A0A087YI13_POEFO Loading...

Actinin alpha 4

AlphaFold DB , UniProt , Accession A0A087YI13, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 898 aa.

						>A0A087YI13_POEFO|A0A087YI13
MVDYHSTNNQSAGGAQTYMEQENDWDRDLLLDPAWEKQQRKTFTAWCNSHLRKAGTQIENIEEDFRDGLKLMLLLEVISGERLPKPERGKMRVHKINNVNKALDFIASKGVKLVSIGAEEIVDGNAKMTLGMIWTIILRFAIQDISVEETSAKEGLLLWCQRKTAPYKNVNVQNFHISWKDGLAFNALIHRHRPDLIDYDSLRKDDPVTNLNNAFEVAEKHLDIPKMLDAEDIVGTVRPDEKAIMTYVSCFYHAFSGAQKAETAANRICKVLAVNQENEQMMEDYEKLASDLLEWIRRTIPWLENRTQEKTVKDLQAKQEDFRDYRTVHKPPKVQEKCQLEISFNTLQTKLRLSNRPAFMPSEGRMVSDINTAWHTLEGAEKGYEEWILSEIRRLERLEHLAEKFHQKAAIHESWTDGKEAMLTQKDYETSTLSEVKALLRKHEAFESDLAAHQDRVEQIAAIAQELNELDYYDAASVNARCQKICEQWDILGSLTHSRKESLERTEKQLESIDELYLEYAKRAAPFNNWMEGAMEDLQDMFIVHNIEEIQGLISAHEQFKSTLPEANKEREAIQAIQAEVQRIAQSNGIKLSGANPYTTITPQSIDSKWEKAMTMVPQRDCALQDELNKQNSNDSLRATFAAQANSVGAYIQAKMEEIGRISIEMNGTLEDQLTNLKDYQKTIMSYMPEINKLEGHHQQIQEALIFDNQYTSYTMEHLRVGWEQLLTTIARTINEVENQILTRDAKGISQEQLFEYRASFNHFDKDHSGGLKAEEFKACLISLGYDVENDKQGDGEFNRIMGIVDPNSSGFVTFQAFIDFMSRETTDTDTADQVIASFKILAGDKNFITADELRRELPPDQAEYCIARMAPYAGPDGVPGALDYMSFSTALYGESDL
					

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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	33.4	Very low	29.1	Very low	242 Å²	242	149.2 Å²	149.2	100%	1.192	79%	0.788	S	S	*	*				0	125.9	0	-85.1	-172.4	173.2	0	0	107.6
2	V	32.7	Very low	28.9	Very low	121 Å²	121	145.8 Å²	145.8	73%	0.733	80%	0.797	S	S	*	*			cis	-147.4	142.7	-20	171.5	0	0	0	0	104.8
3	D	28.3	Very low	28.5	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	80%	0.798	S	S	*	*			trans	-58.8	168.1	175.7	-52.9	-89.8	0	0	0	113.6
4	Y	31.1	Very low	28.1	Very low	224 Å²	224	136.4 Å²	136.4	88%	0.878	80%	0.802	S	S	*	*				-151.5	148.6	127.4	-117.3	-77	0	0	0	113.1
5	H	30.1	Very low	28	Very low	151 Å²	151	133.3 Å²	133.3	70%	0.699	80%	0.797	S	S	*	*			trans	-79.6	149.1	-160.2	-74.4	-26.1	0	0	0	117.8
6	S	28.8	Very low	28.1	Very low	97 Å²	97	136.7 Å²	136.7	68%	0.678	80%	0.802	S	S	*	*				26.3	138.5	119	-33.4	0	0	0	0	120.5
7	T	29.2	Very low	28	Very low	150 Å²	150	135.1 Å²	135.1	92%	0.92	80%	0.795	S	S	*	*				-164.6	156.9	114.7	12.4	0	0	0	0	114.1
8	N	27.1	Very low	28	Very low	146 Å²	146	139.4 Å²	139.4	78%	0.781	80%	0.797	S	S	*	*			trans	-91.5	145.7	-175.6	-154.8	7.1	0	0	0	110.4
9	N	27.7	Very low	28	Very low	122 Å²	122	142.2 Å²	142.2	65%	0.652	81%	0.805	S	S	*	*				172.9	133.7	117.6	-124.5	1.9	0	0	0	116.2
10	Q	26.7	Very low	28.1	Very low	154 Å²	154	144.3 Å²	144.3	72%	0.72	81%	0.808	S	S	*	*				45.4	131.2	128.3	-79.8	179.5	0.7	0	0	124.8
11	S	24.7	Very low	28.1	Very low	102 Å²	102	145.3 Å²	145.3	71%	0.713	81%	0.806	S	S	*	*				82.2	104.8	128.5	-61.5	0	0	0	0	121.8
12	A	26.6	Very low	27.9	Very low	108 Å²	108	143 Å²	143	89%	0.893	79%	0.792	S	S	*	*				34.9	129.5	119.1	0	0	0	0	0	121.2
13	G	23.9	Very low	27.6	Very low	78 Å²	78	142.2 Å²	142.2	80%	0.804	78%	0.784	S	S	*	*			trans	139.8	123.3	135.8	0	0	0	0	0	116.9
14	G	23.6	Very low	27.6	Very low	83 Å²	83	143.8 Å²	143.8	86%	0.856	79%	0.793	S	S	*	*			trans	81	156.6	163.6	0	0	0	0	0	116
15	A	25.5	Very low	27.6	Very low	89 Å²	89	142.3 Å²	142.3	74%	0.736	79%	0.785	S	S	*	*			cis	-158.8	161.5	-14.7	0	0	0	0	0	109.8
16	Q	30.9	Very low	27.7	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	79%	0.786	S	S	*	*			trans	-46.4	138.1	167.7	-66	148.1	-77.3	0	0	112.7
17	T	25.9	Very low	27.8	Very low	110 Å²	110	147.5 Å²	147.5	68%	0.675	79%	0.794	S	S	*	*			trans	-152.2	124.7	149.9	10	0	0	0	0	112.5
18	Y	28.3	Very low	28.3	Very low	212 Å²	212	147.5 Å²	147.5	83%	0.831	79%	0.789	S	S	*	*			trans	57	88.3	159.6	-49.3	-58	0	0	0	119.1
19	M	28.1	Very low	28.6	Very low	192 Å²	192	146.6 Å²	146.6	95%	0.946	78%	0.783	S	S	*	*			trans	-75.8	125.2	133.4	-78.4	-171.2	178.2	0	0	107.8
20	E	30.1	Very low	29	Very low	184 Å²	184	148.6 Å²	148.6	86%	0.86	79%	0.793	S	S	*	*			trans	-71.8	133.9	173	-69.3	177.9	129.7	0	0	110.2	E22	E20-E22 PolarHBondContact O-N 3.29Å
21	Q	27.5	Very low	29.8	Very low	167 Å²	167	146.9 Å²	146.9	78%	0.78	79%	0.788	S	S	*	*			trans	-82.8	100.8	170.1	-73	179.7	-19	0	0	109.1	N23	Q21-N23 PolarHBondContact O-N 3.49Å
22	E	28.8	Very low	31	Very low	193 Å²	193	147.2 Å²	147.2	90%	0.902	78%	0.782	S	S	*	*			trans	-72.5	87.8	156.7	-73.6	-164.9	144.5	0	0	108.9	E20 D24	E20-E22 PolarHBondContact O-N 3.29Å; E22-D24 PolarHBondContact O-N 3.45Å
23	N	26.8	Very low	32.7	Very low	104 Å²	104	146.4 Å²	146.4	56%	0.556	77%	0.767	S	S	*	*			trans	-68.6	105.6	160.9	-85.7	-70.6	0	0	0	108.3	Q21 W25	Q21-N23 PolarHBondContact O-N 3.49Å; N23-W25 PolarHBondContact OD1-NE1 3.39Å
24	D	28.1	Very low	34.9	Very low	166 Å²	166	144 Å²	144	89%	0.888	74%	0.74	S	S	*	*			trans	-111.5	105.2	160.7	-147.6	11.7	0	0	0	108.1	E22	E22-D24 PolarHBondContact O-N 3.45Å
25	W	31.4	Very low	37.3	Very low	192 Å²	192	144.4 Å²	144.4	73%	0.727	72%	0.716	S	S	*	*			trans	-93.1	152.1	-172.4	-82.9	45.8	0	0	0	111.7	N23	N23-W25 PolarHBondContact OD1-NE1 3.39Å
26	D	32.6	Very low	39.8	Very low	133 Å²	133	141.8 Å²	141.8	71%	0.711	69%	0.688	S	S	*	*			trans	54.5	92.5	155.3	-63.3	-26.3	0	0	0	118.9
27	R	30	Very low	42.2	Very low	225 Å²	225	137.7 Å²	137.7	85%	0.849	67%	0.668	S	S	*	*				-151.9	86.3	124	-137.5	176.1	-87	-165	-4	115	L29	R27-L29 VanDerWaalsContact C-N 3.29Å; R27-L29 HydrophobicContact CG-CB 3.92Å; R27-L29 PolarHBondContact O-N 3.09Å
28	D	39.7	Very low	44.8	Very low	150 Å²	150	132.8 Å²	132.8	80%	0.802	64%	0.637	S	S	*	*			trans	-73.2	85.3	158.9	-160.7	10.5	0	0	0	108.8
29	L	33.4	Very low	47.5	Very low	126 Å²	126	123 Å²	123	66%	0.66	60%	0.599	S	S	*	*			trans	-153.5	105.1	178.9	-148.9	78.4	0	0	0	111.9	R27	R27-L29 VanDerWaalsContact C-N 3.29Å; R27-L29 HydrophobicContact CG-CB 3.92Å; R27-L29 PolarHBondContact O-N 3.09Å
30	L	36.9	Very low	50.2	Low	165 Å²	165	117.3 Å²	117.3	86%	0.864	57%	0.567	S	S	*	*			trans	59.8	93.6	-179.8	-80.8	82.5	0	0	0	115.9	D32	L30-D32 PolarHBondContact O-N 2.94Å
31	L	43.3	Very low	52.8	Low	118 Å²	118	112.2 Å²	112.2	62%	0.618	54%	0.542	S	S	*	.			trans	-66.4	127.7	161.7	-79.7	88.7	0	0	0	111.1
32	D	49.5	Very low	55.6	Low	108 Å²	108	104.3 Å²	104.3	58%	0.578	51%	0.505	S	S	*	.			trans	-82.5	122.5	167.5	-174.2	-13.9	0	0	0	110.2	L30 A34 W35	L30-D32 PolarHBondContact O-N 2.94Å; D32-A34 PolarHBondContact O-N 3.45Å; D32-A34 WeakPolarHBondContact OD1-CB 3.41Å; D32-A34 PolarHBondContact OD1-N 3.35Å; D32-W35 VanDerWaalsContact O-CD1 3.28Å
33	P	63.2	Low	58.6	Low	91 Å²	91	95.1 Å²	95.1	59%	0.591	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	1	179.8	30	-35.7	0	0	0	115	W35 E36 K37	P33-W35 PolarHBondContact O-N 3.02Å; P33-E36 PolarHBondContact O-N 2.64Å; P33-K37 PolarHBondContact O-N 2.86Å
34	A	68.3	Low	61.6	Low	28 Å²	28	91.1 Å²	91.1	23%	0.231	44%	0.441	C	S	.	.	H	α-helix	trans	-56.2	-40.6	-177.4	0	0	0	0	0	114.6	D32 K37 Q38	D32-A34 PolarHBondContact O-N 3.45Å; D32-A34 WeakPolarHBondContact OD1-CB 3.41Å; D32-A34 PolarHBondContact OD1-N 3.35Å; A34-K37 WeakPolarHBondContact O-CB 3.43Å; A34-K37 PolarHBondContact O-N 3.46Å; A34-Q38 PolarHBondContact O-N 3.37Å; A34-Q38 VanDerWaalsContact O-N 3.14Å
35	W	75.8	Confident	64.3	Low	92 Å²	92	84.3 Å²	84.3	35%	0.348	41%	0.408	S	S	.	.	H	α-helix	trans	-69.4	-36	-176.6	70.5	-89.1	0	0	0	112.9	D32 P33 K37 Q38 Q39	D32-W35 VanDerWaalsContact O-CD1 3.28Å; P33-W35 PolarHBondContact O-N 3.02Å; W35-K37 VanDerWaalsContact C-N 3.31Å; W35-K37 PolarHBondContact O-N 2.95Å; W35-Q38 PolarHBondContact O-N 3.32Å; W35-Q39 PolarHBondContact O-N 3.47Å
36	E	78.1	Confident	67.1	Low	33 Å²	33	75.2 Å²	75.2	15%	0.154	37%	0.373	C	S	.	.	H	α-helix	trans	-65	-37.7	176.2	-63.8	-176.5	-160.7	0	0	110.9	P33 R40 K127	P33-E36 PolarHBondContact O-N 2.64Å; E36-R40 WeakPolarHBondContact O-CB 3.25Å; E36-R40 PolarHBondContact O-N 3.22Å; E36-K127 WeakPolarHBondContact OE1-CE 3.4Å; E36-K127 IonicContact OE1-NZ 3Å; E36-K127 PolarHBondContact OE1-NZ 3.27Å
37	K	79.8	Confident	69.8	Low	103 Å²	103	68.9 Å²	68.9	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-42.6	174.8	-173.3	-166.8	173	-146.1	0	111.6	P33 A34 W35 K41 D232	P33-K37 PolarHBondContact O-N 2.86Å; A34-K37 WeakPolarHBondContact O-CB 3.43Å; A34-K37 PolarHBondContact O-N 3.46Å; W35-K37 VanDerWaalsContact C-N 3.31Å; W35-K37 PolarHBondContact O-N 2.95Å; K37-K41 PolarHBondContact O-N 3.5Å; K37-D232 IonicContact NZ-OD1 3.3Å; K37-D232 PolarHBondContact NZ-OD1 3.27Å; K37-D232 IonicContact NZ-OD2 3.14Å
38	Q	81	Confident	72.6	Confident	7 Å²	7	59.9 Å²	59.9	3%	0.033	31%	0.308	C	S	.	.	H	α-helix	trans	-68.4	-45.2	179.9	-167.7	177.1	10.7	0	0	112.3	A34 W35 K41 T42 D240 A243	A34-Q38 PolarHBondContact O-N 3.37Å; A34-Q38 VanDerWaalsContact O-N 3.14Å; W35-Q38 PolarHBondContact O-N 3.32Å; Q38-K41 PolarHBondContact O-N 3.35Å; Q38-T42 PolarHBondContact O-N 3.43Å; Q38-T42 VanDerWaalsContact O-N 3.15Å; Q38-T42 PolarHBondContact O-OG1 3.2Å; Q38-D240 HydrophobicContact CB-CB 4.45Å; Q38-D240 HydrophobicContact CG-CB 4.38Å; Q38-A243 HydrophobicContact CG-CB 4.13Å
39	Q	84.7	Confident	74.8	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.028	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-43.2	175	-74.9	-178.3	20.6	0	0	111.6	W35 K41 T42 F43 L130 D240	W35-Q39 PolarHBondContact O-N 3.47Å; Q39-K41 PolarHBondContact O-N 3.04Å; Q39-T42 PolarHBondContact O-N 3.48Å; Q39-F43 HydrophobicContact CB-CD2 4.26Å; Q39-F43 HydrophobicContact CB-CE2 3.97Å; Q39-F43 HydrophobicContact CB-CZ 4.25Å; Q39-F43 HydrophobicContact CG-CE2 4.22Å; Q39-F43 HydrophobicContact CG-CZ 4.1Å; Q39-F43 VanDerWaalsContact O-CB 3.3Å; Q39-F43 WeakPolarHBondContact O-CB 3.42Å; Q39-F43 VanDerWaalsContact O-CG 3.29Å; Q39-F43 WeakPolarHBondContact O-CG 3.41Å; Q39-F43 PolarHBondContact O-N 3.18Å; Q39-L130 HydrophobicContact CB-CD1 4.37Å; Q39-L130 HydrophobicContact CB-CD2 4.48Å; Q39-D240 WeakPolarHBondContact CG-OD2 3.48Å; Q39-D240 VanDerWaalsContact NE2-CG 3.33Å; Q39-D240 PolarHBondContact NE2-OD1 2.72Å; Q39-D240 PolarHBondContact NE2-OD2 3.48Å
40	R	85.9	Confident	77.3	Confident	73 Å²	73	49.7 Å²	49.7	28%	0.275	25%	0.254	S	S	.	.	H	α-helix	trans	-53.3	-51.2	177.5	-174.6	-168.2	-54.5	-110.2	-11.5	112.1	E36 T44 I61 E62 L130	E36-R40 WeakPolarHBondContact O-CB 3.25Å; E36-R40 PolarHBondContact O-N 3.22Å; R40-T44 VanDerWaalsContact O-CB 3.25Å; R40-T44 WeakPolarHBondContact O-CB 3.37Å; R40-T44 PolarHBondContact O-N 2.84Å; R40-T44 PolarHBondContact O-OG1 2.82Å; R40-I61 HydrophobicContact CG-CG2 3.82Å; R40-E62 IonicContact CZ-OE1 2.65Å; R40-E62 IonicContact CZ-OE2 3.9Å; R40-E62 IonicContact NH1-OE1 2.8Å; R40-E62 PolarHBondContact NH1-OE1 2.97Å; R40-E62 IonicContact NH1-OE2 2.71Å; R40-E62 PolarHBondContact NH1-OE2 3.2Å; R40-E62 IonicContact NH2-OE1 3.3Å; R40-E62 PolarHBondContact NH2-OE1 3.4Å; R40-E62 IonicContact NH2-OE2 3.59Å; R40-L130 HydrophobicContact CB-CD2 4.4Å
41	K	84.6	Confident	79.6	Confident	77 Å²	77	41.8 Å²	41.8	34%	0.335	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-52.9	177.6	-70.7	179.7	172.9	-176.1	0	111.7	K37 Q38 Q39 F43 T44 A45 D229 D232	K37-K41 PolarHBondContact O-N 3.5Å; Q38-K41 PolarHBondContact O-N 3.35Å; Q39-K41 PolarHBondContact O-N 3.04Å; K41-F43 PolarHBondContact O-N 3.18Å; K41-T44 PolarHBondContact O-N 3.15Å; K41-A45 WeakPolarHBondContact O-CB 3.5Å; K41-A45 PolarHBondContact O-N 3.41Å; K41-D229 VanDerWaalsContact CD-OD2 3.28Å; K41-D229 WeakPolarHBondContact CD-OD2 3.5Å; K41-D229 WeakPolarHBondContact CE-OD2 3.37Å; K41-D229 IonicContact NZ-OD2 3.97Å; K41-D229 PolarHBondContact NZ-OD2 3.31Å; K41-D232 IonicContact NZ-OD2 3.61Å; K41-D232 PolarHBondContact NZ-OD2 3.32Å
42	T	86.1	Confident	81.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.1	-47.7	-175.4	-47.4	0	0	0	0	112.2	Q38 Q39 A45 W46 M227 L228 A243 T246	Q38-T42 PolarHBondContact O-N 3.43Å; Q38-T42 VanDerWaalsContact O-N 3.15Å; Q38-T42 PolarHBondContact O-OG1 3.2Å; Q39-T42 PolarHBondContact O-N 3.48Å; T42-A45 PolarHBondContact O-N 2.8Å; T42-W46 WeakPolarHBondContact O-CB 3.48Å; T42-W46 PolarHBondContact O-N 3.41Å; T42-M227 VanDerWaalsContact CA-O 3.26Å; T42-M227 WeakPolarHBondContact CA-O 3.14Å; T42-M227 HydrophobicContact CG2-CB 4.02Å; T42-M227 PolarHBondContact OG1-O 3.27Å; T42-L228 HydrophobicContact CG2-CD2 4.14Å; T42-L228 WeakPolarHBondContact OG1-CD2 3.25Å; T42-A243 HydrophobicContact CG2-CB 3.98Å; T42-A243 WeakPolarHBondContact CG2-O 3.37Å; T42-A243 WeakPolarHBondContact OG1-CB 3.49Å; T42-T246 HydrophobicContact CG2-CG2 4.29Å
43	F	91	Very high	83.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-71.2	-34	-179.3	-64.6	-8.1	0	0	0	111.8	Q39 K41 W46 C47 I61 L130 I133 W134 I137 K242	Q39-F43 HydrophobicContact CB-CD2 4.26Å; Q39-F43 HydrophobicContact CB-CE2 3.97Å; Q39-F43 HydrophobicContact CB-CZ 4.25Å; Q39-F43 HydrophobicContact CG-CE2 4.22Å; Q39-F43 HydrophobicContact CG-CZ 4.1Å; Q39-F43 VanDerWaalsContact O-CB 3.3Å; Q39-F43 WeakPolarHBondContact O-CB 3.42Å; Q39-F43 VanDerWaalsContact O-CG 3.29Å; Q39-F43 WeakPolarHBondContact O-CG 3.41Å; Q39-F43 PolarHBondContact O-N 3.18Å; K41-F43 PolarHBondContact O-N 3.18Å; F43-W46 PolarHBondContact O-N 3.11Å; F43-C47 WeakPolarHBondContact O-CB 3.46Å; F43-C47 PolarHBondContact O-N 3.19Å; F43-C47 PolarHBondContact O-SG 2.89Å; F43-I61 HydrophobicContact CB-CD1 3.73Å; F43-L130 HydrophobicContact CD2-CB 4.43Å; F43-L130 HydrophobicContact CD2-CD2 3.83Å; F43-L130 HydrophobicContact CE2-CB 4.41Å; F43-L130 WeakPolarHBondContact CE2-O 3.37Å; F43-I133 HydrophobicContact CB-CG2 3.81Å; F43-I133 HydrophobicContact CD2-CB 4.28Å; F43-I133 HydrophobicContact CD2-CG2 4.14Å; F43-I133 HydrophobicContact CG-CG2 4.04Å; F43-W134 HydrophobicContact CE1-CE3 4.16Å; F43-W134 HydrophobicContact CE2-CB 3.96Å; F43-W134 HydrophobicContact CZ-CB 3.93Å; F43-W134 HydrophobicContact CZ-CD2 4.48Å; F43-W134 AromaticContact CZ-CE3 3.91Å; F43-W134 HydrophobicContact CZ-CE3 3.91Å; F43-I137 HydrophobicContact CD1-CD1 3.4Å; F43-I137 VanDerWaalsContact CD1-CD1 3.4Å; F43-I137 HydrophobicContact CE1-CD1 3.71Å; F43-I137 HydrophobicContact CG-CD1 3.96Å; F43-I137 HydrophobicContact CZ-CD1 4.47Å; F43-K242 HydrophobicContact CE1-CB 4.42Å; F43-K242 HydrophobicContact CZ-CB 4.02Å
44	T	89.3	Confident	83.8	Confident	20 Å²	20	41.1 Å²	41.1	12%	0.123	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-48.6	173.3	-57.2	0	0	0	0	110.6	R40 K41 C47 N48 I58	R40-T44 VanDerWaalsContact O-CB 3.25Å; R40-T44 WeakPolarHBondContact O-CB 3.37Å; R40-T44 PolarHBondContact O-N 2.84Å; R40-T44 PolarHBondContact O-OG1 2.82Å; K41-T44 PolarHBondContact O-N 3.15Å; T44-C47 PolarHBondContact O-N 3.5Å; T44-N48 WeakPolarHBondContact O-CB 3.37Å; T44-N48 PolarHBondContact O-N 3.13Å; T44-N48 PolarHBondContact O-ND2 3.12Å; T44-I58 HydrophobicContact CG2-CD1 3.96Å; T44-I58 HydrophobicContact CG2-CG1 3.92Å
45	A	86.4	Confident	84.5	Confident	23 Å²	23	43.2 Å²	43.2	19%	0.19	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-41.3	177.4	0	0	0	0	0	112.4	K41 T42 N48 S49 M227	K41-A45 WeakPolarHBondContact O-CB 3.5Å; K41-A45 PolarHBondContact O-N 3.41Å; T42-A45 PolarHBondContact O-N 2.8Å; A45-N48 PolarHBondContact O-N 3.4Å; A45-S49 PolarHBondContact O-N 3.42Å; A45-M227 HydrophobicContact CB-CB 3.93Å; A45-M227 HydrophobicContact CB-CG 3.82Å
46	W	89.3	Confident	85	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-47.7	174.8	-176.9	86.9	0	0	0	111.9	T42 F43 N48 S49 H50 L74 I78 I136 I137 A141 M227 T246	T42-W46 WeakPolarHBondContact O-CB 3.48Å; T42-W46 PolarHBondContact O-N 3.41Å; F43-W46 PolarHBondContact O-N 3.11Å; W46-N48 VanDerWaalsContact C-N 3.31Å; W46-N48 PolarHBondContact O-N 3.35Å; W46-S49 WeakPolarHBondContact O-CB 3.39Å; W46-S49 PolarHBondContact O-N 3.24Å; W46-S49 VanDerWaalsContact O-N 3.14Å; W46-S49 PolarHBondContact O-OG 2.76Å; W46-H50 AromaticContact CD1-NE2 3.58Å; W46-H50 AromaticContact CD2-CD2 3.97Å; W46-H50 AromaticContact CD2-NE2 3.64Å; W46-H50 AromaticContact CE2-CD2 3.67Å; W46-H50 AromaticContact CE2-NE2 2.7Å; W46-H50 AromaticContact CH2-NE2 3.89Å; W46-H50 AromaticContact CZ2-CD2 3.72Å; W46-H50 AromaticContact CZ2-NE2 2.87Å; W46-H50 WeakPolarHBondContact CZ2-NE2 3.33Å; W46-H50 AromaticContact NE1-NE2 2.68Å; W46-H50 PolarHBondContact NE1-NE2 2.89Å; W46-H50 PolarHBondContact O-CD2 3.09Å; W46-H50 PolarHBondContact O-N 3.44Å; W46-L74 HydrophobicContact CZ3-CD1 4.4Å; W46-L74 HydrophobicContact CZ3-CD2 4.31Å; W46-I78 HydrophobicContact CH2-CD1 4.32Å; W46-I78 HydrophobicContact CH2-CG2 4.19Å; W46-I136 HydrophobicContact CH2-CG2 4.16Å; W46-I136 HydrophobicContact CZ3-CG2 4.36Å; W46-I137 HydrophobicContact CD2-CD1 4Å; W46-I137 HydrophobicContact CD2-CG1 3.6Å; W46-I137 HydrophobicContact CE3-CD1 3.9Å; W46-I137 HydrophobicContact CE3-CG1 3.49Å; W46-I137 VanDerWaalsContact CE3-CG1 3.49Å; W46-I137 HydrophobicContact CG-CD1 4.31Å; W46-I137 HydrophobicContact CG-CG1 4.32Å; W46-I137 HydrophobicContact CH2-CG1 3.79Å; W46-I137 HydrophobicContact CZ2-CG1 3.89Å; W46-I137 HydrophobicContact CZ3-CD1 4.41Å; W46-I137 HydrophobicContact CZ3-CG1 3.59Å; W46-A141 HydrophobicContact CZ2-CB 4.18Å; W46-M227 HydrophobicContact CB-CE 4.32Å; W46-M227 HydrophobicContact CB-SD 3.78Å; W46-M227 HydrophobicContact CG-SD 4.36Å; W46-T246 HydrophobicContact CB-CG2 3.95Å; W46-T246 VanDerWaalsContact CD1-CG2 3.48Å; W46-T246 HydrophobicContact CG-CG2 3.74Å
47	C	89.3	Confident	85.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-43.7	175.7	-67.8	0	0	0	0	111.4	F43 T44 S49 H50 L51 I58 F65 L74	F43-C47 WeakPolarHBondContact O-CB 3.46Å; F43-C47 PolarHBondContact O-N 3.19Å; F43-C47 PolarHBondContact O-SG 2.89Å; T44-C47 PolarHBondContact O-N 3.5Å; C47-S49 VanDerWaalsContact C-N 3.32Å; C47-S49 PolarHBondContact O-N 3.1Å; C47-H50 PolarHBondContact O-N 3.17Å; C47-L51 WeakPolarHBondContact O-CB 3.47Å; C47-L51 WeakPolarHBondContact O-CG 3.45Å; C47-L51 PolarHBondContact O-N 3.05Å; C47-I58 HydrophobicContact CB-CD1 3.89Å; C47-I58 HydrophobicContact CB-CG1 4.35Å; C47-F65 HydrophobicContact CB-CZ 4.25Å; C47-L74 HydrophobicContact CB-CD2 4.19Å; C47-L74 VanDerWaalsContact SG-CD2 3.57Å
48	N	89	Confident	86	Confident	36 Å²	36	40.4 Å²	40.4	19%	0.193	22%	0.216	C	C	.	.	H	α-helix	trans	-65.4	-31.8	177	-74	-18.6	0	0	0	113	T44 A45 W46 H50 L51 R52 Q57 I58	T44-N48 WeakPolarHBondContact O-CB 3.37Å; T44-N48 PolarHBondContact O-N 3.13Å; T44-N48 PolarHBondContact O-ND2 3.12Å; A45-N48 PolarHBondContact O-N 3.4Å; W46-N48 VanDerWaalsContact C-N 3.31Å; W46-N48 PolarHBondContact O-N 3.35Å; N48-H50 PolarHBondContact O-N 3.19Å; N48-L51 PolarHBondContact O-N 3.15Å; N48-R52 WeakPolarHBondContact O-CB 3.48Å; N48-R52 WeakPolarHBondContact O-CG 3.48Å; N48-R52 PolarHBondContact O-N 2.93Å; N48-Q57 WeakPolarHBondContact OD1-CA 3.44Å; N48-I58 PolarHBondContact ND2-O 3.14Å; N48-I58 VanDerWaalsContact OD1-CG1 3.25Å; N48-I58 WeakPolarHBondContact OD1-CG1 3.28Å; N48-I58 PolarHBondContact OD1-N 3.26Å
49	S	85.7	Confident	86.2	Confident	12 Å²	12	48 Å²	48	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-26.7	175.6	82.2	0	0	0	0	113.6	A45 W46 C47 R52	A45-S49 PolarHBondContact O-N 3.42Å; W46-S49 WeakPolarHBondContact O-CB 3.39Å; W46-S49 PolarHBondContact O-N 3.24Å; W46-S49 VanDerWaalsContact O-N 3.14Å; W46-S49 PolarHBondContact O-OG 2.76Å; C47-S49 VanDerWaalsContact C-N 3.32Å; C47-S49 PolarHBondContact O-N 3.1Å; S49-R52 WeakPolarHBondContact O-CG 3.46Å; S49-R52 PolarHBondContact O-NE 3.15Å; S49-R52 VanDerWaalsContact O-NE 3.13Å
50	H	86.4	Confident	86.3	Confident	50 Å²	50	49.8 Å²	49.8	23%	0.231	26%	0.261	C	S	.	.	H	α-helix	trans	-92.3	-49.2	172.6	-66.6	-70.4	0	0	0	111.4	W46 C47 N48 R52 K53 L74 V77 I78	W46-H50 AromaticContact CD1-NE2 3.58Å; W46-H50 AromaticContact CD2-CD2 3.97Å; W46-H50 AromaticContact CD2-NE2 3.64Å; W46-H50 AromaticContact CE2-CD2 3.67Å; W46-H50 AromaticContact CE2-NE2 2.7Å; W46-H50 AromaticContact CH2-NE2 3.89Å; W46-H50 AromaticContact CZ2-CD2 3.72Å; W46-H50 AromaticContact CZ2-NE2 2.87Å; W46-H50 WeakPolarHBondContact CZ2-NE2 3.33Å; W46-H50 AromaticContact NE1-NE2 2.68Å; W46-H50 PolarHBondContact NE1-NE2 2.89Å; W46-H50 PolarHBondContact O-CD2 3.09Å; W46-H50 PolarHBondContact O-N 3.44Å; C47-H50 PolarHBondContact O-N 3.17Å; N48-H50 PolarHBondContact O-N 3.19Å; H50-R52 PolarHBondContact O-N 2.87Å; H50-K53 VanDerWaalsContact O-CB 3.27Å; H50-K53 WeakPolarHBondContact O-CB 3.25Å; H50-K53 PolarHBondContact O-N 3.42Å; H50-L74 HydrophobicContact CB-CD1 3.81Å; H50-V77 HydrophobicContact CB-CG1 4.09Å; H50-I78 HydrophobicContact CB-CG2 4.09Å
51	L	86.1	Confident	86.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.5	-26.3	-178.1	-70.4	174.5	0	0	0	113.7	C47 N48 K53 A54 G55 T56 I58 L73 L74	C47-L51 WeakPolarHBondContact O-CB 3.47Å; C47-L51 WeakPolarHBondContact O-CG 3.45Å; C47-L51 PolarHBondContact O-N 3.05Å; N48-L51 PolarHBondContact O-N 3.15Å; L51-K53 PolarHBondContact O-N 3.31Å; L51-A54 CarbonylContact O-C 3.39Å; L51-A54 WeakPolarHBondContact O-CA 3.44Å; L51-A54 PolarHBondContact O-N 3.2Å; L51-G55 PolarHBondContact O-N 3.48Å; L51-G55 VanDerWaalsContact O-N 3.14Å; L51-T56 CarbonylContact C-O 3.48Å; L51-T56 HydrophobicContact CB-CG2 3.96Å; L51-T56 VanDerWaalsContact CB-O 3.3Å; L51-T56 WeakPolarHBondContact CB-O 3.22Å; L51-T56 HydrophobicContact CD1-CG2 4.43Å; L51-T56 HydrophobicContact CD2-CG2 3.86Å; L51-T56 HydrophobicContact CG-CG2 4.3Å; L51-T56 PolarHBondContact O-N 2.93Å; L51-T56 VanDerWaalsContact O-O 3.12Å; L51-I58 HydrophobicContact CD1-CG2 4.19Å; L51-L73 HydrophobicContact CD2-CB 4.47Å; L51-L73 HydrophobicContact CD2-CD2 4.43Å; L51-L73 HydrophobicContact CD2-CG 4.22Å; L51-L74 HydrophobicContact CD2-CB 4Å; L51-L74 HydrophobicContact CD2-CD1 4.49Å; L51-L74 HydrophobicContact CG-CB 4.45Å; L51-L74 HydrophobicContact CG-CD1 4.23Å
52	R	84.8	Confident	86.1	Confident	111 Å²	111	44.2 Å²	44.2	42%	0.419	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-55.4	-33.9	171	70.7	-177.4	177.5	161.8	2	112.5	N48 S49 H50 A54 G55 T56 D223	N48-R52 WeakPolarHBondContact O-CB 3.48Å; N48-R52 WeakPolarHBondContact O-CG 3.48Å; N48-R52 PolarHBondContact O-N 2.93Å; S49-R52 WeakPolarHBondContact O-CG 3.46Å; S49-R52 PolarHBondContact O-NE 3.15Å; S49-R52 VanDerWaalsContact O-NE 3.13Å; H50-R52 PolarHBondContact O-N 2.87Å; R52-A54 PolarHBondContact O-N 3.04Å; R52-G55 PolarHBondContact O-N 2.73Å; R52-G55 VanDerWaalsContact O-N 3.12Å; R52-T56 PolarHBondContact N-O 3.33Å; R52-D223 IonicContact CZ-OD1 3.66Å; R52-D223 IonicContact CZ-OD2 3.54Å; R52-D223 IonicContact NH1-OD1 3.86Å; R52-D223 PolarHBondContact NH1-OD1 3.39Å; R52-D223 IonicContact NH1-OD2 2.7Å; R52-D223 PolarHBondContact NH2-O 3.47Å; R52-D223 IonicContact NH2-OD1 2.7Å; R52-D223 PolarHBondContact NH2-OD1 2.94Å; R52-D223 VanDerWaalsContact NH2-OD1 3.12Å; R52-D223 IonicContact NH2-OD2 2.66Å; R52-D223 PolarHBondContact NH2-OD2 3.38Å
53	K	79.7	Confident	86.1	Confident	147 Å²	147	50.2 Å²	50.2	64%	0.639	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-68.2	-22	177.5	-56.4	179.9	-179.6	177.2	0	112.6	H50 L51 V77	H50-K53 VanDerWaalsContact O-CB 3.27Å; H50-K53 WeakPolarHBondContact O-CB 3.25Å; H50-K53 PolarHBondContact O-N 3.42Å; L51-K53 PolarHBondContact O-N 3.31Å; K53-V77 HydrophobicContact CB-CG1 4.41Å
54	A	79.3	Confident	85.9	Confident	44 Å²	44	51.9 Å²	51.9	36%	0.364	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-103.4	8.3	174.1	0	0	0	0	0	113.4	L51 R52 L73 V77	L51-A54 CarbonylContact O-C 3.39Å; L51-A54 WeakPolarHBondContact O-CA 3.44Å; L51-A54 PolarHBondContact O-N 3.2Å; R52-A54 PolarHBondContact O-N 3.04Å; A54-L73 HydrophobicContact CB-CD1 4.19Å; A54-L73 HydrophobicContact CB-CD2 4.09Å; A54-L73 HydrophobicContact CB-CG 4.22Å; A54-V77 HydrophobicContact CB-CG2 3.8Å
55	G	81.8	Confident	86	Confident	73 Å²	73	51 Å²	51	75%	0.753	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	27.6	176.4	0	0	0	0	0	115.3	L51 R52	L51-G55 PolarHBondContact O-N 3.48Å; L51-G55 VanDerWaalsContact O-N 3.14Å; R52-G55 PolarHBondContact O-N 2.73Å; R52-G55 VanDerWaalsContact O-N 3.12Å
56	T	87	Confident	86.1	Confident	48 Å²	48	53.5 Å²	53.5	29%	0.294	28%	0.275	S	S	.	.			trans	-138.2	168.4	176.6	-161.2	0	0	0	0	112.6	L51 R52 L73	L51-T56 CarbonylContact C-O 3.48Å; L51-T56 HydrophobicContact CB-CG2 3.96Å; L51-T56 VanDerWaalsContact CB-O 3.3Å; L51-T56 WeakPolarHBondContact CB-O 3.22Å; L51-T56 HydrophobicContact CD1-CG2 4.43Å; L51-T56 HydrophobicContact CD2-CG2 3.86Å; L51-T56 HydrophobicContact CG-CG2 4.3Å; L51-T56 PolarHBondContact O-N 2.93Å; L51-T56 VanDerWaalsContact O-O 3.12Å; R52-T56 PolarHBondContact N-O 3.33Å; T56-L73 HydrophobicContact CG2-CD2 3.77Å
57	Q	88.4	Confident	85.9	Confident	117 Å²	117	55.7 Å²	55.7	55%	0.547	29%	0.287	S	S	.	.			trans	-149.6	165.1	179.3	68.4	-175.1	17.7	0	0	112.2	N48 K70	N48-Q57 WeakPolarHBondContact OD1-CA 3.44Å; Q57-K70 PolarHBondContact O-NZ 2.93Å
58	I	89.7	Confident	85.7	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	29%	0.287	C	S	.	.			trans	-116.4	143.5	170.2	56	160.8	0	0	0	110.8	T44 C47 N48 L51 I61 D64 F65 K70	T44-I58 HydrophobicContact CG2-CD1 3.96Å; T44-I58 HydrophobicContact CG2-CG1 3.92Å; C47-I58 HydrophobicContact CB-CD1 3.89Å; C47-I58 HydrophobicContact CB-CG1 4.35Å; N48-I58 PolarHBondContact ND2-O 3.14Å; N48-I58 VanDerWaalsContact OD1-CG1 3.25Å; N48-I58 WeakPolarHBondContact OD1-CG1 3.28Å; N48-I58 PolarHBondContact OD1-N 3.26Å; L51-I58 HydrophobicContact CD1-CG2 4.19Å; I58-I61 HydrophobicContact CD1-CB 4.2Å; I58-I61 HydrophobicContact CD1-CD1 4.48Å; I58-I61 HydrophobicContact CD1-CG1 3.96Å; I58-D64 WeakPolarHBondContact CA-OD2 3.34Å; I58-D64 HydrophobicContact CB-CB 3.88Å; I58-D64 HydrophobicContact CG2-CB 3.54Å; I58-F65 HydrophobicContact CD1-CE2 3.86Å; I58-F65 HydrophobicContact CD1-CZ 3.79Å; I58-F65 HydrophobicContact CG2-CE1 4.24Å; I58-F65 HydrophobicContact CG2-CZ 4.46Å; I58-K70 HydrophobicContact CG2-CB 4.36Å; I58-K70 HydrophobicContact CG2-CD 3.47Å; I58-K70 VanDerWaalsContact CG2-CD 3.47Å
59	E	86.4	Confident	85.6	Confident	165 Å²	165	56.9 Å²	56.9	77%	0.771	29%	0.293	S	S	*	.	S	Bend	trans	-106.7	-42.7	176.2	-66.8	-179.6	-171.3	0	0	110.7	D64	E59-D64 PolarHBondContact N-OD2 3.48Å
60	N	85.5	Confident	85.8	Confident	45 Å²	45	58.7 Å²	58.7	24%	0.241	30%	0.299	C	S	.	.			trans	-127.7	103.8	177.1	-175.2	3.8	0	0	0	110.6	E62 E63 D64	N60-E62 PolarHBondContact O-N 3.13Å; N60-E62 PolarHBondContact OD1-N 3.1Å; N60-E63 HydrophobicContact CB-CB 4.29Å; N60-E63 VanDerWaalsContact ND2-CD 3.34Å; N60-E63 WeakPolarHBondContact ND2-CG 3.31Å; N60-E63 PolarHBondContact ND2-OE2 3.42Å; N60-E63 PolarHBondContact O-N 3.07Å; N60-D64 PolarHBondContact N-OD2 3.2Å; N60-D64 WeakPolarHBondContact O-CB 3.17Å; N60-D64 PolarHBondContact O-N 2.67Å
61	I	85.6	Confident	85.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-54.2	-27.7	-177	-157.7	168.7	0	0	0	114.2	R40 F43 I58 F65 L130 I133	R40-I61 HydrophobicContact CG-CG2 3.82Å; F43-I61 HydrophobicContact CB-CD1 3.73Å; I58-I61 HydrophobicContact CD1-CB 4.2Å; I58-I61 HydrophobicContact CD1-CD1 4.48Å; I58-I61 HydrophobicContact CD1-CG1 3.96Å; I61-F65 HydrophobicContact CD1-CE2 4.18Å; I61-F65 HydrophobicContact CG1-CD2 3.7Å; I61-F65 HydrophobicContact CG1-CE2 3.53Å; I61-F65 WeakPolarHBondContact O-CD2 3.29Å; I61-L130 HydrophobicContact CD1-CD2 4.29Å; I61-L130 HydrophobicContact CG2-CD2 4.2Å; I61-I133 HydrophobicContact CD1-CG1 4.2Å
62	E	81.8	Confident	86.1	Confident	33 Å²	33	56.6 Å²	56.6	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-81.6	-20.5	179.9	-62.9	176.7	164.6	0	0	113.4	R40 N60 R66 A126	R40-E62 IonicContact CZ-OE1 2.65Å; R40-E62 IonicContact CZ-OE2 3.9Å; R40-E62 IonicContact NH1-OE1 2.8Å; R40-E62 PolarHBondContact NH1-OE1 2.97Å; R40-E62 IonicContact NH1-OE2 2.71Å; R40-E62 PolarHBondContact NH1-OE2 3.2Å; R40-E62 IonicContact NH2-OE1 3.3Å; R40-E62 PolarHBondContact NH2-OE1 3.4Å; R40-E62 IonicContact NH2-OE2 3.59Å; N60-E62 PolarHBondContact O-N 3.13Å; N60-E62 PolarHBondContact OD1-N 3.1Å; E62-R66 WeakPolarHBondContact O-CD 3.34Å; E62-R66 WeakPolarHBondContact O-CG 3.49Å; E62-A126 HydrophobicContact CG-CB 4.44Å; E62-A126 WeakPolarHBondContact OE1-CA 3.38Å; E62-A126 WeakPolarHBondContact OE1-CB 3.49Å
63	E	85.4	Confident	86.3	Confident	125 Å²	125	53.9 Å²	53.9	58%	0.584	28%	0.283	S	S	*	.	H	α-helix	trans	-107.4	-41.1	-177.5	-69.1	-175.7	132.9	0	0	112.1	N60 F65 R66	N60-E63 HydrophobicContact CB-CB 4.29Å; N60-E63 VanDerWaalsContact ND2-CD 3.34Å; N60-E63 WeakPolarHBondContact ND2-CG 3.31Å; N60-E63 PolarHBondContact ND2-OE2 3.42Å; N60-E63 PolarHBondContact O-N 3.07Å; E63-F65 VanDerWaalsContact C-N 3.34Å; E63-F65 PolarHBondContact O-N 3.37Å; E63-R66 WeakPolarHBondContact O-CB 3.5Å; E63-R66 WeakPolarHBondContact O-CG 3.47Å; E63-R66 PolarHBondContact O-N 3.42Å
64	D	88.1	Confident	86.7	Confident	36 Å²	36	46.9 Å²	46.9	19%	0.193	25%	0.253	C	S	.	.	H	α-helix	trans	-69.6	-24.7	-176	-86.6	-54.3	0	0	0	114.5	I58 E59 N60 K70	I58-D64 WeakPolarHBondContact CA-OD2 3.34Å; I58-D64 HydrophobicContact CB-CB 3.88Å; I58-D64 HydrophobicContact CG2-CB 3.54Å; E59-D64 PolarHBondContact N-OD2 3.48Å; N60-D64 PolarHBondContact N-OD2 3.2Å; N60-D64 WeakPolarHBondContact O-CB 3.17Å; N60-D64 PolarHBondContact O-N 2.67Å; D64-K70 HydrophobicContact CB-CD 4.19Å; D64-K70 IonicContact OD1-NZ 3.92Å; D64-K70 PolarHBondContact OD1-NZ 2.81Å; D64-K70 IonicContact OD2-NZ 3.36Å
65	F	89.9	Confident	87.2	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-6.4	175.8	-69.6	-41.3	0	0	0	113.8	C47 I58 I61 E63 D67 G68 K70 L71 L74 T129 I133	C47-F65 HydrophobicContact CB-CZ 4.25Å; I58-F65 HydrophobicContact CD1-CE2 3.86Å; I58-F65 HydrophobicContact CD1-CZ 3.79Å; I58-F65 HydrophobicContact CG2-CE1 4.24Å; I58-F65 HydrophobicContact CG2-CZ 4.46Å; I61-F65 HydrophobicContact CD1-CE2 4.18Å; I61-F65 HydrophobicContact CG1-CD2 3.7Å; I61-F65 HydrophobicContact CG1-CE2 3.53Å; I61-F65 WeakPolarHBondContact O-CD2 3.29Å; E63-F65 VanDerWaalsContact C-N 3.34Å; E63-F65 PolarHBondContact O-N 3.37Å; F65-D67 PolarHBondContact O-N 3.32Å; F65-D67 VanDerWaalsContact O-N 3.11Å; F65-G68 PolarHBondContact O-N 3.28Å; F65-K70 HydrophobicContact CD1-CB 4Å; F65-K70 HydrophobicContact CE1-CB 3.98Å; F65-L71 HydrophobicContact CD1-CB 3.83Å; F65-L71 HydrophobicContact CE1-CB 4.31Å; F65-L71 HydrophobicContact CG-CB 4.44Å; F65-L74 HydrophobicContact CZ-CD2 4.11Å; F65-T129 HydrophobicContact CD2-CG2 4.35Å; F65-I133 HydrophobicContact CD2-CD1 3.94Å; F65-I133 HydrophobicContact CD2-CG1 4.32Å; F65-I133 HydrophobicContact CE2-CD1 3.38Å; F65-I133 HydrophobicContact CE2-CG1 3.94Å; F65-I133 HydrophobicContact CZ-CD1 3.96Å
66	R	88.9	Confident	87.4	Confident	75 Å²	75	42.9 Å²	42.9	28%	0.283	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.8	-176.3	-61	-179.7	65.4	164.7	8.7	114.5	E62 E63 K95 I121 V122 D123	E62-R66 WeakPolarHBondContact O-CD 3.34Å; E62-R66 WeakPolarHBondContact O-CG 3.49Å; E63-R66 WeakPolarHBondContact O-CB 3.5Å; E63-R66 WeakPolarHBondContact O-CG 3.47Å; E63-R66 PolarHBondContact O-N 3.42Å; R66-K95 WeakPolarHBondContact O-CB 3.4Å; R66-K95 WeakPolarHBondContact O-CD 3.16Å; R66-I121 WeakPolarHBondContact CG-O 3.22Å; R66-V122 VanDerWaalsContact CZ-O 3.29Å; R66-V122 PolarHBondContact NE-O 3.27Å; R66-V122 PolarHBondContact NH2-O 3.17Å; R66-D123 VanDerWaalsContact NH2-C 3.28Å; R66-D123 PolarHBondContact NH2-O 3.17Å
67	D	84.7	Confident	87.4	Confident	48 Å²	48	42.8 Å²	42.8	26%	0.257	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-4.8	176.8	75.3	6.1	0	0	0	114.4	F65 L69 K95 N98	F65-D67 PolarHBondContact O-N 3.32Å; F65-D67 VanDerWaalsContact O-N 3.11Å; D67-L69 HydrophobicContact CB-CG 4.5Å; D67-L69 PolarHBondContact O-N 3.46Å; D67-L69 WeakPolarHBondContact OD1-CB 3.43Å; D67-L69 PolarHBondContact OD1-N 3.27Å; D67-K95 HydrophobicContact CB-CD 4.3Å; D67-K95 HydrophobicContact CB-CG 4.2Å; D67-N98 WeakPolarHBondContact O-CB 3.44Å; D67-N98 PolarHBondContact O-ND2 3.13Å; D67-N98 VanDerWaalsContact O-ND2 3.09Å
68	G	84.8	Confident	87.3	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	72	-12.3	-177	0	0	0	0	0	115.6	F65 L71 M72	F65-G68 PolarHBondContact O-N 3.28Å; G68-L71 PolarHBondContact O-N 3.04Å; G68-M72 VanDerWaalsContact O-CG 3.28Å; G68-M72 WeakPolarHBondContact O-CG 3.3Å; G68-M72 PolarHBondContact O-N 3.23Å
69	L	88.4	Confident	87	Confident	60 Å²	60	40 Å²	40	31%	0.314	20%	0.197	S	C	.	.	H	α-helix	trans	-69.1	-50.5	-171.1	-60.9	-178.7	0	0	0	112	D67 L71 M72 L73 P86 N98	D67-L69 HydrophobicContact CB-CG 4.5Å; D67-L69 PolarHBondContact O-N 3.46Å; D67-L69 WeakPolarHBondContact OD1-CB 3.43Å; D67-L69 PolarHBondContact OD1-N 3.27Å; L69-L71 VanDerWaalsContact C-N 3.27Å; L69-L71 PolarHBondContact O-N 3.37Å; L69-M72 PolarHBondContact O-N 3.11Å; L69-L73 PolarHBondContact O-N 3.25Å; L69-L73 VanDerWaalsContact O-N 3.13Å; L69-P86 HydrophobicContact CD2-CB 3.44Å; L69-P86 VanDerWaalsContact CD2-CB 3.44Å; L69-P86 HydrophobicContact CD2-CG 4.03Å; L69-N98 WeakPolarHBondContact CD2-ND2 3.04Å
70	K	89.2	Confident	86.7	Confident	50 Å²	50	35.5 Å²	35.5	22%	0.217	20%	0.196	C	C	.	.	H	α-helix	trans	-67.9	-29.8	178.3	-62.9	-171.6	-176.6	-178.3	0	112.1	Q57 I58 D64 F65 L74	Q57-K70 PolarHBondContact O-NZ 2.93Å; I58-K70 HydrophobicContact CG2-CB 4.36Å; I58-K70 HydrophobicContact CG2-CD 3.47Å; I58-K70 VanDerWaalsContact CG2-CD 3.47Å; D64-K70 HydrophobicContact CB-CD 4.19Å; D64-K70 IonicContact OD1-NZ 3.92Å; D64-K70 PolarHBondContact OD1-NZ 2.81Å; D64-K70 IonicContact OD2-NZ 3.36Å; F65-K70 HydrophobicContact CD1-CB 4Å; F65-K70 HydrophobicContact CE1-CB 3.98Å; K70-L74 WeakPolarHBondContact O-CB 3.48Å; K70-L74 PolarHBondContact O-N 3.46Å
71	L	89.4	Confident	86.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.5	-47.3	175.6	179.7	64.5	0	0	0	111.5	F65 G68 L69 L73 L74 L75 A102 M132 I133 I136	F65-L71 HydrophobicContact CD1-CB 3.83Å; F65-L71 HydrophobicContact CE1-CB 4.31Å; F65-L71 HydrophobicContact CG-CB 4.44Å; G68-L71 PolarHBondContact O-N 3.04Å; L69-L71 VanDerWaalsContact C-N 3.27Å; L69-L71 PolarHBondContact O-N 3.37Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 3.09Å; L71-L74 PolarHBondContact O-N 3.14Å; L71-L75 WeakPolarHBondContact O-CG 3.43Å; L71-L75 PolarHBondContact O-N 2.78Å; L71-L75 VanDerWaalsContact O-N 3.1Å; L71-A102 HydrophobicContact CD2-CB 3.64Å; L71-A102 HydrophobicContact CG-CB 3.85Å; L71-M132 HydrophobicContact CD1-CE 3.59Å; L71-M132 HydrophobicContact CD1-SD 4.29Å; L71-M132 HydrophobicContact CD2-CE 3.68Å; L71-M132 HydrophobicContact CD2-SD 3.69Å; L71-M132 HydrophobicContact CG-CE 4.28Å; L71-I133 HydrophobicContact CD1-CD1 4.11Å; L71-I136 HydrophobicContact CD1-CD1 3.97Å
72	M	89.4	Confident	86.4	Confident	7 Å²	7	47.6 Å²	47.6	3%	0.034	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-43.5	175.7	-70.6	177.2	76.5	0	0	111.5	G68 L69 L75 E76 L83 P84 P86 N98 K101 A102	G68-M72 VanDerWaalsContact O-CG 3.28Å; G68-M72 WeakPolarHBondContact O-CG 3.3Å; G68-M72 PolarHBondContact O-N 3.23Å; L69-M72 PolarHBondContact O-N 3.11Å; M72-L75 WeakPolarHBondContact O-CB 3.25Å; M72-L75 PolarHBondContact O-N 3.05Å; M72-E76 PolarHBondContact O-N 3.33Å; M72-L83 HydrophobicContact CB-CD2 4.16Å; M72-L83 HydrophobicContact CE-CB 4.05Å; M72-L83 HydrophobicContact CE-CD2 4.25Å; M72-L83 HydrophobicContact CG-CD2 4.15Å; M72-P84 WeakPolarHBondContact CE-O 3.31Å; M72-P86 HydrophobicContact CE-CB 4.45Å; M72-P86 HydrophobicContact SD-CB 4.04Å; M72-N98 HydrophobicContact SD-CB 4.02Å; M72-K101 HydrophobicContact CE-CB 3.78Å; M72-K101 HydrophobicContact CE-CD 4.05Å; M72-K101 HydrophobicContact SD-CB 4.22Å; M72-A102 HydrophobicContact CG-CB 3.91Å
73	L	88.2	Confident	86.6	Confident	53 Å²	53	46.8 Å²	46.8	28%	0.277	24%	0.238	S	C	.	.	H	α-helix	trans	-65.4	-38.2	178	-177	60.4	0	0	0	112.7	L51 A54 T56 L69 L71 L75 E76 V77	L51-L73 HydrophobicContact CD2-CB 4.47Å; L51-L73 HydrophobicContact CD2-CD2 4.43Å; L51-L73 HydrophobicContact CD2-CG 4.22Å; A54-L73 HydrophobicContact CB-CD1 4.19Å; A54-L73 HydrophobicContact CB-CD2 4.09Å; A54-L73 HydrophobicContact CB-CG 4.22Å; T56-L73 HydrophobicContact CG2-CD2 3.77Å; L69-L73 PolarHBondContact O-N 3.25Å; L69-L73 VanDerWaalsContact O-N 3.13Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 3.09Å; L73-L75 VanDerWaalsContact C-N 3.31Å; L73-L75 PolarHBondContact O-N 2.83Å; L73-E76 PolarHBondContact O-N 3.39Å; L73-V77 HydrophobicContact CD1-CG2 4.5Å; L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.38Å; L73-V77 VanDerWaalsContact O-N 3.07Å
74	L	89.6	Confident	86.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.7	-44.5	172.7	176.6	64.4	0	0	0	111	W46 C47 H50 L51 F65 K70 L71 V77 I78 I133	W46-L74 HydrophobicContact CZ3-CD1 4.4Å; W46-L74 HydrophobicContact CZ3-CD2 4.31Å; C47-L74 HydrophobicContact CB-CD2 4.19Å; C47-L74 VanDerWaalsContact SG-CD2 3.57Å; H50-L74 HydrophobicContact CB-CD1 3.81Å; L51-L74 HydrophobicContact CD2-CB 4Å; L51-L74 HydrophobicContact CD2-CD1 4.49Å; L51-L74 HydrophobicContact CG-CB 4.45Å; L51-L74 HydrophobicContact CG-CD1 4.23Å; F65-L74 HydrophobicContact CZ-CD2 4.11Å; K70-L74 WeakPolarHBondContact O-CB 3.48Å; K70-L74 PolarHBondContact O-N 3.46Å; L71-L74 PolarHBondContact O-N 3.14Å; L74-V77 PolarHBondContact O-N 3.4Å; L74-I78 HydrophobicContact CD1-CG2 4.06Å; L74-I78 WeakPolarHBondContact O-CG1 3.41Å; L74-I78 WeakPolarHBondContact O-CG2 3.18Å; L74-I78 PolarHBondContact O-N 3.32Å; L74-I133 HydrophobicContact CD2-CD1 4.41Å
75	L	88.2	Confident	86.2	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.9	-39.4	177.3	-66.9	170.5	0	0	0	112.5	L71 M72 L73 I78 S79 L83 A102 F105 I106 I136 F140	L71-L75 WeakPolarHBondContact O-CG 3.43Å; L71-L75 PolarHBondContact O-N 2.78Å; L71-L75 VanDerWaalsContact O-N 3.1Å; M72-L75 WeakPolarHBondContact O-CB 3.25Å; M72-L75 PolarHBondContact O-N 3.05Å; L73-L75 VanDerWaalsContact C-N 3.31Å; L73-L75 PolarHBondContact O-N 2.83Å; L75-I78 HydrophobicContact CD2-CD1 4.14Å; L75-S79 VanDerWaalsContact O-CB 3.31Å; L75-S79 WeakPolarHBondContact O-CB 3.23Å; L75-S79 PolarHBondContact O-N 3.15Å; L75-S79 VanDerWaalsContact O-N 3.15Å; L75-S79 PolarHBondContact O-OG 2.94Å; L75-L83 HydrophobicContact CB-CD1 4.05Å; L75-L83 HydrophobicContact CB-CD2 4.16Å; L75-L83 HydrophobicContact CD1-CD2 4.06Å; L75-A102 HydrophobicContact CD1-CB 3.67Å; L75-F105 HydrophobicContact CB-CD1 4Å; L75-F105 HydrophobicContact CB-CE1 4.1Å; L75-F105 HydrophobicContact CD1-CD1 4.09Å; L75-F105 HydrophobicContact CD2-CD1 4.3Å; L75-F105 HydrophobicContact CG-CD1 4.36Å; L75-I106 HydrophobicContact CD1-CD1 3.92Å; L75-I106 HydrophobicContact CD1-CG1 3.85Å; L75-I106 HydrophobicContact CD2-CD1 4.07Å; L75-I106 HydrophobicContact CD2-CG1 3.65Å; L75-I106 HydrophobicContact CG-CG1 4.42Å; L75-I136 HydrophobicContact CD2-CD1 4.13Å; L75-I136 HydrophobicContact CD2-CG1 4.3Å; L75-I136 HydrophobicContact CD2-CG2 4.27Å; L75-F140 HydrophobicContact CD2-CE2 4.43Å
76	E	87.9	Confident	86	Confident	34 Å²	34	54.9 Å²	54.9	16%	0.159	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-44.6	173.6	-64.4	-163	158.3	0	0	111.7	M72 L73 G80 E81 R82 L83	M72-E76 PolarHBondContact O-N 3.33Å; L73-E76 PolarHBondContact O-N 3.39Å; E76-G80 WeakPolarHBondContact O-CA 2.9Å; E76-G80 PolarHBondContact O-N 3.16Å; E76-E81 VanDerWaalsContact CA-O 3.24Å; E76-E81 WeakPolarHBondContact CA-O 3.27Å; E76-E81 WeakPolarHBondContact CB-O 3.42Å; E76-E81 WeakPolarHBondContact CG-O 3.27Å; E76-R82 WeakPolarHBondContact OE1-CA 3.24Å; E76-R82 WeakPolarHBondContact OE2-CD 3.44Å; E76-R82 IonicContact OE2-CZ 3.19Å; E76-R82 IonicContact OE2-NE 3.25Å; E76-R82 IonicContact OE2-NH1 3.36Å; E76-R82 PolarHBondContact OE2-NH1 3.19Å; E76-L83 HydrophobicContact CG-CB 4.17Å; E76-L83 HydrophobicContact CG-CD1 3.67Å; E76-L83 HydrophobicContact CG-CG 4.48Å; E76-L83 PolarHBondContact OE1-N 3.06Å
77	V	86.6	Confident	85.7	Confident	45 Å²	45	54.1 Å²	54.1	27%	0.273	28%	0.284	S	S	.	.	H	α-helix	trans	-69.1	-38.8	-176.2	174.8	0	0	0	0	112.8	H50 K53 A54 L73 L74	H50-V77 HydrophobicContact CB-CG1 4.09Å; K53-V77 HydrophobicContact CB-CG1 4.41Å; A54-V77 HydrophobicContact CB-CG2 3.8Å; L73-V77 HydrophobicContact CD1-CG2 4.5Å; L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.38Å; L73-V77 VanDerWaalsContact O-N 3.07Å; L74-V77 PolarHBondContact O-N 3.4Å
78	I	85.9	Confident	85.3	Confident	30 Å²	30	63 Å²	63	15%	0.154	31%	0.314	C	S	.	.	H	α-helix	trans	-81	-23.4	-179	69.3	-176.4	0	0	0	113.5	W46 H50 L74 L75 I136 F140	W46-I78 HydrophobicContact CH2-CD1 4.32Å; W46-I78 HydrophobicContact CH2-CG2 4.19Å; H50-I78 HydrophobicContact CB-CG2 4.09Å; L74-I78 HydrophobicContact CD1-CG2 4.06Å; L74-I78 WeakPolarHBondContact O-CG1 3.41Å; L74-I78 WeakPolarHBondContact O-CG2 3.18Å; L74-I78 PolarHBondContact O-N 3.32Å; L75-I78 HydrophobicContact CD2-CD1 4.14Å; I78-I136 HydrophobicContact CD1-CG2 3.34Å; I78-F140 HydrophobicContact CD1-CB 4.06Å; I78-F140 HydrophobicContact CD1-CD1 4.32Å; I78-F140 HydrophobicContact CD1-CD2 3.66Å; I78-F140 HydrophobicContact CD1-CE2 4.1Å; I78-F140 HydrophobicContact CD1-CG 3.77Å; I78-F140 HydrophobicContact CG1-CB 4.46Å; I78-F140 HydrophobicContact CG1-CD1 4.19Å; I78-F140 HydrophobicContact CG1-CD2 4.39Å; I78-F140 HydrophobicContact CG1-CG 4.12Å
79	S	82.4	Confident	84.9	Confident	32 Å²	32	64.4 Å²	64.4	22%	0.224	33%	0.328	C	S	.	.	H	α-helix	trans	-99	-21.7	-179.9	66.7	0	0	0	0	114	L75 E81 F105	L75-S79 VanDerWaalsContact O-CB 3.31Å; L75-S79 WeakPolarHBondContact O-CB 3.23Å; L75-S79 PolarHBondContact O-N 3.15Å; L75-S79 VanDerWaalsContact O-N 3.15Å; L75-S79 PolarHBondContact O-OG 2.94Å; S79-E81 PolarHBondContact O-N 3.41Å; S79-E81 PolarHBondContact OG-N 3.38Å; S79-F105 WeakPolarHBondContact OG-CZ 3.34Å
80	G	81.1	Confident	84.3	Confident	72 Å²	72	71.1 Å²	71.1	74%	0.742	36%	0.355	S	S	*	.	S	Bend	trans	76.3	-3	-170.5	0	0	0	0	0	114.4	E76	E76-G80 WeakPolarHBondContact O-CA 2.9Å; E76-G80 PolarHBondContact O-N 3.16Å
81	E	83.4	Confident	84	Confident	91 Å²	91	74.9 Å²	74.9	43%	0.425	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-98.5	152.6	-177	-69.3	174.7	-153.2	0	0	112.2	E76 S79 F105 K109	E76-E81 VanDerWaalsContact CA-O 3.24Å; E76-E81 WeakPolarHBondContact CA-O 3.27Å; E76-E81 WeakPolarHBondContact CB-O 3.42Å; E76-E81 WeakPolarHBondContact CG-O 3.27Å; S79-E81 PolarHBondContact O-N 3.41Å; S79-E81 PolarHBondContact OG-N 3.38Å; E81-F105 HydrophobicContact CB-CE2 4.37Å; E81-F105 HydrophobicContact CB-CZ 4.28Å; E81-K109 IonicContact OE1-NZ 2.73Å; E81-K109 PolarHBondContact OE1-NZ 3.45Å; E81-K109 WeakPolarHBondContact OE2-CE 3.31Å; E81-K109 IonicContact OE2-NZ 2.63Å; E81-K109 PolarHBondContact OE2-NZ 3.1Å
82	R	81.5	Confident	83.8	Confident	208 Å²	208	80.1 Å²	80.1	79%	0.785	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-90.8	130.5	176.2	-68.6	-62.6	-170.9	178.6	-2.6	111.5	E76	E76-R82 WeakPolarHBondContact OE1-CA 3.24Å; E76-R82 WeakPolarHBondContact OE2-CD 3.44Å; E76-R82 IonicContact OE2-CZ 3.19Å; E76-R82 IonicContact OE2-NE 3.25Å; E76-R82 IonicContact OE2-NH1 3.36Å; E76-R82 PolarHBondContact OE2-NH1 3.19Å
83	L	84.9	Confident	83.6	Confident	15 Å²	15	83.3 Å²	83.3	8%	0.079	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-86.7	162.3	176.8	-88.8	77.8	0	0	0	111.3	M72 L75 E76 F105	M72-L83 HydrophobicContact CB-CD2 4.16Å; M72-L83 HydrophobicContact CE-CB 4.05Å; M72-L83 HydrophobicContact CE-CD2 4.25Å; M72-L83 HydrophobicContact CG-CD2 4.15Å; L75-L83 HydrophobicContact CB-CD1 4.05Å; L75-L83 HydrophobicContact CB-CD2 4.16Å; L75-L83 HydrophobicContact CD1-CD2 4.06Å; E76-L83 HydrophobicContact CG-CB 4.17Å; E76-L83 HydrophobicContact CG-CD1 3.67Å; E76-L83 HydrophobicContact CG-CG 4.48Å; E76-L83 PolarHBondContact OE1-N 3.06Å; L83-F105 HydrophobicContact CD1-CD1 4.04Å; L83-F105 HydrophobicContact CD1-CD2 3.88Å; L83-F105 HydrophobicContact CD1-CE1 4.01Å; L83-F105 HydrophobicContact CD1-CE2 3.86Å; L83-F105 HydrophobicContact CD1-CG 3.96Å; L83-F105 HydrophobicContact CD1-CZ 3.92Å; L83-F105 HydrophobicContact CD2-CB 3.94Å; L83-F105 HydrophobicContact CD2-CD1 4.36Å; L83-F105 HydrophobicContact CD2-CD2 4.49Å; L83-F105 HydrophobicContact CD2-CG 4.02Å; L83-F105 HydrophobicContact CG-CB 4.29Å; L83-F105 HydrophobicContact CG-CD1 4.48Å; L83-F105 HydrophobicContact CG-CD2 3.96Å; L83-F105 HydrophobicContact CG-CE2 4.4Å; L83-F105 HydrophobicContact CG-CG 3.99Å
84	P	83.6	Confident	83.5	Confident	80 Å²	80	83.2 Å²	83.2	52%	0.519	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-57.4	147.7	174.5	-24.5	34.8	0	0	0	112.4	M72 K101	M72-P84 WeakPolarHBondContact CE-O 3.31Å; P84-K101 HydrophobicContact CB-CD 4.49Å
85	K	82.4	Confident	83.5	Confident	192 Å²	192	86.5 Å²	86.5	84%	0.835	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-57.5	130.9	-175.1	-70.8	-177.3	179.9	175.8	0	112.2	K101	K85-K101 PolarHBondContact O-NZ 3.09Å
86	P	85.1	Confident	83.5	Confident	60 Å²	60	87.2 Å²	87.2	39%	0.39	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-75.8	152	179.7	29.4	-34.8	0	0	0	112.7	L69 M72	L69-P86 HydrophobicContact CD2-CB 3.44Å; L69-P86 VanDerWaalsContact CD2-CB 3.44Å; L69-P86 HydrophobicContact CD2-CG 4.03Å; M72-P86 HydrophobicContact CE-CB 4.45Å; M72-P86 HydrophobicContact SD-CB 4.04Å
87	E	83.7	Confident	83.5	Confident	60 Å²	60	88.2 Å²	88.2	28%	0.28	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-85.1	129.4	173.3	-75.1	157.6	-127	0	0	110.4	H94 N97 N98 K101	E87-H94 HydrophobicContact CB-CB 4.08Å; E87-H94 IonicContact OE2-CD2 2.64Å; E87-N97 WeakPolarHBondContact OE1-CB 3.1Å; E87-N97 WeakPolarHBondContact OE2-CB 3.49Å; E87-N97 PolarHBondContact OE2-ND2 3.4Å; E87-N98 PolarHBondContact N-OD1 2.66Å; E87-N98 PolarHBondContact O-ND2 2.91Å; E87-K101 IonicContact OE1-NZ 2.71Å; E87-K101 PolarHBondContact OE1-NZ 2.7Å
88	R	76.4	Confident	83.7	Confident	233 Å²	233	86.2 Å²	86.2	88%	0.879	43%	0.425	S	S	*	.			trans	-96.1	11.4	-173.9	-63.6	-176.7	174.6	-174	-3.3	114.4
89	G	74.9	Confident	83.8	Confident	30 Å²	30	84.8 Å²	84.8	31%	0.309	42%	0.418	S	S	.	.			trans	-81.3	146.4	-176.1	0	0	0	0	0	113.2	H94	G89-H94 WeakPolarHBondContact CA-ND1 3.3Å; G89-H94 WeakPolarHBondContact O-CB 3.31Å
90	K	76	Confident	84.2	Confident	201 Å²	201	86.1 Å²	86.1	87%	0.874	42%	0.422	S	S	*	.			trans	-80.5	-15.2	-175.4	-66.4	-174	177.4	-176.2	0	115.4
91	M	83.3	Confident	84.6	Confident	130 Å²	130	84.9 Å²	84.9	64%	0.64	40%	0.396	S	S	*	.	S	Bend	trans	-68.1	147.7	-179.9	-59.4	171.6	66.7	0	0	112.2	V93 H94	M91-V93 HydrophobicContact CB-CG1 4.1Å; M91-V93 PolarHBondContact O-N 3.48Å; M91-V93 VanDerWaalsContact O-N 3.11Å; M91-H94 PolarHBondContact O-N 3.34Å
92	R	85.8	Confident	84.8	Confident	110 Å²	110	80.5 Å²	80.5	42%	0.415	38%	0.376	S	S	.	.	H	α-helix	trans	-50	-37.5	180	-171.3	176.2	175.6	-86.3	2.7	113.3	H94 K95 I96 E119 V122 D123	R92-H94 PolarHBondContact O-N 3.29Å; R92-K95 WeakPolarHBondContact O-CB 2.98Å; R92-K95 PolarHBondContact O-N 2.76Å; R92-I96 HydrophobicContact CG-CD1 3.93Å; R92-I96 VanDerWaalsContact NH1-CD1 3.31Å; R92-I96 WeakPolarHBondContact O-CG1 3.26Å; R92-I96 PolarHBondContact O-N 3.45Å; R92-E119 IonicContact CZ-OE2 3.68Å; R92-E119 IonicContact NH1-OE2 2.7Å; R92-E119 PolarHBondContact NH1-OE2 3.46Å; R92-E119 IonicContact NH2-OE2 3.94Å; R92-E119 PolarHBondContact NH2-OE2 2.65Å; R92-V122 HydrophobicContact CG-CG1 3.89Å; R92-D123 IonicContact CZ-OD1 2.81Å; R92-D123 IonicContact CZ-OD2 2.72Å; R92-D123 IonicContact NE-OD1 3.63Å; R92-D123 PolarHBondContact NE-OD1 3.38Å; R92-D123 IonicContact NE-OD2 3.71Å; R92-D123 IonicContact NH2-OD1 2.65Å; R92-D123 PolarHBondContact NH2-OD1 3.1Å; R92-D123 VanDerWaalsContact NH2-OD1 3.08Å; R92-D123 IonicContact NH2-OD2 2.7Å; R92-D123 PolarHBondContact NH2-OD2 3.37Å
93	V	84.9	Confident	85.2	Confident	73 Å²	73	71.1 Å²	71.1	44%	0.442	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-41.2	178.1	65.8	0	0	0	0	113.8	M91 K95 I96 N97	M91-V93 HydrophobicContact CB-CG1 4.1Å; M91-V93 PolarHBondContact O-N 3.48Å; M91-V93 VanDerWaalsContact O-N 3.11Å; V93-K95 VanDerWaalsContact C-N 3.32Å; V93-K95 PolarHBondContact O-N 3.29Å; V93-I96 PolarHBondContact O-N 3.47Å; V93-N97 VanDerWaalsContact O-CG 3.29Å; V93-N97 PolarHBondContact O-N 3.43Å; V93-N97 PolarHBondContact O-OD1 3.04Å
94	H	86.4	Confident	85.3	Confident	51 Å²	51	75.6 Å²	75.6	24%	0.236	37%	0.365	C	S	.	.	H	α-helix	trans	-68.7	-34.4	179	-52.8	114.1	0	0	0	111.7	E87 G89 M91 R92 N97 N98	E87-H94 HydrophobicContact CB-CB 4.08Å; E87-H94 IonicContact OE2-CD2 2.64Å; G89-H94 WeakPolarHBondContact CA-ND1 3.3Å; G89-H94 WeakPolarHBondContact O-CB 3.31Å; M91-H94 PolarHBondContact O-N 3.34Å; R92-H94 PolarHBondContact O-N 3.29Å; H94-N97 PolarHBondContact O-N 2.77Å; H94-N98 VanDerWaalsContact O-CG 3.3Å; H94-N98 PolarHBondContact O-N 3.12Å; H94-N98 PolarHBondContact O-ND2 3.26Å
95	K	89.1	Confident	85.5	Confident	69 Å²	69	72.8 Å²	72.8	30%	0.3	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-45.2	174.5	-61.7	-172.4	164.4	-157.1	0	110.8	R66 D67 R92 V93 N97 N98 V99 V122	R66-K95 WeakPolarHBondContact O-CB 3.4Å; R66-K95 WeakPolarHBondContact O-CD 3.16Å; D67-K95 HydrophobicContact CB-CD 4.3Å; D67-K95 HydrophobicContact CB-CG 4.2Å; R92-K95 WeakPolarHBondContact O-CB 2.98Å; R92-K95 PolarHBondContact O-N 2.76Å; V93-K95 VanDerWaalsContact C-N 3.32Å; V93-K95 PolarHBondContact O-N 3.29Å; K95-N97 VanDerWaalsContact C-N 3.35Å; K95-N97 PolarHBondContact O-N 2.84Å; K95-N98 PolarHBondContact O-N 3.19Å; K95-V99 WeakPolarHBondContact O-CG2 3.05Å; K95-V99 PolarHBondContact O-N 2.82Å; K95-V122 HydrophobicContact CB-CG1 3.82Å; K95-V122 HydrophobicContact CB-CG2 3.97Å; K95-V122 HydrophobicContact CD-CG1 4.25Å
96	I	87.4	Confident	85.7	Confident	16 Å²	16	63.7 Å²	63.7	8%	0.082	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-43.6	175.1	-68.2	162.2	0	0	0	110.8	R92 V93 N98 V99 N100 A118 V122	R92-I96 HydrophobicContact CG-CD1 3.93Å; R92-I96 VanDerWaalsContact NH1-CD1 3.31Å; R92-I96 WeakPolarHBondContact O-CG1 3.26Å; R92-I96 PolarHBondContact O-N 3.45Å; V93-I96 PolarHBondContact O-N 3.47Å; I96-N98 VanDerWaalsContact C-N 3.35Å; I96-N98 PolarHBondContact O-N 3.36Å; I96-V99 PolarHBondContact O-N 2.54Å; I96-N100 WeakPolarHBondContact CG2-ND2 3.44Å; I96-N100 WeakPolarHBondContact O-CB 3.46Å; I96-N100 PolarHBondContact O-N 2.81Å; I96-N100 PolarHBondContact O-ND2 3.26Å; I96-A118 HydrophobicContact CG2-CB 4.2Å; I96-V122 HydrophobicContact CG1-CB 4.09Å; I96-V122 HydrophobicContact CG1-CG1 4.14Å; I96-V122 HydrophobicContact CG1-CG2 3.81Å
97	N	88.8	Confident	85.7	Confident	55 Å²	55	63.1 Å²	63.1	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-40	176.2	-69.7	-11.9	0	0	0	112.9	E87 V93 H94 K95 K101	E87-N97 WeakPolarHBondContact OE1-CB 3.1Å; E87-N97 WeakPolarHBondContact OE2-CB 3.49Å; E87-N97 PolarHBondContact OE2-ND2 3.4Å; V93-N97 VanDerWaalsContact O-CG 3.29Å; V93-N97 PolarHBondContact O-N 3.43Å; V93-N97 PolarHBondContact O-OD1 3.04Å; H94-N97 PolarHBondContact O-N 2.77Å; K95-N97 VanDerWaalsContact C-N 3.35Å; K95-N97 PolarHBondContact O-N 2.84Å; N97-K101 VanDerWaalsContact O-CG 3.3Å; N97-K101 WeakPolarHBondContact O-CG 3.32Å; N97-K101 PolarHBondContact O-N 3.05Å; N97-K101 VanDerWaalsContact O-N 3.09Å
98	N	90.1	Very high	85.7	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-68.3	-43.6	176.3	-67.9	-21.2	0	0	0	112.2	D67 L69 M72 E87 H94 K95 I96 K101 A102	D67-N98 WeakPolarHBondContact O-CB 3.44Å; D67-N98 PolarHBondContact O-ND2 3.13Å; D67-N98 VanDerWaalsContact O-ND2 3.09Å; L69-N98 WeakPolarHBondContact CD2-ND2 3.04Å; M72-N98 HydrophobicContact SD-CB 4.02Å; E87-N98 PolarHBondContact N-OD1 2.66Å; E87-N98 PolarHBondContact O-ND2 2.91Å; H94-N98 VanDerWaalsContact O-CG 3.3Å; H94-N98 PolarHBondContact O-N 3.12Å; H94-N98 PolarHBondContact O-ND2 3.26Å; K95-N98 PolarHBondContact O-N 3.19Å; I96-N98 VanDerWaalsContact C-N 3.35Å; I96-N98 PolarHBondContact O-N 3.36Å; N98-K101 PolarHBondContact O-N 3.41Å; N98-A102 PolarHBondContact O-N 3Å; N98-A102 VanDerWaalsContact O-N 3.15Å
99	V	89.4	Confident	86	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-41	176.1	175.4	0	0	0	0	110.9	K95 I96 K101 A102 L103 A118 I121 V122	K95-V99 WeakPolarHBondContact O-CG2 3.05Å; K95-V99 PolarHBondContact O-N 2.82Å; I96-V99 PolarHBondContact O-N 2.54Å; V99-K101 PolarHBondContact O-N 2.94Å; V99-A102 WeakPolarHBondContact O-CB 3.41Å; V99-A102 PolarHBondContact O-N 2.85Å; V99-A102 VanDerWaalsContact O-N 3.11Å; V99-L103 HydrophobicContact CG1-CD1 3.98Å; V99-L103 HydrophobicContact CG1-CG 4.09Å; V99-L103 WeakPolarHBondContact O-CG 3.24Å; V99-L103 PolarHBondContact O-N 2.87Å; V99-A118 HydrophobicContact CB-CB 3.97Å; V99-A118 HydrophobicContact CG1-CB 3.62Å; V99-I121 HydrophobicContact CG1-CB 3.95Å; V99-I121 HydrophobicContact CG1-CG1 4.13Å; V99-I121 HydrophobicContact CG1-CG2 4.18Å; V99-I121 HydrophobicContact CG2-CG2 4.23Å; V99-V122 HydrophobicContact CB-CG2 4.3Å; V99-V122 HydrophobicContact CG2-CG2 3.78Å
100	N	89.8	Confident	86	Confident	60 Å²	60	57.2 Å²	57.2	32%	0.321	30%	0.304	S	S	.	.	H	α-helix	trans	-57.1	-48.4	173.5	-79.5	-31	0	0	0	111.5	I96 A102 L103 D104 A118	I96-N100 WeakPolarHBondContact CG2-ND2 3.44Å; I96-N100 WeakPolarHBondContact O-CB 3.46Å; I96-N100 PolarHBondContact O-N 2.81Å; I96-N100 PolarHBondContact O-ND2 3.26Å; N100-A102 PolarHBondContact O-N 2.67Å; N100-L103 PolarHBondContact O-N 3.27Å; N100-L103 VanDerWaalsContact O-N 3.08Å; N100-D104 WeakPolarHBondContact O-CB 3.37Å; N100-D104 VanDerWaalsContact O-CG 3.23Å; N100-D104 PolarHBondContact O-N 2.94Å; N100-A118 WeakPolarHBondContact OD1-CB 3.47Å
101	K	89.3	Confident	86.2	Confident	45 Å²	45	48.4 Å²	48.4	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-56.2	-35.8	175.5	-70.2	164.4	-169.1	166.5	0	112.9	M72 P84 K85 E87 N97 N98 V99 F105	M72-K101 HydrophobicContact CE-CB 3.78Å; M72-K101 HydrophobicContact CE-CD 4.05Å; M72-K101 HydrophobicContact SD-CB 4.22Å; P84-K101 HydrophobicContact CB-CD 4.49Å; K85-K101 PolarHBondContact O-NZ 3.09Å; E87-K101 IonicContact OE1-NZ 2.71Å; E87-K101 PolarHBondContact OE1-NZ 2.7Å; N97-K101 VanDerWaalsContact O-CG 3.3Å; N97-K101 WeakPolarHBondContact O-CG 3.32Å; N97-K101 PolarHBondContact O-N 3.05Å; N97-K101 VanDerWaalsContact O-N 3.09Å; N98-K101 PolarHBondContact O-N 3.41Å; V99-K101 PolarHBondContact O-N 2.94Å; K101-F105 PolarHBondContact O-N 3.25Å
102	A	88.9	Confident	85.8	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-71.7	-45.1	174.7	0	0	0	0	0	112.4	L71 M72 L75 N98 V99 N100 F105 I106	L71-A102 HydrophobicContact CD2-CB 3.64Å; L71-A102 HydrophobicContact CG-CB 3.85Å; M72-A102 HydrophobicContact CG-CB 3.91Å; L75-A102 HydrophobicContact CD1-CB 3.67Å; N98-A102 PolarHBondContact O-N 3Å; N98-A102 VanDerWaalsContact O-N 3.15Å; V99-A102 WeakPolarHBondContact O-CB 3.41Å; V99-A102 PolarHBondContact O-N 2.85Å; V99-A102 VanDerWaalsContact O-N 3.11Å; N100-A102 PolarHBondContact O-N 2.67Å; A102-F105 PolarHBondContact O-N 3.13Å; A102-I106 WeakPolarHBondContact O-CD1 3.39Å; A102-I106 VanDerWaalsContact O-CG1 3.25Å; A102-I106 WeakPolarHBondContact O-CG1 3.48Å; A102-I106 PolarHBondContact O-N 2.91Å
103	L	88.6	Confident	85.4	Confident	11 Å²	11	47.9 Å²	47.9	6%	0.058	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-39.3	178.1	-66.4	-180	0	0	0	112	V99 N100 I106 A107 L113 I116 A118 M132	V99-L103 HydrophobicContact CG1-CD1 3.98Å; V99-L103 HydrophobicContact CG1-CG 4.09Å; V99-L103 WeakPolarHBondContact O-CG 3.24Å; V99-L103 PolarHBondContact O-N 2.87Å; N100-L103 PolarHBondContact O-N 3.27Å; N100-L103 VanDerWaalsContact O-N 3.08Å; L103-I106 HydrophobicContact CD2-CD1 4.33Å; L103-I106 PolarHBondContact O-N 3.33Å; L103-A107 WeakPolarHBondContact O-CB 3.45Å; L103-A107 PolarHBondContact O-N 3.03Å; L103-L113 HydrophobicContact CB-CD1 3.88Å; L103-L113 HydrophobicContact CD2-CD1 3.87Å; L103-L113 HydrophobicContact CD2-CD2 4.38Å; L103-L113 HydrophobicContact CG-CD1 4.39Å; L103-L113 WeakPolarHBondContact O-CD1 3.4Å; L103-I116 HydrophobicContact CD2-CG2 4.46Å; L103-A118 HydrophobicContact CD1-CB 4.01Å; L103-M132 HydrophobicContact CD2-CG 4.11Å; L103-M132 HydrophobicContact CD2-SD 3.76Å
104	D	87.3	Confident	84.6	Confident	109 Å²	109	49.8 Å²	49.8	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-61.3	-43.2	174.1	-69.8	-29.1	0	0	0	111.1	N100 A107 S108	N100-D104 WeakPolarHBondContact O-CB 3.37Å; N100-D104 VanDerWaalsContact O-CG 3.23Å; N100-D104 PolarHBondContact O-N 2.94Å; D104-A107 PolarHBondContact O-N 2.72Å; D104-S108 WeakPolarHBondContact O-CB 3.29Å; D104-S108 PolarHBondContact O-N 3.43Å
105	F	87.9	Confident	84	Confident	21 Å²	21	52 Å²	52	9%	0.092	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-46.7	174.2	-176.4	-96.5	0	0	0	111.4	L75 S79 E81 L83 K101 A102 A107 S108 K109 F140	L75-F105 HydrophobicContact CB-CD1 4Å; L75-F105 HydrophobicContact CB-CE1 4.1Å; L75-F105 HydrophobicContact CD1-CD1 4.09Å; L75-F105 HydrophobicContact CD2-CD1 4.3Å; L75-F105 HydrophobicContact CG-CD1 4.36Å; S79-F105 WeakPolarHBondContact OG-CZ 3.34Å; E81-F105 HydrophobicContact CB-CE2 4.37Å; E81-F105 HydrophobicContact CB-CZ 4.28Å; L83-F105 HydrophobicContact CD1-CD1 4.04Å; L83-F105 HydrophobicContact CD1-CD2 3.88Å; L83-F105 HydrophobicContact CD1-CE1 4.01Å; L83-F105 HydrophobicContact CD1-CE2 3.86Å; L83-F105 HydrophobicContact CD1-CG 3.96Å; L83-F105 HydrophobicContact CD1-CZ 3.92Å; L83-F105 HydrophobicContact CD2-CB 3.94Å; L83-F105 HydrophobicContact CD2-CD1 4.36Å; L83-F105 HydrophobicContact CD2-CD2 4.49Å; L83-F105 HydrophobicContact CD2-CG 4.02Å; L83-F105 HydrophobicContact CG-CB 4.29Å; L83-F105 HydrophobicContact CG-CD1 4.48Å; L83-F105 HydrophobicContact CG-CD2 3.96Å; L83-F105 HydrophobicContact CG-CE2 4.4Å; L83-F105 HydrophobicContact CG-CG 3.99Å; K101-F105 PolarHBondContact O-N 3.25Å; A102-F105 PolarHBondContact O-N 3.13Å; F105-A107 VanDerWaalsContact C-N 3.34Å; F105-A107 PolarHBondContact O-N 3.05Å; F105-S108 PolarHBondContact O-N 3.41Å; F105-S108 PolarHBondContact O-OG 3.26Å; F105-K109 HydrophobicContact CD1-CG 4.43Å; F105-K109 HydrophobicContact CE1-CG 4.13Å; F105-K109 HydrophobicContact CZ-CD 4.48Å; F105-K109 VanDerWaalsContact CZ-CE 3.43Å; F105-K109 HydrophobicContact CZ-CG 4.28Å; F105-K109 WeakPolarHBondContact O-CG 3.31Å; F105-K109 PolarHBondContact O-N 2.8Å; F105-K109 VanDerWaalsContact O-N 3.16Å; F105-F140 HydrophobicContact CE1-CZ 4.28Å
106	I	86.2	Confident	83.6	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-44.7	176.8	-69.3	159.8	0	0	0	111.1	L75 A102 L103 K109 V111 L113 I136	L75-I106 HydrophobicContact CD1-CD1 3.92Å; L75-I106 HydrophobicContact CD1-CG1 3.85Å; L75-I106 HydrophobicContact CD2-CD1 4.07Å; L75-I106 HydrophobicContact CD2-CG1 3.65Å; L75-I106 HydrophobicContact CG-CG1 4.42Å; A102-I106 WeakPolarHBondContact O-CD1 3.39Å; A102-I106 VanDerWaalsContact O-CG1 3.25Å; A102-I106 WeakPolarHBondContact O-CG1 3.48Å; A102-I106 PolarHBondContact O-N 2.91Å; L103-I106 HydrophobicContact CD2-CD1 4.33Å; L103-I106 PolarHBondContact O-N 3.33Å; I106-K109 PolarHBondContact O-N 3.48Å; I106-V111 HydrophobicContact CG2-CB 3.58Å; I106-V111 HydrophobicContact CG2-CG1 3.74Å; I106-V111 HydrophobicContact CG2-CG2 3.89Å; I106-V111 WeakPolarHBondContact O-CB 3.38Å; I106-V111 PolarHBondContact O-N 2.7Å; I106-L113 HydrophobicContact CB-CD1 4.46Å; I106-L113 HydrophobicContact CG2-CD1 4.2Å; I106-L113 HydrophobicContact CG2-CD2 4.01Å; I106-L113 HydrophobicContact CG2-CG 4.25Å; I106-I136 HydrophobicContact CD1-CD1 3.6Å; I106-I136 HydrophobicContact CD1-CG1 3.78Å; I106-I136 HydrophobicContact CG1-CD1 4.33Å; I106-I136 HydrophobicContact CG1-CG1 4.07Å
107	A	85	Confident	83.4	Confident	49 Å²	49	50.8 Å²	50.8	41%	0.405	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-43	175.7	0	0	0	0	0	111.8	L103 D104 F105 K109 G110 L113	L103-A107 WeakPolarHBondContact O-CB 3.45Å; L103-A107 PolarHBondContact O-N 3.03Å; D104-A107 PolarHBondContact O-N 2.72Å; F105-A107 VanDerWaalsContact C-N 3.34Å; F105-A107 PolarHBondContact O-N 3.05Å; A107-K109 PolarHBondContact O-N 3.19Å; A107-G110 PolarHBondContact O-N 2.84Å; A107-L113 HydrophobicContact CB-CD1 4.43Å
108	S	84.9	Confident	83.2	Confident	85 Å²	85	48.4 Å²	48.4	59%	0.594	29%	0.291	S	S	*	.	H	α-helix	trans	-60.7	-27	177.3	81.5	0	0	0	0	113.4	D104 F105 G110	D104-S108 WeakPolarHBondContact O-CB 3.29Å; D104-S108 PolarHBondContact O-N 3.43Å; F105-S108 PolarHBondContact O-N 3.41Å; F105-S108 PolarHBondContact O-OG 3.26Å; S108-G110 PolarHBondContact O-N 2.86Å
109	K	81.3	Confident	83	Confident	57 Å²	57	52.5 Å²	52.5	25%	0.248	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	10.6	177.2	-60.9	-67.6	178.6	-171.4	0	113.5	E81 F105 I106 A107 R139 F140	E81-K109 IonicContact OE1-NZ 2.73Å; E81-K109 PolarHBondContact OE1-NZ 3.45Å; E81-K109 WeakPolarHBondContact OE2-CE 3.31Å; E81-K109 IonicContact OE2-NZ 2.63Å; E81-K109 PolarHBondContact OE2-NZ 3.1Å; F105-K109 HydrophobicContact CD1-CG 4.43Å; F105-K109 HydrophobicContact CE1-CG 4.13Å; F105-K109 HydrophobicContact CZ-CD 4.48Å; F105-K109 VanDerWaalsContact CZ-CE 3.43Å; F105-K109 HydrophobicContact CZ-CG 4.28Å; F105-K109 WeakPolarHBondContact O-CG 3.31Å; F105-K109 PolarHBondContact O-N 2.8Å; F105-K109 VanDerWaalsContact O-N 3.16Å; I106-K109 PolarHBondContact O-N 3.48Å; A107-K109 PolarHBondContact O-N 3.19Å; K109-R139 PolarHBondContact O-NE 3.09Å; K109-F140 HydrophobicContact CB-CZ 3.95Å; K109-F140 HydrophobicContact CG-CE1 4.43Å; K109-F140 HydrophobicContact CG-CZ 3.9Å
110	G	76.5	Confident	82.9	Confident	57 Å²	57	56.1 Å²	56.1	59%	0.588	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.9	13.4	171	0	0	0	0	0	115.2	A107 S108	A107-G110 PolarHBondContact O-N 2.84Å; S108-G110 PolarHBondContact O-N 2.86Å
111	V	79.1	Confident	82.8	Confident	16 Å²	16	53.3 Å²	53.3	10%	0.097	31%	0.312	C	S	.	.			trans	-89.1	126	-178.2	-178.7	0	0	0	0	111.3	I106 L113 T135 R139	I106-V111 HydrophobicContact CG2-CB 3.58Å; I106-V111 HydrophobicContact CG2-CG1 3.74Å; I106-V111 HydrophobicContact CG2-CG2 3.89Å; I106-V111 WeakPolarHBondContact O-CB 3.38Å; I106-V111 PolarHBondContact O-N 2.7Å; V111-L113 HydrophobicContact CG1-CD2 4.27Å; V111-L113 PolarHBondContact O-N 2.77Å; V111-T135 HydrophobicContact CG1-CG2 4.37Å; V111-R139 HydrophobicContact CG2-CB 3.59Å; V111-R139 HydrophobicContact CG2-CG 3.63Å
112	K	75.1	Confident	82.7	Confident	184 Å²	184	51.4 Å²	51.4	80%	0.8	30%	0.304	S	S	*	.			trans	-82	97.4	174.3	-68.8	-176.7	179.4	177.8	0	111.1	V114	K112-V114 VanDerWaalsContact C-N 3.34Å; K112-V114 HydrophobicContact CB-CG2 4.41Å; K112-V114 PolarHBondContact O-N 3.2Å
113	L	76.8	Confident	82.6	Confident	44 Å²	44	55.4 Å²	55.4	23%	0.23	33%	0.326	C	S	.	.			trans	-78.5	76.7	174.2	-64.8	171.5	0	0	0	111.2	L103 I106 A107 V111 I116	L103-L113 HydrophobicContact CB-CD1 3.88Å; L103-L113 HydrophobicContact CD2-CD1 3.87Å; L103-L113 HydrophobicContact CD2-CD2 4.38Å; L103-L113 HydrophobicContact CG-CD1 4.39Å; L103-L113 WeakPolarHBondContact O-CD1 3.4Å; I106-L113 HydrophobicContact CB-CD1 4.46Å; I106-L113 HydrophobicContact CG2-CD1 4.2Å; I106-L113 HydrophobicContact CG2-CD2 4.01Å; I106-L113 HydrophobicContact CG2-CG 4.25Å; A107-L113 HydrophobicContact CB-CD1 4.43Å; V111-L113 HydrophobicContact CG1-CD2 4.27Å; V111-L113 PolarHBondContact O-N 2.77Å; L113-I116 HydrophobicContact CD2-CD1 4.35Å
114	V	68.9	Low	82.3	Confident	113 Å²	113	56 Å²	56	69%	0.685	33%	0.334	S	S	*	.			trans	-82.7	125.3	175.1	-174.4	0	0	0	0	109.5	K112 I116	K112-V114 VanDerWaalsContact C-N 3.34Å; K112-V114 HydrophobicContact CB-CG2 4.41Å; K112-V114 PolarHBondContact O-N 3.2Å; V114-I116 VanDerWaalsContact C-N 3.27Å; V114-I116 PolarHBondContact O-N 3.45Å
115	S	73.7	Confident	82.3	Confident	97 Å²	97	53.2 Å²	53.2	68%	0.678	32%	0.32	S	S	*	.	S	Bend	trans	63.5	15.8	177.4	-52.1	0	0	0	0	117	M128	S115-M128 VanDerWaalsContact O-CE 3.32Å; S115-M128 WeakPolarHBondContact O-CE 3.13Å
116	I	81	Confident	82	Confident	27 Å²	27	53.2 Å²	53.2	14%	0.138	32%	0.323	C	S	.	.			trans	-109.8	111.2	174.5	-58.3	173.6	0	0	0	109	L103 L113 V114 I121 M128 M132	L103-I116 HydrophobicContact CD2-CG2 4.46Å; L113-I116 HydrophobicContact CD2-CD1 4.35Å; V114-I116 VanDerWaalsContact C-N 3.27Å; V114-I116 PolarHBondContact O-N 3.45Å; I116-I121 HydrophobicContact CG2-CD1 4.19Å; I116-I121 HydrophobicContact CG2-CG1 4.49Å; I116-M128 HydrophobicContact CG1-SD 4.36Å; I116-M132 HydrophobicContact CD1-CB 4.18Å; I116-M132 HydrophobicContact CG2-CB 4.28Å
117	G	82.1	Confident	81.9	Confident	33 Å²	33	58.1 Å²	58.1	34%	0.34	35%	0.345	S	S	.	.			trans	-108.5	155.2	173.7	0	0	0	0	0	112.3	E119 E120	G117-E119 VanDerWaalsContact C-N 3.25Å; G117-E119 PolarHBondContact O-N 3.28Å; G117-E120 WeakPolarHBondContact O-CB 2.98Å; G117-E120 PolarHBondContact O-N 3.35Å; G117-E120 VanDerWaalsContact O-N 3.17Å
118	A	85.8	Confident	81.9	Confident	6 Å²	6	58.3 Å²	58.3	5%	0.05	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-31.9	178.5	0	0	0	0	0	113.6	I96 V99 N100 L103 E120 I121 V122	I96-A118 HydrophobicContact CG2-CB 4.2Å; V99-A118 HydrophobicContact CB-CB 3.97Å; V99-A118 HydrophobicContact CG1-CB 3.62Å; N100-A118 WeakPolarHBondContact OD1-CB 3.47Å; L103-A118 HydrophobicContact CD1-CB 4.01Å; A118-E120 VanDerWaalsContact C-N 3.3Å; A118-E120 PolarHBondContact O-N 2.92Å; A118-I121 PolarHBondContact O-N 3.21Å; A118-V122 WeakPolarHBondContact O-CG2 3.26Å; A118-V122 PolarHBondContact O-N 3.04Å
119	E	86.5	Confident	81.9	Confident	89 Å²	89	54.3 Å²	54.3	42%	0.416	31%	0.31	S	S	.	.	H	α-helix	trans	-54.1	-46.1	173.9	-54.8	-74.9	149	0	0	111.2	R92 G117 I121 V122 D123	R92-E119 IonicContact CZ-OE2 3.68Å; R92-E119 IonicContact NH1-OE2 2.7Å; R92-E119 PolarHBondContact NH1-OE2 3.46Å; R92-E119 IonicContact NH2-OE2 3.94Å; R92-E119 PolarHBondContact NH2-OE2 2.65Å; G117-E119 VanDerWaalsContact C-N 3.25Å; G117-E119 PolarHBondContact O-N 3.28Å; E119-I121 PolarHBondContact O-N 3.04Å; E119-V122 PolarHBondContact O-N 3.43Å; E119-D123 WeakPolarHBondContact O-CB 3.37Å; E119-D123 PolarHBondContact O-N 3.17Å
120	E	86.6	Confident	82.1	Confident	76 Å²	76	51.7 Å²	51.7	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-62.3	-40.1	-178.3	-61.9	-65.7	146.1	0	0	112.6	G117 A118 G124 N125 M128	G117-E120 WeakPolarHBondContact O-CB 2.98Å; G117-E120 PolarHBondContact O-N 3.35Å; G117-E120 VanDerWaalsContact O-N 3.17Å; A118-E120 VanDerWaalsContact C-N 3.3Å; A118-E120 PolarHBondContact O-N 2.92Å; E120-G124 PolarHBondContact O-N 3.38Å; E120-N125 HydrophobicContact CB-CB 4.2Å; E120-N125 WeakPolarHBondContact O-CB 3.16Å; E120-N125 PolarHBondContact O-N 3.22Å; E120-N125 PolarHBondContact OE2-ND2 3.14Å; E120-M128 HydrophobicContact CB-CB 3.92Å; E120-M128 HydrophobicContact CB-CG 3.95Å; E120-M128 HydrophobicContact CG-CG 4.12Å
121	I	87.1	Confident	82.5	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-72.1	-40.4	178.8	-51.3	-60.4	0	0	0	110.4	R66 V99 I116 A118 E119 G124 M128 M132	R66-I121 WeakPolarHBondContact CG-O 3.22Å; V99-I121 HydrophobicContact CG1-CB 3.95Å; V99-I121 HydrophobicContact CG1-CG1 4.13Å; V99-I121 HydrophobicContact CG1-CG2 4.18Å; V99-I121 HydrophobicContact CG2-CG2 4.23Å; I116-I121 HydrophobicContact CG2-CD1 4.19Å; I116-I121 HydrophobicContact CG2-CG1 4.49Å; A118-I121 PolarHBondContact O-N 3.21Å; E119-I121 PolarHBondContact O-N 3.04Å; I121-G124 PolarHBondContact O-N 2.81Å; I121-M128 HydrophobicContact CD1-CB 4.32Å; I121-M132 HydrophobicContact CD1-CB 4.28Å; I121-M132 HydrophobicContact CD1-CE 4.29Å; I121-M132 HydrophobicContact CD1-SD 3.94Å; I121-M132 HydrophobicContact CG1-SD 4.09Å; I121-M132 HydrophobicContact CG2-CE 4.45Å
122	V	88.1	Confident	83	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-71.6	-32.3	179.5	174.9	0	0	0	0	112	R66 R92 K95 I96 V99 A118 E119 G124	R66-V122 VanDerWaalsContact CZ-O 3.29Å; R66-V122 PolarHBondContact NE-O 3.27Å; R66-V122 PolarHBondContact NH2-O 3.17Å; R92-V122 HydrophobicContact CG-CG1 3.89Å; K95-V122 HydrophobicContact CB-CG1 3.82Å; K95-V122 HydrophobicContact CB-CG2 3.97Å; K95-V122 HydrophobicContact CD-CG1 4.25Å; I96-V122 HydrophobicContact CG1-CB 4.09Å; I96-V122 HydrophobicContact CG1-CG1 4.14Å; I96-V122 HydrophobicContact CG1-CG2 3.81Å; V99-V122 HydrophobicContact CB-CG2 4.3Å; V99-V122 HydrophobicContact CG2-CG2 3.78Å; A118-V122 WeakPolarHBondContact O-CG2 3.26Å; A118-V122 PolarHBondContact O-N 3.04Å; E119-V122 PolarHBondContact O-N 3.43Å; V122-G124 VanDerWaalsContact C-N 3.33Å
123	D	85.7	Confident	83.6	Confident	84 Å²	84	40.4 Å²	40.4	45%	0.449	24%	0.237	S	C	.	.	H	α-helix	trans	-81.3	-13.3	176.6	-70.3	-14.6	0	0	0	113.2	R66 R92 E119	R66-D123 VanDerWaalsContact NH2-C 3.28Å; R66-D123 PolarHBondContact NH2-O 3.17Å; R92-D123 IonicContact CZ-OD1 2.81Å; R92-D123 IonicContact CZ-OD2 2.72Å; R92-D123 IonicContact NE-OD1 3.63Å; R92-D123 PolarHBondContact NE-OD1 3.38Å; R92-D123 IonicContact NE-OD2 3.71Å; R92-D123 IonicContact NH2-OD1 2.65Å; R92-D123 PolarHBondContact NH2-OD1 3.1Å; R92-D123 VanDerWaalsContact NH2-OD1 3.08Å; R92-D123 IonicContact NH2-OD2 2.7Å; R92-D123 PolarHBondContact NH2-OD2 3.37Å; E119-D123 WeakPolarHBondContact O-CB 3.37Å; E119-D123 PolarHBondContact O-N 3.17Å
