α-helix	trans	-69	-38.5	175.2	-168.8	170.7	-171.9	158.1	0	111.5	G768 A769 L774 S775 A855 S857 W858	G768-K771 WeakPolarHBondContact O-CA 3.48Å; G768-K771 WeakPolarHBondContact O-CB 3.33Å; G768-K771 PolarHBondContact O-N 3.2Å; A769-K771 VanDerWaalsContact C-N 3.28Å; A769-K771 PolarHBondContact O-N 3.29Å; K771-L774 PolarHBondContact O-N 2.76Å; K771-S775 WeakPolarHBondContact O-CB 3.41Å; K771-S775 PolarHBondContact O-N 3.03Å; K771-A855 HydrophobicContact CB-CB 4.13Å; K771-S857 PolarHBondContact NZ-OG 3.26Å; K771-W858 VanDerWaalsContact CE-CZ2 3.49Å
772	A	86.9	Confident	84.5	Confident	8 Å²	8	25.8 Å²	25.8	7%	0.066	15%	0.145	C	C	.	.	H	α-helix	trans	-64.9	-39.3	172.3	0	0	0	0	0	112.2	P706 M707 G768 A769 S775 L776	P706-A772 HydrophobicContact CB-CB 3.95Å; M707-A772 HydrophobicContact CG-CB 3.83Å; M707-A772 HydrophobicContact SD-CB 3.46Å; M707-A772 WeakPolarHBondContact SD-CB 3.49Å; G768-A772 PolarHBondContact O-N 3.36Å; A769-A772 CarbonylContact O-C 3.14Å; A769-A772 WeakPolarHBondContact O-CB 3.31Å; A769-A772 PolarHBondContact O-N 3.28Å; A769-A772 VanDerWaalsContact O-N 3.12Å; A772-S775 PolarHBondContact O-N 2.88Å; A772-L776 VanDerWaalsContact O-CB 3.25Å; A772-L776 WeakPolarHBondContact O-CB 3.47Å; A772-L776 PolarHBondContact O-N 3.29Å
773	T	89.5	Confident	83.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-44.7	173	-55.9	0	0	0	0	112.1	P706 L750 Q753 I754 F761 A769 L770 L776 L777	P706-T773 WeakPolarHBondContact CB-OG1 3.48Å; P706-T773 VanDerWaalsContact CG-OG1 3.3Å; P706-T773 WeakPolarHBondContact CG-OG1 3.3Å; L750-T773 HydrophobicContact CD2-CG2 3.64Å; Q753-T773 HydrophobicContact CB-CG2 4.34Å; I754-T773 HydrophobicContact CD1-CG2 4.35Å; I754-T773 HydrophobicContact CG1-CG2 3.97Å; F761-T773 HydrophobicContact CE2-CG2 4.43Å; F761-T773 HydrophobicContact CZ-CG2 4.32Å; F761-T773 VanDerWaalsContact CZ-OG1 3.23Å; F761-T773 WeakPolarHBondContact CZ-OG1 3.29Å; A769-T773 PolarHBondContact O-N 3.34Å; A769-T773 PolarHBondContact O-OG1 2.9Å; L770-T773 WeakPolarHBondContact O-CB 3.4Å; L770-T773 PolarHBondContact O-N 2.93Å; T773-L776 PolarHBondContact O-N 3.1Å; T773-L777 PolarHBondContact O-N 3.13Å
774	L	89.3	Confident	83.1	Confident	10 Å²	10	35.2 Å²	35.2	5%	0.052	19%	0.188	C	C	.	.	H	α-helix	trans	-65.8	-46.1	177.1	-69.4	166.5	0	0	0	112.1	I754 L770 K771 L776 L777 E778 V798 A855 F856	I754-L774 HydrophobicContact CD1-CD2 3.85Å; I754-L774 HydrophobicContact CG1-CD2 4.23Å; L770-L774 WeakPolarHBondContact O-CG 3.39Å; L770-L774 PolarHBondContact O-N 2.63Å; K771-L774 PolarHBondContact O-N 2.76Å; L774-L776 VanDerWaalsContact C-N 3.3Å; L774-L776 PolarHBondContact O-N 3.27Å; L774-L777 PolarHBondContact O-N 3.41Å; L774-E778 PolarHBondContact O-N 3.09Å; L774-E778 VanDerWaalsContact O-N 3.09Å; L774-V798 HydrophobicContact CD2-CG1 3.95Å; L774-V798 HydrophobicContact CD2-CG2 3.67Å; L774-A855 HydrophobicContact CD1-CB 4.42Å; L774-F856 HydrophobicContact CD1-CD1 3.94Å; L774-F856 HydrophobicContact CD1-CE1 3.76Å; L774-F856 HydrophobicContact CD1-CZ 4.31Å; L774-F856 HydrophobicContact CD2-CE1 4.19Å
775	S	88.6	Confident	82.6	Confident	38 Å²	38	36.9 Å²	36.9	27%	0.266	19%	0.192	S	C	.	.	H	α-helix	trans	-61.5	-37.5	174.8	-177.2	0	0	0	0	112.2	K771 A772 E778 R779	K771-S775 WeakPolarHBondContact O-CB 3.41Å; K771-S775 PolarHBondContact O-N 3.03Å; A772-S775 PolarHBondContact O-N 2.88Å; S775-E778 PolarHBondContact O-N 3.3Å; S775-R779 WeakPolarHBondContact O-CB 3.29Å; S775-R779 PolarHBondContact O-N 3.23Å
776	L	89.7	Confident	81.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.1	-40.5	174.4	-175.1	52.2	0	0	0	112.2	L709 H710 Y713 L750 A772 T773 L774 E778 R779 V780	L709-L776 HydrophobicContact CB-CD2 3.69Å; H710-L776 HydrophobicContact CB-CB 4.36Å; H710-L776 HydrophobicContact CB-CD1 3.94Å; H710-L776 HydrophobicContact CB-CD2 4.22Å; H710-L776 HydrophobicContact CB-CG 4.4Å; Y713-L776 HydrophobicContact CD1-CD1 4.11Å; Y713-L776 HydrophobicContact CG-CD1 4.34Å; L750-L776 HydrophobicContact CD1-CB 4.43Å; L750-L776 HydrophobicContact CD1-CD2 4.36Å; L750-L776 HydrophobicContact CD1-CG 3.94Å; L750-L776 HydrophobicContact CD2-CD2 4.15Å; L750-L776 HydrophobicContact CD2-CG 4.42Å; A772-L776 VanDerWaalsContact O-CB 3.25Å; A772-L776 WeakPolarHBondContact O-CB 3.47Å; A772-L776 PolarHBondContact O-N 3.29Å; T773-L776 PolarHBondContact O-N 3.1Å; L774-L776 VanDerWaalsContact C-N 3.3Å; L774-L776 PolarHBondContact O-N 3.27Å; L776-E778 VanDerWaalsContact C-N 3.35Å; L776-E778 PolarHBondContact O-N 2.89Å; L776-R779 PolarHBondContact O-N 3.19Å; L776-V780 HydrophobicContact CD1-CG2 3.81Å; L776-V780 HydrophobicContact CG-CG2 4.13Å; L776-V780 WeakPolarHBondContact O-CB 3.32Å; L776-V780 WeakPolarHBondContact O-CG2 3.44Å; L776-V780 PolarHBondContact O-N 2.77Å
777	L	89.7	Confident	81.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-47.1	174.7	179.5	63.2	0	0	0	111	L750 I754 T773 L774 R779 V780 L781 V798	L750-L777 HydrophobicContact CB-CD1 4.35Å; L750-L777 HydrophobicContact CD1-CB 4.31Å; L750-L777 HydrophobicContact CD1-CD1 4.49Å; I754-L777 HydrophobicContact CD1-CD2 3.67Å; T773-L777 PolarHBondContact O-N 3.13Å; L774-L777 PolarHBondContact O-N 3.41Å; L777-R779 VanDerWaalsContact C-N 3.33Å; L777-R779 PolarHBondContact O-N 3.2Å; L777-V780 PolarHBondContact O-N 3.49Å; L777-L781 HydrophobicContact CD1-CD1 4.11Å; L777-L781 HydrophobicContact CD1-CG 4.31Å; L777-L781 HydrophobicContact CG-CD1 3.98Å; L777-L781 WeakPolarHBondContact O-CD1 3.47Å; L777-L781 VanDerWaalsContact O-CG 3.24Å; L777-L781 WeakPolarHBondContact O-CG 3.47Å; L777-L781 PolarHBondContact O-N 2.91Å; L777-V798 HydrophobicContact CD2-CG2 4.11Å
778	E	87.3	Confident	80.7	Confident	60 Å²	60	43 Å²	43	28%	0.28	24%	0.237	S	C	.	.	H	α-helix	trans	-55.1	-48.6	174.3	-167.8	-168.5	155.7	0	0	111.5	L774 S775 L776 V780 L781 M782 T794	L774-E778 PolarHBondContact O-N 3.09Å; L774-E778 VanDerWaalsContact O-N 3.09Å; S775-E778 PolarHBondContact O-N 3.3Å; L776-E778 VanDerWaalsContact C-N 3.35Å; L776-E778 PolarHBondContact O-N 2.89Å; E778-V780 VanDerWaalsContact C-N 3.34Å; E778-V780 PolarHBondContact O-N 2.76Å; E778-L781 PolarHBondContact O-N 2.84Å; E778-M782 HydrophobicContact CG-CE 4.43Å; E778-M782 PolarHBondContact O-N 3.28Å; E778-T794 HydrophobicContact CB-CG2 4.11Å; E778-T794 HydrophobicContact CG-CG2 4.44Å
779	R	85.8	Confident	80.2	Confident	68 Å²	68	41.7 Å²	41.7	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-67.5	-28.6	-179.8	-169.5	170.9	-174.3	78.6	2.9	114	H710 Y713 S775 L776 L777 M782	H710-R779 VanDerWaalsContact NE2-CD 3.32Å; H710-R779 WeakPolarHBondContact NE2-CD 3.45Å; Y713-R779 HydrophobicContact CD1-CG 4.47Å; Y713-R779 HydrophobicContact CE1-CG 4.42Å; S775-R779 WeakPolarHBondContact O-CB 3.29Å; S775-R779 PolarHBondContact O-N 3.23Å; L776-R779 PolarHBondContact O-N 3.19Å; L777-R779 VanDerWaalsContact C-N 3.33Å; L777-R779 PolarHBondContact O-N 3.2Å; R779-M782 HydrophobicContact CG-SD 4.39Å
780	V	87.3	Confident	79.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-77.7	-29.6	177	173.9	0	0	0	0	111.4	Y713 R743 L746 I747 L750 L776 L777 E778	Y713-V780 HydrophobicContact CD1-CG2 3.81Å; Y713-V780 HydrophobicContact CD2-CG2 4.23Å; Y713-V780 HydrophobicContact CE1-CB 4.22Å; Y713-V780 HydrophobicContact CE1-CG2 3.6Å; Y713-V780 HydrophobicContact CE2-CG2 4.03Å; Y713-V780 HydrophobicContact CG-CG2 4.14Å; R743-V780 HydrophobicContact CG-CG1 3.83Å; R743-V780 PolarHBondContact NE-O 2.9Å; R743-V780 PolarHBondContact NH2-O 2.92Å; L746-V780 HydrophobicContact CD2-CG2 3.69Å; L746-V780 HydrophobicContact CG-CG2 4.23Å; I747-V780 HydrophobicContact CD1-CG1 4.04Å; I747-V780 HydrophobicContact CG1-CG1 3.4Å; I747-V780 VanDerWaalsContact CG1-CG1 3.4Å; L750-V780 HydrophobicContact CD1-CG2 4.26Å; L776-V780 HydrophobicContact CD1-CG2 3.81Å; L776-V780 HydrophobicContact CG-CG2 4.13Å; L776-V780 WeakPolarHBondContact O-CB 3.32Å; L776-V780 WeakPolarHBondContact O-CG2 3.44Å; L776-V780 PolarHBondContact O-N 2.77Å; L777-V780 PolarHBondContact O-N 3.49Å; E778-V780 VanDerWaalsContact C-N 3.34Å; E778-V780 PolarHBondContact O-N 2.76Å
781	L	84.8	Confident	79	Confident	19 Å²	19	48.4 Å²	48.4	10%	0.099	27%	0.266	C	S	.	.	H	α-helix	trans	-75	-22	174.8	-66.8	167	0	0	0	113.1	I747 L777 E778 K783 V789 T794	I747-L781 HydrophobicContact CD1-CD2 4.39Å; L777-L781 HydrophobicContact CD1-CD1 4.11Å; L777-L781 HydrophobicContact CD1-CG 4.31Å; L777-L781 HydrophobicContact CG-CD1 3.98Å; L777-L781 WeakPolarHBondContact O-CD1 3.47Å; L777-L781 VanDerWaalsContact O-CG 3.24Å; L777-L781 WeakPolarHBondContact O-CG 3.47Å; L777-L781 PolarHBondContact O-N 2.91Å; E778-L781 PolarHBondContact O-N 2.84Å; L781-K783 PolarHBondContact O-N 2.99Å; L781-V789 HydrophobicContact CB-CG1 4.41Å; L781-V789 HydrophobicContact CB-CG2 3.77Å; L781-T794 HydrophobicContact CD1-CG2 4.36Å
782	M	82.1	Confident	78.6	Confident	31 Å²	31	50.2 Å²	50.2	15%	0.153	28%	0.275	C	S	.	.			trans	-57.1	121	175.7	-71.1	176.1	-179.6	0	0	111.9	R743 E778 R779 D784 V789	R743-M782 PolarHBondContact NH2-O 3.35Å; E778-M782 HydrophobicContact CG-CE 4.43Å; E778-M782 PolarHBondContact O-N 3.28Å; R779-M782 HydrophobicContact CG-SD 4.39Å; M782-D784 VanDerWaalsContact C-N 3.3Å; M782-D784 PolarHBondContact O-N 3.15Å; M782-V789 HydrophobicContact CB-CG2 4.25Å; M782-V789 HydrophobicContact CG-CG2 3.75Å; M782-V789 VanDerWaalsContact N-CG2 3.28Å
783	K	70.6	Confident	78.5	Confident	168 Å²	168	53.4 Å²	53.4	73%	0.73	29%	0.289	S	S	*	.	S	Bend	trans	-68.9	-31.6	179.9	-68.4	-179.1	-178.9	174.6	0	112.7	L781	L781-K783 PolarHBondContact O-N 2.99Å
784	D	64.3	Low	78.2	Confident	45 Å²	45	53.5 Å²	53.5	24%	0.241	29%	0.289	C	S	.	.	S	Bend	trans	-153.2	165.7	-179.7	57	-80.4	0	0	0	108.4	M782 T786 T787	M782-D784 VanDerWaalsContact C-N 3.3Å; M782-D784 PolarHBondContact O-N 3.15Å; D784-T786 VanDerWaalsContact C-N 3.27Å; D784-T786 PolarHBondContact O-N 3.22Å; D784-T786 PolarHBondContact OD2-N 3.08Å; D784-T786 PolarHBondContact OD2-OG1 3.02Å; D784-T787 VanDerWaalsContact CG-OG1 3.3Å; D784-T787 VanDerWaalsContact OD1-CB 3.28Å; D784-T787 WeakPolarHBondContact OD1-CB 3.38Å; D784-T787 PolarHBondContact OD1-OG1 3.3Å; D784-T787 VanDerWaalsContact OD1-OG1 3.1Å; D784-T787 VanDerWaalsContact OD2-CB 3.26Å; D784-T787 WeakPolarHBondContact OD2-CB 3.47Å; D784-T787 PolarHBondContact OD2-N 2.67Å; D784-T787 PolarHBondContact OD2-OG1 2.94Å
785	I	65.4	Low	78.1	Confident	53 Å²	53	54.6 Å²	54.6	27%	0.272	29%	0.294	S	S	.	.	S	Bend	trans	-72.9	-22.9	-174.8	-70.5	172.3	0	0	0	112.6	A717 S718 H721 N723	A717-I785 WeakPolarHBondContact O-CD1 3.06Å; S718-I785 VanDerWaalsContact CA-CD1 3.47Å; H721-I785 HydrophobicContact CB-CD1 3.92Å; H721-I785 HydrophobicContact CB-CG1 4.05Å; N723-I785 HydrophobicContact CB-CD1 4.15Å; N723-I785 HydrophobicContact CB-CG2 4.5Å; N723-I785 WeakPolarHBondContact ND2-CG2 3.32Å
786	T	58.5	Low	78.1	Confident	109 Å²	109	59.6 Å²	59.6	67%	0.669	31%	0.307	S	S	*	.	S	Bend	trans	-88.1	-27.9	-174.8	30.9	0	0	0	0	113.6	D784 P788	D784-T786 VanDerWaalsContact C-N 3.27Å; D784-T786 PolarHBondContact O-N 3.22Å; D784-T786 PolarHBondContact OD2-N 3.08Å; D784-T786 PolarHBondContact OD2-OG1 3.02Å; T786-P788 VanDerWaalsContact O-CD 3.29Å; T786-P788 WeakPolarHBondContact O-CD 3.22Å
787	T	67.4	Low	78	Confident	81 Å²	81	63.4 Å²	63.4	50%	0.497	32%	0.321	S	S	.	.	S	Bend	trans	-102.6	100.6	-178.6	-48.5	0	0	0	0	109.9	D784	D784-T787 VanDerWaalsContact CG-OG1 3.3Å; D784-T787 VanDerWaalsContact OD1-CB 3.28Å; D784-T787 WeakPolarHBondContact OD1-CB 3.38Å; D784-T787 PolarHBondContact OD1-OG1 3.3Å; D784-T787 VanDerWaalsContact OD1-OG1 3.1Å; D784-T787 VanDerWaalsContact OD2-CB 3.26Å; D784-T787 WeakPolarHBondContact OD2-CB 3.47Å; D784-T787 PolarHBondContact OD2-N 2.67Å; D784-T787 PolarHBondContact OD2-OG1 2.94Å
788	P	66.4	Low	78.1	Confident	88 Å²	88	63.4 Å²	63.4	57%	0.571	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-63.7	147.5	173.6	28.2	-34.9	0	0	0	110.5	T786	T786-P788 VanDerWaalsContact O-CD 3.29Å; T786-P788 WeakPolarHBondContact O-CD 3.22Å
789	V	69.9	Low	78.3	Confident	16 Å²	16	63.3 Å²	63.3	10%	0.097	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-65.7	137.8	173.4	-173.9	0	0	0	0	108.4	L781 M782 S791 E793	L781-V789 HydrophobicContact CB-CG1 4.41Å; L781-V789 HydrophobicContact CB-CG2 3.77Å; M782-V789 HydrophobicContact CB-CG2 4.25Å; M782-V789 HydrophobicContact CG-CG2 3.75Å; M782-V789 VanDerWaalsContact N-CG2 3.28Å; V789-S791 PolarHBondContact O-N 3.36Å; V789-S791 VanDerWaalsContact O-N 3.16Å; V789-E793 HydrophobicContact CG1-CB 3.98Å
790	P	73.1	Confident	78.5	Confident	88 Å²	88	66.1 Å²	66.1	57%	0.571	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-56	122.7	168.1	-23.2	34	0	0	0	109.4	E792 E793	P790-E792 PolarHBondContact O-N 3.32Å; P790-E793 PolarHBondContact O-N 3.47Å
791	S	74.3	Confident	78.8	Confident	65 Å²	65	66.3 Å²	66.3	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-48.1	-35.9	-174.8	-166.4	0	0	0	0	112.7	V789 E793 T794 K795 W859	V789-S791 PolarHBondContact O-N 3.36Å; V789-S791 VanDerWaalsContact O-N 3.16Å; S791-E793 PolarHBondContact O-N 3.39Å; S791-T794 PolarHBondContact O-N 3.41Å; S791-K795 WeakPolarHBondContact O-CB 3.27Å; S791-K795 PolarHBondContact O-N 3.17Å; S791-W859 WeakPolarHBondContact OG-CZ2 3.44Å
792	E	79.8	Confident	79.1	Confident	108 Å²	108	65.6 Å²	65.6	51%	0.505	33%	0.332	S	S	.	.	H	α-helix	trans	-58.8	-30.8	174.6	-69.7	-59.1	121.5	0	0	116.3	P790 R796	P790-E792 PolarHBondContact O-N 3.32Å; E792-R796 VanDerWaalsContact O-CB 3.23Å; E792-R796 WeakPolarHBondContact O-CB 3.41Å; E792-R796 PolarHBondContact O-N 2.94Å
793	E	84.1	Confident	79.6	Confident	74 Å²	74	68.1 Å²	68.1	35%	0.346	34%	0.344	S	S	.	.	H	α-helix	trans	-72.6	-44.1	175.5	-171.1	179.4	160.4	0	0	110.7	V789 P790 S791 R796 R797	V789-E793 HydrophobicContact CG1-CB 3.98Å; P790-E793 PolarHBondContact O-N 3.47Å; S791-E793 PolarHBondContact O-N 3.39Å; E793-R796 PolarHBondContact O-N 3.44Å; E793-R797 PolarHBondContact O-N 2.81Å; E793-R797 VanDerWaalsContact O-N 3.09Å; E793-R797 IonicContact OE1-NE 3.49Å; E793-R797 IonicContact OE1-NH2 3.28Å
794	T	84.2	Confident	80.5	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.018	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-46	175	-47.8	0	0	0	0	110.5	E778 L781 S791 R796 R797 V798 W859	E778-T794 HydrophobicContact CB-CG2 4.11Å; E778-T794 HydrophobicContact CG-CG2 4.44Å; L781-T794 HydrophobicContact CD1-CG2 4.36Å; S791-T794 PolarHBondContact O-N 3.41Å; T794-R796 VanDerWaalsContact C-N 3.35Å; T794-R796 PolarHBondContact O-N 3.49Å; T794-R797 PolarHBondContact O-N 2.97Å; T794-V798 WeakPolarHBondContact O-CG2 3.29Å; T794-V798 PolarHBondContact O-N 3.12Å; T794-W859 HydrophobicContact CG2-CH2 3.8Å; T794-W859 HydrophobicContact CG2-CZ3 4.45Å
795	K	86.9	Confident	81.9	Confident	32 Å²	32	62.6 Å²	62.6	14%	0.139	32%	0.318	C	S	.	.	H	α-helix	trans	-53.5	-49.9	175.6	-167.3	-173.6	-174.4	-175.2	0	111	S791 R797 V798 Q799 W859 E861 L862	S791-K795 WeakPolarHBondContact O-CB 3.27Å; S791-K795 PolarHBondContact O-N 3.17Å; K795-R797 PolarHBondContact O-N 3.5Å; K795-V798 PolarHBondContact O-N 3.48Å; K795-Q799 VanDerWaalsContact O-CB 3.31Å; K795-Q799 WeakPolarHBondContact O-CB 3.18Å; K795-Q799 PolarHBondContact O-N 3.32Å; K795-W859 HydrophobicContact CB-CZ2 4.11Å; K795-W859 HydrophobicContact CG-CD2 4.26Å; K795-W859 HydrophobicContact CG-CG 4.39Å; K795-E861 IonicContact NZ-OE2 2.72Å; K795-E861 PolarHBondContact NZ-OE2 3.3Å; K795-L862 HydrophobicContact CG-CD1 4.11Å; K795-L862 HydrophobicContact CG-CD2 4.11Å; K795-L862 HydrophobicContact CG-CG 4.39Å
796	R	88.4	Confident	83.1	Confident	143 Å²	143	60.2 Å²	60.2	54%	0.54	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-34.2	179.7	-167.7	-177.1	-55.6	115.2	12.8	113.8	E792 E793 T794 K800	E792-R796 VanDerWaalsContact O-CB 3.23Å; E792-R796 WeakPolarHBondContact O-CB 3.41Å; E792-R796 PolarHBondContact O-N 2.94Å; E793-R796 PolarHBondContact O-N 3.44Å; T794-R796 VanDerWaalsContact C-N 3.35Å; T794-R796 PolarHBondContact O-N 3.49Å; R796-K800 WeakPolarHBondContact O-CB 3.39Å; R796-K800 PolarHBondContact O-N 3.18Å; R796-K800 VanDerWaalsContact O-N 3.15Å
797	R	88.8	Confident	84.6	Confident	81 Å²	81	60.4 Å²	60.4	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-68.8	-43.9	173.1	-76.3	-179.2	-177.7	-99.1	3.7	111.8	E751 E793 T794 K795 K800 C801	E751-R797 IonicContact OE1-CZ 3.2Å; E751-R797 IonicContact OE1-NH1 3.41Å; E751-R797 PolarHBondContact OE1-NH1 2.84Å; E793-R797 PolarHBondContact O-N 2.81Å; E793-R797 VanDerWaalsContact O-N 3.09Å; E793-R797 IonicContact OE1-NE 3.49Å; E793-R797 IonicContact OE1-NH2 3.28Å; T794-R797 PolarHBondContact O-N 2.97Å; K795-R797 PolarHBondContact O-N 3.5Å; R797-K800 PolarHBondContact O-N 3.01Å; R797-C801 PolarHBondContact O-N 2.85Å; R797-C801 PolarHBondContact O-SG 3.22Å
798	V	90.4	Very high	85.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65	-44.7	177.9	176.9	0	0	0	0	110.7	I754 L774 L777 T794 K795 K800 C801 L802 F856 W859 L862	I754-V798 HydrophobicContact CG2-CG1 4.5Å; L774-V798 HydrophobicContact CD2-CG1 3.95Å; L774-V798 HydrophobicContact CD2-CG2 3.67Å; L777-V798 HydrophobicContact CD2-CG2 4.11Å; T794-V798 WeakPolarHBondContact O-CG2 3.29Å; T794-V798 PolarHBondContact O-N 3.12Å; K795-V798 PolarHBondContact O-N 3.48Å; V798-K800 PolarHBondContact O-N 3.13Å; V798-C801 WeakPolarHBondContact O-CA 3.47Å; V798-C801 WeakPolarHBondContact O-CB 3.46Å; V798-C801 PolarHBondContact O-N 2.84Å; V798-L802 HydrophobicContact CG1-CD1 4Å; V798-L802 HydrophobicContact CG1-CG 4.42Å; V798-L802 WeakPolarHBondContact O-CG 3.3Å; V798-L802 PolarHBondContact O-N 3.04Å; V798-F856 HydrophobicContact CG1-CD1 4.49Å; V798-F856 HydrophobicContact CG1-CE1 3.87Å; V798-W859 HydrophobicContact CG2-CZ3 4.27Å; V798-L862 HydrophobicContact CB-CD1 4.25Å; V798-L862 HydrophobicContact CG1-CD1 3.86Å
799	Q	91.1	Very high	86.7	Confident	58 Å²	58	54.7 Å²	54.7	27%	0.271	26%	0.26	S	S	.	.	H	α-helix	trans	-49.9	-53.4	171.6	-176.6	177.9	47.7	0	0	111.4	K795 C801 L802 E803 L862 E865	K795-Q799 VanDerWaalsContact O-CB 3.31Å; K795-Q799 WeakPolarHBondContact O-CB 3.18Å; K795-Q799 PolarHBondContact O-N 3.32Å; Q799-C801 VanDerWaalsContact C-N 3.27Å; Q799-C801 PolarHBondContact O-N 3.2Å; Q799-L802 CarbonylContact O-C 3.51Å; Q799-L802 WeakPolarHBondContact O-CA 3.39Å; Q799-L802 WeakPolarHBondContact O-CB 3.38Å; Q799-L802 PolarHBondContact O-N 3.08Å; Q799-E803 WeakPolarHBondContact O-CG 3.48Å; Q799-E803 PolarHBondContact O-N 2.72Å; Q799-L862 HydrophobicContact CB-CD2 3.89Å; Q799-L862 HydrophobicContact CG-CD2 4.31Å; Q799-E865 PolarHBondContact NE2-OE2 3.09Å
800	K	91.6	Very high	87.7	Confident	126 Å²	126	54.7 Å²	54.7	55%	0.548	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-25	177.7	-169.8	172.8	-174.6	175.7	0	114.6	R796 R797 V798 K804	R796-K800 WeakPolarHBondContact O-CB 3.39Å; R796-K800 PolarHBondContact O-N 3.18Å; R796-K800 VanDerWaalsContact O-N 3.15Å; R797-K800 PolarHBondContact O-N 3.01Å; V798-K800 PolarHBondContact O-N 3.13Å; K800-K804 WeakPolarHBondContact O-CG 3.19Å
801	C	92.8	Very high	88.4	Confident	4 Å²	4	53.7 Å²	53.7	3%	0.027	25%	0.254	C	S	.	.	H	α-helix	trans	-76.6	-35.5	171.2	-63	0	0	0	0	111.3	I754 R797 V798 Q799 K804 A805	I754-C801 HydrophobicContact CB-CB 4.19Å; I754-C801 HydrophobicContact CG2-CB 3.65Å; R797-C801 PolarHBondContact O-N 2.85Å; R797-C801 PolarHBondContact O-SG 3.22Å; V798-C801 WeakPolarHBondContact O-CA 3.47Å; V798-C801 WeakPolarHBondContact O-CB 3.46Å; V798-C801 PolarHBondContact O-N 2.84Å; Q799-C801 VanDerWaalsContact C-N 3.27Å; Q799-C801 PolarHBondContact O-N 3.2Å; C801-K804 PolarHBondContact O-N 3.35Å; C801-A805 WeakPolarHBondContact O-CB 3.44Å; C801-A805 PolarHBondContact O-N 2.92Å
802	L	91.6	Very high	88.9	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-72.1	-37.9	176.2	-68.9	171	0	0	0	112.4	F757 V798 Q799 K804 A805 S806 F856 L862 H866	F757-L802 HydrophobicContact CD1-CD2 4.34Å; F757-L802 HydrophobicContact CE1-CD2 4.03Å; V798-L802 HydrophobicContact CG1-CD1 4Å; V798-L802 HydrophobicContact CG1-CG 4.42Å; V798-L802 WeakPolarHBondContact O-CG 3.3Å; V798-L802 PolarHBondContact O-N 3.04Å; Q799-L802 CarbonylContact O-C 3.51Å; Q799-L802 WeakPolarHBondContact O-CA 3.39Å; Q799-L802 WeakPolarHBondContact O-CB 3.38Å; Q799-L802 PolarHBondContact O-N 3.08Å; L802-K804 PolarHBondContact O-N 3.49Å; L802-A805 CarbonylContact O-C 3.56Å; L802-A805 WeakPolarHBondContact O-CB 3.4Å; L802-A805 PolarHBondContact O-N 2.82Å; L802-S806 PolarHBondContact O-N 3.04Å; L802-S806 PolarHBondContact O-OG 3.4Å; L802-F856 HydrophobicContact CD1-CE1 4.11Å; L802-F856 HydrophobicContact CD1-CZ 4.48Å; L802-F856 HydrophobicContact CD2-CE1 4.49Å; L802-F856 HydrophobicContact CD2-CZ 4.08Å; L802-L862 HydrophobicContact CD1-CB 3.81Å; L802-H866 HydrophobicContact CB-CB 4.32Å; L802-H866 PolarHBondContact O-CD2 3.05Å
803	E	91.3	Very high	89.2	Confident	85 Å²	85	48.7 Å²	48.7	40%	0.397	22%	0.223	S	C	.	.	H	α-helix	trans	-54.8	-37.7	169.7	-72.6	169.2	-177.5	0	0	112.5	Q799 S806 Q807	Q799-E803 WeakPolarHBondContact O-CG 3.48Å; Q799-E803 PolarHBondContact O-N 2.72Å; E803-S806 PolarHBondContact O-OG 2.8Å; E803-Q807 WeakPolarHBondContact O-CG 3.48Å
804	K	91.5	Very high	89.1	Confident	97 Å²	97	46.7 Å²	46.7	42%	0.422	21%	0.214	S	C	.	.	H	α-helix	trans	-76.7	-38.9	173.1	-67.8	173.9	178.3	-178.7	0	111.9	T755 K800 C801 L802 S806 Q807 I808	T755-K804 HydrophobicContact CG2-CB 3.72Å; T755-K804 HydrophobicContact CG2-CD 4.35Å; K800-K804 WeakPolarHBondContact O-CG 3.19Å; C801-K804 PolarHBondContact O-N 3.35Å; L802-K804 PolarHBondContact O-N 3.49Å; K804-S806 VanDerWaalsContact C-N 3.32Å; K804-S806 PolarHBondContact O-N 2.81Å; K804-Q807 PolarHBondContact O-N 3.25Å; K804-I808 WeakPolarHBondContact O-CG1 3.41Å; K804-I808 PolarHBondContact O-N 3.48Å
805	A	91.8	Very high	89	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-37.5	179.4	0	0	0	0	0	111.7	T755 F757 C801 L802 N809 H866	T755-A805 WeakPolarHBondContact O-CB 3.37Å; F757-A805 HydrophobicContact CD1-CB 4.05Å; F757-A805 HydrophobicContact CE1-CB 3.83Å; C801-A805 WeakPolarHBondContact O-CB 3.44Å; C801-A805 PolarHBondContact O-N 2.92Å; L802-A805 CarbonylContact O-C 3.56Å; L802-A805 WeakPolarHBondContact O-CB 3.4Å; L802-A805 PolarHBondContact O-N 2.82Å; A805-N809 WeakPolarHBondContact O-CB 3.32Å; A805-N809 PolarHBondContact O-N 3.02Å; A805-N809 PolarHBondContact O-ND2 2.95Å; A805-H866 VanDerWaalsContact CB-NE2 3.35Å; A805-H866 WeakPolarHBondContact CB-NE2 3.29Å; A805-H866 PolarHBondContact O-NE2 3.12Å
806	S	91.1	Very high	88.5	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-46	174.6	59.1	0	0	0	0	111.5	L802 E803 K804 N809 Y810 H866	L802-S806 PolarHBondContact O-N 3.04Å; L802-S806 PolarHBondContact O-OG 3.4Å; E803-S806 PolarHBondContact O-OG 2.8Å; K804-S806 VanDerWaalsContact C-N 3.32Å; K804-S806 PolarHBondContact O-N 2.81Å; S806-N809 PolarHBondContact O-N 2.66Å; S806-Y810 VanDerWaalsContact O-CB 3.3Å; S806-Y810 WeakPolarHBondContact O-CB 3.41Å; S806-Y810 PolarHBondContact O-N 3.29Å; S806-H866 WeakPolarHBondContact CA-NE2 3.46Å; S806-H866 PolarHBondContact N-NE2 3.23Å
807	Q	90.5	Very high	87.9	Confident	114 Å²	114	52 Å²	52	53%	0.533	24%	0.243	S	C	.	.	H	α-helix	trans	-58.2	-48.7	175.4	-65.9	169.3	9.4	0	0	112.4	E803 K804 Y810 S811 L873	E803-Q807 WeakPolarHBondContact O-CG 3.48Å; K804-Q807 PolarHBondContact O-N 3.25Å; Q807-Y810 PolarHBondContact O-N 3.4Å; Q807-S811 PolarHBondContact O-N 3.09Å; Q807-L873 HydrophobicContact CB-CD1 4.41Å; Q807-L873 HydrophobicContact CG-CD1 4.08Å
808	I	89.4	Confident	86.9	Confident	45 Å²	45	56 Å²	56	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-45.6	179.9	-67.5	162.7	0	0	0	110.8	T755 K804 Y810 Q812	T755-I808 HydrophobicContact CG2-CD1 3.53Å; K804-I808 WeakPolarHBondContact O-CG1 3.41Å; K804-I808 PolarHBondContact O-N 3.48Å; I808-Y810 VanDerWaalsContact C-N 3.28Å; I808-Y810 PolarHBondContact O-N 2.9Å; I808-Q812 WeakPolarHBondContact O-CB 3.38Å; I808-Q812 VanDerWaalsContact O-CG 3.25Å; I808-Q812 WeakPolarHBondContact O-CG 3.27Å; I808-Q812 PolarHBondContact O-N 3.14Å; I808-Q812 PolarHBondContact O-OE1 3.4Å
809	N	89.1	Confident	85.6	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-35.6	177	-71.3	-27.3	0	0	0	112.2	R758 A805 S806 L813 H866 F870	R758-N809 VanDerWaalsContact CD-CG 3.46Å; R758-N809 WeakPolarHBondContact CD-ND2 3.42Å; R758-N809 WeakPolarHBondContact CD-OD1 3.35Å; A805-N809 WeakPolarHBondContact O-CB 3.32Å; A805-N809 PolarHBondContact O-N 3.02Å; A805-N809 PolarHBondContact O-ND2 2.95Å; S806-N809 PolarHBondContact O-N 2.66Å; N809-L813 WeakPolarHBondContact O-CB 3.17Å; N809-L813 PolarHBondContact O-N 3.31Å; N809-H866 PolarHBondContact ND2-CE1 3.22Å; N809-H866 PolarHBondContact ND2-NE2 3.24Å; N809-F870 HydrophobicContact CB-CD2 4.24Å; N809-F870 HydrophobicContact CB-CE2 3.94Å
810	Y	89.4	Confident	83.9	Confident	16 Å²	16	60.3 Å²	60.3	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-74.4	-47.9	-179.7	-171.9	-103.7	0	0	0	111.5	S806 Q807 I808 Q812 L813 M814 F870 L873 Y874 D877	S806-Y810 VanDerWaalsContact O-CB 3.3Å; S806-Y810 WeakPolarHBondContact O-CB 3.41Å; S806-Y810 PolarHBondContact O-N 3.29Å; Q807-Y810 PolarHBondContact O-N 3.4Å; I808-Y810 VanDerWaalsContact C-N 3.28Å; I808-Y810 PolarHBondContact O-N 2.9Å; Y810-Q812 VanDerWaalsContact C-N 3.29Å; Y810-Q812 PolarHBondContact O-N 3.19Å; Y810-L813 WeakPolarHBondContact O-CA 3.42Å; Y810-L813 WeakPolarHBondContact O-CB 3.31Å; Y810-L813 PolarHBondContact O-N 3.22Å; Y810-M814 HydrophobicContact CD1-CG 4.32Å; Y810-M814 HydrophobicContact CE1-CG 3.92Å; Y810-M814 HydrophobicContact CE1-SD 4.37Å; Y810-M814 PolarHBondContact O-N 2.91Å; Y810-F870 HydrophobicContact CD2-CD2 4.45Å; Y810-F870 HydrophobicContact CD2-CE1 4.39Å; Y810-F870 HydrophobicContact CD2-CE2 4.01Å; Y810-F870 AromaticContact CD2-CZ 3.97Å; Y810-F870 HydrophobicContact CD2-CZ 3.97Å; Y810-F870 HydrophobicContact CG-CE2 4.45Å; Y810-L873 HydrophobicContact CD1-CB 3.68Å; Y810-L873 HydrophobicContact CD1-CD1 4.2Å; Y810-L873 HydrophobicContact CD2-CB 4.29Å; Y810-L873 HydrophobicContact CE1-CB 3.97Å; Y810-L873 HydrophobicContact CG-CB 3.86Å; Y810-L873 HydrophobicContact CG-CD1 4.04Å; Y810-Y874 HydrophobicContact CE2-CD2 4.34Å; Y810-Y874 WeakPolarHBondContact OH-CA 3.37Å; Y810-D877 PolarHBondContact OH-OD2 3.27Å
811	S	88.1	Confident	82.1	Confident	67 Å²	67	58.9 Å²	58.9	47%	0.469	29%	0.292	S	S	.	.	H	α-helix	trans	-54.3	-46.6	174.8	-170.8	0	0	0	0	111.5	Q807 L813 M814 D815	Q807-S811 PolarHBondContact O-N 3.09Å; S811-L813 VanDerWaalsContact C-N 3.26Å; S811-L813 PolarHBondContact O-N 3.47Å; S811-M814 WeakPolarHBondContact O-CB 3.22Å; S811-M814 PolarHBondContact O-N 2.85Å; S811-D815 PolarHBondContact O-N 3.26Å
812	Q	84.4	Confident	80.2	Confident	56 Å²	56	62.8 Å²	62.8	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-69.2	-22.8	179	-69.7	167.1	-16.4	0	0	113.4	Y759 I808 Y810 Y816	Y759-Q812 PolarHBondContact OH-OE1 3.08Å; I808-Q812 WeakPolarHBondContact O-CB 3.38Å; I808-Q812 VanDerWaalsContact O-CG 3.25Å; I808-Q812 WeakPolarHBondContact O-CG 3.27Å; I808-Q812 PolarHBondContact O-N 3.14Å; I808-Q812 PolarHBondContact O-OE1 3.4Å; Y810-Q812 VanDerWaalsContact C-N 3.29Å; Y810-Q812 PolarHBondContact O-N 3.19Å; Q812-Y816 WeakPolarHBondContact O-CB 3.41Å; Q812-Y816 PolarHBondContact O-N 2.96Å; Q812-Y816 VanDerWaalsContact O-N 3.16Å
813	L	86.1	Confident	78.4	Confident	12 Å²	12	67.9 Å²	67.9	6%	0.063	35%	0.346	C	S	.	.	H	α-helix	trans	-76.8	-39.4	172.8	-166.2	63.5	0	0	0	111.3	N809 Y810 S811 Y816 A817 L837 L840 C841 V844 F870	N809-L813 WeakPolarHBondContact O-CB 3.17Å; N809-L813 PolarHBondContact O-N 3.31Å; Y810-L813 WeakPolarHBondContact O-CA 3.42Å; Y810-L813 WeakPolarHBondContact O-CB 3.31Å; Y810-L813 PolarHBondContact O-N 3.22Å; S811-L813 VanDerWaalsContact C-N 3.26Å; S811-L813 PolarHBondContact O-N 3.47Å; L813-Y816 PolarHBondContact O-N 3.33Å; L813-A817 VanDerWaalsContact O-CB 3.29Å; L813-A817 WeakPolarHBondContact O-CB 3.46Å; L813-A817 PolarHBondContact O-N 2.98Å; L813-L837 HydrophobicContact CD2-CD1 4.18Å; L813-L837 HydrophobicContact CG-CD1 4.25Å; L813-L840 HydrophobicContact CD1-CB 4.05Å; L813-L840 HydrophobicContact CD2-CB 4.14Å; L813-L840 HydrophobicContact CG-CB 4.31Å; L813-C841 HydrophobicContact CD2-CB 4.43Å; L813-C841 VanDerWaalsContact CD2-SG 3.6Å; L813-V844 HydrophobicContact CD1-CG2 3.72Å; L813-V844 HydrophobicContact CD2-CG2 4.03Å; L813-V844 HydrophobicContact CG-CG2 4.46Å; L813-F870 HydrophobicContact CD2-CZ 3.95Å
