A0A087YB37_POEFO Loading...

Myb-like, SWIRM and MPN domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A087YB37, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 837 aa.

						>A0A087YB37_POEFO|A0A087YB37
MEDEVDVDIEGDDFDSNVGEVDAAGLVQEQFIQPADRTSSWILPWELDSSISPENREAIERMLLEEQYYLTGDRIPDILPSDPNKKPKIKKSPTKSSTSASASSRWSKQEKELFEEGLAQYGRRWTKIAKLVDTRSVLQVKSYARQYFKHKGKSEPGAAAPSRGPEPQLRPPRPTMTNAVRIERLSDDEDVDITDDLSEGEGEDMKIEPSGPAGQPQTDAAAEEQKEPTMSEGIHETKHQPCPSSPSKQSPLSSFNLFCAEEDRKTTSDENLVKTEPLEAEAETESKLTTNPGDEQSCQSHTLAHDGQLTEEGHDSTDGDPEEQQEEEEEDEEVEELKAPEQEVEMDTEMITEDEKQAIPEFFEGRPSKTPERYLKIRNYILDQWLKSKPRYLNKTSVRPGLKNCGDVNCIGRIHTYLELIGAINFNCEQAVYNRPKVVDRTKPKEGKDVLEAYQLAQRLQSMRTRKRRVRDIWGNWCDARDLEGQTYEHLSAEELAQRREEMKKQPKPGKTSRYRGSFDPFQLIPCRSFEGDVQEPFQVIVCAETLLIMDMHAHVSRGEVIGLLGGTFNQEEKVLKIRAAEPCNSVSTGLQCEMDPVSQTQACDVLSSLGFSVVGWYHSHPSFHPNPSVRDINTQDQFQSYFSRGGAPFIGMIVSPYDPANPSTHSQITCLLVKESQEPSSQNKLPYRFNFLSSQDSPDWEQTMRRAQWIVQKYAQAHGSVQMDRLFRRDSSLTCLEKMMASLARHLEALPDGEGDQVLSEIQALFLSDFVSKQKSSCKEEEQHLNISSSVQSDDDAFDQLIGQEEFPKGGESAETNSSSVLHLGSVLSTEHDYLL
					

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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	35.8	Very low	38.5	Very low	214 Å²	214	153.3 Å²	153.3	100%	1.054	83%	0.828	S	S	*	*				0	77.2	0	-65.3	169.3	-179	0	0	104.7
2	E	37.9	Very low	37.6	Very low	167 Å²	167	153.6 Å²	153.6	78%	0.78	83%	0.829	S	S	*	*			cis	60.7	134	31.5	-52.5	151.6	150.8	0	0	110.3
3	D	42.3	Very low	37.2	Very low	156 Å²	156	152.4 Å²	152.4	83%	0.834	82%	0.822	S	S	*	*			cis	-130	157.2	15.9	-75.7	-70.8	0	0	0	114.5
4	E	52.8	Low	36.4	Very low	180 Å²	180	155.6 Å²	155.6	84%	0.841	83%	0.825	S	S	*	*			trans	-99	165	163.5	-62.8	167.4	130.6	0	0	109.5
5	V	46.7	Very low	35.9	Very low	147 Å²	147	154.3 Å²	154.3	89%	0.891	82%	0.818	S	S	*	*			trans	-154.1	133.4	157.5	-114.5	0	0	0	0	111.7
6	D	39.4	Very low	35.4	Very low	144 Å²	144	151.4 Å²	151.4	77%	0.77	82%	0.815	S	S	*	*			trans	-82.4	-178	-177.6	-43.8	-85.4	0	0	0	113.8
7	V	35	Very low	34.9	Very low	136 Å²	136	151.2 Å²	151.2	82%	0.824	81%	0.813	S	S	*	*				-177.6	124.1	108.7	151.4	0	0	0	0	110.2
8	D	34.5	Very low	34.6	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	82%	0.815	S	S	*	*			trans	-77	174.2	169.5	-75.3	-55.4	0	0	0	112.7
9	I	36.5	Very low	34.2	Very low	151 Å²	151	146.8 Å²	146.8	77%	0.774	82%	0.815	S	S	*	*			trans	-166.4	144.4	132.7	-102.5	153.4	0	0	0	113.4
10	E	32.1	Very low	33.9	Very low	170 Å²	170	148.9 Å²	148.9	79%	0.794	82%	0.818	S	S	*	*			trans	-24	158.6	166.5	-60.9	154.7	148.5	0	0	118.9
11	G	30.2	Very low	33.6	Very low	72 Å²	72	149.2 Å²	149.2	74%	0.742	82%	0.824	S	S	*	*			cis	95.3	88.1	-4.8	0	0	0	0	0	116.9
12	D	28.1	Very low	33.2	Very low	157 Å²	157	146.6 Å²	146.6	84%	0.84	81%	0.814	S	S	*	*			trans	-155.9	161.2	158.8	-155.1	1.4	0	0	0	112.5
13	D	31.7	Very low	32.6	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	81%	0.811	S	S	*	*			trans	-93.5	165.4	-171.4	-70.8	-55.5	0	0	0	114.4
14	F	26.5	Very low	31.9	Very low	197 Å²	197	140.3 Å²	140.3	86%	0.864	81%	0.813	S	S	*	*				-173.9	158.8	108	-119.6	-95.5	0	0	0	116.1
15	D	29.3	Very low	30.6	Very low	137 Å²	137	135.6 Å²	135.6	73%	0.733	81%	0.812	S	S	*	*			trans	-99.7	160.3	-174.3	-174.8	13.4	0	0	0	113.1
16	S	27.5	Very low	29.7	Very low	108 Å²	108	136.9 Å²	136.9	76%	0.755	81%	0.813	S	S	*	*			trans	154.9	92.2	146	-71.6	0	0	0	0	116.6
17	N	26.4	Very low	29.1	Very low	147 Å²	147	136.7 Å²	136.7	79%	0.786	82%	0.817	S	S	*	*				43.1	120.8	118.3	-144.3	19	0	0	0	123.6
18	V	29.3	Very low	28.7	Very low	141 Å²	141	136.9 Å²	136.9	86%	0.855	81%	0.809	S	S	*	*			trans	62	125.6	145.5	167.2	0	0	0	0	121.8
19	G	26.9	Very low	28.4	Very low	79 Å²	79	139.2 Å²	139.2	81%	0.814	82%	0.815	S	S	*	*			trans	-174.9	113	162.6	0	0	0	0	0	114.3
20	E	29.3	Very low	28	Very low	188 Å²	188	139.3 Å²	139.3	88%	0.879	81%	0.812	S	S	*	*			trans	-96.4	131.9	-175.9	171	-172.2	-166	0	0	112.7
21	V	28	Very low	27.6	Very low	156 Å²	156	140.9 Å²	140.9	95%	0.945	82%	0.817	S	S	*	*			trans	-166.3	169.9	149.9	-102	0	0	0	0	111.9
22	D	26.1	Very low	27.5	Very low	158 Å²	158	145.2 Å²	145.2	85%	0.845	82%	0.822	S	S	*	*			trans	-114	161.2	-148.5	-155.7	-4	0	0	0	116.4
23	A	26.9	Very low	27.7	Very low	86 Å²	86	145.6 Å²	145.6	71%	0.711	82%	0.818	S	S	*	*			trans	52.2	120.8	156.1	0	0	0	0	0	122.7
24	A	26.2	Very low	27.6	Very low	106 Å²	106	144.9 Å²	144.9	88%	0.876	82%	0.821	S	S	*	*				174.6	141.3	106.6	0	0	0	0	0	115.4
25	G	26.2	Very low	27.7	Very low	80 Å²	80	139.2 Å²	139.2	83%	0.825	81%	0.81	S	S	*	*			trans	90.9	109.6	150.2	0	0	0	0	0	118.9
26	L	27.7	Very low	27.7	Very low	174 Å²	174	140.3 Å²	140.3	91%	0.911	82%	0.816	S	S	*	*			trans	-144.5	82.8	168.9	-168.3	82.1	0	0	0	113.6
27	V	27.2	Very low	27.8	Very low	141 Å²	141	146.5 Å²	146.5	86%	0.855	82%	0.823	S	S	*	*			trans	-156.7	148.6	153.6	-128	0	0	0	0	104.5
28	Q	25.8	Very low	28.1	Very low	139 Å²	139	146.3 Å²	146.3	65%	0.65	83%	0.827	S	S	*	*			cis	-165	140.1	20.7	179.5	177.6	8.8	0	0	109.1	Q30	Q28-Q30 HydrophobicContact CG-CG 4.25Å; Q28-Q30 VanDerWaalsContact NE2-NE2 3.18Å
29	E	28	Very low	27.9	Very low	198 Å²	198	145.3 Å²	145.3	93%	0.925	83%	0.826	S	S	*	*			trans	-132	157.5	153.6	-76.6	-152.7	132.4	0	0	110
30	Q	27.8	Very low	28.5	Very low	153 Å²	153	147.1 Å²	147.1	72%	0.715	83%	0.827	S	S	*	*			trans	-118.8	140.8	-158.3	-66.2	179.2	-15.2	0	0	113	Q28	Q28-Q30 HydrophobicContact CG-CG 4.25Å; Q28-Q30 VanDerWaalsContact NE2-NE2 3.18Å
31	F	25.2	Very low	28.7	Very low	203 Å²	203	150.3 Å²	150.3	89%	0.89	83%	0.831	S	S	*	*			trans	-63.2	137.3	169.6	-93.3	-106.6	0	0	0	111.9
32	I	28.4	Very low	28.9	Very low	164 Å²	164	150.6 Å²	150.6	84%	0.841	83%	0.825	S	S	*	*			trans	-129	129.8	154.4	-63	-177.9	0	0	0	107.2
33	Q	30.6	Very low	29.2	Very low	165 Å²	165	150.7 Å²	150.7	77%	0.771	83%	0.825	S	S	*	*			trans	-82.9	166.2	177.4	-62.7	179.9	2.2	0	0	111.4
34	P	30.9	Very low	29.6	Very low	123 Å²	123	151.6 Å²	151.6	80%	0.799	82%	0.824	S	S	*	*				-128.3	161.5	121.4	37.3	-32	0	0	0	113.8
35	A	28.8	Very low	29.9	Very low	77 Å²	77	158.9 Å²	158.9	64%	0.636	83%	0.829	S	S	*	*			trans	-76.5	168.7	165	0	0	0	0	0	109.6
36	D	28.4	Very low	30.7	Very low	160 Å²	160	164 Å²	164	86%	0.856	83%	0.831	S	S	*	*			cis	-144.4	164.8	42	-87.1	-51.1	0	0	0	114.9
37	R	30.9	Very low	31.4	Very low	239 Å²	239	159.3 Å²	159.3	90%	0.902	81%	0.806	S	S	*	*			trans	-104.4	132	170.1	-76.9	176.5	162.9	-172.8	-5.4	110.8
38	T	31.3	Very low	32.2	Very low	143 Å²	143	157.8 Å²	157.8	88%	0.877	79%	0.794	S	S	*	*			trans	-164.2	99	144.9	11.5	0	0	0	0	112.2
39	S	26.4	Very low	33.3	Very low	119 Å²	119	157.1 Å²	157.1	83%	0.832	80%	0.804	S	S	*	*			trans	-154.7	93.3	164	46.4	0	0	0	0	110.6	W41	S39-W41 PolarHBondContact O-N 2.67Å; S39-W41 VanDerWaalsContact O-N 3.14Å
40	S	38.3	Very low	34.4	Very low	118 Å²	118	152.2 Å²	152.2	83%	0.825	79%	0.792	S	S	*	*			trans	-79	90.2	177.6	-62.7	0	0	0	0	111
41	W	34.2	Very low	36.1	Very low	255 Å²	255	147.6 Å²	147.6	97%	0.966	77%	0.772	S	S	*	*			trans	-153.6	35.3	162.6	-120.9	-51.3	0	0	0	115.7	S39	S39-W41 PolarHBondContact O-N 2.67Å; S39-W41 VanDerWaalsContact O-N 3.14Å
42	I	31.6	Very low	38.4	Very low	161 Å²	161	139.9 Å²	139.9	83%	0.826	74%	0.743	S	S	*	*			trans	-127.8	101.2	165.5	-54.7	178.1	0	0	0	108.2
43	L	32	Very low	40.4	Very low	161 Å²	161	137.1 Å²	137.1	84%	0.843	74%	0.736	S	S	*	*			trans	-81.2	128.6	158.5	-73.5	172.5	0	0	0	107.6
44	P	35.3	Very low	42.2	Very low	104 Å²	104	136.3 Å²	136.3	68%	0.675	73%	0.732	S	S	*	*			trans	-61.1	146	173.1	-21.9	33.7	0	0	0	111.4	E46	P44-E46 PolarHBondContact O-N 2.86Å
45	W	33.4	Very low	43.6	Very low	259 Å²	259	134.8 Å²	134.8	98%	0.981	72%	0.717	S	S	*	*			trans	-71.1	111.4	163.8	-81	40.2	0	0	0	108.5
46	E	41.6	Very low	45.7	Very low	187 Å²	187	136.6 Å²	136.6	87%	0.874	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-85.5	139.2	166.9	-64.1	-157.7	149.4	0	0	110.4	P44	P44-E46 PolarHBondContact O-N 2.86Å
47	L	44.1	Very low	47.8	Very low	76 Å²	76	134 Å²	134	40%	0.398	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-80.1	134.2	-176.9	-154.7	71.6	0	0	0	109.9	S49 I51 R56	L47-S49 PolarHBondContact O-N 3.05Å; L47-I51 HydrophobicContact CD2-CD1 4.39Å; L47-I51 HydrophobicContact CD2-CG2 3.96Å; L47-I51 HydrophobicContact CG-CG2 4.37Å; L47-R56 HydrophobicContact CD2-CG 4.03Å
48	D	42.4	Very low	49.5	Very low	109 Å²	109	124.3 Å²	124.3	58%	0.583	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-52.1	135.5	-176.7	177.1	20	0	0	0	112.5	S50 I51	D48-S50 VanDerWaalsContact CG-OG 3.3Å; D48-S50 PolarHBondContact O-N 3.4Å; D48-S50 VanDerWaalsContact O-N 3.13Å; D48-S50 PolarHBondContact OD1-N 2.89Å; D48-S50 VanDerWaalsContact OD2-CB 3.28Å; D48-S50 WeakPolarHBondContact OD2-CB 3.37Å; D48-S50 PolarHBondContact OD2-OG 2.67Å; D48-I51 WeakPolarHBondContact O-CG2 3.47Å; D48-I51 PolarHBondContact O-N 3.17Å
49	S	48.9	Very low	51.2	Low	125 Å²	125	120.6 Å²	120.6	87%	0.874	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-6.7	-179.3	-63.7	0	0	0	0	113.9	L47 I51	L47-S49 PolarHBondContact O-N 3.05Å; S49-I51 VanDerWaalsContact C-N 3.32Å
50	S	51.3	Low	53.5	Low	96 Å²	96	119.4 Å²	119.4	67%	0.671	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-17.7	173.5	75.1	0	0	0	0	114.5	D48	D48-S50 VanDerWaalsContact CG-OG 3.3Å; D48-S50 PolarHBondContact O-N 3.4Å; D48-S50 VanDerWaalsContact O-N 3.13Å; D48-S50 PolarHBondContact OD1-N 2.89Å; D48-S50 VanDerWaalsContact OD2-CB 3.28Å; D48-S50 WeakPolarHBondContact OD2-CB 3.37Å; D48-S50 PolarHBondContact OD2-OG 2.67Å
51	I	65.1	Low	55.2	Low	55 Å²	55	120.2 Å²	120.2	28%	0.282	60%	0.602	S	S	.	*	S	Bend	trans	-81.9	138	-170.2	-154.7	166.4	0	0	0	112.8	L47 D48 S49 N55 R56 I59	L47-I51 HydrophobicContact CD2-CD1 4.39Å; L47-I51 HydrophobicContact CD2-CG2 3.96Å; L47-I51 HydrophobicContact CG-CG2 4.37Å; D48-I51 WeakPolarHBondContact O-CG2 3.47Å; D48-I51 PolarHBondContact O-N 3.17Å; S49-I51 VanDerWaalsContact C-N 3.32Å; I51-N55 HydrophobicContact CD1-CB 4.17Å; I51-N55 HydrophobicContact CG1-CB 3.79Å; I51-R56 HydrophobicContact CG2-CB 4.35Å; I51-I59 HydrophobicContact CD1-CD1 3.56Å
52	S	73.7	Confident	56.6	Low	41 Å²	41	113.6 Å²	113.6	29%	0.287	58%	0.583	S	S	.	*			trans	-66.2	149.5	178.9	73.9	0	0	0	0	111.6	E54 N55 R56	S52-E54 PolarHBondContact O-N 2.98Å; S52-N55 PolarHBondContact O-N 3.26Å; S52-N55 VanDerWaalsContact O-N 3.14Å; S52-N55 WeakPolarHBondContact OG-CB 3.48Å; S52-N55 PolarHBondContact OG-N 3.38Å; S52-N55 PolarHBondContact OG-OD1 3.18Å; S52-R56 PolarHBondContact O-N 2.96Å
53	P	69.9	Low	58.3	Low	106 Å²	106	110.7 Å²	110.7	69%	0.688	57%	0.569	S	S	*	*	H	α-helix	trans	-60.7	-33.5	179.1	23.5	-33.7	0	0	0	112.4	R56 E57	P53-R56 PolarHBondContact O-N 3.25Å; P53-E57 WeakPolarHBondContact O-CB 3.14Å; P53-E57 PolarHBondContact O-N 3.4Å
54	E	67.6	Low	60	Low	148 Å²	148	107.3 Å²	107.3	69%	0.692	55%	0.551	S	S	*	*	H	α-helix	trans	-68.1	-38.3	177.1	-62.4	169.6	134.8	0	0	112	S52 A58	S52-E54 PolarHBondContact O-N 2.98Å; E54-A58 WeakPolarHBondContact O-CB 3.28Å; E54-A58 PolarHBondContact O-N 2.91Å; E54-A58 VanDerWaalsContact O-N 3.07Å
55	N	59.5	Low	61.5	Low	92 Å²	92	107.6 Å²	107.6	49%	0.492	54%	0.543	S	S	.	.	H	α-helix	trans	-70	-39	173.9	-74	6.9	0	0	0	111.4	I51 S52 A58 I59	I51-N55 HydrophobicContact CD1-CB 4.17Å; I51-N55 HydrophobicContact CG1-CB 3.79Å; S52-N55 PolarHBondContact O-N 3.26Å; S52-N55 VanDerWaalsContact O-N 3.14Å; S52-N55 WeakPolarHBondContact OG-CB 3.48Å; S52-N55 PolarHBondContact OG-N 3.38Å; S52-N55 PolarHBondContact OG-OD1 3.18Å; N55-A58 PolarHBondContact O-N 2.84Å; N55-I59 VanDerWaalsContact O-CG1 3.31Å; N55-I59 WeakPolarHBondContact O-CG1 3.27Å; N55-I59 PolarHBondContact O-N 3.16Å
56	R	74.9	Confident	63.2	Low	115 Å²	115	100.8 Å²	100.8	43%	0.434	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-48.8	175.3	-176.6	174.2	-174.8	146.5	4.5	111.5	L47 I51 S52 P53 A58 I59 E60	L47-R56 HydrophobicContact CD2-CG 4.03Å; I51-R56 HydrophobicContact CG2-CB 4.35Å; S52-R56 PolarHBondContact O-N 2.96Å; P53-R56 PolarHBondContact O-N 3.25Å; R56-A58 VanDerWaalsContact C-N 3.28Å; R56-A58 PolarHBondContact O-N 2.78Å; R56-I59 PolarHBondContact O-N 3.16Å; R56-E60 WeakPolarHBondContact CG-OE1 3.45Å; R56-E60 IonicContact CZ-OE1 2.7Å; R56-E60 IonicContact NE-OE1 2.79Å; R56-E60 PolarHBondContact NE-OE1 3.25Å; R56-E60 IonicContact NH2-OE1 2.73Å; R56-E60 WeakPolarHBondContact O-CG 3.23Å; R56-E60 PolarHBondContact O-N 2.96Å
57	E	70.8	Confident	64	Low	104 Å²	104	97.5 Å²	97.5	49%	0.486	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-34.1	177.5	-158.8	-152.9	124.7	0	0	112	P53 R61	P53-E57 WeakPolarHBondContact O-CB 3.14Å; P53-E57 PolarHBondContact O-N 3.4Å; E57-R61 VanDerWaalsContact CD-NH2 3.33Å; E57-R61 WeakPolarHBondContact O-CB 3.36Å; E57-R61 WeakPolarHBondContact O-CG 3.44Å; E57-R61 PolarHBondContact O-N 3.28Å; E57-R61 IonicContact OE1-CZ 3.19Å; E57-R61 IonicContact OE1-NE 2.88Å; E57-R61 PolarHBondContact OE1-NE 3.04Å; E57-R61 IonicContact OE1-NH2 3.64Å; E57-R61 PolarHBondContact OE1-NH2 3.32Å; E57-R61 IonicContact OE2-NH2 3.52Å
58	A	68.2	Low	64.8	Low	37 Å²	37	99.2 Å²	99.2	31%	0.306	51%	0.509	S	S	.	.	H	α-helix	trans	-66.6	-41.9	173.8	0	0	0	0	0	112.6	E54 N55 R56 R61 M62	E54-A58 WeakPolarHBondContact O-CB 3.28Å; E54-A58 PolarHBondContact O-N 2.91Å; E54-A58 VanDerWaalsContact O-N 3.07Å; N55-A58 PolarHBondContact O-N 2.84Å; R56-A58 VanDerWaalsContact C-N 3.28Å; R56-A58 PolarHBondContact O-N 2.78Å; A58-R61 PolarHBondContact O-N 2.62Å; A58-M62 WeakPolarHBondContact O-CG 3.44Å; A58-M62 PolarHBondContact O-N 2.66Å
59	I	67.1	Low	65.1	Low	65 Å²	65	102 Å²	102	33%	0.333	51%	0.513	S	S	.	.	H	α-helix	trans	-67.2	-46.2	177	-68.8	162.6	0	0	0	110.8	I51 N55 R56 R61 M62 L63	I51-I59 HydrophobicContact CD1-CD1 3.56Å; N55-I59 VanDerWaalsContact O-CG1 3.31Å; N55-I59 WeakPolarHBondContact O-CG1 3.27Å; N55-I59 PolarHBondContact O-N 3.16Å; R56-I59 PolarHBondContact O-N 3.16Å; I59-R61 VanDerWaalsContact C-N 3.29Å; I59-R61 PolarHBondContact O-N 2.9Å; I59-M62 PolarHBondContact O-N 3.41Å; I59-L63 HydrophobicContact CG2-CD1 3.94Å; I59-L63 HydrophobicContact CG2-CG 4.48Å; I59-L63 WeakPolarHBondContact O-CG 3.3Å; I59-L63 PolarHBondContact O-N 3.32Å
60	E	73.7	Confident	64.9	Low	93 Å²	93	103.3 Å²	103.3	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-60.7	-38.4	176.2	-71.7	173.6	-167	0	0	111.1	R56 L64	R56-E60 WeakPolarHBondContact CG-OE1 3.45Å; R56-E60 IonicContact CZ-OE1 2.7Å; R56-E60 IonicContact NE-OE1 2.79Å; R56-E60 PolarHBondContact NE-OE1 3.25Å; R56-E60 IonicContact NH2-OE1 2.73Å; R56-E60 WeakPolarHBondContact O-CG 3.23Å; R56-E60 PolarHBondContact O-N 2.96Å; E60-L64 WeakPolarHBondContact O-CB 3.39Å; E60-L64 WeakPolarHBondContact O-CD1 3.18Å; E60-L64 WeakPolarHBondContact O-CG 2.95Å; E60-L64 PolarHBondContact O-N 3.44Å; E60-L64 VanDerWaalsContact O-N 3.08Å
61	R	73.1	Confident	65.5	Low	135 Å²	135	103 Å²	103	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-66.6	-39.8	172.7	-79.1	-168.7	-93.8	104.4	-6.7	113.6	E57 A58 I59 L64 E65	E57-R61 VanDerWaalsContact CD-NH2 3.33Å; E57-R61 WeakPolarHBondContact O-CB 3.36Å; E57-R61 WeakPolarHBondContact O-CG 3.44Å; E57-R61 PolarHBondContact O-N 3.28Å; E57-R61 IonicContact OE1-CZ 3.19Å; E57-R61 IonicContact OE1-NE 2.88Å; E57-R61 PolarHBondContact OE1-NE 3.04Å; E57-R61 IonicContact OE1-NH2 3.64Å; E57-R61 PolarHBondContact OE1-NH2 3.32Å; E57-R61 IonicContact OE2-NH2 3.52Å; A58-R61 PolarHBondContact O-N 2.62Å; I59-R61 VanDerWaalsContact C-N 3.29Å; I59-R61 PolarHBondContact O-N 2.9Å; R61-L64 PolarHBondContact O-N 2.92Å; R61-E65 WeakPolarHBondContact O-CB 3.23Å; R61-E65 PolarHBondContact O-N 3.03Å
62	M	65.6	Low	64.4	Low	117 Å²	117	102.9 Å²	102.9	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-43.9	175.2	-78.1	-178.4	60.9	0	0	112.1	A58 I59 L64 E65 E66	A58-M62 WeakPolarHBondContact O-CG 3.44Å; A58-M62 PolarHBondContact O-N 2.66Å; I59-M62 PolarHBondContact O-N 3.41Å; M62-L64 VanDerWaalsContact C-N 3.33Å; M62-L64 PolarHBondContact O-N 3.49Å; M62-E65 PolarHBondContact O-N 2.79Å; M62-E65 VanDerWaalsContact O-N 3.16Å; M62-E66 PolarHBondContact O-N 2.6Å
63	L	66.6	Low	63	Low	100 Å²	100	107 Å²	107	52%	0.524	53%	0.534	S	S	.	.	H	α-helix	trans	-65.1	-36.7	178.7	-68.7	169.1	0	0	0	112.1	I59 Q67	I59-L63 HydrophobicContact CG2-CD1 3.94Å; I59-L63 HydrophobicContact CG2-CG 4.48Å; I59-L63 WeakPolarHBondContact O-CG 3.3Å; I59-L63 PolarHBondContact O-N 3.32Å; L63-Q67 WeakPolarHBondContact O-CB 3.37Å; L63-Q67 PolarHBondContact O-N 3.29Å
64	L	67.6	Low	61.8	Low	90 Å²	90	112.4 Å²	112.4	47%	0.471	54%	0.541	S	S	.	.	H	α-helix	trans	-68.1	-34.5	172.5	-75.3	166.3	0	0	0	112.7	E60 R61 M62 Y68	E60-L64 WeakPolarHBondContact O-CB 3.39Å; E60-L64 WeakPolarHBondContact O-CD1 3.18Å; E60-L64 WeakPolarHBondContact O-CG 2.95Å; E60-L64 PolarHBondContact O-N 3.44Å; E60-L64 VanDerWaalsContact O-N 3.08Å; R61-L64 PolarHBondContact O-N 2.92Å; M62-L64 VanDerWaalsContact C-N 3.33Å; M62-L64 PolarHBondContact O-N 3.49Å; L64-Y68 WeakPolarHBondContact O-CB 3.49Å; L64-Y68 PolarHBondContact O-N 3.34Å
65	E	66.3	Low	60.9	Low	110 Å²	110	111.5 Å²	111.5	51%	0.514	54%	0.539	S	S	.	.	H	α-helix	trans	-69.4	-44.9	174.7	-176.2	166.3	-161.6	0	0	111.6	R61 M62 Q67 Y68 Y69	R61-E65 WeakPolarHBondContact O-CB 3.23Å; R61-E65 PolarHBondContact O-N 3.03Å; M62-E65 PolarHBondContact O-N 2.79Å; M62-E65 VanDerWaalsContact O-N 3.16Å; E65-Q67 PolarHBondContact O-N 2.96Å; E65-Y68 WeakPolarHBondContact O-CB 3.35Å; E65-Y68 PolarHBondContact O-N 2.68Å; E65-Y69 HydrophobicContact CG-CD2 3.91Å; E65-Y69 HydrophobicContact CG-CE2 3.64Å; E65-Y69 WeakPolarHBondContact O-CD2 3.36Å; E65-Y69 PolarHBondContact O-N 3.48Å
66	E	69	Low	59.9	Low	116 Å²	116	112.1 Å²	112.1	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-60.4	-44.2	172.7	-72.1	-174.3	157.3	0	0	111.8	M62 Y68 Y69 L70	M62-E66 PolarHBondContact O-N 2.6Å; E66-Y68 VanDerWaalsContact C-N 3.35Å; E66-Y68 PolarHBondContact O-N 2.88Å; E66-Y69 PolarHBondContact O-N 2.91Å; E66-L70 WeakPolarHBondContact O-CD1 3.39Å; E66-L70 PolarHBondContact O-N 2.79Å
67	Q	58.2	Low	58.2	Low	118 Å²	118	114.4 Å²	114.4	55%	0.551	57%	0.57	S	S	*	*	H	α-helix	trans	-62.8	-40.7	176.9	-169.3	174.5	15.1	0	0	111.9	L63 E65 L70 T71	L63-Q67 WeakPolarHBondContact O-CB 3.37Å; L63-Q67 PolarHBondContact O-N 3.29Å; E65-Q67 PolarHBondContact O-N 2.96Å; Q67-L70 PolarHBondContact O-N 3.48Å; Q67-T71 PolarHBondContact O-N 3.34Å; Q67-T71 PolarHBondContact O-OG1 2.88Å; Q67-T71 VanDerWaalsContact O-OG1 3.14Å
68	Y	61	Low	56.5	Low	111 Å²	111	116.5 Å²	116.5	44%	0.435	58%	0.583	S	S	.	*	H	α-helix	trans	-60.4	-43.2	174.4	170.7	-114.1	0	0	0	112.3	L64 E65 E66 L70 G72 D73	L64-Y68 WeakPolarHBondContact O-CB 3.49Å; L64-Y68 PolarHBondContact O-N 3.34Å; E65-Y68 WeakPolarHBondContact O-CB 3.35Å; E65-Y68 PolarHBondContact O-N 2.68Å; E66-Y68 VanDerWaalsContact C-N 3.35Å; E66-Y68 PolarHBondContact O-N 2.88Å; Y68-L70 VanDerWaalsContact C-N 3.31Å; Y68-L70 PolarHBondContact O-N 3.43Å; Y68-G72 WeakPolarHBondContact O-CA 3.32Å; Y68-G72 PolarHBondContact O-N 3.24Å; Y68-D73 WeakPolarHBondContact CD2-O 3.37Å
69	Y	49.7	Very low	54.7	Low	169 Å²	169	122.4 Å²	122.4	66%	0.663	61%	0.608	S	S	*	*	H	α-helix	trans	-69.6	-24.5	175.5	-77.5	-62.6	0	0	0	113.7	E65 E66	E65-Y69 HydrophobicContact CG-CD2 3.91Å; E65-Y69 HydrophobicContact CG-CE2 3.64Å; E65-Y69 WeakPolarHBondContact O-CD2 3.36Å; E65-Y69 PolarHBondContact O-N 3.48Å; E66-Y69 PolarHBondContact O-N 2.91Å
70	L	44.2	Very low	53.1	Low	151 Å²	151	124.7 Å²	124.7	79%	0.791	63%	0.627	S	S	*	*	H	α-helix	trans	-83	-35.7	176.7	-102.3	69	0	0	0	114.3	E66 Q67 Y68	E66-L70 WeakPolarHBondContact O-CD1 3.39Å; E66-L70 PolarHBondContact O-N 2.79Å; Q67-L70 PolarHBondContact O-N 3.48Å; Y68-L70 VanDerWaalsContact C-N 3.31Å; Y68-L70 PolarHBondContact O-N 3.43Å
71	T	62.8	Low	51.2	Low	89 Å²	89	126.3 Å²	126.3	55%	0.546	65%	0.649	S	S	.	*	H	α-helix	trans	-108.9	-22.8	-174.5	64.9	0	0	0	0	114.8	Q67 D73	Q67-T71 PolarHBondContact O-N 3.34Å; Q67-T71 PolarHBondContact O-OG1 2.88Å; Q67-T71 VanDerWaalsContact O-OG1 3.14Å; T71-D73 PolarHBondContact O-N 2.94Å; T71-D73 VanDerWaalsContact O-N 3.13Å
72	G	42.3	Very low	49.2	Very low	53 Å²	53	127.7 Å²	127.7	55%	0.546	67%	0.666	S	S	.	*			trans	73.6	-9.4	177.3	0	0	0	0	0	116.5	Y68	Y68-G72 WeakPolarHBondContact O-CA 3.32Å; Y68-G72 PolarHBondContact O-N 3.24Å
73	D	45.4	Very low	47.7	Very low	129 Å²	129	127.2 Å²	127.2	69%	0.69	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-74.9	155.4	178.8	-95	-37.1	0	0	0	113.1	Y68 T71	Y68-D73 WeakPolarHBondContact CD2-O 3.37Å; T71-D73 PolarHBondContact O-N 2.94Å; T71-D73 VanDerWaalsContact O-N 3.13Å
74	R	45.3	Very low	46	Very low	218 Å²	218	129.8 Å²	129.8	82%	0.823	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-94.1	137.4	-179.8	-69.9	-171.6	177.4	-158.1	-0.4	112.7
75	I	48.1	Very low	44.3	Very low	129 Å²	129	135.2 Å²	135.2	66%	0.662	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-60.1	130.6	175.1	-54.4	173.3	0	0	0	110.9
76	P	37.6	Very low	42.8	Very low	106 Å²	106	140 Å²	140	69%	0.688	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-91.7	129.5	170	-3.9	23.4	0	0	0	112.9
77	D	40.7	Very low	41.6	Very low	163 Å²	163	140 Å²	140	87%	0.872	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-77.9	125.9	173.1	-69.6	-48.8	0	0	0	112.3
78	I	34.7	Very low	40.1	Very low	148 Å²	148	143.7 Å²	143.7	76%	0.759	75%	0.749	S	S	*	*			trans	-138	94.3	174.1	-55.2	-177.3	0	0	0	113
79	L	29.1	Very low	38.6	Very low	160 Å²	160	144.9 Å²	144.9	84%	0.838	76%	0.762	S	S	*	*			trans	58.4	172.2	149.4	-99.4	63.2	0	0	0	119.7
80	P	35.3	Very low	37.5	Very low	114 Å²	114	146.8 Å²	146.8	74%	0.74	77%	0.774	S	S	*	*			cis	-120.8	168.2	-19.2	31.1	-13.4	0	0	0	113.8
81	S	32.1	Very low	36.8	Very low	127 Å²	127	148.7 Å²	148.7	89%	0.888	78%	0.775	S	S	*	*			trans	-114.8	129.2	171.6	-55	0	0	0	0	111.3
82	D	30.9	Very low	35.2	Very low	163 Å²	163	149.9 Å²	149.9	87%	0.872	79%	0.788	S	S	*	*			trans	-104	136.7	175.7	-162.8	44.2	0	0	0	111.4
83	P	34.8	Very low	34.7	Very low	107 Å²	107	153.2 Å²	153.2	70%	0.695	80%	0.8	S	S	*	*			trans	-110.9	92.3	-151.8	38.7	-31.4	0	0	0	115.4
84	N	30.5	Very low	33.9	Very low	154 Å²	154	152.8 Å²	152.8	82%	0.824	80%	0.802	S	S	*	*			trans	-151.9	75.5	167.8	-131.6	-28.1	0	0	0	119.3
85	K	33.1	Very low	33.3	Very low	205 Å²	205	151.7 Å²	151.7	89%	0.891	80%	0.803	S	S	*	*			trans	-173.1	144.9	130.6	-97.5	145.7	-169.2	170.2	0	110.9
86	K	34.8	Very low	32.1	Very low	211 Å²	211	151.2 Å²	151.2	92%	0.917	81%	0.811	S	S	*	*			trans	-99.6	152.3	-170.7	-80.5	-179.3	176.8	174	0	113.9
87	P	42.3	Very low	32.3	Very low	115 Å²	115	151.7 Å²	151.7	75%	0.747	82%	0.817	S	S	*	*			trans	-105.3	167.2	-160.9	40.5	-36.8	0	0	0	115
88	K	26.7	Very low	31.8	Very low	196 Å²	196	150.1 Å²	150.1	85%	0.852	81%	0.813	S	S	*	*			trans	-141.4	93.5	159.3	-73.5	-168.9	179.4	175.9	0	114
89	I	29.9	Very low	31.6	Very low	136 Å²	136	147.2 Å²	147.2	70%	0.697	81%	0.806	S	S	*	*				54.3	114.7	128.3	-56.3	157.1	0	0	0	117.5
90	K	27.6	Very low	31.8	Very low	209 Å²	209	145.3 Å²	145.3	91%	0.909	81%	0.813	S	S	*	*				-141.3	155.9	89.6	-90.2	177.1	-171.6	175.9	0	110.2
91	K	28.1	Very low	32.1	Very low	190 Å²	190	144.7 Å²	144.7	83%	0.826	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-102.5	137.8	-163.6	-59	175.4	179.7	179.1	0	112
92	S	29.1	Very low	32.5	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81.3	146.6	148.8	49.8	0	0	0	0	109.9
93	P	32.6	Very low	33.5	Very low	123 Å²	123	138.8 Å²	138.8	80%	0.799	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-100.6	121.2	168.5	13.9	4.6	0	0	0	112.2
94	T	28.1	Very low	34.7	Very low	119 Å²	119	139.1 Å²	139.1	73%	0.73	79%	0.793	S	S	*	*			trans	-44.1	158.8	146.2	48.2	0	0	0	0	112.6
95	K	32.4	Very low	36.8	Very low	196 Å²	196	142.1 Å²	142.1	85%	0.852	79%	0.793	S	S	*	*			cis	-171.3	146.7	9.6	-120	167.2	-175.3	-176.2	0	107.4
96	S	24.8	Very low	39.2	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	76%	0.756	S	S	*	*			trans	-173.7	149.3	139.6	51.9	0	0	0	0	111.8
97	S	40.7	Very low	41.7	Very low	116 Å²	116	126.3 Å²	126.3	81%	0.811	73%	0.729	S	S	*	*			trans	-105	103	178.5	50.7	0	0	0	0	110.8
98	T	30.4	Very low	43.7	Very low	130 Å²	130	127.9 Å²	127.9	80%	0.798	73%	0.725	S	S	*	*			trans	-165.3	165.1	163.6	-4	0	0	0	0	110.8
99	S	30.4	Very low	46.5	Very low	87 Å²	87	125 Å²	125	61%	0.608	71%	0.714	S	S	*	*			trans	62.3	52.4	168.8	65.5	0	0	0	0	120	S101	S99-S101 PolarHBondContact O-N 2.85Å
100	A	34.1	Very low	49.4	Very low	120 Å²	120	119.5 Å²	119.5	99%	0.992	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	39.1	160.8	0	0	0	0	0	114.2
101	S	40	Very low	52.5	Low	102 Å²	102	112.9 Å²	112.9	71%	0.713	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	0.6	-174.1	57.3	0	0	0	0	114.1	S99	S99-S101 PolarHBondContact O-N 2.85Å
102	A	41.3	Very low	55.5	Low	76 Å²	76	108.3 Å²	108.3	63%	0.628	64%	0.638	S	S	*	*			trans	-88.3	-7.3	-165.7	0	0	0	0	0	116.6
103	S	51.9	Low	58.5	Low	89 Å²	89	104.9 Å²	104.9	62%	0.622	61%	0.611	S	S	*	*	S	Bend	trans	-98.3	-9.3	-170.3	-158.4	0	0	0	0	115.8	R135	S103-R135 PolarHBondContact O-NH1 3.41Å
104	S	59.3	Low	61.4	Low	115 Å²	115	99 Å²	99	80%	0.804	57%	0.573	S	S	*	*	S	Bend	trans	-78.7	-22.7	178.3	-172.5	0	0	0	0	113.7
105	R	74.4	Confident	64.5	Low	217 Å²	217	97.4 Å²	97.4	82%	0.819	56%	0.557	S	S	*	*	S	Bend	trans	-101.6	119.9	-169.8	-166.8	172.7	-174.8	169.7	0.2	111.1	S107 R135	R105-S107 PolarHBondContact O-N 3.37Å; R105-R135 PolarHBondContact O-NH2 3.42Å
106	W	84.3	Confident	67.3	Low	31 Å²	31	93.2 Å²	93.2	12%	0.117	54%	0.54	C	S	.	.			trans	-64.8	131.9	173.7	-76.8	63.3	0	0	0	110.9	E110 K111 F114 V132 R135 V140 Y143	W106-E110 VanDerWaalsContact CA-OE2 3.26Å; W106-E110 WeakPolarHBondContact CA-OE2 3.46Å; W106-E110 HydrophobicContact CE3-CB 3.79Å; W106-E110 HydrophobicContact CZ3-CB 4.22Å; W106-K111 HydrophobicContact CB-CG 4.26Å; W106-K111 HydrophobicContact CE3-CG 4.41Å; W106-K111 WeakPolarHBondContact O-CE 3.41Å; W106-K111 PolarHBondContact O-NZ 2.99Å; W106-F114 HydrophobicContact CH2-CD2 4.49Å; W106-F114 HydrophobicContact CZ3-CB 4.09Å; W106-F114 HydrophobicContact CZ3-CD2 4.47Å; W106-F114 HydrophobicContact CZ3-CG 4.46Å; W106-V132 HydrophobicContact CH2-CG1 4.49Å; W106-V132 HydrophobicContact CZ3-CG1 4.25Å; W106-R135 HydrophobicContact CH2-CB 4.13Å; W106-R135 HydrophobicContact CH2-CG 3.91Å; W106-R135 HydrophobicContact CZ2-CB 4.27Å; W106-R135 HydrophobicContact CZ2-CG 3.96Å; W106-R135 HydrophobicContact CZ3-CG 4.33Å; W106-V140 HydrophobicContact CH2-CG2 4.07Å; W106-Y143 HydrophobicContact CB-CE2 4.43Å; W106-Y143 AromaticContact CD1-CD2 3.86Å; W106-Y143 AromaticContact CD2-CD1 3.87Å; W106-Y143 HydrophobicContact CD2-CD1 3.87Å; W106-Y143 AromaticContact CD2-CD2 3.87Å; W106-Y143 HydrophobicContact CD2-CD2 3.87Å; W106-Y143 HydrophobicContact CD2-CE1 4.26Å; W106-Y143 HydrophobicContact CD2-CE2 4.28Å; W106-Y143 AromaticContact CD2-CG 3.68Å; W106-Y143 HydrophobicContact CD2-CG 3.68Å; W106-Y143 VanDerWaalsContact CE2-CB 3.47Å; W106-Y143 AromaticContact CE2-CD2 3.88Å; W106-Y143 AromaticContact CE2-CG 3.49Å; W106-Y143 VanDerWaalsContact CE2-CG 3.49Å; W106-Y143 AromaticContact CE3-CD1 3.73Å; W106-Y143 HydrophobicContact CE3-CD1 3.73Å; W106-Y143 AromaticContact CE3-CE1 3.97Å; W106-Y143 HydrophobicContact CE3-CE1 3.97Å; W106-Y143 HydrophobicContact CE3-CG 4.04Å; W106-Y143 AromaticContact CG-CD2 3.91Å; W106-Y143 HydrophobicContact CG-CD2 3.91Å; W106-Y143 HydrophobicContact CG-CE2 4.1Å; W106-Y143 HydrophobicContact CG-CG 4.23Å; W106-Y143 AromaticContact CH2-CD1 3.94Å; W106-Y143 HydrophobicContact CH2-CD1 3.94Å; W106-Y143 HydrophobicContact CH2-CG 4.1Å; W106-Y143 HydrophobicContact CZ2-CD1 4.07Å; W106-Y143 AromaticContact CZ2-CG 3.73Å; W106-Y143 HydrophobicContact CZ2-CG 3.73Å; W106-Y143 AromaticContact CZ3-CD1 3.77Å; W106-Y143 HydrophobicContact CZ3-CD1 3.77Å; W106-Y143 HydrophobicContact CZ3-CE1 4.31Å; W106-Y143 HydrophobicContact CZ3-CG 4.24Å; W106-Y143 AromaticContact NE1-CD2 3.82Å; W106-Y143 AromaticContact NE1-CG 3.86Å
107	S	87.8	Confident	70.5	Confident	52 Å²	52	87.6 Å²	87.6	36%	0.364	50%	0.501	S	S	.	.			trans	-70.7	-175.4	178.5	94.3	0	0	0	0	111.6	R105 Q109 E110 K111	R105-S107 PolarHBondContact O-N 3.37Å; S107-Q109 PolarHBondContact OG-N 3.27Å; S107-E110 PolarHBondContact N-OE2 2.69Å; S107-E110 WeakPolarHBondContact OG-CG 3.29Å; S107-E110 PolarHBondContact OG-N 3.48Å; S107-K111 VanDerWaalsContact O-CD 3.26Å; S107-K111 WeakPolarHBondContact O-CD 3.4Å; S107-K111 VanDerWaalsContact O-CE 3.23Å; S107-K111 WeakPolarHBondContact O-CE 3.48Å; S107-K111 VanDerWaalsContact O-CG 3.28Å; S107-K111 WeakPolarHBondContact O-CG 3.15Å; S107-K111 PolarHBondContact O-NZ 3.5Å
108	K	84.6	Confident	72.9	Confident	148 Å²	148	83.6 Å²	83.6	64%	0.643	47%	0.47	S	S	*	.	S	Bend	trans	-79.9	-47	172.5	-171.5	170.8	178.8	-74.5	0	110.6	E110 K111 E112	K108-E110 PolarHBondContact O-N 3.44Å; K108-K111 WeakPolarHBondContact O-CB 3.41Å; K108-K111 PolarHBondContact O-N 2.92Å; K108-K111 VanDerWaalsContact O-N 3.09Å; K108-E112 WeakPolarHBondContact CE-OE1 3.35Å; K108-E112 IonicContact NZ-OE1 2.58Å; K108-E112 PolarHBondContact NZ-OE1 3.06Å; K108-E112 IonicContact NZ-OE2 3.75Å; K108-E112 PolarHBondContact O-N 2.75Å
109	Q	83.9	Confident	75.8	Confident	137 Å²	137	81.7 Å²	81.7	64%	0.64	47%	0.468	S	S	*	.	H	α-helix	trans	-62.6	-41.2	178.7	-171.6	175.3	-2.5	0	0	112.6	S107 K111 E112 L113	S107-Q109 PolarHBondContact OG-N 3.27Å; Q109-K111 PolarHBondContact O-N 3.36Å; Q109-E112 PolarHBondContact O-N 3.27Å; Q109-L113 HydrophobicContact CG-CD1 4.14Å; Q109-L113 WeakPolarHBondContact O-CB 3.18Å; Q109-L113 VanDerWaalsContact O-CG 3.29Å; Q109-L113 WeakPolarHBondContact O-CG 3.2Å; Q109-L113 PolarHBondContact O-N 3.29Å
110	E	92.4	Very high	78.5	Confident	20 Å²	20	82.9 Å²	82.9	9%	0.093	46%	0.464	C	S	.	.	H	α-helix	trans	-61.1	-28.6	175.2	-70.8	174.3	150.3	0	0	112.6	W106 S107 K108 F114 V132 T134 R135	W106-E110 VanDerWaalsContact CA-OE2 3.26Å; W106-E110 WeakPolarHBondContact CA-OE2 3.46Å; W106-E110 HydrophobicContact CE3-CB 3.79Å; W106-E110 HydrophobicContact CZ3-CB 4.22Å; S107-E110 PolarHBondContact N-OE2 2.69Å; S107-E110 WeakPolarHBondContact OG-CG 3.29Å; S107-E110 PolarHBondContact OG-N 3.48Å; K108-E110 PolarHBondContact O-N 3.44Å; E110-F114 VanDerWaalsContact O-CB 3.26Å; E110-F114 WeakPolarHBondContact O-CB 3.47Å; E110-F114 PolarHBondContact O-N 2.91Å; E110-F114 VanDerWaalsContact O-N 3.11Å; E110-V132 HydrophobicContact CB-CG1 4.45Å; E110-V132 HydrophobicContact CG-CG1 4.49Å; E110-T134 PolarHBondContact OE1-OG1 2.9Å; E110-R135 VanDerWaalsContact CD-NE 3.35Å; E110-R135 VanDerWaalsContact CD-NH2 3.31Å; E110-R135 IonicContact OE1-CZ 3.47Å; E110-R135 IonicContact OE1-NE 3.97Å; E110-R135 PolarHBondContact OE1-NE 3.3Å; E110-R135 IonicContact OE1-NH2 2.89Å; E110-R135 PolarHBondContact OE1-NH2 3.27Å; E110-R135 IonicContact OE2-CZ 2.6Å; E110-R135 IonicContact OE2-NE 3.78Å; E110-R135 IonicContact OE2-NH2 2.77Å; E110-R135 PolarHBondContact OE2-NH2 2.86Å
111	K	92.3	Very high	81.1	Confident	70 Å²	70	80.1 Å²	80.1	30%	0.304	43%	0.428	S	S	.	.	H	α-helix	trans	-82.6	-40.6	177.9	-67	172.8	-168.3	132.7	0	111.9	W106 S107 K108 Q109 L113 F114 E115 Y143	W106-K111 HydrophobicContact CB-CG 4.26Å; W106-K111 HydrophobicContact CE3-CG 4.41Å; W106-K111 WeakPolarHBondContact O-CE 3.41Å; W106-K111 PolarHBondContact O-NZ 2.99Å; S107-K111 VanDerWaalsContact O-CD 3.26Å; S107-K111 WeakPolarHBondContact O-CD 3.4Å; S107-K111 VanDerWaalsContact O-CE 3.23Å; S107-K111 WeakPolarHBondContact O-CE 3.48Å; S107-K111 VanDerWaalsContact O-CG 3.28Å; S107-K111 WeakPolarHBondContact O-CG 3.15Å; S107-K111 PolarHBondContact O-NZ 3.5Å; K108-K111 WeakPolarHBondContact O-CB 3.41Å; K108-K111 PolarHBondContact O-N 2.92Å; K108-K111 VanDerWaalsContact O-N 3.09Å; Q109-K111 PolarHBondContact O-N 3.36Å; K111-L113 VanDerWaalsContact C-N 3.34Å; K111-F114 CarbonylContact O-C 3.57Å; K111-F114 WeakPolarHBondContact O-CB 3.48Å; K111-F114 PolarHBondContact O-N 3.01Å; K111-F114 VanDerWaalsContact O-N 3.14Å; K111-E115 WeakPolarHBondContact O-CG 3.36Å; K111-E115 PolarHBondContact O-N 3.1Å; K111-Y143 WeakPolarHBondContact CD-OH 3.41Å; K111-Y143 HydrophobicContact CG-CE1 4.16Å; K111-Y143 WeakPolarHBondContact CG-OH 3.47Å
112	E	90.4	Very high	83.3	Confident	93 Å²	93	76.8 Å²	76.8	44%	0.435	41%	0.409	S	S	.	.	H	α-helix	trans	-61.7	-45.6	175.8	-71.6	165.2	161.1	0	0	109.9	K108 Q109 F114 E115 E116	K108-E112 WeakPolarHBondContact CE-OE1 3.35Å; K108-E112 IonicContact NZ-OE1 2.58Å; K108-E112 PolarHBondContact NZ-OE1 3.06Å; K108-E112 IonicContact NZ-OE2 3.75Å; K108-E112 PolarHBondContact O-N 2.75Å; Q109-E112 PolarHBondContact O-N 3.27Å; E112-F114 VanDerWaalsContact C-N 3.35Å; E112-F114 PolarHBondContact O-N 3Å; E112-E115 PolarHBondContact O-N 2.85Å; E112-E116 WeakPolarHBondContact O-CB 3.35Å; E112-E116 PolarHBondContact O-N 3.29Å
113	L	91.8	Very high	85.6	Confident	43 Å²	43	82.4 Å²	82.4	23%	0.225	42%	0.415	C	S	.	.	H	α-helix	trans	-62.3	-36.3	171	-69.7	171.8	0	0	0	113	Q109 K111 G117 L131 V132	Q109-L113 HydrophobicContact CG-CD1 4.14Å; Q109-L113 WeakPolarHBondContact O-CB 3.18Å; Q109-L113 VanDerWaalsContact O-CG 3.29Å; Q109-L113 WeakPolarHBondContact O-CG 3.2Å; Q109-L113 PolarHBondContact O-N 3.29Å; K111-L113 VanDerWaalsContact C-N 3.34Å; L113-G117 PolarHBondContact O-N 2.86Å; L113-L131 HydrophobicContact CB-CD2 3.85Å; L113-L131 HydrophobicContact CD2-CD2 3.69Å; L113-L131 HydrophobicContact CG-CD2 4.35Å; L113-L131 VanDerWaalsContact O-CD2 3.25Å; L113-L131 WeakPolarHBondContact O-CD2 3.49Å; L113-V132 HydrophobicContact CB-CG2 3.99Å
114	F	94.1	Very high	87.4	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-68.4	-39.9	174.2	173.6	-90.5	0	0	0	112.6	W106 E110 K111 E112 L118 W125 I128 V132 V140 Y143 A144 Y147	W106-F114 HydrophobicContact CH2-CD2 4.49Å; W106-F114 HydrophobicContact CZ3-CB 4.09Å; W106-F114 HydrophobicContact CZ3-CD2 4.47Å; W106-F114 HydrophobicContact CZ3-CG 4.46Å; E110-F114 VanDerWaalsContact O-CB 3.26Å; E110-F114 WeakPolarHBondContact O-CB 3.47Å; E110-F114 PolarHBondContact O-N 2.91Å; E110-F114 VanDerWaalsContact O-N 3.11Å; K111-F114 CarbonylContact O-C 3.57Å; K111-F114 WeakPolarHBondContact O-CB 3.48Å; K111-F114 PolarHBondContact O-N 3.01Å; K111-F114 VanDerWaalsContact O-N 3.14Å; E112-F114 VanDerWaalsContact C-N 3.35Å; E112-F114 PolarHBondContact O-N 3Å; F114-L118 HydrophobicContact CE1-CD2 4.24Å; F114-L118 WeakPolarHBondContact O-CB 3.35Å; F114-L118 PolarHBondContact O-N 3.37Å; F114-W125 HydrophobicContact CE2-CE3 4.45Å; F114-W125 HydrophobicContact CE2-CZ3 4.06Å; F114-W125 HydrophobicContact CZ-CZ3 4.14Å; F114-I128 HydrophobicContact CD2-CG2 3.8Å; F114-I128 HydrophobicContact CE2-CG2 4.33Å; F114-V132 HydrophobicContact CB-CG2 4.3Å; F114-V140 HydrophobicContact CD2-CG1 4.09Å; F114-V140 HydrophobicContact CE2-CG1 3.96Å; F114-Y143 AromaticContact CD1-CD1 3.94Å; F114-Y143 HydrophobicContact CD1-CD1 3.94Å; F114-Y143 AromaticContact CD1-CE1 3.8Å; F114-Y143 HydrophobicContact CD1-CE1 3.8Å; F114-Y143 HydrophobicContact CD2-CD1 4.12Å; F114-Y143 HydrophobicContact CE1-CD1 4.12Å; F114-Y143 HydrophobicContact CE1-CE1 4.18Å; F114-Y143 HydrophobicContact CE2-CD1 4.29Å; F114-Y143 AromaticContact CG-CD1 3.96Å; F114-Y143 HydrophobicContact CG-CD1 3.96Å; F114-Y143 HydrophobicContact CG-CE1 4.12Å; F114-Y143 HydrophobicContact CZ-CD1 4.31Å; F114-A144 HydrophobicContact CE2-CB 4Å; F114-A144 HydrophobicContact CZ-CB 3.67Å; F114-Y147 HydrophobicContact CE1-CD1 4.05Å; F114-Y147 HydrophobicContact CE1-CD2 4.2Å; F114-Y147 HydrophobicContact CE1-CE1 4.47Å; F114-Y147 AromaticContact CE1-CG 3.91Å; F114-Y147 HydrophobicContact CE1-CG 3.91Å
115	E	93.8	Very high	88.9	Confident	85 Å²	85	82 Å²	82	40%	0.397	38%	0.382	S	S	.	.	H	α-helix	trans	-72	-40.6	178.1	-71.5	-171.8	128.3	0	0	111.7	K111 E112 L118 A119 Y147	K111-E115 WeakPolarHBondContact O-CG 3.36Å; K111-E115 PolarHBondContact O-N 3.1Å; E112-E115 PolarHBondContact O-N 2.85Å; E115-L118 PolarHBondContact O-N 3.42Å; E115-A119 WeakPolarHBondContact O-CB 3.29Å; E115-A119 PolarHBondContact O-N 3.47Å; E115-Y147 HydrophobicContact CG-CE2 3.93Å; E115-Y147 WeakPolarHBondContact OE1-CE2 3.41Å; E115-Y147 VanDerWaalsContact OE1-CZ 3.23Å; E115-Y147 PolarHBondContact OE1-OH 2.93Å
116	E	90.3	Very high	89.7	Confident	109 Å²	109	75.9 Å²	75.9	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-50.1	171.2	-179	174.5	-159.8	0	0	111.1	E112 L118 A119 Q120	E112-E116 WeakPolarHBondContact O-CB 3.35Å; E112-E116 PolarHBondContact O-N 3.29Å; E116-L118 VanDerWaalsContact C-N 3.27Å; E116-L118 PolarHBondContact O-N 2.9Å; E116-A119 PolarHBondContact O-N 2.91Å; E116-A119 VanDerWaalsContact O-N 3.12Å; E116-Q120 WeakPolarHBondContact O-CB 3.48Å; E116-Q120 PolarHBondContact O-N 2.84Å
117	G	91.6	Very high	89.8	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-61.4	-33.7	175.8	0	0	0	0	0	113.2	L113 Y121 I128	L113-G117 PolarHBondContact O-N 2.86Å; G117-Y121 WeakPolarHBondContact O-CB 3.37Å; G117-Y121 WeakPolarHBondContact O-CD2 3.36Å; G117-Y121 PolarHBondContact O-N 2.85Å; G117-I128 WeakPolarHBondContact O-CG1 3.46Å
118	L	92.8	Very high	90	Very high	31 Å²	31	77.1 Å²	77.1	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-70.3	-37.2	174.4	179.8	63.5	0	0	0	112.1	F114 E115 E116 G122 W125 I128 Y147 F148	F114-L118 HydrophobicContact CE1-CD2 4.24Å; F114-L118 WeakPolarHBondContact O-CB 3.35Å; F114-L118 PolarHBondContact O-N 3.37Å; E115-L118 PolarHBondContact O-N 3.42Å; E116-L118 VanDerWaalsContact C-N 3.27Å; E116-L118 PolarHBondContact O-N 2.9Å; L118-G122 VanDerWaalsContact O-CA 3.24Å; L118-G122 WeakPolarHBondContact O-CA 3.39Å; L118-G122 PolarHBondContact O-N 3.16Å; L118-W125 HydrophobicContact CD1-CH2 4.19Å; L118-W125 HydrophobicContact CD1-CZ3 4.26Å; L118-I128 HydrophobicContact CB-CD1 4.3Å; L118-Y147 HydrophobicContact CD2-CD1 4.42Å; L118-Y147 HydrophobicContact CD2-CE1 3.93Å; L118-F148 HydrophobicContact CD1-CZ 4.02Å; L118-F148 HydrophobicContact CD2-CE1 4.01Å; L118-F148 HydrophobicContact CD2-CZ 3.83Å
119	A	89.5	Confident	90.4	Very high	90 Å²	90	70.5 Å²	70.5	74%	0.744	34%	0.341	S	S	*	.	H	α-helix	trans	-70.6	-40.5	174.3	0	0	0	0	0	112.3	E115 E116	E115-A119 WeakPolarHBondContact O-CB 3.29Å; E115-A119 PolarHBondContact O-N 3.47Å; E116-A119 PolarHBondContact O-N 2.91Å; E116-A119 VanDerWaalsContact O-N 3.12Å
120	Q	87.6	Confident	90.7	Very high	112 Å²	112	72.8 Å²	72.8	52%	0.523	35%	0.349	S	S	.	.	H	α-helix	trans	-80.6	-36.8	-175.9	-168.2	176.4	43.6	0	0	113.4	E116	E116-Q120 WeakPolarHBondContact O-CB 3.48Å; E116-Q120 PolarHBondContact O-N 2.84Å
121	Y	88.3	Confident	90.4	Very high	63 Å²	63	73.9 Å²	73.9	25%	0.247	36%	0.355	C	S	.	.	H	α-helix	trans	-116.2	-5.4	-174	-55.6	-68.9	0	0	0	114.7	G117 R124 K127 L131	G117-Y121 WeakPolarHBondContact O-CB 3.37Å; G117-Y121 WeakPolarHBondContact O-CD2 3.36Å; G117-Y121 PolarHBondContact O-N 2.85Å; Y121-R124 WeakPolarHBondContact O-CB 3.32Å; Y121-R124 WeakPolarHBondContact O-CG 3.25Å; Y121-R124 PolarHBondContact O-NE 2.87Å; Y121-K127 HydrophobicContact CD1-CB 4.05Å; Y121-K127 HydrophobicContact CD1-CD 3.57Å; Y121-K127 HydrophobicContact CD1-CG 4.42Å; Y121-K127 HydrophobicContact CD2-CB 4.02Å; Y121-K127 HydrophobicContact CE1-CB 4.49Å; Y121-K127 HydrophobicContact CE1-CD 3.92Å; Y121-K127 HydrophobicContact CE2-CB 4.49Å; Y121-K127 HydrophobicContact CG-CB 3.8Å; Y121-K127 HydrophobicContact CG-CD 4.18Å; Y121-L131 HydrophobicContact CE2-CD1 3.85Å
122	G	87.3	Confident	90.3	Very high	31 Å²	31	70.5 Å²	70.5	32%	0.32	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	-141.4	-174.4	0	0	0	0	0	111.5	L118 R124 I128	L118-G122 VanDerWaalsContact O-CA 3.24Å; L118-G122 WeakPolarHBondContact O-CA 3.39Å; L118-G122 PolarHBondContact O-N 3.16Å; G122-R124 PolarHBondContact O-N 2.99Å; G122-I128 WeakPolarHBondContact O-CD1 3.25Å
123	R	89.6	Confident	89.9	Confident	195 Å²	195	72.4 Å²	72.4	74%	0.736	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	20.1	-176.7	-63.3	-179.7	179.6	161.1	2.8	114.5	W125	R123-W125 VanDerWaalsContact C-N 3.35Å; R123-W125 HydrophobicContact CB-CH2 4.18Å; R123-W125 HydrophobicContact CB-CZ2 3.63Å; R123-W125 HydrophobicContact CG-CH2 4.1Å; R123-W125 HydrophobicContact CG-CZ2 3.81Å; R123-W125 VanDerWaalsContact O-CD1 3.26Å; R123-W125 VanDerWaalsContact O-CE2 3.24Å; R123-W125 PolarHBondContact O-N 2.83Å; R123-W125 PolarHBondContact O-NE1 3.13Å; R123-W125 VanDerWaalsContact O-NE1 3.09Å
124	R	89.3	Confident	89.7	Confident	152 Å²	152	74.2 Å²	74.2	57%	0.574	37%	0.367	S	S	*	.			trans	-84.6	71.9	-177.1	-69.2	-178.1	-84.5	-152.2	-3.3	111.5	Y121 G122 T126 K127 I128	Y121-R124 WeakPolarHBondContact O-CB 3.32Å; Y121-R124 WeakPolarHBondContact O-CG 3.25Å; Y121-R124 PolarHBondContact O-NE 2.87Å; G122-R124 PolarHBondContact O-N 2.99Å; R124-T126 PolarHBondContact O-N 3.14Å; R124-K127 PolarHBondContact O-N 2.85Å; R124-I128 PolarHBondContact O-N 2.84Å
125	W	91.3	Very high	89.3	Confident	44 Å²	44	75.2 Å²	75.2	17%	0.167	37%	0.37	C	S	.	.	H	α-helix	trans	-53.4	-26.8	-171.8	-47.8	114.1	0	0	0	115.7	F114 L118 R123 I128 A129 V137 V140 K141 A144 F148	F114-W125 HydrophobicContact CE2-CE3 4.45Å; F114-W125 HydrophobicContact CE2-CZ3 4.06Å; F114-W125 HydrophobicContact CZ-CZ3 4.14Å; L118-W125 HydrophobicContact CD1-CH2 4.19Å; L118-W125 HydrophobicContact CD1-CZ3 4.26Å; R123-W125 VanDerWaalsContact C-N 3.35Å; R123-W125 HydrophobicContact CB-CH2 4.18Å; R123-W125 HydrophobicContact CB-CZ2 3.63Å; R123-W125 HydrophobicContact CG-CH2 4.1Å; R123-W125 HydrophobicContact CG-CZ2 3.81Å; R123-W125 VanDerWaalsContact O-CD1 3.26Å; R123-W125 VanDerWaalsContact O-CE2 3.24Å; R123-W125 PolarHBondContact O-N 2.83Å; R123-W125 PolarHBondContact O-NE1 3.13Å; R123-W125 VanDerWaalsContact O-NE1 3.09Å; W125-I128 HydrophobicContact CE3-CD1 3.88Å; W125-I128 HydrophobicContact CZ3-CD1 3.91Å; W125-A129 WeakPolarHBondContact O-CB 3.45Å; W125-A129 PolarHBondContact O-N 2.87Å; W125-V137 HydrophobicContact CB-CG1 4.13Å; W125-V140 HydrophobicContact CB-CG1 4.43Å; W125-V140 HydrophobicContact CE3-CG1 4.05Å; W125-K141 HydrophobicContact CG-CB 4.32Å; W125-K141 HydrophobicContact CG-CG 4.32Å; W125-A144 HydrophobicContact CE3-CB 4.08Å; W125-A144 HydrophobicContact CH2-CB 3.6Å; W125-A144 HydrophobicContact CZ2-CB 4.19Å; W125-A144 HydrophobicContact CZ3-CB 3.53Å; W125-F148 AromaticContact CH2-CE2 4Å; W125-F148 HydrophobicContact CH2-CE2 4Å; W125-F148 HydrophobicContact CH2-CZ 4.43Å
126	T	90.4	Very high	89.1	Confident	88 Å²	88	74 Å²	74	54%	0.54	37%	0.372	S	S	.	.	H	α-helix	trans	-69.4	-38.9	175.9	46.2	0	0	0	0	112.6	R124 K130 V137	R124-T126 PolarHBondContact O-N 3.14Å; T126-K130 PolarHBondContact O-N 3.48Å; T126-V137 HydrophobicContact CG2-CG1 4.03Å; T126-V137 HydrophobicContact CG2-CG2 4.29Å
127	K	87.8	Confident	89	Confident	108 Å²	108	71.6 Å²	71.6	47%	0.47	36%	0.364	S	S	.	.	H	α-helix	trans	-71.2	-40	173.7	-64.7	-165.9	177.2	-170.4	0	111	Y121 R124 A129 K130 L131	Y121-K127 HydrophobicContact CD1-CB 4.05Å; Y121-K127 HydrophobicContact CD1-CD 3.57Å; Y121-K127 HydrophobicContact CD1-CG 4.42Å; Y121-K127 HydrophobicContact CD2-CB 4.02Å; Y121-K127 HydrophobicContact CE1-CB 4.49Å; Y121-K127 HydrophobicContact CE1-CD 3.92Å; Y121-K127 HydrophobicContact CE2-CB 4.49Å; Y121-K127 HydrophobicContact CG-CB 3.8Å; Y121-K127 HydrophobicContact CG-CD 4.18Å; R124-K127 PolarHBondContact O-N 2.85Å; K127-A129 PolarHBondContact O-N 3.1Å; K127-K130 PolarHBondContact O-N 3.22Å; K127-L131 PolarHBondContact O-N 3.06Å
128	I	91	Very high	88.7	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-63.2	-41.9	175.8	-58.2	-179.9	0	0	0	111.6	F114 G117 L118 G122 R124 W125 K130 L131 V132 V140	F114-I128 HydrophobicContact CD2-CG2 3.8Å; F114-I128 HydrophobicContact CE2-CG2 4.33Å; G117-I128 WeakPolarHBondContact O-CG1 3.46Å; L118-I128 HydrophobicContact CB-CD1 4.3Å; G122-I128 WeakPolarHBondContact O-CD1 3.25Å; R124-I128 PolarHBondContact O-N 2.84Å; W125-I128 HydrophobicContact CE3-CD1 3.88Å; W125-I128 HydrophobicContact CZ3-CD1 3.91Å; I128-K130 VanDerWaalsContact C-N 3.34Å; I128-K130 PolarHBondContact O-N 3.03Å; I128-L131 PolarHBondContact O-N 3.43Å; I128-L131 VanDerWaalsContact O-N 3.13Å; I128-V132 HydrophobicContact CG2-CG2 4.15Å; I128-V132 WeakPolarHBondContact O-CG2 3.48Å; I128-V132 PolarHBondContact O-N 2.94Å; I128-V140 HydrophobicContact CB-CG1 4.07Å; I128-V140 HydrophobicContact CG2-CG1 3.73Å
129	A	92	Very high	88.4	Confident	10 Å²	10	80.7 Å²	80.7	8%	0.083	41%	0.409	C	S	.	.	H	α-helix	trans	-63.2	-38	175.2	0	0	0	0	0	112.9	W125 K127 L131 D133 V137 V140	W125-A129 WeakPolarHBondContact O-CB 3.45Å; W125-A129 PolarHBondContact O-N 2.87Å; K127-A129 PolarHBondContact O-N 3.1Å; A129-L131 VanDerWaalsContact C-N 3.28Å; A129-L131 PolarHBondContact O-N 3.34Å; A129-D133 PolarHBondContact O-N 3.13Å; A129-V137 HydrophobicContact CB-CB 4.38Å; A129-V137 HydrophobicContact CB-CG2 3.76Å; A129-V140 HydrophobicContact CB-CG2 3.97Å
130	K	90.4	Very high	88.5	Confident	185 Å²	185	76.4 Å²	76.4	80%	0.804	37%	0.374	S	S	*	.	H	α-helix	trans	-65.6	-28.5	172.8	-73.9	-174.8	176.3	-171.3	0	113.2	T126 K127 I128	T126-K130 PolarHBondContact O-N 3.48Å; K127-K130 PolarHBondContact O-N 3.22Å; I128-K130 VanDerWaalsContact C-N 3.34Å; I128-K130 PolarHBondContact O-N 3.03Å
131	L	87.8	Confident	88.6	Confident	42 Å²	42	75.9 Å²	75.9	22%	0.22	37%	0.37	C	S	.	.	H	α-helix	trans	-86.7	-28.5	178.9	-171.3	147.7	0	0	0	113.2	L113 Y121 K127 I128 A129	L113-L131 HydrophobicContact CB-CD2 3.85Å; L113-L131 HydrophobicContact CD2-CD2 3.69Å; L113-L131 HydrophobicContact CG-CD2 4.35Å; L113-L131 VanDerWaalsContact O-CD2 3.25Å; L113-L131 WeakPolarHBondContact O-CD2 3.49Å; Y121-L131 HydrophobicContact CE2-CD1 3.85Å; K127-L131 PolarHBondContact O-N 3.06Å; I128-L131 PolarHBondContact O-N 3.43Å; I128-L131 VanDerWaalsContact O-N 3.13Å; A129-L131 VanDerWaalsContact C-N 3.28Å; A129-L131 PolarHBondContact O-N 3.34Å