124	G	83.4	Confident	84.2	Confident	23 Å²	23	39.7 Å²	39.7	24%	0.237	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	33.2	171.5	0	0	0	0	0	113.9	E120 I121 V122 A126	E120-G124 PolarHBondContact O-N 3.38Å; I121-G124 PolarHBondContact O-N 2.81Å; V122-G124 VanDerWaalsContact C-N 3.33Å; G124-A126 PolarHBondContact O-N 2.92Å; G124-A126 VanDerWaalsContact O-N 3.08Å
125	N	86.2	Confident	84.9	Confident	52 Å²	52	35.7 Å²	35.7	28%	0.278	21%	0.208	S	C	.	.			trans	-69.2	106	175.6	-173.8	-26.9	0	0	0	110.4	E120 K127 M128 T129	E120-N125 HydrophobicContact CB-CB 4.2Å; E120-N125 WeakPolarHBondContact O-CB 3.16Å; E120-N125 PolarHBondContact O-N 3.22Å; E120-N125 PolarHBondContact OE2-ND2 3.14Å; N125-K127 VanDerWaalsContact C-N 3.35Å; N125-K127 PolarHBondContact O-N 3.45Å; N125-K127 PolarHBondContact OD1-N 2.92Å; N125-K127 VanDerWaalsContact OD1-N 3.14Å; N125-M128 HydrophobicContact CB-CB 4.14Å; N125-M128 HydrophobicContact CB-CG 4.17Å; N125-M128 WeakPolarHBondContact ND2-CG 3.25Å; N125-M128 PolarHBondContact O-N 2.9Å; N125-M128 PolarHBondContact OD1-N 2.72Å; N125-T129 WeakPolarHBondContact O-CB 3.42Å; N125-T129 PolarHBondContact O-N 3.36Å; N125-T129 PolarHBondContact O-OG1 3.41Å
126	A	81.9	Confident	85.6	Confident	21 Å²	21	31.1 Å²	31.1	17%	0.174	18%	0.175	C	C	.	.	H	α-helix	trans	-43	-55.1	176.7	0	0	0	0	0	113.5	E62 G124 M128 T129 L130	E62-A126 HydrophobicContact CG-CB 4.44Å; E62-A126 WeakPolarHBondContact OE1-CA 3.38Å; E62-A126 WeakPolarHBondContact OE1-CB 3.49Å; G124-A126 PolarHBondContact O-N 2.92Å; G124-A126 VanDerWaalsContact O-N 3.08Å; A126-M128 PolarHBondContact O-N 3.24Å; A126-T129 PolarHBondContact O-N 3.38Å; A126-L130 WeakPolarHBondContact O-CG 3.48Å; A126-L130 PolarHBondContact O-N 3.1Å
127	K	83.3	Confident	85.8	Confident	103 Å²	103	29.8 Å²	29.8	45%	0.448	17%	0.169	S	C	.	.	H	α-helix	trans	-67.3	-40.5	-173.5	-70.6	179.7	172.6	178.1	0	111.9	E36 N125 G131	E36-K127 WeakPolarHBondContact OE1-CE 3.4Å; E36-K127 IonicContact OE1-NZ 3Å; E36-K127 PolarHBondContact OE1-NZ 3.27Å; N125-K127 VanDerWaalsContact C-N 3.35Å; N125-K127 PolarHBondContact O-N 3.45Å; N125-K127 PolarHBondContact OD1-N 2.92Å; N125-K127 VanDerWaalsContact OD1-N 3.14Å; K127-G131 PolarHBondContact O-N 3.18Å
128	M	85.9	Confident	86	Confident	53 Å²	53	31 Å²	31	26%	0.261	17%	0.167	S	C	.	.	H	α-helix	trans	-71.4	-36.5	178.1	-61.1	-55.5	-169.5	0	0	111.7	S115 I116 E120 I121 N125 A126 G131 M132	S115-M128 VanDerWaalsContact O-CE 3.32Å; S115-M128 WeakPolarHBondContact O-CE 3.13Å; I116-M128 HydrophobicContact CG1-SD 4.36Å; E120-M128 HydrophobicContact CB-CB 3.92Å; E120-M128 HydrophobicContact CB-CG 3.95Å; E120-M128 HydrophobicContact CG-CG 4.12Å; I121-M128 HydrophobicContact CD1-CB 4.32Å; N125-M128 HydrophobicContact CB-CB 4.14Å; N125-M128 HydrophobicContact CB-CG 4.17Å; N125-M128 WeakPolarHBondContact ND2-CG 3.25Å; N125-M128 PolarHBondContact O-N 2.9Å; N125-M128 PolarHBondContact OD1-N 2.72Å; A126-M128 PolarHBondContact O-N 3.24Å; M128-G131 PolarHBondContact O-N 2.96Å; M128-M132 WeakPolarHBondContact O-CB 3.46Å; M128-M132 PolarHBondContact O-N 2.83Å
129	T	85.8	Confident	85.9	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-67.4	-47.3	177.4	-52.4	0	0	0	0	111.5	F65 N125 A126 G131 M132 I133	F65-T129 HydrophobicContact CD2-CG2 4.35Å; N125-T129 WeakPolarHBondContact O-CB 3.42Å; N125-T129 PolarHBondContact O-N 3.36Å; N125-T129 PolarHBondContact O-OG1 3.41Å; A126-T129 PolarHBondContact O-N 3.38Å; T129-G131 VanDerWaalsContact C-N 3.33Å; T129-G131 PolarHBondContact O-N 3.46Å; T129-M132 PolarHBondContact O-N 2.72Å; T129-I133 WeakPolarHBondContact O-CG1 3.37Å; T129-I133 PolarHBondContact O-N 3.04Å
130	L	85.3	Confident	85.7	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-37.9	173.4	-65.1	174.7	0	0	0	111.8	Q39 R40 F43 I61 A126 I133 W134	Q39-L130 HydrophobicContact CB-CD1 4.37Å; Q39-L130 HydrophobicContact CB-CD2 4.48Å; R40-L130 HydrophobicContact CB-CD2 4.4Å; F43-L130 HydrophobicContact CD2-CB 4.43Å; F43-L130 HydrophobicContact CD2-CD2 3.83Å; F43-L130 HydrophobicContact CE2-CB 4.41Å; F43-L130 WeakPolarHBondContact CE2-O 3.37Å; I61-L130 HydrophobicContact CD1-CD2 4.29Å; I61-L130 HydrophobicContact CG2-CD2 4.2Å; A126-L130 WeakPolarHBondContact O-CG 3.48Å; A126-L130 PolarHBondContact O-N 3.1Å; L130-I133 PolarHBondContact O-N 2.81Å; L130-W134 WeakPolarHBondContact O-CB 3.48Å; L130-W134 PolarHBondContact O-N 2.85Å
131	G	85.1	Confident	85.5	Confident	20 Å²	20	28.2 Å²	28.2	21%	0.206	15%	0.152	C	C	.	.	H	α-helix	trans	-59.9	-44	174.5	0	0	0	0	0	113.3	K127 M128 T129 T135	K127-G131 PolarHBondContact O-N 3.18Å; M128-G131 PolarHBondContact O-N 2.96Å; T129-G131 VanDerWaalsContact C-N 3.33Å; T129-G131 PolarHBondContact O-N 3.46Å; G131-T135 PolarHBondContact O-N 2.91Å
132	M	88	Confident	85.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66	-45.9	176.4	-179.6	-165.6	67.9	0	0	112.2	L71 L103 I116 I121 M128 T129 W134 T135 I136	L71-M132 HydrophobicContact CD1-CE 3.59Å; L71-M132 HydrophobicContact CD1-SD 4.29Å; L71-M132 HydrophobicContact CD2-CE 3.68Å; L71-M132 HydrophobicContact CD2-SD 3.69Å; L71-M132 HydrophobicContact CG-CE 4.28Å; L103-M132 HydrophobicContact CD2-CG 4.11Å; L103-M132 HydrophobicContact CD2-SD 3.76Å; I116-M132 HydrophobicContact CD1-CB 4.18Å; I116-M132 HydrophobicContact CG2-CB 4.28Å; I121-M132 HydrophobicContact CD1-CB 4.28Å; I121-M132 HydrophobicContact CD1-CE 4.29Å; I121-M132 HydrophobicContact CD1-SD 3.94Å; I121-M132 HydrophobicContact CG1-SD 4.09Å; I121-M132 HydrophobicContact CG2-CE 4.45Å; M128-M132 WeakPolarHBondContact O-CB 3.46Å; M128-M132 PolarHBondContact O-N 2.83Å; T129-M132 PolarHBondContact O-N 2.72Å; M132-W134 VanDerWaalsContact C-N 3.29Å; M132-W134 PolarHBondContact O-N 2.86Å; M132-T135 PolarHBondContact O-N 2.81Å; M132-T135 PolarHBondContact O-OG1 3.39Å; M132-I136 HydrophobicContact CG-CD1 4.3Å; M132-I136 WeakPolarHBondContact O-CG1 3.35Å; M132-I136 PolarHBondContact O-N 2.79Å; M132-I136 VanDerWaalsContact O-N 3.16Å
133	I	88.3	Confident	84.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-35.8	179.4	-61.4	-67.2	0	0	0	110.8	F43 I61 F65 L71 L74 T129 L130 T135 I136 I137	F43-I133 HydrophobicContact CB-CG2 3.81Å; F43-I133 HydrophobicContact CD2-CB 4.28Å; F43-I133 HydrophobicContact CD2-CG2 4.14Å; F43-I133 HydrophobicContact CG-CG2 4.04Å; I61-I133 HydrophobicContact CD1-CG1 4.2Å; F65-I133 HydrophobicContact CD2-CD1 3.94Å; F65-I133 HydrophobicContact CD2-CG1 4.32Å; F65-I133 HydrophobicContact CE2-CD1 3.38Å; F65-I133 HydrophobicContact CE2-CG1 3.94Å; F65-I133 HydrophobicContact CZ-CD1 3.96Å; L71-I133 HydrophobicContact CD1-CD1 4.11Å; L74-I133 HydrophobicContact CD2-CD1 4.41Å; T129-I133 WeakPolarHBondContact O-CG1 3.37Å; T129-I133 PolarHBondContact O-N 3.04Å; L130-I133 PolarHBondContact O-N 2.81Å; I133-T135 PolarHBondContact O-N 3.45Å; I133-I136 HydrophobicContact CD1-CD1 4.19Å; I133-I136 PolarHBondContact O-N 2.9Å; I133-I137 HydrophobicContact CG2-CD1 3.87Å; I133-I137 HydrophobicContact CG2-CG1 4.4Å; I133-I137 VanDerWaalsContact O-CG1 3.32Å; I133-I137 WeakPolarHBondContact O-CG1 3.18Å; I133-I137 PolarHBondContact O-N 2.93Å
134	W	88.6	Confident	84.3	Confident	30 Å²	30	33.8 Å²	33.8	11%	0.114	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-43.8	171.7	171.7	-109.3	0	0	0	113.2	F43 L130 M132 I136 I137 L138 I142 K242 M245	F43-W134 HydrophobicContact CE1-CE3 4.16Å; F43-W134 HydrophobicContact CE2-CB 3.96Å; F43-W134 HydrophobicContact CZ-CB 3.93Å; F43-W134 HydrophobicContact CZ-CD2 4.48Å; F43-W134 AromaticContact CZ-CE3 3.91Å; F43-W134 HydrophobicContact CZ-CE3 3.91Å; L130-W134 WeakPolarHBondContact O-CB 3.48Å; L130-W134 PolarHBondContact O-N 2.85Å; M132-W134 VanDerWaalsContact C-N 3.29Å; M132-W134 PolarHBondContact O-N 2.86Å; W134-I136 VanDerWaalsContact C-N 3.29Å; W134-I136 PolarHBondContact O-N 2.7Å; W134-I137 HydrophobicContact CE3-CG2 4.46Å; W134-I137 HydrophobicContact CZ3-CG2 4.35Å; W134-I137 PolarHBondContact O-N 3.07Å; W134-L138 HydrophobicContact CZ2-CB 4.4Å; W134-L138 HydrophobicContact CZ2-CD1 4.15Å; W134-L138 VanDerWaalsContact O-CB 3.29Å; W134-L138 WeakPolarHBondContact O-CB 3.42Å; W134-L138 PolarHBondContact O-N 2.64Å; W134-I142 HydrophobicContact CH2-CD1 4.23Å; W134-I142 HydrophobicContact CZ3-CD1 4.39Å; W134-K242 HydrophobicContact CB-CD 4.32Å; W134-K242 HydrophobicContact CD2-CB 3.99Å; W134-K242 HydrophobicContact CD2-CD 3.52Å; W134-K242 HydrophobicContact CD2-CG 3.73Å; W134-K242 HydrophobicContact CE3-CB 3.55Å; W134-K242 HydrophobicContact CE3-CD 3.98Å; W134-K242 HydrophobicContact CE3-CG 3.83Å; W134-K242 HydrophobicContact CG-CD 3.65Å; W134-K242 HydrophobicContact CG-CG 4.39Å; W134-K242 HydrophobicContact CH2-CB 3.97Å; W134-K242 HydrophobicContact CH2-CG 3.9Å; W134-K242 HydrophobicContact CZ2-CB 4.39Å; W134-K242 HydrophobicContact CZ2-CD 4.37Å; W134-K242 HydrophobicContact CZ2-CG 3.83Å; W134-K242 HydrophobicContact CZ3-CB 3.54Å; W134-K242 HydrophobicContact CZ3-CG 3.91Å; W134-M245 HydrophobicContact CH2-CB 4.16Å; W134-M245 HydrophobicContact CH2-CE 4.13Å; W134-M245 HydrophobicContact CH2-SD 4.1Å; W134-M245 HydrophobicContact CZ3-CB 4.49Å
135	T	85.4	Confident	83.8	Confident	29 Å²	29	32.7 Å²	32.7	18%	0.178	17%	0.167	C	C	.	.	H	α-helix	trans	-68.8	-30	-179.6	57.2	0	0	0	0	112.4	V111 G131 M132 I133 R139	V111-T135 HydrophobicContact CG1-CG2 4.37Å; G131-T135 PolarHBondContact O-N 2.91Å; M132-T135 PolarHBondContact O-N 2.81Å; M132-T135 PolarHBondContact O-OG1 3.39Å; I133-T135 PolarHBondContact O-N 3.45Å; T135-R139 WeakPolarHBondContact O-CB 3.38Å; T135-R139 PolarHBondContact O-N 2.79Å
136	I	86.5	Confident	82.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.3	-52.4	170	-64.2	165.8	0	0	0	110.6	W46 L71 L75 I78 I106 M132 I133 W134 L138 R139 F140	W46-I136 HydrophobicContact CH2-CG2 4.16Å; W46-I136 HydrophobicContact CZ3-CG2 4.36Å; L71-I136 HydrophobicContact CD1-CD1 3.97Å; L75-I136 HydrophobicContact CD2-CD1 4.13Å; L75-I136 HydrophobicContact CD2-CG1 4.3Å; L75-I136 HydrophobicContact CD2-CG2 4.27Å; I78-I136 HydrophobicContact CD1-CG2 3.34Å; I106-I136 HydrophobicContact CD1-CD1 3.6Å; I106-I136 HydrophobicContact CD1-CG1 3.78Å; I106-I136 HydrophobicContact CG1-CD1 4.33Å; I106-I136 HydrophobicContact CG1-CG1 4.07Å; M132-I136 HydrophobicContact CG-CD1 4.3Å; M132-I136 WeakPolarHBondContact O-CG1 3.35Å; M132-I136 PolarHBondContact O-N 2.79Å; M132-I136 VanDerWaalsContact O-N 3.16Å; I133-I136 HydrophobicContact CD1-CD1 4.19Å; I133-I136 PolarHBondContact O-N 2.9Å; W134-I136 VanDerWaalsContact C-N 3.29Å; W134-I136 PolarHBondContact O-N 2.7Å; I136-L138 VanDerWaalsContact C-N 3.32Å; I136-L138 PolarHBondContact O-N 3.37Å; I136-R139 PolarHBondContact O-N 2.99Å; I136-F140 HydrophobicContact CG2-CD2 3.93Å; I136-F140 HydrophobicContact CG2-CE2 4.4Å; I136-F140 WeakPolarHBondContact O-CD2 3.36Å; I136-F140 PolarHBondContact O-N 3.42Å
137	I	87.3	Confident	81.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-56.3	-48.3	177.7	-68.9	163.5	0	0	0	110.6	F43 W46 I133 W134 R139 A141 I142 T246	F43-I137 HydrophobicContact CD1-CD1 3.4Å; F43-I137 VanDerWaalsContact CD1-CD1 3.4Å; F43-I137 HydrophobicContact CE1-CD1 3.71Å; F43-I137 HydrophobicContact CG-CD1 3.96Å; F43-I137 HydrophobicContact CZ-CD1 4.47Å; W46-I137 HydrophobicContact CD2-CD1 4Å; W46-I137 HydrophobicContact CD2-CG1 3.6Å; W46-I137 HydrophobicContact CE3-CD1 3.9Å; W46-I137 HydrophobicContact CE3-CG1 3.49Å; W46-I137 VanDerWaalsContact CE3-CG1 3.49Å; W46-I137 HydrophobicContact CG-CD1 4.31Å; W46-I137 HydrophobicContact CG-CG1 4.32Å; W46-I137 HydrophobicContact CH2-CG1 3.79Å; W46-I137 HydrophobicContact CZ2-CG1 3.89Å; W46-I137 HydrophobicContact CZ3-CD1 4.41Å; W46-I137 HydrophobicContact CZ3-CG1 3.59Å; I133-I137 HydrophobicContact CG2-CD1 3.87Å; I133-I137 HydrophobicContact CG2-CG1 4.4Å; I133-I137 VanDerWaalsContact O-CG1 3.32Å; I133-I137 WeakPolarHBondContact O-CG1 3.18Å; I133-I137 PolarHBondContact O-N 2.93Å; W134-I137 HydrophobicContact CE3-CG2 4.46Å; W134-I137 HydrophobicContact CZ3-CG2 4.35Å; W134-I137 PolarHBondContact O-N 3.07Å; I137-R139 VanDerWaalsContact C-N 3.34Å; I137-R139 PolarHBondContact O-N 3.45Å; I137-A141 HydrophobicContact CG2-CB 4.46Å; I137-A141 WeakPolarHBondContact O-CA 3.11Å; I137-A141 WeakPolarHBondContact O-CB 3.22Å; I137-A141 PolarHBondContact O-N 3.37Å; I137-I142 HydrophobicContact CG2-CD1 4.27Å; I137-I142 PolarHBondContact O-N 2.85Å; I137-T246 HydrophobicContact CD1-CG2 3.96Å; I137-T246 HydrophobicContact CG1-CG2 4.48Å; I137-T246 HydrophobicContact CG2-CG2 3.9Å
138	L	85.2	Confident	80.7	Confident	58 Å²	58	35.5 Å²	35.5	30%	0.304	19%	0.188	S	C	.	.	I	π-helix	trans	-57.2	-47.4	179.1	-177.6	62.7	0	0	0	110.7	W134 I136 I142 Q143	W134-L138 HydrophobicContact CZ2-CB 4.4Å; W134-L138 HydrophobicContact CZ2-CD1 4.15Å; W134-L138 VanDerWaalsContact O-CB 3.29Å; W134-L138 WeakPolarHBondContact O-CB 3.42Å; W134-L138 PolarHBondContact O-N 2.64Å; I136-L138 VanDerWaalsContact C-N 3.32Å; I136-L138 PolarHBondContact O-N 3.37Å; L138-I142 HydrophobicContact CD1-CB 4.25Å; L138-I142 HydrophobicContact CD1-CG2 4.29Å; L138-I142 CarbonylContact O-C 3.58Å; L138-I142 PolarHBondContact O-N 3.37Å; L138-Q143 VanDerWaalsContact O-CB 3.25Å; L138-Q143 WeakPolarHBondContact O-CB 3.35Å; L138-Q143 PolarHBondContact O-N 3.27Å
139	R	84.7	Confident	79.4	Confident	56 Å²	56	42.4 Å²	42.4	21%	0.211	22%	0.22	C	C	.	.	I	π-helix	trans	-69.9	-46.7	-177.2	179.9	61.9	-168	108.2	-9.5	114.1	K109 V111 T135 I136 I137 D144	K109-R139 PolarHBondContact O-NE 3.09Å; V111-R139 HydrophobicContact CG2-CB 3.59Å; V111-R139 HydrophobicContact CG2-CG 3.63Å; T135-R139 WeakPolarHBondContact O-CB 3.38Å; T135-R139 PolarHBondContact O-N 2.79Å; I136-R139 PolarHBondContact O-N 2.99Å; I137-R139 VanDerWaalsContact C-N 3.34Å; I137-R139 PolarHBondContact O-N 3.45Å; R139-D144 IonicContact CZ-OD1 3.14Å; R139-D144 VanDerWaalsContact NH1-CG 3.34Å; R139-D144 IonicContact NH1-OD1 2.83Å; R139-D144 PolarHBondContact NH1-OD1 3.48Å; R139-D144 IonicContact NH1-OD2 3.08Å; R139-D144 PolarHBondContact NH1-OD2 3.02Å; R139-D144 IonicContact NH2-OD1 2.69Å
140	F	81.9	Confident	78.6	Confident	47 Å²	47	44.7 Å²	44.7	21%	0.206	23%	0.234	C	C	.	.	I	π-helix	trans	-97.2	-21.5	-167.7	-70.7	-84.8	0	0	0	114.3	L75 I78 F105 K109 I136	L75-F140 HydrophobicContact CD2-CE2 4.43Å; I78-F140 HydrophobicContact CD1-CB 4.06Å; I78-F140 HydrophobicContact CD1-CD1 4.32Å; I78-F140 HydrophobicContact CD1-CD2 3.66Å; I78-F140 HydrophobicContact CD1-CE2 4.1Å; I78-F140 HydrophobicContact CD1-CG 3.77Å; I78-F140 HydrophobicContact CG1-CB 4.46Å; I78-F140 HydrophobicContact CG1-CD1 4.19Å; I78-F140 HydrophobicContact CG1-CD2 4.39Å; I78-F140 HydrophobicContact CG1-CG 4.12Å; F105-F140 HydrophobicContact CE1-CZ 4.28Å; K109-F140 HydrophobicContact CB-CZ 3.95Å; K109-F140 HydrophobicContact CG-CE1 4.43Å; K109-F140 HydrophobicContact CG-CZ 3.9Å; I136-F140 HydrophobicContact CG2-CD2 3.93Å; I136-F140 HydrophobicContact CG2-CE2 4.4Å; I136-F140 WeakPolarHBondContact O-CD2 3.36Å; I136-F140 PolarHBondContact O-N 3.42Å
141	A	82.2	Confident	78	Confident	10 Å²	10	47.6 Å²	47.6	8%	0.083	25%	0.254	C	S	.	.	I	π-helix	trans	-112.4	-18.9	179.5	0	0	0	0	0	113.8	W46 I137 H253	W46-A141 HydrophobicContact CZ2-CB 4.18Å; I137-A141 HydrophobicContact CG2-CB 4.46Å; I137-A141 WeakPolarHBondContact O-CA 3.11Å; I137-A141 WeakPolarHBondContact O-CB 3.22Å; I137-A141 PolarHBondContact O-N 3.37Å; A141-H253 PolarHBondContact O-NE2 3.32Å
142	I	81.9	Confident	77.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-119.8	-46.3	-174.3	-54	-177.3	0	0	0	112	W134 I137 L138 D144 I145 A152 L156 M245	W134-I142 HydrophobicContact CH2-CD1 4.23Å; W134-I142 HydrophobicContact CZ3-CD1 4.39Å; I137-I142 HydrophobicContact CG2-CD1 4.27Å; I137-I142 PolarHBondContact O-N 2.85Å; L138-I142 HydrophobicContact CD1-CB 4.25Å; L138-I142 HydrophobicContact CD1-CG2 4.29Å; L138-I142 CarbonylContact O-C 3.58Å; L138-I142 PolarHBondContact O-N 3.37Å; I142-D144 VanDerWaalsContact C-N 3.26Å; I142-D144 PolarHBondContact O-N 3.21Å; I142-D144 VanDerWaalsContact O-N 3.13Å; I142-I145 VanDerWaalsContact O-CB 3.22Å; I142-I145 WeakPolarHBondContact O-CB 3.23Å; I142-I145 VanDerWaalsContact O-CG1 3.32Å; I142-I145 WeakPolarHBondContact O-CG1 3.48Å; I142-I145 PolarHBondContact O-N 3.41Å; I142-A152 HydrophobicContact CG2-CB 4.43Å; I142-A152 WeakPolarHBondContact O-CB 3.42Å; I142-L156 HydrophobicContact CG2-CD2 4.38Å; I142-M245 HydrophobicContact CD1-CB 4.06Å; I142-M245 HydrophobicContact CD1-CE 3.99Å; I142-M245 HydrophobicContact CG2-CE 4.19Å
143	Q	79.9	Confident	77.2	Confident	97 Å²	97	51.5 Å²	51.5	45%	0.453	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.5	-166.8	-173.4	171.1	-21.8	0	0	114.9	L138 I145 A152	L138-Q143 VanDerWaalsContact O-CB 3.25Å; L138-Q143 WeakPolarHBondContact O-CB 3.35Å; L138-Q143 PolarHBondContact O-N 3.27Å; Q143-I145 VanDerWaalsContact C-N 3.31Å; Q143-A152 VanDerWaalsContact CA-CB 3.49Å; Q143-A152 WeakPolarHBondContact O-CB 3.42Å
144	D	72.7	Confident	76.9	Confident	108 Å²	108	56.9 Å²	56.9	58%	0.578	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	5	177.7	-56.4	-37.7	0	0	0	112.9	R139 I142 S146	R139-D144 IonicContact CZ-OD1 3.14Å; R139-D144 VanDerWaalsContact NH1-CG 3.34Å; R139-D144 IonicContact NH1-OD1 2.83Å; R139-D144 PolarHBondContact NH1-OD1 3.48Å; R139-D144 IonicContact NH1-OD2 3.08Å; R139-D144 PolarHBondContact NH1-OD2 3.02Å; R139-D144 IonicContact NH2-OD1 2.69Å; I142-D144 VanDerWaalsContact C-N 3.26Å; I142-D144 PolarHBondContact O-N 3.21Å; I142-D144 VanDerWaalsContact O-N 3.13Å; D144-S146 PolarHBondContact O-N 3.25Å
145	I	73.6	Confident	76.6	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	29%	0.289	C	S	.	.			trans	-80	95.2	171	-59.1	178.1	0	0	0	108.9	I142 Q143 A152 L156 Y252	I142-I145 VanDerWaalsContact O-CB 3.22Å; I142-I145 WeakPolarHBondContact O-CB 3.23Å; I142-I145 VanDerWaalsContact O-CG1 3.32Å; I142-I145 WeakPolarHBondContact O-CG1 3.48Å; I142-I145 PolarHBondContact O-N 3.41Å; Q143-I145 VanDerWaalsContact C-N 3.31Å; I145-A152 WeakPolarHBondContact O-CA 3.12Å; I145-L156 HydrophobicContact CD1-CD1 4.08Å; I145-L156 HydrophobicContact CD1-CD2 4.44Å; I145-L156 HydrophobicContact CG2-CB 4.39Å; I145-Y252 HydrophobicContact CB-CE1 4.2Å; I145-Y252 HydrophobicContact CD1-CD1 3.55Å; I145-Y252 HydrophobicContact CD1-CE1 4.08Å; I145-Y252 HydrophobicContact CD1-CG 3.97Å; I145-Y252 HydrophobicContact CG1-CD1 3.72Å; I145-Y252 HydrophobicContact CG1-CE1 3.72Å; I145-Y252 HydrophobicContact CG2-CD1 4.09Å; I145-Y252 HydrophobicContact CG2-CD2 4.27Å; I145-Y252 HydrophobicContact CG2-CE1 3.71Å; I145-Y252 HydrophobicContact CG2-CE2 3.92Å; I145-Y252 HydrophobicContact CG2-CG 4.36Å
146	S	66.1	Low	76.6	Confident	91 Å²	91	54.1 Å²	54.1	64%	0.636	28%	0.28	S	S	*	.			trans	-101.5	130.9	169.3	61.6	0	0	0	0	111.6	D144	D144-S146 PolarHBondContact O-N 3.25Å
147	V	62	Low	76.7	Confident	26 Å²	26	55.6 Å²	55.6	16%	0.158	29%	0.288	C	S	.	.	S	Bend	trans	-135.5	115.7	170.9	-179	0	0	0	0	106.4	E149 T150 L158 W159 Y252	V147-E149 VanDerWaalsContact C-N 3.35Å; V147-E149 PolarHBondContact O-N 3.42Å; V147-T150 PolarHBondContact O-N 3.39Å; V147-T150 PolarHBondContact O-OG1 3.08Å; V147-L158 HydrophobicContact CG1-CD2 4.28Å; V147-W159 HydrophobicContact CG2-CB 4.47Å; V147-Y252 HydrophobicContact CG2-CE2 4.44Å
148	E	58.8	Low	76.6	Confident	117 Å²	117	57.4 Å²	57.4	55%	0.547	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	47.1	179	-60.8	179.3	168.3	0	0	113.8	T150 R162	E148-T150 PolarHBondContact O-N 3.06Å; E148-R162 VanDerWaalsContact CD-NH1 3.34Å; E148-R162 IonicContact OE1-CZ 2.85Å; E148-R162 IonicContact OE1-NH1 3.53Å; E148-R162 PolarHBondContact OE1-NH1 3.25Å; E148-R162 IonicContact OE1-NH2 3.9Å; E148-R162 PolarHBondContact OE1-NH2 2.95Å; E148-R162 IonicContact OE2-CZ 3.63Å; E148-R162 IonicContact OE2-NH1 3.9Å; E148-R162 IonicContact OE2-NH2 3.94Å; E148-R162 PolarHBondContact OE2-NH2 3.4Å
149	E	57.9	Low	76.6	Confident	198 Å²	198	55.8 Å²	55.8	93%	0.925	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	6.1	174.9	-54.9	-174.9	161.4	0	0	116.1	V147	V147-E149 VanDerWaalsContact C-N 3.35Å; V147-E149 PolarHBondContact O-N 3.42Å
150	T	68.4	Low	76.8	Confident	50 Å²	50	53.1 Å²	53.1	31%	0.307	28%	0.278	S	S	.	.			trans	-73.9	160.5	176.3	60.5	0	0	0	0	113	V147 E148 G155	V147-T150 PolarHBondContact O-N 3.39Å; V147-T150 PolarHBondContact O-OG1 3.08Å; E148-T150 PolarHBondContact O-N 3.06Å; T150-G155 VanDerWaalsContact OG1-CA 3.26Å; T150-G155 WeakPolarHBondContact OG1-CA 3.38Å; T150-G155 PolarHBondContact OG1-N 3.42Å
151	S	72.9	Confident	77.1	Confident	62 Å²	62	54.3 Å²	54.3	43%	0.434	28%	0.284	S	S	.	.			trans	-64.8	149.2	177.1	80.1	0	0	0	0	110.9	K153 E154 G155	S151-K153 VanDerWaalsContact C-N 3.26Å; S151-K153 PolarHBondContact O-N 3.28Å; S151-E154 VanDerWaalsContact CB-OE2 3.3Å; S151-E154 WeakPolarHBondContact CB-OE2 3.48Å; S151-E154 PolarHBondContact N-OE2 3.2Å; S151-E154 CarbonylContact O-C 3.53Å; S151-E154 WeakPolarHBondContact O-CA 3Å; S151-E154 WeakPolarHBondContact O-CB 3.11Å; S151-E154 PolarHBondContact O-N 2.7Å; S151-E154 WeakPolarHBondContact OG-CG 3.04Å; S151-E154 PolarHBondContact OG-OE2 2.96Å; S151-G155 PolarHBondContact O-N 3.41Å
152	A	76.2	Confident	77.2	Confident	18 Å²	18	60.2 Å²	60.2	15%	0.149	30%	0.304	C	S	.	.	H	α-helix	trans	-54.1	-34.7	-168.6	0	0	0	0	0	116.5	I142 Q143 I145 L156	I142-A152 HydrophobicContact CG2-CB 4.43Å; I142-A152 WeakPolarHBondContact O-CB 3.42Å; Q143-A152 VanDerWaalsContact CA-CB 3.49Å; Q143-A152 WeakPolarHBondContact O-CB 3.42Å; I145-A152 WeakPolarHBondContact O-CA 3.12Å; A152-L156 WeakPolarHBondContact O-CB 2.87Å; A152-L156 PolarHBondContact O-N 3.39Å; A152-L156 VanDerWaalsContact O-N 3.12Å
153	K	81.4	Confident	77.4	Confident	84 Å²	84	62.1 Å²	62.1	37%	0.365	31%	0.312	S	S	.	.	H	α-helix	trans	-68.4	-41	174.7	178.8	176	-179.6	-179.1	0	111.4	S151 L157 F175 E241 M245	S151-K153 VanDerWaalsContact C-N 3.26Å; S151-K153 PolarHBondContact O-N 3.28Å; K153-L157 WeakPolarHBondContact O-CB 2.89Å; K153-L157 PolarHBondContact O-N 3.08Å; K153-L157 VanDerWaalsContact O-N 3.13Å; K153-F175 HydrophobicContact CG-CE2 4.13Å; K153-E241 WeakPolarHBondContact CE-OE1 3.3Å; K153-E241 IonicContact NZ-OE1 3.39Å; K153-E241 PolarHBondContact NZ-OE1 3.06Å; K153-E241 IonicContact NZ-OE2 2.68Å; K153-E241 PolarHBondContact NZ-OE2 3.35Å; K153-E241 VanDerWaalsContact NZ-OE2 3.15Å; K153-M245 HydrophobicContact CB-CE 4.07Å; K153-M245 HydrophobicContact CD-CE 4.08Å; K153-M245 HydrophobicContact CD-SD 4.09Å; K153-M245 HydrophobicContact CG-CE 3.7Å; K153-M245 HydrophobicContact CG-SD 4.15Å
154	E	82.1	Confident	77.7	Confident	113 Å²	113	57.7 Å²	57.7	53%	0.528	29%	0.292	S	S	.	.	H	α-helix	trans	-73	-40.2	178.9	-64.9	164.8	150.1	0	0	111	S151 L157 L158	S151-E154 VanDerWaalsContact CB-OE2 3.3Å; S151-E154 WeakPolarHBondContact CB-OE2 3.48Å; S151-E154 PolarHBondContact N-OE2 3.2Å; S151-E154 CarbonylContact O-C 3.53Å; S151-E154 WeakPolarHBondContact O-CA 3Å; S151-E154 WeakPolarHBondContact O-CB 3.11Å; S151-E154 PolarHBondContact O-N 2.7Å; S151-E154 WeakPolarHBondContact OG-CG 3.04Å; S151-E154 PolarHBondContact OG-OE2 2.96Å; E154-L157 WeakPolarHBondContact O-CB 3.09Å; E154-L157 PolarHBondContact O-N 3.47Å; E154-L157 VanDerWaalsContact O-N 3.16Å; E154-L158 VanDerWaalsContact O-CB 3.27Å; E154-L158 WeakPolarHBondContact O-CB 3.46Å; E154-L158 PolarHBondContact O-N 2.93Å
155	G	82.3	Confident	78.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-42.7	175.1	0	0	0	0	0	112.8	T150 S151 W159	T150-G155 VanDerWaalsContact OG1-CA 3.26Å; T150-G155 WeakPolarHBondContact OG1-CA 3.38Å; T150-G155 PolarHBondContact OG1-N 3.42Å; S151-G155 PolarHBondContact O-N 3.41Å; G155-W159 WeakPolarHBondContact O-CB 3.32Å; G155-W159 PolarHBondContact O-N 3.01Å
156	L	85.6	Confident	78.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-38.9	172.6	-176.3	59.7	0	0	0	111.9	I142 I145 A152 W159 C160 F175 V248 Y252	I142-L156 HydrophobicContact CG2-CD2 4.38Å; I145-L156 HydrophobicContact CD1-CD1 4.08Å; I145-L156 HydrophobicContact CD1-CD2 4.44Å; I145-L156 HydrophobicContact CG2-CB 4.39Å; A152-L156 WeakPolarHBondContact O-CB 2.87Å; A152-L156 PolarHBondContact O-N 3.39Å; A152-L156 VanDerWaalsContact O-N 3.12Å; L156-W159 HydrophobicContact CD1-CE3 4.3Å; L156-C160 PolarHBondContact O-N 3.35Å; L156-C160 VanDerWaalsContact O-N 3.07Å; L156-C160 PolarHBondContact O-SG 3.14Å; L156-F175 HydrophobicContact CB-CZ 4.16Å; L156-F175 HydrophobicContact CD2-CE1 4.34Å; L156-F175 HydrophobicContact CD2-CZ 4.1Å; L156-F175 HydrophobicContact CG-CE1 4.24Å; L156-F175 HydrophobicContact CG-CZ 3.87Å; L156-V248 HydrophobicContact CD1-CG1 4.24Å; L156-V248 HydrophobicContact CG-CG1 4.39Å; L156-Y252 HydrophobicContact CD1-CD2 4.23Å; L156-Y252 HydrophobicContact CD1-CG 4.13Å
157	L	87.6	Confident	79.8	Confident	32 Å²	32	57.4 Å²	57.4	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-67.5	-44.2	177.6	-176.3	62.5	0	0	0	111.6	K153 E154 C160 Q161 V172 F175	K153-L157 WeakPolarHBondContact O-CB 2.89Å; K153-L157 PolarHBondContact O-N 3.08Å; K153-L157 VanDerWaalsContact O-N 3.13Å; E154-L157 WeakPolarHBondContact O-CB 3.09Å; E154-L157 PolarHBondContact O-N 3.47Å; E154-L157 VanDerWaalsContact O-N 3.16Å; L157-C160 WeakPolarHBondContact O-CB 3.33Å; L157-C160 PolarHBondContact O-N 2.81Å; L157-Q161 WeakPolarHBondContact O-CG 3.38Å; L157-Q161 PolarHBondContact O-N 2.86Å; L157-V172 HydrophobicContact CD1-CG1 3.8Å; L157-F175 HydrophobicContact CB-CE2 3.83Å; L157-F175 HydrophobicContact CB-CZ 3.84Å; L157-F175 HydrophobicContact CD1-CE2 4.14Å; L157-F175 HydrophobicContact CD1-CZ 4.13Å; L157-F175 HydrophobicContact CG-CE2 4.48Å
158	L	84.8	Confident	80.8	Confident	38 Å²	38	66 Å²	66	20%	0.199	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-39.9	177.1	179.8	62	0	0	0	111.4	V147 E154 Q161 R162	V147-L158 HydrophobicContact CG1-CD2 4.28Å; E154-L158 VanDerWaalsContact O-CB 3.27Å; E154-L158 WeakPolarHBondContact O-CB 3.46Å; E154-L158 PolarHBondContact O-N 2.93Å; L158-Q161 PolarHBondContact O-N 2.95Å; L158-R162 HydrophobicContact CD1-CG 4.32Å; L158-R162 WeakPolarHBondContact O-CB 3.22Å; L158-R162 WeakPolarHBondContact O-CG 3.02Å; L158-R162 PolarHBondContact O-N 3.37Å
159	W	86.3	Confident	81.9	Confident	24 Å²	24	65.3 Å²	65.3	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-47.5	171.4	176.6	90.6	0	0	0	111.3	V147 G155 L156 Q161 R162 K163 L188 H192 F251 Y252 F255	V147-W159 HydrophobicContact CG2-CB 4.47Å; G155-W159 WeakPolarHBondContact O-CB 3.32Å; G155-W159 PolarHBondContact O-N 3.01Å; L156-W159 HydrophobicContact CD1-CE3 4.3Å; W159-Q161 PolarHBondContact O-N 3.33Å; W159-R162 PolarHBondContact O-N 3.01Å; W159-K163 HydrophobicContact CD2-CG 4.25Å; W159-K163 HydrophobicContact CG-CG 4.46Å; W159-K163 HydrophobicContact CZ2-CG 4.41Å; W159-K163 WeakPolarHBondContact O-CB 3.12Å; W159-K163 VanDerWaalsContact O-CG 3.24Å; W159-K163 WeakPolarHBondContact O-CG 3.22Å; W159-K163 PolarHBondContact O-N 2.88Å; W159-L188 HydrophobicContact CH2-CD1 4.28Å; W159-L188 HydrophobicContact CH2-CD2 4.21Å; W159-L188 HydrophobicContact CZ3-CD1 3.76Å; W159-L188 HydrophobicContact CZ3-CD2 4.02Å; W159-H192 AromaticContact CZ2-CE1 3.58Å; W159-H192 AromaticContact CZ2-NE2 3.93Å; W159-F251 HydrophobicContact CH2-CB 4.44Å; W159-Y252 HydrophobicContact CB-CD2 4.35Å; W159-Y252 HydrophobicContact CB-CE2 4.37Å; W159-Y252 AromaticContact CD1-CD2 3.78Å; W159-Y252 AromaticContact CD1-CE2 3.63Å; W159-Y252 AromaticContact CD2-CD2 3.59Å; W159-Y252 HydrophobicContact CD2-CD2 3.59Å; W159-Y252 HydrophobicContact CD2-CE2 4.23Å; W159-Y252 AromaticContact CE2-CD2 3.67Å; W159-Y252 HydrophobicContact CE3-CD2 4.07Å; W159-Y252 AromaticContact CG-CD2 3.69Å; W159-Y252 HydrophobicContact CG-CD2 3.69Å; W159-Y252 AromaticContact CG-CE2 3.86Å; W159-Y252 HydrophobicContact CG-CE2 3.86Å; W159-Y252 HydrophobicContact CZ2-CD2 4.25Å; W159-Y252 AromaticContact NE1-CD2 3.75Å; W159-Y252 AromaticContact NE1-CE2 3.87Å; W159-F255 HydrophobicContact CH2-CD2 4.2Å; W159-F255 HydrophobicContact CZ2-CB 4.42Å; W159-F255 HydrophobicContact CZ2-CD2 4.29Å
160	C	87.8	Confident	83.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-53.2	176.2	-64.8	0	0	0	0	110.7	L156 L157 R162 K163 T164 V172 W179 V248	L156-C160 PolarHBondContact O-N 3.35Å; L156-C160 VanDerWaalsContact O-N 3.07Å; L156-C160 PolarHBondContact O-SG 3.14Å; L157-C160 WeakPolarHBondContact O-CB 3.33Å; L157-C160 PolarHBondContact O-N 2.81Å; C160-R162 PolarHBondContact O-N 3.15Å; C160-K163 PolarHBondContact O-N 3.18Å; C160-T164 WeakPolarHBondContact O-CG2 3.47Å; C160-T164 PolarHBondContact O-N 3.17Å; C160-T164 PolarHBondContact O-OG1 3.35Å; C160-V172 HydrophobicContact CB-CG1 4.17Å; C160-W179 HydrophobicContact CB-CH2 4.23Å; C160-W179 HydrophobicContact CB-CZ2 4.1Å; C160-V248 WeakPolarHBondContact SG-CG1 3.46Å
161	Q	88.1	Confident	84.3	Confident	71 Å²	71	59.2 Å²	59.2	33%	0.332	30%	0.304	S	S	.	.	H	α-helix	trans	-53.6	-49.8	179	-76.2	171.4	-7.5	0	0	112.5	L157 L158 W159 K163 T164 A165 V172	L157-Q161 WeakPolarHBondContact O-CG 3.38Å; L157-Q161 PolarHBondContact O-N 2.86Å; L158-Q161 PolarHBondContact O-N 2.95Å; W159-Q161 PolarHBondContact O-N 3.33Å; Q161-K163 PolarHBondContact O-N 2.77Å; Q161-T164 PolarHBondContact O-N 2.8Å; Q161-T164 PolarHBondContact O-OG1 3.32Å; Q161-A165 WeakPolarHBondContact O-CA 3.39Å; Q161-A165 VanDerWaalsContact O-CB 3.27Å; Q161-A165 WeakPolarHBondContact O-CB 3.35Å; Q161-A165 PolarHBondContact O-N 2.87Å; Q161-V172 HydrophobicContact CG-CB 4.33Å; Q161-V172 WeakPolarHBondContact CG-O 3.34Å; Q161-V172 PolarHBondContact NE2-O 3.11Å
162	R	84.5	Confident	85	Confident	135 Å²	135	56.3 Å²	56.3	51%	0.509	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-38.5	-179.9	-76.3	-175.6	172.2	-171.8	2.8	113	E148 L158 W159 C160	E148-R162 VanDerWaalsContact CD-NH1 3.34Å; E148-R162 IonicContact OE1-CZ 2.85Å; E148-R162 IonicContact OE1-NH1 3.53Å; E148-R162 PolarHBondContact OE1-NH1 3.25Å; E148-R162 IonicContact OE1-NH2 3.9Å; E148-R162 PolarHBondContact OE1-NH2 2.95Å; E148-R162 IonicContact OE2-CZ 3.63Å; E148-R162 IonicContact OE2-NH1 3.9Å; E148-R162 IonicContact OE2-NH2 3.94Å; E148-R162 PolarHBondContact OE2-NH2 3.4Å; L158-R162 HydrophobicContact CD1-CG 4.32Å; L158-R162 WeakPolarHBondContact O-CB 3.22Å; L158-R162 WeakPolarHBondContact O-CG 3.02Å; L158-R162 PolarHBondContact O-N 3.37Å; W159-R162 PolarHBondContact O-N 3.01Å; C160-R162 PolarHBondContact O-N 3.15Å
163	K	86.3	Confident	85.5	Confident	40 Å²	40	61.3 Å²	61.3	17%	0.174	30%	0.304	C	S	.	.	H	α-helix	trans	-74.3	-32.8	179	-64.3	-70.2	-174.8	152.6	0	111.5	W159 C160 Q161 L188 R191 H192	W159-K163 HydrophobicContact CD2-CG 4.25Å; W159-K163 HydrophobicContact CG-CG 4.46Å; W159-K163 HydrophobicContact CZ2-CG 4.41Å; W159-K163 WeakPolarHBondContact O-CB 3.12Å; W159-K163 VanDerWaalsContact O-CG 3.24Å; W159-K163 WeakPolarHBondContact O-CG 3.22Å; W159-K163 PolarHBondContact O-N 2.88Å; C160-K163 PolarHBondContact O-N 3.18Å; Q161-K163 PolarHBondContact O-N 2.77Å; K163-L188 HydrophobicContact CB-CD2 3.53Å; K163-L188 HydrophobicContact CG-CD2 4.45Å; K163-R191 HydrophobicContact CB-CG 4.29Å; K163-R191 HydrophobicContact CD-CG 4.3Å; K163-R191 WeakPolarHBondContact O-CG 3.4Å; K163-H192 WeakPolarHBondContact CD-NE2 3.25Å; K163-H192 VanDerWaalsContact CE-NE2 3.3Å; K163-H192 WeakPolarHBondContact CE-NE2 3.49Å; K163-H192 PolarHBondContact NZ-NE2 2.77Å
164	T	85.7	Confident	85.8	Confident	3 Å²	3	59 Å²	59	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-89.4	-11.9	176.2	63.9	0	0	0	0	114.9	C160 Q161 P166 Y167 V170 V172 A187 L188	C160-T164 WeakPolarHBondContact O-CG2 3.47Å; C160-T164 PolarHBondContact O-N 3.17Å; C160-T164 PolarHBondContact O-OG1 3.35Å; Q161-T164 PolarHBondContact O-N 2.8Å; Q161-T164 PolarHBondContact O-OG1 3.32Å; T164-P166 VanDerWaalsContact C-N 3.31Å; T164-P166 VanDerWaalsContact O-N 3.14Å; T164-Y167 WeakPolarHBondContact O-CD2 3.42Å; T164-Y167 PolarHBondContact O-N 3.43Å; T164-V170 HydrophobicContact CG2-CG1 4.08Å; T164-V172 HydrophobicContact CG2-CG2 4.34Å; T164-A187 HydrophobicContact CG2-CB 3.98Å; T164-L188 HydrophobicContact CG2-CD2 3.8Å; T164-L188 HydrophobicContact CG2-CG 3.93Å
165	A	86.6	Confident	86.1	Confident	76 Å²	76	53.6 Å²	53.6	63%	0.628	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-33.4	-177.4	0	0	0	0	0	116	Q161 Y167	Q161-A165 WeakPolarHBondContact O-CA 3.39Å; Q161-A165 VanDerWaalsContact O-CB 3.27Å; Q161-A165 WeakPolarHBondContact O-CB 3.35Å; Q161-A165 PolarHBondContact O-N 2.87Å; A165-Y167 PolarHBondContact O-N 3.13Å
166	P	85.7	Confident	86.2	Confident	86 Å²	86	54.7 Å²	54.7	56%	0.558	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-21.4	174.9	-23.6	36	0	0	0	114.5	T164 K168	T164-P166 VanDerWaalsContact C-N 3.31Å; T164-P166 VanDerWaalsContact O-N 3.14Å; P166-K168 PolarHBondContact O-N 3.26Å
167	Y	85.9	Confident	86.2	Confident	32 Å²	32	59.1 Å²	59.1	13%	0.125	30%	0.298	C	S	.	.			trans	-91.7	97.6	-174.4	-57.3	-89.4	0	0	0	110.6	T164 A165 N169 V170 A187 H190 R191 Y199	T164-Y167 WeakPolarHBondContact O-CD2 3.42Å; T164-Y167 PolarHBondContact O-N 3.43Å; A165-Y167 PolarHBondContact O-N 3.13Å; Y167-N169 PolarHBondContact O-N 3.38Å; Y167-V170 PolarHBondContact O-N 2.8Å; Y167-A187 HydrophobicContact CD1-CB 4.35Å; Y167-A187 HydrophobicContact CD2-CB 3.76Å; Y167-A187 HydrophobicContact CE2-CB 3.99Å; Y167-A187 HydrophobicContact CG-CB 3.94Å; Y167-H190 AromaticContact CE1-ND1 3.43Å; Y167-H190 WeakPolarHBondContact CE1-ND1 3.38Å; Y167-H190 AromaticContact CZ-ND1 3.6Å; Y167-H190 PolarHBondContact OH-ND1 3.36Å; Y167-R191 HydrophobicContact CE2-CB 4.15Å; Y167-R191 WeakPolarHBondContact OH-CA 3.47Å; Y167-R191 PolarHBondContact OH-N 2.71Å; Y167-Y199 AromaticContact CD1-CD1 3.76Å; Y167-Y199 HydrophobicContact CD1-CD1 3.76Å; Y167-Y199 HydrophobicContact CD1-CD2 4.38Å; Y167-Y199 AromaticContact CD1-CE1 3.47Å; Y167-Y199 HydrophobicContact CD1-CE1 3.47Å; Y167-Y199 VanDerWaalsContact CD1-CE1 3.47Å; Y167-Y199 HydrophobicContact CD1-CE2 4.13Å; Y167-Y199 HydrophobicContact CD1-CG 4.21Å; Y167-Y199 AromaticContact CD1-CZ 3.68Å; Y167-Y199 AromaticContact CE1-CD1 3.97Å; Y167-Y199 HydrophobicContact CE1-CD1 3.97Å; Y167-Y199 HydrophobicContact CE1-CD2 4.21Å; Y167-Y199 HydrophobicContact CE1-CE1 4.13Å; Y167-Y199 HydrophobicContact CE1-CE2 4.36Å; Y167-Y199 HydrophobicContact CE1-CG 4.02Å; Y167-Y199 HydrophobicContact CG-CE1 4.35Å
168	K	81.4	Confident	86.2	Confident	206 Å²	206	58.5 Å²	58.5	90%	0.896	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-23	-178	-62	179.3	-178.7	175.6	0	115.1	P166	P166-K168 PolarHBondContact O-N 3.26Å
169	N	83.6	Confident	86.5	Confident	103 Å²	103	56.8 Å²	56.8	55%	0.551	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.8	-174.7	-53.2	-3.8	0	0	0	112.7	Y167 L183	Y167-N169 PolarHBondContact O-N 3.38Å; N169-L183 HydrophobicContact CB-CD1 4.4Å
170	V	87.1	Confident	86.5	Confident	14 Å²	14	58.1 Å²	58.1	9%	0.085	29%	0.294	C	S	.	.			trans	-118.7	130	-173.5	173.3	0	0	0	0	110.1	T164 Y167 V172 L183 A184 A187 Y199	T164-V170 HydrophobicContact CG2-CG1 4.08Å; Y167-V170 PolarHBondContact O-N 2.8Å; V170-V172 HydrophobicContact CG1-CG2 3.81Å; V170-L183 HydrophobicContact CG2-CB 3.62Å; V170-A184 HydrophobicContact CG1-CB 3.92Å; V170-A187 HydrophobicContact CG2-CB 4.26Å; V170-Y199 VanDerWaalsContact CG2-OH 3.22Å; V170-Y199 WeakPolarHBondContact CG2-OH 3.45Å
171	N	87.7	Confident	86.5	Confident	106 Å²	106	59.3 Å²	59.3	57%	0.567	30%	0.3	S	S	*	.			trans	-137.2	99.6	175.4	178.9	16.9	0	0	0	109.7	Q173 S178	N171-Q173 PolarHBondContact ND2-NE2 2.89Å; N171-Q173 VanDerWaalsContact ND2-NE2 3.14Å; N171-Q173 PolarHBondContact O-N 2.92Å; N171-Q173 WeakPolarHBondContact OD1-CG 3.33Å; N171-S178 PolarHBondContact O-OG 2.99Å
172	V	88.7	Confident	86.4	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	28%	0.284	C	S	.	.			trans	-88.7	103.6	-176.4	-172.1	0	0	0	0	110.2	L157 C160 Q161 T164 V170 W179 A184	L157-V172 HydrophobicContact CD1-CG1 3.8Å; C160-V172 HydrophobicContact CB-CG1 4.17Å; Q161-V172 HydrophobicContact CG-CB 4.33Å; Q161-V172 WeakPolarHBondContact CG-O 3.34Å; Q161-V172 PolarHBondContact NE2-O 3.11Å; T164-V172 HydrophobicContact CG2-CG2 4.34Å; V170-V172 HydrophobicContact CG1-CG2 3.81Å; V172-W179 HydrophobicContact CG1-CZ2 3.67Å; V172-W179 HydrophobicContact CG2-CZ2 4.49Å; V172-A184 HydrophobicContact CG2-CB 4.01Å
173	Q	86.9	Confident	86.6	Confident	124 Å²	124	49.7 Å²	49.7	58%	0.579	26%	0.261	S	S	*	.			trans	-112.7	-20.2	-179.7	-65	-175	-24.1	0	0	113.3	N171 S178	N171-Q173 PolarHBondContact ND2-NE2 2.89Å; N171-Q173 VanDerWaalsContact ND2-NE2 3.14Å; N171-Q173 PolarHBondContact O-N 2.92Å; N171-Q173 WeakPolarHBondContact OD1-CG 3.33Å; Q173-S178 PolarHBondContact N-OG 3.29Å
174	N	87.3	Confident	86.8	Confident	34 Å²	34	47.8 Å²	47.8	18%	0.182	25%	0.252	C	S	.	.	S	Bend	trans	-154	165.1	-178.6	52.7	69.7	0	0	0	110.3	H176 I177 S178 W179	N174-H176 VanDerWaalsContact C-N 3.27Å; N174-H176 VanDerWaalsContact CG-CE1 3.47Å; N174-H176 PolarHBondContact O-N 3.1Å; N174-H176 PolarHBondContact OD1-N 3.47Å; N174-H176 VanDerWaalsContact OD1-N 3.17Å; N174-H176 PolarHBondContact OD1-ND1 3.41Å; N174-I177 PolarHBondContact OD1-N 2.98Å; N174-S178 PolarHBondContact N-OG 2.99Å; N174-S178 WeakPolarHBondContact O-CB 3.19Å; N174-S178 PolarHBondContact OD1-N 3.17Å; N174-S178 VanDerWaalsContact OD1-N 3.12Å; N174-S178 PolarHBondContact OD1-OG 3.01Å; N174-W179 PolarHBondContact O-NE1 3.45Å
175	F	87.5	Confident	87	Confident	1 Å²	1	47.7 Å²	47.7	0%	0.004	25%	0.252	C	S	.	.	S	Bend	trans	-89.2	28.8	175.2	-64.9	-76.1	0	0	0	113.3	K153 L156 L157 W179 E241 I244 M245 V248	K153-F175 HydrophobicContact CG-CE2 4.13Å; L156-F175 HydrophobicContact CB-CZ 4.16Å; L156-F175 HydrophobicContact CD2-CE1 4.34Å; L156-F175 HydrophobicContact CD2-CZ 4.1Å; L156-F175 HydrophobicContact CG-CE1 4.24Å; L156-F175 HydrophobicContact CG-CZ 3.87Å; L157-F175 HydrophobicContact CB-CE2 3.83Å; L157-F175 HydrophobicContact CB-CZ 3.84Å; L157-F175 HydrophobicContact CD1-CE2 4.14Å; L157-F175 HydrophobicContact CD1-CZ 4.13Å; L157-F175 HydrophobicContact CG-CE2 4.48Å; F175-W179 HydrophobicContact CD1-CZ2 4.24Å; F175-W179 AromaticContact CD1-NE1 3.85Å; F175-W179 HydrophobicContact CE1-CZ2 4.25Å; F175-E241 HydrophobicContact CB-CG 3.68Å; F175-E241 WeakPolarHBondContact O-CA 3.37Å; F175-I244 HydrophobicContact CB-CG2 4.14Å; F175-I244 HydrophobicContact CD1-CG2 4.29Å; F175-I244 VanDerWaalsContact O-CB 3.27Å; F175-I244 WeakPolarHBondContact O-CB 3.08Å; F175-I244 VanDerWaalsContact O-CD1 3.32Å; F175-I244 WeakPolarHBondContact O-CD1 3.5Å; F175-I244 WeakPolarHBondContact O-CG2 3.5Å; F175-M245 HydrophobicContact CB-CG 3.57Å; F175-M245 HydrophobicContact CB-SD 4.5Å; F175-M245 HydrophobicContact CD1-CG 3.89Å; F175-M245 HydrophobicContact CD2-CG 3.45Å; F175-M245 VanDerWaalsContact CD2-CG 3.45Å; F175-M245 HydrophobicContact CD2-SD 3.85Å; F175-M245 HydrophobicContact CE1-CG 4.4Å; F175-M245 HydrophobicContact CE2-CG 4.01Å; F175-M245 HydrophobicContact CE2-SD 4.35Å; F175-M245 HydrophobicContact CG-CG 3.37Å; F175-M245 HydrophobicContact CG-SD 4.33Å; F175-M245 HydrophobicContact CZ-CG 4.45Å; F175-V248 HydrophobicContact CE1-CB 4.43Å; F175-V248 HydrophobicContact CE1-CG1 4.11Å
176	H	84.4	Confident	87.2	Confident	22 Å²	22	44 Å²	44	10%	0.102	22%	0.222	C	C	.	.	S	Bend	trans	-130	-74.4	175.8	48.6	82.8	0	0	0	113.5	N174 R238 P239	N174-H176 VanDerWaalsContact C-N 3.27Å; N174-H176 VanDerWaalsContact CG-CE1 3.47Å; N174-H176 PolarHBondContact O-N 3.1Å; N174-H176 PolarHBondContact OD1-N 3.47Å; N174-H176 VanDerWaalsContact OD1-N 3.17Å; N174-H176 PolarHBondContact OD1-ND1 3.41Å; H176-R238 HydrophobicContact CB-CG 4.11Å; H176-R238 PolarHBondContact CD2-NH2 3.47Å; H176-R238 PolarHBondContact NE2-NH2 3.47Å; H176-P239 WeakPolarHBondContact CB-O 3Å
177	I	86.4	Confident	87.3	Confident	94 Å²	94	40 Å²	40	48%	0.482	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-79.5	-32.9	-172.1	-69	159.1	0	0	0	110.8	N174 W179 K180	N174-I177 PolarHBondContact OD1-N 2.98Å; I177-W179 PolarHBondContact O-N 3Å; I177-W179 VanDerWaalsContact O-N 3.08Å; I177-K180 WeakPolarHBondContact O-CB 3.36Å; I177-K180 PolarHBondContact O-N 3.02Å; I177-K180 VanDerWaalsContact O-N 3.15Å
178	S	88.2	Confident	87.4	Confident	19 Å²	19	38.5 Å²	38.5	13%	0.133	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-64.5	-12.4	-179.4	-58.9	0	0	0	0	115.2	N171 Q173 N174	N171-S178 PolarHBondContact O-OG 2.99Å; Q173-S178 PolarHBondContact N-OG 3.29Å; N174-S178 PolarHBondContact N-OG 2.99Å; N174-S178 WeakPolarHBondContact O-CB 3.19Å; N174-S178 PolarHBondContact OD1-N 3.17Å; N174-S178 VanDerWaalsContact OD1-N 3.12Å; N174-S178 PolarHBondContact OD1-OG 3.01Å
179	W	89.8	Confident	87.7	Confident	1 Å²	1	28.7 Å²	28.7	0%	0.004	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-107	-5.1	-179.3	-59.5	82.6	0	0	0	112.7	C160 V172 N174 F175 I177 D181 G182 A184 F185 L188 I244 V248	C160-W179 HydrophobicContact CB-CH2 4.23Å; C160-W179 HydrophobicContact CB-CZ2 4.1Å; V172-W179 HydrophobicContact CG1-CZ2 3.67Å; V172-W179 HydrophobicContact CG2-CZ2 4.49Å; N174-W179 PolarHBondContact O-NE1 3.45Å; F175-W179 HydrophobicContact CD1-CZ2 4.24Å; F175-W179 AromaticContact CD1-NE1 3.85Å; F175-W179 HydrophobicContact CE1-CZ2 4.25Å; I177-W179 PolarHBondContact O-N 3Å; I177-W179 VanDerWaalsContact O-N 3.08Å; W179-D181 VanDerWaalsContact C-N 3.28Å; W179-D181 PolarHBondContact O-N 3.38Å; W179-G182 PolarHBondContact O-N 3.37Å; W179-G182 VanDerWaalsContact O-N 3.15Å; W179-A184 HydrophobicContact CD2-CB 4Å; W179-A184 HydrophobicContact CE3-CB 3.52Å; W179-A184 HydrophobicContact CH2-CB 4.47Å; W179-A184 HydrophobicContact CZ3-CB 3.79Å; W179-F185 HydrophobicContact CB-CE2 3.99Å; W179-F185 HydrophobicContact CB-CZ 4.43Å; W179-F185 HydrophobicContact CD2-CE2 4.38Å; W179-F185 HydrophobicContact CD2-CZ 4.24Å; W179-F185 AromaticContact CE3-CD1 3.77Å; W179-F185 HydrophobicContact CE3-CD1 3.77Å; W179-F185 AromaticContact CE3-CD2 3.83Å; W179-F185 HydrophobicContact CE3-CD2 3.83Å; W179-F185 AromaticContact CE3-CE1 3.63Å; W179-F185 HydrophobicContact CE3-CE1 3.63Å; W179-F185 AromaticContact CE3-CE2 3.71Å; W179-F185 HydrophobicContact CE3-CE2 3.71Å; W179-F185 AromaticContact CE3-CG 3.86Å; W179-F185 HydrophobicContact CE3-CG 3.86Å; W179-F185 AromaticContact CE3-CZ 3.6Å; W179-F185 HydrophobicContact CE3-CZ 3.6Å; W179-F185 AromaticContact CZ3-CD1 3.71Å; W179-F185 HydrophobicContact CZ3-CD1 3.71Å; W179-F185 AromaticContact CZ3-CE1 3.79Å; W179-F185 HydrophobicContact CZ3-CE1 3.79Å; W179-F185 HydrophobicContact CZ3-CG 4.09Å; W179-F185 HydrophobicContact CZ3-CZ 4.25Å; W179-L188 HydrophobicContact CH2-CD1 3.63Å; W179-L188 HydrophobicContact CZ3-CD1 3.94Å; W179-I244 HydrophobicContact CB-CD1 4.26Å; W179-I244 HydrophobicContact CB-CG2 4.29Å; W179-I244 HydrophobicContact CD2-CG2 4.11Å; W179-I244 HydrophobicContact CG-CG2 3.8Å; W179-V248 HydrophobicContact CD2-CG2 4.32Å; W179-V248 HydrophobicContact CE3-CG2 4.1Å; W179-V248 HydrophobicContact CH2-CB 4.42Å; W179-V248 HydrophobicContact CH2-CG1 3.86Å; W179-V248 HydrophobicContact CH2-CG2 3.55Å; W179-V248 HydrophobicContact CZ2-CG1 4.15Å; W179-V248 HydrophobicContact CZ2-CG2 3.8Å; W179-V248 HydrophobicContact CZ3-CG2 3.72Å
180	K	87.4	Confident	88	Confident	53 Å²	53	26.1 Å²	26.1	23%	0.23	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.1	-170.9	-173.8	169.5	-178.4	170.4	0	113.8	I177 P207 I233 V234 T236 P239	I177-K180 WeakPolarHBondContact O-CB 3.36Å; I177-K180 PolarHBondContact O-N 3.02Å; I177-K180 VanDerWaalsContact O-N 3.15Å; K180-P207 WeakPolarHBondContact O-CB 3.4Å; K180-I233 WeakPolarHBondContact CE-O 3.36Å; K180-I233 HydrophobicContact CG-CG2 4.3Å; K180-V234 WeakPolarHBondContact CE-O 3.39Å; K180-V234 PolarHBondContact NZ-O 2.73Å; K180-T236 PolarHBondContact NZ-O 2.8Å; K180-P239 HydrophobicContact CB-CG 4.31Å; K180-P239 HydrophobicContact CD-CG 4.26Å; K180-P239 HydrophobicContact CG-CG 4.35Å
181	D	86.6	Confident	88	Confident	24 Å²	24	31.3 Å²	31.3	13%	0.128	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-2.6	177.3	63.2	18	0	0	0	114.4	W179 L183 K204 N210	W179-D181 VanDerWaalsContact C-N 3.28Å; W179-D181 PolarHBondContact O-N 3.38Å; D181-L183 PolarHBondContact O-N 2.76Å; D181-L183 PolarHBondContact OD1-N 2.98Å; D181-K204 HydrophobicContact CB-CG 4.12Å; D181-K204 WeakPolarHBondContact OD2-CE 3.45Å; D181-K204 IonicContact OD2-NZ 3.15Å; D181-K204 PolarHBondContact OD2-NZ 2.8Å; D181-N210 WeakPolarHBondContact O-CB 3.45Å; D181-N210 PolarHBondContact O-ND2 2.86Å
182	G	86.3	Confident	87.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	71.7	-13.8	180	0	0	0	0	0	115.6	W179 A184 F185 N186	W179-G182 PolarHBondContact O-N 3.37Å; W179-G182 VanDerWaalsContact O-N 3.15Å; G182-A184 VanDerWaalsContact C-N 3.3Å; G182-A184 PolarHBondContact O-N 3.03Å; G182-F185 PolarHBondContact O-N 2.77Å; G182-N186 PolarHBondContact O-N 2.71Å; G182-N186 PolarHBondContact O-ND2 3.3Å
183	L	89.7	Confident	87.4	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-33.9	-175.4	-65.3	176.7	0	0	0	111.9	N169 V170 D181 F185 N186 A187 L202 K204	N169-L183 HydrophobicContact CB-CD1 4.4Å; V170-L183 HydrophobicContact CG2-CB 3.62Å; D181-L183 PolarHBondContact O-N 2.76Å; D181-L183 PolarHBondContact OD1-N 2.98Å; L183-F185 PolarHBondContact O-N 2.73Å; L183-N186 PolarHBondContact O-N 3.06Å; L183-A187 VanDerWaalsContact O-CB 3.28Å; L183-A187 WeakPolarHBondContact O-CB 3.33Å; L183-A187 PolarHBondContact O-N 3.39Å; L183-L202 HydrophobicContact CD2-CB 3.83Å; L183-K204 HydrophobicContact CD1-CB 3.96Å; L183-K204 HydrophobicContact CD1-CG 4.26Å
184	A	89.4	Confident	87.2	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-40.2	177.5	0	0	0	0	0	113.7	V170 V172 W179 G182 L188	V170-A184 HydrophobicContact CG1-CB 3.92Å; V172-A184 HydrophobicContact CG2-CB 4.01Å; W179-A184 HydrophobicContact CD2-CB 4Å; W179-A184 HydrophobicContact CE3-CB 3.52Å; W179-A184 HydrophobicContact CH2-CB 4.47Å; W179-A184 HydrophobicContact CZ3-CB 3.79Å; G182-A184 VanDerWaalsContact C-N 3.3Å; G182-A184 PolarHBondContact O-N 3.03Å; A184-L188 PolarHBondContact O-N 2.78Å; A184-L188 VanDerWaalsContact O-N 3.14Å
185	F	91.1	Very high	87	Confident	1 Å²	1	34.6 Å²	34.6	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-67.8	-46	176.8	-71	-70.4	0	0	0	111.6	W179 G182 L183 A187 L188 I189 L211 A214 F215 L228 I244 Y247 V248 F251	W179-F185 HydrophobicContact CB-CE2 3.99Å; W179-F185 HydrophobicContact CB-CZ 4.43Å; W179-F185 HydrophobicContact CD2-CE2 4.38Å; W179-F185 HydrophobicContact CD2-CZ 4.24Å; W179-F185 AromaticContact CE3-CD1 3.77Å; W179-F185 HydrophobicContact CE3-CD1 3.77Å; W179-F185 AromaticContact CE3-CD2 3.83Å; W179-F185 HydrophobicContact CE3-CD2 3.83Å; W179-F185 AromaticContact CE3-CE1 3.63Å; W179-F185 HydrophobicContact CE3-CE1 3.63Å; W179-F185 AromaticContact CE3-CE2 3.71Å; W179-F185 HydrophobicContact CE3-CE2 3.71Å; W179-F185 AromaticContact CE3-CG 3.86Å; W179-F185 HydrophobicContact CE3-CG 3.86Å; W179-F185 AromaticContact CE3-CZ 3.6Å; W179-F185 HydrophobicContact CE3-CZ 3.6Å; W179-F185 AromaticContact CZ3-CD1 3.71Å; W179-F185 HydrophobicContact CZ3-CD1 3.71Å; W179-F185 AromaticContact CZ3-CE1 3.79Å; W179-F185 HydrophobicContact CZ3-CE1 3.79Å; W179-F185 HydrophobicContact CZ3-CG 4.09Å; W179-F185 HydrophobicContact CZ3-CZ 4.25Å; G182-F185 PolarHBondContact O-N 2.77Å; L183-F185 PolarHBondContact O-N 2.73Å; F185-A187 VanDerWaalsContact C-N 3.31Å; F185-A187 PolarHBondContact O-N 3.28Å; F185-L188 PolarHBondContact O-N 2.68Å; F185-I189 PolarHBondContact O-N 2.74Å; F185-L211 HydrophobicContact CD2-CD2 3.77Å; F185-L211 HydrophobicContact CE2-CD2 3.91Å; F185-A214 HydrophobicContact CB-CB 3.61Å; F185-F215 AromaticContact CD2-CE1 3.98Å; F185-F215 HydrophobicContact CD2-CE1 3.98Å; F185-F215 HydrophobicContact CE2-CE1 4.02Å; F185-F215 HydrophobicContact CE2-CZ 4.27Å; F185-F215 HydrophobicContact CG-CE1 4.24Å; F185-F215 HydrophobicContact CZ-CE1 4.33Å; F185-L228 HydrophobicContact CZ-CD1 4.1Å; F185-I244 HydrophobicContact CZ-CG2 4.38Å; F185-Y247 HydrophobicContact CD1-CD1 4.3Å; F185-Y247 HydrophobicContact CD1-CE1 4.39Å; F185-Y247 AromaticContact CE1-CD1 3.62Å; F185-Y247 HydrophobicContact CE1-CD1 3.62Å; F185-Y247 HydrophobicContact CE1-CE1 4.15Å; F185-Y247 HydrophobicContact CZ-CD1 4.04Å; F185-V248 HydrophobicContact CE1-CG2 3.63Å; F185-V248 HydrophobicContact CZ-CG2 4.2Å; F185-F251 HydrophobicContact CD1-CE2 4.09Å; F185-F251 HydrophobicContact CE1-CE2 4.43Å
186	N	89.3	Confident	86.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-40	177.1	-70.1	-88.9	0	0	0	111.6	G182 L183 I189 H190 I197 Y199 L202 N210 N213	G182-N186 PolarHBondContact O-N 2.71Å; G182-N186 PolarHBondContact O-ND2 3.3Å; L183-N186 PolarHBondContact O-N 3.06Å; N186-I189 PolarHBondContact O-N 3.22Å; N186-H190 VanDerWaalsContact O-CB 3.31Å; N186-H190 WeakPolarHBondContact O-CB 3.49Å; N186-H190 PolarHBondContact O-N 3.38Å; N186-I197 HydrophobicContact CB-CD1 4.16Å; N186-I197 HydrophobicContact CB-CG2 4.34Å; N186-Y199 HydrophobicContact CB-CD2 4.19Å; N186-Y199 HydrophobicContact CB-CE2 4.11Å; N186-L202 HydrophobicContact CB-CD1 3.4Å; N186-L202 VanDerWaalsContact CB-CD1 3.4Å; N186-L202 VanDerWaalsContact CG-CD1 3.42Å; N186-N210 PolarHBondContact ND2-O 3.28Å; N186-N213 PolarHBondContact OD1-ND2 2.79Å
187	A	88.6	Confident	86.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-40.6	177.9	0	0	0	0	0	112.4	T164 Y167 V170 L183 F185 R191 Y199	T164-A187 HydrophobicContact CG2-CB 3.98Å; Y167-A187 HydrophobicContact CD1-CB 4.35Å; Y167-A187 HydrophobicContact CD2-CB 3.76Å; Y167-A187 HydrophobicContact CE2-CB 3.99Å; Y167-A187 HydrophobicContact CG-CB 3.94Å; V170-A187 HydrophobicContact CG2-CB 4.26Å; L183-A187 VanDerWaalsContact O-CB 3.28Å; L183-A187 WeakPolarHBondContact O-CB 3.33Å; L183-A187 PolarHBondContact O-N 3.39Å; F185-A187 VanDerWaalsContact C-N 3.31Å; F185-A187 PolarHBondContact O-N 3.28Å; A187-R191 VanDerWaalsContact O-CB 3.24Å; A187-R191 WeakPolarHBondContact O-CB 3.5Å; A187-R191 PolarHBondContact O-N 3.5Å; A187-Y199 HydrophobicContact CB-CE2 3.69Å
188	L	88.6	Confident	86.9	Confident	1 Å²	1	36 Å²	36	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-65.2	-40.4	176.7	-79.5	-175.2	0	0	0	113.2	W159 K163 T164 W179 A184 F185 H192	W159-L188 HydrophobicContact CH2-CD1 4.28Å; W159-L188 HydrophobicContact CH2-CD2 4.21Å; W159-L188 HydrophobicContact CZ3-CD1 3.76Å; W159-L188 HydrophobicContact CZ3-CD2 4.02Å; K163-L188 HydrophobicContact CB-CD2 3.53Å; K163-L188 HydrophobicContact CG-CD2 4.45Å; T164-L188 HydrophobicContact CG2-CD2 3.8Å; T164-L188 HydrophobicContact CG2-CG 3.93Å; W179-L188 HydrophobicContact CH2-CD1 3.63Å; W179-L188 HydrophobicContact CZ3-CD1 3.94Å; A184-L188 PolarHBondContact O-N 2.78Å; A184-L188 VanDerWaalsContact O-N 3.14Å; F185-L188 PolarHBondContact O-N 2.68Å; L188-H192 PolarHBondContact O-ND1 3.16Å
189	I	88.3	Confident	86.8	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.7	-54.4	176.5	-63.3	165.4	0	0	0	109.2	F185 N186 R191 H192 R193 L196 I197 A214 V217 A218 L222 F251	F185-I189 PolarHBondContact O-N 2.74Å; N186-I189 PolarHBondContact O-N 3.22Å; I189-R191 PolarHBondContact O-N 2.87Å; I189-R191 VanDerWaalsContact O-N 3.15Å; I189-H192 PolarHBondContact O-N 3.21Å; I189-R193 CarbonylContact O-C 3.14Å; I189-R193 PolarHBondContact O-N 3Å; I189-L196 HydrophobicContact CG2-CB 4.42Å; I189-I197 HydrophobicContact CB-CD1 3.62Å; I189-I197 HydrophobicContact CB-CG1 4.48Å; I189-I197 HydrophobicContact CD1-CD1 3.93Å; I189-I197 HydrophobicContact CG1-CD1 4.38Å; I189-I197 HydrophobicContact CG2-CD1 3.59Å; I189-I197 HydrophobicContact CG2-CG1 3.96Å; I189-A214 HydrophobicContact CD1-CB 4.09Å; I189-V217 HydrophobicContact CG2-CG1 4.02Å; I189-A218 HydrophobicContact CD1-CB 4.47Å; I189-L222 HydrophobicContact CG1-CD1 4.25Å; I189-L222 HydrophobicContact CG2-CD1 4.4Å; I189-F251 HydrophobicContact CD1-CE1 3.7Å; I189-F251 HydrophobicContact CD1-CZ 4.09Å; I189-F251 HydrophobicContact CG1-CD1 4.15Å; I189-F251 HydrophobicContact CG1-CE1 3.61Å; I189-F251 HydrophobicContact CG1-CZ 4.39Å
190	H	89.4	Confident	86.4	Confident	50 Å²	50	43.4 Å²	43.4	23%	0.231	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-31.8	179.7	-178.1	-119.3	0	0	0	112.7	Y167 N186 H192 P194 I197 Y199	Y167-H190 AromaticContact CE1-ND1 3.43Å; Y167-H190 WeakPolarHBondContact CE1-ND1 3.38Å; Y167-H190 AromaticContact CZ-ND1 3.6Å; Y167-H190 PolarHBondContact OH-ND1 3.36Å; N186-H190 VanDerWaalsContact O-CB 3.31Å; N186-H190 WeakPolarHBondContact O-CB 3.49Å; N186-H190 PolarHBondContact O-N 3.38Å; H190-H192 VanDerWaalsContact C-N 3.32Å; H190-H192 PolarHBondContact O-N 2.98Å; H190-P194 VanDerWaalsContact CD2-CA 3.41Å; H190-P194 WeakPolarHBondContact CD2-CA 3.44Å; H190-P194 VanDerWaalsContact O-CA 3.27Å; H190-P194 WeakPolarHBondContact O-CA 3.21Å; H190-P194 WeakPolarHBondContact O-CB 3.26Å; H190-P194 WeakPolarHBondContact O-CD 3.26Å; H190-I197 HydrophobicContact CB-CB 4.3Å; H190-I197 PolarHBondContact CD2-O 3.37Å; H190-Y199 HydrophobicContact CB-CD2 4.38Å
191	R	85.8	Confident	86.3	Confident	123 Å²	123	44.2 Å²	44.2	46%	0.464	22%	0.224	S	C	.	.	H	α-helix	trans	-66.6	-29.8	178	-175.1	62.2	-170.8	90.1	-9.9	114.3	K163 Y167 A187 I189	K163-R191 HydrophobicContact CB-CG 4.29Å; K163-R191 HydrophobicContact CD-CG 4.3Å; K163-R191 WeakPolarHBondContact O-CG 3.4Å; Y167-R191 HydrophobicContact CE2-CB 4.15Å; Y167-R191 WeakPolarHBondContact OH-CA 3.47Å; Y167-R191 PolarHBondContact OH-N 2.71Å; A187-R191 VanDerWaalsContact O-CB 3.24Å; A187-R191 WeakPolarHBondContact O-CB 3.5Å; A187-R191 PolarHBondContact O-N 3.5Å; I189-R191 PolarHBondContact O-N 2.87Å; I189-R191 VanDerWaalsContact O-N 3.15Å
192	H	82.9	Confident	86.2	Confident	43 Å²	43	44.3 Å²	44.3	20%	0.199	22%	0.224	C	C	.	.	H	α-helix	trans	-104.6	-30.7	-178.2	-63.6	94.7	0	0	0	112.6	W159 K163 L188 I189 H190 F255	W159-H192 AromaticContact CZ2-CE1 3.58Å; W159-H192 AromaticContact CZ2-NE2 3.93Å; K163-H192 WeakPolarHBondContact CD-NE2 3.25Å; K163-H192 VanDerWaalsContact CE-NE2 3.3Å; K163-H192 WeakPolarHBondContact CE-NE2 3.49Å; K163-H192 PolarHBondContact NZ-NE2 2.77Å; L188-H192 PolarHBondContact O-ND1 3.16Å; I189-H192 PolarHBondContact O-N 3.21Å; H190-H192 VanDerWaalsContact C-N 3.32Å; H190-H192 PolarHBondContact O-N 2.98Å; H192-F255 HydrophobicContact CB-CD1 3.63Å; H192-F255 HydrophobicContact CB-CD2 4.2Å; H192-F255 HydrophobicContact CB-CE1 3.65Å; H192-F255 HydrophobicContact CB-CE2 4.21Å; H192-F255 HydrophobicContact CB-CG 3.92Å; H192-F255 HydrophobicContact CB-CZ 3.95Å; H192-F255 AromaticContact CD2-CG 3.92Å; H192-F255 AromaticContact CE1-CD2 3.92Å; H192-F255 AromaticContact CG-CD1 3.93Å; H192-F255 AromaticContact CG-CD2 3.79Å; H192-F255 AromaticContact CG-CG 3.67Å; H192-F255 AromaticContact ND1-CD2 3.55Å; H192-F255 AromaticContact ND1-CE2 3.82Å; H192-F255 AromaticContact ND1-CG 3.92Å
193	R	82.1	Confident	86	Confident	112 Å²	112	52.7 Å²	52.7	42%	0.423	26%	0.256	S	S	.	.			trans	-137.7	76.5	-179.7	-69.7	-59.6	-61.9	-106.7	-3.9	109.4	I189 D195 L196 F255	I189-R193 CarbonylContact O-C 3.14Å; I189-R193 PolarHBondContact O-N 3Å; R193-D195 VanDerWaalsContact CA-OD1 3.26Å; R193-D195 WeakPolarHBondContact CA-OD1 3.35Å; R193-D195 WeakPolarHBondContact CB-OD1 3.35Å; R193-D195 IonicContact CZ-OD1 3.09Å; R193-D195 IonicContact CZ-OD2 2.69Å; R193-D195 IonicContact NE-OD1 3.05Å; R193-D195 PolarHBondContact NE-OD1 2.65Å; R193-D195 IonicContact NE-OD2 3.19Å; R193-D195 PolarHBondContact NE-OD2 3.06Å; R193-D195 IonicContact NH2-OD1 3.58Å; R193-D195 IonicContact NH2-OD2 2.88Å; R193-D195 PolarHBondContact NH2-OD2 2.78Å; R193-D195 PolarHBondContact O-N 3.06Å; R193-L196 HydrophobicContact CB-CB 4.43Å; R193-L196 HydrophobicContact CB-CD1 3.67Å; R193-L196 HydrophobicContact CB-CG 3.94Å; R193-L196 HydrophobicContact CG-CD1 4.12Å; R193-L196 PolarHBondContact O-N 3.37Å; R193-F255 HydrophobicContact CG-CE1 4.26Å
194	P	83.3	Confident	85.6	Confident	80 Å²	80	58.8 Å²	58.8	52%	0.519	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-66	-19.4	-178.8	27.1	-34.4	0	0	0	112.8	H190 L196	H190-P194 VanDerWaalsContact CD2-CA 3.41Å; H190-P194 WeakPolarHBondContact CD2-CA 3.44Å; H190-P194 VanDerWaalsContact O-CA 3.27Å; H190-P194 WeakPolarHBondContact O-CA 3.21Å; H190-P194 WeakPolarHBondContact O-CB 3.26Å; H190-P194 WeakPolarHBondContact O-CD 3.26Å; P194-L196 PolarHBondContact O-N 3.02Å
195	D	82.2	Confident	85.4	Confident	98 Å²	98	64.9 Å²	64.9	52%	0.524	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-65.7	-17.7	174.8	59.7	-57.8	0	0	0	114.4	R193	R193-D195 VanDerWaalsContact CA-OD1 3.26Å; R193-D195 WeakPolarHBondContact CA-OD1 3.35Å; R193-D195 WeakPolarHBondContact CB-OD1 3.35Å; R193-D195 IonicContact CZ-OD1 3.09Å; R193-D195 IonicContact CZ-OD2 2.69Å; R193-D195 IonicContact NE-OD1 3.05Å; R193-D195 PolarHBondContact NE-OD1 2.65Å; R193-D195 IonicContact NE-OD2 3.19Å; R193-D195 PolarHBondContact NE-OD2 3.06Å; R193-D195 IonicContact NH2-OD1 3.58Å; R193-D195 IonicContact NH2-OD2 2.88Å; R193-D195 PolarHBondContact NH2-OD2 2.78Å; R193-D195 PolarHBondContact O-N 3.06Å
196	L	84.4	Confident	85.2	Confident	33 Å²	33	68.2 Å²	68.2	17%	0.173	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-101.2	-13.6	-171.5	-61.7	-179.1	0	0	0	115.2	I189 R193 P194 V217 H221 L222	I189-L196 HydrophobicContact CG2-CB 4.42Å; R193-L196 HydrophobicContact CB-CB 4.43Å; R193-L196 HydrophobicContact CB-CD1 3.67Å; R193-L196 HydrophobicContact CB-CG 3.94Å; R193-L196 HydrophobicContact CG-CD1 4.12Å; R193-L196 PolarHBondContact O-N 3.37Å; P194-L196 PolarHBondContact O-N 3.02Å; L196-V217 HydrophobicContact CB-CG1 3.78Å; L196-V217 HydrophobicContact CD1-CG1 4.27Å; L196-H221 HydrophobicContact CD1-CB 3.76Å; L196-H221 HydrophobicContact CD2-CB 4.04Å; L196-L222 HydrophobicContact CD1-CD2 4.14Å
197	I	86.1	Confident	85	Confident	7 Å²	7	69.6 Å²	69.6	4%	0.036	34%	0.342	C	S	.	.			trans	-142.6	122.7	-175.8	-64	-170.3	0	0	0	110.9	N186 I189 H190 Y199 L202 V217	N186-I197 HydrophobicContact CB-CD1 4.16Å; N186-I197 HydrophobicContact CB-CG2 4.34Å; I189-I197 HydrophobicContact CB-CD1 3.62Å; I189-I197 HydrophobicContact CB-CG1 4.48Å; I189-I197 HydrophobicContact CD1-CD1 3.93Å; I189-I197 HydrophobicContact CG1-CD1 4.38Å; I189-I197 HydrophobicContact CG2-CD1 3.59Å; I189-I197 HydrophobicContact CG2-CG1 3.96Å; H190-I197 HydrophobicContact CB-CB 4.3Å; H190-I197 PolarHBondContact CD2-O 3.37Å; I197-Y199 PolarHBondContact O-N 3.15Å; I197-Y199 VanDerWaalsContact O-N 3.15Å; I197-L202 HydrophobicContact CG2-CD1 4.16Å; I197-V217 HydrophobicContact CD1-CG1 4.39Å; I197-V217 HydrophobicContact CG1-CG1 4.12Å; I197-V217 HydrophobicContact CG1-CG2 4.26Å
198	D	85.6	Confident	85	Confident	108 Å²	108	71.8 Å²	71.8	58%	0.578	36%	0.355	S	S	*	.			trans	-76.9	94.2	163.4	178.4	-1.1	0	0	0	109.6	D200 S201	D198-D200 PolarHBondContact OD1-N 2.95Å; D198-S201 PolarHBondContact O-OG 3.04Å; D198-S201 PolarHBondContact OD1-N 3.03Å
199	Y	85.3	Confident	85	Confident	17 Å²	17	75.5 Å²	75.5	7%	0.067	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-71.8	-27.3	-175.3	-167.2	-88.9	0	0	0	113.5	Y167 V170 N186 A187 H190 I197 S201 L202	Y167-Y199 AromaticContact CD1-CD1 3.76Å; Y167-Y199 HydrophobicContact CD1-CD1 3.76Å; Y167-Y199 HydrophobicContact CD1-CD2 4.38Å; Y167-Y199 AromaticContact CD1-CE1 3.47Å; Y167-Y199 HydrophobicContact CD1-CE1 3.47Å; Y167-Y199 VanDerWaalsContact CD1-CE1 3.47Å; Y167-Y199 HydrophobicContact CD1-CE2 4.13Å; Y167-Y199 HydrophobicContact CD1-CG 4.21Å; Y167-Y199 AromaticContact CD1-CZ 3.68Å; Y167-Y199 AromaticContact CE1-CD1 3.97Å; Y167-Y199 HydrophobicContact CE1-CD1 3.97Å; Y167-Y199 HydrophobicContact CE1-CD2 4.21Å; Y167-Y199 HydrophobicContact CE1-CE1 4.13Å; Y167-Y199 HydrophobicContact CE1-CE2 4.36Å; Y167-Y199 HydrophobicContact CE1-CG 4.02Å; Y167-Y199 HydrophobicContact CG-CE1 4.35Å; V170-Y199 VanDerWaalsContact CG2-OH 3.22Å; V170-Y199 WeakPolarHBondContact CG2-OH 3.45Å; N186-Y199 HydrophobicContact CB-CD2 4.19Å; N186-Y199 HydrophobicContact CB-CE2 4.11Å; A187-Y199 HydrophobicContact CB-CE2 3.69Å; H190-Y199 HydrophobicContact CB-CD2 4.38Å; I197-Y199 PolarHBondContact O-N 3.15Å; I197-Y199 VanDerWaalsContact O-N 3.15Å; Y199-S201 VanDerWaalsContact C-N 3.26Å; Y199-S201 PolarHBondContact O-N 3.37Å; Y199-L202 HydrophobicContact CD2-CD1 4.02Å; Y199-L202 HydrophobicContact CE2-CD1 4.33Å; Y199-L202 PolarHBondContact O-N 3.31Å
200	D	82.8	Confident	85	Confident	158 Å²	158	75.7 Å²	75.7	85%	0.845	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-74.4	-19.9	-177.6	-72.4	-28.9	0	0	0	112.2	D198 L202	D198-D200 PolarHBondContact OD1-N 2.95Å; D200-L202 VanDerWaalsContact C-N 3.31Å
201	S	84.1	Confident	85	Confident	70 Å²	70	73.3 Å²	73.3	49%	0.49	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-70.5	-22.2	173.1	75.4	0	0	0	0	114.3	D198 Y199	D198-S201 PolarHBondContact O-OG 3.04Å; D198-S201 PolarHBondContact OD1-N 3.03Å; Y199-S201 VanDerWaalsContact C-N 3.26Å; Y199-S201 PolarHBondContact O-N 3.37Å
202	L	85.1	Confident	85.2	Confident	25 Å²	25	70.7 Å²	70.7	13%	0.131	36%	0.363	C	S	.	.			trans	-83.5	141.5	-168.4	-56.6	176.7	0	0	0	112.6	L183 N186 I197 Y199 D200	L183-L202 HydrophobicContact CD2-CB 3.83Å; N186-L202 HydrophobicContact CB-CD1 3.4Å; N186-L202 VanDerWaalsContact CB-CD1 3.4Å; N186-L202 VanDerWaalsContact CG-CD1 3.42Å; I197-L202 HydrophobicContact CG2-CD1 4.16Å; Y199-L202 HydrophobicContact CD2-CD1 4.02Å; Y199-L202 HydrophobicContact CE2-CD1 4.33Å; Y199-L202 PolarHBondContact O-N 3.31Å; D200-L202 VanDerWaalsContact C-N 3.31Å
203	R	82.3	Confident	85.5	Confident	176 Å²	176	71.4 Å²	71.4	66%	0.664	37%	0.368	S	S	*	.			trans	-133.1	146.8	-177.9	-52	-175.7	171	-154.4	-2.4	113	D205 D206 N210	R203-D205 VanDerWaalsContact C-N 3.28Å; R203-D205 WeakPolarHBondContact CB-OD1 3.37Å; R203-D205 PolarHBondContact O-N 2.83Å; R203-D206 PolarHBondContact O-N 3.46Å; R203-N210 PolarHBondContact O-ND2 2.76Å
204	K	82.2	Confident	85.8	Confident	133 Å²	133	66.1 Å²	66.1	58%	0.578	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.3	-173.9	-170.4	169.8	178.3	111.2	0	114.1	D181 L183	D181-K204 HydrophobicContact CB-CG 4.12Å; D181-K204 WeakPolarHBondContact OD2-CE 3.45Å; D181-K204 IonicContact OD2-NZ 3.15Å; D181-K204 PolarHBondContact OD2-NZ 2.8Å; L183-K204 HydrophobicContact CD1-CB 3.96Å; L183-K204 HydrophobicContact CD1-CG 4.26Å
205	D	83.5	Confident	86.2	Confident	128 Å²	128	62.3 Å²	62.3	68%	0.684	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.3	179.2	52.3	-34.9	0	0	0	114	R203 P207	R203-D205 VanDerWaalsContact C-N 3.28Å; R203-D205 WeakPolarHBondContact CB-OD1 3.37Å; R203-D205 PolarHBondContact O-N 2.83Å; D205-P207 VanDerWaalsContact C-CD 3.48Å; D205-P207 VanDerWaalsContact O-CD 3.27Å; D205-P207 WeakPolarHBondContact O-CD 3.31Å
206	D	87.7	Confident	86.4	Confident	71 Å²	71	61.5 Å²	61.5	38%	0.38	32%	0.317	S	S	.	.			trans	-116.5	76.5	173.5	-170.5	-4.6	0	0	0	112.4	R203 V208 T209 N210	R203-D206 PolarHBondContact O-N 3.46Å; D206-V208 VanDerWaalsContact C-N 3.3Å; D206-V208 PolarHBondContact O-N 3.02Å; D206-V208 PolarHBondContact OD1-N 2.99Å; D206-T209 VanDerWaalsContact CG-CB 3.46Å; D206-T209 PolarHBondContact OD1-N 3.15Å; D206-T209 VanDerWaalsContact OD1-N 3.1Å; D206-T209 PolarHBondContact OD1-OG1 3.3Å; D206-T209 WeakPolarHBondContact OD2-CB 3.21Å; D206-T209 PolarHBondContact OD2-OG1 3.41Å; D206-N210 PolarHBondContact O-N 2.94Å; D206-N210 PolarHBondContact O-ND2 2.75Å; D206-N210 PolarHBondContact O-OD1 3.19Å
207	P	85.6	Confident	86.6	Confident	29 Å²	29	60.6 Å²	60.6	19%	0.188	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-27.4	-177.9	30.1	-37.5	0	0	0	113.2	K180 D205 L211 V234	K180-P207 WeakPolarHBondContact O-CB 3.4Å; D205-P207 VanDerWaalsContact C-CD 3.48Å; D205-P207 VanDerWaalsContact O-CD 3.27Å; D205-P207 WeakPolarHBondContact O-CD 3.31Å; P207-L211 WeakPolarHBondContact O-CB 3.43Å; P207-L211 WeakPolarHBondContact O-CD1 3.49Å; P207-L211 WeakPolarHBondContact O-CG 3.41Å; P207-L211 PolarHBondContact O-N 2.91Å; P207-L211 VanDerWaalsContact O-N 3.09Å; P207-V234 HydrophobicContact CB-CG2 3.8Å; P207-V234 HydrophobicContact CG-CG1 4.03Å; P207-V234 HydrophobicContact CG-CG2 3.83Å
208	V	87.6	Confident	86.7	Confident	46 Å²	46	60.3 Å²	60.3	28%	0.279	31%	0.311	S	S	.	.	H	α-helix	trans	-72.2	-46.5	-176.1	179	0	0	0	0	110.2	D206 L211 N212 A230 V234	D206-V208 VanDerWaalsContact C-N 3.3Å; D206-V208 PolarHBondContact O-N 3.02Å; D206-V208 PolarHBondContact OD1-N 2.99Å; V208-L211 PolarHBondContact O-N 2.75Å; V208-N212 PolarHBondContact O-N 2.97Å; V208-N212 VanDerWaalsContact O-N 3.07Å; V208-N212 PolarHBondContact O-ND2 3.05Å; V208-A230 HydrophobicContact CG1-CB 4.05Å; V208-V234 HydrophobicContact CG2-CB 4.16Å; V208-V234 HydrophobicContact CG2-CG1 4.24Å; V208-V234 HydrophobicContact CG2-CG2 3.87Å
209	T	87.9	Confident	86.7	Confident	79 Å²	79	58.8 Å²	58.8	49%	0.485	30%	0.301	S	S	.	.	H	α-helix	trans	-65.1	-42.4	176.5	-57.6	0	0	0	0	111.4	D206 L211 N212 N213	D206-T209 VanDerWaalsContact CG-CB 3.46Å; D206-T209 PolarHBondContact OD1-N 3.15Å; D206-T209 VanDerWaalsContact OD1-N 3.1Å; D206-T209 PolarHBondContact OD1-OG1 3.3Å; D206-T209 WeakPolarHBondContact OD2-CB 3.21Å; D206-T209 PolarHBondContact OD2-OG1 3.41Å; T209-L211 PolarHBondContact O-N 3.46Å; T209-N212 PolarHBondContact O-N 2.94Å; T209-N213 WeakPolarHBondContact O-CB 3.46Å; T209-N213 PolarHBondContact O-N 3.4Å
210	N	89.5	Confident	86.7	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-58	-46.9	177	-67.3	-19.2	0	0	0	112.3	D181 N186 R203 D206 A214	D181-N210 WeakPolarHBondContact O-CB 3.45Å; D181-N210 PolarHBondContact O-ND2 2.86Å; N186-N210 PolarHBondContact ND2-O 3.28Å; R203-N210 PolarHBondContact O-ND2 2.76Å; D206-N210 PolarHBondContact O-N 2.94Å; D206-N210 PolarHBondContact O-ND2 2.75Å; D206-N210 PolarHBondContact O-OD1 3.19Å; N210-A214 PolarHBondContact O-N 3.26Å
211	L	89.1	Confident	86.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-50	179.6	-74.2	165.6	0	0	0	111	F185 P207 V208 T209 N213 A214 F215 A230 I233 V234	F185-L211 HydrophobicContact CD2-CD2 3.77Å; F185-L211 HydrophobicContact CE2-CD2 3.91Å; P207-L211 WeakPolarHBondContact O-CB 3.43Å; P207-L211 WeakPolarHBondContact O-CD1 3.49Å; P207-L211 WeakPolarHBondContact O-CG 3.41Å; P207-L211 PolarHBondContact O-N 2.91Å; P207-L211 VanDerWaalsContact O-N 3.09Å; V208-L211 PolarHBondContact O-N 2.75Å; T209-L211 PolarHBondContact O-N 3.46Å; L211-N213 VanDerWaalsContact C-N 3.32Å; L211-N213 PolarHBondContact O-N 2.8Å; L211-A214 PolarHBondContact O-N 2.85Å; L211-F215 HydrophobicContact CB-CE2 4Å; L211-F215 HydrophobicContact CB-CZ 4.13Å; L211-F215 HydrophobicContact CD2-CE1 4.25Å; L211-F215 HydrophobicContact CD2-CE2 4.36Å; L211-F215 HydrophobicContact CD2-CZ 3.7Å; L211-F215 WeakPolarHBondContact O-CD1 3.09Å; L211-F215 WeakPolarHBondContact O-CD2 3.42Å; L211-F215 WeakPolarHBondContact O-CG 3.38Å; L211-F215 PolarHBondContact O-N 2.7Å; L211-A230 HydrophobicContact CB-CB 3.61Å; L211-A230 HydrophobicContact CD1-CB 4.13Å; L211-I233 HydrophobicContact CD1-CB 4.06Å; L211-I233 HydrophobicContact CD1-CD1 4.4Å; L211-I233 HydrophobicContact CD1-CG2 3.75Å; L211-I233 HydrophobicContact CD2-CD1 4.28Å; L211-V234 HydrophobicContact CD1-CG2 3.9Å
212	N	89.9	Confident	86.6	Confident	67 Å²	67	60.7 Å²	60.7	36%	0.358	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-38.5	179.4	-75.4	-30.2	0	0	0	112.6	V208 T209 F215 E216 A230	V208-N212 PolarHBondContact O-N 2.97Å; V208-N212 VanDerWaalsContact O-N 3.07Å; V208-N212 PolarHBondContact O-ND2 3.05Å; T209-N212 PolarHBondContact O-N 2.94Å; N212-F215 PolarHBondContact O-N 3.01Å; N212-E216 WeakPolarHBondContact O-CB 3.5Å; N212-E216 PolarHBondContact O-N 2.72Å; N212-A230 VanDerWaalsContact OD1-CB 3.3Å; N212-A230 WeakPolarHBondContact OD1-CB 3.4Å
213	N	89	Confident	86.4	Confident	59 Å²	59	64.1 Å²	64.1	32%	0.316	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-51.7	175.5	-176.6	56.7	0	0	0	111.9	N186 T209 L211 F215 E216 V217	N186-N213 PolarHBondContact OD1-ND2 2.79Å; T209-N213 WeakPolarHBondContact O-CB 3.46Å; T209-N213 PolarHBondContact O-N 3.4Å; L211-N213 VanDerWaalsContact C-N 3.32Å; L211-N213 PolarHBondContact O-N 2.8Å; N213-F215 VanDerWaalsContact C-N 3.3Å; N213-F215 PolarHBondContact O-N 3.09Å; N213-E216 PolarHBondContact O-N 2.96Å; N213-V217 WeakPolarHBondContact O-CG2 3.32Å; N213-V217 PolarHBondContact O-N 3.23Å
214	A	88.6	Confident	86.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-40.5	178.3	0	0	0	0	0	112.1	F185 I189 N210 L211 A218	F185-A214 HydrophobicContact CB-CB 3.61Å; I189-A214 HydrophobicContact CD1-CB 4.09Å; N210-A214 PolarHBondContact O-N 3.26Å; L211-A214 PolarHBondContact O-N 2.85Å; A214-A218 WeakPolarHBondContact O-CB 3.25Å; A214-A218 PolarHBondContact O-N 3.39Å