814	M	82.8	Confident	76.5	Confident	32 Å²	32	73 Å²	73	16%	0.158	37%	0.37	C	S	.	.	H	α-helix	trans	-60.8	-48.1	171.6	-68	-62.9	-74.1	0	0	111.2	Y810 S811 Y816 A817 Q818 I819 V821 L837	Y810-M814 HydrophobicContact CD1-CG 4.32Å; Y810-M814 HydrophobicContact CE1-CG 3.92Å; Y810-M814 HydrophobicContact CE1-SD 4.37Å; Y810-M814 PolarHBondContact O-N 2.91Å; S811-M814 WeakPolarHBondContact O-CB 3.22Å; S811-M814 PolarHBondContact O-N 2.85Å; M814-Y816 VanDerWaalsContact C-N 3.27Å; M814-Y816 PolarHBondContact O-N 2.63Å; M814-A817 PolarHBondContact O-N 3.21Å; M814-Q818 PolarHBondContact O-N 3.27Å; M814-I819 HydrophobicContact CE-CB 4.2Å; M814-I819 HydrophobicContact CE-CG2 4.29Å; M814-V821 HydrophobicContact CE-CG2 4.42Å; M814-L837 HydrophobicContact CE-CD2 4.38Å; M814-L837 HydrophobicContact SD-CD1 3.79Å; M814-L837 HydrophobicContact SD-CD2 3.4Å; M814-L837 WeakPolarHBondContact SD-CD2 3.47Å; M814-L837 HydrophobicContact SD-CG 4.26Å
815	D	81.5	Confident	75	Confident	113 Å²	113	71.2 Å²	71.2	60%	0.604	36%	0.363	S	S	*	.	H	α-helix	trans	-55.7	-41.6	175.1	-64.3	-33.8	0	0	0	111.8	S811	S811-D815 PolarHBondContact O-N 3.26Å
816	Y	77.6	Confident	74.1	Confident	173 Å²	173	75.3 Å²	75.3	68%	0.678	39%	0.388	S	S	*	.	H	α-helix	trans	-74	-37.1	179.1	178.2	-100.4	0	0	0	113.4	Q812 L813 M814 Q818 L840	Q812-Y816 WeakPolarHBondContact O-CB 3.41Å; Q812-Y816 PolarHBondContact O-N 2.96Å; Q812-Y816 VanDerWaalsContact O-N 3.16Å; L813-Y816 PolarHBondContact O-N 3.33Å; M814-Y816 VanDerWaalsContact C-N 3.27Å; M814-Y816 PolarHBondContact O-N 2.63Å; Y816-Q818 PolarHBondContact O-N 2.99Å; Y816-L840 HydrophobicContact CE1-CD2 4.38Å
817	A	74.6	Confident	73.2	Confident	3 Å²	3	77.5 Å²	77.5	3%	0.025	40%	0.402	C	S	.	.	H	α-helix	trans	-71.1	-21	178	0	0	0	0	0	112.7	L813 M814 I819 R836 L840	L813-A817 VanDerWaalsContact O-CB 3.29Å; L813-A817 WeakPolarHBondContact O-CB 3.46Å; L813-A817 PolarHBondContact O-N 2.98Å; M814-A817 PolarHBondContact O-N 3.21Å; A817-I819 VanDerWaalsContact C-N 3.26Å; A817-I819 HydrophobicContact CB-CD1 3.73Å; A817-I819 HydrophobicContact CB-CG1 3.8Å; A817-I819 PolarHBondContact O-N 3.36Å; A817-R836 PolarHBondContact O-NH1 3.47Å; A817-L840 HydrophobicContact CB-CD1 3.98Å
818	Q	68.9	Low	72.4	Confident	165 Å²	165	78.3 Å²	78.3	77%	0.771	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	30.3	-176.5	-57.7	-176.6	-15	0	0	113.4	M814 Y816 N820	M814-Q818 PolarHBondContact O-N 3.27Å; Y816-Q818 PolarHBondContact O-N 2.99Å; Q818-N820 VanDerWaalsContact C-N 3.34Å; Q818-N820 PolarHBondContact O-N 3.1Å
819	I	62.9	Low	71.9	Confident	30 Å²	30	80.1 Å²	80.1	15%	0.154	41%	0.412	C	S	.	.			trans	-82	82.7	179.3	-58.4	170.6	0	0	0	108.5	M814 A817 V821 D833 L837	M814-I819 HydrophobicContact CE-CB 4.2Å; M814-I819 HydrophobicContact CE-CG2 4.29Å; A817-I819 VanDerWaalsContact C-N 3.26Å; A817-I819 HydrophobicContact CB-CD1 3.73Å; A817-I819 HydrophobicContact CB-CG1 3.8Å; A817-I819 PolarHBondContact O-N 3.36Å; I819-V821 PolarHBondContact O-N 2.79Å; I819-D833 HydrophobicContact CD1-CB 4.14Å; I819-D833 WeakPolarHBondContact CD1-O 3.48Å; I819-D833 HydrophobicContact CG1-CB 4.19Å; I819-D833 HydrophobicContact CG2-CB 4.36Å; I819-L837 HydrophobicContact CD1-CB 3.74Å; I819-L837 HydrophobicContact CD1-CD1 4.32Å; I819-L837 HydrophobicContact CD1-CD2 4.21Å; I819-L837 HydrophobicContact CD1-CG 4.31Å
820	N	55.4	Low	71.5	Confident	118 Å²	118	82.3 Å²	82.3	63%	0.631	42%	0.42	S	S	*	.			trans	-67.2	119.4	164	-75.2	-8.6	0	0	0	108.4	Q818 D822	Q818-N820 VanDerWaalsContact C-N 3.34Å; Q818-N820 PolarHBondContact O-N 3.1Å; N820-D822 PolarHBondContact O-N 2.92Å
821	V	52.6	Low	71.2	Confident	96 Å²	96	82.1 Å²	82.1	58%	0.582	42%	0.42	S	S	*	.			trans	-80.1	61.4	177.9	-168.5	0	0	0	0	109.8	M814 I819 P823	M814-V821 HydrophobicContact CE-CG2 4.42Å; I819-V821 PolarHBondContact O-N 2.79Å; V821-P823 WeakPolarHBondContact O-CD 3.45Å
822	D	52.9	Low	71	Confident	87 Å²	87	85.6 Å²	85.6	47%	0.465	43%	0.429	S	S	.	.			trans	-70.8	124.5	-177.9	-93.4	-49.5	0	0	0	110.7	N820 E824 E825 R830	N820-D822 PolarHBondContact O-N 2.92Å; D822-E824 PolarHBondContact O-N 2.91Å; D822-E825 HydrophobicContact CB-CG 4.03Å; D822-E825 PolarHBondContact O-N 3.28Å; D822-R830 PolarHBondContact O-NH2 3.24Å
823	P	53.8	Low	71	Confident	111 Å²	111	84 Å²	84	72%	0.721	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-19	-171.9	-29	36.8	0	0	0	116.5	V821 R830	V821-P823 WeakPolarHBondContact O-CD 3.45Å; P823-R830 VanDerWaalsContact CA-NH2 3.34Å; P823-R830 PolarHBondContact O-NH2 3.15Å
824	E	51.3	Low	71.1	Confident	193 Å²	193	83.8 Å²	83.8	90%	0.902	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-2.9	-177.2	-58.1	-165.8	144.9	0	0	114.6	D822	D822-E824 PolarHBondContact O-N 2.91Å
825	E	61	Low	71.4	Confident	58 Å²	58	84.5 Å²	84.5	27%	0.271	43%	0.425	S	S	.	.	S	Bend	trans	-67.9	147.1	-178.3	-68.5	-145.9	126.7	0	0	115	D822 K829 R830	D822-E825 HydrophobicContact CB-CG 4.03Å; D822-E825 PolarHBondContact O-N 3.28Å; E825-K829 WeakPolarHBondContact OE1-CD 3.44Å; E825-K829 WeakPolarHBondContact OE1-CE 3.47Å; E825-K829 IonicContact OE1-NZ 3.38Å; E825-K829 PolarHBondContact OE1-NZ 3Å; E825-K829 IonicContact OE2-NZ 2.61Å; E825-K829 PolarHBondContact OE2-NZ 3.05Å; E825-R830 HydrophobicContact CB-CG 4.28Å
826	V	71.9	Confident	71.6	Confident	87 Å²	87	84.6 Å²	84.6	53%	0.527	42%	0.417	S	S	.	.			trans	-62.5	132	-178.5	-176.2	0	0	0	0	110.9	E828 K829 R830	V826-E828 HydrophobicContact CG1-CB 4.36Å; V826-E828 PolarHBondContact O-N 3.2Å; V826-E828 VanDerWaalsContact O-N 3.1Å; V826-K829 PolarHBondContact O-N 3.03Å; V826-K829 VanDerWaalsContact O-N 3.08Å; V826-R830 PolarHBondContact O-N 2.98Å
827	P	73.3	Confident	72.2	Confident	47 Å²	47	76.4 Å²	76.4	31%	0.305	39%	0.385	S	S	.	.	H	α-helix	trans	-56.4	-29.3	-176.9	-29	35.8	0	0	0	115.5	L831 Q885	P827-L831 PolarHBondContact O-N 3.44Å; P827-Q885 PolarHBondContact O-NE2 2.82Å
828	E	73.3	Confident	72.8	Confident	131 Å²	131	76.3 Å²	76.3	61%	0.612	38%	0.384	S	S	*	.	H	α-helix	trans	-68.2	-46.1	176.7	-61.4	-177.8	141.3	0	0	111.7	V826 R830 L831 E832	V826-E828 HydrophobicContact CG1-CB 4.36Å; V826-E828 PolarHBondContact O-N 3.2Å; V826-E828 VanDerWaalsContact O-N 3.1Å; E828-R830 PolarHBondContact O-N 2.93Å; E828-L831 WeakPolarHBondContact O-CB 3.3Å; E828-L831 PolarHBondContact O-N 2.97Å; E828-L831 VanDerWaalsContact O-N 3.15Å; E828-E832 PolarHBondContact O-N 3.45Å; E828-E832 VanDerWaalsContact O-N 3.11Å
829	K	78.3	Confident	73.8	Confident	83 Å²	83	73.1 Å²	73.1	36%	0.361	37%	0.369	S	S	.	.	H	α-helix	trans	-61	-44.5	176.4	-177.3	-173.1	171.4	-74.8	0	111.1	E825 V826 L831 E832 D833	E825-K829 WeakPolarHBondContact OE1-CD 3.44Å; E825-K829 WeakPolarHBondContact OE1-CE 3.47Å; E825-K829 IonicContact OE1-NZ 3.38Å; E825-K829 PolarHBondContact OE1-NZ 3Å; E825-K829 IonicContact OE2-NZ 2.61Å; E825-K829 PolarHBondContact OE2-NZ 3.05Å; V826-K829 PolarHBondContact O-N 3.03Å; V826-K829 VanDerWaalsContact O-N 3.08Å; K829-L831 PolarHBondContact O-N 3.29Å; K829-E832 WeakPolarHBondContact O-CB 3.3Å; K829-E832 PolarHBondContact O-N 2.93Å; K829-E832 VanDerWaalsContact O-N 3.12Å; K829-D833 IonicContact NZ-OD2 3.43Å; K829-D833 PolarHBondContact NZ-OD2 2.89Å; K829-D833 PolarHBondContact O-N 2.82Å
830	R	80.9	Confident	75	Confident	51 Å²	51	73 Å²	73	19%	0.192	37%	0.369	C	S	.	.	H	α-helix	trans	-57.1	-36.7	176.5	-69.8	-171.7	179.4	143.6	5.2	112.5	D822 P823 E825 V826 E828 M834 T881	D822-R830 PolarHBondContact O-NH2 3.24Å; P823-R830 VanDerWaalsContact CA-NH2 3.34Å; P823-R830 PolarHBondContact O-NH2 3.15Å; E825-R830 HydrophobicContact CB-CG 4.28Å; V826-R830 PolarHBondContact O-N 2.98Å; E828-R830 PolarHBondContact O-N 2.93Å; R830-M834 VanDerWaalsContact O-CB 3.22Å; R830-M834 WeakPolarHBondContact O-CB 3.31Å; R830-M834 PolarHBondContact O-N 3.45Å; R830-T881 HydrophobicContact CB-CG2 4.06Å
831	L	83.9	Confident	76.7	Confident	11 Å²	11	67.5 Å²	67.5	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-72.8	-35.2	179	-172	60.2	0	0	0	112.2	P827 E828 K829 L835 L882 N891 L895	P827-L831 PolarHBondContact O-N 3.44Å; E828-L831 WeakPolarHBondContact O-CB 3.3Å; E828-L831 PolarHBondContact O-N 2.97Å; E828-L831 VanDerWaalsContact O-N 3.15Å; K829-L831 PolarHBondContact O-N 3.29Å; L831-L835 WeakPolarHBondContact O-CB 3.31Å; L831-L835 PolarHBondContact O-N 3.37Å; L831-L882 HydrophobicContact CD1-CD2 4.04Å; L831-N891 HydrophobicContact CD2-CB 3.81Å; L831-L895 HydrophobicContact CD1-CD2 4.19Å
832	E	83.6	Confident	78.4	Confident	141 Å²	141	63.7 Å²	63.7	66%	0.659	32%	0.315	S	S	*	.	H	α-helix	trans	-65.7	-47.5	171.6	-173.5	175.5	-171.6	0	0	111.5	E828 K829 M834 L835 R836	E828-E832 PolarHBondContact O-N 3.45Å; E828-E832 VanDerWaalsContact O-N 3.11Å; K829-E832 WeakPolarHBondContact O-CB 3.3Å; K829-E832 PolarHBondContact O-N 2.93Å; K829-E832 VanDerWaalsContact O-N 3.12Å; E832-M834 VanDerWaalsContact C-N 3.34Å; E832-M834 PolarHBondContact O-N 3.15Å; E832-L835 PolarHBondContact O-N 2.95Å; E832-R836 WeakPolarHBondContact O-CB 3.41Å; E832-R836 PolarHBondContact O-N 2.91Å
833	D	84.9	Confident	80	Confident	23 Å²	23	65 Å²	65	12%	0.123	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-38	175.1	-79.8	-44.5	0	0	0	112	I819 K829 R836 L837	I819-D833 HydrophobicContact CD1-CB 4.14Å; I819-D833 WeakPolarHBondContact CD1-O 3.48Å; I819-D833 HydrophobicContact CG1-CB 4.19Å; I819-D833 HydrophobicContact CG2-CB 4.36Å; K829-D833 IonicContact NZ-OD2 3.43Å; K829-D833 PolarHBondContact NZ-OD2 2.89Å; K829-D833 PolarHBondContact O-N 2.82Å; D833-R836 PolarHBondContact O-N 3.43Å; D833-R836 IonicContact OD1-NH1 3.57Å; D833-L837 VanDerWaalsContact O-CB 3.3Å; D833-L837 WeakPolarHBondContact O-CB 3.37Å; D833-L837 PolarHBondContact O-N 3.37Å
834	M	88.6	Confident	81.7	Confident	7 Å²	7	60.1 Å²	60.1	3%	0.034	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-34	175	-165.5	79.3	-132.2	0	0	112.9	R830 E832 L837 G838 Y874 D877 M878 T881 L895	R830-M834 VanDerWaalsContact O-CB 3.22Å; R830-M834 WeakPolarHBondContact O-CB 3.31Å; R830-M834 PolarHBondContact O-N 3.45Å; E832-M834 VanDerWaalsContact C-N 3.34Å; E832-M834 PolarHBondContact O-N 3.15Å; M834-L837 HydrophobicContact CE-CD2 3.97Å; M834-G838 PolarHBondContact O-N 3.3Å; M834-Y874 HydrophobicContact CE-CD1 4.32Å; M834-Y874 HydrophobicContact CE-CD2 3.63Å; M834-Y874 HydrophobicContact CE-CE1 3.99Å; M834-Y874 HydrophobicContact CE-CE2 3.24Å; M834-Y874 HydrophobicContact CE-CG 4.15Å; M834-Y874 VanDerWaalsContact CE-CZ 3.43Å; M834-Y874 PolarHBondContact O-OH 2.75Å; M834-D877 HydrophobicContact CE-CB 4.11Å; M834-D877 VanDerWaalsContact SD-C 3.6Å; M834-D877 HydrophobicContact SD-CB 4.24Å; M834-M878 HydrophobicContact CE-CB 3.82Å; M834-M878 HydrophobicContact SD-CB 4.41Å; M834-T881 HydrophobicContact CB-CG2 3.99Å; M834-T881 HydrophobicContact CG-CG2 4.21Å; M834-L895 HydrophobicContact CG-CD2 4.24Å
835	L	87.3	Confident	83.5	Confident	47 Å²	47	51.5 Å²	51.5	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-70.6	-47.7	174.4	-174.4	149.1	0	0	0	110.9	L831 E832 L837 G838 E839 P894 L895 L898	L831-L835 WeakPolarHBondContact O-CB 3.31Å; L831-L835 PolarHBondContact O-N 3.37Å; E832-L835 PolarHBondContact O-N 2.95Å; L835-L837 VanDerWaalsContact C-N 3.28Å; L835-L837 PolarHBondContact O-N 2.92Å; L835-G838 CarbonylContact O-C 3.45Å; L835-G838 VanDerWaalsContact O-CA 3.3Å; L835-G838 WeakPolarHBondContact O-CA 3.44Å; L835-G838 PolarHBondContact O-N 3.19Å; L835-E839 HydrophobicContact CD2-CG 4.32Å; L835-E839 PolarHBondContact O-N 2.88Å; L835-P894 HydrophobicContact CD1-CB 3.83Å; L835-L895 HydrophobicContact CB-CD1 3.99Å; L835-L895 HydrophobicContact CG-CD1 4.34Å; L835-L898 HydrophobicContact CD2-CD2 4.44Å; L835-L898 HydrophobicContact CG-CD2 4.14Å
836	R	86.9	Confident	84.7	Confident	114 Å²	114	51.5 Å²	51.5	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-58.5	-38.7	173.3	-178.5	177.2	170.8	-126.7	-7.2	112.1	A817 E832 D833 G838 E839 L840	A817-R836 PolarHBondContact O-NH1 3.47Å; E832-R836 WeakPolarHBondContact O-CB 3.41Å; E832-R836 PolarHBondContact O-N 2.91Å; D833-R836 PolarHBondContact O-N 3.43Å; D833-R836 IonicContact OD1-NH1 3.57Å; R836-G838 VanDerWaalsContact C-N 3.33Å; R836-E839 PolarHBondContact O-N 3.12Å; R836-L840 HydrophobicContact CG-CD1 4.5Å; R836-L840 WeakPolarHBondContact O-CB 3.41Å; R836-L840 VanDerWaalsContact O-CG 3.32Å; R836-L840 WeakPolarHBondContact O-CG 3.46Å; R836-L840 PolarHBondContact O-N 3.46Å
837	L	88.9	Confident	85.2	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-36.6	171.1	-176.3	60.4	0	0	0	111.9	L813 M814 I819 D833 M834 L835 L840 C841 Y874	L813-L837 HydrophobicContact CD2-CD1 4.18Å; L813-L837 HydrophobicContact CG-CD1 4.25Å; M814-L837 HydrophobicContact CE-CD2 4.38Å; M814-L837 HydrophobicContact SD-CD1 3.79Å; M814-L837 HydrophobicContact SD-CD2 3.4Å; M814-L837 WeakPolarHBondContact SD-CD2 3.47Å; M814-L837 HydrophobicContact SD-CG 4.26Å; I819-L837 HydrophobicContact CD1-CB 3.74Å; I819-L837 HydrophobicContact CD1-CD1 4.32Å; I819-L837 HydrophobicContact CD1-CD2 4.21Å; I819-L837 HydrophobicContact CD1-CG 4.31Å; D833-L837 VanDerWaalsContact O-CB 3.3Å; D833-L837 WeakPolarHBondContact O-CB 3.37Å; D833-L837 PolarHBondContact O-N 3.37Å; M834-L837 HydrophobicContact CE-CD2 3.97Å; L835-L837 VanDerWaalsContact C-N 3.28Å; L835-L837 PolarHBondContact O-N 2.92Å; L837-L840 PolarHBondContact O-N 2.92Å; L837-C841 VanDerWaalsContact O-CB 3.3Å; L837-C841 WeakPolarHBondContact O-CB 3.43Å; L837-C841 PolarHBondContact O-N 3.48Å; L837-C841 PolarHBondContact O-SG 3.38Å; L837-Y874 HydrophobicContact CB-CE2 4.27Å; L837-Y874 HydrophobicContact CD2-CD2 4.19Å; L837-Y874 HydrophobicContact CD2-CE2 4.22Å; L837-Y874 HydrophobicContact CG-CD2 4.07Å; L837-Y874 HydrophobicContact CG-CE2 3.93Å
838	G	88.7	Confident	85.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-45	174.1	0	0	0	0	0	112.5	M834 L835 R836 C841 I842 Y874	M834-G838 PolarHBondContact O-N 3.3Å; L835-G838 CarbonylContact O-C 3.45Å; L835-G838 VanDerWaalsContact O-CA 3.3Å; L835-G838 WeakPolarHBondContact O-CA 3.44Å; L835-G838 PolarHBondContact O-N 3.19Å; R836-G838 VanDerWaalsContact C-N 3.33Å; G838-C841 WeakPolarHBondContact O-CB 3.45Å; G838-C841 PolarHBondContact O-N 3.46Å; G838-I842 VanDerWaalsContact O-CG1 3.31Å; G838-I842 WeakPolarHBondContact O-CG1 3.33Å; G838-I842 PolarHBondContact O-N 3.11Å; G838-Y874 WeakPolarHBondContact CA-OH 3.24Å
839	E	89.3	Confident	86.4	Confident	99 Å²	99	45.8 Å²	45.8	46%	0.463	21%	0.21	S	C	.	.	H	α-helix	trans	-59.5	-50.3	174	-64.5	-179	148	0	0	110.9	L835 R836 C841 I842 E843 L898	L835-E839 HydrophobicContact CD2-CG 4.32Å; L835-E839 PolarHBondContact O-N 2.88Å; R836-E839 PolarHBondContact O-N 3.12Å; E839-C841 VanDerWaalsContact C-N 3.31Å; E839-C841 PolarHBondContact O-N 3.07Å; E839-I842 PolarHBondContact O-N 3.31Å; E839-I842 VanDerWaalsContact O-N 3.15Å; E839-E843 PolarHBondContact O-N 3.13Å; E839-L898 HydrophobicContact CG-CD1 4.15Å; E839-L898 HydrophobicContact CG-CD2 3.62Å
840	L	87.9	Confident	86.5	Confident	28 Å²	28	44.8 Å²	44.8	15%	0.147	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-36	177	-72.6	172.3	0	0	0	112.8	L813 Y816 A817 R836 L837 V844	L813-L840 HydrophobicContact CD1-CB 4.05Å; L813-L840 HydrophobicContact CD2-CB 4.14Å; L813-L840 HydrophobicContact CG-CB 4.31Å; Y816-L840 HydrophobicContact CE1-CD2 4.38Å; A817-L840 HydrophobicContact CB-CD1 3.98Å; R836-L840 HydrophobicContact CG-CD1 4.5Å; R836-L840 WeakPolarHBondContact O-CB 3.41Å; R836-L840 VanDerWaalsContact O-CG 3.32Å; R836-L840 WeakPolarHBondContact O-CG 3.46Å; R836-L840 PolarHBondContact O-N 3.46Å; L837-L840 PolarHBondContact O-N 2.92Å; L840-V844 WeakPolarHBondContact O-CB 3.49Å; L840-V844 VanDerWaalsContact O-CG2 3.29Å; L840-V844 WeakPolarHBondContact O-CG2 3.44Å; L840-V844 PolarHBondContact O-N 2.84Å
841	C	90.6	Very high	86.6	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-44.7	173.9	-76.6	0	0	0	0	111.3	L813 L837 G838 E839 V844 L845 F870 Y874	L813-C841 HydrophobicContact CD2-CB 4.43Å; L813-C841 VanDerWaalsContact CD2-SG 3.6Å; L837-C841 VanDerWaalsContact O-CB 3.3Å; L837-C841 WeakPolarHBondContact O-CB 3.43Å; L837-C841 PolarHBondContact O-N 3.48Å; L837-C841 PolarHBondContact O-SG 3.38Å; G838-C841 WeakPolarHBondContact O-CB 3.45Å; G838-C841 PolarHBondContact O-N 3.46Å; E839-C841 VanDerWaalsContact C-N 3.31Å; E839-C841 PolarHBondContact O-N 3.07Å; C841-V844 PolarHBondContact O-N 3.25Å; C841-L845 WeakPolarHBondContact O-CG 3.4Å; C841-L845 PolarHBondContact O-N 2.95Å; C841-F870 HydrophobicContact CB-CE1 3.81Å; C841-Y874 HydrophobicContact CB-CD2 4.41Å; C841-Y874 VanDerWaalsContact SG-CD2 3.52Å
842	I	89.8	Confident	86.7	Confident	16 Å²	16	43.3 Å²	43.3	8%	0.082	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-45	176.5	-69.2	164.6	0	0	0	110.6	G838 E839 V844 L845 Q846 L898 L899 F902	G838-I842 VanDerWaalsContact O-CG1 3.31Å; G838-I842 WeakPolarHBondContact O-CG1 3.33Å; G838-I842 PolarHBondContact O-N 3.11Å; E839-I842 PolarHBondContact O-N 3.31Å; E839-I842 VanDerWaalsContact O-N 3.15Å; I842-V844 VanDerWaalsContact C-N 3.33Å; I842-V844 PolarHBondContact O-N 2.81Å; I842-L845 PolarHBondContact O-N 3.32Å; I842-Q846 HydrophobicContact CG2-CG 4.42Å; I842-Q846 VanDerWaalsContact CG2-NE2 3.29Å; I842-Q846 WeakPolarHBondContact O-CB 3.32Å; I842-Q846 WeakPolarHBondContact O-CG 3.48Å; I842-Q846 PolarHBondContact O-N 3.4Å; I842-L898 HydrophobicContact CD1-CD1 3.72Å; I842-L898 HydrophobicContact CD1-CD2 4.44Å; I842-L898 HydrophobicContact CD1-CG 3.73Å; I842-L899 HydrophobicContact CD1-CD2 4.44Å; I842-F902 HydrophobicContact CB-CG 4.5Å; I842-F902 HydrophobicContact CD1-CB 3.87Å; I842-F902 HydrophobicContact CD1-CD1 4.46Å; I842-F902 HydrophobicContact CD1-CG 4.22Å; I842-F902 HydrophobicContact CG1-CB 4.08Å; I842-F902 HydrophobicContact CG1-CD1 3.83Å; I842-F902 HydrophobicContact CG1-CD2 4.45Å; I842-F902 HydrophobicContact CG1-CE1 4.4Å; I842-F902 HydrophobicContact CG1-CG 3.86Å; I842-F902 HydrophobicContact CG2-CB 4.37Å; I842-F902 HydrophobicContact CG2-CD2 3.71Å; I842-F902 HydrophobicContact CG2-CE2 4.11Å; I842-F902 HydrophobicContact CG2-CG 3.95Å
843	E	86.2	Confident	86.6	Confident	113 Å²	113	38.9 Å²	38.9	53%	0.528	19%	0.186	S	C	.	.	H	α-helix	trans	-59.4	-42.2	174.4	-72.4	-164.3	161	0	0	112.3	E839 Q847	E839-E843 PolarHBondContact O-N 3.13Å; E843-Q847 WeakPolarHBondContact O-CB 3.04Å; E843-Q847 VanDerWaalsContact O-CG 3.31Å; E843-Q847 WeakPolarHBondContact O-CG 3.49Å; E843-Q847 PolarHBondContact O-N 2.99Å
844	V	88.4	Confident	86.5	Confident	9 Å²	9	43.5 Å²	43.5	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-44.3	177.9	160.2	0	0	0	0	111.6	L813 L840 C841 I842 N848 F870	L813-V844 HydrophobicContact CD1-CG2 3.72Å; L813-V844 HydrophobicContact CD2-CG2 4.03Å; L813-V844 HydrophobicContact CG-CG2 4.46Å; L840-V844 WeakPolarHBondContact O-CB 3.49Å; L840-V844 VanDerWaalsContact O-CG2 3.29Å; L840-V844 WeakPolarHBondContact O-CG2 3.44Å; L840-V844 PolarHBondContact O-N 2.84Å; C841-V844 PolarHBondContact O-N 3.25Å; I842-V844 VanDerWaalsContact C-N 3.33Å; I842-V844 PolarHBondContact O-N 2.81Å; V844-N848 PolarHBondContact O-N 3.17Å; V844-N848 VanDerWaalsContact O-N 3.1Å; V844-N848 PolarHBondContact O-ND2 3.2Å; V844-N848 PolarHBondContact O-OD1 2.91Å; V844-F870 HydrophobicContact CB-CZ 4.4Å; V844-F870 HydrophobicContact CG1-CE1 4.46Å; V844-F870 HydrophobicContact CG1-CE2 4.14Å; V844-F870 HydrophobicContact CG1-CZ 3.83Å
845	L	89.1	Confident	86.2	Confident	13 Å²	13	43.7 Å²	43.7	7%	0.068	21%	0.21	C	C	.	.	H	α-helix	trans	-67.9	-44.2	178.4	-68.3	176.5	0	0	0	111.5	C841 I842 Q847 N848 E849 A867 F870 L871 F902	C841-L845 WeakPolarHBondContact O-CG 3.4Å; C841-L845 PolarHBondContact O-N 2.95Å; I842-L845 PolarHBondContact O-N 3.32Å; L845-Q847 PolarHBondContact O-N 2.92Å; L845-N848 WeakPolarHBondContact O-CB 3.46Å; L845-N848 PolarHBondContact O-N 2.97Å; L845-N848 VanDerWaalsContact O-N 3.08Å; L845-E849 PolarHBondContact O-N 2.92Å; L845-A867 HydrophobicContact CD1-CB 4.42Å; L845-A867 HydrophobicContact CD2-CB 3.84Å; L845-F870 HydrophobicContact CD1-CD1 4.2Å; L845-F870 HydrophobicContact CD2-CB 4.43Å; L845-F870 HydrophobicContact CD2-CD1 3.91Å; L845-F870 HydrophobicContact CD2-CE1 4.44Å; L845-F870 HydrophobicContact CD2-CG 4.26Å; L845-F870 HydrophobicContact CG-CD1 4.11Å; L845-F870 HydrophobicContact CG-CE1 4.3Å; L845-L871 HydrophobicContact CD1-CD1 4.26Å; L845-L871 HydrophobicContact CD1-CD2 4.09Å; L845-L871 HydrophobicContact CD1-CG 4.06Å; L845-F902 HydrophobicContact CB-CZ 4.08Å; L845-F902 HydrophobicContact CD1-CE1 3.94Å; L845-F902 HydrophobicContact CD1-CZ 4.25Å
846	Q	86.3	Confident	86.1	Confident	57 Å²	57	41.6 Å²	41.6	27%	0.266	20%	0.199	S	C	.	.	H	α-helix	trans	-62.5	-41.6	175.5	-71	-171.1	38.5	0	0	112.5	I842 N848 E849 E850 F902	I842-Q846 HydrophobicContact CG2-CG 4.42Å; I842-Q846 VanDerWaalsContact CG2-NE2 3.29Å; I842-Q846 WeakPolarHBondContact O-CB 3.32Å; I842-Q846 WeakPolarHBondContact O-CG 3.48Å; I842-Q846 PolarHBondContact O-N 3.4Å; Q846-N848 VanDerWaalsContact C-N 3.25Å; Q846-N848 PolarHBondContact O-N 3.32Å; Q846-E849 PolarHBondContact O-N 2.86Å; Q846-E850 WeakPolarHBondContact O-CB 3.42Å; Q846-E850 WeakPolarHBondContact O-CG 3.47Å; Q846-E850 PolarHBondContact O-N 3.17Å; Q846-F902 HydrophobicContact CG-CE2 3.91Å
847	Q	83.5	Confident	85.8	Confident	46 Å²	46	39.2 Å²	39.2	22%	0.215	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-33.2	173	-76.9	177.7	34.5	0	0	112.5	E843 L845 H851	E843-Q847 WeakPolarHBondContact O-CB 3.04Å; E843-Q847 VanDerWaalsContact O-CG 3.31Å; E843-Q847 WeakPolarHBondContact O-CG 3.49Å; E843-Q847 PolarHBondContact O-N 2.99Å; L845-Q847 PolarHBondContact O-N 2.92Å; Q847-H851 WeakPolarHBondContact O-CB 3.44Å; Q847-H851 PolarHBondContact O-CD2 3.12Å; Q847-H851 PolarHBondContact O-N 2.89Å
848	N	87.8	Confident	85.2	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.011	23%	0.226	C	C	.	.	H	α-helix	trans	-70.2	-41.6	176.9	-66.6	-18.3	0	0	0	110.9	R758 V844 L845 Q846 H852 S853 M863 H866	R758-N848 VanDerWaalsContact CD-OD1 3.31Å; R758-N848 WeakPolarHBondContact CD-OD1 3.3Å; R758-N848 PolarHBondContact NE-OD1 3.48Å; V844-N848 PolarHBondContact O-N 3.17Å; V844-N848 VanDerWaalsContact O-N 3.1Å; V844-N848 PolarHBondContact O-ND2 3.2Å; V844-N848 PolarHBondContact O-OD1 2.91Å; L845-N848 WeakPolarHBondContact O-CB 3.46Å; L845-N848 PolarHBondContact O-N 2.97Å; L845-N848 VanDerWaalsContact O-N 3.08Å; Q846-N848 VanDerWaalsContact C-N 3.25Å; Q846-N848 PolarHBondContact O-N 3.32Å; N848-H852 WeakPolarHBondContact O-CA 3.46Å; N848-H852 WeakPolarHBondContact O-CB 3.4Å; N848-H852 PolarHBondContact O-N 2.86Å; N848-S853 PolarHBondContact O-N 3.28Å; N848-M863 HydrophobicContact CB-CE 4.02Å; N848-H866 PolarHBondContact ND2-CE1 3.34Å
849	E	83.4	Confident	84.9	Confident	97 Å²	97	47.9 Å²	47.9	45%	0.453	23%	0.233	S	C	.	.	H	α-helix	trans	-61.8	-53.8	172.7	-165.4	-168	-176.4	0	0	111.2	L845 Q846 H851 S853	L845-E849 PolarHBondContact O-N 2.92Å; Q846-E849 PolarHBondContact O-N 2.86Å; E849-H851 VanDerWaalsContact C-N 3.28Å; E849-H851 PolarHBondContact O-N 3.29Å; E849-S853 WeakPolarHBondContact O-CB 3.46Å; E849-S853 PolarHBondContact O-N 3.46Å; E849-S853 PolarHBondContact O-OG 3.38Å
850	E	81.5	Confident	84.5	Confident	63 Å²	63	46.4 Å²	46.4	29%	0.294	23%	0.231	S	C	.	.	H	α-helix	trans	-59.9	-30.7	-176.8	-77.7	-172.5	-177.6	0	0	114.7	R182 Q846	R182-E850 WeakPolarHBondContact CD-OE1 3.44Å; R182-E850 IonicContact CZ-OE1 2.71Å; R182-E850 IonicContact NE-OE1 3.16Å; R182-E850 PolarHBondContact NE-OE1 3Å; R182-E850 IonicContact NH1-OE1 2.78Å; R182-E850 PolarHBondContact NH1-OE1 3.15Å; Q846-E850 WeakPolarHBondContact O-CB 3.42Å; Q846-E850 WeakPolarHBondContact O-CG 3.47Å; Q846-E850 PolarHBondContact O-N 3.17Å
851	H	81.9	Confident	84.3	Confident	26 Å²	26	50.1 Å²	50.1	12%	0.12	25%	0.248	C	C	.	.	H	α-helix	trans	-114.7	-16.7	-169.3	-58.6	-16.8	0	0	0	114.4	F763 G764 Q847 E849	F763-H851 AromaticContact CD1-CD2 3.73Å; F763-H851 AromaticContact CD1-NE2 3.58Å; G764-H851 WeakPolarHBondContact CA-O 3.18Å; Q847-H851 WeakPolarHBondContact O-CB 3.44Å; Q847-H851 PolarHBondContact O-CD2 3.12Å; Q847-H851 PolarHBondContact O-N 2.89Å; E849-H851 VanDerWaalsContact C-N 3.28Å; E849-H851 PolarHBondContact O-N 3.29Å
852	H	86.1	Confident	84.1	Confident	4 Å²	4	50 Å²	50	2%	0.019	25%	0.247	C	C	.	.	H	α-helix	trans	-130.5	-17.4	-173.2	-56.9	-85.3	0	0	0	115	F757 F761 L770 N848 E854 A855 F856	F757-H852 HydrophobicContact CD2-CB 4.35Å; F757-H852 AromaticContact CD2-CD2 3.89Å; F757-H852 AromaticContact CD2-CE1 3.69Å; F757-H852 AromaticContact CD2-CG 3.71Å; F757-H852 AromaticContact CD2-ND1 3.6Å; F757-H852 AromaticContact CD2-NE2 3.87Å; F757-H852 HydrophobicContact CE2-CB 4.21Å; F757-H852 AromaticContact CE2-CD2 3.74Å; F757-H852 AromaticContact CE2-CG 3.8Å; F761-H852 PolarHBondContact O-CE1 3.03Å; L770-H852 HydrophobicContact CD2-CB 4.13Å; N848-H852 WeakPolarHBondContact O-CA 3.46Å; N848-H852 WeakPolarHBondContact O-CB 3.4Å; N848-H852 PolarHBondContact O-N 2.86Å; H852-E854 VanDerWaalsContact C-N 3.28Å; H852-E854 PolarHBondContact O-N 3.27Å; H852-A855 WeakPolarHBondContact O-CB 3.34Å; H852-A855 PolarHBondContact O-N 3.11Å; H852-F856 HydrophobicContact CB-CE2 4.47Å; H852-F856 WeakPolarHBondContact O-CD2 3.35Å
853	S	82	Confident	84	Confident	48 Å²	48	50.6 Å²	50.6	34%	0.336	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-55.3	-39.2	179.7	61.2	0	0	0	0	113.6	N848 E849 A855 F856 S857	N848-S853 PolarHBondContact O-N 3.28Å; E849-S853 WeakPolarHBondContact O-CB 3.46Å; E849-S853 PolarHBondContact O-N 3.46Å; E849-S853 PolarHBondContact O-OG 3.38Å; S853-A855 PolarHBondContact O-N 3.24Å; S853-A855 VanDerWaalsContact O-N 3.12Å; S853-F856 CarbonylContact O-C 3.58Å; S853-F856 PolarHBondContact O-N 3.4Å; S853-S857 PolarHBondContact O-N 2.89Å
854	E	83.6	Confident	84	Confident	121 Å²	121	46.1 Å²	46.1	57%	0.565	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-55.2	-31.3	177.9	-61.5	-176.9	125.2	0	0	112.7	K178 H852 S857	K178-E854 IonicContact NZ-OE2 3.45Å; K178-E854 PolarHBondContact NZ-OE2 3.14Å; H852-E854 VanDerWaalsContact C-N 3.28Å; H852-E854 PolarHBondContact O-N 3.27Å; E854-S857 WeakPolarHBondContact O-CB 3.43Å; E854-S857 PolarHBondContact O-OG 3.38Å
855	A	82.2	Confident	84	Confident	11 Å²	11	48.9 Å²	48.9	9%	0.091	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-75.6	-30.8	177.5	0	0	0	0	0	113	L770 K771 L774 H852 S853	L770-A855 HydrophobicContact CB-CB 4.03Å; L770-A855 HydrophobicContact CD2-CB 3.93Å; L770-A855 HydrophobicContact CG-CB 3.81Å; K771-A855 HydrophobicContact CB-CB 4.13Å; L774-A855 HydrophobicContact CD1-CB 4.42Å; H852-A855 WeakPolarHBondContact O-CB 3.34Å; H852-A855 PolarHBondContact O-N 3.11Å; S853-A855 PolarHBondContact O-N 3.24Å; S853-A855 VanDerWaalsContact O-N 3.12Å
856	F	84.3	Confident	84.1	Confident	3 Å²	3	48.3 Å²	48.3	1%	0.013	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-94.2	13.6	177.7	-60.8	-78.1	0	0	0	113.2	L770 L774 V798 L802 H852 S853 W858 W859 M863	L770-F856 HydrophobicContact CD2-CE2 3.87Å; L770-F856 HydrophobicContact CD2-CZ 4.21Å; L774-F856 HydrophobicContact CD1-CD1 3.94Å; L774-F856 HydrophobicContact CD1-CE1 3.76Å; L774-F856 HydrophobicContact CD1-CZ 4.31Å; L774-F856 HydrophobicContact CD2-CE1 4.19Å; V798-F856 HydrophobicContact CG1-CD1 4.49Å; V798-F856 HydrophobicContact CG1-CE1 3.87Å; L802-F856 HydrophobicContact CD1-CE1 4.11Å; L802-F856 HydrophobicContact CD1-CZ 4.48Å; L802-F856 HydrophobicContact CD2-CE1 4.49Å; L802-F856 HydrophobicContact CD2-CZ 4.08Å; H852-F856 HydrophobicContact CB-CE2 4.47Å; H852-F856 WeakPolarHBondContact O-CD2 3.35Å; S853-F856 CarbonylContact O-C 3.58Å; S853-F856 PolarHBondContact O-N 3.4Å; F856-W858 PolarHBondContact O-N 3.48Å; F856-W859 CarbonylContact O-C 3.6Å; F856-W859 PolarHBondContact O-N 3.32Å; F856-M863 HydrophobicContact CB-CG 3.82Å; F856-M863 HydrophobicContact CD2-CG 3.69Å; F856-M863 HydrophobicContact CD2-SD 3.38Å; F856-M863 WeakPolarHBondContact CD2-SD 3.47Å; F856-M863 HydrophobicContact CE2-CG 4.49Å; F856-M863 HydrophobicContact CE2-SD 3.61Å; F856-M863 HydrophobicContact CG-CG 3.88Å; F856-M863 HydrophobicContact CG-SD 4.05Å; F856-M863 HydrophobicContact CZ-SD 4.43Å