132	V	90.1	Very high	88.6	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-82.2	-22	174.9	172.9	0	0	0	0	112.5	W106 E110 L113 F114 I128 T134 R135	W106-V132 HydrophobicContact CH2-CG1 4.49Å; W106-V132 HydrophobicContact CZ3-CG1 4.25Å; E110-V132 HydrophobicContact CB-CG1 4.45Å; E110-V132 HydrophobicContact CG-CG1 4.49Å; L113-V132 HydrophobicContact CB-CG2 3.99Å; F114-V132 HydrophobicContact CB-CG2 4.3Å; I128-V132 HydrophobicContact CG2-CG2 4.15Å; I128-V132 WeakPolarHBondContact O-CG2 3.48Å; I128-V132 PolarHBondContact O-N 2.94Å; V132-T134 PolarHBondContact O-N 3.3Å; V132-T134 PolarHBondContact O-OG1 3Å; V132-R135 HydrophobicContact CG1-CB 3.83Å; V132-R135 HydrophobicContact CG1-CG 3.75Å
133	D	82	Confident	88.7	Confident	133 Å²	133	76.1 Å²	76.1	71%	0.711	37%	0.371	S	S	*	.			trans	52	-49.3	180	73.4	35.8	0	0	0	117.5	A129 R135	A129-D133 PolarHBondContact O-N 3.13Å; D133-R135 PolarHBondContact O-N 3.47Å
134	T	86.9	Confident	88.7	Confident	80 Å²	80	67 Å²	67	49%	0.491	34%	0.337	S	S	.	.	S	Bend	trans	-61.6	-14.9	174.8	52.1	0	0	0	0	115.8	E110 V132	E110-T134 PolarHBondContact OE1-OG1 2.9Å; V132-T134 PolarHBondContact O-N 3.3Å; V132-T134 PolarHBondContact O-OG1 3Å
135	R	85.9	Confident	88.5	Confident	21 Å²	21	68.4 Å²	68.4	8%	0.079	34%	0.342	C	S	.	.	S	Bend	trans	-130.2	134	-169.5	-59.4	-61.5	175.6	164.2	5.5	113.6	S103 R105 W106 E110 V132 D133 Q139 V140	S103-R135 PolarHBondContact O-NH1 3.41Å; R105-R135 PolarHBondContact O-NH2 3.42Å; W106-R135 HydrophobicContact CH2-CB 4.13Å; W106-R135 HydrophobicContact CH2-CG 3.91Å; W106-R135 HydrophobicContact CZ2-CB 4.27Å; W106-R135 HydrophobicContact CZ2-CG 3.96Å; W106-R135 HydrophobicContact CZ3-CG 4.33Å; E110-R135 VanDerWaalsContact CD-NE 3.35Å; E110-R135 VanDerWaalsContact CD-NH2 3.31Å; E110-R135 IonicContact OE1-CZ 3.47Å; E110-R135 IonicContact OE1-NE 3.97Å; E110-R135 PolarHBondContact OE1-NE 3.3Å; E110-R135 IonicContact OE1-NH2 2.89Å; E110-R135 PolarHBondContact OE1-NH2 3.27Å; E110-R135 IonicContact OE2-CZ 2.6Å; E110-R135 IonicContact OE2-NE 3.78Å; E110-R135 IonicContact OE2-NH2 2.77Å; E110-R135 PolarHBondContact OE2-NH2 2.86Å; V132-R135 HydrophobicContact CG1-CB 3.83Å; V132-R135 HydrophobicContact CG1-CG 3.75Å; D133-R135 PolarHBondContact O-N 3.47Å; R135-Q139 HydrophobicContact CB-CB 4.33Å; R135-V140 HydrophobicContact CB-CG2 4.01Å
136	S	89.4	Confident	88.2	Confident	61 Å²	61	71.5 Å²	71.5	43%	0.427	36%	0.358	S	S	.	.			trans	-71.3	158.8	178.9	80.7	0	0	0	0	112.8	L138 Q139 V140	S136-L138 PolarHBondContact O-N 3.49Å; S136-L138 VanDerWaalsContact O-N 3.15Å; S136-Q139 WeakPolarHBondContact O-CA 3.25Å; S136-Q139 WeakPolarHBondContact O-CB 3.4Å; S136-Q139 PolarHBondContact O-N 2.93Å; S136-Q139 WeakPolarHBondContact OG-CG 3.11Å; S136-Q139 PolarHBondContact OG-N 3.47Å; S136-V140 WeakPolarHBondContact O-CG2 3.45Å; S136-V140 PolarHBondContact O-N 2.93Å
137	V	88.8	Confident	88.1	Confident	57 Å²	57	68.5 Å²	68.5	35%	0.345	34%	0.338	S	S	.	.	H	α-helix	trans	-54.9	-35.8	179.5	-172.1	0	0	0	0	112.2	W125 T126 A129 K141	W125-V137 HydrophobicContact CB-CG1 4.13Å; T126-V137 HydrophobicContact CG2-CG1 4.03Å; T126-V137 HydrophobicContact CG2-CG2 4.29Å; A129-V137 HydrophobicContact CB-CB 4.38Å; A129-V137 HydrophobicContact CB-CG2 3.76Å; V137-K141 WeakPolarHBondContact O-CB 3.41Å; V137-K141 PolarHBondContact O-N 3.38Å
138	L	83.8	Confident	88.1	Confident	139 Å²	139	67.4 Å²	67.4	73%	0.728	33%	0.333	S	S	*	.	H	α-helix	trans	-70.7	-39.7	174.9	-86.9	81.5	0	0	0	112.5	S136 K141 S142	S136-L138 PolarHBondContact O-N 3.49Å; S136-L138 VanDerWaalsContact O-N 3.15Å; L138-K141 PolarHBondContact O-N 3.34Å; L138-S142 VanDerWaalsContact O-CB 3.31Å; L138-S142 WeakPolarHBondContact O-CB 3.31Å; L138-S142 PolarHBondContact O-N 2.9Å
139	Q	88.1	Confident	87.6	Confident	83 Å²	83	75 Å²	75	39%	0.388	37%	0.366	S	S	.	.	H	α-helix	trans	-64.3	-45.8	176.7	-70.5	169.9	-20.4	0	0	110.9	R135 S136 S142 Y143	R135-Q139 HydrophobicContact CB-CB 4.33Å; S136-Q139 WeakPolarHBondContact O-CA 3.25Å; S136-Q139 WeakPolarHBondContact O-CB 3.4Å; S136-Q139 PolarHBondContact O-N 2.93Å; S136-Q139 WeakPolarHBondContact OG-CG 3.11Å; S136-Q139 PolarHBondContact OG-N 3.47Å; Q139-S142 WeakPolarHBondContact O-CB 3.35Å; Q139-S142 PolarHBondContact O-N 2.98Å; Q139-Y143 WeakPolarHBondContact O-CB 3.44Å; Q139-Y143 PolarHBondContact O-N 3.12Å
140	V	91.4	Very high	86.8	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-57.6	-48.3	173.3	171.7	0	0	0	0	111.1	W106 F114 W125 I128 A129 R135 S136 S142 Y143 A144	W106-V140 HydrophobicContact CH2-CG2 4.07Å; F114-V140 HydrophobicContact CD2-CG1 4.09Å; F114-V140 HydrophobicContact CE2-CG1 3.96Å; W125-V140 HydrophobicContact CB-CG1 4.43Å; W125-V140 HydrophobicContact CE3-CG1 4.05Å; I128-V140 HydrophobicContact CB-CG1 4.07Å; I128-V140 HydrophobicContact CG2-CG1 3.73Å; A129-V140 HydrophobicContact CB-CG2 3.97Å; R135-V140 HydrophobicContact CB-CG2 4.01Å; S136-V140 WeakPolarHBondContact O-CG2 3.45Å; S136-V140 PolarHBondContact O-N 2.93Å; V140-S142 VanDerWaalsContact C-N 3.28Å; V140-S142 PolarHBondContact O-N 3.21Å; V140-Y143 PolarHBondContact O-N 3Å; V140-A144 WeakPolarHBondContact O-CB 3.44Å; V140-A144 PolarHBondContact O-N 3.31Å
141	K	88.8	Confident	85.8	Confident	102 Å²	102	77.3 Å²	77.3	44%	0.443	38%	0.376	S	S	.	.	H	α-helix	trans	-67.9	-24.9	178.9	-168.3	173.8	-172.9	175.3	0	113.1	W125 V137 L138 R145	W125-K141 HydrophobicContact CG-CB 4.32Å; W125-K141 HydrophobicContact CG-CG 4.32Å; V137-K141 WeakPolarHBondContact O-CB 3.41Å; V137-K141 PolarHBondContact O-N 3.38Å; L138-K141 PolarHBondContact O-N 3.34Å; K141-R145 WeakPolarHBondContact O-CG 3.35Å
142	S	88.3	Confident	84.1	Confident	63 Å²	63	78.8 Å²	78.8	44%	0.441	40%	0.401	S	S	.	.	H	α-helix	trans	-77.3	-47.5	172.3	-169.4	0	0	0	0	111.3	L138 Q139 V140 A144 R145 Q146	L138-S142 VanDerWaalsContact O-CB 3.31Å; L138-S142 WeakPolarHBondContact O-CB 3.31Å; L138-S142 PolarHBondContact O-N 2.9Å; Q139-S142 WeakPolarHBondContact O-CB 3.35Å; Q139-S142 PolarHBondContact O-N 2.98Å; V140-S142 VanDerWaalsContact C-N 3.28Å; V140-S142 PolarHBondContact O-N 3.21Å; S142-A144 VanDerWaalsContact C-N 3.34Å; S142-A144 PolarHBondContact O-N 3.3Å; S142-R145 WeakPolarHBondContact O-CB 3.47Å; S142-R145 PolarHBondContact O-N 3.38Å; S142-R145 VanDerWaalsContact O-N 3.15Å; S142-Q146 PolarHBondContact O-N 2.84Å
143	Y	89.2	Confident	82.3	Confident	36 Å²	36	87.6 Å²	87.6	14%	0.141	44%	0.439	C	S	.	.	H	α-helix	trans	-60.5	-42.5	176.6	-174.6	-113.7	0	0	0	111.8	W106 K111 F114 Q139 V140 R145 Q146 Y147	W106-Y143 HydrophobicContact CB-CE2 4.43Å; W106-Y143 AromaticContact CD1-CD2 3.86Å; W106-Y143 AromaticContact CD2-CD1 3.87Å; W106-Y143 HydrophobicContact CD2-CD1 3.87Å; W106-Y143 AromaticContact CD2-CD2 3.87Å; W106-Y143 HydrophobicContact CD2-CD2 3.87Å; W106-Y143 HydrophobicContact CD2-CE1 4.26Å; W106-Y143 HydrophobicContact CD2-CE2 4.28Å; W106-Y143 AromaticContact CD2-CG 3.68Å; W106-Y143 HydrophobicContact CD2-CG 3.68Å; W106-Y143 VanDerWaalsContact CE2-CB 3.47Å; W106-Y143 AromaticContact CE2-CD2 3.88Å; W106-Y143 AromaticContact CE2-CG 3.49Å; W106-Y143 VanDerWaalsContact CE2-CG 3.49Å; W106-Y143 AromaticContact CE3-CD1 3.73Å; W106-Y143 HydrophobicContact CE3-CD1 3.73Å; W106-Y143 AromaticContact CE3-CE1 3.97Å; W106-Y143 HydrophobicContact CE3-CE1 3.97Å; W106-Y143 HydrophobicContact CE3-CG 4.04Å; W106-Y143 AromaticContact CG-CD2 3.91Å; W106-Y143 HydrophobicContact CG-CD2 3.91Å; W106-Y143 HydrophobicContact CG-CE2 4.1Å; W106-Y143 HydrophobicContact CG-CG 4.23Å; W106-Y143 AromaticContact CH2-CD1 3.94Å; W106-Y143 HydrophobicContact CH2-CD1 3.94Å; W106-Y143 HydrophobicContact CH2-CG 4.1Å; W106-Y143 HydrophobicContact CZ2-CD1 4.07Å; W106-Y143 AromaticContact CZ2-CG 3.73Å; W106-Y143 HydrophobicContact CZ2-CG 3.73Å; W106-Y143 AromaticContact CZ3-CD1 3.77Å; W106-Y143 HydrophobicContact CZ3-CD1 3.77Å; W106-Y143 HydrophobicContact CZ3-CE1 4.31Å; W106-Y143 HydrophobicContact CZ3-CG 4.24Å; W106-Y143 AromaticContact NE1-CD2 3.82Å; W106-Y143 AromaticContact NE1-CG 3.86Å; K111-Y143 WeakPolarHBondContact CD-OH 3.41Å; K111-Y143 HydrophobicContact CG-CE1 4.16Å; K111-Y143 WeakPolarHBondContact CG-OH 3.47Å; F114-Y143 AromaticContact CD1-CD1 3.94Å; F114-Y143 HydrophobicContact CD1-CD1 3.94Å; F114-Y143 AromaticContact CD1-CE1 3.8Å; F114-Y143 HydrophobicContact CD1-CE1 3.8Å; F114-Y143 HydrophobicContact CD2-CD1 4.12Å; F114-Y143 HydrophobicContact CE1-CD1 4.12Å; F114-Y143 HydrophobicContact CE1-CE1 4.18Å; F114-Y143 HydrophobicContact CE2-CD1 4.29Å; F114-Y143 AromaticContact CG-CD1 3.96Å; F114-Y143 HydrophobicContact CG-CD1 3.96Å; F114-Y143 HydrophobicContact CG-CE1 4.12Å; F114-Y143 HydrophobicContact CZ-CD1 4.31Å; Q139-Y143 WeakPolarHBondContact O-CB 3.44Å; Q139-Y143 PolarHBondContact O-N 3.12Å; V140-Y143 PolarHBondContact O-N 3Å; Y143-R145 VanDerWaalsContact C-N 3.29Å; Y143-R145 PolarHBondContact O-N 2.92Å; Y143-Q146 CarbonylContact O-C 3.58Å; Y143-Q146 PolarHBondContact O-N 3.36Å; Y143-Y147 HydrophobicContact CE1-CD2 4.38Å; Y143-Y147 WeakPolarHBondContact O-CB 3.25Å; Y143-Y147 PolarHBondContact O-N 2.92Å
144	A	89.4	Confident	80.4	Confident	3 Å²	3	85.1 Å²	85.1	3%	0.025	43%	0.432	C	S	.	.	H	α-helix	trans	-53	-43	174.1	0	0	0	0	0	113.2	F114 W125 V140 S142 Q146 Y147 F148	F114-A144 HydrophobicContact CE2-CB 4Å; F114-A144 HydrophobicContact CZ-CB 3.67Å; W125-A144 HydrophobicContact CE3-CB 4.08Å; W125-A144 HydrophobicContact CH2-CB 3.6Å; W125-A144 HydrophobicContact CZ2-CB 4.19Å; W125-A144 HydrophobicContact CZ3-CB 3.53Å; V140-A144 WeakPolarHBondContact O-CB 3.44Å; V140-A144 PolarHBondContact O-N 3.31Å; S142-A144 VanDerWaalsContact C-N 3.34Å; S142-A144 PolarHBondContact O-N 3.3Å; A144-Q146 VanDerWaalsContact C-N 3.33Å; A144-Q146 PolarHBondContact O-N 3.31Å; A144-Y147 PolarHBondContact O-N 3.26Å; A144-F148 HydrophobicContact CB-CE2 4.3Å; A144-F148 WeakPolarHBondContact O-CD2 3.42Å; A144-F148 PolarHBondContact O-N 3.13Å
145	R	86.7	Confident	77.9	Confident	181 Å²	181	90.1 Å²	90.1	68%	0.683	45%	0.45	S	S	*	.	H	α-helix	trans	-64.6	-36.5	177.6	-68.3	168.4	-178.6	-98.3	9.7	112.2	K141 S142 Y143 K149	K141-R145 WeakPolarHBondContact O-CG 3.35Å; S142-R145 WeakPolarHBondContact O-CB 3.47Å; S142-R145 PolarHBondContact O-N 3.38Å; S142-R145 VanDerWaalsContact O-N 3.15Å; Y143-R145 VanDerWaalsContact C-N 3.29Å; Y143-R145 PolarHBondContact O-N 2.92Å; R145-K149 WeakPolarHBondContact O-CB 3.24Å; R145-K149 PolarHBondContact O-N 3.36Å
146	Q	85.1	Confident	75.7	Confident	109 Å²	109	95.1 Å²	95.1	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-72.9	-45.4	175.3	-63.6	-176.9	-4	0	0	111	S142 Y143 A144 F148 K149 H150	S142-Q146 PolarHBondContact O-N 2.84Å; Y143-Q146 CarbonylContact O-C 3.58Å; Y143-Q146 PolarHBondContact O-N 3.36Å; A144-Q146 VanDerWaalsContact C-N 3.33Å; A144-Q146 PolarHBondContact O-N 3.31Å; Q146-F148 PolarHBondContact O-N 3.47Å; Q146-K149 WeakPolarHBondContact O-CB 3.38Å; Q146-K149 PolarHBondContact O-N 3.08Å; Q146-K149 VanDerWaalsContact O-N 3.1Å; Q146-H150 PolarHBondContact O-CD2 2.95Å; Q146-H150 PolarHBondContact O-N 2.83Å
147	Y	87.8	Confident	73.3	Confident	26 Å²	26	96.1 Å²	96.1	10%	0.102	51%	0.505	C	S	.	.	H	α-helix	trans	-52.8	-54	178.6	179	-93.5	0	0	0	111.9	F114 E115 L118 Y143 A144 K149 H150 K151	F114-Y147 HydrophobicContact CE1-CD1 4.05Å; F114-Y147 HydrophobicContact CE1-CD2 4.2Å; F114-Y147 HydrophobicContact CE1-CE1 4.47Å; F114-Y147 AromaticContact CE1-CG 3.91Å; F114-Y147 HydrophobicContact CE1-CG 3.91Å; E115-Y147 HydrophobicContact CG-CE2 3.93Å; E115-Y147 WeakPolarHBondContact OE1-CE2 3.41Å; E115-Y147 VanDerWaalsContact OE1-CZ 3.23Å; E115-Y147 PolarHBondContact OE1-OH 2.93Å; L118-Y147 HydrophobicContact CD2-CD1 4.42Å; L118-Y147 HydrophobicContact CD2-CE1 3.93Å; Y143-Y147 HydrophobicContact CE1-CD2 4.38Å; Y143-Y147 WeakPolarHBondContact O-CB 3.25Å; Y143-Y147 PolarHBondContact O-N 2.92Å; A144-Y147 PolarHBondContact O-N 3.26Å; Y147-K149 VanDerWaalsContact C-N 3.33Å; Y147-K149 PolarHBondContact O-N 3.49Å; Y147-H150 PolarHBondContact O-N 2.71Å; Y147-K151 HydrophobicContact CE1-CD 3.68Å; Y147-K151 WeakPolarHBondContact O-CB 3.41Å; Y147-K151 PolarHBondContact O-N 3.24Å; Y147-K151 WeakPolarHBondContact OH-CD 3.36Å; Y147-K151 PolarHBondContact OH-NZ 3.31Å
148	F	88.1	Confident	70.5	Confident	85 Å²	85	98.5 Å²	98.5	37%	0.373	53%	0.531	S	S	.	.	H	α-helix	trans	-64.6	-34.9	177.2	-63.3	-58	0	0	0	113.1	L118 W125 A144 Q146 H150 G152	L118-F148 HydrophobicContact CD1-CZ 4.02Å; L118-F148 HydrophobicContact CD2-CE1 4.01Å; L118-F148 HydrophobicContact CD2-CZ 3.83Å; W125-F148 AromaticContact CH2-CE2 4Å; W125-F148 HydrophobicContact CH2-CE2 4Å; W125-F148 HydrophobicContact CH2-CZ 4.43Å; A144-F148 HydrophobicContact CB-CE2 4.3Å; A144-F148 WeakPolarHBondContact O-CD2 3.42Å; A144-F148 PolarHBondContact O-N 3.13Å; Q146-F148 PolarHBondContact O-N 3.47Å; F148-H150 VanDerWaalsContact C-N 3.28Å; F148-H150 PolarHBondContact O-N 3.29Å; F148-G152 PolarHBondContact O-N 3.04Å
149	K	80	Confident	68.1	Low	160 Å²	160	96.9 Å²	96.9	70%	0.696	54%	0.538	S	S	*	.	H	α-helix	trans	-67.1	-26.8	177.6	-173.3	179.9	179.5	-174.6	0	113.1	R145 Q146 Y147	R145-K149 WeakPolarHBondContact O-CB 3.24Å; R145-K149 PolarHBondContact O-N 3.36Å; Q146-K149 WeakPolarHBondContact O-CB 3.38Å; Q146-K149 PolarHBondContact O-N 3.08Å; Q146-K149 VanDerWaalsContact O-N 3.1Å; Y147-K149 VanDerWaalsContact C-N 3.33Å; Y147-K149 PolarHBondContact O-N 3.49Å
150	H	74.1	Confident	65.4	Low	130 Å²	130	97.6 Å²	97.6	60%	0.602	56%	0.557	S	S	*	*	H	α-helix	trans	-94.1	-37.8	176.1	-79.2	-90.3	0	0	0	113.2	Q146 Y147 F148 G152 K153	Q146-H150 PolarHBondContact O-CD2 2.95Å; Q146-H150 PolarHBondContact O-N 2.83Å; Y147-H150 PolarHBondContact O-N 2.71Å; F148-H150 VanDerWaalsContact C-N 3.28Å; F148-H150 PolarHBondContact O-N 3.29Å; H150-G152 VanDerWaalsContact C-N 3.28Å; H150-G152 PolarHBondContact O-N 3.33Å; H150-K153 PolarHBondContact O-N 3.21Å
151	K	69.8	Low	62.7	Low	113 Å²	113	103.2 Å²	103.2	49%	0.491	59%	0.594	S	S	.	*	H	α-helix	trans	-60.8	-36.5	178.3	-170	158.1	-179.7	162.9	0	112.2	Y147 K153 S154	Y147-K151 HydrophobicContact CE1-CD 3.68Å; Y147-K151 WeakPolarHBondContact O-CB 3.41Å; Y147-K151 PolarHBondContact O-N 3.24Å; Y147-K151 WeakPolarHBondContact OH-CD 3.36Å; Y147-K151 PolarHBondContact OH-NZ 3.31Å; K151-K153 PolarHBondContact O-N 2.84Å; K151-S154 PolarHBondContact O-N 2.95Å; K151-S154 PolarHBondContact O-OG 3.24Å
152	G	52.5	Low	59.9	Low	72 Å²	72	103.7 Å²	103.7	74%	0.742	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	10.9	170.2	0	0	0	0	0	116.1	F148 H150	F148-G152 PolarHBondContact O-N 3.04Å; H150-G152 VanDerWaalsContact C-N 3.28Å; H150-G152 PolarHBondContact O-N 3.33Å
153	K	52.6	Low	57.2	Low	186 Å²	186	112.8 Å²	112.8	81%	0.809	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.8	4.6	174.1	-68.7	-166.9	171.9	-164.2	0	113.6	H150 K151	H150-K153 PolarHBondContact O-N 3.21Å; K151-K153 PolarHBondContact O-N 2.84Å
154	S	41.9	Very low	54.3	Low	81 Å²	81	114.2 Å²	114.2	57%	0.566	66%	0.661	S	S	*	*			trans	-127.3	39.1	-168.3	68.5	0	0	0	0	114	K151	K151-S154 PolarHBondContact O-N 2.95Å; K151-S154 PolarHBondContact O-OG 3.24Å
155	E	34.4	Very low	51.9	Low	185 Å²	185	120.6 Å²	120.6	86%	0.864	70%	0.702	S	S	*	*			trans	-106.3	112.5	163.1	-70.2	-162.1	158.4	0	0	110.2
156	P	38.9	Very low	49.1	Very low	125 Å²	125	119.7 Å²	119.7	81%	0.812	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-76	131.4	161.8	-7.1	25	0	0	0	109.2	A158	P156-A158 PolarHBondContact O-N 3.01Å
157	G	39.7	Very low	46.8	Very low	82 Å²	82	119.4 Å²	119.4	85%	0.845	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-64	133.4	-176.1	0	0	0	0	0	113.9
158	A	31	Very low	44	Very low	108 Å²	108	125.8 Å²	125.8	89%	0.893	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-74.9	147.1	168.4	0	0	0	0	0	111.3	P156	P156-A158 PolarHBondContact O-N 3.01Å
159	A	31.5	Very low	41.1	Very low	105 Å²	105	129.7 Å²	129.7	87%	0.868	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-86.2	150.2	-166.3	0	0	0	0	0	114.9
160	A	32.2	Very low	38.6	Very low	97 Å²	97	133.3 Å²	133.3	80%	0.802	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-94	152.5	167.9	0	0	0	0	0	111.9
161	P	35.1	Very low	36.4	Very low	119 Å²	119	132.8 Å²	132.8	77%	0.773	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-85.4	139	-177.7	32.5	-34.6	0	0	0	115.2
162	S	30.6	Very low	34.4	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	80%	0.801	S	S	*	*			trans	26.2	97.4	154.6	61.3	0	0	0	0	122
163	R	31.5	Very low	33.2	Very low	253 Å²	253	141.6 Å²	141.6	96%	0.955	81%	0.809	S	S	*	*				26.1	116.6	127	-166.8	179.7	-167.9	174.1	4.2	120.2
164	G	26.9	Very low	32.4	Very low	66 Å²	66	138.4 Å²	138.4	68%	0.68	81%	0.808	S	S	*	*			trans	-131.6	163.3	150.9	0	0	0	0	0	110.7
165	P	39.4	Very low	31.6	Very low	137 Å²	137	140.9 Å²	140.9	89%	0.89	82%	0.819	S	S	*	*			trans	-92.9	170.5	-163.4	35.8	-36.8	0	0	0	117.7
166	E	27.8	Very low	31.2	Very low	162 Å²	162	139.9 Å²	139.9	76%	0.757	82%	0.817	S	S	*	*			trans	-43.1	171.9	169.5	-88.2	-170	100.7	0	0	118.3
167	P	37.2	Very low	30.6	Very low	103 Å²	103	139.6 Å²	139.6	67%	0.669	81%	0.813	S	S	*	*			cis	-137.1	165.7	16.7	23.2	2.6	0	0	0	119.4
168	Q	29.6	Very low	30.2	Very low	161 Å²	161	143.5 Å²	143.5	75%	0.752	81%	0.814	S	S	*	*			trans	37.6	125.7	141.7	-56.9	173.2	23.9	0	0	122.2
169	L	26.8	Very low	30.1	Very low	166 Å²	166	143.3 Å²	143.3	87%	0.869	81%	0.813	S	S	*	*				-175.5	172.8	107.7	-98	166.4	0	0	0	112.9
170	R	28	Very low	30	Very low	237 Å²	237	144.4 Å²	144.4	89%	0.894	81%	0.808	S	S	*	*			trans	-88.9	146.1	-171.4	-58.3	176.5	-177.1	167.2	-0.2	113.7
171	P	27.2	Very low	29.7	Very low	119 Å²	119	151.9 Å²	151.9	77%	0.773	82%	0.816	S	S	*	*			trans	-97.2	143.8	167.2	36	-32	0	0	0	113.8
172	P	28.5	Very low	29.5	Very low	127 Å²	127	152.6 Å²	152.6	83%	0.825	81%	0.812	S	S	*	*			trans	-85.9	-175.5	156.4	35.4	-32.1	0	0	0	111.9
173	R	26.8	Very low	29.3	Very low	243 Å²	243	156.6 Å²	156.6	92%	0.917	82%	0.818	S	S	*	*			trans	-88.6	161.8	-170.2	-76.3	179.5	176.8	171.3	-1.8	114.6
174	P	36.6	Very low	29.4	Very low	119 Å²	119	154.8 Å²	154.8	77%	0.773	81%	0.811	S	S	*	*			trans	-100.9	156	-165.1	38.6	-36.3	0	0	0	116.3
175	T	23.7	Very low	29.6	Very low	133 Å²	133	159.5 Å²	159.5	82%	0.816	82%	0.82	S	S	*	*			trans	-151.9	153.4	156.8	46.5	0	0	0	0	106.4
176	M	27.1	Very low	29	Very low	163 Å²	163	158.3 Å²	158.3	80%	0.803	82%	0.815	S	S	*	*			cis	-158.3	-165.2	-6	-116.3	-66.6	159.2	0	0	109.4
177	T	25.2	Very low	29.1	Very low	119 Å²	119	156.7 Å²	156.7	73%	0.73	81%	0.812	S	S	*	*			trans	64.6	101.4	161.3	58.6	0	0	0	0	121.3
178	N	31.8	Very low	29	Very low	164 Å²	164	159.8 Å²	159.8	88%	0.877	82%	0.823	S	S	*	*				20.5	127.6	126	-55.2	-14.5	0	0	0	121.1
179	A	27.8	Very low	29.3	Very low	104 Å²	104	159.6 Å²	159.6	86%	0.86	82%	0.822	S	S	*	*			trans	-148.6	142.3	138.1	0	0	0	0	0	109.8
180	V	29.3	Very low	29.6	Very low	129 Å²	129	159.9 Å²	159.9	78%	0.782	82%	0.824	S	S	*	*			trans	-122.7	135.7	176.4	172.8	0	0	0	0	109.2	I182	V180-I182 HydrophobicContact CG1-CG1 4.39Å
181	R	26.3	Very low	29.9	Very low	254 Å²	254	154.7 Å²	154.7	96%	0.958	82%	0.818	S	S	*	*			trans	-148.7	159.1	152.5	-120.6	171.1	-179.3	154.7	1.6	110.9
182	I	31.5	Very low	30.3	Very low	133 Å²	133	155.9 Å²	155.9	68%	0.682	82%	0.818	S	S	*	*			trans	-125.2	140.2	-161.3	-62.3	159.9	0	0	0	108.5	V180 R184	V180-I182 HydrophobicContact CG1-CG1 4.39Å; I182-R184 HydrophobicContact CG2-CG 4.36Å
183	E	27.4	Very low	30.4	Very low	196 Å²	196	157.2 Å²	157.2	92%	0.916	82%	0.817	S	S	*	*			trans	-126.7	163.6	152.4	-71.8	-165.9	147	0	0	109.9
184	R	33	Very low	30.7	Very low	215 Å²	215	151.5 Å²	151.5	81%	0.811	81%	0.809	S	S	*	*			trans	-125.9	139	-159.6	-77.8	-177.3	175.4	179	-1.8	112.9	I182	I182-R184 HydrophobicContact CG2-CG 4.36Å
185	L	31.6	Very low	30.8	Very low	166 Å²	166	153 Å²	153	87%	0.869	81%	0.81	S	S	*	*			trans	54.8	125.9	137	-57.1	171.7	0	0	0	120.9
186	S	26.9	Very low	31.2	Very low	112 Å²	112	153.3 Å²	153.3	78%	0.783	81%	0.807	S	S	*	*			trans	-150.7	110.5	140.7	-153.9	0	0	0	0	103.6
187	D	29.8	Very low	31.7	Very low	128 Å²	128	152.8 Å²	152.8	68%	0.684	81%	0.807	S	S	*	*				81.2	123.5	69.7	-170.1	39.1	0	0	0	112
188	D	33.5	Very low	31.9	Very low	168 Å²	168	153 Å²	153	90%	0.898	81%	0.813	S	S	*	*			trans	-167.8	101.5	-176.2	-133.6	-3.4	0	0	0	107.7
189	E	36.8	Very low	32.1	Very low	157 Å²	157	154.6 Å²	154.6	73%	0.734	82%	0.815	S	S	*	*			trans	-82.4	144.8	-170.2	-75.6	-93.4	93.1	0	0	114.4
190	D	33.3	Very low	32.2	Very low	171 Å²	171	153.4 Å²	153.4	91%	0.914	81%	0.813	S	S	*	*			trans	-107.7	107.2	170	-92.7	-42.4	0	0	0	110.4
191	V	34.2	Very low	32.4	Very low	129 Å²	129	157.2 Å²	157.2	78%	0.782	82%	0.823	S	S	*	*			trans	-139.2	145	170.4	-154.6	0	0	0	0	112.1
192	D	35.4	Very low	32.5	Very low	144 Å²	144	148.4 Å²	148.4	77%	0.77	81%	0.811	S	S	*	*			trans	-73.5	159.7	-172.5	-111	-44	0	0	0	115.4
193	I	29.6	Very low	32.4	Very low	155 Å²	155	151.7 Å²	151.7	80%	0.795	82%	0.823	S	S	*	*			trans	-139.2	109	149.9	-58.9	-177.5	0	0	0	109.1
194	T	34	Very low	32.5	Very low	123 Å²	123	149 Å²	149	76%	0.755	82%	0.815	S	S	*	*			trans	-94	146.1	150.6	39.4	0	0	0	0	109.6
195	D	39	Very low	32.3	Very low	149 Å²	149	145.9 Å²	145.9	80%	0.797	81%	0.812	S	S	*	*			trans	-68.3	146.8	171.7	-49.3	-72.5	0	0	0	110.8
196	D	32.7	Very low	32	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	81%	0.805	S	S	*	*				177.5	163.8	85.6	-141.1	-14.4	0	0	0	114.6
197	L	35.7	Very low	31.9	Very low	152 Å²	152	147.1 Å²	147.1	80%	0.796	80%	0.801	S	S	*	*			trans	44.3	143.9	158.9	-56.3	-173.6	0	0	0	126
198	S	31.2	Very low	31.5	Very low	123 Å²	123	149 Å²	149	86%	0.86	81%	0.806	S	S	*	*			trans	97.4	156.6	140.1	-151.8	0	0	0	0	121.1
199	E	35.9	Very low	31.7	Very low	197 Å²	197	145.5 Å²	145.5	92%	0.921	79%	0.792	S	S	*	*			trans	-98.3	158.2	-168.8	-51.5	175.6	145.8	0	0	113.5
200	G	29.9	Very low	31	Very low	79 Å²	79	143.4 Å²	143.4	81%	0.814	79%	0.794	S	S	*	*			trans	163	129.4	166	0	0	0	0	0	116.7
201	E	31.9	Very low	30.3	Very low	210 Å²	210	138.4 Å²	138.4	98%	0.981	78%	0.784	S	S	*	*			trans	-79.1	161.9	171.1	-56.5	163.3	156.6	0	0	110.5
202	G	29.5	Very low	30.8	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	79%	0.786	S	S	*	*			cis	168.7	168.2	-1.6	0	0	0	0	0	111.2
203	E	29.1	Very low	30.4	Very low	202 Å²	202	136.7 Å²	136.7	94%	0.944	79%	0.792	S	S	*	*			trans	62.1	160.4	169.6	-58.2	-175	168.2	0	0	119.5
204	D	29.2	Very low	30.2	Very low	139 Å²	139	132.7 Å²	132.7	74%	0.743	79%	0.789	S	S	*	*			cis	-161.7	162.8	-48.5	-163.1	2.6	0	0	0	110.2
205	M	28.2	Very low	29.6	Very low	150 Å²	150	136.1 Å²	136.1	74%	0.739	80%	0.797	S	S	*	*			trans	66.5	157.5	161	-70.5	-175.3	53.7	0	0	121.8
206	K	26.1	Very low	29.5	Very low	170 Å²	170	133.8 Å²	133.8	74%	0.739	79%	0.79	S	S	*	*			cis	-177.8	164.8	-34.2	-148.1	-178.4	176.6	174.8	0	112
207	I	24.9	Very low	29.3	Very low	134 Å²	134	135 Å²	135	69%	0.687	79%	0.791	S	S	*	*			trans	81.9	127.4	159.6	-62.4	161.5	0	0	0	115.6
208	E	21.7	Very low	28.8	Very low	168 Å²	168	132.3 Å²	132.3	79%	0.785	78%	0.781	S	S	*	*			cis	80.2	163.4	41.7	-76.3	-79.1	158.3	0	0	114.5
209	P	36.8	Very low	28.5	Very low	93 Å²	93	133.5 Å²	133.5	60%	0.604	78%	0.778	S	S	*	*			cis	-138.2	176.4	-11.8	38.1	-19	0	0	0	117.8
210	S	22.6	Very low	28	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	77%	0.77	S	S	*	*			trans	61.5	157.7	147.7	60.7	0	0	0	0	121.9
211	G	19.5	Very low	27.8	Very low	67 Å²	67	129.5 Å²	129.5	69%	0.691	77%	0.771	S	S	*	*			cis	105.5	160	2	0	0	0	0	0	115
212	P	44.1	Very low	27.5	Very low	128 Å²	128	124.3 Å²	124.3	83%	0.831	76%	0.763	S	S	*	*			cis	-145.3	-172.7	-23	44.1	-25.1	0	0	0	116.8
213	A	26.5	Very low	27.3	Very low	108 Å²	108	128.9 Å²	128.9	89%	0.893	77%	0.766	S	S	*	*			trans	68.2	158.6	155.8	0	0	0	0	0	122.3
214	G	25.5	Very low	27	Very low	72 Å²	72	126 Å²	126	74%	0.742	75%	0.753	S	S	*	*			cis	160.1	140.2	-18.2	0	0	0	0	0	118.5
215	Q	21.9	Very low	26.8	Very low	195 Å²	195	125 Å²	125	91%	0.911	74%	0.744	S	S	*	*			trans	67.4	171.9	156.8	-92.8	-175.3	2.7	0	0	121.7
216	P	37.2	Very low	26.6	Very low	99 Å²	99	126.2 Å²	126.2	64%	0.643	75%	0.745	S	S	*	*			cis	-143.6	-172.7	-20.8	39.1	-18.1	0	0	0	118.4
217	Q	27.3	Very low	26.3	Very low	167 Å²	167	125.6 Å²	125.6	78%	0.78	75%	0.745	S	S	*	*			trans	74.1	163.2	151.2	-81.9	-169.3	-117	0	0	123
218	T	25.2	Very low	26.7	Very low	95 Å²	95	124.8 Å²	124.8	58%	0.583	75%	0.748	S	S	*	*			cis	-164.7	-179.8	-34	28.2	0	0	0	0	113.8
219	D	25.8	Very low	26.7	Very low	149 Å²	149	121.9 Å²	121.9	80%	0.797	74%	0.742	S	S	*	*			trans	85.9	155.3	155.1	-54.2	-37.8	0	0	0	121.7
220	A	26.4	Very low	26	Very low	92 Å²	92	125.6 Å²	125.6	76%	0.76	75%	0.753	S	S	*	*			cis	-171.6	166	-30.5	0	0	0	0	0	114.9
221	A	24.3	Very low	25.9	Very low	100 Å²	100	124.5 Å²	124.5	83%	0.826	75%	0.745	S	S	*	*			trans	73.7	152.4	172.1	0	0	0	0	0	119.7
222	A	26.3	Very low	26.1	Very low	100 Å²	100	130.4 Å²	130.4	83%	0.826	76%	0.755	S	S	*	*			cis	97.8	139.3	4.9	0	0	0	0	0	118.2
223	E	25.1	Very low	25	Very low	165 Å²	165	127.8 Å²	127.8	77%	0.771	75%	0.751	S	S	*	*			cis	-124.9	-136.7	-3.5	-148.5	-164.5	98.9	0	0	111.5
224	E	23	Very low	24.9	Very low	142 Å²	142	130.3 Å²	130.3	66%	0.664	75%	0.748	S	S	*	*			cis	-147.3	178.7	5.7	-147.7	-148.3	119.2	0	0	113.7
225	Q	24.3	Very low	24.8	Very low	119 Å²	119	134.1 Å²	134.1	56%	0.556	75%	0.746	S	S	*	*			trans	-48.8	164	179.2	-64.5	154.5	52.2	0	0	118.8
226	K	23.8	Very low	24.9	Very low	175 Å²	175	132.1 Å²	132.1	76%	0.761	74%	0.736	S	S	*	*			cis	-171.3	161.8	43.7	-141.5	163	-156.2	112.7	0	114.4
227	E	20.5	Very low	24.3	Very low	157 Å²	157	133.2 Å²	133.2	73%	0.734	74%	0.742	S	S	*	*			trans	-99.9	-178.9	167.5	-123.2	-154.3	-110.9	0	0	110.9
228	P	32.9	Very low	24.1	Very low	117 Å²	117	133.2 Å²	133.2	76%	0.76	74%	0.739	S	S	*	*			cis	-145.1	-175.1	30	45.1	-23.8	0	0	0	119.5
229	T	21.8	Very low	24.2	Very low	107 Å²	107	136.9 Å²	136.9	66%	0.656	75%	0.749	S	S	*	*			trans	-74.8	150.3	175.4	-52.8	0	0	0	0	115.1
230	M	21.3	Very low	24.2	Very low	171 Å²	171	137.3 Å²	137.3	84%	0.842	75%	0.747	S	S	*	*			trans	-170.6	179.5	143.1	-104.2	-54.6	107	0	0	113.7
231	S	22.4	Very low	24.6	Very low	89 Å²	89	138.7 Å²	138.7	62%	0.622	75%	0.748	S	S	*	*			trans	-133.5	173.5	-152.9	57.9	0	0	0	0	118.1
232	E	21.9	Very low	24.7	Very low	192 Å²	192	138.7 Å²	138.7	90%	0.897	74%	0.741	S	S	*	*			trans	74	122.1	159.9	-61.6	-172.3	161.8	0	0	122
233	G	22	Very low	25.4	Very low	72 Å²	72	140 Å²	140	74%	0.742	74%	0.741	S	S	*	*				120	145	115.3	0	0	0	0	0	122
234	I	23.9	Very low	25.3	Very low	162 Å²	162	137.7 Å²	137.7	83%	0.831	74%	0.742	S	S	*	*			trans	89.9	108.8	140.4	-65.3	176.1	0	0	0	121.6
235	H	24.1	Very low	25.5	Very low	152 Å²	152	136.2 Å²	136.2	70%	0.704	75%	0.748	S	S	*	*			trans	49.4	105.7	142.1	-70.7	-87.5	0	0	0	124.8
236	E	23.8	Very low	26.3	Very low	152 Å²	152	135.8 Å²	135.8	71%	0.71	76%	0.755	S	S	*	*				49.6	116.8	96.9	-165.9	-166.4	-171.6	0	0	121.5
237	T	24.5	Very low	26.5	Very low	123 Å²	123	132 Å²	132	76%	0.755	75%	0.751	S	S	*	*				167	159.8	124.8	36	0	0	0	0	108.5
238	K	23.9	Very low	27	Very low	166 Å²	166	134 Å²	134	72%	0.722	76%	0.757	S	S	*	*			cis	-162	146.7	9.5	-145.5	174	-177.3	172.1	0	110
239	H	25.8	Very low	26.7	Very low	172 Å²	172	137 Å²	137	80%	0.796	76%	0.761	S	S	*	*				159.5	139.6	123.3	-94.7	-76.7	0	0	0	115.9
240	Q	25.4	Very low	27.1	Very low	159 Å²	159	136.9 Å²	136.9	74%	0.743	77%	0.765	S	S	*	*			trans	-128.6	173.3	164.4	-125.5	-167.3	5.4	0	0	106.6
241	P	35.8	Very low	28.5	Very low	120 Å²	120	134.3 Å²	134.3	78%	0.779	76%	0.761	S	S	*	*			cis	-144.2	179	44.4	40.2	-19.1	0	0	0	117.7
242	C	25.5	Very low	28.6	Very low	101 Å²	101	137.9 Å²	137.9	68%	0.682	77%	0.772	S	S	*	*			trans	-96.9	173.7	173.1	-45.6	0	0	0	0	112.1
243	P	41.6	Very low	28.6	Very low	128 Å²	128	133.8 Å²	133.8	83%	0.831	77%	0.765	S	S	*	*				-139.8	-153.5	78.3	39.4	-19.9	0	0	0	111.5
244	S	22.8	Very low	28.8	Very low	115 Å²	115	134.6 Å²	134.6	80%	0.804	76%	0.759	S	S	*	*			cis	-157	-179.6	4.8	63.3	0	0	0	0	112.1
245	S	27.3	Very low	28.7	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	76%	0.762	S	S	*	*			trans	-159.2	167.5	165.9	63.1	0	0	0	0	110.5
246	P	40.8	Very low	28.7	Very low	110 Å²	110	136.3 Å²	136.3	71%	0.714	77%	0.766	S	S	*	*				-160.8	160.7	119.1	39.9	-20.6	0	0	0	120.1
247	S	27.9	Very low	28.7	Very low	95 Å²	95	136 Å²	136	66%	0.664	77%	0.768	S	S	*	*			trans	64.4	118.8	144.7	52	0	0	0	0	122.5
248	K	31.5	Very low	28.5	Very low	199 Å²	199	138.3 Å²	138.3	87%	0.865	77%	0.768	S	S	*	*				81.3	149.2	77.8	-73.6	-179.4	-178.9	-175.3	0	114.3
249	Q	26.4	Very low	28.4	Very low	180 Å²	180	135.2 Å²	135.2	84%	0.841	77%	0.766	S	S	*	*			cis	-134.2	-159.1	11	-53	176.1	113.9	0	0	109.7
250	S	29.6	Very low	28.3	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	76%	0.764	S	S	*	*			cis	-166.4	159	-4.3	21.3	0	0	0	0	110.6
251	P	50.8	Low	28.2	Very low	117 Å²	117	132.3 Å²	132.3	76%	0.76	77%	0.768	S	S	*	*			trans	-125.5	175.6	-172.9	43.1	-31	0	0	0	117.2
252	L	24.7	Very low	27.7	Very low	164 Å²	164	134 Å²	134	86%	0.859	77%	0.766	S	S	*	*			trans	164.3	146.9	132.3	-91.8	168.8	0	0	0	116.7
253	S	23.3	Very low	27.6	Very low	106 Å²	106	134 Å²	134	74%	0.741	76%	0.759	S	S	*	*			trans	70.4	150.7	143.1	-176.5	0	0	0	0	122
254	S	24.8	Very low	26.9	Very low	89 Å²	89	137.3 Å²	137.3	62%	0.622	76%	0.755	S	S	*	*			cis	-172.1	166.2	-26.9	-70.4	0	0	0	0	111.6
255	F	22.8	Very low	26.9	Very low	203 Å²	203	140.6 Å²	140.6	89%	0.89	76%	0.755	S	S	*	*			trans	79.3	150.4	153.7	-81.1	-70.8	0	0	0	123
256	N	23.7	Very low	26.7	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	75%	0.752	S	S	*	*			trans	-95.3	171.2	176	-55.3	-39.3	0	0	0	111.4
257	L	23.1	Very low	25.8	Very low	147 Å²	147	141.2 Å²	141.2	77%	0.77	75%	0.752	S	S	*	*				147.2	138.3	103.7	-161.9	63.5	0	0	0	115.7
258	F	21.8	Very low	25.6	Very low	170 Å²	170	140.7 Å²	140.7	75%	0.746	75%	0.749	S	S	*	*			trans	72.8	110.9	154.6	-94.6	-140.5	0	0	0	123.8
259	C	20.9	Very low	25.3	Very low	102 Å²	102	138.2 Å²	138.2	69%	0.689	75%	0.745	S	S	*	*				52.8	113	105.7	-56.8	0	0	0	0	123.6
260	A	24.4	Very low	25.4	Very low	90 Å²	90	137.1 Å²	137.1	74%	0.744	74%	0.74	S	S	*	*				89.5	150.1	111.7	0	0	0	0	0	123.1
261	E	23.6	Very low	25.2	Very low	179 Å²	179	137.4 Å²	137.4	84%	0.836	73%	0.733	S	S	*	*			trans	67.8	151.1	163.8	-52.1	-158.9	151.1	0	0	118.1
262	E	24.8	Very low	23.9	Very low	155 Å²	155	140.2 Å²	140.2	72%	0.724	74%	0.741	S	S	*	*			cis	-154.6	158.7	-4.1	-138.1	-160.6	165.5	0	0	113
263	D	23.5	Very low	24.1	Very low	103 Å²	103	137 Å²	137	55%	0.551	73%	0.728	S	S	*	*			trans	63.2	155.1	140.2	-146.7	4	0	0	0	124.5
264	R	26.1	Very low	24.1	Very low	196 Å²	196	141 Å²	141	74%	0.74	73%	0.732	S	S	*	*			trans	86	90.1	152.5	-90.2	158.7	-130.6	-169.7	14.2	124.6
265	K	24	Very low	24.2	Very low	184 Å²	184	143.1 Å²	143.1	80%	0.8	74%	0.742	S	S	*	*				64.9	150.1	106.1	-123.2	179.5	-178.4	173.1	0	122.5
266	T	22.1	Very low	24.2	Very low	116 Å²	116	141.3 Å²	141.3	71%	0.712	74%	0.736	S	S	*	*			trans	69	143.3	156.2	54.3	0	0	0	0	117.9
267	T	22.7	Very low	25.1	Very low	118 Å²	118	139 Å²	139	72%	0.724	73%	0.729	S	S	*	*			cis	-165.6	153.7	-2.1	14.7	0	0	0	0	112.7
268	S	23.5	Very low	25.1	Very low	85 Å²	85	138.5 Å²	138.5	59%	0.594	73%	0.726	S	S	*	*			trans	59.4	131.7	137.1	71.6	0	0	0	0	123.7
269	D	24.7	Very low	25.2	Very low	147 Å²	147	139 Å²	139	79%	0.786	73%	0.731	S	S	*	*				67.7	154.3	129.5	-55.8	5.4	0	0	0	121.1
270	E	27.7	Very low	25.4	Very low	156 Å²	156	139.3 Å²	139.3	73%	0.729	74%	0.741	S	S	*	*			cis	-164.5	156.4	-28.2	-104.9	-131.3	143.9	0	0	111.1
271	N	26.5	Very low	25.5	Very low	112 Å²	112	143.9 Å²	143.9	60%	0.599	75%	0.747	S	S	*	*			trans	29.9	128.1	147.2	-71.1	-40.6	0	0	0	124.3	V273	N271-V273 HydrophobicContact CB-CG2 4.42Å
272	L	24.3	Very low	25.5	Very low	175 Å²	175	139.4 Å²	139.4	92%	0.916	74%	0.741	S	S	*	*			trans	-159.7	158.7	135.4	-148.1	70	0	0	0	112.1
273	V	28.1	Very low	25.4	Very low	98 Å²	98	141.1 Å²	141.1	59%	0.594	75%	0.749	S	S	*	*				-167.8	146.8	-79.6	139.5	0	0	0	0	110.3	N271	N271-V273 HydrophobicContact CB-CG2 4.42Å
274	K	23.7	Very low	25.4	Very low	189 Å²	189	142.2 Å²	142.2	82%	0.822	76%	0.759	S	S	*	*			trans	89.1	144.9	-179.3	-63.5	161.1	178.1	174.9	0	116.1
275	T	25.9	Very low	25.2	Very low	134 Å²	134	141.2 Å²	141.2	82%	0.822	76%	0.763	S	S	*	*			cis	-150.4	145.4	3.4	-7.2	0	0	0	0	113.9
276	E	23.4	Very low	25.3	Very low	164 Å²	164	137.1 Å²	137.1	77%	0.766	76%	0.757	S	S	*	*			trans	-74.8	178.8	160.3	-86.8	-77.4	135.5	0	0	112.6
277	P	41.7	Very low	25.7	Very low	100 Å²	100	140.7 Å²	140.7	65%	0.649	76%	0.763	S	S	*	*			cis	-140.3	-173.3	0.8	29	-3.7	0	0	0	117.6
278	L	23.4	Very low	25.8	Very low	135 Å²	135	141.5 Å²	141.5	71%	0.707	76%	0.762	S	S	*	*			trans	93.1	100.8	151.4	-58.4	-172.7	0	0	0	122.7
279	E	24.7	Very low	25.7	Very low	181 Å²	181	143.6 Å²	143.6	85%	0.846	77%	0.771	S	S	*	*				46.3	119.6	114.3	-62.7	176	-179.5	0	0	122.7
280	A	25.6	Very low	25.7	Very low	108 Å²	108	142.3 Å²	142.3	89%	0.893	77%	0.769	S	S	*	*				-172.5	154	124	0	0	0	0	0	112
281	E	24.9	Very low	25.8	Very low	186 Å²	186	141.5 Å²	141.5	87%	0.869	77%	0.77	S	S	*	*			trans	-98.9	157.4	-178.4	-80.2	-77.9	158	0	0	113.7
282	A	25.1	Very low	26.7	Very low	86 Å²	86	141.9 Å²	141.9	71%	0.711	78%	0.778	S	S	*	*			trans	41.3	124.8	157.2	0	0	0	0	0	122.1
283	E	22.4	Very low	26.9	Very low	191 Å²	191	136.3 Å²	136.3	89%	0.893	76%	0.763	S	S	*	*				-167.2	-166.6	111.7	-119.1	-176.1	-157.4	0	0	114.3
284	T	22.9	Very low	27	Very low	125 Å²	125	139.2 Å²	139.2	77%	0.767	78%	0.775	S	S	*	*			trans	-102.3	-177.4	-148.2	46.8	0	0	0	0	117.7
285	E	22.3	Very low	27.1	Very low	176 Å²	176	138.3 Å²	138.3	82%	0.822	77%	0.774	S	S	*	*			trans	-18.9	127.6	172.6	-65.5	-168.7	111.4	0	0	122.9
286	S	26.6	Very low	27.1	Very low	97 Å²	97	140.4 Å²	140.4	68%	0.678	78%	0.775	S	S	*	*				89	158.2	123.3	83.1	0	0	0	0	123.2
287	K	30.5	Very low	27	Very low	191 Å²	191	138 Å²	138	83%	0.83	78%	0.776	S	S	*	*			trans	70.5	148.5	168.3	-69.8	170.4	-179.1	169.4	0	115.3
288	L	23	Very low	26.2	Very low	135 Å²	135	138.2 Å²	138.2	71%	0.707	78%	0.778	S	S	*	*			cis	-155.7	150.8	38.5	-175.5	73.8	0	0	0	113.1
289	T	22.9	Very low	26.2	Very low	129 Å²	129	140.9 Å²	140.9	79%	0.791	79%	0.787	S	S	*	*			trans	163.5	131	137	39.7	0	0	0	0	109.8
290	T	24.5	Very low	26	Very low	120 Å²	120	136.7 Å²	136.7	74%	0.736	78%	0.778	S	S	*	*			cis	-156.2	155.7	-12.4	-46.8	0	0	0	0	109.8
291	N	28.5	Very low	25.8	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	77%	0.773	S	S	*	*			trans	-70.5	-174.8	177.3	-51.6	-3.6	0	0	0	113.8
292	P	47	Very low	25.7	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	77%	0.765	S	S	*	*			cis	-117.7	179.9	-17.3	17.4	8	0	0	0	111.9
293	G	28.2	Very low	25.7	Very low	58 Å²	58	139.9 Å²	139.9	60%	0.598	77%	0.772	S	S	*	*			cis	101.2	137.3	20.3	0	0	0	0	0	111.2
294	D	30	Very low	25.7	Very low	158 Å²	158	135.2 Å²	135.2	85%	0.845	77%	0.766	S	S	*	*			cis	-147.7	-148.8	0.2	-70.5	-68.7	0	0	0	108.2
295	E	25.1	Very low	25.8	Very low	171 Å²	171	137 Å²	137	80%	0.799	77%	0.765	S	S	*	*			cis	-163.6	121	10	-171.6	166.7	-149.1	0	0	113.3
296	Q	26	Very low	26	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	77%	0.765	S	S	*	*			trans	73.5	141.6	138.3	-157.8	177.2	76.5	0	0	126.1
297	S	22.7	Very low	25.9	Very low	113 Å²	113	134.3 Å²	134.3	79%	0.79	76%	0.764	S	S	*	*			trans	89	156.7	155.1	-144.3	0	0	0	0	121.5
298	C	23.7	Very low	25.7	Very low	104 Å²	104	133.6 Å²	133.6	70%	0.703	76%	0.763	S	S	*	*			trans	-133.3	150.8	-173.6	57	0	0	0	0	112
299	Q	23.1	Very low	25.8	Very low	192 Å²	192	133.7 Å²	133.7	90%	0.897	76%	0.764	S	S	*	*			trans	-172.9	-179.7	152.2	-114.5	156.7	86.7	0	0	114.6
300	S	21.6	Very low	25.9	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	76%	0.761	S	S	*	*			trans	-88.5	174.1	-169	45.8	0	0	0	0	115.6
301	H	21.3	Very low	26.1	Very low	172 Å²	172	134.9 Å²	134.9	80%	0.796	76%	0.76	S	S	*	*			trans	15.9	138.2	146.2	-64.2	-77.3	0	0	0	118.8
302	T	22	Very low	26	Very low	114 Å²	114	137.1 Å²	137.1	70%	0.699	77%	0.766	S	S	*	*			cis	-173.7	169.1	35.6	-13.2	0	0	0	0	113.3
303	L	24.6	Very low	25	Very low	161 Å²	161	135 Å²	135	84%	0.843	77%	0.766	S	S	*	*			trans	79.5	150.8	144.4	-80.3	166.7	0	0	0	122.8
304	A	23.9	Very low	25	Very low	93 Å²	93	141.3 Å²	141.3	77%	0.769	78%	0.78	S	S	*	*			trans	75.8	141.2	156	0	0	0	0	0	119.8
305	H	24.4	Very low	24.8	Very low	162 Å²	162	140.5 Å²	140.5	75%	0.75	78%	0.775	S	S	*	*			cis	-166.9	133.3	-20.8	-173.9	-81.8	0	0	0	110.3
306	D	25.9	Very low	24.9	Very low	153 Å²	153	136.7 Å²	136.7	82%	0.818	77%	0.768	S	S	*	*			trans	177.4	146.8	144.9	-94.4	-10.1	0	0	0	108.2
307	G	25.7	Very low	25	Very low	64 Å²	64	135.1 Å²	135.1	66%	0.66	77%	0.77	S	S	*	*			cis	116.5	121	14	0	0	0	0	0	109.2
308	Q	25.3	Very low	25.2	Very low	175 Å²	175	137.6 Å²	137.6	82%	0.818	78%	0.775	S	S	*	*			cis	-159	153.3	12.5	-176.8	173	3.3	0	0	111.6
309	L	26.1	Very low	25.4	Very low	137 Å²	137	136.5 Å²	136.5	72%	0.717	78%	0.781	S	S	*	*			trans	-4.3	157.2	157.2	-47.5	170.3	0	0	0	119.5
310	T	24.2	Very low	25.6	Very low	118 Å²	118	134.8 Å²	134.8	72%	0.724	78%	0.778	S	S	*	*			cis	-145.8	157.6	38.3	50.6	0	0	0	0	111.5
311	E	27.8	Very low	26.6	Very low	156 Å²	156	134.9 Å²	134.9	73%	0.729	78%	0.776	S	S	*	*				48.1	137.8	72.8	-76.7	172.5	-171.1	0	0	113.6
312	E	26.9	Very low	27	Very low	188 Å²	188	135.1 Å²	135.1	88%	0.879	78%	0.778	S	S	*	*			cis	-160	169.8	10.2	-143.5	-178.9	-163.6	0	0	110.1
313	G	26.8	Very low	27.4	Very low	75 Å²	75	138.4 Å²	138.4	77%	0.773	79%	0.785	S	S	*	*			trans	162.4	137.3	167.1	0	0	0	0	0	117.3
314	H	27.4	Very low	27.5	Very low	191 Å²	191	139.7 Å²	139.7	88%	0.884	79%	0.787	S	S	*	*			trans	-150.1	168.3	-177.4	-165.1	-83.3	0	0	0	111.4
315	D	25.2	Very low	27.8	Very low	140 Å²	140	144.5 Å²	144.5	75%	0.749	79%	0.794	S	S	*	*			trans	94.3	169	167.9	-152	17.3	0	0	0	118.4
316	S	28	Very low	28.1	Very low	92 Å²	92	145.4 Å²	145.4	64%	0.643	80%	0.798	S	S	*	*			trans	-129.6	160.6	-130.2	-37.1	0	0	0	0	115
317	T	27.5	Very low	28.2	Very low	144 Å²	144	147.5 Å²	147.5	88%	0.883	80%	0.803	S	S	*	*			trans	-165	155.3	149.9	-4.6	0	0	0	0	113.2
318	D	28.4	Very low	28.4	Very low	166 Å²	166	153 Å²	153	89%	0.888	81%	0.812	S	S	*	*			trans	-71.4	154.2	-174.2	-54.9	-86.7	0	0	0	115.8
319	G	26.7	Very low	28.9	Very low	81 Å²	81	153.7 Å²	153.7	84%	0.835	82%	0.815	S	S	*	*			trans	177.7	104.5	166.1	0	0	0	0	0	114.9
320	D	28.6	Very low	29.2	Very low	155 Å²	155	155.7 Å²	155.7	83%	0.829	82%	0.82	S	S	*	*			trans	-149	150.6	174.4	-173.9	59.4	0	0	0	107.1
321	P	42.4	Very low	29.5	Very low	95 Å²	95	157.6 Å²	157.6	62%	0.617	83%	0.826	S	S	*	*			cis	-125.4	171.5	6.3	30.1	-8.7	0	0	0	115.5
322	E	28.1	Very low	29.9	Very low	178 Å²	178	158.6 Å²	158.6	83%	0.832	83%	0.831	S	S	*	*				171.5	127.3	110.3	-91.3	-176.8	178.7	0	0	113.4
323	E	30.6	Very low	30.5	Very low	183 Å²	183	158.5 Å²	158.5	86%	0.855	83%	0.831	S	S	*	*			trans	-2.4	119.9	166.8	-57.4	-178.7	163.7	0	0	120.2
324	Q	28.4	Very low	31.2	Very low	188 Å²	188	160.2 Å²	160.2	88%	0.879	83%	0.826	S	S	*	*			trans	-141.9	135.8	138.2	-122.5	122.1	120.4	0	0	109.5
325	Q	29.1	Very low	32.2	Very low	194 Å²	194	158.4 Å²	158.4	91%	0.907	82%	0.817	S	S	*	*			trans	-93.7	109	175.5	-70.3	175	-26	0	0	108.8
326	E	30.3	Very low	33.1	Very low	181 Å²	181	159.4 Å²	159.4	85%	0.846	82%	0.818	S	S	*	*			trans	-110	127.8	158.9	-63.2	-165.6	143.6	0	0	107.2	E328	E326-E328 PolarHBondContact O-N 3.46Å
327	E	29.4	Very low	34.4	Very low	196 Å²	196	160.3 Å²	160.3	92%	0.916	82%	0.815	S	S	*	*			trans	-81	95.1	-179.4	-66.6	-179.1	132.3	0	0	108.5	E329	E327-E329 PolarHBondContact O-N 2.91Å
328	E	30.2	Very low	35.8	Very low	181 Å²	181	161.9 Å²	161.9	85%	0.846	81%	0.809	S	S	*	*			trans	-67.6	117.3	165.8	-68.6	-169.7	139.9	0	0	108.8	E326 E330	E326-E328 PolarHBondContact O-N 3.46Å; E328-E330 VanDerWaalsContact C-N 3.32Å; E328-E330 PolarHBondContact O-N 2.83Å
329	E	33.9	Very low	37.5	Very low	189 Å²	189	156 Å²	156	88%	0.883	78%	0.784	S	S	*	*			trans	-72.4	88.9	168.9	-68.6	-171.2	130.8	0	0	108.4	E327 D331	E327-E329 PolarHBondContact O-N 2.91Å; E329-D331 PolarHBondContact O-N 3.41Å
330	E	32.5	Very low	39.4	Very low	178 Å²	178	153.7 Å²	153.7	83%	0.832	75%	0.754	S	S	*	*			trans	-61.8	102.5	163.1	-78	-169	129	0	0	108.6	E328 E332	E328-E330 VanDerWaalsContact C-N 3.32Å; E328-E330 PolarHBondContact O-N 2.83Å; E330-E332 PolarHBondContact O-N 2.86Å
331	D	30.6	Very low	41.3	Very low	158 Å²	158	154.9 Å²	154.9	85%	0.845	76%	0.755	S	S	*	*			trans	-59.1	98.3	164.2	-91.1	-45.7	0	0	0	108.4	E329 E333	E329-D331 PolarHBondContact O-N 3.41Å; D331-E333 VanDerWaalsContact C-N 3.25Å; D331-E333 PolarHBondContact O-N 2.87Å
332	E	37.9	Very low	42.8	Very low	178 Å²	178	157.9 Å²	157.9	83%	0.832	76%	0.761	S	S	*	*			trans	-61	89.9	166.5	-79.9	-170.2	162.1	0	0	108.6	E330 V334	E330-E332 PolarHBondContact O-N 2.86Å; E332-V334 WeakPolarHBondContact O-CG2 3.27Å; E332-V334 PolarHBondContact O-N 3.05Å
333	E	38.5	Very low	45.4	Very low	186 Å²	186	152.6 Å²	152.6	87%	0.869	74%	0.736	S	S	*	*			trans	-59.7	99.9	172.9	-126.6	-170.5	172.3	0	0	108	D331 E335	D331-E333 VanDerWaalsContact C-N 3.25Å; D331-E333 PolarHBondContact O-N 2.87Å; E333-E335 VanDerWaalsContact C-N 3.28Å; E333-E335 PolarHBondContact O-N 3.33Å
334	V	40.6	Very low	47.9	Very low	111 Å²	111	147 Å²	147	67%	0.673	71%	0.714	S	S	*	*			trans	-69.7	88	-171.7	-177.4	0	0	0	0	109.3	E332 E336 K437	E332-V334 WeakPolarHBondContact O-CG2 3.27Å; E332-V334 PolarHBondContact O-N 3.05Å; V334-E336 PolarHBondContact O-N 3.32Å; V334-K437 HydrophobicContact CG1-CD 4.47Å
335	E	48.6	Very low	50.3	Low	152 Å²	152	147.3 Å²	147.3	71%	0.71	72%	0.715	S	S	*	*			trans	-51	112.8	-170.4	-162	-175.1	-147.2	0	0	110.9	E333 L337 K437	E333-E335 VanDerWaalsContact C-N 3.28Å; E333-E335 PolarHBondContact O-N 3.33Å; E335-L337 PolarHBondContact O-N 3.08Å; E335-K437 PolarHBondContact O-NZ 3.1Å
336	E	45.7	Very low	52.9	Low	161 Å²	161	139.4 Å²	139.4	75%	0.752	68%	0.679	S	S	*	*			trans	-73.7	117	-176.6	-174.6	167.9	-144.7	0	0	109.1	V334 K338	V334-E336 PolarHBondContact O-N 3.32Å; E336-K338 PolarHBondContact O-N 3.32Å
337	L	55.1	Low	55.3	Low	111 Å²	111	135 Å²	135	58%	0.581	66%	0.661	S	S	*	*			trans	-65.3	103	179	-71.5	169.7	0	0	0	109.4	E335 K437	E335-L337 PolarHBondContact O-N 3.08Å; L337-K437 HydrophobicContact CD1-CG 4.22Å
338	K	55.7	Low	57.8	Low	178 Å²	178	129.2 Å²	129.2	77%	0.774	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-59.4	147.8	169.5	-64.1	174.3	-175.9	169.4	0	109.4	E336	E336-K338 PolarHBondContact O-N 3.32Å
339	A	63.6	Low	60.3	Low	43 Å²	43	128.6 Å²	128.6	36%	0.355	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-58.3	142.1	172.2	0	0	0	0	0	110	E341 Y433	A339-E341 PolarHBondContact O-N 3.12Å; A339-Y433 HydrophobicContact CB-CD2 4.16Å; A339-Y433 HydrophobicContact CB-CG 4.23Å
340	P	68.5	Low	62.8	Low	31 Å²	31	125.4 Å²	125.4	20%	0.201	62%	0.623	C	S	.	*	P	Polyproline II helix	trans	-61.7	128	-176.4	24.4	-33.4	0	0	0	111	Q342 F426 Y433	P340-Q342 VanDerWaalsContact C-N 3.34Å; P340-F426 HydrophobicContact CB-CE2 4.33Å; P340-F426 HydrophobicContact CG-CD2 4.44Å; P340-F426 HydrophobicContact CG-CE2 4.41Å; P340-F426 WeakPolarHBondContact O-CE2 3.47Å; P340-Y433 HydrophobicContact CG-CD1 3.65Å; P340-Y433 HydrophobicContact CG-CE1 3.84Å; P340-Y433 HydrophobicContact CG-CG 4.19Å
341	E	68.4	Low	65.4	Low	181 Å²	181	118.2 Å²	118.2	85%	0.846	59%	0.59	S	S	*	*	S	Bend	trans	-82	-15.5	179.1	-61.8	-178.4	-176.1	0	0	112.5	A339	A339-E341 PolarHBondContact O-N 3.12Å
342	Q	73.1	Confident	68.1	Low	158 Å²	158	113.4 Å²	113.4	74%	0.738	57%	0.566	S	S	*	*	S	Bend	trans	-143.5	152.8	178.9	-170.1	169.4	22.2	0	0	110.5	P340 F426	P340-Q342 VanDerWaalsContact C-N 3.34Å; Q342-F426 VanDerWaalsContact C-CZ 3.41Å; Q342-F426 VanDerWaalsContact CA-CZ 3.47Å; Q342-F426 WeakPolarHBondContact O-CE2 3.22Å
343	E	82.9	Confident	70.1	Confident	67 Å²	67	111.1 Å²	111.1	31%	0.313	56%	0.556	S	S	.	*			trans	-65.1	131.8	172.2	-176.3	173.5	-120.4	0	0	110.6	W385 K389 F426	E343-W385 PolarHBondContact OE1-NE1 2.96Å; E343-K389 WeakPolarHBondContact OE1-CE 3.49Å; E343-K389 IonicContact OE1-NZ 3.2Å; E343-K389 PolarHBondContact OE1-NZ 3.44Å; E343-K389 IonicContact OE2-NZ 3.88Å; E343-K389 PolarHBondContact OE2-NZ 3.34Å; E343-F426 HydrophobicContact CB-CB 4.01Å; E343-F426 HydrophobicContact CB-CD1 3.71Å; E343-F426 HydrophobicContact CB-CD2 4.21Å; E343-F426 HydrophobicContact CB-CE1 4.25Å; E343-F426 HydrophobicContact CB-CG 3.69Å; E343-F426 HydrophobicContact CG-CB 4.02Å; E343-F426 HydrophobicContact CG-CG 4.26Å
344	V	82.9	Confident	72.2	Confident	64 Å²	64	107.9 Å²	107.9	39%	0.388	54%	0.544	S	S	.	.			trans	-94.2	108.5	-177.9	175.4	0	0	0	0	110.2	M346 I421 G422 A423	V344-M346 HydrophobicContact CG1-CG 4.36Å; V344-I421 WeakPolarHBondContact CG2-O 3.47Å; V344-G422 PolarHBondContact N-O 2.93Å; V344-G422 VanDerWaalsContact N-O 3.14Å; V344-A423 HydrophobicContact CB-CB 4.44Å; V344-A423 WeakPolarHBondContact O-CA 3.03Å; V344-A423 WeakPolarHBondContact O-CB 3.35Å
345	E	78.4	Confident	74.4	Confident	195 Å²	195	102.7 Å²	102.7	91%	0.911	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-76.4	123.1	168.9	-172.1	167.2	-157.8	0	0	109.7
346	M	84.2	Confident	76.2	Confident	29 Å²	29	98.3 Å²	98.3	14%	0.143	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-102	137.6	-178.8	-63	-172.1	78.8	0	0	111.6	V344 T348 E355 L382 Y417 L418 I421 A423	V344-M346 HydrophobicContact CG1-CG 4.36Å; M346-T348 PolarHBondContact O-N 2.92Å; M346-E355 VanDerWaalsContact CE-CD 3.43Å; M346-E355 HydrophobicContact CE-CG 3.91Å; M346-L382 HydrophobicContact CB-CD1 4.17Å; M346-L382 HydrophobicContact SD-CD1 4.35Å; M346-Y417 HydrophobicContact CE-CE1 4.5Å; M346-L418 HydrophobicContact CE-CD2 4.33Å; M346-L418 HydrophobicContact SD-CD2 3.32Å; M346-L418 WeakPolarHBondContact SD-CD2 3.13Å; M346-I421 HydrophobicContact CE-CD1 4.09Å; M346-I421 HydrophobicContact SD-CD1 3.77Å; M346-A423 HydrophobicContact CG-CB 3.94Å; M346-A423 HydrophobicContact SD-CB 3.83Å