215	F	90.8	Very high	86.5	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-70.5	-35.1	-179	-58.4	-13.6	0	0	0	112.2	F185 L211 N212 N213 E219 K226 L228 I233 Y247	F185-F215 AromaticContact CD2-CE1 3.98Å; F185-F215 HydrophobicContact CD2-CE1 3.98Å; F185-F215 HydrophobicContact CE2-CE1 4.02Å; F185-F215 HydrophobicContact CE2-CZ 4.27Å; F185-F215 HydrophobicContact CG-CE1 4.24Å; F185-F215 HydrophobicContact CZ-CE1 4.33Å; L211-F215 HydrophobicContact CB-CE2 4Å; L211-F215 HydrophobicContact CB-CZ 4.13Å; L211-F215 HydrophobicContact CD2-CE1 4.25Å; L211-F215 HydrophobicContact CD2-CE2 4.36Å; L211-F215 HydrophobicContact CD2-CZ 3.7Å; L211-F215 WeakPolarHBondContact O-CD1 3.09Å; L211-F215 WeakPolarHBondContact O-CD2 3.42Å; L211-F215 WeakPolarHBondContact O-CG 3.38Å; L211-F215 PolarHBondContact O-N 2.7Å; N212-F215 PolarHBondContact O-N 3.01Å; N213-F215 VanDerWaalsContact C-N 3.3Å; N213-F215 PolarHBondContact O-N 3.09Å; F215-E219 WeakPolarHBondContact O-CB 3.23Å; F215-E219 PolarHBondContact O-N 3.34Å; F215-K226 HydrophobicContact CB-CD 4.46Å; F215-K226 HydrophobicContact CB-CG 4.12Å; F215-L228 WeakPolarHBondContact CD2-O 3.34Å; F215-L228 HydrophobicContact CE1-CB 4.47Å; F215-L228 HydrophobicContact CE2-CB 3.71Å; F215-L228 WeakPolarHBondContact CE2-O 3.14Å; F215-L228 HydrophobicContact CZ-CB 3.68Å; F215-L228 HydrophobicContact CZ-CD1 4.12Å; F215-I233 HydrophobicContact CE2-CD1 4.35Å; F215-I233 HydrophobicContact CZ-CD1 4.02Å; F215-Y247 HydrophobicContact CD1-CD1 4.43Å; F215-Y247 AromaticContact CD1-CE1 3.42Å; F215-Y247 HydrophobicContact CD1-CE1 3.42Å; F215-Y247 VanDerWaalsContact CD1-CE1 3.42Å; F215-Y247 AromaticContact CD1-CZ 3.9Å; F215-Y247 HydrophobicContact CE1-CD1 4.04Å; F215-Y247 AromaticContact CE1-CE1 3.43Å; F215-Y247 HydrophobicContact CE1-CE1 3.43Å; F215-Y247 VanDerWaalsContact CE1-CE1 3.43Å; F215-Y247 HydrophobicContact CG-CE1 4.41Å; F215-Y247 HydrophobicContact CZ-CE1 4.42Å
216	E	88.1	Confident	86.7	Confident	81 Å²	81	48.9 Å²	48.9	38%	0.379	25%	0.25	S	C	.	.	H	α-helix	trans	-69.8	-43.7	172.9	-82.4	-162.7	-155.2	0	0	113.6	N212 N213 A218 E219 K220 K226	N212-E216 WeakPolarHBondContact O-CB 3.5Å; N212-E216 PolarHBondContact O-N 2.72Å; N213-E216 PolarHBondContact O-N 2.96Å; E216-A218 VanDerWaalsContact C-N 3.33Å; E216-E219 PolarHBondContact O-N 3.49Å; E216-K220 WeakPolarHBondContact O-CB 3.38Å; E216-K220 WeakPolarHBondContact O-CG 3.39Å; E216-K220 PolarHBondContact O-N 3.1Å; E216-K220 IonicContact OE2-NZ 3.84Å; E216-K220 PolarHBondContact OE2-NZ 3.26Å; E216-K226 VanDerWaalsContact CG-CE 3.5Å
217	V	87.6	Confident	86.5	Confident	14 Å²	14	45.7 Å²	45.7	9%	0.085	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-41.9	177.6	171	0	0	0	0	110.5	I189 L196 I197 N213 E219 H221	I189-V217 HydrophobicContact CG2-CG1 4.02Å; L196-V217 HydrophobicContact CB-CG1 3.78Å; L196-V217 HydrophobicContact CD1-CG1 4.27Å; I197-V217 HydrophobicContact CD1-CG1 4.39Å; I197-V217 HydrophobicContact CG1-CG1 4.12Å; I197-V217 HydrophobicContact CG1-CG2 4.26Å; N213-V217 WeakPolarHBondContact O-CG2 3.32Å; N213-V217 PolarHBondContact O-N 3.23Å; V217-E219 PolarHBondContact O-N 3.39Å; V217-H221 WeakPolarHBondContact O-CB 3.36Å; V217-H221 PolarHBondContact O-N 2.71Å
218	A	87.5	Confident	86.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-41.3	176.9	0	0	0	0	0	112.9	I189 A214 E216 L222 D223 I224 F251	I189-A218 HydrophobicContact CD1-CB 4.47Å; A214-A218 WeakPolarHBondContact O-CB 3.25Å; A214-A218 PolarHBondContact O-N 3.39Å; E216-A218 VanDerWaalsContact C-N 3.33Å; A218-L222 CarbonylContact O-C 3.35Å; A218-L222 WeakPolarHBondContact O-CA 3.27Å; A218-L222 WeakPolarHBondContact O-CB 3.45Å; A218-L222 PolarHBondContact O-N 2.74Å; A218-L222 VanDerWaalsContact O-N 3.11Å; A218-D223 PolarHBondContact O-N 3.07Å; A218-D223 VanDerWaalsContact O-N 3.16Å; A218-I224 CarbonylContact C-O 3.34Å; A218-I224 HydrophobicContact CB-CB 4.17Å; A218-I224 PolarHBondContact O-N 3.45Å; A218-I224 VanDerWaalsContact O-N 3.07Å; A218-F251 HydrophobicContact CB-CE1 3.66Å; A218-F251 HydrophobicContact CB-CZ 3.55Å
219	E	85.6	Confident	86.4	Confident	77 Å²	77	46 Å²	46	36%	0.36	23%	0.231	S	C	.	.	H	α-helix	trans	-71.2	-45.6	178.5	-177.6	169.8	-108.6	0	0	112.4	F215 E216 V217 I224 K226	F215-E219 WeakPolarHBondContact O-CB 3.23Å; F215-E219 PolarHBondContact O-N 3.34Å; E216-E219 PolarHBondContact O-N 3.49Å; V217-E219 PolarHBondContact O-N 3.39Å; E219-I224 WeakPolarHBondContact CA-O 3.12Å; E219-I224 PolarHBondContact N-O 2.86Å; E219-K226 HydrophobicContact CB-CG 4.22Å; E219-K226 PolarHBondContact OE1-N 3.16Å; E219-K226 WeakPolarHBondContact OE2-CE 3.33Å; E219-K226 IonicContact OE2-NZ 2.85Å; E219-K226 PolarHBondContact OE2-NZ 3.4Å
220	K	85.4	Confident	86.3	Confident	135 Å²	135	42.3 Å²	42.3	59%	0.587	21%	0.209	S	C	*	.	H	α-helix	trans	-74.9	-35.7	-175.6	-70.5	171	-177.3	161.7	0	113.9	E216	E216-K220 WeakPolarHBondContact O-CB 3.38Å; E216-K220 WeakPolarHBondContact O-CG 3.39Å; E216-K220 PolarHBondContact O-N 3.1Å; E216-K220 IonicContact OE2-NZ 3.84Å; E216-K220 PolarHBondContact OE2-NZ 3.26Å
221	H	83.5	Confident	86	Confident	115 Å²	115	49.3 Å²	49.3	53%	0.532	24%	0.241	S	C	.	.	H	α-helix	trans	-117.8	-17.5	-168.7	-62.6	-75.7	0	0	0	114.8	L196 V217	L196-H221 HydrophobicContact CD1-CB 3.76Å; L196-H221 HydrophobicContact CD2-CB 4.04Å; V217-H221 WeakPolarHBondContact O-CB 3.36Å; V217-H221 PolarHBondContact O-N 2.71Å
222	L	81.4	Confident	85.6	Confident	34 Å²	34	50.8 Å²	50.8	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-117.4	-0.4	-179.4	-51.7	175.9	0	0	0	113.2	I189 L196 A218 I224 F251 F255	I189-L222 HydrophobicContact CG1-CD1 4.25Å; I189-L222 HydrophobicContact CG2-CD1 4.4Å; L196-L222 HydrophobicContact CD1-CD2 4.14Å; A218-L222 CarbonylContact O-C 3.35Å; A218-L222 WeakPolarHBondContact O-CA 3.27Å; A218-L222 WeakPolarHBondContact O-CB 3.45Å; A218-L222 PolarHBondContact O-N 2.74Å; A218-L222 VanDerWaalsContact O-N 3.11Å; L222-I224 HydrophobicContact CB-CD1 4Å; L222-I224 HydrophobicContact CB-CG1 4.1Å; L222-I224 HydrophobicContact CD1-CD1 4.38Å; L222-I224 PolarHBondContact O-N 2.9Å; L222-I224 VanDerWaalsContact O-N 3.16Å; L222-F251 HydrophobicContact CD1-CD1 4.25Å; L222-F251 HydrophobicContact CD1-CE1 4.02Å; L222-F255 HydrophobicContact CD1-CE1 4.15Å; L222-F255 HydrophobicContact CD1-CZ 3.66Å; L222-F255 HydrophobicContact CD2-CE1 4.07Å; L222-F255 HydrophobicContact CD2-CZ 4.41Å
223	D	81.8	Confident	85.3	Confident	98 Å²	98	47.7 Å²	47.7	52%	0.524	23%	0.232	S	C	.	.			trans	54.8	24.2	-175	-168.3	36.3	0	0	0	114.6	R52 A218 P225	R52-D223 IonicContact CZ-OD1 3.66Å; R52-D223 IonicContact CZ-OD2 3.54Å; R52-D223 IonicContact NH1-OD1 3.86Å; R52-D223 PolarHBondContact NH1-OD1 3.39Å; R52-D223 IonicContact NH1-OD2 2.7Å; R52-D223 PolarHBondContact NH2-O 3.47Å; R52-D223 IonicContact NH2-OD1 2.7Å; R52-D223 PolarHBondContact NH2-OD1 2.94Å; R52-D223 VanDerWaalsContact NH2-OD1 3.12Å; R52-D223 IonicContact NH2-OD2 2.66Å; R52-D223 PolarHBondContact NH2-OD2 3.38Å; A218-D223 PolarHBondContact O-N 3.07Å; A218-D223 VanDerWaalsContact O-N 3.16Å; D223-P225 WeakPolarHBondContact O-CD 3.3Å
224	I	84.9	Confident	85.1	Confident	9 Å²	9	46.7 Å²	46.7	5%	0.046	23%	0.229	C	C	.	.			trans	-92.8	105.6	174.8	-59.6	171.4	0	0	0	107.5	A218 E219 L222 Y247 C250 F251 A254	A218-I224 CarbonylContact C-O 3.34Å; A218-I224 HydrophobicContact CB-CB 4.17Å; A218-I224 PolarHBondContact O-N 3.45Å; A218-I224 VanDerWaalsContact O-N 3.07Å; E219-I224 WeakPolarHBondContact CA-O 3.12Å; E219-I224 PolarHBondContact N-O 2.86Å; L222-I224 HydrophobicContact CB-CD1 4Å; L222-I224 HydrophobicContact CB-CG1 4.1Å; L222-I224 HydrophobicContact CD1-CD1 4.38Å; L222-I224 PolarHBondContact O-N 2.9Å; L222-I224 VanDerWaalsContact O-N 3.16Å; I224-Y247 HydrophobicContact CG2-CD2 4.36Å; I224-Y247 HydrophobicContact CG2-CE2 3.66Å; I224-C250 HydrophobicContact CG2-CB 3.94Å; I224-F251 HydrophobicContact CD1-CB 4.48Å; I224-F251 HydrophobicContact CD1-CD1 3.51Å; I224-F251 HydrophobicContact CD1-CD2 4.49Å; I224-F251 HydrophobicContact CD1-CE1 3.77Å; I224-F251 HydrophobicContact CD1-CG 3.92Å; I224-F251 HydrophobicContact CD1-CZ 4.38Å; I224-A254 HydrophobicContact CD1-CB 4.02Å
225	P	82.3	Confident	84.6	Confident	26 Å²	26	50 Å²	50	17%	0.169	26%	0.262	C	S	.	.			trans	-68.9	154.8	-172.2	29.2	-35.2	0	0	0	111.7	D223 M227 Y247	D223-P225 WeakPolarHBondContact O-CD 3.3Å; P225-M227 HydrophobicContact CG-CE 3.87Å; P225-M227 WeakPolarHBondContact O-CG 3.27Å; P225-M227 PolarHBondContact O-N 2.87Å; P225-Y247 WeakPolarHBondContact O-CE2 3.42Å
226	K	85.9	Confident	84	Confident	81 Å²	81	51.3 Å²	51.3	35%	0.352	27%	0.271	S	S	.	.			trans	-65.9	108.1	177.2	-63.8	-177.3	179.9	124.4	0	111.2	F215 E216 E219	F215-K226 HydrophobicContact CB-CD 4.46Å; F215-K226 HydrophobicContact CB-CG 4.12Å; E216-K226 VanDerWaalsContact CG-CE 3.5Å; E219-K226 HydrophobicContact CB-CG 4.22Å; E219-K226 PolarHBondContact OE1-N 3.16Å; E219-K226 WeakPolarHBondContact OE2-CE 3.33Å; E219-K226 IonicContact OE2-NZ 2.85Å; E219-K226 PolarHBondContact OE2-NZ 3.4Å
227	M	84.1	Confident	83.5	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.025	29%	0.291	C	S	.	.			trans	-102.1	-14	177.5	-50.5	-173.6	-169.9	0	0	113.4	T42 A45 W46 P225 T246 Y247	T42-M227 VanDerWaalsContact CA-O 3.26Å; T42-M227 WeakPolarHBondContact CA-O 3.14Å; T42-M227 HydrophobicContact CG2-CB 4.02Å; T42-M227 PolarHBondContact OG1-O 3.27Å; A45-M227 HydrophobicContact CB-CB 3.93Å; A45-M227 HydrophobicContact CB-CG 3.82Å; W46-M227 HydrophobicContact CB-CE 4.32Å; W46-M227 HydrophobicContact CB-SD 3.78Å; W46-M227 HydrophobicContact CG-SD 4.36Å; P225-M227 HydrophobicContact CG-CE 3.87Å; P225-M227 WeakPolarHBondContact O-CG 3.27Å; P225-M227 PolarHBondContact O-N 2.87Å; M227-T246 HydrophobicContact SD-CG2 4.4Å; M227-Y247 HydrophobicContact CB-CD2 3.76Å; M227-Y247 HydrophobicContact CB-CE2 4.24Å; M227-Y247 HydrophobicContact CG-CD2 3.74Å; M227-Y247 HydrophobicContact CG-CE2 4.07Å; M227-Y247 HydrophobicContact SD-CD2 3.96Å
228	L	86.3	Confident	83.2	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	31%	0.314	C	S	.	.			trans	-125.5	138.2	-173.3	-67.3	175.6	0	0	0	110.1	T42 F185 F215 I233 A243 I244 Y247	T42-L228 HydrophobicContact CG2-CD2 4.14Å; T42-L228 WeakPolarHBondContact OG1-CD2 3.25Å; F185-L228 HydrophobicContact CZ-CD1 4.1Å; F215-L228 WeakPolarHBondContact CD2-O 3.34Å; F215-L228 HydrophobicContact CE1-CB 4.47Å; F215-L228 HydrophobicContact CE2-CB 3.71Å; F215-L228 WeakPolarHBondContact CE2-O 3.14Å; F215-L228 HydrophobicContact CZ-CB 3.68Å; F215-L228 HydrophobicContact CZ-CD1 4.12Å; L228-I233 HydrophobicContact CB-CD1 3.93Å; L228-I233 HydrophobicContact CD1-CD1 4.07Å; L228-I233 HydrophobicContact CD2-CD1 4.48Å; L228-I233 HydrophobicContact CG-CD1 4.39Å; L228-A243 HydrophobicContact CD2-CB 3.89Å; L228-I244 HydrophobicContact CD1-CG1 4.3Å; L228-Y247 HydrophobicContact CD1-CD1 3.56Å; L228-Y247 HydrophobicContact CD1-CE1 4.45Å; L228-Y247 HydrophobicContact CD1-CG 3.81Å; L228-Y247 HydrophobicContact CG-CD1 4.26Å; L228-Y247 HydrophobicContact CG-CG 4.19Å
229	D	84.9	Confident	83.1	Confident	76 Å²	76	60.5 Å²	60.5	41%	0.406	32%	0.315	S	S	.	.			trans	-98.6	129.6	172.6	-69.6	-36.2	0	0	0	110.4	K41 E231 D232 I233	K41-D229 VanDerWaalsContact CD-OD2 3.28Å; K41-D229 WeakPolarHBondContact CD-OD2 3.5Å; K41-D229 WeakPolarHBondContact CE-OD2 3.37Å; K41-D229 IonicContact NZ-OD2 3.97Å; K41-D229 PolarHBondContact NZ-OD2 3.31Å; D229-E231 VanDerWaalsContact C-N 3.3Å; D229-E231 PolarHBondContact O-N 3.16Å; D229-D232 HydrophobicContact CB-CB 4.34Å; D229-D232 PolarHBondContact O-N 2.91Å; D229-I233 PolarHBondContact O-N 2.84Å
230	A	85.2	Confident	83.1	Confident	2 Å²	2	57.8 Å²	57.8	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-38.5	-178.6	0	0	0	0	0	112.8	V208 L211 N212 I233 V234	V208-A230 HydrophobicContact CG1-CB 4.05Å; L211-A230 HydrophobicContact CB-CB 3.61Å; L211-A230 HydrophobicContact CD1-CB 4.13Å; N212-A230 VanDerWaalsContact OD1-CB 3.3Å; N212-A230 WeakPolarHBondContact OD1-CB 3.4Å; A230-I233 PolarHBondContact O-N 3.4Å; A230-V234 WeakPolarHBondContact O-CG2 3.42Å; A230-V234 PolarHBondContact O-N 2.98Å
231	E	83.1	Confident	83.2	Confident	152 Å²	152	54 Å²	54	71%	0.71	29%	0.288	S	S	*	.	H	α-helix	trans	-64.9	-43.4	179	-62.5	-176.6	175.3	0	0	112.5	D229 I233 V234 G235	D229-E231 VanDerWaalsContact C-N 3.3Å; D229-E231 PolarHBondContact O-N 3.16Å; E231-I233 VanDerWaalsContact C-N 3.33Å; E231-I233 PolarHBondContact O-N 2.71Å; E231-V234 PolarHBondContact O-N 3.45Å; E231-G235 PolarHBondContact O-N 2.78Å
232	D	82.2	Confident	83.3	Confident	31 Å²	31	51.5 Å²	51.5	17%	0.166	28%	0.275	C	S	.	.	H	α-helix	trans	-66.8	-34.7	178.6	-78	-26.4	0	0	0	110.9	K37 K41 D229 T236	K37-D232 IonicContact NZ-OD1 3.3Å; K37-D232 PolarHBondContact NZ-OD1 3.27Å; K37-D232 IonicContact NZ-OD2 3.14Å; K41-D232 IonicContact NZ-OD2 3.61Å; K41-D232 PolarHBondContact NZ-OD2 3.32Å; D229-D232 HydrophobicContact CB-CB 4.34Å; D229-D232 PolarHBondContact O-N 2.91Å; D232-T236 WeakPolarHBondContact O-CB 3.28Å; D232-T236 PolarHBondContact O-N 2.85Å; D232-T236 PolarHBondContact O-OG1 2.64Å
233	I	83.3	Confident	83.6	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-45.7	174.6	-70.5	170.8	0	0	0	111.8	K180 L211 F215 L228 D229 A230 E231 P239	K180-I233 WeakPolarHBondContact CE-O 3.36Å; K180-I233 HydrophobicContact CG-CG2 4.3Å; L211-I233 HydrophobicContact CD1-CB 4.06Å; L211-I233 HydrophobicContact CD1-CD1 4.4Å; L211-I233 HydrophobicContact CD1-CG2 3.75Å; L211-I233 HydrophobicContact CD2-CD1 4.28Å; F215-I233 HydrophobicContact CE2-CD1 4.35Å; F215-I233 HydrophobicContact CZ-CD1 4.02Å; L228-I233 HydrophobicContact CB-CD1 3.93Å; L228-I233 HydrophobicContact CD1-CD1 4.07Å; L228-I233 HydrophobicContact CD2-CD1 4.48Å; L228-I233 HydrophobicContact CG-CD1 4.39Å; D229-I233 PolarHBondContact O-N 2.84Å; A230-I233 PolarHBondContact O-N 3.4Å; E231-I233 VanDerWaalsContact C-N 3.33Å; E231-I233 PolarHBondContact O-N 2.71Å; I233-P239 HydrophobicContact CG2-CB 4.4Å; I233-P239 HydrophobicContact CG2-CG 3.96Å
234	V	84.5	Confident	83.9	Confident	39 Å²	39	45.2 Å²	45.2	24%	0.236	24%	0.242	C	C	.	.	H	α-helix	trans	-74.4	-41.2	-175.8	175.2	0	0	0	0	111.3	K180 P207 V208 L211 A230 E231 T236	K180-V234 WeakPolarHBondContact CE-O 3.39Å; K180-V234 PolarHBondContact NZ-O 2.73Å; P207-V234 HydrophobicContact CB-CG2 3.8Å; P207-V234 HydrophobicContact CG-CG1 4.03Å; P207-V234 HydrophobicContact CG-CG2 3.83Å; V208-V234 HydrophobicContact CG2-CB 4.16Å; V208-V234 HydrophobicContact CG2-CG1 4.24Å; V208-V234 HydrophobicContact CG2-CG2 3.87Å; L211-V234 HydrophobicContact CD1-CG2 3.9Å; A230-V234 WeakPolarHBondContact O-CG2 3.42Å; A230-V234 PolarHBondContact O-N 2.98Å; E231-V234 PolarHBondContact O-N 3.45Å; V234-T236 PolarHBondContact O-N 3.14Å
235	G	78	Confident	84	Confident	68 Å²	68	45 Å²	45	70%	0.701	24%	0.24	S	C	*	.	H	α-helix	trans	-67.7	-28.7	180	0	0	0	0	0	114.6	E231	E231-G235 PolarHBondContact O-N 2.78Å
236	T	78.9	Confident	84.3	Confident	30 Å²	30	43.7 Å²	43.7	18%	0.184	23%	0.232	C	C	.	.	S	Bend	trans	-83.9	134.3	179.7	-50.8	0	0	0	0	111.3	K180 D232 V234 R238	K180-T236 PolarHBondContact NZ-O 2.8Å; D232-T236 WeakPolarHBondContact O-CB 3.28Å; D232-T236 PolarHBondContact O-N 2.85Å; D232-T236 PolarHBondContact O-OG1 2.64Å; V234-T236 PolarHBondContact O-N 3.14Å; T236-R238 VanDerWaalsContact C-N 3.32Å; T236-R238 VanDerWaalsContact CG2-O 3.31Å; T236-R238 WeakPolarHBondContact CG2-O 3.29Å; T236-R238 PolarHBondContact O-N 3.14Å
237	V	77.5	Confident	84.5	Confident	133 Å²	133	39.9 Å²	39.9	81%	0.806	22%	0.215	S	C	*	.	S	Bend	trans	-58.5	-43.6	-179.6	178.6	0	0	0	0	111.7
238	R	81.6	Confident	84.7	Confident	152 Å²	152	39.6 Å²	39.6	57%	0.574	21%	0.214	S	C	*	.	S	Bend	trans	-126.2	109.2	174.4	-175.4	-178.7	-171.8	-178.3	2.6	109	H176 T236	H176-R238 HydrophobicContact CB-CG 4.11Å; H176-R238 PolarHBondContact CD2-NH2 3.47Å; H176-R238 PolarHBondContact NE2-NH2 3.47Å; T236-R238 VanDerWaalsContact C-N 3.32Å; T236-R238 VanDerWaalsContact CG2-O 3.31Å; T236-R238 WeakPolarHBondContact CG2-O 3.29Å; T236-R238 PolarHBondContact O-N 3.14Å
239	P	85.2	Confident	84.7	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.013	21%	0.213	C	C	.	.			trans	-57.9	148.3	173.7	-26.1	36.1	0	0	0	111.9	H176 K180 I233 E241 I244	H176-P239 WeakPolarHBondContact CB-O 3Å; K180-P239 HydrophobicContact CB-CG 4.31Å; K180-P239 HydrophobicContact CD-CG 4.26Å; K180-P239 HydrophobicContact CG-CG 4.35Å; I233-P239 HydrophobicContact CG2-CB 4.4Å; I233-P239 HydrophobicContact CG2-CG 3.96Å; P239-E241 PolarHBondContact O-N 3.06Å; P239-I244 HydrophobicContact CB-CD1 3.59Å
240	D	85.6	Confident	84.7	Confident	21 Å²	21	36.9 Å²	36.9	11%	0.112	20%	0.201	C	C	.	.			trans	-66.3	127.5	179.6	-179.5	75.1	0	0	0	112.5	Q38 Q39 K242 A243 I244	Q38-D240 HydrophobicContact CB-CB 4.45Å; Q38-D240 HydrophobicContact CG-CB 4.38Å; Q39-D240 WeakPolarHBondContact CG-OD2 3.48Å; Q39-D240 VanDerWaalsContact NE2-CG 3.33Å; Q39-D240 PolarHBondContact NE2-OD1 2.72Å; Q39-D240 PolarHBondContact NE2-OD2 3.48Å; D240-K242 PolarHBondContact O-N 2.82Å; D240-K242 WeakPolarHBondContact OD2-CA 3.11Å; D240-K242 WeakPolarHBondContact OD2-CB 3.5Å; D240-K242 PolarHBondContact OD2-N 3.23Å; D240-K242 VanDerWaalsContact OD2-N 3.08Å; D240-A243 HydrophobicContact CB-CB 4.03Å; D240-A243 WeakPolarHBondContact OD2-CB 3.49Å; D240-A243 PolarHBondContact OD2-N 3.4Å; D240-I244 PolarHBondContact O-N 3.14Å
241	E	86.3	Confident	84.8	Confident	56 Å²	56	36.8 Å²	36.8	26%	0.262	20%	0.2	S	C	.	.	H	α-helix	trans	-67.6	-37.1	-174.6	-163.6	-175.7	-161.5	0	0	112.3	K153 F175 P239 M245	K153-E241 WeakPolarHBondContact CE-OE1 3.3Å; K153-E241 IonicContact NZ-OE1 3.39Å; K153-E241 PolarHBondContact NZ-OE1 3.06Å; K153-E241 IonicContact NZ-OE2 2.68Å; K153-E241 PolarHBondContact NZ-OE2 3.35Å; K153-E241 VanDerWaalsContact NZ-OE2 3.15Å; F175-E241 HydrophobicContact CB-CG 3.68Å; F175-E241 WeakPolarHBondContact O-CA 3.37Å; P239-E241 PolarHBondContact O-N 3.06Å; E241-M245 HydrophobicContact CG-SD 4.32Å; E241-M245 WeakPolarHBondContact O-CB 3.49Å; E241-M245 VanDerWaalsContact O-CG 3.29Å; E241-M245 WeakPolarHBondContact O-CG 2.97Å; E241-M245 PolarHBondContact O-N 2.81Å
242	K	87.1	Confident	84.9	Confident	62 Å²	62	31 Å²	31	27%	0.27	17%	0.172	S	C	.	.	H	α-helix	trans	-71.3	-41.6	-176.9	-63.1	-179.5	173.3	-175.3	0	111.2	F43 W134 D240 M245 T246	F43-K242 HydrophobicContact CE1-CB 4.42Å; F43-K242 HydrophobicContact CZ-CB 4.02Å; W134-K242 HydrophobicContact CB-CD 4.32Å; W134-K242 HydrophobicContact CD2-CB 3.99Å; W134-K242 HydrophobicContact CD2-CD 3.52Å; W134-K242 HydrophobicContact CD2-CG 3.73Å; W134-K242 HydrophobicContact CE3-CB 3.55Å; W134-K242 HydrophobicContact CE3-CD 3.98Å; W134-K242 HydrophobicContact CE3-CG 3.83Å; W134-K242 HydrophobicContact CG-CD 3.65Å; W134-K242 HydrophobicContact CG-CG 4.39Å; W134-K242 HydrophobicContact CH2-CB 3.97Å; W134-K242 HydrophobicContact CH2-CG 3.9Å; W134-K242 HydrophobicContact CZ2-CB 4.39Å; W134-K242 HydrophobicContact CZ2-CD 4.37Å; W134-K242 HydrophobicContact CZ2-CG 3.83Å; W134-K242 HydrophobicContact CZ3-CB 3.54Å; W134-K242 HydrophobicContact CZ3-CG 3.91Å; D240-K242 PolarHBondContact O-N 2.82Å; D240-K242 WeakPolarHBondContact OD2-CA 3.11Å; D240-K242 WeakPolarHBondContact OD2-CB 3.5Å; D240-K242 PolarHBondContact OD2-N 3.23Å; D240-K242 VanDerWaalsContact OD2-N 3.08Å; K242-M245 PolarHBondContact O-N 3.11Å; K242-T246 WeakPolarHBondContact O-CB 3.4Å; K242-T246 PolarHBondContact O-N 3.33Å; K242-T246 PolarHBondContact O-OG1 2.86Å
243	A	86.4	Confident	84.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.5	-49.7	175.1	0	0	0	0	0	111.6	Q38 T42 L228 D240 T246 Y247	Q38-A243 HydrophobicContact CG-CB 4.13Å; T42-A243 HydrophobicContact CG2-CB 3.98Å; T42-A243 WeakPolarHBondContact CG2-O 3.37Å; T42-A243 WeakPolarHBondContact OG1-CB 3.49Å; L228-A243 HydrophobicContact CD2-CB 3.89Å; D240-A243 HydrophobicContact CB-CB 4.03Å; D240-A243 WeakPolarHBondContact OD2-CB 3.49Å; D240-A243 PolarHBondContact OD2-N 3.4Å; A243-T246 PolarHBondContact O-N 2.85Å; A243-Y247 PolarHBondContact O-N 3.42Å
244	I	89.1	Confident	84.7	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-45.2	178.6	-70.5	164.2	0	0	0	111.4	F175 W179 F185 L228 P239 D240 T246 Y247 V248	F175-I244 HydrophobicContact CB-CG2 4.14Å; F175-I244 HydrophobicContact CD1-CG2 4.29Å; F175-I244 VanDerWaalsContact O-CB 3.27Å; F175-I244 WeakPolarHBondContact O-CB 3.08Å; F175-I244 VanDerWaalsContact O-CD1 3.32Å; F175-I244 WeakPolarHBondContact O-CD1 3.5Å; F175-I244 WeakPolarHBondContact O-CG2 3.5Å; W179-I244 HydrophobicContact CB-CD1 4.26Å; W179-I244 HydrophobicContact CB-CG2 4.29Å; W179-I244 HydrophobicContact CD2-CG2 4.11Å; W179-I244 HydrophobicContact CG-CG2 3.8Å; F185-I244 HydrophobicContact CZ-CG2 4.38Å; L228-I244 HydrophobicContact CD1-CG1 4.3Å; P239-I244 HydrophobicContact CB-CD1 3.59Å; D240-I244 PolarHBondContact O-N 3.14Å; I244-T246 VanDerWaalsContact C-N 3.28Å; I244-T246 PolarHBondContact O-N 3.06Å; I244-Y247 PolarHBondContact O-N 3.46Å; I244-Y247 VanDerWaalsContact O-N 3.14Å; I244-V248 HydrophobicContact CG2-CG2 3.99Å; I244-V248 WeakPolarHBondContact O-CB 3.47Å; I244-V248 VanDerWaalsContact O-CG2 3.29Å; I244-V248 WeakPolarHBondContact O-CG2 3.47Å; I244-V248 PolarHBondContact O-N 3.4Å
245	M	87.3	Confident	84.4	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-56.1	-41.8	176	-79.4	-177.2	65.3	0	0	112.6	W134 I142 K153 F175 E241 K242 Y247 S249	W134-M245 HydrophobicContact CH2-CB 4.16Å; W134-M245 HydrophobicContact CH2-CE 4.13Å; W134-M245 HydrophobicContact CH2-SD 4.1Å; W134-M245 HydrophobicContact CZ3-CB 4.49Å; I142-M245 HydrophobicContact CD1-CB 4.06Å; I142-M245 HydrophobicContact CD1-CE 3.99Å; I142-M245 HydrophobicContact CG2-CE 4.19Å; K153-M245 HydrophobicContact CB-CE 4.07Å; K153-M245 HydrophobicContact CD-CE 4.08Å; K153-M245 HydrophobicContact CD-SD 4.09Å; K153-M245 HydrophobicContact CG-CE 3.7Å; K153-M245 HydrophobicContact CG-SD 4.15Å; F175-M245 HydrophobicContact CB-CG 3.57Å; F175-M245 HydrophobicContact CB-SD 4.5Å; F175-M245 HydrophobicContact CD1-CG 3.89Å; F175-M245 HydrophobicContact CD2-CG 3.45Å; F175-M245 VanDerWaalsContact CD2-CG 3.45Å; F175-M245 HydrophobicContact CD2-SD 3.85Å; F175-M245 HydrophobicContact CE1-CG 4.4Å; F175-M245 HydrophobicContact CE2-CG 4.01Å; F175-M245 HydrophobicContact CE2-SD 4.35Å; F175-M245 HydrophobicContact CG-CG 3.37Å; F175-M245 HydrophobicContact CG-SD 4.33Å; F175-M245 HydrophobicContact CZ-CG 4.45Å; E241-M245 HydrophobicContact CG-SD 4.32Å; E241-M245 WeakPolarHBondContact O-CB 3.49Å; E241-M245 VanDerWaalsContact O-CG 3.29Å; E241-M245 WeakPolarHBondContact O-CG 2.97Å; E241-M245 PolarHBondContact O-N 2.81Å; K242-M245 PolarHBondContact O-N 3.11Å; M245-Y247 VanDerWaalsContact C-N 3.35Å; M245-Y247 PolarHBondContact O-N 3.09Å; M245-S249 WeakPolarHBondContact O-CB 3.43Å; M245-S249 PolarHBondContact O-N 3.44Å; M245-S249 PolarHBondContact O-OG 3.34Å
246	T	87.6	Confident	84	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-44.6	177.2	-56.3	0	0	0	0	111.5	T42 W46 I137 M227 K242 A243 I244 S249 C250	T42-T246 HydrophobicContact CG2-CG2 4.29Å; W46-T246 HydrophobicContact CB-CG2 3.95Å; W46-T246 VanDerWaalsContact CD1-CG2 3.48Å; W46-T246 HydrophobicContact CG-CG2 3.74Å; I137-T246 HydrophobicContact CD1-CG2 3.96Å; I137-T246 HydrophobicContact CG1-CG2 4.48Å; I137-T246 HydrophobicContact CG2-CG2 3.9Å; M227-T246 HydrophobicContact SD-CG2 4.4Å; K242-T246 WeakPolarHBondContact O-CB 3.4Å; K242-T246 PolarHBondContact O-N 3.33Å; K242-T246 PolarHBondContact O-OG1 2.86Å; A243-T246 PolarHBondContact O-N 2.85Å; I244-T246 VanDerWaalsContact C-N 3.28Å; I244-T246 PolarHBondContact O-N 3.06Å; T246-S249 PolarHBondContact O-OG 2.91Å; T246-C250 PolarHBondContact O-SG 3.25Å
247	Y	89.8	Confident	83.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-74.2	-40.4	-177.8	-166.1	-122.4	0	0	0	112.1	F185 F215 I224 P225 M227 L228 A243 I244 M245 S249 C250 F251	F185-Y247 HydrophobicContact CD1-CD1 4.3Å; F185-Y247 HydrophobicContact CD1-CE1 4.39Å; F185-Y247 AromaticContact CE1-CD1 3.62Å; F185-Y247 HydrophobicContact CE1-CD1 3.62Å; F185-Y247 HydrophobicContact CE1-CE1 4.15Å; F185-Y247 HydrophobicContact CZ-CD1 4.04Å; F215-Y247 HydrophobicContact CD1-CD1 4.43Å; F215-Y247 AromaticContact CD1-CE1 3.42Å; F215-Y247 HydrophobicContact CD1-CE1 3.42Å; F215-Y247 VanDerWaalsContact CD1-CE1 3.42Å; F215-Y247 AromaticContact CD1-CZ 3.9Å; F215-Y247 HydrophobicContact CE1-CD1 4.04Å; F215-Y247 AromaticContact CE1-CE1 3.43Å; F215-Y247 HydrophobicContact CE1-CE1 3.43Å; F215-Y247 VanDerWaalsContact CE1-CE1 3.43Å; F215-Y247 HydrophobicContact CG-CE1 4.41Å; F215-Y247 HydrophobicContact CZ-CE1 4.42Å; I224-Y247 HydrophobicContact CG2-CD2 4.36Å; I224-Y247 HydrophobicContact CG2-CE2 3.66Å; P225-Y247 WeakPolarHBondContact O-CE2 3.42Å; M227-Y247 HydrophobicContact CB-CD2 3.76Å; M227-Y247 HydrophobicContact CB-CE2 4.24Å; M227-Y247 HydrophobicContact CG-CD2 3.74Å; M227-Y247 HydrophobicContact CG-CE2 4.07Å; M227-Y247 HydrophobicContact SD-CD2 3.96Å; L228-Y247 HydrophobicContact CD1-CD1 3.56Å; L228-Y247 HydrophobicContact CD1-CE1 4.45Å; L228-Y247 HydrophobicContact CD1-CG 3.81Å; L228-Y247 HydrophobicContact CG-CD1 4.26Å; L228-Y247 HydrophobicContact CG-CG 4.19Å; A243-Y247 PolarHBondContact O-N 3.42Å; I244-Y247 PolarHBondContact O-N 3.46Å; I244-Y247 VanDerWaalsContact O-N 3.14Å; M245-Y247 VanDerWaalsContact C-N 3.35Å; M245-Y247 PolarHBondContact O-N 3.09Å; Y247-S249 PolarHBondContact O-N 3.29Å; Y247-C250 WeakPolarHBondContact O-CB 3.31Å; Y247-C250 PolarHBondContact O-N 2.61Å; Y247-F251 AromaticContact CD1-CE2 3.86Å; Y247-F251 HydrophobicContact CD1-CE2 3.86Å; Y247-F251 AromaticContact CE1-CE2 3.49Å; Y247-F251 HydrophobicContact CE1-CE2 3.49Å; Y247-F251 VanDerWaalsContact CE1-CE2 3.49Å; Y247-F251 AromaticContact CE1-CZ 4Å; Y247-F251 HydrophobicContact CE1-CZ 4Å; Y247-F251 HydrophobicContact CE2-CE2 4.47Å; Y247-F251 HydrophobicContact CG-CE2 4.49Å; Y247-F251 AromaticContact CZ-CE2 3.83Å; Y247-F251 WeakPolarHBondContact O-CD2 3.16Å
248	V	88.8	Confident	82.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-35.3	177.6	175.9	0	0	0	0	112.2	L156 C160 F175 W179 F185 I244 C250 F251 Y252	L156-V248 HydrophobicContact CD1-CG1 4.24Å; L156-V248 HydrophobicContact CG-CG1 4.39Å; C160-V248 WeakPolarHBondContact SG-CG1 3.46Å; F175-V248 HydrophobicContact CE1-CB 4.43Å; F175-V248 HydrophobicContact CE1-CG1 4.11Å; W179-V248 HydrophobicContact CD2-CG2 4.32Å; W179-V248 HydrophobicContact CE3-CG2 4.1Å; W179-V248 HydrophobicContact CH2-CB 4.42Å; W179-V248 HydrophobicContact CH2-CG1 3.86Å; W179-V248 HydrophobicContact CH2-CG2 3.55Å; W179-V248 HydrophobicContact CZ2-CG1 4.15Å; W179-V248 HydrophobicContact CZ2-CG2 3.8Å; W179-V248 HydrophobicContact CZ3-CG2 3.72Å; F185-V248 HydrophobicContact CE1-CG2 3.63Å; F185-V248 HydrophobicContact CZ-CG2 4.2Å; I244-V248 HydrophobicContact CG2-CG2 3.99Å; I244-V248 WeakPolarHBondContact O-CB 3.47Å; I244-V248 VanDerWaalsContact O-CG2 3.29Å; I244-V248 WeakPolarHBondContact O-CG2 3.47Å; I244-V248 PolarHBondContact O-N 3.4Å; V248-C250 VanDerWaalsContact C-N 3.25Å; V248-C250 PolarHBondContact O-N 3.27Å; V248-F251 PolarHBondContact O-N 3.42Å; V248-Y252 PolarHBondContact O-N 3.42Å
249	S	86.7	Confident	81.1	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-29	176.1	71.6	0	0	0	0	112.9	M245 T246 Y247 Y252 H253	M245-S249 WeakPolarHBondContact O-CB 3.43Å; M245-S249 PolarHBondContact O-N 3.44Å; M245-S249 PolarHBondContact O-OG 3.34Å; T246-S249 PolarHBondContact O-OG 2.91Å; Y247-S249 PolarHBondContact O-N 3.29Å; S249-Y252 WeakPolarHBondContact O-CB 3.18Å; S249-Y252 PolarHBondContact O-N 3.25Å; S249-H253 PolarHBondContact O-CD2 3.24Å; S249-H253 PolarHBondContact O-N 3.04Å; S249-H253 VanDerWaalsContact O-N 3.13Å
250	C	85.7	Confident	79.9	Confident	22 Å²	22	34.8 Å²	34.8	15%	0.149	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-38.9	174.2	-61.3	0	0	0	0	111.9	I224 T246 Y247 V248 A254	I224-C250 HydrophobicContact CG2-CB 3.94Å; T246-C250 PolarHBondContact O-SG 3.25Å; Y247-C250 WeakPolarHBondContact O-CB 3.31Å; Y247-C250 PolarHBondContact O-N 2.61Å; V248-C250 VanDerWaalsContact C-N 3.25Å; V248-C250 PolarHBondContact O-N 3.27Å; C250-A254 WeakPolarHBondContact O-CB 3.38Å; C250-A254 PolarHBondContact O-N 2.85Å; C250-A254 VanDerWaalsContact O-N 3.14Å
251	F	86.4	Confident	78.5	Confident	1 Å²	1	34.7 Å²	34.7	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-38.2	172.4	-70.6	-81.2	0	0	0	112.5	W159 F185 I189 A218 L222 I224 Y247 V248 A254 F255	W159-F251 HydrophobicContact CH2-CB 4.44Å; F185-F251 HydrophobicContact CD1-CE2 4.09Å; F185-F251 HydrophobicContact CE1-CE2 4.43Å; I189-F251 HydrophobicContact CD1-CE1 3.7Å; I189-F251 HydrophobicContact CD1-CZ 4.09Å; I189-F251 HydrophobicContact CG1-CD1 4.15Å; I189-F251 HydrophobicContact CG1-CE1 3.61Å; I189-F251 HydrophobicContact CG1-CZ 4.39Å; A218-F251 HydrophobicContact CB-CE1 3.66Å; A218-F251 HydrophobicContact CB-CZ 3.55Å; L222-F251 HydrophobicContact CD1-CD1 4.25Å; L222-F251 HydrophobicContact CD1-CE1 4.02Å; I224-F251 HydrophobicContact CD1-CB 4.48Å; I224-F251 HydrophobicContact CD1-CD1 3.51Å; I224-F251 HydrophobicContact CD1-CD2 4.49Å; I224-F251 HydrophobicContact CD1-CE1 3.77Å; I224-F251 HydrophobicContact CD1-CG 3.92Å; I224-F251 HydrophobicContact CD1-CZ 4.38Å; Y247-F251 AromaticContact CD1-CE2 3.86Å; Y247-F251 HydrophobicContact CD1-CE2 3.86Å; Y247-F251 AromaticContact CE1-CE2 3.49Å; Y247-F251 HydrophobicContact CE1-CE2 3.49Å; Y247-F251 VanDerWaalsContact CE1-CE2 3.49Å; Y247-F251 AromaticContact CE1-CZ 4Å; Y247-F251 HydrophobicContact CE1-CZ 4Å; Y247-F251 HydrophobicContact CE2-CE2 4.47Å; Y247-F251 HydrophobicContact CG-CE2 4.49Å; Y247-F251 AromaticContact CZ-CE2 3.83Å; Y247-F251 WeakPolarHBondContact O-CD2 3.16Å; V248-F251 PolarHBondContact O-N 3.42Å; F251-A254 PolarHBondContact O-N 3.41Å; F251-F255 HydrophobicContact CB-CD2 4.35Å; F251-F255 HydrophobicContact CB-CE2 4.22Å; F251-F255 AromaticContact CD1-CE2 3.91Å; F251-F255 HydrophobicContact CD1-CE2 3.91Å; F251-F255 HydrophobicContact CD1-CZ 4.4Å; F251-F255 WeakPolarHBondContact O-CD2 3.48Å; F251-F255 PolarHBondContact O-N 2.99Å; F251-F255 VanDerWaalsContact O-N 3.11Å
252	Y	84.4	Confident	77.1	Confident	29 Å²	29	37.6 Å²	37.6	11%	0.114	21%	0.211	C	C	.	.	H	α-helix	trans	-58.5	-50.2	176.7	177.4	-91.4	0	0	0	111.4	I145 V147 L156 W159 V248 S249 F255 S256	I145-Y252 HydrophobicContact CB-CE1 4.2Å; I145-Y252 HydrophobicContact CD1-CD1 3.55Å; I145-Y252 HydrophobicContact CD1-CE1 4.08Å; I145-Y252 HydrophobicContact CD1-CG 3.97Å; I145-Y252 HydrophobicContact CG1-CD1 3.72Å; I145-Y252 HydrophobicContact CG1-CE1 3.72Å; I145-Y252 HydrophobicContact CG2-CD1 4.09Å; I145-Y252 HydrophobicContact CG2-CD2 4.27Å; I145-Y252 HydrophobicContact CG2-CE1 3.71Å; I145-Y252 HydrophobicContact CG2-CE2 3.92Å; I145-Y252 HydrophobicContact CG2-CG 4.36Å; V147-Y252 HydrophobicContact CG2-CE2 4.44Å; L156-Y252 HydrophobicContact CD1-CD2 4.23Å; L156-Y252 HydrophobicContact CD1-CG 4.13Å; W159-Y252 HydrophobicContact CB-CD2 4.35Å; W159-Y252 HydrophobicContact CB-CE2 4.37Å; W159-Y252 AromaticContact CD1-CD2 3.78Å; W159-Y252 AromaticContact CD1-CE2 3.63Å; W159-Y252 AromaticContact CD2-CD2 3.59Å; W159-Y252 HydrophobicContact CD2-CD2 3.59Å; W159-Y252 HydrophobicContact CD2-CE2 4.23Å; W159-Y252 AromaticContact CE2-CD2 3.67Å; W159-Y252 HydrophobicContact CE3-CD2 4.07Å; W159-Y252 AromaticContact CG-CD2 3.69Å; W159-Y252 HydrophobicContact CG-CD2 3.69Å; W159-Y252 AromaticContact CG-CE2 3.86Å; W159-Y252 HydrophobicContact CG-CE2 3.86Å; W159-Y252 HydrophobicContact CZ2-CD2 4.25Å; W159-Y252 AromaticContact NE1-CD2 3.75Å; W159-Y252 AromaticContact NE1-CE2 3.87Å; V248-Y252 PolarHBondContact O-N 3.42Å; S249-Y252 WeakPolarHBondContact O-CB 3.18Å; S249-Y252 PolarHBondContact O-N 3.25Å; Y252-F255 PolarHBondContact O-N 2.73Å; Y252-S256 WeakPolarHBondContact O-CB 3.27Å; Y252-S256 PolarHBondContact O-N 2.66Å
253	H	81.5	Confident	75.7	Confident	88 Å²	88	38.1 Å²	38.1	41%	0.407	22%	0.219	S	C	.	.	H	α-helix	trans	-65.7	-40.1	-179.1	-71	-58.1	0	0	0	112.7	A141 S249 F255 G257	A141-H253 PolarHBondContact O-NE2 3.32Å; S249-H253 PolarHBondContact O-CD2 3.24Å; S249-H253 PolarHBondContact O-N 3.04Å; S249-H253 VanDerWaalsContact O-N 3.13Å; H253-F255 VanDerWaalsContact C-N 3.35Å; H253-F255 PolarHBondContact O-N 3.21Å; H253-G257 PolarHBondContact O-N 3.11Å
254	A	79.4	Confident	74.3	Confident	45 Å²	45	38.3 Å²	38.3	37%	0.372	22%	0.221	S	C	.	.	H	α-helix	trans	-60.2	-41.3	176.4	0	0	0	0	0	112.7	I224 C250 F251	I224-A254 HydrophobicContact CD1-CB 4.02Å; C250-A254 WeakPolarHBondContact O-CB 3.38Å; C250-A254 PolarHBondContact O-N 2.85Å; C250-A254 VanDerWaalsContact O-N 3.14Å; F251-A254 PolarHBondContact O-N 3.41Å
255	F	79.7	Confident	72.8	Confident	19 Å²	19	38.6 Å²	38.6	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-89	-26.2	-177.7	-62.3	-47.9	0	0	0	114.5	W159 H192 R193 L222 F251 Y252 H253	W159-F255 HydrophobicContact CH2-CD2 4.2Å; W159-F255 HydrophobicContact CZ2-CB 4.42Å; W159-F255 HydrophobicContact CZ2-CD2 4.29Å; H192-F255 HydrophobicContact CB-CD1 3.63Å; H192-F255 HydrophobicContact CB-CD2 4.2Å; H192-F255 HydrophobicContact CB-CE1 3.65Å; H192-F255 HydrophobicContact CB-CE2 4.21Å; H192-F255 HydrophobicContact CB-CG 3.92Å; H192-F255 HydrophobicContact CB-CZ 3.95Å; H192-F255 AromaticContact CD2-CG 3.92Å; H192-F255 AromaticContact CE1-CD2 3.92Å; H192-F255 AromaticContact CG-CD1 3.93Å; H192-F255 AromaticContact CG-CD2 3.79Å; H192-F255 AromaticContact CG-CG 3.67Å; H192-F255 AromaticContact ND1-CD2 3.55Å; H192-F255 AromaticContact ND1-CE2 3.82Å; H192-F255 AromaticContact ND1-CG 3.92Å; R193-F255 HydrophobicContact CG-CE1 4.26Å; L222-F255 HydrophobicContact CD1-CE1 4.15Å; L222-F255 HydrophobicContact CD1-CZ 3.66Å; L222-F255 HydrophobicContact CD2-CE1 4.07Å; L222-F255 HydrophobicContact CD2-CZ 4.41Å; F251-F255 HydrophobicContact CB-CD2 4.35Å; F251-F255 HydrophobicContact CB-CE2 4.22Å; F251-F255 AromaticContact CD1-CE2 3.91Å; F251-F255 HydrophobicContact CD1-CE2 3.91Å; F251-F255 HydrophobicContact CD1-CZ 4.4Å; F251-F255 WeakPolarHBondContact O-CD2 3.48Å; F251-F255 PolarHBondContact O-N 2.99Å; F251-F255 VanDerWaalsContact O-N 3.11Å; Y252-F255 PolarHBondContact O-N 2.73Å; H253-F255 VanDerWaalsContact C-N 3.35Å; H253-F255 PolarHBondContact O-N 3.21Å
256	S	69.9	Low	71.7	Confident	28 Å²	28	42.6 Å²	42.6	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-72.1	-34.7	-179.9	-171.5	0	0	0	0	112.9	Y252	Y252-S256 WeakPolarHBondContact O-CB 3.27Å; Y252-S256 PolarHBondContact O-N 2.66Å
257	G	62.1	Low	70.6	Confident	47 Å²	47	49.3 Å²	49.3	49%	0.485	27%	0.27	S	S	.	.	H	α-helix	trans	-62.7	-43.3	176.1	0	0	0	0	0	113.3	H253 Q259 K260	H253-G257 PolarHBondContact O-N 3.11Å; G257-Q259 PolarHBondContact O-N 3.18Å; G257-K260 PolarHBondContact O-N 2.87Å
258	A	57.7	Low	69.6	Low	64 Å²	64	49.4 Å²	49.4	53%	0.529	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-40.9	-176.7	0	0	0	0	0	113.4	K260 A261 E262	A258-K260 VanDerWaalsContact C-N 3.3Å; A258-K260 PolarHBondContact O-N 3.5Å; A258-A261 PolarHBondContact O-N 2.89Å; A258-E262 PolarHBondContact O-N 3.47Å
259	Q	56.8	Low	68.6	Low	105 Å²	105	50.3 Å²	50.3	49%	0.491	28%	0.276	S	S	.	.	H	α-helix	trans	-68.6	-26.9	-175	-167	175.6	-10.5	0	0	113.2	G257 T263	G257-Q259 PolarHBondContact O-N 3.18Å; Q259-T263 PolarHBondContact O-N 3.13Å; Q259-T263 PolarHBondContact O-OG1 3.26Å
260	K	60.3	Low	67.8	Low	140 Å²	140	57.6 Å²	57.6	61%	0.609	31%	0.308	S	S	*	.	H	α-helix	trans	-72.5	-41.5	175.9	-70	-177.8	178.7	-179.6	0	111.9	G257 A258 A264	G257-K260 PolarHBondContact O-N 2.87Å; A258-K260 VanDerWaalsContact C-N 3.3Å; A258-K260 PolarHBondContact O-N 3.5Å; K260-A264 PolarHBondContact O-N 2.65Å
261	A	55.7	Low	67.1	Low	19 Å²	19	57.7 Å²	57.7	16%	0.157	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-49.6	175.3	0	0	0	0	0	111.2	A258 T263 A264 A265	A258-A261 PolarHBondContact O-N 2.89Å; A261-T263 VanDerWaalsContact C-N 3.33Å; A261-T263 PolarHBondContact O-N 3Å; A261-A264 PolarHBondContact O-N 3.42Å; A261-A265 WeakPolarHBondContact O-CB 3.33Å; A261-A265 PolarHBondContact O-N 3.49Å
262	E	56.9	Low	66.3	Low	118 Å²	118	57.7 Å²	57.7	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-57.2	-40.9	179.2	-175.2	-176.9	-164.4	0	0	113.1	A258 A265 N266	A258-E262 PolarHBondContact O-N 3.47Å; E262-A265 PolarHBondContact O-N 3.33Å; E262-N266 PolarHBondContact O-N 2.91Å; E262-N266 VanDerWaalsContact O-N 3.08Å; E262-N266 PolarHBondContact O-ND2 3.14Å
263	T	57.6	Low	65.7	Low	73 Å²	73	58.3 Å²	58.3	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-69.6	-39.4	-178.5	-55.4	0	0	0	0	111.9	Q259 A261 R267	Q259-T263 PolarHBondContact O-N 3.13Å; Q259-T263 PolarHBondContact O-OG1 3.26Å; A261-T263 VanDerWaalsContact C-N 3.33Å; A261-T263 PolarHBondContact O-N 3Å; T263-R267 PolarHBondContact O-N 3.17Å
264	A	57.6	Low	65.3	Low	4 Å²	4	56.2 Å²	56.2	3%	0.033	31%	0.312	C	S	.	.	H	α-helix	trans	-72.5	-36.1	176.3	0	0	0	0	0	111.6	K260 A261 N266 R267 I268 I841 L842	K260-A264 PolarHBondContact O-N 2.65Å; A261-A264 PolarHBondContact O-N 3.42Å; A264-N266 PolarHBondContact O-N 3.48Å; A264-R267 WeakPolarHBondContact O-CB 3.33Å; A264-R267 PolarHBondContact O-N 3.29Å; A264-R267 VanDerWaalsContact O-N 3.1Å; A264-I268 WeakPolarHBondContact O-CG1 3.35Å; A264-I268 PolarHBondContact O-N 3.44Å; A264-I268 VanDerWaalsContact O-N 3.07Å; A264-I841 HydrophobicContact CB-CB 3.66Å; A264-I841 HydrophobicContact CB-CD1 4.34Å; A264-I841 HydrophobicContact CB-CG2 3.57Å; A264-L842 HydrophobicContact CB-CD1 3.38Å
265	A	58.1	Low	65.2	Low	5 Å²	5	55.2 Å²	55.2	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-50.1	176.4	0	0	0	0	0	109.6	A261 E262 R267 I268 C269 L842 E857 L858	A261-A265 WeakPolarHBondContact O-CB 3.33Å; A261-A265 PolarHBondContact O-N 3.49Å; E262-A265 PolarHBondContact O-N 3.33Å; A265-R267 PolarHBondContact O-N 2.93Å; A265-R267 VanDerWaalsContact O-N 3.14Å; A265-I268 WeakPolarHBondContact O-CB 3.45Å; A265-I268 PolarHBondContact O-N 3.11Å; A265-I268 VanDerWaalsContact O-N 3.09Å; A265-C269 PolarHBondContact O-N 3.19Å; A265-C269 PolarHBondContact O-SG 3.03Å; A265-L842 HydrophobicContact CB-CD1 4.18Å; A265-L842 HydrophobicContact CB-CD2 4.38Å; A265-L842 VanDerWaalsContact N-CD1 3.3Å; A265-E857 WeakPolarHBondContact CB-O 3.43Å; A265-L858 HydrophobicContact CB-CD2 4Å
266	N	63.6	Low	64.8	Low	88 Å²	88	58.8 Å²	58.8	47%	0.471	32%	0.318	S	S	.	.	H	α-helix	trans	-58.4	-27.3	176.1	-82.2	-69.2	0	0	0	114.8	E262 A264 K270	E262-N266 PolarHBondContact O-N 2.91Å; E262-N266 VanDerWaalsContact O-N 3.08Å; E262-N266 PolarHBondContact O-ND2 3.14Å; A264-N266 PolarHBondContact O-N 3.48Å; N266-K270 WeakPolarHBondContact O-CG 3.29Å
267	R	64.9	Low	65.2	Low	141 Å²	141	62.3 Å²	62.3	53%	0.532	33%	0.331	S	S	.	.	H	α-helix	trans	-74.7	-47.2	173.7	-70.5	179.8	-179.7	-172.1	-1.8	111.1	T263 A264 A265 C269 K270 V271 S838	T263-R267 PolarHBondContact O-N 3.17Å; A264-R267 WeakPolarHBondContact O-CB 3.33Å; A264-R267 PolarHBondContact O-N 3.29Å; A264-R267 VanDerWaalsContact O-N 3.1Å; A265-R267 PolarHBondContact O-N 2.93Å; A265-R267 VanDerWaalsContact O-N 3.14Å; R267-C269 VanDerWaalsContact C-N 3.33Å; R267-C269 PolarHBondContact O-N 3.26Å; R267-K270 PolarHBondContact O-N 3.45Å; R267-V271 WeakPolarHBondContact O-CG2 3.33Å; R267-V271 PolarHBondContact O-N 2.87Å; R267-S838 VanDerWaalsContact CD-OG 3.32Å; R267-S838 WeakPolarHBondContact CD-OG 3.34Å
268	I	68.6	Low	66	Low	2 Å²	2	60.1 Å²	60.1	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-57.1	-48	174.8	-67.7	164.7	0	0	0	110.1	A264 A265 K270 V271 L272 F839 L842 L858	A264-I268 WeakPolarHBondContact O-CG1 3.35Å; A264-I268 PolarHBondContact O-N 3.44Å; A264-I268 VanDerWaalsContact O-N 3.07Å; A265-I268 WeakPolarHBondContact O-CB 3.45Å; A265-I268 PolarHBondContact O-N 3.11Å; A265-I268 VanDerWaalsContact O-N 3.09Å; I268-K270 PolarHBondContact O-N 3.33Å; I268-K270 VanDerWaalsContact O-N 3.15Å; I268-V271 PolarHBondContact O-N 2.89Å; I268-L272 HydrophobicContact CG2-CD1 3.53Å; I268-L272 HydrophobicContact CG2-CG 3.96Å; I268-L272 VanDerWaalsContact O-CG 3.3Å; I268-L272 WeakPolarHBondContact O-CG 3.44Å; I268-L272 PolarHBondContact O-N 3.19Å; I268-F839 HydrophobicContact CB-CE1 4.2Å; I268-F839 HydrophobicContact CB-CZ 4.19Å; I268-F839 HydrophobicContact CD1-CD1 3.54Å; I268-F839 HydrophobicContact CD1-CE1 3.8Å; I268-F839 HydrophobicContact CD1-CG 3.96Å; I268-F839 HydrophobicContact CD1-CZ 4.42Å; I268-F839 HydrophobicContact CG1-CD1 3.79Å; I268-F839 HydrophobicContact CG1-CD2 4.09Å; I268-F839 HydrophobicContact CG1-CE1 3.7Å; I268-F839 HydrophobicContact CG1-CE2 4.01Å; I268-F839 HydrophobicContact CG1-CG 3.98Å; I268-F839 HydrophobicContact CG1-CZ 3.82Å; I268-F839 HydrophobicContact CG2-CD1 4.36Å; I268-F839 HydrophobicContact CG2-CE1 3.49Å; I268-F839 VanDerWaalsContact CG2-CE1 3.49Å; I268-F839 HydrophobicContact CG2-CZ 3.59Å; I268-L842 HydrophobicContact CD1-CB 4.28Å; I268-L842 HydrophobicContact CD1-CD1 3.64Å; I268-L842 HydrophobicContact CD1-CD2 3.61Å; I268-L842 HydrophobicContact CD1-CG 4.03Å; I268-L858 HydrophobicContact CB-CD2 4.24Å; I268-L858 HydrophobicContact CG2-CD1 4.02Å; I268-L858 HydrophobicContact CG2-CD2 3.91Å
269	C	68.3	Low	67	Low	18 Å²	18	58.3 Å²	58.3	12%	0.122	29%	0.289	C	S	.	.	H	α-helix	trans	-54.5	-38.6	-179.5	-63.8	0	0	0	0	113.4	A265 R267 A273 P859 Q862	A265-C269 PolarHBondContact O-N 3.19Å; A265-C269 PolarHBondContact O-SG 3.03Å; R267-C269 VanDerWaalsContact C-N 3.33Å; R267-C269 PolarHBondContact O-N 3.26Å; C269-A273 WeakPolarHBondContact O-CB 3.29Å; C269-A273 PolarHBondContact O-N 3.49Å; C269-P859 VanDerWaalsContact SG-CD 3.51Å; C269-Q862 PolarHBondContact O-NE2 2.99Å; C269-Q862 VanDerWaalsContact O-NE2 3.15Å; C269-Q862 PolarHBondContact SG-OE1 3.39Å
270	K	69.7	Low	68.1	Low	154 Å²	154	58 Å²	58	67%	0.67	29%	0.287	S	S	*	.	H	α-helix	trans	-70.4	-43.4	176.3	-70.8	176.5	-179.4	-174.7	0	112.1	N266 R267 I268 L272 A273 V274	N266-K270 WeakPolarHBondContact O-CG 3.29Å; R267-K270 PolarHBondContact O-N 3.45Å; I268-K270 PolarHBondContact O-N 3.33Å; I268-K270 VanDerWaalsContact O-N 3.15Å; K270-L272 VanDerWaalsContact C-N 3.32Å; K270-L272 PolarHBondContact O-N 3.35Å; K270-A273 PolarHBondContact O-N 3.15Å; K270-V274 WeakPolarHBondContact O-CG2 3.41Å; K270-V274 PolarHBondContact O-N 3.02Å; K270-V274 VanDerWaalsContact O-N 3.16Å
271	V	71.2	Confident	69.1	Low	23 Å²	23	53.3 Å²	53.3	14%	0.139	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-37.9	-179.9	171.2	0	0	0	0	111.5	R267 I268 N275 R356 V835 L892	R267-V271 WeakPolarHBondContact O-CG2 3.33Å; R267-V271 PolarHBondContact O-N 2.87Å; I268-V271 PolarHBondContact O-N 2.89Å; V271-N275 PolarHBondContact O-N 3.32Å; V271-R356 PolarHBondContact O-NH2 3.12Å; V271-R356 VanDerWaalsContact O-NH2 3.08Å; V271-V835 HydrophobicContact CG1-CG1 4.2Å; V271-V835 HydrophobicContact CG2-CG1 4.07Å; V271-L892 HydrophobicContact CG1-CD2 3.18Å
272	L	69.1	Low	70.3	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-70.6	-45.8	175.1	-64.7	175.7	0	0	0	112.7	I268 K270 V274 N275 Q276 L858 Q862 Y865 C866 F888	I268-L272 HydrophobicContact CG2-CD1 3.53Å; I268-L272 HydrophobicContact CG2-CG 3.96Å; I268-L272 VanDerWaalsContact O-CG 3.3Å; I268-L272 WeakPolarHBondContact O-CG 3.44Å; I268-L272 PolarHBondContact O-N 3.19Å; K270-L272 VanDerWaalsContact C-N 3.32Å; K270-L272 PolarHBondContact O-N 3.35Å; L272-V274 VanDerWaalsContact C-N 3.28Å; L272-V274 PolarHBondContact O-N 2.81Å; L272-N275 WeakPolarHBondContact O-CA 3.43Å; L272-N275 WeakPolarHBondContact O-CB 3.21Å; L272-N275 PolarHBondContact O-N 3.14Å; L272-Q276 PolarHBondContact O-N 3.34Å; L272-L858 HydrophobicContact CD1-CD1 4.32Å; L272-Q862 HydrophobicContact CD1-CB 4.08Å; L272-Y865 HydrophobicContact CD2-CD1 4.03Å; L272-Y865 HydrophobicContact CD2-CE1 4.01Å; L272-C866 WeakPolarHBondContact CD1-SG 3.13Å; L272-C866 VanDerWaalsContact CD2-SG 3.54Å; L272-F888 HydrophobicContact CD2-CE1 3.64Å; L272-F888 HydrophobicContact CD2-CZ 3.5Å; L272-F888 VanDerWaalsContact CD2-CZ 3.5Å
273	A	71.8	Confident	71.6	Confident	42 Å²	42	55.3 Å²	55.3	35%	0.347	28%	0.275	S	S	.	.	H	α-helix	trans	-56.9	-42.6	177	0	0	0	0	0	111.8	C269 K270 N275 Q276 E277	C269-A273 WeakPolarHBondContact O-CB 3.29Å; C269-A273 PolarHBondContact O-N 3.49Å; K270-A273 PolarHBondContact O-N 3.15Å; A273-N275 VanDerWaalsContact C-N 3.27Å; A273-N275 PolarHBondContact O-N 3.19Å; A273-Q276 PolarHBondContact O-N 2.98Å; A273-E277 WeakPolarHBondContact O-CB 3.36Å; A273-E277 PolarHBondContact O-N 2.86Å; A273-E277 VanDerWaalsContact O-N 3.11Å
274	V	73.3	Confident	72.7	Confident	44 Å²	44	56 Å²	56	27%	0.267	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-31.8	173.3	173	0	0	0	0	112.1	K270 L272 N278	K270-V274 WeakPolarHBondContact O-CG2 3.41Å; K270-V274 PolarHBondContact O-N 3.02Å; K270-V274 VanDerWaalsContact O-N 3.16Å; L272-V274 VanDerWaalsContact C-N 3.28Å; L272-V274 PolarHBondContact O-N 2.81Å; V274-N278 PolarHBondContact O-N 2.9Å; V274-N278 PolarHBondContact O-ND2 2.75Å; V274-N278 PolarHBondContact O-OD1 3.13Å; V274-N278 VanDerWaalsContact O-OD1 3.13Å
275	N	76.1	Confident	74.2	Confident	24 Å²	24	56 Å²	56	13%	0.128	28%	0.275	C	S	.	.	H	α-helix	trans	-72.2	-47.7	176.4	-149	32.5	0	0	0	112.5	V271 L272 A273 E277 N278 E279 R356 Y865	V271-N275 PolarHBondContact O-N 3.32Å; L272-N275 WeakPolarHBondContact O-CA 3.43Å; L272-N275 WeakPolarHBondContact O-CB 3.21Å; L272-N275 PolarHBondContact O-N 3.14Å; A273-N275 VanDerWaalsContact C-N 3.27Å; A273-N275 PolarHBondContact O-N 3.19Å; N275-E277 VanDerWaalsContact C-N 3.3Å; N275-E277 PolarHBondContact O-N 3.44Å; N275-N278 WeakPolarHBondContact O-CB 3.43Å; N275-N278 PolarHBondContact O-N 3.45Å; N275-E279 PolarHBondContact O-N 3.48Å; N275-R356 PolarHBondContact OD1-NH1 3.29Å; N275-Y865 HydrophobicContact CB-CE1 4.48Å; N275-Y865 WeakPolarHBondContact CB-OH 3.44Å; N275-Y865 PolarHBondContact ND2-OH 3.08Å
276	Q	72.8	Confident	75.4	Confident	93 Å²	93	57.9 Å²	57.9	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-61.4	-38.9	-179.8	-169.9	177	16.8	0	0	112	L272 A273 N278 E279 Q280 Y865	L272-Q276 PolarHBondContact O-N 3.34Å; A273-Q276 PolarHBondContact O-N 2.98Å; Q276-N278 VanDerWaalsContact C-N 3.35Å; Q276-E279 PolarHBondContact O-N 3.29Å; Q276-Q280 PolarHBondContact O-N 2.89Å; Q276-Q280 VanDerWaalsContact O-N 3.11Å; Q276-Y865 HydrophobicContact CB-CE2 4.25Å; Q276-Y865 HydrophobicContact CG-CE2 4.4Å
277	E	76.4	Confident	76.5	Confident	103 Å²	103	60.4 Å²	60.4	48%	0.481	29%	0.29	S	S	.	.	H	α-helix	trans	-66	-36	174.5	-160.1	-156.9	135.7	0	0	112.2	A273 N275 M281 K350	A273-E277 WeakPolarHBondContact O-CB 3.36Å; A273-E277 PolarHBondContact O-N 2.86Å; A273-E277 VanDerWaalsContact O-N 3.11Å; N275-E277 VanDerWaalsContact C-N 3.3Å; N275-E277 PolarHBondContact O-N 3.44Å; E277-M281 HydrophobicContact CG-CE 4.34Å; E277-M281 WeakPolarHBondContact O-CE 3.39Å; E277-M281 PolarHBondContact O-N 3.43Å; E277-K350 IonicContact OE1-NZ 2.94Å; E277-K350 PolarHBondContact OE1-NZ 3.4Å; E277-K350 IonicContact OE2-NZ 2.88Å; E277-K350 PolarHBondContact OE2-NZ 3.41Å
278	N	80.4	Confident	77.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.9	-35.8	175.1	-66.4	-5.9	0	0	0	111.8	V274 N275 Q276 M281 M282 L347 K350 L351	V274-N278 PolarHBondContact O-N 2.9Å; V274-N278 PolarHBondContact O-ND2 2.75Å; V274-N278 PolarHBondContact O-OD1 3.13Å; V274-N278 VanDerWaalsContact O-OD1 3.13Å; N275-N278 WeakPolarHBondContact O-CB 3.43Å; N275-N278 PolarHBondContact O-N 3.45Å; Q276-N278 VanDerWaalsContact C-N 3.35Å; N278-M281 PolarHBondContact O-N 3.05Å; N278-M282 WeakPolarHBondContact O-CG 3.43Å; N278-M282 PolarHBondContact O-N 3.33Å; N278-L347 HydrophobicContact CB-CD1 3.99Å; N278-K350 WeakPolarHBondContact OD1-CD 3.42Å; N278-K350 WeakPolarHBondContact OD1-CE 3.36Å; N278-K350 PolarHBondContact OD1-NZ 2.76Å; N278-L351 HydrophobicContact CB-CD2 4.45Å
279	E	78.4	Confident	78.5	Confident	27 Å²	27	55.5 Å²	55.5	13%	0.126	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-43.4	175.8	-71.7	176.1	-175.2	0	0	112.4	N275 Q276 M281 M282 E283 Y865 R869	N275-E279 PolarHBondContact O-N 3.48Å; Q276-E279 PolarHBondContact O-N 3.29Å; E279-M281 VanDerWaalsContact C-N 3.3Å; E279-M281 PolarHBondContact O-N 2.9Å; E279-M282 HydrophobicContact CB-CE 4.2Å; E279-M282 HydrophobicContact CG-CE 3.66Å; E279-M282 WeakPolarHBondContact O-CB 3.49Å; E279-M282 PolarHBondContact O-N 3.43Å; E279-M282 VanDerWaalsContact O-N 3.1Å; E279-E283 PolarHBondContact O-N 3.13Å; E279-E283 VanDerWaalsContact O-N 3.1Å; E279-Y865 PolarHBondContact OE1-OH 3.12Å; E279-Y865 WeakPolarHBondContact OE2-CE2 3.3Å; E279-Y865 PolarHBondContact OE2-OH 3.43Å; E279-R869 IonicContact OE1-CZ 3.93Å; E279-R869 IonicContact OE1-NE 3Å; E279-R869 PolarHBondContact OE1-NE 3.42Å; E279-R869 IonicContact OE1-NH1 3.53Å; E279-R869 PolarHBondContact OE1-NH1 3.17Å; E279-R869 IonicContact OE1-NH2 3.49Å; E279-R869 PolarHBondContact OE1-NH2 3.37Å; E279-R869 VanDerWaalsContact OE1-NH2 3.14Å; E279-R869 IonicContact OE2-CZ 3.12Å; E279-R869 VanDerWaalsContact OE2-CZ 3.3Å; E279-R869 IonicContact OE2-NE 2.7Å; E279-R869 IonicContact OE2-NH2 2.68Å; E279-R869 PolarHBondContact OE2-NH2 2.81Å
280	Q	80.2	Confident	79.5	Confident	98 Å²	98	56.1 Å²	56.1	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-59	-42.5	173.4	-172.1	62.1	60	0	0	111.7	Q276 M282 E283 D284	Q276-Q280 PolarHBondContact O-N 2.89Å; Q276-Q280 VanDerWaalsContact O-N 3.11Å; Q280-M282 VanDerWaalsContact C-N 3.29Å; Q280-M282 PolarHBondContact O-N 2.87Å; Q280-E283 PolarHBondContact O-N 2.79Å; Q280-D284 PolarHBondContact NE2-OD1 2.78Å; Q280-D284 WeakPolarHBondContact O-CB 3.42Å; Q280-D284 VanDerWaalsContact O-CG 3.25Å; Q280-D284 PolarHBondContact O-N 3.29Å
281	M	80.6	Confident	80.4	Confident	42 Å²	42	52.8 Å²	52.8	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-28	176.4	-74.9	-172.4	-75.3	0	0	113.7	E277 N278 E279 Y285 L347 K350	E277-M281 HydrophobicContact CG-CE 4.34Å; E277-M281 WeakPolarHBondContact O-CE 3.39Å; E277-M281 PolarHBondContact O-N 3.43Å; N278-M281 PolarHBondContact O-N 3.05Å; E279-M281 VanDerWaalsContact C-N 3.3Å; E279-M281 PolarHBondContact O-N 2.9Å; M281-Y285 WeakPolarHBondContact O-CB 3.38Å; M281-Y285 PolarHBondContact O-N 3.46Å; M281-L347 HydrophobicContact CB-CD1 4.22Å; M281-L347 HydrophobicContact CE-CD1 4.43Å; M281-K350 HydrophobicContact CE-CD 3.8Å
282	M	81.7	Confident	81.3	Confident	51 Å²	51	51.7 Å²	51.7	25%	0.251	26%	0.261	S	S	.	.	H	α-helix	trans	-69.6	-44.7	172.5	-73.6	-175.7	-68.6	0	0	111.6	N278 E279 Q280 Y285 E286 L347 F359	N278-M282 WeakPolarHBondContact O-CG 3.43Å; N278-M282 PolarHBondContact O-N 3.33Å; E279-M282 HydrophobicContact CB-CE 4.2Å; E279-M282 HydrophobicContact CG-CE 3.66Å; E279-M282 WeakPolarHBondContact O-CB 3.49Å; E279-M282 PolarHBondContact O-N 3.43Å; E279-M282 VanDerWaalsContact O-N 3.1Å; Q280-M282 VanDerWaalsContact C-N 3.29Å; Q280-M282 PolarHBondContact O-N 2.87Å; M282-Y285 PolarHBondContact O-N 3.07Å; M282-E286 PolarHBondContact O-N 3.38Å; M282-E286 VanDerWaalsContact O-N 3.1Å; M282-L347 HydrophobicContact CG-CD1 4.46Å; M282-L347 HydrophobicContact CG-CD2 3.52Å; M282-F359 HydrophobicContact CB-CD2 4.33Å; M282-F359 HydrophobicContact CB-CE2 3.86Å; M282-F359 HydrophobicContact CB-CZ 4Å; M282-F359 HydrophobicContact CG-CD1 4.23Å; M282-F359 HydrophobicContact CG-CD2 3.53Å; M282-F359 HydrophobicContact CG-CE1 4.25Å; M282-F359 HydrophobicContact CG-CE2 3.57Å; M282-F359 HydrophobicContact CG-CG 3.86Å; M282-F359 HydrophobicContact CG-CZ 3.93Å; M282-F359 HydrophobicContact SD-CB 4.32Å; M282-F359 HydrophobicContact SD-CD2 3.29Å; M282-F359 WeakPolarHBondContact SD-CD2 3.49Å; M282-F359 HydrophobicContact SD-CE2 3.71Å; M282-F359 HydrophobicContact SD-CG 3.94Å
283	E	82.6	Confident	82.3	Confident	128 Å²	128	52.5 Å²	52.5	60%	0.598	27%	0.266	S	S	*	.	H	α-helix	trans	-65.1	-43.8	177.1	-67.9	-173.5	-177.7	0	0	112.4	E279 Q280 Y285 E286 K287	E279-E283 PolarHBondContact O-N 3.13Å; E279-E283 VanDerWaalsContact O-N 3.1Å; Q280-E283 PolarHBondContact O-N 2.79Å; E283-Y285 VanDerWaalsContact C-N 3.32Å; E283-Y285 PolarHBondContact O-N 3.19Å; E283-E286 PolarHBondContact O-N 3.45Å; E283-K287 PolarHBondContact O-N 2.96Å
284	D	82.4	Confident	83.2	Confident	87 Å²	87	56.5 Å²	56.5	47%	0.465	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-39.3	178.4	-70	-16.9	0	0	0	111.4	Q280 L288	Q280-D284 PolarHBondContact NE2-OD1 2.78Å; Q280-D284 WeakPolarHBondContact O-CB 3.42Å; Q280-D284 VanDerWaalsContact O-CG 3.25Å; Q280-D284 PolarHBondContact O-N 3.29Å; D284-L288 WeakPolarHBondContact O-CB 3.45Å; D284-L288 PolarHBondContact O-N 2.88Å; D284-L288 VanDerWaalsContact O-N 3.11Å
285	Y	88.6	Confident	84.1	Confident	3 Å²	3	56 Å²	56	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-50.5	172.4	173.2	-81.7	0	0	0	111.7	M281 M282 E283 K287 L288 A289 L340 F344 F359 P361 R365 V367	M281-Y285 WeakPolarHBondContact O-CB 3.38Å; M281-Y285 PolarHBondContact O-N 3.46Å; M282-Y285 PolarHBondContact O-N 3.07Å; E283-Y285 VanDerWaalsContact C-N 3.32Å; E283-Y285 PolarHBondContact O-N 3.19Å; Y285-K287 VanDerWaalsContact C-N 3.3Å; Y285-K287 PolarHBondContact O-N 3.17Å; Y285-L288 PolarHBondContact O-N 3.09Å; Y285-A289 HydrophobicContact CE1-CB 4.21Å; Y285-A289 VanDerWaalsContact O-CB 3.29Å; Y285-A289 WeakPolarHBondContact O-CB 3.23Å; Y285-A289 PolarHBondContact O-N 3.4Å; Y285-L340 HydrophobicContact CD2-CD2 4.24Å; Y285-L340 HydrophobicContact CD2-CG 3.93Å; Y285-L340 HydrophobicContact CE2-CD1 4.33Å; Y285-L340 HydrophobicContact CE2-CD2 3.43Å; Y285-L340 VanDerWaalsContact CE2-CD2 3.43Å; Y285-L340 HydrophobicContact CE2-CG 3.6Å; Y285-F344 HydrophobicContact CD2-CB 4.01Å; Y285-F344 HydrophobicContact CD2-CD2 4.36Å; Y285-F344 HydrophobicContact CE2-CB 3.76Å; Y285-F344 AromaticContact CE2-CD2 3.91Å; Y285-F344 HydrophobicContact CE2-CD2 3.91Å; Y285-F344 HydrophobicContact CE2-CG 4.19Å; Y285-F359 AromaticContact CD1-CE1 3.67Å; Y285-F359 HydrophobicContact CD1-CE1 3.67Å; Y285-F359 HydrophobicContact CD1-CZ 4.06Å; Y285-F359 HydrophobicContact CE1-CE1 4.22Å; Y285-F359 AromaticContact CG-CE1 4Å; Y285-F359 HydrophobicContact CG-CE1 4Å; Y285-P361 HydrophobicContact CD1-CB 4.44Å; Y285-P361 HydrophobicContact CD1-CG 4.2Å; Y285-P361 HydrophobicContact CE1-CB 3.72Å; Y285-P361 HydrophobicContact CE1-CG 3.43Å; Y285-P361 VanDerWaalsContact CE1-CG 3.43Å; Y285-R365 PolarHBondContact OH-O 3.05Å; Y285-V367 HydrophobicContact CE2-CG2 4.02Å; Y285-V367 WeakPolarHBondContact OH-CG2 3.47Å; Y285-V367 PolarHBondContact OH-N 2.8Å
286	E	83.9	Confident	84.9	Confident	46 Å²	46	55 Å²	55	22%	0.215	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-36.8	-176.1	-77.5	-130.1	142.4	0	0	112.8	M282 E283 S290 F359 S362 R365	M282-E286 PolarHBondContact O-N 3.38Å; M282-E286 VanDerWaalsContact O-N 3.1Å; E283-E286 PolarHBondContact O-N 3.45Å; E286-S290 WeakPolarHBondContact O-CB 3.35Å; E286-S290 PolarHBondContact O-N 3.21Å; E286-S290 VanDerWaalsContact O-N 3.1Å; E286-S290 PolarHBondContact O-OG 3Å; E286-F359 HydrophobicContact CG-CZ 4.44Å; E286-S362 WeakPolarHBondContact OE1-CB 3.24Å; E286-S362 PolarHBondContact OE1-N 3.07Å; E286-S362 PolarHBondContact OE1-OG 3.17Å; E286-S362 PolarHBondContact OE2-OG 3.36Å; E286-R365 IonicContact OE1-NH1 3.14Å; E286-R365 IonicContact OE2-NH1 2.85Å; E286-R365 PolarHBondContact OE2-NH1 2.66Å
287	K	86.4	Confident	85.7	Confident	141 Å²	141	58.6 Å²	58.6	61%	0.613	28%	0.275	S	S	*	.	H	α-helix	trans	-66.7	-51.2	175.8	-174.6	179.9	177.2	-175.3	0	111.3	E283 Y285 A289 S290 D291	E283-K287 PolarHBondContact O-N 2.96Å; Y285-K287 VanDerWaalsContact C-N 3.3Å; Y285-K287 PolarHBondContact O-N 3.17Å; K287-A289 VanDerWaalsContact C-N 3.3Å; K287-A289 PolarHBondContact O-N 2.96Å; K287-S290 WeakPolarHBondContact O-CB 3.31Å; K287-S290 PolarHBondContact O-N 3.09Å; K287-S290 VanDerWaalsContact O-N 3.11Å; K287-D291 PolarHBondContact O-N 2.89Å; K287-D291 VanDerWaalsContact O-N 3.1Å
288	L	87.8	Confident	86.5	Confident	40 Å²	40	62.5 Å²	62.5	21%	0.209	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-40	178.6	-171.1	68.1	0	0	0	111.8	D284 Y285 L292 E336 Q339 L340	D284-L288 WeakPolarHBondContact O-CB 3.45Å; D284-L288 PolarHBondContact O-N 2.88Å; D284-L288 VanDerWaalsContact O-N 3.11Å; Y285-L288 PolarHBondContact O-N 3.09Å; L288-L292 WeakPolarHBondContact O-CB 3.35Å; L288-L292 PolarHBondContact O-N 3.34Å; L288-L292 VanDerWaalsContact O-N 3.14Å; L288-E336 HydrophobicContact CD1-CB 4.19Å; L288-E336 HydrophobicContact CD1-CG 4.15Å; L288-Q339 HydrophobicContact CD2-CG 4.42Å; L288-L340 HydrophobicContact CB-CD1 4.43Å; L288-L340 HydrophobicContact CD2-CB 3.74Å; L288-L340 HydrophobicContact CD2-CD1 4.4Å; L288-L340 HydrophobicContact CD2-CG 4.43Å; L288-L340 HydrophobicContact CG-CB 4.38Å; L288-L340 HydrophobicContact CG-CD1 4.24Å
289	A	87.6	Confident	87.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.8	-42.8	174.2	0	0	0	0	0	112.3	Y285 K287 L293 L340 R365 I370	Y285-A289 HydrophobicContact CE1-CB 4.21Å; Y285-A289 VanDerWaalsContact O-CB 3.29Å; Y285-A289 WeakPolarHBondContact O-CB 3.23Å; Y285-A289 PolarHBondContact O-N 3.4Å; K287-A289 VanDerWaalsContact C-N 3.3Å; K287-A289 PolarHBondContact O-N 2.96Å; A289-L293 WeakPolarHBondContact O-CB 3.45Å; A289-L293 WeakPolarHBondContact O-CD1 3.48Å; A289-L293 VanDerWaalsContact O-CG 3.24Å; A289-L293 WeakPolarHBondContact O-CG 3.47Å; A289-L293 PolarHBondContact O-N 3.06Å; A289-L340 VanDerWaalsContact CA-CD1 3.49Å; A289-L340 HydrophobicContact CB-CD1 3.81Å; A289-R365 HydrophobicContact CB-CB 4.43Å; A289-I370 HydrophobicContact CB-CD1 3.9Å
290	S	88.5	Confident	87.7	Confident	30 Å²	30	63 Å²	63	21%	0.21	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-49.8	-178.6	-60.7	0	0	0	0	111.9	E286 K287 L292 L293 E294 R365	E286-S290 WeakPolarHBondContact O-CB 3.35Å; E286-S290 PolarHBondContact O-N 3.21Å; E286-S290 VanDerWaalsContact O-N 3.1Å; E286-S290 PolarHBondContact O-OG 3Å; K287-S290 WeakPolarHBondContact O-CB 3.31Å; K287-S290 PolarHBondContact O-N 3.09Å; K287-S290 VanDerWaalsContact O-N 3.11Å; S290-L292 VanDerWaalsContact C-N 3.33Å; S290-L292 PolarHBondContact O-N 3Å; S290-L293 PolarHBondContact O-N 3.35Å; S290-E294 PolarHBondContact O-N 3.28Å; S290-R365 PolarHBondContact OG-NE 3.39Å; S290-R365 PolarHBondContact OG-NH2 3.15Å; S290-R365 VanDerWaalsContact OG-NH2 3.12Å
291	D	88.9	Confident	88.3	Confident	85 Å²	85	62.1 Å²	62.1	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-40.7	-179.8	-68.6	-11.3	0	0	0	111.4	K287 W295	K287-D291 PolarHBondContact O-N 2.89Å; K287-D291 VanDerWaalsContact O-N 3.1Å; D291-W295 WeakPolarHBondContact O-CB 3.29Å; D291-W295 PolarHBondContact O-N 3.08Å; D291-W295 VanDerWaalsContact O-N 3.09Å
292	L	90.5	Very high	88.8	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.1	-45.8	177.8	-173.4	62.7	0	0	0	112	L288 S290 E294 W295 I296 K333 K337 L340 I370 W374	L288-L292 WeakPolarHBondContact O-CB 3.35Å; L288-L292 PolarHBondContact O-N 3.34Å; L288-L292 VanDerWaalsContact O-N 3.14Å; S290-L292 VanDerWaalsContact C-N 3.33Å; S290-L292 PolarHBondContact O-N 3Å; L292-E294 PolarHBondContact O-N 3.27Å; L292-W295 HydrophobicContact CD1-CE3 4.43Å; L292-W295 PolarHBondContact O-N 3.03Å; L292-I296 HydrophobicContact CG-CD1 4.24Å; L292-I296 VanDerWaalsContact O-CG1 3.32Å; L292-I296 WeakPolarHBondContact O-CG1 3.35Å; L292-I296 PolarHBondContact O-N 3.08Å; L292-K333 HydrophobicContact CD1-CB 4.32Å; L292-K333 HydrophobicContact CD1-CD 4.48Å; L292-K337 HydrophobicContact CD2-CB 4.04Å; L292-K337 HydrophobicContact CD2-CG 4.43Å; L292-L340 HydrophobicContact CD2-CD1 4.49Å; L292-I370 HydrophobicContact CD2-CG2 3.93Å; L292-W374 HydrophobicContact CD1-CZ3 4.16Å
293	L	89.6	Confident	89.2	Confident	19 Å²	19	62.2 Å²	62.2	10%	0.099	29%	0.287	C	S	.	.	H	α-helix	trans	-68	-31	179	-73.9	169.7	0	0	0	113	A289 S290 R297 R365 I370 A373	A289-L293 WeakPolarHBondContact O-CB 3.45Å; A289-L293 WeakPolarHBondContact O-CD1 3.48Å; A289-L293 VanDerWaalsContact O-CG 3.24Å; A289-L293 WeakPolarHBondContact O-CG 3.47Å; A289-L293 PolarHBondContact O-N 3.06Å; S290-L293 PolarHBondContact O-N 3.35Å; L293-R297 WeakPolarHBondContact O-CB 3.46Å; L293-R297 WeakPolarHBondContact O-CG 3.28Å; L293-R297 PolarHBondContact O-N 3.4Å; L293-R297 PolarHBondContact O-NE 3.26Å; L293-R365 HydrophobicContact CD1-CG 4.46Å; L293-I370 HydrophobicContact CD1-CG1 4.1Å; L293-I370 HydrophobicContact CD2-CG1 4.07Å; L293-I370 HydrophobicContact CG-CG1 4.12Å; L293-A373 HydrophobicContact CD2-CB 3.97Å
294	E	90.1	Very high	89.6	Confident	126 Å²	126	61.7 Å²	61.7	59%	0.589	28%	0.284	S	S	*	.	H	α-helix	trans	-68.3	-45.4	170.8	-172.4	175.5	162.2	0	0	111.4	S290 L292 I296 R297 R298	S290-E294 PolarHBondContact O-N 3.28Å; L292-E294 PolarHBondContact O-N 3.27Å; E294-I296 PolarHBondContact O-N 2.85Å; E294-R297 PolarHBondContact O-N 3.07Å; E294-R298 PolarHBondContact O-N 2.91Å
295	W	93.4	Very high	89.8	Confident	33 Å²	33	61.1 Å²	61.1	13%	0.125	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-44	177.3	177.8	84.3	0	0	0	112.6	D291 L292 R298 T299 Y325 K333 W374 L377	D291-W295 WeakPolarHBondContact O-CB 3.29Å; D291-W295 PolarHBondContact O-N 3.08Å; D291-W295 VanDerWaalsContact O-N 3.09Å; L292-W295 HydrophobicContact CD1-CE3 4.43Å; L292-W295 PolarHBondContact O-N 3.03Å; W295-R298 PolarHBondContact O-N 3.39Å; W295-T299 HydrophobicContact CZ2-CG2 4.41Å; W295-T299 WeakPolarHBondContact O-CB 3.29Å; W295-T299 PolarHBondContact O-N 3.45Å; W295-T299 VanDerWaalsContact O-N 3.08Å; W295-T299 PolarHBondContact O-OG1 2.84Å; W295-Y325 HydrophobicContact CH2-CE2 4.14Å; W295-Y325 AromaticContact CZ2-CE2 3.8Å; W295-Y325 HydrophobicContact CZ2-CE2 3.8Å; W295-K333 HydrophobicContact CD2-CD 4.45Å; W295-K333 HydrophobicContact CD2-CG 3.86Å; W295-K333 HydrophobicContact CE3-CB 4.19Å; W295-K333 HydrophobicContact CE3-CG 4.01Å; W295-K333 HydrophobicContact CG-CG 4.46Å; W295-K333 HydrophobicContact CH2-CB 4.03Å; W295-K333 HydrophobicContact CH2-CG 4.1Å; W295-K333 HydrophobicContact CZ2-CB 4.35Å; W295-K333 HydrophobicContact CZ2-CG 3.91Å; W295-K333 HydrophobicContact CZ3-CB 3.93Å; W295-K333 HydrophobicContact CZ3-CG 4.13Å; W295-W374 HydrophobicContact CZ3-CZ3 4.02Å; W295-L377 HydrophobicContact CH2-CD2 3.92Å; W295-L377 HydrophobicContact CZ3-CD2 3.53Å
296	I	92.3	Very high	89.6	Confident	2 Å²	2	65 Å²	65	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-58.2	-50.9	175.6	-67.5	166.3	0	0	0	110.4	L292 E294 R298 T299 I300 A373 W374 L377	L292-I296 HydrophobicContact CG-CD1 4.24Å; L292-I296 VanDerWaalsContact O-CG1 3.32Å; L292-I296 WeakPolarHBondContact O-CG1 3.35Å; L292-I296 PolarHBondContact O-N 3.08Å; E294-I296 PolarHBondContact O-N 2.85Å; I296-R298 VanDerWaalsContact C-N 3.26Å; I296-R298 PolarHBondContact O-N 2.93Å; I296-T299 PolarHBondContact O-N 3.42Å; I296-I300 HydrophobicContact CG2-CD1 3.62Å; I296-I300 HydrophobicContact CG2-CG1 4.25Å; I296-I300 PolarHBondContact O-N 3.46Å; I296-I300 VanDerWaalsContact O-N 3.08Å; I296-A373 HydrophobicContact CD1-CB 4.2Å; I296-A373 HydrophobicContact CG2-CB 4.21Å; I296-W374 HydrophobicContact CD1-CE3 4.11Å; I296-W374 HydrophobicContact CG1-CE3 4.48Å; I296-L377 HydrophobicContact CG1-CD2 4.38Å; I296-L377 HydrophobicContact CG2-CB 4.27Å
297	R	90.4	Very high	89.5	Confident	170 Å²	170	66 Å²	66	64%	0.642	31%	0.305	S	S	*	.	H	α-helix	trans	-61	-31.6	-178.2	-78.7	179	-73.8	-172.4	-0.4	113.4	L293 E294 P301	L293-R297 WeakPolarHBondContact O-CB 3.46Å; L293-R297 WeakPolarHBondContact O-CG 3.28Å; L293-R297 PolarHBondContact O-N 3.4Å; L293-R297 PolarHBondContact O-NE 3.26Å; E294-R297 PolarHBondContact O-N 3.07Å; R297-P301 VanDerWaalsContact O-CD 3.29Å; R297-P301 WeakPolarHBondContact O-CD 3.1Å
298	R	92.3	Very high	88.9	Confident	185 Å²	185	66.1 Å²	66.1	70%	0.698	31%	0.308	S	S	*	.	H	α-helix	trans	-78.4	-27.9	174.7	-164.1	-179.5	72.5	-170.1	3.5	113.3	E294 W295 I296	E294-R298 PolarHBondContact O-N 2.91Å; W295-R298 PolarHBondContact O-N 3.39Å; I296-R298 VanDerWaalsContact C-N 3.26Å; I296-R298 PolarHBondContact O-N 2.93Å
299	T	92.6	Very high	88.4	Confident	12 Å²	12	67.3 Å²	67.3	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-87	-35.6	-172	-55	0	0	0	0	112.5	W295 I296 W302 L303 Y325 L377	W295-T299 HydrophobicContact CZ2-CG2 4.41Å; W295-T299 WeakPolarHBondContact O-CB 3.29Å; W295-T299 PolarHBondContact O-N 3.45Å; W295-T299 VanDerWaalsContact O-N 3.08Å; W295-T299 PolarHBondContact O-OG1 2.84Å; I296-T299 PolarHBondContact O-N 3.42Å; T299-W302 HydrophobicContact CG2-CE3 4.5Å; T299-W302 PolarHBondContact O-N 3.37Å; T299-W302 VanDerWaalsContact O-N 3.14Å; T299-L303 HydrophobicContact CG2-CD1 4Å; T299-L303 HydrophobicContact CG2-CG 4.38Å; T299-L303 PolarHBondContact O-N 2.68Å; T299-Y325 HydrophobicContact CG2-CE2 3.67Å; T299-L377 HydrophobicContact CG2-CD1 3.92Å
300	I	91.8	Very high	87.7	Confident	25 Å²	25	75.5 Å²	75.5	13%	0.128	35%	0.348	C	S	.	.	H	α-helix	trans	-53.7	-49.5	179.3	-70.6	166.9	0	0	0	112.7	I296 W302 L303 E304 T376 L377	I296-I300 HydrophobicContact CG2-CD1 3.62Å; I296-I300 HydrophobicContact CG2-CG1 4.25Å; I296-I300 PolarHBondContact O-N 3.46Å; I296-I300 VanDerWaalsContact O-N 3.08Å; I300-W302 PolarHBondContact O-N 2.96Å; I300-W302 VanDerWaalsContact O-N 3.15Å; I300-L303 CarbonylContact O-C 3.57Å; I300-L303 WeakPolarHBondContact O-CA 3.47Å; I300-L303 PolarHBondContact O-N 2.76Å; I300-E304 HydrophobicContact CG2-CG 4.08Å; I300-E304 WeakPolarHBondContact O-CG 3.49Å; I300-E304 PolarHBondContact O-N 2.88Å; I300-T376 HydrophobicContact CD1-CG2 4.07Å; I300-L377 HydrophobicContact CG1-CB 4.37Å; I300-L377 HydrophobicContact CG1-CD1 3.86Å
301	P	92.8	Very high	87.2	Confident	80 Å²	80	77 Å²	77	52%	0.519	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-25.2	-179.4	-25.1	35.7	0	0	0	114.9	R297 N305	R297-P301 VanDerWaalsContact O-CD 3.29Å; R297-P301 WeakPolarHBondContact O-CD 3.1Å; P301-N305 PolarHBondContact O-N 2.97Å
302	W	91.3	Very high	86.9	Confident	95 Å²	95	73.7 Å²	73.7	36%	0.36	34%	0.338	S	S	.	.	H	α-helix	trans	-74.2	-41.2	173.5	174.6	76.5	0	0	0	111	T299 I300 E304 N305 F322 Y325	T299-W302 HydrophobicContact CG2-CE3 4.5Å; T299-W302 PolarHBondContact O-N 3.37Å; T299-W302 VanDerWaalsContact O-N 3.14Å; I300-W302 PolarHBondContact O-N 2.96Å; I300-W302 VanDerWaalsContact O-N 3.15Å; W302-E304 VanDerWaalsContact C-N 3.3Å; W302-E304 PolarHBondContact O-N 2.83Å; W302-N305 WeakPolarHBondContact O-CB 3.26Å; W302-N305 PolarHBondContact O-N 2.85Å; W302-F322 HydrophobicContact CH2-CD2 4.37Å; W302-Y325 HydrophobicContact CH2-CD2 4.49Å; W302-Y325 HydrophobicContact CH2-CG 4.03Å; W302-Y325 HydrophobicContact CZ3-CD1 4.11Å; W302-Y325 AromaticContact CZ3-CD2 3.9Å; W302-Y325 HydrophobicContact CZ3-CD2 3.9Å; W302-Y325 HydrophobicContact CZ3-CE2 4.45Å; W302-Y325 AromaticContact CZ3-CG 3.72Å; W302-Y325 HydrophobicContact CZ3-CG 3.72Å
303	L	90	Very high	86.5	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-72.2	-17.4	174	-65.9	169.9	0	0	0	114	T299 I300 R306 F322 Y325 L377 A380 E381 Y384	T299-L303 HydrophobicContact CG2-CD1 4Å; T299-L303 HydrophobicContact CG2-CG 4.38Å; T299-L303 PolarHBondContact O-N 2.68Å; I300-L303 CarbonylContact O-C 3.57Å; I300-L303 WeakPolarHBondContact O-CA 3.47Å; I300-L303 PolarHBondContact O-N 2.76Å; L303-R306 VanDerWaalsContact O-CZ 3.25Å; L303-R306 PolarHBondContact O-NH1 3.36Å; L303-R306 PolarHBondContact O-NH2 3.45Å; L303-F322 HydrophobicContact CD2-CD2 4.15Å; L303-F322 HydrophobicContact CD2-CE2 3.81Å; L303-Y325 HydrophobicContact CD2-CE1 4.48Å; L303-L377 HydrophobicContact CD1-CD1 3.55Å; L303-L377 HydrophobicContact CD1-CG 4.42Å; L303-A380 HydrophobicContact CB-CB 3.94Å; L303-A380 HydrophobicContact CD1-CB 4.35Å; L303-E381 HydrophobicContact CD1-CB 4.47Å; L303-E381 HydrophobicContact CD1-CG 3.52Å; L303-E381 HydrophobicContact CD2-CG 4.23Å; L303-Y384 HydrophobicContact CD2-CD1 4.43Å; L303-Y384 HydrophobicContact CD2-CD2 4.46Å; L303-Y384 HydrophobicContact CD2-CG 4.14Å; L303-Y384 VanDerWaalsContact O-CD2 3.28Å; L303-Y384 WeakPolarHBondContact O-CD2 3.32Å
304	E	89.5	Confident	86.2	Confident	116 Å²	116	84 Å²	84	54%	0.542	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-6.8	174	-70.8	-177.8	159.1	0	0	113.3	I300 W302 R306 A380	I300-E304 HydrophobicContact CG2-CG 4.08Å; I300-E304 WeakPolarHBondContact O-CG 3.49Å; I300-E304 PolarHBondContact O-N 2.88Å; W302-E304 VanDerWaalsContact C-N 3.3Å; W302-E304 PolarHBondContact O-N 2.83Å; E304-R306 PolarHBondContact O-N 2.75Å; E304-R306 VanDerWaalsContact O-N 3.13Å; E304-A380 HydrophobicContact CG-CB 4.37Å