857	S	81.2	Confident	84.3	Confident	64 Å²	64	46 Å²	46	45%	0.448	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-14.5	-179	44.5	0	0	0	0	116	K771 S853 E854	K771-S857 PolarHBondContact NZ-OG 3.26Å; S853-S857 PolarHBondContact O-N 2.89Å; E854-S857 WeakPolarHBondContact O-CB 3.43Å; E854-S857 PolarHBondContact O-OG 3.38Å
858	W	76.3	Confident	84.7	Confident	146 Å²	146	45.2 Å²	45.2	55%	0.553	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-18.7	173	-58.8	-33.7	0	0	0	114.1	K771 F856	K771-W858 VanDerWaalsContact CE-CZ2 3.49Å; F856-W858 PolarHBondContact O-N 3.48Å
859	W	82.5	Confident	84.8	Confident	38 Å²	38	47.1 Å²	47.1	14%	0.144	24%	0.242	C	C	.	.			trans	-142.7	66.3	178.6	-58.6	-50.8	0	0	0	110.5	S791 T794 K795 V798 F856 E861 L862	S791-W859 WeakPolarHBondContact OG-CZ2 3.44Å; T794-W859 HydrophobicContact CG2-CH2 3.8Å; T794-W859 HydrophobicContact CG2-CZ3 4.45Å; K795-W859 HydrophobicContact CB-CZ2 4.11Å; K795-W859 HydrophobicContact CG-CD2 4.26Å; K795-W859 HydrophobicContact CG-CG 4.39Å; V798-W859 HydrophobicContact CG2-CZ3 4.27Å; F856-W859 CarbonylContact O-C 3.6Å; F856-W859 PolarHBondContact O-N 3.32Å; W859-E861 PolarHBondContact O-N 3.36Å; W859-E861 VanDerWaalsContact O-N 3.13Å; W859-L862 HydrophobicContact CB-CD1 3.72Å; W859-L862 HydrophobicContact CB-CG 3.88Å; W859-L862 HydrophobicContact CD2-CD1 4.05Å; W859-L862 HydrophobicContact CE3-CD1 3.67Å; W859-L862 HydrophobicContact CG-CD1 4.14Å; W859-L862 WeakPolarHBondContact O-CB 3.47Å; W859-L862 PolarHBondContact O-N 3.23Å
860	P	79.4	Confident	85.2	Confident	67 Å²	67	42.5 Å²	42.5	44%	0.435	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.1	-177.4	23.6	-34.1	0	0	0	112.9	L862 M863 A864	P860-L862 PolarHBondContact O-N 3.14Å; P860-M863 PolarHBondContact O-N 3.38Å; P860-M863 VanDerWaalsContact O-N 3.09Å; P860-A864 PolarHBondContact O-N 2.86Å
861	E	84.1	Confident	85.7	Confident	106 Å²	106	39.6 Å²	39.6	50%	0.495	21%	0.207	S	C	.	.	H	α-helix	trans	-46.8	-40.3	171.2	-59.9	170.3	164.9	0	0	113.1	K795 W859 M863 A864 E865	K795-E861 IonicContact NZ-OE2 2.72Å; K795-E861 PolarHBondContact NZ-OE2 3.3Å; W859-E861 PolarHBondContact O-N 3.36Å; W859-E861 VanDerWaalsContact O-N 3.13Å; E861-M863 VanDerWaalsContact C-N 3.29Å; E861-M863 PolarHBondContact O-N 2.97Å; E861-A864 WeakPolarHBondContact O-CB 3.45Å; E861-A864 PolarHBondContact O-N 2.94Å; E861-A864 VanDerWaalsContact O-N 3.12Å; E861-E865 WeakPolarHBondContact O-CG 3.38Å; E861-E865 PolarHBondContact O-N 2.69Å
862	L	87.1	Confident	86.2	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.1	-27.8	-176.6	-68.4	-179.7	0	0	0	113.3	K795 V798 Q799 L802 W859 P860 H866	K795-L862 HydrophobicContact CG-CD1 4.11Å; K795-L862 HydrophobicContact CG-CD2 4.11Å; K795-L862 HydrophobicContact CG-CG 4.39Å; V798-L862 HydrophobicContact CB-CD1 4.25Å; V798-L862 HydrophobicContact CG1-CD1 3.86Å; Q799-L862 HydrophobicContact CB-CD2 3.89Å; Q799-L862 HydrophobicContact CG-CD2 4.31Å; L802-L862 HydrophobicContact CD1-CB 3.81Å; W859-L862 HydrophobicContact CB-CD1 3.72Å; W859-L862 HydrophobicContact CB-CG 3.88Å; W859-L862 HydrophobicContact CD2-CD1 4.05Å; W859-L862 HydrophobicContact CE3-CD1 3.67Å; W859-L862 HydrophobicContact CG-CD1 4.14Å; W859-L862 WeakPolarHBondContact O-CB 3.47Å; W859-L862 PolarHBondContact O-N 3.23Å; P860-L862 PolarHBondContact O-N 3.14Å; L862-H866 WeakPolarHBondContact O-CB 3.45Å; L862-H866 PolarHBondContact O-N 3.43Å
863	M	87.5	Confident	86.4	Confident	27 Å²	27	44.1 Å²	44.1	13%	0.133	24%	0.238	C	C	.	.	H	α-helix	trans	-76.9	-32.7	174.1	-74.5	-60.9	-60.3	0	0	111.6	N848 F856 P860 E861 H866 A867	N848-M863 HydrophobicContact CB-CE 4.02Å; F856-M863 HydrophobicContact CB-CG 3.82Å; F856-M863 HydrophobicContact CD2-CG 3.69Å; F856-M863 HydrophobicContact CD2-SD 3.38Å; F856-M863 WeakPolarHBondContact CD2-SD 3.47Å; F856-M863 HydrophobicContact CE2-CG 4.49Å; F856-M863 HydrophobicContact CE2-SD 3.61Å; F856-M863 HydrophobicContact CG-CG 3.88Å; F856-M863 HydrophobicContact CG-SD 4.05Å; F856-M863 HydrophobicContact CZ-SD 4.43Å; P860-M863 PolarHBondContact O-N 3.38Å; P860-M863 VanDerWaalsContact O-N 3.09Å; E861-M863 VanDerWaalsContact C-N 3.29Å; E861-M863 PolarHBondContact O-N 2.97Å; M863-H866 PolarHBondContact O-N 3.5Å; M863-A867 WeakPolarHBondContact O-CB 3.46Å; M863-A867 PolarHBondContact O-N 2.94Å
864	A	86.6	Confident	86.8	Confident	20 Å²	20	41.9 Å²	41.9	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-69.4	-41.3	171	0	0	0	0	0	111.4	P860 E861 H866 A867 E868 H908	P860-A864 PolarHBondContact O-N 2.86Å; E861-A864 WeakPolarHBondContact O-CB 3.45Å; E861-A864 PolarHBondContact O-N 2.94Å; E861-A864 VanDerWaalsContact O-N 3.12Å; A864-H866 VanDerWaalsContact C-N 3.35Å; A864-H866 PolarHBondContact O-N 2.91Å; A864-A867 PolarHBondContact O-N 2.91Å; A864-E868 PolarHBondContact O-N 3.26Å; A864-H908 HydrophobicContact CB-CB 3.79Å
865	E	88.1	Confident	87.2	Confident	66 Å²	66	40.2 Å²	40.2	31%	0.308	21%	0.21	S	C	.	.	H	α-helix	trans	-61.9	-39.4	172.5	-71.7	176.6	-167.4	0	0	112.2	Q799 E861 S869	Q799-E865 PolarHBondContact NE2-OE2 3.09Å; E861-E865 WeakPolarHBondContact O-CG 3.38Å; E861-E865 PolarHBondContact O-N 2.69Å; E865-S869 VanDerWaalsContact O-CB 3.23Å; E865-S869 WeakPolarHBondContact O-CB 3.34Å; E865-S869 PolarHBondContact O-N 3.5Å; E865-S869 PolarHBondContact O-OG 3.37Å
866	H	91	Very high	87.5	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-46.7	171.7	176.6	-91.5	0	0	0	111.7	L802 A805 S806 N809 N848 L862 M863 A864 S869 F870	L802-H866 HydrophobicContact CB-CB 4.32Å; L802-H866 PolarHBondContact O-CD2 3.05Å; A805-H866 VanDerWaalsContact CB-NE2 3.35Å; A805-H866 WeakPolarHBondContact CB-NE2 3.29Å; A805-H866 PolarHBondContact O-NE2 3.12Å; S806-H866 WeakPolarHBondContact CA-NE2 3.46Å; S806-H866 PolarHBondContact N-NE2 3.23Å; N809-H866 PolarHBondContact ND2-CE1 3.22Å; N809-H866 PolarHBondContact ND2-NE2 3.24Å; N848-H866 PolarHBondContact ND2-CE1 3.34Å; L862-H866 WeakPolarHBondContact O-CB 3.45Å; L862-H866 PolarHBondContact O-N 3.43Å; M863-H866 PolarHBondContact O-N 3.5Å; A864-H866 VanDerWaalsContact C-N 3.35Å; A864-H866 PolarHBondContact O-N 2.91Å; H866-S869 PolarHBondContact O-N 3.11Å; H866-F870 WeakPolarHBondContact O-CB 3.12Å; H866-F870 PolarHBondContact O-N 2.93Å
867	A	90.7	Very high	87.6	Confident	8 Å²	8	44.9 Å²	44.9	7%	0.066	24%	0.242	C	C	.	.	H	α-helix	trans	-68.2	-45.2	-179	0	0	0	0	0	112.8	L845 M863 A864 S869 F870 L871 L909	L845-A867 HydrophobicContact CD1-CB 4.42Å; L845-A867 HydrophobicContact CD2-CB 3.84Å; M863-A867 WeakPolarHBondContact O-CB 3.46Å; M863-A867 PolarHBondContact O-N 2.94Å; A864-A867 PolarHBondContact O-N 2.91Å; A867-S869 VanDerWaalsContact C-N 3.33Å; A867-S869 PolarHBondContact O-N 2.86Å; A867-F870 WeakPolarHBondContact O-CB 3.25Å; A867-F870 PolarHBondContact O-N 3.44Å; A867-L871 WeakPolarHBondContact O-CB 2.97Å; A867-L871 VanDerWaalsContact O-CG 3.27Å; A867-L871 WeakPolarHBondContact O-CG 3.29Å; A867-L871 PolarHBondContact O-N 2.93Å; A867-L909 HydrophobicContact CB-CD1 4.05Å; A867-L909 HydrophobicContact CB-CD2 4.02Å
868	E	90.6	Very high	88	Confident	29 Å²	29	41.8 Å²	41.8	14%	0.136	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-39.7	172.1	-79.1	-73.7	165.6	0	0	111.4	A864 F870 L871 S872 L909 G912 P913 F914	A864-E868 PolarHBondContact O-N 3.26Å; E868-F870 VanDerWaalsContact C-N 3.32Å; E868-F870 PolarHBondContact O-N 3.38Å; E868-L871 PolarHBondContact O-N 2.85Å; E868-S872 VanDerWaalsContact O-CB 3.28Å; E868-S872 WeakPolarHBondContact O-CB 3.38Å; E868-S872 PolarHBondContact O-N 3Å; E868-L909 HydrophobicContact CG-CD2 3.83Å; E868-G912 WeakPolarHBondContact OE1-CA 3.23Å; E868-P913 VanDerWaalsContact CD-CD 3.5Å; E868-P913 WeakPolarHBondContact OE1-CD 3.34Å; E868-F914 WeakPolarHBondContact OE2-CB 3.48Å; E868-F914 PolarHBondContact OE2-N 3.05Å
869	S	91.1	Very high	88.7	Confident	42 Å²	42	36.1 Å²	36.1	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-63.5	-38.2	175	-60.6	0	0	0	0	112.3	E865 H866 A867	E865-S869 VanDerWaalsContact O-CB 3.23Å; E865-S869 WeakPolarHBondContact O-CB 3.34Å; E865-S869 PolarHBondContact O-N 3.5Å; E865-S869 PolarHBondContact O-OG 3.37Å; H866-S869 PolarHBondContact O-N 3.11Å; A867-S869 VanDerWaalsContact C-N 3.33Å; A867-S869 PolarHBondContact O-N 2.86Å
870	F	92.1	Very high	88.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70.1	-45.2	176.4	-178.4	-90.5	0	0	0	111.6	N809 Y810 L813 C841 V844 L845 H866 A867 E868 S872 L873 Y874	N809-F870 HydrophobicContact CB-CD2 4.24Å; N809-F870 HydrophobicContact CB-CE2 3.94Å; Y810-F870 HydrophobicContact CD2-CD2 4.45Å; Y810-F870 HydrophobicContact CD2-CE1 4.39Å; Y810-F870 HydrophobicContact CD2-CE2 4.01Å; Y810-F870 AromaticContact CD2-CZ 3.97Å; Y810-F870 HydrophobicContact CD2-CZ 3.97Å; Y810-F870 HydrophobicContact CG-CE2 4.45Å; L813-F870 HydrophobicContact CD2-CZ 3.95Å; C841-F870 HydrophobicContact CB-CE1 3.81Å; V844-F870 HydrophobicContact CB-CZ 4.4Å; V844-F870 HydrophobicContact CG1-CE1 4.46Å; V844-F870 HydrophobicContact CG1-CE2 4.14Å; V844-F870 HydrophobicContact CG1-CZ 3.83Å; L845-F870 HydrophobicContact CD1-CD1 4.2Å; L845-F870 HydrophobicContact CD2-CB 4.43Å; L845-F870 HydrophobicContact CD2-CD1 3.91Å; L845-F870 HydrophobicContact CD2-CE1 4.44Å; L845-F870 HydrophobicContact CD2-CG 4.26Å; L845-F870 HydrophobicContact CG-CD1 4.11Å; L845-F870 HydrophobicContact CG-CE1 4.3Å; H866-F870 WeakPolarHBondContact O-CB 3.12Å; H866-F870 PolarHBondContact O-N 2.93Å; A867-F870 WeakPolarHBondContact O-CB 3.25Å; A867-F870 PolarHBondContact O-N 3.44Å; E868-F870 VanDerWaalsContact C-N 3.32Å; E868-F870 PolarHBondContact O-N 3.38Å; F870-S872 VanDerWaalsContact C-N 3.27Å; F870-S872 PolarHBondContact O-N 3.36Å; F870-L873 WeakPolarHBondContact O-CB 3.27Å; F870-L873 PolarHBondContact O-N 3.43Å; F870-L873 VanDerWaalsContact O-N 3.12Å; F870-Y874 PolarHBondContact O-N 2.98Å
871	L	91.9	Very high	89.2	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-28.3	175.3	-69.6	168.5	0	0	0	112.3	L845 A867 E868 L873 Y874 R875 L903 L909 F914	L845-L871 HydrophobicContact CD1-CD1 4.26Å; L845-L871 HydrophobicContact CD1-CD2 4.09Å; L845-L871 HydrophobicContact CD1-CG 4.06Å; A867-L871 WeakPolarHBondContact O-CB 2.97Å; A867-L871 VanDerWaalsContact O-CG 3.27Å; A867-L871 WeakPolarHBondContact O-CG 3.29Å; A867-L871 PolarHBondContact O-N 2.93Å; E868-L871 PolarHBondContact O-N 2.85Å; L871-L873 VanDerWaalsContact C-N 3.27Å; L871-L873 PolarHBondContact O-N 2.75Å; L871-Y874 PolarHBondContact O-N 2.89Å; L871-R875 VanDerWaalsContact O-CB 3.32Å; L871-R875 WeakPolarHBondContact O-CB 3.39Å; L871-R875 PolarHBondContact O-N 3.25Å; L871-L903 HydrophobicContact CD1-CD2 3.87Å; L871-L909 HydrophobicContact CD1-CD1 4.33Å; L871-F914 HydrophobicContact CB-CB 4.05Å; L871-F914 HydrophobicContact CB-CD1 4.06Å; L871-F914 HydrophobicContact CB-CD2 3.89Å; L871-F914 HydrophobicContact CB-CE2 4.37Å; L871-F914 HydrophobicContact CB-CG 3.72Å; L871-F914 HydrophobicContact CD1-CB 4.49Å; L871-F914 HydrophobicContact CD1-CD1 4.01Å; L871-F914 HydrophobicContact CD1-CG 4.34Å; L871-F914 HydrophobicContact CD2-CD1 4.28Å; L871-F914 HydrophobicContact CD2-CE1 4.12Å; L871-F914 HydrophobicContact CD2-CZ 4.44Å; L871-F914 HydrophobicContact CG-CD1 4.35Å; L871-F914 HydrophobicContact CG-CG 4.49Å; L871-F914 WeakPolarHBondContact O-CD2 3.46Å; L871-F914 WeakPolarHBondContact O-CE2 3.35Å
872	S	91.6	Very high	89.3	Confident	70 Å²	70	31.3 Å²	31.3	49%	0.49	18%	0.184	S	C	.	.	H	α-helix	trans	-69.7	-21.1	173.1	-170.9	0	0	0	0	113.6	E868 F870	E868-S872 VanDerWaalsContact O-CB 3.28Å; E868-S872 WeakPolarHBondContact O-CB 3.38Å; E868-S872 PolarHBondContact O-N 3Å; F870-S872 VanDerWaalsContact C-N 3.27Å; F870-S872 PolarHBondContact O-N 3.36Å
873	L	90.6	Very high	89.2	Confident	55 Å²	55	39 Å²	39	29%	0.288	22%	0.22	S	C	.	.	H	α-helix	trans	-78	-52.6	169.8	-61.1	168.4	0	0	0	109.3	Q807 Y810 F870 L871 R875 A876	Q807-L873 HydrophobicContact CB-CD1 4.41Å; Q807-L873 HydrophobicContact CG-CD1 4.08Å; Y810-L873 HydrophobicContact CD1-CB 3.68Å; Y810-L873 HydrophobicContact CD1-CD1 4.2Å; Y810-L873 HydrophobicContact CD2-CB 4.29Å; Y810-L873 HydrophobicContact CE1-CB 3.97Å; Y810-L873 HydrophobicContact CG-CB 3.86Å; Y810-L873 HydrophobicContact CG-CD1 4.04Å; F870-L873 WeakPolarHBondContact O-CB 3.27Å; F870-L873 PolarHBondContact O-N 3.43Å; F870-L873 VanDerWaalsContact O-N 3.12Å; L871-L873 VanDerWaalsContact C-N 3.27Å; L871-L873 PolarHBondContact O-N 2.75Å; L873-R875 PolarHBondContact O-N 3.07Å; L873-R875 VanDerWaalsContact O-N 3.13Å; L873-A876 WeakPolarHBondContact O-CB 3.45Å; L873-A876 PolarHBondContact O-N 3.34Å
874	Y	91.2	Very high	89	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-50.4	-38.2	173.5	178.2	-90.8	0	0	0	113.1	Y810 M834 L837 G838 C841 F870 L871 A876 D877 M878 L895 L899 F914	Y810-Y874 HydrophobicContact CE2-CD2 4.34Å; Y810-Y874 WeakPolarHBondContact OH-CA 3.37Å; M834-Y874 HydrophobicContact CE-CD1 4.32Å; M834-Y874 HydrophobicContact CE-CD2 3.63Å; M834-Y874 HydrophobicContact CE-CE1 3.99Å; M834-Y874 HydrophobicContact CE-CE2 3.24Å; M834-Y874 HydrophobicContact CE-CG 4.15Å; M834-Y874 VanDerWaalsContact CE-CZ 3.43Å; M834-Y874 PolarHBondContact O-OH 2.75Å; L837-Y874 HydrophobicContact CB-CE2 4.27Å; L837-Y874 HydrophobicContact CD2-CD2 4.19Å; L837-Y874 HydrophobicContact CD2-CE2 4.22Å; L837-Y874 HydrophobicContact CG-CD2 4.07Å; L837-Y874 HydrophobicContact CG-CE2 3.93Å; G838-Y874 WeakPolarHBondContact CA-OH 3.24Å; C841-Y874 HydrophobicContact CB-CD2 4.41Å; C841-Y874 VanDerWaalsContact SG-CD2 3.52Å; F870-Y874 PolarHBondContact O-N 2.98Å; L871-Y874 PolarHBondContact O-N 2.89Å; Y874-A876 VanDerWaalsContact C-N 3.31Å; Y874-A876 PolarHBondContact O-N 3.03Å; Y874-D877 PolarHBondContact O-N 3.27Å; Y874-M878 HydrophobicContact CD1-CB 4.38Å; Y874-M878 HydrophobicContact CE1-CB 4.14Å; Y874-M878 HydrophobicContact CE1-CG 4.26Å; Y874-M878 HydrophobicContact CE1-SD 4.01Å; Y874-M878 VanDerWaalsContact O-CB 3.31Å; Y874-M878 WeakPolarHBondContact O-CB 3.45Å; Y874-M878 PolarHBondContact O-N 3.19Å; Y874-L895 WeakPolarHBondContact OH-CD1 3.38Å; Y874-L899 HydrophobicContact CE1-CD1 3.88Å; Y874-L899 HydrophobicContact CE1-CD2 4.05Å; Y874-F914 HydrophobicContact CD1-CE2 4.08Å; Y874-F914 AromaticContact CD1-CZ 3.83Å; Y874-F914 HydrophobicContact CD1-CZ 3.83Å; Y874-F914 HydrophobicContact CE1-CZ 4.12Å
875	R	91.1	Very high	88.8	Confident	86 Å²	86	40 Å²	40	33%	0.325	23%	0.228	S	C	.	.	H	α-helix	trans	-54.8	-41.8	174.8	-179.9	-178.7	163.2	166.3	0.3	113.2	L871 L873 D877 M878 D879 F914 H917	L871-R875 VanDerWaalsContact O-CB 3.32Å; L871-R875 WeakPolarHBondContact O-CB 3.39Å; L871-R875 PolarHBondContact O-N 3.25Å; L873-R875 PolarHBondContact O-N 3.07Å; L873-R875 VanDerWaalsContact O-N 3.13Å; R875-D877 VanDerWaalsContact C-N 3.34Å; R875-D877 PolarHBondContact O-N 2.96Å; R875-M878 PolarHBondContact O-N 3.12Å; R875-D879 WeakPolarHBondContact CG-OD2 3.49Å; R875-D879 IonicContact NE-OD2 2.79Å; R875-D879 PolarHBondContact NE-OD2 3.48Å; R875-D879 VanDerWaalsContact NE-OD2 3.17Å; R875-D879 IonicContact NH2-OD2 3.77Å; R875-D879 VanDerWaalsContact O-CB 3.29Å; R875-D879 WeakPolarHBondContact O-CB 3.39Å; R875-D879 VanDerWaalsContact O-CG 3.22Å; R875-D879 PolarHBondContact O-N 2.72Å; R875-F914 HydrophobicContact CB-CD2 3.97Å; R875-F914 HydrophobicContact CB-CE2 3.8Å; R875-F914 HydrophobicContact CG-CD2 4.49Å; R875-F914 HydrophobicContact CG-CE2 4.41Å; R875-H917 PolarHBondContact NE-CD2 2.95Å; R875-H917 VanDerWaalsContact NE-CD2 3.32Å; R875-H917 PolarHBondContact NE-NE2 3.07Å; R875-H917 PolarHBondContact NH2-CE1 3Å; R875-H917 PolarHBondContact NH2-ND1 2.86Å
876	A	88.1	Confident	88.4	Confident	61 Å²	61	41 Å²	41	50%	0.504	24%	0.24	S	C	.	.	H	α-helix	trans	-64.5	-43.4	-175.3	0	0	0	0	0	111	L873 Y874 S880	L873-A876 WeakPolarHBondContact O-CB 3.45Å; L873-A876 PolarHBondContact O-N 3.34Å; Y874-A876 VanDerWaalsContact C-N 3.31Å; Y874-A876 PolarHBondContact O-N 3.03Å; A876-S880 WeakPolarHBondContact O-CB 3.47Å; A876-S880 PolarHBondContact O-N 3.41Å; A876-S880 VanDerWaalsContact O-N 3.12Å
877	D	87.6	Confident	87.6	Confident	51 Å²	51	45.6 Å²	45.6	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-73.6	-33.9	177.4	-61.9	-48.2	0	0	0	111.9	Y810 M834 Y874 R875 T881	Y810-D877 PolarHBondContact OH-OD2 3.27Å; M834-D877 HydrophobicContact CE-CB 4.11Å; M834-D877 VanDerWaalsContact SD-C 3.6Å; M834-D877 HydrophobicContact SD-CB 4.24Å; Y874-D877 PolarHBondContact O-N 3.27Å; R875-D877 VanDerWaalsContact C-N 3.34Å; R875-D877 PolarHBondContact O-N 2.96Å; D877-T881 VanDerWaalsContact O-CB 3.3Å; D877-T881 WeakPolarHBondContact O-CB 3.43Å; D877-T881 PolarHBondContact O-N 3.11Å; D877-T881 PolarHBondContact O-OG1 3.44Å
878	M	89.9	Confident	86.9	Confident	0 Å²	0	48 Å²	48	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-50.4	172.2	-170.7	-167.9	74.8	0	0	111.8	M834 Y874 R875 S880 T881 L882 L895 L899 F914 L918 L921	M834-M878 HydrophobicContact CE-CB 3.82Å; M834-M878 HydrophobicContact SD-CB 4.41Å; Y874-M878 HydrophobicContact CD1-CB 4.38Å; Y874-M878 HydrophobicContact CE1-CB 4.14Å; Y874-M878 HydrophobicContact CE1-CG 4.26Å; Y874-M878 HydrophobicContact CE1-SD 4.01Å; Y874-M878 VanDerWaalsContact O-CB 3.31Å; Y874-M878 WeakPolarHBondContact O-CB 3.45Å; Y874-M878 PolarHBondContact O-N 3.19Å; R875-M878 PolarHBondContact O-N 3.12Å; M878-S880 VanDerWaalsContact C-N 3.29Å; M878-S880 PolarHBondContact O-N 3.17Å; M878-T881 PolarHBondContact O-N 2.86Å; M878-L882 HydrophobicContact CE-CD1 4.43Å; M878-L882 HydrophobicContact CG-CD1 3.84Å; M878-L882 HydrophobicContact CG-CG 4.48Å; M878-L882 WeakPolarHBondContact O-CB 3.41Å; M878-L882 WeakPolarHBondContact O-CG 3.48Å; M878-L882 PolarHBondContact O-N 3.28Å; M878-L882 HydrophobicContact SD-CD1 4.43Å; M878-L895 HydrophobicContact CG-CD2 4.16Å; M878-L899 HydrophobicContact SD-CD1 3.96Å; M878-F914 HydrophobicContact CE-CE2 4.48Å; M878-F914 HydrophobicContact SD-CZ 4.23Å; M878-L918 HydrophobicContact CE-CD1 4.41Å; M878-L918 HydrophobicContact SD-CD1 4.24Å; M878-L921 HydrophobicContact CE-CD2 3.9Å
879	D	90	Very high	86.2	Confident	26 Å²	26	47.7 Å²	47.7	14%	0.139	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-37.7	-179.3	-73.5	-11.1	0	0	0	110.5	R875 Q883 H917	R875-D879 WeakPolarHBondContact CG-OD2 3.49Å; R875-D879 IonicContact NE-OD2 2.79Å; R875-D879 PolarHBondContact NE-OD2 3.48Å; R875-D879 VanDerWaalsContact NE-OD2 3.17Å; R875-D879 IonicContact NH2-OD2 3.77Å; R875-D879 VanDerWaalsContact O-CB 3.29Å; R875-D879 WeakPolarHBondContact O-CB 3.39Å; R875-D879 VanDerWaalsContact O-CG 3.22Å; R875-D879 PolarHBondContact O-N 2.72Å; D879-Q883 WeakPolarHBondContact O-CB 3.5Å; D879-Q883 WeakPolarHBondContact O-CG 3.17Å; D879-Q883 PolarHBondContact O-N 3.42Å; D879-Q883 VanDerWaalsContact O-N 3.08Å; D879-Q883 PolarHBondContact O-NE2 2.96Å; D879-H917 VanDerWaalsContact CG-NE2 3.27Å; D879-H917 IonicContact OD1-CD2 3.54Å; D879-H917 IonicContact OD1-CE1 2.62Å; D879-H917 IonicContact OD1-NE2 2.76Å; D879-H917 PolarHBondContact OD1-NE2 3.06Å; D879-H917 IonicContact OD2-CE1 3.96Å; D879-H917 PolarHBondContact OD2-CE1 2.89Å; D879-H917 IonicContact OD2-NE2 3.58Å; D879-H917 PolarHBondContact OD2-NE2 3.35Å
880	S	86.8	Confident	85.8	Confident	68 Å²	68	47.1 Å²	47.1	48%	0.476	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-49.6	172.3	-175.3	0	0	0	0	112.1	A876 M878 L882 Q883 A884	A876-S880 WeakPolarHBondContact O-CB 3.47Å; A876-S880 PolarHBondContact O-N 3.41Å; A876-S880 VanDerWaalsContact O-N 3.12Å; M878-S880 VanDerWaalsContact C-N 3.29Å; M878-S880 PolarHBondContact O-N 3.17Å; S880-L882 VanDerWaalsContact C-N 3.34Å; S880-L882 PolarHBondContact O-N 3.23Å; S880-Q883 PolarHBondContact O-N 3.06Å; S880-A884 PolarHBondContact O-N 2.72Å; S880-A884 VanDerWaalsContact O-N 3.14Å
881	T	86.3	Confident	85.2	Confident	18 Å²	18	50.7 Å²	50.7	11%	0.11	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-35.8	-178.4	-61.7	0	0	0	0	112.7	R830 M834 D877 M878 A884 Q885	R830-T881 HydrophobicContact CB-CG2 4.06Å; M834-T881 HydrophobicContact CB-CG2 3.99Å; M834-T881 HydrophobicContact CG-CG2 4.21Å; D877-T881 VanDerWaalsContact O-CB 3.3Å; D877-T881 WeakPolarHBondContact O-CB 3.43Å; D877-T881 PolarHBondContact O-N 3.11Å; D877-T881 PolarHBondContact O-OG1 3.44Å; M878-T881 PolarHBondContact O-N 2.86Å; T881-A884 PolarHBondContact O-N 2.76Å; T881-Q885 PolarHBondContact O-NE2 3.29Å
882	L	85.9	Confident	84.9	Confident	24 Å²	24	50.8 Å²	50.8	13%	0.126	30%	0.302	C	S	.	.	H	α-helix	trans	-76.6	-33.7	177.3	-68.5	173.1	0	0	0	112.4	L831 M878 S880 A884 Q885 L895 L921 F922	L831-L882 HydrophobicContact CD1-CD2 4.04Å; M878-L882 HydrophobicContact CE-CD1 4.43Å; M878-L882 HydrophobicContact CG-CD1 3.84Å; M878-L882 HydrophobicContact CG-CG 4.48Å; M878-L882 WeakPolarHBondContact O-CB 3.41Å; M878-L882 WeakPolarHBondContact O-CG 3.48Å; M878-L882 PolarHBondContact O-N 3.28Å; M878-L882 HydrophobicContact SD-CD1 4.43Å; S880-L882 VanDerWaalsContact C-N 3.34Å; S880-L882 PolarHBondContact O-N 3.23Å; L882-A884 PolarHBondContact O-N 3.45Å; L882-Q885 WeakPolarHBondContact O-CB 3.47Å; L882-Q885 PolarHBondContact O-N 3.47Å; L882-L895 HydrophobicContact CD2-CD2 4.44Å; L882-L921 HydrophobicContact CD1-CD2 3.54Å; L882-F922 HydrophobicContact CD1-CE2 3.94Å; L882-F922 HydrophobicContact CD1-CZ 4.07Å; L882-F922 HydrophobicContact CD2-CZ 4.46Å
883	Q	85.3	Confident	84.7	Confident	163 Å²	163	47.5 Å²	47.5	76%	0.762	28%	0.279	S	S	*	.	H	α-helix	trans	-65.8	-25.7	170.7	-77.8	169.7	61.1	0	0	113.2	D879 S880 Q885	D879-Q883 WeakPolarHBondContact O-CB 3.5Å; D879-Q883 WeakPolarHBondContact O-CG 3.17Å; D879-Q883 PolarHBondContact O-N 3.42Å; D879-Q883 VanDerWaalsContact O-N 3.08Å; D879-Q883 PolarHBondContact O-NE2 2.96Å; S880-Q883 PolarHBondContact O-N 3.06Å; Q883-Q885 VanDerWaalsContact C-N 3.3Å
884	A	83.6	Confident	84.6	Confident	40 Å²	40	46.3 Å²	46.3	33%	0.331	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-4.8	175.8	0	0	0	0	0	114.4	S880 T881 L882	S880-A884 PolarHBondContact O-N 2.72Å; S880-A884 VanDerWaalsContact O-N 3.14Å; T881-A884 PolarHBondContact O-N 2.76Å; L882-A884 PolarHBondContact O-N 3.45Å
885	Q	81.2	Confident	84.4	Confident	29 Å²	29	46.4 Å²	46.4	14%	0.136	28%	0.275	C	S	.	.	S	Bend	trans	-79	147.2	179.3	-61.3	-56.6	-49.4	0	0	112.1	P827 T881 L882 Q883	P827-Q885 PolarHBondContact O-NE2 2.82Å; T881-Q885 PolarHBondContact O-NE2 3.29Å; L882-Q885 WeakPolarHBondContact O-CB 3.47Å; L882-Q885 PolarHBondContact O-N 3.47Å; Q883-Q885 VanDerWaalsContact C-N 3.3Å
886	P	79.6	Confident	84.3	Confident	85 Å²	85	42.3 Å²	42.3	55%	0.552	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-65.8	149.3	172.7	25.8	-30.6	0	0	0	111.8	S889	P886-S889 WeakPolarHBondContact O-CB 3.39Å; P886-S889 PolarHBondContact O-N 3.47Å
887	A	74.2	Confident	84.3	Confident	99 Å²	99	41 Å²	41	82%	0.818	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	144.7	177.8	0	0	0	0	0	111.9	S889	A887-S889 PolarHBondContact O-N 3.17Å
888	D	75.6	Confident	84.4	Confident	58 Å²	58	40.8 Å²	40.8	31%	0.31	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	29.8	-172.6	-62.6	-36.5	0	0	0	114.5	W890 R928 L932	D888-W890 VanDerWaalsContact CA-CZ2 3.49Å; D888-W890 HydrophobicContact CB-CH2 4.45Å; D888-W890 HydrophobicContact CB-CZ2 3.74Å; D888-W890 VanDerWaalsContact O-CE2 3.27Å; D888-W890 PolarHBondContact O-NE1 3.37Å; D888-R928 VanDerWaalsContact OD1-CG 3.32Å; D888-R928 WeakPolarHBondContact OD1-CG 3.22Å; D888-R928 IonicContact OD1-CZ 2.68Å; D888-R928 IonicContact OD1-NE 3.41Å; D888-R928 PolarHBondContact OD1-NE 3.45Å; D888-R928 IonicContact OD1-NH2 3.35Å; D888-R928 PolarHBondContact OD1-NH2 3.01Å; D888-R928 IonicContact OD2-CZ 2.68Å; D888-R928 IonicContact OD2-NE 2.72Å; D888-R928 IonicContact OD2-NH2 2.74Å; D888-R928 PolarHBondContact OD2-NH2 2.96Å; D888-L932 HydrophobicContact CB-CD1 4.27Å
889	S	77.7	Confident	84.4	Confident	23 Å²	23	40.9 Å²	40.9	16%	0.161	24%	0.242	C	C	.	.			trans	-85.1	132.6	168.4	-177.3	0	0	0	0	112.4	P886 A887	P886-S889 WeakPolarHBondContact O-CB 3.39Å; P886-S889 PolarHBondContact O-N 3.47Å; A887-S889 PolarHBondContact O-N 3.17Å
890	W	81.9	Confident	84.3	Confident	31 Å²	31	39.6 Å²	39.6	12%	0.117	24%	0.236	C	C	.	.			trans	-113.7	4.4	-175.5	-49.2	119.2	0	0	0	113.9	D888 S892 F893 L925 R928 Y929 L932	D888-W890 VanDerWaalsContact CA-CZ2 3.49Å; D888-W890 HydrophobicContact CB-CH2 4.45Å; D888-W890 HydrophobicContact CB-CZ2 3.74Å; D888-W890 VanDerWaalsContact O-CE2 3.27Å; D888-W890 PolarHBondContact O-NE1 3.37Å; W890-S892 PolarHBondContact O-N 3.3Å; W890-S892 VanDerWaalsContact O-N 3.15Å; W890-F893 HydrophobicContact CB-CD2 3.92Å; W890-F893 HydrophobicContact CB-CE2 3.79Å; W890-F893 AromaticContact CD2-CE2 3.96Å; W890-F893 HydrophobicContact CD2-CE2 3.96Å; W890-F893 HydrophobicContact CD2-CZ 4.45Å; W890-F893 HydrophobicContact CE3-CD2 4.49Å; W890-F893 AromaticContact CE3-CE2 3.44Å; W890-F893 HydrophobicContact CE3-CE2 3.44Å; W890-F893 VanDerWaalsContact CE3-CE2 3.44Å; W890-F893 AromaticContact CE3-CZ 3.54Å; W890-F893 HydrophobicContact CE3-CZ 3.54Å; W890-F893 HydrophobicContact CG-CE2 4.11Å; W890-F893 HydrophobicContact CZ3-CE2 4.4Å; W890-F893 HydrophobicContact CZ3-CZ 4.08Å; W890-F893 WeakPolarHBondContact O-CD2 3.45Å; W890-F893 PolarHBondContact O-N 3.33Å; W890-L925 HydrophobicContact CZ3-CB 4.12Å; W890-L925 HydrophobicContact CZ3-CD2 3.92Å; W890-L925 WeakPolarHBondContact CZ3-O 3.36Å; W890-R928 HydrophobicContact CH2-CB 4.05Å; W890-R928 HydrophobicContact CH2-CG 3.66Å; W890-R928 HydrophobicContact CZ2-CG 4.23Å; W890-Y929 AromaticContact CD1-CD2 3.82Å; W890-Y929 AromaticContact CD2-CD2 3.72Å; W890-Y929 HydrophobicContact CD2-CD2 3.72Å; W890-Y929 HydrophobicContact CD2-CG 4.36Å; W890-Y929 AromaticContact CE2-CD2 3.84Å; W890-Y929 HydrophobicContact CE3-CD2 4.35Å; W890-Y929 AromaticContact CG-CD2 3.75Å; W890-Y929 HydrophobicContact CG-CD2 3.75Å; W890-Y929 HydrophobicContact CG-CE2 4.2Å; W890-Y929 AromaticContact NE1-CD2 3.86Å; W890-L932 HydrophobicContact CZ2-CD1 3.87Å
891	N	80.1	Confident	84.4	Confident	74 Å²	74	39.4 Å²	39.4	40%	0.396	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-9.6	-179.7	-67.1	-10.2	0	0	0	113	L831 P894	L831-N891 HydrophobicContact CD2-CB 3.81Å; N891-P894 WeakPolarHBondContact O-CD 3.25Å
892	S	85.8	Confident	84.4	Confident	5 Å²	5	39.8 Å²	39.8	4%	0.035	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-11	-180	55.4	0	0	0	0	114.6	W890 L895 F896	W890-S892 PolarHBondContact O-N 3.3Å; W890-S892 VanDerWaalsContact O-N 3.15Å; S892-L895 VanDerWaalsContact O-CB 3.25Å; S892-L895 WeakPolarHBondContact O-CB 3.4Å; S892-L895 PolarHBondContact O-N 2.93Å; S892-L895 VanDerWaalsContact O-N 3.1Å; S892-F896 PolarHBondContact O-N 3.2Å