347	D	80.1	Confident	78	Confident	87 Å²	87	96.2 Å²	96.2	47%	0.465	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-61.2	119.1	168.2	178.6	-1.8	0	0	0	110.1	E349 M350 R378	D347-E349 VanDerWaalsContact C-N 3.29Å; D347-E349 PolarHBondContact O-N 2.89Å; D347-E349 PolarHBondContact OD1-N 3.48Å; D347-M350 HydrophobicContact CB-CB 4.39Å; D347-M350 WeakPolarHBondContact OD2-CB 3.38Å; D347-R378 PolarHBondContact O-NH1 3.47Å; D347-R378 PolarHBondContact O-NH2 2.89Å
348	T	82.8	Confident	79.2	Confident	76 Å²	76	93.4 Å²	93.4	47%	0.466	47%	0.474	S	S	.	.	S	Bend	trans	-71.1	-18.2	-178.8	54	0	0	0	0	114.2	M346 R378 N379	M346-T348 PolarHBondContact O-N 2.92Å; T348-R378 PolarHBondContact O-NH2 2.94Å; T348-R378 VanDerWaalsContact O-NH2 3.08Å; T348-N379 PolarHBondContact O-ND2 3.4Å; T348-N379 PolarHBondContact O-OD1 2.86Å
349	E	81.6	Confident	80.7	Confident	168 Å²	168	85.1 Å²	85.1	79%	0.785	44%	0.438	S	S	*	.	S	Bend	trans	-99.9	-34.5	-176.4	-60.3	-167	173.8	0	0	113.2	D347	D347-E349 VanDerWaalsContact C-N 3.29Å; D347-E349 PolarHBondContact O-N 2.89Å; D347-E349 PolarHBondContact OD1-N 3.48Å
350	M	86.6	Confident	81.8	Confident	122 Å²	122	85.9 Å²	85.9	60%	0.601	44%	0.44	S	S	*	.			trans	-89.4	153	178.3	-162.8	172	-58.9	0	0	113.1	D347 R378	D347-M350 HydrophobicContact CB-CB 4.39Å; D347-M350 WeakPolarHBondContact OD2-CB 3.38Å; M350-R378 PolarHBondContact O-NH1 3.06Å; M350-R378 PolarHBondContact O-NH2 3.41Å
351	I	88	Confident	82.5	Confident	26 Å²	26	85.4 Å²	85.4	13%	0.133	44%	0.435	C	S	.	.			trans	-115.4	119	168.4	-51.4	173.8	0	0	0	107.7	E355 K356 F363 P371 Y374 L375	I351-E355 HydrophobicContact CG2-CB 3.82Å; I351-K356 HydrophobicContact CG2-CG 4.06Å; I351-F363 HydrophobicContact CD1-CE1 3.69Å; I351-F363 HydrophobicContact CD1-CZ 4.09Å; I351-F363 HydrophobicContact CG2-CE1 4Å; I351-F363 HydrophobicContact CG2-CZ 3.73Å; I351-P371 HydrophobicContact CD1-CB 3.92Å; I351-Y374 HydrophobicContact CD1-CD1 4.24Å; I351-Y374 HydrophobicContact CG2-CD1 4.45Å; I351-Y374 HydrophobicContact CG2-CE1 4.17Å; I351-L375 HydrophobicContact CD1-CD1 3.93Å; I351-L375 HydrophobicContact CD1-CD2 4.16Å; I351-L375 HydrophobicContact CD1-CG 3.73Å; I351-L375 HydrophobicContact CG1-CD1 4.06Å; I351-L375 HydrophobicContact CG1-CD2 3.59Å; I351-L375 HydrophobicContact CG1-CG 3.75Å
352	T	86.4	Confident	83.4	Confident	57 Å²	57	76.9 Å²	76.9	35%	0.35	40%	0.395	S	S	.	.			trans	-72.7	166	178.7	68.1	0	0	0	0	112.1	D354 E355 K356	T352-D354 VanDerWaalsContact C-N 3.31Å; T352-E355 PolarHBondContact N-OE1 2.85Å; T352-E355 WeakPolarHBondContact OG1-CG 3.32Å; T352-E355 PolarHBondContact OG1-N 2.63Å; T352-E355 PolarHBondContact OG1-OE1 2.87Å; T352-K356 WeakPolarHBondContact O-CG 3.3Å; T352-K356 PolarHBondContact O-N 3.11Å
353	E	80.3	Confident	84.2	Confident	131 Å²	131	72 Å²	72	61%	0.612	37%	0.371	S	S	*	.	H	α-helix	trans	-68.2	-32.2	172.7	-56.3	-50.1	138.7	0	0	111.8	E355 K356 Q357	E353-E355 VanDerWaalsContact C-N 3.31Å; E353-E355 PolarHBondContact O-N 3.13Å; E353-K356 WeakPolarHBondContact O-CB 3.23Å; E353-K356 PolarHBondContact O-N 2.94Å; E353-K356 VanDerWaalsContact O-N 3.12Å; E353-K356 IonicContact OE1-NZ 3.96Å; E353-K356 PolarHBondContact OE1-NZ 2.94Å; E353-K356 WeakPolarHBondContact OE2-CD 3.35Å; E353-K356 IonicContact OE2-NZ 2.73Å; E353-K356 PolarHBondContact OE2-NZ 3.28Å; E353-Q357 WeakPolarHBondContact O-CB 3.44Å; E353-Q357 PolarHBondContact O-N 2.94Å
354	D	82.1	Confident	84.2	Confident	118 Å²	118	73.4 Å²	73.4	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-62.6	-37.6	176.6	-57.1	-52.4	0	0	0	112.3	T352 K356 Q357 A358	T352-D354 VanDerWaalsContact C-N 3.31Å; D354-K356 VanDerWaalsContact C-N 3.34Å; D354-Q357 PolarHBondContact O-N 3.31Å; D354-A358 VanDerWaalsContact O-CB 3.25Å; D354-A358 WeakPolarHBondContact O-CB 3.24Å; D354-A358 PolarHBondContact O-N 2.95Å
355	E	87.4	Confident	83.9	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.009	39%	0.394	C	S	.	.	H	α-helix	trans	-64	-39.4	173.7	-75.3	176.3	-92	0	0	112.3	M346 I351 T352 E353 I359 Y374 R378 Y417	M346-E355 VanDerWaalsContact CE-CD 3.43Å; M346-E355 HydrophobicContact CE-CG 3.91Å; I351-E355 HydrophobicContact CG2-CB 3.82Å; T352-E355 PolarHBondContact N-OE1 2.85Å; T352-E355 WeakPolarHBondContact OG1-CG 3.32Å; T352-E355 PolarHBondContact OG1-N 2.63Å; T352-E355 PolarHBondContact OG1-OE1 2.87Å; E353-E355 VanDerWaalsContact C-N 3.31Å; E353-E355 PolarHBondContact O-N 3.13Å; E355-I359 PolarHBondContact O-N 3.13Å; E355-Y374 HydrophobicContact CB-CE1 4.37Å; E355-Y374 WeakPolarHBondContact OE2-CE1 3.41Å; E355-Y374 PolarHBondContact OE2-OH 3.39Å; E355-R378 VanDerWaalsContact CD-NH1 3.27Å; E355-R378 IonicContact OE1-NH1 3.51Å; E355-R378 PolarHBondContact OE1-NH1 3.31Å; E355-R378 VanDerWaalsContact OE1-NH1 3.07Å; E355-R378 WeakPolarHBondContact OE2-CD 3.4Å; E355-R378 IonicContact OE2-CZ 3.52Å; E355-R378 IonicContact OE2-NE 3.03Å; E355-R378 IonicContact OE2-NH1 3.75Å; E355-R378 PolarHBondContact OE2-NH1 3.25Å; E355-Y417 HydrophobicContact CG-CE1 3.75Å; E355-Y417 WeakPolarHBondContact CG-OH 3.29Å
356	K	85.9	Confident	83.9	Confident	60 Å²	60	70.6 Å²	70.6	26%	0.261	37%	0.374	S	S	.	.	H	α-helix	trans	-70.1	-42.4	176.9	-60.7	175	-149.2	164.3	0	110.9	I351 T352 E353 D354 I359 P360 F363	I351-K356 HydrophobicContact CG2-CG 4.06Å; T352-K356 WeakPolarHBondContact O-CG 3.3Å; T352-K356 PolarHBondContact O-N 3.11Å; E353-K356 WeakPolarHBondContact O-CB 3.23Å; E353-K356 PolarHBondContact O-N 2.94Å; E353-K356 VanDerWaalsContact O-N 3.12Å; E353-K356 IonicContact OE1-NZ 3.96Å; E353-K356 PolarHBondContact OE1-NZ 2.94Å; E353-K356 WeakPolarHBondContact OE2-CD 3.35Å; E353-K356 IonicContact OE2-NZ 2.73Å; E353-K356 PolarHBondContact OE2-NZ 3.28Å; D354-K356 VanDerWaalsContact C-N 3.34Å; K356-I359 CarbonylContact O-C 3.35Å; K356-I359 PolarHBondContact O-N 3.48Å; K356-P360 WeakPolarHBondContact O-CA 3.45Å; K356-P360 WeakPolarHBondContact O-CB 3.47Å; K356-P360 WeakPolarHBondContact O-CD 3.25Å; K356-F363 HydrophobicContact CB-CD2 3.93Å; K356-F363 HydrophobicContact CB-CE2 4.2Å; K356-F363 HydrophobicContact CB-CG 4.24Å; K356-F363 HydrophobicContact CD-CD1 4.36Å; K356-F363 HydrophobicContact CD-CG 4.5Å; K356-F363 HydrophobicContact CG-CD1 3.94Å; K356-F363 HydrophobicContact CG-CD2 3.85Å; K356-F363 HydrophobicContact CG-CE1 3.98Å; K356-F363 HydrophobicContact CG-CE2 3.9Å; K356-F363 HydrophobicContact CG-CG 3.88Å; K356-F363 HydrophobicContact CG-CZ 3.97Å
357	Q	83.3	Confident	83.5	Confident	116 Å²	116	75.3 Å²	75.3	54%	0.542	41%	0.407	S	S	.	.	H	α-helix	trans	-67.1	-36.6	178.1	-168	62.1	15.9	0	0	111.9	E353 D354 D440	E353-Q357 WeakPolarHBondContact O-CB 3.44Å; E353-Q357 PolarHBondContact O-N 2.94Å; D354-Q357 PolarHBondContact O-N 3.31Å; Q357-D440 PolarHBondContact NE2-OD2 3.45Å
358	A	81.6	Confident	83.4	Confident	52 Å²	52	75.1 Å²	75.1	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-73.4	-33	176.1	0	0	0	0	0	113.4	D354 Y417	D354-A358 VanDerWaalsContact O-CB 3.25Å; D354-A358 WeakPolarHBondContact O-CB 3.24Å; D354-A358 PolarHBondContact O-N 2.95Å; A358-Y417 HydrophobicContact CB-CD2 3.38Å; A358-Y417 HydrophobicContact CB-CE2 3.4Å; A358-Y417 VanDerWaalsContact CB-CE2 3.4Å; A358-Y417 HydrophobicContact CB-CG 4.25Å
359	I	87.6	Confident	83.6	Confident	5 Å²	5	73.1 Å²	73.1	3%	0.026	40%	0.397	C	S	.	.	S	Bend	trans	-136.2	58.8	-173.3	-43.4	-172.5	0	0	0	111.6	E355 K356 E361 F362 F363 Y374 I414 Y417	E355-I359 PolarHBondContact O-N 3.13Å; K356-I359 CarbonylContact O-C 3.35Å; K356-I359 PolarHBondContact O-N 3.48Å; I359-E361 HydrophobicContact CG2-CG 4.11Å; I359-E361 PolarHBondContact O-N 2.68Å; I359-E361 VanDerWaalsContact O-N 3.09Å; I359-F362 HydrophobicContact CG2-CD2 3.78Å; I359-F362 HydrophobicContact CG2-CE2 4.03Å; I359-F363 WeakPolarHBondContact O-CD2 3.39Å; I359-F363 WeakPolarHBondContact O-CE2 3.48Å; I359-Y374 HydrophobicContact CB-CE2 3.95Å; I359-Y374 HydrophobicContact CD1-CE2 3.88Å; I359-Y374 HydrophobicContact CG1-CE2 4.32Å; I359-Y374 HydrophobicContact CG2-CD2 4.45Å; I359-Y374 HydrophobicContact CG2-CE2 4.17Å; I359-I414 HydrophobicContact CD1-CB 4.18Å; I359-I414 HydrophobicContact CD1-CG1 3.67Å; I359-I414 HydrophobicContact CG2-CG1 4.42Å; I359-Y417 HydrophobicContact CD1-CD1 4.31Å; I359-Y417 HydrophobicContact CD1-CG 4.11Å
360	P	84.8	Confident	84	Confident	59 Å²	59	67 Å²	67	38%	0.383	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-63.7	-23.6	-169.1	24	-35.4	0	0	0	114.2	K356 F362 F363 E364	K356-P360 WeakPolarHBondContact O-CA 3.45Å; K356-P360 WeakPolarHBondContact O-CB 3.47Å; K356-P360 WeakPolarHBondContact O-CD 3.25Å; P360-F362 PolarHBondContact O-N 3.34Å; P360-F363 CarbonylContact O-C 3.52Å; P360-F363 WeakPolarHBondContact O-CA 3.15Å; P360-F363 WeakPolarHBondContact O-CB 3.27Å; P360-F363 PolarHBondContact O-N 3.29Å; P360-E364 WeakPolarHBondContact O-CG 3.4Å; P360-E364 PolarHBondContact O-N 3.29Å
361	E	83.9	Confident	84.2	Confident	21 Å²	21	63.4 Å²	63.4	10%	0.098	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-65	-6.5	-176.2	56.1	167.9	-135.8	0	0	116.4	I359 E364 K369 C410 R413	I359-E361 HydrophobicContact CG2-CG 4.11Å; I359-E361 PolarHBondContact O-N 2.68Å; I359-E361 VanDerWaalsContact O-N 3.09Å; E361-E364 WeakPolarHBondContact CA-OE1 3.41Å; E361-E364 PolarHBondContact N-OE1 2.74Å; E361-K369 HydrophobicContact CB-CD 4.25Å; E361-K369 HydrophobicContact CG-CD 4.37Å; E361-K369 WeakPolarHBondContact O-CB 3.42Å; E361-K369 VanDerWaalsContact O-CD 3.25Å; E361-K369 WeakPolarHBondContact O-CD 3.37Å; E361-K369 IonicContact OE1-NZ 3.1Å; E361-K369 PolarHBondContact OE1-NZ 3.03Å; E361-K369 IonicContact OE2-NZ 2.72Å; E361-K369 PolarHBondContact OE2-NZ 2.91Å; E361-C410 PolarHBondContact OE1-SG 3.37Å; E361-R413 VanDerWaalsContact CD-CZ 3.43Å; E361-R413 VanDerWaalsContact CD-NH1 3.3Å; E361-R413 IonicContact OE1-CZ 2.65Å; E361-R413 IonicContact OE1-NH1 2.73Å; E361-R413 IonicContact OE1-NH2 2.61Å; E361-R413 PolarHBondContact OE1-NH2 2.86Å; E361-R413 IonicContact OE2-CZ 3.61Å; E361-R413 IonicContact OE2-NH1 2.76Å; E361-R413 PolarHBondContact OE2-NH1 3.39Å; E361-R413 IonicContact OE2-NH2 3.66Å; E361-R413 PolarHBondContact OE2-NH2 2.97Å
362	F	87.4	Confident	84.3	Confident	2 Å²	2	68 Å²	68	1%	0.009	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-98.3	-4.3	168	-71.3	-98.1	0	0	0	113.5	I359 P360 K369 T370 P371 R373 Y374 I377 C410 I414	I359-F362 HydrophobicContact CG2-CD2 3.78Å; I359-F362 HydrophobicContact CG2-CE2 4.03Å; P360-F362 PolarHBondContact O-N 3.34Å; F362-K369 CarbonylContact C-O 3.35Å; F362-K369 WeakPolarHBondContact CA-O 3.48Å; F362-K369 HydrophobicContact CD1-CB 3.81Å; F362-K369 HydrophobicContact CD1-CG 4.4Å; F362-K369 HydrophobicContact CE1-CB 4.16Å; F362-K369 HydrophobicContact CE1-CG 4.27Å; F362-K369 HydrophobicContact CE2-CD 4.44Å; F362-K369 HydrophobicContact CG-CB 4.13Å; F362-K369 HydrophobicContact CZ-CD 4.49Å; F362-T370 CarbonylContact O-C 3.23Å; F362-P371 WeakPolarHBondContact O-CD 3.29Å; F362-R373 HydrophobicContact CE1-CG 4.15Å; F362-Y374 HydrophobicContact CB-CD2 4.24Å; F362-Y374 HydrophobicContact CB-CG 4.37Å; F362-Y374 AromaticContact CD2-CD2 3.96Å; F362-Y374 HydrophobicContact CD2-CD2 3.96Å; F362-Y374 HydrophobicContact CE2-CD2 4.47Å; F362-Y374 HydrophobicContact CG-CD2 4.04Å; F362-Y374 HydrophobicContact CG-CG 4.4Å; F362-I377 HydrophobicContact CE1-CD1 4.14Å; F362-I377 HydrophobicContact CZ-CD1 4.1Å; F362-C410 HydrophobicContact CE2-CB 4.12Å; F362-C410 HydrophobicContact CZ-CB 3.99Å; F362-I414 HydrophobicContact CE2-CD1 3.96Å; F362-I414 HydrophobicContact CZ-CD1 3.93Å
363	F	89	Confident	84.4	Confident	54 Å²	54	69.2 Å²	69.2	24%	0.237	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-18.2	-175.6	-51.9	-73	0	0	0	112.1	I351 K356 I359 P360 G365 P371 Y374	I351-F363 HydrophobicContact CD1-CE1 3.69Å; I351-F363 HydrophobicContact CD1-CZ 4.09Å; I351-F363 HydrophobicContact CG2-CE1 4Å; I351-F363 HydrophobicContact CG2-CZ 3.73Å; K356-F363 HydrophobicContact CB-CD2 3.93Å; K356-F363 HydrophobicContact CB-CE2 4.2Å; K356-F363 HydrophobicContact CB-CG 4.24Å; K356-F363 HydrophobicContact CD-CD1 4.36Å; K356-F363 HydrophobicContact CD-CG 4.5Å; K356-F363 HydrophobicContact CG-CD1 3.94Å; K356-F363 HydrophobicContact CG-CD2 3.85Å; K356-F363 HydrophobicContact CG-CE1 3.98Å; K356-F363 HydrophobicContact CG-CE2 3.9Å; K356-F363 HydrophobicContact CG-CG 3.88Å; K356-F363 HydrophobicContact CG-CZ 3.97Å; I359-F363 WeakPolarHBondContact O-CD2 3.39Å; I359-F363 WeakPolarHBondContact O-CE2 3.48Å; P360-F363 CarbonylContact O-C 3.52Å; P360-F363 WeakPolarHBondContact O-CA 3.15Å; P360-F363 WeakPolarHBondContact O-CB 3.27Å; P360-F363 PolarHBondContact O-N 3.29Å; F363-G365 PolarHBondContact O-N 2.83Å; F363-P371 HydrophobicContact CD1-CB 4.26Å; F363-P371 HydrophobicContact CD1-CG 3.93Å; F363-P371 HydrophobicContact CE1-CB 3.91Å; F363-P371 HydrophobicContact CE1-CG 4.1Å; F363-Y374 HydrophobicContact CE2-CD2 4.34Å; F363-Y374 HydrophobicContact CE2-CG 4.4Å; F363-Y374 AromaticContact CZ-CD1 3.87Å; F363-Y374 HydrophobicContact CZ-CD1 3.87Å; F363-Y374 HydrophobicContact CZ-CD2 4.26Å; F363-Y374 HydrophobicContact CZ-CE1 4.29Å; F363-Y374 AromaticContact CZ-CG 3.88Å; F363-Y374 HydrophobicContact CZ-CG 3.88Å
364	E	84.7	Confident	85	Confident	98 Å²	98	63 Å²	63	46%	0.458	35%	0.347	S	S	.	.	S	Bend	trans	-59.3	10.2	168.4	-72.8	170.4	-143.5	0	0	115.7	P360 E361 R366	P360-E364 WeakPolarHBondContact O-CG 3.4Å; P360-E364 PolarHBondContact O-N 3.29Å; E361-E364 WeakPolarHBondContact CA-OE1 3.41Å; E361-E364 PolarHBondContact N-OE1 2.74Å; E364-R366 HydrophobicContact CB-CG 4.28Å; E364-R366 PolarHBondContact O-N 3.49Å; E364-R366 IonicContact OE2-CZ 3.99Å; E364-R366 IonicContact OE2-NE 3.75Å; E364-R366 PolarHBondContact OE2-NE 2.87Å; E364-R366 IonicContact OE2-NH2 3.94Å; E364-R366 PolarHBondContact OE2-NH2 2.78Å
365	G	75.5	Confident	85.5	Confident	71 Å²	71	59.1 Å²	59.1	73%	0.732	33%	0.326	S	S	*	.			trans	70.3	21	175.6	0	0	0	0	0	115.9	F363	F363-G365 PolarHBondContact O-N 2.83Å
366	R	79.8	Confident	85.7	Confident	129 Å²	129	65.5 Å²	65.5	49%	0.487	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-79.6	128.6	-178.3	-60.1	178.7	-175	-113.6	6.9	110.9	E364 S368 K369	E364-R366 HydrophobicContact CB-CG 4.28Å; E364-R366 PolarHBondContact O-N 3.49Å; E364-R366 IonicContact OE2-CZ 3.99Å; E364-R366 IonicContact OE2-NE 3.75Å; E364-R366 PolarHBondContact OE2-NE 2.87Å; E364-R366 IonicContact OE2-NH2 3.94Å; E364-R366 PolarHBondContact OE2-NH2 2.78Å; R366-S368 PolarHBondContact O-N 2.93Å; R366-K369 HydrophobicContact CB-CB 4.39Å; R366-K369 CarbonylContact O-C 3.6Å; R366-K369 VanDerWaalsContact O-C 3.23Å; R366-K369 PolarHBondContact O-N 2.85Å
367	P	74.1	Confident	86	Confident	128 Å²	128	62.7 Å²	62.7	83%	0.831	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.6	-175	24.6	-34.7	0	0	0	114.4
368	S	78.9	Confident	86.5	Confident	83 Å²	83	57.2 Å²	57.2	58%	0.58	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-8	175.2	54.9	0	0	0	0	114.5	R366 R373	R366-S368 PolarHBondContact O-N 2.93Å; S368-R373 VanDerWaalsContact O-CD 3.24Å; S368-R373 WeakPolarHBondContact O-CD 3.35Å; S368-R373 PolarHBondContact O-NE 2.94Å
369	K	87	Confident	87.1	Confident	33 Å²	33	56.9 Å²	56.9	14%	0.143	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-143.1	93	-178.6	-64.6	-171.3	-177	-173.7	0	110.3	E361 F362 R366 C410	E361-K369 HydrophobicContact CB-CD 4.25Å; E361-K369 HydrophobicContact CG-CD 4.37Å; E361-K369 WeakPolarHBondContact O-CB 3.42Å; E361-K369 VanDerWaalsContact O-CD 3.25Å; E361-K369 WeakPolarHBondContact O-CD 3.37Å; E361-K369 IonicContact OE1-NZ 3.1Å; E361-K369 PolarHBondContact OE1-NZ 3.03Å; E361-K369 IonicContact OE2-NZ 2.72Å; E361-K369 PolarHBondContact OE2-NZ 2.91Å; F362-K369 CarbonylContact C-O 3.35Å; F362-K369 WeakPolarHBondContact CA-O 3.48Å; F362-K369 HydrophobicContact CD1-CB 3.81Å; F362-K369 HydrophobicContact CD1-CG 4.4Å; F362-K369 HydrophobicContact CE1-CB 4.16Å; F362-K369 HydrophobicContact CE1-CG 4.27Å; F362-K369 HydrophobicContact CE2-CD 4.44Å; F362-K369 HydrophobicContact CG-CB 4.13Å; F362-K369 HydrophobicContact CZ-CD 4.49Å; R366-K369 HydrophobicContact CB-CB 4.39Å; R366-K369 CarbonylContact O-C 3.6Å; R366-K369 VanDerWaalsContact O-C 3.23Å; R366-K369 PolarHBondContact O-N 2.85Å; K369-C410 PolarHBondContact NZ-SG 2.8Å
370	T	89.4	Confident	87.4	Confident	41 Å²	41	59.6 Å²	59.6	25%	0.252	32%	0.318	S	S	.	.			trans	-113.5	162.6	-176	69.1	0	0	0	0	111.7	F362 E372 R373 Y374	F362-T370 CarbonylContact O-C 3.23Å; T370-E372 VanDerWaalsContact C-N 3.29Å; T370-E372 WeakPolarHBondContact CB-OE2 3.34Å; T370-E372 PolarHBondContact O-N 2.94Å; T370-E372 PolarHBondContact OG1-OE2 2.93Å; T370-R373 WeakPolarHBondContact O-CB 3.4Å; T370-R373 PolarHBondContact O-N 2.92Å; T370-R373 VanDerWaalsContact O-N 3.09Å; T370-Y374 PolarHBondContact O-N 3.38Å
371	P	90.4	Very high	87.8	Confident	46 Å²	46	56.8 Å²	56.8	30%	0.299	30%	0.299	S	S	.	.	H	α-helix	trans	-58.1	-36.2	-179.5	-27.5	37.5	0	0	0	114	I351 F362 F363 R373 Y374 L375	I351-P371 HydrophobicContact CD1-CB 3.92Å; F362-P371 WeakPolarHBondContact O-CD 3.29Å; F363-P371 HydrophobicContact CD1-CB 4.26Å; F363-P371 HydrophobicContact CD1-CG 3.93Å; F363-P371 HydrophobicContact CE1-CB 3.91Å; F363-P371 HydrophobicContact CE1-CG 4.1Å; P371-R373 VanDerWaalsContact C-N 3.32Å; P371-R373 PolarHBondContact O-N 3.41Å; P371-Y374 WeakPolarHBondContact O-CB 3.35Å; P371-Y374 PolarHBondContact O-N 3.31Å; P371-L375 PolarHBondContact O-N 3.29Å
372	E	90	Very high	88.3	Confident	121 Å²	121	57 Å²	57	57%	0.565	30%	0.301	S	S	*	.	H	α-helix	trans	-70.6	-33.3	179.5	-40.1	70.1	-147.1	0	0	110.7	T370 K376	T370-E372 VanDerWaalsContact C-N 3.29Å; T370-E372 WeakPolarHBondContact CB-OE2 3.34Å; T370-E372 PolarHBondContact O-N 2.94Å; T370-E372 PolarHBondContact OG1-OE2 2.93Å; E372-K376 VanDerWaalsContact O-CB 3.31Å; E372-K376 WeakPolarHBondContact O-CB 3.38Å; E372-K376 PolarHBondContact O-N 2.96Å
373	R	89.7	Confident	88.6	Confident	83 Å²	83	59.7 Å²	59.7	31%	0.313	32%	0.315	S	S	.	.	H	α-helix	trans	-70.6	-35.6	173.6	-175.3	-178.9	-72.3	-86.4	3.9	111.4	F362 S368 T370 P371 I377 N404 C405	F362-R373 HydrophobicContact CE1-CG 4.15Å; S368-R373 VanDerWaalsContact O-CD 3.24Å; S368-R373 WeakPolarHBondContact O-CD 3.35Å; S368-R373 PolarHBondContact O-NE 2.94Å; T370-R373 WeakPolarHBondContact O-CB 3.4Å; T370-R373 PolarHBondContact O-N 2.92Å; T370-R373 VanDerWaalsContact O-N 3.09Å; P371-R373 VanDerWaalsContact C-N 3.32Å; P371-R373 PolarHBondContact O-N 3.41Å; R373-I377 HydrophobicContact CG-CD1 4.49Å; R373-I377 WeakPolarHBondContact O-CG1 3.39Å; R373-I377 PolarHBondContact O-N 3.01Å; R373-N404 PolarHBondContact NH1-O 3.41Å; R373-C405 WeakPolarHBondContact CD-O 3.49Å; R373-C405 WeakPolarHBondContact CG-O 3.4Å; R373-C405 VanDerWaalsContact NH1-C 3.32Å; R373-C405 PolarHBondContact NH1-O 3.17Å
374	Y	92.2	Very high	88.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.2	-55.9	171.1	175.4	-91.1	0	0	0	111.1	I351 E355 I359 F362 F363 T370 P371 K376 I377 R378 I414	I351-Y374 HydrophobicContact CD1-CD1 4.24Å; I351-Y374 HydrophobicContact CG2-CD1 4.45Å; I351-Y374 HydrophobicContact CG2-CE1 4.17Å; E355-Y374 HydrophobicContact CB-CE1 4.37Å; E355-Y374 WeakPolarHBondContact OE2-CE1 3.41Å; E355-Y374 PolarHBondContact OE2-OH 3.39Å; I359-Y374 HydrophobicContact CB-CE2 3.95Å; I359-Y374 HydrophobicContact CD1-CE2 3.88Å; I359-Y374 HydrophobicContact CG1-CE2 4.32Å; I359-Y374 HydrophobicContact CG2-CD2 4.45Å; I359-Y374 HydrophobicContact CG2-CE2 4.17Å; F362-Y374 HydrophobicContact CB-CD2 4.24Å; F362-Y374 HydrophobicContact CB-CG 4.37Å; F362-Y374 AromaticContact CD2-CD2 3.96Å; F362-Y374 HydrophobicContact CD2-CD2 3.96Å; F362-Y374 HydrophobicContact CE2-CD2 4.47Å; F362-Y374 HydrophobicContact CG-CD2 4.04Å; F362-Y374 HydrophobicContact CG-CG 4.4Å; F363-Y374 HydrophobicContact CE2-CD2 4.34Å; F363-Y374 HydrophobicContact CE2-CG 4.4Å; F363-Y374 AromaticContact CZ-CD1 3.87Å; F363-Y374 HydrophobicContact CZ-CD1 3.87Å; F363-Y374 HydrophobicContact CZ-CD2 4.26Å; F363-Y374 HydrophobicContact CZ-CE1 4.29Å; F363-Y374 AromaticContact CZ-CG 3.88Å; F363-Y374 HydrophobicContact CZ-CG 3.88Å; T370-Y374 PolarHBondContact O-N 3.38Å; P371-Y374 WeakPolarHBondContact O-CB 3.35Å; P371-Y374 PolarHBondContact O-N 3.31Å; Y374-K376 VanDerWaalsContact C-N 3.28Å; Y374-K376 PolarHBondContact O-N 2.85Å; Y374-I377 PolarHBondContact O-N 2.81Å; Y374-R378 HydrophobicContact CE1-CB 4.31Å; Y374-R378 HydrophobicContact CE1-CG 4.49Å; Y374-R378 WeakPolarHBondContact O-CB 3.4Å; Y374-R378 PolarHBondContact O-N 2.83Å; Y374-I414 HydrophobicContact CD2-CD1 3.84Å; Y374-I414 HydrophobicContact CD2-CG1 4.12Å; Y374-I414 HydrophobicContact CE2-CD1 4.13Å; Y374-I414 HydrophobicContact CE2-CG1 3.9Å
375	L	92.4	Very high	89.2	Confident	37 Å²	37	55.2 Å²	55.2	19%	0.194	30%	0.295	C	S	.	.	H	α-helix	trans	-51.7	-46	176.6	-78.7	169.6	0	0	0	111.9	I351 P371 I377 R378 N379	I351-L375 HydrophobicContact CD1-CD1 3.93Å; I351-L375 HydrophobicContact CD1-CD2 4.16Å; I351-L375 HydrophobicContact CD1-CG 3.73Å; I351-L375 HydrophobicContact CG1-CD1 4.06Å; I351-L375 HydrophobicContact CG1-CD2 3.59Å; I351-L375 HydrophobicContact CG1-CG 3.75Å; P371-L375 PolarHBondContact O-N 3.29Å; L375-I377 VanDerWaalsContact C-N 3.3Å; L375-I377 PolarHBondContact O-N 3.46Å; L375-R378 PolarHBondContact O-N 3.28Å; L375-N379 VanDerWaalsContact O-CB 3.29Å; L375-N379 WeakPolarHBondContact O-CB 2.94Å; L375-N379 PolarHBondContact O-N 2.67Å; L375-N379 PolarHBondContact O-OD1 3.5Å
376	K	91.3	Very high	89.9	Confident	137 Å²	137	58.8 Å²	58.8	60%	0.596	30%	0.296	S	S	*	.	H	α-helix	trans	-61.2	-34.2	178.4	-174	172.2	-176.7	174.6	0	113.6	E372 Y374 Y380	E372-K376 VanDerWaalsContact O-CB 3.31Å; E372-K376 WeakPolarHBondContact O-CB 3.38Å; E372-K376 PolarHBondContact O-N 2.96Å; Y374-K376 VanDerWaalsContact C-N 3.28Å; Y374-K376 PolarHBondContact O-N 2.85Å; K376-Y380 VanDerWaalsContact O-CB 3.31Å; K376-Y380 WeakPolarHBondContact O-CB 3.5Å
377	I	92.9	Very high	90.5	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-76.7	-48	174.8	-65.1	163	0	0	0	110.4	F362 R373 Y374 L375 Y380 I381 L402 C405 I411 I414	F362-I377 HydrophobicContact CE1-CD1 4.14Å; F362-I377 HydrophobicContact CZ-CD1 4.1Å; R373-I377 HydrophobicContact CG-CD1 4.49Å; R373-I377 WeakPolarHBondContact O-CG1 3.39Å; R373-I377 PolarHBondContact O-N 3.01Å; Y374-I377 PolarHBondContact O-N 2.81Å; L375-I377 VanDerWaalsContact C-N 3.3Å; L375-I377 PolarHBondContact O-N 3.46Å; I377-Y380 PolarHBondContact O-N 2.96Å; I377-I381 HydrophobicContact CG2-CD1 3.76Å; I377-I381 WeakPolarHBondContact O-CG1 3.18Å; I377-I381 PolarHBondContact O-N 2.98Å; I377-I381 VanDerWaalsContact O-N 3.11Å; I377-L402 HydrophobicContact CB-CD2 4.48Å; I377-L402 HydrophobicContact CG1-CD2 4.2Å; I377-L402 HydrophobicContact CG2-CD1 3.94Å; I377-C405 HydrophobicContact CG1-CB 4.08Å; I377-I411 HydrophobicContact CD1-CG1 4.2Å; I377-I411 HydrophobicContact CG1-CG1 4.5Å; I377-I411 HydrophobicContact CG2-CG1 4.24Å; I377-I411 HydrophobicContact CG2-CG2 4.48Å; I377-I414 HydrophobicContact CB-CD1 3.8Å; I377-I414 HydrophobicContact CD1-CD1 3.94Å; I377-I414 HydrophobicContact CG2-CB 4.14Å; I377-I414 HydrophobicContact CG2-CD1 3.54Å; I377-I414 HydrophobicContact CG2-CG1 4.43Å; I377-I414 HydrophobicContact CG2-CG2 4.08Å
378	R	93.6	Very high	91.1	Very high	1 Å²	1	54.9 Å²	54.9	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-56.5	-57.8	-179.3	-173	-166.4	70.1	166.3	4.6	111.5	D347 T348 M350 E355 Y374 L375 Y380 I381 L382 I414 L418	D347-R378 PolarHBondContact O-NH1 3.47Å; D347-R378 PolarHBondContact O-NH2 2.89Å; T348-R378 PolarHBondContact O-NH2 2.94Å; T348-R378 VanDerWaalsContact O-NH2 3.08Å; M350-R378 PolarHBondContact O-NH1 3.06Å; M350-R378 PolarHBondContact O-NH2 3.41Å; E355-R378 VanDerWaalsContact CD-NH1 3.27Å; E355-R378 IonicContact OE1-NH1 3.51Å; E355-R378 PolarHBondContact OE1-NH1 3.31Å; E355-R378 VanDerWaalsContact OE1-NH1 3.07Å; E355-R378 WeakPolarHBondContact OE2-CD 3.4Å; E355-R378 IonicContact OE2-CZ 3.52Å; E355-R378 IonicContact OE2-NE 3.03Å; E355-R378 IonicContact OE2-NH1 3.75Å; E355-R378 PolarHBondContact OE2-NH1 3.25Å; Y374-R378 HydrophobicContact CE1-CB 4.31Å; Y374-R378 HydrophobicContact CE1-CG 4.49Å; Y374-R378 WeakPolarHBondContact O-CB 3.4Å; Y374-R378 PolarHBondContact O-N 2.83Å; L375-R378 PolarHBondContact O-N 3.28Å; R378-Y380 VanDerWaalsContact C-N 3.28Å; R378-Y380 PolarHBondContact O-N 2.92Å; R378-I381 PolarHBondContact O-N 3Å; R378-L382 HydrophobicContact CG-CD1 4.23Å; R378-L382 PolarHBondContact O-N 3.03Å; R378-I414 HydrophobicContact CB-CG2 4.23Å; R378-L418 HydrophobicContact CG-CD1 4.17Å; R378-L418 HydrophobicContact CG-CD2 4.03Å
379	N	94.2	Very high	91.5	Very high	45 Å²	45	55.3 Å²	55.3	24%	0.241	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-32.1	-175.6	-61.9	3	0	0	0	112.1	T348 L375 D383	T348-N379 PolarHBondContact O-ND2 3.4Å; T348-N379 PolarHBondContact O-OD1 2.86Å; L375-N379 VanDerWaalsContact O-CB 3.29Å; L375-N379 WeakPolarHBondContact O-CB 2.94Å; L375-N379 PolarHBondContact O-N 2.67Å; L375-N379 PolarHBondContact O-OD1 3.5Å; N379-D383 WeakPolarHBondContact O-CB 3.2Å; N379-D383 PolarHBondContact O-N 2.97Å
380	Y	94.3	Very high	91.3	Very high	63 Å²	63	58.9 Å²	58.9	25%	0.247	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-39.6	173	178.8	-91.6	0	0	0	112.1	K376 I377 R378 L382 D383 Q384 V398 L402	K376-Y380 VanDerWaalsContact O-CB 3.31Å; K376-Y380 WeakPolarHBondContact O-CB 3.5Å; I377-Y380 PolarHBondContact O-N 2.96Å; R378-Y380 VanDerWaalsContact C-N 3.28Å; R378-Y380 PolarHBondContact O-N 2.92Å; Y380-L382 VanDerWaalsContact C-N 3.35Å; Y380-D383 PolarHBondContact O-N 2.88Å; Y380-Q384 HydrophobicContact CD1-CG 4.08Å; Y380-Q384 HydrophobicContact CE1-CG 3.53Å; Y380-Q384 HydrophobicContact CE2-CG 4.12Å; Y380-Q384 VanDerWaalsContact O-CG 3.29Å; Y380-Q384 WeakPolarHBondContact O-CG 3.37Å; Y380-Q384 PolarHBondContact O-N 2.91Å; Y380-Q384 PolarHBondContact OH-OE1 3.37Å; Y380-V398 HydrophobicContact CE1-CB 4.19Å; Y380-V398 WeakPolarHBondContact CE1-O 3.39Å; Y380-L402 HydrophobicContact CD1-CD1 3.75Å; Y380-L402 HydrophobicContact CD1-CD2 3.74Å; Y380-L402 HydrophobicContact CD1-CG 3.46Å; Y380-L402 VanDerWaalsContact CD1-CG 3.46Å; Y380-L402 HydrophobicContact CE1-CD1 4.31Å; Y380-L402 HydrophobicContact CE1-CG 3.89Å; Y380-L402 HydrophobicContact CG-CD2 3.84Å; Y380-L402 HydrophobicContact CG-CG 4.09Å
381	I	93.9	Very high	91.2	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.3	-40	177	-67.2	165.6	0	0	0	110.5	I377 R378 Q384 W385 L393 V398 L402 I414 H415 L418 I424	I377-I381 HydrophobicContact CG2-CD1 3.76Å; I377-I381 WeakPolarHBondContact O-CG1 3.18Å; I377-I381 PolarHBondContact O-N 2.98Å; I377-I381 VanDerWaalsContact O-N 3.11Å; R378-I381 PolarHBondContact O-N 3Å; I381-Q384 PolarHBondContact O-N 3.43Å; I381-W385 PolarHBondContact O-N 3.28Å; I381-L393 HydrophobicContact CG2-CD2 4.06Å; I381-L393 WeakPolarHBondContact O-CD2 3.46Å; I381-V398 HydrophobicContact CG1-CB 4.28Å; I381-V398 HydrophobicContact CG1-CG1 4.26Å; I381-V398 HydrophobicContact CG1-CG2 4.31Å; I381-L402 HydrophobicContact CD1-CD1 4.49Å; I381-L402 HydrophobicContact CG1-CD1 4.28Å; I381-I414 HydrophobicContact CD1-CB 4.45Å; I381-I414 HydrophobicContact CD1-CG2 4.06Å; I381-H415 HydrophobicContact CD1-CB 4.21Å; I381-L418 HydrophobicContact CB-CD1 3.93Å; I381-L418 HydrophobicContact CG2-CD1 3.7Å; I381-I424 HydrophobicContact CG2-CD1 3.7Å; I381-I424 HydrophobicContact CG2-CG2 4.15Å
382	L	93.3	Very high	91.3	Very high	26 Å²	26	67.3 Å²	67.3	14%	0.136	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-45.8	173	-65.8	169.7	0	0	0	112.2	M346 R378 Y380 Q384 W385 L386 L418 A423 I424	M346-L382 HydrophobicContact CB-CD1 4.17Å; M346-L382 HydrophobicContact SD-CD1 4.35Å; R378-L382 HydrophobicContact CG-CD1 4.23Å; R378-L382 PolarHBondContact O-N 3.03Å; Y380-L382 VanDerWaalsContact C-N 3.35Å; L382-Q384 VanDerWaalsContact C-N 3.3Å; L382-Q384 PolarHBondContact O-N 3.5Å; L382-W385 PolarHBondContact O-N 2.89Å; L382-W385 VanDerWaalsContact O-N 3.13Å; L382-L386 PolarHBondContact O-N 3.41Å; L382-L418 HydrophobicContact CD2-CD2 4.3Å; L382-L418 HydrophobicContact CG-CD1 4.43Å; L382-A423 HydrophobicContact CD2-CB 4.1Å; L382-I424 HydrophobicContact CD2-CG2 3.98Å
383	D	93.7	Very high	91.4	Very high	57 Å²	57	61.9 Å²	61.9	31%	0.305	29%	0.288	S	S	.	.	H	α-helix	trans	-57.8	-39.4	174.1	169.1	91.5	0	0	0	112.8	N379 Y380 K387	N379-D383 WeakPolarHBondContact O-CB 3.2Å; N379-D383 PolarHBondContact O-N 2.97Å; Y380-D383 PolarHBondContact O-N 2.88Å; D383-K387 WeakPolarHBondContact O-CD 3.41Å; D383-K387 WeakPolarHBondContact O-CG 3.4Å; D383-K387 PolarHBondContact O-N 2.91Å; D383-K387 WeakPolarHBondContact OD1-CE 3.26Å; D383-K387 IonicContact OD1-NZ 3.17Å; D383-K387 PolarHBondContact OD1-NZ 3.37Å; D383-K387 WeakPolarHBondContact OD2-CE 3.49Å; D383-K387 IonicContact OD2-NZ 3.29Å; D383-K387 PolarHBondContact OD2-NZ 3.21Å
384	Q	93.1	Very high	91.4	Very high	49 Å²	49	61.6 Å²	61.6	23%	0.229	29%	0.293	C	S	.	.	H	α-helix	trans	-72.6	-32.8	176.2	-66	-58.7	-83.5	0	0	112.5	Y380 I381 L382 K387 S388 L393 V398	Y380-Q384 HydrophobicContact CD1-CG 4.08Å; Y380-Q384 HydrophobicContact CE1-CG 3.53Å; Y380-Q384 HydrophobicContact CE2-CG 4.12Å; Y380-Q384 VanDerWaalsContact O-CG 3.29Å; Y380-Q384 WeakPolarHBondContact O-CG 3.37Å; Y380-Q384 PolarHBondContact O-N 2.91Å; Y380-Q384 PolarHBondContact OH-OE1 3.37Å; I381-Q384 PolarHBondContact O-N 3.43Å; L382-Q384 VanDerWaalsContact C-N 3.3Å; L382-Q384 PolarHBondContact O-N 3.5Å; Q384-K387 PolarHBondContact O-N 2.95Å; Q384-S388 WeakPolarHBondContact O-CB 3.33Å; Q384-S388 PolarHBondContact O-N 3Å; Q384-S388 PolarHBondContact O-OG 3.23Å; Q384-L393 HydrophobicContact CB-CD1 3.87Å; Q384-L393 HydrophobicContact CB-CD2 4.02Å; Q384-V398 HydrophobicContact CB-CG1 4.12Å; Q384-V398 HydrophobicContact CG-CG1 4.34Å
385	W	93.2	Very high	91.3	Very high	10 Å²	10	64.8 Å²	64.8	4%	0.038	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-47.8	172.9	171.6	-123.7	0	0	0	111.1	E343 I381 L382 K387 S388 K389 L393 I424 N425 F426	E343-W385 PolarHBondContact OE1-NE1 2.96Å; I381-W385 PolarHBondContact O-N 3.28Å; L382-W385 PolarHBondContact O-N 2.89Å; L382-W385 VanDerWaalsContact O-N 3.13Å; W385-K387 PolarHBondContact O-N 3.11Å; W385-K387 VanDerWaalsContact O-N 3.07Å; W385-S388 PolarHBondContact O-N 3.12Å; W385-K389 HydrophobicContact CD2-CB 4.15Å; W385-K389 HydrophobicContact CE3-CB 4.2Å; W385-K389 HydrophobicContact CH2-CB 4.05Å; W385-K389 HydrophobicContact CH2-CD 4.34Å; W385-K389 HydrophobicContact CH2-CG 3.76Å; W385-K389 HydrophobicContact CZ2-CB 3.99Å; W385-K389 HydrophobicContact CZ2-CD 3.63Å; W385-K389 HydrophobicContact CZ2-CG 3.56Å; W385-K389 HydrophobicContact CZ3-CB 4.15Å; W385-K389 HydrophobicContact CZ3-CG 4.36Å; W385-K389 WeakPolarHBondContact O-CB 3.38Å; W385-K389 PolarHBondContact O-N 2.96Å; W385-L393 HydrophobicContact CB-CD2 4.01Å; W385-L393 HydrophobicContact CE3-CB 4.18Å; W385-I424 HydrophobicContact CB-CB 4Å; W385-I424 HydrophobicContact CB-CG2 3.56Å; W385-I424 HydrophobicContact CD2-CB 4.22Å; W385-I424 HydrophobicContact CG-CB 3.87Å; W385-I424 HydrophobicContact CG-CG2 3.82Å; W385-N425 VanDerWaalsContact CH2-CA 3.43Å; W385-N425 WeakPolarHBondContact CZ3-OD1 3.47Å; W385-F426 HydrophobicContact CZ2-CB 4.38Å
386	L	91.4	Very high	91	Very high	145 Å²	145	67.6 Å²	67.6	76%	0.759	33%	0.325	S	S	*	.	H	α-helix	trans	-56.6	-27.7	176.5	-172.8	63.6	0	0	0	112.7	L382	L382-L386 PolarHBondContact O-N 3.41Å
387	K	91.3	Very high	90.9	Very high	144 Å²	144	64.1 Å²	64.1	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-90.7	-18.4	176.2	-69.9	167.7	-170.9	165.7	0	114.8	D383 Q384 W385	D383-K387 WeakPolarHBondContact O-CD 3.41Å; D383-K387 WeakPolarHBondContact O-CG 3.4Å; D383-K387 PolarHBondContact O-N 2.91Å; D383-K387 WeakPolarHBondContact OD1-CE 3.26Å; D383-K387 IonicContact OD1-NZ 3.17Å; D383-K387 PolarHBondContact OD1-NZ 3.37Å; D383-K387 WeakPolarHBondContact OD2-CE 3.49Å; D383-K387 IonicContact OD2-NZ 3.29Å; D383-K387 PolarHBondContact OD2-NZ 3.21Å; Q384-K387 PolarHBondContact O-N 2.95Å; W385-K387 PolarHBondContact O-N 3.11Å; W385-K387 VanDerWaalsContact O-N 3.07Å
388	S	87.1	Confident	90.7	Very high	32 Å²	32	64.1 Å²	64.1	22%	0.224	32%	0.319	C	S	.	.	H	α-helix	trans	-103.7	-26.7	-179	80.5	0	0	0	0	114	Q384 W385 R391	Q384-S388 WeakPolarHBondContact O-CB 3.33Å; Q384-S388 PolarHBondContact O-N 3Å; Q384-S388 PolarHBondContact O-OG 3.23Å; W385-S388 PolarHBondContact O-N 3.12Å; S388-R391 WeakPolarHBondContact O-CA 3.37Å; S388-R391 VanDerWaalsContact O-CB 3.24Å; S388-R391 WeakPolarHBondContact O-CB 3.12Å; S388-R391 PolarHBondContact O-N 3.39Å; S388-R391 PolarHBondContact OG-O 3.18Å
389	K	87	Confident	90.3	Very high	91 Å²	91	67.4 Å²	67.4	40%	0.396	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	134.1	-176.7	-172.8	177.3	-175.3	179	0	111.7	E343 W385	E343-K389 WeakPolarHBondContact OE1-CE 3.49Å; E343-K389 IonicContact OE1-NZ 3.2Å; E343-K389 PolarHBondContact OE1-NZ 3.44Å; E343-K389 IonicContact OE2-NZ 3.88Å; E343-K389 PolarHBondContact OE2-NZ 3.34Å; W385-K389 HydrophobicContact CD2-CB 4.15Å; W385-K389 HydrophobicContact CE3-CB 4.2Å; W385-K389 HydrophobicContact CH2-CB 4.05Å; W385-K389 HydrophobicContact CH2-CD 4.34Å; W385-K389 HydrophobicContact CH2-CG 3.76Å; W385-K389 HydrophobicContact CZ2-CB 3.99Å; W385-K389 HydrophobicContact CZ2-CD 3.63Å; W385-K389 HydrophobicContact CZ2-CG 3.56Å; W385-K389 HydrophobicContact CZ3-CB 4.15Å; W385-K389 HydrophobicContact CZ3-CG 4.36Å; W385-K389 WeakPolarHBondContact O-CB 3.38Å; W385-K389 PolarHBondContact O-N 2.96Å
390	P	82.6	Confident	90	Very high	108 Å²	108	69.1 Å²	69.1	70%	0.701	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.6	13.6	6.1	36.2	-37.4	0	0	0	115.4	C428	P390-C428 PolarHBondContact O-SG 2.76Å; P390-C428 VanDerWaalsContact O-SG 3.36Å
391	R	87.3	Confident	89.4	Confident	206 Å²	206	68.2 Å²	68.2	78%	0.777	35%	0.354	S	S	*	.	S	Bend	trans	-82.5	128.2	180	-55.8	-179.3	176.1	-174.1	-2	111.2	S388 L393	S388-R391 WeakPolarHBondContact O-CA 3.37Å; S388-R391 VanDerWaalsContact O-CB 3.24Å; S388-R391 WeakPolarHBondContact O-CB 3.12Å; S388-R391 PolarHBondContact O-N 3.39Å; S388-R391 PolarHBondContact OG-O 3.18Å; R391-L393 PolarHBondContact O-N 2.97Å
392	Y	92.1	Very high	89.1	Confident	59 Å²	59	68.5 Å²	68.5	23%	0.231	36%	0.356	C	S	.	.			trans	-51.2	117.4	-179.9	-178.6	-102.7	0	0	0	113.4	N394 E419 N425 C428 Q430 A431	Y392-N394 PolarHBondContact O-N 3.36Å; Y392-N394 PolarHBondContact O-ND2 3.13Å; Y392-E419 PolarHBondContact OH-OE2 2.84Å; Y392-N425 HydrophobicContact CD2-CB 3.76Å; Y392-N425 VanDerWaalsContact CD2-CG 3.41Å; Y392-N425 WeakPolarHBondContact CD2-ND2 3.14Å; Y392-N425 HydrophobicContact CE2-CB 3.9Å; Y392-N425 WeakPolarHBondContact CE2-ND2 3.43Å; Y392-C428 HydrophobicContact CD2-CB 3.75Å; Y392-C428 HydrophobicContact CG-CB 4.39Å; Y392-Q430 HydrophobicContact CD1-CB 4.2Å; Y392-Q430 HydrophobicContact CD2-CB 3.92Å; Y392-Q430 HydrophobicContact CE1-CB 4.28Å; Y392-Q430 HydrophobicContact CE2-CB 4.01Å; Y392-Q430 HydrophobicContact CG-CB 4.01Å; Y392-A431 HydrophobicContact CE2-CB 4.37Å
393	L	91.9	Very high	88.3	Confident	7 Å²	7	74.6 Å²	74.6	4%	0.037	38%	0.381	C	S	.	.			trans	-79.5	101.2	178.5	-175.3	69	0	0	0	110.3	I381 Q384 W385 R391 V398 H415 N425	I381-L393 HydrophobicContact CG2-CD2 4.06Å; I381-L393 WeakPolarHBondContact O-CD2 3.46Å; Q384-L393 HydrophobicContact CB-CD1 3.87Å; Q384-L393 HydrophobicContact CB-CD2 4.02Å; W385-L393 HydrophobicContact CB-CD2 4.01Å; W385-L393 HydrophobicContact CE3-CB 4.18Å; R391-L393 PolarHBondContact O-N 2.97Å; L393-V398 HydrophobicContact CD1-CG1 3.79Å; L393-V398 HydrophobicContact CD2-CG1 3.73Å; L393-V398 HydrophobicContact CG-CG1 3.82Å; L393-H415 PolarHBondContact O-NE2 2.82Å; L393-N425 WeakPolarHBondContact CA-OD1 3.47Å; L393-N425 WeakPolarHBondContact CB-OD1 3.07Å; L393-N425 PolarHBondContact N-OD1 3.42Å; L393-N425 PolarHBondContact O-ND2 2.83Å
394	N	90.8	Very high	87.6	Confident	76 Å²	76	79.5 Å²	79.5	41%	0.406	41%	0.407	S	S	.	.			trans	-69.2	135.4	176.8	-82	-86.6	0	0	0	112	Y392 T396 S397	Y392-N394 PolarHBondContact O-N 3.36Å; Y392-N394 PolarHBondContact O-ND2 3.13Å; N394-T396 PolarHBondContact O-N 2.85Å; N394-S397 PolarHBondContact O-N 2.95Å; N394-S397 PolarHBondContact O-OG 3.49Å
395	K	89.5	Confident	86.6	Confident	67 Å²	67	77.6 Å²	77.6	29%	0.291	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-26.4	169.1	178.6	173.8	162.2	175.6	0	114.2	V398 R399 G412 H415	K395-V398 WeakPolarHBondContact O-CG2 3.47Å; K395-R399 VanDerWaalsContact O-CG 3.3Å; K395-R399 WeakPolarHBondContact O-CG 3.42Å; K395-G412 VanDerWaalsContact NZ-CA 3.26Å; K395-H415 HydrophobicContact CG-CB 4.46Å
396	T	86.8	Confident	85.5	Confident	96 Å²	96	78.7 Å²	78.7	59%	0.589	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-35	176.1	18.5	0	0	0	0	113.7	N394 R399	N394-T396 PolarHBondContact O-N 2.85Å; T396-R399 PolarHBondContact O-N 3.07Å
397	S	88.2	Confident	84.9	Confident	65 Å²	65	75 Å²	75	46%	0.455	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.1	-177.1	55	0	0	0	0	113.5	N394 R399 P400	N394-S397 PolarHBondContact O-N 2.95Å; N394-S397 PolarHBondContact O-OG 3.49Å; S397-R399 VanDerWaalsContact C-N 3.32Å; S397-R399 PolarHBondContact O-N 2.94Å; S397-P400 WeakPolarHBondContact O-CD 3.3Å
398	V	89.8	Confident	84.4	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-15.8	173.3	-62.3	0	0	0	0	114	Y380 I381 Q384 L393 K395 I411	Y380-V398 HydrophobicContact CE1-CB 4.19Å; Y380-V398 WeakPolarHBondContact CE1-O 3.39Å; I381-V398 HydrophobicContact CG1-CB 4.28Å; I381-V398 HydrophobicContact CG1-CG1 4.26Å; I381-V398 HydrophobicContact CG1-CG2 4.31Å; Q384-V398 HydrophobicContact CB-CG1 4.12Å; Q384-V398 HydrophobicContact CG-CG1 4.34Å; L393-V398 HydrophobicContact CD1-CG1 3.79Å; L393-V398 HydrophobicContact CD2-CG1 3.73Å; L393-V398 HydrophobicContact CG-CG1 3.82Å; K395-V398 WeakPolarHBondContact O-CG2 3.47Å; V398-I411 HydrophobicContact CG2-CG2 4.44Å
399	R	85.8	Confident	84.2	Confident	69 Å²	69	76.1 Å²	76.1	26%	0.26	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-41.7	-175.7	-57.6	-172.8	178.4	-78.3	16.5	115.1	K395 T396 S397 G401 L402 V408	K395-R399 VanDerWaalsContact O-CG 3.3Å; K395-R399 WeakPolarHBondContact O-CG 3.42Å; T396-R399 PolarHBondContact O-N 3.07Å; S397-R399 VanDerWaalsContact C-N 3.32Å; S397-R399 PolarHBondContact O-N 2.94Å; R399-G401 VanDerWaalsContact C-N 3.27Å; R399-G401 PolarHBondContact O-N 2.83Å; R399-L402 PolarHBondContact O-N 3.3Å; R399-V408 PolarHBondContact NH1-O 3.01Å; R399-V408 PolarHBondContact NH2-O 3.17Å; R399-V408 VanDerWaalsContact NH2-O 3.12Å
400	P	86.6	Confident	84.2	Confident	82 Å²	82	71.9 Å²	71.9	53%	0.532	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-23.5	-172.2	-24.1	36.9	0	0	0	114.8	S397 K403	S397-P400 WeakPolarHBondContact O-CD 3.3Å; P400-K403 WeakPolarHBondContact O-CD 3.44Å; P400-K403 WeakPolarHBondContact O-CE 3.08Å; P400-K403 WeakPolarHBondContact O-CG 3.37Å
401	G	82.7	Confident	84.5	Confident	43 Å²	43	67.1 Å²	67.1	44%	0.443	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-29.9	172.7	0	0	0	0	0	114	R399 K403	R399-G401 VanDerWaalsContact C-N 3.27Å; R399-G401 PolarHBondContact O-N 2.83Å; G401-K403 PolarHBondContact O-N 3.48Å; G401-K403 VanDerWaalsContact O-N 3.09Å
402	L	87	Confident	84.6	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.031	32%	0.322	C	S	.	.			trans	-84.4	31.9	-179	-70.9	172.8	0	0	0	114.3	I377 Y380 I381 R399 N404 C405 I411	I377-L402 HydrophobicContact CB-CD2 4.48Å; I377-L402 HydrophobicContact CG1-CD2 4.2Å; I377-L402 HydrophobicContact CG2-CD1 3.94Å; Y380-L402 HydrophobicContact CD1-CD1 3.75Å; Y380-L402 HydrophobicContact CD1-CD2 3.74Å; Y380-L402 HydrophobicContact CD1-CG 3.46Å; Y380-L402 VanDerWaalsContact CD1-CG 3.46Å; Y380-L402 HydrophobicContact CE1-CD1 4.31Å; Y380-L402 HydrophobicContact CE1-CG 3.89Å; Y380-L402 HydrophobicContact CG-CD2 3.84Å; Y380-L402 HydrophobicContact CG-CG 4.09Å; I381-L402 HydrophobicContact CD1-CD1 4.49Å; I381-L402 HydrophobicContact CG1-CD1 4.28Å; R399-L402 PolarHBondContact O-N 3.3Å; L402-N404 PolarHBondContact O-N 3.03Å; L402-C405 HydrophobicContact CB-CB 4.23Å; L402-C405 HydrophobicContact CD2-CB 3.98Å; L402-C405 WeakPolarHBondContact O-CB 3.38Å; L402-C405 PolarHBondContact O-N 3.03Å; L402-I411 HydrophobicContact CB-CD1 3.92Å; L402-I411 HydrophobicContact CD1-CD1 4.31Å; L402-I411 HydrophobicContact CD1-CG1 4.31Å; L402-I411 HydrophobicContact CD1-CG2 3.74Å
403	K	76.9	Confident	84.5	Confident	155 Å²	155	60.2 Å²	60.2	67%	0.674	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	136.1	173.6	-71.7	167.4	-178.8	166.3	0	110	P400 G401 C405	P400-K403 WeakPolarHBondContact O-CD 3.44Å; P400-K403 WeakPolarHBondContact O-CE 3.08Å; P400-K403 WeakPolarHBondContact O-CG 3.37Å; G401-K403 PolarHBondContact O-N 3.48Å; G401-K403 VanDerWaalsContact O-N 3.09Å; K403-C405 PolarHBondContact O-N 3.37Å; K403-C405 PolarHBondContact O-SG 3.08Å
404	N	78.3	Confident	84.4	Confident	160 Å²	160	59.9 Å²	59.9	86%	0.856	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	6.1	-178.3	-51.9	-8.9	0	0	0	115.6	R373 L402	R373-N404 PolarHBondContact NH1-O 3.41Å; L402-N404 PolarHBondContact O-N 3.03Å
405	C	73.1	Confident	84.5	Confident	8 Å²	8	56.5 Å²	56.5	5%	0.054	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-29.2	-176.6	-65.2	0	0	0	0	112.9	R373 I377 L402 K403	R373-C405 WeakPolarHBondContact CD-O 3.49Å; R373-C405 WeakPolarHBondContact CG-O 3.4Å; R373-C405 VanDerWaalsContact NH1-C 3.32Å; R373-C405 PolarHBondContact NH1-O 3.17Å; I377-C405 HydrophobicContact CG1-CB 4.08Å; L402-C405 HydrophobicContact CB-CB 4.23Å; L402-C405 HydrophobicContact CD2-CB 3.98Å; L402-C405 WeakPolarHBondContact O-CB 3.38Å; L402-C405 PolarHBondContact O-N 3.03Å; K403-C405 PolarHBondContact O-N 3.37Å; K403-C405 PolarHBondContact O-SG 3.08Å
406	G	69.4	Low	84.6	Confident	33 Å²	33	54.8 Å²	54.8	34%	0.34	31%	0.308	S	S	.	.	S	Bend	trans	-178.6	179	173.4	0	0	0	0	0	112.1
407	D	78.7	Confident	84.7	Confident	67 Å²	67	51.7 Å²	51.7	36%	0.358	29%	0.285	S	S	.	.			trans	-76.2	163.6	175.3	68.5	-92.9	0	0	0	113.2	N409 C410 I411	D407-N409 PolarHBondContact O-N 3.25Å; D407-N409 WeakPolarHBondContact OD2-CA 3.43Å; D407-N409 WeakPolarHBondContact OD2-CB 3.24Å; D407-N409 PolarHBondContact OD2-N 3.01Å; D407-C410 PolarHBondContact O-N 3.33Å; D407-C410 PolarHBondContact OD1-SG 3.27Å; D407-C410 PolarHBondContact OD2-N 2.92Å; D407-C410 PolarHBondContact OD2-SG 2.74Å; D407-I411 PolarHBondContact O-N 3.3Å
408	V	80.7	Confident	84.9	Confident	90 Å²	90	48.6 Å²	48.6	55%	0.545	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-21.6	-175	168.9	0	0	0	0	113.7	R399	R399-V408 PolarHBondContact NH1-O 3.01Å; R399-V408 PolarHBondContact NH2-O 3.17Å; R399-V408 VanDerWaalsContact NH2-O 3.12Å
409	N	83.8	Confident	84.9	Confident	111 Å²	111	49.3 Å²	49.3	59%	0.594	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-38.9	-178.6	-60.4	-42.8	0	0	0	112.3	D407 G412 R413	D407-N409 PolarHBondContact O-N 3.25Å; D407-N409 WeakPolarHBondContact OD2-CA 3.43Å; D407-N409 WeakPolarHBondContact OD2-CB 3.24Å; D407-N409 PolarHBondContact OD2-N 3.01Å; N409-G412 CarbonylContact O-C 3.56Å; N409-G412 VanDerWaalsContact O-CA 3.23Å; N409-G412 WeakPolarHBondContact O-CA 3.43Å; N409-G412 PolarHBondContact O-N 3.23Å; N409-R413 PolarHBondContact O-N 3.02Å; N409-R413 VanDerWaalsContact O-N 3.07Å
410	C	86	Confident	84.8	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.014	27%	0.267	C	S	.	.	H	α-helix	trans	-71.2	-42.3	-177.6	-59.1	0	0	0	0	112.7	E361 F362 K369 D407 G412 R413 I414	E361-C410 PolarHBondContact OE1-SG 3.37Å; F362-C410 HydrophobicContact CE2-CB 4.12Å; F362-C410 HydrophobicContact CZ-CB 3.99Å; K369-C410 PolarHBondContact NZ-SG 2.8Å; D407-C410 PolarHBondContact O-N 3.33Å; D407-C410 PolarHBondContact OD1-SG 3.27Å; D407-C410 PolarHBondContact OD2-N 2.92Å; D407-C410 PolarHBondContact OD2-SG 2.74Å; C410-G412 PolarHBondContact O-N 3.31Å; C410-R413 PolarHBondContact O-N 3.41Å; C410-R413 PolarHBondContact SG-NH2 3.09Å; C410-I414 PolarHBondContact O-N 3.23Å; C410-I414 VanDerWaalsContact O-N 3.14Å
411	I	89.4	Confident	84.8	Confident	7 Å²	7	46.7 Å²	46.7	4%	0.036	25%	0.253	C	S	.	.	H	α-helix	trans	-52.5	-30.1	166	-64	168.4	0	0	0	110.8	I377 V398 L402 D407 H415	I377-I411 HydrophobicContact CD1-CG1 4.2Å; I377-I411 HydrophobicContact CG1-CG1 4.5Å; I377-I411 HydrophobicContact CG2-CG1 4.24Å; I377-I411 HydrophobicContact CG2-CG2 4.48Å; V398-I411 HydrophobicContact CG2-CG2 4.44Å; L402-I411 HydrophobicContact CB-CD1 3.92Å; L402-I411 HydrophobicContact CD1-CD1 4.31Å; L402-I411 HydrophobicContact CD1-CG1 4.31Å; L402-I411 HydrophobicContact CD1-CG2 3.74Å; D407-I411 PolarHBondContact O-N 3.3Å; I411-H415 WeakPolarHBondContact O-CB 3.48Å; I411-H415 PolarHBondContact O-N 3.44Å
412	G	90	Very high	84.9	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-75.7	-32.9	177.2	0	0	0	0	0	116.6	K395 N409 C410 T416	K395-G412 VanDerWaalsContact NZ-CA 3.26Å; N409-G412 CarbonylContact O-C 3.56Å; N409-G412 VanDerWaalsContact O-CA 3.23Å; N409-G412 WeakPolarHBondContact O-CA 3.43Å; N409-G412 PolarHBondContact O-N 3.23Å; C410-G412 PolarHBondContact O-N 3.31Å; G412-T416 WeakPolarHBondContact O-CB 3.21Å; G412-T416 PolarHBondContact O-N 3.02Å; G412-T416 VanDerWaalsContact O-N 3.09Å; G412-T416 PolarHBondContact O-OG1 2.78Å