305	N	87.8	Confident	86	Confident	75 Å²	75	78 Å²	78	40%	0.401	36%	0.358	S	S	.	.			trans	-71.2	108	177.1	-174.6	-8.6	0	0	0	111	P301 W302 T307	P301-N305 PolarHBondContact O-N 2.97Å; W302-N305 WeakPolarHBondContact O-CB 3.26Å; W302-N305 PolarHBondContact O-N 2.85Å; N305-T307 WeakPolarHBondContact OD1-CB 3.45Å; N305-T307 VanDerWaalsContact OD1-CG2 3.27Å; N305-T307 WeakPolarHBondContact OD1-CG2 3.31Å; N305-T307 PolarHBondContact OD1-N 3.32Å; N305-T307 PolarHBondContact OD1-OG1 3.1Å
306	R	83.9	Confident	85.5	Confident	85 Å²	85	80.8 Å²	80.8	32%	0.321	37%	0.373	S	S	.	.			trans	-104.6	33.9	-178.4	-61.9	-76.6	170.9	-86	-10.7	113.1	L303 E304 Q308 G383 W387	L303-R306 VanDerWaalsContact O-CZ 3.25Å; L303-R306 PolarHBondContact O-NH1 3.36Å; L303-R306 PolarHBondContact O-NH2 3.45Å; E304-R306 PolarHBondContact O-N 2.75Å; E304-R306 VanDerWaalsContact O-N 3.13Å; R306-Q308 PolarHBondContact O-N 3.49Å; R306-Q308 VanDerWaalsContact O-N 3.16Å; R306-G383 PolarHBondContact NH2-O 3.5Å; R306-W387 VanDerWaalsContact C-CZ2 3.49Å; R306-W387 HydrophobicContact CB-CZ2 4.45Å; R306-W387 VanDerWaalsContact CD-CD2 3.42Å
307	T	81.9	Confident	85.2	Confident	67 Å²	67	83.3 Å²	83.3	41%	0.411	39%	0.393	S	S	.	.			trans	-63.5	112.7	179.5	34.5	0	0	0	0	112	N305 K318 W387	N305-T307 WeakPolarHBondContact OD1-CB 3.45Å; N305-T307 VanDerWaalsContact OD1-CG2 3.27Å; N305-T307 WeakPolarHBondContact OD1-CG2 3.31Å; N305-T307 PolarHBondContact OD1-N 3.32Å; N305-T307 PolarHBondContact OD1-OG1 3.1Å; T307-K318 PolarHBondContact O-NZ 2.97Å; T307-K318 PolarHBondContact OG1-NZ 2.85Å; T307-K318 VanDerWaalsContact OG1-NZ 3.11Å; T307-W387 WeakPolarHBondContact O-CH2 3.18Å; T307-W387 WeakPolarHBondContact O-CZ2 3.12Å
308	Q	74.9	Confident	85	Confident	143 Å²	143	76.9 Å²	76.9	67%	0.668	37%	0.37	S	S	*	.			trans	-65.3	129.1	176.1	-71	177	-28.4	0	0	111	R306	R306-Q308 PolarHBondContact O-N 3.49Å; R306-Q308 VanDerWaalsContact O-N 3.16Å
309	E	77.1	Confident	84.8	Confident	65 Å²	65	71.6 Å²	71.6	30%	0.304	35%	0.353	S	S	.	.			trans	-105.3	159.5	174	-61.3	-58.3	160.6	0	0	111.1	D314 L315 K318	E309-D314 HydrophobicContact CB-CB 3.96Å; E309-D314 HydrophobicContact CG-CB 4.14Å; E309-L315 HydrophobicContact CB-CD2 3.88Å; E309-L315 HydrophobicContact CB-CG 4.13Å; E309-L315 HydrophobicContact CG-CD2 3.89Å; E309-K318 HydrophobicContact CG-CD 4.37Å; E309-K318 WeakPolarHBondContact OE1-CE 3.49Å; E309-K318 IonicContact OE1-NZ 3.67Å; E309-K318 PolarHBondContact OE1-NZ 2.71Å
310	K	71.4	Confident	84.5	Confident	173 Å²	173	75.9 Å²	75.9	75%	0.752	37%	0.372	S	S	*	.	S	Bend	trans	-91.7	-16.3	-173.5	-65.1	-174.4	-179.9	-176.5	0	114.7
311	T	78.8	Confident	84.4	Confident	60 Å²	60	79.3 Å²	79.3	37%	0.368	39%	0.391	S	S	.	.	S	Bend	trans	-129.8	149.1	-177.4	86.6	0	0	0	0	112.3	K313 D314 L315	T311-K313 PolarHBondContact O-N 2.95Å; T311-K313 PolarHBondContact OG1-N 3.14Å; T311-D314 WeakPolarHBondContact CB-OD2 3.37Å; T311-D314 WeakPolarHBondContact CG2-OD2 3.23Å; T311-D314 PolarHBondContact O-N 3.32Å; T311-D314 PolarHBondContact OG1-N 2.99Å; T311-D314 PolarHBondContact OG1-OD2 3.49Å; T311-L315 PolarHBondContact O-N 3.46Å
312	V	82.8	Confident	84.2	Confident	16 Å²	16	76 Å²	76	10%	0.097	37%	0.369	C	S	.	.	H	α-helix	trans	-56.8	-35	174.6	-177.7	0	0	0	0	110.9	L315 Q316 L395 E396	V312-L315 PolarHBondContact O-N 3.21Å; V312-Q316 HydrophobicContact CG1-CG 4.27Å; V312-Q316 VanDerWaalsContact O-CG 3.31Å; V312-Q316 WeakPolarHBondContact O-CG 3.5Å; V312-Q316 PolarHBondContact O-N 3.39Å; V312-L395 HydrophobicContact CG2-CB 3.6Å; V312-E396 HydrophobicContact CG1-CG 4.11Å; V312-E396 HydrophobicContact CG2-CG 4.19Å
313	K	82.6	Confident	84.1	Confident	162 Å²	162	78.4 Å²	78.4	70%	0.704	38%	0.378	S	S	*	.	H	α-helix	trans	-66	-39.3	-179.1	-68.2	179.3	179.7	172.9	0	112.9	T311 L315 Q316 A317	T311-K313 PolarHBondContact O-N 2.95Å; T311-K313 PolarHBondContact OG1-N 3.14Å; K313-L315 VanDerWaalsContact C-N 3.32Å; K313-Q316 PolarHBondContact O-N 3.29Å; K313-A317 PolarHBondContact O-N 3.41Å
314	D	83	Confident	84.1	Confident	73 Å²	73	82 Å²	82	39%	0.39	40%	0.397	S	S	.	.	H	α-helix	trans	-68.9	-34.5	179	-55.3	-46.2	0	0	0	110.9	E309 T311 A317 K318	E309-D314 HydrophobicContact CB-CB 3.96Å; E309-D314 HydrophobicContact CG-CB 4.14Å; T311-D314 WeakPolarHBondContact CB-OD2 3.37Å; T311-D314 WeakPolarHBondContact CG2-OD2 3.23Å; T311-D314 PolarHBondContact O-N 3.32Å; T311-D314 PolarHBondContact OG1-N 2.99Å; T311-D314 PolarHBondContact OG1-OD2 3.49Å; D314-A317 PolarHBondContact O-N 2.83Å; D314-K318 PolarHBondContact O-N 3.03Å
315	L	84.8	Confident	84.2	Confident	0 Å²	0	77 Å²	77	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-74.8	-33.6	172.1	-66.3	-177.2	0	0	0	113.5	E309 T311 V312 K313 A317 K318 Q319 E391 I392 L395	E309-L315 HydrophobicContact CB-CD2 3.88Å; E309-L315 HydrophobicContact CB-CG 4.13Å; E309-L315 HydrophobicContact CG-CD2 3.89Å; T311-L315 PolarHBondContact O-N 3.46Å; V312-L315 PolarHBondContact O-N 3.21Å; K313-L315 VanDerWaalsContact C-N 3.32Å; L315-A317 VanDerWaalsContact C-N 3.26Å; L315-A317 PolarHBondContact O-N 2.87Å; L315-K318 HydrophobicContact CD2-CD 4.32Å; L315-K318 CarbonylContact O-C 3.53Å; L315-K318 PolarHBondContact O-N 3.03Å; L315-Q319 WeakPolarHBondContact O-CB 3.33Å; L315-Q319 PolarHBondContact O-N 3Å; L315-E391 HydrophobicContact CD1-CB 3.85Å; L315-E391 HydrophobicContact CD1-CG 3.38Å; L315-I392 HydrophobicContact CB-CD1 4.32Å; L315-I392 HydrophobicContact CB-CG1 3.74Å; L315-I392 HydrophobicContact CD1-CG1 4.13Å; L315-L395 HydrophobicContact CD1-CD1 3.54Å; L315-L395 HydrophobicContact CD1-CG 4.25Å; L315-L395 HydrophobicContact CG-CD1 4.22Å
316	Q	83.8	Confident	84.3	Confident	93 Å²	93	78.6 Å²	78.6	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-61.8	-36.2	171.2	-76.9	171.7	-8.5	0	0	111.3	V312 K313 Q319 E320	V312-Q316 HydrophobicContact CG1-CG 4.27Å; V312-Q316 VanDerWaalsContact O-CG 3.31Å; V312-Q316 WeakPolarHBondContact O-CG 3.5Å; V312-Q316 PolarHBondContact O-N 3.39Å; K313-Q316 PolarHBondContact O-N 3.29Å; Q316-Q319 PolarHBondContact O-N 2.79Å; Q316-E320 PolarHBondContact O-N 3.48Å
317	A	86.3	Confident	84.3	Confident	54 Å²	54	78.7 Å²	78.7	45%	0.446	38%	0.384	S	S	.	.	H	α-helix	trans	-63.6	-50.1	171	0	0	0	0	0	111.8	K313 D314 L315 Q319 E320 D321	K313-A317 PolarHBondContact O-N 3.41Å; D314-A317 PolarHBondContact O-N 2.83Å; L315-A317 VanDerWaalsContact C-N 3.26Å; L315-A317 PolarHBondContact O-N 2.87Å; A317-Q319 PolarHBondContact O-N 3.34Å; A317-E320 PolarHBondContact O-N 3.35Å; A317-E320 VanDerWaalsContact O-N 3.09Å; A317-D321 PolarHBondContact O-N 3.48Å
318	K	86.4	Confident	84.5	Confident	35 Å²	35	79.3 Å²	79.3	15%	0.152	39%	0.387	C	S	.	.	H	α-helix	trans	-59.7	-28.9	174.3	-69.6	-171.2	-174.6	177.8	0	113.3	T307 E309 D314 L315 F322 I388	T307-K318 PolarHBondContact O-NZ 2.97Å; T307-K318 PolarHBondContact OG1-NZ 2.85Å; T307-K318 VanDerWaalsContact OG1-NZ 3.11Å; E309-K318 HydrophobicContact CG-CD 4.37Å; E309-K318 WeakPolarHBondContact OE1-CE 3.49Å; E309-K318 IonicContact OE1-NZ 3.67Å; E309-K318 PolarHBondContact OE1-NZ 2.71Å; D314-K318 PolarHBondContact O-N 3.03Å; L315-K318 HydrophobicContact CD2-CD 4.32Å; L315-K318 CarbonylContact O-C 3.53Å; L315-K318 PolarHBondContact O-N 3.03Å; K318-F322 WeakPolarHBondContact O-CB 3.31Å; K318-F322 PolarHBondContact O-N 2.97Å; K318-F322 VanDerWaalsContact O-N 3.15Å; K318-I388 HydrophobicContact CB-CD1 4.05Å
319	Q	87.1	Confident	85.1	Confident	74 Å²	74	77.5 Å²	77.5	35%	0.346	38%	0.378	S	S	.	.	H	α-helix	trans	-73.1	-38.8	175.4	-172.3	-179.1	30.7	0	0	111.8	L315 Q316 A317 F322 R323 I388 I392	L315-Q319 WeakPolarHBondContact O-CB 3.33Å; L315-Q319 PolarHBondContact O-N 3Å; Q316-Q319 PolarHBondContact O-N 2.79Å; A317-Q319 PolarHBondContact O-N 3.34Å; Q319-F322 PolarHBondContact O-N 3.29Å; Q319-R323 WeakPolarHBondContact O-CB 3.43Å; Q319-R323 PolarHBondContact O-N 2.63Å; Q319-I388 HydrophobicContact CB-CG2 4.12Å; Q319-I388 HydrophobicContact CG-CG2 4.23Å; Q319-I392 HydrophobicContact CB-CD1 4.25Å; Q319-I392 HydrophobicContact CG-CD1 4.47Å
320	E	86.6	Confident	85.6	Confident	102 Å²	102	75.8 Å²	75.8	48%	0.477	37%	0.37	S	S	.	.	H	α-helix	trans	-72.2	-36.9	175.9	-164.4	66	-167.8	0	0	111.3	Q316 A317 F322 R323 D324	Q316-E320 PolarHBondContact O-N 3.48Å; A317-E320 PolarHBondContact O-N 3.35Å; A317-E320 VanDerWaalsContact O-N 3.09Å; E320-F322 VanDerWaalsContact C-N 3.3Å; E320-F322 PolarHBondContact O-N 2.76Å; E320-R323 WeakPolarHBondContact O-CA 3.41Å; E320-R323 WeakPolarHBondContact O-CB 3.37Å; E320-R323 PolarHBondContact O-N 2.88Å; E320-R323 VanDerWaalsContact O-N 3.09Å; E320-R323 IonicContact OE1-NH1 3.45Å; E320-R323 PolarHBondContact OE1-NH1 2.94Å; E320-R323 WeakPolarHBondContact OE2-CD 3.34Å; E320-R323 IonicContact OE2-CZ 3.5Å; E320-R323 IonicContact OE2-NH1 2.71Å; E320-R323 PolarHBondContact OE2-NH1 3.39Å; E320-D324 PolarHBondContact O-N 2.98Å
321	D	88.7	Confident	86.5	Confident	98 Å²	98	70.2 Å²	70.2	52%	0.524	35%	0.352	S	S	.	.	H	α-helix	trans	-58.2	-42	169.6	-69.1	-21.4	0	0	0	111.5	A317 R323 Y325	A317-D321 PolarHBondContact O-N 3.48Å; D321-R323 VanDerWaalsContact C-N 3.33Å; D321-Y325 WeakPolarHBondContact O-CB 3.21Å; D321-Y325 PolarHBondContact O-N 3.45Å
322	F	90.4	Very high	87	Confident	10 Å²	10	70.2 Å²	70.2	4%	0.044	35%	0.352	C	S	.	.	H	α-helix	trans	-69.3	-31.3	175	-176.6	-116	0	0	0	113.1	W302 L303 K318 Q319 E320 Y325 R326 Y384 E385	W302-F322 HydrophobicContact CH2-CD2 4.37Å; L303-F322 HydrophobicContact CD2-CD2 4.15Å; L303-F322 HydrophobicContact CD2-CE2 3.81Å; K318-F322 WeakPolarHBondContact O-CB 3.31Å; K318-F322 PolarHBondContact O-N 2.97Å; K318-F322 VanDerWaalsContact O-N 3.15Å; Q319-F322 PolarHBondContact O-N 3.29Å; E320-F322 VanDerWaalsContact C-N 3.3Å; E320-F322 PolarHBondContact O-N 2.76Å; F322-Y325 HydrophobicContact CD2-CD1 4.04Å; F322-Y325 HydrophobicContact CE2-CD1 4.08Å; F322-Y325 HydrophobicContact CE2-CE1 4.36Å; F322-Y325 WeakPolarHBondContact O-CB 3.45Å; F322-R326 HydrophobicContact CE1-CG 4.45Å; F322-R326 HydrophobicContact CE2-CG 4.46Å; F322-R326 HydrophobicContact CZ-CG 4.31Å; F322-R326 WeakPolarHBondContact O-CG 3.48Å; F322-R326 PolarHBondContact O-N 3.4Å; F322-Y384 HydrophobicContact CB-CD1 4.38Å; F322-Y384 HydrophobicContact CB-CE1 3.77Å; F322-Y384 HydrophobicContact CD1-CD1 4.31Å; F322-Y384 HydrophobicContact CD1-CE1 4.47Å; F322-Y384 AromaticContact CD2-CD1 3.48Å; F322-Y384 HydrophobicContact CD2-CD1 3.48Å; F322-Y384 VanDerWaalsContact CD2-CD1 3.48Å; F322-Y384 AromaticContact CD2-CE1 3.63Å; F322-Y384 HydrophobicContact CD2-CE1 3.63Å; F322-Y384 HydrophobicContact CE1-CD1 4.48Å; F322-Y384 AromaticContact CE2-CD1 3.71Å; F322-Y384 HydrophobicContact CE2-CD1 3.71Å; F322-Y384 HydrophobicContact CE2-CE1 4.33Å; F322-Y384 HydrophobicContact CE2-CG 4.47Å; F322-Y384 AromaticContact CG-CD1 3.81Å; F322-Y384 HydrophobicContact CG-CD1 3.81Å; F322-Y384 AromaticContact CG-CE1 3.71Å; F322-Y384 HydrophobicContact CG-CE1 3.71Å; F322-Y384 HydrophobicContact CZ-CD1 4.2Å; F322-E385 HydrophobicContact CE1-CB 3.83Å; F322-E385 HydrophobicContact CE1-CG 4.26Å; F322-E385 HydrophobicContact CZ-CB 4.03Å
323	R	87.4	Confident	87.3	Confident	146 Å²	146	71.4 Å²	71.4	55%	0.551	36%	0.356	S	S	*	.	H	α-helix	trans	-67.7	-47.6	174.5	-169.2	-172.3	-171.8	-178.9	0.9	110.9	Q319 E320 D321 Y325 R326 T327	Q319-R323 WeakPolarHBondContact O-CB 3.43Å; Q319-R323 PolarHBondContact O-N 2.63Å; E320-R323 WeakPolarHBondContact O-CA 3.41Å; E320-R323 WeakPolarHBondContact O-CB 3.37Å; E320-R323 PolarHBondContact O-N 2.88Å; E320-R323 VanDerWaalsContact O-N 3.09Å; E320-R323 IonicContact OE1-NH1 3.45Å; E320-R323 PolarHBondContact OE1-NH1 2.94Å; E320-R323 WeakPolarHBondContact OE2-CD 3.34Å; E320-R323 IonicContact OE2-CZ 3.5Å; E320-R323 IonicContact OE2-NH1 2.71Å; E320-R323 PolarHBondContact OE2-NH1 3.39Å; D321-R323 VanDerWaalsContact C-N 3.33Å; R323-Y325 VanDerWaalsContact C-N 3.33Å; R323-Y325 PolarHBondContact O-N 3.5Å; R323-R326 CarbonylContact O-C 3.5Å; R323-R326 PolarHBondContact O-N 2.87Å; R323-T327 HydrophobicContact CG-CG2 4.32Å; R323-T327 WeakPolarHBondContact O-CG2 3.38Å; R323-T327 PolarHBondContact O-N 3.09Å; R323-T327 PolarHBondContact O-OG1 2.9Å
324	D	90.1	Very high	87.6	Confident	74 Å²	74	66.9 Å²	66.9	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-42.1	175.3	-172.9	68.3	0	0	0	111.6	E320 R326 T327 V328 H329	E320-D324 PolarHBondContact O-N 2.98Å; D324-R326 VanDerWaalsContact C-N 3.33Å; D324-R326 PolarHBondContact O-N 3.16Å; D324-T327 PolarHBondContact O-N 2.62Å; D324-V328 WeakPolarHBondContact O-CB 3.39Å; D324-V328 PolarHBondContact O-N 2.84Å; D324-V328 WeakPolarHBondContact OD1-CG2 3.35Å; D324-H329 PolarHBondContact O-N 3.41Å; D324-H329 IonicContact OD2-CD2 2.64Å; D324-H329 IonicContact OD2-NE2 2.71Å; D324-H329 PolarHBondContact OD2-NE2 3.44Å
325	Y	92.4	Very high	87.8	Confident	12 Å²	12	70.1 Å²	70.1	5%	0.047	36%	0.355	C	S	.	.	I	π-helix	trans	-52.7	-47.9	168.5	166.8	-99.5	0	0	0	112.2	W295 T299 W302 L303 D321 F322 R323 H329 K330 E381	W295-Y325 HydrophobicContact CH2-CE2 4.14Å; W295-Y325 AromaticContact CZ2-CE2 3.8Å; W295-Y325 HydrophobicContact CZ2-CE2 3.8Å; T299-Y325 HydrophobicContact CG2-CE2 3.67Å; W302-Y325 HydrophobicContact CH2-CD2 4.49Å; W302-Y325 HydrophobicContact CH2-CG 4.03Å; W302-Y325 HydrophobicContact CZ3-CD1 4.11Å; W302-Y325 AromaticContact CZ3-CD2 3.9Å; W302-Y325 HydrophobicContact CZ3-CD2 3.9Å; W302-Y325 HydrophobicContact CZ3-CE2 4.45Å; W302-Y325 AromaticContact CZ3-CG 3.72Å; W302-Y325 HydrophobicContact CZ3-CG 3.72Å; L303-Y325 HydrophobicContact CD2-CE1 4.48Å; D321-Y325 WeakPolarHBondContact O-CB 3.21Å; D321-Y325 PolarHBondContact O-N 3.45Å; F322-Y325 HydrophobicContact CD2-CD1 4.04Å; F322-Y325 HydrophobicContact CE2-CD1 4.08Å; F322-Y325 HydrophobicContact CE2-CE1 4.36Å; F322-Y325 WeakPolarHBondContact O-CB 3.45Å; R323-Y325 VanDerWaalsContact C-N 3.33Å; R323-Y325 PolarHBondContact O-N 3.5Å; Y325-H329 HydrophobicContact CD2-CB 4.38Å; Y325-H329 PolarHBondContact O-N 2.98Å; Y325-K330 HydrophobicContact CE1-CB 4.39Å; Y325-K330 HydrophobicContact CE1-CD 4.36Å; Y325-K330 WeakPolarHBondContact O-CB 3.32Å; Y325-K330 PolarHBondContact O-N 3.34Å; Y325-E381 HydrophobicContact CE1-CG 4.13Å; Y325-E381 WeakPolarHBondContact CE1-OE1 2.8Å; Y325-E381 PolarHBondContact OH-OE1 2.89Å
326	R	89.4	Confident	87.9	Confident	108 Å²	108	72.4 Å²	72.4	41%	0.408	37%	0.366	S	S	.	.	I	π-helix	trans	-74.8	-29	-178.7	-73	-177	74.5	170.4	12.3	114.8	F322 R323 D324 P331 E385	F322-R326 HydrophobicContact CE1-CG 4.45Å; F322-R326 HydrophobicContact CE2-CG 4.46Å; F322-R326 HydrophobicContact CZ-CG 4.31Å; F322-R326 WeakPolarHBondContact O-CG 3.48Å; F322-R326 PolarHBondContact O-N 3.4Å; R323-R326 CarbonylContact O-C 3.5Å; R323-R326 PolarHBondContact O-N 2.87Å; D324-R326 VanDerWaalsContact C-N 3.33Å; D324-R326 PolarHBondContact O-N 3.16Å; R326-P331 WeakPolarHBondContact O-CD 3.35Å; R326-P331 WeakPolarHBondContact O-CG 3.44Å; R326-E385 IonicContact CZ-OE1 3.69Å; R326-E385 IonicContact CZ-OE2 3.63Å; R326-E385 IonicContact NH1-OE1 2.69Å; R326-E385 PolarHBondContact NH1-OE1 2.99Å; R326-E385 IonicContact NH1-OE2 3.61Å; R326-E385 PolarHBondContact NH1-OE2 3.19Å; R326-E385 IonicContact NH2-OE2 2.64Å
327	T	83.6	Confident	88.1	Confident	88 Å²	88	69.2 Å²	69.2	54%	0.54	35%	0.35	S	S	.	.	I	π-helix	trans	-96.4	-28.7	-174.9	55.8	0	0	0	0	113.7	R323 D324	R323-T327 HydrophobicContact CG-CG2 4.32Å; R323-T327 WeakPolarHBondContact O-CG2 3.38Å; R323-T327 PolarHBondContact O-N 3.09Å; R323-T327 PolarHBondContact O-OG1 2.9Å; D324-T327 PolarHBondContact O-N 2.62Å
328	V	86.6	Confident	88.1	Confident	80 Å²	80	69.5 Å²	69.5	49%	0.485	35%	0.349	S	S	.	.	I	π-helix	trans	-114	-51.1	-175.4	-176.6	0	0	0	0	111.5	D324 P332	D324-V328 WeakPolarHBondContact O-CB 3.39Å; D324-V328 PolarHBondContact O-N 2.84Å; D324-V328 WeakPolarHBondContact OD1-CG2 3.35Å; V328-P332 VanDerWaalsContact O-CD 3.28Å; V328-P332 WeakPolarHBondContact O-CD 3.27Å
329	H	87	Confident	88	Confident	104 Å²	104	72.3 Å²	72.3	48%	0.481	36%	0.362	S	S	.	.	I	π-helix	trans	-86.5	-38.5	-168.7	-67.5	-58.2	0	0	0	114.8	D324 Y325 P332	D324-H329 PolarHBondContact O-N 3.41Å; D324-H329 IonicContact OD2-CD2 2.64Å; D324-H329 IonicContact OD2-NE2 2.71Å; D324-H329 PolarHBondContact OD2-NE2 3.44Å; Y325-H329 HydrophobicContact CD2-CB 4.38Å; Y325-H329 PolarHBondContact O-N 2.98Å; H329-P332 WeakPolarHBondContact O-CG 3.41Å
330	K	89	Confident	88	Confident	29 Å²	29	68.8 Å²	68.8	13%	0.126	35%	0.346	C	S	.	.	H	α-helix	trans	-72.9	-44	179.6	-171.6	-177.3	-175.9	175.5	0	114.2	Y325 K333 V334 E381	Y325-K330 HydrophobicContact CE1-CB 4.39Å; Y325-K330 HydrophobicContact CE1-CD 4.36Å; Y325-K330 WeakPolarHBondContact O-CB 3.32Å; Y325-K330 PolarHBondContact O-N 3.34Å; K330-K333 WeakPolarHBondContact O-CA 3.4Å; K330-K333 WeakPolarHBondContact O-CB 3.49Å; K330-K333 PolarHBondContact O-N 2.98Å; K330-V334 HydrophobicContact CG-CG2 4.09Å; K330-V334 PolarHBondContact O-N 2.83Å; K330-E381 VanDerWaalsContact CD-OE1 3.25Å; K330-E381 WeakPolarHBondContact CD-OE1 3.37Å; K330-E381 WeakPolarHBondContact CE-OE1 3.49Å; K330-E381 IonicContact NZ-OE1 3.96Å; K330-E381 PolarHBondContact NZ-OE1 3.02Å; K330-E381 IonicContact NZ-OE2 3.31Å; K330-E381 PolarHBondContact NZ-OE2 3.09Å
331	P	89.3	Confident	87.9	Confident	57 Å²	57	66.4 Å²	66.4	37%	0.37	34%	0.335	S	S	.	.	H	α-helix	trans	-53.6	-44.4	-174.5	-28.9	38.2	0	0	0	116.1	R326 K333 V334 Q335	R326-P331 WeakPolarHBondContact O-CD 3.35Å; R326-P331 WeakPolarHBondContact O-CG 3.44Å; P331-K333 VanDerWaalsContact C-N 3.26Å; P331-K333 PolarHBondContact O-N 3.25Å; P331-V334 WeakPolarHBondContact O-CB 3.15Å; P331-V334 PolarHBondContact O-N 3.44Å; P331-Q335 PolarHBondContact O-N 2.89Å; P331-Q335 VanDerWaalsContact O-N 3.13Å
332	P	88.8	Confident	87.7	Confident	59 Å²	59	65.7 Å²	65.7	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-63.9	-30.7	175.2	24.8	-33.9	0	0	0	112.5	V328 H329 Q335 E336	V328-P332 VanDerWaalsContact O-CD 3.28Å; V328-P332 WeakPolarHBondContact O-CD 3.27Å; H329-P332 WeakPolarHBondContact O-CG 3.41Å; P332-Q335 WeakPolarHBondContact O-CB 3.49Å; P332-Q335 PolarHBondContact O-N 3.02Å; P332-E336 WeakPolarHBondContact O-CG 3.35Å; P332-E336 PolarHBondContact O-N 3.35Å
333	K	89.8	Confident	87.2	Confident	41 Å²	41	66.7 Å²	66.7	18%	0.178	34%	0.338	C	S	.	.	H	α-helix	trans	-73.8	-30.1	176.6	-60.3	-49.4	-169.3	-173.8	0	113.5	L292 W295 K330 P331 Q335 E336 K337 W374	L292-K333 HydrophobicContact CD1-CB 4.32Å; L292-K333 HydrophobicContact CD1-CD 4.48Å; W295-K333 HydrophobicContact CD2-CD 4.45Å; W295-K333 HydrophobicContact CD2-CG 3.86Å; W295-K333 HydrophobicContact CE3-CB 4.19Å; W295-K333 HydrophobicContact CE3-CG 4.01Å; W295-K333 HydrophobicContact CG-CG 4.46Å; W295-K333 HydrophobicContact CH2-CB 4.03Å; W295-K333 HydrophobicContact CH2-CG 4.1Å; W295-K333 HydrophobicContact CZ2-CB 4.35Å; W295-K333 HydrophobicContact CZ2-CG 3.91Å; W295-K333 HydrophobicContact CZ3-CB 3.93Å; W295-K333 HydrophobicContact CZ3-CG 4.13Å; K330-K333 WeakPolarHBondContact O-CA 3.4Å; K330-K333 WeakPolarHBondContact O-CB 3.49Å; K330-K333 PolarHBondContact O-N 2.98Å; P331-K333 VanDerWaalsContact C-N 3.26Å; P331-K333 PolarHBondContact O-N 3.25Å; K333-Q335 VanDerWaalsContact C-N 3.33Å; K333-E336 VanDerWaalsContact CD-CD 3.46Å; K333-E336 WeakPolarHBondContact CD-OE1 3.39Å; K333-E336 WeakPolarHBondContact CD-OE2 3.35Å; K333-E336 WeakPolarHBondContact CE-OE2 3.32Å; K333-E336 IonicContact NZ-OE1 3.13Å; K333-E336 PolarHBondContact NZ-OE1 2.85Å; K333-E336 IonicContact NZ-OE2 2.85Å; K333-E336 PolarHBondContact NZ-OE2 3.42Å; K333-E336 PolarHBondContact O-N 3.27Å; K333-K337 PolarHBondContact O-N 2.75Å; K333-W374 HydrophobicContact CB-CH2 4.42Å; K333-W374 HydrophobicContact CB-CZ3 4.43Å
334	V	89.6	Confident	87	Confident	68 Å²	68	61.6 Å²	61.6	41%	0.412	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-42.6	167	-179.1	0	0	0	0	110.2	K330 P331 K337 C338 W374	K330-V334 HydrophobicContact CG-CG2 4.09Å; K330-V334 PolarHBondContact O-N 2.83Å; P331-V334 WeakPolarHBondContact O-CB 3.15Å; P331-V334 PolarHBondContact O-N 3.44Å; V334-K337 PolarHBondContact O-N 3.19Å; V334-C338 WeakPolarHBondContact O-CB 3.18Å; V334-C338 PolarHBondContact O-N 3.26Å; V334-W374 HydrophobicContact CG2-CH2 3.98Å; V334-W374 HydrophobicContact CG2-CZ2 3.87Å
335	Q	85.9	Confident	86.6	Confident	140 Å²	140	62.6 Å²	62.6	65%	0.654	33%	0.325	S	S	*	.	H	α-helix	trans	-66.6	-41	177.1	-171.8	175.8	-1.6	0	0	112.1	P331 P332 K333 C338 Q339	P331-Q335 PolarHBondContact O-N 2.89Å; P331-Q335 VanDerWaalsContact O-N 3.13Å; P332-Q335 WeakPolarHBondContact O-CB 3.49Å; P332-Q335 PolarHBondContact O-N 3.02Å; K333-Q335 VanDerWaalsContact C-N 3.33Å; Q335-C338 PolarHBondContact O-N 3.25Å; Q335-Q339 VanDerWaalsContact O-CB 3.28Å; Q335-Q339 WeakPolarHBondContact O-CB 3.24Å; Q335-Q339 PolarHBondContact O-N 3.49Å
336	E	87.6	Confident	86.1	Confident	48 Å²	48	65.5 Å²	65.5	22%	0.224	34%	0.344	C	S	.	.	H	α-helix	trans	-61.6	-43.6	173.6	-73.4	171.2	-150	0	0	112.1	L288 P332 K333 Q339 L340	L288-E336 HydrophobicContact CD1-CB 4.19Å; L288-E336 HydrophobicContact CD1-CG 4.15Å; P332-E336 WeakPolarHBondContact O-CG 3.35Å; P332-E336 PolarHBondContact O-N 3.35Å; K333-E336 VanDerWaalsContact CD-CD 3.46Å; K333-E336 WeakPolarHBondContact CD-OE1 3.39Å; K333-E336 WeakPolarHBondContact CD-OE2 3.35Å; K333-E336 WeakPolarHBondContact CE-OE2 3.32Å; K333-E336 IonicContact NZ-OE1 3.13Å; K333-E336 PolarHBondContact NZ-OE1 2.85Å; K333-E336 IonicContact NZ-OE2 2.85Å; K333-E336 PolarHBondContact NZ-OE2 3.42Å; K333-E336 PolarHBondContact O-N 3.27Å; E336-Q339 PolarHBondContact O-N 3.29Å; E336-L340 WeakPolarHBondContact O-CB 3.41Å; E336-L340 PolarHBondContact O-N 3.04Å
337	K	87.9	Confident	85.6	Confident	26 Å²	26	60.4 Å²	60.4	11%	0.113	33%	0.325	C	S	.	.	H	α-helix	trans	-58.6	-49	173.1	-174.7	-160.7	174.6	-177.2	0	111.5	L292 K333 V334 Q339 L340 E341 N371 W374	L292-K337 HydrophobicContact CD2-CB 4.04Å; L292-K337 HydrophobicContact CD2-CG 4.43Å; K333-K337 PolarHBondContact O-N 2.75Å; V334-K337 PolarHBondContact O-N 3.19Å; K337-Q339 PolarHBondContact O-N 3Å; K337-L340 WeakPolarHBondContact O-CB 3.42Å; K337-L340 PolarHBondContact O-N 3.1Å; K337-E341 WeakPolarHBondContact CE-OE1 3.46Å; K337-E341 IonicContact NZ-OE1 3.79Å; K337-E341 PolarHBondContact O-N 3.19Å; K337-N371 WeakPolarHBondContact CE-OD1 3.33Å; K337-N371 PolarHBondContact NZ-OD1 3.25Å; K337-W374 HydrophobicContact CB-CZ3 4.49Å; K337-W374 HydrophobicContact CD-CD2 3.73Å; K337-W374 HydrophobicContact CD-CE3 4.14Å; K337-W374 HydrophobicContact CD-CG 3.89Å
338	C	85.6	Confident	85.4	Confident	61 Å²	61	58.6 Å²	58.6	41%	0.412	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-44.3	178.9	-174.8	0	0	0	0	111.3	V334 Q335 L340 E341 I342	V334-C338 WeakPolarHBondContact O-CB 3.18Å; V334-C338 PolarHBondContact O-N 3.26Å; Q335-C338 PolarHBondContact O-N 3.25Å; C338-L340 VanDerWaalsContact C-N 3.3Å; C338-L340 PolarHBondContact O-N 2.64Å; C338-E341 PolarHBondContact O-N 2.71Å; C338-I342 WeakPolarHBondContact O-CB 3.38Å; C338-I342 VanDerWaalsContact O-CG1 3.24Å; C338-I342 WeakPolarHBondContact O-CG1 3.41Å; C338-I342 PolarHBondContact O-N 3.44Å
339	Q	84.6	Confident	84.8	Confident	94 Å²	94	57.3 Å²	57.3	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-61.8	-37.4	175.8	-175.8	59.5	46	0	0	111.9	L288 Q335 E336 K337 S343	L288-Q339 HydrophobicContact CD2-CG 4.42Å; Q335-Q339 VanDerWaalsContact O-CB 3.28Å; Q335-Q339 WeakPolarHBondContact O-CB 3.24Å; Q335-Q339 PolarHBondContact O-N 3.49Å; E336-Q339 PolarHBondContact O-N 3.29Å; K337-Q339 PolarHBondContact O-N 3Å; Q339-S343 PolarHBondContact NE2-OG 3.38Å; Q339-S343 VanDerWaalsContact NE2-OG 3.14Å; Q339-S343 VanDerWaalsContact O-CB 3.27Å; Q339-S343 WeakPolarHBondContact O-CB 3.42Å; Q339-S343 PolarHBondContact O-N 3.23Å; Q339-S343 PolarHBondContact O-OG 3.1Å
340	L	87.9	Confident	84.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.4	-47.2	176	-176.5	148.7	0	0	0	111.7	Y285 L288 A289 L292 E336 K337 C338 S343 F344 V367 I370	Y285-L340 HydrophobicContact CD2-CD2 4.24Å; Y285-L340 HydrophobicContact CD2-CG 3.93Å; Y285-L340 HydrophobicContact CE2-CD1 4.33Å; Y285-L340 HydrophobicContact CE2-CD2 3.43Å; Y285-L340 VanDerWaalsContact CE2-CD2 3.43Å; Y285-L340 HydrophobicContact CE2-CG 3.6Å; L288-L340 HydrophobicContact CB-CD1 4.43Å; L288-L340 HydrophobicContact CD2-CB 3.74Å; L288-L340 HydrophobicContact CD2-CD1 4.4Å; L288-L340 HydrophobicContact CD2-CG 4.43Å; L288-L340 HydrophobicContact CG-CB 4.38Å; L288-L340 HydrophobicContact CG-CD1 4.24Å; A289-L340 VanDerWaalsContact CA-CD1 3.49Å; A289-L340 HydrophobicContact CB-CD1 3.81Å; L292-L340 HydrophobicContact CD2-CD1 4.49Å; E336-L340 WeakPolarHBondContact O-CB 3.41Å; E336-L340 PolarHBondContact O-N 3.04Å; K337-L340 WeakPolarHBondContact O-CB 3.42Å; K337-L340 PolarHBondContact O-N 3.1Å; C338-L340 VanDerWaalsContact C-N 3.3Å; C338-L340 PolarHBondContact O-N 2.64Å; L340-S343 PolarHBondContact O-N 3.43Å; L340-F344 WeakPolarHBondContact O-CB 3.27Å; L340-F344 PolarHBondContact O-N 3Å; L340-V367 HydrophobicContact CD2-CG2 4.21Å; L340-I370 HydrophobicContact CD1-CD1 3.78Å; L340-I370 HydrophobicContact CD2-CD1 3.64Å; L340-I370 HydrophobicContact CG-CD1 4.38Å
341	E	85.2	Confident	83.3	Confident	52 Å²	52	53.5 Å²	53.5	24%	0.243	29%	0.286	C	S	.	.	H	α-helix	trans	-65.1	-40.9	176.5	-70.7	178.1	171.3	0	0	112.1	K337 C338 N345 V367 N371	K337-E341 WeakPolarHBondContact CE-OE1 3.46Å; K337-E341 IonicContact NZ-OE1 3.79Å; K337-E341 PolarHBondContact O-N 3.19Å; C338-E341 PolarHBondContact O-N 2.71Å; E341-N345 WeakPolarHBondContact O-CB 3.37Å; E341-N345 VanDerWaalsContact O-CG 3.29Å; E341-N345 PolarHBondContact O-N 2.94Å; E341-N345 PolarHBondContact O-ND2 3.05Å; E341-V367 HydrophobicContact CG-CG1 3.94Å; E341-N371 PolarHBondContact OE1-ND2 2.75Å; E341-N371 PolarHBondContact OE1-OD1 3.12Å
342	I	82.8	Confident	82.4	Confident	83 Å²	83	57.7 Å²	57.7	43%	0.426	29%	0.294	S	S	.	.	H	α-helix	trans	-60.7	-49.7	172.8	-70.6	165.7	0	0	0	109.9	C338 F344 N345 T346	C338-I342 WeakPolarHBondContact O-CB 3.38Å; C338-I342 VanDerWaalsContact O-CG1 3.24Å; C338-I342 WeakPolarHBondContact O-CG1 3.41Å; C338-I342 PolarHBondContact O-N 3.44Å; I342-F344 VanDerWaalsContact C-N 3.34Å; I342-F344 PolarHBondContact O-N 3.14Å; I342-N345 PolarHBondContact O-N 3.1Å; I342-T346 VanDerWaalsContact O-CB 3.29Å; I342-T346 WeakPolarHBondContact O-CB 3.42Å; I342-T346 PolarHBondContact O-N 3.35Å; I342-T346 PolarHBondContact O-OG1 2.85Å
343	S	80.6	Confident	81.4	Confident	31 Å²	31	61.3 Å²	61.3	22%	0.217	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-41.6	-177.5	-54.2	0	0	0	0	111.4	Q339 L340 L347	Q339-S343 PolarHBondContact NE2-OG 3.38Å; Q339-S343 VanDerWaalsContact NE2-OG 3.14Å; Q339-S343 VanDerWaalsContact O-CB 3.27Å; Q339-S343 WeakPolarHBondContact O-CB 3.42Å; Q339-S343 PolarHBondContact O-N 3.23Å; Q339-S343 PolarHBondContact O-OG 3.1Å; L340-S343 PolarHBondContact O-N 3.43Å; S343-L347 WeakPolarHBondContact O-CB 3.46Å; S343-L347 PolarHBondContact O-N 3.11Å
344	F	84.4	Confident	80.1	Confident	38 Å²	38	60.6 Å²	60.6	17%	0.167	31%	0.309	C	S	.	.	H	α-helix	trans	-62.5	-49.5	173.7	-175.7	-98.5	0	0	0	112.3	Y285 L340 I342 T346 L347 Q348 F359 P361 V367	Y285-F344 HydrophobicContact CD2-CB 4.01Å; Y285-F344 HydrophobicContact CD2-CD2 4.36Å; Y285-F344 HydrophobicContact CE2-CB 3.76Å; Y285-F344 AromaticContact CE2-CD2 3.91Å; Y285-F344 HydrophobicContact CE2-CD2 3.91Å; Y285-F344 HydrophobicContact CE2-CG 4.19Å; L340-F344 WeakPolarHBondContact O-CB 3.27Å; L340-F344 PolarHBondContact O-N 3Å; I342-F344 VanDerWaalsContact C-N 3.34Å; I342-F344 PolarHBondContact O-N 3.14Å; F344-T346 PolarHBondContact O-N 3.47Å; F344-L347 PolarHBondContact O-N 2.75Å; F344-Q348 WeakPolarHBondContact O-CB 3.42Å; F344-Q348 PolarHBondContact O-N 2.77Å; F344-F359 HydrophobicContact CD2-CD1 4.06Å; F344-F359 HydrophobicContact CD2-CE1 4.46Å; F344-F359 HydrophobicContact CE2-CD1 4.01Å; F344-P361 HydrophobicContact CE2-CG 4.22Å; F344-V367 HydrophobicContact CB-CG2 3.98Å; F344-V367 HydrophobicContact CD1-CG2 3.74Å; F344-V367 HydrophobicContact CD2-CG2 4.03Å; F344-V367 HydrophobicContact CE1-CG2 4.22Å; F344-V367 HydrophobicContact CE2-CG2 4.49Å; F344-V367 HydrophobicContact CG-CG2 3.63Å
345	N	81.4	Confident	78.8	Confident	95 Å²	95	60.1 Å²	60.1	51%	0.508	31%	0.305	S	S	.	.	H	α-helix	trans	-65.9	-37.1	-179.6	-75.1	-40.1	0	0	0	112.8	E341 I342 T349	E341-N345 WeakPolarHBondContact O-CB 3.37Å; E341-N345 VanDerWaalsContact O-CG 3.29Å; E341-N345 PolarHBondContact O-N 2.94Å; E341-N345 PolarHBondContact O-ND2 3.05Å; I342-N345 PolarHBondContact O-N 3.1Å; N345-T349 WeakPolarHBondContact O-CB 3.37Å; N345-T349 PolarHBondContact O-N 2.93Å; N345-T349 PolarHBondContact O-OG1 2.85Å
346	T	80.2	Confident	77.8	Confident	73 Å²	73	54.4 Å²	54.4	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-50.3	173.4	-65.3	0	0	0	0	110.5	I342 F344 T349 K350	I342-T346 VanDerWaalsContact O-CB 3.29Å; I342-T346 WeakPolarHBondContact O-CB 3.42Å; I342-T346 PolarHBondContact O-N 3.35Å; I342-T346 PolarHBondContact O-OG1 2.85Å; F344-T346 PolarHBondContact O-N 3.47Å; T346-T349 PolarHBondContact O-N 3.17Å; T346-K350 VanDerWaalsContact O-CB 3.24Å; T346-K350 WeakPolarHBondContact O-CB 3.47Å; T346-K350 PolarHBondContact O-N 2.94Å
347	L	80.8	Confident	76.9	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-49.3	177.3	176.8	62.7	0	0	0	111.5	N278 M281 M282 S343 F344 T349 K350 L351 F359	N278-L347 HydrophobicContact CB-CD1 3.99Å; M281-L347 HydrophobicContact CB-CD1 4.22Å; M281-L347 HydrophobicContact CE-CD1 4.43Å; M282-L347 HydrophobicContact CG-CD1 4.46Å; M282-L347 HydrophobicContact CG-CD2 3.52Å; S343-L347 WeakPolarHBondContact O-CB 3.46Å; S343-L347 PolarHBondContact O-N 3.11Å; F344-L347 PolarHBondContact O-N 2.75Å; L347-T349 VanDerWaalsContact C-N 3.31Å; L347-T349 PolarHBondContact O-N 2.64Å; L347-K350 PolarHBondContact O-N 2.96Å; L347-K350 VanDerWaalsContact O-N 3.14Å; L347-L351 HydrophobicContact CD1-CD1 3.95Å; L347-L351 HydrophobicContact CD1-CG 4.13Å; L347-L351 HydrophobicContact CG-CD1 3.9Å; L347-L351 HydrophobicContact CG-CG 4.48Å; L347-L351 WeakPolarHBondContact O-CB 3.28Å; L347-L351 VanDerWaalsContact O-CG 3.28Å; L347-L351 WeakPolarHBondContact O-CG 3.39Å; L347-L351 PolarHBondContact O-N 3.09Å; L347-F359 HydrophobicContact CD2-CB 4.01Å; L347-F359 HydrophobicContact CD2-CD1 3.47Å; L347-F359 VanDerWaalsContact CD2-CD1 3.47Å; L347-F359 HydrophobicContact CD2-CE1 4.06Å; L347-F359 HydrophobicContact CD2-CG 3.84Å; L347-F359 HydrophobicContact CG-CB 4.44Å
348	Q	78.8	Confident	76.2	Confident	51 Å²	51	57.1 Å²	57.1	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-38.5	179.1	-170.1	67.9	-1.1	0	0	112.2	F344 R352 A358	F344-Q348 WeakPolarHBondContact O-CB 3.42Å; F344-Q348 PolarHBondContact O-N 2.77Å; Q348-R352 VanDerWaalsContact O-CB 3.32Å; Q348-R352 WeakPolarHBondContact O-CB 3.47Å; Q348-R352 PolarHBondContact O-N 3.03Å; Q348-A358 VanDerWaalsContact NE2-CB 3.28Å
349	T	74.1	Confident	75.8	Confident	52 Å²	52	55.3 Å²	55.3	32%	0.319	29%	0.292	S	S	.	.	H	α-helix	trans	-70.9	-39.5	174.5	-64.3	0	0	0	0	111.8	N345 T346 L347 R352 L353	N345-T349 WeakPolarHBondContact O-CB 3.37Å; N345-T349 PolarHBondContact O-N 2.93Å; N345-T349 PolarHBondContact O-OG1 2.85Å; T346-T349 PolarHBondContact O-N 3.17Å; L347-T349 VanDerWaalsContact C-N 3.31Å; L347-T349 PolarHBondContact O-N 2.64Å; T349-R352 PolarHBondContact O-N 3.49Å; T349-R352 PolarHBondContact OG1-NH2 2.98Å; T349-L353 HydrophobicContact CG2-CD1 3.78Å; T349-L353 HydrophobicContact CG2-CG 4.19Å; T349-L353 WeakPolarHBondContact O-CB 3.13Å; T349-L353 VanDerWaalsContact O-CG 3.28Å; T349-L353 WeakPolarHBondContact O-CG 3.43Å; T349-L353 PolarHBondContact O-N 3.33Å
350	K	72.9	Confident	75.4	Confident	42 Å²	42	58.2 Å²	58.2	18%	0.183	31%	0.307	C	S	.	.	H	α-helix	trans	-68.1	-36.9	178.3	-169.2	178.1	177.6	-156.4	0	112.2	E277 N278 M281 T346 L347 S354	E277-K350 IonicContact OE1-NZ 2.94Å; E277-K350 PolarHBondContact OE1-NZ 3.4Å; E277-K350 IonicContact OE2-NZ 2.88Å; E277-K350 PolarHBondContact OE2-NZ 3.41Å; N278-K350 WeakPolarHBondContact OD1-CD 3.42Å; N278-K350 WeakPolarHBondContact OD1-CE 3.36Å; N278-K350 PolarHBondContact OD1-NZ 2.76Å; M281-K350 HydrophobicContact CE-CD 3.8Å; T346-K350 VanDerWaalsContact O-CB 3.24Å; T346-K350 WeakPolarHBondContact O-CB 3.47Å; T346-K350 PolarHBondContact O-N 2.94Å; L347-K350 PolarHBondContact O-N 2.96Å; L347-K350 VanDerWaalsContact O-N 3.14Å; K350-S354 VanDerWaalsContact O-CB 3.25Å; K350-S354 WeakPolarHBondContact O-CB 3.45Å; K350-S354 PolarHBondContact O-N 2.97Å; K350-S354 PolarHBondContact O-OG 2.87Å
351	L	71.9	Confident	75	Confident	11 Å²	11	59 Å²	59	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-64.5	-52.7	170.3	-68.8	167.8	0	0	0	110.2	N278 L347 L353 S354 N355 R356 F359	N278-L351 HydrophobicContact CB-CD2 4.45Å; L347-L351 HydrophobicContact CD1-CD1 3.95Å; L347-L351 HydrophobicContact CD1-CG 4.13Å; L347-L351 HydrophobicContact CG-CD1 3.9Å; L347-L351 HydrophobicContact CG-CG 4.48Å; L347-L351 WeakPolarHBondContact O-CB 3.28Å; L347-L351 VanDerWaalsContact O-CG 3.28Å; L347-L351 WeakPolarHBondContact O-CG 3.39Å; L347-L351 PolarHBondContact O-N 3.09Å; L351-L353 PolarHBondContact O-N 3.29Å; L351-S354 CarbonylContact O-C 3.49Å; L351-S354 VanDerWaalsContact O-C 3.29Å; L351-S354 WeakPolarHBondContact O-CA 3.25Å; L351-S354 PolarHBondContact O-N 2.84Å; L351-N355 PolarHBondContact O-N 3.34Å; L351-R356 HydrophobicContact CB-CB 4.19Å; L351-R356 HydrophobicContact CD2-CB 3.7Å; L351-R356 HydrophobicContact CD2-CG 4.18Å; L351-R356 PolarHBondContact O-N 3.44Å; L351-F359 HydrophobicContact CD1-CB 3.76Å
352	R	70.4	Confident	74.7	Confident	146 Å²	146	59.3 Å²	59.3	55%	0.551	32%	0.32	S	S	*	.	H	α-helix	trans	-57.2	-47.7	177.9	-175.8	178.7	66	-114.7	-5.6	113.5	Q348 T349 S354 N355	Q348-R352 VanDerWaalsContact O-CB 3.32Å; Q348-R352 WeakPolarHBondContact O-CB 3.47Å; Q348-R352 PolarHBondContact O-N 3.03Å; T349-R352 PolarHBondContact O-N 3.49Å; T349-R352 PolarHBondContact OG1-NH2 2.98Å; R352-S354 PolarHBondContact O-N 3.06Å; R352-N355 WeakPolarHBondContact O-CA 3.46Å; R352-N355 PolarHBondContact O-N 2.88Å; R352-N355 PolarHBondContact O-OD1 3.4Å
353	L	66.5	Low	74	Confident	135 Å²	135	64.9 Å²	64.9	71%	0.707	35%	0.345	S	S	*	.	H	α-helix	trans	-65.7	-22.7	177.6	-72	173.2	0	0	0	113	T349 L351 N355	T349-L353 HydrophobicContact CG2-CD1 3.78Å; T349-L353 HydrophobicContact CG2-CG 4.19Å; T349-L353 WeakPolarHBondContact O-CB 3.13Å; T349-L353 VanDerWaalsContact O-CG 3.28Å; T349-L353 WeakPolarHBondContact O-CG 3.43Å; T349-L353 PolarHBondContact O-N 3.33Å; L351-L353 PolarHBondContact O-N 3.29Å; L353-N355 VanDerWaalsContact C-N 3.34Å
354	S	62.5	Low	73.7	Confident	25 Å²	25	65.3 Å²	65.3	18%	0.175	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	10.7	173.2	-54.2	0	0	0	0	112.2	K350 L351 R352 R356 Y893	K350-S354 VanDerWaalsContact O-CB 3.25Å; K350-S354 WeakPolarHBondContact O-CB 3.45Å; K350-S354 PolarHBondContact O-N 2.97Å; K350-S354 PolarHBondContact O-OG 2.87Å; L351-S354 CarbonylContact O-C 3.49Å; L351-S354 VanDerWaalsContact O-C 3.29Å; L351-S354 WeakPolarHBondContact O-CA 3.25Å; L351-S354 PolarHBondContact O-N 2.84Å; R352-S354 PolarHBondContact O-N 3.06Å; S354-R356 WeakPolarHBondContact O-CG 3.33Å; S354-R356 PolarHBondContact O-N 2.83Å; S354-Y893 WeakPolarHBondContact O-CE1 3.46Å
355	N	62	Low	73.6	Confident	58 Å²	58	67.2 Å²	67.2	31%	0.31	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	26	-175.6	-66.8	-39.8	0	0	0	115.1	L351 R352 L353 A832 Y893	L351-N355 PolarHBondContact O-N 3.34Å; R352-N355 WeakPolarHBondContact O-CA 3.46Å; R352-N355 PolarHBondContact O-N 2.88Å; R352-N355 PolarHBondContact O-OD1 3.4Å; L353-N355 VanDerWaalsContact C-N 3.34Å; N355-A832 HydrophobicContact CB-CB 4.4Å; N355-Y893 HydrophobicContact CB-CD1 3.54Å; N355-Y893 HydrophobicContact CB-CE1 3.91Å; N355-Y893 CarbonylContact O-C 3.59Å; N355-Y893 WeakPolarHBondContact O-CA 3.31Å
356	R	66.8	Low	73.6	Confident	20 Å²	20	66.4 Å²	66.4	8%	0.075	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-86.6	158.7	-177.9	-44.5	-141.2	172.6	159.1	2.3	112	V271 N275 L351 S354 L892	V271-R356 PolarHBondContact O-NH2 3.12Å; V271-R356 VanDerWaalsContact O-NH2 3.08Å; N275-R356 PolarHBondContact OD1-NH1 3.29Å; L351-R356 HydrophobicContact CB-CB 4.19Å; L351-R356 HydrophobicContact CD2-CB 3.7Å; L351-R356 HydrophobicContact CD2-CG 4.18Å; L351-R356 PolarHBondContact O-N 3.44Å; S354-R356 WeakPolarHBondContact O-CG 3.33Å; S354-R356 PolarHBondContact O-N 2.83Å; R356-L892 WeakPolarHBondContact CA-O 3.46Å; R356-L892 WeakPolarHBondContact CB-O 3.32Å; R356-L892 WeakPolarHBondContact CD-O 3.35Å; R356-L892 WeakPolarHBondContact CG-O 3.1Å; R356-L892 VanDerWaalsContact CZ-CD2 3.44Å; R356-L892 VanDerWaalsContact NH2-CD2 3.35Å
357	P	68.3	Low	73.9	Confident	70 Å²	70	64.3 Å²	64.3	46%	0.455	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-51.2	146.5	170	-27.6	35.8	0	0	0	113.3	A891	P357-A891 WeakPolarHBondContact CD-O 3.15Å
358	A	72	Confident	74.1	Confident	61 Å²	61	67.2 Å²	67.2	50%	0.504	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-62.1	141.7	174.1	0	0	0	0	0	111.7	Q348 M360	Q348-A358 VanDerWaalsContact NE2-CB 3.28Å; A358-M360 PolarHBondContact O-N 3.35Å
359	F	77.8	Confident	74.4	Confident	24 Å²	24	66.9 Å²	66.9	11%	0.105	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-77.1	123	171.1	172.4	-127.2	0	0	0	110	M282 Y285 E286 F344 L347 L351 P361	M282-F359 HydrophobicContact CB-CD2 4.33Å; M282-F359 HydrophobicContact CB-CE2 3.86Å; M282-F359 HydrophobicContact CB-CZ 4Å; M282-F359 HydrophobicContact CG-CD1 4.23Å; M282-F359 HydrophobicContact CG-CD2 3.53Å; M282-F359 HydrophobicContact CG-CE1 4.25Å; M282-F359 HydrophobicContact CG-CE2 3.57Å; M282-F359 HydrophobicContact CG-CG 3.86Å; M282-F359 HydrophobicContact CG-CZ 3.93Å; M282-F359 HydrophobicContact SD-CB 4.32Å; M282-F359 HydrophobicContact SD-CD2 3.29Å; M282-F359 WeakPolarHBondContact SD-CD2 3.49Å; M282-F359 HydrophobicContact SD-CE2 3.71Å; M282-F359 HydrophobicContact SD-CG 3.94Å; Y285-F359 AromaticContact CD1-CE1 3.67Å; Y285-F359 HydrophobicContact CD1-CE1 3.67Å; Y285-F359 HydrophobicContact CD1-CZ 4.06Å; Y285-F359 HydrophobicContact CE1-CE1 4.22Å; Y285-F359 AromaticContact CG-CE1 4Å; Y285-F359 HydrophobicContact CG-CE1 4Å; E286-F359 HydrophobicContact CG-CZ 4.44Å; F344-F359 HydrophobicContact CD2-CD1 4.06Å; F344-F359 HydrophobicContact CD2-CE1 4.46Å; F344-F359 HydrophobicContact CE2-CD1 4.01Å; L347-F359 HydrophobicContact CD2-CB 4.01Å; L347-F359 HydrophobicContact CD2-CD1 3.47Å; L347-F359 VanDerWaalsContact CD2-CD1 3.47Å; L347-F359 HydrophobicContact CD2-CE1 4.06Å; L347-F359 HydrophobicContact CD2-CG 3.84Å; L347-F359 HydrophobicContact CG-CB 4.44Å; L351-F359 HydrophobicContact CD1-CB 3.76Å; F359-P361 HydrophobicContact CD1-CG 4.28Å; F359-P361 HydrophobicContact CE1-CB 4.46Å; F359-P361 HydrophobicContact CE1-CG 3.77Å; F359-P361 HydrophobicContact CZ-CB 4.28Å; F359-P361 HydrophobicContact CZ-CG 4.05Å
360	M	76.8	Confident	75.1	Confident	154 Å²	154	64.4 Å²	64.4	76%	0.759	35%	0.346	S	S	*	.			trans	-113	112.5	170.7	-64.9	-168.7	73.4	0	0	108.9	A358	A358-M360 PolarHBondContact O-N 3.35Å
361	P	78.8	Confident	75.9	Confident	18 Å²	18	64.1 Å²	64.1	12%	0.117	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-62.3	162.4	175.4	-22.9	33.4	0	0	0	113.2	Y285 F344 F359 R365	Y285-P361 HydrophobicContact CD1-CB 4.44Å; Y285-P361 HydrophobicContact CD1-CG 4.2Å; Y285-P361 HydrophobicContact CE1-CB 3.72Å; Y285-P361 HydrophobicContact CE1-CG 3.43Å; Y285-P361 VanDerWaalsContact CE1-CG 3.43Å; F344-P361 HydrophobicContact CE2-CG 4.22Å; F359-P361 HydrophobicContact CD1-CG 4.28Å; F359-P361 HydrophobicContact CE1-CB 4.46Å; F359-P361 HydrophobicContact CE1-CG 3.77Å; F359-P361 HydrophobicContact CZ-CB 4.28Å; F359-P361 HydrophobicContact CZ-CG 4.05Å; P361-R365 HydrophobicContact CB-CB 4.18Å
362	S	78.3	Confident	76.7	Confident	57 Å²	57	67.8 Å²	67.8	40%	0.399	37%	0.37	S	S	.	.	S	Bend	trans	-53.4	151.2	171.5	-59.3	0	0	0	0	112.9	E286 G364 R365	E286-S362 WeakPolarHBondContact OE1-CB 3.24Å; E286-S362 PolarHBondContact OE1-N 3.07Å; E286-S362 PolarHBondContact OE1-OG 3.17Å; E286-S362 PolarHBondContact OE2-OG 3.36Å; S362-G364 PolarHBondContact O-N 3.44Å; S362-R365 WeakPolarHBondContact O-CB 3.47Å; S362-R365 PolarHBondContact O-N 3.35Å
363	E	69.7	Low	77.6	Confident	201 Å²	201	62 Å²	62	94%	0.939	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	128.5	-177.3	-168.3	178.9	-176.4	0	0	112.5	R365	E363-R365 VanDerWaalsContact C-N 3.33Å
364	G	73.2	Confident	78.8	Confident	40 Å²	40	55.8 Å²	55.8	41%	0.412	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	6.7	-176.9	0	0	0	0	0	115.6	S362 D369	S362-G364 PolarHBondContact O-N 3.44Å; G364-D369 VanDerWaalsContact C-OD2 3.25Å; G364-D369 VanDerWaalsContact CA-OD2 3.24Å; G364-D369 WeakPolarHBondContact CA-OD2 3.14Å
365	R	81.9	Confident	80.2	Confident	78 Å²	78	60.2 Å²	60.2	29%	0.294	34%	0.337	S	S	.	.			trans	-114.6	16.4	175.2	-54.8	-174.9	178.8	172.5	-9.9	113.4	Y285 E286 A289 S290 L293 P361 S362 E363	Y285-R365 PolarHBondContact OH-O 3.05Å; E286-R365 IonicContact OE1-NH1 3.14Å; E286-R365 IonicContact OE2-NH1 2.85Å; E286-R365 PolarHBondContact OE2-NH1 2.66Å; A289-R365 HydrophobicContact CB-CB 4.43Å; S290-R365 PolarHBondContact OG-NE 3.39Å; S290-R365 PolarHBondContact OG-NH2 3.15Å; S290-R365 VanDerWaalsContact OG-NH2 3.12Å; L293-R365 HydrophobicContact CD1-CG 4.46Å; P361-R365 HydrophobicContact CB-CB 4.18Å; S362-R365 WeakPolarHBondContact O-CB 3.47Å; S362-R365 PolarHBondContact O-N 3.35Å; E363-R365 VanDerWaalsContact C-N 3.33Å
366	M	83.2	Confident	81.6	Confident	77 Å²	77	60.9 Å²	60.9	38%	0.379	34%	0.344	S	S	.	.	S	Bend	trans	-70.3	153.5	176.3	-60.3	-175.4	-70.4	0	0	110.6	S368 D369 I370	M366-S368 WeakPolarHBondContact CB-OG 3.34Å; M366-S368 PolarHBondContact O-N 3.37Å; M366-S368 VanDerWaalsContact O-N 3.17Å; M366-D369 WeakPolarHBondContact CB-OD2 3.35Å; M366-D369 WeakPolarHBondContact CE-OD2 3.47Å; M366-D369 PolarHBondContact N-OD2 2.85Å; M366-D369 VanDerWaalsContact N-OD2 3.09Å; M366-D369 WeakPolarHBondContact O-CB 3.47Å; M366-D369 PolarHBondContact O-N 3.24Å; M366-I370 WeakPolarHBondContact O-CG1 3.33Å; M366-I370 PolarHBondContact O-N 3.24Å
367	V	85	Confident	82.8	Confident	29 Å²	29	59.9 Å²	59.9	18%	0.176	34%	0.34	C	S	.	.	H	α-helix	trans	-58.2	-29.1	176	178.1	0	0	0	0	111.8	Y285 L340 E341 F344 N371	Y285-V367 HydrophobicContact CE2-CG2 4.02Å; Y285-V367 WeakPolarHBondContact OH-CG2 3.47Å; Y285-V367 PolarHBondContact OH-N 2.8Å; L340-V367 HydrophobicContact CD2-CG2 4.21Å; E341-V367 HydrophobicContact CG-CG1 3.94Å; F344-V367 HydrophobicContact CB-CG2 3.98Å; F344-V367 HydrophobicContact CD1-CG2 3.74Å; F344-V367 HydrophobicContact CD2-CG2 4.03Å; F344-V367 HydrophobicContact CE1-CG2 4.22Å; F344-V367 HydrophobicContact CE2-CG2 4.49Å; F344-V367 HydrophobicContact CG-CG2 3.63Å; V367-N371 WeakPolarHBondContact O-CB 3.22Å; V367-N371 PolarHBondContact O-N 3.28Å; V367-N371 PolarHBondContact O-ND2 2.72Å
368	S	84.9	Confident	83.9	Confident	62 Å²	62	59.9 Å²	59.9	43%	0.434	33%	0.334	S	S	.	.	H	α-helix	trans	-63.4	-41.9	170.8	51.3	0	0	0	0	113.2	M366 N371 T372	M366-S368 WeakPolarHBondContact CB-OG 3.34Å; M366-S368 PolarHBondContact O-N 3.37Å; M366-S368 VanDerWaalsContact O-N 3.17Å; S368-N371 PolarHBondContact O-N 3.35Å; S368-T372 WeakPolarHBondContact O-CB 3.36Å; S368-T372 PolarHBondContact O-N 3.43Å; S368-T372 PolarHBondContact O-OG1 3.04Å
369	D	86.3	Confident	84.7	Confident	44 Å²	44	59.1 Å²	59.1	24%	0.235	33%	0.332	C	S	.	.	H	α-helix	trans	-73.7	-41	-175.8	-48.6	-24.4	0	0	0	109.4	G364 M366 T372 A373	G364-D369 VanDerWaalsContact C-OD2 3.25Å; G364-D369 VanDerWaalsContact CA-OD2 3.24Å; G364-D369 WeakPolarHBondContact CA-OD2 3.14Å; M366-D369 WeakPolarHBondContact CB-OD2 3.35Å; M366-D369 WeakPolarHBondContact CE-OD2 3.47Å; M366-D369 PolarHBondContact N-OD2 2.85Å; M366-D369 VanDerWaalsContact N-OD2 3.09Å; M366-D369 WeakPolarHBondContact O-CB 3.47Å; M366-D369 PolarHBondContact O-N 3.24Å; D369-T372 PolarHBondContact O-N 3.13Å; D369-A373 WeakPolarHBondContact O-CB 3.46Å; D369-A373 PolarHBondContact O-N 3.33Å
370	I	88.3	Confident	85.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-43.9	172.8	-62.9	165.7	0	0	0	110.3	A289 L292 L293 L340 M366 A373 W374	A289-I370 HydrophobicContact CB-CD1 3.9Å; L292-I370 HydrophobicContact CD2-CG2 3.93Å; L293-I370 HydrophobicContact CD1-CG1 4.1Å; L293-I370 HydrophobicContact CD2-CG1 4.07Å; L293-I370 HydrophobicContact CG-CG1 4.12Å; L340-I370 HydrophobicContact CD1-CD1 3.78Å; L340-I370 HydrophobicContact CD2-CD1 3.64Å; L340-I370 HydrophobicContact CG-CD1 4.38Å; M366-I370 WeakPolarHBondContact O-CG1 3.33Å; M366-I370 PolarHBondContact O-N 3.24Å; I370-A373 PolarHBondContact O-N 3.06Å; I370-W374 WeakPolarHBondContact O-CB 3.32Å; I370-W374 PolarHBondContact O-N 3.32Å
371	N	88.5	Confident	86	Confident	37 Å²	37	51.7 Å²	51.7	20%	0.198	30%	0.297	C	S	.	.	H	α-helix	trans	-66	-36.5	174.8	-89.1	-67.2	0	0	0	112.9	K337 E341 V367 S368 W374 H375	K337-N371 WeakPolarHBondContact CE-OD1 3.33Å; K337-N371 PolarHBondContact NZ-OD1 3.25Å; E341-N371 PolarHBondContact OE1-ND2 2.75Å; E341-N371 PolarHBondContact OE1-OD1 3.12Å; V367-N371 WeakPolarHBondContact O-CB 3.22Å; V367-N371 PolarHBondContact O-N 3.28Å; V367-N371 PolarHBondContact O-ND2 2.72Å; S368-N371 PolarHBondContact O-N 3.35Å; N371-W374 PolarHBondContact O-N 2.89Å; N371-H375 WeakPolarHBondContact O-CB 3.01Å; N371-H375 PolarHBondContact O-CD2 3.25Å; N371-H375 PolarHBondContact O-N 2.99Å
372	T	89.3	Confident	86.4	Confident	88 Å²	88	56.8 Å²	56.8	54%	0.54	32%	0.317	S	S	.	.	H	α-helix	trans	-67	-44.7	175.9	-56.7	0	0	0	0	111.4	S368 D369 W374 H375 T376	S368-T372 WeakPolarHBondContact O-CB 3.36Å; S368-T372 PolarHBondContact O-N 3.43Å; S368-T372 PolarHBondContact O-OG1 3.04Å; D369-T372 PolarHBondContact O-N 3.13Å; T372-W374 VanDerWaalsContact C-N 3.33Å; T372-W374 PolarHBondContact O-N 3.37Å; T372-H375 PolarHBondContact O-N 3.34Å; T372-T376 PolarHBondContact O-N 3.43Å; T372-T376 PolarHBondContact O-OG1 3.47Å
373	A	89.6	Confident	86.9	Confident	23 Å²	23	55.2 Å²	55.2	19%	0.19	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-38.8	174.7	0	0	0	0	0	111.7	L293 I296 D369 I370 T376 L377	L293-A373 HydrophobicContact CD2-CB 3.97Å; I296-A373 HydrophobicContact CD1-CB 4.2Å; I296-A373 HydrophobicContact CG2-CB 4.21Å; D369-A373 WeakPolarHBondContact O-CB 3.46Å; D369-A373 PolarHBondContact O-N 3.33Å; I370-A373 PolarHBondContact O-N 3.06Å; A373-T376 WeakPolarHBondContact O-CB 3.48Å; A373-T376 PolarHBondContact O-N 2.87Å; A373-L377 PolarHBondContact O-N 3.11Å
374	W	92.8	Very high	87.9	Confident	6 Å²	6	46.1 Å²	46.1	2%	0.023	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-42.1	176.3	-172.1	-84.3	0	0	0	112.5	L292 W295 I296 K333 V334 K337 I370 N371 T372 T376 L377 E378	L292-W374 HydrophobicContact CD1-CZ3 4.16Å; W295-W374 HydrophobicContact CZ3-CZ3 4.02Å; I296-W374 HydrophobicContact CD1-CE3 4.11Å; I296-W374 HydrophobicContact CG1-CE3 4.48Å; K333-W374 HydrophobicContact CB-CH2 4.42Å; K333-W374 HydrophobicContact CB-CZ3 4.43Å; V334-W374 HydrophobicContact CG2-CH2 3.98Å; V334-W374 HydrophobicContact CG2-CZ2 3.87Å; K337-W374 HydrophobicContact CB-CZ3 4.49Å; K337-W374 HydrophobicContact CD-CD2 3.73Å; K337-W374 HydrophobicContact CD-CE3 4.14Å; K337-W374 HydrophobicContact CD-CG 3.89Å; I370-W374 WeakPolarHBondContact O-CB 3.32Å; I370-W374 PolarHBondContact O-N 3.32Å; N371-W374 PolarHBondContact O-N 2.89Å; T372-W374 VanDerWaalsContact C-N 3.33Å; T372-W374 PolarHBondContact O-N 3.37Å; W374-T376 VanDerWaalsContact C-N 3.29Å; W374-T376 PolarHBondContact O-N 2.98Å; W374-L377 HydrophobicContact CE3-CD2 4.37Å; W374-L377 HydrophobicContact CZ3-CD2 4.35Å; W374-L377 WeakPolarHBondContact O-CB 3.32Å; W374-L377 PolarHBondContact O-N 3.1Å; W374-E378 VanDerWaalsContact CD1-OE1 3.27Å; W374-E378 VanDerWaalsContact NE1-CD 3.26Å; W374-E378 PolarHBondContact NE1-OE1 2.97Å; W374-E378 WeakPolarHBondContact O-CG 3.46Å; W374-E378 PolarHBondContact O-N 3.02Å
375	H	90.9	Very high	88.5	Confident	117 Å²	117	47.6 Å²	47.6	54%	0.542	26%	0.263	S	S	.	.	H	α-helix	trans	-65	-32.8	172.3	-77.3	-36.7	0	0	0	112.6	N371 T372 E378 G379	N371-H375 WeakPolarHBondContact O-CB 3.01Å; N371-H375 PolarHBondContact O-CD2 3.25Å; N371-H375 PolarHBondContact O-N 2.99Å; T372-H375 PolarHBondContact O-N 3.34Å; H375-E378 IonicContact CE1-OE2 2.63Å; H375-E378 IonicContact CG-OE2 3.77Å; H375-E378 IonicContact ND1-OE2 2.88Å; H375-E378 PolarHBondContact ND1-OE2 3.46Å; H375-E378 PolarHBondContact O-N 2.73Å; H375-G379 PolarHBondContact O-N 3.22Å
376	T	91.3	Very high	88.8	Confident	72 Å²	72	49 Å²	49	44%	0.442	27%	0.274	S	S	.	.	H	α-helix	trans	-65	-41.6	172.2	-53.3	0	0	0	0	110.9	I300 T372 A373 W374 G379 A380	I300-T376 HydrophobicContact CD1-CG2 4.07Å; T372-T376 PolarHBondContact O-N 3.43Å; T372-T376 PolarHBondContact O-OG1 3.47Å; A373-T376 WeakPolarHBondContact O-CB 3.48Å; A373-T376 PolarHBondContact O-N 2.87Å; W374-T376 VanDerWaalsContact C-N 3.29Å; W374-T376 PolarHBondContact O-N 2.98Å; T376-G379 PolarHBondContact O-N 3.48Å; T376-A380 PolarHBondContact O-N 3.3Å
377	L	92.5	Very high	89.2	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-47.6	171.8	-177.8	74.7	0	0	0	111.8	W295 I296 T299 I300 L303 A373 W374 G379 A380 E381	W295-L377 HydrophobicContact CH2-CD2 3.92Å; W295-L377 HydrophobicContact CZ3-CD2 3.53Å; I296-L377 HydrophobicContact CG1-CD2 4.38Å; I296-L377 HydrophobicContact CG2-CB 4.27Å; T299-L377 HydrophobicContact CG2-CD1 3.92Å; I300-L377 HydrophobicContact CG1-CB 4.37Å; I300-L377 HydrophobicContact CG1-CD1 3.86Å; L303-L377 HydrophobicContact CD1-CD1 3.55Å; L303-L377 HydrophobicContact CD1-CG 4.42Å; A373-L377 PolarHBondContact O-N 3.11Å; W374-L377 HydrophobicContact CE3-CD2 4.37Å; W374-L377 HydrophobicContact CZ3-CD2 4.35Å; W374-L377 WeakPolarHBondContact O-CB 3.32Å; W374-L377 PolarHBondContact O-N 3.1Å; L377-G379 VanDerWaalsContact C-N 3.29Å; L377-G379 PolarHBondContact O-N 3.38Å; L377-A380 PolarHBondContact O-N 2.79Å; L377-A380 VanDerWaalsContact O-N 3.16Å; L377-E381 WeakPolarHBondContact O-CG 3.46Å; L377-E381 PolarHBondContact O-N 2.8Å
378	E	90.1	Very high	89.3	Confident	70 Å²	70	45.8 Å²	45.8	33%	0.327	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-36.2	177.1	-71.5	173.6	155	0	0	112.4	W374 H375 K382	W374-E378 VanDerWaalsContact CD1-OE1 3.27Å; W374-E378 VanDerWaalsContact NE1-CD 3.26Å; W374-E378 PolarHBondContact NE1-OE1 2.97Å; W374-E378 WeakPolarHBondContact O-CG 3.46Å; W374-E378 PolarHBondContact O-N 3.02Å; H375-E378 IonicContact CE1-OE2 2.63Å; H375-E378 IonicContact CG-OE2 3.77Å; H375-E378 IonicContact ND1-OE2 2.88Å; H375-E378 PolarHBondContact ND1-OE2 3.46Å; H375-E378 PolarHBondContact O-N 2.73Å; E378-K382 WeakPolarHBondContact O-CB 3.4Å; E378-K382 PolarHBondContact O-N 3.21Å
379	G	90.4	Very high	89.3	Confident	44 Å²	44	45.6 Å²	45.6	45%	0.454	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-45.4	171.6	0	0	0	0	0	112.7	H375 T376 L377 K382 G383	H375-G379 PolarHBondContact O-N 3.22Å; T376-G379 PolarHBondContact O-N 3.48Å; L377-G379 VanDerWaalsContact C-N 3.29Å; L377-G379 PolarHBondContact O-N 3.38Å; G379-K382 PolarHBondContact O-N 3.28Å; G379-G383 PolarHBondContact O-N 3.39Å
380	A	91.4	Very high	89.4	Confident	9 Å²	9	46 Å²	46	7%	0.074	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-40.9	176.3	0	0	0	0	0	112.2	L303 E304 T376 L377 G383 Y384	L303-A380 HydrophobicContact CB-CB 3.94Å; L303-A380 HydrophobicContact CD1-CB 4.35Å; E304-A380 HydrophobicContact CG-CB 4.37Å; T376-A380 PolarHBondContact O-N 3.3Å; L377-A380 PolarHBondContact O-N 2.79Å; L377-A380 VanDerWaalsContact O-N 3.16Å; A380-G383 PolarHBondContact O-N 2.71Å; A380-Y384 WeakPolarHBondContact O-CB 3.48Å; A380-Y384 PolarHBondContact O-N 3.47Å
381	E	89.5	Confident	89.3	Confident	13 Å²	13	46.6 Å²	46.6	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-49.6	173.5	-75.3	-177.3	-173.2	0	0	112.2	L303 Y325 K330 L377 G383 Y384 E385	L303-E381 HydrophobicContact CD1-CB 4.47Å; L303-E381 HydrophobicContact CD1-CG 3.52Å; L303-E381 HydrophobicContact CD2-CG 4.23Å; Y325-E381 HydrophobicContact CE1-CG 4.13Å; Y325-E381 WeakPolarHBondContact CE1-OE1 2.8Å; Y325-E381 PolarHBondContact OH-OE1 2.89Å; K330-E381 VanDerWaalsContact CD-OE1 3.25Å; K330-E381 WeakPolarHBondContact CD-OE1 3.37Å; K330-E381 WeakPolarHBondContact CE-OE1 3.49Å; K330-E381 IonicContact NZ-OE1 3.96Å; K330-E381 PolarHBondContact NZ-OE1 3.02Å; K330-E381 IonicContact NZ-OE2 3.31Å; K330-E381 PolarHBondContact NZ-OE2 3.09Å; L377-E381 WeakPolarHBondContact O-CG 3.46Å; L377-E381 PolarHBondContact O-N 2.8Å; E381-G383 VanDerWaalsContact C-N 3.3Å; E381-G383 PolarHBondContact O-N 2.65Å; E381-Y384 PolarHBondContact O-N 2.88Å; E381-Y384 VanDerWaalsContact O-N 3.07Å; E381-E385 PolarHBondContact O-N 2.94Å
382	K	87.9	Confident	89.2	Confident	126 Å²	126	45.4 Å²	45.4	55%	0.548	25%	0.251	S	S	.	.	H	α-helix	trans	-57.9	-46.3	177.6	178.5	179.4	172.1	-177.8	0	110.4	E378 G379 Y384 E385 E386	E378-K382 WeakPolarHBondContact O-CB 3.4Å; E378-K382 PolarHBondContact O-N 3.21Å; G379-K382 PolarHBondContact O-N 3.28Å; K382-Y384 VanDerWaalsContact C-N 3.3Å; K382-Y384 PolarHBondContact O-N 3.2Å; K382-E385 PolarHBondContact O-N 3.15Å; K382-E386 WeakPolarHBondContact CE-OE1 3.39Å; K382-E386 HydrophobicContact CG-CG 4.42Å; K382-E386 IonicContact NZ-OE1 2.85Å; K382-E386 WeakPolarHBondContact O-CB 3.33Å; K382-E386 WeakPolarHBondContact O-CG 3.29Å; K382-E386 PolarHBondContact O-N 3.26Å
383	G	88.7	Confident	89	Confident	24 Å²	24	48.1 Å²	48.1	25%	0.247	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-31.2	175.7	0	0	0	0	0	113.8	R306 G379 A380 E381 W387	R306-G383 PolarHBondContact NH2-O 3.5Å; G379-G383 PolarHBondContact O-N 3.39Å; A380-G383 PolarHBondContact O-N 2.71Å; E381-G383 VanDerWaalsContact C-N 3.3Å; E381-G383 PolarHBondContact O-N 2.65Å; G383-W387 WeakPolarHBondContact O-CB 3.46Å; G383-W387 PolarHBondContact O-N 3.35Å
384	Y	90	Very high	89	Confident	9 Å²	9	49.8 Å²	49.8	4%	0.035	25%	0.252	C	S	.	.	H	α-helix	trans	-75.8	-41.9	176.9	-171.4	-84.2	0	0	0	111.3	L303 F322 A380 E381 K382 W387 I388	L303-Y384 HydrophobicContact CD2-CD1 4.43Å; L303-Y384 HydrophobicContact CD2-CD2 4.46Å; L303-Y384 HydrophobicContact CD2-CG 4.14Å; L303-Y384 VanDerWaalsContact O-CD2 3.28Å; L303-Y384 WeakPolarHBondContact O-CD2 3.32Å; F322-Y384 HydrophobicContact CB-CD1 4.38Å; F322-Y384 HydrophobicContact CB-CE1 3.77Å; F322-Y384 HydrophobicContact CD1-CD1 4.31Å; F322-Y384 HydrophobicContact CD1-CE1 4.47Å; F322-Y384 AromaticContact CD2-CD1 3.48Å; F322-Y384 HydrophobicContact CD2-CD1 3.48Å; F322-Y384 VanDerWaalsContact CD2-CD1 3.48Å; F322-Y384 AromaticContact CD2-CE1 3.63Å; F322-Y384 HydrophobicContact CD2-CE1 3.63Å; F322-Y384 HydrophobicContact CE1-CD1 4.48Å; F322-Y384 AromaticContact CE2-CD1 3.71Å; F322-Y384 HydrophobicContact CE2-CD1 3.71Å; F322-Y384 HydrophobicContact CE2-CE1 4.33Å; F322-Y384 HydrophobicContact CE2-CG 4.47Å; F322-Y384 AromaticContact CG-CD1 3.81Å; F322-Y384 HydrophobicContact CG-CD1 3.81Å; F322-Y384 AromaticContact CG-CE1 3.71Å; F322-Y384 HydrophobicContact CG-CE1 3.71Å; F322-Y384 HydrophobicContact CZ-CD1 4.2Å; A380-Y384 WeakPolarHBondContact O-CB 3.48Å; A380-Y384 PolarHBondContact O-N 3.47Å; E381-Y384 PolarHBondContact O-N 2.88Å; E381-Y384 VanDerWaalsContact O-N 3.07Å; K382-Y384 VanDerWaalsContact C-N 3.3Å; K382-Y384 PolarHBondContact O-N 3.2Å; Y384-W387 HydrophobicContact CD2-CE3 4.45Å; Y384-W387 HydrophobicContact CE2-CE3 4.47Å; Y384-W387 HydrophobicContact CE2-CZ3 4.17Å; Y384-W387 PolarHBondContact O-N 3.01Å; Y384-I388 HydrophobicContact CD1-CD1 3.95Å; Y384-I388 HydrophobicContact CD1-CG1 4.2Å; Y384-I388 HydrophobicContact CE1-CD1 3.2Å; Y384-I388 HydrophobicContact CE1-CG1 3.87Å; Y384-I388 WeakPolarHBondContact O-CB 3.37Å; Y384-I388 PolarHBondContact O-N 3.23Å
385	E	86.1	Confident	88.7	Confident	71 Å²	71	50.2 Å²	50.2	33%	0.332	26%	0.255	S	S	.	.	H	α-helix	trans	-63.6	-49	174.1	-178.5	162.1	-149.4	0	0	111.6	F322 R326 E381 K382 W387 L389	F322-E385 HydrophobicContact CE1-CB 3.83Å; F322-E385 HydrophobicContact CE1-CG 4.26Å; F322-E385 HydrophobicContact CZ-CB 4.03Å; R326-E385 IonicContact CZ-OE1 3.69Å; R326-E385 IonicContact CZ-OE2 3.63Å; R326-E385 IonicContact NH1-OE1 2.69Å; R326-E385 PolarHBondContact NH1-OE1 2.99Å; R326-E385 IonicContact NH1-OE2 3.61Å; R326-E385 PolarHBondContact NH1-OE2 3.19Å; R326-E385 IonicContact NH2-OE2 2.64Å; E381-E385 PolarHBondContact O-N 2.94Å; K382-E385 PolarHBondContact O-N 3.15Å; E385-W387 VanDerWaalsContact C-N 3.34Å; E385-W387 PolarHBondContact O-N 3.27Å; E385-L389 HydrophobicContact CG-CD1 3.82Å; E385-L389 HydrophobicContact CG-CG 4.49Å; E385-L389 VanDerWaalsContact O-CB 3.31Å; E385-L389 WeakPolarHBondContact O-CB 3.38Å; E385-L389 WeakPolarHBondContact O-CG 3.46Å; E385-L389 PolarHBondContact O-N 3.48Å
386	E	87.6	Confident	88.5	Confident	109 Å²	109	49.1 Å²	49.1	51%	0.509	25%	0.25	S	S	.	.	H	α-helix	trans	-60.6	-43.3	176.1	-74.1	177.4	173	0	0	111.6	K382 S390	K382-E386 WeakPolarHBondContact CE-OE1 3.39Å; K382-E386 HydrophobicContact CG-CG 4.42Å; K382-E386 IonicContact NZ-OE1 2.85Å; K382-E386 WeakPolarHBondContact O-CB 3.33Å; K382-E386 WeakPolarHBondContact O-CG 3.29Å; K382-E386 PolarHBondContact O-N 3.26Å; E386-S390 VanDerWaalsContact O-CB 3.26Å; E386-S390 WeakPolarHBondContact O-CB 3.41Å; E386-S390 PolarHBondContact O-N 3.24Å; E386-S390 PolarHBondContact O-OG 3.28Å
387	W	91.5	Very high	88.4	Confident	34 Å²	34	52.2 Å²	52.2	13%	0.129	25%	0.254	C	S	.	.	H	α-helix	trans	-63	-54.8	176.8	172.6	70.9	0	0	0	112.4	R306 T307 G383 Y384 E385 L389 S390 E391	R306-W387 VanDerWaalsContact C-CZ2 3.49Å; R306-W387 HydrophobicContact CB-CZ2 4.45Å; R306-W387 VanDerWaalsContact CD-CD2 3.42Å; T307-W387 WeakPolarHBondContact O-CH2 3.18Å; T307-W387 WeakPolarHBondContact O-CZ2 3.12Å; G383-W387 WeakPolarHBondContact O-CB 3.46Å; G383-W387 PolarHBondContact O-N 3.35Å; Y384-W387 HydrophobicContact CD2-CE3 4.45Å; Y384-W387 HydrophobicContact CE2-CE3 4.47Å; Y384-W387 HydrophobicContact CE2-CZ3 4.17Å; Y384-W387 PolarHBondContact O-N 3.01Å; E385-W387 VanDerWaalsContact C-N 3.34Å; E385-W387 PolarHBondContact O-N 3.27Å; W387-L389 VanDerWaalsContact C-N 3.31Å; W387-L389 PolarHBondContact O-N 3.23Å; W387-S390 PolarHBondContact O-N 3.21Å; W387-S390 VanDerWaalsContact O-N 3.13Å; W387-S390 PolarHBondContact O-OG 3.48Å; W387-E391 WeakPolarHBondContact O-CB 3.49Å; W387-E391 PolarHBondContact O-N 3.02Å
388	I	87.5	Confident	88.2	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-55.4	-47.6	178.4	-78.5	-161.5	0	0	0	110.8	K318 Q319 Y384 S390 E391 I392	K318-I388 HydrophobicContact CB-CD1 4.05Å; Q319-I388 HydrophobicContact CB-CG2 4.12Å; Q319-I388 HydrophobicContact CG-CG2 4.23Å; Y384-I388 HydrophobicContact CD1-CD1 3.95Å; Y384-I388 HydrophobicContact CD1-CG1 4.2Å; Y384-I388 HydrophobicContact CE1-CD1 3.2Å; Y384-I388 HydrophobicContact CE1-CG1 3.87Å; Y384-I388 WeakPolarHBondContact O-CB 3.37Å; Y384-I388 PolarHBondContact O-N 3.23Å; I388-S390 VanDerWaalsContact C-N 3.32Å; I388-S390 PolarHBondContact O-N 3.22Å; I388-E391 PolarHBondContact O-N 2.94Å; I388-I392 HydrophobicContact CG2-CD1 3.58Å; I388-I392 HydrophobicContact CG2-CG1 4.24Å; I388-I392 WeakPolarHBondContact O-CB 3.5Å; I388-I392 WeakPolarHBondContact O-CG1 3.49Å; I388-I392 PolarHBondContact O-N 3.28Å
389	L	85.9	Confident	88.1	Confident	58 Å²	58	55.5 Å²	55.5	30%	0.304	27%	0.269	S	S	.	.	H	α-helix	trans	-67.3	-34.2	-178.4	-68.1	174.2	0	0	0	112	E385 W387 R393	E385-L389 HydrophobicContact CG-CD1 3.82Å; E385-L389 HydrophobicContact CG-CG 4.49Å; E385-L389 VanDerWaalsContact O-CB 3.31Å; E385-L389 WeakPolarHBondContact O-CB 3.38Å; E385-L389 WeakPolarHBondContact O-CG 3.46Å; E385-L389 PolarHBondContact O-N 3.48Å; W387-L389 VanDerWaalsContact C-N 3.31Å; W387-L389 PolarHBondContact O-N 3.23Å; L389-R393 WeakPolarHBondContact O-CB 3.5Å; L389-R393 VanDerWaalsContact O-CG 3.29Å; L389-R393 WeakPolarHBondContact O-CG 3.28Å; L389-R393 PolarHBondContact O-N 2.82Å; L389-R393 PolarHBondContact O-NE 3.09Å; L389-R393 VanDerWaalsContact O-NE 3.13Å; L389-R393 PolarHBondContact O-NH2 3.31Å
390	S	87.2	Confident	88	Confident	54 Å²	54	59.4 Å²	59.4	38%	0.378	28%	0.275	S	S	.	.	H	α-helix	trans	-66.6	-41.6	173.3	75.6	0	0	0	0	112	E386 W387 I388 R393 R394	E386-S390 VanDerWaalsContact O-CB 3.26Å; E386-S390 WeakPolarHBondContact O-CB 3.41Å; E386-S390 PolarHBondContact O-N 3.24Å; E386-S390 PolarHBondContact O-OG 3.28Å; W387-S390 PolarHBondContact O-N 3.21Å; W387-S390 VanDerWaalsContact O-N 3.13Å; W387-S390 PolarHBondContact O-OG 3.48Å; I388-S390 VanDerWaalsContact C-N 3.32Å; I388-S390 PolarHBondContact O-N 3.22Å; S390-R393 PolarHBondContact O-N 3.48Å; S390-R394 WeakPolarHBondContact O-CB 3.46Å; S390-R394 PolarHBondContact O-N 3.12Å
391	E	86	Confident	88	Confident	12 Å²	12	59.3 Å²	59.3	6%	0.056	27%	0.274	C	S	.	.	H	α-helix	trans	-77.9	-38.3	-174.2	-168.8	73.6	166.6	0	0	111.7	L315 W387 I388 R393 R394 L395	L315-E391 HydrophobicContact CD1-CB 3.85Å; L315-E391 HydrophobicContact CD1-CG 3.38Å; W387-E391 WeakPolarHBondContact O-CB 3.49Å; W387-E391 PolarHBondContact O-N 3.02Å; I388-E391 PolarHBondContact O-N 2.94Å; E391-R393 PolarHBondContact O-N 3.29Å; E391-R394 WeakPolarHBondContact O-CB 3.27Å; E391-R394 PolarHBondContact O-N 3.38Å; E391-R394 IonicContact OE1-CZ 2.64Å; E391-R394 IonicContact OE1-NE 2.63Å; E391-R394 PolarHBondContact OE1-NE 2.62Å; E391-R394 IonicContact OE1-NH2 2.93Å; E391-R394 PolarHBondContact OE1-NH2 3.14Å; E391-R394 IonicContact OE2-CZ 2.77Å; E391-R394 IonicContact OE2-NE 3.35Å; E391-R394 PolarHBondContact OE2-NE 3.48Å; E391-R394 IonicContact OE2-NH2 3.5Å; E391-L395 WeakPolarHBondContact O-CG 3.28Å; E391-L395 PolarHBondContact O-N 2.7Å
392	I	86.3	Confident	88.1	Confident	12 Å²	12	59 Å²	59	6%	0.062	27%	0.273	C	S	.	.	H	α-helix	trans	-57.4	-50.2	169.3	-71.2	174.1	0	0	0	109.8	L315 Q319 I388 R394 L395 E396	L315-I392 HydrophobicContact CB-CD1 4.32Å; L315-I392 HydrophobicContact CB-CG1 3.74Å; L315-I392 HydrophobicContact CD1-CG1 4.13Å; Q319-I392 HydrophobicContact CB-CD1 4.25Å; Q319-I392 HydrophobicContact CG-CD1 4.47Å; I388-I392 HydrophobicContact CG2-CD1 3.58Å; I388-I392 HydrophobicContact CG2-CG1 4.24Å; I388-I392 WeakPolarHBondContact O-CB 3.5Å; I388-I392 WeakPolarHBondContact O-CG1 3.49Å; I388-I392 PolarHBondContact O-N 3.28Å; I392-R394 VanDerWaalsContact C-N 3.28Å; I392-R394 PolarHBondContact O-N 3.39Å; I392-L395 PolarHBondContact O-N 3.21Å; I392-E396 HydrophobicContact CG2-CG 4.27Å; I392-E396 WeakPolarHBondContact O-CB 3.42Å; I392-E396 WeakPolarHBondContact O-CG 3.5Å; I392-E396 PolarHBondContact O-N 2.84Å
393	R	85.6	Confident	88.2	Confident	145 Å²	145	58 Å²	58	55%	0.547	27%	0.271	S	S	.	.	H	α-helix	trans	-61.1	-35.4	176.6	-73.8	-176.4	-63.1	-107.6	-0.5	112.7	L389 S390 E391 R397	L389-R393 WeakPolarHBondContact O-CB 3.5Å; L389-R393 VanDerWaalsContact O-CG 3.29Å; L389-R393 WeakPolarHBondContact O-CG 3.28Å; L389-R393 PolarHBondContact O-N 2.82Å; L389-R393 PolarHBondContact O-NE 3.09Å; L389-R393 VanDerWaalsContact O-NE 3.13Å; L389-R393 PolarHBondContact O-NH2 3.31Å; S390-R393 PolarHBondContact O-N 3.48Å; E391-R393 PolarHBondContact O-N 3.29Å; R393-R397 VanDerWaalsContact O-CB 3.23Å; R393-R397 WeakPolarHBondContact O-CB 3.4Å; R393-R397 PolarHBondContact O-N 3.14Å
394	R	89.2	Confident	88.3	Confident	57 Å²	57	60.7 Å²	60.7	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-65.3	-48.3	175.8	-168.9	-176	69.8	85.8	2.3	110.9	S390 E391 I392 R397 L398 L470	S390-R394 WeakPolarHBondContact O-CB 3.46Å; S390-R394 PolarHBondContact O-N 3.12Å; E391-R394 WeakPolarHBondContact O-CB 3.27Å; E391-R394 PolarHBondContact O-N 3.38Å; E391-R394 IonicContact OE1-CZ 2.64Å; E391-R394 IonicContact OE1-NE 2.63Å; E391-R394 PolarHBondContact OE1-NE 2.62Å; E391-R394 IonicContact OE1-NH2 2.93Å; E391-R394 PolarHBondContact OE1-NH2 3.14Å; E391-R394 IonicContact OE2-CZ 2.77Å; E391-R394 IonicContact OE2-NE 3.35Å; E391-R394 PolarHBondContact OE2-NE 3.48Å; E391-R394 IonicContact OE2-NH2 3.5Å; I392-R394 VanDerWaalsContact C-N 3.28Å; I392-R394 PolarHBondContact O-N 3.39Å; R394-R397 PolarHBondContact O-N 3.38Å; R394-L398 WeakPolarHBondContact O-CB 3.44Å; R394-L398 WeakPolarHBondContact O-CG 3.42Å; R394-L398 PolarHBondContact O-N 3.1Å; R394-L470 HydrophobicContact CG-CD2 4.3Å; R394-L470 PolarHBondContact NH1-O 3.47Å
395	L	87	Confident	88.5	Confident	16 Å²	16	60.3 Å²	60.3	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-68	-40.2	179.2	-66.5	-170.3	0	0	0	112.4	V312 L315 E391 I392 L398 E399	V312-L395 HydrophobicContact CG2-CB 3.6Å; L315-L395 HydrophobicContact CD1-CD1 3.54Å; L315-L395 HydrophobicContact CD1-CG 4.25Å; L315-L395 HydrophobicContact CG-CD1 4.22Å; E391-L395 WeakPolarHBondContact O-CG 3.28Å; E391-L395 PolarHBondContact O-N 2.7Å; I392-L395 PolarHBondContact O-N 3.21Å; L395-L398 HydrophobicContact CD2-CD1 4.14Å; L395-L398 WeakPolarHBondContact O-CB 3.24Å; L395-L398 PolarHBondContact O-N 3.1Å; L395-E399 PolarHBondContact O-N 3.18Å
396	E	86.3	Confident	88.8	Confident	94 Å²	94	60.5 Å²	60.5	44%	0.439	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-42.2	173.3	-73.7	178.9	158.7	0	0	111.7	V312 I392 E399 H400	V312-E396 HydrophobicContact CG1-CG 4.11Å; V312-E396 HydrophobicContact CG2-CG 4.19Å; I392-E396 HydrophobicContact CG2-CG 4.27Å; I392-E396 WeakPolarHBondContact O-CB 3.42Å; I392-E396 WeakPolarHBondContact O-CG 3.5Å; I392-E396 PolarHBondContact O-N 2.84Å; E396-E399 PolarHBondContact O-N 2.93Å; E396-H400 WeakPolarHBondContact O-CB 3.45Å; E396-H400 PolarHBondContact O-N 3.34Å
397	R	89.1	Confident	89	Confident	137 Å²	137	60.4 Å²	60.4	52%	0.517	27%	0.274	S	S	.	.	H	α-helix	trans	-62.2	-44.4	173.5	-178	179.1	-176.9	169.7	1.4	111	R393 R394 H400 L401 E466 L470	R393-R397 VanDerWaalsContact O-CB 3.23Å; R393-R397 WeakPolarHBondContact O-CB 3.4Å; R393-R397 PolarHBondContact O-N 3.14Å; R394-R397 PolarHBondContact O-N 3.38Å; R397-H400 PolarHBondContact O-N 2.95Å; R397-L401 HydrophobicContact CG-CD1 3.74Å; R397-L401 HydrophobicContact CG-CG 4.17Å; R397-L401 VanDerWaalsContact O-CB 3.31Å; R397-L401 WeakPolarHBondContact O-CB 3.18Å; R397-L401 WeakPolarHBondContact O-CG 3.33Å; R397-L401 PolarHBondContact O-N 3Å; R397-E466 IonicContact CZ-OE1 3.51Å; R397-E466 IonicContact NE-OE1 3.95Å; R397-E466 PolarHBondContact NE-OE1 2.87Å; R397-E466 IonicContact NH2-OE1 3.89Å; R397-E466 PolarHBondContact NH2-OE1 2.62Å; R397-L470 HydrophobicContact CG-CD1 4.26Å
398	L	89.1	Confident	89	Confident	9 Å²	9	61 Å²	61	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-47.3	176.3	-81.8	177.6	0	0	0	112.5	R394 L395 L401 A402 L467 L470 Y472	R394-L398 WeakPolarHBondContact O-CB 3.44Å; R394-L398 WeakPolarHBondContact O-CG 3.42Å; R394-L398 PolarHBondContact O-N 3.1Å; L395-L398 HydrophobicContact CD2-CD1 4.14Å; L395-L398 WeakPolarHBondContact O-CB 3.24Å; L395-L398 PolarHBondContact O-N 3.1Å; L398-L401 PolarHBondContact O-N 3.46Å; L398-A402 VanDerWaalsContact O-CB 3.23Å; L398-A402 WeakPolarHBondContact O-CB 3.45Å; L398-A402 PolarHBondContact O-N 3.06Å; L398-L467 HydrophobicContact CD2-CD2 3.69Å; L398-L470 HydrophobicContact CD1-CB 4.49Å; L398-L470 HydrophobicContact CD2-CB 3.47Å; L398-L470 VanDerWaalsContact CD2-CB 3.47Å; L398-L470 HydrophobicContact CD2-CD1 4.06Å; L398-L470 HydrophobicContact CD2-CG 4.43Å; L398-L470 HydrophobicContact CG-CB 4.09Å; L398-L470 HydrophobicContact CG-CD1 4.45Å; L398-Y472 HydrophobicContact CB-CD2 4.17Å; L398-Y472 HydrophobicContact CD1-CD2 4.38Å; L398-Y472 HydrophobicContact CD2-CD2 3.93Å; L398-Y472 HydrophobicContact CD2-CG 4.25Å; L398-Y472 HydrophobicContact CG-CD2 4.41Å
399	E	87.4	Confident	89.3	Confident	129 Å²	129	60.8 Å²	60.8	60%	0.603	28%	0.277	S	S	*	.	H	α-helix	trans	-61.9	-44.2	178	-172.1	169.4	-165.8	0	0	111.1	L395 E396 A402 E403	L395-E399 PolarHBondContact O-N 3.18Å; E396-E399 PolarHBondContact O-N 2.93Å; E399-A402 PolarHBondContact O-N 3.4Å; E399-E403 PolarHBondContact O-N 3.3Å
400	H	88.8	Confident	89.6	Confident	126 Å²	126	60.2 Å²	60.2	58%	0.583	28%	0.281	S	S	*	.	H	α-helix	trans	-64.8	-44.1	176.3	-176.1	73.3	0	0	0	113.2	E396 R397 K404	E396-H400 WeakPolarHBondContact O-CB 3.45Å; E396-H400 PolarHBondContact O-N 3.34Å; R397-H400 PolarHBondContact O-N 2.95Å; H400-K404 WeakPolarHBondContact O-CB 3.29Å; H400-K404 PolarHBondContact O-N 3.34Å