893	F	87.1	Confident	84.5	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-35.8	179.2	-69.1	-51.9	0	0	0	114.8	W890 L895 F896 Q897 F922 L925 V926 Y929 F1023 L1027	W890-F893 HydrophobicContact CB-CD2 3.92Å; W890-F893 HydrophobicContact CB-CE2 3.79Å; W890-F893 AromaticContact CD2-CE2 3.96Å; W890-F893 HydrophobicContact CD2-CE2 3.96Å; W890-F893 HydrophobicContact CD2-CZ 4.45Å; W890-F893 HydrophobicContact CE3-CD2 4.49Å; W890-F893 AromaticContact CE3-CE2 3.44Å; W890-F893 HydrophobicContact CE3-CE2 3.44Å; W890-F893 VanDerWaalsContact CE3-CE2 3.44Å; W890-F893 AromaticContact CE3-CZ 3.54Å; W890-F893 HydrophobicContact CE3-CZ 3.54Å; W890-F893 HydrophobicContact CG-CE2 4.11Å; W890-F893 HydrophobicContact CZ3-CE2 4.4Å; W890-F893 HydrophobicContact CZ3-CZ 4.08Å; W890-F893 WeakPolarHBondContact O-CD2 3.45Å; W890-F893 PolarHBondContact O-N 3.33Å; F893-L895 PolarHBondContact O-N 3.13Å; F893-F896 WeakPolarHBondContact O-CB 3.46Å; F893-F896 PolarHBondContact O-N 3.02Å; F893-Q897 WeakPolarHBondContact O-CG 3.37Å; F893-Q897 PolarHBondContact O-N 3.05Å; F893-F922 HydrophobicContact CD1-CD1 4Å; F893-F922 HydrophobicContact CD1-CE1 4.23Å; F893-F922 HydrophobicContact CE1-CD1 4.15Å; F893-L925 HydrophobicContact CE1-CB 4.16Å; F893-L925 HydrophobicContact CZ-CB 4.33Å; F893-V926 HydrophobicContact CD1-CG2 4.44Å; F893-V926 HydrophobicContact CE1-CG2 3.68Å; F893-V926 HydrophobicContact CZ-CG2 4.36Å; F893-Y929 HydrophobicContact CE2-CD1 4.5Å; F893-Y929 HydrophobicContact CE2-CD2 4.32Å; F893-Y929 HydrophobicContact CE2-CG 4.09Å; F893-Y929 HydrophobicContact CZ-CG 4.42Å; F893-F1023 HydrophobicContact CB-CE2 4.21Å; F893-F1023 HydrophobicContact CD1-CE2 4.29Å; F893-F1023 HydrophobicContact CD1-CZ 4.09Å; F893-F1023 AromaticContact CD2-CE2 3.54Å; F893-F1023 HydrophobicContact CD2-CE2 3.54Å; F893-F1023 AromaticContact CD2-CZ 3.73Å; F893-F1023 HydrophobicContact CD2-CZ 3.73Å; F893-F1023 AromaticContact CE1-CZ 3.99Å; F893-F1023 HydrophobicContact CE1-CZ 3.99Å; F893-F1023 AromaticContact CE2-CE2 3.87Å; F893-F1023 HydrophobicContact CE2-CE2 3.87Å; F893-F1023 AromaticContact CE2-CZ 3.58Å; F893-F1023 HydrophobicContact CE2-CZ 3.58Å; F893-F1023 AromaticContact CG-CE2 3.78Å; F893-F1023 HydrophobicContact CG-CE2 3.78Å; F893-F1023 AromaticContact CG-CZ 3.99Å; F893-F1023 HydrophobicContact CG-CZ 3.99Å; F893-F1023 HydrophobicContact CZ-CE2 4.4Å; F893-F1023 AromaticContact CZ-CZ 3.73Å; F893-F1023 HydrophobicContact CZ-CZ 3.73Å; F893-L1027 HydrophobicContact CD1-CD2 4.41Å
894	P	87.8	Confident	84.5	Confident	30 Å²	30	36.4 Å²	36.4	20%	0.195	21%	0.208	C	C	.	.	H	α-helix	trans	-57.7	-34.1	171.3	-28.2	37.4	0	0	0	113.7	L835 N891 Q897 L898 W986	L835-P894 HydrophobicContact CD1-CB 3.83Å; N891-P894 WeakPolarHBondContact O-CD 3.25Å; P894-Q897 PolarHBondContact O-N 3.41Å; P894-L898 WeakPolarHBondContact O-CB 3.38Å; P894-L898 PolarHBondContact O-N 3.28Å; P894-W986 HydrophobicContact CG-CD2 4.35Å; P894-W986 HydrophobicContact CG-CG 4.16Å
895	L	87.6	Confident	84.5	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-44.6	175.9	-168.7	65.7	0	0	0	111.4	L831 M834 L835 Y874 M878 L882 S892 F893 L899	L831-L895 HydrophobicContact CD1-CD2 4.19Å; M834-L895 HydrophobicContact CG-CD2 4.24Å; L835-L895 HydrophobicContact CB-CD1 3.99Å; L835-L895 HydrophobicContact CG-CD1 4.34Å; Y874-L895 WeakPolarHBondContact OH-CD1 3.38Å; M878-L895 HydrophobicContact CG-CD2 4.16Å; L882-L895 HydrophobicContact CD2-CD2 4.44Å; S892-L895 VanDerWaalsContact O-CB 3.25Å; S892-L895 WeakPolarHBondContact O-CB 3.4Å; S892-L895 PolarHBondContact O-N 2.93Å; S892-L895 VanDerWaalsContact O-N 3.1Å; F893-L895 PolarHBondContact O-N 3.13Å; L895-L899 HydrophobicContact CD1-CD1 4.42Å; L895-L899 HydrophobicContact CG-CD1 4.14Å; L895-L899 WeakPolarHBondContact O-CG 3.18Å; L895-L899 PolarHBondContact O-N 3.1Å; L895-L899 VanDerWaalsContact O-N 3.13Å
896	F	88.8	Confident	84.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-45.7	172.6	176.8	-92	0	0	0	111.5	S892 F893 L898 L899 N900 L918 F922 L1027 W1029	S892-F896 PolarHBondContact O-N 3.2Å; F893-F896 WeakPolarHBondContact O-CB 3.46Å; F893-F896 PolarHBondContact O-N 3.02Å; F896-L898 PolarHBondContact O-N 3.48Å; F896-L899 PolarHBondContact O-N 3.28Å; F896-N900 HydrophobicContact CD1-CB 4.37Å; F896-N900 HydrophobicContact CE1-CB 4.05Å; F896-N900 HydrophobicContact CZ-CB 4.15Å; F896-N900 WeakPolarHBondContact O-CB 3.2Å; F896-N900 PolarHBondContact O-N 3.38Å; F896-L918 HydrophobicContact CD2-CD1 4.05Å; F896-L918 HydrophobicContact CD2-CD2 4.26Å; F896-L918 HydrophobicContact CD2-CG 3.81Å; F896-L918 HydrophobicContact CE2-CD2 4.45Å; F896-L918 HydrophobicContact CE2-CG 4.05Å; F896-F922 HydrophobicContact CB-CD1 3.77Å; F896-F922 HydrophobicContact CB-CD2 4.15Å; F896-F922 HydrophobicContact CB-CE1 3.74Å; F896-F922 HydrophobicContact CB-CE2 4.11Å; F896-F922 HydrophobicContact CB-CG 3.97Å; F896-F922 HydrophobicContact CB-CZ 3.9Å; F896-F922 HydrophobicContact CD2-CB 3.64Å; F896-F922 HydrophobicContact CD2-CD1 4.19Å; F896-F922 AromaticContact CD2-CD2 3.69Å; F896-F922 HydrophobicContact CD2-CD2 3.69Å; F896-F922 HydrophobicContact CD2-CE2 4.38Å; F896-F922 AromaticContact CD2-CG 3.56Å; F896-F922 HydrophobicContact CD2-CG 3.56Å; F896-F922 HydrophobicContact CE2-CB 3.97Å; F896-F922 HydrophobicContact CE2-CG 4.39Å; F896-F922 HydrophobicContact CG-CB 4.28Å; F896-F922 HydrophobicContact CG-CD1 4.14Å; F896-F922 HydrophobicContact CG-CD2 4.32Å; F896-F922 AromaticContact CG-CG 3.99Å; F896-F922 HydrophobicContact CG-CG 3.99Å; F896-L1027 HydrophobicContact CD1-CD2 3.68Å; F896-L1027 HydrophobicContact CE1-CD2 3.88Å; F896-W1029 AromaticContact CE1-CE3 3.96Å; F896-W1029 HydrophobicContact CE1-CE3 3.96Å; F896-W1029 AromaticContact CE1-CZ3 3.89Å; F896-W1029 HydrophobicContact CE1-CZ3 3.89Å; F896-W1029 HydrophobicContact CE2-CE3 4.45Å; F896-W1029 AromaticContact CE2-CH2 3.98Å; F896-W1029 HydrophobicContact CE2-CH2 3.98Å; F896-W1029 AromaticContact CE2-CZ3 3.77Å; F896-W1029 HydrophobicContact CE2-CZ3 3.77Å; F896-W1029 HydrophobicContact CZ-CD2 4.35Å; F896-W1029 AromaticContact CZ-CE3 3.55Å; F896-W1029 HydrophobicContact CZ-CE3 3.55Å; F896-W1029 AromaticContact CZ-CH2 3.88Å; F896-W1029 HydrophobicContact CZ-CH2 3.88Å; F896-W1029 AromaticContact CZ-CZ3 3.28Å; F896-W1029 HydrophobicContact CZ-CZ3 3.28Å
897	Q	87.3	Confident	84.4	Confident	33 Å²	33	39.7 Å²	39.7	15%	0.154	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-41.9	180	-71.4	178.3	-62.9	0	0	112.5	F893 P894 N901 D1026	F893-Q897 WeakPolarHBondContact O-CG 3.37Å; F893-Q897 PolarHBondContact O-N 3.05Å; P894-Q897 PolarHBondContact O-N 3.41Å; Q897-N901 VanDerWaalsContact O-CB 3.22Å; Q897-N901 WeakPolarHBondContact O-CB 3.47Å; Q897-N901 PolarHBondContact O-N 2.71Å; Q897-N901 PolarHBondContact O-ND2 3.15Å; Q897-D1026 PolarHBondContact NE2-O 3.35Å; Q897-D1026 VanDerWaalsContact NE2-O 3.08Å
898	L	89.3	Confident	84.6	Confident	46 Å²	46	40.3 Å²	40.3	24%	0.241	22%	0.222	C	C	.	.	H	α-helix	trans	-59.6	-54.9	176.4	174.2	63.8	0	0	0	111.2	L835 E839 I842 P894 F896 F902	L835-L898 HydrophobicContact CD2-CD2 4.44Å; L835-L898 HydrophobicContact CG-CD2 4.14Å; E839-L898 HydrophobicContact CG-CD1 4.15Å; E839-L898 HydrophobicContact CG-CD2 3.62Å; I842-L898 HydrophobicContact CD1-CD1 3.72Å; I842-L898 HydrophobicContact CD1-CD2 4.44Å; I842-L898 HydrophobicContact CD1-CG 3.73Å; P894-L898 WeakPolarHBondContact O-CB 3.38Å; P894-L898 PolarHBondContact O-N 3.28Å; F896-L898 PolarHBondContact O-N 3.48Å; L898-F902 PolarHBondContact O-N 3.24Å
899	L	89.8	Confident	85	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-45.4	-177.1	-64.5	167.9	0	0	0	111.8	I842 Y874 M878 L895 F896 N901 F902 L903 F914 L918	I842-L899 HydrophobicContact CD1-CD2 4.44Å; Y874-L899 HydrophobicContact CE1-CD1 3.88Å; Y874-L899 HydrophobicContact CE1-CD2 4.05Å; M878-L899 HydrophobicContact SD-CD1 3.96Å; L895-L899 HydrophobicContact CD1-CD1 4.42Å; L895-L899 HydrophobicContact CG-CD1 4.14Å; L895-L899 WeakPolarHBondContact O-CG 3.18Å; L895-L899 PolarHBondContact O-N 3.1Å; L895-L899 VanDerWaalsContact O-N 3.13Å; F896-L899 PolarHBondContact O-N 3.28Å; L899-N901 PolarHBondContact O-N 3.24Å; L899-F902 PolarHBondContact O-N 3.33Å; L899-L903 HydrophobicContact CB-CD1 4.46Å; L899-L903 WeakPolarHBondContact O-CB 3.48Å; L899-L903 WeakPolarHBondContact O-CD1 3.15Å; L899-L903 WeakPolarHBondContact O-CG 3.49Å; L899-L903 PolarHBondContact O-N 2.92Å; L899-F914 HydrophobicContact CD1-CE1 4.49Å; L899-F914 HydrophobicContact CD1-CZ 4.28Å; L899-F914 HydrophobicContact CD2-CE1 4.47Å; L899-L918 HydrophobicContact CB-CD2 3.6Å; L899-L918 HydrophobicContact CD1-CD1 4.06Å; L899-L918 HydrophobicContact CD1-CD2 4.46Å
900	N	89.3	Confident	85.3	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-45.1	177.6	-179.7	29.6	0	0	0	111.5	F896 F902 L903 R904 H915 L1027 H1028 P1030	F896-N900 HydrophobicContact CD1-CB 4.37Å; F896-N900 HydrophobicContact CE1-CB 4.05Å; F896-N900 HydrophobicContact CZ-CB 4.15Å; F896-N900 WeakPolarHBondContact O-CB 3.2Å; F896-N900 PolarHBondContact O-N 3.38Å; N900-F902 VanDerWaalsContact C-N 3.28Å; N900-F902 PolarHBondContact O-N 3.3Å; N900-L903 PolarHBondContact O-N 2.9Å; N900-R904 WeakPolarHBondContact O-CB 3.23Å; N900-R904 WeakPolarHBondContact O-CD 3.32Å; N900-R904 WeakPolarHBondContact O-CG 3.46Å; N900-R904 PolarHBondContact O-N 2.85Å; N900-H915 PolarHBondContact OD1-NE2 2.92Å; N900-L1027 PolarHBondContact ND2-O 3.36Å; N900-H1028 PolarHBondContact ND2-O 3.44Å; N900-P1030 VanDerWaalsContact OD1-CG 3.26Å; N900-P1030 WeakPolarHBondContact OD1-CG 3.32Å
901	N	87.8	Confident	85.3	Confident	63 Å²	63	40.4 Å²	40.4	34%	0.337	23%	0.231	S	C	.	.	H	α-helix	trans	-67	-26.7	-179.5	-76.6	-51.7	0	0	0	114	Q897 L899 R904	Q897-N901 VanDerWaalsContact O-CB 3.22Å; Q897-N901 WeakPolarHBondContact O-CB 3.47Å; Q897-N901 PolarHBondContact O-N 2.71Å; Q897-N901 PolarHBondContact O-ND2 3.15Å; L899-N901 PolarHBondContact O-N 3.24Å; N901-R904 PolarHBondContact OD1-NH1 3.06Å
902	F	87.4	Confident	85.5	Confident	27 Å²	27	37.4 Å²	37.4	12%	0.118	22%	0.217	C	C	.	.	H	α-helix	trans	-73	-55.9	167.5	173.6	-115.2	0	0	0	111.7	I842 L845 Q846 L898 L899 N900 R904 A905 D906 L909	I842-F902 HydrophobicContact CB-CG 4.5Å; I842-F902 HydrophobicContact CD1-CB 3.87Å; I842-F902 HydrophobicContact CD1-CD1 4.46Å; I842-F902 HydrophobicContact CD1-CG 4.22Å; I842-F902 HydrophobicContact CG1-CB 4.08Å; I842-F902 HydrophobicContact CG1-CD1 3.83Å; I842-F902 HydrophobicContact CG1-CD2 4.45Å; I842-F902 HydrophobicContact CG1-CE1 4.4Å; I842-F902 HydrophobicContact CG1-CG 3.86Å; I842-F902 HydrophobicContact CG2-CB 4.37Å; I842-F902 HydrophobicContact CG2-CD2 3.71Å; I842-F902 HydrophobicContact CG2-CE2 4.11Å; I842-F902 HydrophobicContact CG2-CG 3.95Å; L845-F902 HydrophobicContact CB-CZ 4.08Å; L845-F902 HydrophobicContact CD1-CE1 3.94Å; L845-F902 HydrophobicContact CD1-CZ 4.25Å; Q846-F902 HydrophobicContact CG-CE2 3.91Å; L898-F902 PolarHBondContact O-N 3.24Å; L899-F902 PolarHBondContact O-N 3.33Å; N900-F902 VanDerWaalsContact C-N 3.28Å; N900-F902 PolarHBondContact O-N 3.3Å; F902-R904 VanDerWaalsContact C-N 3.26Å; F902-R904 PolarHBondContact O-N 3.41Å; F902-A905 WeakPolarHBondContact O-CB 3.06Å; F902-A905 PolarHBondContact O-N 3.39Å; F902-D906 PolarHBondContact O-N 3.32Å; F902-L909 HydrophobicContact CE1-CD1 4.1Å; F902-L909 HydrophobicContact CZ-CD1 4.38Å
903	L	88	Confident	85.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.6	-22.1	-171.8	-63.4	164.3	0	0	0	114.3	L871 L899 N900 L909 C910 F914 H915 L918	L871-L903 HydrophobicContact CD1-CD2 3.87Å; L899-L903 HydrophobicContact CB-CD1 4.46Å; L899-L903 WeakPolarHBondContact O-CB 3.48Å; L899-L903 WeakPolarHBondContact O-CD1 3.15Å; L899-L903 WeakPolarHBondContact O-CG 3.49Å; L899-L903 PolarHBondContact O-N 2.92Å; N900-L903 PolarHBondContact O-N 2.9Å; L903-L909 HydrophobicContact CD2-CB 3.89Å; L903-L909 HydrophobicContact CD2-CD1 4.18Å; L903-C910 VanDerWaalsContact O-CA 3.23Å; L903-C910 WeakPolarHBondContact O-CA 3.34Å; L903-C910 WeakPolarHBondContact O-CB 3.44Å; L903-C910 PolarHBondContact O-N 2.94Å; L903-F914 HydrophobicContact CD1-CD1 3.68Å; L903-F914 HydrophobicContact CD1-CE1 3.83Å; L903-F914 HydrophobicContact CD2-CD1 4.33Å; L903-H915 HydrophobicContact CB-CB 4.46Å; L903-H915 WeakPolarHBondContact CB-ND1 3.49Å; L903-H915 HydrophobicContact CD1-CB 4.07Å; L903-L918 HydrophobicContact CD1-CD2 3.95Å
904	R	84.8	Confident	85.8	Confident	116 Å²	116	41.8 Å²	41.8	44%	0.438	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-14.9	174.1	73.7	-170.9	-87	-122	-5.6	114.2	N900 N901 F902 H1028	N900-R904 WeakPolarHBondContact O-CB 3.23Å; N900-R904 WeakPolarHBondContact O-CD 3.32Å; N900-R904 WeakPolarHBondContact O-CG 3.46Å; N900-R904 PolarHBondContact O-N 2.85Å; N901-R904 PolarHBondContact OD1-NH1 3.06Å; F902-R904 VanDerWaalsContact C-N 3.26Å; F902-R904 PolarHBondContact O-N 3.41Å; R904-H1028 PolarHBondContact NH1-CD2 2.85Å; R904-H1028 VanDerWaalsContact NH1-CG 3.26Å
905	A	82.8	Confident	85.9	Confident	85 Å²	85	40.3 Å²	40.3	70%	0.702	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-28.3	179.1	0	0	0	0	0	112.1	F902	F902-A905 WeakPolarHBondContact O-CB 3.06Å; F902-A905 PolarHBondContact O-N 3.39Å
906	D	80.9	Confident	85.9	Confident	36 Å²	36	45.2 Å²	45.2	19%	0.193	26%	0.257	C	S	.	.	S	Bend	trans	-83.5	124.8	174.4	-176.8	-40.2	0	0	0	110.9	F902 H908 L909 C910	F902-D906 PolarHBondContact O-N 3.32Å; D906-H908 VanDerWaalsContact C-N 3.31Å; D906-H908 PolarHBondContact O-N 3.2Å; D906-H908 WeakPolarHBondContact OD1-CA 3.37Å; D906-H908 WeakPolarHBondContact OD1-CB 3.47Å; D906-H908 PolarHBondContact OD1-N 3Å; D906-L909 HydrophobicContact CB-CB 4.08Å; D906-L909 HydrophobicContact CB-CD1 4.45Å; D906-L909 HydrophobicContact CB-CG 4.38Å; D906-L909 PolarHBondContact OD1-N 2.77Å; D906-L909 WeakPolarHBondContact OD2-CD1 3.44Å; D906-L909 WeakPolarHBondContact OD2-CG 3.37Å; D906-C910 WeakPolarHBondContact O-CB 3.22Å; D906-C910 PolarHBondContact O-N 3.45Å
907	S	77.8	Confident	86	Confident	102 Å²	102	46.6 Å²	46.6	71%	0.713	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-16.1	-178.4	53.8	0	0	0	0	115.2
908	H	80	Confident	86.2	Confident	112 Å²	112	45 Å²	45	52%	0.519	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-30.3	179.8	-63.3	-74.9	0	0	0	112.7	A864 D906	A864-H908 HydrophobicContact CB-CB 3.79Å; D906-H908 VanDerWaalsContact C-N 3.31Å; D906-H908 PolarHBondContact O-N 3.2Å; D906-H908 WeakPolarHBondContact OD1-CA 3.37Å; D906-H908 WeakPolarHBondContact OD1-CB 3.47Å; D906-H908 PolarHBondContact OD1-N 3Å
909	L	83	Confident	86.1	Confident	2 Å²	2	43 Å²	43	1%	0.01	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-15.5	174.8	-58.1	179.5	0	0	0	113.4	A867 E868 L871 F902 L903 D906 S911 G912 H915	A867-L909 HydrophobicContact CB-CD1 4.05Å; A867-L909 HydrophobicContact CB-CD2 4.02Å; E868-L909 HydrophobicContact CG-CD2 3.83Å; L871-L909 HydrophobicContact CD1-CD1 4.33Å; F902-L909 HydrophobicContact CE1-CD1 4.1Å; F902-L909 HydrophobicContact CZ-CD1 4.38Å; L903-L909 HydrophobicContact CD2-CB 3.89Å; L903-L909 HydrophobicContact CD2-CD1 4.18Å; D906-L909 HydrophobicContact CB-CB 4.08Å; D906-L909 HydrophobicContact CB-CD1 4.45Å; D906-L909 HydrophobicContact CB-CG 4.38Å; D906-L909 PolarHBondContact OD1-N 2.77Å; D906-L909 WeakPolarHBondContact OD2-CD1 3.44Å; D906-L909 WeakPolarHBondContact OD2-CG 3.37Å; L909-S911 PolarHBondContact O-N 3.39Å; L909-G912 PolarHBondContact O-N 3.37Å; L909-G912 VanDerWaalsContact O-N 3.11Å; L909-H915 PolarHBondContact O-ND1 3.22Å
910	C	84.3	Confident	86.1	Confident	52 Å²	52	48.1 Å²	48.1	35%	0.351	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	124.9	173.1	-172.6	0	0	0	0	111.1	L903 D906 G912	L903-C910 VanDerWaalsContact O-CA 3.23Å; L903-C910 WeakPolarHBondContact O-CA 3.34Å; L903-C910 WeakPolarHBondContact O-CB 3.44Å; L903-C910 PolarHBondContact O-N 2.94Å; D906-C910 WeakPolarHBondContact O-CB 3.22Å; D906-C910 PolarHBondContact O-N 3.45Å; C910-G912 PolarHBondContact O-N 3.27Å
911	S	81.9	Confident	86	Confident	60 Å²	60	50.7 Å²	50.7	42%	0.42	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	16.6	-173.9	-51.4	0	0	0	0	116.1	L909 H915 K916	L909-S911 PolarHBondContact O-N 3.39Å; S911-H915 PolarHBondContact N-ND1 3.41Å; S911-H915 VanDerWaalsContact N-ND1 3.19Å; S911-K916 WeakPolarHBondContact O-CE 3.43Å; S911-K916 PolarHBondContact O-NZ 2.92Å
912	G	84.6	Confident	86.1	Confident	10 Å²	10	47.7 Å²	47.7	10%	0.103	27%	0.27	C	S	.	.			trans	-68.3	170.6	172.9	0	0	0	0	0	114.1	E868 L909 C910 F914 H915 K916	E868-G912 WeakPolarHBondContact OE1-CA 3.23Å; L909-G912 PolarHBondContact O-N 3.37Å; L909-G912 VanDerWaalsContact O-N 3.11Å; C910-G912 PolarHBondContact O-N 3.27Å; G912-F914 PolarHBondContact O-N 3.49Å; G912-H915 PolarHBondContact O-N 2.88Å; G912-H915 VanDerWaalsContact O-N 3.14Å; G912-K916 PolarHBondContact O-N 3.08Å
913	P	88.4	Confident	86.2	Confident	96 Å²	96	48.4 Å²	48.4	62%	0.623	28%	0.275	S	S	*	.	H	α-helix	trans	-50.9	-48	-179.3	-29	34.3	0	0	0	115.1	E868 H917	E868-P913 VanDerWaalsContact CD-CD 3.5Å; E868-P913 WeakPolarHBondContact OE1-CD 3.34Å; P913-H917 PolarHBondContact O-N 3.42Å
914	F	90.6	Very high	86.2	Confident	3 Å²	3	52 Å²	52	1%	0.013	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-42.7	176.5	179.6	-100.1	0	0	0	111.9	E868 L871 Y874 R875 M878 L899 L903 G912 K916 H917 L918	E868-F914 WeakPolarHBondContact OE2-CB 3.48Å; E868-F914 PolarHBondContact OE2-N 3.05Å; L871-F914 HydrophobicContact CB-CB 4.05Å; L871-F914 HydrophobicContact CB-CD1 4.06Å; L871-F914 HydrophobicContact CB-CD2 3.89Å; L871-F914 HydrophobicContact CB-CE2 4.37Å; L871-F914 HydrophobicContact CB-CG 3.72Å; L871-F914 HydrophobicContact CD1-CB 4.49Å; L871-F914 HydrophobicContact CD1-CD1 4.01Å; L871-F914 HydrophobicContact CD1-CG 4.34Å; L871-F914 HydrophobicContact CD2-CD1 4.28Å; L871-F914 HydrophobicContact CD2-CE1 4.12Å; L871-F914 HydrophobicContact CD2-CZ 4.44Å; L871-F914 HydrophobicContact CG-CD1 4.35Å; L871-F914 HydrophobicContact CG-CG 4.49Å; L871-F914 WeakPolarHBondContact O-CD2 3.46Å; L871-F914 WeakPolarHBondContact O-CE2 3.35Å; Y874-F914 HydrophobicContact CD1-CE2 4.08Å; Y874-F914 AromaticContact CD1-CZ 3.83Å; Y874-F914 HydrophobicContact CD1-CZ 3.83Å; Y874-F914 HydrophobicContact CE1-CZ 4.12Å; R875-F914 HydrophobicContact CB-CD2 3.97Å; R875-F914 HydrophobicContact CB-CE2 3.8Å; R875-F914 HydrophobicContact CG-CD2 4.49Å; R875-F914 HydrophobicContact CG-CE2 4.41Å; M878-F914 HydrophobicContact CE-CE2 4.48Å; M878-F914 HydrophobicContact SD-CZ 4.23Å; L899-F914 HydrophobicContact CD1-CE1 4.49Å; L899-F914 HydrophobicContact CD1-CZ 4.28Å; L899-F914 HydrophobicContact CD2-CE1 4.47Å; L903-F914 HydrophobicContact CD1-CD1 3.68Å; L903-F914 HydrophobicContact CD1-CE1 3.83Å; L903-F914 HydrophobicContact CD2-CD1 4.33Å; G912-F914 PolarHBondContact O-N 3.49Å; F914-K916 VanDerWaalsContact C-N 3.33Å; F914-K916 PolarHBondContact O-N 3.23Å; F914-H917 PolarHBondContact O-N 3.03Å; F914-L918 WeakPolarHBondContact O-CB 3.47Å; F914-L918 PolarHBondContact O-N 3.03Å
915	H	89.8	Confident	86.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.8	-31.4	-177.9	-163.8	169.1	0	0	0	112.9	N900 L903 L909 S911 G912 Q919 P1030	N900-H915 PolarHBondContact OD1-NE2 2.92Å; L903-H915 HydrophobicContact CB-CB 4.46Å; L903-H915 WeakPolarHBondContact CB-ND1 3.49Å; L903-H915 HydrophobicContact CD1-CB 4.07Å; L909-H915 PolarHBondContact O-ND1 3.22Å; S911-H915 PolarHBondContact N-ND1 3.41Å; S911-H915 VanDerWaalsContact N-ND1 3.19Å; G912-H915 PolarHBondContact O-N 2.88Å; G912-H915 VanDerWaalsContact O-N 3.14Å; H915-Q919 WeakPolarHBondContact O-CG 3.33Å; H915-Q919 PolarHBondContact O-N 3.39Å; H915-Q919 PolarHBondContact O-NE2 3.24Å; H915-P1030 WeakPolarHBondContact NE2-CG 3.26Å
916	K	88.3	Confident	86.5	Confident	105 Å²	105	44.8 Å²	44.8	46%	0.457	26%	0.256	S	S	.	.	H	α-helix	trans	-71.1	-46.8	172	-78.1	172.9	174.5	151.8	0	111.9	S911 G912 F914 L918 Q919 D920	S911-K916 WeakPolarHBondContact O-CE 3.43Å; S911-K916 PolarHBondContact O-NZ 2.92Å; G912-K916 PolarHBondContact O-N 3.08Å; F914-K916 VanDerWaalsContact C-N 3.33Å; F914-K916 PolarHBondContact O-N 3.23Å; K916-L918 VanDerWaalsContact C-N 3.3Å; K916-L918 PolarHBondContact O-N 2.78Å; K916-Q919 CarbonylContact O-C 3.52Å; K916-Q919 WeakPolarHBondContact O-CA 3.32Å; K916-Q919 WeakPolarHBondContact O-CB 3.27Å; K916-Q919 PolarHBondContact O-N 2.9Å; K916-D920 PolarHBondContact O-N 2.85Å
917	H	90.7	Very high	86.8	Confident	28 Å²	28	44.9 Å²	44.9	13%	0.13	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-41.5	175.2	174	71.5	0	0	0	112.8	R875 D879 P913 F914 Q919 D920 L921	R875-H917 PolarHBondContact NE-CD2 2.95Å; R875-H917 VanDerWaalsContact NE-CD2 3.32Å; R875-H917 PolarHBondContact NE-NE2 3.07Å; R875-H917 PolarHBondContact NH2-CE1 3Å; R875-H917 PolarHBondContact NH2-ND1 2.86Å; D879-H917 VanDerWaalsContact CG-NE2 3.27Å; D879-H917 IonicContact OD1-CD2 3.54Å; D879-H917 IonicContact OD1-CE1 2.62Å; D879-H917 IonicContact OD1-NE2 2.76Å; D879-H917 PolarHBondContact OD1-NE2 3.06Å; D879-H917 IonicContact OD2-CE1 3.96Å; D879-H917 PolarHBondContact OD2-CE1 2.89Å; D879-H917 IonicContact OD2-NE2 3.58Å; D879-H917 PolarHBondContact OD2-NE2 3.35Å; P913-H917 PolarHBondContact O-N 3.42Å; F914-H917 PolarHBondContact O-N 3.03Å; H917-Q919 VanDerWaalsContact C-N 3.26Å; H917-Q919 PolarHBondContact O-N 3.39Å; H917-D920 PolarHBondContact O-N 3.18Å; H917-L921 WeakPolarHBondContact O-CB 3.44Å; H917-L921 PolarHBondContact O-N 3.39Å
918	L	90.3	Very high	87.3	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.3	-37.3	174.3	-178.5	67.3	0	0	0	112.1	M878 F896 L899 L903 F914 K916 F922	M878-L918 HydrophobicContact CE-CD1 4.41Å; M878-L918 HydrophobicContact SD-CD1 4.24Å; F896-L918 HydrophobicContact CD2-CD1 4.05Å; F896-L918 HydrophobicContact CD2-CD2 4.26Å; F896-L918 HydrophobicContact CD2-CG 3.81Å; F896-L918 HydrophobicContact CE2-CD2 4.45Å; F896-L918 HydrophobicContact CE2-CG 4.05Å; L899-L918 HydrophobicContact CB-CD2 3.6Å; L899-L918 HydrophobicContact CD1-CD1 4.06Å; L899-L918 HydrophobicContact CD1-CD2 4.46Å; L903-L918 HydrophobicContact CD1-CD2 3.95Å; F914-L918 WeakPolarHBondContact O-CB 3.47Å; F914-L918 PolarHBondContact O-N 3.03Å; K916-L918 VanDerWaalsContact C-N 3.3Å; K916-L918 PolarHBondContact O-N 2.78Å; L918-F922 HydrophobicContact CD1-CD2 3.94Å; L918-F922 HydrophobicContact CD1-CE2 3.88Å; L918-F922 WeakPolarHBondContact O-CD2 3.39Å; L918-F922 PolarHBondContact O-N 3.13Å
919	Q	88.2	Confident	87.5	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-70.6	-51.6	174.1	-76.3	172.8	98.3	0	0	111.4	H915 K916 H917 L921 F922 I923 W1029 P1030	H915-Q919 WeakPolarHBondContact O-CG 3.33Å; H915-Q919 PolarHBondContact O-N 3.39Å; H915-Q919 PolarHBondContact O-NE2 3.24Å; K916-Q919 CarbonylContact O-C 3.52Å; K916-Q919 WeakPolarHBondContact O-CA 3.32Å; K916-Q919 WeakPolarHBondContact O-CB 3.27Å; K916-Q919 PolarHBondContact O-N 2.9Å; H917-Q919 VanDerWaalsContact C-N 3.26Å; H917-Q919 PolarHBondContact O-N 3.39Å; Q919-L921 PolarHBondContact O-N 2.93Å; Q919-F922 PolarHBondContact O-N 2.89Å; Q919-I923 VanDerWaalsContact O-CG1 3.27Å; Q919-I923 WeakPolarHBondContact O-CG1 3.26Å; Q919-I923 PolarHBondContact O-N 2.91Å; Q919-W1029 HydrophobicContact CB-CH2 4.22Å; Q919-W1029 HydrophobicContact CB-CZ2 3.64Å; Q919-W1029 HydrophobicContact CG-CH2 4.22Å; Q919-W1029 HydrophobicContact CG-CZ2 3.63Å; Q919-P1030 HydrophobicContact CG-CG 4.34Å
920	D	89.3	Confident	87.7	Confident	110 Å²	110	41.4 Å²	41.4	59%	0.588	23%	0.226	S	C	*	.	H	α-helix	trans	-52.1	-40	178.5	-69.4	-40	0	0	0	112.4	K916 H917 P924	K916-D920 PolarHBondContact O-N 2.85Å; H917-D920 PolarHBondContact O-N 3.18Å; D920-P924 VanDerWaalsContact O-CD 3.22Å; D920-P924 WeakPolarHBondContact O-CD 3.1Å
921	L	88.4	Confident	87.8	Confident	53 Å²	53	41.6 Å²	41.6	28%	0.277	22%	0.223	S	C	.	.	H	α-helix	trans	-71.6	-37.2	179.6	-170.6	64.7	0	0	0	113.2	M878 L882 H917 Q919	M878-L921 HydrophobicContact CE-CD2 3.9Å; L882-L921 HydrophobicContact CD1-CD2 3.54Å; H917-L921 WeakPolarHBondContact O-CB 3.44Å; H917-L921 PolarHBondContact O-N 3.39Å; Q919-L921 PolarHBondContact O-N 2.93Å
922	F	88.8	Confident	88	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-94.3	-18.1	-176.3	-81.5	-93.3	0	0	0	114.7	L882 F893 F896 L918 Q919 L925 V926 W1029	L882-F922 HydrophobicContact CD1-CE2 3.94Å; L882-F922 HydrophobicContact CD1-CZ 4.07Å; L882-F922 HydrophobicContact CD2-CZ 4.46Å; F893-F922 HydrophobicContact CD1-CD1 4Å; F893-F922 HydrophobicContact CD1-CE1 4.23Å; F893-F922 HydrophobicContact CE1-CD1 4.15Å; F896-F922 HydrophobicContact CB-CD1 3.77Å; F896-F922 HydrophobicContact CB-CD2 4.15Å; F896-F922 HydrophobicContact CB-CE1 3.74Å; F896-F922 HydrophobicContact CB-CE2 4.11Å; F896-F922 HydrophobicContact CB-CG 3.97Å; F896-F922 HydrophobicContact CB-CZ 3.9Å; F896-F922 HydrophobicContact CD2-CB 3.64Å; F896-F922 HydrophobicContact CD2-CD1 4.19Å; F896-F922 AromaticContact CD2-CD2 3.69Å; F896-F922 HydrophobicContact CD2-CD2 3.69Å; F896-F922 HydrophobicContact CD2-CE2 4.38Å; F896-F922 AromaticContact CD2-CG 3.56Å; F896-F922 HydrophobicContact CD2-CG 3.56Å; F896-F922 HydrophobicContact CE2-CB 3.97Å; F896-F922 HydrophobicContact CE2-CG 4.39Å; F896-F922 HydrophobicContact CG-CB 4.28Å; F896-F922 HydrophobicContact CG-CD1 4.14Å; F896-F922 HydrophobicContact CG-CD2 4.32Å; F896-F922 AromaticContact CG-CG 3.99Å; F896-F922 HydrophobicContact CG-CG 3.99Å; L918-F922 HydrophobicContact CD1-CD2 3.94Å; L918-F922 HydrophobicContact CD1-CE2 3.88Å; L918-F922 WeakPolarHBondContact O-CD2 3.39Å; L918-F922 PolarHBondContact O-N 3.13Å; Q919-F922 PolarHBondContact O-N 2.89Å; F922-L925 HydrophobicContact CD1-CD1 3.84Å; F922-L925 HydrophobicContact CE1-CD1 4.01Å; F922-L925 HydrophobicContact CG-CD1 4.34Å; F922-L925 PolarHBondContact O-N 3.24Å; F922-V926 WeakPolarHBondContact O-CG2 3.36Å; F922-V926 PolarHBondContact O-N 3.19Å; F922-W1029 HydrophobicContact CB-CH2 4.33Å; F922-W1029 HydrophobicContact CB-CZ3 4.48Å
923	I	89.2	Confident	87.9	Confident	43 Å²	43	39.9 Å²	39.9	22%	0.221	21%	0.206	C	C	.	.	H	α-helix	trans	-47.9	-55.6	170.8	-77.3	165.2	0	0	0	112.3	Q919 L925 V926 V927 W1029 F1034	Q919-I923 VanDerWaalsContact O-CG1 3.27Å; Q919-I923 WeakPolarHBondContact O-CG1 3.26Å; Q919-I923 PolarHBondContact O-N 2.91Å; I923-L925 VanDerWaalsContact C-N 3.31Å; I923-L925 PolarHBondContact O-N 3.08Å; I923-V926 PolarHBondContact O-N 3.16Å; I923-V927 WeakPolarHBondContact O-CG2 3.39Å; I923-V927 PolarHBondContact O-N 2.9Å; I923-W1029 HydrophobicContact CD1-CZ2 4Å; I923-W1029 HydrophobicContact CG1-CH2 3.67Å; I923-W1029 HydrophobicContact CG1-CZ2 3.39Å; I923-F1034 HydrophobicContact CB-CZ 4.36Å; I923-F1034 HydrophobicContact CG1-CE1 4.06Å; I923-F1034 HydrophobicContact CG1-CE2 4.49Å; I923-F1034 HydrophobicContact CG1-CZ 4.04Å; I923-F1034 HydrophobicContact CG2-CE2 4.12Å; I923-F1034 HydrophobicContact CG2-CZ 3.95Å
924	P	88.5	Confident	87.7	Confident	75 Å²	75	38.3 Å²	38.3	49%	0.487	19%	0.191	S	C	.	.	H	α-helix	trans	-65.6	-33.7	-178.4	25.2	-34.3	0	0	0	112.5	D920 R928	D920-P924 VanDerWaalsContact O-CD 3.22Å; D920-P924 WeakPolarHBondContact O-CD 3.1Å; P924-R928 WeakPolarHBondContact O-CB 3.45Å; P924-R928 PolarHBondContact O-N 3.14Å
925	L	86.4	Confident	87.5	Confident	49 Å²	49	41.1 Å²	41.1	26%	0.257	21%	0.208	S	C	.	.	H	α-helix	trans	-66.8	-46.1	177	-67.4	172	0	0	0	111.7	W890 F893 F922 I923 R928 Y929	W890-L925 HydrophobicContact CZ3-CB 4.12Å; W890-L925 HydrophobicContact CZ3-CD2 3.92Å; W890-L925 WeakPolarHBondContact CZ3-O 3.36Å; F893-L925 HydrophobicContact CE1-CB 4.16Å; F893-L925 HydrophobicContact CZ-CB 4.33Å; F922-L925 HydrophobicContact CD1-CD1 3.84Å; F922-L925 HydrophobicContact CE1-CD1 4.01Å; F922-L925 HydrophobicContact CG-CD1 4.34Å; F922-L925 PolarHBondContact O-N 3.24Å; I923-L925 VanDerWaalsContact C-N 3.31Å; I923-L925 PolarHBondContact O-N 3.08Å; L925-R928 PolarHBondContact O-N 3.45Å; L925-Y929 WeakPolarHBondContact O-CB 3.34Å; L925-Y929 PolarHBondContact O-N 3.04Å
926	V	87.2	Confident	87.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-44	177.5	172.6	0	0	0	0	111.2	F893 F922 I923 I930 L1027 W1029 L1038	F893-V926 HydrophobicContact CD1-CG2 4.44Å; F893-V926 HydrophobicContact CE1-CG2 3.68Å; F893-V926 HydrophobicContact CZ-CG2 4.36Å; F922-V926 WeakPolarHBondContact O-CG2 3.36Å; F922-V926 PolarHBondContact O-N 3.19Å; I923-V926 PolarHBondContact O-N 3.16Å; V926-I930 HydrophobicContact CG1-CD1 3.95Å; V926-I930 VanDerWaalsContact O-CG1 3.31Å; V926-I930 WeakPolarHBondContact O-CG1 3.33Å; V926-I930 PolarHBondContact O-N 3.48Å; V926-I930 VanDerWaalsContact O-N 3.08Å; V926-L1027 HydrophobicContact CB-CD1 4.48Å; V926-L1027 HydrophobicContact CG1-CD1 3.79Å; V926-L1027 HydrophobicContact CG2-CD1 3.76Å; V926-L1027 HydrophobicContact CG2-CD2 4.36Å; V926-W1029 HydrophobicContact CG2-CZ3 4.15Å; V926-L1038 HydrophobicContact CG1-CD1 4.02Å; V926-L1038 HydrophobicContact CG1-CD2 4.2Å
927	V	87.6	Confident	86.8	Confident	39 Å²	39	37 Å²	37	24%	0.236	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-46.9	176.6	174.3	0	0	0	0	110.8	I923 Y929 I930 D931 F1034	I923-V927 WeakPolarHBondContact O-CG2 3.39Å; I923-V927 PolarHBondContact O-N 2.9Å; V927-Y929 PolarHBondContact O-N 3.13Å; V927-I930 PolarHBondContact O-N 2.82Å; V927-I930 VanDerWaalsContact O-N 3.16Å; V927-D931 PolarHBondContact O-N 2.71Å; V927-F1034 HydrophobicContact CG2-CE2 4.32Å; V927-F1034 HydrophobicContact CG2-CZ 3.94Å