413	R	88.4	Confident	85	Confident	119 Å²	119	44.5 Å²	44.5	45%	0.449	23%	0.232	S	C	.	.	H	α-helix	trans	-76.5	-35.8	175.8	-81.8	178.7	-76.1	164.3	1.7	110.9	E361 N409 C410 T416 Y417	E361-R413 VanDerWaalsContact CD-CZ 3.43Å; E361-R413 VanDerWaalsContact CD-NH1 3.3Å; E361-R413 IonicContact OE1-CZ 2.65Å; E361-R413 IonicContact OE1-NH1 2.73Å; E361-R413 IonicContact OE1-NH2 2.61Å; E361-R413 PolarHBondContact OE1-NH2 2.86Å; E361-R413 IonicContact OE2-CZ 3.61Å; E361-R413 IonicContact OE2-NH1 2.76Å; E361-R413 PolarHBondContact OE2-NH1 3.39Å; E361-R413 IonicContact OE2-NH2 3.66Å; E361-R413 PolarHBondContact OE2-NH2 2.97Å; N409-R413 PolarHBondContact O-N 3.02Å; N409-R413 VanDerWaalsContact O-N 3.07Å; C410-R413 PolarHBondContact O-N 3.41Å; C410-R413 PolarHBondContact SG-NH2 3.09Å; R413-T416 PolarHBondContact O-N 3.4Å; R413-Y417 VanDerWaalsContact O-CB 3.29Å; R413-Y417 WeakPolarHBondContact O-CB 3.17Å; R413-Y417 PolarHBondContact O-N 2.88Å
414	I	91.4	Very high	85.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-48.9	171.8	-58.9	167.3	0	0	0	110.4	I359 F362 Y374 I377 R378 I381 C410 T416 Y417 L418	I359-I414 HydrophobicContact CD1-CB 4.18Å; I359-I414 HydrophobicContact CD1-CG1 3.67Å; I359-I414 HydrophobicContact CG2-CG1 4.42Å; F362-I414 HydrophobicContact CE2-CD1 3.96Å; F362-I414 HydrophobicContact CZ-CD1 3.93Å; Y374-I414 HydrophobicContact CD2-CD1 3.84Å; Y374-I414 HydrophobicContact CD2-CG1 4.12Å; Y374-I414 HydrophobicContact CE2-CD1 4.13Å; Y374-I414 HydrophobicContact CE2-CG1 3.9Å; I377-I414 HydrophobicContact CB-CD1 3.8Å; I377-I414 HydrophobicContact CD1-CD1 3.94Å; I377-I414 HydrophobicContact CG2-CB 4.14Å; I377-I414 HydrophobicContact CG2-CD1 3.54Å; I377-I414 HydrophobicContact CG2-CG1 4.43Å; I377-I414 HydrophobicContact CG2-CG2 4.08Å; R378-I414 HydrophobicContact CB-CG2 4.23Å; I381-I414 HydrophobicContact CD1-CB 4.45Å; I381-I414 HydrophobicContact CD1-CG2 4.06Å; C410-I414 PolarHBondContact O-N 3.23Å; C410-I414 VanDerWaalsContact O-N 3.14Å; I414-T416 PolarHBondContact O-N 3.13Å; I414-Y417 PolarHBondContact O-N 3.26Å; I414-L418 HydrophobicContact CG2-CD1 4.06Å; I414-L418 HydrophobicContact CG2-CG 4.48Å; I414-L418 WeakPolarHBondContact O-CG 3.49Å; I414-L418 PolarHBondContact O-N 3.2Å
415	H	93.2	Very high	86.2	Confident	4 Å²	4	29.5 Å²	29.5	2%	0.019	16%	0.159	C	C	.	.	H	α-helix	trans	-56	-50.1	174.3	172.8	-89.8	0	0	0	112.6	I381 L393 K395 I411 Y417 L418 E419 I424	I381-H415 HydrophobicContact CD1-CB 4.21Å; L393-H415 PolarHBondContact O-NE2 2.82Å; K395-H415 HydrophobicContact CG-CB 4.46Å; I411-H415 WeakPolarHBondContact O-CB 3.48Å; I411-H415 PolarHBondContact O-N 3.44Å; H415-Y417 PolarHBondContact O-N 2.86Å; H415-L418 PolarHBondContact O-N 3.38Å; H415-E419 IonicContact CE1-OE2 2.7Å; H415-E419 PolarHBondContact CE1-OE2 3.03Å; H415-E419 VanDerWaalsContact CE1-OE2 3.29Å; H415-E419 IonicContact NE2-OE2 2.62Å; H415-E419 WeakPolarHBondContact O-CB 3.47Å; H415-E419 PolarHBondContact O-N 3.3Å; H415-E419 VanDerWaalsContact O-N 3.09Å; H415-I424 WeakPolarHBondContact CD2-CD1 3.47Å
416	T	89.8	Confident	86.8	Confident	32 Å²	32	30.3 Å²	30.3	20%	0.196	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-36.7	178.6	-65.9	0	0	0	0	113.1	G412 R413 I414 E419 L420	G412-T416 WeakPolarHBondContact O-CB 3.21Å; G412-T416 PolarHBondContact O-N 3.02Å; G412-T416 VanDerWaalsContact O-N 3.09Å; G412-T416 PolarHBondContact O-OG1 2.78Å; R413-T416 PolarHBondContact O-N 3.4Å; I414-T416 PolarHBondContact O-N 3.13Å; T416-E419 PolarHBondContact O-N 3.38Å; T416-L420 HydrophobicContact CG2-CD1 3.95Å; T416-L420 HydrophobicContact CG2-CG 4.28Å; T416-L420 WeakPolarHBondContact O-CG 3.45Å; T416-L420 PolarHBondContact O-N 3.2Å
417	Y	90.7	Very high	87.4	Confident	30 Å²	30	35.3 Å²	35.3	12%	0.118	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-48.2	176	168.3	-100	0	0	0	111.8	M346 E355 A358 I359 R413 I414 H415 E419 L420 I421	M346-Y417 HydrophobicContact CE-CE1 4.5Å; E355-Y417 HydrophobicContact CG-CE1 3.75Å; E355-Y417 WeakPolarHBondContact CG-OH 3.29Å; A358-Y417 HydrophobicContact CB-CD2 3.38Å; A358-Y417 HydrophobicContact CB-CE2 3.4Å; A358-Y417 VanDerWaalsContact CB-CE2 3.4Å; A358-Y417 HydrophobicContact CB-CG 4.25Å; I359-Y417 HydrophobicContact CD1-CD1 4.31Å; I359-Y417 HydrophobicContact CD1-CG 4.11Å; R413-Y417 VanDerWaalsContact O-CB 3.29Å; R413-Y417 WeakPolarHBondContact O-CB 3.17Å; R413-Y417 PolarHBondContact O-N 2.88Å; I414-Y417 PolarHBondContact O-N 3.26Å; H415-Y417 PolarHBondContact O-N 2.86Å; Y417-E419 PolarHBondContact O-N 3.35Å; Y417-L420 PolarHBondContact O-N 3.27Å; Y417-I421 HydrophobicContact CD1-CD1 4.39Å; Y417-I421 HydrophobicContact CD2-CG2 4.39Å; Y417-I421 HydrophobicContact CE1-CD1 3.74Å; Y417-I421 HydrophobicContact CE2-CG2 3.93Å; Y417-I421 PolarHBondContact O-N 3.1Å; Y417-I421 VanDerWaalsContact O-N 3.13Å
418	L	90.6	Very high	87.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.7	-33.1	177.5	-67.6	174.1	0	0	0	112.6	M346 R378 I381 L382 I414 H415 I421 G422 A423 I424	M346-L418 HydrophobicContact CE-CD2 4.33Å; M346-L418 HydrophobicContact SD-CD2 3.32Å; M346-L418 WeakPolarHBondContact SD-CD2 3.13Å; R378-L418 HydrophobicContact CG-CD1 4.17Å; R378-L418 HydrophobicContact CG-CD2 4.03Å; I381-L418 HydrophobicContact CB-CD1 3.93Å; I381-L418 HydrophobicContact CG2-CD1 3.7Å; L382-L418 HydrophobicContact CD2-CD2 4.3Å; L382-L418 HydrophobicContact CG-CD1 4.43Å; I414-L418 HydrophobicContact CG2-CD1 4.06Å; I414-L418 HydrophobicContact CG2-CG 4.48Å; I414-L418 WeakPolarHBondContact O-CG 3.49Å; I414-L418 PolarHBondContact O-N 3.2Å; H415-L418 PolarHBondContact O-N 3.38Å; L418-I421 HydrophobicContact CD2-CD1 4.37Å; L418-G422 PolarHBondContact O-N 3.45Å; L418-A423 HydrophobicContact CD2-CB 4.21Å; L418-A423 PolarHBondContact O-N 3.42Å; L418-I424 HydrophobicContact CB-CD1 3.95Å; L418-I424 HydrophobicContact CB-CG1 3.9Å; L418-I424 HydrophobicContact CB-CG2 4.26Å; L418-I424 PolarHBondContact O-N 3.13Å; L418-I424 VanDerWaalsContact O-N 3.15Å
419	E	89.7	Confident	87.3	Confident	16 Å²	16	36.9 Å²	36.9	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-71.9	-42.9	175.5	-177.7	168.6	85.4	0	0	111.8	Y392 H415 T416 Y417 I421 G422 I424 N425 A431 Y433	Y392-E419 PolarHBondContact OH-OE2 2.84Å; H415-E419 IonicContact CE1-OE2 2.7Å; H415-E419 PolarHBondContact CE1-OE2 3.03Å; H415-E419 VanDerWaalsContact CE1-OE2 3.29Å; H415-E419 IonicContact NE2-OE2 2.62Å; H415-E419 WeakPolarHBondContact O-CB 3.47Å; H415-E419 PolarHBondContact O-N 3.3Å; H415-E419 VanDerWaalsContact O-N 3.09Å; T416-E419 PolarHBondContact O-N 3.38Å; Y417-E419 PolarHBondContact O-N 3.35Å; E419-I421 PolarHBondContact O-N 3.22Å; E419-G422 PolarHBondContact O-N 2.91Å; E419-I424 HydrophobicContact CB-CD1 4.34Å; E419-I424 HydrophobicContact CB-CG1 4.03Å; E419-N425 HydrophobicContact CG-CB 4.36Å; E419-N425 PolarHBondContact OE2-ND2 3.42Å; E419-A431 HydrophobicContact CG-CB 4.46Å; E419-Y433 VanDerWaalsContact O-CD1 3.23Å; E419-Y433 WeakPolarHBondContact O-CD1 3.45Å; E419-Y433 VanDerWaalsContact O-CE1 3.23Å; E419-Y433 WeakPolarHBondContact O-CE1 3.46Å
420	L	84.8	Confident	87.2	Confident	48 Å²	48	36.5 Å²	36.5	25%	0.251	18%	0.175	S	C	.	.	H	α-helix	trans	-62.5	-40.4	178.1	-70.9	167.4	0	0	0	112.6	T416 Y417 G422 V432 Y433 R435	T416-L420 HydrophobicContact CG2-CD1 3.95Å; T416-L420 HydrophobicContact CG2-CG 4.28Å; T416-L420 WeakPolarHBondContact O-CG 3.45Å; T416-L420 PolarHBondContact O-N 3.2Å; Y417-L420 PolarHBondContact O-N 3.27Å; L420-G422 VanDerWaalsContact C-N 3.28Å; L420-G422 PolarHBondContact O-N 2.89Å; L420-V432 WeakPolarHBondContact CD2-O 3.48Å; L420-Y433 WeakPolarHBondContact CD2-O 3.23Å; L420-R435 HydrophobicContact CD1-CB 4.41Å; L420-R435 HydrophobicContact CD2-CB 3.73Å
421	I	86.3	Confident	86.9	Confident	47 Å²	47	37 Å²	37	24%	0.241	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.5	178.1	69.9	177.3	0	0	0	113.8	V344 M346 Y417 L418 E419 A423	V344-I421 WeakPolarHBondContact CG2-O 3.47Å; M346-I421 HydrophobicContact CE-CD1 4.09Å; M346-I421 HydrophobicContact SD-CD1 3.77Å; Y417-I421 HydrophobicContact CD1-CD1 4.39Å; Y417-I421 HydrophobicContact CD2-CG2 4.39Å; Y417-I421 HydrophobicContact CE1-CD1 3.74Å; Y417-I421 HydrophobicContact CE2-CG2 3.93Å; Y417-I421 PolarHBondContact O-N 3.1Å; Y417-I421 VanDerWaalsContact O-N 3.13Å; L418-I421 HydrophobicContact CD2-CD1 4.37Å; E419-I421 PolarHBondContact O-N 3.22Å; I421-A423 VanDerWaalsContact C-N 3.33Å; I421-A423 HydrophobicContact CD1-CB 3.92Å; I421-A423 HydrophobicContact CG1-CB 3.81Å; I421-A423 PolarHBondContact O-N 3.33Å
422	G	85.4	Confident	86.1	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	19.3	-179.3	0	0	0	0	0	115.3	V344 L418 E419 L420	V344-G422 PolarHBondContact N-O 2.93Å; V344-G422 VanDerWaalsContact N-O 3.14Å; L418-G422 PolarHBondContact O-N 3.45Å; E419-G422 PolarHBondContact O-N 2.91Å; L420-G422 VanDerWaalsContact C-N 3.28Å; L420-G422 PolarHBondContact O-N 2.89Å
423	A	87.9	Confident	85	Confident	4 Å²	4	43 Å²	43	3%	0.033	21%	0.212	C	C	.	.	S	Bend	trans	-83.5	-17.2	174.6	0	0	0	0	0	113.1	V344 M346 L382 L418 I421	V344-A423 HydrophobicContact CB-CB 4.44Å; V344-A423 WeakPolarHBondContact O-CA 3.03Å; V344-A423 WeakPolarHBondContact O-CB 3.35Å; M346-A423 HydrophobicContact CG-CB 3.94Å; M346-A423 HydrophobicContact SD-CB 3.83Å; L382-A423 HydrophobicContact CD2-CB 4.1Å; L418-A423 HydrophobicContact CD2-CB 4.21Å; L418-A423 PolarHBondContact O-N 3.42Å; I421-A423 VanDerWaalsContact C-N 3.33Å; I421-A423 HydrophobicContact CD1-CB 3.92Å; I421-A423 HydrophobicContact CG1-CB 3.81Å; I421-A423 PolarHBondContact O-N 3.33Å
424	I	90.4	Very high	83.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	S	Bend	trans	-134.6	162.1	163.7	67.6	177.9	0	0	0	110.4	I381 L382 W385 H415 L418 E419 F426	I381-I424 HydrophobicContact CG2-CD1 3.7Å; I381-I424 HydrophobicContact CG2-CG2 4.15Å; L382-I424 HydrophobicContact CD2-CG2 3.98Å; W385-I424 HydrophobicContact CB-CB 4Å; W385-I424 HydrophobicContact CB-CG2 3.56Å; W385-I424 HydrophobicContact CD2-CB 4.22Å; W385-I424 HydrophobicContact CG-CB 3.87Å; W385-I424 HydrophobicContact CG-CG2 3.82Å; H415-I424 WeakPolarHBondContact CD2-CD1 3.47Å; L418-I424 HydrophobicContact CB-CD1 3.95Å; L418-I424 HydrophobicContact CB-CG1 3.9Å; L418-I424 HydrophobicContact CB-CG2 4.26Å; L418-I424 PolarHBondContact O-N 3.13Å; L418-I424 VanDerWaalsContact O-N 3.15Å; E419-I424 HydrophobicContact CB-CD1 4.34Å; E419-I424 HydrophobicContact CB-CG1 4.03Å; I424-F426 PolarHBondContact O-N 3.06Å
425	N	90.3	Very high	81.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	59.8	17.6	175	-64.2	-21.1	0	0	0	114.5	W385 Y392 L393 E419 N427 C428 A431 Y433	W385-N425 VanDerWaalsContact CH2-CA 3.43Å; W385-N425 WeakPolarHBondContact CZ3-OD1 3.47Å; Y392-N425 HydrophobicContact CD2-CB 3.76Å; Y392-N425 VanDerWaalsContact CD2-CG 3.41Å; Y392-N425 WeakPolarHBondContact CD2-ND2 3.14Å; Y392-N425 HydrophobicContact CE2-CB 3.9Å; Y392-N425 WeakPolarHBondContact CE2-ND2 3.43Å; L393-N425 WeakPolarHBondContact CA-OD1 3.47Å; L393-N425 WeakPolarHBondContact CB-OD1 3.07Å; L393-N425 PolarHBondContact N-OD1 3.42Å; L393-N425 PolarHBondContact O-ND2 2.83Å; E419-N425 HydrophobicContact CG-CB 4.36Å; E419-N425 PolarHBondContact OE2-ND2 3.42Å; N425-N427 PolarHBondContact O-N 3.01Å; N425-C428 HydrophobicContact CB-CB 4.47Å; N425-C428 WeakPolarHBondContact O-CB 3.05Å; N425-C428 PolarHBondContact O-N 3.25Å; N425-C428 VanDerWaalsContact O-N 3.11Å; N425-A431 HydrophobicContact CB-CB 4.16Å; N425-Y433 PolarHBondContact O-OH 2.97Å
426	F	86.6	Confident	79.5	Confident	24 Å²	24	50.8 Å²	50.8	11%	0.105	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	133.5	174.2	-168.7	-95.8	0	0	0	111.1	P340 Q342 E343 W385 I424 C428 Y433	P340-F426 HydrophobicContact CB-CE2 4.33Å; P340-F426 HydrophobicContact CG-CD2 4.44Å; P340-F426 HydrophobicContact CG-CE2 4.41Å; P340-F426 WeakPolarHBondContact O-CE2 3.47Å; Q342-F426 VanDerWaalsContact C-CZ 3.41Å; Q342-F426 VanDerWaalsContact CA-CZ 3.47Å; Q342-F426 WeakPolarHBondContact O-CE2 3.22Å; E343-F426 HydrophobicContact CB-CB 4.01Å; E343-F426 HydrophobicContact CB-CD1 3.71Å; E343-F426 HydrophobicContact CB-CD2 4.21Å; E343-F426 HydrophobicContact CB-CE1 4.25Å; E343-F426 HydrophobicContact CB-CG 3.69Å; E343-F426 HydrophobicContact CG-CB 4.02Å; E343-F426 HydrophobicContact CG-CG 4.26Å; W385-F426 HydrophobicContact CZ2-CB 4.38Å; I424-F426 PolarHBondContact O-N 3.06Å; F426-C428 PolarHBondContact O-N 3.5Å; F426-Y433 WeakPolarHBondContact CA-OH 3.42Å
427	N	80.5	Confident	77.3	Confident	138 Å²	138	54 Å²	54	74%	0.738	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	22.9	-171.5	-67.3	-10	0	0	0	115.5	N425	N425-N427 PolarHBondContact O-N 3.01Å
428	C	82.2	Confident	75.1	Confident	9 Å²	9	58 Å²	58	6%	0.061	30%	0.297	C	S	.	.			trans	-93.1	125.5	164.3	-62.6	0	0	0	0	110.5	P390 Y392 N425 F426 Q430 A431	P390-C428 PolarHBondContact O-SG 2.76Å; P390-C428 VanDerWaalsContact O-SG 3.36Å; Y392-C428 HydrophobicContact CD2-CB 3.75Å; Y392-C428 HydrophobicContact CG-CB 4.39Å; N425-C428 HydrophobicContact CB-CB 4.47Å; N425-C428 WeakPolarHBondContact O-CB 3.05Å; N425-C428 PolarHBondContact O-N 3.25Å; N425-C428 VanDerWaalsContact O-N 3.11Å; F426-C428 PolarHBondContact O-N 3.5Å; C428-Q430 PolarHBondContact O-N 3Å; C428-A431 WeakPolarHBondContact O-CB 3.18Å; C428-A431 PolarHBondContact O-N 3.44Å
429	E	75.9	Confident	72.6	Confident	182 Å²	182	63.4 Å²	63.4	85%	0.85	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-19.4	177.2	-57.7	167.5	164.3	0	0	113.9
430	Q	81.9	Confident	70.1	Confident	102 Å²	102	66.8 Å²	66.8	48%	0.477	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-5.6	-178.5	-53.6	78.6	26.7	0	0	113.4	Y392 C428	Y392-Q430 HydrophobicContact CD1-CB 4.2Å; Y392-Q430 HydrophobicContact CD2-CB 3.92Å; Y392-Q430 HydrophobicContact CE1-CB 4.28Å; Y392-Q430 HydrophobicContact CE2-CB 4.01Å; Y392-Q430 HydrophobicContact CG-CB 4.01Å; C428-Q430 PolarHBondContact O-N 3Å
431	A	78.4	Confident	68.2	Low	14 Å²	14	71 Å²	71	12%	0.116	36%	0.36	C	S	.	.			trans	-79.8	146.7	178.9	0	0	0	0	0	112.1	Y392 E419 N425 C428 Y433	Y392-A431 HydrophobicContact CE2-CB 4.37Å; E419-A431 HydrophobicContact CG-CB 4.46Å; N425-A431 HydrophobicContact CB-CB 4.16Å; C428-A431 WeakPolarHBondContact O-CB 3.18Å; C428-A431 PolarHBondContact O-N 3.44Å; A431-Y433 HydrophobicContact CB-CE1 4.08Å; A431-Y433 HydrophobicContact CB-CE2 3.94Å; A431-Y433 WeakPolarHBondContact CB-OH 3.43Å
432	V	73.4	Confident	66.4	Low	89 Å²	89	74.1 Å²	74.1	54%	0.539	38%	0.381	S	S	.	.			trans	-129.7	90.3	-175.6	-175.1	0	0	0	0	110.4	L420	L420-V432 WeakPolarHBondContact CD2-O 3.48Å
433	Y	67.7	Low	63.9	Low	45 Å²	45	83.6 Å²	83.6	18%	0.176	42%	0.423	C	S	.	.			trans	-74.6	-29.5	-174.8	-52.9	-71.3	0	0	0	114	A339 P340 E419 L420 N425 F426 A431 R435	A339-Y433 HydrophobicContact CB-CD2 4.16Å; A339-Y433 HydrophobicContact CB-CG 4.23Å; P340-Y433 HydrophobicContact CG-CD1 3.65Å; P340-Y433 HydrophobicContact CG-CE1 3.84Å; P340-Y433 HydrophobicContact CG-CG 4.19Å; E419-Y433 VanDerWaalsContact O-CD1 3.23Å; E419-Y433 WeakPolarHBondContact O-CD1 3.45Å; E419-Y433 VanDerWaalsContact O-CE1 3.23Å; E419-Y433 WeakPolarHBondContact O-CE1 3.46Å; L420-Y433 WeakPolarHBondContact CD2-O 3.23Å; N425-Y433 PolarHBondContact O-OH 2.97Å; F426-Y433 WeakPolarHBondContact CA-OH 3.42Å; A431-Y433 HydrophobicContact CB-CE1 4.08Å; A431-Y433 HydrophobicContact CB-CE2 3.94Å; A431-Y433 WeakPolarHBondContact CB-OH 3.43Å; Y433-R435 PolarHBondContact O-N 3.32Å
434	N	57.7	Low	62.1	Low	96 Å²	96	89.8 Å²	89.8	51%	0.513	46%	0.462	S	S	.	.			trans	-86.7	99.2	-176.5	-65.9	37.4	0	0	0	110.9
435	R	53	Low	59.5	Low	115 Å²	115	99.2 Å²	99.2	43%	0.434	50%	0.504	S	S	.	.			trans	-132.1	131.6	170	-172.8	173.8	-118.2	128.4	6.1	110.8	L420 Y433 K437 M463	L420-R435 HydrophobicContact CD1-CB 4.41Å; L420-R435 HydrophobicContact CD2-CB 3.73Å; Y433-R435 PolarHBondContact O-N 3.32Å; R435-K437 PolarHBondContact O-N 3.35Å; R435-M463 PolarHBondContact NH2-O 2.82Å
436	P	46.7	Very low	57.4	Low	75 Å²	75	109.3 Å²	109.3	49%	0.487	55%	0.55	S	S	.	*			trans	-55.8	135.3	179.9	-27.2	34.7	0	0	0	113.4	M463	P436-M463 HydrophobicContact CG-CG 4.31Å
437	K	42.8	Very low	55.6	Low	101 Å²	101	111.7 Å²	111.7	44%	0.439	58%	0.582	S	S	.	*			trans	-51.9	136.5	171.1	-74.7	171.8	169.9	165	0	110.3	V334 E335 L337 R435	V334-K437 HydrophobicContact CG1-CD 4.47Å; E335-K437 PolarHBondContact O-NZ 3.1Å; L337-K437 HydrophobicContact CD1-CG 4.22Å; R435-K437 PolarHBondContact O-N 3.35Å
438	V	45.6	Very low	53.9	Low	114 Å²	114	112.2 Å²	112.2	69%	0.691	58%	0.578	S	S	*	*			trans	-86.2	109.3	166	178.3	0	0	0	0	106.6
439	V	37.7	Very low	52.3	Low	113 Å²	113	116 Å²	116	69%	0.685	60%	0.597	S	S	*	*			trans	-66.6	137.1	-179.7	-173.9	0	0	0	0	109.9
440	D	37.7	Very low	50.9	Low	86 Å²	86	113.3 Å²	113.3	46%	0.46	59%	0.593	S	S	.	*			trans	-72.9	156.8	-175.8	-165.7	10.5	0	0	0	112.7	Q357 T442	Q357-D440 PolarHBondContact NE2-OD2 3.45Å; D440-T442 WeakPolarHBondContact OD2-CG2 3.41Å
441	R	44.2	Very low	49.2	Very low	137 Å²	137	114.3 Å²	114.3	52%	0.517	60%	0.601	S	S	.	*			trans	-124.5	68.9	-172.8	-80.1	-171.5	142.4	-143.9	-10.1	112.1	D449 E452	R441-D449 IonicContact CZ-OD1 2.67Å; R441-D449 IonicContact NH1-OD1 3.01Å; R441-D449 PolarHBondContact NH1-OD1 3.01Å; R441-D449 IonicContact NH2-OD1 3.45Å; R441-D449 PolarHBondContact NH2-OD1 3.09Å; R441-E452 IonicContact NH2-OE2 3.11Å
442	T	47.9	Very low	47.7	Very low	112 Å²	112	117.4 Å²	117.4	69%	0.687	61%	0.613	S	S	*	*			trans	-115.4	24.5	-170.9	43.3	0	0	0	0	115.9	D440	D440-T442 WeakPolarHBondContact OD2-CG2 3.41Å
443	K	33.7	Very low	46.6	Very low	200 Å²	200	115.2 Å²	115.2	87%	0.87	60%	0.604	S	S	*	*			trans	-135.3	126.8	166.2	-68.9	-179.6	-176.1	167	0	112.1
444	P	49.5	Very low	45.6	Very low	133 Å²	133	120.7 Å²	120.7	86%	0.864	63%	0.626	S	S	*	*			trans	-86	115.4	178.3	32.3	-32.1	0	0	0	112.1
445	K	35.5	Very low	45.1	Very low	199 Å²	199	121.7 Å²	121.7	87%	0.865	63%	0.627	S	S	*	*			trans	-139.2	107.2	164.4	-103.6	178.9	177.5	174.7	0	110.1	G447	K445-G447 PolarHBondContact O-N 3.07Å
446	E	47.7	Very low	44.7	Very low	211 Å²	211	119.4 Å²	119.4	99%	0.986	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	129.7	177.6	-60.5	-177.2	129.5	0	0	110.4
447	G	47.9	Very low	44.8	Very low	74 Å²	74	117.9 Å²	117.9	76%	0.763	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	134.9	-39.8	173.6	0	0	0	0	0	115.8	K445	K445-G447 PolarHBondContact O-N 3.07Å
448	K	43.7	Very low	44.8	Very low	149 Å²	149	118.8 Å²	118.8	65%	0.648	62%	0.623	S	S	*	*	S	Bend	trans	-86	-18.8	-179	-75.6	-164.7	177	-175.7	0	115.1	V450 L451 E452	K448-V450 PolarHBondContact O-N 2.91Å; K448-L451 PolarHBondContact O-N 3.39Å; K448-E452 WeakPolarHBondContact CB-OE1 3.27Å; K448-E452 WeakPolarHBondContact CD-OE1 3.27Å; K448-E452 PolarHBondContact O-N 2.82Å
449	D	49.8	Very low	44.7	Very low	88 Å²	88	122 Å²	122	47%	0.471	62%	0.622	S	S	.	*	H	α-helix	trans	-55.6	-29.6	-166.6	-167.3	38.8	0	0	0	114.6	R441 A453	R441-D449 IonicContact CZ-OD1 2.67Å; R441-D449 IonicContact NH1-OD1 3.01Å; R441-D449 PolarHBondContact NH1-OD1 3.01Å; R441-D449 IonicContact NH2-OD1 3.45Å; R441-D449 PolarHBondContact NH2-OD1 3.09Å; D449-A453 WeakPolarHBondContact O-CB 3.37Å; D449-A453 PolarHBondContact O-N 3.5Å
450	V	46	Very low	44.8	Very low	127 Å²	127	121.8 Å²	121.8	77%	0.77	62%	0.617	S	S	*	*	H	α-helix	trans	-67.2	-40.7	178.2	-178.1	0	0	0	0	112.5	K448 Y454	K448-V450 PolarHBondContact O-N 2.91Å; V450-Y454 WeakPolarHBondContact O-CB 3.48Å; V450-Y454 PolarHBondContact O-N 3.21Å
451	L	45.9	Very low	45.1	Very low	122 Å²	122	122.6 Å²	122.6	64%	0.639	62%	0.618	S	S	*	*	H	α-helix	trans	-81.2	-38.6	-176.4	-145.3	75.2	0	0	0	111.1	K448 Y454 Q455	K448-L451 PolarHBondContact O-N 3.39Å; L451-Y454 WeakPolarHBondContact O-CB 3.19Å; L451-Y454 PolarHBondContact O-N 3.27Å; L451-Q455 WeakPolarHBondContact O-CG 3.45Å; L451-Q455 PolarHBondContact O-N 2.87Å
452	E	48.3	Very low	45.1	Very low	80 Å²	80	120.2 Å²	120.2	37%	0.374	62%	0.622	S	S	.	*	H	α-helix	trans	-70.1	-38.5	175.3	-71.2	170.1	-167.1	0	0	111.9	R441 K448 Y454 Q455 L456	R441-E452 IonicContact NH2-OE2 3.11Å; K448-E452 WeakPolarHBondContact CB-OE1 3.27Å; K448-E452 WeakPolarHBondContact CD-OE1 3.27Å; K448-E452 PolarHBondContact O-N 2.82Å; E452-Y454 VanDerWaalsContact C-N 3.27Å; E452-Y454 PolarHBondContact O-N 2.9Å; E452-Q455 PolarHBondContact O-N 2.89Å; E452-L456 WeakPolarHBondContact O-CB 3.39Å; E452-L456 PolarHBondContact O-N 3.01Å
453	A	49.9	Very low	44.5	Very low	42 Å²	42	118.5 Å²	118.5	35%	0.347	61%	0.608	S	S	.	*	H	α-helix	trans	-65.3	-31	171.5	0	0	0	0	0	112.2	D449 A457	D449-A453 WeakPolarHBondContact O-CB 3.37Å; D449-A453 PolarHBondContact O-N 3.5Å; A453-A457 WeakPolarHBondContact O-CB 3.37Å; A453-A457 PolarHBondContact O-N 3.41Å
454	Y	46.2	Very low	44.7	Very low	161 Å²	161	117.6 Å²	117.6	63%	0.631	60%	0.599	S	S	*	*	H	α-helix	trans	-66.9	-49.9	173.2	-167.4	-89	0	0	0	111.1	V450 L451 E452 L456 A457 Q458	V450-Y454 WeakPolarHBondContact O-CB 3.48Å; V450-Y454 PolarHBondContact O-N 3.21Å; L451-Y454 WeakPolarHBondContact O-CB 3.19Å; L451-Y454 PolarHBondContact O-N 3.27Å; E452-Y454 VanDerWaalsContact C-N 3.27Å; E452-Y454 PolarHBondContact O-N 2.9Å; Y454-L456 PolarHBondContact O-N 2.99Å; Y454-A457 PolarHBondContact O-N 3.19Å; Y454-Q458 WeakPolarHBondContact O-CB 3.22Å; Y454-Q458 PolarHBondContact O-N 2.56Å
455	Q	48.4	Very low	44.2	Very low	116 Å²	116	119 Å²	119	54%	0.542	61%	0.605	S	S	.	*	H	α-helix	trans	-63.8	-40.3	177	-70.1	176.6	-5.7	0	0	112.5	L451 E452 Q458 R459	L451-Q455 WeakPolarHBondContact O-CG 3.45Å; L451-Q455 PolarHBondContact O-N 2.87Å; E452-Q455 PolarHBondContact O-N 2.89Å; Q455-Q458 WeakPolarHBondContact O-CB 3.34Å; Q455-Q458 PolarHBondContact O-N 3.28Å; Q455-R459 PolarHBondContact O-N 2.8Å
456	L	43.5	Very low	44.5	Very low	68 Å²	68	119.4 Å²	119.4	36%	0.356	60%	0.601	S	S	.	*	H	α-helix	trans	-65.2	-41.5	174.5	-176.8	61.8	0	0	0	111.4	E452 Y454 Q458 R459 L460	E452-L456 WeakPolarHBondContact O-CB 3.39Å; E452-L456 PolarHBondContact O-N 3.01Å; Y454-L456 PolarHBondContact O-N 2.99Å; L456-Q458 VanDerWaalsContact C-N 3.27Å; L456-Q458 PolarHBondContact O-N 2.56Å; L456-R459 PolarHBondContact O-N 2.89Å; L456-L460 HydrophobicContact CD1-CD1 4.27Å; L456-L460 HydrophobicContact CD1-CG 4.45Å; L456-L460 HydrophobicContact CG-CD1 4.1Å; L456-L460 WeakPolarHBondContact O-CB 3.43Å; L456-L460 VanDerWaalsContact O-CG 3.31Å; L456-L460 WeakPolarHBondContact O-CG 3.3Å; L456-L460 PolarHBondContact O-N 2.8Å
457	A	49	Very low	44.3	Very low	43 Å²	43	116 Å²	116	36%	0.355	58%	0.583	S	S	.	*	H	α-helix	trans	-65.1	-30.7	173.1	0	0	0	0	0	112.4	A453 Y454 Q461	A453-A457 WeakPolarHBondContact O-CB 3.37Å; A453-A457 PolarHBondContact O-N 3.41Å; Y454-A457 PolarHBondContact O-N 3.19Å; A457-Q461 WeakPolarHBondContact O-CB 3.21Å; A457-Q461 WeakPolarHBondContact O-CG 3.42Å; A457-Q461 PolarHBondContact O-N 3.01Å; A457-Q461 PolarHBondContact O-NE2 2.89Å
458	Q	43.6	Very low	44.3	Very low	120 Å²	120	121 Å²	121	56%	0.561	58%	0.579	S	S	*	*	H	α-helix	trans	-71.9	-46.3	175.3	-163.3	172.5	8.1	0	0	111.1	Y454 Q455 L456 L460 Q461 S462	Y454-Q458 WeakPolarHBondContact O-CB 3.22Å; Y454-Q458 PolarHBondContact O-N 2.56Å; Q455-Q458 WeakPolarHBondContact O-CB 3.34Å; Q455-Q458 PolarHBondContact O-N 3.28Å; L456-Q458 VanDerWaalsContact C-N 3.27Å; L456-Q458 PolarHBondContact O-N 2.56Å; Q458-L460 PolarHBondContact O-N 3.02Å; Q458-Q461 PolarHBondContact O-N 3.44Å; Q458-Q461 VanDerWaalsContact O-N 3.1Å; Q458-S462 PolarHBondContact O-N 3.45Å
459	R	42.1	Very low	44.7	Very low	180 Å²	180	121 Å²	121	68%	0.679	58%	0.575	S	S	*	*	H	α-helix	trans	-61.7	-38.2	173.3	-115.6	174.7	178.6	158.3	-1.9	112.7	Q455 L456 Q461 S462	Q455-R459 PolarHBondContact O-N 2.8Å; L456-R459 PolarHBondContact O-N 2.89Å; R459-Q461 VanDerWaalsContact C-N 3.26Å; R459-Q461 PolarHBondContact O-N 3.29Å; R459-S462 PolarHBondContact O-OG 2.91Å
460	L	41.3	Very low	45.4	Very low	109 Å²	109	119.5 Å²	119.5	57%	0.571	57%	0.568	S	S	*	*	H	α-helix	trans	-74.8	-11.8	175.3	-70.9	171.3	0	0	0	114	L456 Q458	L456-L460 HydrophobicContact CD1-CD1 4.27Å; L456-L460 HydrophobicContact CD1-CG 4.45Å; L456-L460 HydrophobicContact CG-CD1 4.1Å; L456-L460 WeakPolarHBondContact O-CB 3.43Å; L456-L460 VanDerWaalsContact O-CG 3.31Å; L456-L460 WeakPolarHBondContact O-CG 3.3Å; L456-L460 PolarHBondContact O-N 2.8Å; Q458-L460 PolarHBondContact O-N 3.02Å
461	Q	43.4	Very low	45.8	Very low	103 Å²	103	120.3 Å²	120.3	48%	0.481	56%	0.558	S	S	.	*	H	α-helix	trans	-88.5	-28.4	174	-82.6	171.9	88.2	0	0	113.3	A457 Q458 R459	A457-Q461 WeakPolarHBondContact O-CB 3.21Å; A457-Q461 WeakPolarHBondContact O-CG 3.42Å; A457-Q461 PolarHBondContact O-N 3.01Å; A457-Q461 PolarHBondContact O-NE2 2.89Å; Q458-Q461 PolarHBondContact O-N 3.44Å; Q458-Q461 VanDerWaalsContact O-N 3.1Å; R459-Q461 VanDerWaalsContact C-N 3.26Å; R459-Q461 PolarHBondContact O-N 3.29Å
462	S	43.2	Very low	46.7	Very low	87 Å²	87	116.1 Å²	116.1	61%	0.608	54%	0.536	S	S	*	.	H	α-helix	trans	-70.6	-42.8	178.4	60.7	0	0	0	0	112.6	Q458 R459 R464	Q458-S462 PolarHBondContact O-N 3.45Å; R459-S462 PolarHBondContact O-OG 2.91Å; S462-R464 PolarHBondContact O-N 2.93Å; S462-R464 VanDerWaalsContact O-N 3.13Å
463	M	36.5	Very low	46.6	Very low	77 Å²	77	119.4 Å²	119.4	38%	0.379	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.8	31.1	-175.9	-65.2	-60.9	-74	0	0	114.7	R435 P436	R435-M463 PolarHBondContact NH2-O 2.82Å; P436-M463 HydrophobicContact CG-CG 4.31Å
464	R	38.6	Very low	46.4	Very low	180 Å²	180	127.2 Å²	127.2	68%	0.679	58%	0.575	S	S	*	*			trans	-136.5	106.9	173.3	-171	179.4	-169.9	167.2	4	111.3	S462 R466	S462-R464 PolarHBondContact O-N 2.93Å; S462-R464 VanDerWaalsContact O-N 3.13Å; R464-R466 PolarHBondContact O-N 3.29Å
465	T	37.2	Very low	47	Very low	163 Å²	163	120.4 Å²	120.4	100%	1	55%	0.554	S	S	*	*	S	Bend	trans	-70.8	41.1	175.4	46.2	0	0	0	0	114.2
466	R	43.5	Very low	47.4	Very low	207 Å²	207	119.6 Å²	119.6	78%	0.781	55%	0.554	S	S	*	*	S	Bend	trans	-143.7	97.2	167.3	-158.4	175.7	-146.2	-114.3	3.6	108.8	R464 R468	R464-R466 PolarHBondContact O-N 3.29Å; R466-R468 PolarHBondContact O-N 3.19Å
467	K	42.3	Very low	47.9	Very low	140 Å²	140	123.4 Å²	123.4	61%	0.609	56%	0.563	S	S	*	*			trans	-48.6	132.7	-176.8	-57.8	-173	-169.5	179.6	0	111.2	D479	K467-D479 WeakPolarHBondContact CD-OD1 3.46Å; K467-D479 WeakPolarHBondContact CD-OD2 3.4Å; K467-D479 WeakPolarHBondContact CE-OD2 3.42Å; K467-D479 IonicContact NZ-OD2 2.85Å; K467-D479 PolarHBondContact NZ-OD2 3.45Å
468	R	47.4	Very low	48.7	Very low	179 Å²	179	123 Å²	123	68%	0.675	56%	0.558	S	S	*	*			trans	-85.1	111.6	170	175.3	179.3	170.5	178.6	-5.1	108.5	R466	R466-R468 PolarHBondContact O-N 3.19Å
469	R	53.8	Low	49.7	Very low	150 Å²	150	118.8 Å²	118.8	57%	0.566	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	145.2	167.2	-63.1	-177.8	-174.6	-176.4	3.4	110.6	W477 C478	R469-W477 HydrophobicContact CB-CB 3.85Å; R469-W477 HydrophobicContact CB-CE3 4.18Å; R469-W477 WeakPolarHBondContact CD-O 3.36Å; R469-W477 WeakPolarHBondContact O-CZ3 3.31Å; R469-C478 CarbonylContact C-O 3.47Å; R469-C478 WeakPolarHBondContact CA-O 3.37Å; R469-C478 VanDerWaalsContact CB-O 3.23Å; R469-C478 WeakPolarHBondContact CB-O 3.44Å
470	V	63.4	Low	50.2	Low	55 Å²	55	112.2 Å²	112.2	33%	0.333	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	153.6	176.1	179.6	0	0	0	0	108	W477 C478 A480	V470-W477 CarbonylContact O-C 3.52Å; V470-W477 WeakPolarHBondContact O-CA 3.42Å; V470-C478 PolarHBondContact N-O 3.23Å; V470-C478 PolarHBondContact O-N 3.13Å; V470-A480 HydrophobicContact CG2-CB 3.97Å
471	R	55	Low	50.9	Low	144 Å²	144	115.9 Å²	115.9	54%	0.543	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.6	171	-76.5	-168.1	-176.5	-128	11.9	111	G475 N476 W477	R471-G475 VanDerWaalsContact CD-O 3.28Å; R471-G475 WeakPolarHBondContact CD-O 3.31Å; R471-G475 PolarHBondContact NH1-O 2.93Å; R471-N476 CarbonylContact C-O 3.59Å; R471-N476 VanDerWaalsContact CA-O 3.23Å; R471-N476 WeakPolarHBondContact CA-O 3.09Å; R471-W477 HydrophobicContact CG-CD2 3.82Å; R471-W477 HydrophobicContact CG-CE3 3.71Å; R471-W477 HydrophobicContact CG-CH2 4.14Å; R471-W477 HydrophobicContact CG-CZ2 4.23Å; R471-W477 HydrophobicContact CG-CZ3 3.88Å
472	D	63.6	Low	51.5	Low	34 Å²	34	116.6 Å²	116.6	18%	0.182	54%	0.537	C	S	.	.			trans	-68.4	179.4	168	72.4	11.7	0	0	0	111.7	W474 G475 N476	D472-W474 HydrophobicContact CB-CE3 4.36Å; D472-W474 PolarHBondContact O-N 3.44Å; D472-W474 VanDerWaalsContact OD1-C 3.32Å; D472-W474 WeakPolarHBondContact OD1-CA 3.35Å; D472-W474 PolarHBondContact OD1-N 2.85Å; D472-G475 PolarHBondContact O-N 2.83Å; D472-G475 VanDerWaalsContact O-N 3.13Å; D472-G475 PolarHBondContact OD1-N 2.9Å; D472-N476 PolarHBondContact N-O 2.8Å; D472-N476 PolarHBondContact OD1-N 3.16Å; D472-N476 WeakPolarHBondContact OD2-CB 3.2Å; D472-N476 PolarHBondContact OD2-ND2 2.71Å
473	I	46.1	Very low	52	Low	150 Å²	150	117.2 Å²	117.2	77%	0.769	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-8.6	-179.4	62.8	175.1	0	0	0	114.3
474	W	47.2	Very low	52.7	Low	205 Å²	205	121 Å²	121	78%	0.777	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-11.1	173.3	-59.5	-79.7	0	0	0	112.5	D472	D472-W474 HydrophobicContact CB-CE3 4.36Å; D472-W474 PolarHBondContact O-N 3.44Å; D472-W474 VanDerWaalsContact OD1-C 3.32Å; D472-W474 WeakPolarHBondContact OD1-CA 3.35Å; D472-W474 PolarHBondContact OD1-N 2.85Å
475	G	58.1	Low	53.3	Low	19 Å²	19	116 Å²	116	20%	0.196	55%	0.553	C	S	.	*	S	Bend	trans	101.7	6.4	176.2	0	0	0	0	0	115.3	R471 D472	R471-G475 VanDerWaalsContact CD-O 3.28Å; R471-G475 WeakPolarHBondContact CD-O 3.31Å; R471-G475 PolarHBondContact NH1-O 2.93Å; D472-G475 PolarHBondContact O-N 2.83Å; D472-G475 VanDerWaalsContact O-N 3.13Å; D472-G475 PolarHBondContact OD1-N 2.9Å
476	N	57.1	Low	53.5	Low	99 Å²	99	115.9 Å²	115.9	53%	0.529	54%	0.541	S	S	.	.			trans	-84.5	151.4	-178.8	-56	-50.4	0	0	0	112	R471 D472 C478	R471-N476 CarbonylContact C-O 3.59Å; R471-N476 VanDerWaalsContact CA-O 3.23Å; R471-N476 WeakPolarHBondContact CA-O 3.09Å; D472-N476 PolarHBondContact N-O 2.8Å; D472-N476 PolarHBondContact OD1-N 3.16Å; D472-N476 WeakPolarHBondContact OD2-CB 3.2Å; D472-N476 PolarHBondContact OD2-ND2 2.71Å; N476-C478 PolarHBondContact O-N 2.9Å
477	W	54.8	Low	53.1	Low	147 Å²	147	112.5 Å²	112.5	56%	0.557	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	99.7	-176.1	-67.1	109.9	0	0	0	112.1	R469 V470 R471	R469-W477 HydrophobicContact CB-CB 3.85Å; R469-W477 HydrophobicContact CB-CE3 4.18Å; R469-W477 WeakPolarHBondContact CD-O 3.36Å; R469-W477 WeakPolarHBondContact O-CZ3 3.31Å; V470-W477 CarbonylContact O-C 3.52Å; V470-W477 WeakPolarHBondContact O-CA 3.42Å; R471-W477 HydrophobicContact CG-CD2 3.82Å; R471-W477 HydrophobicContact CG-CE3 3.71Å; R471-W477 HydrophobicContact CG-CH2 4.14Å; R471-W477 HydrophobicContact CG-CZ2 4.23Å; R471-W477 HydrophobicContact CG-CZ3 3.88Å
478	C	64.5	Low	52.9	Low	36 Å²	36	115.1 Å²	115.1	24%	0.243	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.3	162.3	177.1	-56.3	0	0	0	0	111.8	R469 V470 N476	R469-C478 CarbonylContact C-O 3.47Å; R469-C478 WeakPolarHBondContact CA-O 3.37Å; R469-C478 VanDerWaalsContact CB-O 3.23Å; R469-C478 WeakPolarHBondContact CB-O 3.44Å; V470-C478 PolarHBondContact N-O 3.23Å; V470-C478 PolarHBondContact O-N 3.13Å; N476-C478 PolarHBondContact O-N 2.9Å
479	D	64.4	Low	52.9	Low	30 Å²	30	114.2 Å²	114.2	16%	0.16	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.9	145.4	170.8	-89.9	-19.3	0	0	0	110	K467 R481 D482	K467-D479 WeakPolarHBondContact CD-OD1 3.46Å; K467-D479 WeakPolarHBondContact CD-OD2 3.4Å; K467-D479 WeakPolarHBondContact CE-OD2 3.42Å; K467-D479 IonicContact NZ-OD2 2.85Å; K467-D479 PolarHBondContact NZ-OD2 3.45Å; D479-R481 PolarHBondContact O-N 2.69Å; D479-R481 VanDerWaalsContact O-N 3.12Å; D479-D482 WeakPolarHBondContact CB-OD2 3.34Å; D479-D482 PolarHBondContact N-OD2 3Å; D479-D482 WeakPolarHBondContact O-CB 3.36Å; D479-D482 PolarHBondContact O-N 2.91Å
480	A	53.3	Low	52.3	Low	42 Å²	42	116.1 Å²	116.1	35%	0.347	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-60.8	-27.4	-172.8	0	0	0	0	0	114.3	V470 D482 L483	V470-A480 HydrophobicContact CG2-CB 3.97Å; A480-D482 VanDerWaalsContact C-N 3.29Å; A480-D482 PolarHBondContact O-N 2.92Å; A480-L483 PolarHBondContact O-N 2.86Å
481	R	55.5	Low	51.7	Low	187 Å²	187	116.5 Å²	116.5	71%	0.706	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-73.8	-16.3	177.5	-81.6	-177.7	-82.8	179.7	-9.2	113.7	D479 L483 E484	D479-R481 PolarHBondContact O-N 2.69Å; D479-R481 VanDerWaalsContact O-N 3.12Å; R481-L483 PolarHBondContact O-N 2.68Å; R481-E484 PolarHBondContact O-N 2.96Å
482	D	55.7	Low	52.2	Low	117 Å²	117	112 Å²	112	63%	0.626	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-72.2	-8.3	176	-49.6	-31.9	0	0	0	111.9	D479 A480	D479-D482 WeakPolarHBondContact CB-OD2 3.34Å; D479-D482 PolarHBondContact N-OD2 3Å; D479-D482 WeakPolarHBondContact O-CB 3.36Å; D479-D482 PolarHBondContact O-N 2.91Å; A480-D482 VanDerWaalsContact C-N 3.29Å; A480-D482 PolarHBondContact O-N 2.92Å
483	L	54.8	Low	51.6	Low	100 Å²	100	114.6 Å²	114.6	52%	0.524	59%	0.587	S	S	.	*	S	Bend	trans	-106	-18.8	177.4	-60.9	172.9	0	0	0	113.2	A480 R481 G485	A480-L483 PolarHBondContact O-N 2.86Å; R481-L483 PolarHBondContact O-N 2.68Å; L483-G485 PolarHBondContact O-N 2.78Å
484	E	50.7	Low	52.2	Low	158 Å²	158	114.1 Å²	114.1	74%	0.738	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	97	178.7	-71.9	-175.7	141.6	0	0	110	R481	R481-E484 PolarHBondContact O-N 2.96Å
485	G	50.3	Low	52.6	Low	73 Å²	73	108.4 Å²	108.4	75%	0.753	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	161.4	-14.8	-176.4	0	0	0	0	0	114.1	L483 T487	L483-G485 PolarHBondContact O-N 2.78Å; G485-T487 PolarHBondContact O-N 2.82Å
486	Q	42.5	Very low	52.7	Low	161 Å²	161	111.4 Å²	111.4	75%	0.752	57%	0.574	S	S	*	*			trans	-78.3	111.8	167.3	-66.3	-173	2.1	0	0	109.7	Y488	Q486-Y488 PolarHBondContact O-N 3.13Å; Q486-Y488 VanDerWaalsContact O-N 3.16Å
487	T	34.2	Very low	53.1	Low	136 Å²	136	109.1 Å²	109.1	83%	0.834	57%	0.569	S	S	*	*			trans	-62	115.3	167.7	-60.9	0	0	0	0	108	G485 E489	G485-T487 PolarHBondContact O-N 2.82Å; T487-E489 PolarHBondContact O-N 3.47Å; T487-E489 VanDerWaalsContact O-N 3.16Å
488	Y	39.5	Very low	53.5	Low	196 Å²	196	107.9 Å²	107.9	77%	0.769	57%	0.569	S	S	*	*			trans	-70	109.5	174.3	-90.6	-98.6	0	0	0	109.5	Q486 H490	Q486-Y488 PolarHBondContact O-N 3.13Å; Q486-Y488 VanDerWaalsContact O-N 3.16Å; Y488-H490 PolarHBondContact O-CD2 2.95Å; Y488-H490 PolarHBondContact O-N 3.49Å
489	E	46	Very low	53.3	Low	159 Å²	159	113.4 Å²	113.4	74%	0.743	59%	0.585	S	S	*	*			trans	-59.9	126.3	156.6	-72.3	-170.9	132.2	0	0	108.4	T487 L491	T487-E489 PolarHBondContact O-N 3.47Å; T487-E489 VanDerWaalsContact O-N 3.16Å; E489-L491 HydrophobicContact CB-CG 4.44Å; E489-L491 PolarHBondContact O-N 2.72Å
490	H	41.5	Very low	53.1	Low	190 Å²	190	120.6 Å²	120.6	88%	0.88	61%	0.61	S	S	*	*			trans	-76	66.4	176.3	-76.6	-110.7	0	0	0	110.3	Y488	Y488-H490 PolarHBondContact O-CD2 2.95Å; Y488-H490 PolarHBondContact O-N 3.49Å
491	L	50.8	Low	53.7	Low	63 Å²	63	124 Å²	124	33%	0.33	62%	0.618	S	S	.	*			trans	-55.2	141.8	172.5	-63.4	176.9	0	0	0	110.1	E489 E495	E489-L491 HydrophobicContact CB-CG 4.44Å; E489-L491 PolarHBondContact O-N 2.72Å; L491-E495 HydrophobicContact CB-CB 4.31Å
492	S	66.3	Low	53.9	Low	50 Å²	50	121.3 Å²	121.3	35%	0.35	61%	0.614	S	S	.	*			trans	-64.8	160.9	-174.8	68.4	0	0	0	0	112.5	E494 E495 L496	S492-E494 PolarHBondContact O-N 3.11Å; S492-E494 VanDerWaalsContact O-N 3.13Å; S492-E495 VanDerWaalsContact CB-OE2 3.23Å; S492-E495 WeakPolarHBondContact CB-OE2 3.23Å; S492-E495 PolarHBondContact N-OE2 3.01Å; S492-E495 PolarHBondContact O-N 2.96Å; S492-E495 WeakPolarHBondContact OG-CG 3.4Å; S492-E495 PolarHBondContact OG-N 2.98Å; S492-E495 PolarHBondContact OG-OE2 3.1Å; S492-L496 PolarHBondContact O-N 3.45Å; S492-L496 VanDerWaalsContact O-N 3.1Å
493	A	50.6	Low	53.7	Low	89 Å²	89	122.8 Å²	122.8	74%	0.736	62%	0.619	S	S	*	*	H	α-helix	trans	-58.7	-24.6	174	0	0	0	0	0	112.9	A497	A493-A497 WeakPolarHBondContact O-CB 3.42Å; A493-A497 PolarHBondContact O-N 3.33Å; A493-A497 VanDerWaalsContact O-N 3.14Å
494	E	59	Low	53.5	Low	139 Å²	139	126.2 Å²	126.2	65%	0.65	63%	0.629	S	S	*	*	H	α-helix	trans	-76.3	-43.7	177.7	-170	166.5	-177	0	0	111.9	S492 L496 A497 Q498	S492-E494 PolarHBondContact O-N 3.11Å; S492-E494 VanDerWaalsContact O-N 3.13Å; E494-L496 PolarHBondContact O-N 2.95Å; E494-A497 WeakPolarHBondContact O-CA 3.17Å; E494-A497 WeakPolarHBondContact O-CB 3.13Å; E494-A497 PolarHBondContact O-N 3.49Å; E494-Q498 WeakPolarHBondContact O-CG 3.43Å; E494-Q498 PolarHBondContact O-N 3.04Å
495	E	56.1	Low	53.6	Low	85 Å²	85	126.4 Å²	126.4	40%	0.397	63%	0.628	S	S	.	*	H	α-helix	trans	-65.7	-38.4	175.5	-68.8	159.9	110.8	0	0	111.8	L491 S492 A497 Q498 R499	L491-E495 HydrophobicContact CB-CB 4.31Å; S492-E495 VanDerWaalsContact CB-OE2 3.23Å; S492-E495 WeakPolarHBondContact CB-OE2 3.23Å; S492-E495 PolarHBondContact N-OE2 3.01Å; S492-E495 PolarHBondContact O-N 2.96Å; S492-E495 WeakPolarHBondContact OG-CG 3.4Å; S492-E495 PolarHBondContact OG-N 2.98Å; S492-E495 PolarHBondContact OG-OE2 3.1Å; E495-A497 VanDerWaalsContact C-N 3.28Å; E495-A497 PolarHBondContact O-N 3.3Å; E495-Q498 PolarHBondContact O-N 3.45Å; E495-R499 PolarHBondContact O-N 3.3Å
496	L	59.9	Low	53.2	Low	83 Å²	83	130.1 Å²	130.1	44%	0.435	63%	0.626	S	S	.	*	H	α-helix	trans	-65.2	-29	170.7	-84.8	167.6	0	0	0	112.9	S492 E494 R500	S492-L496 PolarHBondContact O-N 3.45Å; S492-L496 VanDerWaalsContact O-N 3.1Å; E494-L496 PolarHBondContact O-N 2.95Å; L496-R500 WeakPolarHBondContact O-CB 3.08Å; L496-R500 WeakPolarHBondContact O-CD 3.31Å; L496-R500 VanDerWaalsContact O-CG 3.23Å; L496-R500 WeakPolarHBondContact O-CG 3.39Å; L496-R500 PolarHBondContact O-N 3.12Å
497	A	65.1	Low	53.3	Low	50 Å²	50	128.4 Å²	128.4	41%	0.413	63%	0.629	S	S	.	*	H	α-helix	trans	-72.7	-43.5	172.8	0	0	0	0	0	111.6	A493 E494 E495 R500 E501	A493-A497 WeakPolarHBondContact O-CB 3.42Å; A493-A497 PolarHBondContact O-N 3.33Å; A493-A497 VanDerWaalsContact O-N 3.14Å; E494-A497 WeakPolarHBondContact O-CA 3.17Å; E494-A497 WeakPolarHBondContact O-CB 3.13Å; E494-A497 PolarHBondContact O-N 3.49Å; E495-A497 VanDerWaalsContact C-N 3.28Å; E495-A497 PolarHBondContact O-N 3.3Å; A497-R500 WeakPolarHBondContact O-CB 3.43Å; A497-R500 PolarHBondContact O-N 3.21Å; A497-R500 VanDerWaalsContact O-N 3.13Å; A497-E501 PolarHBondContact O-N 3.13Å
498	Q	63.1	Low	53.8	Low	122 Å²	122	131.2 Å²	131.2	57%	0.57	63%	0.629	S	S	*	*	H	α-helix	trans	-61.3	-46.5	177.3	-67.2	-179.9	24.3	0	0	111.9	E494 E495 R500 E501 E502	E494-Q498 WeakPolarHBondContact O-CG 3.43Å; E494-Q498 PolarHBondContact O-N 3.04Å; E495-Q498 PolarHBondContact O-N 3.45Å; Q498-R500 VanDerWaalsContact C-N 3.27Å; Q498-R500 PolarHBondContact O-N 2.94Å; Q498-E501 WeakPolarHBondContact O-CB 3.45Å; Q498-E501 PolarHBondContact O-N 3.24Å; Q498-E501 VanDerWaalsContact O-N 3.13Å; Q498-E502 PolarHBondContact O-N 3.18Å
499	R	60.9	Low	53.8	Low	151 Å²	151	127.8 Å²	127.8	57%	0.57	63%	0.631	S	S	*	*	H	α-helix	trans	-59	-35.7	172.8	-98.1	178.9	168.3	154.2	-2.9	113	E495 E502 M503	E495-R499 PolarHBondContact O-N 3.3Å; R499-E502 PolarHBondContact O-N 2.65Å; R499-M503 WeakPolarHBondContact O-CG 3.39Å; R499-M503 PolarHBondContact O-N 2.96Å
500	R	60.3	Low	53.4	Low	182 Å²	182	123.1 Å²	123.1	69%	0.687	63%	0.626	S	S	*	*	H	α-helix	trans	-71.7	-31.2	176	-78.1	171.4	174.1	170.3	-0.4	113.2	L496 A497 Q498 K504	L496-R500 WeakPolarHBondContact O-CB 3.08Å; L496-R500 WeakPolarHBondContact O-CD 3.31Å; L496-R500 VanDerWaalsContact O-CG 3.23Å; L496-R500 WeakPolarHBondContact O-CG 3.39Å; L496-R500 PolarHBondContact O-N 3.12Å; A497-R500 WeakPolarHBondContact O-CB 3.43Å; A497-R500 PolarHBondContact O-N 3.21Å; A497-R500 VanDerWaalsContact O-N 3.13Å; Q498-R500 VanDerWaalsContact C-N 3.27Å; Q498-R500 PolarHBondContact O-N 2.94Å; R500-K504 WeakPolarHBondContact O-CB 3.09Å; R500-K504 PolarHBondContact O-N 3.12Å
501	E	65.3	Low	53.6	Low	113 Å²	113	124.3 Å²	124.3	53%	0.528	63%	0.628	S	S	.	*	H	α-helix	trans	-69.7	-40.2	169.5	-74.9	-123	125.6	0	0	112	A497 Q498 K504 K505	A497-E501 PolarHBondContact O-N 3.13Å; Q498-E501 WeakPolarHBondContact O-CB 3.45Å; Q498-E501 PolarHBondContact O-N 3.24Å; Q498-E501 VanDerWaalsContact O-N 3.13Å; E501-K504 WeakPolarHBondContact O-CA 3.47Å; E501-K504 WeakPolarHBondContact O-CB 3.15Å; E501-K504 PolarHBondContact O-N 3.12Å; E501-K504 VanDerWaalsContact O-N 3.08Å; E501-K505 PolarHBondContact O-N 2.7Å
502	E	59.5	Low	52.8	Low	131 Å²	131	126.6 Å²	126.6	61%	0.612	65%	0.645	S	S	*	*	H	α-helix	trans	-65.6	-46.6	-179.9	-169.8	164.8	-119.9	0	0	112	Q498 R499 K504 K505	Q498-E502 PolarHBondContact O-N 3.18Å; R499-E502 PolarHBondContact O-N 2.65Å; E502-K504 PolarHBondContact O-N 2.94Å; E502-K504 VanDerWaalsContact O-N 3.17Å; E502-K505 WeakPolarHBondContact O-CB 3.36Å; E502-K505 PolarHBondContact O-N 2.83Å
503	M	50.7	Low	51.3	Low	148 Å²	148	129.6 Å²	129.6	73%	0.729	67%	0.666	S	S	*	*	H	α-helix	trans	-59.4	-25.7	169.9	-71.2	-175.8	178	0	0	113.1	R499 K505	R499-M503 WeakPolarHBondContact O-CG 3.39Å; R499-M503 PolarHBondContact O-N 2.96Å; M503-K505 VanDerWaalsContact C-N 3.32Å
504	K	52	Low	50.8	Low	171 Å²	171	135.4 Å²	135.4	74%	0.743	67%	0.669	S	S	*	*	H	α-helix	trans	-75.5	-19.1	176.5	-128.5	174.5	-177.9	177.9	0	113.4	R500 E501 E502	R500-K504 WeakPolarHBondContact O-CB 3.09Å; R500-K504 PolarHBondContact O-N 3.12Å; E501-K504 WeakPolarHBondContact O-CA 3.47Å; E501-K504 WeakPolarHBondContact O-CB 3.15Å; E501-K504 PolarHBondContact O-N 3.12Å; E501-K504 VanDerWaalsContact O-N 3.08Å; E502-K504 PolarHBondContact O-N 2.94Å; E502-K504 VanDerWaalsContact O-N 3.17Å
505	K	51.5	Low	49.7	Very low	163 Å²	163	139.2 Å²	139.2	71%	0.709	68%	0.679	S	S	*	*	H	α-helix	trans	-85.9	-15.8	178	-68	166.1	-172.4	165.2	0	112.5	E501 E502 M503	E501-K505 PolarHBondContact O-N 2.7Å; E502-K505 WeakPolarHBondContact O-CB 3.36Å; E502-K505 PolarHBondContact O-N 2.83Å; M503-K505 VanDerWaalsContact C-N 3.32Å
506	Q	43.1	Very low	48.9	Very low	150 Å²	150	145.3 Å²	145.3	70%	0.701	70%	0.698	S	S	*	*	S	Bend	trans	-74.1	139.9	172.2	-66.9	-153.7	1.9	0	0	111.9	K508	Q506-K508 PolarHBondContact O-N 2.9Å
507	P	42.9	Very low	48	Very low	126 Å²	126	143.3 Å²	143.3	82%	0.818	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-69.4	127.3	178.3	28.7	-33.7	0	0	0	110.6
508	K	45.8	Very low	47	Very low	195 Å²	195	146.8 Å²	146.8	85%	0.848	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-60.5	138.1	176.1	-65.2	-178.1	-180	-179.3	0	110.2	Q506 G510	Q506-K508 PolarHBondContact O-N 2.9Å; K508-G510 PolarHBondContact O-N 3.47Å; K508-G510 VanDerWaalsContact O-N 3.14Å
509	P	39.5	Very low	47.3	Very low	123 Å²	123	148 Å²	148	80%	0.799	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-59.6	120.6	178.1	23.9	-33.4	0	0	0	110.4
510	G	37.4	Very low	48.2	Very low	62 Å²	62	144.8 Å²	144.8	64%	0.639	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-62	141.3	174.1	0	0	0	0	0	110.3	K508 T512	K508-G510 PolarHBondContact O-N 3.47Å; K508-G510 VanDerWaalsContact O-N 3.14Å; G510-T512 PolarHBondContact O-N 3.1Å
511	K	45.5	Very low	49.3	Very low	215 Å²	215	139.1 Å²	139.1	94%	0.935	70%	0.704	S	S	*	*			trans	-62.1	101.2	176	-73.4	-178.7	177.8	176.7	0	109.3	S513	K511-S513 PolarHBondContact O-N 3.15Å
512	T	34.4	Very low	50.3	Low	110 Å²	110	137.9 Å²	137.9	68%	0.675	70%	0.697	S	S	*	*			trans	-59.6	135.6	-177.7	46.8	0	0	0	0	110.9	G510 R514	G510-T512 PolarHBondContact O-N 3.1Å; T512-R514 PolarHBondContact O-N 2.82Å
513	S	35.3	Very low	51.7	Low	114 Å²	114	136.4 Å²	136.4	80%	0.797	69%	0.69	S	S	*	*			trans	-65.8	120.4	172.3	-172.8	0	0	0	0	108.1	K511 Y515	K511-S513 PolarHBondContact O-N 3.15Å; S513-Y515 VanDerWaalsContact C-N 3.26Å; S513-Y515 PolarHBondContact O-N 2.67Å
514	R	39.8	Very low	53.6	Low	211 Å²	211	132.4 Å²	132.4	80%	0.796	67%	0.671	S	S	*	*			trans	-73	79.1	-177.1	-79.6	-175.5	-77.3	147.4	-9.2	111.4	T512 R516	T512-R514 PolarHBondContact O-N 2.82Å; R514-R516 PolarHBondContact O-N 3.35Å
515	Y	35.1	Very low	55.5	Low	218 Å²	218	126.3 Å²	126.3	86%	0.855	65%	0.646	S	S	*	*			trans	-73.9	70.5	161.8	-144.8	-81.3	0	0	0	109	S513 G517	S513-Y515 VanDerWaalsContact C-N 3.26Å; S513-Y515 PolarHBondContact O-N 2.67Å; Y515-G517 PolarHBondContact O-N 3.34Å
516	R	39	Very low	57.5	Low	213 Å²	213	123 Å²	123	80%	0.804	64%	0.641	S	S	*	*			trans	-77.7	70.2	179	-169.1	-159.4	-78.6	-167.7	-6.8	110.1	R514	R514-R516 PolarHBondContact O-N 3.35Å
517	G	41	Very low	59.9	Low	41 Å²	41	117 Å²	117	42%	0.423	62%	0.616	S	S	.	*			trans	-68	147.4	148.8	0	0	0	0	0	109.1	Y515 F519	Y515-G517 PolarHBondContact O-N 3.34Å; G517-F519 PolarHBondContact O-N 2.99Å
518	S	46	Very low	62.2	Low	123 Å²	123	115.7 Å²	115.7	86%	0.86	60%	0.595	S	S	*	*			trans	-77.2	108.3	162.6	45.1	0	0	0	0	107.8	D520	S518-D520 PolarHBondContact O-N 3.31Å
519	F	67.4	Low	64.3	Low	148 Å²	148	109.3 Å²	109.3	65%	0.649	57%	0.574	S	S	*	*			trans	-69	128.2	165.1	-72.1	-86.2	0	0	0	108.3	G517	G517-F519 PolarHBondContact O-N 2.99Å
520	D	81.3	Confident	66.4	Low	83 Å²	83	104.6 Å²	104.6	44%	0.444	54%	0.541	S	S	.	.			trans	-76.2	121.8	171.3	178.3	-0.6	0	0	0	108.6	S518 F522 Q523	S518-D520 PolarHBondContact O-N 3.31Å; D520-F522 PolarHBondContact O-N 3.34Å; D520-F522 VanDerWaalsContact O-N 3.15Å; D520-F522 WeakPolarHBondContact OD1-CD2 3.34Å; D520-F522 PolarHBondContact OD1-N 2.8Å; D520-Q523 HydrophobicContact CB-CB 4.22Å; D520-Q523 WeakPolarHBondContact O-CB 3Å; D520-Q523 PolarHBondContact O-N 2.63Å
521	P	83.1	Confident	68.3	Low	64 Å²	64	108.3 Å²	108.3	42%	0.416	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.7	176.7	-24.5	35.1	0	0	0	113.9	V630 R631	P521-V630 PolarHBondContact O-N 3.23Å; P521-R631 WeakPolarHBondContact O-CB 3.42Å; P521-R631 PolarHBondContact O-N 2.9Å
522	F	85.4	Confident	69.6	Low	86 Å²	86	101.4 Å²	101.4	38%	0.377	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	0.4	-175.3	-51.9	-68.5	0	0	0	113.2	D520 L524 L591	D520-F522 PolarHBondContact O-N 3.34Å; D520-F522 VanDerWaalsContact O-N 3.15Å; D520-F522 WeakPolarHBondContact OD1-CD2 3.34Å; D520-F522 PolarHBondContact OD1-N 2.8Å; F522-L524 PolarHBondContact O-N 2.9Å; F522-L524 VanDerWaalsContact O-N 3.11Å; F522-L591 HydrophobicContact CE1-CB 4.31Å; F522-L591 WeakPolarHBondContact CE1-O 3.47Å; F522-L591 HydrophobicContact CE2-CB 4.41Å; F522-L591 HydrophobicContact CE2-CD1 4.28Å; F522-L591 HydrophobicContact CZ-CB 3.77Å; F522-L591 HydrophobicContact CZ-CD1 4.41Å