401	L	91.6	Very high	89.8	Confident	8 Å²	8	62.3 Å²	62.3	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-40.7	177.4	-72.8	171.3	0	0	0	111.7	R397 L398 K404 F405 I463 E466 L467 L470	R397-L401 HydrophobicContact CG-CD1 3.74Å; R397-L401 HydrophobicContact CG-CG 4.17Å; R397-L401 VanDerWaalsContact O-CB 3.31Å; R397-L401 WeakPolarHBondContact O-CB 3.18Å; R397-L401 WeakPolarHBondContact O-CG 3.33Å; R397-L401 PolarHBondContact O-N 3Å; L398-L401 PolarHBondContact O-N 3.46Å; L401-K404 PolarHBondContact O-N 3.11Å; L401-F405 WeakPolarHBondContact O-CB 3.03Å; L401-F405 PolarHBondContact O-N 3.38Å; L401-I463 HydrophobicContact CB-CG2 4.25Å; L401-I463 HydrophobicContact CD2-CG2 4.2Å; L401-I463 WeakPolarHBondContact O-CG2 3.34Å; L401-E466 HydrophobicContact CD1-CB 4.46Å; L401-E466 VanDerWaalsContact CD1-CD 3.46Å; L401-E466 HydrophobicContact CD1-CG 3.76Å; L401-E466 WeakPolarHBondContact CD1-OE1 3.44Å; L401-E466 WeakPolarHBondContact CD2-OE2 3.45Å; L401-L467 HydrophobicContact CB-CD1 4.47Å; L401-L467 HydrophobicContact CB-CD2 3.64Å; L401-L467 HydrophobicContact CB-CG 4Å; L401-L467 HydrophobicContact CD1-CD2 4.42Å; L401-L470 HydrophobicContact CD1-CD1 3.89Å
402	A	90.5	Very high	90.1	Very high	6 Å²	6	61.7 Å²	61.7	5%	0.05	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-46.1	178.4	0	0	0	0	0	111.4	L398 E399 F405 H406 L467 Y472	L398-A402 VanDerWaalsContact O-CB 3.23Å; L398-A402 WeakPolarHBondContact O-CB 3.45Å; L398-A402 PolarHBondContact O-N 3.06Å; E399-A402 PolarHBondContact O-N 3.4Å; A402-F405 WeakPolarHBondContact O-CB 3.32Å; A402-F405 PolarHBondContact O-N 3.31Å; A402-H406 PolarHBondContact O-N 2.88Å; A402-H406 PolarHBondContact O-ND1 3.02Å; A402-L467 HydrophobicContact CB-CD2 4.31Å; A402-Y472 HydrophobicContact CB-CE1 4.22Å; A402-Y472 HydrophobicContact CB-CE2 3.97Å
403	E	90.9	Very high	90.3	Very high	105 Å²	105	64.3 Å²	64.3	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-43.8	175.4	-179.7	56.8	-156.1	0	0	111.4	E399 F405 H406 Q407	E399-E403 PolarHBondContact O-N 3.3Å; E403-F405 VanDerWaalsContact C-N 3.32Å; E403-F405 PolarHBondContact O-N 3.46Å; E403-H406 PolarHBondContact O-N 3Å; E403-H406 VanDerWaalsContact O-N 3.15Å; E403-Q407 WeakPolarHBondContact O-CG 3.31Å; E403-Q407 PolarHBondContact O-N 3.02Å; E403-Q407 WeakPolarHBondContact OE1-CG 3.47Å; E403-Q407 PolarHBondContact OE1-NE2 3.38Å
404	K	91.4	Very high	90.6	Very high	81 Å²	81	62 Å²	62	35%	0.352	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-38.3	176.2	-173.8	-177.1	178.9	-173.2	0	112.4	H400 L401 K408 I463	H400-K404 WeakPolarHBondContact O-CB 3.29Å; H400-K404 PolarHBondContact O-N 3.34Å; L401-K404 PolarHBondContact O-N 3.11Å; K404-K408 HydrophobicContact CG-CD 4.29Å; K404-K408 WeakPolarHBondContact O-CB 3.36Å; K404-K408 WeakPolarHBondContact O-CG 3.47Å; K404-K408 PolarHBondContact O-N 3.41Å; K404-I463 HydrophobicContact CD-CD1 3.9Å; K404-I463 HydrophobicContact CG-CD1 4.02Å
405	F	94.2	Very high	90.7	Very high	1 Å²	1	61 Å²	61	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-50.6	171.7	174.9	-94	0	0	0	110.9	L401 A402 E403 Q407 K408 A409 I460 I463 A464 L467 V478 R481 C482	L401-F405 WeakPolarHBondContact O-CB 3.03Å; L401-F405 PolarHBondContact O-N 3.38Å; A402-F405 WeakPolarHBondContact O-CB 3.32Å; A402-F405 PolarHBondContact O-N 3.31Å; E403-F405 VanDerWaalsContact C-N 3.32Å; E403-F405 PolarHBondContact O-N 3.46Å; F405-Q407 VanDerWaalsContact C-N 3.34Å; F405-Q407 PolarHBondContact O-N 3.23Å; F405-K408 PolarHBondContact O-N 3.26Å; F405-A409 HydrophobicContact CE1-CB 4.47Å; F405-A409 WeakPolarHBondContact O-CB 3.39Å; F405-A409 PolarHBondContact O-N 3.04Å; F405-I460 HydrophobicContact CD2-CG2 4.08Å; F405-I460 HydrophobicContact CE2-CG2 3.61Å; F405-I460 HydrophobicContact CZ-CG2 4.48Å; F405-I463 HydrophobicContact CB-CG2 3.87Å; F405-A464 HydrophobicContact CD2-CB 4.28Å; F405-A464 HydrophobicContact CE2-CB 3.94Å; F405-L467 HydrophobicContact CB-CD1 4.17Å; F405-V478 HydrophobicContact CD1-CB 4.5Å; F405-V478 HydrophobicContact CD1-CG1 4Å; F405-V478 HydrophobicContact CD1-CG2 4.15Å; F405-V478 HydrophobicContact CD2-CG1 4.03Å; F405-V478 HydrophobicContact CE1-CB 4.14Å; F405-V478 HydrophobicContact CE1-CG1 3.79Å; F405-V478 HydrophobicContact CE1-CG2 4.15Å; F405-V478 HydrophobicContact CE2-CG1 3.81Å; F405-V478 HydrophobicContact CG-CG1 4.12Å; F405-V478 HydrophobicContact CZ-CB 4.36Å; F405-V478 HydrophobicContact CZ-CG1 3.7Å; F405-V478 WeakPolarHBondContact CZ-O 3.21Å; F405-R481 HydrophobicContact CE1-CB 4.47Å; F405-R481 HydrophobicContact CZ-CB 4.32Å; F405-C482 HydrophobicContact CE2-CB 4.16Å; F405-C482 HydrophobicContact CZ-CB 4.24Å
406	H	91.4	Very high	90.8	Very high	74 Å²	74	60.5 Å²	60.5	34%	0.343	30%	0.295	S	S	.	.	H	α-helix	trans	-58.4	-44.6	-179.1	-80.4	74.4	0	0	0	112.4	A402 E403 A410	A402-H406 PolarHBondContact O-N 2.88Å; A402-H406 PolarHBondContact O-ND1 3.02Å; E403-H406 PolarHBondContact O-N 3Å; E403-H406 VanDerWaalsContact O-N 3.15Å; H406-A410 WeakPolarHBondContact O-CB 3.37Å; H406-A410 PolarHBondContact O-N 3.05Å; H406-A410 VanDerWaalsContact O-N 3.08Å
407	Q	92.4	Very high	91	Very high	107 Å²	107	62.4 Å²	62.4	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-64.9	-50.5	176.6	-67.9	180	13.4	0	0	112	E403 F405 A409 A410 I411	E403-Q407 WeakPolarHBondContact O-CG 3.31Å; E403-Q407 PolarHBondContact O-N 3.02Å; E403-Q407 WeakPolarHBondContact OE1-CG 3.47Å; E403-Q407 PolarHBondContact OE1-NE2 3.38Å; F405-Q407 VanDerWaalsContact C-N 3.34Å; F405-Q407 PolarHBondContact O-N 3.23Å; Q407-A409 PolarHBondContact O-N 3.32Å; Q407-A410 PolarHBondContact O-N 3.34Å; Q407-I411 WeakPolarHBondContact O-CB 3.42Å; Q407-I411 WeakPolarHBondContact O-CD1 3.19Å; Q407-I411 VanDerWaalsContact O-CG1 3.25Å; Q407-I411 WeakPolarHBondContact O-CG1 3.41Å; Q407-I411 PolarHBondContact O-N 3.38Å
408	K	92.1	Very high	90.9	Very high	46 Å²	46	58.1 Å²	58.1	20%	0.2	31%	0.307	C	S	.	.	H	α-helix	trans	-62.7	-43	-179.6	-78.5	177.7	171.9	-79.1	0	112.3	K404 F405 I411 H412 I460 I463	K404-K408 HydrophobicContact CG-CD 4.29Å; K404-K408 WeakPolarHBondContact O-CB 3.36Å; K404-K408 WeakPolarHBondContact O-CG 3.47Å; K404-K408 PolarHBondContact O-N 3.41Å; F405-K408 PolarHBondContact O-N 3.26Å; K408-I411 PolarHBondContact O-N 3.31Å; K408-H412 WeakPolarHBondContact O-CB 3.29Å; K408-H412 PolarHBondContact O-N 3.48Å; K408-I460 HydrophobicContact CB-CD1 4.13Å; K408-I460 HydrophobicContact CB-CG1 3.71Å; K408-I463 HydrophobicContact CD-CD1 3.82Å
409	A	92.6	Very high	90.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-47.8	176.8	0	0	0	0	0	111.7	F405 Q407 I411 H412 E413 I485	F405-A409 HydrophobicContact CE1-CB 4.47Å; F405-A409 WeakPolarHBondContact O-CB 3.39Å; F405-A409 PolarHBondContact O-N 3.04Å; Q407-A409 PolarHBondContact O-N 3.32Å; A409-I411 PolarHBondContact O-N 3.15Å; A409-H412 PolarHBondContact O-N 3.27Å; A409-E413 VanDerWaalsContact O-CG 3.29Å; A409-E413 WeakPolarHBondContact O-CG 3.28Å; A409-E413 PolarHBondContact O-N 3.17Å; A409-I485 HydrophobicContact CB-CD1 3.77Å
410	A	92.4	Very high	90.9	Very high	46 Å²	46	57 Å²	57	38%	0.38	30%	0.301	S	S	.	.	H	α-helix	trans	-63.3	-38.6	178.3	0	0	0	0	0	112.9	H406 Q407 S414	H406-A410 WeakPolarHBondContact O-CB 3.37Å; H406-A410 PolarHBondContact O-N 3.05Å; H406-A410 VanDerWaalsContact O-N 3.08Å; Q407-A410 PolarHBondContact O-N 3.34Å; A410-S414 WeakPolarHBondContact O-CB 3.34Å; A410-S414 PolarHBondContact O-N 3.05Å; A410-S414 VanDerWaalsContact O-N 3.08Å
411	I	91.2	Very high	90.9	Very high	97 Å²	97	54.1 Å²	54.1	50%	0.497	30%	0.299	S	S	.	.	H	α-helix	trans	-67.6	-36.3	175.8	-67.4	165.2	0	0	0	111.2	Q407 K408 A409 W415	Q407-I411 WeakPolarHBondContact O-CB 3.42Å; Q407-I411 WeakPolarHBondContact O-CD1 3.19Å; Q407-I411 VanDerWaalsContact O-CG1 3.25Å; Q407-I411 WeakPolarHBondContact O-CG1 3.41Å; Q407-I411 PolarHBondContact O-N 3.38Å; K408-I411 PolarHBondContact O-N 3.31Å; A409-I411 PolarHBondContact O-N 3.15Å; I411-W415 PolarHBondContact O-N 3.18Å
412	H	92.4	Very high	90.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.4	-50.7	175.4	-178.4	-80.4	0	0	0	111.8	K408 A409 S414 W415 T416 V457 I460 W489	K408-H412 WeakPolarHBondContact O-CB 3.29Å; K408-H412 PolarHBondContact O-N 3.48Å; A409-H412 PolarHBondContact O-N 3.27Å; H412-S414 PolarHBondContact O-N 3.39Å; H412-W415 PolarHBondContact O-N 2.96Å; H412-T416 WeakPolarHBondContact CE1-CG2 3.21Å; H412-T416 PolarHBondContact O-N 2.85Å; H412-V457 VanDerWaalsContact NE2-CG2 3.25Å; H412-V457 WeakPolarHBondContact NE2-CG2 3.49Å; H412-I460 HydrophobicContact CB-CD1 3.84Å; H412-W489 AromaticContact NE2-CE3 3.49Å; H412-W489 AromaticContact NE2-CZ3 3.55Å
413	E	91.6	Very high	90.5	Very high	66 Å²	66	57.4 Å²	57.4	31%	0.308	31%	0.314	S	S	.	.	H	α-helix	trans	-57.4	-35.8	178	-69.8	163.7	175.5	0	0	112.3	A409 W415 T416 R481 I485	A409-E413 VanDerWaalsContact O-CG 3.29Å; A409-E413 WeakPolarHBondContact O-CG 3.28Å; A409-E413 PolarHBondContact O-N 3.17Å; E413-W415 VanDerWaalsContact C-N 3.34Å; E413-T416 PolarHBondContact O-OG1 3.3Å; E413-R481 VanDerWaalsContact CD-NH2 3.34Å; E413-R481 IonicContact OE1-CZ 2.75Å; E413-R481 IonicContact OE1-NE 2.96Å; E413-R481 PolarHBondContact OE1-NE 3.15Å; E413-R481 IonicContact OE1-NH2 2.74Å; E413-R481 PolarHBondContact OE1-NH2 2.84Å; E413-R481 IonicContact OE2-CZ 3.68Å; E413-R481 IonicContact OE2-NE 3.64Å; E413-R481 IonicContact OE2-NH2 2.7Å; E413-R481 PolarHBondContact OE2-NH2 2.75Å; E413-I485 HydrophobicContact CG-CD1 4.31Å; E413-I485 HydrophobicContact CG-CG1 4.31Å
414	S	91.1	Very high	90.3	Very high	98 Å²	98	57 Å²	57	69%	0.685	32%	0.319	S	S	*	.	H	α-helix	trans	-68.2	-29.3	174.3	-174	0	0	0	0	113.4	A410 H412	A410-S414 WeakPolarHBondContact O-CB 3.34Å; A410-S414 PolarHBondContact O-N 3.05Å; A410-S414 VanDerWaalsContact O-N 3.08Å; H412-S414 PolarHBondContact O-N 3.39Å
415	W	91.4	Very high	90.1	Very high	36 Å²	36	58.4 Å²	58.4	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-84.2	-29.9	178.1	172.2	95.7	0	0	0	113.2	I411 H412 E413 D417 K419 F446 D449 L450 H453 W489 L492	I411-W415 PolarHBondContact O-N 3.18Å; H412-W415 PolarHBondContact O-N 2.96Å; E413-W415 VanDerWaalsContact C-N 3.34Å; W415-D417 VanDerWaalsContact C-N 3.3Å; W415-K419 WeakPolarHBondContact O-CE 3.32Å; W415-K419 WeakPolarHBondContact O-CG 3.41Å; W415-F446 HydrophobicContact CZ2-CE2 4.29Å; W415-D449 WeakPolarHBondContact CZ2-OD2 3.24Å; W415-D449 PolarHBondContact NE1-OD2 2.83Å; W415-L450 HydrophobicContact CH2-CB 4.46Å; W415-L450 HydrophobicContact CH2-CD1 3.77Å; W415-L450 HydrophobicContact CZ3-CD1 4.4Å; W415-H453 AromaticContact CD1-CE1 3.23Å; W415-H453 AromaticContact CD1-ND1 3.9Å; W415-H453 AromaticContact CD1-NE2 3.95Å; W415-H453 AromaticContact CD2-CE1 3.38Å; W415-H453 AromaticContact CD2-ND1 3.2Å; W415-H453 AromaticContact CE2-CE1 3.49Å; W415-H453 VanDerWaalsContact CE2-CE1 3.49Å; W415-H453 AromaticContact CE2-CG 3.99Å; W415-H453 AromaticContact CE2-ND1 3.41Å; W415-H453 AromaticContact CE3-ND1 3.49Å; W415-H453 AromaticContact CG-CE1 3.23Å; W415-H453 AromaticContact CG-ND1 3.57Å; W415-H453 HydrophobicContact CH2-CB 4.29Å; W415-H453 HydrophobicContact CZ2-CB 4.43Å; W415-H453 AromaticContact CZ2-ND1 3.9Å; W415-H453 HydrophobicContact CZ3-CB 4.47Å; W415-H453 AromaticContact CZ3-ND1 3.98Å; W415-H453 AromaticContact NE1-CE1 3.35Å; W415-H453 PolarHBondContact NE1-CE1 2.96Å; W415-H453 AromaticContact NE1-ND1 3.78Å; W415-H453 AromaticContact NE1-NE2 3.82Å; W415-W489 HydrophobicContact CH2-CZ3 4.13Å; W415-W489 AromaticContact CZ3-CZ3 3.73Å; W415-W489 HydrophobicContact CZ3-CZ3 3.73Å; W415-L492 HydrophobicContact CZ3-CD1 4.39Å
416	T	89.4	Confident	89.7	Confident	4 Å²	4	65.3 Å²	65.3	3%	0.025	36%	0.357	C	S	.	.	H	α-helix	trans	-73.8	-20.9	177.1	53	0	0	0	0	113.2	H412 E413 G418 K419 Q488 L492	H412-T416 WeakPolarHBondContact CE1-CG2 3.21Å; H412-T416 PolarHBondContact O-N 2.85Å; E413-T416 PolarHBondContact O-OG1 3.3Å; T416-G418 PolarHBondContact O-N 3.46Å; T416-K419 WeakPolarHBondContact O-CB 3.2Å; T416-K419 WeakPolarHBondContact O-CG 3.44Å; T416-K419 PolarHBondContact O-N 3.33Å; T416-Q488 PolarHBondContact OG1-OE1 3.19Å; T416-L492 HydrophobicContact CG2-CD1 3.68Å
417	D	90.8	Very high	89.4	Confident	135 Å²	135	64.3 Å²	64.3	72%	0.722	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	135.2	179.8	-167.7	21.6	0	0	0	112.5	W415 K419	W415-D417 VanDerWaalsContact C-N 3.3Å; D417-K419 PolarHBondContact O-N 3.17Å
418	G	85.8	Confident	88.8	Confident	47 Å²	47	60.2 Å²	60.2	49%	0.485	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	-11.6	-177.4	0	0	0	0	0	117.4	T416 E420 A421 M422	T416-G418 PolarHBondContact O-N 3.46Å; G418-E420 PolarHBondContact O-N 3.03Å; G418-A421 PolarHBondContact O-N 3.33Å; G418-M422 PolarHBondContact O-N 3.36Å
419	K	88.9	Confident	88.2	Confident	42 Å²	42	64 Å²	64	18%	0.183	35%	0.352	C	S	.	.	H	α-helix	trans	-65.1	-39.8	-175.1	-59.3	-64.3	-165.2	149.7	0	113.1	W415 T416 D417 A421 M422 L423 F446 D449 L492	W415-K419 WeakPolarHBondContact O-CE 3.32Å; W415-K419 WeakPolarHBondContact O-CG 3.41Å; T416-K419 WeakPolarHBondContact O-CB 3.2Å; T416-K419 WeakPolarHBondContact O-CG 3.44Å; T416-K419 PolarHBondContact O-N 3.33Å; D417-K419 PolarHBondContact O-N 3.17Å; K419-A421 VanDerWaalsContact C-N 3.27Å; K419-A421 PolarHBondContact O-N 3.26Å; K419-M422 WeakPolarHBondContact O-CB 3.44Å; K419-M422 PolarHBondContact O-N 2.96Å; K419-M422 VanDerWaalsContact O-N 3.11Å; K419-L423 PolarHBondContact O-N 3.26Å; K419-F446 HydrophobicContact CB-CE2 4.46Å; K419-F446 HydrophobicContact CB-CZ 4.39Å; K419-F446 HydrophobicContact CD-CE2 3.84Å; K419-F446 HydrophobicContact CG-CE2 4.36Å; K419-D449 IonicContact NZ-OD2 3.93Å; K419-L492 HydrophobicContact CB-CD2 3.88Å
420	E	88.8	Confident	87.3	Confident	73 Å²	73	70.5 Å²	70.5	34%	0.341	39%	0.392	S	S	.	.	H	α-helix	trans	-59.2	-37.1	176.8	-64.4	173.1	-148.3	0	0	112.3	G418 M422 L423 T424 Q488 L492 L495	G418-E420 PolarHBondContact O-N 3.03Å; E420-M422 VanDerWaalsContact C-N 3.35Å; E420-L423 PolarHBondContact O-N 3.45Å; E420-T424 PolarHBondContact O-OG1 3.35Å; E420-Q488 PolarHBondContact OE1-NE2 3.22Å; E420-L492 HydrophobicContact CG-CD2 3.64Å; E420-L492 HydrophobicContact CG-CG 4.33Å; E420-L495 HydrophobicContact CB-CD1 4.2Å; E420-L495 HydrophobicContact CG-CD1 4.23Å
421	A	87.5	Confident	86.7	Confident	64 Å²	64	69.9 Å²	69.9	53%	0.529	39%	0.385	S	S	.	.	H	α-helix	trans	-73	-25.3	178	0	0	0	0	0	113.3	G418 K419 T424	G418-A421 PolarHBondContact O-N 3.33Å; K419-A421 VanDerWaalsContact C-N 3.27Å; K419-A421 PolarHBondContact O-N 3.26Å; A421-T424 PolarHBondContact O-OG1 3.41Å
422	M	86.3	Confident	86.1	Confident	77 Å²	77	68.2 Å²	68.2	38%	0.379	38%	0.379	S	S	.	.	H	α-helix	trans	-71.4	-42.3	172.9	-173.1	-167.2	75.8	0	0	111.2	G418 K419 E420 T424 F446	G418-M422 PolarHBondContact O-N 3.36Å; K419-M422 WeakPolarHBondContact O-CB 3.44Å; K419-M422 PolarHBondContact O-N 2.96Å; K419-M422 VanDerWaalsContact O-N 3.11Å; E420-M422 VanDerWaalsContact C-N 3.35Å; M422-T424 PolarHBondContact O-N 3.47Å; M422-F446 HydrophobicContact CE-CB 4.46Å; M422-F446 HydrophobicContact CE-CD1 4.21Å; M422-F446 HydrophobicContact CE-CD2 3.87Å; M422-F446 HydrophobicContact CE-CE2 4.2Å; M422-F446 HydrophobicContact CE-CG 3.87Å
423	L	87.4	Confident	85.5	Confident	7 Å²	7	69.4 Å²	69.4	4%	0.037	39%	0.386	C	S	.	.	H	α-helix	trans	-67.5	-15.5	-174.1	-71.6	172.6	0	0	0	114.5	K419 E420 F446 L492 L495 T496 R499	K419-L423 PolarHBondContact O-N 3.26Å; E420-L423 PolarHBondContact O-N 3.45Å; L423-F446 HydrophobicContact CD1-CE1 3.94Å; L423-F446 HydrophobicContact CD1-CZ 4.28Å; L423-F446 HydrophobicContact CD2-CD1 4Å; L423-F446 HydrophobicContact CD2-CE1 3.74Å; L423-F446 HydrophobicContact CG-CE1 4.17Å; L423-L492 HydrophobicContact CD1-CD2 4.05Å; L423-L495 HydrophobicContact CB-CB 4.1Å; L423-L495 HydrophobicContact CD1-CB 3.79Å; L423-T496 WeakPolarHBondContact CD1-OG1 3.19Å; L423-R499 WeakPolarHBondContact O-CD 3.24Å
424	T	88	Confident	85.1	Confident	95 Å²	95	70.6 Å²	70.6	58%	0.583	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	3.7	-174.8	47.9	0	0	0	0	115	E420 A421 M422 L495	E420-T424 PolarHBondContact O-OG1 3.35Å; A421-T424 PolarHBondContact O-OG1 3.41Å; M422-T424 PolarHBondContact O-N 3.47Å; T424-L495 HydrophobicContact CG2-CD2 4.41Å
425	Q	87.1	Confident	84.7	Confident	112 Å²	112	70.5 Å²	70.5	52%	0.523	39%	0.39	S	S	.	.			trans	-78.7	159	-179.3	-59.6	-172.5	6.2	0	0	113.6	R499	Q425-R499 PolarHBondContact O-NH1 3.14Å
426	K	85.4	Confident	84.5	Confident	146 Å²	146	68.8 Å²	68.8	64%	0.635	38%	0.383	S	S	*	.			trans	-125.4	52.4	-177.9	-64.9	-168.9	174.4	-167	0	113.3	Y428	K426-Y428 HydrophobicContact CB-CE1 4.31Å; K426-Y428 HydrophobicContact CG-CE1 4.4Å
427	D	84.4	Confident	84.2	Confident	52 Å²	52	71.6 Å²	71.6	28%	0.278	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-74.7	-20.3	-176.8	46.8	-26.7	0	0	0	114.5	E429 L439 R499	D427-E429 PolarHBondContact O-N 3.27Å; D427-L439 HydrophobicContact CB-CD1 4.21Å; D427-L439 WeakPolarHBondContact OD2-CD2 3.3Å; D427-R499 IonicContact OD1-CZ 3.37Å; D427-R499 IonicContact OD1-NH1 2.89Å; D427-R499 PolarHBondContact OD1-NH1 3.33Å; D427-R499 IonicContact OD1-NH2 3.86Å; D427-R499 PolarHBondContact OD1-NH2 3.23Å; D427-R499 IonicContact OD2-NH2 3.33Å; D427-R499 PolarHBondContact OD2-NH2 3.24Å; D427-R499 VanDerWaalsContact OD2-NH2 3.09Å
428	Y	80.8	Confident	83.9	Confident	22 Å²	22	67.4 Å²	67.4	9%	0.086	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-77.1	-18.3	-173.1	54.6	-94.4	0	0	0	115.5	K426 T430 L503	K426-Y428 HydrophobicContact CB-CE1 4.31Å; K426-Y428 HydrophobicContact CG-CE1 4.4Å; Y428-T430 VanDerWaalsContact C-N 3.28Å; Y428-T430 PolarHBondContact O-N 3.46Å; Y428-L503 HydrophobicContact CD1-CD2 3.94Å; Y428-L503 HydrophobicContact CD1-CG 4.29Å; Y428-L503 HydrophobicContact CG-CD2 3.95Å
429	E	78.5	Confident	84	Confident	126 Å²	126	66.2 Å²	66.2	59%	0.589	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-70.7	-18.5	-171.3	-62.1	-177.5	178.1	0	0	114.1	D427	D427-E429 PolarHBondContact O-N 3.27Å
430	T	75.1	Confident	83.9	Confident	136 Å²	136	65 Å²	65	83%	0.834	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-116.6	7.4	-176.9	52.7	0	0	0	0	114.4	Y428	Y428-T430 VanDerWaalsContact C-N 3.28Å; Y428-T430 PolarHBondContact O-N 3.46Å
431	S	78.6	Confident	83.8	Confident	32 Å²	32	70.2 Å²	70.2	22%	0.224	37%	0.374	C	S	.	.			trans	-96.8	152.7	-170.5	-86.4	0	0	0	0	114	E435	S431-E435 WeakPolarHBondContact CA-OE2 3.47Å
432	T	78.9	Confident	83.7	Confident	63 Å²	63	74.2 Å²	74.2	39%	0.387	38%	0.379	S	S	.	.			trans	-71.1	164.6	169.8	59	0	0	0	0	111.5	S434 E435 V436	T432-S434 VanDerWaalsContact C-N 3.29Å; T432-S434 PolarHBondContact O-N 3.43Å; T432-S434 PolarHBondContact OG1-OG 3.48Å; T432-E435 PolarHBondContact N-OE2 3.32Å; T432-E435 CarbonylContact O-C 3.56Å; T432-E435 WeakPolarHBondContact O-CB 3.45Å; T432-E435 PolarHBondContact O-N 3.36Å; T432-E435 VanDerWaalsContact OG1-CG 3.29Å; T432-E435 WeakPolarHBondContact OG1-CG 3.5Å; T432-E435 PolarHBondContact OG1-OE2 3.48Å; T432-V436 WeakPolarHBondContact O-CG2 3.1Å; T432-V436 PolarHBondContact O-N 2.91Å
433	L	80.6	Confident	83.9	Confident	25 Å²	25	70.9 Å²	70.9	13%	0.131	36%	0.363	C	S	.	.	H	α-helix	trans	-58.2	-39.2	-178.9	-179.7	57.7	0	0	0	113.1	E435 V436 K437 E507 L510 E511 D514	L433-E435 VanDerWaalsContact C-N 3.33Å; L433-V436 PolarHBondContact O-N 3.36Å; L433-K437 HydrophobicContact CD1-CD 3.88Å; L433-K437 HydrophobicContact CD1-CG 3.98Å; L433-K437 HydrophobicContact CG-CD 4.1Å; L433-K437 HydrophobicContact CG-CG 4.47Å; L433-K437 VanDerWaalsContact O-CB 3.25Å; L433-K437 WeakPolarHBondContact O-CB 3.45Å; L433-K437 WeakPolarHBondContact O-CG 3.46Å; L433-K437 PolarHBondContact O-N 3.11Å; L433-E507 HydrophobicContact CD1-CG 4.38Å; L433-L510 HydrophobicContact CB-CB 4.01Å; L433-L510 HydrophobicContact CB-CD1 4.38Å; L433-L510 HydrophobicContact CD1-CB 3.72Å; L433-L510 HydrophobicContact CG-CB 4.28Å; L433-E511 HydrophobicContact CD1-CG 4.11Å; L433-D514 HydrophobicContact CD2-CB 3.39Å; L433-D514 WeakPolarHBondContact CD2-OD1 3.27Å
434	S	81.1	Confident	83.9	Confident	90 Å²	90	74.9 Å²	74.9	63%	0.629	38%	0.381	S	S	*	.	H	α-helix	trans	-67.5	-34.3	177	51.9	0	0	0	0	112.3	T432 A438	T432-S434 VanDerWaalsContact C-N 3.29Å; T432-S434 PolarHBondContact O-N 3.43Å; T432-S434 PolarHBondContact OG1-OG 3.48Å; S434-A438 WeakPolarHBondContact O-CB 3.48Å; S434-A438 PolarHBondContact O-N 2.97Å
435	E	83.6	Confident	83.9	Confident	96 Å²	96	73.3 Å²	73.3	45%	0.449	38%	0.378	S	S	.	.	H	α-helix	trans	-72.8	-43.6	174.1	-71	164.3	158.3	0	0	111.6	S431 T432 L433 A438 L439	S431-E435 WeakPolarHBondContact CA-OE2 3.47Å; T432-E435 PolarHBondContact N-OE2 3.32Å; T432-E435 CarbonylContact O-C 3.56Å; T432-E435 WeakPolarHBondContact O-CB 3.45Å; T432-E435 PolarHBondContact O-N 3.36Å; T432-E435 VanDerWaalsContact OG1-CG 3.29Å; T432-E435 WeakPolarHBondContact OG1-CG 3.5Å; T432-E435 PolarHBondContact OG1-OE2 3.48Å; L433-E435 VanDerWaalsContact C-N 3.33Å; E435-A438 CarbonylContact O-C 3.52Å; E435-A438 WeakPolarHBondContact O-CB 3.17Å; E435-A438 PolarHBondContact O-N 3.16Å; E435-A438 VanDerWaalsContact O-N 3.14Å; E435-L439 WeakPolarHBondContact O-CG 3.29Å; E435-L439 PolarHBondContact O-N 3.29Å
436	V	86.9	Confident	84	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-63.4	-43.3	174.6	177.3	0	0	0	0	110.4	T432 L433 A438 L439 L440 T506 E507 L510	T432-V436 WeakPolarHBondContact O-CG2 3.1Å; T432-V436 PolarHBondContact O-N 2.91Å; L433-V436 PolarHBondContact O-N 3.36Å; V436-A438 VanDerWaalsContact C-N 3.32Å; V436-A438 PolarHBondContact O-N 3.33Å; V436-L439 CarbonylContact O-C 3.55Å; V436-L439 WeakPolarHBondContact O-CB 3.42Å; V436-L439 PolarHBondContact O-N 3.38Å; V436-L440 WeakPolarHBondContact O-CB 3.24Å; V436-L440 PolarHBondContact O-N 2.98Å; V436-T506 HydrophobicContact CG1-CG2 4.39Å; V436-T506 HydrophobicContact CG2-CG2 4.16Å; V436-E507 HydrophobicContact CG1-CB 4.17Å; V436-L510 HydrophobicContact CG2-CD1 4.04Å
437	K	84	Confident	84.3	Confident	64 Å²	64	63.9 Å²	63.9	28%	0.278	34%	0.336	S	S	.	.	H	α-helix	trans	-65.9	-30.4	171.8	-78.4	-177.2	164.9	174.2	0	113	L433 R441 E507 E511	L433-K437 HydrophobicContact CD1-CD 3.88Å; L433-K437 HydrophobicContact CD1-CG 3.98Å; L433-K437 HydrophobicContact CG-CD 4.1Å; L433-K437 HydrophobicContact CG-CG 4.47Å; L433-K437 VanDerWaalsContact O-CB 3.25Å; L433-K437 WeakPolarHBondContact O-CB 3.45Å; L433-K437 WeakPolarHBondContact O-CG 3.46Å; L433-K437 PolarHBondContact O-N 3.11Å; K437-R441 WeakPolarHBondContact O-CB 3.42Å; K437-R441 WeakPolarHBondContact O-CG 3.37Å; K437-R441 PolarHBondContact O-N 2.82Å; K437-E507 WeakPolarHBondContact CE-OE1 3.47Å; K437-E507 HydrophobicContact CG-CG 4.39Å; K437-E507 VanDerWaalsContact CG-OE1 3.31Å; K437-E507 WeakPolarHBondContact CG-OE1 3.36Å; K437-E511 VanDerWaalsContact CE-OE1 3.24Å; K437-E511 WeakPolarHBondContact CE-OE1 3.44Å; K437-E511 IonicContact NZ-OE1 2.82Å; K437-E511 PolarHBondContact NZ-OE1 3.33Å
438	A	84.2	Confident	84.4	Confident	46 Å²	46	65.1 Å²	65.1	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-73.4	-32.6	171.9	0	0	0	0	0	112.4	S434 E435 V436 K442	S434-A438 WeakPolarHBondContact O-CB 3.48Å; S434-A438 PolarHBondContact O-N 2.97Å; E435-A438 CarbonylContact O-C 3.52Å; E435-A438 WeakPolarHBondContact O-CB 3.17Å; E435-A438 PolarHBondContact O-N 3.16Å; E435-A438 VanDerWaalsContact O-N 3.14Å; V436-A438 VanDerWaalsContact C-N 3.32Å; V436-A438 PolarHBondContact O-N 3.33Å; A438-K442 WeakPolarHBondContact O-CB 3.48Å; A438-K442 VanDerWaalsContact O-CG 3.26Å; A438-K442 WeakPolarHBondContact O-CG 3.38Å; A438-K442 PolarHBondContact O-N 3.25Å
439	L	87.8	Confident	84.7	Confident	23 Å²	23	66.8 Å²	66.8	12%	0.12	36%	0.359	C	S	.	.	H	α-helix	trans	-70	-41.3	170.2	-69.9	177.1	0	0	0	111	D427 E435 V436 K442 H443 L503	D427-L439 HydrophobicContact CB-CD1 4.21Å; D427-L439 WeakPolarHBondContact OD2-CD2 3.3Å; E435-L439 WeakPolarHBondContact O-CG 3.29Å; E435-L439 PolarHBondContact O-N 3.29Å; V436-L439 CarbonylContact O-C 3.55Å; V436-L439 WeakPolarHBondContact O-CB 3.42Å; V436-L439 PolarHBondContact O-N 3.38Å; L439-K442 HydrophobicContact CD2-CD 4.47Å; L439-K442 PolarHBondContact O-N 3.22Å; L439-H443 VanDerWaalsContact O-CB 3.31Å; L439-H443 WeakPolarHBondContact O-CB 3.44Å; L439-H443 PolarHBondContact O-N 2.91Å; L439-L503 HydrophobicContact CB-CD2 3.91Å
440	L	87.5	Confident	85.3	Confident	16 Å²	16	61.7 Å²	61.7	8%	0.084	34%	0.336	C	S	.	.	H	α-helix	trans	-60.9	-47.4	173.4	-152.5	124.7	0	0	0	110.1	V436 K442 H443 E444 L503 E504 E507	V436-L440 WeakPolarHBondContact O-CB 3.24Å; V436-L440 PolarHBondContact O-N 2.98Å; L440-K442 PolarHBondContact O-N 2.84Å; L440-H443 CarbonylContact O-C 3.51Å; L440-H443 WeakPolarHBondContact O-CA 3.35Å; L440-H443 VanDerWaalsContact O-CB 3.3Å; L440-H443 WeakPolarHBondContact O-CB 3.48Å; L440-H443 PolarHBondContact O-N 3.19Å; L440-E444 HydrophobicContact CD2-CG 4.4Å; L440-E444 WeakPolarHBondContact O-CG 3.19Å; L440-E444 PolarHBondContact O-N 2.8Å; L440-L503 HydrophobicContact CD1-CB 3.93Å; L440-E504 HydrophobicContact CD1-CG 4.11Å; L440-E507 HydrophobicContact CD1-CB 4.32Å; L440-E507 WeakPolarHBondContact CD1-OE2 3.32Å
441	R	85.3	Confident	85.9	Confident	183 Å²	183	58.4 Å²	58.4	69%	0.691	32%	0.322	S	S	*	.	H	α-helix	trans	-65.6	-33.5	173.8	-77.4	-177.7	-179.4	178.3	3	114.8	K437 H443 E444 A445	K437-R441 WeakPolarHBondContact O-CB 3.42Å; K437-R441 WeakPolarHBondContact O-CG 3.37Å; K437-R441 PolarHBondContact O-N 2.82Å; R441-H443 VanDerWaalsContact C-N 3.27Å; R441-E444 WeakPolarHBondContact CG-OE2 3.19Å; R441-A445 WeakPolarHBondContact O-CB 3.44Å; R441-A445 PolarHBondContact O-N 2.72Å
442	K	86.4	Confident	86.4	Confident	147 Å²	147	60 Å²	60	64%	0.639	34%	0.337	S	S	*	.	H	α-helix	trans	-66.5	-34.8	170.1	-80.8	173.3	178.6	179.4	0	110.9	A438 L439 L440 F446	A438-K442 WeakPolarHBondContact O-CB 3.48Å; A438-K442 VanDerWaalsContact O-CG 3.26Å; A438-K442 WeakPolarHBondContact O-CG 3.38Å; A438-K442 PolarHBondContact O-N 3.25Å; L439-K442 HydrophobicContact CD2-CD 4.47Å; L439-K442 PolarHBondContact O-N 3.22Å; L440-K442 PolarHBondContact O-N 2.84Å; K442-F446 WeakPolarHBondContact O-CB 3.17Å; K442-F446 PolarHBondContact O-N 2.81Å
443	H	90.6	Very high	86.8	Confident	8 Å²	8	57.6 Å²	57.6	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-72.7	-40.7	175.5	-164.7	82	0	0	0	111.7	L439 L440 R441 F446 E447 T496 R499 L503	L439-H443 VanDerWaalsContact O-CB 3.31Å; L439-H443 WeakPolarHBondContact O-CB 3.44Å; L439-H443 PolarHBondContact O-N 2.91Å; L440-H443 CarbonylContact O-C 3.51Å; L440-H443 WeakPolarHBondContact O-CA 3.35Å; L440-H443 VanDerWaalsContact O-CB 3.3Å; L440-H443 WeakPolarHBondContact O-CB 3.48Å; L440-H443 PolarHBondContact O-N 3.19Å; R441-H443 VanDerWaalsContact C-N 3.27Å; H443-F446 CarbonylContact O-C 3.6Å; H443-F446 WeakPolarHBondContact O-CA 3.4Å; H443-F446 WeakPolarHBondContact O-CB 3.47Å; H443-F446 PolarHBondContact O-N 3.14Å; H443-E447 WeakPolarHBondContact O-CG 3.35Å; H443-E447 PolarHBondContact O-N 3.36Å; H443-T496 PolarHBondContact CE1-O 3.37Å; H443-T496 VanDerWaalsContact CE1-O 3.29Å; H443-T496 WeakPolarHBondContact NE2-CG2 3.4Å; H443-T496 PolarHBondContact NE2-O 3.17Å; H443-R499 WeakPolarHBondContact ND1-CD 3.35Å; H443-L503 HydrophobicContact CB-CD1 3.93Å
444	E	88.1	Confident	87.3	Confident	90 Å²	90	59.9 Å²	59.9	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-64.8	-40	170.9	-70.2	174.3	149.5	0	0	111.7	L440 R441 F446 E447 S448	L440-E444 HydrophobicContact CD2-CG 4.4Å; L440-E444 WeakPolarHBondContact O-CG 3.19Å; L440-E444 PolarHBondContact O-N 2.8Å; R441-E444 WeakPolarHBondContact CG-OE2 3.19Å; E444-F446 VanDerWaalsContact C-N 3.26Å; E444-F446 PolarHBondContact O-N 2.83Å; E444-E447 CarbonylContact O-C 3.57Å; E444-E447 PolarHBondContact O-N 3.46Å; E444-S448 VanDerWaalsContact O-CB 3.26Å; E444-S448 WeakPolarHBondContact O-CB 3.29Å; E444-S448 PolarHBondContact O-N 2.93Å
445	A	86.3	Confident	87.8	Confident	63 Å²	63	59.7 Å²	59.7	52%	0.521	32%	0.324	S	S	.	.	H	α-helix	trans	-64.9	-34.2	173	0	0	0	0	0	111.1	R441 D449	R441-A445 WeakPolarHBondContact O-CB 3.44Å; R441-A445 PolarHBondContact O-N 2.72Å; A445-D449 WeakPolarHBondContact O-CB 3.25Å; A445-D449 PolarHBondContact O-N 2.99Å
446	F	90.5	Very high	88.1	Confident	13 Å²	13	58.3 Å²	58.3	6%	0.057	31%	0.314	C	S	.	.	H	α-helix	trans	-72.1	-39.2	170.9	178.4	-100.6	0	0	0	112.5	W415 K419 M422 L423 K442 H443 E444 S448 D449 L450 T496	W415-F446 HydrophobicContact CZ2-CE2 4.29Å; K419-F446 HydrophobicContact CB-CE2 4.46Å; K419-F446 HydrophobicContact CB-CZ 4.39Å; K419-F446 HydrophobicContact CD-CE2 3.84Å; K419-F446 HydrophobicContact CG-CE2 4.36Å; M422-F446 HydrophobicContact CE-CB 4.46Å; M422-F446 HydrophobicContact CE-CD1 4.21Å; M422-F446 HydrophobicContact CE-CD2 3.87Å; M422-F446 HydrophobicContact CE-CE2 4.2Å; M422-F446 HydrophobicContact CE-CG 3.87Å; L423-F446 HydrophobicContact CD1-CE1 3.94Å; L423-F446 HydrophobicContact CD1-CZ 4.28Å; L423-F446 HydrophobicContact CD2-CD1 4Å; L423-F446 HydrophobicContact CD2-CE1 3.74Å; L423-F446 HydrophobicContact CG-CE1 4.17Å; K442-F446 WeakPolarHBondContact O-CB 3.17Å; K442-F446 PolarHBondContact O-N 2.81Å; H443-F446 CarbonylContact O-C 3.6Å; H443-F446 WeakPolarHBondContact O-CA 3.4Å; H443-F446 WeakPolarHBondContact O-CB 3.47Å; H443-F446 PolarHBondContact O-N 3.14Å; E444-F446 VanDerWaalsContact C-N 3.26Å; E444-F446 PolarHBondContact O-N 2.83Å; F446-S448 VanDerWaalsContact C-N 3.25Å; F446-S448 PolarHBondContact O-N 3.36Å; F446-D449 PolarHBondContact O-N 3.35Å; F446-L450 WeakPolarHBondContact O-CB 3.36Å; F446-L450 PolarHBondContact O-N 2.95Å; F446-T496 HydrophobicContact CD1-CG2 4.26Å; F446-T496 HydrophobicContact CE1-CG2 4.28Å
447	E	90.8	Very high	88.4	Confident	47 Å²	47	58.7 Å²	58.7	22%	0.22	32%	0.317	C	S	.	.	H	α-helix	trans	-63.1	-32.2	171.4	-77.2	-174.3	137.6	0	0	111.7	H443 E444 A451 T496 K500	H443-E447 WeakPolarHBondContact O-CG 3.35Å; H443-E447 PolarHBondContact O-N 3.36Å; E444-E447 CarbonylContact O-C 3.57Å; E444-E447 PolarHBondContact O-N 3.46Å; E447-A451 WeakPolarHBondContact O-CB 3.4Å; E447-A451 PolarHBondContact O-N 2.87Å; E447-T496 HydrophobicContact CG-CG2 3.48Å; E447-T496 VanDerWaalsContact CG-CG2 3.48Å; E447-K500 WeakPolarHBondContact OE1-CD 3.28Å; E447-K500 IonicContact OE1-NZ 2.68Å; E447-K500 PolarHBondContact OE1-NZ 2.9Å; E447-K500 IonicContact OE2-NZ 3.85Å; E447-K500 PolarHBondContact OE2-NZ 3.49Å
448	S	86.4	Confident	88.7	Confident	77 Å²	77	60.8 Å²	60.8	54%	0.538	33%	0.327	S	S	.	.	H	α-helix	trans	-78.4	-37.9	175.6	-171.2	0	0	0	0	112.4	E444 F446 L450 A451 A452	E444-S448 VanDerWaalsContact O-CB 3.26Å; E444-S448 WeakPolarHBondContact O-CB 3.29Å; E444-S448 PolarHBondContact O-N 2.93Å; F446-S448 VanDerWaalsContact C-N 3.25Å; F446-S448 PolarHBondContact O-N 3.36Å; S448-L450 VanDerWaalsContact C-N 3.35Å; S448-A451 PolarHBondContact O-N 3.28Å; S448-A452 VanDerWaalsContact O-CB 3.26Å; S448-A452 WeakPolarHBondContact O-CB 3.2Å; S448-A452 PolarHBondContact O-N 3.5Å
449	D	88	Confident	89.1	Confident	57 Å²	57	61.6 Å²	61.6	31%	0.305	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-43.4	169.7	-169.4	47.3	0	0	0	110.3	W415 K419 A445 F446 A452 H453	W415-D449 WeakPolarHBondContact CZ2-OD2 3.24Å; W415-D449 PolarHBondContact NE1-OD2 2.83Å; K419-D449 IonicContact NZ-OD2 3.93Å; A445-D449 WeakPolarHBondContact O-CB 3.25Å; A445-D449 PolarHBondContact O-N 2.99Å; F446-D449 PolarHBondContact O-N 3.35Å; D449-A452 PolarHBondContact O-N 3.36Å; D449-H453 WeakPolarHBondContact O-CB 3.41Å; D449-H453 PolarHBondContact O-CD2 3.36Å; D449-H453 VanDerWaalsContact O-CD2 3.25Å; D449-H453 PolarHBondContact O-N 2.59Å
450	L	90	Very high	89.4	Confident	20 Å²	20	60.5 Å²	60.5	11%	0.105	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-49.5	171.3	-174.4	71.8	0	0	0	110.9	W415 F446 S448 A452 H453 Q454 W489 L492 T496	W415-L450 HydrophobicContact CH2-CB 4.46Å; W415-L450 HydrophobicContact CH2-CD1 3.77Å; W415-L450 HydrophobicContact CZ3-CD1 4.4Å; F446-L450 WeakPolarHBondContact O-CB 3.36Å; F446-L450 PolarHBondContact O-N 2.95Å; S448-L450 VanDerWaalsContact C-N 3.35Å; L450-A452 VanDerWaalsContact C-N 3.33Å; L450-A452 PolarHBondContact O-N 3.4Å; L450-H453 CarbonylContact O-C 3.34Å; L450-H453 WeakPolarHBondContact O-CA 3.43Å; L450-H453 PolarHBondContact O-N 2.99Å; L450-Q454 PolarHBondContact O-N 3.3Å; L450-W489 HydrophobicContact CD1-CE3 4.23Å; L450-W489 HydrophobicContact CD1-CH2 3.51Å; L450-W489 HydrophobicContact CD1-CZ2 3.85Å; L450-W489 HydrophobicContact CD1-CZ3 3.72Å; L450-W489 HydrophobicContact CG-CH2 4.09Å; L450-W489 HydrophobicContact CG-CZ2 4.15Å; L450-W489 WeakPolarHBondContact O-CH2 3.46Å; L450-W489 WeakPolarHBondContact O-CZ2 3.17Å; L450-L492 HydrophobicContact CD1-CB 4.49Å; L450-T496 HydrophobicContact CD2-CG2 4.22Å
451	A	88.5	Confident	89.7	Confident	67 Å²	67	61.5 Å²	61.5	55%	0.554	33%	0.328	S	S	*	.	H	α-helix	trans	-63.7	-35.3	176.8	0	0	0	0	0	112.9	E447 S448 H453 Q454	E447-A451 WeakPolarHBondContact O-CB 3.4Å; E447-A451 PolarHBondContact O-N 2.87Å; S448-A451 PolarHBondContact O-N 3.28Å; A451-H453 VanDerWaalsContact C-N 3.26Å; A451-H453 PolarHBondContact O-N 3.46Å; A451-Q454 WeakPolarHBondContact O-CB 3.19Å; A451-Q454 PolarHBondContact O-N 3.31Å
452	A	88.1	Confident	90	Very high	65 Å²	65	55.3 Å²	55.3	54%	0.537	32%	0.316	S	S	.	.	H	α-helix	trans	-70.4	-23.8	173.1	0	0	0	0	0	112.6	S448 D449 L450	S448-A452 VanDerWaalsContact O-CB 3.26Å; S448-A452 WeakPolarHBondContact O-CB 3.2Å; S448-A452 PolarHBondContact O-N 3.5Å; D449-A452 PolarHBondContact O-N 3.36Å; L450-A452 VanDerWaalsContact C-N 3.33Å; L450-A452 PolarHBondContact O-N 3.4Å
453	H	89.2	Confident	90.3	Very high	13 Å²	13	48.7 Å²	48.7	6%	0.06	29%	0.287	C	S	.	.	H	α-helix	trans	-85.7	-14.5	173.6	-84.1	-134.8	0	0	0	113.4	W415 D449 L450 A451 D455 R456 V457 W489	W415-H453 AromaticContact CD1-CE1 3.23Å; W415-H453 AromaticContact CD1-ND1 3.9Å; W415-H453 AromaticContact CD1-NE2 3.95Å; W415-H453 AromaticContact CD2-CE1 3.38Å; W415-H453 AromaticContact CD2-ND1 3.2Å; W415-H453 AromaticContact CE2-CE1 3.49Å; W415-H453 VanDerWaalsContact CE2-CE1 3.49Å; W415-H453 AromaticContact CE2-CG 3.99Å; W415-H453 AromaticContact CE2-ND1 3.41Å; W415-H453 AromaticContact CE3-ND1 3.49Å; W415-H453 AromaticContact CG-CE1 3.23Å; W415-H453 AromaticContact CG-ND1 3.57Å; W415-H453 HydrophobicContact CH2-CB 4.29Å; W415-H453 HydrophobicContact CZ2-CB 4.43Å; W415-H453 AromaticContact CZ2-ND1 3.9Å; W415-H453 HydrophobicContact CZ3-CB 4.47Å; W415-H453 AromaticContact CZ3-ND1 3.98Å; W415-H453 AromaticContact NE1-CE1 3.35Å; W415-H453 PolarHBondContact NE1-CE1 2.96Å; W415-H453 AromaticContact NE1-ND1 3.78Å; W415-H453 AromaticContact NE1-NE2 3.82Å; D449-H453 WeakPolarHBondContact O-CB 3.41Å; D449-H453 PolarHBondContact O-CD2 3.36Å; D449-H453 VanDerWaalsContact O-CD2 3.25Å; D449-H453 PolarHBondContact O-N 2.59Å; L450-H453 CarbonylContact O-C 3.34Å; L450-H453 WeakPolarHBondContact O-CA 3.43Å; L450-H453 PolarHBondContact O-N 2.99Å; A451-H453 VanDerWaalsContact C-N 3.26Å; A451-H453 PolarHBondContact O-N 3.46Å; H453-D455 PolarHBondContact O-N 3.24Å; H453-R456 VanDerWaalsContact CE1-CZ 3.49Å; H453-R456 PolarHBondContact CE1-NH1 3.18Å; H453-R456 PolarHBondContact NE2-NH1 3.17Å; H453-R456 PolarHBondContact NE2-NH2 3.45Å; H453-R456 WeakPolarHBondContact O-CA 3.47Å; H453-R456 VanDerWaalsContact O-CB 3.27Å; H453-R456 WeakPolarHBondContact O-CB 3.37Å; H453-R456 PolarHBondContact O-N 3.47Å; H453-V457 PolarHBondContact O-N 3.04Å; H453-V457 VanDerWaalsContact O-N 3.1Å; H453-W489 HydrophobicContact CB-CH2 3.56Å; H453-W489 HydrophobicContact CB-CZ3 3.94Å
454	Q	90.9	Very high	90.4	Very high	72 Å²	72	48.4 Å²	48.4	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-53.7	-52.4	172.8	180	67.5	27.6	0	0	111.6	L450 A451 R456 V457 E458 W489	L450-Q454 PolarHBondContact O-N 3.3Å; A451-Q454 WeakPolarHBondContact O-CB 3.19Å; A451-Q454 PolarHBondContact O-N 3.31Å; Q454-R456 PolarHBondContact O-N 3.36Å; Q454-R456 VanDerWaalsContact O-N 3.17Å; Q454-V457 PolarHBondContact O-N 3.32Å; Q454-E458 WeakPolarHBondContact CG-OE1 3.19Å; Q454-E458 PolarHBondContact NE2-OE1 2.95Å; Q454-E458 WeakPolarHBondContact O-CG 3.05Å; Q454-E458 PolarHBondContact O-N 3.44Å; Q454-W489 HydrophobicContact CB-CZ2 4.07Å
455	D	90	Very high	90.6	Very high	87 Å²	87	49.6 Å²	49.6	47%	0.465	29%	0.292	S	S	.	.	H	α-helix	trans	-56	-32.5	175.4	164.6	71.6	0	0	0	112.1	H453 Q459	H453-D455 PolarHBondContact O-N 3.24Å; D455-Q459 VanDerWaalsContact O-CB 3.25Å; D455-Q459 WeakPolarHBondContact O-CB 3.42Å; D455-Q459 WeakPolarHBondContact O-CG 3.21Å; D455-Q459 PolarHBondContact O-N 3.39Å; D455-Q459 PolarHBondContact OD1-NE2 3.15Å; D455-Q459 PolarHBondContact OD2-NE2 3.28Å
456	R	90.3	Very high	90.8	Very high	66 Å²	66	48.8 Å²	48.8	25%	0.249	28%	0.278	C	S	.	.	H	α-helix	trans	-69.7	-40.8	176.1	-167.2	176.9	-56.2	160.9	18.2	111.9	H453 Q454 I460	H453-R456 VanDerWaalsContact CE1-CZ 3.49Å; H453-R456 PolarHBondContact CE1-NH1 3.18Å; H453-R456 PolarHBondContact NE2-NH1 3.17Å; H453-R456 PolarHBondContact NE2-NH2 3.45Å; H453-R456 WeakPolarHBondContact O-CA 3.47Å; H453-R456 VanDerWaalsContact O-CB 3.27Å; H453-R456 WeakPolarHBondContact O-CB 3.37Å; H453-R456 PolarHBondContact O-N 3.47Å; Q454-R456 PolarHBondContact O-N 3.36Å; Q454-R456 VanDerWaalsContact O-N 3.17Å; R456-I460 HydrophobicContact CG-CD1 4.2Å; R456-I460 WeakPolarHBondContact O-CD1 3.35Å; R456-I460 WeakPolarHBondContact O-CG1 3.44Å; R456-I460 PolarHBondContact O-N 3.46Å
457	V	92.9	Very high	90.9	Very high	9 Å²	9	48.1 Å²	48.1	6%	0.055	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-45.7	175.9	178.3	0	0	0	0	110.4	H412 H453 Q454 Q459 I460 A461 I485 W489	H412-V457 VanDerWaalsContact NE2-CG2 3.25Å; H412-V457 WeakPolarHBondContact NE2-CG2 3.49Å; H453-V457 PolarHBondContact O-N 3.04Å; H453-V457 VanDerWaalsContact O-N 3.1Å; Q454-V457 PolarHBondContact O-N 3.32Å; V457-Q459 VanDerWaalsContact C-N 3.33Å; V457-Q459 PolarHBondContact O-N 3.42Å; V457-I460 PolarHBondContact O-N 2.83Å; V457-I460 VanDerWaalsContact O-N 3.11Å; V457-A461 PolarHBondContact O-N 3.3Å; V457-I485 HydrophobicContact CG1-CG2 4.49Å; V457-W489 HydrophobicContact CG2-CD2 3.81Å; V457-W489 HydrophobicContact CG2-CE3 3.62Å; V457-W489 HydrophobicContact CG2-CG 4.34Å; V457-W489 HydrophobicContact CG2-CH2 4.26Å; V457-W489 HydrophobicContact CG2-CZ2 4.46Å; V457-W489 HydrophobicContact CG2-CZ3 3.85Å
458	E	91.6	Very high	90.9	Very high	107 Å²	107	48.8 Å²	48.8	50%	0.5	28%	0.28	S	S	.	.	H	α-helix	trans	-59.3	-42.5	175.4	-70.8	176.6	-173.1	0	0	111.6	Q454 A461 A462	Q454-E458 WeakPolarHBondContact CG-OE1 3.19Å; Q454-E458 PolarHBondContact NE2-OE1 2.95Å; Q454-E458 WeakPolarHBondContact O-CG 3.05Å; Q454-E458 PolarHBondContact O-N 3.44Å; E458-A461 PolarHBondContact O-N 2.92Å; E458-A462 VanDerWaalsContact O-CB 3.25Å; E458-A462 WeakPolarHBondContact O-CB 3.39Å; E458-A462 PolarHBondContact O-N 2.84Å
459	Q	92.9	Very high	91.1	Very high	64 Å²	64	51.4 Å²	51.4	30%	0.299	28%	0.283	S	S	.	.	H	α-helix	trans	-66.3	-36.3	173.5	-75.6	171.9	23.5	0	0	113.3	D455 V457 I463	D455-Q459 VanDerWaalsContact O-CB 3.25Å; D455-Q459 WeakPolarHBondContact O-CB 3.42Å; D455-Q459 WeakPolarHBondContact O-CG 3.21Å; D455-Q459 PolarHBondContact O-N 3.39Å; D455-Q459 PolarHBondContact OD1-NE2 3.15Å; D455-Q459 PolarHBondContact OD2-NE2 3.28Å; V457-Q459 VanDerWaalsContact C-N 3.33Å; V457-Q459 PolarHBondContact O-N 3.42Å; Q459-I463 WeakPolarHBondContact O-CB 3.28Å; Q459-I463 WeakPolarHBondContact O-CD1 3.22Å; Q459-I463 WeakPolarHBondContact O-CG1 3.49Å; Q459-I463 PolarHBondContact O-N 3.5Å
460	I	93.8	Very high	91.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-44.7	175.2	-73	161.8	0	0	0	109.8	F405 K408 H412 R456 V457 A464 I485	F405-I460 HydrophobicContact CD2-CG2 4.08Å; F405-I460 HydrophobicContact CE2-CG2 3.61Å; F405-I460 HydrophobicContact CZ-CG2 4.48Å; K408-I460 HydrophobicContact CB-CD1 4.13Å; K408-I460 HydrophobicContact CB-CG1 3.71Å; H412-I460 HydrophobicContact CB-CD1 3.84Å; R456-I460 HydrophobicContact CG-CD1 4.2Å; R456-I460 WeakPolarHBondContact O-CD1 3.35Å; R456-I460 WeakPolarHBondContact O-CG1 3.44Å; R456-I460 PolarHBondContact O-N 3.46Å; V457-I460 PolarHBondContact O-N 2.83Å; V457-I460 VanDerWaalsContact O-N 3.11Å; I460-A464 WeakPolarHBondContact O-CB 3.44Å; I460-A464 PolarHBondContact O-N 3.17Å; I460-I485 HydrophobicContact CG2-CD1 4.35Å
461	A	93	Very high	91	Very high	37 Å²	37	56.2 Å²	56.2	31%	0.306	31%	0.309	S	S	.	.	H	α-helix	trans	-65.7	-43.9	176.1	0	0	0	0	0	112.6	V457 E458 A464 Q465	V457-A461 PolarHBondContact O-N 3.3Å; E458-A461 PolarHBondContact O-N 2.92Å; A461-A464 WeakPolarHBondContact O-CB 2.97Å; A461-A464 PolarHBondContact O-N 3.4Å; A461-Q465 PolarHBondContact O-N 2.77Å
462	A	92.5	Very high	91	Very high	52 Å²	52	54.2 Å²	54.2	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-41.8	177.5	0	0	0	0	0	112.2	E458 Q465 E466	E458-A462 VanDerWaalsContact O-CB 3.25Å; E458-A462 WeakPolarHBondContact O-CB 3.39Å; E458-A462 PolarHBondContact O-N 2.84Å; A462-Q465 PolarHBondContact O-N 3.32Å; A462-E466 WeakPolarHBondContact O-CB 3.4Å; A462-E466 PolarHBondContact O-N 2.96Å
463	I	92.9	Very high	90.9	Very high	8 Å²	8	59.5 Å²	59.5	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-66.4	-39	174.9	-67.2	163.6	0	0	0	110.6	L401 K404 F405 K408 Q459 E466 L467	L401-I463 HydrophobicContact CB-CG2 4.25Å; L401-I463 HydrophobicContact CD2-CG2 4.2Å; L401-I463 WeakPolarHBondContact O-CG2 3.34Å; K404-I463 HydrophobicContact CD-CD1 3.9Å; K404-I463 HydrophobicContact CG-CD1 4.02Å; F405-I463 HydrophobicContact CB-CG2 3.87Å; K408-I463 HydrophobicContact CD-CD1 3.82Å; Q459-I463 WeakPolarHBondContact O-CB 3.28Å; Q459-I463 WeakPolarHBondContact O-CD1 3.22Å; Q459-I463 WeakPolarHBondContact O-CG1 3.49Å; Q459-I463 PolarHBondContact O-N 3.5Å; I463-E466 PolarHBondContact O-N 3.48Å; I463-L467 HydrophobicContact CG2-CD1 4.05Å; I463-L467 HydrophobicContact CG2-CG 4.48Å; I463-L467 WeakPolarHBondContact O-CB 3.41Å; I463-L467 VanDerWaalsContact O-CG 3.27Å; I463-L467 WeakPolarHBondContact O-CG 3.29Å; I463-L467 PolarHBondContact O-N 3.32Å
464	A	91.9	Very high	90.9	Very high	3 Å²	3	61.8 Å²	61.8	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-41.6	174.1	0	0	0	0	0	111.8	F405 I460 A461 L467 N468 V478 C482	F405-A464 HydrophobicContact CD2-CB 4.28Å; F405-A464 HydrophobicContact CE2-CB 3.94Å; I460-A464 WeakPolarHBondContact O-CB 3.44Å; I460-A464 PolarHBondContact O-N 3.17Å; A461-A464 WeakPolarHBondContact O-CB 2.97Å; A461-A464 PolarHBondContact O-N 3.4Å; A464-L467 PolarHBondContact O-N 3.29Å; A464-N468 PolarHBondContact O-N 3.09Å; A464-N468 VanDerWaalsContact O-N 3.13Å; A464-N468 PolarHBondContact O-ND2 3.26Å; A464-V478 HydrophobicContact CB-CG1 3.72Å; A464-C482 HydrophobicContact CB-CB 4.11Å
465	Q	91.6	Very high	90.9	Very high	114 Å²	114	59 Å²	59	53%	0.533	30%	0.297	S	S	.	.	H	α-helix	trans	-63.9	-47.3	174	-175.1	179.9	-29.6	0	0	111.7	A461 A462 L467 N468 E469	A461-Q465 PolarHBondContact O-N 2.77Å; A462-Q465 PolarHBondContact O-N 3.32Å; Q465-L467 VanDerWaalsContact C-N 3.26Å; Q465-L467 PolarHBondContact O-N 3.29Å; Q465-N468 WeakPolarHBondContact O-CA 3.36Å; Q465-N468 WeakPolarHBondContact O-CB 3.49Å; Q465-N468 PolarHBondContact O-N 3.39Å; Q465-E469 HydrophobicContact CG-CG 4.45Å; Q465-E469 WeakPolarHBondContact CG-OE1 3.47Å; Q465-E469 PolarHBondContact NE2-OE1 2.9Å; Q465-E469 WeakPolarHBondContact O-CG 3.4Å; Q465-E469 PolarHBondContact O-N 3.35Å
466	E	92.1	Very high	90.9	Very high	46 Å²	46	58.7 Å²	58.7	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-58.7	-36.8	177	-169.8	-176.8	170.2	0	0	111.9	R397 L401 A462 I463 E469 L470	R397-E466 IonicContact CZ-OE1 3.51Å; R397-E466 IonicContact NE-OE1 3.95Å; R397-E466 PolarHBondContact NE-OE1 2.87Å; R397-E466 IonicContact NH2-OE1 3.89Å; R397-E466 PolarHBondContact NH2-OE1 2.62Å; L401-E466 HydrophobicContact CD1-CB 4.46Å; L401-E466 VanDerWaalsContact CD1-CD 3.46Å; L401-E466 HydrophobicContact CD1-CG 3.76Å; L401-E466 WeakPolarHBondContact CD1-OE1 3.44Å; L401-E466 WeakPolarHBondContact CD2-OE2 3.45Å; A462-E466 WeakPolarHBondContact O-CB 3.4Å; A462-E466 PolarHBondContact O-N 2.96Å; I463-E466 PolarHBondContact O-N 3.48Å; E466-E469 PolarHBondContact O-N 3.19Å; E466-L470 HydrophobicContact CG-CD1 4.27Å; E466-L470 WeakPolarHBondContact O-CB 3.49Å; E466-L470 VanDerWaalsContact O-CG 3.3Å; E466-L470 WeakPolarHBondContact O-CG 3.44Å; E466-L470 PolarHBondContact O-N 2.87Å; E466-L470 VanDerWaalsContact O-N 3.15Å
467	L	92.5	Very high	91	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-33.6	172.8	-75.4	167.3	0	0	0	113	L398 L401 A402 F405 I463 A464 Q465 Y472 V478	L398-L467 HydrophobicContact CD2-CD2 3.69Å; L401-L467 HydrophobicContact CB-CD1 4.47Å; L401-L467 HydrophobicContact CB-CD2 3.64Å; L401-L467 HydrophobicContact CB-CG 4Å; L401-L467 HydrophobicContact CD1-CD2 4.42Å; A402-L467 HydrophobicContact CB-CD2 4.31Å; F405-L467 HydrophobicContact CB-CD1 4.17Å; I463-L467 HydrophobicContact CG2-CD1 4.05Å; I463-L467 HydrophobicContact CG2-CG 4.48Å; I463-L467 WeakPolarHBondContact O-CB 3.41Å; I463-L467 VanDerWaalsContact O-CG 3.27Å; I463-L467 WeakPolarHBondContact O-CG 3.29Å; I463-L467 PolarHBondContact O-N 3.32Å; A464-L467 PolarHBondContact O-N 3.29Å; Q465-L467 VanDerWaalsContact C-N 3.26Å; Q465-L467 PolarHBondContact O-N 3.29Å; L467-Y472 HydrophobicContact CD2-CD1 4.38Å; L467-Y472 HydrophobicContact CD2-CD2 4.23Å; L467-Y472 HydrophobicContact CD2-CG 4Å; L467-Y472 WeakPolarHBondContact O-CB 3.34Å; L467-Y472 PolarHBondContact O-N 2.79Å; L467-V478 HydrophobicContact CD1-CG1 4.02Å; L467-V478 HydrophobicContact CD1-CG2 4.41Å
468	N	90.4	Very high	91	Very high	60 Å²	60	58 Å²	58	32%	0.321	31%	0.312	S	S	.	.	H	α-helix	trans	-70.1	-45.9	171.6	-71.5	-74.1	0	0	0	111.6	A464 Q465 L470 D471 A475 N479	A464-N468 PolarHBondContact O-N 3.09Å; A464-N468 VanDerWaalsContact O-N 3.13Å; A464-N468 PolarHBondContact O-ND2 3.26Å; Q465-N468 WeakPolarHBondContact O-CA 3.36Å; Q465-N468 WeakPolarHBondContact O-CB 3.49Å; Q465-N468 PolarHBondContact O-N 3.39Å; N468-L470 PolarHBondContact O-N 2.68Å; N468-D471 PolarHBondContact O-N 2.84Å; N468-A475 WeakPolarHBondContact OD1-CB 3.31Å; N468-N479 PolarHBondContact ND2-ND2 3.11Å; N468-N479 PolarHBondContact ND2-OD1 2.94Å; N468-N479 PolarHBondContact OD1-ND2 3.43Å
469	E	90.7	Very high	91.1	Very high	132 Å²	132	55.7 Å²	55.7	62%	0.617	30%	0.303	S	S	*	.	H	α-helix	trans	-62.2	-23.9	-178.9	-71.4	176.4	-169.6	0	0	112.9	Q465 E466	Q465-E469 HydrophobicContact CG-CG 4.45Å; Q465-E469 WeakPolarHBondContact CG-OE1 3.47Å; Q465-E469 PolarHBondContact NE2-OE1 2.9Å; Q465-E469 WeakPolarHBondContact O-CG 3.4Å; Q465-E469 PolarHBondContact O-N 3.35Å; E466-E469 PolarHBondContact O-N 3.19Å
470	L	89.1	Confident	91.1	Very high	36 Å²	36	55.7 Å²	55.7	19%	0.188	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	11.9	175.6	-66.3	174.6	0	0	0	113.7	R394 R397 L398 L401 E466 N468 Y472	R394-L470 HydrophobicContact CG-CD2 4.3Å; R394-L470 PolarHBondContact NH1-O 3.47Å; R397-L470 HydrophobicContact CG-CD1 4.26Å; L398-L470 HydrophobicContact CD1-CB 4.49Å; L398-L470 HydrophobicContact CD2-CB 3.47Å; L398-L470 VanDerWaalsContact CD2-CB 3.47Å; L398-L470 HydrophobicContact CD2-CD1 4.06Å; L398-L470 HydrophobicContact CD2-CG 4.43Å; L398-L470 HydrophobicContact CG-CB 4.09Å; L398-L470 HydrophobicContact CG-CD1 4.45Å; L401-L470 HydrophobicContact CD1-CD1 3.89Å; E466-L470 HydrophobicContact CG-CD1 4.27Å; E466-L470 WeakPolarHBondContact O-CB 3.49Å; E466-L470 VanDerWaalsContact O-CG 3.3Å; E466-L470 WeakPolarHBondContact O-CG 3.44Å; E466-L470 PolarHBondContact O-N 2.87Å; E466-L470 VanDerWaalsContact O-N 3.15Å; N468-L470 PolarHBondContact O-N 2.68Å; L470-Y472 PolarHBondContact O-N 2.71Å
471	D	86.2	Confident	91.1	Very high	142 Å²	142	58.8 Å²	58.8	76%	0.759	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	49.6	-179.3	-70.1	-50.3	0	0	0	113.6	N468	N468-D471 PolarHBondContact O-N 2.84Å
472	Y	88.5	Confident	91.2	Very high	25 Å²	25	57.6 Å²	57.6	10%	0.098	32%	0.315	C	S	.	.			trans	-64.8	134.5	177.3	-175.6	-116.6	0	0	0	112.6	L398 A402 L467 L470 D474 A475 V478	L398-Y472 HydrophobicContact CB-CD2 4.17Å; L398-Y472 HydrophobicContact CD1-CD2 4.38Å; L398-Y472 HydrophobicContact CD2-CD2 3.93Å; L398-Y472 HydrophobicContact CD2-CG 4.25Å; L398-Y472 HydrophobicContact CG-CD2 4.41Å; A402-Y472 HydrophobicContact CB-CE1 4.22Å; A402-Y472 HydrophobicContact CB-CE2 3.97Å; L467-Y472 HydrophobicContact CD2-CD1 4.38Å; L467-Y472 HydrophobicContact CD2-CD2 4.23Å; L467-Y472 HydrophobicContact CD2-CG 4Å; L467-Y472 WeakPolarHBondContact O-CB 3.34Å; L467-Y472 PolarHBondContact O-N 2.79Å; L470-Y472 PolarHBondContact O-N 2.71Å; Y472-D474 VanDerWaalsContact C-N 3.26Å; Y472-D474 HydrophobicContact CD1-CB 4.3Å; Y472-D474 HydrophobicContact CE1-CB 3.73Å; Y472-D474 PolarHBondContact O-N 3.31Å; Y472-D474 VanDerWaalsContact O-N 3.15Å; Y472-A475 VanDerWaalsContact O-CB 3.32Å; Y472-A475 WeakPolarHBondContact O-CB 3.34Å; Y472-A475 PolarHBondContact O-N 3.36Å; Y472-A475 VanDerWaalsContact O-N 3.14Å; Y472-V478 HydrophobicContact CD1-CG2 4.4Å; Y472-V478 HydrophobicContact CE1-CG2 4.26Å
473	Y	85.4	Confident	91.2	Very high	177 Å²	177	60.8 Å²	60.8	69%	0.694	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-24.4	-171.1	71.5	-92.7	0	0	0	115
474	D	88.9	Confident	91.3	Very high	61 Å²	61	67.4 Å²	67.4	33%	0.326	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	29.2	177.8	-169.6	37.6	0	0	0	112.2	Y472 A476 S477 V478	Y472-D474 VanDerWaalsContact C-N 3.26Å; Y472-D474 HydrophobicContact CD1-CB 4.3Å; Y472-D474 HydrophobicContact CE1-CB 3.73Å; Y472-D474 PolarHBondContact O-N 3.31Å; Y472-D474 VanDerWaalsContact O-N 3.15Å; D474-A476 PolarHBondContact O-N 3.27Å; D474-S477 VanDerWaalsContact CG-CB 3.4Å; D474-S477 PolarHBondContact O-N 3.22Å; D474-S477 WeakPolarHBondContact OD1-CB 3.41Å; D474-S477 WeakPolarHBondContact OD2-CB 3.35Å; D474-V478 PolarHBondContact O-N 3.43Å
475	A	90.9	Very high	91.3	Very high	13 Å²	13	67.4 Å²	67.4	11%	0.107	35%	0.349	C	S	.	.	H	α-helix	trans	-58.2	-30.2	-180	0	0	0	0	0	113.1	N468 Y472 S477 V478 N479	N468-A475 WeakPolarHBondContact OD1-CB 3.31Å; Y472-A475 VanDerWaalsContact O-CB 3.32Å; Y472-A475 WeakPolarHBondContact O-CB 3.34Å; Y472-A475 PolarHBondContact O-N 3.36Å; Y472-A475 VanDerWaalsContact O-N 3.14Å; A475-S477 PolarHBondContact O-N 3.44Å; A475-V478 PolarHBondContact O-N 2.96Å; A475-N479 WeakPolarHBondContact O-CB 3.46Å; A475-N479 PolarHBondContact O-N 3.45Å; A475-N479 PolarHBondContact O-ND2 3.11Å
476	A	90.7	Very high	91.4	Very high	80 Å²	80	64 Å²	64	66%	0.661	34%	0.337	S	S	*	.	H	α-helix	trans	-61.2	-40.5	177.3	0	0	0	0	0	113.2	D474 A480	D474-A476 PolarHBondContact O-N 3.27Å; A476-A480 PolarHBondContact O-N 3Å
477	S	92.1	Very high	91.4	Very high	60 Å²	60	66.6 Å²	66.6	42%	0.42	35%	0.349	S	S	.	.	H	α-helix	trans	-68	-45.2	176.6	-179.6	0	0	0	0	111.4	D474 A475 N479 A480 R481	D474-S477 VanDerWaalsContact CG-CB 3.4Å; D474-S477 PolarHBondContact O-N 3.22Å; D474-S477 WeakPolarHBondContact OD1-CB 3.41Å; D474-S477 WeakPolarHBondContact OD2-CB 3.35Å; A475-S477 PolarHBondContact O-N 3.44Å; S477-N479 PolarHBondContact O-N 3.3Å; S477-A480 PolarHBondContact O-N 3.07Å; S477-R481 PolarHBondContact O-N 3.37Å; S477-R481 VanDerWaalsContact O-N 3.1Å
478	V	93.5	Very high	91.4	Very high	1 Å²	1	69.1 Å²	69.1	1%	0.006	36%	0.361	C	S	.	.	H	α-helix	trans	-55.9	-48.7	175.1	170.5	0	0	0	0	111	F405 A464 L467 Y472 D474 A475 R481 C482	F405-V478 HydrophobicContact CD1-CB 4.5Å; F405-V478 HydrophobicContact CD1-CG1 4Å; F405-V478 HydrophobicContact CD1-CG2 4.15Å; F405-V478 HydrophobicContact CD2-CG1 4.03Å; F405-V478 HydrophobicContact CE1-CB 4.14Å; F405-V478 HydrophobicContact CE1-CG1 3.79Å; F405-V478 HydrophobicContact CE1-CG2 4.15Å; F405-V478 HydrophobicContact CE2-CG1 3.81Å; F405-V478 HydrophobicContact CG-CG1 4.12Å; F405-V478 HydrophobicContact CZ-CB 4.36Å; F405-V478 HydrophobicContact CZ-CG1 3.7Å; F405-V478 WeakPolarHBondContact CZ-O 3.21Å; A464-V478 HydrophobicContact CB-CG1 3.72Å; L467-V478 HydrophobicContact CD1-CG1 4.02Å; L467-V478 HydrophobicContact CD1-CG2 4.41Å; Y472-V478 HydrophobicContact CD1-CG2 4.4Å; Y472-V478 HydrophobicContact CE1-CG2 4.26Å; D474-V478 PolarHBondContact O-N 3.43Å; A475-V478 PolarHBondContact O-N 2.96Å; V478-R481 PolarHBondContact O-N 3.33Å; V478-C482 WeakPolarHBondContact O-CB 3.46Å; V478-C482 PolarHBondContact O-N 2.74Å
479	N	92.5	Very high	91.5	Very high	58 Å²	58	67.5 Å²	67.5	31%	0.31	35%	0.351	S	S	.	.	H	α-helix	trans	-62.7	-46.5	180	-69.3	-23	0	0	0	112.7	N468 A475 S477 R481 C482 Q483	N468-N479 PolarHBondContact ND2-ND2 3.11Å; N468-N479 PolarHBondContact ND2-OD1 2.94Å; N468-N479 PolarHBondContact OD1-ND2 3.43Å; A475-N479 WeakPolarHBondContact O-CB 3.46Å; A475-N479 PolarHBondContact O-N 3.45Å; A475-N479 PolarHBondContact O-ND2 3.11Å; S477-N479 PolarHBondContact O-N 3.3Å; N479-R481 VanDerWaalsContact C-N 3.3Å; N479-R481 PolarHBondContact O-N 2.89Å; N479-C482 PolarHBondContact O-N 2.91Å; N479-Q483 PolarHBondContact O-N 3.37Å
480	A	93.4	Very high	91.5	Very high	65 Å²	65	66.7 Å²	66.7	54%	0.537	35%	0.351	S	S	.	.	H	α-helix	trans	-61.6	-38.3	179.3	0	0	0	0	0	112.2	A476 S477 K484	A476-A480 PolarHBondContact O-N 3Å; S477-A480 PolarHBondContact O-N 3.07Å; A480-K484 PolarHBondContact O-N 3.13Å
481	R	94.8	Very high	91.6	Very high	64 Å²	64	69 Å²	69	24%	0.242	36%	0.362	C	S	.	.	H	α-helix	trans	-70	-41.8	174.6	-170.6	177.2	-176.1	-168.5	0.2	112.1	F405 E413 S477 V478 N479 K484 I485	F405-R481 HydrophobicContact CE1-CB 4.47Å; F405-R481 HydrophobicContact CZ-CB 4.32Å; E413-R481 VanDerWaalsContact CD-NH2 3.34Å; E413-R481 IonicContact OE1-CZ 2.75Å; E413-R481 IonicContact OE1-NE 2.96Å; E413-R481 PolarHBondContact OE1-NE 3.15Å; E413-R481 IonicContact OE1-NH2 2.74Å; E413-R481 PolarHBondContact OE1-NH2 2.84Å; E413-R481 IonicContact OE2-CZ 3.68Å; E413-R481 IonicContact OE2-NE 3.64Å; E413-R481 IonicContact OE2-NH2 2.7Å; E413-R481 PolarHBondContact OE2-NH2 2.75Å; S477-R481 PolarHBondContact O-N 3.37Å; S477-R481 VanDerWaalsContact O-N 3.1Å; V478-R481 PolarHBondContact O-N 3.33Å; N479-R481 VanDerWaalsContact C-N 3.3Å; N479-R481 PolarHBondContact O-N 2.89Å; R481-K484 PolarHBondContact O-N 3.28Å; R481-I485 HydrophobicContact CG-CD1 4.48Å; R481-I485 PolarHBondContact O-N 2.79Å
482	C	94.6	Very high	91.8	Very high	12 Å²	12	62.2 Å²	62.2	8%	0.081	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-45.6	177.6	-169.4	0	0	0	0	111.8	F405 A464 V478 N479 K484 I485 C486	F405-C482 HydrophobicContact CE2-CB 4.16Å; F405-C482 HydrophobicContact CZ-CB 4.24Å; A464-C482 HydrophobicContact CB-CB 4.11Å; V478-C482 WeakPolarHBondContact O-CB 3.46Å; V478-C482 PolarHBondContact O-N 2.74Å; N479-C482 PolarHBondContact O-N 2.91Å; C482-K484 VanDerWaalsContact C-N 3.33Å; C482-K484 PolarHBondContact O-N 3.2Å; C482-I485 WeakPolarHBondContact O-CB 3.42Å; C482-I485 PolarHBondContact O-N 2.84Å; C482-I485 VanDerWaalsContact O-N 3.14Å; C482-C486 PolarHBondContact O-N 2.93Å; C482-C486 VanDerWaalsContact O-N 3.1Å; C482-C486 PolarHBondContact O-SG 3.3Å; C482-C486 VanDerWaalsContact O-SG 3.38Å
483	Q	93.3	Very high	91.9	Very high	120 Å²	120	62.6 Å²	62.6	56%	0.561	34%	0.338	S	S	*	.	H	α-helix	trans	-56.9	-46.4	178	-179.2	-179.5	-15.9	0	0	111.7	N479 I485 C486 E487	N479-Q483 PolarHBondContact O-N 3.37Å; Q483-I485 VanDerWaalsContact C-N 3.27Å; Q483-I485 PolarHBondContact O-N 3.39Å; Q483-C486 PolarHBondContact O-N 3.08Å; Q483-C486 VanDerWaalsContact O-N 3.15Å; Q483-E487 HydrophobicContact CG-CG 4.45Å; Q483-E487 WeakPolarHBondContact CG-OE1 3.4Å; Q483-E487 PolarHBondContact NE2-OE1 3.31Å; Q483-E487 WeakPolarHBondContact O-CG 3.3Å; Q483-E487 PolarHBondContact O-N 2.75Å
484	K	93.3	Very high	92.1	Very high	147 Å²	147	57.6 Å²	57.6	64%	0.639	33%	0.328	S	S	*	.	H	α-helix	trans	-60.2	-35.9	178.4	-173.1	-174.2	175	-166.2	0	112.8	A480 R481 C482 Q488	A480-K484 PolarHBondContact O-N 3.13Å; R481-K484 PolarHBondContact O-N 3.28Å; C482-K484 VanDerWaalsContact C-N 3.33Å; C482-K484 PolarHBondContact O-N 3.2Å; K484-Q488 PolarHBondContact O-N 2.79Å; K484-Q488 VanDerWaalsContact O-N 3.16Å
485	I	93.7	Very high	92.2	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.015	33%	0.326	C	S	.	.	H	α-helix	trans	-66.4	-44.3	175.9	-72.8	170.5	0	0	0	110.6	A409 E413 V457 I460 R481 C482 Q483 Q488 W489	A409-I485 HydrophobicContact CB-CD1 3.77Å; E413-I485 HydrophobicContact CG-CD1 4.31Å; E413-I485 HydrophobicContact CG-CG1 4.31Å; V457-I485 HydrophobicContact CG1-CG2 4.49Å; I460-I485 HydrophobicContact CG2-CD1 4.35Å; R481-I485 HydrophobicContact CG-CD1 4.48Å; R481-I485 PolarHBondContact O-N 2.79Å; C482-I485 WeakPolarHBondContact O-CB 3.42Å; C482-I485 PolarHBondContact O-N 2.84Å; C482-I485 VanDerWaalsContact O-N 3.14Å; Q483-I485 VanDerWaalsContact C-N 3.27Å; Q483-I485 PolarHBondContact O-N 3.39Å; I485-Q488 PolarHBondContact O-N 2.99Å; I485-W489 PolarHBondContact O-N 2.84Å
486	C	92.4	Very high	92.3	Very high	42 Å²	42	56.7 Å²	56.7	28%	0.284	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-43.6	176.3	-59.7	0	0	0	0	112.3	C482 Q483 Q488 W489 D490	C482-C486 PolarHBondContact O-N 2.93Å; C482-C486 VanDerWaalsContact O-N 3.1Å; C482-C486 PolarHBondContact O-SG 3.3Å; C482-C486 VanDerWaalsContact O-SG 3.38Å; Q483-C486 PolarHBondContact O-N 3.08Å; Q483-C486 VanDerWaalsContact O-N 3.15Å; C486-Q488 VanDerWaalsContact C-N 3.33Å; C486-Q488 PolarHBondContact O-N 3.19Å; C486-W489 VanDerWaalsContact O-CB 3.27Å; C486-W489 WeakPolarHBondContact O-CB 3.39Å; C486-W489 PolarHBondContact O-N 2.95Å; C486-W489 VanDerWaalsContact O-N 3.09Å; C486-D490 PolarHBondContact O-N 3.15Å; C486-D490 VanDerWaalsContact O-N 3.12Å
487	E	92.4	Very high	92.2	Very high	101 Å²	101	58.5 Å²	58.5	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-39.1	177.5	-71.9	173.1	-174.3	0	0	112.4	Q483 W489 I491	Q483-E487 HydrophobicContact CG-CG 4.45Å; Q483-E487 WeakPolarHBondContact CG-OE1 3.4Å; Q483-E487 PolarHBondContact NE2-OE1 3.31Å; Q483-E487 WeakPolarHBondContact O-CG 3.3Å; Q483-E487 PolarHBondContact O-N 2.75Å; E487-W489 VanDerWaalsContact C-N 3.34Å; E487-I491 WeakPolarHBondContact O-CG1 3.38Å; E487-I491 PolarHBondContact O-N 3.13Å
488	Q	92.3	Very high	92	Very high	53 Å²	53	59 Å²	59	25%	0.248	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-35.1	174.3	-171.9	175.1	36.4	0	0	112.2	T416 E420 K484 I485 C486 I491 L492	T416-Q488 PolarHBondContact OG1-OE1 3.19Å; E420-Q488 PolarHBondContact OE1-NE2 3.22Å; K484-Q488 PolarHBondContact O-N 2.79Å; K484-Q488 VanDerWaalsContact O-N 3.16Å; I485-Q488 PolarHBondContact O-N 2.99Å; C486-Q488 VanDerWaalsContact C-N 3.33Å; C486-Q488 PolarHBondContact O-N 3.19Å; Q488-I491 PolarHBondContact O-N 3.3Å; Q488-L492 HydrophobicContact CG-CD1 4.47Å; Q488-L492 PolarHBondContact O-N 3.11Å; Q488-L492 VanDerWaalsContact O-N 3.1Å
489	W	93.3	Very high	91.8	Very high	25 Å²	25	60 Å²	60	10%	0.095	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-47.4	178.2	-170.4	-105.9	0	0	0	112.4	H412 W415 L450 H453 Q454 V457 I485 C486 E487 I491 L492 G493	H412-W489 AromaticContact NE2-CE3 3.49Å; H412-W489 AromaticContact NE2-CZ3 3.55Å; W415-W489 HydrophobicContact CH2-CZ3 4.13Å; W415-W489 AromaticContact CZ3-CZ3 3.73Å; W415-W489 HydrophobicContact CZ3-CZ3 3.73Å; L450-W489 HydrophobicContact CD1-CE3 4.23Å; L450-W489 HydrophobicContact CD1-CH2 3.51Å; L450-W489 HydrophobicContact CD1-CZ2 3.85Å; L450-W489 HydrophobicContact CD1-CZ3 3.72Å; L450-W489 HydrophobicContact CG-CH2 4.09Å; L450-W489 HydrophobicContact CG-CZ2 4.15Å; L450-W489 WeakPolarHBondContact O-CH2 3.46Å; L450-W489 WeakPolarHBondContact O-CZ2 3.17Å; H453-W489 HydrophobicContact CB-CH2 3.56Å; H453-W489 HydrophobicContact CB-CZ3 3.94Å; Q454-W489 HydrophobicContact CB-CZ2 4.07Å; V457-W489 HydrophobicContact CG2-CD2 3.81Å; V457-W489 HydrophobicContact CG2-CE3 3.62Å; V457-W489 HydrophobicContact CG2-CG 4.34Å; V457-W489 HydrophobicContact CG2-CH2 4.26Å; V457-W489 HydrophobicContact CG2-CZ2 4.46Å; V457-W489 HydrophobicContact CG2-CZ3 3.85Å; I485-W489 PolarHBondContact O-N 2.84Å; C486-W489 VanDerWaalsContact O-CB 3.27Å; C486-W489 WeakPolarHBondContact O-CB 3.39Å; C486-W489 PolarHBondContact O-N 2.95Å; C486-W489 VanDerWaalsContact O-N 3.09Å; E487-W489 VanDerWaalsContact C-N 3.34Å; W489-I491 VanDerWaalsContact C-N 3.29Å; W489-I491 PolarHBondContact O-N 2.85Å; W489-L492 PolarHBondContact O-N 2.85Å; W489-G493 PolarHBondContact O-N 3.04Å
490	D	90.5	Very high	91.7	Very high	116 Å²	116	59.8 Å²	59.8	62%	0.62	32%	0.319	S	S	*	.	H	α-helix	trans	-60.6	-39.2	178.7	-68.1	-24.4	0	0	0	111.9	C486 G493 S494	C486-D490 PolarHBondContact O-N 3.15Å; C486-D490 VanDerWaalsContact O-N 3.12Å; D490-G493 PolarHBondContact O-N 3.44Å; D490-S494 PolarHBondContact O-N 3Å; D490-S494 VanDerWaalsContact O-N 3.1Å
491	I	91.3	Very high	91.4	Very high	83 Å²	83	61.1 Å²	61.1	43%	0.426	32%	0.315	S	S	.	.	H	α-helix	trans	-62.4	-48.7	175.7	-67.3	168.4	0	0	0	110.6	E487 Q488 W489 G493 S494 L495	E487-I491 WeakPolarHBondContact O-CG1 3.38Å; E487-I491 PolarHBondContact O-N 3.13Å; Q488-I491 PolarHBondContact O-N 3.3Å; W489-I491 VanDerWaalsContact C-N 3.29Å; W489-I491 PolarHBondContact O-N 2.85Å; I491-G493 VanDerWaalsContact C-N 3.32Å; I491-G493 PolarHBondContact O-N 3.39Å; I491-S494 PolarHBondContact O-N 3.04Å; I491-S494 PolarHBondContact O-OG 3.28Å; I491-L495 HydrophobicContact CG2-CD1 4.14Å; I491-L495 PolarHBondContact O-N 3.39Å; I491-L495 VanDerWaalsContact O-N 3.11Å
492	L	91.1	Very high	91	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59	-42.4	177.7	-77.2	170.2	0	0	0	111.9	W415 T416 K419 E420 L423 L450 Q488 W489 S494 L495 T496	W415-L492 HydrophobicContact CZ3-CD1 4.39Å; T416-L492 HydrophobicContact CG2-CD1 3.68Å; K419-L492 HydrophobicContact CB-CD2 3.88Å; E420-L492 HydrophobicContact CG-CD2 3.64Å; E420-L492 HydrophobicContact CG-CG 4.33Å; L423-L492 HydrophobicContact CD1-CD2 4.05Å; L450-L492 HydrophobicContact CD1-CB 4.49Å; Q488-L492 HydrophobicContact CG-CD1 4.47Å; Q488-L492 PolarHBondContact O-N 3.11Å; Q488-L492 VanDerWaalsContact O-N 3.1Å; W489-L492 PolarHBondContact O-N 2.85Å; L492-S494 PolarHBondContact O-N 3.24Å; L492-L495 PolarHBondContact O-N 3.45Å; L492-T496 WeakPolarHBondContact O-CB 3.4Å; L492-T496 PolarHBondContact O-N 2.81Å; L492-T496 PolarHBondContact O-OG1 3.08Å
493	G	89.9	Confident	90.6	Very high	34 Å²	34	58.9 Å²	58.9	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-57.2	-46.9	174.4	0	0	0	0	0	112.6	W489 D490 I491 T496 H497	W489-G493 PolarHBondContact O-N 3.04Å; D490-G493 PolarHBondContact O-N 3.44Å; I491-G493 VanDerWaalsContact C-N 3.32Å; I491-G493 PolarHBondContact O-N 3.39Å; G493-T496 PolarHBondContact O-N 3.28Å; G493-H497 PolarHBondContact O-N 2.91Å; G493-H497 VanDerWaalsContact O-N 3.13Å
494	S	90.2	Very high	90.3	Very high	71 Å²	71	57.1 Å²	57.1	50%	0.497	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-43	-179.1	75.6	0	0	0	0	113.7	D490 I491 L492 T496 H497 S498	D490-S494 PolarHBondContact O-N 3Å; D490-S494 VanDerWaalsContact O-N 3.1Å; I491-S494 PolarHBondContact O-N 3.04Å; I491-S494 PolarHBondContact O-OG 3.28Å; L492-S494 PolarHBondContact O-N 3.24Å; S494-T496 VanDerWaalsContact C-N 3.34Å; S494-H497 PolarHBondContact O-N 3.33Å; S494-S498 PolarHBondContact O-N 3.07Å
495	L	91.2	Very high	89.9	Confident	52 Å²	52	57.6 Å²	57.6	27%	0.272	30%	0.299	S	S	.	.	H	α-helix	trans	-66.6	-37.8	177.5	-70.3	174.9	0	0	0	111.6	E420 L423 T424 I491 L492 H497 S498 R499	E420-L495 HydrophobicContact CB-CD1 4.2Å; E420-L495 HydrophobicContact CG-CD1 4.23Å; L423-L495 HydrophobicContact CB-CB 4.1Å; L423-L495 HydrophobicContact CD1-CB 3.79Å; T424-L495 HydrophobicContact CG2-CD2 4.41Å; I491-L495 HydrophobicContact CG2-CD1 4.14Å; I491-L495 PolarHBondContact O-N 3.39Å; I491-L495 VanDerWaalsContact O-N 3.11Å; L492-L495 PolarHBondContact O-N 3.45Å; L495-H497 PolarHBondContact O-N 3.23Å; L495-S498 PolarHBondContact O-N 3Å; L495-R499 PolarHBondContact O-N 3.17Å; L495-R499 VanDerWaalsContact O-N 3.13Å
496	T	91.4	Very high	89.4	Confident	4 Å²	4	58.7 Å²	58.7	3%	0.025	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-43.1	177.9	-57.4	0	0	0	0	111.3	L423 H443 F446 E447 L450 L492 G493 S494 K500	L423-T496 WeakPolarHBondContact CD1-OG1 3.19Å; H443-T496 PolarHBondContact CE1-O 3.37Å; H443-T496 VanDerWaalsContact CE1-O 3.29Å; H443-T496 WeakPolarHBondContact NE2-CG2 3.4Å; H443-T496 PolarHBondContact NE2-O 3.17Å; F446-T496 HydrophobicContact CD1-CG2 4.26Å; F446-T496 HydrophobicContact CE1-CG2 4.28Å; E447-T496 HydrophobicContact CG-CG2 3.48Å; E447-T496 VanDerWaalsContact CG-CG2 3.48Å; L450-T496 HydrophobicContact CD2-CG2 4.22Å; L492-T496 WeakPolarHBondContact O-CB 3.4Å; L492-T496 PolarHBondContact O-N 2.81Å; L492-T496 PolarHBondContact O-OG1 3.08Å; G493-T496 PolarHBondContact O-N 3.28Å; S494-T496 VanDerWaalsContact C-N 3.34Å; T496-K500 WeakPolarHBondContact O-CB 3.43Å; T496-K500 PolarHBondContact O-N 3.48Å; T496-K500 VanDerWaalsContact O-N 3.15Å
497	H	88.8	Confident	89	Confident	118 Å²	118	58.1 Å²	58.1	55%	0.546	30%	0.299	S	S	.	.	H	α-helix	trans	-64.5	-44.6	177	-171.5	58.5	0	0	0	112.7	G493 S494 L495 R499 K500 E501	G493-H497 PolarHBondContact O-N 2.91Å; G493-H497 VanDerWaalsContact O-N 3.13Å; S494-H497 PolarHBondContact O-N 3.33Å; L495-H497 PolarHBondContact O-N 3.23Å; H497-R499 PolarHBondContact O-N 3.1Å; H497-K500 WeakPolarHBondContact O-CB 3.42Å; H497-K500 PolarHBondContact O-N 3.47Å; H497-E501 PolarHBondContact O-N 3.21Å; H497-E501 VanDerWaalsContact O-N 3.17Å
498	S	87.9	Confident	88.7	Confident	69 Å²	69	60.7 Å²	60.7	48%	0.483	31%	0.308	S	S	.	.	H	α-helix	trans	-65.7	-37	-179.5	-174.2	0	0	0	0	113.4	S494 L495 K500 S502	S494-S498 PolarHBondContact O-N 3.07Å; L495-S498 PolarHBondContact O-N 3Å; S498-K500 VanDerWaalsContact C-N 3.35Å; S498-S502 PolarHBondContact O-OG 2.96Å
499	R	90.6	Very high	88.1	Confident	23 Å²	23	62.5 Å²	62.5	9%	0.087	32%	0.317	C	S	.	.	H	α-helix	trans	-65.7	-38.7	173.6	178.5	170.9	172.6	85.2	0.9	111.6	L423 Q425 D427 H443 L495 H497 S502 L503	L423-R499 WeakPolarHBondContact O-CD 3.24Å; Q425-R499 PolarHBondContact O-NH1 3.14Å; D427-R499 IonicContact OD1-CZ 3.37Å; D427-R499 IonicContact OD1-NH1 2.89Å; D427-R499 PolarHBondContact OD1-NH1 3.33Å; D427-R499 IonicContact OD1-NH2 3.86Å; D427-R499 PolarHBondContact OD1-NH2 3.23Å; D427-R499 IonicContact OD2-NH2 3.33Å; D427-R499 PolarHBondContact OD2-NH2 3.24Å; D427-R499 VanDerWaalsContact OD2-NH2 3.09Å; H443-R499 WeakPolarHBondContact ND1-CD 3.35Å; L495-R499 PolarHBondContact O-N 3.17Å; L495-R499 VanDerWaalsContact O-N 3.13Å; H497-R499 PolarHBondContact O-N 3.1Å; R499-S502 PolarHBondContact O-N 3.18Å; R499-L503 HydrophobicContact CG-CD1 3.89Å; R499-L503 WeakPolarHBondContact O-CG 3.43Å; R499-L503 PolarHBondContact O-N 3.49Å; R499-L503 VanDerWaalsContact O-N 3.12Å
500	K	89.4	Confident	87.6	Confident	53 Å²	53	62.6 Å²	62.6	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-60.2	-52.7	177.8	-179.5	163.2	-175	162.5	0	112.8	E447 T496 H497 S498 S502 L503 E504	E447-K500 WeakPolarHBondContact OE1-CD 3.28Å; E447-K500 IonicContact OE1-NZ 2.68Å; E447-K500 PolarHBondContact OE1-NZ 2.9Å; E447-K500 IonicContact OE2-NZ 3.85Å; E447-K500 PolarHBondContact OE2-NZ 3.49Å; T496-K500 WeakPolarHBondContact O-CB 3.43Å; T496-K500 PolarHBondContact O-N 3.48Å; T496-K500 VanDerWaalsContact O-N 3.15Å; H497-K500 WeakPolarHBondContact O-CB 3.42Å; H497-K500 PolarHBondContact O-N 3.47Å; S498-K500 VanDerWaalsContact C-N 3.35Å; K500-S502 PolarHBondContact O-N 3.4Å; K500-S502 VanDerWaalsContact O-N 3.09Å; K500-L503 PolarHBondContact O-N 2.99Å; K500-E504 WeakPolarHBondContact CE-OE1 3.15Å; K500-E504 HydrophobicContact CG-CG 4.08Å; K500-E504 VanDerWaalsContact CG-OE1 3.23Å; K500-E504 WeakPolarHBondContact CG-OE1 3.43Å; K500-E504 WeakPolarHBondContact O-CG 3.29Å; K500-E504 PolarHBondContact O-N 3.12Å
501	E	87.9	Confident	87.3	Confident	93 Å²	93	59.8 Å²	59.8	44%	0.435	30%	0.302	S	S	.	.	H	α-helix	trans	-54.5	-34.6	178.4	-68.5	-167.5	141.2	0	0	113.2	H497 R505	H497-E501 PolarHBondContact O-N 3.21Å; H497-E501 VanDerWaalsContact O-N 3.17Å; E501-R505 WeakPolarHBondContact O-CB 3.34Å; E501-R505 PolarHBondContact O-N 2.92Å
502	S	84.9	Confident	86.9	Confident	30 Å²	30	57.7 Å²	57.7	21%	0.21	30%	0.295	C	S	.	.	H	α-helix	trans	-74.5	-39.9	-179.3	-59	0	0	0	0	111.7	S498 R499 K500 T506	S498-S502 PolarHBondContact O-OG 2.96Å; R499-S502 PolarHBondContact O-N 3.18Å; K500-S502 PolarHBondContact O-N 3.4Å; K500-S502 VanDerWaalsContact O-N 3.09Å; S502-T506 PolarHBondContact O-N 3.32Å; S502-T506 PolarHBondContact O-OG1 3.29Å