928	R	87.4	Confident	86.4	Confident	107 Å²	107	37.5 Å²	37.5	40%	0.404	20%	0.202	S	C	.	.	H	α-helix	trans	-61.4	-41.3	179.1	177.5	61.6	175.2	176.4	1.6	112.7	D888 W890 P924 L925 D931 L932	D888-R928 VanDerWaalsContact OD1-CG 3.32Å; D888-R928 WeakPolarHBondContact OD1-CG 3.22Å; D888-R928 IonicContact OD1-CZ 2.68Å; D888-R928 IonicContact OD1-NE 3.41Å; D888-R928 PolarHBondContact OD1-NE 3.45Å; D888-R928 IonicContact OD1-NH2 3.35Å; D888-R928 PolarHBondContact OD1-NH2 3.01Å; D888-R928 IonicContact OD2-CZ 2.68Å; D888-R928 IonicContact OD2-NE 2.72Å; D888-R928 IonicContact OD2-NH2 2.74Å; D888-R928 PolarHBondContact OD2-NH2 2.96Å; W890-R928 HydrophobicContact CH2-CB 4.05Å; W890-R928 HydrophobicContact CH2-CG 3.66Å; W890-R928 HydrophobicContact CZ2-CG 4.23Å; P924-R928 WeakPolarHBondContact O-CB 3.45Å; P924-R928 PolarHBondContact O-N 3.14Å; L925-R928 PolarHBondContact O-N 3.45Å; R928-D931 PolarHBondContact O-N 3.48Å; R928-L932 HydrophobicContact CG-CD1 4.21Å; R928-L932 WeakPolarHBondContact O-CB 3.38Å; R928-L932 WeakPolarHBondContact O-CG 3.43Å; R928-L932 PolarHBondContact O-N 2.92Å
929	Y	85.6	Confident	86	Confident	28 Å²	28	40 Å²	40	11%	0.11	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-43.8	174.1	177.2	-105.2	0	0	0	111.5	W890 F893 L925 V927 L932 M933 L1020 F1023	W890-Y929 AromaticContact CD1-CD2 3.82Å; W890-Y929 AromaticContact CD2-CD2 3.72Å; W890-Y929 HydrophobicContact CD2-CD2 3.72Å; W890-Y929 HydrophobicContact CD2-CG 4.36Å; W890-Y929 AromaticContact CE2-CD2 3.84Å; W890-Y929 HydrophobicContact CE3-CD2 4.35Å; W890-Y929 AromaticContact CG-CD2 3.75Å; W890-Y929 HydrophobicContact CG-CD2 3.75Å; W890-Y929 HydrophobicContact CG-CE2 4.2Å; W890-Y929 AromaticContact NE1-CD2 3.86Å; F893-Y929 HydrophobicContact CE2-CD1 4.5Å; F893-Y929 HydrophobicContact CE2-CD2 4.32Å; F893-Y929 HydrophobicContact CE2-CG 4.09Å; F893-Y929 HydrophobicContact CZ-CG 4.42Å; L925-Y929 WeakPolarHBondContact O-CB 3.34Å; L925-Y929 PolarHBondContact O-N 3.04Å; V927-Y929 PolarHBondContact O-N 3.13Å; Y929-L932 PolarHBondContact O-N 3.07Å; Y929-M933 HydrophobicContact CD1-CG 4.39Å; Y929-M933 HydrophobicContact CD2-CG 4.35Å; Y929-M933 HydrophobicContact CE1-CG 4.01Å; Y929-M933 HydrophobicContact CE2-CG 3.94Å; Y929-M933 HydrophobicContact CE2-SD 4.48Å; Y929-M933 WeakPolarHBondContact O-CB 3.35Å; Y929-M933 WeakPolarHBondContact O-CG 3.39Å; Y929-M933 PolarHBondContact O-N 2.99Å; Y929-L1020 HydrophobicContact CD1-CD1 4.14Å; Y929-L1020 HydrophobicContact CE1-CD1 3.65Å; Y929-F1023 AromaticContact CD1-CD1 3.85Å; Y929-F1023 HydrophobicContact CD1-CD1 3.85Å; Y929-F1023 AromaticContact CD1-CE1 3.4Å; Y929-F1023 HydrophobicContact CD1-CE1 3.4Å; Y929-F1023 AromaticContact CD1-CZ 3.78Å; Y929-F1023 HydrophobicContact CD1-CZ 3.78Å; Y929-F1023 AromaticContact CE1-CD1 3.62Å; Y929-F1023 HydrophobicContact CE1-CD1 3.62Å; Y929-F1023 HydrophobicContact CE1-CD2 4.32Å; Y929-F1023 AromaticContact CE1-CE1 3.64Å; Y929-F1023 HydrophobicContact CE1-CE1 3.64Å; Y929-F1023 HydrophobicContact CE1-CE2 4.34Å; Y929-F1023 AromaticContact CE1-CG 3.98Å; Y929-F1023 HydrophobicContact CE1-CG 3.98Å; Y929-F1023 HydrophobicContact CE1-CZ 4.01Å; Y929-F1023 HydrophobicContact CG-CE1 4.46Å
930	I	86.1	Confident	85.6	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-44	175.8	-67.8	165.8	0	0	0	111.2	V926 V927 L932 M933 E934 L1020 V1024 L1038	V926-I930 HydrophobicContact CG1-CD1 3.95Å; V926-I930 VanDerWaalsContact O-CG1 3.31Å; V926-I930 WeakPolarHBondContact O-CG1 3.33Å; V926-I930 PolarHBondContact O-N 3.48Å; V926-I930 VanDerWaalsContact O-N 3.08Å; V927-I930 PolarHBondContact O-N 2.82Å; V927-I930 VanDerWaalsContact O-N 3.16Å; I930-L932 VanDerWaalsContact C-N 3.3Å; I930-L932 PolarHBondContact O-N 3.16Å; I930-M933 PolarHBondContact O-N 3.45Å; I930-E934 WeakPolarHBondContact O-CB 3.39Å; I930-E934 PolarHBondContact O-N 3.3Å; I930-L1020 HydrophobicContact CG1-CD1 4.27Å; I930-V1024 HydrophobicContact CD1-CG2 4.16Å; I930-L1038 HydrophobicContact CD1-CD2 3.74Å
931	D	86.4	Confident	85	Confident	55 Å²	55	36.2 Å²	36.2	29%	0.294	20%	0.196	S	C	.	.	H	α-helix	trans	-58.1	-41.5	176.6	-63.7	-22.5	0	0	0	112.2	V927 R928 T935 R1041	V927-D931 PolarHBondContact O-N 2.71Å; R928-D931 PolarHBondContact O-N 3.48Å; D931-T935 WeakPolarHBondContact O-CB 3.42Å; D931-T935 PolarHBondContact O-N 2.9Å; D931-T935 PolarHBondContact O-OG1 3.44Å; D931-R1041 IonicContact OD1-CZ 2.75Å; D931-R1041 IonicContact OD1-NH1 2.65Å; D931-R1041 PolarHBondContact OD1-NH1 3.21Å; D931-R1041 IonicContact OD1-NH2 2.77Å; D931-R1041 PolarHBondContact OD1-NH2 2.77Å
932	L	86.1	Confident	84.6	Confident	18 Å²	18	38.6 Å²	38.6	9%	0.094	21%	0.205	C	C	.	.	H	α-helix	trans	-74.3	-40.1	179.8	-74	173.2	0	0	0	112.2	D888 W890 R928 Y929 I930 T935 S936 F981	D888-L932 HydrophobicContact CB-CD1 4.27Å; W890-L932 HydrophobicContact CZ2-CD1 3.87Å; R928-L932 HydrophobicContact CG-CD1 4.21Å; R928-L932 WeakPolarHBondContact O-CB 3.38Å; R928-L932 WeakPolarHBondContact O-CG 3.43Å; R928-L932 PolarHBondContact O-N 2.92Å; Y929-L932 PolarHBondContact O-N 3.07Å; I930-L932 VanDerWaalsContact C-N 3.3Å; I930-L932 PolarHBondContact O-N 3.16Å; L932-T935 PolarHBondContact O-N 2.74Å; L932-S936 WeakPolarHBondContact O-CB 3.38Å; L932-S936 PolarHBondContact O-N 3.43Å; L932-F981 HydrophobicContact CB-CE1 4.33Å; L932-F981 HydrophobicContact CB-CZ 4.17Å
933	M	83.4	Confident	84	Confident	17 Å²	17	45.8 Å²	45.8	8%	0.084	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-40.5	172	-76.7	-67.8	-73.1	0	0	111.5	Y929 I930 T935 S936 I937 L1020	Y929-M933 HydrophobicContact CD1-CG 4.39Å; Y929-M933 HydrophobicContact CD2-CG 4.35Å; Y929-M933 HydrophobicContact CE1-CG 4.01Å; Y929-M933 HydrophobicContact CE2-CG 3.94Å; Y929-M933 HydrophobicContact CE2-SD 4.48Å; Y929-M933 WeakPolarHBondContact O-CB 3.35Å; Y929-M933 WeakPolarHBondContact O-CG 3.39Å; Y929-M933 PolarHBondContact O-N 2.99Å; I930-M933 PolarHBondContact O-N 3.45Å; M933-T935 PolarHBondContact O-N 3.16Å; M933-S936 PolarHBondContact O-N 2.84Å; M933-I937 WeakPolarHBondContact O-CB 3.19Å; M933-I937 VanDerWaalsContact O-CG1 3.22Å; M933-I937 WeakPolarHBondContact O-CG1 3.38Å; M933-I937 PolarHBondContact O-N 2.87Å; M933-L1020 HydrophobicContact CB-CD1 4.31Å; M933-L1020 HydrophobicContact CB-CD2 3.97Å; M933-L1020 HydrophobicContact CE-CB 4.45Å; M933-L1020 HydrophobicContact CG-CD1 4.3Å
934	E	84.2	Confident	83.1	Confident	62 Å²	62	44.6 Å²	44.6	29%	0.29	23%	0.23	S	C	.	.	H	α-helix	trans	-58.3	-49.5	174.9	-178.6	165	179.6	0	0	110.8	I930 S936 A938 R1041 M1045 M1049	I930-E934 WeakPolarHBondContact O-CB 3.39Å; I930-E934 PolarHBondContact O-N 3.3Å; E934-S936 PolarHBondContact O-N 3.22Å; E934-A938 VanDerWaalsContact O-CB 3.31Å; E934-A938 WeakPolarHBondContact O-CB 3.22Å; E934-A938 PolarHBondContact O-N 2.92Å; E934-R1041 IonicContact OE2-CZ 2.87Å; E934-R1041 IonicContact OE2-NE 2.66Å; E934-R1041 PolarHBondContact OE2-NE 2.68Å; E934-R1041 IonicContact OE2-NH2 3.46Å; E934-R1041 PolarHBondContact OE2-NH2 2.9Å; E934-M1045 HydrophobicContact CB-CG 4.35Å; E934-M1045 HydrophobicContact CB-SD 3.56Å; E934-M1045 VanDerWaalsContact CB-SD 3.56Å; E934-M1045 HydrophobicContact CG-CG 3.78Å; E934-M1045 HydrophobicContact CG-SD 3.68Å; E934-M1049 HydrophobicContact CB-CE 4.35Å; E934-M1049 HydrophobicContact CG-CE 3.84Å; E934-M1049 WeakPolarHBondContact O-CE 3.41Å
935	T	84.9	Confident	82.3	Confident	63 Å²	63	42.1 Å²	42.1	39%	0.387	21%	0.212	S	C	.	.	H	α-helix	trans	-62.3	-41.3	175.4	-58.4	0	0	0	0	112.3	D931 L932 M933 Q939	D931-T935 WeakPolarHBondContact O-CB 3.42Å; D931-T935 PolarHBondContact O-N 2.9Å; D931-T935 PolarHBondContact O-OG1 3.44Å; L932-T935 PolarHBondContact O-N 2.74Å; M933-T935 PolarHBondContact O-N 3.16Å; T935-Q939 WeakPolarHBondContact O-CB 3.31Å; T935-Q939 WeakPolarHBondContact O-CG 3.18Å; T935-Q939 PolarHBondContact O-N 3.02Å
936	S	83.6	Confident	81.5	Confident	19 Å²	19	46.9 Å²	46.9	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-47.3	-179.4	-175.1	0	0	0	0	111.6	L932 M933 E934 Q939 S940	L932-S936 WeakPolarHBondContact O-CB 3.38Å; L932-S936 PolarHBondContact O-N 3.43Å; M933-S936 PolarHBondContact O-N 2.84Å; E934-S936 PolarHBondContact O-N 3.22Å; S936-Q939 PolarHBondContact O-N 2.78Å; S936-S940 PolarHBondContact O-N 3.36Å
937	I	80.8	Confident	80.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.9	-43.2	177.2	-62.1	162.7	0	0	0	110.3	M933 Q939 S940 I941 L1013 K1016 L1017 L1020 M1049	M933-I937 WeakPolarHBondContact O-CB 3.19Å; M933-I937 VanDerWaalsContact O-CG1 3.22Å; M933-I937 WeakPolarHBondContact O-CG1 3.38Å; M933-I937 PolarHBondContact O-N 2.87Å; I937-Q939 VanDerWaalsContact C-N 3.32Å; I937-Q939 PolarHBondContact O-N 3.34Å; I937-S940 WeakPolarHBondContact O-CB 3.37Å; I937-S940 PolarHBondContact O-N 2.79Å; I937-I941 HydrophobicContact CG2-CD1 4.12Å; I937-I941 HydrophobicContact CG2-CG1 4.49Å; I937-I941 WeakPolarHBondContact O-CG1 3.47Å; I937-I941 PolarHBondContact O-N 3.36Å; I937-L1013 HydrophobicContact CG2-CD1 3.29Å; I937-K1016 HydrophobicContact CD1-CB 3.97Å; I937-K1016 HydrophobicContact CG1-CB 3.8Å; I937-K1016 HydrophobicContact CG1-CD 4.07Å; I937-K1016 HydrophobicContact CG1-CG 4.47Å; I937-L1017 HydrophobicContact CD1-CD2 4.17Å; I937-L1020 HydrophobicContact CD1-CD2 4.46Å; I937-M1049 HydrophobicContact CB-CE 3.91Å; I937-M1049 HydrophobicContact CB-SD 3.81Å; I937-M1049 HydrophobicContact CD1-SD 4.2Å; I937-M1049 HydrophobicContact CG2-CE 4.06Å; I937-M1049 HydrophobicContact CG2-CG 4.2Å; I937-M1049 HydrophobicContact CG2-SD 3.36Å; I937-M1049 WeakPolarHBondContact CG2-SD 3.44Å
938	A	82	Confident	79.5	Confident	38 Å²	38	53.7 Å²	53.7	31%	0.314	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-41.5	174.5	0	0	0	0	0	112.2	E934 I941 H942	E934-A938 VanDerWaalsContact O-CB 3.31Å; E934-A938 WeakPolarHBondContact O-CB 3.22Å; E934-A938 PolarHBondContact O-N 2.92Å; A938-I941 PolarHBondContact O-N 3.4Å; A938-H942 PolarHBondContact O-CD2 2.82Å; A938-H942 PolarHBondContact O-N 3.08Å
939	Q	81.4	Confident	78.5	Confident	53 Å²	53	52.5 Å²	52.5	25%	0.248	27%	0.267	C	S	.	.	H	α-helix	trans	-66.9	-39	174.1	-75.5	-172.4	47	0	0	113	T935 S936 I937 H942 R943 M978	T935-Q939 WeakPolarHBondContact O-CB 3.31Å; T935-Q939 WeakPolarHBondContact O-CG 3.18Å; T935-Q939 PolarHBondContact O-N 3.02Å; S936-Q939 PolarHBondContact O-N 2.78Å; I937-Q939 VanDerWaalsContact C-N 3.32Å; I937-Q939 PolarHBondContact O-N 3.34Å; Q939-H942 PolarHBondContact O-N 3.06Å; Q939-R943 PolarHBondContact O-N 3.31Å; Q939-M978 PolarHBondContact NE2-SD 3.28Å; Q939-M978 VanDerWaalsContact NE2-SD 3.44Å
940	S	79.8	Confident	77.8	Confident	30 Å²	30	52 Å²	52	21%	0.21	27%	0.265	C	S	.	.	H	α-helix	trans	-56.7	-47.8	171.2	-100.3	0	0	0	0	110.9	S936 I937 H942 G944 D1012 K1016	S936-S940 PolarHBondContact O-N 3.36Å; I937-S940 WeakPolarHBondContact O-CB 3.37Å; I937-S940 PolarHBondContact O-N 2.79Å; S940-H942 PolarHBondContact O-N 3.39Å; S940-G944 VanDerWaalsContact O-CA 3.31Å; S940-G944 WeakPolarHBondContact O-CA 3.46Å; S940-G944 PolarHBondContact O-N 2.8Å; S940-D1012 PolarHBondContact OG-OD2 3.33Å; S940-K1016 PolarHBondContact OG-NZ 2.88Å
941	I	78.2	Confident	76.8	Confident	4 Å²	4	56 Å²	56	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-41.2	177.6	-62.2	166.7	0	0	0	111.1	I937 A938 F945 L1013 M1049 A1052	I937-I941 HydrophobicContact CG2-CD1 4.12Å; I937-I941 HydrophobicContact CG2-CG1 4.49Å; I937-I941 WeakPolarHBondContact O-CG1 3.47Å; I937-I941 PolarHBondContact O-N 3.36Å; A938-I941 PolarHBondContact O-N 3.4Å; I941-F945 HydrophobicContact CG2-CD2 3.94Å; I941-F945 HydrophobicContact CG2-CE2 4.26Å; I941-F945 WeakPolarHBondContact O-CB 3.49Å; I941-F945 WeakPolarHBondContact O-CD2 3.44Å; I941-F945 PolarHBondContact O-N 3.36Å; I941-L1013 HydrophobicContact CD1-CD1 3.79Å; I941-L1013 HydrophobicContact CD1-CD2 4.23Å; I941-L1013 HydrophobicContact CG1-CD1 4Å; I941-L1013 HydrophobicContact CG1-CD2 4.17Å; I941-M1049 HydrophobicContact CD1-CB 3.82Å; I941-M1049 HydrophobicContact CD1-CG 3.92Å; I941-A1052 HydrophobicContact CG2-CB 4.43Å
942	H	78.3	Confident	75.4	Confident	102 Å²	102	54 Å²	54	47%	0.472	27%	0.274	S	S	.	.	H	α-helix	trans	-66.4	-59.1	178.4	-91.2	-90.6	0	0	0	112.4	A938 Q939 S940 E946 R1056	A938-H942 PolarHBondContact O-CD2 2.82Å; A938-H942 PolarHBondContact O-N 3.08Å; Q939-H942 PolarHBondContact O-N 3.06Å; S940-H942 PolarHBondContact O-N 3.39Å; H942-E946 VanDerWaalsContact O-CG 3.32Å; H942-E946 WeakPolarHBondContact O-CG 3.47Å; H942-E946 PolarHBondContact O-N 3.44Å; H942-R1056 PolarHBondContact CD2-NH2 3.1Å; H942-R1056 PolarHBondContact CE1-NH2 3.29Å; H942-R1056 PolarHBondContact ND1-NH2 3.38Å; H942-R1056 PolarHBondContact NE2-NH2 2.98Å
943	R	76.3	Confident	74	Confident	152 Å²	152	54.4 Å²	54.4	57%	0.574	28%	0.277	S	S	*	.	H	α-helix	trans	-73.7	-35.9	-174.1	-66.5	-177.7	179.8	134.8	5.3	113.1	Q939 E946 Q947	Q939-R943 PolarHBondContact O-N 3.31Å; R943-E946 PolarHBondContact O-N 3.07Å; R943-Q947 PolarHBondContact O-N 3.38Å
944	G	71.9	Confident	72.4	Confident	18 Å²	18	59 Å²	59	19%	0.186	29%	0.293	C	S	.	.	H	α-helix	trans	-64.7	-52.3	-179	0	0	0	0	0	111.7	S940 E946 Q947 E948	S940-G944 VanDerWaalsContact O-CA 3.31Å; S940-G944 WeakPolarHBondContact O-CA 3.46Å; S940-G944 PolarHBondContact O-N 2.8Å; G944-E946 VanDerWaalsContact C-N 3.25Å; G944-E946 PolarHBondContact O-N 2.97Å; G944-Q947 CarbonylContact O-C 3.57Å; G944-Q947 PolarHBondContact O-N 2.72Å; G944-E948 WeakPolarHBondContact O-CA 3.48Å; G944-E948 WeakPolarHBondContact O-CB 3.12Å; G944-E948 PolarHBondContact O-N 3.04Å
945	F	71.5	Confident	70.2	Confident	23 Å²	23	59.8 Å²	59.8	10%	0.101	30%	0.299	C	S	.	.	H	α-helix	trans	-69.7	-17.6	179.5	-76.3	-73.5	0	0	0	114.3	I941 E948 W950 T1009 C1053 R1056	I941-F945 HydrophobicContact CG2-CD2 3.94Å; I941-F945 HydrophobicContact CG2-CE2 4.26Å; I941-F945 WeakPolarHBondContact O-CB 3.49Å; I941-F945 WeakPolarHBondContact O-CD2 3.44Å; I941-F945 PolarHBondContact O-N 3.36Å; F945-E948 HydrophobicContact CD1-CB 4.43Å; F945-E948 HydrophobicContact CD1-CG 4.47Å; F945-W950 AromaticContact CD1-CH2 3.57Å; F945-W950 HydrophobicContact CD1-CH2 3.57Å; F945-W950 AromaticContact CD1-CZ2 3.76Å; F945-W950 HydrophobicContact CD1-CZ2 3.76Å; F945-W950 AromaticContact CE1-CH2 3.46Å; F945-W950 HydrophobicContact CE1-CH2 3.46Å; F945-W950 VanDerWaalsContact CE1-CH2 3.46Å; F945-W950 HydrophobicContact CE1-CZ2 4.13Å; F945-W950 HydrophobicContact CE1-CZ3 4.08Å; F945-T1009 HydrophobicContact CD2-CG2 3.68Å; F945-T1009 HydrophobicContact CE2-CG2 3.61Å; F945-T1009 HydrophobicContact CG-CG2 4.19Å; F945-T1009 HydrophobicContact CZ-CG2 4.07Å; F945-C1053 HydrophobicContact CE2-CB 4.31Å; F945-C1053 HydrophobicContact CZ-CB 4.47Å; F945-C1053 VanDerWaalsContact CZ-SG 3.53Å; F945-R1056 HydrophobicContact CB-CB 4.29Å; F945-R1056 HydrophobicContact CD1-CB 4.44Å; F945-R1056 HydrophobicContact CG-CB 4.18Å
946	E	68	Low	68.2	Low	149 Å²	149	61 Å²	61	70%	0.696	30%	0.303	S	S	*	.	H	α-helix	trans	-74	-28.2	168.5	-77.3	171.1	-171.7	0	0	112.9	H942 R943 G944	H942-E946 VanDerWaalsContact O-CG 3.32Å; H942-E946 WeakPolarHBondContact O-CG 3.47Å; H942-E946 PolarHBondContact O-N 3.44Å; R943-E946 PolarHBondContact O-N 3.07Å; G944-E946 VanDerWaalsContact C-N 3.25Å; G944-E946 PolarHBondContact O-N 2.97Å
947	Q	64.6	Low	66.3	Low	155 Å²	155	64.8 Å²	64.8	72%	0.724	33%	0.325	S	S	*	.	H	α-helix	trans	-105.6	-2.3	-179.8	-60.7	-177.6	12.7	0	0	113.1	R943 G944 T949	R943-Q947 PolarHBondContact O-N 3.38Å; G944-Q947 CarbonylContact O-C 3.57Å; G944-Q947 PolarHBondContact O-N 2.72Å; Q947-T949 PolarHBondContact O-N 2.76Å
948	E	69.8	Low	64.1	Low	26 Å²	26	70.7 Å²	70.7	12%	0.121	36%	0.357	C	S	.	.			trans	-64.4	122.6	-172.2	-178	55.9	-93.5	0	0	111.8	G944 F945 W950 S1007 T1009	G944-E948 WeakPolarHBondContact O-CA 3.48Å; G944-E948 WeakPolarHBondContact O-CB 3.12Å; G944-E948 PolarHBondContact O-N 3.04Å; F945-E948 HydrophobicContact CD1-CB 4.43Å; F945-E948 HydrophobicContact CD1-CG 4.47Å; E948-W950 HydrophobicContact CB-CZ2 4.34Å; E948-W950 HydrophobicContact CG-CD2 3.61Å; E948-W950 VanDerWaalsContact CG-CE2 3.49Å; E948-W950 HydrophobicContact CG-CE3 4.09Å; E948-W950 HydrophobicContact CG-CG 3.9Å; E948-W950 HydrophobicContact CG-CH2 4.36Å; E948-W950 HydrophobicContact CG-CZ2 3.91Å; E948-W950 HydrophobicContact CG-CZ3 4.44Å; E948-W950 PolarHBondContact O-NE1 3.21Å; E948-W950 PolarHBondContact OE1-N 3.23Å; E948-S1007 WeakPolarHBondContact OE2-CB 3.32Å; E948-S1007 PolarHBondContact OE2-OG 3.23Å; E948-T1009 VanDerWaalsContact OE2-CB 3.28Å; E948-T1009 WeakPolarHBondContact OE2-CB 3.37Å; E948-T1009 PolarHBondContact OE2-N 3.46Å; E948-T1009 PolarHBondContact OE2-OG1 3.1Å
949	T	65.1	Low	61.9	Low	82 Å²	82	74.7 Å²	74.7	50%	0.503	37%	0.373	S	S	.	.			trans	-90.5	-14.2	-179.1	60.4	0	0	0	0	112.3	Q947 H951	Q947-T949 PolarHBondContact O-N 2.76Å; T949-H951 VanDerWaalsContact C-N 3.33Å; T949-H951 WeakPolarHBondContact CB-ND1 3.32Å; T949-H951 PolarHBondContact OG1-ND1 3.22Å
950	W	71.6	Confident	59.8	Low	18 Å²	18	79.5 Å²	79.5	7%	0.068	40%	0.399	C	S	.	.			trans	63.3	36.1	178.5	-52.9	86.3	0	0	0	113.2	F945 E948 T1057 A1060 S1079 M1083	F945-W950 AromaticContact CD1-CH2 3.57Å; F945-W950 HydrophobicContact CD1-CH2 3.57Å; F945-W950 AromaticContact CD1-CZ2 3.76Å; F945-W950 HydrophobicContact CD1-CZ2 3.76Å; F945-W950 AromaticContact CE1-CH2 3.46Å; F945-W950 HydrophobicContact CE1-CH2 3.46Å; F945-W950 VanDerWaalsContact CE1-CH2 3.46Å; F945-W950 HydrophobicContact CE1-CZ2 4.13Å; F945-W950 HydrophobicContact CE1-CZ3 4.08Å; E948-W950 HydrophobicContact CB-CZ2 4.34Å; E948-W950 HydrophobicContact CG-CD2 3.61Å; E948-W950 VanDerWaalsContact CG-CE2 3.49Å; E948-W950 HydrophobicContact CG-CE3 4.09Å; E948-W950 HydrophobicContact CG-CG 3.9Å; E948-W950 HydrophobicContact CG-CH2 4.36Å; E948-W950 HydrophobicContact CG-CZ2 3.91Å; E948-W950 HydrophobicContact CG-CZ3 4.44Å; E948-W950 PolarHBondContact O-NE1 3.21Å; E948-W950 PolarHBondContact OE1-N 3.23Å; W950-T1057 HydrophobicContact CH2-CG2 4.02Å; W950-T1057 HydrophobicContact CZ3-CG2 3.87Å; W950-A1060 HydrophobicContact CH2-CB 4.11Å; W950-A1060 HydrophobicContact CZ2-CB 3.37Å; W950-S1079 WeakPolarHBondContact O-CA 3.29Å; W950-S1079 WeakPolarHBondContact O-CB 3.47Å; W950-M1083 HydrophobicContact CB-CE 4.45Å; W950-M1083 HydrophobicContact CD2-CE 3.46Å; W950-M1083 VanDerWaalsContact CD2-CE 3.46Å; W950-M1083 HydrophobicContact CD2-CG 3.91Å; W950-M1083 HydrophobicContact CE3-CB 4.44Å; W950-M1083 HydrophobicContact CE3-CE 3.93Å; W950-M1083 HydrophobicContact CE3-CG 3.35Å; W950-M1083 HydrophobicContact CG-CE 3.7Å; W950-M1083 HydrophobicContact CH2-CG 4.44Å; W950-M1083 HydrophobicContact CZ2-CE 4.2Å; W950-M1083 HydrophobicContact CZ3-CE 4.46Å; W950-M1083 HydrophobicContact CZ3-CG 3.67Å
951	H	65	Low	57.5	Low	92 Å²	92	83 Å²	83	43%	0.426	43%	0.43	S	S	.	.			trans	-85.5	136.3	164.4	-62.2	98.3	0	0	0	109.3	T949	T949-H951 VanDerWaalsContact C-N 3.33Å; T949-H951 WeakPolarHBondContact CB-ND1 3.32Å; T949-H951 PolarHBondContact OG1-ND1 3.22Å
952	S	56.3	Low	55.4	Low	14 Å²	14	87.7 Å²	87.7	10%	0.098	46%	0.463	C	S	.	.			trans	-61.6	140.5	167	177.5	0	0	0	0	109.8	R954 L955 T1082	S952-R954 PolarHBondContact O-N 2.88Å; S952-L955 WeakPolarHBondContact O-CB 3.38Å; S952-L955 PolarHBondContact O-N 3.14Å; S952-T1082 PolarHBondContact N-OG1 3.29Å
953	V	57.5	Low	53	Low	26 Å²	26	88.7 Å²	88.7	16%	0.158	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-52.7	-30.5	-177.8	-179.3	0	0	0	0	112.7	L955 L956 F1004 E1011	V953-L955 PolarHBondContact O-N 2.68Å; V953-L956 PolarHBondContact O-N 3.35Å; V953-L956 VanDerWaalsContact O-N 3.12Å; V953-F1004 HydrophobicContact CB-CB 4.38Å; V953-F1004 HydrophobicContact CB-CD1 4.36Å; V953-F1004 HydrophobicContact CG1-CD1 4.13Å; V953-F1004 HydrophobicContact CG1-CG 4.42Å; V953-E1011 HydrophobicContact CG2-CG 4.18Å
954	R	50.5	Low	50.6	Low	112 Å²	112	87 Å²	87	42%	0.423	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-56.8	-16.6	174.9	-58.7	-174.8	-166.5	-158	-0.2	115.4	S952 T957 P1001 F1004 N1005	S952-R954 PolarHBondContact O-N 2.88Å; R954-T957 PolarHBondContact O-OG1 3.48Å; R954-P1001 PolarHBondContact NH1-O 3.14Å; R954-P1001 PolarHBondContact NH2-O 3.24Å; R954-F1004 HydrophobicContact CG-CB 4.32Å; R954-F1004 PolarHBondContact NE-O 3.49Å; R954-F1004 PolarHBondContact NH2-O 2.89Å; R954-N1005 PolarHBondContact NH2-OD1 2.92Å
955	L	38.1	Very low	48.5	Very low	80 Å²	80	93.9 Å²	93.9	42%	0.419	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-97.1	-21	-178.5	-120.4	151.9	0	0	0	112.9	S952 V953 L1078	S952-L955 WeakPolarHBondContact O-CB 3.38Å; S952-L955 PolarHBondContact O-N 3.14Å; V953-L955 PolarHBondContact O-N 2.68Å; L955-L1078 HydrophobicContact CD1-CD2 3.56Å
956	L	42.6	Very low	46.2	Very low	89 Å²	89	98.3 Å²	98.3	47%	0.466	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-35.1	177.4	-71.1	166.8	0	0	0	111.9	V953 N958	V953-L956 PolarHBondContact O-N 3.35Å; V953-L956 VanDerWaalsContact O-N 3.12Å; L956-N958 PolarHBondContact O-N 3.34Å
957	T	42.1	Very low	44.4	Very low	98 Å²	98	102.9 Å²	102.9	60%	0.601	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-21.3	179.3	53	0	0	0	0	114	R954	R954-T957 PolarHBondContact O-OG1 3.48Å
958	N	35.8	Very low	42.5	Very low	124 Å²	124	103.2 Å²	103.2	66%	0.663	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	1.1	-169.3	-71.6	3.7	0	0	0	115.1	L956	L956-N958 PolarHBondContact O-N 3.34Å
959	N	35.5	Very low	40.2	Very low	121 Å²	121	106.6 Å²	106.6	65%	0.647	59%	0.59	S	S	*	*	S	Bend	trans	-137.9	26	-175.8	-79.7	-70.6	0	0	0	114.8	A961	N959-A961 PolarHBondContact O-N 3.24Å
960	L	36.4	Very low	38.4	Very low	154 Å²	154	107.7 Å²	107.7	81%	0.806	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	36.8	-174.9	-115.7	166.8	0	0	0	114.6
961	A	33.3	Very low	36.1	Very low	103 Å²	103	114.6 Å²	114.6	85%	0.851	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-6.7	-179	0	0	0	0	0	115	N959	N959-A961 PolarHBondContact O-N 3.24Å
962	S	34.2	Very low	34.7	Very low	104 Å²	104	115.4 Å²	115.4	73%	0.727	65%	0.652	S	S	*	*	S	Bend	trans	-154.1	37.8	-165.8	55	0	0	0	0	116.8
963	V	27.5	Very low	33.2	Very low	122 Å²	122	123 Å²	123	74%	0.739	69%	0.69	S	S	*	*			trans	-131.4	120.1	163.8	-174.4	0	0	0	0	110.3
964	P	25.9	Very low	32	Very low	117 Å²	117	128.7 Å²	128.7	76%	0.76	73%	0.726	S	S	*	*			trans	-75	135.1	174.6	30.4	-33.1	0	0	0	111.1
965	L	26.5	Very low	30.7	Very low	162 Å²	162	130.5 Å²	130.5	85%	0.848	74%	0.743	S	S	*	*			trans	-60.2	131.1	172.9	-71.9	164.6	0	0	0	110.6	R967	L965-R967 PolarHBondContact O-N 3.38Å; L965-R967 VanDerWaalsContact O-N 3.16Å
966	P	23.8	Very low	30.1	Very low	116 Å²	116	132.5 Å²	132.5	75%	0.753	76%	0.761	S	S	*	*			trans	-72.1	110.6	-179.2	28.2	-33.6	0	0	0	111.2
967	R	29.6	Very low	29.3	Very low	245 Å²	245	137.3 Å²	137.3	93%	0.925	78%	0.781	S	S	*	*			trans	-72.3	123.5	161.6	-70.3	-178.5	176.5	177.4	-1.6	109.1	L965	L965-R967 PolarHBondContact O-N 3.38Å; L965-R967 VanDerWaalsContact O-N 3.16Å
968	I	25.4	Very low	28.5	Very low	162 Å²	162	137 Å²	137	83%	0.831	77%	0.774	S	S	*	*			trans	-129.5	133.8	160	-61.6	-177	0	0	0	108
969	S	21.7	Very low	28	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	77%	0.766	S	S	*	*			trans	-99.7	138.4	-174.5	-50.8	0	0	0	0	111.6
970	S	26.3	Very low	27.5	Very low	105 Å²	105	134.2 Å²	134.2	73%	0.734	77%	0.771	S	S	*	*			trans	54.7	148.8	141.7	63.5	0	0	0	0	121.9
971	L	24.2	Very low	27.3	Very low	162 Å²	162	130.7 Å²	130.7	85%	0.848	75%	0.75	S	S	*	*			trans	94.3	143	164.1	-61.7	176.7	0	0	0	116.3
972	P	36.1	Very low	27	Very low	110 Å²	110	130.5 Å²	130.5	71%	0.714	74%	0.742	S	S	*	*				-135.6	133.4	-101	35.3	-16.1	0	0	0	115.3
973	L	24.7	Very low	26.7	Very low	172 Å²	172	129.2 Å²	129.2	90%	0.901	73%	0.73	S	S	*	*			trans	-136	128.7	165.8	-76.8	172.5	0	0	0	110.4	L975	L973-L975 PolarHBondContact O-N 3.44Å
974	T	32	Very low	26.9	Very low	147 Å²	147	125 Å²	125	90%	0.902	71%	0.705	S	S	*	*			trans	-78.2	99.2	-178.1	47.2	0	0	0	0	111.4
975	L	24	Very low	27.2	Very low	150 Å²	150	124.4 Å²	124.4	79%	0.785	71%	0.71	S	S	*	*			trans	-116.3	148	155.6	-81.8	164	0	0	0	108	L973 Q977	L973-L975 PolarHBondContact O-N 3.44Å; L975-Q977 PolarHBondContact O-N 2.86Å; L975-Q977 VanDerWaalsContact O-N 3.16Å
976	P	25.4	Very low	28	Very low	121 Å²	121	121.1 Å²	121.1	79%	0.786	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-58.8	121	173.2	-20.9	32.8	0	0	0	109.7	M978	P976-M978 PolarHBondContact O-N 2.94Å
977	Q	25.7	Very low	28.6	Very low	190 Å²	190	118.2 Å²	118.2	89%	0.888	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-66.2	119.9	170.1	-68.9	-178.9	-82.7	0	0	107.8	L975	L975-Q977 PolarHBondContact O-N 2.86Å; L975-Q977 VanDerWaalsContact O-N 3.16Å
978	M	24.6	Very low	28.6	Very low	93 Å²	93	108.4 Å²	108.4	46%	0.458	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-65	141	165.5	-66.1	-164.6	73.5	0	0	108.5	Q939 P976	Q939-M978 PolarHBondContact NE2-SD 3.28Å; Q939-M978 VanDerWaalsContact NE2-SD 3.44Å; P976-M978 PolarHBondContact O-N 2.94Å
979	P	25.8	Very low	28.9	Very low	76 Å²	76	105.3 Å²	105.3	49%	0.494	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-59.3	141.5	177.4	25.3	-34	0	0	0	110.3	F981	P979-F981 HydrophobicContact CG-CE2 4.5Å; P979-F981 HydrophobicContact CG-CZ 4.41Å; P979-F981 WeakPolarHBondContact O-CD2 3.46Å; P979-F981 PolarHBondContact O-N 3.48Å; P979-F981 VanDerWaalsContact O-N 3.13Å
980	S	24.2	Very low	29.5	Very low	109 Å²	109	106.8 Å²	106.8	76%	0.762	63%	0.626	S	S	*	*			trans	-70.6	106	172.5	50.2	0	0	0	0	109.2	S982	S980-S982 PolarHBondContact O-N 2.83Å
981	F	32.4	Very low	30	Very low	81 Å²	81	108 Å²	108	36%	0.355	62%	0.615	S	S	.	*			trans	-68.7	78.5	174	-65.7	-86.7	0	0	0	110.9	L932 P979	L932-F981 HydrophobicContact CB-CE1 4.33Å; L932-F981 HydrophobicContact CB-CZ 4.17Å; P979-F981 HydrophobicContact CG-CE2 4.5Å; P979-F981 HydrophobicContact CG-CZ 4.41Å; P979-F981 WeakPolarHBondContact O-CD2 3.46Å; P979-F981 PolarHBondContact O-N 3.48Å; P979-F981 VanDerWaalsContact O-N 3.13Å
982	S	26.8	Very low	30.2	Very low	98 Å²	98	107 Å²	107	69%	0.685	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-73.3	146.5	162	46.5	0	0	0	0	110.2	S980	S980-S982 PolarHBondContact O-N 2.83Å
983	V	28.2	Very low	29.8	Very low	78 Å²	78	109 Å²	109	47%	0.473	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-62.2	133.4	175	-170.2	0	0	0	0	109.3	A985 F987 W1015	V983-A985 PolarHBondContact O-N 3.48Å; V983-F987 HydrophobicContact CG1-CB 3.73Å; V983-F987 HydrophobicContact CG1-CG 4.48Å; V983-W1015 HydrophobicContact CG1-CH2 4.39Å; V983-W1015 HydrophobicContact CG2-CH2 3.78Å; V983-W1015 HydrophobicContact CG2-CZ2 4.39Å
984	P	32	Very low	30.1	Very low	32 Å²	32	105.4 Å²	105.4	21%	0.208	60%	0.596	C	S	.	*	P	Polyproline II helix	trans	-59.8	136	174.2	-22.6	33.5	0	0	0	111	W986 F987	P984-W986 HydrophobicContact CB-CD2 4.44Å; P984-W986 HydrophobicContact CB-CG 4.33Å; P984-W986 PolarHBondContact O-N 3.45Å; P984-F987 WeakPolarHBondContact O-CB 3.31Å; P984-F987 PolarHBondContact O-N 2.99Å
985	A	32.1	Very low	30.1	Very low	106 Å²	106	102.4 Å²	102.4	88%	0.876	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-18	-173	0	0	0	0	0	114.7	V983 F987	V983-A985 PolarHBondContact O-N 3.48Å; A985-F987 VanDerWaalsContact C-N 3.35Å
986	W	43.5	Very low	30.5	Very low	93 Å²	93	104.3 Å²	104.3	35%	0.352	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.3	-13.6	174.3	61.2	-98.6	0	0	0	113.7	P894 P984 G988 F1023	P894-W986 HydrophobicContact CG-CD2 4.35Å; P894-W986 HydrophobicContact CG-CG 4.16Å; P984-W986 HydrophobicContact CB-CD2 4.44Å; P984-W986 HydrophobicContact CB-CG 4.33Å; P984-W986 PolarHBondContact O-N 3.45Å; W986-G988 VanDerWaalsContact C-N 3.27Å; W986-G988 PolarHBondContact O-N 3.25Å; W986-F1023 HydrophobicContact CH2-CD2 4.29Å
987	F	35.2	Very low	30.8	Very low	55 Å²	55	102 Å²	102	24%	0.241	58%	0.578	C	S	.	*	S	Bend	trans	-77.3	80.5	167.8	-120.1	-95.1	0	0	0	108.8	V983 P984 A985 A1019 M1022	V983-F987 HydrophobicContact CG1-CB 3.73Å; V983-F987 HydrophobicContact CG1-CG 4.48Å; P984-F987 WeakPolarHBondContact O-CB 3.31Å; P984-F987 PolarHBondContact O-N 2.99Å; A985-F987 VanDerWaalsContact C-N 3.35Å; F987-A1019 HydrophobicContact CE1-CB 4.23Å; F987-A1019 HydrophobicContact CZ-CB 4.28Å; F987-M1022 HydrophobicContact CZ-CB 4.45Å