523	Q	89.5	Confident	71.3	Confident	100 Å²	100	103.5 Å²	103.5	47%	0.467	54%	0.539	S	S	.	.			trans	-62	116.2	174.6	-178.7	176.2	7.4	0	0	110.3	D520 S629 V630	D520-Q523 HydrophobicContact CB-CB 4.22Å; D520-Q523 WeakPolarHBondContact O-CB 3Å; D520-Q523 PolarHBondContact O-N 2.63Å; Q523-S629 CarbonylContact O-C 3.51Å; Q523-S629 WeakPolarHBondContact O-CA 3.27Å; Q523-V630 HydrophobicContact CB-CG2 4.24Å; Q523-V630 PolarHBondContact O-N 3.41Å
524	L	91.4	Very high	73.4	Confident	64 Å²	64	99.1 Å²	99.1	34%	0.335	51%	0.508	S	S	.	.	B	Isolated β-bridge	trans	-69	130.7	173.8	-49.2	-176.3	0	0	0	110.1	F522 F624 N627	F522-L524 PolarHBondContact O-N 2.9Å; F522-L524 VanDerWaalsContact O-N 3.11Å; L524-F624 HydrophobicContact CD1-CD2 3.85Å; L524-F624 HydrophobicContact CD1-CE2 4.45Å; L524-F624 HydrophobicContact CD2-CD2 4.27Å; L524-F624 HydrophobicContact CD2-CE2 4.05Å; L524-N627 HydrophobicContact CB-CB 4.31Å
525	I	92.2	Very high	75.4	Confident	43 Å²	43	96.7 Å²	96.7	22%	0.221	51%	0.505	C	S	.	.			trans	-113.3	119.2	178.9	-68.6	-177.8	0	0	0	108.3	C527 P628 V630 I633 P687	I525-C527 PolarHBondContact O-N 2.79Å; I525-P628 PolarHBondContact N-O 3.4Å; I525-P628 WeakPolarHBondContact O-CD 3.43Å; I525-V630 HydrophobicContact CD1-CG2 3.64Å; I525-V630 HydrophobicContact CG1-CG2 4.28Å; I525-I633 HydrophobicContact CB-CD1 3.83Å; I525-I633 HydrophobicContact CD1-CD1 3.77Å; I525-I633 HydrophobicContact CG1-CD1 4.24Å; I525-I633 HydrophobicContact CG2-CD1 4.1Å; I525-P687 HydrophobicContact CG2-CG 3.88Å
526	P	93.4	Very high	77.8	Confident	93 Å²	93	89.7 Å²	89.7	60%	0.604	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-57.7	132.7	175.9	-25.8	35.1	0	0	0	112.5
527	C	92.5	Very high	80.2	Confident	26 Å²	26	82 Å²	82	18%	0.176	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-65.6	139.1	171.8	-64.5	0	0	0	0	111.2	I525 P628 P687 R689	I525-C527 PolarHBondContact O-N 2.79Å; C527-P628 WeakPolarHBondContact SG-CD 3.22Å; C527-P687 WeakPolarHBondContact CA-O 3.42Å; C527-R689 HydrophobicContact CB-CB 3.59Å
528	R	91.9	Very high	82.7	Confident	98 Å²	98	81 Å²	81	37%	0.37	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	144.1	167	-68.7	179.6	167.6	-172.6	-6.1	110	E679 L686 P687 Y688 R689	R528-E679 IonicContact NH2-OE1 2.65Å; R528-E679 PolarHBondContact NH2-OE1 2.71Å; R528-L686 VanDerWaalsContact CZ-CD1 3.44Å; R528-P687 PolarHBondContact N-O 2.95Å; R528-Y688 HydrophobicContact CB-CD1 3.74Å; R528-Y688 HydrophobicContact CB-CE1 3.71Å; R528-Y688 HydrophobicContact CB-CG 4.22Å; R528-Y688 PolarHBondContact NH1-OH 3.35Å; R528-Y688 CarbonylContact O-C 3.44Å; R528-Y688 WeakPolarHBondContact O-CA 3.2Å; R528-R689 PolarHBondContact O-N 2.73Å
529	S	88.7	Confident	85	Confident	60 Å²	60	79.1 Å²	79.1	42%	0.42	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	157.8	165.7	-56.7	0	0	0	0	111.5	E531	S529-E531 VanDerWaalsContact CB-CD 3.49Å; S529-E531 WeakPolarHBondContact CB-OE1 3.23Å; S529-E531 PolarHBondContact O-N 3.35Å; S529-E531 VanDerWaalsContact O-N 3.13Å; S529-E531 PolarHBondContact OG-OE1 3.17Å
530	F	84.9	Confident	86.4	Confident	24 Å²	24	72.1 Å²	72.1	11%	0.105	39%	0.389	C	S	.	.	S	Bend	trans	-82.6	65.4	163.7	-67.8	-69.4	0	0	0	111.2	V534 E536 L673 K675 Y688 R689 F690	F530-V534 CarbonylContact C-O 3.59Å; F530-V534 VanDerWaalsContact CA-O 3.29Å; F530-V534 WeakPolarHBondContact CA-O 3.3Å; F530-V534 WeakPolarHBondContact CB-O 3.34Å; F530-V534 HydrophobicContact CD1-CG1 4.19Å; F530-E536 HydrophobicContact CB-CB 4.44Å; F530-E536 HydrophobicContact CB-CG 3.42Å; F530-E536 VanDerWaalsContact CB-CG 3.42Å; F530-E536 HydrophobicContact CD2-CB 4.48Å; F530-E536 HydrophobicContact CD2-CG 3.56Å; F530-E536 HydrophobicContact CE2-CG 4.39Å; F530-E536 HydrophobicContact CG-CB 4.43Å; F530-E536 HydrophobicContact CG-CG 3.62Å; F530-L673 HydrophobicContact CZ-CB 4.25Å; F530-L673 HydrophobicContact CZ-CD2 4.41Å; F530-K675 HydrophobicContact CE1-CD 4.12Å; F530-Y688 AromaticContact CD1-CD1 3.8Å; F530-Y688 HydrophobicContact CD1-CD1 3.8Å; F530-Y688 HydrophobicContact CD1-CG 4.21Å; F530-Y688 AromaticContact CE1-CD1 3.82Å; F530-Y688 HydrophobicContact CE1-CD1 3.82Å; F530-Y688 AromaticContact CE1-CG 3.75Å; F530-Y688 HydrophobicContact CE1-CG 3.75Å; F530-Y688 HydrophobicContact CG-CD1 4.49Å; F530-Y688 HydrophobicContact CZ-CG 4.19Å; F530-R689 WeakPolarHBondContact CD2-O 3.36Å; F530-F690 HydrophobicContact CD2-CD1 4.14Å; F530-F690 HydrophobicContact CD2-CE1 4.49Å; F530-F690 AromaticContact CE2-CD1 3.62Å; F530-F690 HydrophobicContact CE2-CD1 3.62Å; F530-F690 HydrophobicContact CE2-CD2 4.23Å; F530-F690 AromaticContact CE2-CE1 3.75Å; F530-F690 HydrophobicContact CE2-CE1 3.75Å; F530-F690 HydrophobicContact CE2-CE2 4.36Å; F530-F690 AromaticContact CE2-CG 3.88Å; F530-F690 HydrophobicContact CE2-CG 3.88Å; F530-F690 HydrophobicContact CE2-CZ 4.12Å; F530-F690 HydrophobicContact CZ-CE1 4.21Å; F530-F690 HydrophobicContact CZ-CZ 4.28Å
531	E	77.1	Confident	87.2	Confident	140 Å²	140	69.5 Å²	69.5	65%	0.654	38%	0.375	S	S	*	.			trans	-117.8	151.4	-178.7	-72	169.3	-130.4	0	0	111	S529 D533	S529-E531 VanDerWaalsContact CB-CD 3.49Å; S529-E531 WeakPolarHBondContact CB-OE1 3.23Å; S529-E531 PolarHBondContact O-N 3.35Å; S529-E531 VanDerWaalsContact O-N 3.13Å; S529-E531 PolarHBondContact OG-OE1 3.17Å; E531-D533 PolarHBondContact O-N 3.01Å
532	G	72.6	Confident	87.8	Confident	70 Å²	70	66.5 Å²	66.5	72%	0.722	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	-127.6	-179.2	0	0	0	0	0	113.3	V534	G532-V534 PolarHBondContact O-N 2.75Å; G532-V534 VanDerWaalsContact O-N 3.17Å
533	D	69.9	Low	88.3	Confident	154 Å²	154	62.8 Å²	62.8	82%	0.824	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-5.1	-172.1	-59.2	-51.5	0	0	0	114.7	E531	E531-D533 PolarHBondContact O-N 3.01Å
534	V	78.8	Confident	88.5	Confident	23 Å²	23	58.1 Å²	58.1	14%	0.139	32%	0.318	C	S	.	.			trans	-121	88.6	-176.9	-169	0	0	0	0	111.3	F530 G532 K675 Y688	F530-V534 CarbonylContact C-O 3.59Å; F530-V534 VanDerWaalsContact CA-O 3.29Å; F530-V534 WeakPolarHBondContact CA-O 3.3Å; F530-V534 WeakPolarHBondContact CB-O 3.34Å; F530-V534 HydrophobicContact CD1-CG1 4.19Å; G532-V534 PolarHBondContact O-N 2.75Å; G532-V534 VanDerWaalsContact O-N 3.17Å; V534-K675 HydrophobicContact CG1-CD 4.21Å; V534-Y688 HydrophobicContact CB-CE1 4.1Å; V534-Y688 HydrophobicContact CG1-CD1 4.27Å; V534-Y688 HydrophobicContact CG1-CE1 3.8Å; V534-Y688 HydrophobicContact CG2-CE1 4.37Å
535	Q	81.6	Confident	88.6	Confident	160 Å²	160	55.7 Å²	55.7	75%	0.748	31%	0.305	S	S	*	.			trans	-67.8	155.3	177.4	-65.5	-177.5	-11.8	0	0	113.6	K675	Q535-K675 PolarHBondContact O-NZ 3.5Å
536	E	86.9	Confident	88.9	Confident	70 Å²	70	53.7 Å²	53.7	33%	0.327	30%	0.295	S	S	.	.			trans	-60.9	129.6	166.5	-65	-159.9	143.6	0	0	109.6	F530 F538 F690 N691	F530-E536 HydrophobicContact CB-CB 4.44Å; F530-E536 HydrophobicContact CB-CG 3.42Å; F530-E536 VanDerWaalsContact CB-CG 3.42Å; F530-E536 HydrophobicContact CD2-CB 4.48Å; F530-E536 HydrophobicContact CD2-CG 3.56Å; F530-E536 HydrophobicContact CE2-CG 4.39Å; F530-E536 HydrophobicContact CG-CB 4.43Å; F530-E536 HydrophobicContact CG-CG 3.62Å; E536-F538 VanDerWaalsContact C-N 3.33Å; E536-F690 HydrophobicContact CG-CD1 4.41Å; E536-N691 PolarHBondContact OE1-N 3.37Å
537	P	88.8	Confident	89	Confident	52 Å²	52	49.2 Å²	49.2	34%	0.338	27%	0.266	S	S	.	.	S	Bend	trans	-74.2	-25.2	-179.6	28.4	-33.2	0	0	0	113.4	L673 F690	P537-L673 HydrophobicContact CG-CD2 3.85Å; P537-F690 HydrophobicContact CG-CE1 4.3Å; P537-F690 HydrophobicContact CG-CZ 4.19Å
538	F	93.1	Very high	89.2	Confident	20 Å²	20	48 Å²	48	9%	0.088	26%	0.258	C	S	.	.	S	Bend	trans	-161.1	154.6	179.6	48.5	-96.1	0	0	0	108.4	E536 V540 F569 K574 L576 P649 I651 L673 F690	E536-F538 VanDerWaalsContact C-N 3.33Å; F538-V540 HydrophobicContact CD2-CG2 3.94Å; F538-V540 HydrophobicContact CE2-CG2 3.76Å; F538-F569 HydrophobicContact CB-CE2 3.91Å; F538-F569 HydrophobicContact CG-CE2 4.29Å; F538-K574 CarbonylContact C-O 3.6Å; F538-K574 WeakPolarHBondContact CA-O 3.28Å; F538-K574 HydrophobicContact CB-CB 4.17Å; F538-K574 WeakPolarHBondContact CB-O 3.22Å; F538-L576 HydrophobicContact CD2-CB 3.91Å; F538-L576 HydrophobicContact CE2-CB 4.18Å; F538-L576 HydrophobicContact CE2-CD2 3.95Å; F538-P649 HydrophobicContact CD1-CB 3.91Å; F538-P649 HydrophobicContact CD2-CB 4.39Å; F538-P649 HydrophobicContact CE1-CB 3.36Å; F538-P649 HydrophobicContact CE2-CB 3.88Å; F538-P649 HydrophobicContact CG-CB 4.41Å; F538-P649 HydrophobicContact CZ-CB 3.33Å; F538-I651 HydrophobicContact CE2-CG2 4Å; F538-I651 HydrophobicContact CZ-CG2 4.03Å; F538-L673 HydrophobicContact CZ-CD1 4.26Å; F538-F690 HydrophobicContact CD2-CE1 4.15Å; F538-F690 HydrophobicContact CD2-CZ 4.03Å; F538-F690 HydrophobicContact CE1-CZ 4.25Å; F538-F690 AromaticContact CE2-CE1 3.92Å; F538-F690 HydrophobicContact CE2-CE1 3.92Å; F538-F690 AromaticContact CE2-CE2 3.99Å; F538-F690 HydrophobicContact CE2-CE2 3.99Å; F538-F690 AromaticContact CE2-CZ 3.35Å; F538-F690 HydrophobicContact CE2-CZ 3.35Å; F538-F690 HydrophobicContact CZ-CE1 4.35Å; F538-F690 HydrophobicContact CZ-CE2 4.12Å; F538-F690 AromaticContact CZ-CZ 3.48Å; F538-F690 HydrophobicContact CZ-CZ 3.48Å; F538-F690 VanDerWaalsContact CZ-CZ 3.48Å; F538-F690 WeakPolarHBondContact O-CE1 3.48Å
539	Q	95.3	Very high	89.5	Confident	83 Å²	83	43.3 Å²	43.3	39%	0.388	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	146.2	170.9	-178.3	174.6	79.9	0	0	110.1	I541 K574 V575 L576	Q539-I541 HydrophobicContact CG-CG1 4.44Å; Q539-K574 PolarHBondContact N-O 2.93Å; Q539-V575 HydrophobicContact CB-CG2 4.45Å; Q539-L576 PolarHBondContact O-N 3.19Å
540	V	96.9	Very high	90	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.3	174.6	-176.6	0	0	0	0	110.1	F538 V542 L576 I578 F690 F692 L693	F538-V540 HydrophobicContact CD2-CG2 3.94Å; F538-V540 HydrophobicContact CE2-CG2 3.76Å; V540-V542 HydrophobicContact CG1-CG2 4.01Å; V540-L576 WeakPolarHBondContact CA-O 3.35Å; V540-I578 HydrophobicContact CG1-CD1 4.06Å; V540-I578 HydrophobicContact CG1-CG1 4.49Å; V540-F690 HydrophobicContact CG2-CB 4.36Å; V540-F690 HydrophobicContact CG2-CD1 3.89Å; V540-F690 HydrophobicContact CG2-CD2 4.01Å; V540-F690 HydrophobicContact CG2-CE1 4.07Å; V540-F690 HydrophobicContact CG2-CE2 4.15Å; V540-F690 HydrophobicContact CG2-CG 3.85Å; V540-F690 HydrophobicContact CG2-CZ 4.2Å; V540-F692 HydrophobicContact CB-CB 3.93Å; V540-F692 HydrophobicContact CG1-CB 3.91Å; V540-F692 VanDerWaalsContact O-CA 3.32Å; V540-F692 WeakPolarHBondContact O-CA 3.38Å; V540-L693 PolarHBondContact O-N 3.42Å
541	I	96.6	Very high	90.6	Very high	29 Å²	29	39.3 Å²	39.3	15%	0.149	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.3	173.1	-55.8	-178.5	0	0	0	108.3	Q539 V575 L576 K577 I578 L693	Q539-I541 HydrophobicContact CG-CG1 4.44Å; I541-V575 HydrophobicContact CD1-CG1 3.68Å; I541-V575 HydrophobicContact CG1-CG1 4.01Å; I541-L576 PolarHBondContact N-O 3.45Å; I541-K577 HydrophobicContact CB-CG 4.4Å; I541-K577 HydrophobicContact CG2-CG 4.46Å; I541-K577 CarbonylContact O-C 3.4Å; I541-K577 WeakPolarHBondContact O-CA 3.33Å; I541-I578 PolarHBondContact O-N 3.46Å; I541-L693 CarbonylContact C-O 3.55Å; I541-L693 WeakPolarHBondContact CA-O 3.37Å; I541-L693 HydrophobicContact CG1-CB 4.44Å
542	V	97.1	Very high	91.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.4	-175.8	-168.5	0	0	0	0	110	V540 T546 L547 I578 M653 F692 L693 S694 S695	V540-V542 HydrophobicContact CG1-CG2 4.01Å; V542-T546 HydrophobicContact CG1-CG2 3.81Å; V542-L547 HydrophobicContact CB-CD1 4.42Å; V542-L547 HydrophobicContact CB-CD2 4.35Å; V542-L547 HydrophobicContact CB-CG 4.36Å; V542-L547 HydrophobicContact CG1-CD1 4.31Å; V542-L547 HydrophobicContact CG1-CD2 3.81Å; V542-L547 HydrophobicContact CG1-CG 3.75Å; V542-I578 HydrophobicContact CG1-CB 4.34Å; V542-I578 HydrophobicContact CG2-CD1 4.28Å; V542-M653 HydrophobicContact CG2-CE 4.3Å; V542-F692 HydrophobicContact CB-CD2 4.12Å; V542-F692 HydrophobicContact CB-CE2 4.46Å; V542-F692 HydrophobicContact CG2-CB 4.2Å; V542-F692 HydrophobicContact CG2-CD2 3.58Å; V542-F692 HydrophobicContact CG2-CE2 4.21Å; V542-F692 HydrophobicContact CG2-CG 4.06Å; V542-L693 PolarHBondContact N-O 2.73Å; V542-S694 CarbonylContact O-C 3.55Å; V542-S694 WeakPolarHBondContact O-CA 3.49Å; V542-S695 PolarHBondContact O-N 2.89Å
543	C	95.3	Very high	92.8	Very high	8 Å²	8	29.3 Å²	29.3	5%	0.054	15%	0.15	C	C	.	.			trans	-70.7	150.3	176.5	-68.4	0	0	0	0	111.9	E545 T546 L547 I578	C543-E545 VanDerWaalsContact C-N 3.32Å; C543-E545 PolarHBondContact O-N 2.76Å; C543-T546 WeakPolarHBondContact O-CB 3.35Å; C543-T546 PolarHBondContact O-N 3.07Å; C543-T546 VanDerWaalsContact O-N 3.08Å; C543-L547 PolarHBondContact O-N 2.94Å; C543-I578 PolarHBondContact N-O 3.15Å; C543-I578 PolarHBondContact SG-O 2.74Å
544	A	94	Very high	94.1	Very high	2 Å²	2	22 Å²	22	2%	0.017	11%	0.111	C	C	.	.	H	α-helix	trans	-59.8	-39.8	-175.6	0	0	0	0	0	112.6	T546 L547 L548 P699 L748 L751	A544-T546 VanDerWaalsContact C-N 3.33Å; A544-T546 PolarHBondContact O-N 2.68Å; A544-L547 WeakPolarHBondContact O-CB 3.29Å; A544-L547 PolarHBondContact O-N 2.83Å; A544-L548 WeakPolarHBondContact O-CG 3.23Å; A544-L548 PolarHBondContact O-N 2.8Å; A544-P699 HydrophobicContact CB-CG 3.99Å; A544-L748 HydrophobicContact CB-CD2 4.12Å; A544-L751 HydrophobicContact CB-CD1 4.12Å; A544-L751 HydrophobicContact CB-CD2 4.43Å; A544-L751 HydrophobicContact CB-CG 4.4Å
545	E	94	Very high	95	Very high	14 Å²	14	21 Å²	21	7%	0.065	10%	0.104	C	C	.	.	H	α-helix	trans	-47.4	-52	170.7	172.3	172.7	178.7	0	0	112.5	C543 L547 L548 I549 P699 D700 Q703 T704	C543-E545 VanDerWaalsContact C-N 3.32Å; C543-E545 PolarHBondContact O-N 2.76Å; E545-L547 VanDerWaalsContact C-N 3.28Å; E545-L547 PolarHBondContact O-N 2.93Å; E545-L548 PolarHBondContact O-N 3.23Å; E545-I549 HydrophobicContact CG-CG1 4.4Å; E545-I549 WeakPolarHBondContact O-CG1 3.33Å; E545-I549 PolarHBondContact O-N 2.86Å; E545-P699 HydrophobicContact CB-CB 4.14Å; E545-D700 PolarHBondContact OE2-N 2.61Å; E545-Q703 WeakPolarHBondContact OE1-CB 3.2Å; E545-T704 WeakPolarHBondContact CG-OG1 3.44Å
546	T	96.9	Very high	95.7	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58	-43.9	179.9	-54	0	0	0	0	110.6	V542 C543 A544 M550 L565 I578 R579 A580 A581	V542-T546 HydrophobicContact CG1-CG2 3.81Å; C543-T546 WeakPolarHBondContact O-CB 3.35Å; C543-T546 PolarHBondContact O-N 3.07Å; C543-T546 VanDerWaalsContact O-N 3.08Å; A544-T546 VanDerWaalsContact C-N 3.33Å; A544-T546 PolarHBondContact O-N 2.68Å; T546-M550 HydrophobicContact CG2-CE 3.81Å; T546-M550 HydrophobicContact CG2-SD 4.33Å; T546-M550 WeakPolarHBondContact O-CB 3.48Å; T546-M550 VanDerWaalsContact O-CG 3.24Å; T546-M550 WeakPolarHBondContact O-CG 3.17Å; T546-M550 PolarHBondContact O-N 3.48Å; T546-L565 HydrophobicContact CG2-CD2 3.89Å; T546-I578 HydrophobicContact CG2-CG2 3.7Å; T546-R579 PolarHBondContact OG1-O 3.04Å; T546-A580 PolarHBondContact OG1-N 3.17Å; T546-A581 HydrophobicContact CG2-CB 3.79Å
547	L	97	Very high	96.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-66.1	-44.5	179.9	-63	165.5	0	0	0	111.7	V542 C543 A544 E545 M550 D551 I669 F692 H747	V542-L547 HydrophobicContact CB-CD1 4.42Å; V542-L547 HydrophobicContact CB-CD2 4.35Å; V542-L547 HydrophobicContact CB-CG 4.36Å; V542-L547 HydrophobicContact CG1-CD1 4.31Å; V542-L547 HydrophobicContact CG1-CD2 3.81Å; V542-L547 HydrophobicContact CG1-CG 3.75Å; C543-L547 PolarHBondContact O-N 2.94Å; A544-L547 WeakPolarHBondContact O-CB 3.29Å; A544-L547 PolarHBondContact O-N 2.83Å; E545-L547 VanDerWaalsContact C-N 3.28Å; E545-L547 PolarHBondContact O-N 2.93Å; L547-M550 HydrophobicContact CD2-CE 3.89Å; L547-D551 VanDerWaalsContact O-CB 3.26Å; L547-D551 WeakPolarHBondContact O-CB 3.48Å; L547-D551 PolarHBondContact O-N 3.19Å; L547-I669 HydrophobicContact CD2-CD1 4.06Å; L547-F692 HydrophobicContact CD2-CE2 3.86Å; L547-F692 HydrophobicContact CD2-CZ 4.18Å; L547-H747 HydrophobicContact CB-CB 4.03Å
548	L	96.9	Very high	96.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-59.5	-48.6	176.3	-66.8	175.3	0	0	0	111.8	A544 E545 D551 M552 W701 T704 L744 L748	A544-L548 WeakPolarHBondContact O-CG 3.23Å; A544-L548 PolarHBondContact O-N 2.8Å; E545-L548 PolarHBondContact O-N 3.23Å; L548-D551 PolarHBondContact O-N 3.28Å; L548-M552 HydrophobicContact CB-CE 4.28Å; L548-M552 WeakPolarHBondContact O-CB 3.2Å; L548-M552 WeakPolarHBondContact O-CG 2.89Å; L548-M552 PolarHBondContact O-N 3.06Å; L548-W701 HydrophobicContact CD1-CZ3 3.99Å; L548-T704 HydrophobicContact CD1-CG2 3.93Å; L548-L744 HydrophobicContact CB-CD2 4.29Å; L548-L744 HydrophobicContact CD2-CB 3.74Å; L548-L744 HydrophobicContact CD2-CD2 3.62Å; L548-L744 HydrophobicContact CD2-CG 4.18Å; L548-L748 HydrophobicContact CD1-CD2 4.19Å; L548-L748 HydrophobicContact CD2-CD1 4.14Å; L548-L748 HydrophobicContact CD2-CG 4.19Å
549	I	98	Very high	96.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-67	-43.6	-178.1	-63.6	-43.5	0	0	0	111.4	E545 D551 M552 H553 A581 P583 T704 R707 I711	E545-I549 HydrophobicContact CG-CG1 4.4Å; E545-I549 WeakPolarHBondContact O-CG1 3.33Å; E545-I549 PolarHBondContact O-N 2.86Å; I549-D551 PolarHBondContact O-N 2.86Å; I549-M552 HydrophobicContact CD1-CE 3.57Å; I549-H553 WeakPolarHBondContact O-CB 3.33Å; I549-H553 PolarHBondContact O-N 3.21Å; I549-A581 HydrophobicContact CB-CB 4.2Å; I549-A581 HydrophobicContact CG2-CB 4.05Å; I549-P583 HydrophobicContact CG2-CG 3.55Å; I549-T704 HydrophobicContact CD1-CG2 4.11Å; I549-T704 WeakPolarHBondContact CD1-O 3.4Å; I549-R707 HydrophobicContact CD1-CB 3.52Å; I549-R707 HydrophobicContact CG1-CB 3.99Å; I549-R707 HydrophobicContact CG2-CB 4.23Å; I549-I711 HydrophobicContact CG2-CD1 4.24Å
550	M	98.2	Very high	96	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.2	-44.4	175.4	-71.8	-169.7	-64.9	0	0	111.8	T546 L547 H553 A554 L565 A581 Y618 M653 V655	T546-M550 HydrophobicContact CG2-CE 3.81Å; T546-M550 HydrophobicContact CG2-SD 4.33Å; T546-M550 WeakPolarHBondContact O-CB 3.48Å; T546-M550 VanDerWaalsContact O-CG 3.24Å; T546-M550 WeakPolarHBondContact O-CG 3.17Å; T546-M550 PolarHBondContact O-N 3.48Å; L547-M550 HydrophobicContact CD2-CE 3.89Å; M550-H553 PolarHBondContact O-N 3.44Å; M550-A554 WeakPolarHBondContact O-CB 3.44Å; M550-A554 PolarHBondContact O-N 2.8Å; M550-L565 HydrophobicContact CG-CD2 4.31Å; M550-L565 HydrophobicContact SD-CD2 3.71Å; M550-A581 HydrophobicContact CG-CB 3.85Å; M550-Y618 HydrophobicContact CB-CD2 4.02Å; M550-Y618 HydrophobicContact CB-CE2 3.98Å; M550-Y618 HydrophobicContact CG-CD1 3.88Å; M550-Y618 HydrophobicContact CG-CD2 3.63Å; M550-Y618 HydrophobicContact CG-CE1 4.01Å; M550-Y618 HydrophobicContact CG-CE2 3.76Å; M550-Y618 HydrophobicContact CG-CG 3.67Å; M550-Y618 HydrophobicContact SD-CD1 4.22Å; M550-Y618 HydrophobicContact SD-CD2 4.15Å; M550-Y618 HydrophobicContact SD-CG 3.79Å; M550-M653 HydrophobicContact CE-CE 3.68Å; M550-M653 HydrophobicContact CE-SD 3.77Å; M550-M653 HydrophobicContact SD-CB 4.14Å; M550-M653 HydrophobicContact SD-CE 4.43Å; M550-M653 HydrophobicContact SD-SD 3.96Å; M550-V655 HydrophobicContact CB-CG2 4.1Å
551	D	97.9	Very high	96	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-73.2	-43.2	-175.8	-162	24.6	0	0	0	112.2	L547 L548 I549 H553 A554 H555 S667 S743 L744	L547-D551 VanDerWaalsContact O-CB 3.26Å; L547-D551 WeakPolarHBondContact O-CB 3.48Å; L547-D551 PolarHBondContact O-N 3.19Å; L548-D551 PolarHBondContact O-N 3.28Å; I549-D551 PolarHBondContact O-N 2.86Å; D551-H553 VanDerWaalsContact C-N 3.34Å; D551-H553 PolarHBondContact O-N 3.12Å; D551-A554 PolarHBondContact O-N 2.63Å; D551-H555 VanDerWaalsContact CG-CE1 3.45Å; D551-H555 PolarHBondContact O-N 3.17Å; D551-H555 PolarHBondContact O-ND1 2.93Å; D551-H555 IonicContact OD1-CE1 3.93Å; D551-H555 PolarHBondContact OD1-CE1 2.7Å; D551-H555 IonicContact OD1-ND1 3.51Å; D551-H555 PolarHBondContact OD1-ND1 3.28Å; D551-H555 VanDerWaalsContact OD1-ND1 3.09Å; D551-H555 IonicContact OD2-CE1 2.68Å; D551-H555 PolarHBondContact OD2-CE1 3.03Å; D551-H555 IonicContact OD2-ND1 2.84Å; D551-S667 WeakPolarHBondContact OD1-CB 3.48Å; D551-S667 PolarHBondContact OD1-OG 3.41Å; D551-S667 PolarHBondContact OD2-OG 2.62Å; D551-S743 WeakPolarHBondContact OD2-CB 3.44Å; D551-S743 PolarHBondContact OD2-OG 2.93Å; D551-L744 HydrophobicContact CB-CD2 4.04Å
552	M	98.1	Very high	95.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-57.9	-45.7	171	-76.9	-171.4	-71.9	0	0	111.8	L548 I549 A554 H555 V556 A708 I711 M740 L744 I763 F767	L548-M552 HydrophobicContact CB-CE 4.28Å; L548-M552 WeakPolarHBondContact O-CB 3.2Å; L548-M552 WeakPolarHBondContact O-CG 2.89Å; L548-M552 PolarHBondContact O-N 3.06Å; I549-M552 HydrophobicContact CD1-CE 3.57Å; M552-A554 VanDerWaalsContact C-N 3.28Å; M552-A554 PolarHBondContact O-N 3.47Å; M552-H555 PolarHBondContact O-N 3.06Å; M552-V556 PolarHBondContact O-N 2.71Å; M552-A708 HydrophobicContact CE-CB 3.91Å; M552-A708 HydrophobicContact SD-CB 4.06Å; M552-I711 HydrophobicContact CB-CD1 4.19Å; M552-M740 HydrophobicContact CB-SD 4.43Å; M552-M740 HydrophobicContact CG-CE 4.42Å; M552-M740 HydrophobicContact CG-SD 4.05Å; M552-L744 HydrophobicContact CG-CD1 3.75Å; M552-L744 HydrophobicContact CG-CD2 3.84Å; M552-L744 HydrophobicContact CG-CG 4.42Å; M552-L744 HydrophobicContact SD-CD1 4.24Å; M552-I763 HydrophobicContact CE-CD1 4.09Å; M552-I763 HydrophobicContact SD-CD1 4.06Å; M552-I763 HydrophobicContact SD-CG1 4.34Å; M552-I763 HydrophobicContact SD-CG2 3.64Å; M552-F767 HydrophobicContact SD-CE2 3.93Å
553	H	97.8	Very high	96	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.2	-36.9	179.9	-164.8	-160.1	0	0	0	111.4	I549 M550 D551 V556 V561 I562 Y618 I711 Y715	I549-H553 WeakPolarHBondContact O-CB 3.33Å; I549-H553 PolarHBondContact O-N 3.21Å; M550-H553 PolarHBondContact O-N 3.44Å; D551-H553 VanDerWaalsContact C-N 3.34Å; D551-H553 PolarHBondContact O-N 3.12Å; H553-V556 VanDerWaalsContact O-CG2 3.27Å; H553-V556 WeakPolarHBondContact O-CG2 3.41Å; H553-V561 HydrophobicContact CB-CG2 4.21Å; H553-V561 WeakPolarHBondContact O-CG2 3.41Å; H553-I562 PolarHBondContact CE1-O 3.1Å; H553-Y618 HydrophobicContact CB-CE2 4.31Å; H553-Y618 AromaticContact ND1-CE2 3.81Å; H553-Y618 AromaticContact ND1-CZ 3.68Å; H553-Y618 PolarHBondContact ND1-OH 3.03Å; H553-I711 HydrophobicContact CB-CD1 3.91Å; H553-I711 HydrophobicContact CB-CG1 4.36Å; H553-Y715 AromaticContact CD2-CE2 3.56Å; H553-Y715 AromaticContact NE2-CE2 3.27Å; H553-Y715 VanDerWaalsContact NE2-CE2 3.27Å; H553-Y715 WeakPolarHBondContact NE2-CE2 3.36Å; H553-Y715 AromaticContact NE2-CZ 3.53Å; H553-Y715 PolarHBondContact NE2-OH 3.26Å
554	A	97.6	Very high	96.1	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.008	7%	0.071	C	C	.	.	H	α-helix	trans	-68.5	-36.3	175.1	0	0	0	0	0	113.3	M550 D551 M552 V655 P657	M550-A554 WeakPolarHBondContact O-CB 3.44Å; M550-A554 PolarHBondContact O-N 2.8Å; D551-A554 PolarHBondContact O-N 2.63Å; M552-A554 VanDerWaalsContact C-N 3.28Å; M552-A554 PolarHBondContact O-N 3.47Å; A554-V655 HydrophobicContact CB-CB 3.9Å; A554-V655 HydrophobicContact CB-CG1 3.56Å; A554-P657 HydrophobicContact CB-CG 4.16Å
555	H	97.5	Very high	96.3	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-72.5	-29.8	-178.3	-81.4	89.7	0	0	0	114.5	D551 M552 S557 Y658 S667 V722 M724 K739 M740	D551-H555 VanDerWaalsContact CG-CE1 3.45Å; D551-H555 PolarHBondContact O-N 3.17Å; D551-H555 PolarHBondContact O-ND1 2.93Å; D551-H555 IonicContact OD1-CE1 3.93Å; D551-H555 PolarHBondContact OD1-CE1 2.7Å; D551-H555 IonicContact OD1-ND1 3.51Å; D551-H555 PolarHBondContact OD1-ND1 3.28Å; D551-H555 VanDerWaalsContact OD1-ND1 3.09Å; D551-H555 IonicContact OD2-CE1 2.68Å; D551-H555 PolarHBondContact OD2-CE1 3.03Å; D551-H555 IonicContact OD2-ND1 2.84Å; M552-H555 PolarHBondContact O-N 3.06Å; H555-S557 VanDerWaalsContact C-N 3.3Å; H555-S557 PolarHBondContact O-N 3.34Å; H555-Y658 AromaticContact CD2-CZ 3.69Å; H555-Y658 PolarHBondContact CD2-OH 3.21Å; H555-Y658 VanDerWaalsContact CD2-OH 3.31Å; H555-Y658 PolarHBondContact O-OH 2.85Å; H555-S667 PolarHBondContact CE1-OG 3.15Å; H555-V722 WeakPolarHBondContact O-CB 3.03Å; H555-V722 VanDerWaalsContact O-CG2 3.25Å; H555-V722 WeakPolarHBondContact O-CG2 3.16Å; H555-M724 HydrophobicContact CB-CE 4.15Å; H555-M724 WeakPolarHBondContact O-CE 3.47Å; H555-K739 PolarHBondContact CE1-NZ 3.12Å; H555-K739 WeakPolarHBondContact NE2-CD 3.5Å; H555-K739 WeakPolarHBondContact NE2-CE 3.36Å; H555-K739 PolarHBondContact NE2-NZ 3.34Å; H555-M740 HydrophobicContact CB-CB 4.39Å; H555-M740 HydrophobicContact CB-CG 3.96Å; H555-M740 HydrophobicContact CB-SD 3.61Å; H555-M740 WeakPolarHBondContact NE2-CA 3.46Å
556	V	96.2	Very high	96.4	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-14.7	-174	-69.4	0	0	0	0	115.3	M552 H553 I711 Y715 V722 M724 F767 F771	M552-V556 PolarHBondContact O-N 2.71Å; H553-V556 VanDerWaalsContact O-CG2 3.27Å; H553-V556 WeakPolarHBondContact O-CG2 3.41Å; V556-I711 HydrophobicContact CB-CG2 4.34Å; V556-I711 HydrophobicContact CG1-CG2 3.7Å; V556-I711 HydrophobicContact CG2-CG2 3.76Å; V556-Y715 HydrophobicContact CB-CG 4.17Å; V556-Y715 HydrophobicContact CG2-CD1 4.01Å; V556-Y715 HydrophobicContact CG2-CD2 3.75Å; V556-Y715 HydrophobicContact CG2-CE2 4.41Å; V556-Y715 HydrophobicContact CG2-CG 3.52Å; V556-V722 PolarHBondContact O-N 2.95Å; V556-M724 HydrophobicContact CB-CE 4.49Å; V556-M724 HydrophobicContact CG1-CE 3.92Å; V556-F767 HydrophobicContact CG1-CE1 3.59Å; V556-F767 HydrophobicContact CG1-CZ 3.82Å; V556-F771 HydrophobicContact CB-CE2 4.02Å; V556-F771 HydrophobicContact CB-CZ 3.81Å; V556-F771 HydrophobicContact CG1-CE2 3.67Å; V556-F771 HydrophobicContact CG1-CZ 3.73Å
557	S	94.1	Very high	96.3	Very high	10 Å²	10	13.6 Å²	13.6	7%	0.07	7%	0.067	C	C	.	.	B	Isolated β-bridge	trans	-128.6	137.3	-169.3	178.6	0	0	0	0	112.6	H555 G559	H555-S557 VanDerWaalsContact C-N 3.3Å; H555-S557 PolarHBondContact O-N 3.34Å; S557-G559 WeakPolarHBondContact CB-O 3.37Å; S557-G559 PolarHBondContact OG-N 3.44Å; S557-G559 VanDerWaalsContact OG-N 3.15Å; S557-G559 PolarHBondContact OG-O 2.91Å
558	R	91.6	Very high	96.2	Very high	176 Å²	176	16.3 Å²	16.3	66%	0.664	8%	0.084	S	C	*	.	S	Bend	trans	-82.8	-16.6	171.9	-59.2	173.6	62.8	-179.5	-4	112.5	G720 V722	R558-G720 VanDerWaalsContact CB-O 3.22Å; R558-G720 WeakPolarHBondContact CB-O 3.38Å; R558-G720 VanDerWaalsContact CG-O 3.27Å; R558-G720 WeakPolarHBondContact CG-O 3.24Å; R558-G720 PolarHBondContact N-O 2.88Å; R558-V722 HydrophobicContact CG-CG2 3.55Å
559	G	91.8	Very high	96.1	Very high	37 Å²	37	19.1 Å²	19.1	38%	0.381	10%	0.096	S	C	.	.	S	Bend	trans	-99.5	160.9	168.1	0	0	0	0	0	111.6	S557 V561 P622	S557-G559 WeakPolarHBondContact CB-O 3.37Å; S557-G559 PolarHBondContact OG-N 3.44Å; S557-G559 VanDerWaalsContact OG-N 3.15Å; S557-G559 PolarHBondContact OG-O 2.91Å; G559-V561 PolarHBondContact O-N 3.23Å; G559-P622 WeakPolarHBondContact O-CG 3.49Å
560	E	93.6	Very high	95.8	Very high	52 Å²	52	22.4 Å²	22.4	24%	0.243	11%	0.114	C	C	.	.	P	Polyproline II helix	trans	-58.7	127.6	178.9	-52.5	179.4	150	0	0	111.3	C593 S620	E560-C593 HydrophobicContact CB-CB 3.76Å; E560-C593 PolarHBondContact O-SG 3.48Å; E560-C593 VanDerWaalsContact O-SG 3.35Å; E560-C593 WeakPolarHBondContact OE2-CB 3.49Å; E560-S620 WeakPolarHBondContact CG-O 3.47Å
561	V	95.3	Very high	95.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-99.6	162.4	167.4	-55.2	0	0	0	0	110.1	H553 G559 H619 S620 Y715	H553-V561 HydrophobicContact CB-CG2 4.21Å; H553-V561 WeakPolarHBondContact O-CG2 3.41Å; G559-V561 PolarHBondContact O-N 3.23Å; V561-H619 CarbonylContact O-C 3.55Å; V561-H619 WeakPolarHBondContact O-CA 3.23Å; V561-H619 WeakPolarHBondContact O-CB 3.23Å; V561-S620 PolarHBondContact N-OG 2.89Å; V561-S620 PolarHBondContact O-N 3.37Å; V561-Y715 HydrophobicContact CG1-CE1 3.94Å
562	I	96.3	Very high	95.1	Very high	8 Å²	8	37 Å²	37	4%	0.041	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154.4	-178.7	-158.6	170.2	0	0	0	111.5	H553 C584 M595 W617 Y618 H619	H553-I562 PolarHBondContact CE1-O 3.1Å; I562-C584 HydrophobicContact CG2-CB 4.32Å; I562-C584 WeakPolarHBondContact O-CB 3.37Å; I562-C584 PolarHBondContact O-N 3.09Å; I562-M595 HydrophobicContact CD1-CB 4.19Å; I562-M595 HydrophobicContact CD1-CE 4.13Å; I562-M595 HydrophobicContact CG1-CE 3.89Å; I562-M595 HydrophobicContact CG2-CB 4.22Å; I562-M595 HydrophobicContact CG2-CG 4.22Å; I562-W617 HydrophobicContact CD1-CE3 3.97Å; I562-W617 HydrophobicContact CD1-CZ3 4.12Å; I562-W617 HydrophobicContact CG1-CE3 4.07Å; I562-W617 HydrophobicContact CG1-CZ3 4.46Å; I562-Y618 CarbonylContact C-O 3.58Å; I562-Y618 VanDerWaalsContact CA-O 3.31Å; I562-Y618 WeakPolarHBondContact CA-O 3.33Å; I562-Y618 WeakPolarHBondContact CG1-O 3.47Å; I562-H619 HydrophobicContact CB-CB 4.47Å; I562-H619 HydrophobicContact CG1-CB 4.19Å
563	G	97.3	Very high	94.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	175.3	174.5	0	0	0	0	0	113.8	E582 W617 Y618	G563-E582 CarbonylContact C-O 3.53Å; G563-E582 WeakPolarHBondContact CA-O 3.37Å; G563-W617 CarbonylContact O-C 3.59Å; G563-W617 VanDerWaalsContact O-CA 3.3Å; G563-W617 WeakPolarHBondContact O-CA 3.15Å; G563-W617 WeakPolarHBondContact O-CB 3.36Å; G563-Y618 VanDerWaalsContact CA-CE1 3.44Å; G563-Y618 PolarHBondContact N-O 3.14Å; G563-Y618 PolarHBondContact O-N 3.31Å
564	L	97.5	Very high	94.6	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	158.2	176.7	-69.8	179.4	0	0	0	111.8	A581 E582 M595 Q600 A603 C604 L607 V614	L564-A581 WeakPolarHBondContact O-CA 3.43Å; L564-E582 PolarHBondContact N-O 2.97Å; L564-E582 PolarHBondContact O-N 3.29Å; L564-M595 HydrophobicContact CD1-SD 4.45Å; L564-M595 HydrophobicContact CD2-CE 3.73Å; L564-M595 HydrophobicContact CD2-SD 3.86Å; L564-M595 HydrophobicContact CG-CE 4Å; L564-M595 HydrophobicContact CG-SD 3.85Å; L564-Q600 HydrophobicContact CD1-CG 4.33Å; L564-A603 HydrophobicContact CD1-CB 3.84Å; L564-A603 HydrophobicContact CG-CB 4.42Å; L564-C604 VanDerWaalsContact CD1-SG 3.56Å; L564-L607 HydrophobicContact CB-CD1 3.94Å; L564-V614 HydrophobicContact CD1-CG1 4.33Å; L564-V614 HydrophobicContact CD2-CG1 3.98Å
565	L	98	Very high	94.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123.4	174.9	-59.1	176.1	0	0	0	109.8	T546 M550 I578 A581 V615 G616 W617 Y618 I651 M653	T546-L565 HydrophobicContact CG2-CD2 3.89Å; M550-L565 HydrophobicContact CG-CD2 4.31Å; M550-L565 HydrophobicContact SD-CD2 3.71Å; L565-I578 HydrophobicContact CB-CG2 3.99Å; L565-I578 HydrophobicContact CD1-CD1 4.32Å; L565-I578 HydrophobicContact CD2-CG2 4.42Å; L565-A581 HydrophobicContact CD2-CB 3.93Å; L565-V615 HydrophobicContact CB-CG2 4.47Å; L565-V615 WeakPolarHBondContact O-CG2 3.07Å; L565-V615 PolarHBondContact O-N 3.41Å; L565-G616 PolarHBondContact N-O 2.95Å; L565-G616 PolarHBondContact O-N 3.09Å; L565-W617 WeakPolarHBondContact CD1-O 3.34Å; L565-Y618 HydrophobicContact CD2-CD1 3.71Å; L565-Y618 HydrophobicContact CD2-CE1 4.45Å; L565-Y618 HydrophobicContact CD2-CG 4.35Å; L565-Y618 HydrophobicContact CG-CD1 4.28Å; L565-I651 HydrophobicContact CD1-CD1 4.24Å; L565-I651 HydrophobicContact CD1-CG1 4.42Å; L565-M653 HydrophobicContact CD1-CB 4.25Å; L565-M653 HydrophobicContact CD1-CG 3.74Å; L565-M653 HydrophobicContact CD1-SD 3.67Å
566	G	96.8	Very high	94.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.9	177.2	0	0	0	0	0	112	R579 A580 S613	G566-R579 PolarHBondContact O-N 3.35Å; G566-A580 PolarHBondContact N-O 2.85Å; G566-A580 PolarHBondContact O-N 3.42Å; G566-A580 VanDerWaalsContact O-N 3.1Å; G566-S613 CarbonylContact C-O 3.49Å; G566-S613 WeakPolarHBondContact CA-O 3.36Å
567	G	95.7	Very high	94.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	-163.8	179.6	0	0	0	0	0	114.2	K577 S613	G567-K577 CarbonylContact C-O 3.54Å; G567-K577 WeakPolarHBondContact CA-O 3.49Å; G567-S613 PolarHBondContact N-O 3.4Å; G567-S613 PolarHBondContact O-N 3.18Å
568	T	94.6	Very high	94.6	Very high	58 Å²	58	52.4 Å²	52.4	36%	0.356	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	143.5	177.1	56.7	0	0	0	0	110.3	K577	T568-K577 PolarHBondContact N-O 3.36Å; T568-K577 PolarHBondContact O-N 3.14Å
569	F	94.4	Very high	94.8	Very high	58 Å²	58	48.2 Å²	48.2	25%	0.254	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.4	173.2	176.3	-121.3	0	0	0	109.7	F538 Q571 V575 L576 P649	F538-F569 HydrophobicContact CB-CE2 3.91Å; F538-F569 HydrophobicContact CG-CE2 4.29Å; F569-Q571 HydrophobicContact CD1-CB 4.12Å; F569-Q571 HydrophobicContact CE1-CB 3.62Å; F569-Q571 HydrophobicContact CE1-CG 3.84Å; F569-Q571 HydrophobicContact CZ-CB 4.28Å; F569-Q571 HydrophobicContact CZ-CG 4.4Å; F569-V575 WeakPolarHBondContact CD2-O 3.48Å; F569-L576 HydrophobicContact CB-CD1 4.33Å; F569-L576 HydrophobicContact CD2-CB 4.11Å; F569-P649 HydrophobicContact CB-CG 3.84Å; F569-P649 HydrophobicContact CD1-CG 4.05Å; F569-P649 HydrophobicContact CD2-CG 3.54Å; F569-P649 HydrophobicContact CE1-CG 4.46Å; F569-P649 HydrophobicContact CE2-CG 4.02Å; F569-P649 HydrophobicContact CG-CG 3.54Å; F569-P649 HydrophobicContact CZ-CG 4.45Å
570	N	92.8	Very high	95	Very high	70 Å²	70	46.5 Å²	46.5	37%	0.374	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	114.6	166.2	-176.2	-19.5	0	0	0	108.5	E572 E573 K574 V575	N570-E572 WeakPolarHBondContact OD1-CB 2.89Å; N570-E572 PolarHBondContact OD1-N 3.1Å; N570-E573 HydrophobicContact CB-CB 4.36Å; N570-E573 WeakPolarHBondContact ND2-CG 3.23Å; N570-E573 PolarHBondContact OD1-N 3.25Å; N570-K574 CarbonylContact O-C 3.56Å; N570-K574 WeakPolarHBondContact O-CA 3.2Å; N570-K574 PolarHBondContact O-N 2.98Å; N570-V575 PolarHBondContact N-O 3.07Å; N570-V575 PolarHBondContact O-N 3.36Å
571	Q	89.8	Confident	95.2	Very high	130 Å²	130	44 Å²	44	61%	0.607	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-19.2	-177.6	-170.8	164.8	0.2	0	0	113.8	F569	F569-Q571 HydrophobicContact CD1-CB 4.12Å; F569-Q571 HydrophobicContact CE1-CB 3.62Å; F569-Q571 HydrophobicContact CE1-CG 3.84Å; F569-Q571 HydrophobicContact CZ-CB 4.28Å; F569-Q571 HydrophobicContact CZ-CG 4.4Å
572	E	90.6	Very high	95.3	Very high	176 Å²	176	45.2 Å²	45.2	82%	0.822	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-53.1	175.9	-57.8	-174.7	154.4	0	0	110	N570 K574	N570-E572 WeakPolarHBondContact OD1-CB 2.89Å; N570-E572 PolarHBondContact OD1-N 3.1Å; E572-K574 VanDerWaalsContact C-N 3.27Å; E572-K574 PolarHBondContact O-N 3.44Å
573	E	91.9	Very high	95.4	Very high	138 Å²	138	45.1 Å²	45.1	65%	0.645	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-16.3	175.5	-62.4	-61.5	152.7	0	0	113.2	N570 V575	N570-E573 HydrophobicContact CB-CB 4.36Å; N570-E573 WeakPolarHBondContact ND2-CG 3.23Å; N570-E573 PolarHBondContact OD1-N 3.25Å; E573-V575 VanDerWaalsContact C-N 3.33Å; E573-V575 HydrophobicContact CB-CB 4.41Å; E573-V575 HydrophobicContact CB-CG2 3.93Å; E573-V575 PolarHBondContact O-N 3.29Å
574	K	93.1	Very high	95.3	Very high	123 Å²	123	45.1 Å²	45.1	54%	0.535	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	48.3	-169.1	-54.4	177.8	-175.7	173.8	0	112.4	F538 Q539 N570 E572	F538-K574 CarbonylContact C-O 3.6Å; F538-K574 WeakPolarHBondContact CA-O 3.28Å; F538-K574 HydrophobicContact CB-CB 4.17Å; F538-K574 WeakPolarHBondContact CB-O 3.22Å; Q539-K574 PolarHBondContact N-O 2.93Å; N570-K574 CarbonylContact O-C 3.56Å; N570-K574 WeakPolarHBondContact O-CA 3.2Å; N570-K574 PolarHBondContact O-N 2.98Å; E572-K574 VanDerWaalsContact C-N 3.27Å; E572-K574 PolarHBondContact O-N 3.44Å
575	V	95.3	Very high	95	Very high	31 Å²	31	47.9 Å²	47.9	19%	0.188	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.5	177.3	176.4	0	0	0	0	109.2	Q539 I541 F569 N570 E573	Q539-V575 HydrophobicContact CB-CG2 4.45Å; I541-V575 HydrophobicContact CD1-CG1 3.68Å; I541-V575 HydrophobicContact CG1-CG1 4.01Å; F569-V575 WeakPolarHBondContact CD2-O 3.48Å; N570-V575 PolarHBondContact N-O 3.07Å; N570-V575 PolarHBondContact O-N 3.36Å; E573-V575 VanDerWaalsContact C-N 3.33Å; E573-V575 HydrophobicContact CB-CB 4.41Å; E573-V575 HydrophobicContact CB-CG2 3.93Å; E573-V575 PolarHBondContact O-N 3.29Å
576	L	96.2	Very high	94.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	118.7	165.5	172.1	61.1	0	0	0	108.8	F538 Q539 V540 I541 F569 I578 V615 P649 I651	F538-L576 HydrophobicContact CD2-CB 3.91Å; F538-L576 HydrophobicContact CE2-CB 4.18Å; F538-L576 HydrophobicContact CE2-CD2 3.95Å; Q539-L576 PolarHBondContact O-N 3.19Å; V540-L576 WeakPolarHBondContact CA-O 3.35Å; I541-L576 PolarHBondContact N-O 3.45Å; F569-L576 HydrophobicContact CB-CD1 4.33Å; F569-L576 HydrophobicContact CD2-CB 4.11Å; L576-I578 HydrophobicContact CD2-CD1 4.47Å; L576-I578 HydrophobicContact CD2-CG1 4.44Å; L576-I578 HydrophobicContact CG-CG1 4.19Å; L576-V615 HydrophobicContact CD1-CB 3.64Å; L576-V615 HydrophobicContact CD1-CG1 3.69Å; L576-V615 HydrophobicContact CD1-CG2 3.97Å; L576-P649 HydrophobicContact CB-CG 4.23Å; L576-P649 HydrophobicContact CD1-CG 4Å; L576-P649 HydrophobicContact CD2-CB 4.3Å; L576-P649 HydrophobicContact CD2-CG 4.13Å; L576-P649 HydrophobicContact CG-CG 4.33Å; L576-I651 HydrophobicContact CD2-CG1 4.3Å; L576-I651 HydrophobicContact CD2-CG2 3.87Å
577	K	96.5	Very high	93.9	Very high	43 Å²	43	52.9 Å²	52.9	19%	0.187	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	110.3	177.8	-165.4	168	-162.1	172.7	0	110.9	I541 G567 T568 R579 S695 D697	I541-K577 HydrophobicContact CB-CG 4.4Å; I541-K577 HydrophobicContact CG2-CG 4.46Å; I541-K577 CarbonylContact O-C 3.4Å; I541-K577 WeakPolarHBondContact O-CA 3.33Å; G567-K577 CarbonylContact C-O 3.54Å; G567-K577 WeakPolarHBondContact CA-O 3.49Å; T568-K577 PolarHBondContact N-O 3.36Å; T568-K577 PolarHBondContact O-N 3.14Å; K577-R579 HydrophobicContact CG-CG 4.38Å; K577-S695 WeakPolarHBondContact CE-OG 3.32Å; K577-S695 PolarHBondContact NZ-OG 3.13Å; K577-S695 VanDerWaalsContact NZ-OG 3.16Å; K577-D697 WeakPolarHBondContact CE-OD1 2.94Å; K577-D697 VanDerWaalsContact CE-OD2 3.27Å; K577-D697 WeakPolarHBondContact CE-OD2 3.49Å; K577-D697 IonicContact NZ-OD1 2.79Å; K577-D697 PolarHBondContact NZ-OD1 2.92Å; K577-D697 IonicContact NZ-OD2 3.68Å; K577-D697 PolarHBondContact NZ-OD2 2.83Å
578	I	97.3	Very high	92.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.8	178.5	-46.9	-176.5	0	0	0	108	V540 I541 V542 C543 T546 L565 L576 V615 I651 M653	V540-I578 HydrophobicContact CG1-CD1 4.06Å; V540-I578 HydrophobicContact CG1-CG1 4.49Å; I541-I578 PolarHBondContact O-N 3.46Å; V542-I578 HydrophobicContact CG1-CB 4.34Å; V542-I578 HydrophobicContact CG2-CD1 4.28Å; C543-I578 PolarHBondContact N-O 3.15Å; C543-I578 PolarHBondContact SG-O 2.74Å; T546-I578 HydrophobicContact CG2-CG2 3.7Å; L565-I578 HydrophobicContact CB-CG2 3.99Å; L565-I578 HydrophobicContact CD1-CD1 4.32Å; L565-I578 HydrophobicContact CD2-CG2 4.42Å; L576-I578 HydrophobicContact CD2-CD1 4.47Å; L576-I578 HydrophobicContact CD2-CG1 4.44Å; L576-I578 HydrophobicContact CG-CG1 4.19Å; I578-V615 HydrophobicContact CG1-CG2 4.2Å; I578-V615 HydrophobicContact CG2-CG2 4.49Å; I578-I651 HydrophobicContact CD1-CD1 3.39Å; I578-I651 HydrophobicContact CD1-CG1 4.02Å; I578-M653 HydrophobicContact CD1-SD 4.19Å
579	R	95.9	Very high	91.3	Very high	87 Å²	87	58.6 Å²	58.6	33%	0.328	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-42.5	-169.8	-70.8	-169.4	145.4	174.5	-9.2	113.1	T546 G566 K577 F612 D697	T546-R579 PolarHBondContact OG1-O 3.04Å; G566-R579 PolarHBondContact O-N 3.35Å; K577-R579 HydrophobicContact CG-CG 4.38Å; R579-F612 HydrophobicContact CB-CD1 4.4Å; R579-F612 HydrophobicContact CB-CD2 4.5Å; R579-F612 HydrophobicContact CB-CE1 3.89Å; R579-F612 HydrophobicContact CB-CE2 3.99Å; R579-F612 HydrophobicContact CB-CZ 3.67Å; R579-F612 HydrophobicContact CG-CE1 4.28Å; R579-F612 HydrophobicContact CG-CZ 4.42Å; R579-D697 IonicContact CZ-OD2 3.23Å; R579-D697 IonicContact NE-OD2 2.84Å; R579-D697 IonicContact NH2-OD2 3.77Å; R579-D697 PolarHBondContact NH2-OD2 2.76Å
580	A	96.8	Very high	89.7	Confident	1 Å²	1	59 Å²	59	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.5	177.8	0	0	0	0	0	111.6	T546 G566 L607 F612	T546-A580 PolarHBondContact OG1-N 3.17Å; G566-A580 PolarHBondContact N-O 2.85Å; G566-A580 PolarHBondContact O-N 3.42Å; G566-A580 VanDerWaalsContact O-N 3.1Å; A580-L607 HydrophobicContact CB-CD2 3.73Å; A580-F612 HydrophobicContact CB-CD2 3.9Å; A580-F612 HydrophobicContact CB-CE2 3.92Å
581	A	97.9	Very high	88.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.7	162.6	0	0	0	0	0	108.4	T546 I549 M550 L564 L565 P583 Y618 R707	T546-A581 HydrophobicContact CG2-CB 3.79Å; I549-A581 HydrophobicContact CB-CB 4.2Å; I549-A581 HydrophobicContact CG2-CB 4.05Å; M550-A581 HydrophobicContact CG-CB 3.85Å; L564-A581 WeakPolarHBondContact O-CA 3.43Å; L565-A581 HydrophobicContact CD2-CB 3.93Å; A581-P583 WeakPolarHBondContact O-CD 3.25Å; A581-Y618 HydrophobicContact CB-CD1 4.48Å; A581-Y618 HydrophobicContact CB-CE1 3.93Å; A581-R707 WeakPolarHBondContact O-CD 3.21Å; A581-R707 PolarHBondContact O-NE 3Å
582	E	97.8	Very high	87.4	Confident	26 Å²	26	58.6 Å²	58.6	12%	0.121	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	103.9	179.7	-158.2	59.1	-126.5	0	0	110.7	G563 L564 C584 A603 V606 L607 R707	G563-E582 CarbonylContact C-O 3.53Å; G563-E582 WeakPolarHBondContact CA-O 3.37Å; L564-E582 PolarHBondContact N-O 2.97Å; L564-E582 PolarHBondContact O-N 3.29Å; E582-C584 PolarHBondContact O-N 3.46Å; E582-C584 PolarHBondContact O-SG 3.3Å; E582-A603 HydrophobicContact CB-CB 3.96Å; E582-A603 HydrophobicContact CG-CB 3.56Å; E582-V606 HydrophobicContact CG-CG1 4.46Å; E582-V606 WeakPolarHBondContact OE2-CG1 3.28Å; E582-L607 HydrophobicContact CB-CD1 4.28Å; E582-L607 HydrophobicContact CB-CD2 4.23Å; E582-L607 HydrophobicContact CB-CG 4.17Å; E582-R707 IonicContact OE1-NE 3.35Å; E582-R707 IonicContact OE1-NH2 2.62Å; E582-R707 IonicContact OE2-CZ 3.83Å; E582-R707 IonicContact OE2-NE 2.78Å; E582-R707 PolarHBondContact OE2-NE 3.41Å; E582-R707 IonicContact OE2-NH2 2.78Å; E582-R707 PolarHBondContact OE2-NH2 3.19Å
583	P	97.1	Very high	86.9	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.032	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	128.7	175.8	-28.3	37.9	0	0	0	112.2	I549 A581 W710 I711	I549-P583 HydrophobicContact CG2-CG 3.55Å; A581-P583 WeakPolarHBondContact O-CD 3.25Å; P583-W710 HydrophobicContact CB-CE3 3.75Å; P583-W710 HydrophobicContact CB-CH2 3.79Å; P583-W710 HydrophobicContact CB-CZ3 3.23Å; P583-W710 HydrophobicContact CG-CE3 4.47Å; P583-W710 HydrophobicContact CG-CZ3 4.35Å; P583-W710 WeakPolarHBondContact O-CH2 3.29Å; P583-I711 HydrophobicContact CB-CG1 4.47Å; P583-I711 HydrophobicContact CG-CD1 4.05Å; P583-I711 HydrophobicContact CG-CG1 4.13Å
584	C	95.4	Very high	86.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	161.6	179.3	-68.6	0	0	0	0	112.3	I562 E582 M595 S599 K714	I562-C584 HydrophobicContact CG2-CB 4.32Å; I562-C584 WeakPolarHBondContact O-CB 3.37Å; I562-C584 PolarHBondContact O-N 3.09Å; E582-C584 PolarHBondContact O-N 3.46Å; E582-C584 PolarHBondContact O-SG 3.3Å; C584-M595 HydrophobicContact CB-CG 3.71Å; C584-M595 HydrophobicContact CB-SD 4.21Å; C584-S599 WeakPolarHBondContact CA-OG 3.47Å; C584-K714 PolarHBondContact O-NZ 2.56Å
585	N	92.1	Very high	86.4	Confident	59 Å²	59	43.5 Å²	43.5	32%	0.316	25%	0.25	S	S	.	.			trans	-71.9	139.9	162.6	-65.1	-28.4	0	0	0	109.9	D596 S599 K714	N585-D596 HydrophobicContact CB-CB 3.86Å; N585-D596 WeakPolarHBondContact O-CB 3.23Å; N585-D596 PolarHBondContact O-N 2.97Å; N585-S599 PolarHBondContact N-OG 2.98Å; N585-K714 WeakPolarHBondContact OD1-CE 3.33Å; N585-K714 PolarHBondContact OD1-NZ 2.87Å
586	S	88.2	Confident	86.2	Confident	41 Å²	41	43.9 Å²	43.9	29%	0.287	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.2	174.9	46.4	0	0	0	0	111.2	C593 E594	S586-C593 WeakPolarHBondContact CB-SG 3.24Å; S586-E594 CarbonylContact C-O 3.56Å; S586-E594 WeakPolarHBondContact CA-O 3.3Å
587	V	82.4	Confident	85.9	Confident	64 Å²	64	47.9 Å²	47.9	39%	0.388	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	105.3	166.8	-178.6	0	0	0	0	106.8	E594 D596	V587-E594 PolarHBondContact N-O 3.46Å; V587-E594 PolarHBondContact O-N 3.48Å; V587-E594 VanDerWaalsContact O-N 3.1Å; V587-D596 HydrophobicContact CG2-CB 3.92Å
588	S	72.3	Confident	85.8	Confident	85 Å²	85	50.1 Å²	50.1	59%	0.594	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	112.4	176.5	-177.3	0	0	0	0	110.8	G590 Q592	S588-G590 PolarHBondContact O-N 2.91Å; S588-G590 PolarHBondContact OG-N 3.46Å; S588-Q592 WeakPolarHBondContact CA-O 3.15Å
589	T	63.6	Low	85.7	Confident	93 Å²	93	50.3 Å²	50.3	57%	0.571	30%	0.296	S	S	*	.			trans	-92.2	41.6	169.3	48.5	0	0	0	0	111.6	L591 Q592	T589-L591 PolarHBondContact O-N 3.29Å; T589-Q592 PolarHBondContact N-O 3.09Å; T589-Q592 WeakPolarHBondContact OG1-CB 3.48Å; T589-Q592 WeakPolarHBondContact OG1-CG 2.84Å; T589-Q592 PolarHBondContact OG1-O 3.32Å
590	G	61.2	Low	85.6	Confident	66 Å²	66	48.6 Å²	48.6	68%	0.68	29%	0.292	S	S	*	.	S	Bend	trans	80	-46.1	174.9	0	0	0	0	0	114.9	S588	S588-G590 PolarHBondContact O-N 2.91Å; S588-G590 PolarHBondContact OG-N 3.46Å
591	L	63.4	Low	85.4	Confident	130 Å²	130	52.5 Å²	52.5	68%	0.681	32%	0.316	S	S	*	.	S	Bend	trans	-117.5	3	176.7	-65.4	176.8	0	0	0	113.2	F522 T589	F522-L591 HydrophobicContact CE1-CB 4.31Å; F522-L591 WeakPolarHBondContact CE1-O 3.47Å; F522-L591 HydrophobicContact CE2-CB 4.41Å; F522-L591 HydrophobicContact CE2-CD1 4.28Å; F522-L591 HydrophobicContact CZ-CB 3.77Å; F522-L591 HydrophobicContact CZ-CD1 4.41Å; T589-L591 PolarHBondContact O-N 3.29Å