503	L	86.4	Confident	86.5	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.9	-49.4	174.5	-74.8	164.7	0	0	0	111.6	Y428 L439 L440 H443 R499 K500 R505 T506 E507	Y428-L503 HydrophobicContact CD1-CD2 3.94Å; Y428-L503 HydrophobicContact CD1-CG 4.29Å; Y428-L503 HydrophobicContact CG-CD2 3.95Å; L439-L503 HydrophobicContact CB-CD2 3.91Å; L440-L503 HydrophobicContact CD1-CB 3.93Å; H443-L503 HydrophobicContact CB-CD1 3.93Å; R499-L503 HydrophobicContact CG-CD1 3.89Å; R499-L503 WeakPolarHBondContact O-CG 3.43Å; R499-L503 PolarHBondContact O-N 3.49Å; R499-L503 VanDerWaalsContact O-N 3.12Å; K500-L503 PolarHBondContact O-N 2.99Å; L503-R505 VanDerWaalsContact C-N 3.28Å; L503-R505 PolarHBondContact O-N 3.3Å; L503-T506 PolarHBondContact O-N 3.26Å; L503-T506 VanDerWaalsContact O-N 3.15Å; L503-E507 WeakPolarHBondContact O-CB 3.4Å; L503-E507 PolarHBondContact O-N 3.42Å
504	E	86.7	Confident	86.2	Confident	82 Å²	82	58 Å²	58	38%	0.383	29%	0.288	S	S	.	.	H	α-helix	trans	-57.9	-37.4	178.2	-71.5	174.9	170.2	0	0	112.2	L440 K500 K508	L440-E504 HydrophobicContact CD1-CG 4.11Å; K500-E504 WeakPolarHBondContact CE-OE1 3.15Å; K500-E504 HydrophobicContact CG-CG 4.08Å; K500-E504 VanDerWaalsContact CG-OE1 3.23Å; K500-E504 WeakPolarHBondContact CG-OE1 3.43Å; K500-E504 WeakPolarHBondContact O-CG 3.29Å; K500-E504 PolarHBondContact O-N 3.12Å; E504-K508 WeakPolarHBondContact O-CB 3.17Å; E504-K508 PolarHBondContact O-N 3.27Å
505	R	85	Confident	85.9	Confident	157 Å²	157	59.8 Å²	59.8	59%	0.592	29%	0.289	S	S	*	.	H	α-helix	trans	-64.6	-43	176.8	-174.7	-177.7	-57.3	156.5	9.1	112.4	E501 L503 Q509	E501-R505 WeakPolarHBondContact O-CB 3.34Å; E501-R505 PolarHBondContact O-N 2.92Å; L503-R505 VanDerWaalsContact C-N 3.28Å; L503-R505 PolarHBondContact O-N 3.3Å; R505-Q509 WeakPolarHBondContact O-CG 3.46Å; R505-Q509 PolarHBondContact O-N 3.29Å
506	T	83.1	Confident	85.6	Confident	27 Å²	27	59.2 Å²	59.2	17%	0.166	29%	0.286	C	S	.	.	H	α-helix	trans	-73.7	-38.3	179.7	-59.1	0	0	0	0	111.1	V436 S502 L503 Q509 L510	V436-T506 HydrophobicContact CG1-CG2 4.39Å; V436-T506 HydrophobicContact CG2-CG2 4.16Å; S502-T506 PolarHBondContact O-N 3.32Å; S502-T506 PolarHBondContact O-OG1 3.29Å; L503-T506 PolarHBondContact O-N 3.26Å; L503-T506 VanDerWaalsContact O-N 3.15Å; T506-Q509 PolarHBondContact O-N 3.34Å; T506-L510 HydrophobicContact CG2-CD1 4.39Å; T506-L510 PolarHBondContact O-N 3.41Å
507	E	85.4	Confident	85.3	Confident	29 Å²	29	60 Å²	60	14%	0.136	29%	0.288	C	S	.	.	H	α-helix	trans	-53.1	-59.1	168.6	174	178.6	-128.7	0	0	110.3	L433 V436 K437 L440 L503 Q509 L510 E511	L433-E507 HydrophobicContact CD1-CG 4.38Å; V436-E507 HydrophobicContact CG1-CB 4.17Å; K437-E507 WeakPolarHBondContact CE-OE1 3.47Å; K437-E507 HydrophobicContact CG-CG 4.39Å; K437-E507 VanDerWaalsContact CG-OE1 3.31Å; K437-E507 WeakPolarHBondContact CG-OE1 3.36Å; L440-E507 HydrophobicContact CD1-CB 4.32Å; L440-E507 WeakPolarHBondContact CD1-OE2 3.32Å; L503-E507 WeakPolarHBondContact O-CB 3.4Å; L503-E507 PolarHBondContact O-N 3.42Å; E507-Q509 PolarHBondContact O-N 3.33Å; E507-L510 CarbonylContact O-C 3.51Å; E507-L510 WeakPolarHBondContact O-CA 3.43Å; E507-L510 PolarHBondContact O-N 3.44Å; E507-E511 HydrophobicContact CG-CG 3.74Å; E507-E511 WeakPolarHBondContact O-CG 3.43Å; E507-E511 PolarHBondContact O-N 3.17Å
508	K	84.9	Confident	85.1	Confident	156 Å²	156	57 Å²	57	68%	0.678	28%	0.276	S	S	*	.	H	α-helix	trans	-53.7	-33.3	-175.5	-174	170.6	-173.9	167.3	0	114.6	E504 S512	E504-K508 WeakPolarHBondContact O-CB 3.17Å; E504-K508 PolarHBondContact O-N 3.27Å; K508-S512 PolarHBondContact O-N 3.22Å; K508-S512 VanDerWaalsContact O-N 3.07Å
509	Q	81.2	Confident	85	Confident	90 Å²	90	57 Å²	57	42%	0.421	27%	0.269	S	S	.	.	H	α-helix	trans	-72.4	-40.6	177.4	-71	178.1	-18.7	0	0	112.5	R505 T506 E507	R505-Q509 WeakPolarHBondContact O-CG 3.46Å; R505-Q509 PolarHBondContact O-N 3.29Å; T506-Q509 PolarHBondContact O-N 3.34Å; E507-Q509 PolarHBondContact O-N 3.33Å
510	L	82.1	Confident	84.8	Confident	27 Å²	27	56.1 Å²	56.1	14%	0.141	27%	0.265	C	S	.	.	H	α-helix	trans	-75.3	-31.7	175.1	-70.2	170.9	0	0	0	111.3	L433 V436 T506 E507 I513 D514 I590	L433-L510 HydrophobicContact CB-CB 4.01Å; L433-L510 HydrophobicContact CB-CD1 4.38Å; L433-L510 HydrophobicContact CD1-CB 3.72Å; L433-L510 HydrophobicContact CG-CB 4.28Å; V436-L510 HydrophobicContact CG2-CD1 4.04Å; T506-L510 HydrophobicContact CG2-CD1 4.39Å; T506-L510 PolarHBondContact O-N 3.41Å; E507-L510 CarbonylContact O-C 3.51Å; E507-L510 WeakPolarHBondContact O-CA 3.43Å; E507-L510 PolarHBondContact O-N 3.44Å; L510-I513 PolarHBondContact O-N 2.67Å; L510-D514 WeakPolarHBondContact O-CB 3.48Å; L510-D514 PolarHBondContact O-N 3Å; L510-I590 HydrophobicContact CD2-CD1 4.33Å; L510-I590 HydrophobicContact CD2-CG2 3.92Å
511	E	83.7	Confident	84.6	Confident	57 Å²	57	53.9 Å²	53.9	27%	0.266	26%	0.257	S	S	.	.	H	α-helix	trans	-62.1	-42.6	170.7	-75.8	-165.4	132.5	0	0	112	L433 K437 E507 I513 D514 E515	L433-E511 HydrophobicContact CD1-CG 4.11Å; K437-E511 VanDerWaalsContact CE-OE1 3.24Å; K437-E511 WeakPolarHBondContact CE-OE1 3.44Å; K437-E511 IonicContact NZ-OE1 2.82Å; K437-E511 PolarHBondContact NZ-OE1 3.33Å; E507-E511 HydrophobicContact CG-CG 3.74Å; E507-E511 WeakPolarHBondContact O-CG 3.43Å; E507-E511 PolarHBondContact O-N 3.17Å; E511-I513 PolarHBondContact O-N 3.45Å; E511-I513 VanDerWaalsContact O-N 3.13Å; E511-D514 CarbonylContact O-C 3.53Å; E511-D514 WeakPolarHBondContact O-CB 3.2Å; E511-D514 PolarHBondContact O-N 2.64Å; E511-D514 VanDerWaalsContact O-N 3.14Å; E511-E515 WeakPolarHBondContact O-CB 3.34Å; E511-E515 VanDerWaalsContact O-CG 3.25Å; E511-E515 WeakPolarHBondContact O-CG 3.21Å; E511-E515 PolarHBondContact O-N 3.27Å
512	S	83.3	Confident	84.3	Confident	40 Å²	40	54.7 Å²	54.7	28%	0.28	26%	0.259	S	S	.	.	H	α-helix	trans	-60.9	-27	177	-176.1	0	0	0	0	113.3	K508 L516	K508-S512 PolarHBondContact O-N 3.22Å; K508-S512 VanDerWaalsContact O-N 3.07Å; S512-L516 WeakPolarHBondContact O-CG 3.35Å; S512-L516 PolarHBondContact O-N 2.95Å
513	I	81.9	Confident	84.6	Confident	10 Å²	10	56 Å²	56	5%	0.051	26%	0.259	C	S	.	.	H	α-helix	trans	-80.6	-43.6	174.9	-65.6	175.1	0	0	0	110.8	L510 E511 L516 Y517 V581 I584 A585 I590 L592	L510-I513 PolarHBondContact O-N 2.67Å; E511-I513 PolarHBondContact O-N 3.45Å; E511-I513 VanDerWaalsContact O-N 3.13Å; I513-L516 PolarHBondContact O-N 3.29Å; I513-Y517 HydrophobicContact CG2-CD2 4.22Å; I513-Y517 HydrophobicContact CG2-CE2 4.22Å; I513-Y517 PolarHBondContact O-N 3.19Å; I513-Y517 VanDerWaalsContact O-N 3.1Å; I513-V581 HydrophobicContact CG2-CG1 4.03Å; I513-I584 HydrophobicContact CD1-CG2 4.26Å; I513-I584 HydrophobicContact CG1-CB 4.41Å; I513-I584 HydrophobicContact CG1-CG2 3.88Å; I513-A585 HydrophobicContact CD1-CB 4.25Å; I513-I590 HydrophobicContact CD1-CD1 4Å; I513-I590 HydrophobicContact CD1-CG2 4.44Å; I513-L592 HydrophobicContact CG2-CD2 3.88Å
514	D	83.3	Confident	84.5	Confident	29 Å²	29	56 Å²	56	16%	0.155	26%	0.259	C	S	.	.	H	α-helix	trans	-57	-51.7	171.1	178.8	122.2	0	0	0	110.5	L433 L510 E511 L516 Y517 L518 Y598	L433-D514 HydrophobicContact CD2-CB 3.39Å; L433-D514 WeakPolarHBondContact CD2-OD1 3.27Å; L510-D514 WeakPolarHBondContact O-CB 3.48Å; L510-D514 PolarHBondContact O-N 3Å; E511-D514 CarbonylContact O-C 3.53Å; E511-D514 WeakPolarHBondContact O-CB 3.2Å; E511-D514 PolarHBondContact O-N 2.64Å; E511-D514 VanDerWaalsContact O-N 3.14Å; D514-L516 VanDerWaalsContact C-N 3.28Å; D514-L516 PolarHBondContact O-N 3.44Å; D514-Y517 CarbonylContact O-C 3.57Å; D514-Y517 PolarHBondContact O-N 2.93Å; D514-Y517 VanDerWaalsContact O-N 3.13Å; D514-L518 WeakPolarHBondContact O-CA 3.32Å; D514-L518 WeakPolarHBondContact O-CB 3.46Å; D514-L518 PolarHBondContact O-N 3.16Å; D514-Y598 PolarHBondContact OD1-OH 2.9Å
515	E	85.1	Confident	84.4	Confident	109 Å²	109	53.6 Å²	53.6	51%	0.509	25%	0.254	S	S	.	.	H	α-helix	trans	-52.1	-39.1	177.5	-81.7	-177.9	158.2	0	0	113	E511 L518 E519	E511-E515 WeakPolarHBondContact O-CB 3.34Å; E511-E515 VanDerWaalsContact O-CG 3.25Å; E511-E515 WeakPolarHBondContact O-CG 3.21Å; E511-E515 PolarHBondContact O-N 3.27Å; E515-L518 CarbonylContact O-C 3.59Å; E515-E519 WeakPolarHBondContact O-CA 3.39Å; E515-E519 WeakPolarHBondContact O-CB 3.32Å; E515-E519 PolarHBondContact O-N 3.44Å
516	L	84.6	Confident	84.3	Confident	40 Å²	40	49.5 Å²	49.5	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-81.7	-36.8	179.2	-72.6	172.7	0	0	0	112.7	S512 I513 D514 L518 E519 Y520 I577 E580 V581 I584	S512-L516 WeakPolarHBondContact O-CG 3.35Å; S512-L516 PolarHBondContact O-N 2.95Å; I513-L516 PolarHBondContact O-N 3.29Å; D514-L516 VanDerWaalsContact C-N 3.28Å; D514-L516 PolarHBondContact O-N 3.44Å; L516-L518 VanDerWaalsContact C-N 3.27Å; L516-E519 PolarHBondContact O-N 3.11Å; L516-Y520 PolarHBondContact O-N 3.29Å; L516-I577 HydrophobicContact CD2-CG2 4.45Å; L516-I577 VanDerWaalsContact O-CG2 3.28Å; L516-I577 WeakPolarHBondContact O-CG2 3.36Å; L516-E580 HydrophobicContact CD1-CG 4.12Å; L516-V581 HydrophobicContact CB-CG2 3.55Å; L516-I584 HydrophobicContact CD1-CD1 3.52Å
517	Y	85.7	Confident	84.5	Confident	20 Å²	20	48.6 Å²	48.6	8%	0.078	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-36.7	168.8	-85.7	-41.8	0	0	0	111.4	I513 D514 A521 V581 L592 N596	I513-Y517 HydrophobicContact CG2-CD2 4.22Å; I513-Y517 HydrophobicContact CG2-CE2 4.22Å; I513-Y517 PolarHBondContact O-N 3.19Å; I513-Y517 VanDerWaalsContact O-N 3.1Å; D514-Y517 CarbonylContact O-C 3.57Å; D514-Y517 PolarHBondContact O-N 2.93Å; D514-Y517 VanDerWaalsContact O-N 3.13Å; Y517-A521 WeakPolarHBondContact O-CB 3.4Å; Y517-A521 PolarHBondContact O-N 3.16Å; Y517-V581 HydrophobicContact CD1-CB 4.25Å; Y517-V581 HydrophobicContact CD1-CG1 3.85Å; Y517-V581 HydrophobicContact CD1-CG2 3.86Å; Y517-V581 HydrophobicContact CD2-CG1 3.84Å; Y517-V581 HydrophobicContact CE1-CB 4.04Å; Y517-V581 HydrophobicContact CE1-CG1 3.57Å; Y517-V581 HydrophobicContact CE1-CG2 4.14Å; Y517-V581 HydrophobicContact CE2-CG1 3.58Å; Y517-V581 HydrophobicContact CG-CG1 3.97Å; Y517-V581 HydrophobicContact CG-CG2 4.25Å; Y517-V581 VanDerWaalsContact CZ-CG1 3.42Å; Y517-L592 HydrophobicContact CE2-CD2 4.16Å; Y517-N596 HydrophobicContact CD1-CB 3.7Å; Y517-N596 WeakPolarHBondContact CD1-ND2 3.39Å; Y517-N596 HydrophobicContact CE1-CB 4.02Å; Y517-N596 HydrophobicContact CG-CB 4.31Å; Y517-N596 PolarHBondContact O-ND2 3.47Å
518	L	83.1	Confident	84.6	Confident	55 Å²	55	47.4 Å²	47.4	29%	0.288	24%	0.236	S	C	.	.	H	α-helix	trans	-69.5	-35.6	172.7	-179.4	64	0	0	0	110.2	D514 E515 L516 A521 K522 Y598	D514-L518 WeakPolarHBondContact O-CA 3.32Å; D514-L518 WeakPolarHBondContact O-CB 3.46Å; D514-L518 PolarHBondContact O-N 3.16Å; E515-L518 CarbonylContact O-C 3.59Å; L516-L518 VanDerWaalsContact C-N 3.27Å; L518-A521 CarbonylContact O-C 3.52Å; L518-A521 PolarHBondContact O-N 2.63Å; L518-K522 HydrophobicContact CD1-CG 4.26Å; L518-K522 HydrophobicContact CG-CD 3.98Å; L518-K522 HydrophobicContact CG-CG 4.11Å; L518-K522 WeakPolarHBondContact O-CA 3.05Å; L518-K522 WeakPolarHBondContact O-CB 3.36Å; L518-K522 WeakPolarHBondContact O-CD 3.21Å; L518-K522 WeakPolarHBondContact O-CG 2.99Å; L518-K522 PolarHBondContact O-N 3.49Å; L518-Y598 HydrophobicContact CB-CD2 4.31Å; L518-Y598 HydrophobicContact CD1-CG 4.37Å
519	E	85.8	Confident	84.6	Confident	70 Å²	70	44.4 Å²	44.4	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-69.6	-40.3	175.6	-171.7	61.1	-160.9	0	0	111.2	E515 L516 A521 K522 R523 I577	E515-E519 WeakPolarHBondContact O-CA 3.39Å; E515-E519 WeakPolarHBondContact O-CB 3.32Å; E515-E519 PolarHBondContact O-N 3.44Å; L516-E519 PolarHBondContact O-N 3.11Å; E519-A521 VanDerWaalsContact C-N 3.35Å; E519-K522 PolarHBondContact O-N 2.96Å; E519-K522 VanDerWaalsContact OE2-CD 3.24Å; E519-K522 WeakPolarHBondContact OE2-CD 3.47Å; E519-K522 IonicContact OE2-NZ 2.71Å; E519-R523 WeakPolarHBondContact O-CG 2.95Å; E519-R523 PolarHBondContact O-N 3.44Å; E519-R523 WeakPolarHBondContact OE1-CD 3.38Å; E519-I577 HydrophobicContact CB-CG2 4.34Å; E519-I577 HydrophobicContact CG-CD1 3.98Å
520	Y	87.6	Confident	85	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-56.3	-50.6	166.8	174.4	-86.4	0	0	0	110.3	L516 K522 R523 A524 I574 Q578 N596 T599 I601 P603	L516-Y520 PolarHBondContact O-N 3.29Å; Y520-K522 PolarHBondContact O-N 3.37Å; Y520-R523 PolarHBondContact O-N 2.86Å; Y520-A524 HydrophobicContact CD1-CB 4.33Å; Y520-A524 HydrophobicContact CE1-CB 3.97Å; Y520-A524 WeakPolarHBondContact O-CB 3.5Å; Y520-A524 PolarHBondContact O-N 2.97Å; Y520-I574 HydrophobicContact CD2-CG2 3.99Å; Y520-I574 VanDerWaalsContact CD2-O 3.31Å; Y520-I574 WeakPolarHBondContact CD2-O 3.48Å; Y520-I574 HydrophobicContact CE2-CG2 3.67Å; Y520-Q578 HydrophobicContact CD2-CB 3.9Å; Y520-Q578 HydrophobicContact CE2-CB 4.17Å; Y520-N596 VanDerWaalsContact CD1-ND2 3.31Å; Y520-N596 WeakPolarHBondContact CD1-ND2 3.19Å; Y520-T599 HydrophobicContact CD1-CG2 3.77Å; Y520-T599 HydrophobicContact CE1-CG2 3.59Å; Y520-I601 PolarHBondContact OH-O 3.45Å; Y520-I601 VanDerWaalsContact OH-O 3.07Å; Y520-P603 HydrophobicContact CE2-CG 4.36Å; Y520-P603 VanDerWaalsContact OH-CD 3.26Å; Y520-P603 WeakPolarHBondContact OH-CD 3.14Å; Y520-P603 WeakPolarHBondContact OH-CG 3.39Å
521	A	85.2	Confident	85.2	Confident	7 Å²	7	42.3 Å²	42.3	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-37.6	179.1	0	0	0	0	0	112.9	Y517 L518 E519 R523 A525 T599	Y517-A521 WeakPolarHBondContact O-CB 3.4Å; Y517-A521 PolarHBondContact O-N 3.16Å; L518-A521 CarbonylContact O-C 3.52Å; L518-A521 PolarHBondContact O-N 2.63Å; E519-A521 VanDerWaalsContact C-N 3.35Å; A521-R523 VanDerWaalsContact C-N 3.26Å; A521-R523 PolarHBondContact O-N 3.21Å; A521-A525 WeakPolarHBondContact O-CA 3.43Å; A521-A525 WeakPolarHBondContact O-CB 3.02Å; A521-A525 PolarHBondContact O-N 3.2Å; A521-T599 HydrophobicContact CB-CG2 3.83Å
522	K	82.4	Confident	85.2	Confident	110 Å²	110	42.8 Å²	42.8	48%	0.478	22%	0.216	S	C	.	.	H	α-helix	trans	-69	-18.3	178.1	-83.5	166.1	171.1	170.5	0	113.1	L518 E519 Y520 P526	L518-K522 HydrophobicContact CD1-CG 4.26Å; L518-K522 HydrophobicContact CG-CD 3.98Å; L518-K522 HydrophobicContact CG-CG 4.11Å; L518-K522 WeakPolarHBondContact O-CA 3.05Å; L518-K522 WeakPolarHBondContact O-CB 3.36Å; L518-K522 WeakPolarHBondContact O-CD 3.21Å; L518-K522 WeakPolarHBondContact O-CG 2.99Å; L518-K522 PolarHBondContact O-N 3.49Å; E519-K522 PolarHBondContact O-N 2.96Å; E519-K522 VanDerWaalsContact OE2-CD 3.24Å; E519-K522 WeakPolarHBondContact OE2-CD 3.47Å; E519-K522 IonicContact OE2-NZ 2.71Å; Y520-K522 PolarHBondContact O-N 3.37Å; K522-P526 WeakPolarHBondContact O-CD 3.35Å; K522-P526 WeakPolarHBondContact O-CG 3.27Å
523	R	89.4	Confident	85.1	Confident	57 Å²	57	41.8 Å²	41.8	22%	0.215	21%	0.212	C	C	.	.	H	α-helix	trans	-105.6	-40.3	174	-64.2	177.9	61.5	-170.1	8	111.1	E519 Y520 A521 A525 P526 F527 E570 I574	E519-R523 WeakPolarHBondContact O-CG 2.95Å; E519-R523 PolarHBondContact O-N 3.44Å; E519-R523 WeakPolarHBondContact OE1-CD 3.38Å; Y520-R523 PolarHBondContact O-N 2.86Å; A521-R523 VanDerWaalsContact C-N 3.26Å; A521-R523 PolarHBondContact O-N 3.21Å; R523-A525 PolarHBondContact O-N 2.85Å; R523-P526 WeakPolarHBondContact O-CD 3.4Å; R523-F527 WeakPolarHBondContact O-CB 3.44Å; R523-F527 PolarHBondContact O-N 3.19Å; R523-E570 IonicContact CZ-OE1 3.11Å; R523-E570 IonicContact CZ-OE2 3.26Å; R523-E570 IonicContact NE-OE1 3.09Å; R523-E570 PolarHBondContact NE-OE1 3.04Å; R523-E570 IonicContact NH2-OE1 3.79Å; R523-E570 PolarHBondContact NH2-OE1 3.44Å; R523-E570 IonicContact NH2-OE2 2.66Å; R523-E570 PolarHBondContact NH2-OE2 3.23Å; R523-I574 HydrophobicContact CB-CD1 4.24Å; R523-I574 HydrophobicContact CB-CG1 3.56Å; R523-I574 WeakPolarHBondContact O-CD1 3.3Å
524	A	85.9	Confident	85.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-43.3	170.9	0	0	0	0	0	112.9	Y520 N528 I574 I606	Y520-A524 HydrophobicContact CD1-CB 4.33Å; Y520-A524 HydrophobicContact CE1-CB 3.97Å; Y520-A524 WeakPolarHBondContact O-CB 3.5Å; Y520-A524 PolarHBondContact O-N 2.97Å; A524-N528 WeakPolarHBondContact O-CB 3.48Å; A524-N528 PolarHBondContact O-N 2.99Å; A524-I574 HydrophobicContact CB-CG2 3.94Å; A524-I606 HydrophobicContact CB-CD1 3.87Å
525	A	84.1	Confident	85.3	Confident	32 Å²	32	41.3 Å²	41.3	26%	0.264	21%	0.209	S	C	.	.	H	α-helix	trans	-70.2	-53.2	-178.7	0	0	0	0	0	113.6	A521 R523 F527 N528 N529	A521-A525 WeakPolarHBondContact O-CA 3.43Å; A521-A525 WeakPolarHBondContact O-CB 3.02Å; A521-A525 PolarHBondContact O-N 3.2Å; R523-A525 PolarHBondContact O-N 2.85Å; A525-F527 VanDerWaalsContact C-N 3.26Å; A525-F527 PolarHBondContact O-N 3.24Å; A525-N528 CarbonylContact O-C 3.56Å; A525-N528 WeakPolarHBondContact O-CB 3.39Å; A525-N528 PolarHBondContact O-N 3.02Å; A525-N529 VanDerWaalsContact O-CB 3.31Å; A525-N529 WeakPolarHBondContact O-CB 3.45Å; A525-N529 PolarHBondContact O-N 3.49Å; A525-N529 PolarHBondContact O-OD1 3.06Å
526	P	81.6	Confident	85.3	Confident	70 Å²	70	42.4 Å²	42.4	46%	0.455	21%	0.214	S	C	.	.	H	α-helix	trans	-69.5	-24.6	176.5	30.9	-37.9	0	0	0	112.2	K522 R523 W530	K522-P526 WeakPolarHBondContact O-CD 3.35Å; K522-P526 WeakPolarHBondContact O-CG 3.27Å; R523-P526 WeakPolarHBondContact O-CD 3.4Å; P526-W530 WeakPolarHBondContact O-CA 3.26Å; P526-W530 WeakPolarHBondContact O-CB 3.46Å; P526-W530 PolarHBondContact O-N 3.16Å
527	F	88.4	Confident	85.2	Confident	8 Å²	8	45.2 Å²	45.2	4%	0.035	23%	0.23	C	C	.	.	H	α-helix	trans	-70.5	-42.6	170.2	-172.9	-110.6	0	0	0	111.5	R523 A525 N529 W530 M531 A567 E570 R571 I574 I606 W610	R523-F527 WeakPolarHBondContact O-CB 3.44Å; R523-F527 PolarHBondContact O-N 3.19Å; A525-F527 VanDerWaalsContact C-N 3.26Å; A525-F527 PolarHBondContact O-N 3.24Å; F527-N529 VanDerWaalsContact C-N 3.35Å; F527-N529 PolarHBondContact O-N 3.15Å; F527-W530 HydrophobicContact CE2-CE3 4.25Å; F527-W530 PolarHBondContact O-N 3.45Å; F527-M531 HydrophobicContact CD1-CE 3.93Å; F527-M531 HydrophobicContact CD1-SD 4.46Å; F527-M531 HydrophobicContact CE1-CE 3.92Å; F527-M531 HydrophobicContact CE1-SD 3.93Å; F527-M531 HydrophobicContact CZ-SD 4.29Å; F527-M531 WeakPolarHBondContact O-CG 3.4Å; F527-M531 PolarHBondContact O-N 2.97Å; F527-A567 HydrophobicContact CE2-CB 4.1Å; F527-A567 WeakPolarHBondContact CE2-O 3.37Å; F527-A567 WeakPolarHBondContact CZ-O 3.24Å; F527-E570 HydrophobicContact CD2-CB 4.27Å; F527-E570 HydrophobicContact CD2-CG 4.13Å; F527-E570 HydrophobicContact CE2-CB 4.43Å; F527-R571 HydrophobicContact CD1-CB 4.43Å; F527-R571 HydrophobicContact CE1-CB 3.6Å; F527-R571 HydrophobicContact CE1-CG 3.76Å; F527-R571 HydrophobicContact CZ-CB 3.67Å; F527-R571 HydrophobicContact CZ-CG 4.25Å; F527-I574 HydrophobicContact CB-CD1 3.48Å; F527-I574 VanDerWaalsContact CB-CD1 3.48Å; F527-I574 HydrophobicContact CD1-CD1 3.87Å; F527-I574 HydrophobicContact CG-CD1 3.71Å; F527-I606 HydrophobicContact CD1-CG2 3.6Å; F527-I606 HydrophobicContact CE1-CG2 3.5Å; F527-I606 VanDerWaalsContact CE1-CG2 3.5Å; F527-W610 HydrophobicContact CE1-CE3 4.3Å; F527-W610 HydrophobicContact CE2-CE3 4.29Å; F527-W610 AromaticContact CE2-CZ3 3.91Å; F527-W610 HydrophobicContact CE2-CZ3 3.91Å; F527-W610 AromaticContact CZ-CE3 3.53Å; F527-W610 HydrophobicContact CZ-CE3 3.53Å; F527-W610 AromaticContact CZ-CZ3 3.56Å; F527-W610 HydrophobicContact CZ-CZ3 3.56Å
528	N	88.3	Confident	85.1	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.027	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-44.3	170	172.3	91.6	0	0	0	112.5	A524 A525 M531 E532 I601 K609	A524-N528 WeakPolarHBondContact O-CB 3.48Å; A524-N528 PolarHBondContact O-N 2.99Å; A525-N528 CarbonylContact O-C 3.56Å; A525-N528 WeakPolarHBondContact O-CB 3.39Å; A525-N528 PolarHBondContact O-N 3.02Å; N528-M531 HydrophobicContact CB-CE 4.46Å; N528-M531 WeakPolarHBondContact O-CB 3.49Å; N528-M531 PolarHBondContact O-N 3.45Å; N528-E532 PolarHBondContact ND2-OE2 3.19Å; N528-E532 PolarHBondContact O-N 3.26Å; N528-I601 HydrophobicContact CB-CD1 3.71Å; N528-K609 WeakPolarHBondContact OD1-CD 3.37Å; N528-K609 WeakPolarHBondContact OD1-CE 3.36Å; N528-K609 PolarHBondContact OD1-NZ 2.8Å
529	N	83.1	Confident	85.1	Confident	93 Å²	93	48.5 Å²	48.5	50%	0.497	24%	0.244	S	C	.	.	H	α-helix	trans	-79	-21.7	-179.1	-60.5	5.9	0	0	0	111.8	A525 F527 G533	A525-N529 VanDerWaalsContact O-CB 3.31Å; A525-N529 WeakPolarHBondContact O-CB 3.45Å; A525-N529 PolarHBondContact O-N 3.49Å; A525-N529 PolarHBondContact O-OD1 3.06Å; F527-N529 VanDerWaalsContact C-N 3.35Å; F527-N529 PolarHBondContact O-N 3.15Å; N529-G533 VanDerWaalsContact O-CA 3.28Å; N529-G533 WeakPolarHBondContact O-CA 3.41Å; N529-G533 PolarHBondContact O-N 3.09Å
530	W	89.8	Confident	85.1	Confident	73 Å²	73	49 Å²	49	28%	0.277	25%	0.249	S	C	.	.	H	α-helix	trans	-70.9	-36.3	166	173.5	91.7	0	0	0	109.7	P526 F527 A534 F560 L564 A567 W610	P526-W530 WeakPolarHBondContact O-CA 3.26Å; P526-W530 WeakPolarHBondContact O-CB 3.46Å; P526-W530 PolarHBondContact O-N 3.16Å; F527-W530 HydrophobicContact CE2-CE3 4.25Å; F527-W530 PolarHBondContact O-N 3.45Å; W530-A534 WeakPolarHBondContact O-CA 3.4Å; W530-A534 WeakPolarHBondContact O-CB 3.42Å; W530-A534 PolarHBondContact O-N 3.24Å; W530-F560 HydrophobicContact CZ2-CE2 4.09Å; W530-F560 HydrophobicContact CZ2-CZ 4.45Å; W530-L564 HydrophobicContact CH2-CD2 3.68Å; W530-L564 HydrophobicContact CZ2-CD2 3.87Å; W530-A567 HydrophobicContact CD2-CB 4.4Å; W530-A567 HydrophobicContact CE3-CB 4.25Å; W530-A567 HydrophobicContact CH2-CB 3.55Å; W530-A567 HydrophobicContact CZ2-CB 3.67Å; W530-A567 HydrophobicContact CZ3-CB 3.88Å; W530-W610 HydrophobicContact CE3-CZ3 4.21Å; W530-W610 AromaticContact CH2-CH2 3.99Å; W530-W610 HydrophobicContact CH2-CH2 3.99Å; W530-W610 AromaticContact CH2-CZ3 3.73Å; W530-W610 HydrophobicContact CH2-CZ3 3.73Å; W530-W610 AromaticContact CZ3-CE3 3.9Å; W530-W610 HydrophobicContact CZ3-CE3 3.9Å; W530-W610 HydrophobicContact CZ3-CH2 4.01Å; W530-W610 AromaticContact CZ3-CZ3 3.26Å; W530-W610 HydrophobicContact CZ3-CZ3 3.26Å
531	M	86.2	Confident	84.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-41.3	172.3	-66.7	-177.8	-66.4	0	0	111.9	F527 N528 M535 I606 K609 W610	F527-M531 HydrophobicContact CD1-CE 3.93Å; F527-M531 HydrophobicContact CD1-SD 4.46Å; F527-M531 HydrophobicContact CE1-CE 3.92Å; F527-M531 HydrophobicContact CE1-SD 3.93Å; F527-M531 HydrophobicContact CZ-SD 4.29Å; F527-M531 WeakPolarHBondContact O-CG 3.4Å; F527-M531 PolarHBondContact O-N 2.97Å; N528-M531 HydrophobicContact CB-CE 4.46Å; N528-M531 WeakPolarHBondContact O-CB 3.49Å; N528-M531 PolarHBondContact O-N 3.45Å; M531-M535 WeakPolarHBondContact O-CE 3.35Å; M531-M535 VanDerWaalsContact O-CG 3.29Å; M531-M535 WeakPolarHBondContact O-CG 3.41Å; M531-M535 PolarHBondContact O-N 2.97Å; M531-I606 HydrophobicContact CE-CB 4.42Å; M531-I606 HydrophobicContact CE-CG2 3.89Å; M531-I606 WeakPolarHBondContact CE-O 3.3Å; M531-K609 HydrophobicContact CB-CB 4.44Å; M531-K609 HydrophobicContact CE-CB 3.97Å; M531-K609 HydrophobicContact SD-CB 4.13Å; M531-W610 HydrophobicContact CG-CE3 4.1Å; M531-W610 WeakPolarHBondContact SD-CA 3.27Å; M531-W610 HydrophobicContact SD-CB 3.61Å; M531-W610 HydrophobicContact SD-CD2 4.46Å; M531-W610 HydrophobicContact SD-CE3 3.82Å; M531-W610 HydrophobicContact SD-CG 4.45Å; M531-W610 PolarHBondContact SD-N 2.71Å
532	E	85.4	Confident	84.3	Confident	67 Å²	67	57.9 Å²	57.9	31%	0.313	29%	0.291	S	S	.	.	H	α-helix	trans	-72.5	-43.4	176.9	-72.6	178.4	139.5	0	0	112.3	N528 M535 E536 K609	N528-E532 PolarHBondContact ND2-OE2 3.19Å; N528-E532 PolarHBondContact O-N 3.26Å; E532-M535 HydrophobicContact CB-CE 4.4Å; E532-M535 HydrophobicContact CG-CE 3.8Å; E532-M535 CarbonylContact O-C 3.47Å; E532-M535 WeakPolarHBondContact O-CA 3.35Å; E532-M535 WeakPolarHBondContact O-CB 3.38Å; E532-M535 PolarHBondContact O-N 2.89Å; E532-E536 WeakPolarHBondContact O-CG 3.4Å; E532-E536 PolarHBondContact O-N 3.36Å; E532-K609 HydrophobicContact CG-CD 4.17Å; E532-K609 WeakPolarHBondContact OE1-CE 3.24Å; E532-K609 IonicContact OE1-NZ 3.2Å; E532-K609 PolarHBondContact OE1-NZ 3.08Å; E532-K609 IonicContact OE2-NZ 2.72Å; E532-K609 PolarHBondContact OE2-NZ 3.07Å
533	G	79.9	Confident	83.9	Confident	19 Å²	19	58.2 Å²	58.2	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-41.2	172.1	0	0	0	0	0	112.1	N529 M535 E536 D537	N529-G533 VanDerWaalsContact O-CA 3.28Å; N529-G533 WeakPolarHBondContact O-CA 3.41Å; N529-G533 PolarHBondContact O-N 3.09Å; G533-M535 VanDerWaalsContact C-N 3.31Å; G533-M535 PolarHBondContact O-N 3Å; G533-E536 CarbonylContact O-C 3.51Å; G533-E536 PolarHBondContact O-N 3.19Å; G533-E536 VanDerWaalsContact O-N 3.14Å; G533-D537 VanDerWaalsContact O-CB 3.29Å; G533-D537 WeakPolarHBondContact O-CB 3.35Å; G533-D537 PolarHBondContact O-N 2.8Å
534	A	85.3	Confident	83.6	Confident	2 Å²	2	55.7 Å²	55.7	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-58.2	-43.3	168	0	0	0	0	0	111.5	W530 E536 L538 F560	W530-A534 WeakPolarHBondContact O-CA 3.4Å; W530-A534 WeakPolarHBondContact O-CB 3.42Å; W530-A534 PolarHBondContact O-N 3.24Å; A534-E536 VanDerWaalsContact C-N 3.32Å; A534-E536 PolarHBondContact O-N 2.89Å; A534-L538 VanDerWaalsContact O-CB 3.3Å; A534-L538 WeakPolarHBondContact O-CB 3.43Å; A534-L538 WeakPolarHBondContact O-CD1 3.21Å; A534-L538 WeakPolarHBondContact O-CG 3.5Å; A534-L538 PolarHBondContact O-N 2.68Å; A534-F560 HydrophobicContact CB-CE2 3.97Å; A534-F560 HydrophobicContact CB-CZ 3.62Å
535	M	85.4	Confident	83	Confident	27 Å²	27	60 Å²	60	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-64.8	-35.4	175.5	-72.2	-176.7	-64.8	0	0	112.5	M531 E532 G533 Q539 K612 A613 M616	M531-M535 WeakPolarHBondContact O-CE 3.35Å; M531-M535 VanDerWaalsContact O-CG 3.29Å; M531-M535 WeakPolarHBondContact O-CG 3.41Å; M531-M535 PolarHBondContact O-N 2.97Å; E532-M535 HydrophobicContact CB-CE 4.4Å; E532-M535 HydrophobicContact CG-CE 3.8Å; E532-M535 CarbonylContact O-C 3.47Å; E532-M535 WeakPolarHBondContact O-CA 3.35Å; E532-M535 WeakPolarHBondContact O-CB 3.38Å; E532-M535 PolarHBondContact O-N 2.89Å; G533-M535 VanDerWaalsContact C-N 3.31Å; G533-M535 PolarHBondContact O-N 3Å; M535-Q539 WeakPolarHBondContact O-CG 3.47Å; M535-Q539 PolarHBondContact O-N 3.48Å; M535-K612 HydrophobicContact SD-CB 3.71Å; M535-A613 HydrophobicContact CG-CB 3.71Å; M535-A613 HydrophobicContact SD-CB 4.28Å; M535-M616 HydrophobicContact CB-CE 3.9Å; M535-M616 HydrophobicContact CB-SD 3.85Å; M535-M616 HydrophobicContact CG-CE 4.29Å; M535-M616 HydrophobicContact CG-SD 3.56Å; M535-M616 VanDerWaalsContact CG-SD 3.56Å; M535-M616 VanDerWaalsContact O-CE 3.29Å; M535-M616 WeakPolarHBondContact O-CE 3.36Å; M535-M616 HydrophobicContact SD-SD 3.97Å
536	E	84.5	Confident	82.7	Confident	132 Å²	132	61.1 Å²	61.1	62%	0.617	31%	0.309	S	S	*	.	H	α-helix	trans	-74.3	-49.4	177.7	-72.9	175.7	179.3	0	0	112.4	E532 G533 A534 L538 Q539 D540	E532-E536 WeakPolarHBondContact O-CG 3.4Å; E532-E536 PolarHBondContact O-N 3.36Å; G533-E536 CarbonylContact O-C 3.51Å; G533-E536 PolarHBondContact O-N 3.19Å; G533-E536 VanDerWaalsContact O-N 3.14Å; A534-E536 VanDerWaalsContact C-N 3.32Å; A534-E536 PolarHBondContact O-N 2.89Å; E536-L538 PolarHBondContact O-N 3.29Å; E536-L538 VanDerWaalsContact O-N 3.14Å; E536-Q539 CarbonylContact O-C 3.43Å; E536-Q539 WeakPolarHBondContact O-CA 3.42Å; E536-Q539 PolarHBondContact O-N 3.17Å; E536-D540 WeakPolarHBondContact O-CA 3.46Å; E536-D540 WeakPolarHBondContact O-CB 3.13Å; E536-D540 PolarHBondContact O-N 3.29Å
537	D	82.7	Confident	82.7	Confident	99 Å²	99	60.5 Å²	60.5	53%	0.529	30%	0.302	S	S	.	.	H	α-helix	trans	-55.4	-31.5	175.6	-71.2	-23.4	0	0	0	112.2	G533 Q539 R620	G533-D537 VanDerWaalsContact O-CB 3.29Å; G533-D537 WeakPolarHBondContact O-CB 3.35Å; G533-D537 PolarHBondContact O-N 2.8Å; D537-Q539 VanDerWaalsContact C-N 3.35Å; D537-R620 PolarHBondContact O-NE 3.08Å; D537-R620 PolarHBondContact O-NH2 3.48Å
538	L	83.5	Confident	82.5	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.052	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-15.4	175.5	-66.6	170.7	0	0	0	113.4	A534 E536 H557 F560 M616 V617 R620	A534-L538 VanDerWaalsContact O-CB 3.3Å; A534-L538 WeakPolarHBondContact O-CB 3.43Å; A534-L538 WeakPolarHBondContact O-CD1 3.21Å; A534-L538 WeakPolarHBondContact O-CG 3.5Å; A534-L538 PolarHBondContact O-N 2.68Å; E536-L538 PolarHBondContact O-N 3.29Å; E536-L538 VanDerWaalsContact O-N 3.14Å; L538-H557 WeakPolarHBondContact CD2-CE1 3.3Å; L538-F560 HydrophobicContact CD1-CE1 4.22Å; L538-F560 HydrophobicContact CD2-CD1 4.47Å; L538-F560 HydrophobicContact CD2-CE1 4.3Å; L538-F560 HydrophobicContact CG-CE1 4.49Å; L538-M616 HydrophobicContact CB-CB 4.27Å; L538-M616 HydrophobicContact CD1-CB 4.11Å; L538-V617 HydrophobicContact CD1-CB 4.32Å; L538-V617 HydrophobicContact CD1-CG2 3.59Å; L538-V617 HydrophobicContact CD2-CB 4.47Å; L538-V617 HydrophobicContact CD2-CG2 4.34Å; L538-R620 HydrophobicContact CB-CB 4.37Å; L538-R620 HydrophobicContact CD2-CB 3.72Å; L538-R620 HydrophobicContact CD2-CG 3.98Å
539	Q	83.6	Confident	82.1	Confident	134 Å²	134	71.5 Å²	71.5	63%	0.626	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-9.2	174.9	-68.2	-169.9	-53.4	0	0	114.1	M535 E536 D537 M616	M535-Q539 WeakPolarHBondContact O-CG 3.47Å; M535-Q539 PolarHBondContact O-N 3.48Å; E536-Q539 CarbonylContact O-C 3.43Å; E536-Q539 WeakPolarHBondContact O-CA 3.42Å; E536-Q539 PolarHBondContact O-N 3.17Å; D537-Q539 VanDerWaalsContact C-N 3.35Å; Q539-M616 HydrophobicContact CG-CE 3.44Å; Q539-M616 VanDerWaalsContact CG-CE 3.44Å
540	D	83.9	Confident	82.3	Confident	81 Å²	81	67.1 Å²	67.1	43%	0.433	33%	0.329	S	S	.	.			trans	-62.2	155.6	-167.6	162.6	63	0	0	0	113.1	E536 R620	E536-D540 WeakPolarHBondContact O-CA 3.46Å; E536-D540 WeakPolarHBondContact O-CB 3.13Å; E536-D540 PolarHBondContact O-N 3.29Å; D540-R620 PolarHBondContact O-NH1 3.07Å; D540-R620 IonicContact OD2-NH2 3.03Å; D540-R620 PolarHBondContact OD2-NH2 3.24Å
541	M	73.8	Confident	82.2	Confident	161 Å²	161	69 Å²	69	79%	0.793	34%	0.341	S	S	*	.			trans	-110	99.2	-178.7	-164.5	179.3	70.1	0	0	110.4
542	F	83	Confident	82.1	Confident	35 Å²	35	70.8 Å²	70.8	15%	0.154	36%	0.36	C	S	.	.			trans	-83.4	148.8	-176.5	53.5	-79.7	0	0	0	112.1	I550 L553 R620 A623 L624 E627	F542-I550 HydrophobicContact CD2-CD1 3.73Å; F542-I550 HydrophobicContact CE2-CD1 3.59Å; F542-L553 HydrophobicContact CB-CD1 3.86Å; F542-L553 HydrophobicContact CD2-CD1 4Å; F542-L553 HydrophobicContact CG-CD1 4.07Å; F542-R620 VanDerWaalsContact CE1-NH1 3.32Å; F542-A623 HydrophobicContact CE1-CB 4.01Å; F542-A623 HydrophobicContact CZ-CB 4.14Å; F542-A623 WeakPolarHBondContact CZ-O 3.39Å; F542-L624 HydrophobicContact CD1-CD2 3.73Å; F542-L624 HydrophobicContact CD2-CD2 3.96Å; F542-L624 HydrophobicContact CE1-CD2 3.67Å; F542-L624 HydrophobicContact CE1-CG 4.16Å; F542-L624 HydrophobicContact CE2-CD2 3.87Å; F542-L624 HydrophobicContact CG-CD2 3.92Å; F542-L624 HydrophobicContact CZ-CB 4.45Å; F542-L624 HydrophobicContact CZ-CD2 3.77Å; F542-L624 HydrophobicContact CZ-CG 4.24Å; F542-E627 HydrophobicContact CD2-CB 4.41Å; F542-E627 HydrophobicContact CD2-CG 4.36Å; F542-E627 HydrophobicContact CE2-CB 3.63Å; F542-E627 HydrophobicContact CE2-CG 4.05Å; F542-E627 HydrophobicContact CZ-CB 4.49Å
543	I	74.4	Confident	82.2	Confident	117 Å²	117	70.6 Å²	70.6	60%	0.6	36%	0.361	S	S	*	.			trans	-131	134.2	172.3	-54.4	174.7	0	0	0	106.7
544	V	82.8	Confident	82.6	Confident	5 Å²	5	72.2 Å²	72.2	3%	0.03	36%	0.364	C	S	.	.			trans	-124.9	166	177.2	-72.4	0	0	0	0	110.3	E549 I550 L553 E627 Q631	V544-E549 HydrophobicContact CB-CB 4.1Å; V544-E549 HydrophobicContact CG1-CB 3.76Å; V544-I550 HydrophobicContact CB-CB 4.24Å; V544-I550 HydrophobicContact CG1-CB 3.94Å; V544-I550 HydrophobicContact CG2-CB 3.77Å; V544-I550 HydrophobicContact CG2-CD1 4.47Å; V544-I550 HydrophobicContact CG2-CG1 4.35Å; V544-I550 HydrophobicContact CG2-CG2 4.21Å; V544-L553 HydrophobicContact CG1-CD1 3.77Å; V544-E627 HydrophobicContact CG2-CG 3.43Å; V544-E627 VanDerWaalsContact CG2-CG 3.43Å; V544-Q631 VanDerWaalsContact C-CD 3.49Å; V544-Q631 HydrophobicContact CB-CG 4.17Å; V544-Q631 HydrophobicContact CG2-CG 3.38Å; V544-Q631 PolarHBondContact O-NE2 3.41Å; V544-Q631 PolarHBondContact O-OE1 3.43Å
545	H	72.9	Confident	82.7	Confident	89 Å²	89	75.6 Å²	75.6	41%	0.412	39%	0.388	S	S	.	.	S	Bend	trans	-134.3	-5.4	-173.9	-54.5	87.6	0	0	0	113	E549 Q631 R638	H545-E549 PolarHBondContact N-OE2 3.45Å; H545-Q631 PolarHBondContact O-OE1 3.46Å; H545-R638 PolarHBondContact O-NH2 3.33Å
546	N	77.5	Confident	82.7	Confident	56 Å²	56	76.8 Å²	76.8	30%	0.299	40%	0.402	S	S	.	.	S	Bend	trans	-144.6	173.2	166.4	64.1	62.6	0	0	0	111.4	E548 E549	N546-E548 PolarHBondContact OD1-N 3.46Å; N546-E549 PolarHBondContact N-OE2 3.36Å; N546-E549 PolarHBondContact ND2-OE1 3.31Å; N546-E549 VanDerWaalsContact OD1-CG 3.31Å; N546-E549 WeakPolarHBondContact OD1-CG 3.42Å; N546-E549 PolarHBondContact OD1-N 3.43Å
547	I	81.9	Confident	83	Confident	57 Å²	57	71.2 Å²	71.2	29%	0.292	38%	0.376	S	S	.	.	H	α-helix	trans	-76.6	-29.8	-171.5	-56.4	157.7	0	0	0	111.5	I550 L628 Q631 N632	I547-I550 VanDerWaalsContact O-CG2 3.23Å; I547-I550 WeakPolarHBondContact O-CG2 3.35Å; I547-L628 HydrophobicContact CG2-CD1 3.7Å; I547-Q631 HydrophobicContact CG1-CB 4.2Å; I547-N632 HydrophobicContact CD1-CB 4.48Å; I547-N632 VanDerWaalsContact CD1-OD1 3.27Å; I547-N632 WeakPolarHBondContact CD1-OD1 3.41Å
548	E	84.9	Confident	83.2	Confident	164 Å²	164	71.8 Å²	71.8	77%	0.766	38%	0.375	S	S	*	.	H	α-helix	trans	-75.2	-40.2	-176.4	-169.7	170	-174.1	0	0	111.7	N546 I550 Q551 G552	N546-E548 PolarHBondContact OD1-N 3.46Å; E548-I550 PolarHBondContact O-N 3.44Å; E548-Q551 PolarHBondContact O-N 3.42Å; E548-G552 PolarHBondContact O-N 3.47Å
549	E	80.4	Confident	83.3	Confident	81 Å²	81	78 Å²	78	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-51.4	-52.6	177.8	-80.9	164.8	-173.4	0	0	113.2	V544 H545 N546 Q551 G552 L553	V544-E549 HydrophobicContact CB-CB 4.1Å; V544-E549 HydrophobicContact CG1-CB 3.76Å; H545-E549 PolarHBondContact N-OE2 3.45Å; N546-E549 PolarHBondContact N-OE2 3.36Å; N546-E549 PolarHBondContact ND2-OE1 3.31Å; N546-E549 VanDerWaalsContact OD1-CG 3.31Å; N546-E549 WeakPolarHBondContact OD1-CG 3.42Å; N546-E549 PolarHBondContact OD1-N 3.43Å; E549-Q551 VanDerWaalsContact C-N 3.32Å; E549-Q551 PolarHBondContact O-N 2.78Å; E549-G552 CarbonylContact O-C 3.29Å; E549-G552 WeakPolarHBondContact O-CA 3.39Å; E549-G552 PolarHBondContact O-N 2.88Å; E549-G552 VanDerWaalsContact O-N 3.11Å; E549-L553 PolarHBondContact O-N 3.33Å
550	I	87.5	Confident	83.6	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-69.3	-30.7	-177.3	-178.7	61.7	0	0	0	112.4	F542 V544 I547 E548 G552 L553 I554 L624 E627 L628	F542-I550 HydrophobicContact CD2-CD1 3.73Å; F542-I550 HydrophobicContact CE2-CD1 3.59Å; V544-I550 HydrophobicContact CB-CB 4.24Å; V544-I550 HydrophobicContact CG1-CB 3.94Å; V544-I550 HydrophobicContact CG2-CB 3.77Å; V544-I550 HydrophobicContact CG2-CD1 4.47Å; V544-I550 HydrophobicContact CG2-CG1 4.35Å; V544-I550 HydrophobicContact CG2-CG2 4.21Å; I547-I550 VanDerWaalsContact O-CG2 3.23Å; I547-I550 WeakPolarHBondContact O-CG2 3.35Å; E548-I550 PolarHBondContact O-N 3.44Å; I550-G552 VanDerWaalsContact C-N 3.31Å; I550-L553 HydrophobicContact CD1-CB 4.43Å; I550-L553 HydrophobicContact CD1-CD1 3.98Å; I550-L553 PolarHBondContact O-N 3.13Å; I550-I554 WeakPolarHBondContact O-CG1 3.49Å; I550-I554 PolarHBondContact O-N 3.38Å; I550-I554 VanDerWaalsContact O-N 3.17Å; I550-L624 HydrophobicContact CD1-CD2 4.07Å; I550-L624 WeakPolarHBondContact CD1-O 3.48Å; I550-E627 HydrophobicContact CD1-CB 4.3Å; I550-L628 HydrophobicContact CG1-CB 3.93Å; I550-L628 HydrophobicContact CG2-CB 4.01Å; I550-L628 HydrophobicContact CG2-CD1 3.55Å; I550-L628 HydrophobicContact CG2-CG 4.36Å
551	Q	86.6	Confident	83.8	Confident	112 Å²	112	72.3 Å²	72.3	52%	0.523	37%	0.374	S	S	.	.	H	α-helix	trans	-73.3	-29	173	-156.2	146.6	18.3	0	0	111.6	E548 E549 S555	E548-Q551 PolarHBondContact O-N 3.42Å; E549-Q551 VanDerWaalsContact C-N 3.32Å; E549-Q551 PolarHBondContact O-N 2.78Å; Q551-S555 PolarHBondContact O-N 3.4Å; Q551-S555 PolarHBondContact O-OG 3.49Å
552	G	83.9	Confident	84.6	Confident	38 Å²	38	68.6 Å²	68.6	39%	0.392	36%	0.364	S	S	.	.	H	α-helix	trans	-62.4	-46.6	164	0	0	0	0	0	113	E548 E549 I550 I554 S555 A556	E548-G552 PolarHBondContact O-N 3.47Å; E549-G552 CarbonylContact O-C 3.29Å; E549-G552 WeakPolarHBondContact O-CA 3.39Å; E549-G552 PolarHBondContact O-N 2.88Å; E549-G552 VanDerWaalsContact O-N 3.11Å; I550-G552 VanDerWaalsContact C-N 3.31Å; G552-I554 PolarHBondContact O-N 3.39Å; G552-S555 WeakPolarHBondContact O-CB 3.45Å; G552-S555 PolarHBondContact O-N 3.28Å; G552-S555 VanDerWaalsContact O-N 3.09Å; G552-A556 PolarHBondContact O-N 3.1Å
553	L	86.8	Confident	84.7	Confident	64 Å²	64	69.4 Å²	69.4	34%	0.335	37%	0.371	S	S	.	.	H	α-helix	trans	-59.9	-41.3	178.4	-67.2	176.7	0	0	0	112.8	F542 V544 E549 I550 S555 A556 H557 L624	F542-L553 HydrophobicContact CB-CD1 3.86Å; F542-L553 HydrophobicContact CD2-CD1 4Å; F542-L553 HydrophobicContact CG-CD1 4.07Å; V544-L553 HydrophobicContact CG1-CD1 3.77Å; E549-L553 PolarHBondContact O-N 3.33Å; I550-L553 HydrophobicContact CD1-CB 4.43Å; I550-L553 HydrophobicContact CD1-CD1 3.98Å; I550-L553 PolarHBondContact O-N 3.13Å; L553-S555 VanDerWaalsContact C-N 3.32Å; L553-S555 PolarHBondContact O-N 3.27Å; L553-A556 PolarHBondContact O-N 3.41Å; L553-H557 PolarHBondContact O-N 3.3Å; L553-H557 VanDerWaalsContact O-N 3.11Å; L553-L624 HydrophobicContact CB-CD2 3.75Å; L553-L624 HydrophobicContact CD1-CD2 4.19Å
554	I	88.5	Confident	85.5	Confident	52 Å²	52	65.2 Å²	65.2	27%	0.267	35%	0.35	S	S	.	.	H	α-helix	trans	-59.3	-44.6	173.6	-66.7	168.5	0	0	0	110.7	I550 G552 H557 E558 L624	I550-I554 WeakPolarHBondContact O-CG1 3.49Å; I550-I554 PolarHBondContact O-N 3.38Å; I550-I554 VanDerWaalsContact O-N 3.17Å; G552-I554 PolarHBondContact O-N 3.39Å; I554-H557 PolarHBondContact O-N 3.27Å; I554-E558 PolarHBondContact O-N 3.47Å; I554-L624 HydrophobicContact CD1-CB 4.48Å; I554-L624 HydrophobicContact CG1-CB 3.69Å; I554-L624 HydrophobicContact CG1-CD1 4.47Å
555	S	89	Confident	85.8	Confident	74 Å²	74	69.4 Å²	69.4	52%	0.517	38%	0.377	S	S	.	.	H	α-helix	trans	-67.5	-36.2	179.6	-55.5	0	0	0	0	112.5	Q551 G552 L553 E558 Q559	Q551-S555 PolarHBondContact O-N 3.4Å; Q551-S555 PolarHBondContact O-OG 3.49Å; G552-S555 WeakPolarHBondContact O-CB 3.45Å; G552-S555 PolarHBondContact O-N 3.28Å; G552-S555 VanDerWaalsContact O-N 3.09Å; L553-S555 VanDerWaalsContact C-N 3.32Å; L553-S555 PolarHBondContact O-N 3.27Å; S555-E558 PolarHBondContact O-N 2.85Å; S555-Q559 PolarHBondContact O-N 3.43Å; S555-Q559 VanDerWaalsContact O-N 3.1Å
556	A	83.9	Confident	86.4	Confident	52 Å²	52	71.7 Å²	71.7	43%	0.43	39%	0.388	S	S	.	.	H	α-helix	trans	-66.5	-38.8	177.3	0	0	0	0	0	112.3	G552 L553 Q559 F560	G552-A556 PolarHBondContact O-N 3.1Å; L553-A556 PolarHBondContact O-N 3.41Å; A556-Q559 PolarHBondContact O-N 2.97Å; A556-Q559 VanDerWaalsContact O-N 3.16Å; A556-F560 PolarHBondContact O-N 3.31Å
557	H	90.5	Very high	86.9	Confident	15 Å²	15	69.7 Å²	69.7	7%	0.069	38%	0.38	C	S	.	.	H	α-helix	trans	-65.9	-36.3	176.2	-179.9	53.6	0	0	0	112.5	L538 L553 I554 F560 K561 V617 D621 L624	L538-H557 WeakPolarHBondContact CD2-CE1 3.3Å; L553-H557 PolarHBondContact O-N 3.3Å; L553-H557 VanDerWaalsContact O-N 3.11Å; I554-H557 PolarHBondContact O-N 3.27Å; H557-F560 PolarHBondContact O-N 2.9Å; H557-K561 WeakPolarHBondContact O-CE 3.31Å; H557-K561 WeakPolarHBondContact O-CG 3.41Å; H557-K561 PolarHBondContact O-N 3.05Å; H557-V617 PolarHBondContact CE1-O 2.89Å; H557-V617 PolarHBondContact NE2-O 3.18Å; H557-D621 IonicContact CD2-OD1 2.7Å; H557-D621 PolarHBondContact CD2-OD1 3.49Å; H557-D621 IonicContact CD2-OD2 3.6Å; H557-D621 IonicContact CE1-OD2 2.7Å; H557-D621 IonicContact NE2-OD1 3.62Å; H557-D621 PolarHBondContact NE2-OD1 3.42Å; H557-D621 VanDerWaalsContact NE2-OD1 3.14Å; H557-D621 IonicContact NE2-OD2 2.81Å; H557-D621 PolarHBondContact NE2-OD2 2.85Å; H557-L624 HydrophobicContact CB-CD1 4.07Å
558	E	87.7	Confident	87.2	Confident	110 Å²	110	69.2 Å²	69.2	51%	0.514	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-42.1	168.4	-75.6	-62	158.1	0	0	112.6	I554 S555 K561	I554-E558 PolarHBondContact O-N 3.47Å; S555-E558 PolarHBondContact O-N 2.85Å; E558-K561 PolarHBondContact O-N 2.83Å; E558-K561 WeakPolarHBondContact OE1-CE 3.43Å; E558-K561 IonicContact OE1-NZ 3.81Å; E558-K561 PolarHBondContact OE1-NZ 3.37Å; E558-K561 WeakPolarHBondContact OE2-CE 3.41Å; E558-K561 IonicContact OE2-NZ 2.86Å; E558-K561 PolarHBondContact OE2-NZ 3.13Å
559	Q	86.6	Confident	87.4	Confident	141 Å²	141	67.8 Å²	67.8	66%	0.659	37%	0.369	S	S	*	.	H	α-helix	trans	-65.4	-40.4	177.4	-171.6	174	-2.9	0	0	112.2	S555 A556 K561 S562	S555-Q559 PolarHBondContact O-N 3.43Å; S555-Q559 VanDerWaalsContact O-N 3.1Å; A556-Q559 PolarHBondContact O-N 2.97Å; A556-Q559 VanDerWaalsContact O-N 3.16Å; Q559-K561 VanDerWaalsContact C-N 3.3Å; Q559-K561 PolarHBondContact O-N 3.26Å; Q559-S562 WeakPolarHBondContact O-CB 3.05Å; Q559-S562 PolarHBondContact O-N 3.33Å; Q559-S562 PolarHBondContact O-OG 3.25Å
560	F	88.6	Confident	87.7	Confident	40 Å²	40	67.2 Å²	67.2	18%	0.175	37%	0.366	C	S	.	.	H	α-helix	trans	-53.5	-46.6	175.8	167.8	-101.5	0	0	0	111.8	W530 A534 L538 A556 H557 S562 T563 L564 V617	W530-F560 HydrophobicContact CZ2-CE2 4.09Å; W530-F560 HydrophobicContact CZ2-CZ 4.45Å; A534-F560 HydrophobicContact CB-CE2 3.97Å; A534-F560 HydrophobicContact CB-CZ 3.62Å; L538-F560 HydrophobicContact CD1-CE1 4.22Å; L538-F560 HydrophobicContact CD2-CD1 4.47Å; L538-F560 HydrophobicContact CD2-CE1 4.3Å; L538-F560 HydrophobicContact CG-CE1 4.49Å; A556-F560 PolarHBondContact O-N 3.31Å; H557-F560 PolarHBondContact O-N 2.9Å; F560-S562 PolarHBondContact O-N 3.46Å; F560-T563 PolarHBondContact O-N 2.87Å; F560-T563 PolarHBondContact O-OG1 3.06Å; F560-L564 HydrophobicContact CE1-CD2 4.15Å; F560-L564 HydrophobicContact CE2-CD2 4.35Å; F560-L564 HydrophobicContact CZ-CD2 3.81Å; F560-V617 HydrophobicContact CE1-CG2 4.25Å
561	K	88.9	Confident	87.8	Confident	55 Å²	55	69.9 Å²	69.9	24%	0.239	38%	0.377	C	S	.	.	H	α-helix	trans	-56.3	-25.5	178.8	-69.7	-179.4	-71	-164.2	0	113.5	H557 E558 Q559 V617 D621	H557-K561 WeakPolarHBondContact O-CE 3.31Å; H557-K561 WeakPolarHBondContact O-CG 3.41Å; H557-K561 PolarHBondContact O-N 3.05Å; E558-K561 PolarHBondContact O-N 2.83Å; E558-K561 WeakPolarHBondContact OE1-CE 3.43Å; E558-K561 IonicContact OE1-NZ 3.81Å; E558-K561 PolarHBondContact OE1-NZ 3.37Å; E558-K561 WeakPolarHBondContact OE2-CE 3.41Å; E558-K561 IonicContact OE2-NZ 2.86Å; E558-K561 PolarHBondContact OE2-NZ 3.13Å; Q559-K561 VanDerWaalsContact C-N 3.3Å; Q559-K561 PolarHBondContact O-N 3.26Å; K561-V617 HydrophobicContact CD-CG1 3.46Å; K561-V617 VanDerWaalsContact CD-CG1 3.46Å; K561-V617 HydrophobicContact CG-CG1 3.58Å; K561-D621 IonicContact NZ-OD1 3.36Å; K561-D621 PolarHBondContact NZ-OD1 3.37Å; K561-D621 IonicContact NZ-OD2 2.78Å
562	S	90.3	Very high	87.8	Confident	83 Å²	83	70.1 Å²	70.1	58%	0.58	38%	0.377	S	S	*	.	H	α-helix	trans	-76.1	-20.8	178	76.5	0	0	0	0	114.8	Q559 F560 P565	Q559-S562 WeakPolarHBondContact O-CB 3.05Å; Q559-S562 PolarHBondContact O-N 3.33Å; Q559-S562 PolarHBondContact O-OG 3.25Å; F560-S562 PolarHBondContact O-N 3.46Å; S562-P565 WeakPolarHBondContact O-CD 3.28Å
563	T	86.1	Confident	88.1	Confident	52 Å²	52	70.1 Å²	70.1	32%	0.319	37%	0.374	S	S	.	.	H	α-helix	trans	-83.9	-18.5	-171.7	66.6	0	0	0	0	114.4	F560 P565 E566 A567	F560-T563 PolarHBondContact O-N 2.87Å; F560-T563 PolarHBondContact O-OG1 3.06Å; T563-P565 VanDerWaalsContact C-N 3.35Å; T563-E566 PolarHBondContact O-N 3.05Å; T563-A567 PolarHBondContact O-N 3.28Å
564	L	89.3	Confident	88.1	Confident	29 Å²	29	67 Å²	67	15%	0.152	36%	0.358	C	S	.	.	H	α-helix	trans	-53.1	-36.7	-173.2	-52.1	-179.9	0	0	0	114.9	W530 F560 E566 N568 W610 M614	W530-L564 HydrophobicContact CH2-CD2 3.68Å; W530-L564 HydrophobicContact CZ2-CD2 3.87Å; F560-L564 HydrophobicContact CE1-CD2 4.15Å; F560-L564 HydrophobicContact CE2-CD2 4.35Å; F560-L564 HydrophobicContact CZ-CD2 3.81Å; L564-E566 VanDerWaalsContact C-N 3.34Å; L564-E566 PolarHBondContact O-N 3.18Å; L564-N568 PolarHBondContact O-N 3.15Å; L564-W610 VanDerWaalsContact O-CH2 3.32Å; L564-W610 WeakPolarHBondContact O-CH2 3.39Å; L564-M614 HydrophobicContact CD1-CE 4.02Å; L564-M614 HydrophobicContact CD1-SD 3.96Å; L564-M614 HydrophobicContact CD2-CE 3.89Å; L564-M614 HydrophobicContact CG-CE 4.44Å
565	P	89.4	Confident	87.9	Confident	93 Å²	93	68.5 Å²	68.5	60%	0.604	36%	0.364	S	S	*	.	H	α-helix	trans	-67.8	-28.3	178.3	-21.7	35	0	0	0	114.5	S562 T563	S562-P565 WeakPolarHBondContact O-CD 3.28Å; T563-P565 VanDerWaalsContact C-N 3.35Å
566	E	86.4	Confident	87.8	Confident	137 Å²	137	68.1 Å²	68.1	64%	0.64	37%	0.365	S	S	*	.	H	α-helix	trans	-80.7	-39.7	-179.6	-60.6	-162.7	140.7	0	0	111.2	T563 L564 N568 K569 E570	T563-E566 PolarHBondContact O-N 3.05Å; L564-E566 VanDerWaalsContact C-N 3.34Å; L564-E566 PolarHBondContact O-N 3.18Å; E566-N568 PolarHBondContact O-N 2.82Å; E566-K569 WeakPolarHBondContact O-CB 3.41Å; E566-K569 PolarHBondContact O-N 3.47Å; E566-E570 PolarHBondContact O-N 3.07Å
567	A	86.8	Confident	88	Confident	15 Å²	15	66.6 Å²	66.6	12%	0.124	35%	0.349	C	S	.	.	H	α-helix	trans	-56	-36.1	173.2	0	0	0	0	0	111.9	F527 W530 T563 K569 E570 R571 W610	F527-A567 HydrophobicContact CE2-CB 4.1Å; F527-A567 WeakPolarHBondContact CE2-O 3.37Å; F527-A567 WeakPolarHBondContact CZ-O 3.24Å; W530-A567 HydrophobicContact CD2-CB 4.4Å; W530-A567 HydrophobicContact CE3-CB 4.25Å; W530-A567 HydrophobicContact CH2-CB 3.55Å; W530-A567 HydrophobicContact CZ2-CB 3.67Å; W530-A567 HydrophobicContact CZ3-CB 3.88Å; T563-A567 PolarHBondContact O-N 3.28Å; A567-K569 VanDerWaalsContact C-N 3.29Å; A567-K569 PolarHBondContact O-N 3.09Å; A567-E570 PolarHBondContact O-N 3.14Å; A567-R571 PolarHBondContact O-N 3.47Å; A567-W610 HydrophobicContact CB-CH2 3.77Å; A567-W610 HydrophobicContact CB-CZ3 3.77Å
568	N	88.8	Confident	87.6	Confident	47 Å²	47	68.1 Å²	68.1	25%	0.251	36%	0.356	S	S	.	.	H	α-helix	trans	-63.8	-26.5	173.9	178.4	67.7	0	0	0	114.2	L564 E566 R571 W610	L564-N568 PolarHBondContact O-N 3.15Å; E566-N568 PolarHBondContact O-N 2.82Å; N568-R571 WeakPolarHBondContact O-CB 3.45Å; N568-R571 PolarHBondContact OD1-NE 3.36Å; N568-R571 VanDerWaalsContact OD1-NE 3.09Å; N568-R571 PolarHBondContact OD1-NH2 3.14Å; N568-W610 HydrophobicContact CB-CH2 4.04Å; N568-W610 HydrophobicContact CB-CZ2 3.89Å
569	K	89.1	Confident	87.4	Confident	133 Å²	133	66 Å²	66	58%	0.578	36%	0.358	S	S	*	.	H	α-helix	trans	-73.2	-34.9	175.1	-64.2	175.8	-177.3	165.2	0	111.9	E566 A567 R571 E572 A573	E566-K569 WeakPolarHBondContact O-CB 3.41Å; E566-K569 PolarHBondContact O-N 3.47Å; A567-K569 VanDerWaalsContact C-N 3.29Å; A567-K569 PolarHBondContact O-N 3.09Å; K569-R571 VanDerWaalsContact C-N 3.28Å; K569-R571 PolarHBondContact O-N 2.64Å; K569-E572 PolarHBondContact O-N 3.04Å; K569-A573 PolarHBondContact O-N 3.11Å
570	E	86.9	Confident	87.4	Confident	69 Å²	69	62.7 Å²	62.7	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-38.7	179.3	-177.8	55.6	-159.9	0	0	111.2	R523 F527 E566 A567 E572 A573 I574	R523-E570 IonicContact CZ-OE1 3.11Å; R523-E570 IonicContact CZ-OE2 3.26Å; R523-E570 IonicContact NE-OE1 3.09Å; R523-E570 PolarHBondContact NE-OE1 3.04Å; R523-E570 IonicContact NH2-OE1 3.79Å; R523-E570 PolarHBondContact NH2-OE1 3.44Å; R523-E570 IonicContact NH2-OE2 2.66Å; R523-E570 PolarHBondContact NH2-OE2 3.23Å; F527-E570 HydrophobicContact CD2-CB 4.27Å; F527-E570 HydrophobicContact CD2-CG 4.13Å; F527-E570 HydrophobicContact CE2-CB 4.43Å; E566-E570 PolarHBondContact O-N 3.07Å; A567-E570 PolarHBondContact O-N 3.14Å; E570-E572 VanDerWaalsContact C-N 3.28Å; E570-E572 PolarHBondContact O-N 3.1Å; E570-A573 PolarHBondContact O-N 3.28Å; E570-I574 HydrophobicContact CG-CD1 4.19Å; E570-I574 WeakPolarHBondContact O-CD1 3.43Å; E570-I574 WeakPolarHBondContact O-CG1 3.5Å; E570-I574 PolarHBondContact O-N 3.41Å
571	R	89.4	Confident	87.1	Confident	57 Å²	57	60.8 Å²	60.8	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-48.7	-45.3	170.9	-169.2	173.7	64.5	114.1	-1.5	113.3	F527 A567 N568 K569 I606 D607	F527-R571 HydrophobicContact CD1-CB 4.43Å; F527-R571 HydrophobicContact CE1-CB 3.6Å; F527-R571 HydrophobicContact CE1-CG 3.76Å; F527-R571 HydrophobicContact CZ-CB 3.67Å; F527-R571 HydrophobicContact CZ-CG 4.25Å; A567-R571 PolarHBondContact O-N 3.47Å; N568-R571 WeakPolarHBondContact O-CB 3.45Å; N568-R571 PolarHBondContact OD1-NE 3.36Å; N568-R571 VanDerWaalsContact OD1-NE 3.09Å; N568-R571 PolarHBondContact OD1-NH2 3.14Å; K569-R571 VanDerWaalsContact C-N 3.28Å; K569-R571 PolarHBondContact O-N 2.64Å; R571-I606 HydrophobicContact CG-CG2 3.86Å; R571-D607 WeakPolarHBondContact CD-OD1 3.43Å; R571-D607 IonicContact CZ-OD1 3.18Å; R571-D607 IonicContact NE-OD1 3.99Å; R571-D607 IonicContact NH1-OD1 2.79Å; R571-D607 PolarHBondContact NH1-OD1 2.69Å
572	E	88	Confident	86.7	Confident	116 Å²	116	63.2 Å²	63.2	54%	0.542	35%	0.346	S	S	.	.	H	α-helix	trans	-71.2	-39.9	-177.4	-61.7	178	165.8	0	0	111.3	K569 E570 Q575	K569-E572 PolarHBondContact O-N 3.04Å; E570-E572 VanDerWaalsContact C-N 3.28Å; E570-E572 PolarHBondContact O-N 3.1Å; E572-Q575 PolarHBondContact O-N 2.95Å
573	A	88.1	Confident	86.5	Confident	38 Å²	38	65.9 Å²	65.9	31%	0.314	34%	0.344	S	S	.	.	H	α-helix	trans	-72.6	-27.5	-178.7	0	0	0	0	0	113.4	K569 E570 Q575 A576	K569-A573 PolarHBondContact O-N 3.11Å; E570-A573 PolarHBondContact O-N 3.28Å; A573-Q575 VanDerWaalsContact C-N 3.32Å; A573-A576 PolarHBondContact O-N 3.11Å
574	I	87.3	Confident	86.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-43.8	169.3	-71.8	157.4	0	0	0	111	Y520 R523 A524 F527 E570 A576 I577 I606	Y520-I574 HydrophobicContact CD2-CG2 3.99Å; Y520-I574 VanDerWaalsContact CD2-O 3.31Å; Y520-I574 WeakPolarHBondContact CD2-O 3.48Å; Y520-I574 HydrophobicContact CE2-CG2 3.67Å; R523-I574 HydrophobicContact CB-CD1 4.24Å; R523-I574 HydrophobicContact CB-CG1 3.56Å; R523-I574 WeakPolarHBondContact O-CD1 3.3Å; A524-I574 HydrophobicContact CB-CG2 3.94Å; F527-I574 HydrophobicContact CB-CD1 3.48Å; F527-I574 VanDerWaalsContact CB-CD1 3.48Å; F527-I574 HydrophobicContact CD1-CD1 3.87Å; F527-I574 HydrophobicContact CG-CD1 3.71Å; E570-I574 HydrophobicContact CG-CD1 4.19Å; E570-I574 WeakPolarHBondContact O-CD1 3.43Å; E570-I574 WeakPolarHBondContact O-CG1 3.5Å; E570-I574 PolarHBondContact O-N 3.41Å; I574-A576 VanDerWaalsContact C-N 3.25Å; I574-A576 PolarHBondContact O-N 3.09Å; I574-I577 PolarHBondContact O-N 2.99Å; I574-I606 HydrophobicContact CG2-CD1 4.09Å
575	Q	85.2	Confident	85.8	Confident	83 Å²	83	63.5 Å²	63.5	39%	0.388	33%	0.329	S	S	.	.	H	α-helix	trans	-65.6	-27.4	-176.5	-63.7	-176.8	-4.2	0	0	112.9	E572 A573	E572-Q575 PolarHBondContact O-N 2.95Å; A573-Q575 VanDerWaalsContact C-N 3.32Å
576	A	87.6	Confident	85.3	Confident	66 Å²	66	66.7 Å²	66.7	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-68.4	-33	-179.8	0	0	0	0	0	113.8	A573 I574 Q578 A579	A573-A576 PolarHBondContact O-N 3.11Å; I574-A576 VanDerWaalsContact C-N 3.25Å; I574-A576 PolarHBondContact O-N 3.09Å; A576-Q578 VanDerWaalsContact C-N 3.34Å; A576-Q578 PolarHBondContact O-N 3.24Å; A576-A579 WeakPolarHBondContact O-CB 3.43Å; A576-A579 PolarHBondContact O-N 2.88Å
577	I	86.6	Confident	85	Confident	20 Å²	20	64.1 Å²	64.1	10%	0.103	33%	0.333	C	S	.	.	H	α-helix	trans	-66.2	-38.3	-174	-59.5	165.6	0	0	0	111.3	L516 E519 I574 A579 E580 V581	L516-I577 HydrophobicContact CD2-CG2 4.45Å; L516-I577 VanDerWaalsContact O-CG2 3.28Å; L516-I577 WeakPolarHBondContact O-CG2 3.36Å; E519-I577 HydrophobicContact CB-CG2 4.34Å; E519-I577 HydrophobicContact CG-CD1 3.98Å; I574-I577 PolarHBondContact O-N 2.99Å; I577-A579 PolarHBondContact O-N 3.3Å; I577-A579 VanDerWaalsContact O-N 3.15Å; I577-E580 PolarHBondContact O-N 3.44Å; I577-V581 PolarHBondContact O-N 3.01Å
578	Q	83.3	Confident	84.5	Confident	47 Å²	47	67.5 Å²	67.5	22%	0.22	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-24	178.4	-176.3	64.1	14.4	0	0	112.8	Y520 A576	Y520-Q578 HydrophobicContact CD2-CB 3.9Å; Y520-Q578 HydrophobicContact CE2-CB 4.17Å; A576-Q578 VanDerWaalsContact C-N 3.34Å; A576-Q578 PolarHBondContact O-N 3.24Å
579	A	83.8	Confident	83.6	Confident	66 Å²	66	68.7 Å²	68.7	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-77.3	-32	175.4	0	0	0	0	0	112.8	A576 I577	A576-A579 WeakPolarHBondContact O-CB 3.43Å; A576-A579 PolarHBondContact O-N 2.88Å; I577-A579 PolarHBondContact O-N 3.3Å; I577-A579 VanDerWaalsContact O-N 3.15Å
580	E	84.8	Confident	82.8	Confident	70 Å²	70	64.5 Å²	64.5	33%	0.327	36%	0.356	S	S	.	.	H	α-helix	trans	-76.4	-35.1	-177.1	178.5	59.5	-174.3	0	0	112.5	L516 I577 Q582 R583	L516-E580 HydrophobicContact CD1-CG 4.12Å; I577-E580 PolarHBondContact O-N 3.44Å; E580-Q582 PolarHBondContact O-N 3.27Å; E580-R583 VanDerWaalsContact CD-NE 3.28Å; E580-R583 VanDerWaalsContact O-CB 3.25Å; E580-R583 WeakPolarHBondContact O-CB 3.31Å; E580-R583 PolarHBondContact O-N 3.07Å; E580-R583 IonicContact OE1-CZ 3.2Å; E580-R583 IonicContact OE1-NE 2.95Å; E580-R583 PolarHBondContact OE1-NE 3.36Å; E580-R583 IonicContact OE1-NH2 2.64Å; E580-R583 PolarHBondContact OE1-NH2 3.4Å; E580-R583 WeakPolarHBondContact OE2-CD 3.22Å; E580-R583 IonicContact OE2-CZ 3.87Å; E580-R583 IonicContact OE2-NE 2.86Å; E580-R583 PolarHBondContact OE2-NE 2.9Å
581	V	84	Confident	81.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-55	-39	175.1	-175.1	0	0	0	0	111.8	I513 L516 Y517 I577 R583	I513-V581 HydrophobicContact CG2-CG1 4.03Å; L516-V581 HydrophobicContact CB-CG2 3.55Å; Y517-V581 HydrophobicContact CD1-CB 4.25Å; Y517-V581 HydrophobicContact CD1-CG1 3.85Å; Y517-V581 HydrophobicContact CD1-CG2 3.86Å; Y517-V581 HydrophobicContact CD2-CG1 3.84Å; Y517-V581 HydrophobicContact CE1-CB 4.04Å; Y517-V581 HydrophobicContact CE1-CG1 3.57Å; Y517-V581 HydrophobicContact CE1-CG2 4.14Å; Y517-V581 HydrophobicContact CE2-CG1 3.58Å; Y517-V581 HydrophobicContact CG-CG1 3.97Å; Y517-V581 HydrophobicContact CG-CG2 4.25Å; Y517-V581 VanDerWaalsContact CZ-CG1 3.42Å; I577-V581 PolarHBondContact O-N 3.01Å; V581-R583 PolarHBondContact O-N 3.25Å
582	Q	80.6	Confident	80.8	Confident	107 Å²	107	71 Å²	71	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-66.6	-19.5	-179.3	-62.5	-175.9	-1.2	0	0	113	E580 Q586	E580-Q582 PolarHBondContact O-N 3.27Å; Q582-Q586 WeakPolarHBondContact O-CG 3.44Å; Q582-Q586 PolarHBondContact O-NE2 3.28Å; Q582-Q586 VanDerWaalsContact O-NE2 3.09Å
583	R	84.9	Confident	79.4	Confident	139 Å²	139	70.9 Å²	70.9	53%	0.525	40%	0.4	S	S	.	.	H	α-helix	trans	-82.5	-45.6	-178.4	-165.2	-172.8	66.7	72.6	2.7	112.5	E580 V581 A585 Q586	E580-R583 VanDerWaalsContact CD-NE 3.28Å; E580-R583 VanDerWaalsContact O-CB 3.25Å; E580-R583 WeakPolarHBondContact O-CB 3.31Å; E580-R583 PolarHBondContact O-N 3.07Å; E580-R583 IonicContact OE1-CZ 3.2Å; E580-R583 IonicContact OE1-NE 2.95Å; E580-R583 PolarHBondContact OE1-NE 3.36Å; E580-R583 IonicContact OE1-NH2 2.64Å; E580-R583 PolarHBondContact OE1-NH2 3.4Å; E580-R583 WeakPolarHBondContact OE2-CD 3.22Å; E580-R583 IonicContact OE2-CZ 3.87Å; E580-R583 IonicContact OE2-NE 2.86Å; E580-R583 PolarHBondContact OE2-NE 2.9Å; V581-R583 PolarHBondContact O-N 3.25Å; R583-A585 PolarHBondContact O-N 2.87Å; R583-Q586 PolarHBondContact O-N 3.38Å
584	I	81.4	Confident	78.2	Confident	27 Å²	27	72.1 Å²	72.1	14%	0.138	42%	0.416	C	S	.	.	H	α-helix	trans	-67.3	-36	-172.7	-64.4	-172.8	0	0	0	112.7	I513 L516 Q586 S587 N588	I513-I584 HydrophobicContact CD1-CG2 4.26Å; I513-I584 HydrophobicContact CG1-CB 4.41Å; I513-I584 HydrophobicContact CG1-CG2 3.88Å; L516-I584 HydrophobicContact CD1-CD1 3.52Å; I584-Q586 VanDerWaalsContact C-N 3.33Å; I584-Q586 PolarHBondContact O-N 3.18Å; I584-S587 PolarHBondContact O-OG 3Å; I584-N588 PolarHBondContact O-ND2 3.35Å
585	A	79	Confident	77.2	Confident	3 Å²	3	76.2 Å²	76.2	3%	0.025	45%	0.45	C	S	.	.	H	α-helix	trans	-63.6	-38.7	177.9	0	0	0	0	0	112.9	I513 R583 S587 N588 I590 L592	I513-A585 HydrophobicContact CD1-CB 4.25Å; R583-A585 PolarHBondContact O-N 2.87Å; A585-S587 VanDerWaalsContact C-N 3.33Å; A585-S587 PolarHBondContact O-N 3.27Å; A585-N588 PolarHBondContact O-N 3.12Å; A585-I590 PolarHBondContact O-N 2.83Å; A585-L592 HydrophobicContact CB-CD1 3.33Å; A585-L592 HydrophobicContact CB-CD2 4.2Å; A585-L592 HydrophobicContact CB-CG 3.42Å; A585-L592 VanDerWaalsContact CB-CG 3.42Å
586	Q	79.6	Confident	76.9	Confident	160 Å²	160	73.2 Å²	73.2	75%	0.748	44%	0.436	S	S	*	.	H	α-helix	trans	-67.5	-31	-176	-64.9	179.1	23.4	0	0	112.7	Q582 R583 I584	Q582-Q586 WeakPolarHBondContact O-CG 3.44Å; Q582-Q586 PolarHBondContact O-NE2 3.28Å; Q582-Q586 VanDerWaalsContact O-NE2 3.09Å; R583-Q586 PolarHBondContact O-N 3.38Å; I584-Q586 VanDerWaalsContact C-N 3.33Å; I584-Q586 PolarHBondContact O-N 3.18Å
587	S	80.2	Confident	76.5	Confident	84 Å²	84	74.5 Å²	74.5	59%	0.587	44%	0.439	S	S	*	.	H	α-helix	trans	-79	-23.8	-177.8	53.7	0	0	0	0	114.8	I584 A585	I584-S587 PolarHBondContact O-OG 3Å; A585-S587 VanDerWaalsContact C-N 3.33Å; A585-S587 PolarHBondContact O-N 3.27Å
588	N	76.1	Confident	76.3	Confident	86 Å²	86	78 Å²	78	46%	0.46	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	5	-171.5	-64.6	-71.7	0	0	0	113.7	I584 A585 I590	I584-N588 PolarHBondContact O-ND2 3.35Å; A585-N588 PolarHBondContact O-N 3.12Å; N588-I590 HydrophobicContact CB-CD1 3.86Å; N588-I590 HydrophobicContact CB-CG1 3.95Å; N588-I590 PolarHBondContact O-N 3.48Å
589	G	70.1	Confident	76.3	Confident	72 Å²	72	77 Å²	77	74%	0.742	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	9.6	-177.2	0	0	0	0	0	114.6
590	I	72.6	Confident	76.1	Confident	44 Å²	44	80.3 Å²	80.3	23%	0.226	46%	0.463	C	S	.	.			trans	-77.2	125.8	-178.4	-59	172	0	0	0	109.2	L510 I513 A585 N588 L592	L510-I590 HydrophobicContact CD2-CD1 4.33Å; L510-I590 HydrophobicContact CD2-CG2 3.92Å; I513-I590 HydrophobicContact CD1-CD1 4Å; I513-I590 HydrophobicContact CD1-CG2 4.44Å; A585-I590 PolarHBondContact O-N 2.83Å; N588-I590 HydrophobicContact CB-CD1 3.86Å; N588-I590 HydrophobicContact CB-CG1 3.95Å; N588-I590 PolarHBondContact O-N 3.48Å; I590-L592 PolarHBondContact O-N 3.12Å
591	K	67.9	Low	76.1	Confident	191 Å²	191	78 Å²	78	83%	0.83	45%	0.453	S	S	*	.			trans	-82.3	105	174.2	-68.6	-179.7	-179.4	174.5	0	110.2	S593	K591-S593 PolarHBondContact O-N 3.22Å
592	L	66.6	Low	76.1	Confident	72 Å²	72	81.3 Å²	81.3	38%	0.377	47%	0.473	S	S	.	.			trans	-64.4	123.2	169.5	-79.6	170	0	0	0	110.8	I513 Y517 A585 I590	I513-L592 HydrophobicContact CG2-CD2 3.88Å; Y517-L592 HydrophobicContact CE2-CD2 4.16Å; A585-L592 HydrophobicContact CB-CD1 3.33Å; A585-L592 HydrophobicContact CB-CD2 4.2Å; A585-L592 HydrophobicContact CB-CG 3.42Å; A585-L592 VanDerWaalsContact CB-CG 3.42Å; I590-L592 PolarHBondContact O-N 3.12Å
593	S	57.6	Low	76.3	Confident	114 Å²	114	78.1 Å²	78.1	80%	0.797	46%	0.461	S	S	*	.			trans	-107.5	100.7	172.5	-73.2	0	0	0	0	110.5	K591	K591-S593 PolarHBondContact O-N 3.22Å
594	G	63.3	Low	76.2	Confident	63 Å²	63	77.8 Å²	77.8	65%	0.649	47%	0.465	S	S	*	.	S	Bend	trans	98.1	-175.7	166.3	0	0	0	0	0	116.8
595	A	67.1	Low	76.5	Confident	87 Å²	87	78.6 Å²	78.6	72%	0.719	47%	0.473	S	S	*	.	S	Bend	trans	-81.6	174.3	176.3	0	0	0	0	0	111.7	P597	A595-P597 VanDerWaalsContact O-CD 3.27Å; A595-P597 WeakPolarHBondContact O-CD 3.24Å
596	N	79.1	Confident	76.8	Confident	19 Å²	19	78.6 Å²	78.6	10%	0.102	47%	0.473	C	S	.	.			trans	-53.7	117.4	-178.3	-174.3	-31.4	0	0	0	111.4	Y517 Y520 Y598	Y517-N596 HydrophobicContact CD1-CB 3.7Å; Y517-N596 WeakPolarHBondContact CD1-ND2 3.39Å; Y517-N596 HydrophobicContact CE1-CB 4.02Å; Y517-N596 HydrophobicContact CG-CB 4.31Å; Y517-N596 PolarHBondContact O-ND2 3.47Å; Y520-N596 VanDerWaalsContact CD1-ND2 3.31Å; Y520-N596 WeakPolarHBondContact CD1-ND2 3.19Å; N596-Y598 VanDerWaalsContact C-N 3.34Å; N596-Y598 PolarHBondContact O-N 3.13Å; N596-Y598 VanDerWaalsContact OD1-CD2 3.3Å; N596-Y598 WeakPolarHBondContact OD1-CD2 3.44Å; N596-Y598 PolarHBondContact OD1-N 2.7Å
597	P	79.3	Confident	77.2	Confident	93 Å²	93	73.5 Å²	73.5	60%	0.604	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-23.7	-177.6	-21.5	33.7	0	0	0	115.2	A595	A595-P597 VanDerWaalsContact O-CD 3.27Å; A595-P597 WeakPolarHBondContact O-CD 3.24Å
598	Y	80.6	Confident	77.6	Confident	94 Å²	94	73 Å²	73	37%	0.369	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.9	-166.6	-44.7	-75.1	0	0	0	113.8	D514 L518 N596	D514-Y598 PolarHBondContact OD1-OH 2.9Å; L518-Y598 HydrophobicContact CB-CD2 4.31Å; L518-Y598 HydrophobicContact CD1-CG 4.37Å; N596-Y598 VanDerWaalsContact C-N 3.34Å; N596-Y598 PolarHBondContact O-N 3.13Å; N596-Y598 VanDerWaalsContact OD1-CD2 3.3Å; N596-Y598 WeakPolarHBondContact OD1-CD2 3.44Å; N596-Y598 PolarHBondContact OD1-N 2.7Å
599	T	83	Confident	78	Confident	26 Å²	26	71.1 Å²	71.1	16%	0.16	44%	0.435	C	S	.	.			trans	-153.2	133.8	177.5	-171.1	0	0	0	0	113.6	Y520 A521 I601	Y520-T599 HydrophobicContact CD1-CG2 3.77Å; Y520-T599 HydrophobicContact CE1-CG2 3.59Å; A521-T599 HydrophobicContact CB-CG2 3.83Å; T599-I601 VanDerWaalsContact OG1-CB 3.23Å; T599-I601 WeakPolarHBondContact OG1-CB 3.33Å; T599-I601 WeakPolarHBondContact OG1-CG1 3.38Å; T599-I601 PolarHBondContact OG1-N 2.7Å
600	T	81.2	Confident	79	Confident	135 Å²	135	69.5 Å²	69.5	83%	0.828	41%	0.407	S	S	*	.	S	Bend	trans	-79.5	-9.3	166	55.2	0	0	0	0	112.1	T602	T600-T602 VanDerWaalsContact C-N 3.3Å; T600-T602 PolarHBondContact O-N 2.82Å
601	I	83.8	Confident	79.7	Confident	23 Å²	23	74.2 Å²	74.2	12%	0.118	43%	0.428	C	S	.	.			trans	-75.2	87	178.3	-53.3	167.5	0	0	0	108.1	Y520 N528 T599 I606	Y520-I601 PolarHBondContact OH-O 3.45Å; Y520-I601 VanDerWaalsContact OH-O 3.07Å; N528-I601 HydrophobicContact CB-CD1 3.71Å; T599-I601 VanDerWaalsContact OG1-CB 3.23Å; T599-I601 WeakPolarHBondContact OG1-CB 3.33Å; T599-I601 WeakPolarHBondContact OG1-CG1 3.38Å; T599-I601 PolarHBondContact OG1-N 2.7Å; I601-I606 HydrophobicContact CG2-CD1 4Å; I601-I606 HydrophobicContact CG2-CG1 3.47Å; I601-I606 VanDerWaalsContact CG2-CG1 3.47Å
602	T	83.8	Confident	80.6	Confident	69 Å²	69	71.5 Å²	71.5	42%	0.423	42%	0.416	S	S	.	.			trans	-64.7	157	169.4	71.4	0	0	0	0	109.9	T600 Q604 S605	T600-T602 VanDerWaalsContact C-N 3.3Å; T600-T602 PolarHBondContact O-N 2.82Å; T602-Q604 PolarHBondContact O-N 3.3Å; T602-Q604 PolarHBondContact OG1-OE1 3.24Å; T602-S605 PolarHBondContact O-N 2.86Å
603	P	84.8	Confident	81.5	Confident	40 Å²	40	68.1 Å²	68.1	26%	0.26	40%	0.398	S	S	.	.	H	α-helix	trans	-51.9	-33.9	177.6	-28.3	35.1	0	0	0	113	Y520 S605	Y520-P603 HydrophobicContact CE2-CG 4.36Å; Y520-P603 VanDerWaalsContact OH-CD 3.26Å; Y520-P603 WeakPolarHBondContact OH-CD 3.14Å; Y520-P603 WeakPolarHBondContact OH-CG 3.39Å; P603-S605 PolarHBondContact O-N 3.29Å
604	Q	83.8	Confident	83	Confident	131 Å²	131	66 Å²	66	61%	0.612	38%	0.377	S	S	*	.	H	α-helix	trans	-68	-28.8	178.7	-56.6	85.8	2.7	0	0	113.9	T602	T602-Q604 PolarHBondContact O-N 3.3Å; T602-Q604 PolarHBondContact OG1-OE1 3.24Å
605	S	86.6	Confident	84.2	Confident	44 Å²	44	67.6 Å²	67.6	31%	0.308	37%	0.374	S	S	.	.	H	α-helix	trans	-75.7	-26.3	-178	-175.6	0	0	0	0	113	T602 P603	T602-S605 PolarHBondContact O-N 2.86Å; P603-S605 PolarHBondContact O-N 3.29Å
606	I	86.4	Confident	85.2	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.015	35%	0.346	C	S	.	.	H	α-helix	trans	-65.7	-47.5	178.9	-72.3	175.2	0	0	0	109.8	A524 F527 M531 R571 I574 I601 S608 K609 W610	A524-I606 HydrophobicContact CB-CD1 3.87Å; F527-I606 HydrophobicContact CD1-CG2 3.6Å; F527-I606 HydrophobicContact CE1-CG2 3.5Å; F527-I606 VanDerWaalsContact CE1-CG2 3.5Å; M531-I606 HydrophobicContact CE-CB 4.42Å; M531-I606 HydrophobicContact CE-CG2 3.89Å; M531-I606 WeakPolarHBondContact CE-O 3.3Å; R571-I606 HydrophobicContact CG-CG2 3.86Å; I574-I606 HydrophobicContact CG2-CD1 4.09Å; I601-I606 HydrophobicContact CG2-CD1 4Å; I601-I606 HydrophobicContact CG2-CG1 3.47Å; I601-I606 VanDerWaalsContact CG2-CG1 3.47Å; I606-S608 VanDerWaalsContact C-N 3.29Å; I606-S608 PolarHBondContact O-N 3.3Å; I606-K609 PolarHBondContact O-N 3.08Å; I606-W610 PolarHBondContact O-N 3.18Å
607	D	87.1	Confident	85.6	Confident	54 Å²	54	64.5 Å²	64.5	29%	0.289	35%	0.345	S	S	.	.	H	α-helix	trans	-58.8	-38.3	-176.8	-66.4	-27.6	0	0	0	112.5	R571 K609	R571-D607 WeakPolarHBondContact CD-OD1 3.43Å; R571-D607 IonicContact CZ-OD1 3.18Å; R571-D607 IonicContact NE-OD1 3.99Å; R571-D607 IonicContact NH1-OD1 2.79Å; R571-D607 PolarHBondContact NH1-OD1 2.69Å; D607-K609 PolarHBondContact O-N 3.31Å
608	S	88.4	Confident	86.1	Confident	72 Å²	72	64.4 Å²	64.4	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-74.3	-21	-178.7	-56.6	0	0	0	0	115.3	I606	I606-S608 VanDerWaalsContact C-N 3.29Å; I606-S608 PolarHBondContact O-N 3.3Å
609	K	85.4	Confident	86.4	Confident	47 Å²	47	66.2 Å²	66.2	20%	0.204	36%	0.356	C	S	.	.	H	α-helix	trans	-84.2	-35.4	176.6	-73.8	-173.8	-175.3	-178.6	0	111.7	N528 M531 E532 I606 D607 E611 K612 A613	N528-K609 WeakPolarHBondContact OD1-CD 3.37Å; N528-K609 WeakPolarHBondContact OD1-CE 3.36Å; N528-K609 PolarHBondContact OD1-NZ 2.8Å; M531-K609 HydrophobicContact CB-CB 4.44Å; M531-K609 HydrophobicContact CE-CB 3.97Å; M531-K609 HydrophobicContact SD-CB 4.13Å; E532-K609 HydrophobicContact CG-CD 4.17Å; E532-K609 WeakPolarHBondContact OE1-CE 3.24Å; E532-K609 IonicContact OE1-NZ 3.2Å; E532-K609 PolarHBondContact OE1-NZ 3.08Å; E532-K609 IonicContact OE2-NZ 2.72Å; E532-K609 PolarHBondContact OE2-NZ 3.07Å; I606-K609 PolarHBondContact O-N 3.08Å; D607-K609 PolarHBondContact O-N 3.31Å; K609-E611 VanDerWaalsContact C-N 3.26Å; K609-E611 PolarHBondContact O-N 3.49Å; K609-K612 PolarHBondContact O-N 2.63Å; K609-A613 PolarHBondContact O-N 2.99Å
610	W	90.5	Very high	86.6	Confident	38 Å²	38	66.1 Å²	66.1	14%	0.144	35%	0.353	C	S	.	.	H	α-helix	trans	-51.6	-45.8	176.5	-178.4	-94.7	0	0	0	112	F527 W530 M531 L564 A567 N568 I606 K612	F527-W610 HydrophobicContact CE1-CE3 4.3Å; F527-W610 HydrophobicContact CE2-CE3 4.29Å; F527-W610 AromaticContact CE2-CZ3 3.91Å; F527-W610 HydrophobicContact CE2-CZ3 3.91Å; F527-W610 AromaticContact CZ-CE3 3.53Å; F527-W610 HydrophobicContact CZ-CE3 3.53Å; F527-W610 AromaticContact CZ-CZ3 3.56Å; F527-W610 HydrophobicContact CZ-CZ3 3.56Å; W530-W610 HydrophobicContact CE3-CZ3 4.21Å; W530-W610 AromaticContact CH2-CH2 3.99Å; W530-W610 HydrophobicContact CH2-CH2 3.99Å; W530-W610 AromaticContact CH2-CZ3 3.73Å; W530-W610 HydrophobicContact CH2-CZ3 3.73Å; W530-W610 AromaticContact CZ3-CE3 3.9Å; W530-W610 HydrophobicContact CZ3-CE3 3.9Å; W530-W610 HydrophobicContact CZ3-CH2 4.01Å; W530-W610 AromaticContact CZ3-CZ3 3.26Å; W530-W610 HydrophobicContact CZ3-CZ3 3.26Å; M531-W610 HydrophobicContact CG-CE3 4.1Å; M531-W610 WeakPolarHBondContact SD-CA 3.27Å; M531-W610 HydrophobicContact SD-CB 3.61Å; M531-W610 HydrophobicContact SD-CD2 4.46Å; M531-W610 HydrophobicContact SD-CE3 3.82Å; M531-W610 HydrophobicContact SD-CG 4.45Å; M531-W610 PolarHBondContact SD-N 2.71Å; L564-W610 VanDerWaalsContact O-CH2 3.32Å; L564-W610 WeakPolarHBondContact O-CH2 3.39Å; A567-W610 HydrophobicContact CB-CH2 3.77Å; A567-W610 HydrophobicContact CB-CZ3 3.77Å; N568-W610 HydrophobicContact CB-CH2 4.04Å; N568-W610 HydrophobicContact CB-CZ2 3.89Å; I606-W610 PolarHBondContact O-N 3.18Å; W610-K612 VanDerWaalsContact C-N 3.29Å; W610-K612 PolarHBondContact O-N 3.31Å
611	E	88.6	Confident	86.9	Confident	143 Å²	143	62.5 Å²	62.5	67%	0.668	33%	0.329	S	S	*	.	H	α-helix	trans	-63	-30.1	-179.5	-63.9	-176.8	159.5	0	0	113.8	K609	K609-E611 VanDerWaalsContact C-N 3.26Å; K609-E611 PolarHBondContact O-N 3.49Å
612	K	85.8	Confident	87.1	Confident	134 Å²	134	65.9 Å²	65.9	58%	0.583	35%	0.354	S	S	*	.	H	α-helix	trans	-76.5	-45.2	-179.3	-69.8	-178	178.8	178.9	0	112.5	M535 K609 W610 M614 T615	M535-K612 HydrophobicContact SD-CB 3.71Å; K609-K612 PolarHBondContact O-N 2.63Å; W610-K612 VanDerWaalsContact C-N 3.29Å; W610-K612 PolarHBondContact O-N 3.31Å; K612-M614 PolarHBondContact O-N 3.5Å; K612-M614 VanDerWaalsContact O-N 3.16Å; K612-T615 PolarHBondContact O-N 2.68Å; K612-T615 PolarHBondContact O-OG1 2.7Å
613	A	85.1	Confident	87.2	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.008	35%	0.351	C	S	.	.	H	α-helix	trans	-54.7	-37.4	-178.6	0	0	0	0	0	112.2	M535 K609 T615 M616	M535-A613 HydrophobicContact CG-CB 3.71Å; M535-A613 HydrophobicContact SD-CB 4.28Å; K609-A613 PolarHBondContact O-N 2.99Å; A613-T615 PolarHBondContact O-N 3.48Å; A613-T615 VanDerWaalsContact O-N 3.09Å; A613-M616 PolarHBondContact O-N 3.32Å
614	M	89.8	Confident	87.4	Confident	71 Å²	71	63 Å²	63	35%	0.35	34%	0.339	S	S	.	.	H	α-helix	trans	-63	-16	179.2	-61.3	-59.2	96.6	0	0	114.3	L564 K612	L564-M614 HydrophobicContact CD1-CE 4.02Å; L564-M614 HydrophobicContact CD1-SD 3.96Å; L564-M614 HydrophobicContact CD2-CE 3.89Å; L564-M614 HydrophobicContact CG-CE 4.44Å; K612-M614 PolarHBondContact O-N 3.5Å; K612-M614 VanDerWaalsContact O-N 3.16Å