988	G	31.6	Very low	31	Very low	38 Å²	38	98.1 Å²	98.1	39%	0.392	57%	0.567	S	S	.	*			trans	-60.4	168.3	-177.2	0	0	0	0	0	114.3	W986 I990	W986-G988 VanDerWaalsContact C-N 3.27Å; W986-G988 PolarHBondContact O-N 3.25Å; G988-I990 PolarHBondContact O-N 2.85Å
989	P	31.4	Very low	31.1	Very low	97 Å²	97	100.5 Å²	100.5	63%	0.63	58%	0.581	S	S	*	*			trans	-75.4	65.6	-171	32	-37.2	0	0	0	113.7	Y991 E992	P989-Y991 PolarHBondContact O-N 2.95Å; P989-E992 PolarHBondContact O-N 3.4Å
990	I	33.2	Very low	31.5	Very low	130 Å²	130	103.9 Å²	103.9	67%	0.667	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-20	174.4	-65.3	171.2	0	0	0	111.7	G988	G988-I990 PolarHBondContact O-N 2.85Å
991	Y	36.4	Very low	31.9	Very low	129 Å²	129	101.9 Å²	101.9	51%	0.506	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-19.5	-179.5	-134.2	-84	0	0	0	115.2	P989 F1004	P989-Y991 PolarHBondContact O-N 2.95Å; Y991-F1004 AromaticContact CE1-CZ 3.97Å; Y991-F1004 HydrophobicContact CE1-CZ 3.97Å
992	E	28.8	Very low	32.3	Very low	143 Å²	143	103.7 Å²	103.7	67%	0.668	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-45.9	-178.7	-72.8	-167.7	125.3	0	0	113.5	P989 T994 L995	P989-E992 PolarHBondContact O-N 3.4Å; E992-T994 PolarHBondContact O-N 3.22Å; E992-L995 WeakPolarHBondContact O-CB 3.28Å; E992-L995 PolarHBondContact O-N 2.86Å; E992-L995 VanDerWaalsContact O-N 3.09Å
993	N	27.1	Very low	33.2	Very low	150 Å²	150	102.8 Å²	102.8	80%	0.802	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-7.5	-171.6	-87.8	-17.4	0	0	0	115.4	L995	N993-L995 VanDerWaalsContact C-N 3.34Å
994	T	31.9	Very low	34.3	Very low	97 Å²	97	102.6 Å²	102.6	60%	0.595	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-11.5	173.8	-43.5	0	0	0	0	112.6	E992	E992-T994 PolarHBondContact O-N 3.22Å
995	L	33	Very low	35.5	Very low	84 Å²	84	103.7 Å²	103.7	44%	0.44	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	-2.1	-171.3	-86.8	161.2	0	0	0	116.1	E992 N993 L1000 I1003	E992-L995 WeakPolarHBondContact O-CB 3.28Å; E992-L995 PolarHBondContact O-N 2.86Å; E992-L995 VanDerWaalsContact O-N 3.09Å; N993-L995 VanDerWaalsContact C-N 3.34Å; L995-L1000 HydrophobicContact CD2-CD1 4.01Å; L995-I1003 HydrophobicContact CD2-CD1 3.85Å
996	Q	31.8	Very low	37	Very low	191 Å²	191	98.7 Å²	98.7	89%	0.893	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-0.6	-175.5	-118.3	177.8	16.9	0	0	115.6
997	G	31.5	Very low	38.4	Very low	73 Å²	73	94.3 Å²	94.3	75%	0.753	52%	0.518	S	S	*	.	S	Bend	trans	-131.2	-1.5	-173.8	0	0	0	0	0	117.2
998	V	29.2	Very low	40.1	Very low	108 Å²	108	94.1 Å²	94.1	66%	0.655	53%	0.527	S	S	*	.	S	Bend	trans	-131.1	143.2	-173.6	-171.3	0	0	0	0	110.7
999	N	28.3	Very low	42.2	Very low	143 Å²	143	93.1 Å²	93.1	77%	0.765	51%	0.513	S	S	*	.			trans	-61.1	154.9	177.2	-76.2	-77.2	0	0	0	112.2	P1001	N999-P1001 WeakPolarHBondContact O-CD 3.31Å
1000	L	32.7	Very low	44.4	Very low	146 Å²	146	88.5 Å²	88.5	76%	0.764	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	13.4	-164.2	-145	72.1	0	0	0	119.3	L995	L995-L1000 HydrophobicContact CD2-CD1 4.01Å
1001	P	33.5	Very low	46.5	Very low	67 Å²	67	84.2 Å²	84.2	44%	0.435	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-6.9	-173.7	38.6	-35.5	0	0	0	117.3	R954 N999	R954-P1001 PolarHBondContact NH1-O 3.14Å; R954-P1001 PolarHBondContact NH2-O 3.24Å; N999-P1001 WeakPolarHBondContact O-CD 3.31Å
1002	D	39.5	Very low	48.4	Very low	120 Å²	120	80.6 Å²	80.6	64%	0.642	45%	0.45	S	S	*	.	S	Bend	trans	-114.4	-4.3	-161.2	-75.2	-42.1	0	0	0	117.9
1003	I	46.3	Very low	50.9	Low	79 Å²	79	73.9 Å²	73.9	41%	0.405	42%	0.418	S	S	.	.	S	Bend	trans	-85.2	-30.9	-167.2	-66.2	174.6	0	0	0	114.7	L995	L995-I1003 HydrophobicContact CD2-CD1 3.85Å
1004	F	50.5	Low	53.4	Low	74 Å²	74	67.3 Å²	67.3	33%	0.325	38%	0.383	S	S	.	.			trans	-121.5	111.5	-178.2	-67.6	-67	0	0	0	111.7	V953 R954 Y991	V953-F1004 HydrophobicContact CB-CB 4.38Å; V953-F1004 HydrophobicContact CB-CD1 4.36Å; V953-F1004 HydrophobicContact CG1-CD1 4.13Å; V953-F1004 HydrophobicContact CG1-CG 4.42Å; R954-F1004 HydrophobicContact CG-CB 4.32Å; R954-F1004 PolarHBondContact NE-O 3.49Å; R954-F1004 PolarHBondContact NH2-O 2.89Å; Y991-F1004 AromaticContact CE1-CZ 3.97Å; Y991-F1004 HydrophobicContact CE1-CZ 3.97Å
1005	N	57.4	Low	55.8	Low	55 Å²	55	67.9 Å²	67.9	29%	0.294	37%	0.374	S	S	.	.			trans	-128.7	-30.4	-177.6	-79.9	-30	0	0	0	113.2	R954 E1011 N1085	R954-N1005 PolarHBondContact NH2-OD1 2.92Å; N1005-E1011 PolarHBondContact N-OE1 2.75Å; N1005-N1085 HydrophobicContact CB-CB 4.11Å; N1005-N1085 WeakPolarHBondContact O-CB 3.47Å; N1005-N1085 PolarHBondContact O-ND2 2.94Å
1006	G	63.5	Low	58.1	Low	1 Å²	1	65.6 Å²	65.6	1%	0.01	36%	0.361	C	S	.	.	S	Bend	trans	-79.7	-162.1	-178.8	0	0	0	0	0	115.1	E1011	G1006-E1011 WeakPolarHBondContact CA-OE1 3.22Å; G1006-E1011 PolarHBondContact N-OE1 3.37Å
1007	S	74.3	Confident	60.4	Low	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.32	C	S	.	.			trans	-101.7	165.5	168.9	80.2	0	0	0	0	110.6	E948 T1009 S1010 E1011	E948-S1007 WeakPolarHBondContact OE2-CB 3.32Å; E948-S1007 PolarHBondContact OE2-OG 3.23Å; S1007-T1009 PolarHBondContact O-N 3.48Å; S1007-S1010 PolarHBondContact N-OG 2.88Å; S1007-S1010 PolarHBondContact O-N 3.09Å; S1007-S1010 VanDerWaalsContact O-N 3.08Å; S1007-S1010 PolarHBondContact O-OG 2.75Å; S1007-E1011 VanDerWaalsContact O-CG 3.3Å; S1007-E1011 WeakPolarHBondContact O-CG 3.41Å; S1007-E1011 PolarHBondContact O-N 3Å; S1007-E1011 VanDerWaalsContact O-N 3.08Å
1008	A	71.4	Confident	62.5	Low	52 Å²	52	56 Å²	56	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-55.4	-37.4	-180	0	0	0	0	0	112.7	D1012	A1008-D1012 WeakPolarHBondContact O-CB 3.47Å; A1008-D1012 PolarHBondContact O-N 3.03Å
1009	T	75.2	Confident	64.8	Low	17 Å²	17	51.5 Å²	51.5	10%	0.104	27%	0.272	C	S	.	.	H	α-helix	trans	-69.6	-35.8	178.1	-46.1	0	0	0	0	113.2	F945 E948 S1007 L1013	F945-T1009 HydrophobicContact CD2-CG2 3.68Å; F945-T1009 HydrophobicContact CE2-CG2 3.61Å; F945-T1009 HydrophobicContact CG-CG2 4.19Å; F945-T1009 HydrophobicContact CZ-CG2 4.07Å; E948-T1009 VanDerWaalsContact OE2-CB 3.28Å; E948-T1009 WeakPolarHBondContact OE2-CB 3.37Å; E948-T1009 PolarHBondContact OE2-N 3.46Å; E948-T1009 PolarHBondContact OE2-OG1 3.1Å; S1007-T1009 PolarHBondContact O-N 3.48Å; T1009-L1013 WeakPolarHBondContact O-CB 3.3Å; T1009-L1013 PolarHBondContact O-N 2.9Å
1010	S	77.1	Confident	67.3	Low	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-76.1	-38.8	-180	64.3	0	0	0	0	112.5	S1007 L1013 F1014 V1086	S1007-S1010 PolarHBondContact N-OG 2.88Å; S1007-S1010 PolarHBondContact O-N 3.09Å; S1007-S1010 VanDerWaalsContact O-N 3.08Å; S1007-S1010 PolarHBondContact O-OG 2.75Å; S1010-L1013 WeakPolarHBondContact O-CB 3.36Å; S1010-L1013 PolarHBondContact O-N 3.05Å; S1010-F1014 WeakPolarHBondContact O-CD2 3.33Å; S1010-F1014 VanDerWaalsContact O-CG 3.32Å; S1010-F1014 WeakPolarHBondContact O-CG 3.07Å; S1010-F1014 PolarHBondContact O-N 3.26Å; S1010-V1086 WeakPolarHBondContact OG-CG2 3.47Å
1011	E	77.9	Confident	69.5	Low	39 Å²	39	38.7 Å²	38.7	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-68.4	-40.1	179.5	-55.1	-78.4	-174.1	0	0	110.2	V953 N1005 G1006 S1007 L1013 F1014 W1015	V953-E1011 HydrophobicContact CG2-CG 4.18Å; N1005-E1011 PolarHBondContact N-OE1 2.75Å; G1006-E1011 WeakPolarHBondContact CA-OE1 3.22Å; G1006-E1011 PolarHBondContact N-OE1 3.37Å; S1007-E1011 VanDerWaalsContact O-CG 3.3Å; S1007-E1011 WeakPolarHBondContact O-CG 3.41Å; S1007-E1011 PolarHBondContact O-N 3Å; S1007-E1011 VanDerWaalsContact O-N 3.08Å; E1011-L1013 PolarHBondContact O-N 3.09Å; E1011-F1014 PolarHBondContact O-N 3.45Å; E1011-W1015 VanDerWaalsContact O-CB 3.27Å; E1011-W1015 WeakPolarHBondContact O-CB 3.31Å; E1011-W1015 PolarHBondContact O-N 3.05Å
1012	D	76.4	Confident	71.7	Confident	54 Å²	54	39.2 Å²	39.2	29%	0.289	20%	0.202	S	C	.	.	H	α-helix	trans	-58.4	-44	170.7	175.4	62.5	0	0	0	112.5	S940 A1008 K1016	S940-D1012 PolarHBondContact OG-OD2 3.33Å; A1008-D1012 WeakPolarHBondContact O-CB 3.47Å; A1008-D1012 PolarHBondContact O-N 3.03Å; D1012-K1016 WeakPolarHBondContact O-CB 3.42Å; D1012-K1016 WeakPolarHBondContact O-CG 3.27Å; D1012-K1016 PolarHBondContact O-N 3.04Å; D1012-K1016 WeakPolarHBondContact OD1-CE 3.48Å; D1012-K1016 IonicContact OD1-NZ 2.73Å; D1012-K1016 PolarHBondContact OD1-NZ 3.13Å; D1012-K1016 IonicContact OD2-NZ 2.67Å; D1012-K1016 PolarHBondContact OD2-NZ 3.45Å
1013	L	81.1	Confident	73.7	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-53.1	176.1	167.5	61.9	0	0	0	111.9	I937 I941 T1009 S1010 E1011 K1016 L1017 M1049 C1053	I937-L1013 HydrophobicContact CG2-CD1 3.29Å; I941-L1013 HydrophobicContact CD1-CD1 3.79Å; I941-L1013 HydrophobicContact CD1-CD2 4.23Å; I941-L1013 HydrophobicContact CG1-CD1 4Å; I941-L1013 HydrophobicContact CG1-CD2 4.17Å; T1009-L1013 WeakPolarHBondContact O-CB 3.3Å; T1009-L1013 PolarHBondContact O-N 2.9Å; S1010-L1013 WeakPolarHBondContact O-CB 3.36Å; S1010-L1013 PolarHBondContact O-N 3.05Å; E1011-L1013 PolarHBondContact O-N 3.09Å; L1013-K1016 PolarHBondContact O-N 2.95Å; L1013-L1017 HydrophobicContact CD1-CD1 3.81Å; L1013-L1017 HydrophobicContact CD1-CG 4.2Å; L1013-L1017 HydrophobicContact CG-CD1 4.24Å; L1013-L1017 WeakPolarHBondContact O-CG 3.3Å; L1013-L1017 PolarHBondContact O-N 2.98Å; L1013-M1049 HydrophobicContact CD1-CB 4.31Å; L1013-C1053 HydrophobicContact CD2-CB 3.49Å; L1013-C1053 VanDerWaalsContact CD2-CB 3.49Å
1014	F	79.9	Confident	75.3	Confident	13 Å²	13	30.3 Å²	30.3	6%	0.057	16%	0.155	C	C	.	.	H	α-helix	trans	-67.3	-37.8	-176.7	-60.2	-40.1	0	0	0	111.5	S1010 E1011 L1017 D1018 M1050 D1089 A1090 Q1093	S1010-F1014 WeakPolarHBondContact O-CD2 3.33Å; S1010-F1014 VanDerWaalsContact O-CG 3.32Å; S1010-F1014 WeakPolarHBondContact O-CG 3.07Å; S1010-F1014 PolarHBondContact O-N 3.26Å; E1011-F1014 PolarHBondContact O-N 3.45Å; F1014-L1017 PolarHBondContact O-N 3.42Å; F1014-D1018 WeakPolarHBondContact O-CB 3.45Å; F1014-D1018 PolarHBondContact O-N 2.88Å; F1014-M1050 HydrophobicContact CE1-CG 4.4Å; F1014-D1089 WeakPolarHBondContact CD2-OD2 3.44Å; F1014-D1089 HydrophobicContact CE2-CB 4.28Å; F1014-A1090 HydrophobicContact CE1-CB 4.45Å; F1014-A1090 HydrophobicContact CZ-CB 3.86Å; F1014-Q1093 HydrophobicContact CB-CG 4.33Å; F1014-Q1093 HydrophobicContact CD1-CB 4.36Å; F1014-Q1093 HydrophobicContact CD1-CG 4Å; F1014-Q1093 HydrophobicContact CD2-CG 4.14Å; F1014-Q1093 HydrophobicContact CE1-CG 4.37Å; F1014-Q1093 HydrophobicContact CE2-CG 4.48Å; F1014-Q1093 HydrophobicContact CG-CG 3.91Å
1015	W	82.3	Confident	76.7	Confident	109 Å²	109	30.5 Å²	30.5	41%	0.413	16%	0.158	S	C	.	.	H	α-helix	trans	-61.7	-45	174.2	-179.6	80.4	0	0	0	112.4	V983 E1011 L1017 D1018 A1019	V983-W1015 HydrophobicContact CG1-CH2 4.39Å; V983-W1015 HydrophobicContact CG2-CH2 3.78Å; V983-W1015 HydrophobicContact CG2-CZ2 4.39Å; E1011-W1015 VanDerWaalsContact O-CB 3.27Å; E1011-W1015 WeakPolarHBondContact O-CB 3.31Å; E1011-W1015 PolarHBondContact O-N 3.05Å; W1015-L1017 VanDerWaalsContact C-N 3.35Å; W1015-L1017 PolarHBondContact O-N 2.89Å; W1015-D1018 PolarHBondContact O-N 3.46Å; W1015-A1019 HydrophobicContact CZ2-CB 4.43Å; W1015-A1019 VanDerWaalsContact O-CB 3.31Å; W1015-A1019 WeakPolarHBondContact O-CB 3.33Å; W1015-A1019 PolarHBondContact O-N 3.32Å
1016	K	80.1	Confident	77.7	Confident	35 Å²	35	30.3 Å²	30.3	15%	0.152	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-37.9	176.6	-76.6	169.2	176.2	156.2	0	113	I937 S940 D1012 L1013 L1020	I937-K1016 HydrophobicContact CD1-CB 3.97Å; I937-K1016 HydrophobicContact CG1-CB 3.8Å; I937-K1016 HydrophobicContact CG1-CD 4.07Å; I937-K1016 HydrophobicContact CG1-CG 4.47Å; S940-K1016 PolarHBondContact OG-NZ 2.88Å; D1012-K1016 WeakPolarHBondContact O-CB 3.42Å; D1012-K1016 WeakPolarHBondContact O-CG 3.27Å; D1012-K1016 PolarHBondContact O-N 3.04Å; D1012-K1016 WeakPolarHBondContact OD1-CE 3.48Å; D1012-K1016 IonicContact OD1-NZ 2.73Å; D1012-K1016 PolarHBondContact OD1-NZ 3.13Å; D1012-K1016 IonicContact OD2-NZ 2.67Å; D1012-K1016 PolarHBondContact OD2-NZ 3.45Å; L1013-K1016 PolarHBondContact O-N 2.95Å; K1016-L1020 VanDerWaalsContact O-CB 3.3Å; K1016-L1020 WeakPolarHBondContact O-CB 3.48Å; K1016-L1020 PolarHBondContact O-N 3.35Å; K1016-L1020 VanDerWaalsContact O-N 3.1Å
1017	L	81.3	Confident	78.6	Confident	7 Å²	7	30.3 Å²	30.3	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-67.6	-43	175.6	-74.5	173	0	0	0	111.9	I937 L1013 F1014 W1015 L1020 Q1021 M1045 A1046 M1049	I937-L1017 HydrophobicContact CD1-CD2 4.17Å; L1013-L1017 HydrophobicContact CD1-CD1 3.81Å; L1013-L1017 HydrophobicContact CD1-CG 4.2Å; L1013-L1017 HydrophobicContact CG-CD1 4.24Å; L1013-L1017 WeakPolarHBondContact O-CG 3.3Å; L1013-L1017 PolarHBondContact O-N 2.98Å; F1014-L1017 PolarHBondContact O-N 3.42Å; W1015-L1017 VanDerWaalsContact C-N 3.35Å; W1015-L1017 PolarHBondContact O-N 2.89Å; L1017-L1020 PolarHBondContact O-N 3.47Å; L1017-Q1021 WeakPolarHBondContact O-CB 3.2Å; L1017-Q1021 PolarHBondContact O-N 3.19Å; L1017-M1045 HydrophobicContact CD2-CE 3.96Å; L1017-A1046 HydrophobicContact CD1-CB 4.49Å; L1017-A1046 HydrophobicContact CD2-CB 3.95Å; L1017-M1049 HydrophobicContact CD1-CB 4.47Å; L1017-M1049 HydrophobicContact CD2-SD 3.89Å
1018	D	75.4	Confident	78.8	Confident	55 Å²	55	34 Å²	34	29%	0.294	17%	0.174	S	C	.	.	H	α-helix	trans	-68.3	-41.7	179.3	-148.3	40.4	0	0	0	111.7	F1014 W1015 L1020 Q1021 M1022 K1096	F1014-D1018 WeakPolarHBondContact O-CB 3.45Å; F1014-D1018 PolarHBondContact O-N 2.88Å; W1015-D1018 PolarHBondContact O-N 3.46Å; D1018-L1020 PolarHBondContact O-N 3.39Å; D1018-Q1021 PolarHBondContact O-N 3.36Å; D1018-M1022 WeakPolarHBondContact O-CG 3.44Å; D1018-M1022 PolarHBondContact O-N 3.3Å; D1018-K1096 IonicContact OD1-NZ 2.71Å; D1018-K1096 PolarHBondContact OD1-NZ 2.96Å; D1018-K1096 IonicContact OD2-NZ 3.16Å; D1018-K1096 PolarHBondContact OD2-NZ 2.87Å
1019	A	77.1	Confident	79.4	Confident	14 Å²	14	32.5 Å²	32.5	12%	0.116	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-41.4	175.2	0	0	0	0	0	112.3	F987 W1015 M1022 F1023	F987-A1019 HydrophobicContact CE1-CB 4.23Å; F987-A1019 HydrophobicContact CZ-CB 4.28Å; W1015-A1019 HydrophobicContact CZ2-CB 4.43Å; W1015-A1019 VanDerWaalsContact O-CB 3.31Å; W1015-A1019 WeakPolarHBondContact O-CB 3.33Å; W1015-A1019 PolarHBondContact O-N 3.32Å; A1019-M1022 PolarHBondContact O-N 3.49Å; A1019-F1023 WeakPolarHBondContact O-CB 3.34Å; A1019-F1023 PolarHBondContact O-N 3.4Å
1020	L	81.6	Confident	79.6	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-70.2	-32.3	175.7	-173.5	61.2	0	0	0	112.3	Y929 I930 M933 I937 K1016 L1017 D1018 F1023 V1024 L1042 M1045	Y929-L1020 HydrophobicContact CD1-CD1 4.14Å; Y929-L1020 HydrophobicContact CE1-CD1 3.65Å; I930-L1020 HydrophobicContact CG1-CD1 4.27Å; M933-L1020 HydrophobicContact CB-CD1 4.31Å; M933-L1020 HydrophobicContact CB-CD2 3.97Å; M933-L1020 HydrophobicContact CE-CB 4.45Å; M933-L1020 HydrophobicContact CG-CD1 4.3Å; I937-L1020 HydrophobicContact CD1-CD2 4.46Å; K1016-L1020 VanDerWaalsContact O-CB 3.3Å; K1016-L1020 WeakPolarHBondContact O-CB 3.48Å; K1016-L1020 PolarHBondContact O-N 3.35Å; K1016-L1020 VanDerWaalsContact O-N 3.1Å; L1017-L1020 PolarHBondContact O-N 3.47Å; D1018-L1020 PolarHBondContact O-N 3.39Å; L1020-F1023 HydrophobicContact CD1-CD1 4.19Å; L1020-V1024 WeakPolarHBondContact O-CG2 3.38Å; L1020-V1024 PolarHBondContact O-N 3.19Å; L1020-V1024 VanDerWaalsContact O-N 3.1Å; L1020-L1042 HydrophobicContact CD2-CD1 4.2Å; L1020-L1042 HydrophobicContact CG-CD1 4.18Å; L1020-M1045 HydrophobicContact CD2-CE 3.48Å; L1020-M1045 VanDerWaalsContact CD2-CE 3.48Å; L1020-M1045 HydrophobicContact CD2-SD 4.4Å
1021	Q	78.9	Confident	79.8	Confident	19 Å²	19	37.6 Å²	37.6	9%	0.089	18%	0.183	C	C	.	.	H	α-helix	trans	-66.7	-45.7	172.9	179.5	176.6	-10.5	0	0	112.1	L1017 D1018 V1024 M1025 L1042 L1100	L1017-Q1021 WeakPolarHBondContact O-CB 3.2Å; L1017-Q1021 PolarHBondContact O-N 3.19Å; D1018-Q1021 PolarHBondContact O-N 3.36Å; Q1021-V1024 PolarHBondContact O-N 2.85Å; Q1021-M1025 HydrophobicContact CG-SD 4.39Å; Q1021-M1025 WeakPolarHBondContact O-CG 3.36Å; Q1021-M1025 PolarHBondContact O-N 3.29Å; Q1021-M1025 VanDerWaalsContact O-N 3.09Å; Q1021-L1042 HydrophobicContact CB-CD2 3.96Å; Q1021-L1042 HydrophobicContact CG-CD2 4.11Å; Q1021-L1100 VanDerWaalsContact NE2-CD1 3.32Å
1022	M	77.9	Confident	79.9	Confident	78 Å²	78	39.6 Å²	39.6	38%	0.384	20%	0.199	S	C	.	.	H	α-helix	trans	-59.2	-49.1	173.8	-71.4	-56.3	-53.9	0	0	110.8	F987 D1018 A1019 V1024 M1025 D1026	F987-M1022 HydrophobicContact CZ-CB 4.45Å; D1018-M1022 WeakPolarHBondContact O-CG 3.44Å; D1018-M1022 PolarHBondContact O-N 3.3Å; A1019-M1022 PolarHBondContact O-N 3.49Å; M1022-V1024 PolarHBondContact O-N 3.47Å; M1022-M1025 CarbonylContact O-C 3.5Å; M1022-M1025 WeakPolarHBondContact O-CA 3.34Å; M1022-M1025 WeakPolarHBondContact O-CB 3.22Å; M1022-M1025 PolarHBondContact O-N 2.97Å; M1022-D1026 WeakPolarHBondContact O-CB 3.47Å; M1022-D1026 VanDerWaalsContact O-CG 3.24Å; M1022-D1026 PolarHBondContact O-N 2.9Å
1023	F	82.3	Confident	80.1	Confident	3 Å²	3	44.9 Å²	44.9	1%	0.013	22%	0.222	C	C	.	.	H	α-helix	trans	-51.4	-49	175.4	174	-100.4	0	0	0	113.3	F893 Y929 W986 A1019 L1020 M1025 D1026 L1027	F893-F1023 HydrophobicContact CB-CE2 4.21Å; F893-F1023 HydrophobicContact CD1-CE2 4.29Å; F893-F1023 HydrophobicContact CD1-CZ 4.09Å; F893-F1023 AromaticContact CD2-CE2 3.54Å; F893-F1023 HydrophobicContact CD2-CE2 3.54Å; F893-F1023 AromaticContact CD2-CZ 3.73Å; F893-F1023 HydrophobicContact CD2-CZ 3.73Å; F893-F1023 AromaticContact CE1-CZ 3.99Å; F893-F1023 HydrophobicContact CE1-CZ 3.99Å; F893-F1023 AromaticContact CE2-CE2 3.87Å; F893-F1023 HydrophobicContact CE2-CE2 3.87Å; F893-F1023 AromaticContact CE2-CZ 3.58Å; F893-F1023 HydrophobicContact CE2-CZ 3.58Å; F893-F1023 AromaticContact CG-CE2 3.78Å; F893-F1023 HydrophobicContact CG-CE2 3.78Å; F893-F1023 AromaticContact CG-CZ 3.99Å; F893-F1023 HydrophobicContact CG-CZ 3.99Å; F893-F1023 HydrophobicContact CZ-CE2 4.4Å; F893-F1023 AromaticContact CZ-CZ 3.73Å; F893-F1023 HydrophobicContact CZ-CZ 3.73Å; Y929-F1023 AromaticContact CD1-CD1 3.85Å; Y929-F1023 HydrophobicContact CD1-CD1 3.85Å; Y929-F1023 AromaticContact CD1-CE1 3.4Å; Y929-F1023 HydrophobicContact CD1-CE1 3.4Å; Y929-F1023 AromaticContact CD1-CZ 3.78Å; Y929-F1023 HydrophobicContact CD1-CZ 3.78Å; Y929-F1023 AromaticContact CE1-CD1 3.62Å; Y929-F1023 HydrophobicContact CE1-CD1 3.62Å; Y929-F1023 HydrophobicContact CE1-CD2 4.32Å; Y929-F1023 AromaticContact CE1-CE1 3.64Å; Y929-F1023 HydrophobicContact CE1-CE1 3.64Å; Y929-F1023 HydrophobicContact CE1-CE2 4.34Å; Y929-F1023 AromaticContact CE1-CG 3.98Å; Y929-F1023 HydrophobicContact CE1-CG 3.98Å; Y929-F1023 HydrophobicContact CE1-CZ 4.01Å; Y929-F1023 HydrophobicContact CG-CE1 4.46Å; W986-F1023 HydrophobicContact CH2-CD2 4.29Å; A1019-F1023 WeakPolarHBondContact O-CB 3.34Å; A1019-F1023 PolarHBondContact O-N 3.4Å; L1020-F1023 HydrophobicContact CD1-CD1 4.19Å; F1023-M1025 VanDerWaalsContact C-N 3.27Å; F1023-M1025 PolarHBondContact O-N 2.92Å; F1023-D1026 PolarHBondContact O-N 3.43Å; F1023-L1027 HydrophobicContact CD1-CD1 4.15Å; F1023-L1027 HydrophobicContact CE1-CD1 3.6Å; F1023-L1027 HydrophobicContact CE1-CG 4.32Å; F1023-L1027 HydrophobicContact CE2-CD1 4.39Å; F1023-L1027 HydrophobicContact CE2-CD2 4.35Å; F1023-L1027 HydrophobicContact CE2-CG 4.3Å; F1023-L1027 HydrophobicContact CZ-CD1 3.74Å; F1023-L1027 HydrophobicContact CZ-CD2 4.24Å; F1023-L1027 HydrophobicContact CZ-CG 4.12Å; F1023-L1027 WeakPolarHBondContact O-CG 3.31Å; F1023-L1027 PolarHBondContact O-N 3.22Å
1024	V	80.9	Confident	80.2	Confident	10 Å²	10	46.3 Å²	46.3	6%	0.061	23%	0.228	C	C	.	.	H	α-helix	trans	-68.2	-24.8	179.1	173	0	0	0	0	112.7	I930 L1020 Q1021 M1022 L1038 K1039 L1042	I930-V1024 HydrophobicContact CD1-CG2 4.16Å; L1020-V1024 WeakPolarHBondContact O-CG2 3.38Å; L1020-V1024 PolarHBondContact O-N 3.19Å; L1020-V1024 VanDerWaalsContact O-N 3.1Å; Q1021-V1024 PolarHBondContact O-N 2.85Å; M1022-V1024 PolarHBondContact O-N 3.47Å; V1024-L1038 HydrophobicContact CG1-CB 4.03Å; V1024-K1039 HydrophobicContact CG1-CG 4.42Å; V1024-L1042 HydrophobicContact CB-CD2 4.32Å
1025	M	78.7	Confident	80.3	Confident	77 Å²	77	46.5 Å²	46.5	38%	0.379	23%	0.233	S	C	.	.	H	α-helix	trans	-77.5	-48	172	-73	-178.7	51.4	0	0	111.7	Q1021 M1022 F1023 L1027 H1028 L1100	Q1021-M1025 HydrophobicContact CG-SD 4.39Å; Q1021-M1025 WeakPolarHBondContact O-CG 3.36Å; Q1021-M1025 PolarHBondContact O-N 3.29Å; Q1021-M1025 VanDerWaalsContact O-N 3.09Å; M1022-M1025 CarbonylContact O-C 3.5Å; M1022-M1025 WeakPolarHBondContact O-CA 3.34Å; M1022-M1025 WeakPolarHBondContact O-CB 3.22Å; M1022-M1025 PolarHBondContact O-N 2.97Å; F1023-M1025 VanDerWaalsContact C-N 3.27Å; F1023-M1025 PolarHBondContact O-N 2.92Å; M1025-L1027 VanDerWaalsContact C-N 3.27Å; M1025-L1027 PolarHBondContact O-N 2.94Å; M1025-H1028 PolarHBondContact O-N 2.93Å; M1025-L1100 HydrophobicContact SD-CD1 4.35Å
1026	D	79.1	Confident	80.3	Confident	52 Å²	52	47.7 Å²	47.7	28%	0.278	24%	0.241	S	C	.	.	H	α-helix	trans	-71.4	-19.1	-174.2	-61.6	-30.2	0	0	0	113.2	Q897 M1022 F1023 H1028	Q897-D1026 PolarHBondContact NE2-O 3.35Å; Q897-D1026 VanDerWaalsContact NE2-O 3.08Å; M1022-D1026 WeakPolarHBondContact O-CB 3.47Å; M1022-D1026 VanDerWaalsContact O-CG 3.24Å; M1022-D1026 PolarHBondContact O-N 2.9Å; F1023-D1026 PolarHBondContact O-N 3.43Å; D1026-H1028 PolarHBondContact O-N 2.97Å; D1026-H1028 PolarHBondContact O-ND1 3.49Å
1027	L	81.6	Confident	80.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.9	167.7	-81.9	175.4	0	0	0	113.4	F893 F896 N900 V926 F1023 M1025 W1029	F893-L1027 HydrophobicContact CD1-CD2 4.41Å; F896-L1027 HydrophobicContact CD1-CD2 3.68Å; F896-L1027 HydrophobicContact CE1-CD2 3.88Å; N900-L1027 PolarHBondContact ND2-O 3.36Å; V926-L1027 HydrophobicContact CB-CD1 4.48Å; V926-L1027 HydrophobicContact CG1-CD1 3.79Å; V926-L1027 HydrophobicContact CG2-CD1 3.76Å; V926-L1027 HydrophobicContact CG2-CD2 4.36Å; F1023-L1027 HydrophobicContact CD1-CD1 4.15Å; F1023-L1027 HydrophobicContact CE1-CD1 3.6Å; F1023-L1027 HydrophobicContact CE1-CG 4.32Å; F1023-L1027 HydrophobicContact CE2-CD1 4.39Å; F1023-L1027 HydrophobicContact CE2-CD2 4.35Å; F1023-L1027 HydrophobicContact CE2-CG 4.3Å; F1023-L1027 HydrophobicContact CZ-CD1 3.74Å; F1023-L1027 HydrophobicContact CZ-CD2 4.24Å; F1023-L1027 HydrophobicContact CZ-CG 4.12Å; F1023-L1027 WeakPolarHBondContact O-CG 3.31Å; F1023-L1027 PolarHBondContact O-N 3.22Å; M1025-L1027 VanDerWaalsContact C-N 3.27Å; M1025-L1027 PolarHBondContact O-N 2.94Å; L1027-W1029 VanDerWaalsContact C-N 3.33Å; L1027-W1029 PolarHBondContact O-N 3.07Å
1028	H	79.8	Confident	80.7	Confident	77 Å²	77	50.9 Å²	50.9	36%	0.356	26%	0.256	S	S	.	.			trans	49.3	45.6	177.2	-69	98.1	0	0	0	115.1	N900 R904 M1025 D1026	N900-H1028 PolarHBondContact ND2-O 3.44Å; R904-H1028 PolarHBondContact NH1-CD2 2.85Å; R904-H1028 VanDerWaalsContact NH1-CG 3.26Å; M1025-H1028 PolarHBondContact O-N 2.93Å; D1026-H1028 PolarHBondContact O-N 2.97Å; D1026-H1028 PolarHBondContact O-ND1 3.49Å
1029	W	83.9	Confident	81	Confident	21 Å²	21	53.4 Å²	53.4	8%	0.08	26%	0.264	C	S	.	.			trans	-56.9	128.3	-169.4	-160.3	-85.4	0	0	0	113.8	F896 Q919 F922 I923 V926 L1027 F1034 A1035	F896-W1029 AromaticContact CE1-CE3 3.96Å; F896-W1029 HydrophobicContact CE1-CE3 3.96Å; F896-W1029 AromaticContact CE1-CZ3 3.89Å; F896-W1029 HydrophobicContact CE1-CZ3 3.89Å; F896-W1029 HydrophobicContact CE2-CE3 4.45Å; F896-W1029 AromaticContact CE2-CH2 3.98Å; F896-W1029 HydrophobicContact CE2-CH2 3.98Å; F896-W1029 AromaticContact CE2-CZ3 3.77Å; F896-W1029 HydrophobicContact CE2-CZ3 3.77Å; F896-W1029 HydrophobicContact CZ-CD2 4.35Å; F896-W1029 AromaticContact CZ-CE3 3.55Å; F896-W1029 HydrophobicContact CZ-CE3 3.55Å; F896-W1029 AromaticContact CZ-CH2 3.88Å; F896-W1029 HydrophobicContact CZ-CH2 3.88Å; F896-W1029 AromaticContact CZ-CZ3 3.28Å; F896-W1029 HydrophobicContact CZ-CZ3 3.28Å; Q919-W1029 HydrophobicContact CB-CH2 4.22Å; Q919-W1029 HydrophobicContact CB-CZ2 3.64Å; Q919-W1029 HydrophobicContact CG-CH2 4.22Å; Q919-W1029 HydrophobicContact CG-CZ2 3.63Å; F922-W1029 HydrophobicContact CB-CH2 4.33Å; F922-W1029 HydrophobicContact CB-CZ3 4.48Å; I923-W1029 HydrophobicContact CD1-CZ2 4Å; I923-W1029 HydrophobicContact CG1-CH2 3.67Å; I923-W1029 HydrophobicContact CG1-CZ2 3.39Å; V926-W1029 HydrophobicContact CG2-CZ3 4.15Å; L1027-W1029 VanDerWaalsContact C-N 3.33Å; L1027-W1029 PolarHBondContact O-N 3.07Å; W1029-F1034 AromaticContact CD1-CD1 3.73Å; W1029-F1034 AromaticContact CD2-CD1 3.73Å; W1029-F1034 HydrophobicContact CD2-CD1 3.73Å; W1029-F1034 HydrophobicContact CD2-CE1 4.08Å; W1029-F1034 AromaticContact CE2-CD1 3.5Å; W1029-F1034 AromaticContact CE2-CE1 3.95Å; W1029-F1034 HydrophobicContact CE3-CD1 4.42Å; W1029-F1034 HydrophobicContact CE3-CE1 4.34Å; W1029-F1034 AromaticContact CG-CD1 3.91Å; W1029-F1034 HydrophobicContact CG-CD1 3.91Å; W1029-F1034 HydrophobicContact CH2-CE1 4.39Å; W1029-F1034 HydrophobicContact CZ2-CD1 4.06Å; W1029-F1034 HydrophobicContact CZ2-CE1 4.12Å; W1029-F1034 HydrophobicContact CZ3-CE1 4.48Å; W1029-F1034 AromaticContact NE1-CD1 3.48Å; W1029-A1035 HydrophobicContact CB-CB 4.15Å
1030	P	79.1	Confident	81.2	Confident	36 Å²	36	58.7 Å²	58.7	23%	0.234	29%	0.286	C	S	.	.	S	Bend	trans	-65.3	-48.7	-175.2	-21.9	31.5	0	0	0	114.4	N900 H915 Q919 P1032	N900-P1030 VanDerWaalsContact OD1-CG 3.26Å; N900-P1030 WeakPolarHBondContact OD1-CG 3.32Å; H915-P1030 WeakPolarHBondContact NE2-CG 3.26Å; Q919-P1030 HydrophobicContact CG-CG 4.34Å; P1030-P1032 WeakPolarHBondContact O-CD 3.42Å
1031	E	81.7	Confident	81.4	Confident	87 Å²	87	61.7 Å²	61.7	41%	0.407	30%	0.298	S	S	.	.			trans	-68.2	118.5	-177	-76.6	-178	163.9	0	0	111.7	E1033 F1034 A1035	E1031-E1033 PolarHBondContact O-N 3.36Å; E1031-F1034 HydrophobicContact CB-CB 4.32Å; E1031-F1034 PolarHBondContact O-N 3.19Å; E1031-A1035 VanDerWaalsContact O-CB 3.22Å; E1031-A1035 WeakPolarHBondContact O-CB 3.46Å; E1031-A1035 PolarHBondContact O-N 2.77Å
1032	P	78.2	Confident	81.6	Confident	82 Å²	82	61.5 Å²	61.5	53%	0.532	30%	0.297	S	S	.	.	H	α-helix	trans	-69	-22	-174.2	28.2	-35.5	0	0	0	112.7	P1030 K1036	P1030-P1032 WeakPolarHBondContact O-CD 3.42Å; P1032-K1036 WeakPolarHBondContact O-CB 3.38Å; P1032-K1036 VanDerWaalsContact O-CD 3.29Å; P1032-K1036 WeakPolarHBondContact O-CD 3.32Å; P1032-K1036 WeakPolarHBondContact O-CG 3.48Å; P1032-K1036 PolarHBondContact O-N 2.65Å; P1032-K1036 VanDerWaalsContact O-N 3.14Å
1033	E	82	Confident	81.7	Confident	164 Å²	164	61 Å²	61	77%	0.766	29%	0.293	S	S	*	.	H	α-helix	trans	-76.3	-50.8	177.7	-58	-164.1	164.2	0	0	111.2	E1031 K1036 H1037	E1031-E1033 PolarHBondContact O-N 3.36Å; E1033-K1036 PolarHBondContact O-N 3.18Å; E1033-H1037 WeakPolarHBondContact O-CB 3.34Å; E1033-H1037 PolarHBondContact O-N 3.11Å
1034	F	83.1	Confident	81.8	Confident	31 Å²	31	64.7 Å²	64.7	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-39.8	175.2	-167.4	-107.3	0	0	0	111.8	I923 V927 W1029 E1031 K1036 H1037 L1038	I923-F1034 HydrophobicContact CB-CZ 4.36Å; I923-F1034 HydrophobicContact CG1-CE1 4.06Å; I923-F1034 HydrophobicContact CG1-CE2 4.49Å; I923-F1034 HydrophobicContact CG1-CZ 4.04Å; I923-F1034 HydrophobicContact CG2-CE2 4.12Å; I923-F1034 HydrophobicContact CG2-CZ 3.95Å; V927-F1034 HydrophobicContact CG2-CE2 4.32Å; V927-F1034 HydrophobicContact CG2-CZ 3.94Å; W1029-F1034 AromaticContact CD1-CD1 3.73Å; W1029-F1034 AromaticContact CD2-CD1 3.73Å; W1029-F1034 HydrophobicContact CD2-CD1 3.73Å; W1029-F1034 HydrophobicContact CD2-CE1 4.08Å; W1029-F1034 AromaticContact CE2-CD1 3.5Å; W1029-F1034 AromaticContact CE2-CE1 3.95Å; W1029-F1034 HydrophobicContact CE3-CD1 4.42Å; W1029-F1034 HydrophobicContact CE3-CE1 4.34Å; W1029-F1034 AromaticContact CG-CD1 3.91Å; W1029-F1034 HydrophobicContact CG-CD1 3.91Å; W1029-F1034 HydrophobicContact CH2-CE1 4.39Å; W1029-F1034 HydrophobicContact CZ2-CD1 4.06Å; W1029-F1034 HydrophobicContact CZ2-CE1 4.12Å; W1029-F1034 HydrophobicContact CZ3-CE1 4.48Å; W1029-F1034 AromaticContact NE1-CD1 3.48Å; E1031-F1034 HydrophobicContact CB-CB 4.32Å; E1031-F1034 PolarHBondContact O-N 3.19Å; F1034-K1036 VanDerWaalsContact C-N 3.31Å; F1034-K1036 PolarHBondContact O-N 3.4Å; F1034-H1037 WeakPolarHBondContact O-CB 3.49Å; F1034-H1037 PolarHBondContact O-N 2.66Å; F1034-H1037 VanDerWaalsContact O-N 3.14Å; F1034-L1038 HydrophobicContact CD1-CD1 3.84Å; F1034-L1038 HydrophobicContact CD1-CG 4.02Å; F1034-L1038 HydrophobicContact CE1-CD1 3.59Å; F1034-L1038 HydrophobicContact CE1-CD2 3.99Å; F1034-L1038 HydrophobicContact CE1-CG 3.83Å; F1034-L1038 HydrophobicContact CZ-CD1 4.37Å; F1034-L1038 HydrophobicContact CZ-CD2 3.92Å; F1034-L1038 HydrophobicContact CZ-CG 4.2Å; F1034-L1038 WeakPolarHBondContact O-CG 3.37Å; F1034-L1038 PolarHBondContact O-N 3.23Å