592	Q	69.6	Low	85.3	Confident	62 Å²	62	57.8 Å²	57.8	29%	0.29	34%	0.34	S	S	.	.			trans	-144.4	104.6	-163.7	158.5	148.6	14.9	0	0	109.6	S588 T589 E594	S588-Q592 WeakPolarHBondContact CA-O 3.15Å; T589-Q592 PolarHBondContact N-O 3.09Å; T589-Q592 WeakPolarHBondContact OG1-CB 3.48Å; T589-Q592 WeakPolarHBondContact OG1-CG 2.84Å; T589-Q592 PolarHBondContact OG1-O 3.32Å; Q592-E594 HydrophobicContact CG-CG 3.81Å; Q592-E594 PolarHBondContact NE2-OE1 2.93Å
593	C	80.8	Confident	85.2	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.068	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	117.9	166.3	-174.6	0	0	0	0	109.6	E560 S586 R631	E560-C593 HydrophobicContact CB-CB 3.76Å; E560-C593 PolarHBondContact O-SG 3.48Å; E560-C593 VanDerWaalsContact O-SG 3.35Å; E560-C593 WeakPolarHBondContact OE2-CB 3.49Å; S586-C593 WeakPolarHBondContact CB-SG 3.24Å; C593-R631 PolarHBondContact O-NH1 3.14Å; C593-R631 VanDerWaalsContact O-NH1 3.17Å; C593-R631 PolarHBondContact O-NH2 3.49Å
594	E	86.6	Confident	85.1	Confident	93 Å²	93	58 Å²	58	44%	0.435	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	156.6	167.2	-62.3	-163.6	141.5	0	0	110.1	S586 V587 Q592 R631	S586-E594 CarbonylContact C-O 3.56Å; S586-E594 WeakPolarHBondContact CA-O 3.3Å; V587-E594 PolarHBondContact N-O 3.46Å; V587-E594 PolarHBondContact O-N 3.48Å; V587-E594 VanDerWaalsContact O-N 3.1Å; Q592-E594 HydrophobicContact CG-CG 3.81Å; Q592-E594 PolarHBondContact NE2-OE1 2.93Å; E594-R631 IonicContact OE1-NH2 3.5Å
595	M	87.1	Confident	85.2	Confident	17 Å²	17	62.8 Å²	62.8	8%	0.084	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.2	172.3	-157.7	173.3	-68.8	0	0	109.3	I562 L564 C584 Q600	I562-M595 HydrophobicContact CD1-CB 4.19Å; I562-M595 HydrophobicContact CD1-CE 4.13Å; I562-M595 HydrophobicContact CG1-CE 3.89Å; I562-M595 HydrophobicContact CG2-CB 4.22Å; I562-M595 HydrophobicContact CG2-CG 4.22Å; L564-M595 HydrophobicContact CD1-SD 4.45Å; L564-M595 HydrophobicContact CD2-CE 3.73Å; L564-M595 HydrophobicContact CD2-SD 3.86Å; L564-M595 HydrophobicContact CG-CE 4Å; L564-M595 HydrophobicContact CG-SD 3.85Å; C584-M595 HydrophobicContact CB-CG 3.71Å; C584-M595 HydrophobicContact CB-SD 4.21Å; M595-Q600 HydrophobicContact CG-CB 4Å; M595-Q600 HydrophobicContact CG-CG 4.47Å; M595-Q600 HydrophobicContact SD-CB 3.75Å; M595-Q600 HydrophobicContact SD-CG 3.63Å
596	D	91.6	Very high	85.4	Confident	39 Å²	39	62.6 Å²	62.6	21%	0.209	37%	0.371	C	S	.	.			trans	-63.3	127.1	171	169	57.9	0	0	0	110.2	N585 V587 V598 S599 Q600	N585-D596 HydrophobicContact CB-CB 3.86Å; N585-D596 WeakPolarHBondContact O-CB 3.23Å; N585-D596 PolarHBondContact O-N 2.97Å; V587-D596 HydrophobicContact CG2-CB 3.92Å; D596-V598 VanDerWaalsContact C-N 3.28Å; D596-V598 PolarHBondContact O-N 3.01Å; D596-V598 WeakPolarHBondContact OD2-CB 3.39Å; D596-V598 PolarHBondContact OD2-N 3.43Å; D596-S599 PolarHBondContact O-N 2.82Å; D596-S599 WeakPolarHBondContact OD2-CB 3.35Å; D596-S599 PolarHBondContact OD2-N 3.39Å; D596-Q600 WeakPolarHBondContact O-CB 3.46Å; D596-Q600 PolarHBondContact O-N 3.42Å
597	P	91.1	Very high	85.8	Confident	84 Å²	84	60.6 Å²	60.6	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-59.9	-32.9	-176.9	-27.4	36	0	0	0	114.7	T601	P597-T601 PolarHBondContact O-N 3.47Å; P597-T601 VanDerWaalsContact O-N 3.13Å; P597-T601 PolarHBondContact O-OG1 2.71Å
598	V	94	Very high	86.4	Confident	90 Å²	90	61.2 Å²	61.2	55%	0.545	36%	0.364	S	S	.	.	H	α-helix	trans	-72	-47.7	179.2	-177.4	0	0	0	0	109.9	D596 Q600 T601 Q602	D596-V598 VanDerWaalsContact C-N 3.28Å; D596-V598 PolarHBondContact O-N 3.01Å; D596-V598 WeakPolarHBondContact OD2-CB 3.39Å; D596-V598 PolarHBondContact OD2-N 3.43Å; V598-Q600 VanDerWaalsContact C-N 3.27Å; V598-Q600 PolarHBondContact O-N 3.33Å; V598-T601 PolarHBondContact O-N 3.11Å; V598-Q602 WeakPolarHBondContact O-CG 3.1Å; V598-Q602 PolarHBondContact O-N 3.23Å
599	S	94.3	Very high	87.5	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.035	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-32.7	173.7	-171.9	0	0	0	0	112.8	C584 N585 D596 A603	C584-S599 WeakPolarHBondContact CA-OG 3.47Å; N585-S599 PolarHBondContact N-OG 2.98Å; D596-S599 PolarHBondContact O-N 2.82Å; D596-S599 WeakPolarHBondContact OD2-CB 3.35Å; D596-S599 PolarHBondContact OD2-N 3.39Å; S599-A603 VanDerWaalsContact O-CB 3.25Å; S599-A603 WeakPolarHBondContact O-CB 3.34Å; S599-A603 PolarHBondContact O-N 2.89Å
600	Q	93.5	Very high	88.9	Confident	50 Å²	50	59.9 Å²	59.9	23%	0.234	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-47.7	174.4	-176.6	176.7	20.7	0	0	111	L564 M595 D596 V598 A603 C604	L564-Q600 HydrophobicContact CD1-CG 4.33Å; M595-Q600 HydrophobicContact CG-CB 4Å; M595-Q600 HydrophobicContact CG-CG 4.47Å; M595-Q600 HydrophobicContact SD-CB 3.75Å; M595-Q600 HydrophobicContact SD-CG 3.63Å; D596-Q600 WeakPolarHBondContact O-CB 3.46Å; D596-Q600 PolarHBondContact O-N 3.42Å; V598-Q600 VanDerWaalsContact C-N 3.27Å; V598-Q600 PolarHBondContact O-N 3.33Å; Q600-A603 PolarHBondContact O-N 3.32Å; Q600-C604 PolarHBondContact O-N 3.38Å; Q600-C604 PolarHBondContact O-SG 3.26Å
601	T	94	Very high	90.5	Very high	84 Å²	84	59.6 Å²	59.6	52%	0.515	35%	0.351	S	S	.	.	H	α-helix	trans	-61.6	-47.8	175.8	-61.9	0	0	0	0	111.2	P597 V598 A603 C604 D605	P597-T601 PolarHBondContact O-N 3.47Å; P597-T601 VanDerWaalsContact O-N 3.13Å; P597-T601 PolarHBondContact O-OG1 2.71Å; V598-T601 PolarHBondContact O-N 3.11Å; T601-A603 VanDerWaalsContact C-N 3.29Å; T601-A603 PolarHBondContact O-N 2.97Å; T601-C604 WeakPolarHBondContact O-CB 3.32Å; T601-C604 PolarHBondContact O-N 3.28Å; T601-C604 VanDerWaalsContact O-N 3.12Å; T601-D605 VanDerWaalsContact O-CG 3.31Å; T601-D605 PolarHBondContact O-N 2.77Å
602	Q	95.8	Very high	92	Very high	111 Å²	111	55.3 Å²	55.3	52%	0.519	33%	0.327	S	S	.	.	H	α-helix	trans	-56.8	-42.1	176.7	-71.3	171.4	-16.3	0	0	112.3	V598 D605 V606	V598-Q602 WeakPolarHBondContact O-CG 3.1Å; V598-Q602 PolarHBondContact O-N 3.23Å; Q602-D605 PolarHBondContact O-N 3.18Å; Q602-V606 WeakPolarHBondContact O-CG2 3.48Å; Q602-V606 PolarHBondContact O-N 3.41Å
603	A	95.8	Very high	93.2	Very high	4 Å²	4	56.2 Å²	56.2	3%	0.033	34%	0.34	C	S	.	.	H	α-helix	trans	-67.7	-39.4	176.8	0	0	0	0	0	112.7	L564 E582 S599 Q600 T601 D605 V606 L607	L564-A603 HydrophobicContact CD1-CB 3.84Å; L564-A603 HydrophobicContact CG-CB 4.42Å; E582-A603 HydrophobicContact CB-CB 3.96Å; E582-A603 HydrophobicContact CG-CB 3.56Å; S599-A603 VanDerWaalsContact O-CB 3.25Å; S599-A603 WeakPolarHBondContact O-CB 3.34Å; S599-A603 PolarHBondContact O-N 2.89Å; Q600-A603 PolarHBondContact O-N 3.32Å; T601-A603 VanDerWaalsContact C-N 3.29Å; T601-A603 PolarHBondContact O-N 2.97Å; A603-D605 VanDerWaalsContact C-N 3.34Å; A603-D605 PolarHBondContact O-N 2.92Å; A603-V606 PolarHBondContact O-N 3.03Å; A603-L607 WeakPolarHBondContact O-CB 3.41Å; A603-L607 VanDerWaalsContact O-CG 3.29Å; A603-L607 WeakPolarHBondContact O-CG 3.31Å; A603-L607 PolarHBondContact O-N 3.39Å
604	C	95.4	Very high	93.9	Very high	32 Å²	32	57.1 Å²	57.1	22%	0.216	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-42.8	171.3	-71.2	0	0	0	0	112	L564 Q600 T601 S608	L564-C604 VanDerWaalsContact CD1-SG 3.56Å; Q600-C604 PolarHBondContact O-N 3.38Å; Q600-C604 PolarHBondContact O-SG 3.26Å; T601-C604 WeakPolarHBondContact O-CB 3.32Å; T601-C604 PolarHBondContact O-N 3.28Å; T601-C604 VanDerWaalsContact O-N 3.12Å; C604-S608 VanDerWaalsContact O-CB 3.28Å; C604-S608 WeakPolarHBondContact O-CB 3.45Å; C604-S608 PolarHBondContact O-N 3.48Å; C604-S608 PolarHBondContact O-OG 3.2Å
605	D	96.4	Very high	94.4	Very high	100 Å²	100	53 Å²	53	54%	0.535	33%	0.326	S	S	.	.	H	α-helix	trans	-67	-43.2	179.8	-65.4	-27.1	0	0	0	111.4	T601 Q602 A603 S608 S609	T601-D605 VanDerWaalsContact O-CG 3.31Å; T601-D605 PolarHBondContact O-N 2.77Å; Q602-D605 PolarHBondContact O-N 3.18Å; A603-D605 VanDerWaalsContact C-N 3.34Å; A603-D605 PolarHBondContact O-N 2.92Å; D605-S608 PolarHBondContact O-N 2.75Å; D605-S609 WeakPolarHBondContact O-CB 3.37Å; D605-S609 PolarHBondContact O-N 3.26Å
606	V	96.1	Very high	94.8	Very high	54 Å²	54	52.1 Å²	52.1	33%	0.327	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-51.5	174.4	169.7	0	0	0	0	111	E582 Q602 A603 S608 S609 L610	E582-V606 HydrophobicContact CG-CG1 4.46Å; E582-V606 WeakPolarHBondContact OE2-CG1 3.28Å; Q602-V606 WeakPolarHBondContact O-CG2 3.48Å; Q602-V606 PolarHBondContact O-N 3.41Å; A603-V606 PolarHBondContact O-N 3.03Å; V606-S608 VanDerWaalsContact C-N 3.29Å; V606-S608 PolarHBondContact O-N 2.82Å; V606-S609 PolarHBondContact O-N 3.47Å; V606-S609 PolarHBondContact O-OG 3.42Å; V606-L610 HydrophobicContact CG1-CD1 4.44Å; V606-L610 PolarHBondContact O-N 2.6Å
607	L	96.3	Very high	95.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-39.6	177.8	-68.3	178.2	0	0	0	112.2	L564 A580 E582 A603 L610 G611 F612 V614	L564-L607 HydrophobicContact CB-CD1 3.94Å; A580-L607 HydrophobicContact CB-CD2 3.73Å; E582-L607 HydrophobicContact CB-CD1 4.28Å; E582-L607 HydrophobicContact CB-CD2 4.23Å; E582-L607 HydrophobicContact CB-CG 4.17Å; A603-L607 WeakPolarHBondContact O-CB 3.41Å; A603-L607 VanDerWaalsContact O-CG 3.29Å; A603-L607 WeakPolarHBondContact O-CG 3.31Å; A603-L607 PolarHBondContact O-N 3.39Å; L607-L610 PolarHBondContact O-N 2.77Å; L607-G611 PolarHBondContact O-N 3.49Å; L607-F612 CarbonylContact C-O 3.53Å; L607-F612 PolarHBondContact O-N 2.92Å; L607-V614 HydrophobicContact CD1-CG2 4.26Å
608	S	95.7	Very high	95.4	Very high	76 Å²	76	46.7 Å²	46.7	53%	0.531	29%	0.288	S	S	.	.	H	α-helix	trans	-65	-38.8	176.2	-59	0	0	0	0	112.3	C604 D605 V606 L610 G611	C604-S608 VanDerWaalsContact O-CB 3.28Å; C604-S608 WeakPolarHBondContact O-CB 3.45Å; C604-S608 PolarHBondContact O-N 3.48Å; C604-S608 PolarHBondContact O-OG 3.2Å; D605-S608 PolarHBondContact O-N 2.75Å; V606-S608 VanDerWaalsContact C-N 3.29Å; V606-S608 PolarHBondContact O-N 2.82Å; S608-L610 VanDerWaalsContact C-N 3.25Å; S608-L610 PolarHBondContact O-N 3.41Å; S608-G611 PolarHBondContact O-N 3.44Å
609	S	95.9	Very high	95.5	Very high	96 Å²	96	42.6 Å²	42.6	67%	0.671	26%	0.263	S	S	*	.	H	α-helix	trans	-65.8	-26.5	176	74.8	0	0	0	0	113.7	D605 V606 G611	D605-S609 WeakPolarHBondContact O-CB 3.37Å; D605-S609 PolarHBondContact O-N 3.26Å; V606-S609 PolarHBondContact O-N 3.47Å; V606-S609 PolarHBondContact O-OG 3.42Å; S609-G611 VanDerWaalsContact C-N 3.25Å
610	L	93.5	Very high	95.6	Very high	54 Å²	54	42.4 Å²	42.4	28%	0.283	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	2.2	171.9	-62.3	174.3	0	0	0	112.8	V606 L607 S608 F612	V606-L610 HydrophobicContact CG1-CD1 4.44Å; V606-L610 PolarHBondContact O-N 2.6Å; L607-L610 PolarHBondContact O-N 2.77Å; S608-L610 VanDerWaalsContact C-N 3.25Å; S608-L610 PolarHBondContact O-N 3.41Å; L610-F612 VanDerWaalsContact C-N 3.35Å; L610-F612 HydrophobicContact CB-CD2 3.71Å; L610-F612 HydrophobicContact CB-CE2 3.81Å; L610-F612 HydrophobicContact CB-CG 4.42Å; L610-F612 HydrophobicContact CD1-CD2 4.42Å; L610-F612 HydrophobicContact CD1-CE2 4.33Å
611	G	94.7	Very high	95.7	Very high	60 Å²	60	40 Å²	40	62%	0.619	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	21.1	-178.8	0	0	0	0	0	114.2	L607 S608 S609	L607-G611 PolarHBondContact O-N 3.49Å; S608-G611 PolarHBondContact O-N 3.44Å; S609-G611 VanDerWaalsContact C-N 3.25Å
612	F	95.1	Very high	95.6	Very high	41 Å²	41	36.3 Å²	36.3	18%	0.18	23%	0.227	C	C	.	.			trans	-105.3	138.1	-179.6	-58.6	-37.5	0	0	0	112.4	R579 A580 L607 L610	R579-F612 HydrophobicContact CB-CD1 4.4Å; R579-F612 HydrophobicContact CB-CD2 4.5Å; R579-F612 HydrophobicContact CB-CE1 3.89Å; R579-F612 HydrophobicContact CB-CE2 3.99Å; R579-F612 HydrophobicContact CB-CZ 3.67Å; R579-F612 HydrophobicContact CG-CE1 4.28Å; R579-F612 HydrophobicContact CG-CZ 4.42Å; A580-F612 HydrophobicContact CB-CD2 3.9Å; A580-F612 HydrophobicContact CB-CE2 3.92Å; L607-F612 CarbonylContact C-O 3.53Å; L607-F612 PolarHBondContact O-N 2.92Å; L610-F612 VanDerWaalsContact C-N 3.35Å; L610-F612 HydrophobicContact CB-CD2 3.71Å; L610-F612 HydrophobicContact CB-CE2 3.81Å; L610-F612 HydrophobicContact CB-CG 4.42Å; L610-F612 HydrophobicContact CD1-CD2 4.42Å; L610-F612 HydrophobicContact CD1-CE2 4.33Å
613	S	94.3	Very high	95.4	Very high	80 Å²	80	34.5 Å²	34.5	56%	0.559	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	148.7	167.3	-64.6	0	0	0	0	110	G566 G567 V615	G566-S613 CarbonylContact C-O 3.49Å; G566-S613 WeakPolarHBondContact CA-O 3.36Å; G567-S613 PolarHBondContact N-O 3.4Å; G567-S613 PolarHBondContact O-N 3.18Å; S613-V615 PolarHBondContact O-N 3.07Å
614	V	95.4	Very high	95.3	Very high	29 Å²	29	37.6 Å²	37.6	18%	0.176	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	115.2	168.4	-172.8	0	0	0	0	108.7	L564 L607 F650	L564-V614 HydrophobicContact CD1-CG1 4.33Å; L564-V614 HydrophobicContact CD2-CG1 3.98Å; L607-V614 HydrophobicContact CD1-CG2 4.26Å; V614-F650 HydrophobicContact CG1-CE2 4.19Å
615	V	95.8	Very high	95.2	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.036	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	1.8	-173.6	-65.5	0	0	0	0	113.3	L565 L576 I578 S613 F650 I651	L565-V615 HydrophobicContact CB-CG2 4.47Å; L565-V615 WeakPolarHBondContact O-CG2 3.07Å; L565-V615 PolarHBondContact O-N 3.41Å; L576-V615 HydrophobicContact CD1-CB 3.64Å; L576-V615 HydrophobicContact CD1-CG1 3.69Å; L576-V615 HydrophobicContact CD1-CG2 3.97Å; I578-V615 HydrophobicContact CG1-CG2 4.2Å; I578-V615 HydrophobicContact CG2-CG2 4.49Å; S613-V615 PolarHBondContact O-N 3.07Å; V615-F650 WeakPolarHBondContact O-CA 3.26Å; V615-I651 PolarHBondContact O-N 3.33Å
616	G	96.4	Very high	95.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.9	-170.5	176.5	0	0	0	0	0	113.7	L565 F650 I651	L565-G616 PolarHBondContact N-O 2.95Å; L565-G616 PolarHBondContact O-N 3.09Å; G616-F650 VanDerWaalsContact C-CZ 3.5Å; G616-F650 VanDerWaalsContact CA-CE2 3.46Å; G616-I651 CarbonylContact C-O 3.56Å; G616-I651 WeakPolarHBondContact CA-O 3.42Å
617	W	97.1	Very high	95.1	Very high	8 Å²	8	33.4 Å²	33.4	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	162.8	172.8	67.7	-61.2	0	0	0	109.4	I562 G563 L565 H619 D632 T635 Q636 F639 F650 I651 G652 M653	I562-W617 HydrophobicContact CD1-CE3 3.97Å; I562-W617 HydrophobicContact CD1-CZ3 4.12Å; I562-W617 HydrophobicContact CG1-CE3 4.07Å; I562-W617 HydrophobicContact CG1-CZ3 4.46Å; G563-W617 CarbonylContact O-C 3.59Å; G563-W617 VanDerWaalsContact O-CA 3.3Å; G563-W617 WeakPolarHBondContact O-CA 3.15Å; G563-W617 WeakPolarHBondContact O-CB 3.36Å; L565-W617 WeakPolarHBondContact CD1-O 3.34Å; W617-H619 HydrophobicContact CE3-CB 4.4Å; W617-H619 AromaticContact CH2-CE1 3.81Å; W617-H619 AromaticContact CH2-ND1 3.45Å; W617-H619 WeakPolarHBondContact CH2-ND1 3.35Å; W617-H619 HydrophobicContact CZ3-CB 3.93Å; W617-H619 AromaticContact CZ3-CG 3.82Å; W617-H619 AromaticContact CZ3-ND1 3.31Å; W617-H619 VanDerWaalsContact CZ3-ND1 3.31Å; W617-H619 WeakPolarHBondContact CZ3-ND1 3.35Å; W617-D632 HydrophobicContact CH2-CB 4.35Å; W617-T635 HydrophobicContact CH2-CG2 4.06Å; W617-T635 HydrophobicContact CZ2-CG2 3.96Å; W617-T635 HydrophobicContact CZ3-CG2 4.49Å; W617-Q636 HydrophobicContact CZ2-CB 4.43Å; W617-F639 AromaticContact CD1-CD2 3.9Å; W617-F639 HydrophobicContact CD2-CD2 4.39Å; W617-F639 HydrophobicContact CD2-CE2 4.34Å; W617-F639 HydrophobicContact CG-CD2 4.02Å; W617-F639 HydrophobicContact CG-CE2 4.19Å; W617-F650 HydrophobicContact CB-CZ 4.46Å; W617-F650 AromaticContact CD1-CE1 3.5Å; W617-F650 VanDerWaalsContact CD1-CE1 3.5Å; W617-F650 AromaticContact CD1-CZ 3.98Å; W617-F650 HydrophobicContact CG-CE1 4.45Å; W617-I651 PolarHBondContact N-O 3.16Å; W617-I651 VanDerWaalsContact N-O 3.11Å; W617-G652 CarbonylContact O-C 3.6Å; W617-G652 WeakPolarHBondContact O-CA 3.46Å; W617-M653 PolarHBondContact O-N 3.37Å
618	Y	97.9	Very high	95	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	153.9	170.5	76	-81.9	0	0	0	111.9	M550 H553 I562 G563 L565 A581 M653	M550-Y618 HydrophobicContact CB-CD2 4.02Å; M550-Y618 HydrophobicContact CB-CE2 3.98Å; M550-Y618 HydrophobicContact CG-CD1 3.88Å; M550-Y618 HydrophobicContact CG-CD2 3.63Å; M550-Y618 HydrophobicContact CG-CE1 4.01Å; M550-Y618 HydrophobicContact CG-CE2 3.76Å; M550-Y618 HydrophobicContact CG-CG 3.67Å; M550-Y618 HydrophobicContact SD-CD1 4.22Å; M550-Y618 HydrophobicContact SD-CD2 4.15Å; M550-Y618 HydrophobicContact SD-CG 3.79Å; H553-Y618 HydrophobicContact CB-CE2 4.31Å; H553-Y618 AromaticContact ND1-CE2 3.81Å; H553-Y618 AromaticContact ND1-CZ 3.68Å; H553-Y618 PolarHBondContact ND1-OH 3.03Å; I562-Y618 CarbonylContact C-O 3.58Å; I562-Y618 VanDerWaalsContact CA-O 3.31Å; I562-Y618 WeakPolarHBondContact CA-O 3.33Å; I562-Y618 WeakPolarHBondContact CG1-O 3.47Å; G563-Y618 VanDerWaalsContact CA-CE1 3.44Å; G563-Y618 PolarHBondContact N-O 3.14Å; G563-Y618 PolarHBondContact O-N 3.31Å; L565-Y618 HydrophobicContact CD2-CD1 3.71Å; L565-Y618 HydrophobicContact CD2-CE1 4.45Å; L565-Y618 HydrophobicContact CD2-CG 4.35Å; L565-Y618 HydrophobicContact CG-CD1 4.28Å; A581-Y618 HydrophobicContact CB-CD1 4.48Å; A581-Y618 HydrophobicContact CB-CE1 3.93Å; Y618-M653 CarbonylContact C-O 3.54Å; Y618-M653 WeakPolarHBondContact CA-O 3.32Å; Y618-M653 WeakPolarHBondContact CB-O 3.47Å
619	H	96.6	Very high	94.8	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.019	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	169.3	166.3	78.6	-75.3	0	0	0	112.1	V561 I562 W617 H621 D632 M653 I654 V655	V561-H619 CarbonylContact O-C 3.55Å; V561-H619 WeakPolarHBondContact O-CA 3.23Å; V561-H619 WeakPolarHBondContact O-CB 3.23Å; I562-H619 HydrophobicContact CB-CB 4.47Å; I562-H619 HydrophobicContact CG1-CB 4.19Å; W617-H619 HydrophobicContact CE3-CB 4.4Å; W617-H619 AromaticContact CH2-CE1 3.81Å; W617-H619 AromaticContact CH2-ND1 3.45Å; W617-H619 WeakPolarHBondContact CH2-ND1 3.35Å; W617-H619 HydrophobicContact CZ3-CB 3.93Å; W617-H619 AromaticContact CZ3-CG 3.82Å; W617-H619 AromaticContact CZ3-ND1 3.31Å; W617-H619 VanDerWaalsContact CZ3-ND1 3.31Å; W617-H619 WeakPolarHBondContact CZ3-ND1 3.35Å; H619-H621 AromaticContact CD2-CD2 3.65Å; H619-H621 AromaticContact CD2-NE2 3.82Å; H619-H621 AromaticContact CE1-NE2 3.76Å; H619-H621 AromaticContact NE2-CD2 3.23Å; H619-H621 PolarHBondContact NE2-CD2 2.77Å; H619-H621 AromaticContact NE2-NE2 2.93Å; H619-H621 PolarHBondContact NE2-NE2 2.93Å; H619-D632 IonicContact CE1-OD1 2.68Å; H619-D632 IonicContact CE1-OD2 2.69Å; H619-D632 IonicContact NE2-OD1 3.96Å; H619-D632 IonicContact NE2-OD2 3.09Å; H619-M653 PolarHBondContact N-O 2.93Å; H619-I654 WeakPolarHBondContact O-CA 3.22Å; H619-V655 PolarHBondContact O-N 3.07Å
620	S	96.4	Very high	94.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	145.3	173.9	69.4	0	0	0	0	112.8	E560 V561 P622 V655	E560-S620 WeakPolarHBondContact CG-O 3.47Å; V561-S620 PolarHBondContact N-OG 2.89Å; V561-S620 PolarHBondContact O-N 3.37Å; S620-P622 WeakPolarHBondContact O-CD 3.25Å; S620-V655 CarbonylContact C-O 3.59Å; S620-V655 VanDerWaalsContact CA-O 3.23Å; S620-V655 WeakPolarHBondContact CA-O 3.24Å
621	H	95.1	Very high	94.4	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	16%	0.157	C	C	.	.			trans	-109.1	84.6	159.9	-74.2	-174.9	0	0	0	107.4	H619 S623 F624 H625 N627 D632 I654 V655 S656	H619-H621 AromaticContact CD2-CD2 3.65Å; H619-H621 AromaticContact CD2-NE2 3.82Å; H619-H621 AromaticContact CE1-NE2 3.76Å; H619-H621 AromaticContact NE2-CD2 3.23Å; H619-H621 PolarHBondContact NE2-CD2 2.77Å; H619-H621 AromaticContact NE2-NE2 2.93Å; H619-H621 PolarHBondContact NE2-NE2 2.93Å; H621-S623 VanDerWaalsContact C-N 3.3Å; H621-S623 PolarHBondContact O-N 2.83Å; H621-S623 VanDerWaalsContact O-N 3.11Å; H621-F624 HydrophobicContact CB-CD1 4.34Å; H621-F624 HydrophobicContact CB-CD2 3.77Å; H621-F624 HydrophobicContact CB-CE1 4.18Å; H621-F624 HydrophobicContact CB-CE2 3.63Å; H621-F624 HydrophobicContact CB-CG 4.14Å; H621-F624 HydrophobicContact CB-CZ 3.83Å; H621-F624 WeakPolarHBondContact CB-O 3.47Å; H621-F624 AromaticContact CD2-CE2 3.53Å; H621-F624 AromaticContact CD2-CZ 3.66Å; H621-F624 AromaticContact CE1-CE2 3.55Å; H621-F624 AromaticContact CG-CD2 3.72Å; H621-F624 AromaticContact CG-CE2 3.22Å; H621-F624 AromaticContact CG-CZ 3.64Å; H621-F624 AromaticContact ND1-CD2 3.56Å; H621-F624 AromaticContact ND1-CE2 3.23Å; H621-F624 WeakPolarHBondContact ND1-CE2 3.45Å; H621-F624 AromaticContact NE2-CE2 3.75Å; H621-H625 PolarHBondContact ND1-O 2.86Å; H621-N627 PolarHBondContact CE1-O 2.85Å; H621-D632 IonicContact NE2-OD2 3.97Å; H621-I654 HydrophobicContact CB-CG2 4.17Å; H621-V655 PolarHBondContact N-O 3.38Å; H621-S656 WeakPolarHBondContact O-CA 3.29Å; H621-S656 PolarHBondContact O-OG 3.2Å; H621-S656 VanDerWaalsContact O-OG 3.07Å
622	P	92.8	Very high	94.3	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.032	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-39.4	-162.5	-29.9	36.3	0	0	0	115	G559 S620 Y658	G559-P622 WeakPolarHBondContact O-CG 3.49Å; S620-P622 WeakPolarHBondContact O-CD 3.25Å; P622-Y658 WeakPolarHBondContact O-CA 3.43Å; P622-Y658 VanDerWaalsContact O-CB 3.24Å; P622-Y658 WeakPolarHBondContact O-CB 3.32Å; P622-Y658 PolarHBondContact O-N 3.25Å
623	S	91.5	Very high	94.3	Very high	74 Å²	74	21.7 Å²	21.7	52%	0.517	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.9	22.2	-171.2	69.5	0	0	0	0	114.2	H621 P660	H621-S623 VanDerWaalsContact C-N 3.3Å; H621-S623 PolarHBondContact O-N 2.83Å; H621-S623 VanDerWaalsContact O-N 3.11Å; S623-P660 VanDerWaalsContact O-CD 3.31Å; S623-P660 WeakPolarHBondContact O-CD 3.32Å
624	F	92.5	Very high	94.1	Very high	68 Å²	68	22 Å²	22	30%	0.298	12%	0.117	S	C	.	.	S	Bend	trans	-152.7	161.7	-179.7	57.1	-84.3	0	0	0	111.6	L524 H621 S656	L524-F624 HydrophobicContact CD1-CD2 3.85Å; L524-F624 HydrophobicContact CD1-CE2 4.45Å; L524-F624 HydrophobicContact CD2-CD2 4.27Å; L524-F624 HydrophobicContact CD2-CE2 4.05Å; H621-F624 HydrophobicContact CB-CD1 4.34Å; H621-F624 HydrophobicContact CB-CD2 3.77Å; H621-F624 HydrophobicContact CB-CE1 4.18Å; H621-F624 HydrophobicContact CB-CE2 3.63Å; H621-F624 HydrophobicContact CB-CG 4.14Å; H621-F624 HydrophobicContact CB-CZ 3.83Å; H621-F624 WeakPolarHBondContact CB-O 3.47Å; H621-F624 AromaticContact CD2-CE2 3.53Å; H621-F624 AromaticContact CD2-CZ 3.66Å; H621-F624 AromaticContact CE1-CE2 3.55Å; H621-F624 AromaticContact CG-CD2 3.72Å; H621-F624 AromaticContact CG-CE2 3.22Å; H621-F624 AromaticContact CG-CZ 3.64Å; H621-F624 AromaticContact ND1-CD2 3.56Å; H621-F624 AromaticContact ND1-CE2 3.23Å; H621-F624 WeakPolarHBondContact ND1-CE2 3.45Å; H621-F624 AromaticContact NE2-CE2 3.75Å; F624-S656 WeakPolarHBondContact O-CB 3.43Å; F624-S656 PolarHBondContact O-OG 3.01Å
625	H	93	Very high	93.9	Very high	67 Å²	67	21.8 Å²	21.8	31%	0.31	12%	0.117	S	C	.	.			trans	-55.8	140.7	-171.3	-169.4	-78.2	0	0	0	113.2	H621 N627 D659	H621-H625 PolarHBondContact ND1-O 2.86Å; H625-N627 VanDerWaalsContact CE1-CG 3.48Å; H625-N627 PolarHBondContact CE1-ND2 3.2Å; H625-N627 PolarHBondContact CE1-OD1 3.42Å; H625-N627 PolarHBondContact ND1-N 3.48Å; H625-N627 PolarHBondContact ND1-ND2 3.25Å; H625-N627 PolarHBondContact ND1-OD1 3.24Å; H625-N627 PolarHBondContact O-N 3.05Å; H625-D659 VanDerWaalsContact CA-OD2 3.29Å; H625-D659 WeakPolarHBondContact CA-OD2 3.44Å; H625-D659 WeakPolarHBondContact CB-OD2 3.38Å; H625-D659 IonicContact CD2-OD2 3.6Å; H625-D659 IonicContact CG-OD2 3.07Å; H625-D659 PolarHBondContact N-OD2 3.39Å
626	P	95.1	Very high	93.8	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	12%	0.115	C	C	.	.	S	Bend	trans	-79	50	178.9	34.6	-35.5	0	0	0	112.2	I654 Q668 T670	P626-I654 HydrophobicContact CB-CB 3.99Å; P626-I654 HydrophobicContact CB-CG2 3.77Å; P626-I654 WeakPolarHBondContact CB-O 3.36Å; P626-Q668 HydrophobicContact CG-CB 3.7Å; P626-T670 WeakPolarHBondContact O-CB 3.5Å; P626-T670 PolarHBondContact O-OG1 3.42Å
627	N	95.4	Very high	93.6	Very high	31 Å²	31	23.2 Å²	23.2	17%	0.166	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-94.7	132.8	163.3	-80.1	-25.7	0	0	0	107.7	L524 H621 H625	L524-N627 HydrophobicContact CB-CB 4.31Å; H621-N627 PolarHBondContact CE1-O 2.85Å; H625-N627 VanDerWaalsContact CE1-CG 3.48Å; H625-N627 PolarHBondContact CE1-ND2 3.2Å; H625-N627 PolarHBondContact CE1-OD1 3.42Å; H625-N627 PolarHBondContact ND1-N 3.48Å; H625-N627 PolarHBondContact ND1-ND2 3.25Å; H625-N627 PolarHBondContact ND1-OD1 3.24Å; H625-N627 PolarHBondContact O-N 3.05Å
628	P	94.6	Very high	93.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-63.5	143.4	-178.1	28.2	-36.7	0	0	0	112	I525 C527 D632 I633 I654 L672 P687	I525-P628 PolarHBondContact N-O 3.4Å; I525-P628 WeakPolarHBondContact O-CD 3.43Å; C527-P628 WeakPolarHBondContact SG-CD 3.22Å; P628-D632 HydrophobicContact CB-CB 3.86Å; P628-I633 HydrophobicContact CB-CG1 4.16Å; P628-I633 HydrophobicContact CG-CD1 4.46Å; P628-I633 HydrophobicContact CG-CG1 4.21Å; P628-I654 HydrophobicContact CB-CD1 3.77Å; P628-L672 HydrophobicContact CB-CD2 3.99Å; P628-L672 HydrophobicContact CG-CD2 3.98Å; P628-P687 HydrophobicContact CG-CB 3.62Å; P628-P687 HydrophobicContact CG-CG 3.74Å
629	S	92.6	Very high	93	Very high	8 Å²	8	29.3 Å²	29.3	6%	0.056	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-72	166.4	166.5	68.3	0	0	0	0	112	Q523 R631 D632 I633	Q523-S629 CarbonylContact O-C 3.51Å; Q523-S629 WeakPolarHBondContact O-CA 3.27Å; S629-R631 PolarHBondContact O-N 2.92Å; S629-R631 WeakPolarHBondContact OG-CB 3.42Å; S629-R631 PolarHBondContact OG-N 2.9Å; S629-D632 VanDerWaalsContact CB-OD2 3.32Å; S629-D632 WeakPolarHBondContact CB-OD2 3.38Å; S629-D632 PolarHBondContact N-OD2 3.07Å; S629-D632 PolarHBondContact O-N 3.12Å; S629-D632 VanDerWaalsContact O-N 3.12Å; S629-D632 PolarHBondContact OG-N 3.39Å; S629-D632 PolarHBondContact OG-OD2 3.14Å; S629-I633 WeakPolarHBondContact O-CG1 3.37Å; S629-I633 PolarHBondContact O-N 3Å
630	V	91.3	Very high	92.7	Very high	26 Å²	26	30.4 Å²	30.4	16%	0.158	16%	0.157	C	C	.	.	H	α-helix	trans	-52.4	-37.9	166.5	171.7	0	0	0	0	110.7	P521 Q523 I525 N634	P521-V630 PolarHBondContact O-N 3.23Å; Q523-V630 HydrophobicContact CB-CG2 4.24Å; Q523-V630 PolarHBondContact O-N 3.41Å; I525-V630 HydrophobicContact CD1-CG2 3.64Å; I525-V630 HydrophobicContact CG1-CG2 4.28Å; V630-N634 PolarHBondContact O-N 3.05Å; V630-N634 PolarHBondContact O-ND2 2.94Å
631	R	89.1	Confident	92.4	Very high	33 Å²	33	34.3 Å²	34.3	13%	0.125	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-46.8	175.5	-178.7	173.7	170.6	-88.4	-22.4	112	P521 C593 E594 S629 I633 N634 T635	P521-R631 WeakPolarHBondContact O-CB 3.42Å; P521-R631 PolarHBondContact O-N 2.9Å; C593-R631 PolarHBondContact O-NH1 3.14Å; C593-R631 VanDerWaalsContact O-NH1 3.17Å; C593-R631 PolarHBondContact O-NH2 3.49Å; E594-R631 IonicContact OE1-NH2 3.5Å; S629-R631 PolarHBondContact O-N 2.92Å; S629-R631 WeakPolarHBondContact OG-CB 3.42Å; S629-R631 PolarHBondContact OG-N 2.9Å; R631-I633 VanDerWaalsContact C-N 3.33Å; R631-I633 PolarHBondContact O-N 3.07Å; R631-N634 WeakPolarHBondContact O-CB 3.11Å; R631-N634 PolarHBondContact O-N 2.84Å; R631-N634 VanDerWaalsContact O-N 3.1Å; R631-T635 PolarHBondContact O-N 2.99Å; R631-T635 PolarHBondContact O-OG1 2.79Å
632	D	92.9	Very high	92	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-35.5	-178.7	-52.9	-43.8	0	0	0	112.6	W617 H619 H621 P628 S629 N634 T635 Q636	W617-D632 HydrophobicContact CH2-CB 4.35Å; H619-D632 IonicContact CE1-OD1 2.68Å; H619-D632 IonicContact CE1-OD2 2.69Å; H619-D632 IonicContact NE2-OD1 3.96Å; H619-D632 IonicContact NE2-OD2 3.09Å; H621-D632 IonicContact NE2-OD2 3.97Å; P628-D632 HydrophobicContact CB-CB 3.86Å; S629-D632 VanDerWaalsContact CB-OD2 3.32Å; S629-D632 WeakPolarHBondContact CB-OD2 3.38Å; S629-D632 PolarHBondContact N-OD2 3.07Å; S629-D632 PolarHBondContact O-N 3.12Å; S629-D632 VanDerWaalsContact O-N 3.12Å; S629-D632 PolarHBondContact OG-N 3.39Å; S629-D632 PolarHBondContact OG-OD2 3.14Å; D632-N634 VanDerWaalsContact C-N 3.31Å; D632-N634 PolarHBondContact O-N 3.03Å; D632-T635 PolarHBondContact O-N 3.09Å; D632-Q636 VanDerWaalsContact O-CB 3.3Å; D632-Q636 WeakPolarHBondContact O-CB 3.46Å; D632-Q636 PolarHBondContact O-N 2.78Å
633	I	93.6	Very high	91.6	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.046	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-42.1	172.7	-69.4	158.1	0	0	0	110.7	I525 P628 S629 R631 D637 V674 P687	I525-I633 HydrophobicContact CB-CD1 3.83Å; I525-I633 HydrophobicContact CD1-CD1 3.77Å; I525-I633 HydrophobicContact CG1-CD1 4.24Å; I525-I633 HydrophobicContact CG2-CD1 4.1Å; P628-I633 HydrophobicContact CB-CG1 4.16Å; P628-I633 HydrophobicContact CG-CD1 4.46Å; P628-I633 HydrophobicContact CG-CG1 4.21Å; S629-I633 WeakPolarHBondContact O-CG1 3.37Å; S629-I633 PolarHBondContact O-N 3Å; R631-I633 VanDerWaalsContact C-N 3.33Å; R631-I633 PolarHBondContact O-N 3.07Å; I633-D637 VanDerWaalsContact O-CB 3.29Å; I633-D637 WeakPolarHBondContact O-CB 3.24Å; I633-D637 PolarHBondContact O-N 3.04Å; I633-V674 HydrophobicContact CB-CG2 4.37Å; I633-V674 HydrophobicContact CG1-CG2 4.44Å; I633-V674 HydrophobicContact CG2-CG1 4.09Å; I633-V674 HydrophobicContact CG2-CG2 3.99Å; I633-P687 HydrophobicContact CD1-CG 3.89Å; I633-P687 HydrophobicContact CG1-CB 4.27Å; I633-P687 HydrophobicContact CG1-CG 4.16Å
634	N	91.5	Very high	90.9	Very high	86 Å²	86	43.3 Å²	43.3	46%	0.46	22%	0.218	S	C	.	.	H	α-helix	trans	-69.9	-35.9	176.5	-70.8	-60.4	0	0	0	112.3	V630 R631 D632 Q638	V630-N634 PolarHBondContact O-N 3.05Å; V630-N634 PolarHBondContact O-ND2 2.94Å; R631-N634 WeakPolarHBondContact O-CB 3.11Å; R631-N634 PolarHBondContact O-N 2.84Å; R631-N634 VanDerWaalsContact O-N 3.1Å; D632-N634 VanDerWaalsContact C-N 3.31Å; D632-N634 PolarHBondContact O-N 3.03Å; N634-Q638 WeakPolarHBondContact O-CG 3.28Å; N634-Q638 PolarHBondContact O-N 2.68Å; N634-Q638 PolarHBondContact O-NE2 3.03Å
635	T	90.8	Very high	89.9	Confident	26 Å²	26	50.5 Å²	50.5	16%	0.16	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-50.4	174.2	-57.6	0	0	0	0	110.9	W617 R631 D632 D637 Q638 F639	W617-T635 HydrophobicContact CH2-CG2 4.06Å; W617-T635 HydrophobicContact CZ2-CG2 3.96Å; W617-T635 HydrophobicContact CZ3-CG2 4.49Å; R631-T635 PolarHBondContact O-N 2.99Å; R631-T635 PolarHBondContact O-OG1 2.79Å; D632-T635 PolarHBondContact O-N 3.09Å; T635-D637 PolarHBondContact O-N 3.48Å; T635-Q638 PolarHBondContact O-N 2.98Å; T635-F639 HydrophobicContact CG2-CD2 4.07Å; T635-F639 HydrophobicContact CG2-CE2 3.77Å; T635-F639 HydrophobicContact CG2-CZ 4.02Å; T635-F639 PolarHBondContact O-N 3.07Å
636	Q	94.3	Very high	88.7	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-41.5	178.5	174.9	62.1	9	0	0	112	W617 D632 F639 Q640 F650 L672 V674	W617-Q636 HydrophobicContact CZ2-CB 4.43Å; D632-Q636 VanDerWaalsContact O-CB 3.3Å; D632-Q636 WeakPolarHBondContact O-CB 3.46Å; D632-Q636 PolarHBondContact O-N 2.78Å; Q636-F639 PolarHBondContact O-N 2.93Å; Q636-Q640 HydrophobicContact CG-CG 4.3Å; Q636-Q640 VanDerWaalsContact NE2-CG 3.35Å; Q636-Q640 VanDerWaalsContact O-CB 3.24Å; Q636-Q640 WeakPolarHBondContact O-CB 3.46Å; Q636-Q640 WeakPolarHBondContact O-CG 3.49Å; Q636-Q640 PolarHBondContact O-N 2.95Å; Q636-F650 PolarHBondContact NE2-O 3.21Å; Q636-L672 HydrophobicContact CB-CD1 4.29Å; Q636-L672 HydrophobicContact CG-CD1 3.78Å; Q636-V674 HydrophobicContact CB-CG2 3.94Å; Q636-V674 HydrophobicContact CG-CB 4.15Å; Q636-V674 HydrophobicContact CG-CG2 3.65Å
637	D	92.2	Very high	87.6	Confident	36 Å²	36	53.2 Å²	53.2	19%	0.193	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-43.7	177	-176.1	56.8	0	0	0	112.5	I633 T635 S641 V674 K685	I633-D637 VanDerWaalsContact O-CB 3.29Å; I633-D637 WeakPolarHBondContact O-CB 3.24Å; I633-D637 PolarHBondContact O-N 3.04Å; T635-D637 PolarHBondContact O-N 3.48Å; D637-S641 WeakPolarHBondContact O-CB 3.47Å; D637-S641 PolarHBondContact O-N 2.94Å; D637-V674 HydrophobicContact CB-CG1 4.22Å; D637-K685 HydrophobicContact CB-CD 4.3Å; D637-K685 WeakPolarHBondContact OD1-CD 3.35Å; D637-K685 WeakPolarHBondContact OD1-CE 3.15Å; D637-K685 IonicContact OD1-NZ 2.95Å; D637-K685 PolarHBondContact OD1-NZ 2.85Å; D637-K685 WeakPolarHBondContact OD2-CD 3.23Å; D637-K685 IonicContact OD2-NZ 2.68Å; D637-K685 PolarHBondContact OD2-NZ 3.21Å
638	Q	90.5	Very high	87	Confident	97 Å²	97	53.8 Å²	53.8	45%	0.453	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-50.2	175.8	-76.4	169.8	96.3	0	0	111.3	N634 T635 S641 Y642	N634-Q638 WeakPolarHBondContact O-CG 3.28Å; N634-Q638 PolarHBondContact O-N 2.68Å; N634-Q638 PolarHBondContact O-NE2 3.03Å; T635-Q638 PolarHBondContact O-N 2.98Å; Q638-S641 PolarHBondContact O-N 3.29Å; Q638-S641 VanDerWaalsContact O-N 3.13Å; Q638-Y642 HydrophobicContact CB-CD2 4.49Å; Q638-Y642 HydrophobicContact CB-CE2 4.08Å; Q638-Y642 WeakPolarHBondContact O-CD2 3.36Å; Q638-Y642 PolarHBondContact O-N 3.15Å
639	F	90.8	Very high	86.9	Confident	40 Å²	40	54.3 Å²	54.3	18%	0.175	30%	0.302	C	S	.	.	H	α-helix	trans	-64.2	-42.1	179.3	-69.2	-7.5	0	0	0	112	W617 T635 Q636 S641 Y642 F643 F650	W617-F639 AromaticContact CD1-CD2 3.9Å; W617-F639 HydrophobicContact CD2-CD2 4.39Å; W617-F639 HydrophobicContact CD2-CE2 4.34Å; W617-F639 HydrophobicContact CG-CD2 4.02Å; W617-F639 HydrophobicContact CG-CE2 4.19Å; T635-F639 HydrophobicContact CG2-CD2 4.07Å; T635-F639 HydrophobicContact CG2-CE2 3.77Å; T635-F639 HydrophobicContact CG2-CZ 4.02Å; T635-F639 PolarHBondContact O-N 3.07Å; Q636-F639 PolarHBondContact O-N 2.93Å; F639-S641 VanDerWaalsContact C-N 3.3Å; F639-S641 PolarHBondContact O-N 3.12Å; F639-Y642 PolarHBondContact O-N 3.11Å; F639-F643 HydrophobicContact CB-CD2 4.12Å; F639-F643 HydrophobicContact CB-CE2 4.37Å; F639-F643 HydrophobicContact CG-CE2 4.47Å; F639-F643 WeakPolarHBondContact O-CB 3.45Å; F639-F643 VanDerWaalsContact O-CD2 3.27Å; F639-F643 WeakPolarHBondContact O-CD2 3.29Å; F639-F643 PolarHBondContact O-N 3.47Å; F639-F650 HydrophobicContact CB-CD1 3.86Å; F639-F650 HydrophobicContact CB-CE1 3.28Å; F639-F650 HydrophobicContact CB-CZ 3.8Å; F639-F650 AromaticContact CD2-CE1 3.91Å; F639-F650 HydrophobicContact CD2-CE1 3.91Å; F639-F650 HydrophobicContact CD2-CZ 4.01Å; F639-F650 HydrophobicContact CG-CE1 4.08Å; F639-F650 HydrophobicContact CG-CZ 4.28Å
640	Q	91.7	Very high	87	Confident	26 Å²	26	54.1 Å²	54.1	12%	0.121	30%	0.3	C	S	.	.	H	α-helix	trans	-53.1	-48.2	169.5	-80.4	174.9	-170.5	0	0	111.5	Q636 Y642 S644 F650 L673 V674	Q636-Q640 HydrophobicContact CG-CG 4.3Å; Q636-Q640 VanDerWaalsContact NE2-CG 3.35Å; Q636-Q640 VanDerWaalsContact O-CB 3.24Å; Q636-Q640 WeakPolarHBondContact O-CB 3.46Å; Q636-Q640 WeakPolarHBondContact O-CG 3.49Å; Q636-Q640 PolarHBondContact O-N 2.95Å; Q640-Y642 VanDerWaalsContact C-N 3.31Å; Q640-Y642 PolarHBondContact O-N 3.5Å; Q640-S644 WeakPolarHBondContact O-CB 3.31Å; Q640-S644 PolarHBondContact O-N 3.24Å; Q640-S644 PolarHBondContact O-OG 3.4Å; Q640-F650 HydrophobicContact CG-CB 4.48Å; Q640-F650 HydrophobicContact CG-CD1 4.48Å; Q640-F650 WeakPolarHBondContact CG-O 3.37Å; Q640-L673 HydrophobicContact CG-CD1 4.47Å; Q640-L673 VanDerWaalsContact OE1-CD1 3.24Å; Q640-V674 PolarHBondContact NE2-O 3.19Å
641	S	88.5	Confident	87.2	Confident	82 Å²	82	52.9 Å²	52.9	57%	0.573	29%	0.292	S	S	*	.	H	α-helix	trans	-65	-32.7	-179.3	-166.8	0	0	0	0	113.2	D637 Q638 F639	D637-S641 WeakPolarHBondContact O-CB 3.47Å; D637-S641 PolarHBondContact O-N 2.94Å; Q638-S641 PolarHBondContact O-N 3.29Å; Q638-S641 VanDerWaalsContact O-N 3.13Å; F639-S641 VanDerWaalsContact C-N 3.3Å; F639-S641 PolarHBondContact O-N 3.12Å
642	Y	86.9	Confident	87.6	Confident	146 Å²	146	51.3 Å²	51.3	57%	0.573	29%	0.287	S	S	*	.	H	α-helix	trans	-79.6	-43.9	178.3	-64.3	-46.8	0	0	0	113.1	Q638 F639 Q640 R645	Q638-Y642 HydrophobicContact CB-CD2 4.49Å; Q638-Y642 HydrophobicContact CB-CE2 4.08Å; Q638-Y642 WeakPolarHBondContact O-CD2 3.36Å; Q638-Y642 PolarHBondContact O-N 3.15Å; F639-Y642 PolarHBondContact O-N 3.11Å; Q640-Y642 VanDerWaalsContact C-N 3.31Å; Q640-Y642 PolarHBondContact O-N 3.5Å; Y642-R645 WeakPolarHBondContact O-CD 3.43Å; Y642-R645 WeakPolarHBondContact O-CG 3.47Å
643	F	83.9	Confident	87.9	Confident	71 Å²	71	51.2 Å²	51.2	31%	0.311	29%	0.286	S	S	.	.	H	α-helix	trans	-87.5	-21	-174.3	-70.1	-73.7	0	0	0	114.1	F639 R645 F650	F639-F643 HydrophobicContact CB-CD2 4.12Å; F639-F643 HydrophobicContact CB-CE2 4.37Å; F639-F643 HydrophobicContact CG-CE2 4.47Å; F639-F643 WeakPolarHBondContact O-CB 3.45Å; F639-F643 VanDerWaalsContact O-CD2 3.27Å; F639-F643 WeakPolarHBondContact O-CD2 3.29Å; F639-F643 PolarHBondContact O-N 3.47Å; F643-R645 PolarHBondContact O-N 3.25Å; F643-R645 VanDerWaalsContact O-N 3.11Å; F643-F650 HydrophobicContact CB-CB 4.07Å; F643-F650 HydrophobicContact CB-CD2 3.42Å; F643-F650 VanDerWaalsContact CB-CD2 3.42Å; F643-F650 HydrophobicContact CB-CE2 4.05Å; F643-F650 HydrophobicContact CB-CG 3.88Å; F643-F650 HydrophobicContact CD1-CD2 4.44Å; F643-F650 HydrophobicContact CD1-CE2 4.36Å; F643-F650 AromaticContact CD2-CD2 3.57Å; F643-F650 HydrophobicContact CD2-CD2 3.57Å; F643-F650 HydrophobicContact CD2-CE1 4.32Å; F643-F650 AromaticContact CD2-CE2 3.26Å; F643-F650 HydrophobicContact CD2-CE2 3.26Å; F643-F650 HydrophobicContact CD2-CG 4.2Å; F643-F650 AromaticContact CD2-CZ 3.69Å; F643-F650 HydrophobicContact CD2-CZ 3.69Å; F643-F650 HydrophobicContact CE2-CD2 4.45Å; F643-F650 AromaticContact CE2-CE2 3.72Å; F643-F650 HydrophobicContact CE2-CE2 3.72Å; F643-F650 AromaticContact CE2-CZ 3.95Å; F643-F650 HydrophobicContact CE2-CZ 3.95Å; F643-F650 AromaticContact CG-CD2 3.57Å; F643-F650 HydrophobicContact CG-CD2 3.57Å; F643-F650 AromaticContact CG-CE2 3.64Å; F643-F650 HydrophobicContact CG-CE2 3.64Å; F643-F650 HydrophobicContact CG-CG 4.34Å; F643-F650 HydrophobicContact CG-CZ 4.49Å; F643-F650 HydrophobicContact CZ-CE2 4.44Å
644	S	78.3	Confident	88.1	Confident	53 Å²	53	50.9 Å²	50.9	37%	0.371	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	8.8	176	64.9	0	0	0	0	115.2	Q640 G646 G647 A648	Q640-S644 WeakPolarHBondContact O-CB 3.31Å; Q640-S644 PolarHBondContact O-N 3.24Å; Q640-S644 PolarHBondContact O-OG 3.4Å; S644-G646 PolarHBondContact O-N 3Å; S644-G647 PolarHBondContact O-N 2.87Å; S644-A648 VanDerWaalsContact CA-O 3.3Å; S644-A648 WeakPolarHBondContact CA-O 3.44Å; S644-A648 WeakPolarHBondContact CB-O 3.44Å
645	R	71.6	Confident	88.4	Confident	218 Å²	218	46.8 Å²	46.8	82%	0.823	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	105.1	172.5	-69.9	177.7	66.3	-170.6	-0.3	109.9	Y642 F643	Y642-R645 WeakPolarHBondContact O-CD 3.43Å; Y642-R645 WeakPolarHBondContact O-CG 3.47Å; F643-R645 PolarHBondContact O-N 3.25Å; F643-R645 VanDerWaalsContact O-N 3.11Å
646	G	66.6	Low	88.7	Confident	78 Å²	78	45.5 Å²	45.5	80%	0.804	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.7	1.9	-173.3	0	0	0	0	0	114.6	S644	S644-G646 PolarHBondContact O-N 3Å
647	G	73.4	Confident	88.8	Confident	47 Å²	47	45.7 Å²	45.7	49%	0.485	26%	0.256	S	S	.	.	S	Bend	trans	87.8	5.8	178.3	0	0	0	0	0	114.9	S644	S644-G647 PolarHBondContact O-N 2.87Å
648	A	82.8	Confident	88.9	Confident	44 Å²	44	45.5 Å²	45.5	36%	0.364	25%	0.253	S	S	.	.			trans	-63.2	139	174.3	0	0	0	0	0	111.3	S644	S644-A648 VanDerWaalsContact CA-O 3.3Å; S644-A648 WeakPolarHBondContact CA-O 3.44Å; S644-A648 WeakPolarHBondContact CB-O 3.44Å
649	P	90.9	Very high	89.1	Confident	11 Å²	11	41.3 Å²	41.3	7%	0.071	23%	0.234	C	C	.	.			trans	-73.3	151.7	171.8	33.9	-38.4	0	0	0	110.8	F538 F569 L576	F538-P649 HydrophobicContact CD1-CB 3.91Å; F538-P649 HydrophobicContact CD2-CB 4.39Å; F538-P649 HydrophobicContact CE1-CB 3.36Å; F538-P649 HydrophobicContact CE2-CB 3.88Å; F538-P649 HydrophobicContact CG-CB 4.41Å; F538-P649 HydrophobicContact CZ-CB 3.33Å; F569-P649 HydrophobicContact CB-CG 3.84Å; F569-P649 HydrophobicContact CD1-CG 4.05Å; F569-P649 HydrophobicContact CD2-CG 3.54Å; F569-P649 HydrophobicContact CE1-CG 4.46Å; F569-P649 HydrophobicContact CE2-CG 4.02Å; F569-P649 HydrophobicContact CG-CG 3.54Å; F569-P649 HydrophobicContact CZ-CG 4.45Å; L576-P649 HydrophobicContact CB-CG 4.23Å; L576-P649 HydrophobicContact CD1-CG 4Å; L576-P649 HydrophobicContact CD2-CB 4.3Å; L576-P649 HydrophobicContact CD2-CG 4.13Å; L576-P649 HydrophobicContact CG-CG 4.33Å
650	F	95.6	Very high	89	Confident	3 Å²	3	44 Å²	44	1%	0.013	26%	0.255	C	S	.	.			trans	-142.8	126.5	171.1	-170.7	-86.3	0	0	0	109.6	V614 V615 G616 W617 Q636 F639 Q640 F643 L673	V614-F650 HydrophobicContact CG1-CE2 4.19Å; V615-F650 WeakPolarHBondContact O-CA 3.26Å; G616-F650 VanDerWaalsContact C-CZ 3.5Å; G616-F650 VanDerWaalsContact CA-CE2 3.46Å; W617-F650 HydrophobicContact CB-CZ 4.46Å; W617-F650 AromaticContact CD1-CE1 3.5Å; W617-F650 VanDerWaalsContact CD1-CE1 3.5Å; W617-F650 AromaticContact CD1-CZ 3.98Å; W617-F650 HydrophobicContact CG-CE1 4.45Å; Q636-F650 PolarHBondContact NE2-O 3.21Å; F639-F650 HydrophobicContact CB-CD1 3.86Å; F639-F650 HydrophobicContact CB-CE1 3.28Å; F639-F650 HydrophobicContact CB-CZ 3.8Å; F639-F650 AromaticContact CD2-CE1 3.91Å; F639-F650 HydrophobicContact CD2-CE1 3.91Å; F639-F650 HydrophobicContact CD2-CZ 4.01Å; F639-F650 HydrophobicContact CG-CE1 4.08Å; F639-F650 HydrophobicContact CG-CZ 4.28Å; Q640-F650 HydrophobicContact CG-CB 4.48Å; Q640-F650 HydrophobicContact CG-CD1 4.48Å; Q640-F650 WeakPolarHBondContact CG-O 3.37Å; F643-F650 HydrophobicContact CB-CB 4.07Å; F643-F650 HydrophobicContact CB-CD2 3.42Å; F643-F650 VanDerWaalsContact CB-CD2 3.42Å; F643-F650 HydrophobicContact CB-CE2 4.05Å; F643-F650 HydrophobicContact CB-CG 3.88Å; F643-F650 HydrophobicContact CD1-CD2 4.44Å; F643-F650 HydrophobicContact CD1-CE2 4.36Å; F643-F650 AromaticContact CD2-CD2 3.57Å; F643-F650 HydrophobicContact CD2-CD2 3.57Å; F643-F650 HydrophobicContact CD2-CE1 4.32Å; F643-F650 AromaticContact CD2-CE2 3.26Å; F643-F650 HydrophobicContact CD2-CE2 3.26Å; F643-F650 HydrophobicContact CD2-CG 4.2Å; F643-F650 AromaticContact CD2-CZ 3.69Å; F643-F650 HydrophobicContact CD2-CZ 3.69Å; F643-F650 HydrophobicContact CE2-CD2 4.45Å; F643-F650 AromaticContact CE2-CE2 3.72Å; F643-F650 HydrophobicContact CE2-CE2 3.72Å; F643-F650 AromaticContact CE2-CZ 3.95Å; F643-F650 HydrophobicContact CE2-CZ 3.95Å; F643-F650 AromaticContact CG-CD2 3.57Å; F643-F650 HydrophobicContact CG-CD2 3.57Å; F643-F650 AromaticContact CG-CE2 3.64Å; F643-F650 HydrophobicContact CG-CE2 3.64Å; F643-F650 HydrophobicContact CG-CG 4.34Å; F643-F650 HydrophobicContact CG-CZ 4.49Å; F643-F650 HydrophobicContact CZ-CE2 4.44Å; F650-L673 WeakPolarHBondContact O-CD1 3.3Å
651	I	96.3	Very high	89	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	160.9	-174	68	143.8	0	0	0	113.1	F538 L565 L576 I578 V615 G616 W617 M653 C671 F690	F538-I651 HydrophobicContact CE2-CG2 4Å; F538-I651 HydrophobicContact CZ-CG2 4.03Å; L565-I651 HydrophobicContact CD1-CD1 4.24Å; L565-I651 HydrophobicContact CD1-CG1 4.42Å; L576-I651 HydrophobicContact CD2-CG1 4.3Å; L576-I651 HydrophobicContact CD2-CG2 3.87Å; I578-I651 HydrophobicContact CD1-CD1 3.39Å; I578-I651 HydrophobicContact CD1-CG1 4.02Å; V615-I651 PolarHBondContact O-N 3.33Å; G616-I651 CarbonylContact C-O 3.56Å; G616-I651 WeakPolarHBondContact CA-O 3.42Å; W617-I651 PolarHBondContact N-O 3.16Å; W617-I651 VanDerWaalsContact N-O 3.11Å; I651-M653 HydrophobicContact CD1-CG 3.58Å; I651-M653 HydrophobicContact CD1-SD 3.88Å; I651-C671 WeakPolarHBondContact CD1-SG 3.39Å; I651-F690 HydrophobicContact CG2-CE2 3.83Å
652	G	97	Very high	89.1	Confident	1 Å²	1	43 Å²	43	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	146.6	164.6	0	0	0	0	0	110.9	W617 L672	W617-G652 CarbonylContact O-C 3.6Å; W617-G652 WeakPolarHBondContact O-CA 3.46Å; G652-L672 PolarHBondContact N-O 3.13Å; G652-L672 VanDerWaalsContact N-O 3.07Å; G652-L672 PolarHBondContact O-N 3.36Å
653	M	98.1	Very high	89.1	Confident	1 Å²	1	42 Å²	42	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.7	170.3	-61.4	-172	75.5	0	0	111.1	V542 M550 L565 I578 W617 Y618 H619 I651 I669 T670 C671 F692	V542-M653 HydrophobicContact CG2-CE 4.3Å; M550-M653 HydrophobicContact CE-CE 3.68Å; M550-M653 HydrophobicContact CE-SD 3.77Å; M550-M653 HydrophobicContact SD-CB 4.14Å; M550-M653 HydrophobicContact SD-CE 4.43Å; M550-M653 HydrophobicContact SD-SD 3.96Å; L565-M653 HydrophobicContact CD1-CB 4.25Å; L565-M653 HydrophobicContact CD1-CG 3.74Å; L565-M653 HydrophobicContact CD1-SD 3.67Å; I578-M653 HydrophobicContact CD1-SD 4.19Å; W617-M653 PolarHBondContact O-N 3.37Å; Y618-M653 CarbonylContact C-O 3.54Å; Y618-M653 WeakPolarHBondContact CA-O 3.32Å; Y618-M653 WeakPolarHBondContact CB-O 3.47Å; H619-M653 PolarHBondContact N-O 2.93Å; I651-M653 HydrophobicContact CD1-CG 3.58Å; I651-M653 HydrophobicContact CD1-SD 3.88Å; M653-I669 HydrophobicContact CE-CG2 3.74Å; M653-T670 CarbonylContact C-O 3.58Å; M653-T670 WeakPolarHBondContact CA-O 3.47Å; M653-C671 HydrophobicContact CE-CB 4.23Å; M653-C671 HydrophobicContact CG-CB 4.39Å; M653-F692 HydrophobicContact CE-CD1 4.44Å; M653-F692 HydrophobicContact CE-CE1 4.17Å; M653-F692 HydrophobicContact CE-CZ 4.25Å
654	I	98.1	Very high	89.4	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.2	178.5	-49.2	-175.6	0	0	0	109.2	H619 H621 P626 P628 I669 T670 L672	H619-I654 WeakPolarHBondContact O-CA 3.22Å; H621-I654 HydrophobicContact CB-CG2 4.17Å; P626-I654 HydrophobicContact CB-CB 3.99Å; P626-I654 HydrophobicContact CB-CG2 3.77Å; P626-I654 WeakPolarHBondContact CB-O 3.36Å; P628-I654 HydrophobicContact CB-CD1 3.77Å; I654-I669 WeakPolarHBondContact O-CA 3.45Å; I654-T670 PolarHBondContact N-O 3.04Å; I654-T670 PolarHBondContact O-N 3.07Å; I654-L672 HydrophobicContact CD1-CD2 3.73Å; I654-L672 HydrophobicContact CG1-CD2 3.95Å
655	V	98.1	Very high	90	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.5	179.3	-175.9	0	0	0	0	110.7	M550 A554 H619 S620 H621 I669	M550-V655 HydrophobicContact CB-CG2 4.1Å; A554-V655 HydrophobicContact CB-CB 3.9Å; A554-V655 HydrophobicContact CB-CG1 3.56Å; H619-V655 PolarHBondContact O-N 3.07Å; S620-V655 CarbonylContact C-O 3.59Å; S620-V655 VanDerWaalsContact CA-O 3.23Å; S620-V655 WeakPolarHBondContact CA-O 3.24Å; H621-V655 PolarHBondContact N-O 3.38Å; V655-I669 HydrophobicContact CG1-CG1 4.28Å; V655-I669 HydrophobicContact CG2-CD1 4.32Å; V655-I669 HydrophobicContact CG2-CG1 4.16Å; V655-I669 HydrophobicContact CG2-CG2 4.37Å