615	T	89.1	Confident	87.6	Confident	95 Å²	95	61.6 Å²	61.6	58%	0.583	33%	0.333	S	S	*	.	H	α-helix	trans	-90.8	-19.3	-178.9	67.5	0	0	0	0	114.3	K612 A613	K612-T615 PolarHBondContact O-N 2.68Å; K612-T615 PolarHBondContact O-OG1 2.7Å; A613-T615 PolarHBondContact O-N 3.48Å; A613-T615 VanDerWaalsContact O-N 3.09Å
616	M	86.8	Confident	87.5	Confident	26 Å²	26	65 Å²	65	13%	0.128	35%	0.348	C	S	.	.	H	α-helix	trans	-93.4	-22.7	-169	-63.6	167.4	68	0	0	112.4	M535 L538 Q539 A613 P618 Q619	M535-M616 HydrophobicContact CB-CE 3.9Å; M535-M616 HydrophobicContact CB-SD 3.85Å; M535-M616 HydrophobicContact CG-CE 4.29Å; M535-M616 HydrophobicContact CG-SD 3.56Å; M535-M616 VanDerWaalsContact CG-SD 3.56Å; M535-M616 VanDerWaalsContact O-CE 3.29Å; M535-M616 WeakPolarHBondContact O-CE 3.36Å; M535-M616 HydrophobicContact SD-SD 3.97Å; L538-M616 HydrophobicContact CB-CB 4.27Å; L538-M616 HydrophobicContact CD1-CB 4.11Å; Q539-M616 HydrophobicContact CG-CE 3.44Å; Q539-M616 VanDerWaalsContact CG-CE 3.44Å; A613-M616 PolarHBondContact O-N 3.32Å; M616-P618 VanDerWaalsContact C-CD 3.44Å; M616-Q619 PolarHBondContact O-N 3.14Å
617	V	88.4	Confident	87.4	Confident	16 Å²	16	66.4 Å²	66.4	10%	0.097	35%	0.354	C	S	.	.	H	α-helix	trans	-45.2	-48.7	-178.2	176.3	0	0	0	0	113.7	L538 H557 F560 K561 Q619 R620 D621	L538-V617 HydrophobicContact CD1-CB 4.32Å; L538-V617 HydrophobicContact CD1-CG2 3.59Å; L538-V617 HydrophobicContact CD2-CB 4.47Å; L538-V617 HydrophobicContact CD2-CG2 4.34Å; H557-V617 PolarHBondContact CE1-O 2.89Å; H557-V617 PolarHBondContact NE2-O 3.18Å; F560-V617 HydrophobicContact CE1-CG2 4.25Å; K561-V617 HydrophobicContact CD-CG1 3.46Å; K561-V617 VanDerWaalsContact CD-CG1 3.46Å; K561-V617 HydrophobicContact CG-CG1 3.58Å; V617-Q619 VanDerWaalsContact C-N 3.26Å; V617-Q619 PolarHBondContact O-N 3.12Å; V617-R620 PolarHBondContact O-N 3.33Å; V617-D621 VanDerWaalsContact O-OD2 3.1Å
618	P	89.1	Confident	87.4	Confident	91 Å²	91	65 Å²	65	59%	0.591	35%	0.346	S	S	*	.	H	α-helix	trans	-73.5	-10.2	-174.4	-17	33.2	0	0	0	115.2	M616	M616-P618 VanDerWaalsContact C-CD 3.44Å
619	Q	86.8	Confident	87.3	Confident	131 Å²	131	66.7 Å²	66.7	61%	0.612	35%	0.35	S	S	*	.	H	α-helix	trans	-82.5	-33.8	-179.3	-60	-178.7	14	0	0	111.1	M616 V617 D621 C622	M616-Q619 PolarHBondContact O-N 3.14Å; V617-Q619 VanDerWaalsContact C-N 3.26Å; V617-Q619 PolarHBondContact O-N 3.12Å; Q619-D621 PolarHBondContact O-N 2.94Å; Q619-C622 PolarHBondContact O-N 3.21Å
620	R	87.4	Confident	87.2	Confident	24 Å²	24	69.5 Å²	69.5	9%	0.091	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-40.2	-179.6	-177.3	52.1	158.3	178.3	-10.1	113.1	D537 L538 D540 F542 V617 C622 A623 L624	D537-R620 PolarHBondContact O-NE 3.08Å; D537-R620 PolarHBondContact O-NH2 3.48Å; L538-R620 HydrophobicContact CB-CB 4.37Å; L538-R620 HydrophobicContact CD2-CB 3.72Å; L538-R620 HydrophobicContact CD2-CG 3.98Å; D540-R620 PolarHBondContact O-NH1 3.07Å; D540-R620 IonicContact OD2-NH2 3.03Å; D540-R620 PolarHBondContact OD2-NH2 3.24Å; F542-R620 VanDerWaalsContact CE1-NH1 3.32Å; V617-R620 PolarHBondContact O-N 3.33Å; R620-C622 PolarHBondContact O-N 2.96Å; R620-C622 VanDerWaalsContact O-N 3.14Å; R620-A623 PolarHBondContact O-N 3.25Å; R620-L624 HydrophobicContact CG-CD1 4.28Å
621	D	87.1	Confident	86.9	Confident	60 Å²	60	67.9 Å²	67.9	32%	0.321	36%	0.356	S	S	.	.	H	α-helix	trans	-53.8	-34.4	-179.1	-64.9	-88.1	0	0	0	112.7	H557 K561 V617 Q619	H557-D621 IonicContact CD2-OD1 2.7Å; H557-D621 PolarHBondContact CD2-OD1 3.49Å; H557-D621 IonicContact CD2-OD2 3.6Å; H557-D621 IonicContact CE1-OD2 2.7Å; H557-D621 IonicContact NE2-OD1 3.62Å; H557-D621 PolarHBondContact NE2-OD1 3.42Å; H557-D621 VanDerWaalsContact NE2-OD1 3.14Å; H557-D621 IonicContact NE2-OD2 2.81Å; H557-D621 PolarHBondContact NE2-OD2 2.85Å; K561-D621 IonicContact NZ-OD1 3.36Å; K561-D621 PolarHBondContact NZ-OD1 3.37Å; K561-D621 IonicContact NZ-OD2 2.78Å; V617-D621 VanDerWaalsContact O-OD2 3.1Å; Q619-D621 PolarHBondContact O-N 2.94Å
622	C	88.6	Confident	86.7	Confident	94 Å²	94	65.2 Å²	65.2	64%	0.635	35%	0.347	S	S	*	.	H	α-helix	trans	-73.5	-43	-174.9	-166.1	0	0	0	0	112.9	Q619 R620 L624 Q625	Q619-C622 PolarHBondContact O-N 3.21Å; R620-C622 PolarHBondContact O-N 2.96Å; R620-C622 VanDerWaalsContact O-N 3.14Å; C622-L624 PolarHBondContact O-N 2.63Å; C622-Q625 PolarHBondContact O-N 2.9Å
623	A	86.5	Confident	86.7	Confident	44 Å²	44	62.8 Å²	62.8	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-41.2	-173	0	0	0	0	0	112.6	F542 R620 Q625 D626	F542-A623 HydrophobicContact CE1-CB 4.01Å; F542-A623 HydrophobicContact CZ-CB 4.14Å; F542-A623 WeakPolarHBondContact CZ-O 3.39Å; R620-A623 PolarHBondContact O-N 3.25Å; A623-Q625 PolarHBondContact O-N 2.84Å; A623-D626 PolarHBondContact O-N 2.7Å
624	L	87.7	Confident	86.6	Confident	4 Å²	4	64 Å²	64	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-59.2	-22.7	-176.6	-69.4	167.2	0	0	0	113.3	F542 I550 L553 I554 H557 R620 C622	F542-L624 HydrophobicContact CD1-CD2 3.73Å; F542-L624 HydrophobicContact CD2-CD2 3.96Å; F542-L624 HydrophobicContact CE1-CD2 3.67Å; F542-L624 HydrophobicContact CE1-CG 4.16Å; F542-L624 HydrophobicContact CE2-CD2 3.87Å; F542-L624 HydrophobicContact CG-CD2 3.92Å; F542-L624 HydrophobicContact CZ-CB 4.45Å; F542-L624 HydrophobicContact CZ-CD2 3.77Å; F542-L624 HydrophobicContact CZ-CG 4.24Å; I550-L624 HydrophobicContact CD1-CD2 4.07Å; I550-L624 WeakPolarHBondContact CD1-O 3.48Å; L553-L624 HydrophobicContact CB-CD2 3.75Å; L553-L624 HydrophobicContact CD1-CD2 4.19Å; I554-L624 HydrophobicContact CD1-CB 4.48Å; I554-L624 HydrophobicContact CG1-CB 3.69Å; I554-L624 HydrophobicContact CG1-CD1 4.47Å; H557-L624 HydrophobicContact CB-CD1 4.07Å; R620-L624 HydrophobicContact CG-CD1 4.28Å; C622-L624 PolarHBondContact O-N 2.63Å
625	Q	88.8	Confident	86.4	Confident	101 Å²	101	62.7 Å²	62.7	47%	0.472	35%	0.347	S	S	.	.	H	α-helix	trans	-76.5	-26.4	-178.2	-170.9	54.4	86.4	0	0	113.8	C622 A623 N629	C622-Q625 PolarHBondContact O-N 2.9Å; A623-Q625 PolarHBondContact O-N 2.84Å; Q625-N629 PolarHBondContact O-ND2 3.26Å
626	D	84.8	Confident	86.2	Confident	117 Å²	117	62.2 Å²	62.2	63%	0.626	35%	0.348	S	S	*	.	H	α-helix	trans	-78.8	-44.4	-172.7	-78.8	-23.7	0	0	0	112.8	A623 L628 N629	A623-D626 PolarHBondContact O-N 2.7Å; D626-L628 VanDerWaalsContact C-N 3.28Å; D626-L628 PolarHBondContact O-N 2.88Å; D626-N629 WeakPolarHBondContact O-CB 3.43Å; D626-N629 PolarHBondContact O-N 3.24Å; D626-N629 PolarHBondContact O-ND2 3.21Å
627	E	84.4	Confident	86.1	Confident	32 Å²	32	64.1 Å²	64.1	15%	0.15	36%	0.358	C	S	.	.	H	α-helix	trans	-66.9	-25.1	-177.1	179.9	61.4	-153.9	0	0	113.1	F542 V544 I550 N629 K630 Q631	F542-E627 HydrophobicContact CD2-CB 4.41Å; F542-E627 HydrophobicContact CD2-CG 4.36Å; F542-E627 HydrophobicContact CE2-CB 3.63Å; F542-E627 HydrophobicContact CE2-CG 4.05Å; F542-E627 HydrophobicContact CZ-CB 4.49Å; V544-E627 HydrophobicContact CG2-CG 3.43Å; V544-E627 VanDerWaalsContact CG2-CG 3.43Å; I550-E627 HydrophobicContact CD1-CB 4.3Å; E627-N629 PolarHBondContact O-N 2.98Å; E627-N629 VanDerWaalsContact O-N 3.14Å; E627-K630 WeakPolarHBondContact O-CB 3.25Å; E627-K630 PolarHBondContact O-N 2.97Å; E627-K630 IonicContact OE1-NZ 3.26Å; E627-K630 PolarHBondContact OE1-NZ 3.07Å; E627-K630 IonicContact OE2-NZ 2.68Å; E627-K630 PolarHBondContact OE2-NZ 3.12Å; E627-Q631 PolarHBondContact O-N 2.7Å; E627-Q631 PolarHBondContact OE1-NE2 3.31Å
628	L	87.2	Confident	85.8	Confident	23 Å²	23	63.9 Å²	63.9	12%	0.12	36%	0.355	C	S	.	.	H	α-helix	trans	-55.1	-32.8	174.2	171.9	63.5	0	0	0	112	I547 I550 D626 K630 N632	I547-L628 HydrophobicContact CG2-CD1 3.7Å; I550-L628 HydrophobicContact CG1-CB 3.93Å; I550-L628 HydrophobicContact CG2-CB 4.01Å; I550-L628 HydrophobicContact CG2-CD1 3.55Å; I550-L628 HydrophobicContact CG2-CG 4.36Å; D626-L628 VanDerWaalsContact C-N 3.28Å; D626-L628 PolarHBondContact O-N 2.88Å; L628-K630 VanDerWaalsContact C-N 3.32Å; L628-K630 PolarHBondContact O-N 3.48Å; L628-N632 PolarHBondContact O-ND2 3.11Å
629	N	85.6	Confident	85.7	Confident	108 Å²	108	61.8 Å²	61.8	58%	0.578	35%	0.346	S	S	*	.	H	α-helix	trans	-69.7	-30.4	178.3	-56.4	-63.2	0	0	0	112.5	Q625 D626 E627	Q625-N629 PolarHBondContact O-ND2 3.26Å; D626-N629 WeakPolarHBondContact O-CB 3.43Å; D626-N629 PolarHBondContact O-N 3.24Å; D626-N629 PolarHBondContact O-ND2 3.21Å; E627-N629 PolarHBondContact O-N 2.98Å; E627-N629 VanDerWaalsContact O-N 3.14Å
630	K	83.8	Confident	85.6	Confident	107 Å²	107	59.4 Å²	59.4	47%	0.465	34%	0.34	S	S	.	.	H	α-helix	trans	-72.8	-42.1	-176.6	174.6	161.4	145.9	-104	0	112.3	E627 L628 N632 S633	E627-K630 WeakPolarHBondContact O-CB 3.25Å; E627-K630 PolarHBondContact O-N 2.97Å; E627-K630 IonicContact OE1-NZ 3.26Å; E627-K630 PolarHBondContact OE1-NZ 3.07Å; E627-K630 IonicContact OE2-NZ 2.68Å; E627-K630 PolarHBondContact OE2-NZ 3.12Å; L628-K630 VanDerWaalsContact C-N 3.32Å; L628-K630 PolarHBondContact O-N 3.48Å; K630-N632 VanDerWaalsContact C-N 3.26Å; K630-N632 PolarHBondContact O-N 2.79Å; K630-S633 WeakPolarHBondContact O-CB 3.34Å; K630-S633 PolarHBondContact O-N 3.16Å
631	Q	83.2	Confident	85.5	Confident	3 Å²	3	58.9 Å²	58.9	1%	0.014	34%	0.339	C	S	.	.	H	α-helix	trans	-67	-26	-176.5	-61.5	-49.8	-40.3	0	0	114.5	V544 H545 I547 E627 S633 N634	V544-Q631 VanDerWaalsContact C-CD 3.49Å; V544-Q631 HydrophobicContact CB-CG 4.17Å; V544-Q631 HydrophobicContact CG2-CG 3.38Å; V544-Q631 PolarHBondContact O-NE2 3.41Å; V544-Q631 PolarHBondContact O-OE1 3.43Å; H545-Q631 PolarHBondContact O-OE1 3.46Å; I547-Q631 HydrophobicContact CG1-CB 4.2Å; E627-Q631 PolarHBondContact O-N 2.7Å; E627-Q631 PolarHBondContact OE1-NE2 3.31Å; Q631-S633 PolarHBondContact O-N 3.13Å; Q631-N634 PolarHBondContact O-N 3.05Å; Q631-N634 PolarHBondContact OE1-ND2 3.16Å; Q631-N634 VanDerWaalsContact OE1-ND2 3.1Å
632	N	84.9	Confident	85.4	Confident	88 Å²	88	56.1 Å²	56.1	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-25.9	172.1	-77.3	-84	0	0	0	113.1	I547 L628 K630	I547-N632 HydrophobicContact CD1-CB 4.48Å; I547-N632 VanDerWaalsContact CD1-OD1 3.27Å; I547-N632 WeakPolarHBondContact CD1-OD1 3.41Å; L628-N632 PolarHBondContact O-ND2 3.11Å; K630-N632 VanDerWaalsContact C-N 3.26Å; K630-N632 PolarHBondContact O-N 2.79Å
633	S	85.2	Confident	85.3	Confident	82 Å²	82	55.1 Å²	55.1	57%	0.573	32%	0.323	S	S	*	.	H	α-helix	trans	-79.2	-30.5	178.3	-167.7	0	0	0	0	113.4	K630 Q631	K630-S633 WeakPolarHBondContact O-CB 3.34Å; K630-S633 PolarHBondContact O-N 3.16Å; Q631-S633 PolarHBondContact O-N 3.13Å
634	N	84.6	Confident	85.1	Confident	28 Å²	28	54.4 Å²	54.4	15%	0.15	31%	0.312	C	S	.	.	H	α-helix	trans	-71.4	-40.4	-172.2	-75.8	-12.6	0	0	0	112.1	Q631 S636 L637 I706	Q631-N634 PolarHBondContact O-N 3.05Å; Q631-N634 PolarHBondContact OE1-ND2 3.16Å; Q631-N634 VanDerWaalsContact OE1-ND2 3.1Å; N634-S636 PolarHBondContact O-N 3.43Å; N634-S636 VanDerWaalsContact O-N 3.17Å; N634-L637 PolarHBondContact O-N 3.37Å; N634-I706 HydrophobicContact CB-CD1 3.72Å; N634-I706 HydrophobicContact CB-CG1 4.2Å; N634-I706 WeakPolarHBondContact O-CD1 3.37Å
635	D	84.1	Confident	85	Confident	43 Å²	43	54.2 Å²	54.2	23%	0.23	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-28.5	-176.7	-161.2	59.4	0	0	0	113.2	L637 R638 Y711	D635-L637 VanDerWaalsContact C-N 3.3Å; D635-L637 PolarHBondContact O-N 3.11Å; D635-R638 WeakPolarHBondContact O-CB 2.87Å; D635-R638 PolarHBondContact O-N 3.43Å; D635-R638 IonicContact OD1-NH1 2.78Å; D635-R638 PolarHBondContact OD1-NH1 3.48Å; D635-Y711 PolarHBondContact OD2-OH 3.3Å; D635-Y711 VanDerWaalsContact OD2-OH 3.1Å
636	S	86	Confident	84.9	Confident	85 Å²	85	52.7 Å²	52.7	59%	0.594	31%	0.306	S	S	*	.	H	α-helix	trans	-63.8	-31.6	176.1	-172.2	0	0	0	0	113.5	N634	N634-S636 PolarHBondContact O-N 3.43Å; N634-S636 VanDerWaalsContact O-N 3.17Å
637	L	83.3	Confident	85	Confident	65 Å²	65	50.4 Å²	50.4	34%	0.34	30%	0.299	S	S	.	.	H	α-helix	trans	-71.6	-39.7	177.6	-69.2	173	0	0	0	111.4	N634 D635 A639 T640 I701 A704 I706	N634-L637 PolarHBondContact O-N 3.37Å; D635-L637 VanDerWaalsContact C-N 3.3Å; D635-L637 PolarHBondContact O-N 3.11Å; L637-A639 VanDerWaalsContact C-N 3.34Å; L637-A639 PolarHBondContact O-N 3.47Å; L637-T640 PolarHBondContact O-N 3.14Å; L637-T640 VanDerWaalsContact O-N 3.12Å; L637-I701 HydrophobicContact CB-CG1 4.22Å; L637-A704 HydrophobicContact CD1-CB 3.83Å; L637-I706 HydrophobicContact CB-CD1 4.07Å; L637-I706 HydrophobicContact CD1-CD1 4.08Å
638	R	83.5	Confident	85	Confident	11 Å²	11	49 Å²	49	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-51.6	-52.1	176.4	-66.4	-176.6	174.6	113.1	1.2	111	H545 D635 T640 F641 I706 D708 N709 Y711	H545-R638 PolarHBondContact O-NH2 3.33Å; D635-R638 WeakPolarHBondContact O-CB 2.87Å; D635-R638 PolarHBondContact O-N 3.43Å; D635-R638 IonicContact OD1-NH1 2.78Å; D635-R638 PolarHBondContact OD1-NH1 3.48Å; R638-T640 PolarHBondContact O-N 2.87Å; R638-F641 PolarHBondContact O-N 2.82Å; R638-I706 HydrophobicContact CG-CG2 3.53Å; R638-D708 WeakPolarHBondContact CD-O 3.07Å; R638-D708 IonicContact CZ-OD1 2.7Å; R638-D708 IonicContact CZ-OD2 3.44Å; R638-D708 PolarHBondContact NE-O 3.44Å; R638-D708 IonicContact NE-OD1 3.59Å; R638-D708 PolarHBondContact NE-OD1 3.05Å; R638-D708 IonicContact NE-OD2 2.68Å; R638-D708 PolarHBondContact NE-OD2 3.11Å; R638-D708 IonicContact NH2-OD1 2.7Å; R638-D708 PolarHBondContact NH2-OD1 3.43Å; R638-D708 IonicContact NH2-OD2 3.41Å; R638-D708 PolarHBondContact NH2-OD2 3.42Å; R638-N709 PolarHBondContact O-ND2 2.95Å; R638-N709 PolarHBondContact O-OD1 3.33Å; R638-Y711 HydrophobicContact CB-CD2 4.07Å; R638-Y711 HydrophobicContact CB-CE2 4.05Å
639	A	85.8	Confident	84.6	Confident	47 Å²	47	48.3 Å²	48.3	39%	0.388	29%	0.291	S	S	.	.	H	α-helix	trans	-55.3	-29.9	-177.4	0	0	0	0	0	114.1	L637 Y711	L637-A639 VanDerWaalsContact C-N 3.34Å; L637-A639 PolarHBondContact O-N 3.47Å; A639-Y711 HydrophobicContact CB-CD2 4.03Å; A639-Y711 HydrophobicContact CB-CE2 4.01Å
640	T	85.4	Confident	84.6	Confident	82 Å²	82	46.1 Å²	46.1	50%	0.503	29%	0.288	S	S	.	.	H	α-helix	trans	-76.5	-44.3	-174.9	-57	0	0	0	0	112.9	L637 R638 A642	L637-T640 PolarHBondContact O-N 3.14Å; L637-T640 VanDerWaalsContact O-N 3.12Å; R638-T640 PolarHBondContact O-N 2.87Å; T640-A642 PolarHBondContact O-N 3.18Å
641	F	85	Confident	84.6	Confident	12 Å²	12	44 Å²	44	5%	0.053	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-40.5	179.5	170.9	-92.5	0	0	0	112.5	R638 A643 Q644 A645 L694 H697 H698 I701 N709	R638-F641 PolarHBondContact O-N 2.82Å; F641-A643 VanDerWaalsContact C-N 3.26Å; F641-A643 PolarHBondContact O-N 2.91Å; F641-Q644 PolarHBondContact O-N 3.44Å; F641-Q644 VanDerWaalsContact O-N 3.09Å; F641-A645 HydrophobicContact CE1-CB 4.25Å; F641-A645 PolarHBondContact O-N 3.43Å; F641-L694 HydrophobicContact CD2-CD1 3.82Å; F641-L694 HydrophobicContact CE2-CD1 3.49Å; F641-L694 VanDerWaalsContact CE2-CD1 3.49Å; F641-L694 HydrophobicContact CE2-CG 3.92Å; F641-L694 HydrophobicContact CZ-CD1 4.06Å; F641-L694 HydrophobicContact CZ-CG 4.39Å; F641-H697 HydrophobicContact CD2-CB 3.96Å; F641-H698 HydrophobicContact CD2-CB 4.27Å; F641-H698 HydrophobicContact CE2-CB 3.67Å; F641-H698 HydrophobicContact CZ-CB 4.4Å; F641-H698 AromaticContact CZ-ND1 3.99Å; F641-I701 HydrophobicContact CB-CD1 3.3Å; F641-I701 HydrophobicContact CG-CD1 3.96Å; F641-N709 WeakPolarHBondContact CD1-ND2 3.39Å
642	A	84.4	Confident	84.5	Confident	2 Å²	2	44.3 Å²	44.3	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-37.8	-176.6	0	0	0	0	0	113.6	T640 Q644 N646 Y711 T712	T640-A642 PolarHBondContact O-N 3.18Å; A642-Q644 VanDerWaalsContact C-N 3.26Å; A642-Q644 PolarHBondContact O-N 2.85Å; A642-N646 PolarHBondContact O-ND2 3.36Å; A642-N646 VanDerWaalsContact O-ND2 3.12Å; A642-Y711 VanDerWaalsContact CB-CB 3.48Å; A642-T712 HydrophobicContact CB-CG2 3.71Å
643	A	86.8	Confident	84.2	Confident	74 Å²	74	46 Å²	46	61%	0.612	28%	0.284	S	S	*	.	H	α-helix	trans	-62	-32.1	179.5	0	0	0	0	0	113	F641	F641-A643 VanDerWaalsContact C-N 3.26Å; F641-A643 PolarHBondContact O-N 2.91Å
644	Q	83.7	Confident	84.1	Confident	29 Å²	29	44.6 Å²	44.6	14%	0.136	28%	0.278	C	S	.	.	H	α-helix	trans	-91	-32.5	-176.7	-168.5	175.4	-7.6	0	0	113.1	F641 A642 N646 S647 L694 H697	F641-Q644 PolarHBondContact O-N 3.44Å; F641-Q644 VanDerWaalsContact O-N 3.09Å; A642-Q644 VanDerWaalsContact C-N 3.26Å; A642-Q644 PolarHBondContact O-N 2.85Å; Q644-N646 VanDerWaalsContact C-N 3.27Å; Q644-N646 PolarHBondContact O-N 3.26Å; Q644-S647 PolarHBondContact O-N 3.24Å; Q644-S647 PolarHBondContact O-OG 3.47Å; Q644-L694 HydrophobicContact CB-CD1 3.94Å; Q644-L694 HydrophobicContact CG-CD1 4.08Å; Q644-H697 PolarHBondContact OE1-CE1 3.19Å; Q644-H697 PolarHBondContact OE1-ND1 2.84Å
645	A	83.8	Confident	83.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-38.8	175.7	0	0	0	0	0	112.3	F641 S647 V648 L694 T712 L719	F641-A645 HydrophobicContact CE1-CB 4.25Å; F641-A645 PolarHBondContact O-N 3.43Å; A645-S647 VanDerWaalsContact C-N 3.29Å; A645-S647 PolarHBondContact O-N 3.14Å; A645-V648 PolarHBondContact O-N 2.9Å; A645-L694 HydrophobicContact CB-CD1 4.13Å; A645-L694 HydrophobicContact CB-CD2 4.16Å; A645-T712 HydrophobicContact CB-CG2 4.37Å; A645-L719 HydrophobicContact CB-CD1 4.34Å
646	N	86.6	Confident	83.4	Confident	68 Å²	68	47 Å²	47	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-27.6	-179.4	-69.4	-25.9	0	0	0	114.3	A642 Q644 T712 Y714	A642-N646 PolarHBondContact O-ND2 3.36Å; A642-N646 VanDerWaalsContact O-ND2 3.12Å; Q644-N646 VanDerWaalsContact C-N 3.27Å; Q644-N646 PolarHBondContact O-N 3.26Å; N646-T712 PolarHBondContact OD1-OG1 3.05Å; N646-Y714 WeakPolarHBondContact OD1-CD2 3.43Å
647	S	87.1	Confident	82.9	Confident	70 Å²	70	48.6 Å²	48.6	49%	0.49	29%	0.285	S	S	.	.	H	α-helix	trans	-84.5	-36	-178.3	64.7	0	0	0	0	113	Q644 A645	Q644-S647 PolarHBondContact O-N 3.24Å; Q644-S647 PolarHBondContact O-OG 3.47Å; A645-S647 VanDerWaalsContact C-N 3.29Å; A645-S647 PolarHBondContact O-N 3.14Å
648	V	84.5	Confident	82.4	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-66.9	-41.5	-178.7	175.8	0	0	0	0	111.3	A645 A650 Y651 I691 L694 L719	A645-V648 PolarHBondContact O-N 2.9Å; V648-A650 VanDerWaalsContact C-N 3.31Å; V648-A650 PolarHBondContact O-N 3.13Å; V648-Y651 PolarHBondContact O-N 3.45Å; V648-Y651 VanDerWaalsContact O-N 3.16Å; V648-I691 HydrophobicContact CG1-CG1 4.06Å; V648-L694 HydrophobicContact CG2-CD2 4.35Å; V648-L719 HydrophobicContact CB-CD1 4.33Å; V648-L719 HydrophobicContact CG1-CD1 4.37Å
649	G	80.4	Confident	81.7	Confident	8 Å²	8	47.9 Å²	47.9	8%	0.082	28%	0.28	C	S	.	.	H	α-helix	trans	-58.3	-38.9	-178.6	0	0	0	0	0	114.1	Y651 I652	G649-Y651 VanDerWaalsContact C-N 3.3Å; G649-Y651 PolarHBondContact O-N 3.05Å; G649-I652 PolarHBondContact O-N 2.95Å
650	A	83.6	Confident	80.6	Confident	61 Å²	61	48 Å²	48	50%	0.504	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-29	179.9	0	0	0	0	0	113.6	V648	V648-A650 VanDerWaalsContact C-N 3.31Å; V648-A650 PolarHBondContact O-N 3.13Å
651	Y	84.9	Confident	79.7	Confident	63 Å²	63	51.6 Å²	51.6	25%	0.247	29%	0.29	C	S	.	.	H	α-helix	trans	-71	-40.2	-179.2	-179.7	-92.9	0	0	0	112.5	V648 G649 A654 K655 Y687 W723	V648-Y651 PolarHBondContact O-N 3.45Å; V648-Y651 VanDerWaalsContact O-N 3.16Å; G649-Y651 VanDerWaalsContact C-N 3.3Å; G649-Y651 PolarHBondContact O-N 3.05Å; Y651-A654 PolarHBondContact O-N 3.44Å; Y651-K655 HydrophobicContact CE1-CG 4.34Å; Y651-Y687 AromaticContact CD1-CD1 3.45Å; Y651-Y687 HydrophobicContact CD1-CD1 3.45Å; Y651-Y687 VanDerWaalsContact CD1-CD1 3.45Å; Y651-Y687 HydrophobicContact CD1-CD2 4.34Å; Y651-Y687 AromaticContact CD1-CE1 3.54Å; Y651-Y687 HydrophobicContact CD1-CE1 3.54Å; Y651-Y687 HydrophobicContact CD1-CE2 4.42Å; Y651-Y687 AromaticContact CD1-CG 3.88Å; Y651-Y687 HydrophobicContact CD1-CG 3.88Å; Y651-Y687 HydrophobicContact CD2-CD2 4.45Å; Y651-Y687 HydrophobicContact CD2-CE1 4.33Å; Y651-Y687 HydrophobicContact CD2-CE2 4.05Å; Y651-Y687 AromaticContact CD2-CZ 3.99Å; Y651-Y687 AromaticContact CE1-CD1 3.51Å; Y651-Y687 HydrophobicContact CE1-CD1 3.51Å; Y651-Y687 AromaticContact CE1-CD2 3.89Å; Y651-Y687 HydrophobicContact CE1-CD2 3.89Å; Y651-Y687 HydrophobicContact CE1-CE1 4.02Å; Y651-Y687 HydrophobicContact CE1-CE2 4.36Å; Y651-Y687 AromaticContact CE1-CG 3.44Å; Y651-Y687 HydrophobicContact CE1-CG 3.44Å; Y651-Y687 VanDerWaalsContact CE1-CG 3.44Å; Y651-Y687 AromaticContact CE2-CD2 3.99Å; Y651-Y687 HydrophobicContact CE2-CD2 3.99Å; Y651-Y687 AromaticContact CE2-CE2 3.97Å; Y651-Y687 HydrophobicContact CE2-CE2 3.97Å; Y651-Y687 HydrophobicContact CE2-CG 4.39Å; Y651-Y687 HydrophobicContact CG-CD1 4.11Å; Y651-Y687 AromaticContact CG-CE1 3.73Å; Y651-Y687 HydrophobicContact CG-CE1 3.73Å; Y651-Y687 HydrophobicContact CG-CE2 4.28Å; Y651-Y687 AromaticContact CG-CZ 3.82Å; Y651-Y687 AromaticContact CZ-CD2 3.69Å; Y651-Y687 AromaticContact CZ-CG 3.72Å; Y651-W723 HydrophobicContact CD1-CZ3 4.37Å; Y651-W723 HydrophobicContact CE1-CH2 4.47Å; Y651-W723 HydrophobicContact CE1-CZ3 4.21Å
652	I	81.1	Confident	78.6	Confident	10 Å²	10	53.7 Å²	53.7	5%	0.051	30%	0.301	C	S	.	.	H	α-helix	trans	-64.5	-44.7	-174.8	-57.5	-176.6	0	0	0	110.9	G649 A654 K655 M656 L719 G722 W723	G649-I652 PolarHBondContact O-N 2.95Å; I652-A654 PolarHBondContact O-N 3Å; I652-K655 PolarHBondContact O-N 3.44Å; I652-M656 PolarHBondContact O-N 3.3Å; I652-L719 WeakPolarHBondContact CD1-O 3.43Å; I652-G722 VanDerWaalsContact CG2-C 3.47Å; I652-G722 VanDerWaalsContact CG2-O 3.31Å; I652-G722 WeakPolarHBondContact CG2-O 3.29Å; I652-W723 HydrophobicContact CD1-CB 4.22Å; I652-W723 HydrophobicContact CD1-CE3 4.1Å; I652-W723 HydrophobicContact CG1-CE3 3.91Å; I652-W723 HydrophobicContact CG1-CZ3 4.39Å; I652-W723 HydrophobicContact CG2-CE3 4.48Å
653	Q	79	Confident	77.3	Confident	122 Å²	122	56.9 Å²	56.9	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-59.6	-45.1	-178.9	-174.1	173.4	-10.5	0	0	112.1	K655 M656	Q653-K655 VanDerWaalsContact C-N 3.29Å; Q653-K655 PolarHBondContact O-N 3.04Å; Q653-M656 PolarHBondContact O-N 3.47Å
654	A	82.3	Confident	75.8	Confident	53 Å²	53	59.9 Å²	59.9	44%	0.438	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-32.3	-178.3	0	0	0	0	0	113.7	Y651 I652	Y651-A654 PolarHBondContact O-N 3.44Å; I652-A654 PolarHBondContact O-N 3Å
655	K	79.6	Confident	74.4	Confident	48 Å²	48	66.6 Å²	66.6	21%	0.209	36%	0.359	C	S	.	.	H	α-helix	trans	-79.7	-23	-179.8	-73	-71.2	156.1	-156.9	0	113.8	Y651 I652 Q653 E658 L726	Y651-K655 HydrophobicContact CE1-CG 4.34Å; I652-K655 PolarHBondContact O-N 3.44Å; Q653-K655 VanDerWaalsContact C-N 3.29Å; Q653-K655 PolarHBondContact O-N 3.04Å; K655-E658 IonicContact NZ-OE1 3.33Å; K655-E658 PolarHBondContact NZ-OE1 3.23Å; K655-E658 IonicContact NZ-OE2 3.04Å; K655-E658 PolarHBondContact NZ-OE2 3.1Å; K655-L726 HydrophobicContact CB-CD1 4.31Å; K655-L726 HydrophobicContact CB-CD2 3.96Å
656	M	75.4	Confident	73	Confident	73 Å²	73	72.3 Å²	72.3	36%	0.36	39%	0.387	S	S	.	.	H	α-helix	trans	-70.3	-35.3	176.3	-163.8	172.7	-75.9	0	0	111.9	I652 Q653 E658 Q725 L726	I652-M656 PolarHBondContact O-N 3.3Å; Q653-M656 PolarHBondContact O-N 3.47Å; M656-E658 PolarHBondContact O-N 3.31Å; M656-Q725 HydrophobicContact CE-CB 4.11Å; M656-Q725 HydrophobicContact CE-CG 3.93Å; M656-L726 HydrophobicContact CB-CD1 3.93Å; M656-L726 HydrophobicContact CE-CB 4.09Å; M656-L726 HydrophobicContact CG-CD1 4.32Å
657	E	75.5	Confident	71.3	Confident	120 Å²	120	76.7 Å²	76.7	56%	0.561	41%	0.411	S	S	*	.	H	α-helix	trans	-71.4	-26	179.1	-64.6	179.3	-174.1	0	0	113.8
658	E	71.8	Confident	69.9	Low	54 Å²	54	76 Å²	76	25%	0.252	41%	0.414	S	S	.	.	H	α-helix	trans	-70.8	-38.5	178.7	-78.4	175.9	-171.2	0	0	112.9	K655 M656 G660 R661	K655-E658 IonicContact NZ-OE1 3.33Å; K655-E658 PolarHBondContact NZ-OE1 3.23Å; K655-E658 IonicContact NZ-OE2 3.04Å; K655-E658 PolarHBondContact NZ-OE2 3.1Å; M656-E658 PolarHBondContact O-N 3.31Å; E658-G660 VanDerWaalsContact C-N 3.28Å; E658-G660 PolarHBondContact O-N 2.89Å; E658-R661 PolarHBondContact O-N 3.09Å
659	I	69.1	Low	68.9	Low	6 Å²	6	79.2 Å²	79.2	3%	0.031	43%	0.434	C	S	.	.	H	α-helix	trans	-62.1	-37.1	-177.9	-66.7	161.3	0	0	0	111.2	R661 I662 I684 L726 I730	I659-R661 PolarHBondContact O-N 2.65Å; I659-I662 PolarHBondContact O-N 3.15Å; I659-I684 HydrophobicContact CD1-CD1 4.17Å; I659-L726 HydrophobicContact CD1-CD1 3.57Å; I659-I730 HydrophobicContact CD1-CB 4.15Å; I659-I730 HydrophobicContact CD1-CD1 4.38Å; I659-I730 HydrophobicContact CG1-CD1 4.43Å
660	G	62.6	Low	68	Low	49 Å²	49	81 Å²	81	51%	0.505	44%	0.442	S	S	.	.	H	α-helix	trans	-64.2	-19.4	-179.1	0	0	0	0	0	115	E658	E658-G660 VanDerWaalsContact C-N 3.28Å; E658-G660 PolarHBondContact O-N 2.89Å
661	R	66.4	Low	67.4	Low	158 Å²	158	82.5 Å²	82.5	60%	0.596	44%	0.438	S	S	*	.	H	α-helix	trans	-82.2	-26.8	178.4	-74.3	-172.7	-74.2	-102.5	-0	113.9	E658 I659 S663	E658-R661 PolarHBondContact O-N 3.09Å; I659-R661 PolarHBondContact O-N 2.65Å; R661-S663 VanDerWaalsContact C-N 3.3Å; R661-S663 PolarHBondContact O-N 3.43Å
662	I	62.6	Low	66.6	Low	56 Å²	56	83.8 Å²	83.8	29%	0.287	45%	0.449	S	S	.	.	H	α-helix	trans	-71.7	-25.6	-171.3	-61	173.3	0	0	0	111.9	I659 I664 L677 Y680	I659-I662 PolarHBondContact O-N 3.15Å; I662-I664 VanDerWaalsContact C-N 3.27Å; I662-I664 PolarHBondContact O-N 2.73Å; I662-L677 HydrophobicContact CB-CD2 4.32Å; I662-L677 HydrophobicContact CD1-CD2 4.42Å; I662-L677 HydrophobicContact CG2-CD2 3.77Å; I662-L677 HydrophobicContact CG2-CG 4.35Å; I662-Y680 HydrophobicContact CD1-CD1 4.47Å; I662-Y680 HydrophobicContact CD1-CD2 3.66Å; I662-Y680 HydrophobicContact CD1-CE1 4.38Å; I662-Y680 HydrophobicContact CD1-CE2 3.55Å; I662-Y680 HydrophobicContact CD1-CG 4.13Å
663	S	56.8	Low	65.9	Low	69 Å²	69	85.3 Å²	85.3	48%	0.483	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.3	-176.8	-52.5	0	0	0	0	115.2	R661	R661-S663 VanDerWaalsContact C-N 3.3Å; R661-S663 PolarHBondContact O-N 3.43Å
664	I	55.7	Low	65.5	Low	137 Å²	137	80.6 Å²	80.6	70%	0.703	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-26.2	-169.6	-60.5	177	0	0	0	113	I662 M666	I662-I664 VanDerWaalsContact C-N 3.27Å; I662-I664 PolarHBondContact O-N 2.73Å; I664-M666 PolarHBondContact O-N 2.81Å
665	E	53.2	Low	65.2	Low	171 Å²	171	82 Å²	82	80%	0.799	44%	0.438	S	S	*	.			trans	-101.4	75.9	-175.9	-66.1	-174.5	170	0	0	112.1	N667	E665-N667 PolarHBondContact O-N 2.8Å
666	M	54.9	Low	65	Low	119 Å²	119	84.6 Å²	84.6	59%	0.586	45%	0.454	S	S	*	.			trans	-78.2	85	-177.8	-67.1	-174.2	78.2	0	0	113.6	I664 L670	I664-M666 PolarHBondContact O-N 2.81Å; M666-L670 HydrophobicContact CE-CD2 4.47Å
667	N	50.8	Low	64.9	Low	161 Å²	161	81.6 Å²	81.6	86%	0.861	44%	0.44	S	S	*	.			trans	-125.6	106.7	166	-81	-42.5	0	0	0	110.7	E665	E665-N667 PolarHBondContact O-N 2.8Å
668	G	58.3	Low	64.9	Low	54 Å²	54	80.1 Å²	80.1	56%	0.557	43%	0.432	S	S	*	.	S	Bend	trans	149.2	178.7	-179.9	0	0	0	0	0	112
669	T	62.2	Low	65.3	Low	71 Å²	71	82.2 Å²	82.2	44%	0.436	44%	0.444	S	S	.	.			trans	-74.4	161.3	167.9	66.2	0	0	0	0	110.4	E671 D672 Q673	T669-E671 WeakPolarHBondContact CB-OE2 3.34Å; T669-E671 PolarHBondContact O-N 2.66Å; T669-D672 WeakPolarHBondContact CB-OD2 3.47Å; T669-D672 PolarHBondContact N-OD2 2.67Å; T669-D672 PolarHBondContact O-N 2.96Å; T669-D672 PolarHBondContact OG1-N 2.7Å; T669-D672 PolarHBondContact OG1-OD2 3.4Å; T669-Q673 PolarHBondContact O-N 3.17Å
670	L	63.4	Low	65.8	Low	47 Å²	47	86.5 Å²	86.5	25%	0.246	46%	0.461	C	S	.	.	H	α-helix	trans	-62.3	-30.1	177	-68	171.5	0	0	0	110.6	M666 L674 V737 Q740 I741	M666-L670 HydrophobicContact CE-CD2 4.47Å; L670-L674 PolarHBondContact O-N 2.88Å; L670-V737 HydrophobicContact CB-CG1 4.2Å; L670-V737 HydrophobicContact CD2-CG1 4.33Å; L670-V737 WeakPolarHBondContact O-CG1 3.47Å; L670-Q740 HydrophobicContact CD1-CB 4.21Å; L670-I741 HydrophobicContact CB-CD1 4.28Å; L670-I741 HydrophobicContact CB-CG1 4.29Å; L670-I741 HydrophobicContact CD1-CG1 4.06Å
671	E	70.3	Confident	66.5	Low	91 Å²	91	87.4 Å²	87.4	43%	0.425	45%	0.452	S	S	.	.	H	α-helix	trans	-67.8	-35.5	176.4	-62.8	83.7	169.5	0	0	113.2	T669 T675	T669-E671 WeakPolarHBondContact CB-OE2 3.34Å; T669-E671 PolarHBondContact O-N 2.66Å; E671-T675 PolarHBondContact O-OG1 3.12Å
672	D	68.8	Low	67.3	Low	90 Å²	90	87 Å²	87	48%	0.481	45%	0.454	S	S	.	.	H	α-helix	trans	-70.9	-43.3	177	-63.5	-52.7	0	0	0	112	T669 L674 T675 N676	T669-D672 WeakPolarHBondContact CB-OD2 3.47Å; T669-D672 PolarHBondContact N-OD2 2.67Å; T669-D672 PolarHBondContact O-N 2.96Å; T669-D672 PolarHBondContact OG1-N 2.7Å; T669-D672 PolarHBondContact OG1-OD2 3.4Å; D672-L674 VanDerWaalsContact C-N 3.32Å; D672-L674 PolarHBondContact O-N 3.32Å; D672-T675 WeakPolarHBondContact O-CB 3.36Å; D672-T675 PolarHBondContact O-N 2.98Å; D672-T675 VanDerWaalsContact O-N 3.07Å; D672-N676 PolarHBondContact O-N 3.4Å
673	Q	65.1	Low	68.2	Low	42 Å²	42	88 Å²	88	20%	0.196	46%	0.463	C	S	.	.	H	α-helix	trans	-64.1	-39.1	-178.9	-66	177.8	5.8	0	0	111.5	T669 T675 N676	T669-Q673 PolarHBondContact O-N 3.17Å; Q673-T675 PolarHBondContact O-N 2.98Å; Q673-N676 PolarHBondContact O-N 3.23Å
674	L	71.7	Confident	69.4	Low	23 Å²	23	84.9 Å²	84.9	12%	0.12	44%	0.441	C	S	.	.	H	α-helix	trans	-61.1	-26.5	174.3	-171.4	64.3	0	0	0	113.1	L670 D672 K678 I734 V737 E738	L670-L674 PolarHBondContact O-N 2.88Å; D672-L674 VanDerWaalsContact C-N 3.32Å; D672-L674 PolarHBondContact O-N 3.32Å; L674-K678 WeakPolarHBondContact O-CD 3.32Å; L674-K678 WeakPolarHBondContact O-CG 3.47Å; L674-I734 HydrophobicContact CD1-CB 4.44Å; L674-I734 HydrophobicContact CD1-CG2 3.68Å; L674-I734 WeakPolarHBondContact CD1-O 3.4Å; L674-V737 HydrophobicContact CB-CG1 4.4Å; L674-E738 HydrophobicContact CD1-CG 3.79Å; L674-E738 HydrophobicContact CD2-CG 3.86Å
675	T	75.4	Confident	70.5	Confident	83 Å²	83	84.3 Å²	84.3	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-80.4	-45.3	-177.9	-58.8	0	0	0	0	111.7	E671 D672 Q673 L677 K678	E671-T675 PolarHBondContact O-OG1 3.12Å; D672-T675 WeakPolarHBondContact O-CB 3.36Å; D672-T675 PolarHBondContact O-N 2.98Å; D672-T675 VanDerWaalsContact O-N 3.07Å; Q673-T675 PolarHBondContact O-N 2.98Å; T675-L677 VanDerWaalsContact C-N 3.34Å; T675-L677 PolarHBondContact O-N 3.21Å; T675-K678 PolarHBondContact O-N 3.39Å; T675-K678 VanDerWaalsContact O-N 3.13Å
676	N	76	Confident	72	Confident	102 Å²	102	80 Å²	80	55%	0.545	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-36.9	-179.3	-75.2	-29	0	0	0	113.5	D672 Q673 K678 D679 Y680	D672-N676 PolarHBondContact O-N 3.4Å; Q673-N676 PolarHBondContact O-N 3.23Å; N676-K678 VanDerWaalsContact C-N 3.27Å; N676-K678 PolarHBondContact O-N 3.05Å; N676-D679 PolarHBondContact O-N 3.15Å; N676-Y680 PolarHBondContact O-N 2.94Å
677	L	72.4	Confident	73.5	Confident	10 Å²	10	77.4 Å²	77.4	5%	0.052	41%	0.41	C	S	.	.	H	α-helix	trans	-64.8	-30.2	177	-71.6	171.2	0	0	0	112.6	I662 T675 Q681 I734	I662-L677 HydrophobicContact CB-CD2 4.32Å; I662-L677 HydrophobicContact CD1-CD2 4.42Å; I662-L677 HydrophobicContact CG2-CD2 3.77Å; I662-L677 HydrophobicContact CG2-CG 4.35Å; T675-L677 VanDerWaalsContact C-N 3.34Å; T675-L677 PolarHBondContact O-N 3.21Å; L677-Q681 PolarHBondContact O-N 3.37Å; L677-I734 HydrophobicContact CB-CD1 4.07Å; L677-I734 HydrophobicContact CB-CG1 3.7Å; L677-I734 HydrophobicContact CD1-CG1 4.08Å
678	K	75.8	Confident	74.9	Confident	90 Å²	90	74.4 Å²	74.4	39%	0.391	39%	0.392	S	S	.	.	H	α-helix	trans	-72.9	-29.1	178.6	-69.5	171.6	-178.2	172.4	0	112.3	L674 T675 N676 I734 E738	L674-K678 WeakPolarHBondContact O-CD 3.32Å; L674-K678 WeakPolarHBondContact O-CG 3.47Å; T675-K678 PolarHBondContact O-N 3.39Å; T675-K678 VanDerWaalsContact O-N 3.13Å; N676-K678 VanDerWaalsContact C-N 3.27Å; N676-K678 PolarHBondContact O-N 3.05Å; K678-I734 HydrophobicContact CG-CD1 4.08Å; K678-E738 IonicContact NZ-OE1 3.3Å
679	D	80.4	Confident	76.2	Confident	97 Å²	97	75.7 Å²	75.7	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-77.6	-33	175.3	-90.4	-21.6	0	0	0	113.6	N676 Q681 K682 T683	N676-D679 PolarHBondContact O-N 3.15Å; D679-Q681 VanDerWaalsContact C-N 3.33Å; D679-Q681 PolarHBondContact O-N 3.05Å; D679-K682 WeakPolarHBondContact O-CB 3.22Å; D679-K682 PolarHBondContact O-N 2.85Å; D679-T683 PolarHBondContact O-N 3.23Å; D679-T683 PolarHBondContact O-OG1 3.18Å
680	Y	78.8	Confident	77.2	Confident	96 Å²	96	76.5 Å²	76.5	38%	0.376	39%	0.389	S	S	.	.	H	α-helix	trans	-62.7	-40.1	172.8	-94.8	-86.8	0	0	0	112.2	I662 N676 K682 T683 I684	I662-Y680 HydrophobicContact CD1-CD1 4.47Å; I662-Y680 HydrophobicContact CD1-CD2 3.66Å; I662-Y680 HydrophobicContact CD1-CE1 4.38Å; I662-Y680 HydrophobicContact CD1-CE2 3.55Å; I662-Y680 HydrophobicContact CD1-CG 4.13Å; N676-Y680 PolarHBondContact O-N 2.94Å; Y680-K682 VanDerWaalsContact C-N 3.27Å; Y680-K682 PolarHBondContact O-N 3.25Å; Y680-T683 PolarHBondContact O-N 2.91Å; Y680-T683 VanDerWaalsContact O-N 3.17Å; Y680-I684 PolarHBondContact O-N 3.24Å
681	Q	78.5	Confident	78	Confident	69 Å²	69	75.1 Å²	75.1	32%	0.322	38%	0.382	S	S	.	.	H	α-helix	trans	-56.1	-43	175.3	-170.4	-178.7	20	0	0	111.6	L677 D679 T683 I684 M685 I730	L677-Q681 PolarHBondContact O-N 3.37Å; D679-Q681 VanDerWaalsContact C-N 3.33Å; D679-Q681 PolarHBondContact O-N 3.05Å; Q681-T683 VanDerWaalsContact C-N 3.34Å; Q681-T683 PolarHBondContact O-N 2.9Å; Q681-I684 PolarHBondContact O-N 3.19Å; Q681-M685 WeakPolarHBondContact O-CG 3.39Å; Q681-M685 PolarHBondContact O-N 3Å; Q681-I730 HydrophobicContact CB-CD1 4.05Å; Q681-I730 HydrophobicContact CG-CG2 4.39Å
682	K	81.3	Confident	78.6	Confident	149 Å²	149	74.7 Å²	74.7	65%	0.648	38%	0.383	S	S	*	.	H	α-helix	trans	-64.9	-34.4	179.2	-169.8	180	-178.1	-179.1	0	113.2	D679 Y680	D679-K682 WeakPolarHBondContact O-CB 3.22Å; D679-K682 PolarHBondContact O-N 2.85Å; Y680-K682 VanDerWaalsContact C-N 3.27Å; Y680-K682 PolarHBondContact O-N 3.25Å
683	T	83.3	Confident	79.4	Confident	76 Å²	76	75.8 Å²	75.8	47%	0.466	38%	0.383	S	S	.	.	H	α-helix	trans	-68.8	-43.6	178.4	-60.1	0	0	0	0	111.3	D679 Y680 Q681 M685 S686	D679-T683 PolarHBondContact O-N 3.23Å; D679-T683 PolarHBondContact O-OG1 3.18Å; Y680-T683 PolarHBondContact O-N 2.91Å; Y680-T683 VanDerWaalsContact O-N 3.17Å; Q681-T683 VanDerWaalsContact C-N 3.34Å; Q681-T683 PolarHBondContact O-N 2.9Å; T683-M685 VanDerWaalsContact C-N 3.31Å; T683-M685 PolarHBondContact O-N 2.9Å; T683-S686 WeakPolarHBondContact O-CB 3.4Å; T683-S686 PolarHBondContact O-N 2.8Å; T683-S686 VanDerWaalsContact O-N 3.12Å; T683-S686 PolarHBondContact O-OG 3.34Å
684	I	80.6	Confident	80.4	Confident	4 Å²	4	73.8 Å²	73.8	2%	0.021	37%	0.374	C	S	.	.	H	α-helix	trans	-59.4	-43.9	178.1	-66.3	163.7	0	0	0	110.3	I659 Y680 Q681 S686 Y687 W723 L726 L727 I730	I659-I684 HydrophobicContact CD1-CD1 4.17Å; Y680-I684 PolarHBondContact O-N 3.24Å; Q681-I684 PolarHBondContact O-N 3.19Å; I684-S686 PolarHBondContact O-N 3.48Å; I684-Y687 PolarHBondContact O-N 2.77Å; I684-W723 HydrophobicContact CG2-CH2 3.64Å; I684-W723 HydrophobicContact CG2-CZ2 3.87Å; I684-W723 HydrophobicContact CG2-CZ3 4.12Å; I684-W723 WeakPolarHBondContact O-CH2 3.43Å; I684-W723 WeakPolarHBondContact O-CZ2 3.41Å; I684-L726 HydrophobicContact CD1-CD1 4.29Å; I684-L726 HydrophobicContact CD1-CD2 4.22Å; I684-L726 HydrophobicContact CD1-CG 4.09Å; I684-L726 HydrophobicContact CG1-CD2 4.36Å; I684-L726 HydrophobicContact CG2-CD2 3.77Å; I684-L726 HydrophobicContact CG2-CG 4.3Å; I684-L727 HydrophobicContact CG2-CD2 3.9Å; I684-I730 HydrophobicContact CD1-CD1 4.46Å
685	M	79.8	Confident	80.9	Confident	125 Å²	125	75.3 Å²	75.3	62%	0.616	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-58.8	-18.7	178.5	-67.1	-178.2	73.9	0	0	114.8	Q681 T683	Q681-M685 WeakPolarHBondContact O-CG 3.39Å; Q681-M685 PolarHBondContact O-N 3Å; T683-M685 VanDerWaalsContact C-N 3.31Å; T683-M685 PolarHBondContact O-N 2.9Å
686	S	85	Confident	81.3	Confident	82 Å²	82	73.1 Å²	73.1	57%	0.573	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-74.8	-21.3	-177.5	72.3	0	0	0	0	115.3	T683 I684 M688 P689	T683-S686 WeakPolarHBondContact O-CB 3.4Å; T683-S686 PolarHBondContact O-N 2.8Å; T683-S686 VanDerWaalsContact O-N 3.12Å; T683-S686 PolarHBondContact O-OG 3.34Å; I684-S686 PolarHBondContact O-N 3.48Å; S686-M688 VanDerWaalsContact C-N 3.34Å; S686-P689 WeakPolarHBondContact O-CD 3.45Å
687	Y	85.1	Confident	81.7	Confident	64 Å²	64	70.9 Å²	70.9	25%	0.251	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-85.8	-3.8	-175	-161.2	-105.7	0	0	0	114.3	Y651 I684 P689 E690	Y651-Y687 AromaticContact CD1-CD1 3.45Å; Y651-Y687 HydrophobicContact CD1-CD1 3.45Å; Y651-Y687 VanDerWaalsContact CD1-CD1 3.45Å; Y651-Y687 HydrophobicContact CD1-CD2 4.34Å; Y651-Y687 AromaticContact CD1-CE1 3.54Å; Y651-Y687 HydrophobicContact CD1-CE1 3.54Å; Y651-Y687 HydrophobicContact CD1-CE2 4.42Å; Y651-Y687 AromaticContact CD1-CG 3.88Å; Y651-Y687 HydrophobicContact CD1-CG 3.88Å; Y651-Y687 HydrophobicContact CD2-CD2 4.45Å; Y651-Y687 HydrophobicContact CD2-CE1 4.33Å; Y651-Y687 HydrophobicContact CD2-CE2 4.05Å; Y651-Y687 AromaticContact CD2-CZ 3.99Å; Y651-Y687 AromaticContact CE1-CD1 3.51Å; Y651-Y687 HydrophobicContact CE1-CD1 3.51Å; Y651-Y687 AromaticContact CE1-CD2 3.89Å; Y651-Y687 HydrophobicContact CE1-CD2 3.89Å; Y651-Y687 HydrophobicContact CE1-CE1 4.02Å; Y651-Y687 HydrophobicContact CE1-CE2 4.36Å; Y651-Y687 AromaticContact CE1-CG 3.44Å; Y651-Y687 HydrophobicContact CE1-CG 3.44Å; Y651-Y687 VanDerWaalsContact CE1-CG 3.44Å; Y651-Y687 AromaticContact CE2-CD2 3.99Å; Y651-Y687 HydrophobicContact CE2-CD2 3.99Å; Y651-Y687 AromaticContact CE2-CE2 3.97Å; Y651-Y687 HydrophobicContact CE2-CE2 3.97Å; Y651-Y687 HydrophobicContact CE2-CG 4.39Å; Y651-Y687 HydrophobicContact CG-CD1 4.11Å; Y651-Y687 AromaticContact CG-CE1 3.73Å; Y651-Y687 HydrophobicContact CG-CE1 3.73Å; Y651-Y687 HydrophobicContact CG-CE2 4.28Å; Y651-Y687 AromaticContact CG-CZ 3.82Å; Y651-Y687 AromaticContact CZ-CD2 3.69Å; Y651-Y687 AromaticContact CZ-CG 3.72Å; I684-Y687 PolarHBondContact O-N 2.77Å; Y687-P689 VanDerWaalsContact C-N 3.35Å; Y687-E690 PolarHBondContact O-N 2.95Å
688	M	80.4	Confident	82.2	Confident	97 Å²	97	72.2 Å²	72.2	48%	0.478	37%	0.367	S	S	.	.	H	α-helix	trans	-52	-34.5	-176.8	-166.9	-117	-178.7	0	0	116.1	S686 E690 I691 N692	S686-M688 VanDerWaalsContact C-N 3.34Å; M688-E690 PolarHBondContact O-N 3.39Å; M688-I691 WeakPolarHBondContact O-CB 3.42Å; M688-I691 PolarHBondContact O-N 3.38Å; M688-N692 WeakPolarHBondContact CE-OD1 3.35Å; M688-N692 PolarHBondContact O-N 3.33Å; M688-N692 PolarHBondContact O-ND2 3.49Å; M688-N692 PolarHBondContact SD-ND2 2.9Å
689	P	85.6	Confident	82.6	Confident	82 Å²	82	72.1 Å²	72.1	53%	0.532	37%	0.367	S	S	.	.	H	α-helix	trans	-63.5	-32.3	-176.9	-26.4	36.7	0	0	0	116.4	S686 Y687 I691 N692 K693	S686-P689 WeakPolarHBondContact O-CD 3.45Å; Y687-P689 VanDerWaalsContact C-N 3.35Å; P689-I691 VanDerWaalsContact C-N 3.35Å; P689-N692 WeakPolarHBondContact O-CB 3.47Å; P689-N692 PolarHBondContact O-N 2.64Å; P689-K693 PolarHBondContact O-N 2.68Å; P689-K693 VanDerWaalsContact O-N 3.15Å
690	E	83.6	Confident	82.7	Confident	87 Å²	87	72.8 Å²	72.8	41%	0.407	37%	0.367	S	S	.	.	H	α-helix	trans	-73.5	-29.8	179.5	-74.1	-60.9	144.6	0	0	112	Y687 M688 N692 K693 L694	Y687-E690 PolarHBondContact O-N 2.95Å; M688-E690 PolarHBondContact O-N 3.39Å; E690-N692 VanDerWaalsContact C-N 3.33Å; E690-K693 PolarHBondContact O-N 3.28Å; E690-L694 PolarHBondContact O-N 2.79Å
691	I	81.3	Confident	82.9	Confident	18 Å²	18	68.7 Å²	68.7	9%	0.092	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-43.5	170.1	-56.6	-178.9	0	0	0	109.4	V648 M688 P689 K693 L694 E695 M716 W723	V648-I691 HydrophobicContact CG1-CG1 4.06Å; M688-I691 WeakPolarHBondContact O-CB 3.42Å; M688-I691 PolarHBondContact O-N 3.38Å; P689-I691 VanDerWaalsContact C-N 3.35Å; I691-K693 VanDerWaalsContact C-N 3.26Å; I691-K693 PolarHBondContact O-N 2.92Å; I691-L694 PolarHBondContact O-N 3.14Å; I691-E695 PolarHBondContact O-N 3.13Å; I691-E695 VanDerWaalsContact O-N 3.15Å; I691-M716 HydrophobicContact CG2-CE 3.74Å; I691-M716 WeakPolarHBondContact O-CE 3.48Å; I691-W723 HydrophobicContact CD1-CD2 3.78Å; I691-W723 HydrophobicContact CD1-CE3 4.12Å; I691-W723 HydrophobicContact CD1-CG 4.03Å; I691-W723 HydrophobicContact CD1-CZ2 4.46Å
692	N	82.9	Confident	82.8	Confident	83 Å²	83	68.3 Å²	68.3	44%	0.444	35%	0.35	S	S	.	.	H	α-helix	trans	-64.9	-26.5	176.3	-58.7	-25.4	0	0	0	113.4	M688 P689 E690 E695 G696	M688-N692 WeakPolarHBondContact CE-OD1 3.35Å; M688-N692 PolarHBondContact O-N 3.33Å; M688-N692 PolarHBondContact O-ND2 3.49Å; M688-N692 PolarHBondContact SD-ND2 2.9Å; P689-N692 WeakPolarHBondContact O-CB 3.47Å; P689-N692 PolarHBondContact O-N 2.64Å; E690-N692 VanDerWaalsContact C-N 3.33Å; N692-E695 WeakPolarHBondContact O-CB 3.45Å; N692-G696 PolarHBondContact O-N 2.92Å
693	K	84.7	Confident	82.8	Confident	113 Å²	113	67.7 Å²	67.7	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-76.4	-37.6	176.3	-174.2	-179.9	172.9	-170.6	0	112	P689 E690 I691 E695 G696 H697	P689-K693 PolarHBondContact O-N 2.68Å; P689-K693 VanDerWaalsContact O-N 3.15Å; E690-K693 PolarHBondContact O-N 3.28Å; I691-K693 VanDerWaalsContact C-N 3.26Å; I691-K693 PolarHBondContact O-N 2.92Å; K693-E695 VanDerWaalsContact C-N 3.26Å; K693-E695 PolarHBondContact O-N 2.68Å; K693-G696 PolarHBondContact O-N 3.38Å; K693-G696 VanDerWaalsContact O-N 3.11Å; K693-H697 PolarHBondContact O-N 3.24Å
694	L	85.5	Confident	82.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-38.8	172.5	-177.3	61.7	0	0	0	111.1	F641 Q644 A645 V648 E690 I691 G696 H697 H698 M716 L719	F641-L694 HydrophobicContact CD2-CD1 3.82Å; F641-L694 HydrophobicContact CE2-CD1 3.49Å; F641-L694 VanDerWaalsContact CE2-CD1 3.49Å; F641-L694 HydrophobicContact CE2-CG 3.92Å; F641-L694 HydrophobicContact CZ-CD1 4.06Å; F641-L694 HydrophobicContact CZ-CG 4.39Å; Q644-L694 HydrophobicContact CB-CD1 3.94Å; Q644-L694 HydrophobicContact CG-CD1 4.08Å; A645-L694 HydrophobicContact CB-CD1 4.13Å; A645-L694 HydrophobicContact CB-CD2 4.16Å; V648-L694 HydrophobicContact CG2-CD2 4.35Å; E690-L694 PolarHBondContact O-N 2.79Å; I691-L694 PolarHBondContact O-N 3.14Å; L694-G696 VanDerWaalsContact C-N 3.27Å; L694-G696 PolarHBondContact O-N 3.36Å; L694-H697 PolarHBondContact O-N 2.94Å; L694-H698 PolarHBondContact O-N 3.11Å; L694-M716 HydrophobicContact CB-CE 4.38Å; L694-M716 HydrophobicContact CB-SD 4.42Å; L694-M716 HydrophobicContact CD2-CE 4.4Å; L694-M716 HydrophobicContact CD2-SD 3.64Å; L694-M716 HydrophobicContact CG-CE 4.41Å; L694-M716 HydrophobicContact CG-SD 3.83Å; L694-L719 HydrophobicContact CD2-CD1 3.43Å; L694-L719 VanDerWaalsContact CD2-CD1 3.43Å
695	E	81.9	Confident	82.4	Confident	54 Å²	54	70.8 Å²	70.8	25%	0.252	37%	0.367	S	S	.	.	H	α-helix	trans	-55.1	-39.6	170.7	-158.5	71.5	-123.9	0	0	112.4	I691 N692 K693 H698 Q699 M716 R720	I691-E695 PolarHBondContact O-N 3.13Å; I691-E695 VanDerWaalsContact O-N 3.15Å; N692-E695 WeakPolarHBondContact O-CB 3.45Å; K693-E695 VanDerWaalsContact C-N 3.26Å; K693-E695 PolarHBondContact O-N 2.68Å; E695-H698 VanDerWaalsContact O-CB 3.28Å; E695-H698 WeakPolarHBondContact O-CB 3.4Å; E695-H698 PolarHBondContact O-N 3.43Å; E695-H698 IonicContact OE1-CD2 2.85Å; E695-Q699 PolarHBondContact O-N 2.95Å; E695-M716 HydrophobicContact CB-CE 4.25Å; E695-M716 WeakPolarHBondContact OE2-CE 3.38Å; E695-R720 IonicContact OE1-CZ 3.06Å; E695-R720 IonicContact OE1-NH2 2.81Å; E695-R720 PolarHBondContact OE1-NH2 3.41Å; E695-R720 IonicContact OE2-CZ 3.63Å; E695-R720 IonicContact OE2-NE 3.74Å; E695-R720 IonicContact OE2-NH2 3.77Å; E695-R720 PolarHBondContact OE2-NH2 3.23Å
696	G	84.5	Confident	82.3	Confident	37 Å²	37	65 Å²	65	38%	0.381	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-36.1	178.3	0	0	0	0	0	114.6	N692 K693 L694 Q699 Q700	N692-G696 PolarHBondContact O-N 2.92Å; K693-G696 PolarHBondContact O-N 3.38Å; K693-G696 VanDerWaalsContact O-N 3.11Å; L694-G696 VanDerWaalsContact C-N 3.27Å; L694-G696 PolarHBondContact O-N 3.36Å; G696-Q699 WeakPolarHBondContact O-CB 3.39Å; G696-Q699 PolarHBondContact O-N 3.2Å; G696-Q700 PolarHBondContact O-N 2.73Å
697	H	85.3	Confident	81.6	Confident	56 Å²	56	67.8 Å²	67.8	26%	0.259	34%	0.341	S	S	.	.	H	α-helix	trans	-74	-30.8	171.4	-68.7	153.7	0	0	0	111.9	F641 Q644 K693 L694 Q699 Q700 I701	F641-H697 HydrophobicContact CD2-CB 3.96Å; Q644-H697 PolarHBondContact OE1-CE1 3.19Å; Q644-H697 PolarHBondContact OE1-ND1 2.84Å; K693-H697 PolarHBondContact O-N 3.24Å; L694-H697 PolarHBondContact O-N 2.94Å; H697-Q699 VanDerWaalsContact C-N 3.33Å; H697-Q700 PolarHBondContact O-N 3.25Å; H697-I701 PolarHBondContact O-N 2.97Å
698	H	82.1	Confident	81.1	Confident	38 Å²	38	68.9 Å²	68.9	18%	0.176	35%	0.351	C	S	.	.	H	α-helix	trans	-60.5	-45.6	170.4	-160.5	38.4	0	0	0	110.6	F641 L694 E695 Q700 I701 Q702	F641-H698 HydrophobicContact CD2-CB 4.27Å; F641-H698 HydrophobicContact CE2-CB 3.67Å; F641-H698 HydrophobicContact CZ-CB 4.4Å; F641-H698 AromaticContact CZ-ND1 3.99Å; L694-H698 PolarHBondContact O-N 3.11Å; E695-H698 VanDerWaalsContact O-CB 3.28Å; E695-H698 WeakPolarHBondContact O-CB 3.4Å; E695-H698 PolarHBondContact O-N 3.43Å; E695-H698 IonicContact OE1-CD2 2.85Å; H698-Q700 PolarHBondContact O-N 3.48Å; H698-I701 WeakPolarHBondContact O-CB 3.25Å; H698-I701 PolarHBondContact O-N 3.46Å; H698-Q702 PolarHBondContact CD2-NE2 3.33Å; H698-Q702 PolarHBondContact NE2-NE2 3.36Å; H698-Q702 VanDerWaalsContact O-CG 3.32Å; H698-Q702 WeakPolarHBondContact O-CG 3.37Å; H698-Q702 PolarHBondContact O-N 2.86Å
699	Q	84.2	Confident	81.1	Confident	87 Å²	87	65.7 Å²	65.7	41%	0.407	34%	0.336	S	S	.	.	H	α-helix	trans	-56.8	-43.3	178.2	-174.5	64.6	43.6	0	0	113.1	E695 G696 H697 Q702 E703	E695-Q699 PolarHBondContact O-N 2.95Å; G696-Q699 WeakPolarHBondContact O-CB 3.39Å; G696-Q699 PolarHBondContact O-N 3.2Å; H697-Q699 VanDerWaalsContact C-N 3.33Å; Q699-Q702 WeakPolarHBondContact O-CB 3.41Å; Q699-Q702 PolarHBondContact O-N 3.3Å; Q699-E703 PolarHBondContact NE2-OE1 2.97Å; Q699-E703 WeakPolarHBondContact O-CG 3.42Å; Q699-E703 PolarHBondContact O-N 3.15Å
700	Q	82.4	Confident	80.7	Confident	112 Å²	112	68.3 Å²	68.3	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-68.9	-36.1	178.6	-69.9	-176.5	-31.4	0	0	113.1	G696 H697 H698 E703 A704	G696-Q700 PolarHBondContact O-N 2.73Å; H697-Q700 PolarHBondContact O-N 3.25Å; H698-Q700 PolarHBondContact O-N 3.48Å; Q700-E703 PolarHBondContact O-N 3.08Å; Q700-A704 PolarHBondContact O-N 3.19Å
701	I	82.6	Confident	80.6	Confident	9 Å²	9	69.2 Å²	69.2	5%	0.046	34%	0.341	C	S	.	.	H	α-helix	trans	-64	-44	172.3	-85	-179.7	0	0	0	110	L637 F641 H697 H698 E703 A704 L705 I706	L637-I701 HydrophobicContact CB-CG1 4.22Å; F641-I701 HydrophobicContact CB-CD1 3.3Å; F641-I701 HydrophobicContact CG-CD1 3.96Å; H697-I701 PolarHBondContact O-N 2.97Å; H698-I701 WeakPolarHBondContact O-CB 3.25Å; H698-I701 PolarHBondContact O-N 3.46Å; I701-E703 PolarHBondContact O-N 3.33Å; I701-A704 PolarHBondContact O-N 3.43Å; I701-L705 PolarHBondContact O-N 3.28Å; I701-I706 CarbonylContact C-O 3.5Å; I701-I706 HydrophobicContact CG2-CB 4Å; I701-I706 HydrophobicContact CG2-CG2 4.15Å; I701-I706 WeakPolarHBondContact CG2-O 3.4Å; I701-I706 WeakPolarHBondContact O-CB 3.44Å; I701-I706 PolarHBondContact O-N 3.24Å; I701-I706 VanDerWaalsContact O-O 3.05Å
702	Q	76.9	Confident	80.5	Confident	61 Å²	61	69.6 Å²	69.6	29%	0.285	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-39.3	173.5	-68.9	174.8	-3.1	0	0	112.9	H698 Q699 L705 F707	H698-Q702 PolarHBondContact CD2-NE2 3.33Å; H698-Q702 PolarHBondContact NE2-NE2 3.36Å; H698-Q702 VanDerWaalsContact O-CG 3.32Å; H698-Q702 WeakPolarHBondContact O-CG 3.37Å; H698-Q702 PolarHBondContact O-N 2.86Å; Q699-Q702 WeakPolarHBondContact O-CB 3.41Å; Q699-Q702 PolarHBondContact O-N 3.3Å; Q702-L705 WeakPolarHBondContact O-CA 3.44Å; Q702-L705 PolarHBondContact O-N 3.11Å; Q702-F707 HydrophobicContact CB-CE1 4.23Å; Q702-F707 HydrophobicContact CG-CD1 4.38Å; Q702-F707 HydrophobicContact CG-CE1 4.09Å
703	E	81.6	Confident	80.3	Confident	136 Å²	136	70.4 Å²	70.4	64%	0.636	36%	0.357	S	S	*	.	H	α-helix	trans	-67.3	-33.8	177.3	-78.6	171.1	-164.4	0	0	112.9	Q699 Q700 I701 L705	Q699-E703 PolarHBondContact NE2-OE1 2.97Å; Q699-E703 WeakPolarHBondContact O-CG 3.42Å; Q699-E703 PolarHBondContact O-N 3.15Å; Q700-E703 PolarHBondContact O-N 3.08Å; I701-E703 PolarHBondContact O-N 3.33Å; E703-L705 PolarHBondContact O-N 2.86Å
704	A	78.3	Confident	79.9	Confident	33 Å²	33	69 Å²	69	27%	0.273	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	1.3	169.3	0	0	0	0	0	113.4	L637 Q700 I701 I706	L637-A704 HydrophobicContact CD1-CB 3.83Å; Q700-A704 PolarHBondContact O-N 3.19Å; I701-A704 PolarHBondContact O-N 3.43Å; A704-I706 VanDerWaalsContact C-N 3.26Å; A704-I706 HydrophobicContact CB-CD1 3.68Å; A704-I706 HydrophobicContact CB-CG1 3.96Å; A704-I706 PolarHBondContact O-N 3.24Å
705	L	77.6	Confident	79.7	Confident	112 Å²	112	72.4 Å²	72.4	59%	0.586	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	35.5	-175.5	-55.6	174.8	0	0	0	113.5	I701 Q702 E703 F707	I701-L705 PolarHBondContact O-N 3.28Å; Q702-L705 WeakPolarHBondContact O-CA 3.44Å; Q702-L705 PolarHBondContact O-N 3.11Å; E703-L705 PolarHBondContact O-N 2.86Å; L705-F707 HydrophobicContact CB-CE2 4.08Å; L705-F707 HydrophobicContact CB-CZ 4.37Å; L705-F707 HydrophobicContact CD2-CE2 4.46Å; L705-F707 HydrophobicContact CD2-CZ 4.06Å; L705-F707 WeakPolarHBondContact O-CD2 3.36Å; L705-F707 VanDerWaalsContact O-CE2 3.27Å; L705-F707 WeakPolarHBondContact O-CE2 3.32Å
706	I	76.8	Confident	79.7	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.021	36%	0.359	C	S	.	.			trans	-102.4	134.7	174.3	-55.3	166.2	0	0	0	107.3	N634 L637 R638 I701 A704	N634-I706 HydrophobicContact CB-CD1 3.72Å; N634-I706 HydrophobicContact CB-CG1 4.2Å; N634-I706 WeakPolarHBondContact O-CD1 3.37Å; L637-I706 HydrophobicContact CB-CD1 4.07Å; L637-I706 HydrophobicContact CD1-CD1 4.08Å; R638-I706 HydrophobicContact CG-CG2 3.53Å; I701-I706 CarbonylContact C-O 3.5Å; I701-I706 HydrophobicContact CG2-CB 4Å; I701-I706 HydrophobicContact CG2-CG2 4.15Å; I701-I706 WeakPolarHBondContact CG2-O 3.4Å; I701-I706 WeakPolarHBondContact O-CB 3.44Å; I701-I706 PolarHBondContact O-N 3.24Å; I701-I706 VanDerWaalsContact O-O 3.05Å; A704-I706 VanDerWaalsContact C-N 3.26Å; A704-I706 HydrophobicContact CB-CD1 3.68Å; A704-I706 HydrophobicContact CB-CG1 3.96Å; A704-I706 PolarHBondContact O-N 3.24Å
707	F	70.8	Confident	79.4	Confident	140 Å²	140	73.1 Å²	73.1	61%	0.614	36%	0.363	S	S	*	.			trans	-135.8	-20.1	-174.5	-56.7	-74.4	0	0	0	113.6	Q702 L705	Q702-F707 HydrophobicContact CB-CE1 4.23Å; Q702-F707 HydrophobicContact CG-CD1 4.38Å; Q702-F707 HydrophobicContact CG-CE1 4.09Å; L705-F707 HydrophobicContact CB-CE2 4.08Å; L705-F707 HydrophobicContact CB-CZ 4.37Å; L705-F707 HydrophobicContact CD2-CE2 4.46Å; L705-F707 HydrophobicContact CD2-CZ 4.06Å; L705-F707 WeakPolarHBondContact O-CD2 3.36Å; L705-F707 VanDerWaalsContact O-CE2 3.27Å; L705-F707 WeakPolarHBondContact O-CE2 3.32Å
708	D	74.1	Confident	79.1	Confident	87 Å²	87	76.6 Å²	76.6	47%	0.465	38%	0.38	S	S	.	.			trans	-95.6	148.6	175.2	67.2	-60.9	0	0	0	111.1	R638	R638-D708 WeakPolarHBondContact CD-O 3.07Å; R638-D708 IonicContact CZ-OD1 2.7Å; R638-D708 IonicContact CZ-OD2 3.44Å; R638-D708 PolarHBondContact NE-O 3.44Å; R638-D708 IonicContact NE-OD1 3.59Å; R638-D708 PolarHBondContact NE-OD1 3.05Å; R638-D708 IonicContact NE-OD2 2.68Å; R638-D708 PolarHBondContact NE-OD2 3.11Å; R638-D708 IonicContact NH2-OD1 2.7Å; R638-D708 PolarHBondContact NH2-OD1 3.43Å; R638-D708 IonicContact NH2-OD2 3.41Å; R638-D708 PolarHBondContact NH2-OD2 3.42Å
709	N	79.4	Confident	79.2	Confident	30 Å²	30	75 Å²	75	16%	0.16	37%	0.373	C	S	.	.			trans	-149.1	93	178.1	-162.6	-25.8	0	0	0	112	R638 F641 Y711 T712	R638-N709 PolarHBondContact O-ND2 2.95Å; R638-N709 PolarHBondContact O-OD1 3.33Å; F641-N709 WeakPolarHBondContact CD1-ND2 3.39Å; N709-Y711 PolarHBondContact O-N 3.03Å; N709-Y711 WeakPolarHBondContact OD1-CD2 3.28Å; N709-Y711 PolarHBondContact OD1-N 2.81Å; N709-T712 PolarHBondContact O-N 3.39Å
710	Q	79	Confident	79	Confident	137 Å²	137	75 Å²	75	64%	0.64	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-7.4	-180	58.1	-175.8	-20.3	0	0	115.4
711	Y	80.9	Confident	79	Confident	106 Å²	106	73.9 Å²	73.9	42%	0.416	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-4.3	-173.5	-53.7	-67.1	0	0	0	114.7	D635 R638 A639 A642 N709	D635-Y711 PolarHBondContact OD2-OH 3.3Å; D635-Y711 VanDerWaalsContact OD2-OH 3.1Å; R638-Y711 HydrophobicContact CB-CD2 4.07Å; R638-Y711 HydrophobicContact CB-CE2 4.05Å; A639-Y711 HydrophobicContact CB-CD2 4.03Å; A639-Y711 HydrophobicContact CB-CE2 4.01Å; A642-Y711 VanDerWaalsContact CB-CB 3.48Å; N709-Y711 PolarHBondContact O-N 3.03Å; N709-Y711 WeakPolarHBondContact OD1-CD2 3.28Å; N709-Y711 PolarHBondContact OD1-N 2.81Å
712	T	79.8	Confident	78.8	Confident	26 Å²	26	74.5 Å²	74.5	16%	0.16	38%	0.378	C	S	.	.			trans	-142.3	149.5	173.2	-178.9	0	0	0	0	111.8	A642 A645 N646 N709 Y714	A642-T712 HydrophobicContact CB-CG2 3.71Å; A645-T712 HydrophobicContact CB-CG2 4.37Å; N646-T712 PolarHBondContact OD1-OG1 3.05Å; N709-T712 PolarHBondContact O-N 3.39Å; T712-Y714 PolarHBondContact OG1-N 3.49Å
713	S	77.9	Confident	79.1	Confident	101 Å²	101	73 Å²	73	71%	0.706	37%	0.37	S	S	*	.	S	Bend	trans	-92.9	-11	169.1	53.1	0	0	0	0	113.7	T715	S713-T715 PolarHBondContact O-N 3.09Å
714	Y	77.3	Confident	79	Confident	82 Å²	82	72.4 Å²	72.4	32%	0.322	37%	0.367	S	S	.	.			trans	-86.8	108.2	177.6	-70.2	-76.4	0	0	0	110.5	N646 T712 L719	N646-Y714 WeakPolarHBondContact OD1-CD2 3.43Å; T712-Y714 PolarHBondContact OG1-N 3.49Å; Y714-L719 HydrophobicContact CD1-CD2 3.83Å; Y714-L719 HydrophobicContact CE1-CD2 4.49Å; Y714-L719 HydrophobicContact CG-CD2 4.3Å
715	T	81.4	Confident	79	Confident	72 Å²	72	75.3 Å²	75.3	44%	0.442	38%	0.375	S	S	.	.			trans	-78.6	157.1	164.9	70.5	0	0	0	0	110.2	S713 E717 H718 L719	S713-T715 PolarHBondContact O-N 3.09Å; T715-E717 PolarHBondContact O-N 3.42Å; T715-H718 PolarHBondContact O-N 2.84Å; T715-H718 PolarHBondContact OG1-N 2.8Å; T715-H718 PolarHBondContact OG1-ND1 3.17Å; T715-L719 PolarHBondContact O-N 3.28Å
716	M	81.3	Confident	79.2	Confident	6 Å²	6	70 Å²	70	3%	0.03	35%	0.347	C	S	.	.	H	α-helix	trans	-59.4	-35.5	178.5	-163.7	58.3	-177.3	0	0	112.3	I691 L694 E695 L719 R720	I691-M716 HydrophobicContact CG2-CE 3.74Å; I691-M716 WeakPolarHBondContact O-CE 3.48Å; L694-M716 HydrophobicContact CB-CE 4.38Å; L694-M716 HydrophobicContact CB-SD 4.42Å; L694-M716 HydrophobicContact CD2-CE 4.4Å; L694-M716 HydrophobicContact CD2-SD 3.64Å; L694-M716 HydrophobicContact CG-CE 4.41Å; L694-M716 HydrophobicContact CG-SD 3.83Å; E695-M716 HydrophobicContact CB-CE 4.25Å; E695-M716 WeakPolarHBondContact OE2-CE 3.38Å; M716-L719 WeakPolarHBondContact O-CB 3.2Å; M716-L719 PolarHBondContact O-N 2.9Å; M716-L719 HydrophobicContact SD-CD1 4.5Å; M716-R720 WeakPolarHBondContact O-CG 3.2Å; M716-R720 PolarHBondContact O-N 3.41Å
717	E	77.3	Confident	79.2	Confident	100 Å²	100	72.4 Å²	72.4	47%	0.467	36%	0.36	S	S	.	.	H	α-helix	trans	-64.4	-40.7	177.8	-63.2	-49.7	134.7	0	0	114.1	T715 L719 R720 V721	T715-E717 PolarHBondContact O-N 3.42Å; E717-L719 PolarHBondContact O-N 3.41Å; E717-R720 PolarHBondContact O-N 3.01Å; E717-R720 VanDerWaalsContact O-N 3.15Å; E717-R720 IonicContact OE1-CZ 3.94Å; E717-R720 IonicContact OE1-NE 3Å; E717-R720 IonicContact OE1-NH1 2.66Å; E717-R720 PolarHBondContact OE1-NH1 3.35Å; E717-R720 WeakPolarHBondContact OE2-CD 3.26Å; E717-R720 IonicContact OE2-NH1 3.33Å; E717-V721 WeakPolarHBondContact O-CG2 3.43Å; E717-V721 PolarHBondContact O-N 3.31Å
718	H	80.6	Confident	79.5	Confident	130 Å²	130	69.6 Å²	69.6	60%	0.602	36%	0.355	S	S	*	.	H	α-helix	trans	-60.5	-35	175.6	-76.3	104.1	0	0	0	111.6	T715 G722	T715-H718 PolarHBondContact O-N 2.84Å; T715-H718 PolarHBondContact OG1-N 2.8Å; T715-H718 PolarHBondContact OG1-ND1 3.17Å; H718-G722 PolarHBondContact O-N 2.92Å
719	L	82.9	Confident	79.5	Confident	5 Å²	5	67 Å²	67	3%	0.026	34%	0.342	C	S	.	.	H	α-helix	trans	-73.8	-35.5	176.9	-58.7	177	0	0	0	112	A645 V648 I652 L694 Y714 T715 M716 E717 W723	A645-L719 HydrophobicContact CB-CD1 4.34Å; V648-L719 HydrophobicContact CB-CD1 4.33Å; V648-L719 HydrophobicContact CG1-CD1 4.37Å; I652-L719 WeakPolarHBondContact CD1-O 3.43Å; L694-L719 HydrophobicContact CD2-CD1 3.43Å; L694-L719 VanDerWaalsContact CD2-CD1 3.43Å; Y714-L719 HydrophobicContact CD1-CD2 3.83Å; Y714-L719 HydrophobicContact CE1-CD2 4.49Å; Y714-L719 HydrophobicContact CG-CD2 4.3Å; T715-L719 PolarHBondContact O-N 3.28Å; M716-L719 WeakPolarHBondContact O-CB 3.2Å; M716-L719 PolarHBondContact O-N 2.9Å; M716-L719 HydrophobicContact SD-CD1 4.5Å; E717-L719 PolarHBondContact O-N 3.41Å; L719-W723 WeakPolarHBondContact O-CB 3.43Å; L719-W723 PolarHBondContact O-N 3.16Å
720	R	80.9	Confident	79.3	Confident	86 Å²	86	65.7 Å²	65.7	33%	0.325	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-54.7	173.7	-71.4	170.1	176.4	179.4	-4	112	E695 M716 E717 G722 W723 E724	E695-R720 IonicContact OE1-CZ 3.06Å; E695-R720 IonicContact OE1-NH2 2.81Å; E695-R720 PolarHBondContact OE1-NH2 3.41Å; E695-R720 IonicContact OE2-CZ 3.63Å; E695-R720 IonicContact OE2-NE 3.74Å; E695-R720 IonicContact OE2-NH2 3.77Å; E695-R720 PolarHBondContact OE2-NH2 3.23Å; M716-R720 WeakPolarHBondContact O-CG 3.2Å; M716-R720 PolarHBondContact O-N 3.41Å; E717-R720 PolarHBondContact O-N 3.01Å; E717-R720 VanDerWaalsContact O-N 3.15Å; E717-R720 IonicContact OE1-CZ 3.94Å; E717-R720 IonicContact OE1-NE 3Å; E717-R720 IonicContact OE1-NH1 2.66Å; E717-R720 PolarHBondContact OE1-NH1 3.35Å; E717-R720 WeakPolarHBondContact OE2-CD 3.26Å; E717-R720 IonicContact OE2-NH1 3.33Å; R720-G722 VanDerWaalsContact C-N 3.34Å; R720-G722 PolarHBondContact O-N 3.21Å; R720-W723 VanDerWaalsContact O-CB 3.32Å; R720-W723 WeakPolarHBondContact O-CB 3.47Å; R720-W723 PolarHBondContact O-N 2.73Å; R720-E724 PolarHBondContact O-N 2.9Å
721	V	81	Confident	79	Confident	88 Å²	88	61.6 Å²	61.6	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-40.2	-177.3	176	0	0	0	0	111.7	E717 W723 E724 Q725	E717-V721 WeakPolarHBondContact O-CG2 3.43Å; E717-V721 PolarHBondContact O-N 3.31Å; V721-W723 PolarHBondContact O-N 3.15Å; V721-E724 PolarHBondContact O-N 3.35Å; V721-Q725 WeakPolarHBondContact O-CB 3.49Å; V721-Q725 PolarHBondContact O-N 3.24Å
722	G	78.3	Confident	78.6	Confident	23 Å²	23	63.8 Å²	63.8	24%	0.237	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-36.9	174.6	0	0	0	0	0	112.8	I652 H718 R720 L726	I652-G722 VanDerWaalsContact CG2-C 3.47Å; I652-G722 VanDerWaalsContact CG2-O 3.31Å; I652-G722 WeakPolarHBondContact CG2-O 3.29Å; H718-G722 PolarHBondContact O-N 2.92Å; R720-G722 VanDerWaalsContact C-N 3.34Å; R720-G722 PolarHBondContact O-N 3.21Å; G722-L726 PolarHBondContact O-N 2.83Å
723	W	83.6	Confident	78	Confident	30 Å²	30	64 Å²	64	11%	0.114	33%	0.333	C	S	.	.	H	α-helix	trans	-70.8	-42.1	177.4	-167.8	-112.8	0	0	0	112.8	Y651 I652 I684 I691 L719 R720 V721 L726 L727	Y651-W723 HydrophobicContact CD1-CZ3 4.37Å; Y651-W723 HydrophobicContact CE1-CH2 4.47Å; Y651-W723 HydrophobicContact CE1-CZ3 4.21Å; I652-W723 HydrophobicContact CD1-CB 4.22Å; I652-W723 HydrophobicContact CD1-CE3 4.1Å; I652-W723 HydrophobicContact CG1-CE3 3.91Å; I652-W723 HydrophobicContact CG1-CZ3 4.39Å; I652-W723 HydrophobicContact CG2-CE3 4.48Å; I684-W723 HydrophobicContact CG2-CH2 3.64Å; I684-W723 HydrophobicContact CG2-CZ2 3.87Å; I684-W723 HydrophobicContact CG2-CZ3 4.12Å; I684-W723 WeakPolarHBondContact O-CH2 3.43Å; I684-W723 WeakPolarHBondContact O-CZ2 3.41Å; I691-W723 HydrophobicContact CD1-CD2 3.78Å; I691-W723 HydrophobicContact CD1-CE3 4.12Å; I691-W723 HydrophobicContact CD1-CG 4.03Å; I691-W723 HydrophobicContact CD1-CZ2 4.46Å; L719-W723 WeakPolarHBondContact O-CB 3.43Å; L719-W723 PolarHBondContact O-N 3.16Å; R720-W723 VanDerWaalsContact O-CB 3.32Å; R720-W723 WeakPolarHBondContact O-CB 3.47Å; R720-W723 PolarHBondContact O-N 2.73Å; V721-W723 PolarHBondContact O-N 3.15Å; W723-L726 HydrophobicContact CE3-CD2 4.28Å; W723-L726 HydrophobicContact CZ3-CD2 4.19Å; W723-L726 WeakPolarHBondContact O-CB 3.4Å; W723-L726 PolarHBondContact O-N 3.37Å; W723-L727 PolarHBondContact O-N 3.42Å
724	E	80.3	Confident	77.6	Confident	122 Å²	122	60 Å²	60	57%	0.57	30%	0.304	S	S	*	.	H	α-helix	trans	-69.7	-38.3	-179.8	-68.7	177.2	174.9	0	0	113	R720 V721 L726 L727 T728	R720-E724 PolarHBondContact O-N 2.9Å; V721-E724 PolarHBondContact O-N 3.35Å; E724-L726 VanDerWaalsContact C-N 3.29Å; E724-L726 PolarHBondContact O-N 3.03Å; E724-L727 PolarHBondContact O-N 3.29Å; E724-T728 PolarHBondContact O-N 3.37Å; E724-T728 PolarHBondContact O-OG1 3.4Å
725	Q	78.8	Confident	77.2	Confident	94 Å²	94	60.5 Å²	60.5	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-64.8	-34.6	177.1	-175.9	59.9	26.3	0	0	112.2	M656 V721 T728 T729	M656-Q725 HydrophobicContact CE-CB 4.11Å; M656-Q725 HydrophobicContact CE-CG 3.93Å; V721-Q725 WeakPolarHBondContact O-CB 3.49Å; V721-Q725 PolarHBondContact O-N 3.24Å; Q725-T728 PolarHBondContact O-N 2.89Å; Q725-T729 PolarHBondContact O-N 2.8Å; Q725-T729 VanDerWaalsContact O-N 3.17Å; Q725-T729 PolarHBondContact O-OG1 3.41Å
726	L	80.1	Confident	76.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-44.5	174.2	179.3	64.1	0	0	0	111.2	K655 M656 I659 I684 G722 W723 E724	K655-L726 HydrophobicContact CB-CD1 4.31Å; K655-L726 HydrophobicContact CB-CD2 3.96Å; M656-L726 HydrophobicContact CB-CD1 3.93Å; M656-L726 HydrophobicContact CE-CB 4.09Å; M656-L726 HydrophobicContact CG-CD1 4.32Å; I659-L726 HydrophobicContact CD1-CD1 3.57Å; I684-L726 HydrophobicContact CD1-CD1 4.29Å; I684-L726 HydrophobicContact CD1-CD2 4.22Å; I684-L726 HydrophobicContact CD1-CG 4.09Å; I684-L726 HydrophobicContact CG1-CD2 4.36Å; I684-L726 HydrophobicContact CG2-CD2 3.77Å; I684-L726 HydrophobicContact CG2-CG 4.3Å; G722-L726 PolarHBondContact O-N 2.83Å; W723-L726 HydrophobicContact CE3-CD2 4.28Å; W723-L726 HydrophobicContact CZ3-CD2 4.19Å; W723-L726 WeakPolarHBondContact O-CB 3.4Å; W723-L726 PolarHBondContact O-N 3.37Å; E724-L726 VanDerWaalsContact C-N 3.29Å; E724-L726 PolarHBondContact O-N 3.03Å
727	L	77.9	Confident	75.7	Confident	55 Å²	55	64 Å²	64	29%	0.288	32%	0.324	S	S	.	.	H	α-helix	trans	-67.9	-36	177.9	-65.4	171.9	0	0	0	113	I684 W723 E724 I730	I684-L727 HydrophobicContact CG2-CD2 3.9Å; W723-L727 PolarHBondContact O-N 3.42Å; E724-L727 PolarHBondContact O-N 3.29Å; L727-I730 VanDerWaalsContact O-CG2 3.27Å; L727-I730 WeakPolarHBondContact O-CG2 3.25Å
728	T	76.1	Confident	74.9	Confident	82 Å²	82	63 Å²	63	50%	0.503	32%	0.32	S	S	.	.	H	α-helix	trans	-70.8	-33.6	179.5	-57.1	0	0	0	0	112.2	E724 Q725	E724-T728 PolarHBondContact O-N 3.37Å; E724-T728 PolarHBondContact O-OG1 3.4Å; Q725-T728 PolarHBondContact O-N 2.89Å
729	T	75.1	Confident	73.9	Confident	33 Å²	33	61.3 Å²	61.3	20%	0.202	32%	0.315	C	S	.	.	H	α-helix	trans	-70.9	-40.2	-176.1	-58.7	0	0	0	0	112.2	Q725 A731 R732	Q725-T729 PolarHBondContact O-N 2.8Å; Q725-T729 VanDerWaalsContact O-N 3.17Å; Q725-T729 PolarHBondContact O-OG1 3.41Å; T729-A731 VanDerWaalsContact C-N 3.34Å; T729-A731 PolarHBondContact O-N 3.31Å; T729-R732 PolarHBondContact O-N 3.14Å
730	I	76.1	Confident	72.7	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-70.8	-25.9	178.1	-169	160	0	0	0	113.6	I659 Q681 I684 L727 T733 I734	I659-I730 HydrophobicContact CD1-CB 4.15Å; I659-I730 HydrophobicContact CD1-CD1 4.38Å; I659-I730 HydrophobicContact CG1-CD1 4.43Å; Q681-I730 HydrophobicContact CB-CD1 4.05Å; Q681-I730 HydrophobicContact CG-CG2 4.39Å; I684-I730 HydrophobicContact CD1-CD1 4.46Å; L727-I730 VanDerWaalsContact O-CG2 3.27Å; L727-I730 WeakPolarHBondContact O-CG2 3.25Å; I730-T733 PolarHBondContact O-OG1 3.39Å; I730-I734 WeakPolarHBondContact O-CD1 3.41Å; I730-I734 WeakPolarHBondContact O-CG1 3.3Å
731	A	70.9	Confident	71.6	Confident	51 Å²	51	64 Å²	64	42%	0.421	33%	0.332	S	S	.	.	H	α-helix	trans	-72.5	-29.6	177.6	0	0	0	0	0	113.2	T729	T729-A731 VanDerWaalsContact C-N 3.34Å; T729-A731 PolarHBondContact O-N 3.31Å
732	R	73.7	Confident	70.1	Confident	152 Å²	152	66 Å²	66	57%	0.574	34%	0.339	S	S	*	.	H	α-helix	trans	-72.2	-45.9	-176.1	-163.5	-164.9	-43.6	144.3	13.8	112.4	T729 I734 N735	T729-R732 PolarHBondContact O-N 3.14Å; R732-I734 PolarHBondContact O-N 3.03Å; R732-N735 PolarHBondContact O-N 2.86Å
733	T	67.1	Low	69	Low	31 Å²	31	70.4 Å²	70.4	19%	0.19	36%	0.362	C	S	.	.	H	α-helix	trans	-66.7	-22.1	-178.4	44	0	0	0	0	113.3	I730	I730-T733 PolarHBondContact O-OG1 3.39Å
734	I	69.6	Low	67.5	Low	18 Å²	18	74.5 Å²	74.5	9%	0.092	38%	0.377	C	S	.	.	H	α-helix	trans	-69.6	-42.5	174.2	-72	173.1	0	0	0	111.4	L674 L677 K678 I730 R732	L674-I734 HydrophobicContact CD1-CB 4.44Å; L674-I734 HydrophobicContact CD1-CG2 3.68Å; L674-I734 WeakPolarHBondContact CD1-O 3.4Å; L677-I734 HydrophobicContact CB-CD1 4.07Å; L677-I734 HydrophobicContact CB-CG1 3.7Å; L677-I734 HydrophobicContact CD1-CG1 4.08Å; K678-I734 HydrophobicContact CG-CD1 4.08Å; I730-I734 WeakPolarHBondContact O-CD1 3.41Å; I730-I734 WeakPolarHBondContact O-CG1 3.3Å; R732-I734 PolarHBondContact O-N 3.03Å
735	N	68.6	Low	66.2	Low	91 Å²	91	73.8 Å²	73.8	49%	0.487	38%	0.377	S	S	.	.	H	α-helix	trans	-69.3	-35.2	-175.4	-171.2	-47.2	0	0	0	112.7	R732 V737 E738 N739	R732-N735 PolarHBondContact O-N 2.86Å; N735-V737 VanDerWaalsContact C-N 3.28Å; N735-V737 PolarHBondContact O-N 3.21Å; N735-E738 PolarHBondContact O-N 3.38Å; N735-E738 VanDerWaalsContact O-N 3.14Å; N735-N739 PolarHBondContact O-N 3.47Å; N735-N739 PolarHBondContact O-ND2 2.95Å; N735-N739 PolarHBondContact OD1-ND2 3.26Å; N735-N739 VanDerWaalsContact OD1-ND2 3.1Å
736	E	67.4	Low	64.6	Low	131 Å²	131	73.3 Å²	73.3	61%	0.612	39%	0.389	S	S	*	.	H	α-helix	trans	-65.6	-30.7	-176.9	-165.7	159.6	-169.5	0	0	113
737	V	64.7	Low	63.3	Low	20 Å²	20	79.3 Å²	79.3	12%	0.121	42%	0.415	C	S	.	.	H	α-helix	trans	-72.1	-33.7	174.5	179.8	0	0	0	0	111.8	L670 L674 N735	L670-V737 HydrophobicContact CB-CG1 4.2Å; L670-V737 HydrophobicContact CD2-CG1 4.33Å; L670-V737 WeakPolarHBondContact O-CG1 3.47Å; L674-V737 HydrophobicContact CB-CG1 4.4Å; N735-V737 VanDerWaalsContact C-N 3.28Å; N735-V737 PolarHBondContact O-N 3.21Å
738	E	58.9	Low	62	Low	79 Å²	79	80.6 Å²	80.6	37%	0.369	44%	0.442	S	S	.	.	H	α-helix	trans	-70.7	-33.2	-175.7	-67.4	174.8	159.7	0	0	112.5	L674 K678 N735 Q740	L674-E738 HydrophobicContact CD1-CG 3.79Å; L674-E738 HydrophobicContact CD2-CG 3.86Å; K678-E738 IonicContact NZ-OE1 3.3Å; N735-E738 PolarHBondContact O-N 3.38Å; N735-E738 VanDerWaalsContact O-N 3.14Å; E738-Q740 PolarHBondContact O-N 3.03Å
739	N	59.6	Low	60.9	Low	95 Å²	95	78.7 Å²	78.7	51%	0.508	43%	0.428	S	S	.	.	H	α-helix	trans	-69.2	-28.4	-179.8	-75.2	-66	0	0	0	114.2	N735 I741 L742	N735-N739 PolarHBondContact O-N 3.47Å; N735-N739 PolarHBondContact O-ND2 2.95Å; N735-N739 PolarHBondContact OD1-ND2 3.26Å; N735-N739 VanDerWaalsContact OD1-ND2 3.1Å; N739-I741 VanDerWaalsContact C-N 3.28Å; N739-I741 PolarHBondContact O-N 3.35Å; N739-L742 PolarHBondContact O-N 3.44Å
740	Q	58.1	Low	59.9	Low	109 Å²	109	79.6 Å²	79.6	51%	0.509	44%	0.436	S	S	.	.	H	α-helix	trans	-69	-30.1	-177.6	-60.9	-176	15.9	0	0	112.2	L670 E738 L742	L670-Q740 HydrophobicContact CD1-CB 4.21Å; E738-Q740 PolarHBondContact O-N 3.03Å; Q740-L742 VanDerWaalsContact C-N 3.31Å; Q740-L742 PolarHBondContact O-N 2.89Å
741	I	57.9	Low	58.6	Low	40 Å²	40	86.9 Å²	86.9	21%	0.205	47%	0.47	C	S	.	.	H	α-helix	trans	-67.5	-33.3	178.8	-60	173.9	0	0	0	110.9	L670 N739 T743	L670-I741 HydrophobicContact CB-CD1 4.28Å; L670-I741 HydrophobicContact CB-CG1 4.29Å; L670-I741 HydrophobicContact CD1-CG1 4.06Å; N739-I741 VanDerWaalsContact C-N 3.28Å; N739-I741 PolarHBondContact O-N 3.35Å; I741-T743 PolarHBondContact O-N 3.14Å
742	L	50.4	Low	57.5	Low	129 Å²	129	91.8 Å²	91.8	68%	0.675	48%	0.484	S	S	*	.	H	α-helix	trans	-70.5	-31.8	-171.5	-136.4	101.7	0	0	0	114.4	N739 Q740 R744	N739-L742 PolarHBondContact O-N 3.44Å; Q740-L742 VanDerWaalsContact C-N 3.31Å; Q740-L742 PolarHBondContact O-N 2.89Å; L742-R744 VanDerWaalsContact C-N 3.3Å; L742-R744 PolarHBondContact O-N 3.46Å
743	T	53.8	Low	56.3	Low	115 Å²	115	89 Å²	89	71%	0.706	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-73.8	-23.6	-174	-60.1	0	0	0	0	112.6	I741 D745	I741-T743 PolarHBondContact O-N 3.14Å; T743-D745 VanDerWaalsContact C-N 3.3Å; T743-D745 PolarHBondContact O-N 3.5Å
744	R	52.4	Low	55.7	Low	117 Å²	117	89.5 Å²	89.5	44%	0.442	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-61.5	-35.8	178.2	-175.2	-169.7	66.1	-150.1	-12.5	112.6	L742	L742-R744 VanDerWaalsContact C-N 3.3Å; L742-R744 PolarHBondContact O-N 3.46Å
745	D	52.2	Low	54.9	Low	107 Å²	107	95.8 Å²	95.8	57%	0.572	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-94.7	-4.7	-161.3	-63.3	-17	0	0	0	113.9	T743	T743-D745 VanDerWaalsContact C-N 3.3Å; T743-D745 PolarHBondContact O-N 3.5Å
746	A	46.8	Very low	54.3	Low	83 Å²	83	97.4 Å²	97.4	69%	0.686	51%	0.51	S	S	*	.	S	Bend	trans	-97.5	-16.9	-163.3	0	0	0	0	0	117.2