1035	A	82.2	Confident	81.9	Confident	18 Å²	18	64.4 Å²	64.4	15%	0.149	31%	0.311	C	S	.	.	H	α-helix	trans	-59.7	-38.6	173.7	0	0	0	0	0	112.8	W1029 E1031 K1039	W1029-A1035 HydrophobicContact CB-CB 4.15Å; E1031-A1035 VanDerWaalsContact O-CB 3.22Å; E1031-A1035 WeakPolarHBondContact O-CB 3.46Å; E1031-A1035 PolarHBondContact O-N 2.77Å; A1035-K1039 WeakPolarHBondContact O-CB 3.45Å; A1035-K1039 VanDerWaalsContact O-CG 3.28Å; A1035-K1039 WeakPolarHBondContact O-CG 3.45Å; A1035-K1039 PolarHBondContact O-N 2.92Å
1036	K	81.5	Confident	82.1	Confident	133 Å²	133	60.8 Å²	60.8	58%	0.578	29%	0.293	S	S	*	.	H	α-helix	trans	-68.7	-43.3	172.5	-78.2	168.5	-174.3	175.6	0	111.6	P1032 E1033 F1034 K1039 Q1040	P1032-K1036 WeakPolarHBondContact O-CB 3.38Å; P1032-K1036 VanDerWaalsContact O-CD 3.29Å; P1032-K1036 WeakPolarHBondContact O-CD 3.32Å; P1032-K1036 WeakPolarHBondContact O-CG 3.48Å; P1032-K1036 PolarHBondContact O-N 2.65Å; P1032-K1036 VanDerWaalsContact O-N 3.14Å; E1033-K1036 PolarHBondContact O-N 3.18Å; F1034-K1036 VanDerWaalsContact C-N 3.31Å; F1034-K1036 PolarHBondContact O-N 3.4Å; K1036-K1039 PolarHBondContact O-N 2.9Å; K1036-Q1040 VanDerWaalsContact O-CB 3.31Å; K1036-Q1040 WeakPolarHBondContact O-CB 3.12Å; K1036-Q1040 PolarHBondContact O-N 3.31Å
1037	H	85.2	Confident	82.2	Confident	102 Å²	102	59.2 Å²	59.2	47%	0.472	29%	0.286	S	S	.	.	H	α-helix	trans	-59.5	-48.3	178	176.6	-111.3	0	0	0	112.2	E1033 F1034 K1039 Q1040 R1041	E1033-H1037 WeakPolarHBondContact O-CB 3.34Å; E1033-H1037 PolarHBondContact O-N 3.11Å; F1034-H1037 WeakPolarHBondContact O-CB 3.49Å; F1034-H1037 PolarHBondContact O-N 2.66Å; F1034-H1037 VanDerWaalsContact O-N 3.14Å; H1037-K1039 PolarHBondContact O-N 3.33Å; H1037-Q1040 PolarHBondContact O-N 2.67Å; H1037-R1041 WeakPolarHBondContact O-CB 3.5Å; H1037-R1041 PolarHBondContact O-N 3.04Å
1038	L	84.4	Confident	82.2	Confident	7 Å²	7	63.9 Å²	63.9	4%	0.037	31%	0.311	C	S	.	.	H	α-helix	trans	-58.2	-48.5	175.1	-68.6	-177.9	0	0	0	111.8	V926 I930 V1024 F1034 Q1040 R1041 L1042	V926-L1038 HydrophobicContact CG1-CD1 4.02Å; V926-L1038 HydrophobicContact CG1-CD2 4.2Å; I930-L1038 HydrophobicContact CD1-CD2 3.74Å; V1024-L1038 HydrophobicContact CG1-CB 4.03Å; F1034-L1038 HydrophobicContact CD1-CD1 3.84Å; F1034-L1038 HydrophobicContact CD1-CG 4.02Å; F1034-L1038 HydrophobicContact CE1-CD1 3.59Å; F1034-L1038 HydrophobicContact CE1-CD2 3.99Å; F1034-L1038 HydrophobicContact CE1-CG 3.83Å; F1034-L1038 HydrophobicContact CZ-CD1 4.37Å; F1034-L1038 HydrophobicContact CZ-CD2 3.92Å; F1034-L1038 HydrophobicContact CZ-CG 4.2Å; F1034-L1038 WeakPolarHBondContact O-CG 3.37Å; F1034-L1038 PolarHBondContact O-N 3.23Å; L1038-Q1040 VanDerWaalsContact C-N 3.34Å; L1038-Q1040 PolarHBondContact O-N 3.42Å; L1038-R1041 PolarHBondContact O-N 3.5Å; L1038-L1042 WeakPolarHBondContact O-CB 3.39Å; L1038-L1042 PolarHBondContact O-N 2.85Å
1039	K	81.3	Confident	82.4	Confident	108 Å²	108	60.8 Å²	60.8	47%	0.47	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-37.4	178.2	-73.2	174.7	-179.9	-179.6	0	112.5	V1024 A1035 K1036 H1037 K1043	V1024-K1039 HydrophobicContact CG1-CG 4.42Å; A1035-K1039 WeakPolarHBondContact O-CB 3.45Å; A1035-K1039 VanDerWaalsContact O-CG 3.28Å; A1035-K1039 WeakPolarHBondContact O-CG 3.45Å; A1035-K1039 PolarHBondContact O-N 2.92Å; K1036-K1039 PolarHBondContact O-N 2.9Å; H1037-K1039 PolarHBondContact O-N 3.33Å; K1039-K1043 WeakPolarHBondContact O-CB 3.29Å; K1039-K1043 WeakPolarHBondContact O-CG 3.41Å; K1039-K1043 PolarHBondContact O-N 3.06Å
1040	Q	82.9	Confident	82.3	Confident	125 Å²	125	60.4 Å²	60.4	58%	0.584	30%	0.296	S	S	*	.	H	α-helix	trans	-69.9	-44.2	176.6	-177.9	174.8	-15.7	0	0	111.7	K1036 H1037 L1038 K1043 L1044	K1036-Q1040 VanDerWaalsContact O-CB 3.31Å; K1036-Q1040 WeakPolarHBondContact O-CB 3.12Å; K1036-Q1040 PolarHBondContact O-N 3.31Å; H1037-Q1040 PolarHBondContact O-N 2.67Å; L1038-Q1040 VanDerWaalsContact C-N 3.34Å; L1038-Q1040 PolarHBondContact O-N 3.42Å; Q1040-K1043 PolarHBondContact O-N 3.12Å; Q1040-L1044 HydrophobicContact CG-CD1 4.34Å; Q1040-L1044 WeakPolarHBondContact O-CG 3.41Å; Q1040-L1044 PolarHBondContact O-N 3.48Å
1041	R	85	Confident	82.4	Confident	64 Å²	64	60.5 Å²	60.5	24%	0.242	29%	0.293	C	S	.	.	H	α-helix	trans	-59.4	-47.4	175	-176.8	177	178	179.9	0.9	110.9	D931 E934 H1037 L1038 K1043 L1044 M1045	D931-R1041 IonicContact OD1-CZ 2.75Å; D931-R1041 IonicContact OD1-NH1 2.65Å; D931-R1041 PolarHBondContact OD1-NH1 3.21Å; D931-R1041 IonicContact OD1-NH2 2.77Å; D931-R1041 PolarHBondContact OD1-NH2 2.77Å; E934-R1041 IonicContact OE2-CZ 2.87Å; E934-R1041 IonicContact OE2-NE 2.66Å; E934-R1041 PolarHBondContact OE2-NE 2.68Å; E934-R1041 IonicContact OE2-NH2 3.46Å; E934-R1041 PolarHBondContact OE2-NH2 2.9Å; H1037-R1041 WeakPolarHBondContact O-CB 3.5Å; H1037-R1041 PolarHBondContact O-N 3.04Å; L1038-R1041 PolarHBondContact O-N 3.5Å; R1041-K1043 PolarHBondContact O-N 3.34Å; R1041-L1044 PolarHBondContact O-N 3.27Å; R1041-M1045 VanDerWaalsContact O-CB 3.3Å; R1041-M1045 WeakPolarHBondContact O-CB 3.33Å; R1041-M1045 PolarHBondContact O-N 3.13Å
1042	L	83.4	Confident	82.5	Confident	16 Å²	16	57.5 Å²	57.5	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-45.4	176.6	177.8	65.1	0	0	0	112.2	L1020 Q1021 V1024 L1038 L1044 M1045 A1046	L1020-L1042 HydrophobicContact CD2-CD1 4.2Å; L1020-L1042 HydrophobicContact CG-CD1 4.18Å; Q1021-L1042 HydrophobicContact CB-CD2 3.96Å; Q1021-L1042 HydrophobicContact CG-CD2 4.11Å; V1024-L1042 HydrophobicContact CB-CD2 4.32Å; L1038-L1042 WeakPolarHBondContact O-CB 3.39Å; L1038-L1042 PolarHBondContact O-N 2.85Å; L1042-L1044 PolarHBondContact O-N 2.94Å; L1042-M1045 HydrophobicContact CD1-CE 3.79Å; L1042-M1045 PolarHBondContact O-N 3.39Å; L1042-A1046 VanDerWaalsContact O-CB 3.22Å; L1042-A1046 WeakPolarHBondContact O-CB 3.46Å; L1042-A1046 PolarHBondContact O-N 2.93Å
1043	K	80.7	Confident	82.7	Confident	67 Å²	67	53.6 Å²	53.6	29%	0.291	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-42.1	176.7	-79.6	175.9	178.9	175.9	0	112.6	K1039 Q1040 R1041 S1047 D1101	K1039-K1043 WeakPolarHBondContact O-CB 3.29Å; K1039-K1043 WeakPolarHBondContact O-CG 3.41Å; K1039-K1043 PolarHBondContact O-N 3.06Å; Q1040-K1043 PolarHBondContact O-N 3.12Å; R1041-K1043 PolarHBondContact O-N 3.34Å; K1043-S1047 WeakPolarHBondContact O-CB 3.32Å; K1043-S1047 PolarHBondContact O-N 3.32Å; K1043-S1047 VanDerWaalsContact O-N 3.12Å; K1043-D1101 IonicContact NZ-OD1 2.68Å; K1043-D1101 PolarHBondContact NZ-OD1 2.92Å; K1043-D1101 IonicContact NZ-OD2 3.18Å; K1043-D1101 PolarHBondContact NZ-OD2 3.31Å
1044	L	83.6	Confident	82.7	Confident	80 Å²	80	45.9 Å²	45.9	42%	0.419	22%	0.222	S	C	.	.	H	α-helix	trans	-66.8	-53.1	176.9	-70.7	170.3	0	0	0	111.2	Q1040 R1041 L1042 A1046 S1047 D1048 T1116	Q1040-L1044 HydrophobicContact CG-CD1 4.34Å; Q1040-L1044 WeakPolarHBondContact O-CG 3.41Å; Q1040-L1044 PolarHBondContact O-N 3.48Å; R1041-L1044 PolarHBondContact O-N 3.27Å; L1042-L1044 PolarHBondContact O-N 2.94Å; L1044-A1046 VanDerWaalsContact C-N 3.34Å; L1044-A1046 PolarHBondContact O-N 2.98Å; L1044-S1047 WeakPolarHBondContact O-CA 3.13Å; L1044-S1047 VanDerWaalsContact O-CB 3.32Å; L1044-S1047 WeakPolarHBondContact O-CB 3.38Å; L1044-S1047 PolarHBondContact O-N 3.3Å; L1044-D1048 PolarHBondContact O-N 3.36Å; L1044-T1116 HydrophobicContact CD2-CG2 4.35Å
1045	M	83.2	Confident	82.8	Confident	5 Å²	5	49 Å²	49	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-44.7	-179.9	-175.6	-161.7	76	0	0	112.1	E934 L1017 L1020 R1041 L1042 D1048 M1049	E934-M1045 HydrophobicContact CB-CG 4.35Å; E934-M1045 HydrophobicContact CB-SD 3.56Å; E934-M1045 VanDerWaalsContact CB-SD 3.56Å; E934-M1045 HydrophobicContact CG-CG 3.78Å; E934-M1045 HydrophobicContact CG-SD 3.68Å; L1017-M1045 HydrophobicContact CD2-CE 3.96Å; L1020-M1045 HydrophobicContact CD2-CE 3.48Å; L1020-M1045 VanDerWaalsContact CD2-CE 3.48Å; L1020-M1045 HydrophobicContact CD2-SD 4.4Å; R1041-M1045 VanDerWaalsContact O-CB 3.3Å; R1041-M1045 WeakPolarHBondContact O-CB 3.33Å; R1041-M1045 PolarHBondContact O-N 3.13Å; L1042-M1045 HydrophobicContact CD1-CE 3.79Å; L1042-M1045 PolarHBondContact O-N 3.39Å; M1045-D1048 PolarHBondContact O-N 3.41Å; M1045-M1049 HydrophobicContact CE-CE 4.46Å; M1045-M1049 HydrophobicContact CE-SD 4.22Å; M1045-M1049 HydrophobicContact CG-CE 3.42Å; M1045-M1049 VanDerWaalsContact CG-CE 3.42Å; M1045-M1049 HydrophobicContact CG-SD 3.83Å; M1045-M1049 WeakPolarHBondContact O-CB 3.4Å; M1045-M1049 WeakPolarHBondContact O-CG 3.42Å; M1045-M1049 PolarHBondContact O-N 3.46Å; M1045-M1049 HydrophobicContact SD-CE 3.93Å; M1045-M1049 HydrophobicContact SD-SD 4.41Å
1046	A	81.9	Confident	82.7	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-40	175.5	0	0	0	0	0	112.3	L1017 L1042 L1044 M1050 L1097	L1017-A1046 HydrophobicContact CD1-CB 4.49Å; L1017-A1046 HydrophobicContact CD2-CB 3.95Å; L1042-A1046 VanDerWaalsContact O-CB 3.22Å; L1042-A1046 WeakPolarHBondContact O-CB 3.46Å; L1042-A1046 PolarHBondContact O-N 2.93Å; L1044-A1046 VanDerWaalsContact C-N 3.34Å; L1044-A1046 PolarHBondContact O-N 2.98Å; A1046-M1050 WeakPolarHBondContact O-CB 3.3Å; A1046-M1050 WeakPolarHBondContact O-CE 3.49Å; A1046-M1050 VanDerWaalsContact O-CG 3.29Å; A1046-M1050 WeakPolarHBondContact O-CG 3.41Å; A1046-M1050 PolarHBondContact O-N 3.27Å; A1046-L1097 HydrophobicContact CB-CD1 4.07Å; A1046-L1097 HydrophobicContact CB-CD2 4.2Å
1047	S	82.4	Confident	82.8	Confident	18 Å²	18	45 Å²	45	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-50.6	174.5	179.8	0	0	0	0	111.4	K1043 L1044 M1049 M1050 E1051	K1043-S1047 WeakPolarHBondContact O-CB 3.32Å; K1043-S1047 PolarHBondContact O-N 3.32Å; K1043-S1047 VanDerWaalsContact O-N 3.12Å; L1044-S1047 WeakPolarHBondContact O-CA 3.13Å; L1044-S1047 VanDerWaalsContact O-CB 3.32Å; L1044-S1047 WeakPolarHBondContact O-CB 3.38Å; L1044-S1047 PolarHBondContact O-N 3.3Å; S1047-M1049 VanDerWaalsContact C-N 3.33Å; S1047-M1049 PolarHBondContact O-N 3.24Å; S1047-M1050 PolarHBondContact O-N 3.15Å; S1047-E1051 WeakPolarHBondContact O-CB 3.49Å; S1047-E1051 PolarHBondContact O-N 3.25Å
1048	D	81.9	Confident	82.6	Confident	99 Å²	99	43.4 Å²	43.4	53%	0.529	20%	0.204	S	C	.	.	H	α-helix	trans	-64.2	-38.6	-178.3	-67.5	-11.9	0	0	0	111.4	L1044 M1045 E1051 A1052	L1044-D1048 PolarHBondContact O-N 3.36Å; M1045-D1048 PolarHBondContact O-N 3.41Å; D1048-E1051 PolarHBondContact O-N 3.04Å; D1048-A1052 WeakPolarHBondContact O-CB 3.28Å; D1048-A1052 PolarHBondContact O-N 3.46Å
1049	M	83.6	Confident	82.5	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.059	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-40.9	176.2	-73.2	171.7	-179	0	0	113.3	E934 I937 I941 L1013 L1017 M1045 S1047 A1052 C1053	E934-M1049 HydrophobicContact CB-CE 4.35Å; E934-M1049 HydrophobicContact CG-CE 3.84Å; E934-M1049 WeakPolarHBondContact O-CE 3.41Å; I937-M1049 HydrophobicContact CB-CE 3.91Å; I937-M1049 HydrophobicContact CB-SD 3.81Å; I937-M1049 HydrophobicContact CD1-SD 4.2Å; I937-M1049 HydrophobicContact CG2-CE 4.06Å; I937-M1049 HydrophobicContact CG2-CG 4.2Å; I937-M1049 HydrophobicContact CG2-SD 3.36Å; I937-M1049 WeakPolarHBondContact CG2-SD 3.44Å; I941-M1049 HydrophobicContact CD1-CB 3.82Å; I941-M1049 HydrophobicContact CD1-CG 3.92Å; L1013-M1049 HydrophobicContact CD1-CB 4.31Å; L1017-M1049 HydrophobicContact CD1-CB 4.47Å; L1017-M1049 HydrophobicContact CD2-SD 3.89Å; M1045-M1049 HydrophobicContact CE-CE 4.46Å; M1045-M1049 HydrophobicContact CE-SD 4.22Å; M1045-M1049 HydrophobicContact CG-CE 3.42Å; M1045-M1049 VanDerWaalsContact CG-CE 3.42Å; M1045-M1049 HydrophobicContact CG-SD 3.83Å; M1045-M1049 WeakPolarHBondContact O-CB 3.4Å; M1045-M1049 WeakPolarHBondContact O-CG 3.42Å; M1045-M1049 PolarHBondContact O-N 3.46Å; M1045-M1049 HydrophobicContact SD-CE 3.93Å; M1045-M1049 HydrophobicContact SD-SD 4.41Å; S1047-M1049 VanDerWaalsContact C-N 3.33Å; S1047-M1049 PolarHBondContact O-N 3.24Å; M1049-A1052 PolarHBondContact O-N 3.01Å; M1049-C1053 WeakPolarHBondContact O-CB 3.18Å; M1049-C1053 PolarHBondContact O-N 3.31Å
1050	M	81.1	Confident	82.3	Confident	13 Å²	13	42.6 Å²	42.6	6%	0.064	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-44.2	172.5	-74.9	-173.6	-65	0	0	111.3	F1014 A1046 S1047 A1052 C1053 V1054 L1097	F1014-M1050 HydrophobicContact CE1-CG 4.4Å; A1046-M1050 WeakPolarHBondContact O-CB 3.3Å; A1046-M1050 WeakPolarHBondContact O-CE 3.49Å; A1046-M1050 VanDerWaalsContact O-CG 3.29Å; A1046-M1050 WeakPolarHBondContact O-CG 3.41Å; A1046-M1050 PolarHBondContact O-N 3.27Å; S1047-M1050 PolarHBondContact O-N 3.15Å; M1050-A1052 VanDerWaalsContact C-N 3.33Å; M1050-A1052 PolarHBondContact O-N 3.27Å; M1050-C1053 WeakPolarHBondContact O-CB 3.36Å; M1050-C1053 PolarHBondContact O-N 2.69Å; M1050-V1054 WeakPolarHBondContact O-CB 3.48Å; M1050-V1054 WeakPolarHBondContact O-CG2 2.99Å; M1050-V1054 PolarHBondContact O-N 3.08Å; M1050-L1097 HydrophobicContact CE-CD1 3.45Å; M1050-L1097 VanDerWaalsContact CE-CD1 3.45Å; M1050-L1097 HydrophobicContact SD-CD1 3.67Å
1051	E	82.2	Confident	82.1	Confident	39 Å²	39	39 Å²	39	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-38.9	176.7	-163.1	-172.1	-178.2	0	0	111.3	S1047 D1048 C1053 V1054 K1055 L1123	S1047-E1051 WeakPolarHBondContact O-CB 3.49Å; S1047-E1051 PolarHBondContact O-N 3.25Å; D1048-E1051 PolarHBondContact O-N 3.04Å; E1051-C1053 PolarHBondContact O-N 2.62Å; E1051-V1054 PolarHBondContact O-N 3.5Å; E1051-K1055 VanDerWaalsContact CD-CE 3.46Å; E1051-K1055 HydrophobicContact CG-CD 4.12Å; E1051-K1055 HydrophobicContact CG-CG 4.43Å; E1051-K1055 VanDerWaalsContact O-CB 3.3Å; E1051-K1055 WeakPolarHBondContact O-CB 3.27Å; E1051-K1055 VanDerWaalsContact O-CG 3.27Å; E1051-K1055 WeakPolarHBondContact O-CG 3.48Å; E1051-K1055 PolarHBondContact O-N 3.08Å; E1051-K1055 WeakPolarHBondContact OE1-CE 3.3Å; E1051-K1055 IonicContact OE1-NZ 2.93Å; E1051-K1055 PolarHBondContact OE1-NZ 3.37Å; E1051-K1055 IonicContact OE2-NZ 2.69Å; E1051-K1055 PolarHBondContact OE2-NZ 2.83Å; E1051-L1123 HydrophobicContact CB-CD1 4.46Å; E1051-L1123 HydrophobicContact CG-CD1 4.34Å
1052	A	82.7	Confident	81.9	Confident	24 Å²	24	40.8 Å²	40.8	20%	0.198	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-33.8	175.1	0	0	0	0	0	113.5	I941 D1048 M1049 M1050 R1056	I941-A1052 HydrophobicContact CG2-CB 4.43Å; D1048-A1052 WeakPolarHBondContact O-CB 3.28Å; D1048-A1052 PolarHBondContact O-N 3.46Å; M1049-A1052 PolarHBondContact O-N 3.01Å; M1050-A1052 VanDerWaalsContact C-N 3.33Å; M1050-A1052 PolarHBondContact O-N 3.27Å; A1052-R1056 WeakPolarHBondContact O-CG 3.15Å; A1052-R1056 PolarHBondContact O-N 2.83Å; A1052-R1056 PolarHBondContact O-NH1 2.94Å
1053	C	82.8	Confident	81.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70	-49.7	171.8	173.8	0	0	0	0	111.7	F945 L1013 M1049 M1050 E1051 R1056 T1057	F945-C1053 HydrophobicContact CE2-CB 4.31Å; F945-C1053 HydrophobicContact CZ-CB 4.47Å; F945-C1053 VanDerWaalsContact CZ-SG 3.53Å; L1013-C1053 HydrophobicContact CD2-CB 3.49Å; L1013-C1053 VanDerWaalsContact CD2-CB 3.49Å; M1049-C1053 WeakPolarHBondContact O-CB 3.18Å; M1049-C1053 PolarHBondContact O-N 3.31Å; M1050-C1053 WeakPolarHBondContact O-CB 3.36Å; M1050-C1053 PolarHBondContact O-N 2.69Å; E1051-C1053 PolarHBondContact O-N 2.62Å; C1053-R1056 PolarHBondContact O-N 3.12Å; C1053-T1057 WeakPolarHBondContact O-CB 3.41Å; C1053-T1057 PolarHBondContact O-N 3.35Å; C1053-T1057 PolarHBondContact O-OG1 3.05Å
1054	V	82.6	Confident	81.3	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-63.4	-43.4	179.8	167.3	0	0	0	0	111.5	M1050 E1051 R1056 T1057 K1058 L1087 A1090 L1123 M1126	M1050-V1054 WeakPolarHBondContact O-CB 3.48Å; M1050-V1054 WeakPolarHBondContact O-CG2 2.99Å; M1050-V1054 PolarHBondContact O-N 3.08Å; E1051-V1054 PolarHBondContact O-N 3.5Å; V1054-R1056 PolarHBondContact O-N 2.96Å; V1054-T1057 PolarHBondContact O-N 2.95Å; V1054-K1058 WeakPolarHBondContact O-CB 3.41Å; V1054-K1058 PolarHBondContact O-N 2.99Å; V1054-L1087 HydrophobicContact CB-CD2 4.24Å; V1054-L1087 HydrophobicContact CG1-CD2 3.78Å; V1054-L1087 HydrophobicContact CG2-CD2 4.05Å; V1054-A1090 HydrophobicContact CG2-CB 3.75Å; V1054-L1123 HydrophobicContact CB-CD1 3.91Å; V1054-L1123 HydrophobicContact CG1-CD1 3.9Å; V1054-L1123 HydrophobicContact CG1-CG 4.27Å; V1054-L1123 HydrophobicContact CG2-CD1 3.92Å; V1054-L1123 HydrophobicContact CG2-CD2 4.28Å; V1054-L1123 HydrophobicContact CG2-CG 4.13Å; V1054-M1126 HydrophobicContact CG1-CE 3.83Å
1055	K	83.5	Confident	80.7	Confident	96 Å²	96	43 Å²	43	42%	0.417	23%	0.225	S	C	.	.	H	α-helix	trans	-57.8	-48.3	175.2	-78.1	170.7	179.1	159.9	0	111.8	E1051 K1058 S1059 M1126	E1051-K1055 VanDerWaalsContact CD-CE 3.46Å; E1051-K1055 HydrophobicContact CG-CD 4.12Å; E1051-K1055 HydrophobicContact CG-CG 4.43Å; E1051-K1055 VanDerWaalsContact O-CB 3.3Å; E1051-K1055 WeakPolarHBondContact O-CB 3.27Å; E1051-K1055 VanDerWaalsContact O-CG 3.27Å; E1051-K1055 WeakPolarHBondContact O-CG 3.48Å; E1051-K1055 PolarHBondContact O-N 3.08Å; E1051-K1055 WeakPolarHBondContact OE1-CE 3.3Å; E1051-K1055 IonicContact OE1-NZ 2.93Å; E1051-K1055 PolarHBondContact OE1-NZ 3.37Å; E1051-K1055 IonicContact OE2-NZ 2.69Å; E1051-K1055 PolarHBondContact OE2-NZ 2.83Å; K1055-K1058 PolarHBondContact O-N 2.83Å; K1055-S1059 PolarHBondContact O-N 2.86Å; K1055-S1059 PolarHBondContact O-OG 2.87Å; K1055-M1126 HydrophobicContact CG-CE 4.22Å
1056	R	81.9	Confident	80.1	Confident	68 Å²	68	45.9 Å²	45.9	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-41.6	177.2	-74.2	179.1	-178	75.1	-8.2	112.3	H942 F945 A1052 C1053 V1054 K1058 S1059 A1060	H942-R1056 PolarHBondContact CD2-NH2 3.1Å; H942-R1056 PolarHBondContact CE1-NH2 3.29Å; H942-R1056 PolarHBondContact ND1-NH2 3.38Å; H942-R1056 PolarHBondContact NE2-NH2 2.98Å; F945-R1056 HydrophobicContact CB-CB 4.29Å; F945-R1056 HydrophobicContact CD1-CB 4.44Å; F945-R1056 HydrophobicContact CG-CB 4.18Å; A1052-R1056 WeakPolarHBondContact O-CG 3.15Å; A1052-R1056 PolarHBondContact O-N 2.83Å; A1052-R1056 PolarHBondContact O-NH1 2.94Å; C1053-R1056 PolarHBondContact O-N 3.12Å; V1054-R1056 PolarHBondContact O-N 2.96Å; R1056-K1058 VanDerWaalsContact C-N 3.35Å; R1056-K1058 PolarHBondContact O-N 3.01Å; R1056-S1059 PolarHBondContact O-N 3.02Å; R1056-A1060 WeakPolarHBondContact O-CB 3.28Å; R1056-A1060 PolarHBondContact O-N 3.22Å
1057	T	81.6	Confident	79.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-43	176.2	-58.9	0	0	0	0	111.6	W950 C1053 V1054 A1060 F1061 M1083 V1086 L1087	W950-T1057 HydrophobicContact CH2-CG2 4.02Å; W950-T1057 HydrophobicContact CZ3-CG2 3.87Å; C1053-T1057 WeakPolarHBondContact O-CB 3.41Å; C1053-T1057 PolarHBondContact O-N 3.35Å; C1053-T1057 PolarHBondContact O-OG1 3.05Å; V1054-T1057 PolarHBondContact O-N 2.95Å; T1057-A1060 PolarHBondContact O-N 2.85Å; T1057-F1061 WeakPolarHBondContact O-CB 3.35Å; T1057-F1061 PolarHBondContact O-N 3.18Å; T1057-M1083 HydrophobicContact CG2-CB 4.15Å; T1057-M1083 HydrophobicContact CG2-CG 4.39Å; T1057-V1086 HydrophobicContact CG2-CB 4.38Å; T1057-V1086 HydrophobicContact CG2-CG1 4.26Å; T1057-L1087 HydrophobicContact CG2-CD2 3.98Å; T1057-L1087 HydrophobicContact CG2-CG 3.99Å
1058	K	81.7	Confident	78.3	Confident	68 Å²	68	55 Å²	55	30%	0.296	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-48.8	173.9	179.4	167.1	178.6	166	0	112.3	V1054 K1055 R1056 A1060 F1061 E1062 M1126	V1054-K1058 WeakPolarHBondContact O-CB 3.41Å; V1054-K1058 PolarHBondContact O-N 2.99Å; K1055-K1058 PolarHBondContact O-N 2.83Å; R1056-K1058 VanDerWaalsContact C-N 3.35Å; R1056-K1058 PolarHBondContact O-N 3.01Å; K1058-A1060 VanDerWaalsContact C-N 3.3Å; K1058-A1060 PolarHBondContact O-N 3.24Å; K1058-F1061 WeakPolarHBondContact O-CB 3.38Å; K1058-F1061 PolarHBondContact O-N 2.68Å; K1058-E1062 WeakPolarHBondContact CE-OE1 3.32Å; K1058-E1062 HydrophobicContact CG-CG 4.45Å; K1058-E1062 WeakPolarHBondContact CG-OE1 3.45Å; K1058-E1062 WeakPolarHBondContact O-CG 3.48Å; K1058-E1062 PolarHBondContact O-N 3.25Å; K1058-M1126 HydrophobicContact CD-CB 4.4Å; K1058-M1126 HydrophobicContact CD-CG 4.37Å; K1058-M1126 HydrophobicContact CD-SD 3.82Å
1059	S	81.9	Confident	76.9	Confident	73 Å²	73	54.8 Å²	54.8	51%	0.51	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-37.1	176.9	-59.6	0	0	0	0	112.7	K1055 R1056 A1063	K1055-S1059 PolarHBondContact O-N 2.86Å; K1055-S1059 PolarHBondContact O-OG 2.87Å; R1056-S1059 PolarHBondContact O-N 3.02Å; S1059-A1063 WeakPolarHBondContact O-CB 3.41Å; S1059-A1063 PolarHBondContact O-N 3.15Å
1060	A	78.4	Confident	75.5	Confident	25 Å²	25	65.1 Å²	65.1	21%	0.207	34%	0.336	C	S	.	.	H	α-helix	trans	-69.3	-39.5	175.1	0	0	0	0	0	112.3	W950 R1056 T1057 K1058 K1064 M1083	W950-A1060 HydrophobicContact CH2-CB 4.11Å; W950-A1060 HydrophobicContact CZ2-CB 3.37Å; R1056-A1060 WeakPolarHBondContact O-CB 3.28Å; R1056-A1060 PolarHBondContact O-N 3.22Å; T1057-A1060 PolarHBondContact O-N 2.85Å; K1058-A1060 VanDerWaalsContact C-N 3.3Å; K1058-A1060 PolarHBondContact O-N 3.24Å; A1060-K1064 VanDerWaalsContact O-CB 3.29Å; A1060-K1064 WeakPolarHBondContact O-CB 3.24Å; A1060-K1064 PolarHBondContact O-N 2.85Å; A1060-M1083 HydrophobicContact CB-CE 3.82Å
1061	F	78.9	Confident	74.2	Confident	50 Å²	50	68 Å²	68	22%	0.219	36%	0.357	C	S	.	.	H	α-helix	trans	-61.5	-50.8	172.7	169.2	-95.8	0	0	0	111.5	T1057 K1058 A1063 K1064 M1065 V1080 M1083 F1084	T1057-F1061 WeakPolarHBondContact O-CB 3.35Å; T1057-F1061 PolarHBondContact O-N 3.18Å; K1058-F1061 WeakPolarHBondContact O-CB 3.38Å; K1058-F1061 PolarHBondContact O-N 2.68Å; F1061-A1063 PolarHBondContact O-N 2.95Å; F1061-K1064 PolarHBondContact O-N 2.87Å; F1061-K1064 VanDerWaalsContact O-N 3.1Å; F1061-M1065 HydrophobicContact CD1-CG 4.31Å; F1061-M1065 HydrophobicContact CD2-CG 4.16Å; F1061-M1065 HydrophobicContact CE1-CG 3.95Å; F1061-M1065 HydrophobicContact CE2-CG 3.78Å; F1061-M1065 HydrophobicContact CE2-SD 4.11Å; F1061-M1065 HydrophobicContact CG-CG 4.41Å; F1061-M1065 HydrophobicContact CZ-CE 4.46Å; F1061-M1065 HydrophobicContact CZ-CG 3.68Å; F1061-M1065 HydrophobicContact CZ-SD 4.16Å; F1061-M1065 WeakPolarHBondContact O-CB 3.41Å; F1061-M1065 WeakPolarHBondContact O-CG 3.42Å; F1061-M1065 PolarHBondContact O-N 2.9Å; F1061-V1080 HydrophobicContact CD2-CG1 4.06Å; F1061-V1080 HydrophobicContact CE2-CG1 3.72Å; F1061-M1083 HydrophobicContact CB-SD 3.89Å; F1061-M1083 HydrophobicContact CD2-SD 4.29Å; F1061-F1084 AromaticContact CE2-CE2 3.8Å; F1061-F1084 HydrophobicContact CE2-CE2 3.8Å; F1061-F1084 HydrophobicContact CE2-CZ 4.37Å; F1061-F1084 HydrophobicContact CZ-CE2 4.25Å; F1061-F1084 HydrophobicContact CZ-CZ 4.42Å
1062	E	79.6	Confident	72.7	Confident	102 Å²	102	72.7 Å²	72.7	48%	0.477	39%	0.389	S	S	.	.	H	α-helix	trans	-57.9	-46.9	176.7	-72.1	170.5	-177.5	0	0	111.3	K1058 K1064 M1065 A1066	K1058-E1062 WeakPolarHBondContact CE-OE1 3.32Å; K1058-E1062 HydrophobicContact CG-CG 4.45Å; K1058-E1062 WeakPolarHBondContact CG-OE1 3.45Å; K1058-E1062 WeakPolarHBondContact O-CG 3.48Å; K1058-E1062 PolarHBondContact O-N 3.25Å; E1062-K1064 VanDerWaalsContact C-N 3.28Å; E1062-K1064 PolarHBondContact O-N 3.48Å; E1062-M1065 PolarHBondContact O-N 3.34Å; E1062-A1066 VanDerWaalsContact O-CB 3.3Å; E1062-A1066 WeakPolarHBondContact O-CB 3.46Å; E1062-A1066 PolarHBondContact O-N 3.36Å
1063	A	78.1	Confident	71.2	Confident	49 Å²	49	79 Å²	79	41%	0.405	41%	0.414	S	S	.	.	H	α-helix	trans	-66.8	-24.1	177.2	0	0	0	0	0	114	S1059 F1061 K1067	S1059-A1063 WeakPolarHBondContact O-CB 3.41Å; S1059-A1063 PolarHBondContact O-N 3.15Å; F1061-A1063 PolarHBondContact O-N 2.95Å; A1063-K1067 WeakPolarHBondContact O-CD 3.5Å; A1063-K1067 WeakPolarHBondContact O-CG 3.48Å
1064	K	74	Confident	69.8	Low	64 Å²	64	89.3 Å²	89.3	28%	0.278	46%	0.459	S	S	.	.	H	α-helix	trans	-85.3	-42.9	175.9	-154.4	160.3	-164.7	175.8	0	111.1	A1060 F1061 E1062 A1066 K1067 T1068 S1079 M1083	A1060-K1064 VanDerWaalsContact O-CB 3.29Å; A1060-K1064 WeakPolarHBondContact O-CB 3.24Å; A1060-K1064 PolarHBondContact O-N 2.85Å; F1061-K1064 PolarHBondContact O-N 2.87Å; F1061-K1064 VanDerWaalsContact O-N 3.1Å; E1062-K1064 VanDerWaalsContact C-N 3.28Å; E1062-K1064 PolarHBondContact O-N 3.48Å; K1064-A1066 VanDerWaalsContact C-N 3.31Å; K1064-A1066 PolarHBondContact O-N 3.39Å; K1064-K1067 WeakPolarHBondContact O-CB 3.38Å; K1064-K1067 PolarHBondContact O-N 2.87Å; K1064-T1068 PolarHBondContact O-N 3.3Å; K1064-T1068 PolarHBondContact O-OG1 3.41Å; K1064-S1079 VanDerWaalsContact CE-OG 3.32Å; K1064-S1079 WeakPolarHBondContact CE-OG 3.44Å; K1064-S1079 VanDerWaalsContact NZ-CB 3.33Å; K1064-S1079 PolarHBondContact NZ-OG 3.1Å; K1064-M1083 HydrophobicContact CB-CE 4.44Å; K1064-M1083 HydrophobicContact CD-CE 3.99Å
1065	M	71.3	Confident	68.6	Low	95 Å²	95	99.3 Å²	99.3	47%	0.468	50%	0.497	S	S	.	.	H	α-helix	trans	-56.8	-43	171	-72	-66.4	-74.2	0	0	111.9	F1061 E1062 K1067 T1068 S1069	F1061-M1065 HydrophobicContact CD1-CG 4.31Å; F1061-M1065 HydrophobicContact CD2-CG 4.16Å; F1061-M1065 HydrophobicContact CE1-CG 3.95Å; F1061-M1065 HydrophobicContact CE2-CG 3.78Å; F1061-M1065 HydrophobicContact CE2-SD 4.11Å; F1061-M1065 HydrophobicContact CG-CG 4.41Å; F1061-M1065 HydrophobicContact CZ-CE 4.46Å; F1061-M1065 HydrophobicContact CZ-CG 3.68Å; F1061-M1065 HydrophobicContact CZ-SD 4.16Å; F1061-M1065 WeakPolarHBondContact O-CB 3.41Å; F1061-M1065 WeakPolarHBondContact O-CG 3.42Å; F1061-M1065 PolarHBondContact O-N 2.9Å; E1062-M1065 PolarHBondContact O-N 3.34Å; M1065-K1067 PolarHBondContact O-N 3.34Å; M1065-T1068 PolarHBondContact O-N 3.28Å; M1065-S1069 PolarHBondContact O-N 2.77Å
1066	A	69.9	Low	67.4	Low	67 Å²	67	99.7 Å²	99.7	55%	0.554	51%	0.507	S	S	*	.	H	α-helix	trans	-64.8	-16.5	175.6	0	0	0	0	0	114.5	E1062 K1064 S1069	E1062-A1066 VanDerWaalsContact O-CB 3.3Å; E1062-A1066 WeakPolarHBondContact O-CB 3.46Å; E1062-A1066 PolarHBondContact O-N 3.36Å; K1064-A1066 VanDerWaalsContact C-N 3.31Å; K1064-A1066 PolarHBondContact O-N 3.39Å; A1066-S1069 PolarHBondContact O-OG 2.91Å
1067	K	67.4	Low	66.6	Low	163 Å²	163	98.8 Å²	98.8	71%	0.709	51%	0.51	S	S	*	.	H	α-helix	trans	-95.1	-39	172.9	-69	170.1	-175.6	175.1	0	111.8	A1063 K1064 M1065 S1069	A1063-K1067 WeakPolarHBondContact O-CD 3.5Å; A1063-K1067 WeakPolarHBondContact O-CG 3.48Å; K1064-K1067 WeakPolarHBondContact O-CB 3.38Å; K1064-K1067 PolarHBondContact O-N 2.87Å; M1065-K1067 PolarHBondContact O-N 3.34Å; K1067-S1069 VanDerWaalsContact C-N 3.32Å; K1067-S1069 PolarHBondContact O-N 3.48Å
1068	T	58.8	Low	65.9	Low	47 Å²	47	103.6 Å²	103.6	29%	0.288	54%	0.535	S	S	.	.	H	α-helix	trans	-72.7	-20.4	179.9	-57.6	0	0	0	0	113.3	K1064 M1065 R1070 S1071 P1077	K1064-T1068 PolarHBondContact O-N 3.3Å; K1064-T1068 PolarHBondContact O-OG1 3.41Å; M1065-T1068 PolarHBondContact O-N 3.28Å; T1068-R1070 PolarHBondContact O-N 2.91Å; T1068-S1071 PolarHBondContact O-N 2.91Å; T1068-S1071 VanDerWaalsContact O-N 3.1Å; T1068-S1071 PolarHBondContact O-OG 2.89Å; T1068-P1077 HydrophobicContact CG2-CG 4.32Å
1069	S	52.5	Low	65.3	Low	94 Å²	94	101 Å²	101	66%	0.657	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	3.4	174.3	62.5	0	0	0	0	115.8	M1065 A1066 K1067	M1065-S1069 PolarHBondContact O-N 2.77Å; A1066-S1069 PolarHBondContact O-OG 2.91Å; K1067-S1069 VanDerWaalsContact C-N 3.32Å; K1067-S1069 PolarHBondContact O-N 3.48Å
1070	R	54.9	Low	64.8	Low	230 Å²	230	97.9 Å²	97.9	87%	0.868	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-0.7	176.5	-60.3	-174	179.7	-163.8	-1.1	114.4	T1068	T1068-R1070 PolarHBondContact O-N 2.91Å