656	S	97.4	Very high	91.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	106	174	-173.9	0	0	0	0	111.6	H621 F624 D659 S667 Q668	H621-S656 WeakPolarHBondContact O-CA 3.29Å; H621-S656 PolarHBondContact O-OG 3.2Å; H621-S656 VanDerWaalsContact O-OG 3.07Å; F624-S656 WeakPolarHBondContact O-CB 3.43Å; F624-S656 PolarHBondContact O-OG 3.01Å; S656-D659 WeakPolarHBondContact OG-CB 3.39Å; S656-S667 WeakPolarHBondContact O-CA 3.48Å; S656-Q668 PolarHBondContact N-O 3.28Å; S656-Q668 PolarHBondContact O-N 2.96Å
657	P	96.3	Very high	92.5	Very high	3 Å²	3	29 Å²	29	2%	0.019	20%	0.198	C	C	.	.	S	Bend	trans	-86.1	-30.5	-179.4	31	-33	0	0	0	114.3	A554 S667 K739	A554-P657 HydrophobicContact CB-CG 4.16Å; P657-S667 WeakPolarHBondContact CA-OG 3.36Å; P657-K739 PolarHBondContact O-NZ 3.23Å
658	Y	94.8	Very high	93.6	Very high	32 Å²	32	29.1 Å²	29.1	13%	0.125	19%	0.186	C	C	.	.			trans	-130.1	23.8	-171.6	-47.8	-72.9	0	0	0	114.9	H555 P622 P660 V722 F728 C736 K739	H555-Y658 AromaticContact CD2-CZ 3.69Å; H555-Y658 PolarHBondContact CD2-OH 3.21Å; H555-Y658 VanDerWaalsContact CD2-OH 3.31Å; H555-Y658 PolarHBondContact O-OH 2.85Å; P622-Y658 WeakPolarHBondContact O-CA 3.43Å; P622-Y658 VanDerWaalsContact O-CB 3.24Å; P622-Y658 WeakPolarHBondContact O-CB 3.32Å; P622-Y658 PolarHBondContact O-N 3.25Å; Y658-P660 VanDerWaalsContact O-CD 3.28Å; Y658-P660 WeakPolarHBondContact O-CD 3.37Å; Y658-P660 VanDerWaalsContact O-N 3.17Å; Y658-V722 HydrophobicContact CE2-CG1 4.42Å; Y658-V722 HydrophobicContact CE2-CG2 4.22Å; Y658-F728 HydrophobicContact CD1-CB 4.35Å; Y658-F728 HydrophobicContact CD1-CD2 4.37Å; Y658-F728 HydrophobicContact CE1-CB 4.21Å; Y658-C736 HydrophobicContact CE1-CB 4.49Å; Y658-K739 HydrophobicContact CD1-CD 4.22Å; Y658-K739 HydrophobicContact CE1-CD 3.9Å
659	D	93.4	Very high	94.3	Very high	10 Å²	10	27.8 Å²	27.8	5%	0.053	17%	0.172	C	C	.	.			trans	-50.7	120	169.2	179.6	7.7	0	0	0	110.9	H625 S656 A661 N662 R729	H625-D659 VanDerWaalsContact CA-OD2 3.29Å; H625-D659 WeakPolarHBondContact CA-OD2 3.44Å; H625-D659 WeakPolarHBondContact CB-OD2 3.38Å; H625-D659 IonicContact CD2-OD2 3.6Å; H625-D659 IonicContact CG-OD2 3.07Å; H625-D659 PolarHBondContact N-OD2 3.39Å; S656-D659 WeakPolarHBondContact OG-CB 3.39Å; D659-A661 PolarHBondContact O-N 2.73Å; D659-A661 WeakPolarHBondContact OD1-CB 3.34Å; D659-A661 PolarHBondContact OD1-N 2.77Å; D659-N662 HydrophobicContact CB-CB 4.32Å; D659-N662 WeakPolarHBondContact O-CB 3.38Å; D659-N662 PolarHBondContact O-N 3.08Å; D659-R729 PolarHBondContact O-NH2 2.98Å
660	P	89.9	Confident	94.6	Very high	96 Å²	96	27.2 Å²	27.2	62%	0.623	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.5	175.9	-24.9	35.5	0	0	0	114.1	S623 Y658 N662	S623-P660 VanDerWaalsContact O-CD 3.31Å; S623-P660 WeakPolarHBondContact O-CD 3.32Å; Y658-P660 VanDerWaalsContact O-CD 3.28Å; Y658-P660 WeakPolarHBondContact O-CD 3.37Å; Y658-P660 VanDerWaalsContact O-N 3.17Å; P660-N662 VanDerWaalsContact C-N 3.3Å; P660-N662 PolarHBondContact O-N 3.42Å
661	A	89.9	Confident	94.7	Very high	78 Å²	78	27.1 Å²	27.1	65%	0.645	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.8	179.2	0	0	0	0	0	113.7	D659 P663	D659-A661 PolarHBondContact O-N 2.73Å; D659-A661 WeakPolarHBondContact OD1-CB 3.34Å; D659-A661 PolarHBondContact OD1-N 2.77Å; A661-P663 VanDerWaalsContact O-CD 3.31Å; A661-P663 WeakPolarHBondContact O-CD 3.36Å
662	N	90.6	Very high	94.7	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.043	17%	0.169	C	C	.	.			trans	-81.1	113.3	177.7	-178.5	21.1	0	0	0	111.2	D659 P660 S664 H666 Q668 R729	D659-N662 HydrophobicContact CB-CB 4.32Å; D659-N662 WeakPolarHBondContact O-CB 3.38Å; D659-N662 PolarHBondContact O-N 3.08Å; P660-N662 VanDerWaalsContact C-N 3.3Å; P660-N662 PolarHBondContact O-N 3.42Å; N662-S664 PolarHBondContact ND2-O 3.04Å; N662-S664 PolarHBondContact O-N 3.41Å; N662-S664 VanDerWaalsContact OD1-CB 3.31Å; N662-S664 WeakPolarHBondContact OD1-CB 3.35Å; N662-S664 PolarHBondContact OD1-N 2.91Å; N662-S664 VanDerWaalsContact OD1-N 3.12Å; N662-H666 PolarHBondContact ND2-O 3.35Å; N662-Q668 HydrophobicContact CB-CG 4.39Å; N662-Q668 PolarHBondContact OD1-NE2 2.7Å; N662-Q668 VanDerWaalsContact OD1-NE2 3.15Å; N662-R729 VanDerWaalsContact O-CZ 3.25Å; N662-R729 PolarHBondContact O-NH1 3.14Å; N662-R729 PolarHBondContact O-NH2 3.19Å
663	P	87.8	Confident	94.6	Very high	126 Å²	126	28 Å²	28	82%	0.818	17%	0.173	S	C	*	.			trans	-72.9	-14.9	176.2	31.1	-35.8	0	0	0	113.1	A661	A661-P663 VanDerWaalsContact O-CD 3.31Å; A661-P663 WeakPolarHBondContact O-CD 3.36Å
664	S	91.1	Very high	94.3	Very high	42 Å²	42	28.3 Å²	28.3	29%	0.294	18%	0.175	S	C	.	.	S	Bend	trans	-80.4	152.2	-176.4	-169.7	0	0	0	0	113.3	N662 H666	N662-S664 PolarHBondContact ND2-O 3.04Å; N662-S664 PolarHBondContact O-N 3.41Å; N662-S664 VanDerWaalsContact OD1-CB 3.31Å; N662-S664 WeakPolarHBondContact OD1-CB 3.35Å; N662-S664 PolarHBondContact OD1-N 2.91Å; N662-S664 VanDerWaalsContact OD1-N 3.12Å; S664-H666 VanDerWaalsContact C-N 3.25Å; S664-H666 PolarHBondContact OG-CD2 2.99Å; S664-H666 PolarHBondContact OG-N 2.99Å
665	T	90.8	Very high	93.9	Very high	50 Å²	50	30.9 Å²	30.9	31%	0.307	19%	0.186	S	C	.	.	S	Bend	trans	-76.2	-6.7	167.3	46.8	0	0	0	0	113.4	L734 K739	T665-L734 HydrophobicContact CG2-CD1 3.85Å; T665-K739 WeakPolarHBondContact O-CE 3.46Å; T665-K739 WeakPolarHBondContact O-CG 3.32Å
666	H	94.2	Very high	93.3	Very high	47 Å²	47	37.6 Å²	37.6	22%	0.218	22%	0.217	C	C	.	.	S	Bend	trans	-103.7	151.3	178.1	-38.2	-81.6	0	0	0	112.1	N662 S664 A742	N662-H666 PolarHBondContact ND2-O 3.35Å; S664-H666 VanDerWaalsContact C-N 3.25Å; S664-H666 PolarHBondContact OG-CD2 2.99Å; S664-H666 PolarHBondContact OG-N 2.99Å; H666-A742 PolarHBondContact CE1-O 3.39Å; H666-A742 VanDerWaalsContact CE1-O 3.29Å; H666-A742 PolarHBondContact ND1-O 3.32Å
667	S	96.5	Very high	92.2	Very high	7 Å²	7	38.4 Å²	38.4	5%	0.049	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-64.6	143.6	175.3	-58.7	0	0	0	0	112.4	D551 H555 S656 P657 K739 S743	D551-S667 WeakPolarHBondContact OD1-CB 3.48Å; D551-S667 PolarHBondContact OD1-OG 3.41Å; D551-S667 PolarHBondContact OD2-OG 2.62Å; H555-S667 PolarHBondContact CE1-OG 3.15Å; S656-S667 WeakPolarHBondContact O-CA 3.48Å; P657-S667 WeakPolarHBondContact CA-OG 3.36Å; S667-K739 PolarHBondContact OG-NZ 2.84Å; S667-S743 WeakPolarHBondContact CB-OG 3.48Å; S667-S743 PolarHBondContact N-OG 3.34Å; S667-S743 PolarHBondContact OG-OG 3.36Å
668	Q	96.3	Very high	90.7	Very high	51 Å²	51	45 Å²	45	24%	0.238	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134.7	172.2	-64.8	-179.7	-7.7	0	0	109.7	P626 S656 N662	P626-Q668 HydrophobicContact CG-CB 3.7Å; S656-Q668 PolarHBondContact N-O 3.28Å; S656-Q668 PolarHBondContact O-N 2.96Å; N662-Q668 HydrophobicContact CB-CG 4.39Å; N662-Q668 PolarHBondContact OD1-NE2 2.7Å; N662-Q668 VanDerWaalsContact OD1-NE2 3.15Å
669	I	97.2	Very high	89.2	Confident	15 Å²	15	48 Å²	48	8%	0.077	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	126.5	178.5	-53.8	-175.1	0	0	0	109.5	L547 M653 I654 V655 F692	L547-I669 HydrophobicContact CD2-CD1 4.06Å; M653-I669 HydrophobicContact CE-CG2 3.74Å; I654-I669 WeakPolarHBondContact O-CA 3.45Å; V655-I669 HydrophobicContact CG1-CG1 4.28Å; V655-I669 HydrophobicContact CG2-CD1 4.32Å; V655-I669 HydrophobicContact CG2-CG1 4.16Å; V655-I669 HydrophobicContact CG2-CG2 4.37Å; I669-F692 HydrophobicContact CB-CE1 4.37Å; I669-F692 HydrophobicContact CB-CZ 4.26Å; I669-F692 HydrophobicContact CG2-CE1 4.05Å; I669-F692 HydrophobicContact CG2-CZ 4.09Å
670	T	97.2	Very high	87.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	114.1	173	-66	0	0	0	0	109.5	P626 M653 I654 L672 R689	P626-T670 WeakPolarHBondContact O-CB 3.5Å; P626-T670 PolarHBondContact O-OG1 3.42Å; M653-T670 CarbonylContact C-O 3.58Å; M653-T670 WeakPolarHBondContact CA-O 3.47Å; I654-T670 PolarHBondContact N-O 3.04Å; I654-T670 PolarHBondContact O-N 3.07Å; T670-L672 HydrophobicContact CG2-CB 4.35Å; T670-L672 HydrophobicContact CG2-CD2 4.32Å; T670-R689 HydrophobicContact CG2-CG 4.37Å
671	C	97.4	Very high	85.6	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.007	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	128.7	167.3	-178.5	0	0	0	0	109	I651 M653 R689 F690 F692	I651-C671 WeakPolarHBondContact CD1-SG 3.39Å; M653-C671 HydrophobicContact CE-CB 4.23Å; M653-C671 HydrophobicContact CG-CB 4.39Å; C671-R689 WeakPolarHBondContact O-CA 3.1Å; C671-F690 HydrophobicContact CB-CB 4.17Å; C671-F690 PolarHBondContact O-N 3.11Å; C671-F692 HydrophobicContact CB-CB 4.49Å; C671-F692 HydrophobicContact CB-CD1 3.54Å; C671-F692 HydrophobicContact CB-CE1 4.16Å; C671-F692 HydrophobicContact CB-CG 4.35Å
672	L	95.8	Very high	83.8	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	155.1	-170.8	70.6	91.1	0	0	0	115.4	P628 Q636 G652 I654 T670 V674 Y688	P628-L672 HydrophobicContact CB-CD2 3.99Å; P628-L672 HydrophobicContact CG-CD2 3.98Å; Q636-L672 HydrophobicContact CB-CD1 4.29Å; Q636-L672 HydrophobicContact CG-CD1 3.78Å; G652-L672 PolarHBondContact N-O 3.13Å; G652-L672 VanDerWaalsContact N-O 3.07Å; G652-L672 PolarHBondContact O-N 3.36Å; I654-L672 HydrophobicContact CD1-CD2 3.73Å; I654-L672 HydrophobicContact CG1-CD2 3.95Å; T670-L672 HydrophobicContact CG2-CB 4.35Å; T670-L672 HydrophobicContact CG2-CD2 4.32Å; L672-V674 HydrophobicContact CD1-CG2 4.44Å; L672-Y688 CarbonylContact C-O 3.47Å; L672-Y688 VanDerWaalsContact CA-O 3.23Å; L672-Y688 WeakPolarHBondContact CA-O 3.23Å
673	L	94.8	Very high	82.2	Confident	17 Å²	17	60.7 Å²	60.7	9%	0.089	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.4	169.9	-165.5	79.9	0	0	0	108.9	F530 P537 F538 Q640 F650 K675 Y688 F690	F530-L673 HydrophobicContact CZ-CB 4.25Å; F530-L673 HydrophobicContact CZ-CD2 4.41Å; P537-L673 HydrophobicContact CG-CD2 3.85Å; F538-L673 HydrophobicContact CZ-CD1 4.26Å; Q640-L673 HydrophobicContact CG-CD1 4.47Å; Q640-L673 VanDerWaalsContact OE1-CD1 3.24Å; F650-L673 WeakPolarHBondContact O-CD1 3.3Å; L673-K675 HydrophobicContact CD2-CG 4.1Å; L673-Y688 PolarHBondContact N-O 3.3Å; L673-Y688 PolarHBondContact O-N 3.09Å; L673-F690 HydrophobicContact CB-CE2 3.71Å; L673-F690 HydrophobicContact CB-CZ 4.13Å; L673-F690 HydrophobicContact CD1-CE2 4.48Å; L673-F690 HydrophobicContact CD2-CZ 4.34Å
674	V	93.4	Very high	81.3	Confident	6 Å²	6	58.9 Å²	58.9	4%	0.036	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.8	172.6	171.7	0	0	0	0	109.5	I633 Q636 D637 Q640 L672 K685 L686	I633-V674 HydrophobicContact CB-CG2 4.37Å; I633-V674 HydrophobicContact CG1-CG2 4.44Å; I633-V674 HydrophobicContact CG2-CG1 4.09Å; I633-V674 HydrophobicContact CG2-CG2 3.99Å; Q636-V674 HydrophobicContact CB-CG2 3.94Å; Q636-V674 HydrophobicContact CG-CB 4.15Å; Q636-V674 HydrophobicContact CG-CG2 3.65Å; D637-V674 HydrophobicContact CB-CG1 4.22Å; Q640-V674 PolarHBondContact NE2-O 3.19Å; L672-V674 HydrophobicContact CD1-CG2 4.44Å; V674-K685 HydrophobicContact CG1-CB 3.59Å; V674-K685 HydrophobicContact CG1-CD 4.38Å; V674-L686 WeakPolarHBondContact CA-O 3.31Å
675	K	89.1	Confident	81.1	Confident	57 Å²	57	60.2 Å²	60.2	25%	0.248	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	156	173.3	-69.8	-175.2	176.2	177.2	0	110.1	F530 V534 Q535 L673 K685 L686 Y688	F530-K675 HydrophobicContact CE1-CD 4.12Å; V534-K675 HydrophobicContact CG1-CD 4.21Å; Q535-K675 PolarHBondContact O-NZ 3.5Å; L673-K675 HydrophobicContact CD2-CG 4.1Å; K675-K685 WeakPolarHBondContact O-CA 3.35Å; K675-L686 PolarHBondContact N-O 3.31Å; K675-L686 PolarHBondContact O-N 2.87Å; K675-Y688 HydrophobicContact CB-CD2 3.97Å; K675-Y688 HydrophobicContact CB-CE2 3.99Å; K675-Y688 HydrophobicContact CD-CD2 4.49Å; K675-Y688 HydrophobicContact CG-CD2 4.39Å
676	E	85	Confident	81.1	Confident	141 Å²	141	59.2 Å²	59.2	66%	0.659	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	141	169.2	-55.6	-160.7	149.3	0	0	110.5	K685	E676-K685 HydrophobicContact CG-CG 4.26Å; E676-K685 WeakPolarHBondContact OE1-CE 3.41Å
677	S	74.6	Confident	81.1	Confident	16 Å²	16	57 Å²	57	11%	0.112	30%	0.299	C	S	.	.			trans	-65.7	133.3	174.2	-172.2	0	0	0	0	110.7	E679 N684	S677-E679 PolarHBondContact O-N 3.44Å; S677-E679 PolarHBondContact OG-N 2.91Å; S677-N684 WeakPolarHBondContact CB-O 3.1Å; S677-N684 PolarHBondContact N-O 3.33Å
678	Q	64.6	Low	81	Confident	141 Å²	141	57.2 Å²	57.2	66%	0.659	30%	0.298	S	S	*	.			trans	-75.2	-5.1	173	-63.3	-172	16	0	0	113.1	P680	Q678-P680 WeakPolarHBondContact O-CD 3.43Å
679	E	63.3	Low	81	Confident	96 Å²	96	59.3 Å²	59.3	45%	0.449	30%	0.304	S	S	.	.			trans	-73	121.1	177.9	-73.4	-176.7	-128.3	0	0	111.7	R528 S677 S681 S682	R528-E679 IonicContact NH2-OE1 2.65Å; R528-E679 PolarHBondContact NH2-OE1 2.71Å; S677-E679 PolarHBondContact O-N 3.44Å; S677-E679 PolarHBondContact OG-N 2.91Å; E679-S681 PolarHBondContact O-N 2.88Å; E679-S681 PolarHBondContact OE2-OG 2.8Å; E679-S682 PolarHBondContact O-N 2.97Å; E679-S682 VanDerWaalsContact O-N 3.09Å
680	P	54.5	Low	80.8	Confident	148 Å²	148	58.7 Å²	58.7	96%	0.961	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-5.8	-179	-24.3	34.8	0	0	0	115.7	Q678	Q678-P680 WeakPolarHBondContact O-CD 3.43Å
681	S	52.5	Low	80.6	Confident	97 Å²	97	63.9 Å²	63.9	68%	0.678	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-23.3	179.8	59.6	0	0	0	0	113.7	E679	E679-S681 PolarHBondContact O-N 2.88Å; E679-S681 PolarHBondContact OE2-OG 2.8Å
682	S	52.5	Low	80.4	Confident	28 Å²	28	66 Å²	66	20%	0.196	34%	0.338	C	S	.	.			trans	-138.3	106	-165	54.4	0	0	0	0	112.7	E679 N684	E679-S682 PolarHBondContact O-N 2.97Å; E679-S682 VanDerWaalsContact O-N 3.09Å; S682-N684 PolarHBondContact O-N 3.02Å
683	Q	57.1	Low	80.4	Confident	185 Å²	185	69.8 Å²	69.8	86%	0.864	36%	0.358	S	S	*	.			trans	-74	35.1	165.2	-59.7	-173.6	-78.3	0	0	111.6
684	N	70.4	Confident	80.2	Confident	88 Å²	88	71.5 Å²	71.5	47%	0.471	37%	0.371	S	S	.	.			trans	-92.3	127	-179.6	-69.5	11.1	0	0	0	107.8	S677 S682	S677-N684 WeakPolarHBondContact CB-O 3.1Å; S677-N684 PolarHBondContact N-O 3.33Å; S682-N684 PolarHBondContact O-N 3.02Å
685	K	86.5	Confident	80.1	Confident	71 Å²	71	71.6 Å²	71.6	31%	0.309	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	137.3	170.2	-58.4	-166.9	173.1	-178.1	0	108.9	D637 V674 K675 E676	D637-K685 HydrophobicContact CB-CD 4.3Å; D637-K685 WeakPolarHBondContact OD1-CD 3.35Å; D637-K685 WeakPolarHBondContact OD1-CE 3.15Å; D637-K685 IonicContact OD1-NZ 2.95Å; D637-K685 PolarHBondContact OD1-NZ 2.85Å; D637-K685 WeakPolarHBondContact OD2-CD 3.23Å; D637-K685 IonicContact OD2-NZ 2.68Å; D637-K685 PolarHBondContact OD2-NZ 3.21Å; V674-K685 HydrophobicContact CG1-CB 3.59Å; V674-K685 HydrophobicContact CG1-CD 4.38Å; K675-K685 WeakPolarHBondContact O-CA 3.35Å; E676-K685 HydrophobicContact CG-CG 4.26Å; E676-K685 WeakPolarHBondContact OE1-CE 3.41Å
686	L	90.9	Very high	79.9	Confident	28 Å²	28	76.3 Å²	76.3	15%	0.147	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.8	-169.5	-65.2	176.2	0	0	0	111	R528 V674 K675 Y688	R528-L686 VanDerWaalsContact CZ-CD1 3.44Å; V674-L686 WeakPolarHBondContact CA-O 3.31Å; K675-L686 PolarHBondContact N-O 3.31Å; K675-L686 PolarHBondContact O-N 2.87Å; L686-Y688 HydrophobicContact CB-CE2 4.27Å; L686-Y688 WeakPolarHBondContact O-CD2 3.45Å
687	P	94.4	Very high	80.1	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.013	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	134	176	32.6	-34.1	0	0	0	110.7	I525 C527 R528 P628 I633	I525-P687 HydrophobicContact CG2-CG 3.88Å; C527-P687 WeakPolarHBondContact CA-O 3.42Å; R528-P687 PolarHBondContact N-O 2.95Å; P628-P687 HydrophobicContact CG-CB 3.62Å; P628-P687 HydrophobicContact CG-CG 3.74Å; I633-P687 HydrophobicContact CD1-CG 3.89Å; I633-P687 HydrophobicContact CG1-CB 4.27Å; I633-P687 HydrophobicContact CG1-CG 4.16Å
688	Y	94.3	Very high	80.6	Confident	10 Å²	10	75.6 Å²	75.6	4%	0.039	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	136.6	169.7	-73.9	-102.8	0	0	0	109.1	R528 F530 V534 L672 L673 K675 L686	R528-Y688 HydrophobicContact CB-CD1 3.74Å; R528-Y688 HydrophobicContact CB-CE1 3.71Å; R528-Y688 HydrophobicContact CB-CG 4.22Å; R528-Y688 PolarHBondContact NH1-OH 3.35Å; R528-Y688 CarbonylContact O-C 3.44Å; R528-Y688 WeakPolarHBondContact O-CA 3.2Å; F530-Y688 AromaticContact CD1-CD1 3.8Å; F530-Y688 HydrophobicContact CD1-CD1 3.8Å; F530-Y688 HydrophobicContact CD1-CG 4.21Å; F530-Y688 AromaticContact CE1-CD1 3.82Å; F530-Y688 HydrophobicContact CE1-CD1 3.82Å; F530-Y688 AromaticContact CE1-CG 3.75Å; F530-Y688 HydrophobicContact CE1-CG 3.75Å; F530-Y688 HydrophobicContact CG-CD1 4.49Å; F530-Y688 HydrophobicContact CZ-CG 4.19Å; V534-Y688 HydrophobicContact CB-CE1 4.1Å; V534-Y688 HydrophobicContact CG1-CD1 4.27Å; V534-Y688 HydrophobicContact CG1-CE1 3.8Å; V534-Y688 HydrophobicContact CG2-CE1 4.37Å; L672-Y688 CarbonylContact C-O 3.47Å; L672-Y688 VanDerWaalsContact CA-O 3.23Å; L672-Y688 WeakPolarHBondContact CA-O 3.23Å; L673-Y688 PolarHBondContact N-O 3.3Å; L673-Y688 PolarHBondContact O-N 3.09Å; K675-Y688 HydrophobicContact CB-CD2 3.97Å; K675-Y688 HydrophobicContact CB-CE2 3.99Å; K675-Y688 HydrophobicContact CD-CD2 4.49Å; K675-Y688 HydrophobicContact CG-CD2 4.39Å; L686-Y688 HydrophobicContact CB-CE2 4.27Å; L686-Y688 WeakPolarHBondContact O-CD2 3.45Å
689	R	94.9	Very high	81.8	Confident	96 Å²	96	69.5 Å²	69.5	36%	0.362	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.4	-178.7	169.6	175.5	176.4	147.3	0.9	110.8	C527 R528 F530 T670 C671	C527-R689 HydrophobicContact CB-CB 3.59Å; R528-R689 PolarHBondContact O-N 2.73Å; F530-R689 WeakPolarHBondContact CD2-O 3.36Å; T670-R689 HydrophobicContact CG2-CG 4.37Å; C671-R689 WeakPolarHBondContact O-CA 3.1Å
690	F	94.1	Very high	83.2	Confident	1 Å²	1	68.4 Å²	68.4	0%	0.004	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	148	167.8	-71.2	-77.2	0	0	0	111.8	F530 E536 P537 F538 V540 I651 C671 L673 F692	F530-F690 HydrophobicContact CD2-CD1 4.14Å; F530-F690 HydrophobicContact CD2-CE1 4.49Å; F530-F690 AromaticContact CE2-CD1 3.62Å; F530-F690 HydrophobicContact CE2-CD1 3.62Å; F530-F690 HydrophobicContact CE2-CD2 4.23Å; F530-F690 AromaticContact CE2-CE1 3.75Å; F530-F690 HydrophobicContact CE2-CE1 3.75Å; F530-F690 HydrophobicContact CE2-CE2 4.36Å; F530-F690 AromaticContact CE2-CG 3.88Å; F530-F690 HydrophobicContact CE2-CG 3.88Å; F530-F690 HydrophobicContact CE2-CZ 4.12Å; F530-F690 HydrophobicContact CZ-CE1 4.21Å; F530-F690 HydrophobicContact CZ-CZ 4.28Å; E536-F690 HydrophobicContact CG-CD1 4.41Å; P537-F690 HydrophobicContact CG-CE1 4.3Å; P537-F690 HydrophobicContact CG-CZ 4.19Å; F538-F690 HydrophobicContact CD2-CE1 4.15Å; F538-F690 HydrophobicContact CD2-CZ 4.03Å; F538-F690 HydrophobicContact CE1-CZ 4.25Å; F538-F690 AromaticContact CE2-CE1 3.92Å; F538-F690 HydrophobicContact CE2-CE1 3.92Å; F538-F690 AromaticContact CE2-CE2 3.99Å; F538-F690 HydrophobicContact CE2-CE2 3.99Å; F538-F690 AromaticContact CE2-CZ 3.35Å; F538-F690 HydrophobicContact CE2-CZ 3.35Å; F538-F690 HydrophobicContact CZ-CE1 4.35Å; F538-F690 HydrophobicContact CZ-CE2 4.12Å; F538-F690 AromaticContact CZ-CZ 3.48Å; F538-F690 HydrophobicContact CZ-CZ 3.48Å; F538-F690 VanDerWaalsContact CZ-CZ 3.48Å; F538-F690 WeakPolarHBondContact O-CE1 3.48Å; V540-F690 HydrophobicContact CG2-CB 4.36Å; V540-F690 HydrophobicContact CG2-CD1 3.89Å; V540-F690 HydrophobicContact CG2-CD2 4.01Å; V540-F690 HydrophobicContact CG2-CE1 4.07Å; V540-F690 HydrophobicContact CG2-CE2 4.15Å; V540-F690 HydrophobicContact CG2-CG 3.85Å; V540-F690 HydrophobicContact CG2-CZ 4.2Å; I651-F690 HydrophobicContact CG2-CE2 3.83Å; C671-F690 HydrophobicContact CB-CB 4.17Å; C671-F690 PolarHBondContact O-N 3.11Å; L673-F690 HydrophobicContact CB-CE2 3.71Å; L673-F690 HydrophobicContact CB-CZ 4.13Å; L673-F690 HydrophobicContact CD1-CE2 4.48Å; L673-F690 HydrophobicContact CD2-CZ 4.34Å; F690-F692 PolarHBondContact O-N 2.65Å
691	N	92	Very high	85	Confident	109 Å²	109	63.7 Å²	63.7	58%	0.583	34%	0.335	S	S	*	.			trans	-95.7	79.6	163.2	-67.1	-44.8	0	0	0	109.3	E536	E536-N691 PolarHBondContact OE1-N 3.37Å
692	F	94.1	Very high	86.9	Confident	45 Å²	45	65 Å²	65	20%	0.197	33%	0.33	C	S	.	.			trans	-69.5	151.8	-177.7	72.4	-91.8	0	0	0	112.6	V540 V542 L547 M653 I669 C671 F690	V540-F692 HydrophobicContact CB-CB 3.93Å; V540-F692 HydrophobicContact CG1-CB 3.91Å; V540-F692 VanDerWaalsContact O-CA 3.32Å; V540-F692 WeakPolarHBondContact O-CA 3.38Å; V542-F692 HydrophobicContact CB-CD2 4.12Å; V542-F692 HydrophobicContact CB-CE2 4.46Å; V542-F692 HydrophobicContact CG2-CB 4.2Å; V542-F692 HydrophobicContact CG2-CD2 3.58Å; V542-F692 HydrophobicContact CG2-CE2 4.21Å; V542-F692 HydrophobicContact CG2-CG 4.06Å; L547-F692 HydrophobicContact CD2-CE2 3.86Å; L547-F692 HydrophobicContact CD2-CZ 4.18Å; M653-F692 HydrophobicContact CE-CD1 4.44Å; M653-F692 HydrophobicContact CE-CE1 4.17Å; M653-F692 HydrophobicContact CE-CZ 4.25Å; I669-F692 HydrophobicContact CB-CE1 4.37Å; I669-F692 HydrophobicContact CB-CZ 4.26Å; I669-F692 HydrophobicContact CG2-CE1 4.05Å; I669-F692 HydrophobicContact CG2-CZ 4.09Å; C671-F692 HydrophobicContact CB-CB 4.49Å; C671-F692 HydrophobicContact CB-CD1 3.54Å; C671-F692 HydrophobicContact CB-CE1 4.16Å; C671-F692 HydrophobicContact CB-CG 4.35Å; F690-F692 PolarHBondContact O-N 2.65Å
693	L	94.7	Very high	88.9	Confident	84 Å²	84	65.1 Å²	65.1	44%	0.44	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	146.4	177.6	-55.8	179.3	0	0	0	111.1	V540 I541 V542	V540-L693 PolarHBondContact O-N 3.42Å; I541-L693 CarbonylContact C-O 3.55Å; I541-L693 WeakPolarHBondContact CA-O 3.37Å; I541-L693 HydrophobicContact CG1-CB 4.44Å; V542-L693 PolarHBondContact N-O 2.73Å
694	S	92.1	Very high	90.7	Very high	53 Å²	53	56.3 Å²	56.3	37%	0.371	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	136.9	166.8	-58.7	0	0	0	0	110.2	V542	V542-S694 CarbonylContact O-C 3.55Å; V542-S694 WeakPolarHBondContact O-CA 3.49Å
695	S	90.9	Very high	91.9	Very high	7 Å²	7	53.3 Å²	53.3	5%	0.049	27%	0.27	C	S	.	.			trans	-80.1	146.9	172.8	-144.9	0	0	0	0	111.8	V542 K577 D697	V542-S695 PolarHBondContact O-N 2.89Å; K577-S695 WeakPolarHBondContact CE-OG 3.32Å; K577-S695 PolarHBondContact NZ-OG 3.13Å; K577-S695 VanDerWaalsContact NZ-OG 3.16Å; S695-D697 VanDerWaalsContact C-N 3.28Å; S695-D697 PolarHBondContact OG-OD1 2.81Å
696	Q	85.4	Confident	92.4	Very high	156 Å²	156	55.2 Å²	55.2	73%	0.729	28%	0.276	S	S	*	.			trans	-92.3	19.1	170.3	-61.4	179.1	-18.1	0	0	112.3
697	D	87.3	Confident	92.6	Very high	44 Å²	44	54.2 Å²	54.2	24%	0.235	27%	0.27	C	S	.	.	S	Bend	trans	-77.7	134.1	176.7	-62.5	35.8	0	0	0	108.2	K577 R579 S695 P699	K577-D697 WeakPolarHBondContact CE-OD1 2.94Å; K577-D697 VanDerWaalsContact CE-OD2 3.27Å; K577-D697 WeakPolarHBondContact CE-OD2 3.49Å; K577-D697 IonicContact NZ-OD1 2.79Å; K577-D697 PolarHBondContact NZ-OD1 2.92Å; K577-D697 IonicContact NZ-OD2 3.68Å; K577-D697 PolarHBondContact NZ-OD2 2.83Å; R579-D697 IonicContact CZ-OD2 3.23Å; R579-D697 IonicContact NE-OD2 2.84Å; R579-D697 IonicContact NH2-OD2 3.77Å; R579-D697 PolarHBondContact NH2-OD2 2.76Å; S695-D697 VanDerWaalsContact C-N 3.28Å; S695-D697 PolarHBondContact OG-OD1 2.81Å; D697-P699 VanDerWaalsContact O-CD 3.3Å; D697-P699 WeakPolarHBondContact O-CD 3.33Å
698	S	85.4	Confident	92.8	Very high	99 Å²	99	54.1 Å²	54.1	69%	0.692	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-53.4	119.4	169.3	53.2	0	0	0	0	110.2
699	P	90.6	Very high	92.9	Very high	13 Å²	13	57.9 Å²	57.9	8%	0.084	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-62	155.8	176	-27.8	40.2	0	0	0	112.7	A544 E545 D697 W701 L751	A544-P699 HydrophobicContact CB-CG 3.99Å; E545-P699 HydrophobicContact CB-CB 4.14Å; D697-P699 VanDerWaalsContact O-CD 3.3Å; D697-P699 WeakPolarHBondContact O-CD 3.33Å; P699-W701 HydrophobicContact CB-CD2 3.98Å; P699-W701 HydrophobicContact CB-CE3 3.73Å; P699-W701 HydrophobicContact CB-CH2 3.9Å; P699-W701 HydrophobicContact CB-CZ2 4.09Å; P699-W701 HydrophobicContact CB-CZ3 3.7Å; P699-W701 HydrophobicContact CG-CE3 4.33Å; P699-W701 HydrophobicContact CG-CH2 3.55Å; P699-W701 HydrophobicContact CG-CZ2 3.77Å; P699-W701 HydrophobicContact CG-CZ3 3.84Å; P699-W701 PolarHBondContact O-N 3.5Å; P699-L751 HydrophobicContact CG-CD1 3.7Å
700	D	92.1	Very high	92.9	Very high	72 Å²	72	57.4 Å²	57.4	39%	0.385	29%	0.285	S	S	.	.			trans	-83.2	99.1	164.2	-173.4	-34.4	0	0	0	108.3	E545 E702 Q703 T704	E545-D700 PolarHBondContact OE2-N 2.61Å; D700-E702 VanDerWaalsContact C-N 3.28Å; D700-E702 PolarHBondContact O-N 3.39Å; D700-E702 WeakPolarHBondContact OD1-CB 3.35Å; D700-E702 PolarHBondContact OD1-N 3.31Å; D700-Q703 HydrophobicContact CB-CB 3.84Å; D700-Q703 HydrophobicContact CB-CG 3.91Å; D700-Q703 PolarHBondContact O-N 3.45Å; D700-Q703 WeakPolarHBondContact OD1-CG 3.32Å; D700-Q703 PolarHBondContact OD1-N 2.72Å; D700-Q703 WeakPolarHBondContact OD2-CG 3.36Å; D700-T704 WeakPolarHBondContact O-CB 3.48Å; D700-T704 PolarHBondContact O-N 2.85Å; D700-T704 PolarHBondContact O-OG1 3.26Å
701	W	92.6	Very high	93.1	Very high	50 Å²	50	57.4 Å²	57.4	19%	0.189	29%	0.285	C	S	.	.	H	α-helix	trans	-66.7	-28.1	-177.3	-60.3	131.2	0	0	0	113	L548 P699 M705 L748 L751 E755 V759	L548-W701 HydrophobicContact CD1-CZ3 3.99Å; P699-W701 HydrophobicContact CB-CD2 3.98Å; P699-W701 HydrophobicContact CB-CE3 3.73Å; P699-W701 HydrophobicContact CB-CH2 3.9Å; P699-W701 HydrophobicContact CB-CZ2 4.09Å; P699-W701 HydrophobicContact CB-CZ3 3.7Å; P699-W701 HydrophobicContact CG-CE3 4.33Å; P699-W701 HydrophobicContact CG-CH2 3.55Å; P699-W701 HydrophobicContact CG-CZ2 3.77Å; P699-W701 HydrophobicContact CG-CZ3 3.84Å; P699-W701 PolarHBondContact O-N 3.5Å; W701-M705 WeakPolarHBondContact O-CB 3.19Å; W701-M705 WeakPolarHBondContact O-CG 3.34Å; W701-M705 PolarHBondContact O-N 2.99Å; W701-L748 HydrophobicContact CH2-CD2 3.66Å; W701-L748 HydrophobicContact CZ3-CD2 4.25Å; W701-L751 HydrophobicContact CH2-CD1 3.89Å; W701-L751 HydrophobicContact CZ2-CD1 4.03Å; W701-E755 HydrophobicContact CZ2-CB 4.21Å; W701-E755 PolarHBondContact NE1-OE2 2.74Å; W701-V759 HydrophobicContact CB-CG2 4.35Å; W701-V759 HydrophobicContact CD2-CB 4.46Å; W701-V759 HydrophobicContact CD2-CG1 4.49Å; W701-V759 HydrophobicContact CD2-CG2 3.66Å; W701-V759 HydrophobicContact CE3-CB 4.05Å; W701-V759 HydrophobicContact CE3-CG1 3.74Å; W701-V759 HydrophobicContact CE3-CG2 3.74Å; W701-V759 HydrophobicContact CG-CG2 3.96Å; W701-V759 HydrophobicContact CZ2-CG2 4.5Å; W701-V759 HydrophobicContact CZ3-CB 4.11Å; W701-V759 HydrophobicContact CZ3-CG1 3.94Å; W701-V759 HydrophobicContact CZ3-CG2 4.19Å
702	E	93.3	Very high	93.3	Very high	124 Å²	124	52.2 Å²	52.2	58%	0.579	26%	0.258	S	S	*	.	H	α-helix	trans	-71.1	-44.8	175.7	-163.9	-157.2	102.8	0	0	110.5	D700 T704 M705 R706	D700-E702 VanDerWaalsContact C-N 3.28Å; D700-E702 PolarHBondContact O-N 3.39Å; D700-E702 WeakPolarHBondContact OD1-CB 3.35Å; D700-E702 PolarHBondContact OD1-N 3.31Å; E702-T704 VanDerWaalsContact C-N 3.34Å; E702-M705 PolarHBondContact O-N 3.32Å; E702-R706 VanDerWaalsContact O-CB 3.23Å; E702-R706 WeakPolarHBondContact O-CB 3.25Å; E702-R706 PolarHBondContact O-N 3.24Å; E702-R706 IonicContact OE1-CZ 2.9Å; E702-R706 VanDerWaalsContact OE1-CZ 3.23Å; E702-R706 IonicContact OE1-NH1 2.86Å; E702-R706 PolarHBondContact OE1-NH1 3.28Å; E702-R706 IonicContact OE1-NH2 2.67Å; E702-R706 PolarHBondContact OE1-NH2 3.25Å
703	Q	93.6	Very high	93.2	Very high	30 Å²	30	56.5 Å²	56.5	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-35.7	174.5	-66.5	-63.6	-6	0	0	112.4	E545 D700 R706 R707	E545-Q703 WeakPolarHBondContact OE1-CB 3.2Å; D700-Q703 HydrophobicContact CB-CB 3.84Å; D700-Q703 HydrophobicContact CB-CG 3.91Å; D700-Q703 PolarHBondContact O-N 3.45Å; D700-Q703 WeakPolarHBondContact OD1-CG 3.32Å; D700-Q703 PolarHBondContact OD1-N 2.72Å; D700-Q703 WeakPolarHBondContact OD2-CG 3.36Å; Q703-R706 VanDerWaalsContact OE1-NH1 3.11Å; Q703-R707 VanDerWaalsContact CB-NH1 3.31Å; Q703-R707 WeakPolarHBondContact O-CG 3.38Å; Q703-R707 PolarHBondContact O-N 3.47Å; Q703-R707 PolarHBondContact O-NH1 3.09Å
704	T	95	Very high	93.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-52.8	172.9	-58	0	0	0	0	110.7	E545 L548 I549 D700 E702 R706 R707 A708	E545-T704 WeakPolarHBondContact CG-OG1 3.44Å; L548-T704 HydrophobicContact CD1-CG2 3.93Å; I549-T704 HydrophobicContact CD1-CG2 4.11Å; I549-T704 WeakPolarHBondContact CD1-O 3.4Å; D700-T704 WeakPolarHBondContact O-CB 3.48Å; D700-T704 PolarHBondContact O-N 2.85Å; D700-T704 PolarHBondContact O-OG1 3.26Å; E702-T704 VanDerWaalsContact C-N 3.34Å; T704-R706 PolarHBondContact O-N 3.27Å; T704-R707 PolarHBondContact O-N 3.47Å; T704-A708 PolarHBondContact O-N 3.43Å
705	M	96.3	Very high	93.3	Very high	26 Å²	26	53.3 Å²	53.3	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-68.6	-35.3	-177.7	-72.4	-59	-71.6	0	0	113	W701 E702 R707 A708 Q709 V759 E762 I763 L766	W701-M705 WeakPolarHBondContact O-CB 3.19Å; W701-M705 WeakPolarHBondContact O-CG 3.34Å; W701-M705 PolarHBondContact O-N 2.99Å; E702-M705 PolarHBondContact O-N 3.32Å; M705-R707 VanDerWaalsContact C-N 3.32Å; M705-R707 PolarHBondContact O-N 2.94Å; M705-A708 PolarHBondContact O-N 2.99Å; M705-Q709 WeakPolarHBondContact O-CB 3.5Å; M705-Q709 VanDerWaalsContact O-CG 3.29Å; M705-Q709 WeakPolarHBondContact O-CG 3.41Å; M705-Q709 PolarHBondContact O-N 3.18Å; M705-V759 HydrophobicContact SD-CG1 4.28Å; M705-E762 HydrophobicContact CE-CB 3.89Å; M705-E762 HydrophobicContact SD-CB 4.44Å; M705-I763 HydrophobicContact SD-CD1 4.45Å; M705-I763 HydrophobicContact SD-CG1 3.61Å; M705-L766 HydrophobicContact CE-CD2 4.24Å
706	R	96.1	Very high	93.3	Very high	111 Å²	111	53.2 Å²	53.2	42%	0.419	25%	0.253	S	S	.	.	H	α-helix	trans	-55.2	-45.4	170.7	174.6	179.9	-72.9	106.7	5.2	111.9	E702 Q703 T704 W710	E702-R706 VanDerWaalsContact O-CB 3.23Å; E702-R706 WeakPolarHBondContact O-CB 3.25Å; E702-R706 PolarHBondContact O-N 3.24Å; E702-R706 IonicContact OE1-CZ 2.9Å; E702-R706 VanDerWaalsContact OE1-CZ 3.23Å; E702-R706 IonicContact OE1-NH1 2.86Å; E702-R706 PolarHBondContact OE1-NH1 3.28Å; E702-R706 IonicContact OE1-NH2 2.67Å; E702-R706 PolarHBondContact OE1-NH2 3.25Å; Q703-R706 VanDerWaalsContact OE1-NH1 3.11Å; T704-R706 PolarHBondContact O-N 3.27Å; R706-W710 PolarHBondContact O-N 2.92Å; R706-W710 VanDerWaalsContact O-N 3.13Å
707	R	96.6	Very high	93.4	Very high	6 Å²	6	51.8 Å²	51.8	2%	0.023	25%	0.247	C	C	.	.	H	α-helix	trans	-73.6	-37.3	178.5	-73.6	168.7	-175.4	73	3.2	112.2	I549 A581 E582 Q703 T704 M705 Q709 W710 I711	I549-R707 HydrophobicContact CD1-CB 3.52Å; I549-R707 HydrophobicContact CG1-CB 3.99Å; I549-R707 HydrophobicContact CG2-CB 4.23Å; A581-R707 WeakPolarHBondContact O-CD 3.21Å; A581-R707 PolarHBondContact O-NE 3Å; E582-R707 IonicContact OE1-NE 3.35Å; E582-R707 IonicContact OE1-NH2 2.62Å; E582-R707 IonicContact OE2-CZ 3.83Å; E582-R707 IonicContact OE2-NE 2.78Å; E582-R707 PolarHBondContact OE2-NE 3.41Å; E582-R707 IonicContact OE2-NH2 2.78Å; E582-R707 PolarHBondContact OE2-NH2 3.19Å; Q703-R707 VanDerWaalsContact CB-NH1 3.31Å; Q703-R707 WeakPolarHBondContact O-CG 3.38Å; Q703-R707 PolarHBondContact O-N 3.47Å; Q703-R707 PolarHBondContact O-NH1 3.09Å; T704-R707 PolarHBondContact O-N 3.47Å; M705-R707 VanDerWaalsContact C-N 3.32Å; M705-R707 PolarHBondContact O-N 2.94Å; R707-Q709 VanDerWaalsContact C-N 3.34Å; R707-Q709 PolarHBondContact O-N 3.31Å; R707-W710 PolarHBondContact O-N 3.06Å; R707-I711 WeakPolarHBondContact O-CB 3.38Å; R707-I711 VanDerWaalsContact O-CG1 3.25Å; R707-I711 WeakPolarHBondContact O-CG1 3.45Å; R707-I711 PolarHBondContact O-N 3.09Å
708	A	97.1	Very high	93.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-44.1	172	0	0	0	0	0	111.9	M552 T704 M705 I711 V712 L766	M552-A708 HydrophobicContact CE-CB 3.91Å; M552-A708 HydrophobicContact SD-CB 4.06Å; T704-A708 PolarHBondContact O-N 3.43Å; M705-A708 PolarHBondContact O-N 2.99Å; A708-I711 PolarHBondContact O-N 2.57Å; A708-V712 WeakPolarHBondContact O-CB 3.34Å; A708-V712 WeakPolarHBondContact O-CG2 3.29Å; A708-V712 PolarHBondContact O-N 3.3Å; A708-L766 HydrophobicContact CB-CD2 3.96Å
709	Q	96.7	Very high	93.3	Very high	89 Å²	89	56 Å²	56	42%	0.416	26%	0.259	S	S	.	.	H	α-helix	trans	-61.6	-44.8	175.2	-72.6	171.3	7	0	0	112.2	M705 R707 V712 Q713 L766	M705-Q709 WeakPolarHBondContact O-CB 3.5Å; M705-Q709 VanDerWaalsContact O-CG 3.29Å; M705-Q709 WeakPolarHBondContact O-CG 3.41Å; M705-Q709 PolarHBondContact O-N 3.18Å; R707-Q709 VanDerWaalsContact C-N 3.34Å; R707-Q709 PolarHBondContact O-N 3.31Å; Q709-V712 PolarHBondContact O-N 2.83Å; Q709-Q713 WeakPolarHBondContact O-CB 3.31Å; Q709-Q713 VanDerWaalsContact O-CG 3.24Å; Q709-Q713 WeakPolarHBondContact O-CG 3.31Å; Q709-Q713 PolarHBondContact O-N 2.91Å; Q709-L766 HydrophobicContact CG-CD1 4.13Å; Q709-L766 HydrophobicContact CG-CD2 3.86Å
710	W	95.9	Very high	93	Very high	87 Å²	87	57.2 Å²	57.2	33%	0.33	27%	0.274	S	S	.	.	H	α-helix	trans	-61.7	-45.4	175.9	-176	99	0	0	0	112.2	P583 R706 R707 V712 Q713 K714 Y715	P583-W710 HydrophobicContact CB-CE3 3.75Å; P583-W710 HydrophobicContact CB-CH2 3.79Å; P583-W710 HydrophobicContact CB-CZ3 3.23Å; P583-W710 HydrophobicContact CG-CE3 4.47Å; P583-W710 HydrophobicContact CG-CZ3 4.35Å; P583-W710 WeakPolarHBondContact O-CH2 3.29Å; R706-W710 PolarHBondContact O-N 2.92Å; R706-W710 VanDerWaalsContact O-N 3.13Å; R707-W710 PolarHBondContact O-N 3.06Å; W710-V712 VanDerWaalsContact C-N 3.3Å; W710-V712 PolarHBondContact O-N 3.14Å; W710-Q713 PolarHBondContact O-N 3.13Å; W710-K714 HydrophobicContact CD2-CD 4.48Å; W710-K714 HydrophobicContact CE3-CD 4.11Å; W710-K714 HydrophobicContact CH2-CD 3.42Å; W710-K714 VanDerWaalsContact CH2-CD 3.42Å; W710-K714 HydrophobicContact CZ2-CD 3.76Å; W710-K714 HydrophobicContact CZ3-CD 3.54Å; W710-K714 VanDerWaalsContact O-CB 3.27Å; W710-K714 WeakPolarHBondContact O-CB 3.32Å; W710-K714 PolarHBondContact O-N 3.21Å; W710-Y715 HydrophobicContact CZ3-CE2 4.4Å
711	I	96.9	Very high	93.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.3	-46.5	176	-72.3	165.8	0	0	0	109.8	I549 M552 H553 V556 P583 R707 A708 Y715 F767	I549-I711 HydrophobicContact CG2-CD1 4.24Å; M552-I711 HydrophobicContact CB-CD1 4.19Å; H553-I711 HydrophobicContact CB-CD1 3.91Å; H553-I711 HydrophobicContact CB-CG1 4.36Å; V556-I711 HydrophobicContact CB-CG2 4.34Å; V556-I711 HydrophobicContact CG1-CG2 3.7Å; V556-I711 HydrophobicContact CG2-CG2 3.76Å; P583-I711 HydrophobicContact CB-CG1 4.47Å; P583-I711 HydrophobicContact CG-CD1 4.05Å; P583-I711 HydrophobicContact CG-CG1 4.13Å; R707-I711 WeakPolarHBondContact O-CB 3.38Å; R707-I711 VanDerWaalsContact O-CG1 3.25Å; R707-I711 WeakPolarHBondContact O-CG1 3.45Å; R707-I711 PolarHBondContact O-N 3.09Å; A708-I711 PolarHBondContact O-N 2.57Å; I711-Y715 WeakPolarHBondContact O-CB 3.36Å; I711-Y715 WeakPolarHBondContact O-CD2 3.37Å; I711-Y715 PolarHBondContact O-N 3.46Å; I711-F767 HydrophobicContact CG2-CZ 4.42Å
712	V	95.8	Very high	93.1	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-64.9	-49.7	179	164.4	0	0	0	0	111.9	A708 Q709 W710 K714 A716 L766 F767 D770 F771	A708-V712 WeakPolarHBondContact O-CB 3.34Å; A708-V712 WeakPolarHBondContact O-CG2 3.29Å; A708-V712 PolarHBondContact O-N 3.3Å; Q709-V712 PolarHBondContact O-N 2.83Å; W710-V712 VanDerWaalsContact C-N 3.3Å; W710-V712 PolarHBondContact O-N 3.14Å; V712-K714 VanDerWaalsContact C-N 3.35Å; V712-K714 PolarHBondContact O-N 2.96Å; V712-A716 WeakPolarHBondContact O-CB 3.43Å; V712-A716 PolarHBondContact O-N 3.17Å; V712-L766 HydrophobicContact CG2-CD2 4.34Å; V712-L766 HydrophobicContact CG2-CG 4.24Å; V712-F767 HydrophobicContact CG2-CD1 4.03Å; V712-F767 HydrophobicContact CG2-CD2 3.92Å; V712-F767 HydrophobicContact CG2-CE1 3.71Å; V712-F767 HydrophobicContact CG2-CE2 3.6Å; V712-F767 HydrophobicContact CG2-CG 4.14Å; V712-F767 HydrophobicContact CG2-CZ 3.49Å; V712-F767 VanDerWaalsContact CG2-CZ 3.49Å; V712-D770 HydrophobicContact CG1-CB 3.62Å; V712-F771 HydrophobicContact CB-CD2 4.22Å; V712-F771 HydrophobicContact CG1-CB 4.11Å; V712-F771 HydrophobicContact CG1-CD2 4.12Å; V712-F771 HydrophobicContact CG2-CB 4.42Å; V712-F771 HydrophobicContact CG2-CD2 4.06Å
713	Q	93.9	Very high	93.1	Very high	134 Å²	134	51.6 Å²	51.6	63%	0.626	25%	0.25	S	S	*	.	H	α-helix	trans	-59.9	-43	-179.6	-73.1	170.6	13.8	0	0	112.3	Q709 W710	Q709-Q713 WeakPolarHBondContact O-CB 3.31Å; Q709-Q713 VanDerWaalsContact O-CG 3.24Å; Q709-Q713 WeakPolarHBondContact O-CG 3.31Å; Q709-Q713 PolarHBondContact O-N 2.91Å; W710-Q713 PolarHBondContact O-N 3.13Å
714	K	93.3	Very high	93.1	Very high	57 Å²	57	50.1 Å²	50.1	25%	0.248	24%	0.244	C	C	.	.	H	α-helix	trans	-73.5	-41.7	-178.6	178.3	178.8	161.1	-168.3	0	113.1	C584 N585 W710 V712	C584-K714 PolarHBondContact O-NZ 2.56Å; N585-K714 WeakPolarHBondContact OD1-CE 3.33Å; N585-K714 PolarHBondContact OD1-NZ 2.87Å; W710-K714 HydrophobicContact CD2-CD 4.48Å; W710-K714 HydrophobicContact CE3-CD 4.11Å; W710-K714 HydrophobicContact CH2-CD 3.42Å; W710-K714 VanDerWaalsContact CH2-CD 3.42Å; W710-K714 HydrophobicContact CZ2-CD 3.76Å; W710-K714 HydrophobicContact CZ3-CD 3.54Å; W710-K714 VanDerWaalsContact O-CB 3.27Å; W710-K714 WeakPolarHBondContact O-CB 3.32Å; W710-K714 PolarHBondContact O-N 3.21Å; V712-K714 VanDerWaalsContact C-N 3.35Å; V712-K714 PolarHBondContact O-N 2.96Å
715	Y	94.2	Very high	93	Very high	13 Å²	13	53.7 Å²	53.7	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-98.8	-13.2	-169.9	-72.6	-88.4	0	0	0	115.5	H553 V556 V561 W710 I711 Q717 A718 S721 F771	H553-Y715 AromaticContact CD2-CE2 3.56Å; H553-Y715 AromaticContact NE2-CE2 3.27Å; H553-Y715 VanDerWaalsContact NE2-CE2 3.27Å; H553-Y715 WeakPolarHBondContact NE2-CE2 3.36Å; H553-Y715 AromaticContact NE2-CZ 3.53Å; H553-Y715 PolarHBondContact NE2-OH 3.26Å; V556-Y715 HydrophobicContact CB-CG 4.17Å; V556-Y715 HydrophobicContact CG2-CD1 4.01Å; V556-Y715 HydrophobicContact CG2-CD2 3.75Å; V556-Y715 HydrophobicContact CG2-CE2 4.41Å; V556-Y715 HydrophobicContact CG2-CG 3.52Å; V561-Y715 HydrophobicContact CG1-CE1 3.94Å; W710-Y715 HydrophobicContact CZ3-CE2 4.4Å; I711-Y715 WeakPolarHBondContact O-CB 3.36Å; I711-Y715 WeakPolarHBondContact O-CD2 3.37Å; I711-Y715 PolarHBondContact O-N 3.46Å; Y715-Q717 PolarHBondContact O-N 3.38Å; Y715-A718 HydrophobicContact CD1-CB 4.02Å; Y715-A718 PolarHBondContact O-N 2.96Å; Y715-S721 VanDerWaalsContact O-CB 3.22Å; Y715-S721 WeakPolarHBondContact O-CB 3.2Å; Y715-S721 PolarHBondContact O-OG 3.3Å; Y715-F771 VanDerWaalsContact C-CE2 3.49Å
716	A	91.7	Very high	92.8	Very high	5 Å²	5	59.6 Å²	59.6	4%	0.041	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-30.6	-178.8	0	0	0	0	0	114	V712 F771 K774 Q775	V712-A716 WeakPolarHBondContact O-CB 3.43Å; V712-A716 PolarHBondContact O-N 3.17Å; A716-F771 HydrophobicContact CB-CD2 3.72Å; A716-F771 HydrophobicContact CB-CE2 4.1Å; A716-F771 HydrophobicContact CB-CG 4.17Å; A716-F771 VanDerWaalsContact N-CE2 3.33Å; A716-K774 HydrophobicContact CB-CB 4.25Å; A716-Q775 VanDerWaalsContact O-CG 3.23Å; A716-Q775 WeakPolarHBondContact O-CG 3.23Å
717	Q	88.1	Confident	92.7	Very high	126 Å²	126	58.4 Å²	58.4	59%	0.589	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	15.6	178.3	-66.9	177.5	-36	0	0	112.5	Y715	Y715-Q717 PolarHBondContact O-N 3.38Å
718	A	87.8	Confident	92.3	Very high	31 Å²	31	59.4 Å²	59.4	26%	0.256	29%	0.29	S	S	.	.	S	Bend	trans	-74	145.9	-179.2	0	0	0	0	0	112.6	Y715 G720 S721	Y715-A718 HydrophobicContact CD1-CB 4.02Å; Y715-A718 PolarHBondContact O-N 2.96Å; A718-G720 PolarHBondContact O-N 3.45Å; A718-G720 VanDerWaalsContact O-N 3.12Å; A718-S721 VanDerWaalsContact O-CB 3.28Å; A718-S721 WeakPolarHBondContact O-CB 3.11Å; A718-S721 PolarHBondContact O-N 3.16Å
719	H	80.9	Confident	91.9	Very high	200 Å²	200	62 Å²	62	93%	0.926	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	115.9	170.4	-71.1	75.4	0	0	0	109.5
720	G	85.5	Confident	91.2	Very high	39 Å²	39	70 Å²	70	40%	0.402	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	13.8	-173.8	0	0	0	0	0	115.3	R558 A718	R558-G720 VanDerWaalsContact CB-O 3.22Å; R558-G720 WeakPolarHBondContact CB-O 3.38Å; R558-G720 VanDerWaalsContact CG-O 3.27Å; R558-G720 WeakPolarHBondContact CG-O 3.24Å; R558-G720 PolarHBondContact N-O 2.88Å; A718-G720 PolarHBondContact O-N 3.45Å; A718-G720 VanDerWaalsContact O-N 3.12Å
721	S	93	Very high	90.6	Very high	20 Å²	20	72.4 Å²	72.4	14%	0.14	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-52.5	145.9	169.2	-166.7	0	0	0	0	112.5	Y715 A718 F771 Q775	Y715-S721 VanDerWaalsContact O-CB 3.22Å; Y715-S721 WeakPolarHBondContact O-CB 3.2Å; Y715-S721 PolarHBondContact O-OG 3.3Å; A718-S721 VanDerWaalsContact O-CB 3.28Å; A718-S721 WeakPolarHBondContact O-CB 3.11Å; A718-S721 PolarHBondContact O-N 3.16Å; S721-F771 WeakPolarHBondContact OG-CZ 3.18Å; S721-Q775 PolarHBondContact OG-NE2 3.27Å
722	V	93.8	Very high	90.2	Very high	9 Å²	9	73.6 Å²	73.6	6%	0.055	35%	0.353	C	S	.	.			trans	-84	127.9	173.6	171.8	0	0	0	0	110	H555 V556 R558 Y658 M724 C736 F771 Q775	H555-V722 WeakPolarHBondContact O-CB 3.03Å; H555-V722 VanDerWaalsContact O-CG2 3.25Å; H555-V722 WeakPolarHBondContact O-CG2 3.16Å; V556-V722 PolarHBondContact O-N 2.95Å; R558-V722 HydrophobicContact CG-CG2 3.55Å; Y658-V722 HydrophobicContact CE2-CG1 4.42Å; Y658-V722 HydrophobicContact CE2-CG2 4.22Å; V722-M724 PolarHBondContact O-N 3.46Å; V722-M724 VanDerWaalsContact O-N 3.12Å; V722-C736 HydrophobicContact CG1-CB 3.93Å; V722-F771 WeakPolarHBondContact O-CE1 3.49Å; V722-Q775 PolarHBondContact O-NE2 2.8Å
723	Q	93.3	Very high	89.9	Confident	99 Å²	99	78.5 Å²	78.5	46%	0.463	39%	0.388	S	S	.	.			trans	-67.1	108.6	170	-72.1	172.2	-29.4	0	0	109.2	R726 C736	Q723-R726 HydrophobicContact CB-CB 3.88Å; Q723-R726 PolarHBondContact O-N 3.29Å; Q723-C736 WeakPolarHBondContact O-CB 3.41Å; Q723-C736 PolarHBondContact O-SG 2.98Å
724	M	94	Very high	89.9	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-25.8	-169.6	-83	-64.1	176.4	0	0	113.8	H555 V556 V722 C736 L737 M740 F767 F771 V772	H555-M724 HydrophobicContact CB-CE 4.15Å; H555-M724 WeakPolarHBondContact O-CE 3.47Å; V556-M724 HydrophobicContact CB-CE 4.49Å; V556-M724 HydrophobicContact CG1-CE 3.92Å; V722-M724 PolarHBondContact O-N 3.46Å; V722-M724 VanDerWaalsContact O-N 3.12Å; M724-C736 PolarHBondContact O-N 3.49Å; M724-C736 HydrophobicContact SD-CB 4.05Å; M724-L737 HydrophobicContact CB-CB 4.25Å; M724-L737 WeakPolarHBondContact O-CB 3.47Å; M724-L737 PolarHBondContact O-N 2.98Å; M724-L737 HydrophobicContact SD-CB 4.38Å; M724-M740 HydrophobicContact CE-SD 4.24Å; M724-F767 HydrophobicContact CE-CE1 4.2Å; M724-F767 HydrophobicContact CG-CD1 4.45Å; M724-F771 HydrophobicContact CB-CD1 4.16Å; M724-F771 HydrophobicContact CB-CE1 4.47Å; M724-F771 HydrophobicContact CE-CE1 4.31Å; M724-F771 HydrophobicContact CG-CD1 3.52Å; M724-F771 HydrophobicContact CG-CE1 3.54Å; M724-V772 HydrophobicContact CB-CG2 3.76Å
725	D	92.8	Very high	90	Very high	74 Å²	74	72.8 Å²	72.8	40%	0.396	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	0.9	177.8	66.7	-30.9	0	0	0	114.1	T735 V772 K776	D725-T735 WeakPolarHBondContact O-CG2 3.19Å; D725-V772 HydrophobicContact CB-CG1 4.35Å; D725-K776 WeakPolarHBondContact OD2-CE 3.28Å; D725-K776 IonicContact OD2-NZ 2.68Å; D725-K776 PolarHBondContact OD2-NZ 2.74Å
726	R	92.3	Very high	90.1	Very high	150 Å²	150	72.7 Å²	72.7	57%	0.566	37%	0.366	S	S	*	.	S	Bend	trans	-84.5	143.8	175	176.5	178.2	167.2	157.4	-0.4	110.7	Q723 F728 T735 C736	Q723-R726 HydrophobicContact CB-CB 3.88Å; Q723-R726 PolarHBondContact O-N 3.29Å; R726-F728 PolarHBondContact O-N 3.01Å; R726-T735 CarbonylContact O-C 3.37Å; R726-T735 VanDerWaalsContact O-CA 3.24Å; R726-T735 WeakPolarHBondContact O-CA 3.49Å; R726-C736 PolarHBondContact O-N 3.26Å; R726-C736 PolarHBondContact O-SG 3.38Å; R726-C736 VanDerWaalsContact O-SG 3.39Å
727	L	92.9	Very high	90.3	Very high	86 Å²	86	72.8 Å²	72.8	45%	0.45	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-55.9	129.5	171.1	-64.3	178.3	0	0	0	111.8	R729 L734	L727-R729 VanDerWaalsContact C-N 3.29Å; L727-R729 PolarHBondContact O-N 3.26Å; L727-L734 WeakPolarHBondContact CA-O 3.31Å
728	F	89.4	Confident	90.6	Very high	28 Å²	28	70.7 Å²	70.7	12%	0.123	36%	0.356	C	S	.	.	S	Bend	trans	-72	-24.2	-173.7	90.2	-93.8	0	0	0	113	Y658 R726 S732 L734 K739	Y658-F728 HydrophobicContact CD1-CB 4.35Å; Y658-F728 HydrophobicContact CD1-CD2 4.37Å; Y658-F728 HydrophobicContact CE1-CB 4.21Å; R726-F728 PolarHBondContact O-N 3.01Å; F728-S732 WeakPolarHBondContact CE1-OG 3.28Å; F728-L734 HydrophobicContact CD1-CB 3.92Å; F728-L734 WeakPolarHBondContact CD1-O 3.4Å; F728-L734 HydrophobicContact CE1-CB 3.99Å; F728-L734 HydrophobicContact CE1-CD1 4.39Å; F728-L734 PolarHBondContact N-O 2.94Å; F728-K739 HydrophobicContact CB-CB 4.21Å; F728-K739 HydrophobicContact CB-CG 4.44Å; F728-K739 HydrophobicContact CD1-CB 3.66Å; F728-K739 HydrophobicContact CD1-CG 3.79Å; F728-K739 HydrophobicContact CD2-CG 3.95Å; F728-K739 HydrophobicContact CE1-CB 4.09Å; F728-K739 HydrophobicContact CE1-CG 3.9Å; F728-K739 HydrophobicContact CE2-CG 4.07Å; F728-K739 HydrophobicContact CG-CB 3.92Å; F728-K739 HydrophobicContact CG-CG 3.82Å; F728-K739 HydrophobicContact CZ-CG 4.06Å
729	R	87.1	Confident	91	Very high	55 Å²	55	69.3 Å²	69.3	21%	0.208	34%	0.344	C	S	.	.	S	Bend	trans	-141.5	166.5	165.6	-62.7	-179.8	179.8	150.7	5.1	110.7	D659 N662 L727 D731	D659-R729 PolarHBondContact O-NH2 2.98Å; N662-R729 VanDerWaalsContact O-CZ 3.25Å; N662-R729 PolarHBondContact O-NH1 3.14Å; N662-R729 PolarHBondContact O-NH2 3.19Å; L727-R729 VanDerWaalsContact C-N 3.29Å; L727-R729 PolarHBondContact O-N 3.26Å; R729-D731 VanDerWaalsContact C-N 3.31Å; R729-D731 WeakPolarHBondContact CB-OD1 3.36Å