1071	S	52.7	Low	64.5	Low	73 Å²	73	99.2 Å²	99.2	51%	0.51	51%	0.511	S	S	.	.			trans	-112.2	139.1	179	51.8	0	0	0	0	112.1	T1068	T1068-S1071 PolarHBondContact O-N 2.91Å; T1068-S1071 VanDerWaalsContact O-N 3.1Å; T1068-S1071 PolarHBondContact O-OG 2.89Å
1072	T	52.2	Low	64.2	Low	137 Å²	137	97 Å²	97	84%	0.84	50%	0.501	S	S	*	.			trans	-91.8	10	-174.2	44.1	0	0	0	0	115
1073	E	50.1	Low	64.1	Low	156 Å²	156	92.2 Å²	92.2	73%	0.729	48%	0.479	S	S	*	.			trans	-82.2	118.5	176.3	-64.9	-161.8	151.6	0	0	111.7	R1075	E1073-R1075 PolarHBondContact O-N 3.19Å
1074	F	53.6	Low	63.9	Low	217 Å²	217	94.6 Å²	94.6	95%	0.952	48%	0.48	S	S	*	.			trans	-75.7	46.6	177	-69.5	-90	0	0	0	113.2
1075	R	56.7	Low	64.2	Low	212 Å²	212	93.8 Å²	93.8	80%	0.8	48%	0.479	S	S	*	.			trans	-124.8	126.5	175.6	-76.6	-177.4	169.3	178.2	-3.4	110.5	E1073 P1077	E1073-R1075 PolarHBondContact O-N 3.19Å; R1075-P1077 WeakPolarHBondContact O-CD 3.15Å
1076	V	59.7	Low	64.5	Low	103 Å²	103	89.2 Å²	89.2	62%	0.624	46%	0.457	S	S	*	.			trans	-65.9	123.4	173	-178.8	0	0	0	0	108.7	V1080	V1076-V1080 HydrophobicContact CG1-CB 3.93Å; V1076-V1080 HydrophobicContact CG1-CG1 3.95Å
1077	P	65.1	Low	64.9	Low	49 Å²	49	86.8 Å²	86.8	32%	0.318	43%	0.434	S	S	.	.			trans	-63.9	137.8	177.6	-22.3	33.8	0	0	0	111	T1068 R1075 S1079 V1080	T1068-P1077 HydrophobicContact CG2-CG 4.32Å; R1075-P1077 WeakPolarHBondContact O-CD 3.15Å; P1077-S1079 PolarHBondContact O-N 3.43Å; P1077-V1080 HydrophobicContact CB-CG2 4.37Å; P1077-V1080 HydrophobicContact CG-CG2 4.42Å; P1077-V1080 WeakPolarHBondContact O-CB 3.21Å; P1077-V1080 PolarHBondContact O-N 2.78Å
1078	L	66.8	Low	65.2	Low	102 Å²	102	83.7 Å²	83.7	53%	0.534	43%	0.425	S	S	.	.	H	α-helix	trans	-54	-33.5	-175.6	-173.9	64.1	0	0	0	113.3	L955 V1080 C1081 T1082	L955-L1078 HydrophobicContact CD1-CD2 3.56Å; L1078-V1080 VanDerWaalsContact C-N 3.27Å; L1078-V1080 PolarHBondContact O-N 2.92Å; L1078-C1081 WeakPolarHBondContact O-CB 3.03Å; L1078-C1081 PolarHBondContact O-N 3.11Å; L1078-C1081 VanDerWaalsContact O-N 3.17Å; L1078-T1082 PolarHBondContact O-N 2.98Å; L1078-T1082 PolarHBondContact O-OG1 3.26Å
1079	S	67.8	Low	65.9	Low	14 Å²	14	82.4 Å²	82.4	10%	0.098	42%	0.416	C	S	.	.	H	α-helix	trans	-63.9	-27.3	175.5	60.1	0	0	0	0	114.7	W950 K1064 P1077 T1082 M1083	W950-S1079 WeakPolarHBondContact O-CA 3.29Å; W950-S1079 WeakPolarHBondContact O-CB 3.47Å; K1064-S1079 VanDerWaalsContact CE-OG 3.32Å; K1064-S1079 WeakPolarHBondContact CE-OG 3.44Å; K1064-S1079 VanDerWaalsContact NZ-CB 3.33Å; K1064-S1079 PolarHBondContact NZ-OG 3.1Å; P1077-S1079 PolarHBondContact O-N 3.43Å; S1079-T1082 PolarHBondContact O-N 3.24Å; S1079-M1083 VanDerWaalsContact O-CG 3.27Å; S1079-M1083 WeakPolarHBondContact O-CG 3.25Å; S1079-M1083 PolarHBondContact O-N 3.49Å
1080	V	71.8	Confident	67	Low	7 Å²	7	78 Å²	78	4%	0.042	39%	0.385	C	S	.	.	H	α-helix	trans	-72.5	-39.1	175	173.9	0	0	0	0	109.7	F1061 V1076 P1077 L1078 T1082 M1083 F1084	F1061-V1080 HydrophobicContact CD2-CG1 4.06Å; F1061-V1080 HydrophobicContact CE2-CG1 3.72Å; V1076-V1080 HydrophobicContact CG1-CB 3.93Å; V1076-V1080 HydrophobicContact CG1-CG1 3.95Å; P1077-V1080 HydrophobicContact CB-CG2 4.37Å; P1077-V1080 HydrophobicContact CG-CG2 4.42Å; P1077-V1080 WeakPolarHBondContact O-CB 3.21Å; P1077-V1080 PolarHBondContact O-N 2.78Å; L1078-V1080 VanDerWaalsContact C-N 3.27Å; L1078-V1080 PolarHBondContact O-N 2.92Å; V1080-T1082 VanDerWaalsContact C-N 3.31Å; V1080-T1082 PolarHBondContact O-N 3.15Å; V1080-M1083 WeakPolarHBondContact O-CB 3.22Å; V1080-M1083 PolarHBondContact O-N 3.32Å; V1080-F1084 HydrophobicContact CG1-CD2 4.05Å; V1080-F1084 HydrophobicContact CG1-CE2 4.13Å; V1080-F1084 WeakPolarHBondContact O-CD2 3.36Å; V1080-F1084 PolarHBondContact O-N 2.87Å
1081	C	71.7	Confident	68	Low	53 Å²	53	70.9 Å²	70.9	36%	0.358	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-41.5	169.9	-52.4	0	0	0	0	111.1	L1078 F1084 N1085	L1078-C1081 WeakPolarHBondContact O-CB 3.03Å; L1078-C1081 PolarHBondContact O-N 3.11Å; L1078-C1081 VanDerWaalsContact O-N 3.17Å; C1081-F1084 PolarHBondContact O-N 3.23Å; C1081-N1085 VanDerWaalsContact O-CG 3.28Å; C1081-N1085 PolarHBondContact O-N 3.5Å; C1081-N1085 PolarHBondContact O-OD1 2.88Å
1082	T	73.6	Confident	69	Low	2 Å²	2	73.3 Å²	73.3	1%	0.012	36%	0.362	C	S	.	.	H	α-helix	trans	-61.9	-42.6	173.8	-50.8	0	0	0	0	112.1	S952 L1078 S1079 V1080 F1084 N1085 V1086	S952-T1082 PolarHBondContact N-OG1 3.29Å; L1078-T1082 PolarHBondContact O-N 2.98Å; L1078-T1082 PolarHBondContact O-OG1 3.26Å; S1079-T1082 PolarHBondContact O-N 3.24Å; V1080-T1082 VanDerWaalsContact C-N 3.31Å; V1080-T1082 PolarHBondContact O-N 3.15Å; T1082-F1084 PolarHBondContact O-N 3.42Å; T1082-N1085 WeakPolarHBondContact O-CB 3.38Å; T1082-N1085 PolarHBondContact O-N 2.99Å; T1082-V1086 WeakPolarHBondContact O-CG2 3.4Å; T1082-V1086 PolarHBondContact O-N 2.71Å
1083	M	77.3	Confident	69.8	Low	2 Å²	2	68.7 Å²	68.7	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-58.9	-46.1	173.1	-72.1	161.5	167.3	0	0	112.2	W950 T1057 A1060 F1061 K1064 S1079 V1080 N1085 V1086 L1087	W950-M1083 HydrophobicContact CB-CE 4.45Å; W950-M1083 HydrophobicContact CD2-CE 3.46Å; W950-M1083 VanDerWaalsContact CD2-CE 3.46Å; W950-M1083 HydrophobicContact CD2-CG 3.91Å; W950-M1083 HydrophobicContact CE3-CB 4.44Å; W950-M1083 HydrophobicContact CE3-CE 3.93Å; W950-M1083 HydrophobicContact CE3-CG 3.35Å; W950-M1083 HydrophobicContact CG-CE 3.7Å; W950-M1083 HydrophobicContact CH2-CG 4.44Å; W950-M1083 HydrophobicContact CZ2-CE 4.2Å; W950-M1083 HydrophobicContact CZ3-CE 4.46Å; W950-M1083 HydrophobicContact CZ3-CG 3.67Å; T1057-M1083 HydrophobicContact CG2-CB 4.15Å; T1057-M1083 HydrophobicContact CG2-CG 4.39Å; A1060-M1083 HydrophobicContact CB-CE 3.82Å; F1061-M1083 HydrophobicContact CB-SD 3.89Å; F1061-M1083 HydrophobicContact CD2-SD 4.29Å; K1064-M1083 HydrophobicContact CB-CE 4.44Å; K1064-M1083 HydrophobicContact CD-CE 3.99Å; S1079-M1083 VanDerWaalsContact O-CG 3.27Å; S1079-M1083 WeakPolarHBondContact O-CG 3.25Å; S1079-M1083 PolarHBondContact O-N 3.49Å; V1080-M1083 WeakPolarHBondContact O-CB 3.22Å; V1080-M1083 PolarHBondContact O-N 3.32Å; M1083-N1085 VanDerWaalsContact C-N 3.35Å; M1083-N1085 PolarHBondContact O-N 2.93Å; M1083-V1086 PolarHBondContact O-N 3.33Å; M1083-L1087 WeakPolarHBondContact O-CG 3.43Å; M1083-L1087 PolarHBondContact O-N 3.5Å; M1083-L1087 VanDerWaalsContact O-N 3.15Å
1084	F	75.1	Confident	70.7	Confident	100 Å²	100	61.7 Å²	61.7	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-62.5	-39.7	175.5	-90.8	-72.9	0	0	0	112.6	F1061 V1080 C1081 T1082 L1087 L1088	F1061-F1084 AromaticContact CE2-CE2 3.8Å; F1061-F1084 HydrophobicContact CE2-CE2 3.8Å; F1061-F1084 HydrophobicContact CE2-CZ 4.37Å; F1061-F1084 HydrophobicContact CZ-CE2 4.25Å; F1061-F1084 HydrophobicContact CZ-CZ 4.42Å; V1080-F1084 HydrophobicContact CG1-CD2 4.05Å; V1080-F1084 HydrophobicContact CG1-CE2 4.13Å; V1080-F1084 WeakPolarHBondContact O-CD2 3.36Å; V1080-F1084 PolarHBondContact O-N 2.87Å; C1081-F1084 PolarHBondContact O-N 3.23Å; T1082-F1084 PolarHBondContact O-N 3.42Å; F1084-L1087 WeakPolarHBondContact O-CB 3.34Å; F1084-L1087 PolarHBondContact O-N 3.29Å; F1084-L1088 WeakPolarHBondContact O-CG 3.33Å; F1084-L1088 PolarHBondContact O-N 3.14Å
1085	N	78.7	Confident	71.2	Confident	46 Å²	46	54.4 Å²	54.4	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-41.6	175.2	-74.3	-0.3	0	0	0	112.4	N1005 C1081 T1082 M1083 L1087 L1088 D1089	N1005-N1085 HydrophobicContact CB-CB 4.11Å; N1005-N1085 WeakPolarHBondContact O-CB 3.47Å; N1005-N1085 PolarHBondContact O-ND2 2.94Å; C1081-N1085 VanDerWaalsContact O-CG 3.28Å; C1081-N1085 PolarHBondContact O-N 3.5Å; C1081-N1085 PolarHBondContact O-OD1 2.88Å; T1082-N1085 WeakPolarHBondContact O-CB 3.38Å; T1082-N1085 PolarHBondContact O-N 2.99Å; M1083-N1085 VanDerWaalsContact C-N 3.35Å; M1083-N1085 PolarHBondContact O-N 2.93Å; N1085-L1087 VanDerWaalsContact C-N 3.29Å; N1085-L1087 PolarHBondContact O-N 3.5Å; N1085-L1088 PolarHBondContact O-N 3.22Å; N1085-D1089 PolarHBondContact O-N 2.84Å
1086	V	78.9	Confident	71.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-40.8	174.7	172.1	0	0	0	0	111.1	S1010 T1057 T1082 M1083 A1090	S1010-V1086 WeakPolarHBondContact OG-CG2 3.47Å; T1057-V1086 HydrophobicContact CG2-CB 4.38Å; T1057-V1086 HydrophobicContact CG2-CG1 4.26Å; T1082-V1086 WeakPolarHBondContact O-CG2 3.4Å; T1082-V1086 PolarHBondContact O-N 2.71Å; M1083-V1086 PolarHBondContact O-N 3.33Å; V1086-A1090 VanDerWaalsContact O-CB 3.24Å; V1086-A1090 WeakPolarHBondContact O-CB 3.47Å; V1086-A1090 PolarHBondContact O-N 2.85Å
1087	L	77.1	Confident	71.6	Confident	15 Å²	15	45 Å²	45	8%	0.079	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-40	175.8	-66.1	177.1	0	0	0	112.7	V1054 T1057 M1083 F1084 N1085 K1091 I1127	V1054-L1087 HydrophobicContact CB-CD2 4.24Å; V1054-L1087 HydrophobicContact CG1-CD2 3.78Å; V1054-L1087 HydrophobicContact CG2-CD2 4.05Å; T1057-L1087 HydrophobicContact CG2-CD2 3.98Å; T1057-L1087 HydrophobicContact CG2-CG 3.99Å; M1083-L1087 WeakPolarHBondContact O-CG 3.43Å; M1083-L1087 PolarHBondContact O-N 3.5Å; M1083-L1087 VanDerWaalsContact O-N 3.15Å; F1084-L1087 WeakPolarHBondContact O-CB 3.34Å; F1084-L1087 PolarHBondContact O-N 3.29Å; N1085-L1087 VanDerWaalsContact C-N 3.29Å; N1085-L1087 PolarHBondContact O-N 3.5Å; L1087-K1091 PolarHBondContact O-N 3.46Å; L1087-K1091 VanDerWaalsContact O-N 3.1Å; L1087-I1127 HydrophobicContact CB-CD1 4.45Å; L1087-I1127 HydrophobicContact CB-CG1 4.19Å; L1087-I1127 HydrophobicContact CD2-CG1 4.36Å
1088	L	74.8	Confident	71	Confident	99 Å²	99	45.9 Å²	45.9	52%	0.518	24%	0.239	S	C	.	.	H	α-helix	trans	-68.6	-40.1	177.4	-71.8	171.5	0	0	0	112.4	F1084 N1085 K1091 K1092	F1084-L1088 WeakPolarHBondContact O-CG 3.33Å; F1084-L1088 PolarHBondContact O-N 3.14Å; N1085-L1088 PolarHBondContact O-N 3.22Å; L1088-K1091 WeakPolarHBondContact O-CB 3.15Å; L1088-K1091 PolarHBondContact O-N 3.4Å; L1088-K1092 PolarHBondContact O-N 2.82Å; L1088-K1092 VanDerWaalsContact O-N 3.11Å
1089	D	72.8	Confident	70	Confident	20 Å²	20	45.9 Å²	45.9	11%	0.107	24%	0.243	C	C	.	.	H	α-helix	trans	-74.1	-38.5	175.9	-157.8	68.9	0	0	0	111.4	F1014 N1085 K1091 K1092 Q1093	F1014-D1089 WeakPolarHBondContact CD2-OD2 3.44Å; F1014-D1089 HydrophobicContact CE2-CB 4.28Å; N1085-D1089 PolarHBondContact O-N 2.84Å; D1089-K1091 PolarHBondContact O-N 2.83Å; D1089-K1092 CarbonylContact O-C 3.59Å; D1089-K1092 WeakPolarHBondContact O-CA 3.21Å; D1089-K1092 WeakPolarHBondContact O-CB 3.39Å; D1089-K1092 PolarHBondContact O-N 3.4Å; D1089-K1092 WeakPolarHBondContact OD1-CD 3.48Å; D1089-K1092 IonicContact OD1-NZ 3.32Å; D1089-K1092 PolarHBondContact OD1-NZ 2.84Å; D1089-Q1093 WeakPolarHBondContact O-CG 3.43Å; D1089-Q1093 PolarHBondContact O-N 3.3Å; D1089-Q1093 WeakPolarHBondContact OD2-CG 3.49Å; D1089-Q1093 PolarHBondContact OD2-NE2 3.24Å
1090	A	75.7	Confident	68.9	Low	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-52.4	-42.1	169.7	0	0	0	0	0	112	F1014 V1054 V1086 S1094	F1014-A1090 HydrophobicContact CE1-CB 4.45Å; F1014-A1090 HydrophobicContact CZ-CB 3.86Å; V1054-A1090 HydrophobicContact CG2-CB 3.75Å; V1086-A1090 VanDerWaalsContact O-CB 3.24Å; V1086-A1090 WeakPolarHBondContact O-CB 3.47Å; V1086-A1090 PolarHBondContact O-N 2.85Å; A1090-S1094 VanDerWaalsContact O-CB 3.28Å; A1090-S1094 WeakPolarHBondContact O-CB 3.38Å; A1090-S1094 PolarHBondContact O-N 2.93Å; A1090-S1094 PolarHBondContact O-OG 3.4Å
1091	K	75.1	Confident	67.4	Low	81 Å²	81	54.7 Å²	54.7	35%	0.352	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-41.4	174.2	-173.1	174	-179.5	175.7	0	112.4	L1087 L1088 D1089 S1094 S1095 I1127	L1087-K1091 PolarHBondContact O-N 3.46Å; L1087-K1091 VanDerWaalsContact O-N 3.1Å; L1088-K1091 WeakPolarHBondContact O-CB 3.15Å; L1088-K1091 PolarHBondContact O-N 3.4Å; D1089-K1091 PolarHBondContact O-N 2.83Å; K1091-S1094 PolarHBondContact O-OG 2.97Å; K1091-S1095 PolarHBondContact O-N 3.17Å; K1091-I1127 HydrophobicContact CB-CD1 4.19Å; K1091-I1127 HydrophobicContact CD-CG2 4.42Å
1092	K	74.3	Confident	65.6	Low	125 Å²	125	57.4 Å²	57.4	54%	0.543	31%	0.307	S	S	.	.	H	α-helix	trans	-69.6	-39.9	177.8	-179.8	-178.6	155.4	-145	0	113.3	L1088 D1089 S1095 K1096	L1088-K1092 PolarHBondContact O-N 2.82Å; L1088-K1092 VanDerWaalsContact O-N 3.11Å; D1089-K1092 CarbonylContact O-C 3.59Å; D1089-K1092 WeakPolarHBondContact O-CA 3.21Å; D1089-K1092 WeakPolarHBondContact O-CB 3.39Å; D1089-K1092 PolarHBondContact O-N 3.4Å; D1089-K1092 WeakPolarHBondContact OD1-CD 3.48Å; D1089-K1092 IonicContact OD1-NZ 3.32Å; D1089-K1092 PolarHBondContact OD1-NZ 2.84Å; K1092-S1095 PolarHBondContact O-OG 3.5Å; K1092-K1096 PolarHBondContact O-N 3.43Å
1093	Q	69.9	Low	63.5	Low	39 Å²	39	65 Å²	65	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-70.8	-37.3	173.9	-54.1	-56.6	-11.3	0	0	110.9	F1014 D1089 S1095 K1096 L1097	F1014-Q1093 HydrophobicContact CB-CG 4.33Å; F1014-Q1093 HydrophobicContact CD1-CB 4.36Å; F1014-Q1093 HydrophobicContact CD1-CG 4Å; F1014-Q1093 HydrophobicContact CD2-CG 4.14Å; F1014-Q1093 HydrophobicContact CE1-CG 4.37Å; F1014-Q1093 HydrophobicContact CE2-CG 4.48Å; F1014-Q1093 HydrophobicContact CG-CG 3.91Å; D1089-Q1093 WeakPolarHBondContact O-CG 3.43Å; D1089-Q1093 PolarHBondContact O-N 3.3Å; D1089-Q1093 WeakPolarHBondContact OD2-CG 3.49Å; D1089-Q1093 PolarHBondContact OD2-NE2 3.24Å; Q1093-S1095 VanDerWaalsContact C-N 3.28Å; Q1093-S1095 PolarHBondContact O-N 3.34Å; Q1093-K1096 WeakPolarHBondContact O-CB 3.36Å; Q1093-K1096 PolarHBondContact O-N 2.87Å; Q1093-K1096 VanDerWaalsContact O-N 3.15Å; Q1093-L1097 PolarHBondContact O-N 3.19Å
1094	S	67.6	Low	61.2	Low	9 Å²	9	73.1 Å²	73.1	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-61.5	-34	177.2	75.8	0	0	0	0	113.1	A1090 K1091 C1098	A1090-S1094 VanDerWaalsContact O-CB 3.28Å; A1090-S1094 WeakPolarHBondContact O-CB 3.38Å; A1090-S1094 PolarHBondContact O-N 2.93Å; A1090-S1094 PolarHBondContact O-OG 3.4Å; K1091-S1094 PolarHBondContact O-OG 2.97Å; S1094-C1098 PolarHBondContact O-N 3.36Å; S1094-C1098 PolarHBondContact O-SG 3.26Å
1095	S	65.4	Low	59	Low	65 Å²	65	77.2 Å²	77.2	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-74.9	-39	172.9	60.7	0	0	0	0	112.6	K1091 K1092 Q1093 L1097 C1098 V1099	K1091-S1095 PolarHBondContact O-N 3.17Å; K1092-S1095 PolarHBondContact O-OG 3.5Å; Q1093-S1095 VanDerWaalsContact C-N 3.28Å; Q1093-S1095 PolarHBondContact O-N 3.34Å; S1095-L1097 VanDerWaalsContact C-N 3.26Å; S1095-L1097 PolarHBondContact O-N 2.89Å; S1095-C1098 PolarHBondContact O-N 3.42Å; S1095-V1099 WeakPolarHBondContact O-CG2 3.35Å; S1095-V1099 PolarHBondContact O-N 2.9Å
1096	K	64.8	Low	57.1	Low	95 Å²	95	81 Å²	81	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-53.3	-43.9	172.3	-169.8	-168.2	-178.1	-166.5	0	111.6	D1018 K1092 Q1093 C1098	D1018-K1096 IonicContact OD1-NZ 2.71Å; D1018-K1096 PolarHBondContact OD1-NZ 2.96Å; D1018-K1096 IonicContact OD2-NZ 3.16Å; D1018-K1096 PolarHBondContact OD2-NZ 2.87Å; K1092-K1096 PolarHBondContact O-N 3.43Å; Q1093-K1096 WeakPolarHBondContact O-CB 3.36Å; Q1093-K1096 PolarHBondContact O-N 2.87Å; Q1093-K1096 VanDerWaalsContact O-N 3.15Å; K1096-C1098 VanDerWaalsContact C-N 3.29Å; K1096-C1098 PolarHBondContact O-N 3.1Å
1097	L	59.7	Low	54.7	Low	21 Å²	21	87.8 Å²	87.8	11%	0.11	47%	0.466	C	S	.	.	H	α-helix	trans	-67.8	-20.3	178.3	-77.6	159.2	0	0	0	114.4	A1046 M1050 Q1093 S1095	A1046-L1097 HydrophobicContact CB-CD1 4.07Å; A1046-L1097 HydrophobicContact CB-CD2 4.2Å; M1050-L1097 HydrophobicContact CE-CD1 3.45Å; M1050-L1097 VanDerWaalsContact CE-CD1 3.45Å; M1050-L1097 HydrophobicContact SD-CD1 3.67Å; Q1093-L1097 PolarHBondContact O-N 3.19Å; S1095-L1097 VanDerWaalsContact C-N 3.26Å; S1095-L1097 PolarHBondContact O-N 2.89Å
1098	C	52.4	Low	52.3	Low	68 Å²	68	94.4 Å²	94.4	46%	0.459	50%	0.501	S	S	.	.	H	α-helix	trans	-99.9	-16.1	-177.4	-68	0	0	0	0	115.3	S1094 S1095 K1096 L1100 I1120	S1094-C1098 PolarHBondContact O-N 3.36Å; S1094-C1098 PolarHBondContact O-SG 3.26Å; S1095-C1098 PolarHBondContact O-N 3.42Å; K1096-C1098 VanDerWaalsContact C-N 3.29Å; K1096-C1098 PolarHBondContact O-N 3.1Å; C1098-L1100 VanDerWaalsContact C-N 3.3Å; C1098-L1100 PolarHBondContact O-N 2.94Å; C1098-I1120 WeakPolarHBondContact SG-CD1 3.44Å
1099	V	46.1	Very low	50	Low	102 Å²	102	95.8 Å²	95.8	62%	0.618	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-75.6	-12.2	-171.8	162.9	0	0	0	0	114.2	S1095 D1101	S1095-V1099 WeakPolarHBondContact O-CG2 3.35Å; S1095-V1099 PolarHBondContact O-N 2.9Å; V1099-D1101 VanDerWaalsContact C-N 3.27Å; V1099-D1101 PolarHBondContact O-N 3.47Å; V1099-D1101 VanDerWaalsContact O-N 3.13Å
1100	L	44.1	Very low	48.1	Very low	100 Å²	100	105.8 Å²	105.8	52%	0.524	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-70	-5.6	-172	-84.2	167.1	0	0	0	116.9	Q1021 M1025 C1098	Q1021-L1100 VanDerWaalsContact NE2-CD1 3.32Å; M1025-L1100 HydrophobicContact SD-CD1 4.35Å; C1098-L1100 VanDerWaalsContact C-N 3.3Å; C1098-L1100 PolarHBondContact O-N 2.94Å
1101	D	39.8	Very low	46	Very low	106 Å²	106	114 Å²	114	57%	0.567	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-102.3	0.8	-170.4	-66.1	-17.7	0	0	0	115.2	K1043 V1099 N1103	K1043-D1101 IonicContact NZ-OD1 2.68Å; K1043-D1101 PolarHBondContact NZ-OD1 2.92Å; K1043-D1101 IonicContact NZ-OD2 3.18Å; K1043-D1101 PolarHBondContact NZ-OD2 3.31Å; V1099-D1101 VanDerWaalsContact C-N 3.27Å; V1099-D1101 PolarHBondContact O-N 3.47Å; V1099-D1101 VanDerWaalsContact O-N 3.13Å; D1101-N1103 PolarHBondContact O-N 2.9Å
1102	C	33.7	Very low	43.9	Very low	111 Å²	111	113.1 Å²	113.1	75%	0.75	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-7	-170.7	-69.5	0	0	0	0	116.9
1103	N	30.9	Very low	41.9	Very low	160 Å²	160	113.5 Å²	113.5	86%	0.856	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	13.2	-168.7	-76	8.1	0	0	0	115.5	D1101	D1101-N1103 PolarHBondContact O-N 2.9Å
1104	Q	28.6	Very low	40.2	Very low	174 Å²	174	116.9 Å²	116.9	81%	0.813	63%	0.625	S	S	*	*	S	Bend	trans	-131.8	139.7	166.4	-73.2	-167.5	-19.4	0	0	111.5
1105	E	28.3	Very low	38.6	Very low	185 Å²	185	122.8 Å²	122.8	86%	0.864	66%	0.657	S	S	*	*			trans	-83.5	153.2	-157.1	-64.9	-170.8	119.1	0	0	115.8	N1107	E1105-N1107 PolarHBondContact O-N 2.97Å; E1105-N1107 VanDerWaalsContact O-N 3.11Å
1106	V	38.3	Very low	37.3	Very low	125 Å²	125	121.9 Å²	121.9	76%	0.758	65%	0.648	S	S	*	*			trans	0.1	95	136.9	-167.7	0	0	0	0	115.4
1107	N	29.1	Very low	35.8	Very low	143 Å²	143	122.7 Å²	122.7	77%	0.765	66%	0.655	S	S	*	*				-178.2	163.3	119.2	-101.1	-63.9	0	0	0	114.1	E1105	E1105-N1107 PolarHBondContact O-N 2.97Å; E1105-N1107 VanDerWaalsContact O-N 3.11Å
1108	L	26.7	Very low	34.7	Very low	154 Å²	154	127.9 Å²	127.9	81%	0.806	68%	0.677	S	S	*	*	S	Bend	trans	70.5	134	166.2	-72.6	152.9	0	0	0	119.5
1109	T	26.4	Very low	34	Very low	128 Å²	128	125.2 Å²	125.2	79%	0.785	66%	0.661	S	S	*	*			trans	53	76.9	163.6	41	0	0	0	0	118.5	H1111	T1109-H1111 PolarHBondContact O-N 2.84Å
1110	R	32.8	Very low	33.7	Very low	230 Å²	230	122.7 Å²	122.7	87%	0.868	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.9	121.9	137.5	-66.4	172.5	175.3	164.1	-3.4	109.1
1111	H	31.5	Very low	33.2	Very low	174 Å²	174	120.5 Å²	120.5	81%	0.806	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-177.6	-31.9	146.6	-103.4	78.7	0	0	0	110.9	T1109	T1109-H1111 PolarHBondContact O-N 2.84Å
1112	G	32.3	Very low	33.2	Very low	62 Å²	62	118.7 Å²	118.7	64%	0.639	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-40.7	179.2	0	0	0	0	0	115.2	H1114	G1112-H1114 PolarHBondContact O-N 3.48Å
1113	N	32.3	Very low	33.6	Very low	132 Å²	132	113.8 Å²	113.8	71%	0.706	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	4.4	-170.2	-66.6	11.3	0	0	0	115.5	M1117	N1113-M1117 WeakPolarHBondContact O-CB 3.29Å
1114	H	33.4	Very low	34	Very low	110 Å²	110	108.5 Å²	108.5	51%	0.509	57%	0.566	S	S	.	*	H	α-helix	trans	-74	-40.2	-179.6	-87.1	-59.9	0	0	0	113.2	G1112 M1117 F1118	G1112-H1114 PolarHBondContact O-N 3.48Å; H1114-M1117 PolarHBondContact O-N 3.42Å; H1114-F1118 WeakPolarHBondContact O-CB 3.27Å; H1114-F1118 WeakPolarHBondContact O-CD2 3.37Å; H1114-F1118 PolarHBondContact O-N 2.98Å
1115	N	34.9	Very low	34.6	Very low	134 Å²	134	105.7 Å²	105.7	72%	0.717	56%	0.555	S	S	*	*	H	α-helix	trans	-67.9	-44.5	-174.7	-79.1	9.5	0	0	0	113.2	F1118 G1119	N1115-F1118 PolarHBondContact O-N 3.17Å; N1115-G1119 PolarHBondContact O-N 3.33Å
1116	T	37.5	Very low	35.1	Very low	45 Å²	45	99.1 Å²	99.1	28%	0.276	53%	0.525	S	S	.	.	H	α-helix	trans	-66.3	-40	177.2	32.7	0	0	0	0	112.4	L1044 G1119 I1120	L1044-T1116 HydrophobicContact CD2-CG2 4.35Å; T1116-G1119 PolarHBondContact O-N 2.82Å; T1116-I1120 WeakPolarHBondContact O-CG1 3.49Å; T1116-I1120 PolarHBondContact O-N 3.03Å
1117	M	33.8	Very low	35.3	Very low	113 Å²	113	94.4 Å²	94.4	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-62.5	-42.1	170.5	-84.6	-70.9	-67.7	0	0	112	N1113 H1114 G1119 I1120 C1121	N1113-M1117 WeakPolarHBondContact O-CB 3.29Å; H1114-M1117 PolarHBondContact O-N 3.42Å; M1117-G1119 PolarHBondContact O-N 3.22Å; M1117-I1120 PolarHBondContact O-N 3.35Å; M1117-C1121 VanDerWaalsContact O-CB 3.25Å; M1117-C1121 WeakPolarHBondContact O-CB 3.36Å; M1117-C1121 PolarHBondContact O-N 2.83Å; M1117-C1121 PolarHBondContact O-SG 3.17Å
1118	F	35.8	Very low	35.4	Very low	129 Å²	129	95.5 Å²	95.5	57%	0.566	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-38.3	175.5	-101.4	-85.1	0	0	0	112.4	H1114 N1115 N1122	H1114-F1118 WeakPolarHBondContact O-CB 3.27Å; H1114-F1118 WeakPolarHBondContact O-CD2 3.37Å; H1114-F1118 PolarHBondContact O-N 2.98Å; N1115-F1118 PolarHBondContact O-N 3.17Å; F1118-N1122 VanDerWaalsContact O-CB 3.22Å; F1118-N1122 WeakPolarHBondContact O-CB 3.32Å; F1118-N1122 VanDerWaalsContact O-CG 3.28Å; F1118-N1122 PolarHBondContact O-N 3.28Å; F1118-N1122 PolarHBondContact O-ND2 3.28Å
1119	G	38.8	Very low	35.8	Very low	12 Å²	12	92.6 Å²	92.6	12%	0.124	49%	0.486	C	S	.	.	H	α-helix	trans	-59.8	-48.8	173.6	0	0	0	0	0	112.3	N1115 T1116 M1117 N1122 L1123	N1115-G1119 PolarHBondContact O-N 3.33Å; T1116-G1119 PolarHBondContact O-N 2.82Å; M1117-G1119 PolarHBondContact O-N 3.22Å; G1119-N1122 PolarHBondContact O-N 3.2Å; G1119-L1123 PolarHBondContact O-N 3.16Å
1120	I	38.3	Very low	36.3	Very low	49 Å²	49	90.7 Å²	90.7	25%	0.251	47%	0.47	S	S	.	.	H	α-helix	trans	-72.5	-35.6	-179.1	-63.8	165.9	0	0	0	111.9	C1098 T1116 M1117 L1123 T1124	C1098-I1120 WeakPolarHBondContact SG-CD1 3.44Å; T1116-I1120 WeakPolarHBondContact O-CG1 3.49Å; T1116-I1120 PolarHBondContact O-N 3.03Å; M1117-I1120 PolarHBondContact O-N 3.35Å; I1120-L1123 WeakPolarHBondContact O-CB 3.36Å; I1120-L1123 PolarHBondContact O-N 2.89Å; I1120-T1124 WeakPolarHBondContact O-CB 3.37Å; I1120-T1124 PolarHBondContact O-N 2.93Å; I1120-T1124 PolarHBondContact O-OG1 3.34Å
1121	C	34.2	Very low	36.5	Very low	55 Å²	55	83 Å²	83	37%	0.372	45%	0.448	S	S	.	.	H	α-helix	trans	-64.6	-43.9	170.3	-74.3	0	0	0	0	111.3	M1117 L1123 T1124 I1125	M1117-C1121 VanDerWaalsContact O-CB 3.25Å; M1117-C1121 WeakPolarHBondContact O-CB 3.36Å; M1117-C1121 PolarHBondContact O-N 2.83Å; M1117-C1121 PolarHBondContact O-SG 3.17Å; C1121-L1123 PolarHBondContact O-N 2.82Å; C1121-T1124 CarbonylContact O-C 3.6Å; C1121-T1124 PolarHBondContact O-N 3.45Å; C1121-I1125 WeakPolarHBondContact O-CB 3.45Å; C1121-I1125 WeakPolarHBondContact O-CD1 3.39Å; C1121-I1125 WeakPolarHBondContact O-CG1 3.44Å; C1121-I1125 PolarHBondContact O-N 3.28Å
1122	N	40.1	Very low	36.8	Very low	68 Å²	68	77.6 Å²	77.6	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-63.4	-38.8	173.6	-80.2	-28.4	0	0	0	111.9	F1118 G1119 T1124 I1125 M1126	F1118-N1122 VanDerWaalsContact O-CB 3.22Å; F1118-N1122 WeakPolarHBondContact O-CB 3.32Å; F1118-N1122 VanDerWaalsContact O-CG 3.28Å; F1118-N1122 PolarHBondContact O-N 3.28Å; F1118-N1122 PolarHBondContact O-ND2 3.28Å; G1119-N1122 PolarHBondContact O-N 3.2Å; N1122-T1124 VanDerWaalsContact C-N 3.32Å; N1122-T1124 PolarHBondContact O-N 3Å; N1122-I1125 CarbonylContact O-C 3.15Å; N1122-I1125 PolarHBondContact O-N 3.39Å; N1122-M1126 WeakPolarHBondContact O-CB 3.22Å; N1122-M1126 WeakPolarHBondContact O-CG 2.92Å; N1122-M1126 PolarHBondContact O-N 3.01Å
1123	L	41	Very low	37.1	Very low	8 Å²	8	78.6 Å²	78.6	4%	0.042	41%	0.414	C	S	.	.	H	α-helix	trans	-57.7	-47.3	171.3	-129.4	74.6	0	0	0	110.4	E1051 V1054 G1119 I1120 C1121 I1125 M1126 I1127	E1051-L1123 HydrophobicContact CB-CD1 4.46Å; E1051-L1123 HydrophobicContact CG-CD1 4.34Å; V1054-L1123 HydrophobicContact CB-CD1 3.91Å; V1054-L1123 HydrophobicContact CG1-CD1 3.9Å; V1054-L1123 HydrophobicContact CG1-CG 4.27Å; V1054-L1123 HydrophobicContact CG2-CD1 3.92Å; V1054-L1123 HydrophobicContact CG2-CD2 4.28Å; V1054-L1123 HydrophobicContact CG2-CG 4.13Å; G1119-L1123 PolarHBondContact O-N 3.16Å; I1120-L1123 WeakPolarHBondContact O-CB 3.36Å; I1120-L1123 PolarHBondContact O-N 2.89Å; C1121-L1123 PolarHBondContact O-N 2.82Å; L1123-I1125 VanDerWaalsContact C-N 3.31Å; L1123-I1125 PolarHBondContact O-N 3.48Å; L1123-M1126 PolarHBondContact O-N 2.86Å; L1123-M1126 VanDerWaalsContact O-N 3.17Å; L1123-I1127 HydrophobicContact CD2-CD1 4.45Å; L1123-I1127 HydrophobicContact CG-CD1 4.13Å; L1123-I1127 WeakPolarHBondContact O-CB 3.44Å; L1123-I1127 WeakPolarHBondContact O-CD1 3.49Å; L1123-I1127 WeakPolarHBondContact O-CG1 3.3Å; L1123-I1127 PolarHBondContact O-N 3.1Å
1124	T	39.1	Very low	37.4	Very low	48 Å²	48	75.1 Å²	75.1	29%	0.294	40%	0.395	S	S	.	.	H	α-helix	trans	-66.6	-31.2	178.8	-54.7	0	0	0	0	112.6	I1120 C1121 N1122 N1128	I1120-T1124 WeakPolarHBondContact O-CB 3.37Å; I1120-T1124 PolarHBondContact O-N 2.93Å; I1120-T1124 PolarHBondContact O-OG1 3.34Å; C1121-T1124 CarbonylContact O-C 3.6Å; C1121-T1124 PolarHBondContact O-N 3.45Å; N1122-T1124 VanDerWaalsContact C-N 3.32Å; N1122-T1124 PolarHBondContact O-N 3Å; T1124-N1128 WeakPolarHBondContact O-CB 3.34Å; T1124-N1128 PolarHBondContact O-N 2.95Å; T1124-N1128 PolarHBondContact O-ND2 2.87Å
1125	I	42.1	Very low	37.7	Very low	116 Å²	116	72.6 Å²	72.6	60%	0.595	39%	0.386	S	S	*	.	H	α-helix	trans	-83.5	-12.1	176.2	-67.9	163.8	0	0	0	112.5	C1121 N1122 L1123	C1121-I1125 WeakPolarHBondContact O-CB 3.45Å; C1121-I1125 WeakPolarHBondContact O-CD1 3.39Å; C1121-I1125 WeakPolarHBondContact O-CG1 3.44Å; C1121-I1125 PolarHBondContact O-N 3.28Å; N1122-I1125 CarbonylContact O-C 3.15Å; N1122-I1125 PolarHBondContact O-N 3.39Å; L1123-I1125 VanDerWaalsContact C-N 3.31Å; L1123-I1125 PolarHBondContact O-N 3.48Å
1126	M	39	Very low	37.9	Very low	46 Å²	46	67.8 Å²	67.8	23%	0.227	36%	0.361	C	S	.	.	H	α-helix	trans	-100.9	-14.1	171.8	-73.8	-156.4	-62.5	0	0	114.1	V1054 K1055 K1058 N1122 L1123	V1054-M1126 HydrophobicContact CG1-CE 3.83Å; K1055-M1126 HydrophobicContact CG-CE 4.22Å; K1058-M1126 HydrophobicContact CD-CB 4.4Å; K1058-M1126 HydrophobicContact CD-CG 4.37Å; K1058-M1126 HydrophobicContact CD-SD 3.82Å; N1122-M1126 WeakPolarHBondContact O-CB 3.22Å; N1122-M1126 WeakPolarHBondContact O-CG 2.92Å; N1122-M1126 PolarHBondContact O-N 3.01Å; L1123-M1126 PolarHBondContact O-N 2.86Å; L1123-M1126 VanDerWaalsContact O-N 3.17Å
1127	I	41.5	Very low	37.9	Very low	26 Å²	26	69.8 Å²	69.8	13%	0.133	37%	0.368	C	S	.	.	H	α-helix	trans	-98.9	-24.9	178.8	-67.5	169.7	0	0	0	111.5	L1087 K1091 L1123	L1087-I1127 HydrophobicContact CB-CD1 4.45Å; L1087-I1127 HydrophobicContact CB-CG1 4.19Å; L1087-I1127 HydrophobicContact CD2-CG1 4.36Å; K1091-I1127 HydrophobicContact CB-CD1 4.19Å; K1091-I1127 HydrophobicContact CD-CG2 4.42Å; L1123-I1127 HydrophobicContact CD2-CD1 4.45Å; L1123-I1127 HydrophobicContact CG-CD1 4.13Å; L1123-I1127 WeakPolarHBondContact O-CB 3.44Å; L1123-I1127 WeakPolarHBondContact O-CD1 3.49Å; L1123-I1127 WeakPolarHBondContact O-CG1 3.3Å; L1123-I1127 PolarHBondContact O-N 3.1Å
1128	N	31.6	Very low	38.3	Very low	167 Å²	167	65.8 Å²	65.8	89%	0.893	35%	0.351	S	S	*	.			trans	-85.6	0	161.8	-65.1	-24	0	0	0	110.7	T1124	T1124-N1128 WeakPolarHBondContact O-CB 3.34Å; T1124-N1128 PolarHBondContact O-N 2.95Å; T1124-N1128 PolarHBondContact O-ND2 2.87Å

Retrieved 1,128 of 1,128 residues in 947.9 ms (Link to these results)

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