730	R	83	Confident	91.8	Very high	255 Å²	255	59.8 Å²	59.8	96%	0.962	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.9	-179.9	-61.4	-174.2	-174.9	123.7	-4.3	113.6
731	D	83.9	Confident	92.4	Very high	138 Å²	138	58.9 Å²	58.9	74%	0.738	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-3.4	-177.4	58.1	-46.1	0	0	0	113	R729	R729-D731 VanDerWaalsContact C-N 3.31Å; R729-D731 WeakPolarHBondContact CB-OD1 3.36Å
732	S	86.6	Confident	92.5	Very high	25 Å²	25	59.4 Å²	59.4	18%	0.175	29%	0.291	C	S	.	.			trans	-101.8	147.1	177	-166.8	0	0	0	0	112.3	F728 L734	F728-S732 WeakPolarHBondContact CE1-OG 3.28Å; S732-L734 VanDerWaalsContact C-N 3.33Å; S732-L734 PolarHBondContact OG-N 3.46Å
733	S	89.9	Confident	92.6	Very high	105 Å²	105	59 Å²	59	73%	0.734	29%	0.289	S	S	*	.	S	Bend	trans	-81.2	-8.1	169.7	58.5	0	0	0	0	114
734	L	93.7	Very high	92.8	Very high	46 Å²	46	54.2 Å²	54.2	24%	0.241	27%	0.267	C	S	.	.			trans	-95.6	140.7	-174.4	-57.7	179.1	0	0	0	112.4	T665 L727 F728 S732 E738	T665-L734 HydrophobicContact CG2-CD1 3.85Å; L727-L734 WeakPolarHBondContact CA-O 3.31Å; F728-L734 HydrophobicContact CD1-CB 3.92Å; F728-L734 WeakPolarHBondContact CD1-O 3.4Å; F728-L734 HydrophobicContact CE1-CB 3.99Å; F728-L734 HydrophobicContact CE1-CD1 4.39Å; F728-L734 PolarHBondContact N-O 2.94Å; S732-L734 VanDerWaalsContact C-N 3.33Å; S732-L734 PolarHBondContact OG-N 3.46Å; L734-E738 HydrophobicContact CB-CB 4.19Å; L734-E738 HydrophobicContact CD2-CB 4.11Å
735	T	95.6	Very high	92.8	Very high	25 Å²	25	55.9 Å²	55.9	15%	0.153	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-71.2	164.5	166.1	59.9	0	0	0	0	112.4	D725 R726 L737 E738 K739	D725-T735 WeakPolarHBondContact O-CG2 3.19Å; R726-T735 CarbonylContact O-C 3.37Å; R726-T735 VanDerWaalsContact O-CA 3.24Å; R726-T735 WeakPolarHBondContact O-CA 3.49Å; T735-L737 PolarHBondContact O-N 3.07Å; T735-E738 VanDerWaalsContact CB-OE2 3.3Å; T735-E738 WeakPolarHBondContact CB-OE2 3.32Å; T735-E738 WeakPolarHBondContact CG2-OE2 3.41Å; T735-E738 PolarHBondContact N-OE2 3.13Å; T735-E738 PolarHBondContact O-N 3.42Å; T735-E738 VanDerWaalsContact OG1-CD 3.28Å; T735-E738 VanDerWaalsContact OG1-CG 3.3Å; T735-E738 WeakPolarHBondContact OG1-CG 3.5Å; T735-E738 PolarHBondContact OG1-N 3.4Å; T735-E738 VanDerWaalsContact OG1-N 3.13Å; T735-E738 PolarHBondContact OG1-OE2 3.41Å; T735-K739 WeakPolarHBondContact O-CB 3.49Å; T735-K739 PolarHBondContact O-N 3.09Å
736	C	95.7	Very high	92.8	Very high	10 Å²	10	55.9 Å²	55.9	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-54.9	-37.8	170.5	-71	0	0	0	0	112.1	Y658 V722 Q723 M724 R726 M740	Y658-C736 HydrophobicContact CE1-CB 4.49Å; V722-C736 HydrophobicContact CG1-CB 3.93Å; Q723-C736 WeakPolarHBondContact O-CB 3.41Å; Q723-C736 PolarHBondContact O-SG 2.98Å; M724-C736 PolarHBondContact O-N 3.49Å; M724-C736 HydrophobicContact SD-CB 4.05Å; R726-C736 PolarHBondContact O-N 3.26Å; R726-C736 PolarHBondContact O-SG 3.38Å; R726-C736 VanDerWaalsContact O-SG 3.39Å; C736-M740 WeakPolarHBondContact O-CB 3.32Å; C736-M740 PolarHBondContact O-N 3.15Å
737	L	96.4	Very high	92.9	Very high	7 Å²	7	49 Å²	49	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-67.7	-50.2	175.2	178.9	56	0	0	0	111.9	M724 T735 K739 M740 M741 F767 L768	M724-L737 HydrophobicContact CB-CB 4.25Å; M724-L737 WeakPolarHBondContact O-CB 3.47Å; M724-L737 PolarHBondContact O-N 2.98Å; M724-L737 HydrophobicContact SD-CB 4.38Å; T735-L737 PolarHBondContact O-N 3.07Å; L737-K739 VanDerWaalsContact C-N 3.28Å; L737-K739 PolarHBondContact O-N 3.45Å; L737-M740 HydrophobicContact CD1-CE 3.84Å; L737-M740 CarbonylContact O-C 3.48Å; L737-M740 WeakPolarHBondContact O-CA 3.39Å; L737-M740 WeakPolarHBondContact O-CB 3.35Å; L737-M740 PolarHBondContact O-N 3.31Å; L737-M741 HydrophobicContact CD1-CG 4.23Å; L737-M741 HydrophobicContact CD1-SD 4.12Å; L737-M741 WeakPolarHBondContact O-CG 3.35Å; L737-M741 PolarHBondContact O-N 3.02Å; L737-F767 HydrophobicContact CD1-CB 3.76Å; L737-F767 HydrophobicContact CD1-CG 4.25Å; L737-L768 HydrophobicContact CD2-CD2 3.56Å; L737-L768 HydrophobicContact CD2-CG 3.85Å
738	E	95.9	Very high	92.8	Very high	83 Å²	83	45.6 Å²	45.6	39%	0.388	23%	0.231	S	C	.	.	H	α-helix	trans	-63.8	-35.9	179.1	-68.7	158.2	132.4	0	0	111.8	L734 T735 M740 M741 A742	L734-E738 HydrophobicContact CB-CB 4.19Å; L734-E738 HydrophobicContact CD2-CB 4.11Å; T735-E738 VanDerWaalsContact CB-OE2 3.3Å; T735-E738 WeakPolarHBondContact CB-OE2 3.32Å; T735-E738 WeakPolarHBondContact CG2-OE2 3.41Å; T735-E738 PolarHBondContact N-OE2 3.13Å; T735-E738 PolarHBondContact O-N 3.42Å; T735-E738 VanDerWaalsContact OG1-CD 3.28Å; T735-E738 VanDerWaalsContact OG1-CG 3.3Å; T735-E738 WeakPolarHBondContact OG1-CG 3.5Å; T735-E738 PolarHBondContact OG1-N 3.4Å; T735-E738 VanDerWaalsContact OG1-N 3.13Å; T735-E738 PolarHBondContact OG1-OE2 3.41Å; E738-M740 VanDerWaalsContact C-N 3.34Å; E738-M741 PolarHBondContact O-N 3.1Å; E738-A742 WeakPolarHBondContact O-CB 3.33Å; E738-A742 PolarHBondContact O-N 3.44Å
739	K	96.1	Very high	92.7	Very high	1 Å²	1	51.2 Å²	51.2	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-37.7	170.9	-173	-88.6	134.2	172.6	0	112	H555 P657 Y658 T665 S667 F728 T735 L737 S743	H555-K739 PolarHBondContact CE1-NZ 3.12Å; H555-K739 WeakPolarHBondContact NE2-CD 3.5Å; H555-K739 WeakPolarHBondContact NE2-CE 3.36Å; H555-K739 PolarHBondContact NE2-NZ 3.34Å; P657-K739 PolarHBondContact O-NZ 3.23Å; Y658-K739 HydrophobicContact CD1-CD 4.22Å; Y658-K739 HydrophobicContact CE1-CD 3.9Å; T665-K739 WeakPolarHBondContact O-CE 3.46Å; T665-K739 WeakPolarHBondContact O-CG 3.32Å; S667-K739 PolarHBondContact OG-NZ 2.84Å; F728-K739 HydrophobicContact CB-CB 4.21Å; F728-K739 HydrophobicContact CB-CG 4.44Å; F728-K739 HydrophobicContact CD1-CB 3.66Å; F728-K739 HydrophobicContact CD1-CG 3.79Å; F728-K739 HydrophobicContact CD2-CG 3.95Å; F728-K739 HydrophobicContact CE1-CB 4.09Å; F728-K739 HydrophobicContact CE1-CG 3.9Å; F728-K739 HydrophobicContact CE2-CG 4.07Å; F728-K739 HydrophobicContact CG-CB 3.92Å; F728-K739 HydrophobicContact CG-CG 3.82Å; F728-K739 HydrophobicContact CZ-CG 4.06Å; T735-K739 WeakPolarHBondContact O-CB 3.49Å; T735-K739 PolarHBondContact O-N 3.09Å; L737-K739 VanDerWaalsContact C-N 3.28Å; L737-K739 PolarHBondContact O-N 3.45Å; K739-S743 WeakPolarHBondContact O-CB 3.01Å; K739-S743 PolarHBondContact O-N 3.27Å; K739-S743 VanDerWaalsContact O-N 3.07Å
740	M	97.4	Very high	92.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-52	172.1	-171.1	177.3	75.5	0	0	111	M552 H555 M724 C736 L737 E738 A742 S743 L744 F767	M552-M740 HydrophobicContact CB-SD 4.43Å; M552-M740 HydrophobicContact CG-CE 4.42Å; M552-M740 HydrophobicContact CG-SD 4.05Å; H555-M740 HydrophobicContact CB-CB 4.39Å; H555-M740 HydrophobicContact CB-CG 3.96Å; H555-M740 HydrophobicContact CB-SD 3.61Å; H555-M740 WeakPolarHBondContact NE2-CA 3.46Å; M724-M740 HydrophobicContact CE-SD 4.24Å; C736-M740 WeakPolarHBondContact O-CB 3.32Å; C736-M740 PolarHBondContact O-N 3.15Å; L737-M740 HydrophobicContact CD1-CE 3.84Å; L737-M740 CarbonylContact O-C 3.48Å; L737-M740 WeakPolarHBondContact O-CA 3.39Å; L737-M740 WeakPolarHBondContact O-CB 3.35Å; L737-M740 PolarHBondContact O-N 3.31Å; E738-M740 VanDerWaalsContact C-N 3.34Å; M740-A742 VanDerWaalsContact C-N 3.31Å; M740-A742 PolarHBondContact O-N 2.98Å; M740-S743 WeakPolarHBondContact O-CA 3.41Å; M740-S743 WeakPolarHBondContact O-CB 3.46Å; M740-S743 PolarHBondContact O-N 3.38Å; M740-L744 HydrophobicContact CE-CD1 4.36Å; M740-L744 HydrophobicContact CG-CD1 3.94Å; M740-L744 HydrophobicContact CG-CG 4.2Å; M740-L744 WeakPolarHBondContact O-CG 3.32Å; M740-L744 PolarHBondContact O-N 3.2Å; M740-F767 HydrophobicContact CE-CD1 4Å; M740-F767 HydrophobicContact CE-CD2 3.66Å; M740-F767 HydrophobicContact CE-CE1 3.98Å; M740-F767 HydrophobicContact CE-CE2 3.63Å; M740-F767 HydrophobicContact CE-CG 3.84Å; M740-F767 HydrophobicContact CE-CZ 3.79Å; M740-F767 HydrophobicContact SD-CE1 4.49Å; M740-F767 HydrophobicContact SD-CZ 4.26Å
741	M	97.2	Very high	92.1	Very high	20 Å²	20	39.6 Å²	39.6	10%	0.099	22%	0.223	C	C	.	.	H	α-helix	trans	-58.7	-41.9	-179.9	-59.7	-42.9	-56.1	0	0	112.2	L737 E738 S743 L744 A745 L760 I763 Q764	L737-M741 HydrophobicContact CD1-CG 4.23Å; L737-M741 HydrophobicContact CD1-SD 4.12Å; L737-M741 WeakPolarHBondContact O-CG 3.35Å; L737-M741 PolarHBondContact O-N 3.02Å; E738-M741 PolarHBondContact O-N 3.1Å; M741-S743 VanDerWaalsContact C-N 3.31Å; M741-S743 PolarHBondContact O-N 3.28Å; M741-L744 HydrophobicContact CE-CD1 4.27Å; M741-L744 PolarHBondContact O-N 2.95Å; M741-L744 HydrophobicContact SD-CD1 4.23Å; M741-A745 WeakPolarHBondContact O-CB 3.46Å; M741-A745 PolarHBondContact O-N 3.38Å; M741-L760 HydrophobicContact CE-CB 3.95Å; M741-L760 HydrophobicContact CE-CD2 3.66Å; M741-L760 HydrophobicContact CE-CG 4.43Å; M741-L760 WeakPolarHBondContact CE-O 3.38Å; M741-I763 HydrophobicContact CE-CB 4.4Å; M741-I763 HydrophobicContact CE-CG2 4.19Å; M741-I763 HydrophobicContact SD-CG2 4.21Å; M741-Q764 HydrophobicContact CE-CB 3.98Å; M741-Q764 HydrophobicContact CG-CB 4.34Å; M741-Q764 HydrophobicContact CG-CG 4.22Å; M741-Q764 HydrophobicContact SD-CB 3.99Å; M741-Q764 HydrophobicContact SD-CG 4.41Å
742	A	95.6	Very high	91.5	Very high	31 Å²	31	36.9 Å²	36.9	26%	0.256	21%	0.213	S	C	.	.	H	α-helix	trans	-64.5	-33	174.2	0	0	0	0	0	113	H666 E738 M740	H666-A742 PolarHBondContact CE1-O 3.39Å; H666-A742 VanDerWaalsContact CE1-O 3.29Å; H666-A742 PolarHBondContact ND1-O 3.32Å; E738-A742 WeakPolarHBondContact O-CB 3.33Å; E738-A742 PolarHBondContact O-N 3.44Å; M740-A742 VanDerWaalsContact C-N 3.31Å; M740-A742 PolarHBondContact O-N 2.98Å
743	S	96.5	Very high	90.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-70.9	-44.9	174.5	-165.6	0	0	0	0	112.1	D551 S667 K739 M740 M741 R746 H747	D551-S743 WeakPolarHBondContact OD2-CB 3.44Å; D551-S743 PolarHBondContact OD2-OG 2.93Å; S667-S743 WeakPolarHBondContact CB-OG 3.48Å; S667-S743 PolarHBondContact N-OG 3.34Å; S667-S743 PolarHBondContact OG-OG 3.36Å; K739-S743 WeakPolarHBondContact O-CB 3.01Å; K739-S743 PolarHBondContact O-N 3.27Å; K739-S743 VanDerWaalsContact O-N 3.07Å; M740-S743 WeakPolarHBondContact O-CA 3.41Å; M740-S743 WeakPolarHBondContact O-CB 3.46Å; M740-S743 PolarHBondContact O-N 3.38Å; M741-S743 VanDerWaalsContact C-N 3.31Å; M741-S743 PolarHBondContact O-N 3.28Å; S743-R746 PolarHBondContact O-N 3.02Å; S743-H747 PolarHBondContact O-CD2 2.98Å
744	L	96.1	Very high	89.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.9	-41.1	177.6	-63.5	174.7	0	0	0	112.1	L548 D551 M552 M740 M741 R746 H747 L748 L760 I763	L548-L744 HydrophobicContact CB-CD2 4.29Å; L548-L744 HydrophobicContact CD2-CB 3.74Å; L548-L744 HydrophobicContact CD2-CD2 3.62Å; L548-L744 HydrophobicContact CD2-CG 4.18Å; D551-L744 HydrophobicContact CB-CD2 4.04Å; M552-L744 HydrophobicContact CG-CD1 3.75Å; M552-L744 HydrophobicContact CG-CD2 3.84Å; M552-L744 HydrophobicContact CG-CG 4.42Å; M552-L744 HydrophobicContact SD-CD1 4.24Å; M740-L744 HydrophobicContact CE-CD1 4.36Å; M740-L744 HydrophobicContact CG-CD1 3.94Å; M740-L744 HydrophobicContact CG-CG 4.2Å; M740-L744 WeakPolarHBondContact O-CG 3.32Å; M740-L744 PolarHBondContact O-N 3.2Å; M741-L744 HydrophobicContact CE-CD1 4.27Å; M741-L744 PolarHBondContact O-N 2.95Å; M741-L744 HydrophobicContact SD-CD1 4.23Å; L744-R746 VanDerWaalsContact C-N 3.31Å; L744-R746 PolarHBondContact O-N 3.14Å; L744-H747 WeakPolarHBondContact O-CA 3.45Å; L744-H747 WeakPolarHBondContact O-CB 3.49Å; L744-H747 PolarHBondContact O-N 3.26Å; L744-L748 PolarHBondContact O-N 3.21Å; L744-L760 HydrophobicContact CB-CD2 3.65Å; L744-I763 HydrophobicContact CD1-CG2 4.16Å
745	A	94.8	Very high	88.8	Confident	34 Å²	34	43 Å²	43	28%	0.281	24%	0.243	S	C	.	.	H	α-helix	trans	-57.7	-41.5	178.5	0	0	0	0	0	112.8	M741 H747 L748 E749 L760	M741-A745 WeakPolarHBondContact O-CB 3.46Å; M741-A745 PolarHBondContact O-N 3.38Å; A745-H747 PolarHBondContact O-N 3.03Å; A745-L748 WeakPolarHBondContact O-CA 3.45Å; A745-L748 WeakPolarHBondContact O-CB 3.16Å; A745-L748 PolarHBondContact O-N 3.31Å; A745-E749 PolarHBondContact O-N 2.98Å; A745-E749 VanDerWaalsContact O-N 3.12Å; A745-L760 HydrophobicContact CB-CD1 3.85Å
746	R	93.4	Very high	88.3	Confident	74 Å²	74	42.1 Å²	42.1	28%	0.279	24%	0.238	S	C	.	.	H	α-helix	trans	-64.4	-23.8	175.4	-173.6	-171.7	50.7	64.4	17	113.4	S743 L744 L748 E749	S743-R746 PolarHBondContact O-N 3.02Å; L744-R746 VanDerWaalsContact C-N 3.31Å; L744-R746 PolarHBondContact O-N 3.14Å; R746-L748 PolarHBondContact O-N 3.07Å; R746-E749 WeakPolarHBondContact CA-OE1 3.35Å
747	H	92.6	Very high	87.9	Confident	7 Å²	7	47 Å²	47	3%	0.032	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.8	172.4	-70.6	-64	0	0	0	113.3	L547 S743 L744 A745	L547-H747 HydrophobicContact CB-CB 4.03Å; S743-H747 PolarHBondContact O-CD2 2.98Å; L744-H747 WeakPolarHBondContact O-CA 3.45Å; L744-H747 WeakPolarHBondContact O-CB 3.49Å; L744-H747 PolarHBondContact O-N 3.26Å; A745-H747 PolarHBondContact O-N 3.03Å
748	L	91	Very high	87.6	Confident	14 Å²	14	52.7 Å²	52.7	7%	0.073	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-17	179.9	-65.4	169.8	0	0	0	113.9	A544 L548 W701 L744 A745 R746 A750 L751 L760	A544-L748 HydrophobicContact CB-CD2 4.12Å; L548-L748 HydrophobicContact CD1-CD2 4.19Å; L548-L748 HydrophobicContact CD2-CD1 4.14Å; L548-L748 HydrophobicContact CD2-CG 4.19Å; W701-L748 HydrophobicContact CH2-CD2 3.66Å; W701-L748 HydrophobicContact CZ3-CD2 4.25Å; L744-L748 PolarHBondContact O-N 3.21Å; A745-L748 WeakPolarHBondContact O-CA 3.45Å; A745-L748 WeakPolarHBondContact O-CB 3.16Å; A745-L748 PolarHBondContact O-N 3.31Å; R746-L748 PolarHBondContact O-N 3.07Å; L748-A750 PolarHBondContact O-N 3.38Å; L748-L751 HydrophobicContact CD2-CD1 3.58Å; L748-L751 HydrophobicContact CD2-CG 4.49Å; L748-L751 PolarHBondContact O-N 2.91Å; L748-L760 HydrophobicContact CD1-CD1 3.82Å; L748-L760 HydrophobicContact CD1-CD2 3.77Å; L748-L760 HydrophobicContact CD1-CG 3.53Å
749	E	87.2	Confident	87.3	Confident	146 Å²	146	49.2 Å²	49.2	68%	0.682	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-20.2	172	-73.6	171	-156.4	0	0	114.7	A745 R746	A745-E749 PolarHBondContact O-N 2.98Å; A745-E749 VanDerWaalsContact O-N 3.12Å; R746-E749 WeakPolarHBondContact CA-OE1 3.35Å
750	A	78.8	Confident	87.2	Confident	35 Å²	35	50.1 Å²	50.1	29%	0.289	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-7.1	178.7	0	0	0	0	0	114.5	L748	L748-A750 PolarHBondContact O-N 3.38Å
751	L	80.4	Confident	87.1	Confident	30 Å²	30	53.5 Å²	53.5	16%	0.157	30%	0.303	C	S	.	.	S	Bend	trans	-94.1	146.6	179.3	-60.7	-178.2	0	0	0	111.5	A544 P699 W701 L748	A544-L751 HydrophobicContact CB-CD1 4.12Å; A544-L751 HydrophobicContact CB-CD2 4.43Å; A544-L751 HydrophobicContact CB-CG 4.4Å; P699-L751 HydrophobicContact CG-CD1 3.7Å; W701-L751 HydrophobicContact CH2-CD1 3.89Å; W701-L751 HydrophobicContact CZ2-CD1 4.03Å; L748-L751 HydrophobicContact CD2-CD1 3.58Å; L748-L751 HydrophobicContact CD2-CG 4.49Å; L748-L751 PolarHBondContact O-N 2.91Å
752	P	71.3	Confident	87	Confident	81 Å²	81	56.4 Å²	56.4	53%	0.526	32%	0.316	S	S	.	.	S	Bend	trans	-72.3	168.1	171.8	32.6	-35.8	0	0	0	112.5	G754	P752-G754 PolarHBondContact O-N 2.96Å
753	D	65.9	Low	87	Confident	156 Å²	156	55 Å²	55	83%	0.834	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	6.4	158.5	-54	-31.4	0	0	0	119.2	E755	D753-E755 VanDerWaalsContact C-N 3.32Å; D753-E755 PolarHBondContact O-N 3.44Å
754	G	70.5	Confident	87	Confident	43 Å²	43	58.6 Å²	58.6	44%	0.443	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	7.4	164	0	0	0	0	0	116	P752 G756 D757	P752-G754 PolarHBondContact O-N 2.96Å; G754-G756 PolarHBondContact O-N 3Å; G754-D757 PolarHBondContact O-N 3.49Å
755	E	77.2	Confident	87.1	Confident	106 Å²	106	61.2 Å²	61.2	50%	0.495	34%	0.343	S	S	.	.	H	α-helix	trans	-51.6	-32.6	176	-61	-173.5	179	0	0	112.9	W701 D753 D757 Q758 V759	W701-E755 HydrophobicContact CZ2-CB 4.21Å; W701-E755 PolarHBondContact NE1-OE2 2.74Å; D753-E755 VanDerWaalsContact C-N 3.32Å; D753-E755 PolarHBondContact O-N 3.44Å; E755-D757 VanDerWaalsContact C-N 3.26Å; E755-D757 PolarHBondContact O-N 3.08Å; E755-Q758 PolarHBondContact O-N 2.87Å; E755-V759 PolarHBondContact O-N 3.04Å
756	G	83.6	Confident	87.1	Confident	6 Å²	6	60.8 Å²	60.8	6%	0.062	34%	0.336	C	S	.	.	H	α-helix	trans	-58	-31.9	177.3	0	0	0	0	0	114.3	G754 Q758 V759 L760	G754-G756 PolarHBondContact O-N 3Å; G756-Q758 VanDerWaalsContact C-N 3.33Å; G756-Q758 PolarHBondContact O-N 3.02Å; G756-V759 PolarHBondContact O-N 3.28Å; G756-L760 WeakPolarHBondContact O-CB 3.48Å; G756-L760 VanDerWaalsContact O-CG 3.25Å; G756-L760 WeakPolarHBondContact O-CG 3.24Å; G756-L760 PolarHBondContact O-N 2.97Å
757	D	87.6	Confident	87.3	Confident	112 Å²	112	57.3 Å²	57.3	60%	0.599	32%	0.323	S	S	*	.	H	α-helix	trans	-67.6	-34.6	-178.6	-72.9	-17.1	0	0	0	111.9	G754 E755 S761	G754-D757 PolarHBondContact O-N 3.49Å; E755-D757 VanDerWaalsContact C-N 3.26Å; E755-D757 PolarHBondContact O-N 3.08Å; D757-S761 WeakPolarHBondContact O-CB 3.5Å; D757-S761 PolarHBondContact O-N 3.42Å; D757-S761 VanDerWaalsContact O-N 3.08Å; D757-S761 PolarHBondContact O-OG 3Å
758	Q	89.6	Confident	87.4	Confident	128 Å²	128	61 Å²	61	60%	0.598	34%	0.342	S	S	*	.	H	α-helix	trans	-66.3	-48.1	173.5	179.1	177	-25.6	0	0	110.2	E755 G756 L760 S761 E762	E755-Q758 PolarHBondContact O-N 2.87Å; G756-Q758 VanDerWaalsContact C-N 3.33Å; G756-Q758 PolarHBondContact O-N 3.02Å; Q758-L760 PolarHBondContact O-N 2.97Å; Q758-S761 WeakPolarHBondContact O-CA 3.38Å; Q758-S761 VanDerWaalsContact O-CB 3.31Å; Q758-S761 WeakPolarHBondContact O-CB 3.31Å; Q758-S761 PolarHBondContact O-N 2.95Å; Q758-E762 WeakPolarHBondContact CG-OE1 3.45Å; Q758-E762 PolarHBondContact NE2-OE1 3.22Å; Q758-E762 PolarHBondContact O-N 3.05Å
759	V	91.2	Very high	87.5	Confident	9 Å²	9	63.1 Å²	63.1	6%	0.055	36%	0.358	C	S	.	.	H	α-helix	trans	-70	-34.8	-176.4	-179.1	0	0	0	0	111.9	W701 M705 E755 G756 S761 E762 I763	W701-V759 HydrophobicContact CB-CG2 4.35Å; W701-V759 HydrophobicContact CD2-CB 4.46Å; W701-V759 HydrophobicContact CD2-CG1 4.49Å; W701-V759 HydrophobicContact CD2-CG2 3.66Å; W701-V759 HydrophobicContact CE3-CB 4.05Å; W701-V759 HydrophobicContact CE3-CG1 3.74Å; W701-V759 HydrophobicContact CE3-CG2 3.74Å; W701-V759 HydrophobicContact CG-CG2 3.96Å; W701-V759 HydrophobicContact CZ2-CG2 4.5Å; W701-V759 HydrophobicContact CZ3-CB 4.11Å; W701-V759 HydrophobicContact CZ3-CG1 3.94Å; W701-V759 HydrophobicContact CZ3-CG2 4.19Å; M705-V759 HydrophobicContact SD-CG1 4.28Å; E755-V759 PolarHBondContact O-N 3.04Å; G756-V759 PolarHBondContact O-N 3.28Å; V759-S761 VanDerWaalsContact C-N 3.31Å; V759-S761 PolarHBondContact O-N 2.86Å; V759-E762 PolarHBondContact O-N 2.9Å; V759-I763 HydrophobicContact CG1-CD1 3.96Å; V759-I763 HydrophobicContact CG1-CG1 4.36Å; V759-I763 WeakPolarHBondContact O-CB 3.19Å; V759-I763 VanDerWaalsContact O-CG1 3.25Å; V759-I763 WeakPolarHBondContact O-CG1 3.34Å; V759-I763 PolarHBondContact O-N 2.79Å
760	L	94.2	Very high	87.7	Confident	20 Å²	20	58.8 Å²	58.8	11%	0.105	34%	0.34	C	S	.	.	H	α-helix	trans	-57.6	-44.5	166.7	-73	168.6	0	0	0	111.3	M741 L744 A745 L748 G756 Q758 E762 I763 Q764	M741-L760 HydrophobicContact CE-CB 3.95Å; M741-L760 HydrophobicContact CE-CD2 3.66Å; M741-L760 HydrophobicContact CE-CG 4.43Å; M741-L760 WeakPolarHBondContact CE-O 3.38Å; L744-L760 HydrophobicContact CB-CD2 3.65Å; A745-L760 HydrophobicContact CB-CD1 3.85Å; L748-L760 HydrophobicContact CD1-CD1 3.82Å; L748-L760 HydrophobicContact CD1-CD2 3.77Å; L748-L760 HydrophobicContact CD1-CG 3.53Å; G756-L760 WeakPolarHBondContact O-CB 3.48Å; G756-L760 VanDerWaalsContact O-CG 3.25Å; G756-L760 WeakPolarHBondContact O-CG 3.24Å; G756-L760 PolarHBondContact O-N 2.97Å; Q758-L760 PolarHBondContact O-N 2.97Å; L760-E762 VanDerWaalsContact C-N 3.35Å; L760-E762 PolarHBondContact O-N 3.34Å; L760-I763 PolarHBondContact O-N 2.81Å; L760-Q764 WeakPolarHBondContact O-CB 3.48Å; L760-Q764 PolarHBondContact O-N 3.49Å
761	S	94.4	Very high	88.2	Confident	71 Å²	71	57.1 Å²	57.1	50%	0.497	33%	0.326	S	S	.	.	H	α-helix	trans	-64.1	-39.7	178.7	-55.7	0	0	0	0	112	D757 Q758 V759 Q764 A765	D757-S761 WeakPolarHBondContact O-CB 3.5Å; D757-S761 PolarHBondContact O-N 3.42Å; D757-S761 VanDerWaalsContact O-N 3.08Å; D757-S761 PolarHBondContact O-OG 3Å; Q758-S761 WeakPolarHBondContact O-CA 3.38Å; Q758-S761 VanDerWaalsContact O-CB 3.31Å; Q758-S761 WeakPolarHBondContact O-CB 3.31Å; Q758-S761 PolarHBondContact O-N 2.95Å; V759-S761 VanDerWaalsContact C-N 3.31Å; V759-S761 PolarHBondContact O-N 2.86Å; S761-Q764 PolarHBondContact O-N 3.4Å; S761-A765 WeakPolarHBondContact O-CB 3.46Å; S761-A765 PolarHBondContact O-N 3.15Å
762	E	94.9	Very high	88.7	Confident	81 Å²	81	56.2 Å²	56.2	38%	0.379	32%	0.322	S	S	.	.	H	α-helix	trans	-69.4	-41.3	176.5	-70.6	179.8	-154.7	0	0	112.5	M705 Q758 V759 L760 A765 L766	M705-E762 HydrophobicContact CE-CB 3.89Å; M705-E762 HydrophobicContact SD-CB 4.44Å; Q758-E762 WeakPolarHBondContact CG-OE1 3.45Å; Q758-E762 PolarHBondContact NE2-OE1 3.22Å; Q758-E762 PolarHBondContact O-N 3.05Å; V759-E762 PolarHBondContact O-N 2.9Å; L760-E762 VanDerWaalsContact C-N 3.35Å; L760-E762 PolarHBondContact O-N 3.34Å; E762-A765 PolarHBondContact O-N 3.37Å; E762-L766 WeakPolarHBondContact O-CB 3.36Å; E762-L766 PolarHBondContact O-N 2.86Å
763	I	96.4	Very high	89.6	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-46.2	172	-71.4	168.7	0	0	0	110.2	M552 M705 M741 L744 V759 L760 A765 L766 F767	M552-I763 HydrophobicContact CE-CD1 4.09Å; M552-I763 HydrophobicContact SD-CD1 4.06Å; M552-I763 HydrophobicContact SD-CG1 4.34Å; M552-I763 HydrophobicContact SD-CG2 3.64Å; M705-I763 HydrophobicContact SD-CD1 4.45Å; M705-I763 HydrophobicContact SD-CG1 3.61Å; M741-I763 HydrophobicContact CE-CB 4.4Å; M741-I763 HydrophobicContact CE-CG2 4.19Å; M741-I763 HydrophobicContact SD-CG2 4.21Å; L744-I763 HydrophobicContact CD1-CG2 4.16Å; V759-I763 HydrophobicContact CG1-CD1 3.96Å; V759-I763 HydrophobicContact CG1-CG1 4.36Å; V759-I763 WeakPolarHBondContact O-CB 3.19Å; V759-I763 VanDerWaalsContact O-CG1 3.25Å; V759-I763 WeakPolarHBondContact O-CG1 3.34Å; V759-I763 PolarHBondContact O-N 2.79Å; L760-I763 PolarHBondContact O-N 2.81Å; I763-A765 VanDerWaalsContact C-N 3.35Å; I763-A765 PolarHBondContact O-N 2.85Å; I763-L766 PolarHBondContact O-N 3.07Å; I763-F767 HydrophobicContact CG2-CD2 3.9Å; I763-F767 HydrophobicContact CG2-CE2 4.15Å; I763-F767 WeakPolarHBondContact O-CD2 3.46Å; I763-F767 PolarHBondContact O-N 3.24Å
764	Q	96.8	Very high	90.6	Very high	77 Å²	77	51 Å²	51	36%	0.36	29%	0.292	S	S	.	.	H	α-helix	trans	-61.9	-43.3	178.2	-171.1	178	4.9	0	0	111.4	M741 L760 S761 F767 L768	M741-Q764 HydrophobicContact CE-CB 3.98Å; M741-Q764 HydrophobicContact CG-CB 4.34Å; M741-Q764 HydrophobicContact CG-CG 4.22Å; M741-Q764 HydrophobicContact SD-CB 3.99Å; M741-Q764 HydrophobicContact SD-CG 4.41Å; L760-Q764 WeakPolarHBondContact O-CB 3.48Å; L760-Q764 PolarHBondContact O-N 3.49Å; S761-Q764 PolarHBondContact O-N 3.4Å; Q764-F767 PolarHBondContact O-N 3.49Å; Q764-L768 HydrophobicContact CG-CD1 4.1Å; Q764-L768 WeakPolarHBondContact O-CB 3.46Å; Q764-L768 VanDerWaalsContact O-CG 3.29Å; Q764-L768 WeakPolarHBondContact O-CG 3.35Å; Q764-L768 PolarHBondContact O-N 2.95Å
765	A	96.5	Very high	91.3	Very high	55 Å²	55	50.1 Å²	50.1	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-45.8	175.6	0	0	0	0	0	111.8	S761 E762 I763 F767 L768 S769	S761-A765 WeakPolarHBondContact O-CB 3.46Å; S761-A765 PolarHBondContact O-N 3.15Å; E762-A765 PolarHBondContact O-N 3.37Å; I763-A765 VanDerWaalsContact C-N 3.35Å; I763-A765 PolarHBondContact O-N 2.85Å; A765-F767 PolarHBondContact O-N 2.7Å; A765-L768 PolarHBondContact O-N 2.79Å; A765-S769 WeakPolarHBondContact O-CB 3.4Å; A765-S769 PolarHBondContact O-N 3.23Å; A765-S769 PolarHBondContact O-OG 2.92Å
766	L	96.3	Very high	91.6	Very high	25 Å²	25	49.5 Å²	49.5	13%	0.131	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-43.6	176.3	176.8	67.5	0	0	0	112.3	M705 A708 Q709 V712 E762 I763 S769 D770	M705-L766 HydrophobicContact CE-CD2 4.24Å; A708-L766 HydrophobicContact CB-CD2 3.96Å; Q709-L766 HydrophobicContact CG-CD1 4.13Å; Q709-L766 HydrophobicContact CG-CD2 3.86Å; V712-L766 HydrophobicContact CG2-CD2 4.34Å; V712-L766 HydrophobicContact CG2-CG 4.24Å; E762-L766 WeakPolarHBondContact O-CB 3.36Å; E762-L766 PolarHBondContact O-N 2.86Å; I763-L766 PolarHBondContact O-N 3.07Å; L766-S769 PolarHBondContact O-OG 3.46Å; L766-D770 HydrophobicContact CD1-CB 4.25Å; L766-D770 WeakPolarHBondContact O-CB 3.49Å; L766-D770 PolarHBondContact O-N 2.92Å
767	F	96.2	Very high	91.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.282	C	S	.	.	I	π-helix	trans	-68.3	-36.5	177.2	-91.7	-87.7	0	0	0	112.7	M552 V556 I711 V712 M724 L737 M740 I763 Q764 A765 F771 V772	M552-F767 HydrophobicContact SD-CE2 3.93Å; V556-F767 HydrophobicContact CG1-CE1 3.59Å; V556-F767 HydrophobicContact CG1-CZ 3.82Å; I711-F767 HydrophobicContact CG2-CZ 4.42Å; V712-F767 HydrophobicContact CG2-CD1 4.03Å; V712-F767 HydrophobicContact CG2-CD2 3.92Å; V712-F767 HydrophobicContact CG2-CE1 3.71Å; V712-F767 HydrophobicContact CG2-CE2 3.6Å; V712-F767 HydrophobicContact CG2-CG 4.14Å; V712-F767 HydrophobicContact CG2-CZ 3.49Å; V712-F767 VanDerWaalsContact CG2-CZ 3.49Å; M724-F767 HydrophobicContact CE-CE1 4.2Å; M724-F767 HydrophobicContact CG-CD1 4.45Å; L737-F767 HydrophobicContact CD1-CB 3.76Å; L737-F767 HydrophobicContact CD1-CG 4.25Å; M740-F767 HydrophobicContact CE-CD1 4Å; M740-F767 HydrophobicContact CE-CD2 3.66Å; M740-F767 HydrophobicContact CE-CE1 3.98Å; M740-F767 HydrophobicContact CE-CE2 3.63Å; M740-F767 HydrophobicContact CE-CG 3.84Å; M740-F767 HydrophobicContact CE-CZ 3.79Å; M740-F767 HydrophobicContact SD-CE1 4.49Å; M740-F767 HydrophobicContact SD-CZ 4.26Å; I763-F767 HydrophobicContact CG2-CD2 3.9Å; I763-F767 HydrophobicContact CG2-CE2 4.15Å; I763-F767 WeakPolarHBondContact O-CD2 3.46Å; I763-F767 PolarHBondContact O-N 3.24Å; Q764-F767 PolarHBondContact O-N 3.49Å; A765-F767 PolarHBondContact O-N 2.7Å; F767-F771 HydrophobicContact CD1-CB 3.71Å; F767-F771 HydrophobicContact CD1-CD1 4.22Å; F767-F771 HydrophobicContact CD1-CD2 4.16Å; F767-F771 AromaticContact CD1-CG 3.8Å; F767-F771 HydrophobicContact CD1-CG 3.8Å; F767-F771 HydrophobicContact CE1-CB 4.29Å; F767-F771 HydrophobicContact CE1-CD1 4.42Å; F767-F771 AromaticContact CE1-CD2 3.88Å; F767-F771 HydrophobicContact CE1-CD2 3.88Å; F767-F771 HydrophobicContact CE1-CE2 4.23Å; F767-F771 AromaticContact CE1-CG 3.97Å; F767-F771 HydrophobicContact CE1-CG 3.97Å; F767-F771 HydrophobicContact CG-CB 4.43Å; F767-F771 VanDerWaalsContact O-CB 3.23Å; F767-F771 WeakPolarHBondContact O-CB 3.5Å; F767-F771 PolarHBondContact O-N 2.9Å; F767-V772 PolarHBondContact O-N 2.73Å
768	L	94.7	Very high	90.2	Very high	85 Å²	85	47.6 Å²	47.6	45%	0.445	27%	0.266	S	S	.	.	I	π-helix	trans	-69.3	-44.4	174.4	-71.5	170.9	0	0	0	112.3	L737 Q764 A765 S773	L737-L768 HydrophobicContact CD2-CD2 3.56Å; L737-L768 HydrophobicContact CD2-CG 3.85Å; Q764-L768 HydrophobicContact CG-CD1 4.1Å; Q764-L768 WeakPolarHBondContact O-CB 3.46Å; Q764-L768 VanDerWaalsContact O-CG 3.29Å; Q764-L768 WeakPolarHBondContact O-CG 3.35Å; Q764-L768 PolarHBondContact O-N 2.95Å; A765-L768 PolarHBondContact O-N 2.79Å; L768-S773 PolarHBondContact O-OG 2.84Å
769	S	93.3	Very high	88.8	Confident	58 Å²	58	44.5 Å²	44.5	41%	0.406	26%	0.258	S	S	.	.	I	π-helix	trans	-70.7	-51	-178.3	71.4	0	0	0	0	111.7	A765 L766 S773	A765-S769 WeakPolarHBondContact O-CB 3.4Å; A765-S769 PolarHBondContact O-N 3.23Å; A765-S769 PolarHBondContact O-OG 2.92Å; L766-S769 PolarHBondContact O-OG 3.46Å; S769-S773 WeakPolarHBondContact O-CB 3.48Å; S769-S773 PolarHBondContact O-OG 3.12Å
770	D	91.4	Very high	87.2	Confident	56 Å²	56	50 Å²	50	30%	0.299	28%	0.281	S	S	.	.	I	π-helix	trans	-109.1	-23.5	-161.4	-87.2	60.6	0	0	0	114.3	V712 L766 K774	V712-D770 HydrophobicContact CG1-CB 3.62Å; L766-D770 HydrophobicContact CD1-CB 4.25Å; L766-D770 WeakPolarHBondContact O-CB 3.49Å; L766-D770 PolarHBondContact O-N 2.92Å; D770-K774 WeakPolarHBondContact O-CD 3.26Å; D770-K774 VanDerWaalsContact O-CE 3.25Å; D770-K774 WeakPolarHBondContact O-CE 3.44Å; D770-K774 WeakPolarHBondContact O-CG 3.26Å; D770-K774 PolarHBondContact O-NZ 3.35Å; D770-K774 WeakPolarHBondContact OD2-CE 3.47Å; D770-K774 IonicContact OD2-NZ 3.16Å; D770-K774 PolarHBondContact OD2-NZ 2.9Å
771	F	90.9	Very high	85.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.301	C	S	.	.	I	π-helix	trans	-91.2	-61.1	176.2	-156.4	-92.8	0	0	0	110.5	V556 V712 Y715 A716 S721 V722 M724 F767 S773 K774 Q775	V556-F771 HydrophobicContact CB-CE2 4.02Å; V556-F771 HydrophobicContact CB-CZ 3.81Å; V556-F771 HydrophobicContact CG1-CE2 3.67Å; V556-F771 HydrophobicContact CG1-CZ 3.73Å; V712-F771 HydrophobicContact CB-CD2 4.22Å; V712-F771 HydrophobicContact CG1-CB 4.11Å; V712-F771 HydrophobicContact CG1-CD2 4.12Å; V712-F771 HydrophobicContact CG2-CB 4.42Å; V712-F771 HydrophobicContact CG2-CD2 4.06Å; Y715-F771 VanDerWaalsContact C-CE2 3.49Å; A716-F771 HydrophobicContact CB-CD2 3.72Å; A716-F771 HydrophobicContact CB-CE2 4.1Å; A716-F771 HydrophobicContact CB-CG 4.17Å; A716-F771 VanDerWaalsContact N-CE2 3.33Å; S721-F771 WeakPolarHBondContact OG-CZ 3.18Å; V722-F771 WeakPolarHBondContact O-CE1 3.49Å; M724-F771 HydrophobicContact CB-CD1 4.16Å; M724-F771 HydrophobicContact CB-CE1 4.47Å; M724-F771 HydrophobicContact CE-CE1 4.31Å; M724-F771 HydrophobicContact CG-CD1 3.52Å; M724-F771 HydrophobicContact CG-CE1 3.54Å; F767-F771 HydrophobicContact CD1-CB 3.71Å; F767-F771 HydrophobicContact CD1-CD1 4.22Å; F767-F771 HydrophobicContact CD1-CD2 4.16Å; F767-F771 AromaticContact CD1-CG 3.8Å; F767-F771 HydrophobicContact CD1-CG 3.8Å; F767-F771 HydrophobicContact CE1-CB 4.29Å; F767-F771 HydrophobicContact CE1-CD1 4.42Å; F767-F771 AromaticContact CE1-CD2 3.88Å; F767-F771 HydrophobicContact CE1-CD2 3.88Å; F767-F771 HydrophobicContact CE1-CE2 4.23Å; F767-F771 AromaticContact CE1-CG 3.97Å; F767-F771 HydrophobicContact CE1-CG 3.97Å; F767-F771 HydrophobicContact CG-CB 4.43Å; F767-F771 VanDerWaalsContact O-CB 3.23Å; F767-F771 WeakPolarHBondContact O-CB 3.5Å; F767-F771 PolarHBondContact O-N 2.9Å; F771-S773 PolarHBondContact O-N 2.79Å; F771-K774 PolarHBondContact O-N 2.94Å; F771-Q775 WeakPolarHBondContact O-CG 3.38Å; F771-Q775 PolarHBondContact O-N 2.89Å; F771-Q775 VanDerWaalsContact O-N 3.09Å
772	V	90.5	Very high	83.4	Confident	10 Å²	10	56.8 Å²	56.8	6%	0.061	30%	0.304	C	S	.	.	I	π-helix	trans	-64.1	-38.4	-175.5	174.7	0	0	0	0	112.1	M724 D725 F767 K776	M724-V772 HydrophobicContact CB-CG2 3.76Å; D725-V772 HydrophobicContact CB-CG1 4.35Å; F767-V772 PolarHBondContact O-N 2.73Å; V772-K776 HydrophobicContact CG1-CD 3.94Å; V772-K776 WeakPolarHBondContact O-CB 3.39Å; V772-K776 WeakPolarHBondContact O-CG 3.26Å; V772-K776 PolarHBondContact O-N 2.51Å; V772-K776 VanDerWaalsContact O-N 3.13Å
773	S	89.9	Confident	81.2	Confident	64 Å²	64	58.7 Å²	58.7	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-68.2	-38.8	178.2	-51.6	0	0	0	0	113.1	L768 S769 F771 K776 S777	L768-S773 PolarHBondContact O-OG 2.84Å; S769-S773 WeakPolarHBondContact O-CB 3.48Å; S769-S773 PolarHBondContact O-OG 3.12Å; F771-S773 PolarHBondContact O-N 2.79Å; S773-K776 CarbonylContact O-C 3.53Å; S773-K776 PolarHBondContact O-N 3.02Å; S773-K776 VanDerWaalsContact O-N 3.12Å; S773-S777 PolarHBondContact O-N 3.13Å
774	K	87.6	Confident	78.9	Confident	65 Å²	65	64.6 Å²	64.6	28%	0.283	34%	0.341	S	S	.	.	H	α-helix	trans	-74	-31.2	-179.7	-64.3	179.6	-159.2	154.8	0	112.2	A716 D770 F771 K776 S777 S778	A716-K774 HydrophobicContact CB-CB 4.25Å; D770-K774 WeakPolarHBondContact O-CD 3.26Å; D770-K774 VanDerWaalsContact O-CE 3.25Å; D770-K774 WeakPolarHBondContact O-CE 3.44Å; D770-K774 WeakPolarHBondContact O-CG 3.26Å; D770-K774 PolarHBondContact O-NZ 3.35Å; D770-K774 WeakPolarHBondContact OD2-CE 3.47Å; D770-K774 IonicContact OD2-NZ 3.16Å; D770-K774 PolarHBondContact OD2-NZ 2.9Å; F771-K774 PolarHBondContact O-N 2.94Å; K774-K776 VanDerWaalsContact C-N 3.3Å; K774-S777 PolarHBondContact O-OG 2.7Å; K774-S777 VanDerWaalsContact O-OG 3.1Å; K774-S778 PolarHBondContact O-N 2.82Å
775	Q	85	Confident	76.6	Confident	23 Å²	23	68 Å²	68	11%	0.107	36%	0.356	C	S	.	.	H	α-helix	trans	-60.6	-41.2	165.2	-72.3	-176.5	-27	0	0	111.2	A716 S721 V722 F771 C779	A716-Q775 VanDerWaalsContact O-CG 3.23Å; A716-Q775 WeakPolarHBondContact O-CG 3.23Å; S721-Q775 PolarHBondContact OG-NE2 3.27Å; V722-Q775 PolarHBondContact O-NE2 2.8Å; F771-Q775 WeakPolarHBondContact O-CG 3.38Å; F771-Q775 PolarHBondContact O-N 2.89Å; F771-Q775 VanDerWaalsContact O-N 3.09Å; Q775-C779 PolarHBondContact O-N 3.32Å
776	K	82	Confident	74.2	Confident	93 Å²	93	71.2 Å²	71.2	40%	0.404	37%	0.365	S	S	.	.	H	α-helix	trans	-79	-17	-177.9	-74.3	172.1	-178.9	172.3	0	115.6	D725 V772 S773 K774 K780	D725-K776 WeakPolarHBondContact OD2-CE 3.28Å; D725-K776 IonicContact OD2-NZ 2.68Å; D725-K776 PolarHBondContact OD2-NZ 2.74Å; V772-K776 HydrophobicContact CG1-CD 3.94Å; V772-K776 WeakPolarHBondContact O-CB 3.39Å; V772-K776 WeakPolarHBondContact O-CG 3.26Å; V772-K776 PolarHBondContact O-N 2.51Å; V772-K776 VanDerWaalsContact O-N 3.13Å; S773-K776 CarbonylContact O-C 3.53Å; S773-K776 PolarHBondContact O-N 3.02Å; S773-K776 VanDerWaalsContact O-N 3.12Å; K774-K776 VanDerWaalsContact C-N 3.3Å; K776-K780 WeakPolarHBondContact O-CD 3.33Å; K776-K780 WeakPolarHBondContact O-CG 3.33Å
777	S	76.6	Confident	71.7	Confident	40 Å²	40	75.6 Å²	75.6	28%	0.28	39%	0.389	S	S	.	.	H	α-helix	trans	-78.2	-45.6	166.9	62.5	0	0	0	0	110.7	S773 K774 C779 K780 E781	S773-S777 PolarHBondContact O-N 3.13Å; K774-S777 PolarHBondContact O-OG 2.7Å; K774-S777 VanDerWaalsContact O-OG 3.1Å; S777-C779 PolarHBondContact O-N 3.43Å; S777-K780 WeakPolarHBondContact O-CB 3.37Å; S777-K780 PolarHBondContact O-N 3.05Å; S777-E781 PolarHBondContact O-N 3.21Å
778	S	66.1	Low	69.4	Low	39 Å²	39	81.7 Å²	81.7	27%	0.273	42%	0.42	S	S	.	.	H	α-helix	trans	-51	-52.1	-179.4	-158.9	0	0	0	0	112.7	K774 K780 E781 E782	K774-S778 PolarHBondContact O-N 2.82Å; S778-K780 VanDerWaalsContact C-N 3.28Å; S778-K780 PolarHBondContact O-N 2.88Å; S778-E781 PolarHBondContact O-N 3.41Å; S778-E782 PolarHBondContact O-N 2.89Å; S778-E782 VanDerWaalsContact O-N 3.1Å
779	C	59	Low	66.6	Low	62 Å²	62	82.4 Å²	82.4	42%	0.419	43%	0.432	S	S	.	.	H	α-helix	trans	-64.3	-30.3	179.6	-58.4	0	0	0	0	113.4	Q775 S777 E783	Q775-C779 PolarHBondContact O-N 3.32Å; S777-C779 PolarHBondContact O-N 3.43Å; C779-E783 WeakPolarHBondContact O-CB 3.25Å; C779-E783 WeakPolarHBondContact O-CG 3.37Å; C779-E783 PolarHBondContact O-N 3.22Å
780	K	59.3	Low	64	Low	126 Å²	126	84 Å²	84	55%	0.548	44%	0.443	S	S	.	.	H	α-helix	trans	-75.9	-30.4	178.9	-71.3	177.1	-177.9	178.8	0	112.6	K776 S777 S778 Q784	K776-K780 WeakPolarHBondContact O-CD 3.33Å; K776-K780 WeakPolarHBondContact O-CG 3.33Å; S777-K780 WeakPolarHBondContact O-CB 3.37Å; S777-K780 PolarHBondContact O-N 3.05Å; S778-K780 VanDerWaalsContact C-N 3.28Å; S778-K780 PolarHBondContact O-N 2.88Å; K780-Q784 WeakPolarHBondContact O-CB 3.45Å; K780-Q784 VanDerWaalsContact O-CG 3.26Å; K780-Q784 WeakPolarHBondContact O-CG 3.29Å; K780-Q784 PolarHBondContact O-N 2.86Å; K780-Q784 PolarHBondContact O-NE2 2.94Å
781	E	55.6	Low	61.3	Low	111 Å²	111	86.1 Å²	86.1	52%	0.519	46%	0.462	S	S	.	.	H	α-helix	trans	-72.1	-40.8	174.5	-72	162	-147.1	0	0	110.1	S777 S778 Q784 H785	S777-E781 PolarHBondContact O-N 3.21Å; S778-E781 PolarHBondContact O-N 3.41Å; E781-Q784 PolarHBondContact O-N 3.44Å; E781-H785 PolarHBondContact O-CD2 3.09Å; E781-H785 PolarHBondContact O-N 3.29Å
782	E	51.8	Low	58.7	Low	122 Å²	122	92.3 Å²	92.3	57%	0.57	50%	0.5	S	S	*	.	H	α-helix	trans	-60.4	-48.1	170.4	-69.3	177.2	162.1	0	0	112.2	S778 Q784 H785 L786	S778-E782 PolarHBondContact O-N 2.89Å; S778-E782 VanDerWaalsContact O-N 3.1Å; E782-Q784 VanDerWaalsContact C-N 3.31Å; E782-Q784 PolarHBondContact O-N 3.14Å; E782-H785 PolarHBondContact O-N 3.03Å; E782-L786 WeakPolarHBondContact O-CG 3.41Å; E782-L786 PolarHBondContact O-N 2.73Å; E782-L786 VanDerWaalsContact O-N 3.07Å
783	E	48.8	Very low	55.9	Low	121 Å²	121	100.8 Å²	100.8	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-60.1	-36.7	175.2	-77.8	178.1	168.5	0	0	112.6	C779 N787	C779-E783 WeakPolarHBondContact O-CB 3.25Å; C779-E783 WeakPolarHBondContact O-CG 3.37Å; C779-E783 PolarHBondContact O-N 3.22Å; E783-N787 PolarHBondContact O-N 2.82Å; E783-N787 PolarHBondContact O-ND2 2.89Å
784	Q	49.3	Very low	53	Low	125 Å²	125	103.4 Å²	103.4	58%	0.584	56%	0.557	S	S	*	*	H	α-helix	trans	-72.2	-41	177.2	-77.5	172.6	51.9	0	0	112.5	K780 E781 E782 L786 N787 I788	K780-Q784 WeakPolarHBondContact O-CB 3.45Å; K780-Q784 VanDerWaalsContact O-CG 3.26Å; K780-Q784 WeakPolarHBondContact O-CG 3.29Å; K780-Q784 PolarHBondContact O-N 2.86Å; K780-Q784 PolarHBondContact O-NE2 2.94Å; E781-Q784 PolarHBondContact O-N 3.44Å; E782-Q784 VanDerWaalsContact C-N 3.31Å; E782-Q784 PolarHBondContact O-N 3.14Å; Q784-L786 VanDerWaalsContact C-N 3.3Å; Q784-L786 PolarHBondContact O-N 3.02Å; Q784-N787 PolarHBondContact O-N 3.11Å; Q784-N787 VanDerWaalsContact O-N 3.16Å; Q784-I788 WeakPolarHBondContact O-CG1 3.46Å; Q784-I788 PolarHBondContact O-N 3.31Å
785	H	47.4	Very low	50.3	Low	148 Å²	148	107.9 Å²	107.9	69%	0.685	58%	0.584	S	S	*	*	H	α-helix	trans	-61.8	-36.9	174.9	-93.1	-94.7	0	0	0	112.6	E781 E782 I788	E781-H785 PolarHBondContact O-CD2 3.09Å; E781-H785 PolarHBondContact O-N 3.29Å; E782-H785 PolarHBondContact O-N 3.03Å; H785-I788 PolarHBondContact O-N 3.23Å
786	L	47.2	Very low	47.7	Very low	123 Å²	123	114.2 Å²	114.2	64%	0.644	62%	0.619	S	S	*	*	H	α-helix	trans	-67.8	-33.9	174.2	-70	169.6	0	0	0	112.8	E782 Q784 S789	E782-L786 WeakPolarHBondContact O-CG 3.41Å; E782-L786 PolarHBondContact O-N 2.73Å; E782-L786 VanDerWaalsContact O-N 3.07Å; Q784-L786 VanDerWaalsContact C-N 3.3Å; Q784-L786 PolarHBondContact O-N 3.02Å; L786-S789 PolarHBondContact O-OG 2.58Å
787	N	42.3	Very low	45.1	Very low	116 Å²	116	117.2 Å²	117.2	62%	0.62	64%	0.639	S	S	*	*	H	α-helix	trans	-77.7	-17.3	178.6	-80.5	-68	0	0	0	114.3	E783 Q784 S790	E783-N787 PolarHBondContact O-N 2.82Å; E783-N787 PolarHBondContact O-ND2 2.89Å; Q784-N787 PolarHBondContact O-N 3.11Å; Q784-N787 VanDerWaalsContact O-N 3.16Å; N787-S790 PolarHBondContact O-OG 3.47Å
788	I	48.2	Very low	43	Very low	129 Å²	129	118.7 Å²	118.7	66%	0.662	65%	0.654	S	S	*	*	H	α-helix	trans	-80.9	-26.4	175.5	-67.8	166.3	0	0	0	111.5	Q784 H785 S790	Q784-I788 WeakPolarHBondContact O-CG1 3.46Å; Q784-I788 PolarHBondContact O-N 3.31Å; H785-I788 PolarHBondContact O-N 3.23Å; I788-S790 VanDerWaalsContact C-N 3.32Å; I788-S790 PolarHBondContact O-N 3.49Å
789	S	37.3	Very low	41.1	Very low	99 Å²	99	126.1 Å²	126.1	69%	0.692	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-7.9	-176.2	67.5	0	0	0	0	115	L786	L786-S789 PolarHBondContact O-OG 2.58Å
790	S	37.2	Very low	39.7	Very low	93 Å²	93	128.4 Å²	128.4	65%	0.65	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	7.3	-174.3	58.6	0	0	0	0	115.1	N787 I788	N787-S790 PolarHBondContact O-OG 3.47Å; I788-S790 VanDerWaalsContact C-N 3.32Å; I788-S790 PolarHBondContact O-N 3.49Å
791	S	34.8	Very low	38.3	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	70%	0.697	S	S	*	*			trans	-118	46.9	-165.5	-160	0	0	0	0	115.1
792	V	36.3	Very low	37	Very low	131 Å²	131	131.8 Å²	131.8	79%	0.794	71%	0.712	S	S	*	*			trans	-142.8	144.9	169.2	-162.9	0	0	0	0	110.9
793	Q	33.3	Very low	36	Very low	188 Å²	188	134.3 Å²	134.3	88%	0.879	73%	0.727	S	S	*	*			trans	80.5	95	176	-53.3	-167.8	-13.8	0	0	117.5
794	S	27.4	Very low	35	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	73%	0.729	S	S	*	*			trans	-167.5	74.9	148.5	178.9	0	0	0	0	110.5
795	D	30.6	Very low	34.2	Very low	159 Å²	159	133.4 Å²	133.4	85%	0.85	74%	0.739	S	S	*	*			trans	-104.2	160.4	167.3	-80.8	-51.6	0	0	0	110.7
796	D	31.3	Very low	33.4	Very low	156 Å²	156	133.6 Å²	133.6	83%	0.834	74%	0.74	S	S	*	*			trans	70.8	126.2	-170.9	-57.2	-28.6	0	0	0	114.4
797	D	28.3	Very low	32.4	Very low	157 Å²	157	136 Å²	136	84%	0.84	75%	0.748	S	S	*	*			cis	-157.7	160.7	39	-146.9	-19.5	0	0	0	115.4
798	A	31.2	Very low	31.6	Very low	71 Å²	71	139.8 Å²	139.8	59%	0.587	76%	0.759	S	S	*	*			trans	-25.3	150.1	-178.6	0	0	0	0	0	126.6
799	F	25.8	Very low	31.4	Very low	194 Å²	194	138.4 Å²	138.4	85%	0.851	76%	0.759	S	S	*	*			trans	71.1	150.5	141.9	-89.3	-117.8	0	0	0	119.5
800	D	30	Very low	31.1	Very low	110 Å²	110	143.7 Å²	143.7	59%	0.588	77%	0.769	S	S	*	*			cis	-154.4	174.9	14	-163.2	8.8	0	0	0	113.4
801	Q	30.3	Very low	30.6	Very low	153 Å²	153	143.4 Å²	143.4	72%	0.715	78%	0.78	S	S	*	*			trans	72.9	89.6	153.1	-85.2	164.2	71.1	0	0	122.8
802	L	28.7	Very low	30.2	Very low	156 Å²	156	142.1 Å²	142.1	82%	0.817	78%	0.783	S	S	*	*				40.2	119.2	114.4	-74.1	163.5	0	0	0	122.1
803	I	30.2	Very low	29.9	Very low	174 Å²	174	144.9 Å²	144.9	89%	0.892	79%	0.787	S	S	*	*				160.7	134.2	126.2	-82.8	155.6	0	0	0	108
804	G	27.9	Very low	29.8	Very low	58 Å²	58	141.7 Å²	141.7	60%	0.598	79%	0.786	S	S	*	*			cis	152.2	107.8	-8.7	0	0	0	0	0	113.4
805	Q	31.8	Very low	30	Very low	170 Å²	170	140 Å²	140	79%	0.794	78%	0.778	S	S	*	*			trans	64.3	157.8	171.4	-62.9	175.7	-77.1	0	0	115.4
806	E	30.4	Very low	30.1	Very low	151 Å²	151	140 Å²	140	71%	0.706	77%	0.774	S	S	*	*			cis	-157.5	174.3	-16	-111.4	157	-168.1	0	0	106.5
807	E	26.4	Very low	30.2	Very low	174 Å²	174	139.1 Å²	139.1	81%	0.813	77%	0.774	S	S	*	*			cis	-154.8	177.7	20.2	-145.1	178.3	168.5	0	0	111.6
808	F	25.7	Very low	30.3	Very low	195 Å²	195	137.9 Å²	137.9	86%	0.855	77%	0.767	S	S	*	*			trans	-93.2	-154.5	175.4	-89.1	-92.2	0	0	0	110.7
809	P	45.2	Very low	30.2	Very low	101 Å²	101	139.9 Å²	139.9	66%	0.656	78%	0.777	S	S	*	*			cis	-139.8	169.5	-12	15.2	12.8	0	0	0	119.3
810	K	30.7	Very low	30.3	Very low	210 Å²	210	135.3 Å²	135.3	91%	0.913	77%	0.769	S	S	*	*			trans	76.7	139.2	137	-79.3	167.8	-178.8	175.8	0	124.4
811	G	26	Very low	30.4	Very low	86 Å²	86	134.6 Å²	134.6	89%	0.887	77%	0.773	S	S	*	*			trans	112.4	136.5	150.4	0	0	0	0	0	115.3
812	G	27.5	Very low	30.5	Very low	72 Å²	72	133.4 Å²	133.4	74%	0.742	78%	0.775	S	S	*	*			cis	164.7	120.5	-10.8	0	0	0	0	0	114.7
813	E	29.7	Very low	30.6	Very low	189 Å²	189	134.3 Å²	134.3	88%	0.883	78%	0.78	S	S	*	*			trans	63.9	142.9	156.2	-57.7	-172.2	138.2	0	0	123.2
814	S	30	Very low	30.7	Very low	122 Å²	122	133.9 Å²	133.9	85%	0.853	77%	0.774	S	S	*	*			trans	73	146.2	153.2	73.6	0	0	0	0	119.7
815	A	33.3	Very low	30.8	Very low	81 Å²	81	138.9 Å²	138.9	67%	0.669	79%	0.786	S	S	*	*			cis	-160.4	154.4	-11.2	0	0	0	0	0	112.6
816	E	32.3	Very low	30.5	Very low	161 Å²	161	134.6 Å²	134.6	75%	0.752	79%	0.787	S	S	*	*			trans	56.9	139.1	145.8	-69.6	178.9	-150.7	0	0	120
817	T	33.1	Very low	30.4	Very low	136 Å²	136	132.7 Å²	132.7	83%	0.834	79%	0.791	S	S	*	*				-140	164.2	61.5	41.8	0	0	0	0	116.9
818	N	30.1	Very low	30.6	Very low	131 Å²	131	130.3 Å²	130.3	70%	0.701	79%	0.788	S	S	*	*			trans	-72.7	167.6	-178.3	-62.4	-65.9	0	0	0	112.3
819	S	28.5	Very low	30.9	Very low	114 Å²	114	129.5 Å²	129.5	80%	0.797	79%	0.791	S	S	*	*			cis	-156.5	156.2	27.8	-160.6	0	0	0	0	115
820	S	28.4	Very low	30.1	Very low	98 Å²	98	129.1 Å²	129.1	69%	0.685	79%	0.792	S	S	*	*			trans	-96.4	-176.8	155.7	70.5	0	0	0	0	109.1
821	S	32.7	Very low	30.3	Very low	95 Å²	95	124.6 Å²	124.6	66%	0.664	78%	0.781	S	S	*	*			cis	-160.3	151.6	7.6	5.2	0	0	0	0	111.6
822	V	32.2	Very low	30.4	Very low	127 Å²	127	128.6 Å²	128.6	77%	0.77	78%	0.777	S	S	*	*			trans	57.8	120.2	139.2	178.5	0	0	0	0	120.1
823	L	30.2	Very low	30.7	Very low	175 Å²	175	133.2 Å²	133.2	92%	0.916	78%	0.779	S	S	*	*				-147.3	175	115.1	-102.5	175.8	0	0	0	109.9
824	H	32	Very low	30.9	Very low	165 Å²	165	130.9 Å²	130.9	76%	0.764	77%	0.773	S	S	*	*			trans	-129.6	174.4	-153.5	-172.4	54.3	0	0	0	113.9
825	L	29.7	Very low	31	Very low	164 Å²	164	135 Å²	135	86%	0.859	77%	0.771	S	S	*	*			trans	79.5	137.5	-171.2	-53.2	151.2	0	0	0	114.3
826	G	27	Very low	31.2	Very low	79 Å²	79	138 Å²	138	81%	0.814	78%	0.775	S	S	*	*			cis	152.9	97.3	-12.9	0	0	0	0	0	115.2
827	S	28.6	Very low	31.5	Very low	112 Å²	112	141.5 Å²	141.5	78%	0.783	80%	0.798	S	S	*	*			trans	-164.2	109.5	164.8	-155	0	0	0	0	108.5
828	V	30.2	Very low	31.4	Very low	123 Å²	123	141.8 Å²	141.8	75%	0.745	80%	0.796	S	S	*	*				71.3	118.8	87.9	177	0	0	0	0	114.6
829	L	31.5	Very low	31.5	Very low	178 Å²	178	142.4 Å²	142.4	93%	0.932	80%	0.801	S	S	*	*			trans	-135.5	121.1	159.9	-78.2	176.5	0	0	0	108.5
830	S	29.3	Very low	31.7	Very low	94 Å²	94	143.9 Å²	143.9	66%	0.657	80%	0.801	S	S	*	*			trans	-153.1	115.5	178.5	-86.2	0	0	0	0	105.6
831	T	34	Very low	31.8	Very low	114 Å²	114	146.6 Å²	146.6	70%	0.699	81%	0.808	S	S	*	*				75.7	162.9	88.2	57.9	0	0	0	0	114.2
832	E	29.3	Very low	31.8	Very low	171 Å²	171	149.9 Å²	149.9	80%	0.799	82%	0.817	S	S	*	*			trans	72.1	134	-172.5	-70.7	130.9	-112.5	0	0	114.1
833	H	33.6	Very low	31.8	Very low	169 Å²	169	151.4 Å²	151.4	78%	0.782	82%	0.82	S	S	*	*			cis	59.9	100.8	21.8	-73.5	69.5	0	0	0	115.2
834	D	32.3	Very low	31.9	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	81%	0.813	S	S	*	*				-176.8	-178.7	97.6	-108	-24.1	0	0	0	114.4
835	Y	33.5	Very low	31.9	Very low	207 Å²	207	148.5 Å²	148.5	81%	0.812	82%	0.817	S	S	*	*			trans	-45.7	173.2	161	-66.3	-93.1	0	0	0	114.5
836	L	36.8	Very low	32.1	Very low	144 Å²	144	147.3 Å²	147.3	75%	0.754	81%	0.814	S	S	*	*			cis	-164.2	141.5	17.4	-143	164.8	0	0	0	110.1
837	L	38.8	Very low	32.5	Very low	236 Å²	236	153.5 Å²	153.5	100%	1.236	81%	0.814	S	S	*	*			trans	-173.5	0	135.4	-108.5	167	0	0	0	112

Retrieved 837 of 837 residues in 131.8 ms (Link to these results)

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