747	K	51.3	Low	54	Low	126 Å²	126	94.5 Å²	94.5	55%	0.548	49%	0.494	S	S	.	.	S	Bend	trans	-110.6	1.9	-169.8	-62.8	-155	-177.9	-166.1	0	116.7	I749	K747-I749 HydrophobicContact CB-CD1 4.5Å; K747-I749 PolarHBondContact O-N 3.22Å
748	G	51.4	Low	53.7	Low	83 Å²	83	100 Å²	100	86%	0.856	51%	0.513	S	S	*	.			trans	65.4	-2.5	171.2	0	0	0	0	0	116.6	S750	G748-S750 PolarHBondContact O-N 3.13Å
749	I	53.4	Low	53.7	Low	42 Å²	42	98.2 Å²	98.2	22%	0.215	51%	0.512	C	S	.	.			trans	-64.1	130.1	167.2	-53.5	170.6	0	0	0	106.6	K747 Q753 L754 Y757	K747-I749 HydrophobicContact CB-CD1 4.5Å; K747-I749 PolarHBondContact O-N 3.22Å; I749-Q753 HydrophobicContact CG2-CB 3.66Å; I749-L754 HydrophobicContact CB-CB 4.11Å; I749-L754 HydrophobicContact CB-CD1 4.05Å; I749-L754 HydrophobicContact CD1-CD1 3.72Å; I749-L754 HydrophobicContact CG1-CD1 4.45Å; I749-L754 HydrophobicContact CG2-CB 3.72Å; I749-L754 HydrophobicContact CG2-CD1 4.16Å; I749-L754 VanDerWaalsContact CG2-N 3.29Å; I749-Y757 HydrophobicContact CG2-CD2 4.22Å; I749-Y757 HydrophobicContact CG2-CE2 4.34Å
750	S	53.6	Low	53.6	Low	52 Å²	52	95.7 Å²	95.7	36%	0.364	50%	0.502	S	S	.	.			trans	-59.1	152.3	-178.2	77.4	0	0	0	0	110.4	G748 E752 Q753 L754	G748-S750 PolarHBondContact O-N 3.13Å; S750-E752 PolarHBondContact O-N 3.19Å; S750-E752 VanDerWaalsContact O-N 3.07Å; S750-Q753 PolarHBondContact O-N 3.07Å; S750-Q753 VanDerWaalsContact O-N 3.08Å; S750-Q753 WeakPolarHBondContact OG-CB 3.43Å; S750-Q753 WeakPolarHBondContact OG-CG 3.45Å; S750-Q753 PolarHBondContact OG-N 2.9Å; S750-L754 WeakPolarHBondContact O-CB 3.37Å; S750-L754 PolarHBondContact O-N 3.42Å
751	Q	47.9	Very low	53.7	Low	154 Å²	154	91.5 Å²	91.5	72%	0.72	48%	0.482	S	S	*	.	H	α-helix	trans	-58.7	-28	-178.5	-159.6	173.1	10.8	0	0	111.6	F755	Q751-F755 WeakPolarHBondContact O-CB 3.26Å; Q751-F755 PolarHBondContact O-N 3.44Å; Q751-F755 VanDerWaalsContact O-N 3.12Å
752	E	49.3	Very low	53.9	Low	154 Å²	154	94 Å²	94	72%	0.72	50%	0.496	S	S	*	.	H	α-helix	trans	-76.8	-45.5	173.1	-67.1	176.6	162.6	0	0	113	S750 F755 E756	S750-E752 PolarHBondContact O-N 3.19Å; S750-E752 VanDerWaalsContact O-N 3.07Å; E752-F755 CarbonylContact O-C 3.56Å; E752-F755 PolarHBondContact O-N 2.61Å; E752-E756 WeakPolarHBondContact O-CB 3.39Å; E752-E756 WeakPolarHBondContact O-CG 3.32Å; E752-E756 PolarHBondContact O-N 3.44Å
753	Q	48.6	Very low	54.5	Low	92 Å²	92	94.3 Å²	94.3	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-69.4	-36.3	177.3	-76.2	-178.7	-42.6	0	0	112.4	I749 S750 F755 E756 Y757	I749-Q753 HydrophobicContact CG2-CB 3.66Å; S750-Q753 PolarHBondContact O-N 3.07Å; S750-Q753 VanDerWaalsContact O-N 3.08Å; S750-Q753 WeakPolarHBondContact OG-CB 3.43Å; S750-Q753 WeakPolarHBondContact OG-CG 3.45Å; S750-Q753 PolarHBondContact OG-N 2.9Å; Q753-F755 VanDerWaalsContact C-N 3.29Å; Q753-E756 PolarHBondContact O-N 3.49Å; Q753-Y757 HydrophobicContact CB-CD2 4.49Å; Q753-Y757 HydrophobicContact CB-CE2 4.22Å; Q753-Y757 WeakPolarHBondContact O-CB 3.47Å; Q753-Y757 WeakPolarHBondContact O-CD2 3.2Å; Q753-Y757 VanDerWaalsContact O-CG 3.23Å; Q753-Y757 PolarHBondContact O-N 3.1Å
754	L	53.3	Low	54.8	Low	42 Å²	42	91.4 Å²	91.4	22%	0.22	47%	0.471	C	S	.	.	H	α-helix	trans	-68	-36.2	174.7	-168.5	73.6	0	0	0	109.8	I749 S750 R758 F815	I749-L754 HydrophobicContact CB-CB 4.11Å; I749-L754 HydrophobicContact CB-CD1 4.05Å; I749-L754 HydrophobicContact CD1-CD1 3.72Å; I749-L754 HydrophobicContact CG1-CD1 4.45Å; I749-L754 HydrophobicContact CG2-CB 3.72Å; I749-L754 HydrophobicContact CG2-CD1 4.16Å; I749-L754 VanDerWaalsContact CG2-N 3.29Å; S750-L754 WeakPolarHBondContact O-CB 3.37Å; S750-L754 PolarHBondContact O-N 3.42Å; L754-R758 WeakPolarHBondContact O-CB 3.48Å; L754-R758 PolarHBondContact O-N 2.85Å; L754-F815 HydrophobicContact CD1-CE1 3.74Å; L754-F815 HydrophobicContact CD1-CZ 4.11Å
755	F	53.3	Low	55.4	Low	151 Å²	151	86.3 Å²	86.3	66%	0.662	45%	0.452	S	S	*	.	H	α-helix	trans	-72.5	-35.8	172.8	-174	-90.7	0	0	0	112.4	Q751 E752 Q753 A759	Q751-F755 WeakPolarHBondContact O-CB 3.26Å; Q751-F755 PolarHBondContact O-N 3.44Å; Q751-F755 VanDerWaalsContact O-N 3.12Å; E752-F755 CarbonylContact O-C 3.56Å; E752-F755 PolarHBondContact O-N 2.61Å; Q753-F755 VanDerWaalsContact C-N 3.29Å; F755-A759 HydrophobicContact CD1-CB 4.38Å; F755-A759 HydrophobicContact CE1-CB 4.29Å; F755-A759 WeakPolarHBondContact O-CA 3.33Å; F755-A759 WeakPolarHBondContact O-CB 3.05Å; F755-A759 PolarHBondContact O-N 2.96Å
756	E	56.2	Low	55.7	Low	124 Å²	124	89.4 Å²	89.4	58%	0.579	46%	0.461	S	S	*	.	H	α-helix	trans	-66.6	-51.3	173.8	-80.8	-174	146.4	0	0	110.9	E752 Q753 R758 S760	E752-E756 WeakPolarHBondContact O-CB 3.39Å; E752-E756 WeakPolarHBondContact O-CG 3.32Å; E752-E756 PolarHBondContact O-N 3.44Å; Q753-E756 PolarHBondContact O-N 3.49Å; E756-R758 VanDerWaalsContact C-N 3.31Å; E756-R758 PolarHBondContact O-N 2.68Å; E756-S760 WeakPolarHBondContact O-CB 3.35Å; E756-S760 PolarHBondContact O-N 3.05Å; E756-S760 PolarHBondContact O-OG 2.97Å
757	Y	60.8	Low	56.3	Low	70 Å²	70	89.8 Å²	89.8	28%	0.275	45%	0.451	S	S	.	.	H	α-helix	trans	-60.5	-41.5	176	-63.7	-41.1	0	0	0	110.8	I749 Q753 F761 F815 F818 I819	I749-Y757 HydrophobicContact CG2-CD2 4.22Å; I749-Y757 HydrophobicContact CG2-CE2 4.34Å; Q753-Y757 HydrophobicContact CB-CD2 4.49Å; Q753-Y757 HydrophobicContact CB-CE2 4.22Å; Q753-Y757 WeakPolarHBondContact O-CB 3.47Å; Q753-Y757 WeakPolarHBondContact O-CD2 3.2Å; Q753-Y757 VanDerWaalsContact O-CG 3.23Å; Q753-Y757 PolarHBondContact O-N 3.1Å; Y757-F761 WeakPolarHBondContact O-CB 3.4Å; Y757-F761 PolarHBondContact O-N 3.01Å; Y757-F815 VanDerWaalsContact C-CE2 3.49Å; Y757-F818 HydrophobicContact CD1-CE1 4.33Å; Y757-I819 HydrophobicContact CD2-CD1 3.9Å; Y757-I819 HydrophobicContact CE2-CD1 3.74Å; Y757-I819 HydrophobicContact CG-CD1 4.44Å
758	R	59.3	Low	56.6	Low	135 Å²	135	91.7 Å²	91.7	51%	0.509	46%	0.462	S	S	.	.	H	α-helix	trans	-83.9	-27.2	-177	-163.2	167.3	-175.1	109.4	-1.4	114.6	L754 E756 F761 N762 F815	L754-R758 WeakPolarHBondContact O-CB 3.48Å; L754-R758 PolarHBondContact O-N 2.85Å; E756-R758 VanDerWaalsContact C-N 3.31Å; E756-R758 PolarHBondContact O-N 2.68Å; R758-F761 PolarHBondContact O-N 3.12Å; R758-N762 VanDerWaalsContact O-CB 3.29Å; R758-N762 WeakPolarHBondContact O-CB 3.41Å; R758-N762 VanDerWaalsContact O-CG 3.3Å; R758-N762 PolarHBondContact O-N 2.66Å; R758-N762 PolarHBondContact O-OD1 2.95Å; R758-F815 HydrophobicContact CB-CE2 4.19Å; R758-F815 HydrophobicContact CB-CZ 4.05Å
759	A	57.7	Low	56.9	Low	43 Å²	43	91.3 Å²	91.3	36%	0.355	45%	0.446	S	S	.	.	H	α-helix	trans	-71.4	-37.4	168.2	0	0	0	0	0	110.2	F755 H763	F755-A759 HydrophobicContact CD1-CB 4.38Å; F755-A759 HydrophobicContact CE1-CB 4.29Å; F755-A759 WeakPolarHBondContact O-CA 3.33Å; F755-A759 WeakPolarHBondContact O-CB 3.05Å; F755-A759 PolarHBondContact O-N 2.96Å; A759-H763 WeakPolarHBondContact O-CB 3.39Å; A759-H763 PolarHBondContact O-N 3.04Å
760	S	58	Low	57.1	Low	41 Å²	41	92 Å²	92	29%	0.287	46%	0.464	S	S	.	.	H	α-helix	trans	-60.4	-50	168.7	-57.6	0	0	0	0	110.4	E756 N762 H763 F764	E756-S760 WeakPolarHBondContact O-CB 3.35Å; E756-S760 PolarHBondContact O-N 3.05Å; E756-S760 PolarHBondContact O-OG 2.97Å; S760-N762 PolarHBondContact O-N 2.87Å; S760-H763 PolarHBondContact O-N 3.46Å; S760-F764 WeakPolarHBondContact O-CD2 3.29Å; S760-F764 PolarHBondContact O-N 2.96Å
761	F	60.8	Low	57.5	Low	21 Å²	21	89.9 Å²	89.9	9%	0.092	45%	0.45	C	S	.	.	H	α-helix	trans	-57.9	-49.5	177.5	-159.9	-89.6	0	0	0	112.4	Y757 R758 H763 F764 D765 L772 F815	Y757-F761 WeakPolarHBondContact O-CB 3.4Å; Y757-F761 PolarHBondContact O-N 3.01Å; R758-F761 PolarHBondContact O-N 3.12Å; F761-H763 VanDerWaalsContact C-N 3.35Å; F761-H763 PolarHBondContact O-N 2.93Å; F761-F764 PolarHBondContact O-N 2.69Å; F761-D765 PolarHBondContact O-N 2.88Å; F761-L772 HydrophobicContact CD1-CG 4.37Å; F761-L772 HydrophobicContact CD2-CD1 3.37Å; F761-L772 HydrophobicContact CD2-CG 3.69Å; F761-L772 HydrophobicContact CE1-CG 4.26Å; F761-L772 HydrophobicContact CE2-CB 4.24Å; F761-L772 HydrophobicContact CE2-CD1 3.62Å; F761-L772 HydrophobicContact CE2-CG 3.57Å; F761-L772 HydrophobicContact CG-CD1 4.02Å; F761-L772 HydrophobicContact CG-CG 4.11Å; F761-L772 HydrophobicContact CZ-CB 4.46Å; F761-L772 HydrophobicContact CZ-CD1 4.42Å; F761-L772 HydrophobicContact CZ-CG 3.88Å; F761-F815 HydrophobicContact CB-CD2 4.1Å; F761-F815 HydrophobicContact CB-CE2 4.3Å; F761-F815 HydrophobicContact CD2-CB 4.28Å; F761-F815 AromaticContact CD2-CD2 3.64Å; F761-F815 HydrophobicContact CD2-CD2 3.64Å; F761-F815 HydrophobicContact CD2-CG 4.46Å; F761-F815 HydrophobicContact CE2-CB 3.96Å; F761-F815 HydrophobicContact CE2-CD2 4.17Å; F761-F815 AromaticContact CG-CD2 3.92Å; F761-F815 HydrophobicContact CG-CD2 3.92Å; F761-F815 HydrophobicContact CZ-CB 4.17Å
762	N	62	Low	58.5	Low	94 Å²	94	82.7 Å²	82.7	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-71	-23.8	179	-73.9	11.3	0	0	0	113.9	R758 S760 F764	R758-N762 VanDerWaalsContact O-CB 3.29Å; R758-N762 WeakPolarHBondContact O-CB 3.41Å; R758-N762 VanDerWaalsContact O-CG 3.3Å; R758-N762 PolarHBondContact O-N 2.66Å; R758-N762 PolarHBondContact O-OD1 2.95Å; S760-N762 PolarHBondContact O-N 2.87Å; N762-F764 VanDerWaalsContact C-N 3.29Å
763	H	61.8	Low	59.5	Low	135 Å²	135	78.4 Å²	78.4	63%	0.625	40%	0.396	S	S	*	.	H	α-helix	trans	-69.5	-31.3	175	-177.1	76.9	0	0	0	111.7	A759 S760 F761	A759-H763 WeakPolarHBondContact O-CB 3.39Å; A759-H763 PolarHBondContact O-N 3.04Å; S760-H763 PolarHBondContact O-N 3.46Å; F761-H763 VanDerWaalsContact C-N 3.35Å; F761-H763 PolarHBondContact O-N 2.93Å
764	F	60.8	Low	60.4	Low	54 Å²	54	75.9 Å²	75.9	24%	0.237	39%	0.39	C	S	.	.	H	α-helix	trans	-93	-25.5	177.7	-65.7	-68.2	0	0	0	113.3	S760 F761 N762 K766 L772 E776 A779	S760-F764 WeakPolarHBondContact O-CD2 3.29Å; S760-F764 PolarHBondContact O-N 2.96Å; F761-F764 PolarHBondContact O-N 2.69Å; N762-F764 VanDerWaalsContact C-N 3.29Å; F764-K766 PolarHBondContact O-N 3.32Å; F764-L772 HydrophobicContact CB-CD2 3.68Å; F764-E776 HydrophobicContact CB-CB 4.35Å; F764-A779 HydrophobicContact CE1-CB 4.47Å
765	D	64.3	Low	61	Low	9 Å²	9	81.4 Å²	81.4	5%	0.048	42%	0.415	C	S	.	.			trans	-76.2	81.9	170.7	-175.8	-6.2	0	0	0	112.9	F761 D767 H768 S769 G770 L772	F761-D765 PolarHBondContact O-N 2.88Å; D765-D767 PolarHBondContact OD1-N 2.97Å; D765-H768 PolarHBondContact O-ND1 3.41Å; D765-H768 WeakPolarHBondContact OD1-CA 3.4Å; D765-H768 PolarHBondContact OD1-N 3.35Å; D765-S769 PolarHBondContact OD1-N 3.5Å; D765-G770 VanDerWaalsContact OD2-CA 3.3Å; D765-G770 WeakPolarHBondContact OD2-CA 3.33Å; D765-G770 PolarHBondContact OD2-N 2.76Å; D765-L772 HydrophobicContact CB-CD2 4.33Å
766	K	59.4	Low	61.7	Low	173 Å²	173	76.3 Å²	76.3	75%	0.752	39%	0.393	S	S	*	.			trans	-79.4	-15.3	-178.8	-73	177.4	-178.9	165.6	0	115.6	F764	F764-K766 PolarHBondContact O-N 3.32Å
767	D	59.8	Low	62.3	Low	90 Å²	90	70.6 Å²	70.6	48%	0.481	37%	0.366	S	S	.	.	S	Bend	trans	-101.9	-2	179.7	58.1	28	0	0	0	113.5	D765 S769 K773	D765-D767 PolarHBondContact OD1-N 2.97Å; D767-S769 PolarHBondContact O-N 3.38Å; D767-S769 WeakPolarHBondContact OD1-CB 3.25Å; D767-S769 PolarHBondContact OD1-N 2.85Å; D767-S769 PolarHBondContact OD1-OG 3.4Å; D767-K773 IonicContact OD1-NZ 3.95Å; D767-K773 IonicContact OD2-NZ 3.39Å; D767-K773 PolarHBondContact OD2-NZ 3.36Å
768	H	56.6	Low	62.6	Low	167 Å²	167	69 Å²	69	77%	0.773	36%	0.361	S	S	*	.			trans	58.7	33.3	177	-56.7	-9	0	0	0	112.1	D765	D765-H768 PolarHBondContact O-ND1 3.41Å; D765-H768 WeakPolarHBondContact OD1-CA 3.4Å; D765-H768 PolarHBondContact OD1-N 3.35Å
769	S	57.6	Low	62.9	Low	75 Å²	75	64.6 Å²	64.6	52%	0.524	35%	0.353	S	S	.	.	S	Bend	trans	-83.9	-19	179.9	61	0	0	0	0	113.2	D765 D767	D765-S769 PolarHBondContact OD1-N 3.5Å; D767-S769 PolarHBondContact O-N 3.38Å; D767-S769 WeakPolarHBondContact OD1-CB 3.25Å; D767-S769 PolarHBondContact OD1-N 2.85Å; D767-S769 PolarHBondContact OD1-OG 3.4Å
770	G	59	Low	63.2	Low	56 Å²	56	63 Å²	63	58%	0.577	34%	0.34	S	S	*	.	S	Bend	trans	92.9	17.7	177.1	0	0	0	0	0	115.4	D765	D765-G770 VanDerWaalsContact OD2-CA 3.3Å; D765-G770 WeakPolarHBondContact OD2-CA 3.33Å; D765-G770 PolarHBondContact OD2-N 2.76Å
771	G	61.9	Low	63.5	Low	8 Å²	8	61.2 Å²	61.2	8%	0.082	33%	0.327	C	S	.	.			trans	-155.8	142.8	179.9	0	0	0	0	0	114
772	L	67.2	Low	63.7	Low	2 Å²	2	63.8 Å²	63.8	1%	0.01	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.9	-179	-69.6	-180	0	0	0	112.6	F761 F764 D765 E776 F812 V813	F761-L772 HydrophobicContact CD1-CG 4.37Å; F761-L772 HydrophobicContact CD2-CD1 3.37Å; F761-L772 HydrophobicContact CD2-CG 3.69Å; F761-L772 HydrophobicContact CE1-CG 4.26Å; F761-L772 HydrophobicContact CE2-CB 4.24Å; F761-L772 HydrophobicContact CE2-CD1 3.62Å; F761-L772 HydrophobicContact CE2-CG 3.57Å; F761-L772 HydrophobicContact CG-CD1 4.02Å; F761-L772 HydrophobicContact CG-CG 4.11Å; F761-L772 HydrophobicContact CZ-CB 4.46Å; F761-L772 HydrophobicContact CZ-CD1 4.42Å; F761-L772 HydrophobicContact CZ-CG 3.88Å; F764-L772 HydrophobicContact CB-CD2 3.68Å; D765-L772 HydrophobicContact CB-CD2 4.33Å; L772-E776 HydrophobicContact CB-CB 4.49Å; L772-E776 HydrophobicContact CD2-CB 4.15Å; L772-F812 CarbonylContact O-C 3.03Å; L772-F812 VanDerWaalsContact O-CA 3.29Å; L772-F812 WeakPolarHBondContact O-CA 3.43Å; L772-V813 PolarHBondContact N-O 3.01Å; L772-V813 PolarHBondContact O-N 3.01Å
773	K	71.7	Confident	63.6	Low	65 Å²	65	63.7 Å²	63.7	28%	0.283	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	161	174.8	-59.3	168.5	-165.6	103.8	0	111	D767 E775 E776 F777 F812	D767-K773 IonicContact OD1-NZ 3.95Å; D767-K773 IonicContact OD2-NZ 3.39Å; D767-K773 PolarHBondContact OD2-NZ 3.36Å; K773-E775 VanDerWaalsContact C-N 3.33Å; K773-E775 PolarHBondContact O-N 2.81Å; K773-E776 VanDerWaalsContact CB-OE2 3.32Å; K773-E776 WeakPolarHBondContact CB-OE2 3.07Å; K773-E776 PolarHBondContact N-OE2 3.13Å; K773-E776 IonicContact NZ-OE1 3.5Å; K773-E776 WeakPolarHBondContact O-CA 3.43Å; K773-E776 WeakPolarHBondContact O-CB 3.49Å; K773-E776 PolarHBondContact O-N 3.26Å; K773-F777 PolarHBondContact O-N 2.75Å; K773-F812 HydrophobicContact CD-CE1 4.23Å; K773-F812 HydrophobicContact CG-CD1 3.92Å; K773-F812 HydrophobicContact CG-CE1 3.56Å; K773-F812 HydrophobicContact CG-CZ 4.16Å
774	A	66.7	Low	63.3	Low	38 Å²	38	61.2 Å²	61.2	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-52.7	-41.4	-174.7	0	0	0	0	0	115.1	F777 K778 M802	A774-F777 PolarHBondContact O-N 3.34Å; A774-K778 PolarHBondContact O-N 3.25Å; A774-M802 HydrophobicContact CB-CE 3.86Å
775	E	66.1	Low	63.1	Low	158 Å²	158	61.6 Å²	61.6	74%	0.738	36%	0.357	S	S	*	.	H	α-helix	trans	-65	-38.9	176.1	-66	-68.5	152	0	0	112.4	K773 K778 A779	K773-E775 VanDerWaalsContact C-N 3.33Å; K773-E775 PolarHBondContact O-N 2.81Å; E775-K778 PolarHBondContact O-N 3.06Å; E775-A779 PolarHBondContact O-N 3.05Å
776	E	68.1	Low	62.7	Low	45 Å²	45	65.3 Å²	65.3	21%	0.21	37%	0.371	C	S	.	.	H	α-helix	trans	-72.3	-35.7	179.3	-63.9	159.4	168.1	0	0	110.5	F764 L772 K773 C780	F764-E776 HydrophobicContact CB-CB 4.35Å; L772-E776 HydrophobicContact CB-CB 4.49Å; L772-E776 HydrophobicContact CD2-CB 4.15Å; K773-E776 VanDerWaalsContact CB-OE2 3.32Å; K773-E776 WeakPolarHBondContact CB-OE2 3.07Å; K773-E776 PolarHBondContact N-OE2 3.13Å; K773-E776 IonicContact NZ-OE1 3.5Å; K773-E776 WeakPolarHBondContact O-CA 3.43Å; K773-E776 WeakPolarHBondContact O-CB 3.49Å; K773-E776 PolarHBondContact O-N 3.26Å; E776-C780 PolarHBondContact O-N 2.9Å
777	F	69.1	Low	62.3	Low	4 Å²	4	64 Å²	64	2%	0.018	37%	0.372	C	S	.	.	H	α-helix	trans	-68.4	-39.6	173.3	-173.4	-113.5	0	0	0	112.8	K773 A774 C780 L781 F798 M802 V805 V813 F818	K773-F777 PolarHBondContact O-N 2.75Å; A774-F777 PolarHBondContact O-N 3.34Å; F777-C780 WeakPolarHBondContact O-CB 3.46Å; F777-C780 PolarHBondContact O-N 2.8Å; F777-C780 VanDerWaalsContact O-N 3.16Å; F777-L781 HydrophobicContact CD1-CD1 4.15Å; F777-L781 HydrophobicContact CE1-CD1 3.63Å; F777-L781 HydrophobicContact CE1-CG 4.49Å; F777-L781 HydrophobicContact CZ-CD1 3.94Å; F777-L781 HydrophobicContact CZ-CG 4.41Å; F777-L781 PolarHBondContact O-N 3.37Å; F777-L781 VanDerWaalsContact O-N 3.11Å; F777-F798 HydrophobicContact CD1-CE2 4.14Å; F777-F798 HydrophobicContact CD1-CZ 4.29Å; F777-M802 HydrophobicContact CD1-SD 3.84Å; F777-M802 HydrophobicContact CE1-SD 4.23Å; F777-V805 HydrophobicContact CE1-CG1 4.41Å; F777-V805 HydrophobicContact CZ-CG1 3.9Å; F777-V813 HydrophobicContact CB-CG2 4.41Å; F777-V813 HydrophobicContact CD1-CG2 3.98Å; F777-V813 HydrophobicContact CD2-CB 3.98Å; F777-V813 HydrophobicContact CD2-CG1 3.89Å; F777-V813 HydrophobicContact CD2-CG2 4.06Å; F777-V813 HydrophobicContact CE1-CG2 4.24Å; F777-V813 HydrophobicContact CE2-CB 4.26Å; F777-V813 HydrophobicContact CE2-CG1 3.68Å; F777-V813 HydrophobicContact CE2-CG2 4.32Å; F777-V813 HydrophobicContact CG-CB 4.25Å; F777-V813 HydrophobicContact CG-CG2 3.89Å; F777-V813 HydrophobicContact CZ-CG1 4.19Å; F777-V813 HydrophobicContact CZ-CG2 4.41Å; F777-F818 HydrophobicContact CE2-CB 4.36Å; F777-F818 AromaticContact CE2-CD2 3.41Å; F777-F818 HydrophobicContact CE2-CD2 3.41Å; F777-F818 VanDerWaalsContact CE2-CD2 3.41Å; F777-F818 AromaticContact CE2-CE2 3.98Å; F777-F818 HydrophobicContact CE2-CE2 3.98Å; F777-F818 HydrophobicContact CE2-CG 4.15Å; F777-F818 AromaticContact CZ-CD2 3.74Å; F777-F818 HydrophobicContact CZ-CD2 3.74Å; F777-F818 HydrophobicContact CZ-CE2 4.3Å
778	K	66.6	Low	62.1	Low	35 Å²	35	60.2 Å²	60.2	15%	0.152	35%	0.353	C	S	.	.	H	α-helix	trans	-60.6	-45.2	174.6	-163.4	175.6	-171.7	-174.8	0	111.7	A774 E775 C780 L781 I782 D795 F798	A774-K778 PolarHBondContact O-N 3.25Å; E775-K778 PolarHBondContact O-N 3.06Å; K778-C780 VanDerWaalsContact C-N 3.26Å; K778-C780 PolarHBondContact O-N 3.4Å; K778-L781 PolarHBondContact O-N 3.21Å; K778-I782 HydrophobicContact CG-CD1 4.29Å; K778-I782 WeakPolarHBondContact O-CG1 3.3Å; K778-I782 PolarHBondContact O-N 3.04Å; K778-D795 IonicContact NZ-OD1 3.97Å; K778-D795 PolarHBondContact NZ-OD1 3.49Å; K778-F798 HydrophobicContact CB-CD2 4.38Å; K778-F798 HydrophobicContact CB-CE1 4.12Å; K778-F798 HydrophobicContact CB-CE2 3.63Å; K778-F798 HydrophobicContact CB-CZ 3.48Å; K778-F798 VanDerWaalsContact CB-CZ 3.48Å; K778-F798 HydrophobicContact CD-CD1 4.1Å; K778-F798 HydrophobicContact CD-CD2 4.48Å; K778-F798 HydrophobicContact CD-CE1 4.04Å; K778-F798 HydrophobicContact CD-CE2 4.44Å; K778-F798 HydrophobicContact CD-CG 4.33Å; K778-F798 HydrophobicContact CD-CZ 4.22Å; K778-F798 HydrophobicContact CG-CD1 4.35Å; K778-F798 HydrophobicContact CG-CD2 3.91Å; K778-F798 HydrophobicContact CG-CE1 4.13Å; K778-F798 HydrophobicContact CG-CE2 3.68Å; K778-F798 HydrophobicContact CG-CG 4.25Å; K778-F798 HydrophobicContact CG-CZ 3.8Å
779	A	65	Low	62	Low	43 Å²	43	58.8 Å²	58.8	36%	0.355	35%	0.346	S	S	.	.	H	α-helix	trans	-60.9	-34.9	175.1	0	0	0	0	0	112.6	F764 E775 S783	F764-A779 HydrophobicContact CE1-CB 4.47Å; E775-A779 PolarHBondContact O-N 3.05Å; A779-S783 WeakPolarHBondContact O-CB 3.22Å; A779-S783 PolarHBondContact O-N 3.43Å; A779-S783 VanDerWaalsContact O-N 3.13Å
780	C	65.4	Low	61.8	Low	10 Å²	10	61.8 Å²	61.8	7%	0.068	36%	0.357	C	S	.	.	H	α-helix	trans	-68.1	-44.9	178.2	-168.8	0	0	0	0	112.9	E776 F777 K778 S783 L784	E776-C780 PolarHBondContact O-N 2.9Å; F777-C780 WeakPolarHBondContact O-CB 3.46Å; F777-C780 PolarHBondContact O-N 2.8Å; F777-C780 VanDerWaalsContact O-N 3.16Å; K778-C780 VanDerWaalsContact C-N 3.26Å; K778-C780 PolarHBondContact O-N 3.4Å; C780-S783 PolarHBondContact O-N 3.16Å; C780-L784 PolarHBondContact O-N 2.95Å
781	L	64.5	Low	61.6	Low	3 Å²	3	64.8 Å²	64.8	2%	0.016	36%	0.359	C	S	.	.	H	α-helix	trans	-63.3	-42.5	177.9	-83	165.5	0	0	0	112.9	F777 K778 S783 L784 Y786 F798 I801 F818	F777-L781 HydrophobicContact CD1-CD1 4.15Å; F777-L781 HydrophobicContact CE1-CD1 3.63Å; F777-L781 HydrophobicContact CE1-CG 4.49Å; F777-L781 HydrophobicContact CZ-CD1 3.94Å; F777-L781 HydrophobicContact CZ-CG 4.41Å; F777-L781 PolarHBondContact O-N 3.37Å; F777-L781 VanDerWaalsContact O-N 3.11Å; K778-L781 PolarHBondContact O-N 3.21Å; L781-S783 VanDerWaalsContact C-N 3.32Å; L781-S783 PolarHBondContact O-N 3.18Å; L781-L784 PolarHBondContact O-N 3.04Å; L781-L784 VanDerWaalsContact O-N 3.12Å; L781-Y786 PolarHBondContact O-N 3.4Å; L781-F798 HydrophobicContact CD1-CD2 4.28Å; L781-F798 HydrophobicContact CD1-CE2 4.05Å; L781-I801 HydrophobicContact CD1-CG2 4.16Å; L781-F818 HydrophobicContact CD2-CE2 3.82Å; L781-F818 HydrophobicContact CG-CE2 4.26Å
782	I	64.9	Low	61.3	Low	76 Å²	76	74 Å²	74	39%	0.39	40%	0.397	S	S	.	.	H	α-helix	trans	-63	-40.8	175.8	-64.8	167.2	0	0	0	110.5	K778 L784 G785 V788	K778-I782 HydrophobicContact CG-CD1 4.29Å; K778-I782 WeakPolarHBondContact O-CG1 3.3Å; K778-I782 PolarHBondContact O-N 3.04Å; I782-L784 PolarHBondContact O-N 3.27Å; I782-L784 VanDerWaalsContact O-N 3.13Å; I782-G785 PolarHBondContact O-N 3.32Å; I782-V788 HydrophobicContact CG1-CB 4.41Å
783	S	58.9	Low	60.6	Low	92 Å²	92	82.6 Å²	82.6	64%	0.643	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.8	176.6	-169.7	0	0	0	0	114.2	A779 C780 L781	A779-S783 WeakPolarHBondContact O-CB 3.22Å; A779-S783 PolarHBondContact O-N 3.43Å; A779-S783 VanDerWaalsContact O-N 3.13Å; C780-S783 PolarHBondContact O-N 3.16Å; L781-S783 VanDerWaalsContact C-N 3.32Å; L781-S783 PolarHBondContact O-N 3.18Å
784	L	56.4	Low	59.8	Low	82 Å²	82	80 Å²	80	43%	0.429	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	10.1	179.7	-71.7	165.3	0	0	0	113.2	C780 L781 I782 F818	C780-L784 PolarHBondContact O-N 2.95Å; L781-L784 PolarHBondContact O-N 3.04Å; L781-L784 VanDerWaalsContact O-N 3.12Å; I782-L784 PolarHBondContact O-N 3.27Å; I782-L784 VanDerWaalsContact O-N 3.13Å; L784-F818 HydrophobicContact CD1-CE1 4.12Å; L784-F818 HydrophobicContact CD1-CZ 3.52Å
785	G	56.2	Low	59.5	Low	62 Å²	62	81.4 Å²	81.4	64%	0.639	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	16.3	169.9	0	0	0	0	0	115.5	I782	I782-G785 PolarHBondContact O-N 3.32Å
786	Y	55.1	Low	59.3	Low	87 Å²	87	76.3 Å²	76.3	34%	0.341	42%	0.421	S	S	.	.			trans	-84.4	109.8	163.6	-93.1	-115	0	0	0	108.7	L781 V788 F821 M822	L781-Y786 PolarHBondContact O-N 3.4Å; Y786-V788 VanDerWaalsContact C-N 3.25Å; Y786-V788 PolarHBondContact O-N 3.25Å; Y786-F821 HydrophobicContact CE1-CE1 4.2Å; Y786-M822 HydrophobicContact CD2-CE 4.29Å; Y786-M822 HydrophobicContact CD2-SD 4.19Å; Y786-M822 HydrophobicContact CE2-CE 3.47Å; Y786-M822 VanDerWaalsContact CE2-CE 3.47Å; Y786-M822 HydrophobicContact CE2-SD 3.46Å; Y786-M822 WeakPolarHBondContact CE2-SD 3.37Å
787	D	52.7	Low	58.8	Low	145 Å²	145	78.1 Å²	78.1	78%	0.775	43%	0.429	S	S	*	.			trans	-72.6	76.3	-178.6	-90.8	-34.9	0	0	0	112	E789	D787-E789 PolarHBondContact O-N 2.63Å; D787-E789 VanDerWaalsContact O-N 3.1Å
788	V	54.4	Low	58.7	Low	12 Å²	12	78.6 Å²	78.6	7%	0.073	43%	0.432	C	S	.	.			trans	-79.1	76.9	160.7	-173.9	0	0	0	0	107.5	I782 Y786 G794 F798	I782-V788 HydrophobicContact CG1-CB 4.41Å; Y786-V788 VanDerWaalsContact C-N 3.25Å; Y786-V788 PolarHBondContact O-N 3.25Å; V788-G794 WeakPolarHBondContact CG1-O 3.42Å; V788-F798 HydrophobicContact CG1-CB 3.99Å
789	E	54.9	Low	58.7	Low	136 Å²	136	82.1 Å²	82.1	64%	0.636	45%	0.452	S	S	*	.			trans	-57.8	142.7	177.3	-70	-167.4	141.3	0	0	111.1	D787 D791	D787-E789 PolarHBondContact O-N 2.63Å; D787-E789 VanDerWaalsContact O-N 3.1Å; E789-D791 PolarHBondContact O-N 3.17Å
790	N	52.7	Low	58.8	Low	138 Å²	138	85.7 Å²	85.7	74%	0.738	46%	0.456	S	S	*	.	S	Bend	trans	-73.6	30.3	-175.4	-80.5	-45	0	0	0	114.5
791	D	54.8	Low	58.6	Low	119 Å²	119	85.3 Å²	85.3	64%	0.636	45%	0.454	S	S	*	.	S	Bend	trans	-104.3	162.8	172.5	-94.2	-15.1	0	0	0	111.1	E789 Q793 G794	E789-D791 PolarHBondContact O-N 3.17Å; D791-Q793 PolarHBondContact O-N 3.34Å; D791-G794 PolarHBondContact O-N 3.43Å
792	K	56.4	Low	58.6	Low	203 Å²	203	86.5 Å²	86.5	88%	0.883	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-9.1	-172.5	-72.3	-175.3	176.1	-179.3	0	116
793	Q	52.8	Low	58.5	Low	182 Å²	182	85.3 Å²	85.3	85%	0.85	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-38.2	172.2	-76.8	177.7	-85.8	0	0	112.8	D791 D795 G796 E797	D791-Q793 PolarHBondContact O-N 3.34Å; Q793-D795 PolarHBondContact O-N 3.4Å; Q793-G796 PolarHBondContact O-N 3.18Å; Q793-G796 VanDerWaalsContact O-N 3.09Å; Q793-E797 PolarHBondContact O-N 2.79Å
794	G	53.3	Low	58.7	Low	11 Å²	11	85.7 Å²	85.7	11%	0.113	46%	0.46	C	S	.	.	H	α-helix	trans	-65	-37.2	179.8	0	0	0	0	0	113	V788 D791 G796 E797 F798	V788-G794 WeakPolarHBondContact CG1-O 3.42Å; D791-G794 PolarHBondContact O-N 3.43Å; G794-G796 PolarHBondContact O-N 2.93Å; G794-E797 PolarHBondContact O-N 3.31Å; G794-E797 VanDerWaalsContact O-N 3.16Å; G794-F798 PolarHBondContact O-N 3.1Å
795	D	61.8	Low	58.8	Low	67 Å²	67	82.1 Å²	82.1	36%	0.358	44%	0.441	S	S	.	.	H	α-helix	trans	-62.8	-28	173.4	-80.4	-21.2	0	0	0	113.2	K778 Q793 N799	K778-D795 IonicContact NZ-OD1 3.97Å; K778-D795 PolarHBondContact NZ-OD1 3.49Å; Q793-D795 PolarHBondContact O-N 3.4Å; D795-N799 PolarHBondContact O-N 3.07Å; D795-N799 PolarHBondContact O-ND2 3.47Å
796	G	61.5	Low	59.3	Low	50 Å²	50	79.9 Å²	79.9	52%	0.515	42%	0.415	S	S	.	.	H	α-helix	trans	-68.8	-38.7	174.8	0	0	0	0	0	112.1	Q793 G794 R800	Q793-G796 PolarHBondContact O-N 3.18Å; Q793-G796 VanDerWaalsContact O-N 3.09Å; G794-G796 PolarHBondContact O-N 2.93Å; G796-R800 PolarHBondContact O-N 3.46Å
797	E	56.9	Low	59.4	Low	83 Å²	83	81 Å²	81	39%	0.388	43%	0.433	S	S	.	.	H	α-helix	trans	-73.4	-45.2	177.2	-177.8	146.7	-135.6	0	0	112	Q793 G794 N799 R800 I801	Q793-E797 PolarHBondContact O-N 2.79Å; G794-E797 PolarHBondContact O-N 3.31Å; G794-E797 VanDerWaalsContact O-N 3.16Å; E797-N799 VanDerWaalsContact C-N 3.26Å; E797-N799 PolarHBondContact O-N 3.09Å; E797-R800 WeakPolarHBondContact O-CA 3.22Å; E797-R800 VanDerWaalsContact O-CB 3.29Å; E797-R800 WeakPolarHBondContact O-CB 3.38Å; E797-R800 PolarHBondContact O-N 3.19Å; E797-R800 IonicContact OE1-CZ 3.29Å; E797-R800 IonicContact OE1-NH2 2.75Å; E797-R800 PolarHBondContact OE1-NH2 3.39Å; E797-I801 HydrophobicContact CG-CD1 4.06Å; E797-I801 HydrophobicContact CG-CG1 4.44Å; E797-I801 WeakPolarHBondContact O-CG1 3.28Å; E797-I801 PolarHBondContact O-N 2.99Å
798	F	66.8	Low	59.9	Low	15 Å²	15	79.7 Å²	79.7	7%	0.066	43%	0.426	C	S	.	.	H	α-helix	trans	-55.7	-39.8	176.9	179.9	-105.6	0	0	0	112.9	F777 K778 L781 V788 G794 I801 M802	F777-F798 HydrophobicContact CD1-CE2 4.14Å; F777-F798 HydrophobicContact CD1-CZ 4.29Å; K778-F798 HydrophobicContact CB-CD2 4.38Å; K778-F798 HydrophobicContact CB-CE1 4.12Å; K778-F798 HydrophobicContact CB-CE2 3.63Å; K778-F798 HydrophobicContact CB-CZ 3.48Å; K778-F798 VanDerWaalsContact CB-CZ 3.48Å; K778-F798 HydrophobicContact CD-CD1 4.1Å; K778-F798 HydrophobicContact CD-CD2 4.48Å; K778-F798 HydrophobicContact CD-CE1 4.04Å; K778-F798 HydrophobicContact CD-CE2 4.44Å; K778-F798 HydrophobicContact CD-CG 4.33Å; K778-F798 HydrophobicContact CD-CZ 4.22Å; K778-F798 HydrophobicContact CG-CD1 4.35Å; K778-F798 HydrophobicContact CG-CD2 3.91Å; K778-F798 HydrophobicContact CG-CE1 4.13Å; K778-F798 HydrophobicContact CG-CE2 3.68Å; K778-F798 HydrophobicContact CG-CG 4.25Å; K778-F798 HydrophobicContact CG-CZ 3.8Å; L781-F798 HydrophobicContact CD1-CD2 4.28Å; L781-F798 HydrophobicContact CD1-CE2 4.05Å; V788-F798 HydrophobicContact CG1-CB 3.99Å; G794-F798 PolarHBondContact O-N 3.1Å; F798-I801 PolarHBondContact O-N 2.93Å; F798-M802 PolarHBondContact O-N 3.33Å
799	N	67.8	Low	60.1	Low	109 Å²	109	84.2 Å²	84.2	58%	0.583	46%	0.458	S	S	*	.	H	α-helix	trans	-68.1	-32.7	175.5	-76.6	-61.5	0	0	0	113.1	D795 E797 G803	D795-N799 PolarHBondContact O-N 3.07Å; D795-N799 PolarHBondContact O-ND2 3.47Å; E797-N799 VanDerWaalsContact C-N 3.26Å; E797-N799 PolarHBondContact O-N 3.09Å; N799-G803 PolarHBondContact O-N 3.34Å
800	R	65.8	Low	60.3	Low	117 Å²	117	80.7 Å²	80.7	44%	0.442	45%	0.448	S	S	.	.	H	α-helix	trans	-62.8	-43.3	170.6	-178.2	-179.4	72.5	138.1	-1.9	110.8	G796 E797 G803 I804 E825	G796-R800 PolarHBondContact O-N 3.46Å; E797-R800 WeakPolarHBondContact O-CA 3.22Å; E797-R800 VanDerWaalsContact O-CB 3.29Å; E797-R800 WeakPolarHBondContact O-CB 3.38Å; E797-R800 PolarHBondContact O-N 3.19Å; E797-R800 IonicContact OE1-CZ 3.29Å; E797-R800 IonicContact OE1-NH2 2.75Å; E797-R800 PolarHBondContact OE1-NH2 3.39Å; R800-G803 PolarHBondContact O-N 3.05Å; R800-I804 WeakPolarHBondContact O-CG1 3.44Å; R800-I804 PolarHBondContact O-N 2.63Å; R800-E825 IonicContact CZ-OE1 3.82Å; R800-E825 IonicContact NH1-OE1 2.62Å; R800-E825 PolarHBondContact NH1-OE1 3.31Å; R800-E825 IonicContact NH2-OE1 3.73Å; R800-E825 PolarHBondContact NH2-OE1 2.84Å; R800-E825 IonicContact NH2-OE2 2.73Å
801	I	61.6	Low	60.7	Low	3 Å²	3	75.5 Å²	75.5	2%	0.015	43%	0.428	C	S	.	.	H	α-helix	trans	-66.6	-47.2	-179.7	-60.1	176.8	0	0	0	110.7	L781 E797 F798 G803 I804 V805 F821	L781-I801 HydrophobicContact CD1-CG2 4.16Å; E797-I801 HydrophobicContact CG-CD1 4.06Å; E797-I801 HydrophobicContact CG-CG1 4.44Å; E797-I801 WeakPolarHBondContact O-CG1 3.28Å; E797-I801 PolarHBondContact O-N 2.99Å; F798-I801 PolarHBondContact O-N 2.93Å; I801-G803 VanDerWaalsContact C-N 3.27Å; I801-G803 PolarHBondContact O-N 2.7Å; I801-I804 PolarHBondContact O-N 3.22Å; I801-V805 HydrophobicContact CG2-CG2 4.47Å; I801-V805 WeakPolarHBondContact O-CG2 3.45Å; I801-V805 PolarHBondContact O-N 3.48Å; I801-F821 HydrophobicContact CB-CE2 4.23Å; I801-F821 HydrophobicContact CB-CZ 4.13Å; I801-F821 HydrophobicContact CD1-CE1 3.9Å; I801-F821 HydrophobicContact CD1-CE2 4.42Å; I801-F821 HydrophobicContact CD1-CZ 3.55Å; I801-F821 HydrophobicContact CG1-CE1 4.08Å; I801-F821 HydrophobicContact CG1-CE2 3.76Å; I801-F821 HydrophobicContact CG1-CZ 3.4Å; I801-F821 HydrophobicContact CG2-CD1 3.98Å; I801-F821 HydrophobicContact CG2-CD2 4.15Å; I801-F821 HydrophobicContact CG2-CE1 3.76Å; I801-F821 HydrophobicContact CG2-CE2 3.94Å; I801-F821 HydrophobicContact CG2-CG 4.2Å; I801-F821 HydrophobicContact CG2-CZ 3.78Å
802	M	65.6	Low	61.2	Low	27 Å²	27	74 Å²	74	13%	0.133	42%	0.416	C	S	.	.	H	α-helix	trans	-58	-39.1	177.1	-165.1	72.2	176.1	0	0	111.8	A774 F777 F798 I804 V805 D806 V813	A774-M802 HydrophobicContact CB-CE 3.86Å; F777-M802 HydrophobicContact CD1-SD 3.84Å; F777-M802 HydrophobicContact CE1-SD 4.23Å; F798-M802 PolarHBondContact O-N 3.33Å; M802-I804 VanDerWaalsContact C-N 3.27Å; M802-I804 PolarHBondContact O-N 3.34Å; M802-V805 PolarHBondContact O-N 2.79Å; M802-D806 HydrophobicContact CE-CB 4.24Å; M802-D806 PolarHBondContact O-N 3.15Å; M802-V813 HydrophobicContact CE-CG2 3.73Å; M802-V813 HydrophobicContact SD-CG2 3.86Å
803	G	62.6	Low	61.5	Low	52 Å²	52	64.5 Å²	64.5	54%	0.536	37%	0.374	S	S	.	.	H	α-helix	trans	-67.4	-19.5	176.5	0	0	0	0	0	115.5	N799 R800 I801	N799-G803 PolarHBondContact O-N 3.34Å; R800-G803 PolarHBondContact O-N 3.05Å; I801-G803 VanDerWaalsContact C-N 3.27Å; I801-G803 PolarHBondContact O-N 2.7Å
804	I	62.9	Low	62.1	Low	100 Å²	100	60.1 Å²	60.1	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-86	-29	173.2	-64.5	165.8	0	0	0	110.8	R800 I801 M802 F821	R800-I804 WeakPolarHBondContact O-CG1 3.44Å; R800-I804 PolarHBondContact O-N 2.63Å; I801-I804 PolarHBondContact O-N 3.22Å; M802-I804 VanDerWaalsContact C-N 3.27Å; M802-I804 PolarHBondContact O-N 3.34Å; I804-F821 HydrophobicContact CD1-CD2 4.3Å; I804-F821 HydrophobicContact CD1-CE2 4.22Å; I804-F821 HydrophobicContact CG2-CD2 4.26Å
805	V	58.7	Low	62.2	Low	6 Å²	6	61 Å²	61	4%	0.036	36%	0.361	C	S	.	.	H	α-helix	trans	-101.4	-28	-169.5	177.4	0	0	0	0	113.7	F777 I801 M802 V813 A817 F821	F777-V805 HydrophobicContact CE1-CG1 4.41Å; F777-V805 HydrophobicContact CZ-CG1 3.9Å; I801-V805 HydrophobicContact CG2-CG2 4.47Å; I801-V805 WeakPolarHBondContact O-CG2 3.45Å; I801-V805 PolarHBondContact O-N 3.48Å; M802-V805 PolarHBondContact O-N 2.79Å; V805-V813 HydrophobicContact CG1-CG1 3.53Å; V805-V813 HydrophobicContact CG1-CG2 4.17Å; V805-A817 HydrophobicContact CG1-CB 3.83Å; V805-A817 VanDerWaalsContact O-CB 3.24Å; V805-A817 WeakPolarHBondContact O-CB 3.27Å; V805-F821 HydrophobicContact CG2-CB 4.08Å; V805-F821 HydrophobicContact CG2-CG 4.42Å
806	D	65.8	Low	61.9	Low	15 Å²	15	61.2 Å²	61.2	8%	0.08	36%	0.36	C	S	.	.			trans	-122.9	76.2	171.9	-177.9	16.1	0	0	0	112	M802 N808 S809 S810 G811 V813	M802-D806 HydrophobicContact CE-CB 4.24Å; M802-D806 PolarHBondContact O-N 3.15Å; D806-N808 PolarHBondContact O-N 3.29Å; D806-N808 PolarHBondContact OD1-OD1 3.43Å; D806-S809 PolarHBondContact O-N 3.49Å; D806-S809 PolarHBondContact OD1-N 3Å; D806-S810 PolarHBondContact OD1-N 2.87Å; D806-S810 PolarHBondContact OD1-OG 2.78Å; D806-S810 PolarHBondContact OD2-N 3.32Å; D806-G811 PolarHBondContact OD2-N 3.05Å; D806-V813 HydrophobicContact CB-CG2 4.49Å
807	P	58.1	Low	61.9	Low	110 Å²	110	60.2 Å²	60.2	71%	0.714	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.4	-175.7	-19.9	33.5	0	0	0	114.7
808	N	62.8	Low	61.9	Low	119 Å²	119	57.4 Å²	57.4	64%	0.636	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.1	-176.8	70	29.3	0	0	0	113.2	D806 S810	D806-N808 PolarHBondContact O-N 3.29Å; D806-N808 PolarHBondContact OD1-OD1 3.43Å; N808-S810 PolarHBondContact O-N 3.26Å; N808-S810 WeakPolarHBondContact OD1-CB 3.35Å; N808-S810 PolarHBondContact OD1-N 3.31Å; N808-S810 PolarHBondContact OD1-OG 3.31Å
809	S	58	Low	61.6	Low	107 Å²	107	59.3 Å²	59.3	75%	0.748	34%	0.344	S	S	*	.			trans	54.9	31.8	-179.7	-55.2	0	0	0	0	113.5	D806 G811	D806-S809 PolarHBondContact O-N 3.49Å; D806-S809 PolarHBondContact OD1-N 3Å; S809-G811 PolarHBondContact O-N 3.4Å
810	S	59.8	Low	61.1	Low	61 Å²	61	59.2 Å²	59.2	43%	0.427	34%	0.343	S	S	.	.			trans	-65.3	-23.4	176	59	0	0	0	0	112.6	D806 N808 F812	D806-S810 PolarHBondContact OD1-N 2.87Å; D806-S810 PolarHBondContact OD1-OG 2.78Å; D806-S810 PolarHBondContact OD2-N 3.32Å; N808-S810 PolarHBondContact O-N 3.26Å; N808-S810 WeakPolarHBondContact OD1-CB 3.35Å; N808-S810 PolarHBondContact OD1-N 3.31Å; N808-S810 PolarHBondContact OD1-OG 3.31Å; S810-F812 VanDerWaalsContact C-N 3.29Å; S810-F812 WeakPolarHBondContact O-CD2 3.27Å; S810-F812 PolarHBondContact OG-N 2.86Å; S810-F812 PolarHBondContact OG-O 2.73Å
811	G	60.7	Low	60.7	Low	30 Å²	30	55.2 Å²	55.2	31%	0.309	33%	0.329	S	S	.	.	S	Bend	trans	83.7	5.1	-176.5	0	0	0	0	0	113.6	D806 S809	D806-G811 PolarHBondContact OD2-N 3.05Å; S809-G811 PolarHBondContact O-N 3.4Å
812	F	64.9	Low	60.4	Low	88 Å²	88	59.6 Å²	59.6	39%	0.386	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	114.1	-179.3	-66.9	-94.7	0	0	0	111	L772 K773 S810 T814	L772-F812 CarbonylContact O-C 3.03Å; L772-F812 VanDerWaalsContact O-CA 3.29Å; L772-F812 WeakPolarHBondContact O-CA 3.43Å; K773-F812 HydrophobicContact CD-CE1 4.23Å; K773-F812 HydrophobicContact CG-CD1 3.92Å; K773-F812 HydrophobicContact CG-CE1 3.56Å; K773-F812 HydrophobicContact CG-CZ 4.16Å; S810-F812 VanDerWaalsContact C-N 3.29Å; S810-F812 WeakPolarHBondContact O-CD2 3.27Å; S810-F812 PolarHBondContact OG-N 2.86Å; S810-F812 PolarHBondContact OG-O 2.73Å; F812-T814 PolarHBondContact O-N 2.82Å
813	V	63.8	Low	59.8	Low	2 Å²	2	62.4 Å²	62.4	1%	0.012	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	118.2	176.2	176.4	0	0	0	0	109.8	L772 F777 M802 V805 D806	L772-V813 PolarHBondContact N-O 3.01Å; L772-V813 PolarHBondContact O-N 3.01Å; F777-V813 HydrophobicContact CB-CG2 4.41Å; F777-V813 HydrophobicContact CD1-CG2 3.98Å; F777-V813 HydrophobicContact CD2-CB 3.98Å; F777-V813 HydrophobicContact CD2-CG1 3.89Å; F777-V813 HydrophobicContact CD2-CG2 4.06Å; F777-V813 HydrophobicContact CE1-CG2 4.24Å; F777-V813 HydrophobicContact CE2-CB 4.26Å; F777-V813 HydrophobicContact CE2-CG1 3.68Å; F777-V813 HydrophobicContact CE2-CG2 4.32Å; F777-V813 HydrophobicContact CG-CB 4.25Å; F777-V813 HydrophobicContact CG-CG2 3.89Å; F777-V813 HydrophobicContact CZ-CG1 4.19Å; F777-V813 HydrophobicContact CZ-CG2 4.41Å; M802-V813 HydrophobicContact CE-CG2 3.73Å; M802-V813 HydrophobicContact SD-CG2 3.86Å; V805-V813 HydrophobicContact CG1-CG1 3.53Å; V805-V813 HydrophobicContact CG1-CG2 4.17Å; D806-V813 HydrophobicContact CB-CG2 4.49Å
814	T	64.6	Low	59.2	Low	90 Å²	90	70.8 Å²	70.8	55%	0.552	39%	0.389	S	S	*	.			trans	-77.7	145.7	171	71.5	0	0	0	0	110.8	F812 Q816 A817	F812-T814 PolarHBondContact O-N 2.82Å; T814-Q816 PolarHBondContact O-N 3.47Å; T814-A817 PolarHBondContact O-N 2.96Å
815	F	56.4	Low	58.4	Low	31 Å²	31	72.4 Å²	72.4	14%	0.136	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-24.2	-174.6	-174.1	-110.5	0	0	0	115.8	L754 Y757 R758 F761	L754-F815 HydrophobicContact CD1-CE1 3.74Å; L754-F815 HydrophobicContact CD1-CZ 4.11Å; Y757-F815 VanDerWaalsContact C-CE2 3.49Å; R758-F815 HydrophobicContact CB-CE2 4.19Å; R758-F815 HydrophobicContact CB-CZ 4.05Å; F761-F815 HydrophobicContact CB-CD2 4.1Å; F761-F815 HydrophobicContact CB-CE2 4.3Å; F761-F815 HydrophobicContact CD2-CB 4.28Å; F761-F815 AromaticContact CD2-CD2 3.64Å; F761-F815 HydrophobicContact CD2-CD2 3.64Å; F761-F815 HydrophobicContact CD2-CG 4.46Å; F761-F815 HydrophobicContact CE2-CB 3.96Å; F761-F815 HydrophobicContact CE2-CD2 4.17Å; F761-F815 AromaticContact CG-CD2 3.92Å; F761-F815 HydrophobicContact CG-CD2 3.92Å; F761-F815 HydrophobicContact CZ-CB 4.17Å
816	Q	55.7	Low	57.5	Low	70 Å²	70	78.5 Å²	78.5	33%	0.327	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-40.6	-176.3	-176.9	56.6	44	0	0	114	T814 F818 I819	T814-Q816 PolarHBondContact O-N 3.47Å; Q816-F818 PolarHBondContact O-N 3.13Å; Q816-I819 PolarHBondContact O-N 2.77Å
817	A	59.6	Low	56.1	Low	30 Å²	30	84 Å²	84	25%	0.248	47%	0.466	C	S	.	.	H	α-helix	trans	-70	-21.2	-171.2	0	0	0	0	0	112.9	V805 T814 I819	V805-A817 HydrophobicContact CG1-CB 3.83Å; V805-A817 VanDerWaalsContact O-CB 3.24Å; V805-A817 WeakPolarHBondContact O-CB 3.27Å; T814-A817 PolarHBondContact O-N 2.96Å; A817-I819 VanDerWaalsContact C-N 3.34Å; A817-I819 PolarHBondContact O-N 3.16Å
818	F	58.5	Low	55	Low	23 Å²	23	86.6 Å²	86.6	10%	0.101	47%	0.474	C	S	.	.	H	α-helix	trans	-61.7	-34.4	178.8	176.9	-124.2	0	0	0	114.3	Y757 F777 L781 L784 Q816	Y757-F818 HydrophobicContact CD1-CE1 4.33Å; F777-F818 HydrophobicContact CE2-CB 4.36Å; F777-F818 AromaticContact CE2-CD2 3.41Å; F777-F818 HydrophobicContact CE2-CD2 3.41Å; F777-F818 VanDerWaalsContact CE2-CD2 3.41Å; F777-F818 AromaticContact CE2-CE2 3.98Å; F777-F818 HydrophobicContact CE2-CE2 3.98Å; F777-F818 HydrophobicContact CE2-CG 4.15Å; F777-F818 AromaticContact CZ-CD2 3.74Å; F777-F818 HydrophobicContact CZ-CD2 3.74Å; F777-F818 HydrophobicContact CZ-CE2 4.3Å; L781-F818 HydrophobicContact CD2-CE2 3.82Å; L781-F818 HydrophobicContact CG-CE2 4.26Å; L784-F818 HydrophobicContact CD1-CE1 4.12Å; L784-F818 HydrophobicContact CD1-CZ 3.52Å; Q816-F818 PolarHBondContact O-N 3.13Å
819	I	60.2	Low	53.4	Low	55 Å²	55	88.4 Å²	88.4	28%	0.282	49%	0.489	S	S	.	.	H	α-helix	trans	-77.2	-35.8	-170.7	-64.6	-63.8	0	0	0	112.7	Y757 Q816 A817 F821	Y757-I819 HydrophobicContact CD2-CD1 3.9Å; Y757-I819 HydrophobicContact CE2-CD1 3.74Å; Y757-I819 HydrophobicContact CG-CD1 4.44Å; Q816-I819 PolarHBondContact O-N 2.77Å; A817-I819 VanDerWaalsContact C-N 3.34Å; A817-I819 PolarHBondContact O-N 3.16Å; I819-F821 VanDerWaalsContact C-N 3.27Å; I819-F821 PolarHBondContact O-N 3.34Å
820	D	57.6	Low	52.4	Low	108 Å²	108	90.4 Å²	90.4	58%	0.578	49%	0.491	S	S	*	.	H	α-helix	trans	-72.8	-21.1	-170.6	-64.9	-30.4	0	0	0	113.2	M822 S823	D820-M822 PolarHBondContact O-N 3.49Å; D820-S823 PolarHBondContact O-OG 3.46Å; D820-S823 VanDerWaalsContact O-OG 3.08Å
821	F	57.6	Low	51.5	Low	33 Å²	33	92.6 Å²	92.6	15%	0.145	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-34.2	-173.8	168.2	-105.3	0	0	0	114.4	Y786 I801 I804 V805 I819 S823	Y786-F821 HydrophobicContact CE1-CE1 4.2Å; I801-F821 HydrophobicContact CB-CE2 4.23Å; I801-F821 HydrophobicContact CB-CZ 4.13Å; I801-F821 HydrophobicContact CD1-CE1 3.9Å; I801-F821 HydrophobicContact CD1-CE2 4.42Å; I801-F821 HydrophobicContact CD1-CZ 3.55Å; I801-F821 HydrophobicContact CG1-CE1 4.08Å; I801-F821 HydrophobicContact CG1-CE2 3.76Å; I801-F821 HydrophobicContact CG1-CZ 3.4Å; I801-F821 HydrophobicContact CG2-CD1 3.98Å; I801-F821 HydrophobicContact CG2-CD2 4.15Å; I801-F821 HydrophobicContact CG2-CE1 3.76Å; I801-F821 HydrophobicContact CG2-CE2 3.94Å; I801-F821 HydrophobicContact CG2-CG 4.2Å; I801-F821 HydrophobicContact CG2-CZ 3.78Å; I804-F821 HydrophobicContact CD1-CD2 4.3Å; I804-F821 HydrophobicContact CD1-CE2 4.22Å; I804-F821 HydrophobicContact CG2-CD2 4.26Å; V805-F821 HydrophobicContact CG2-CB 4.08Å; V805-F821 HydrophobicContact CG2-CG 4.42Å; I819-F821 VanDerWaalsContact C-N 3.27Å; I819-F821 PolarHBondContact O-N 3.34Å; F821-S823 PolarHBondContact O-N 2.96Å
822	M	55.3	Low	50.7	Low	95 Å²	95	92 Å²	92	47%	0.468	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	13.8	-163.1	-67.6	-81	-71.6	0	0	117.1	Y786 D820	Y786-M822 HydrophobicContact CD2-CE 4.29Å; Y786-M822 HydrophobicContact CD2-SD 4.19Å; Y786-M822 HydrophobicContact CE2-CE 3.47Å; Y786-M822 VanDerWaalsContact CE2-CE 3.47Å; Y786-M822 HydrophobicContact CE2-SD 3.46Å; Y786-M822 WeakPolarHBondContact CE2-SD 3.37Å; D820-M822 PolarHBondContact O-N 3.49Å
823	S	51.9	Low	50.4	Low	86 Å²	86	93.5 Å²	93.5	60%	0.601	51%	0.506	S	S	*	.	S	Bend	trans	-125.7	9.5	-150.1	62.6	0	0	0	0	119	D820 F821	D820-S823 PolarHBondContact O-OG 3.46Å; D820-S823 VanDerWaalsContact O-OG 3.08Å; F821-S823 PolarHBondContact O-N 2.96Å
824	R	51.1	Low	50.1	Low	228 Å²	228	100.9 Å²	100.9	86%	0.86	54%	0.541	S	S	*	.			trans	-135.6	3.7	-154.4	-76.9	-175.1	177.5	-175	0.2	124.1
825	E	44.7	Very low	49.8	Very low	134 Å²	134	97.7 Å²	97.7	63%	0.626	52%	0.521	S	S	*	.			trans	-113.2	134.3	-169.2	-64.8	-172.3	132.1	0	0	117.7	R800	R800-E825 IonicContact CZ-OE1 3.82Å; R800-E825 IonicContact NH1-OE1 2.62Å; R800-E825 PolarHBondContact NH1-OE1 3.31Å; R800-E825 IonicContact NH2-OE1 3.73Å; R800-E825 PolarHBondContact NH2-OE1 2.84Å; R800-E825 IonicContact NH2-OE2 2.73Å
826	T	39.8	Very low	50.4	Low	134 Å²	134	98.6 Å²	98.6	82%	0.822	53%	0.527	S	S	*	.			trans	-155.3	-76.5	179.2	-14.7	0	0	0	0	126.4
827	T	36.3	Very low	50.8	Low	131 Å²	131	98.5 Å²	98.5	80%	0.804	54%	0.538	S	S	*	.			trans	-141.2	161.4	-145.1	26.5	0	0	0	0	122.6
828	D	35.3	Very low	51	Low	164 Å²	164	97.4 Å²	97.4	88%	0.877	53%	0.528	S	S	*	.			trans	-151.5	176.1	-165.6	-81.8	-40.8	0	0	0	120.8
829	T	29.6	Very low	51.5	Low	157 Å²	157	96.5 Å²	96.5	96%	0.963	52%	0.524	S	S	*	.			trans	-168	-168.3	169	-4.1	0	0	0	0	122.3
830	D	36	Very low	52.2	Low	149 Å²	149	98 Å²	98	80%	0.797	53%	0.529	S	S	*	.			trans	-110.4	0	-137.3	-140.6	-50.7	0	0	0	125.9
831	T	42.8	Very low	52.8	Low	107 Å²	107	96.7 Å²	96.7	66%	0.656	52%	0.521	S	S	*	.				0	-134.5	0	76.2	0	0	0	0	126.1
832	A	43.3	Very low	53.2	Low	16 Å²	16	95.8 Å²	95.8	13%	0.132	52%	0.518	C	S	.	.			trans	-120.8	-40.7	-134.6	0	0	0	0	0	125	N355 Q834 Y893	N355-A832 HydrophobicContact CB-CB 4.4Å; A832-Q834 PolarHBondContact O-N 3.03Å; A832-Y893 HydrophobicContact CB-CD1 3.86Å; A832-Y893 HydrophobicContact CB-CE1 4.45Å
833	D	57.7	Low	53.8	Low	121 Å²	121	91.3 Å²	91.3	65%	0.647	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-50.1	-19.3	-167.7	-90.5	-69.3	0	0	0	117.6	V835	D833-V835 PolarHBondContact O-N 3.4Å
834	Q	59	Low	54.3	Low	156 Å²	156	89.9 Å²	89.9	73%	0.729	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-64.7	-12.6	-165.5	-55.7	-178.4	8.1	0	0	114.2	A832	A832-Q834 PolarHBondContact O-N 3.03Å
835	V	57.8	Low	54.9	Low	23 Å²	23	85 Å²	85	14%	0.139	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-90.9	-39.2	-175.8	179.2	0	0	0	0	113.9	V271 D833 A837 S838 Y893	V271-V835 HydrophobicContact CG1-CG1 4.2Å; V271-V835 HydrophobicContact CG2-CG1 4.07Å; D833-V835 PolarHBondContact O-N 3.4Å; V835-A837 PolarHBondContact O-N 2.59Å; V835-S838 WeakPolarHBondContact O-CB 3.39Å; V835-S838 PolarHBondContact O-N 2.99Å; V835-Y893 HydrophobicContact CB-CD2 4.39Å; V835-Y893 HydrophobicContact CB-CE2 3.75Å; V835-Y893 HydrophobicContact CG1-CE2 3.86Å; V835-Y893 HydrophobicContact CG2-CE1 4.43Å; V835-Y893 HydrophobicContact CG2-CE2 3.75Å; V835-Y893 WeakPolarHBondContact CG2-OH 2.76Å
836	I	68.8	Low	56.3	Low	51 Å²	51	82.5 Å²	82.5	26%	0.262	47%	0.473	S	S	.	.	H	α-helix	trans	-58.8	-39.4	-177.8	-62.4	173.4	0	0	0	110.9	S838 F839	I836-S838 PolarHBondContact O-N 2.91Å; I836-S838 VanDerWaalsContact O-N 3.09Å; I836-F839 PolarHBondContact O-N 2.88Å
837	A	63.5	Low	57.9	Low	67 Å²	67	79.8 Å²	79.8	55%	0.554	45%	0.453	S	S	*	.	H	α-helix	trans	-58.6	-21.5	176.8	0	0	0	0	0	114.1	V835	V835-A837 PolarHBondContact O-N 2.59Å
838	S	64.1	Low	59.8	Low	7 Å²	7	74.7 Å²	74.7	5%	0.049	42%	0.42	C	S	.	.	H	α-helix	trans	-81.6	-29.3	-178.3	-60.9	0	0	0	0	113.4	R267 V835 I836	R267-S838 VanDerWaalsContact CD-OG 3.32Å; R267-S838 WeakPolarHBondContact CD-OG 3.34Å; V835-S838 WeakPolarHBondContact O-CB 3.39Å; V835-S838 PolarHBondContact O-N 2.99Å; I836-S838 PolarHBondContact O-N 2.91Å; I836-S838 VanDerWaalsContact O-N 3.09Å
839	F	69.9	Low	61.8	Low	4 Å²	4	67.1 Å²	67.1	2%	0.018	38%	0.379	C	S	.	.	H	α-helix	trans	-74.7	-37.8	179.1	-85.8	-85.9	0	0	0	113.6	I268 I836 I841 L842 M870 Y885 F888 S889	I268-F839 HydrophobicContact CB-CE1 4.2Å; I268-F839 HydrophobicContact CB-CZ 4.19Å; I268-F839 HydrophobicContact CD1-CD1 3.54Å; I268-F839 HydrophobicContact CD1-CE1 3.8Å; I268-F839 HydrophobicContact CD1-CG 3.96Å; I268-F839 HydrophobicContact CD1-CZ 4.42Å; I268-F839 HydrophobicContact CG1-CD1 3.79Å; I268-F839 HydrophobicContact CG1-CD2 4.09Å; I268-F839 HydrophobicContact CG1-CE1 3.7Å; I268-F839 HydrophobicContact CG1-CE2 4.01Å; I268-F839 HydrophobicContact CG1-CG 3.98Å; I268-F839 HydrophobicContact CG1-CZ 3.82Å; I268-F839 HydrophobicContact CG2-CD1 4.36Å; I268-F839 HydrophobicContact CG2-CE1 3.49Å; I268-F839 VanDerWaalsContact CG2-CE1 3.49Å; I268-F839 HydrophobicContact CG2-CZ 3.59Å; I836-F839 PolarHBondContact O-N 2.88Å; F839-I841 PolarHBondContact O-N 3.08Å; F839-I841 VanDerWaalsContact O-N 3.11Å; F839-L842 PolarHBondContact O-N 3.17Å; F839-M870 HydrophobicContact CD1-CE 4.38Å; F839-M870 HydrophobicContact CE1-CE 3.85Å; F839-Y885 HydrophobicContact CB-CD2 3.37Å; F839-Y885 HydrophobicContact CB-CE2 3.94Å; F839-Y885 HydrophobicContact CB-CG 3.93Å; F839-Y885 HydrophobicContact CG-CD2 4.25Å; F839-F888 HydrophobicContact CE1-CD1 4.43Å; F839-F888 HydrophobicContact CE1-CE1 4.5Å; F839-F888 HydrophobicContact CE2-CD1 4.39Å; F839-F888 HydrophobicContact CE2-CE1 4.44Å; F839-F888 AromaticContact CZ-CD1 3.94Å; F839-F888 HydrophobicContact CZ-CD1 3.94Å; F839-F888 AromaticContact CZ-CE1 3.8Å; F839-F888 HydrophobicContact CZ-CE1 3.8Å; F839-S889 WeakPolarHBondContact CD2-OG 3.09Å
840	K	74.6	Confident	64.2	Low	88 Å²	88	60.9 Å²	60.9	38%	0.383	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.8	-179.4	-175.1	169.3	-179.6	174.5	0	113.7	D845 Y885	K840-D845 WeakPolarHBondContact CE-OD1 3.43Å; K840-D845 PolarHBondContact O-N 3.28Å; K840-Y885 HydrophobicContact CB-CE2 4.27Å
841	I	69.6	Low	65.9	Low	80 Å²	80	54.6 Å²	54.6	41%	0.41	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-32.4	179.2	-60	170.5	0	0	0	111.6	A264 F839	A264-I841 HydrophobicContact CB-CB 3.66Å; A264-I841 HydrophobicContact CB-CD1 4.34Å; A264-I841 HydrophobicContact CB-CG2 3.57Å; F839-I841 PolarHBondContact O-N 3.08Å; F839-I841 VanDerWaalsContact O-N 3.11Å
842	L	66	Low	67.4	Low	14 Å²	14	55.1 Å²	55.1	7%	0.073	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-36.1	178.3	-105	70.6	0	0	0	113.4	A264 A265 I268 F839 G844 I849 E857 L858	A264-L842 HydrophobicContact CB-CD1 3.38Å; A265-L842 HydrophobicContact CB-CD1 4.18Å; A265-L842 HydrophobicContact CB-CD2 4.38Å; A265-L842 VanDerWaalsContact N-CD1 3.3Å; I268-L842 HydrophobicContact CD1-CB 4.28Å; I268-L842 HydrophobicContact CD1-CD1 3.64Å; I268-L842 HydrophobicContact CD1-CD2 3.61Å; I268-L842 HydrophobicContact CD1-CG 4.03Å; F839-L842 PolarHBondContact O-N 3.17Å; L842-G844 PolarHBondContact O-N 2.94Å; L842-G844 VanDerWaalsContact O-N 3.14Å; L842-I849 HydrophobicContact CB-CD1 3.95Å; L842-E857 HydrophobicContact CD2-CB 3.95Å; L842-E857 HydrophobicContact CG-CB 4.32Å; L842-L858 HydrophobicContact CD2-CD2 3.92Å; L842-L858 HydrophobicContact CD2-CG 4.09Å
843	A	68.7	Low	68.7	Low	1 Å²	1	55.7 Å²	55.7	1%	0.008	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-2.5	-178.4	0	0	0	0	0	113.3	K846 I849 Y885	A843-K846 HydrophobicContact CB-CB 4.28Å; A843-K846 WeakPolarHBondContact CB-O 3.42Å; A843-K846 WeakPolarHBondContact O-CB 3.21Å; A843-K846 WeakPolarHBondContact O-CD 3.34Å; A843-K846 WeakPolarHBondContact O-CG 3.29Å; A843-K846 PolarHBondContact O-N 2.83Å; A843-I849 HydrophobicContact CB-CB 4.35Å; A843-Y885 HydrophobicContact CB-CD1 4.45Å; A843-Y885 HydrophobicContact CB-CE1 3.78Å
844	G	61.7	Low	69.3	Low	56 Å²	56	50 Å²	50	58%	0.577	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	45.8	-174.2	0	0	0	0	0	111.8	L842 K846	L842-G844 PolarHBondContact O-N 2.94Å; L842-G844 VanDerWaalsContact O-N 3.14Å; G844-K846 PolarHBondContact O-N 3.32Å; G844-K846 VanDerWaalsContact O-N 3.11Å
845	D	64.4	Low	70.1	Confident	124 Å²	124	48 Å²	48	66%	0.663	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	6.5	-174.2	-74.3	-55.2	0	0	0	116.3	K840	K840-D845 WeakPolarHBondContact CE-OD1 3.43Å; K840-D845 PolarHBondContact O-N 3.28Å
846	K	73.9	Confident	70.8	Confident	83 Å²	83	55.2 Å²	55.2	36%	0.361	29%	0.288	S	S	.	.			trans	-72.3	148.9	167.9	-54.9	170.9	-159.5	168.2	0	110.5	A843 G844 F848 E853 Y885	A843-K846 HydrophobicContact CB-CB 4.28Å; A843-K846 WeakPolarHBondContact CB-O 3.42Å; A843-K846 WeakPolarHBondContact O-CB 3.21Å; A843-K846 WeakPolarHBondContact O-CD 3.34Å; A843-K846 WeakPolarHBondContact O-CG 3.29Å; A843-K846 PolarHBondContact O-N 2.83Å; G844-K846 PolarHBondContact O-N 3.32Å; G844-K846 VanDerWaalsContact O-N 3.11Å; K846-F848 WeakPolarHBondContact CB-O 3.38Å; K846-F848 HydrophobicContact CD-CE2 4.17Å; K846-F848 HydrophobicContact CD-CZ 4.16Å; K846-F848 PolarHBondContact O-N 3.35Å; K846-E853 IonicContact NZ-OE1 3.35Å; K846-E853 PolarHBondContact NZ-OE1 2.88Å; K846-E853 IonicContact NZ-OE2 2.68Å; K846-Y885 PolarHBondContact O-OH 2.73Å
847	N	72.9	Confident	70.8	Confident	76 Å²	76	55.3 Å²	55.3	41%	0.406	29%	0.288	S	S	.	.	S	Bend	trans	-80.6	6.8	174.4	-62	-35.2	0	0	0	113.8	M886	N847-M886 HydrophobicContact CB-CE 4.33Å
848	F	75.7	Confident	71	Confident	25 Å²	25	52.6 Å²	52.6	11%	0.11	26%	0.264	C	S	.	.			trans	-142.1	153.9	177.4	65.7	-97.1	0	0	0	109.5	K846 T850 Y873 D877 V879 A882 L883	K846-F848 WeakPolarHBondContact CB-O 3.38Å; K846-F848 HydrophobicContact CD-CE2 4.17Å; K846-F848 HydrophobicContact CD-CZ 4.16Å; K846-F848 PolarHBondContact O-N 3.35Å; F848-T850 HydrophobicContact CE2-CG2 4.37Å; F848-Y873 HydrophobicContact CB-CD1 3.84Å; F848-Y873 HydrophobicContact CB-CD2 3.92Å; F848-Y873 HydrophobicContact CB-CE1 4.26Å; F848-Y873 HydrophobicContact CB-CE2 4.35Å; F848-Y873 HydrophobicContact CB-CG 3.65Å; F848-Y873 HydrophobicContact CD1-CD1 4.13Å; F848-Y873 AromaticContact CD1-CE1 3.98Å; F848-Y873 HydrophobicContact CD1-CE1 3.98Å; F848-Y873 HydrophobicContact CG-CD1 4.21Å; F848-Y873 HydrophobicContact CG-CE1 4.48Å; F848-Y873 HydrophobicContact CG-CG 4.5Å; F848-D877 HydrophobicContact CE1-CB 4.33Å; F848-V879 HydrophobicContact CD2-CG2 4.45Å; F848-V879 HydrophobicContact CE2-CG2 3.55Å; F848-V879 HydrophobicContact CZ-CG2 3.9Å; F848-A882 HydrophobicContact CB-CB 4.17Å; F848-A882 HydrophobicContact CD2-CB 3.65Å; F848-A882 HydrophobicContact CE2-CB 4.31Å; F848-A882 HydrophobicContact CG-CB 4.05Å; F848-L883 WeakPolarHBondContact CA-O 3.42Å
849	I	77.7	Confident	71.3	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	141.4	175.2	-164.3	163.4	0	0	0	110	L842 A843 E853 L854 M870 L883 Y885	L842-I849 HydrophobicContact CB-CD1 3.95Å; A843-I849 HydrophobicContact CB-CB 4.35Å; I849-E853 HydrophobicContact CG1-CB 3.98Å; I849-L854 HydrophobicContact CD1-CD2 3.69Å; I849-L854 HydrophobicContact CD1-CG 4.03Å; I849-L854 HydrophobicContact CG1-CD2 4.29Å; I849-L854 HydrophobicContact CG1-CG 4.09Å; I849-L854 HydrophobicContact CG2-CD1 4.12Å; I849-L854 HydrophobicContact CG2-CD2 4.22Å; I849-L854 HydrophobicContact CG2-CG 4.11Å; I849-M870 HydrophobicContact CG2-SD 4.39Å; I849-L883 HydrophobicContact CG2-CB 4.3Å; I849-L883 PolarHBondContact N-O 3.15Å; I849-L883 WeakPolarHBondContact O-CB 3.43Å; I849-L883 PolarHBondContact O-N 2.76Å; I849-Y885 HydrophobicContact CB-CD1 4.47Å; I849-Y885 HydrophobicContact CG2-CD1 4.39Å
850	T	79.1	Confident	71.2	Confident	26 Å²	26	59.1 Å²	59.1	16%	0.16	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	155.2	178.6	60.9	0	0	0	0	112.2	F848 D852 E853 L854 V879 G881	F848-T850 HydrophobicContact CE2-CG2 4.37Å; T850-D852 PolarHBondContact O-N 2.92Å; T850-E853 WeakPolarHBondContact CB-OE2 3.49Å; T850-E853 PolarHBondContact N-OE2 3.41Å; T850-E853 PolarHBondContact O-N 3.08Å; T850-E853 VanDerWaalsContact O-N 3.09Å; T850-E853 WeakPolarHBondContact OG1-CB 3.29Å; T850-E853 WeakPolarHBondContact OG1-CG 3.49Å; T850-E853 PolarHBondContact OG1-N 2.83Å; T850-E853 PolarHBondContact OG1-OE2 3.48Å; T850-L854 PolarHBondContact O-N 2.91Å; T850-V879 HydrophobicContact CG2-CG2 4.26Å; T850-G881 WeakPolarHBondContact CA-O 3.36Å
851	A	73.6	Confident	70.8	Confident	18 Å²	18	60.1 Å²	60.1	15%	0.149	32%	0.316	C	S	.	.	H	α-helix	trans	-57	-34.3	176.7	0	0	0	0	0	113.1	R855 I867 G881	A851-R855 WeakPolarHBondContact O-CB 3.42Å; A851-R855 VanDerWaalsContact O-CG 3.31Å; A851-R855 WeakPolarHBondContact O-CG 3.27Å; A851-R855 PolarHBondContact O-N 3.39Å; A851-I867 HydrophobicContact CB-CD1 3.87Å; A851-I867 HydrophobicContact CB-CG1 4.06Å; A851-G881 PolarHBondContact N-O 3.08Å
852	D	72.6	Confident	70.7	Confident	118 Å²	118	57.4 Å²	57.4	63%	0.631	30%	0.302	S	S	*	.	H	α-helix	trans	-77.9	-27.1	178.1	-62.4	-29.3	0	0	0	112.7	T850 R855 R856	T850-D852 PolarHBondContact O-N 2.92Å; D852-R855 IonicContact OD1-NH1 3.66Å; D852-R856 WeakPolarHBondContact O-CB 3.36Å; D852-R856 PolarHBondContact O-N 2.7Å
853	E	70.7	Confident	70.9	Confident	28 Å²	28	56.8 Å²	56.8	13%	0.131	30%	0.298	C	S	.	.	H	α-helix	trans	-69.9	-44	168.7	-74.8	162.3	149	0	0	110.8	K846 I849 T850 R855 R856 E857	K846-E853 IonicContact NZ-OE1 3.35Å; K846-E853 PolarHBondContact NZ-OE1 2.88Å; K846-E853 IonicContact NZ-OE2 2.68Å; I849-E853 HydrophobicContact CG1-CB 3.98Å; T850-E853 WeakPolarHBondContact CB-OE2 3.49Å; T850-E853 PolarHBondContact N-OE2 3.41Å; T850-E853 PolarHBondContact O-N 3.08Å; T850-E853 VanDerWaalsContact O-N 3.09Å; T850-E853 WeakPolarHBondContact OG1-CB 3.29Å; T850-E853 WeakPolarHBondContact OG1-CG 3.49Å; T850-E853 PolarHBondContact OG1-N 2.83Å; T850-E853 PolarHBondContact OG1-OE2 3.48Å; E853-R855 PolarHBondContact O-N 2.69Å; E853-R856 PolarHBondContact O-N 3.46Å; E853-E857 WeakPolarHBondContact O-CG 3.43Å; E853-E857 PolarHBondContact O-N 3.4Å
854	L	71	Confident	71.3	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-46.8	174.5	-74.2	170	0	0	0	112	I849 T850 R856 E857 L858 A863 C866 I867 M870 L883	I849-L854 HydrophobicContact CD1-CD2 3.69Å; I849-L854 HydrophobicContact CD1-CG 4.03Å; I849-L854 HydrophobicContact CG1-CD2 4.29Å; I849-L854 HydrophobicContact CG1-CG 4.09Å; I849-L854 HydrophobicContact CG2-CD1 4.12Å; I849-L854 HydrophobicContact CG2-CD2 4.22Å; I849-L854 HydrophobicContact CG2-CG 4.11Å; T850-L854 PolarHBondContact O-N 2.91Å; L854-R856 PolarHBondContact O-N 3.17Å; L854-E857 PolarHBondContact O-N 3.3Å; L854-L858 HydrophobicContact CD2-CD1 3.68Å; L854-L858 WeakPolarHBondContact O-CB 2.94Å; L854-L858 PolarHBondContact O-N 3.05Å; L854-A863 HydrophobicContact CB-CB 4.4Å; L854-C866 HydrophobicContact CD1-CB 4.02Å; L854-C866 HydrophobicContact CD2-CB 4.32Å; L854-I867 HydrophobicContact CB-CD1 4.48Å; L854-I867 HydrophobicContact CB-CG1 4.5Å; L854-I867 HydrophobicContact CD1-CG1 3.82Å; L854-M870 HydrophobicContact CD1-SD 4.16Å; L854-L883 HydrophobicContact CD1-CD1 3.67Å
855	R	76.1	Confident	71.8	Confident	114 Å²	114	59.3 Å²	59.3	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-65.7	-18.3	177.3	-74.9	173.5	177.8	130.5	6.9	114.5	A851 D852 E853 A863 E864 I867	A851-R855 WeakPolarHBondContact O-CB 3.42Å; A851-R855 VanDerWaalsContact O-CG 3.31Å; A851-R855 WeakPolarHBondContact O-CG 3.27Å; A851-R855 PolarHBondContact O-N 3.39Å; D852-R855 IonicContact OD1-NH1 3.66Å; E853-R855 PolarHBondContact O-N 2.69Å; R855-A863 HydrophobicContact CG-CB 4.12Å; R855-E864 IonicContact CZ-OE1 2.73Å; R855-E864 IonicContact NE-OE1 2.7Å; R855-E864 PolarHBondContact NE-OE1 2.7Å; R855-E864 IonicContact NH2-OE1 2.66Å; R855-E864 PolarHBondContact NH2-OE1 2.81Å; R855-E864 IonicContact NH2-OE2 2.76Å; R855-E864 PolarHBondContact NH2-OE2 2.72Å; R855-E864 VanDerWaalsContact NH2-OE2 3.11Å; R855-I867 HydrophobicContact CG-CD1 4.02Å
856	R	71.6	Confident	72	Confident	174 Å²	174	53.4 Å²	53.4	66%	0.657	26%	0.263	S	S	*	.	H	α-helix	trans	-90.5	-37.3	178.6	-167.3	-176.1	74	-144.5	-3.8	112.4	D852 E853 L854	D852-R856 WeakPolarHBondContact O-CB 3.36Å; D852-R856 PolarHBondContact O-N 2.7Å; E853-R856 PolarHBondContact O-N 3.46Å; L854-R856 PolarHBondContact O-N 3.17Å
857	E	68.8	Low	72.1	Confident	54 Å²	54	51.3 Å²	51.3	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-100	-19.9	-172.9	-53.9	-59.9	149.9	0	0	114.1	A265 L842 E853 L854	A265-E857 WeakPolarHBondContact CB-O 3.43Å; L842-E857 HydrophobicContact CD2-CB 3.95Å; L842-E857 HydrophobicContact CG-CB 4.32Å; E853-E857 WeakPolarHBondContact O-CG 3.43Å; E853-E857 PolarHBondContact O-N 3.4Å; L854-E857 PolarHBondContact O-N 3.3Å
858	L	67.6	Low	72.2	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.052	27%	0.27	C	S	.	.	S	Bend	trans	-114.1	156.1	178.6	-59.9	176.9	0	0	0	112	A265 I268 L272 L842 L854 A863	A265-L858 HydrophobicContact CB-CD2 4Å; I268-L858 HydrophobicContact CB-CD2 4.24Å; I268-L858 HydrophobicContact CG2-CD1 4.02Å; I268-L858 HydrophobicContact CG2-CD2 3.91Å; L272-L858 HydrophobicContact CD1-CD1 4.32Å; L842-L858 HydrophobicContact CD2-CD2 3.92Å; L842-L858 HydrophobicContact CD2-CG 4.09Å; L854-L858 HydrophobicContact CD2-CD1 3.68Å; L854-L858 WeakPolarHBondContact O-CB 2.94Å; L854-L858 PolarHBondContact O-N 3.05Å; L858-A863 HydrophobicContact CB-CB 4.26Å
859	P	69.9	Low	71.9	Confident	52 Å²	52	57.5 Å²	57.5	34%	0.338	29%	0.29	S	S	.	.			trans	-55.1	145.8	170.4	-24.3	34.5	0	0	0	111.9	C269 D861 Q862 A863	C269-P859 VanDerWaalsContact SG-CD 3.51Å; P859-D861 VanDerWaalsContact C-N 3.31Å; P859-D861 PolarHBondContact O-N 3.4Å; P859-Q862 PolarHBondContact O-N 3.36Å; P859-A863 PolarHBondContact O-N 3.43Å
860	P	69.8	Low	71.9	Confident	95 Å²	95	57.8 Å²	57.8	62%	0.617	29%	0.292	S	S	*	.	H	α-helix	trans	-54.9	-44.6	-170.3	-26	34.5	0	0	0	113.7	Q862 A863 E864	P860-Q862 VanDerWaalsContact C-N 3.33Å; P860-Q862 PolarHBondContact O-N 3.34Å; P860-A863 PolarHBondContact O-N 2.9Å; P860-E864 WeakPolarHBondContact O-CG 3.48Å; P860-E864 PolarHBondContact O-N 2.87Å
861	D	64.3	Low	71.6	Confident	110 Å²	110	59 Å²	59	59%	0.588	30%	0.304	S	S	*	.	H	α-helix	trans	-63.5	-32.9	179.1	33.2	-62.2	0	0	0	113.1	P859 Y865	P859-D861 VanDerWaalsContact C-N 3.31Å; P859-D861 PolarHBondContact O-N 3.4Å; D861-Y865 WeakPolarHBondContact O-CB 3.46Å; D861-Y865 PolarHBondContact O-N 3.47Å
862	Q	68.5	Low	71.8	Confident	23 Å²	23	63.2 Å²	63.2	11%	0.107	33%	0.33	C	S	.	.	H	α-helix	trans	-87.4	-30.8	176.4	-62.4	-170.6	-16.8	0	0	112.8	C269 L272 P859 P860 Y865 C866	C269-Q862 PolarHBondContact O-NE2 2.99Å; C269-Q862 VanDerWaalsContact O-NE2 3.15Å; C269-Q862 PolarHBondContact SG-OE1 3.39Å; L272-Q862 HydrophobicContact CD1-CB 4.08Å; P859-Q862 PolarHBondContact O-N 3.36Å; P860-Q862 VanDerWaalsContact C-N 3.33Å; P860-Q862 PolarHBondContact O-N 3.34Å; Q862-Y865 PolarHBondContact O-N 2.71Å; Q862-C866 PolarHBondContact O-N 3.41Å
863	A	70.3	Confident	71.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-49.9	171.1	0	0	0	0	0	110.9	L854 R855 L858 P859 P860 Y865 C866 I867	L854-A863 HydrophobicContact CB-CB 4.4Å; R855-A863 HydrophobicContact CG-CB 4.12Å; L858-A863 HydrophobicContact CB-CB 4.26Å; P859-A863 PolarHBondContact O-N 3.43Å; P860-A863 PolarHBondContact O-N 2.9Å; A863-Y865 VanDerWaalsContact C-N 3.33Å; A863-Y865 PolarHBondContact O-N 3.34Å; A863-C866 PolarHBondContact O-N 3.45Å; A863-I867 WeakPolarHBondContact O-CB 3Å; A863-I867 WeakPolarHBondContact O-CD1 3.36Å; A863-I867 WeakPolarHBondContact O-CG1 3.27Å; A863-I867 PolarHBondContact O-N 3.15Å
864	E	76.9	Confident	71.3	Confident	85 Å²	85	64 Å²	64	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-64.1	-35.9	176.3	-64.7	-56.9	147.3	0	0	112.2	R855 P860 I867 A868	R855-E864 IonicContact CZ-OE1 2.73Å; R855-E864 IonicContact NE-OE1 2.7Å; R855-E864 PolarHBondContact NE-OE1 2.7Å; R855-E864 IonicContact NH2-OE1 2.66Å; R855-E864 PolarHBondContact NH2-OE1 2.81Å; R855-E864 IonicContact NH2-OE2 2.76Å; R855-E864 PolarHBondContact NH2-OE2 2.72Å; R855-E864 VanDerWaalsContact NH2-OE2 3.11Å; P860-E864 WeakPolarHBondContact O-CG 3.48Å; P860-E864 PolarHBondContact O-N 2.87Å; E864-I867 PolarHBondContact O-N 3.28Å; E864-A868 WeakPolarHBondContact O-CB 3.45Å; E864-A868 PolarHBondContact O-N 3.14Å
865	Y	71.4	Confident	71.2	Confident	26 Å²	26	65 Å²	65	10%	0.102	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-46.3	173.1	179.2	-89.6	0	0	0	112.2	L272 N275 Q276 E279 D861 Q862 A863 A868 R869 F888	L272-Y865 HydrophobicContact CD2-CD1 4.03Å; L272-Y865 HydrophobicContact CD2-CE1 4.01Å; N275-Y865 HydrophobicContact CB-CE1 4.48Å; N275-Y865 WeakPolarHBondContact CB-OH 3.44Å; N275-Y865 PolarHBondContact ND2-OH 3.08Å; Q276-Y865 HydrophobicContact CB-CE2 4.25Å; Q276-Y865 HydrophobicContact CG-CE2 4.4Å; E279-Y865 PolarHBondContact OE1-OH 3.12Å; E279-Y865 WeakPolarHBondContact OE2-CE2 3.3Å; E279-Y865 PolarHBondContact OE2-OH 3.43Å; D861-Y865 WeakPolarHBondContact O-CB 3.46Å; D861-Y865 PolarHBondContact O-N 3.47Å; Q862-Y865 PolarHBondContact O-N 2.71Å; A863-Y865 VanDerWaalsContact C-N 3.33Å; A863-Y865 PolarHBondContact O-N 3.34Å; Y865-A868 PolarHBondContact O-N 3.29Å; Y865-R869 HydrophobicContact CE1-CG 4.41Å; Y865-R869 HydrophobicContact CE2-CG 4.43Å; Y865-R869 WeakPolarHBondContact O-CB 3.39Å; Y865-R869 WeakPolarHBondContact O-CG 3.41Å; Y865-R869 PolarHBondContact O-N 3.15Å; Y865-F888 HydrophobicContact CE1-CZ 4.48Å
866	C	68.9	Low	70.3	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-62.3	-44.9	172.8	-81.4	0	0	0	0	112.3	L272 L854 Q862 A863 A868 R869 M870	L272-C866 WeakPolarHBondContact CD1-SG 3.13Å; L272-C866 VanDerWaalsContact CD2-SG 3.54Å; L854-C866 HydrophobicContact CD1-CB 4.02Å; L854-C866 HydrophobicContact CD2-CB 4.32Å; Q862-C866 PolarHBondContact O-N 3.41Å; A863-C866 PolarHBondContact O-N 3.45Å; C866-A868 VanDerWaalsContact C-N 3.28Å; C866-A868 PolarHBondContact O-N 3.33Å; C866-R869 PolarHBondContact O-N 3.47Å; C866-M870 HydrophobicContact CB-CE 4.06Å; C866-M870 HydrophobicContact CB-SD 3.99Å; C866-M870 VanDerWaalsContact O-CB 3.29Å; C866-M870 WeakPolarHBondContact O-CB 3.38Å; C866-M870 VanDerWaalsContact O-CG 3.28Å; C866-M870 WeakPolarHBondContact O-CG 3.42Å; C866-M870 PolarHBondContact O-N 3.23Å
867	I	77.2	Confident	69.9	Low	38 Å²	38	63.1 Å²	63.1	20%	0.195	38%	0.376	C	S	.	.	H	α-helix	trans	-62.5	-35.4	-179.1	-68.8	161.3	0	0	0	111.6	A851 L854 R855 A863 E864 L883	A851-I867 HydrophobicContact CB-CD1 3.87Å; A851-I867 HydrophobicContact CB-CG1 4.06Å; L854-I867 HydrophobicContact CB-CD1 4.48Å; L854-I867 HydrophobicContact CB-CG1 4.5Å; L854-I867 HydrophobicContact CD1-CG1 3.82Å; R855-I867 HydrophobicContact CG-CD1 4.02Å; A863-I867 WeakPolarHBondContact O-CB 3Å; A863-I867 WeakPolarHBondContact O-CD1 3.36Å; A863-I867 WeakPolarHBondContact O-CG1 3.27Å; A863-I867 PolarHBondContact O-N 3.15Å; E864-I867 PolarHBondContact O-N 3.28Å; I867-L883 HydrophobicContact CB-CD1 4.45Å; I867-L883 HydrophobicContact CG1-CD1 4.02Å
868	A	74.4	Confident	69.4	Low	88 Å²	88	62.4 Å²	62.4	73%	0.727	38%	0.383	S	S	*	.	H	α-helix	trans	-76.4	-24.4	177.5	0	0	0	0	0	114.1	E864 Y865 C866	E864-A868 WeakPolarHBondContact O-CB 3.45Å; E864-A868 PolarHBondContact O-N 3.14Å; Y865-A868 PolarHBondContact O-N 3.29Å; C866-A868 VanDerWaalsContact C-N 3.28Å; C866-A868 PolarHBondContact O-N 3.33Å
869	R	70.1	Confident	69.3	Low	143 Å²	143	65.6 Å²	65.6	54%	0.54	40%	0.403	S	S	.	.	H	α-helix	trans	-106.8	-23.1	-172.5	-69.9	-87.1	-176.2	176.9	-5	114.4	E279 Y865 C866 F888	E279-R869 IonicContact OE1-CZ 3.93Å; E279-R869 IonicContact OE1-NE 3Å; E279-R869 PolarHBondContact OE1-NE 3.42Å; E279-R869 IonicContact OE1-NH1 3.53Å; E279-R869 PolarHBondContact OE1-NH1 3.17Å; E279-R869 IonicContact OE1-NH2 3.49Å; E279-R869 PolarHBondContact OE1-NH2 3.37Å; E279-R869 VanDerWaalsContact OE1-NH2 3.14Å; E279-R869 IonicContact OE2-CZ 3.12Å; E279-R869 VanDerWaalsContact OE2-CZ 3.3Å; E279-R869 IonicContact OE2-NE 2.7Å; E279-R869 IonicContact OE2-NH2 2.68Å; E279-R869 PolarHBondContact OE2-NH2 2.81Å; Y865-R869 HydrophobicContact CE1-CG 4.41Å; Y865-R869 HydrophobicContact CE2-CG 4.43Å; Y865-R869 WeakPolarHBondContact O-CB 3.39Å; Y865-R869 WeakPolarHBondContact O-CG 3.41Å; Y865-R869 PolarHBondContact O-N 3.15Å; C866-R869 PolarHBondContact O-N 3.47Å; R869-F888 HydrophobicContact CB-CE2 4.08Å
870	M	76.4	Confident	68.9	Low	11 Å²	11	69.5 Å²	69.5	5%	0.054	43%	0.428	C	S	.	.	S	Bend	trans	-81.3	139.5	178.6	-71.4	175.4	171.2	0	0	111.4	F839 I849 L854 C866 L883 F888	F839-M870 HydrophobicContact CD1-CE 4.38Å; F839-M870 HydrophobicContact CE1-CE 3.85Å; I849-M870 HydrophobicContact CG2-SD 4.39Å; L854-M870 HydrophobicContact CD1-SD 4.16Å; C866-M870 HydrophobicContact CB-CE 4.06Å; C866-M870 HydrophobicContact CB-SD 3.99Å; C866-M870 VanDerWaalsContact O-CB 3.29Å; C866-M870 WeakPolarHBondContact O-CB 3.38Å; C866-M870 VanDerWaalsContact O-CG 3.28Å; C866-M870 WeakPolarHBondContact O-CG 3.42Å; C866-M870 PolarHBondContact O-N 3.23Å; M870-L883 HydrophobicContact CB-CB 4.04Å; M870-L883 HydrophobicContact CB-CD1 4.47Å; M870-L883 HydrophobicContact CB-CD2 4.26Å; M870-L883 HydrophobicContact CB-CG 4.49Å; M870-L883 HydrophobicContact SD-CB 4.41Å; M870-F888 HydrophobicContact CE-CB 4.26Å; M870-F888 HydrophobicContact CE-CD1 3.74Å; M870-F888 HydrophobicContact CE-CE1 4.23Å; M870-F888 HydrophobicContact CE-CG 3.92Å; M870-F888 HydrophobicContact CG-CB 4.17Å; M870-F888 HydrophobicContact CG-CD2 4.08Å; M870-F888 HydrophobicContact CG-CG 4.1Å
871	A	74.5	Confident	68.7	Low	51 Å²	51	67.4 Å²	67.4	42%	0.421	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-74.3	148.2	175.5	0	0	0	0	0	111.5	Y873 L883 D884	A871-Y873 PolarHBondContact O-N 3.31Å; A871-L883 WeakPolarHBondContact O-CA 3.46Å; A871-D884 PolarHBondContact O-N 3.44Å
872	P	75.8	Confident	69.3	Low	106 Å²	106	62.4 Å²	62.4	69%	0.688	40%	0.398	S	S	*	.	B	Isolated β-bridge	trans	-65.5	133.7	172.6	27.6	-33.9	0	0	0	110.8	A874 A882	P872-A874 PolarHBondContact O-N 2.83Å; P872-A882 WeakPolarHBondContact CA-O 3.38Å
873	Y	74.5	Confident	69.8	Low	55 Å²	55	62.1 Å²	62.1	22%	0.216	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-72	120	-176	-176.9	-101.9	0	0	0	111.8	F848 A871 G875 A882 D884	F848-Y873 HydrophobicContact CB-CD1 3.84Å; F848-Y873 HydrophobicContact CB-CD2 3.92Å; F848-Y873 HydrophobicContact CB-CE1 4.26Å; F848-Y873 HydrophobicContact CB-CE2 4.35Å; F848-Y873 HydrophobicContact CB-CG 3.65Å; F848-Y873 HydrophobicContact CD1-CD1 4.13Å; F848-Y873 AromaticContact CD1-CE1 3.98Å; F848-Y873 HydrophobicContact CD1-CE1 3.98Å; F848-Y873 HydrophobicContact CG-CD1 4.21Å; F848-Y873 HydrophobicContact CG-CE1 4.48Å; F848-Y873 HydrophobicContact CG-CG 4.5Å; A871-Y873 PolarHBondContact O-N 3.31Å; Y873-G875 VanDerWaalsContact CE1-CA 3.44Å; Y873-A882 PolarHBondContact N-O 2.98Å; Y873-D884 HydrophobicContact CD2-CB 4.26Å
874	A	60	Low	70.3	Confident	107 Å²	107	63.8 Å²	63.8	88%	0.884	41%	0.405	S	S	*	.			trans	-98.3	13.7	-174.1	0	0	0	0	0	114.8	P872	P872-A874 PolarHBondContact O-N 2.83Å
875	G	67.6	Low	70.2	Confident	22 Å²	22	59.9 Å²	59.9	23%	0.227	39%	0.387	C	S	.	.	S	Bend	trans	-80	164.8	-178.2	0	0	0	0	0	114.7	Y873 D877 G878	Y873-G875 VanDerWaalsContact CE1-CA 3.44Å; G875-D877 PolarHBondContact O-N 2.65Å; G875-G878 PolarHBondContact O-N 3.41Å; G875-G878 VanDerWaalsContact O-N 3.11Å
876	P	57.7	Low	70.3	Confident	132 Å²	132	62 Å²	62	86%	0.857	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.7	-175	27.2	-35.6	0	0	0	114.5	G878	P876-G878 VanDerWaalsContact C-N 3.34Å
877	D	62.6	Low	70.4	Confident	118 Å²	118	64.6 Å²	64.6	63%	0.631	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	9.4	177.8	-56	-52.4	0	0	0	113.2	F848 G875 V879	F848-D877 HydrophobicContact CE1-CB 4.33Å; G875-D877 PolarHBondContact O-N 2.65Å; D877-V879 PolarHBondContact O-N 3.47Å
878	G	59.8	Low	70.1	Confident	39 Å²	39	63.7 Å²	63.7	40%	0.402	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-67.3	121.2	-173.5	0	0	0	0	0	114.4	G875 P876	G875-G878 PolarHBondContact O-N 3.41Å; G875-G878 VanDerWaalsContact O-N 3.11Å; P876-G878 VanDerWaalsContact C-N 3.34Å
879	V	64.9	Low	69.7	Low	76 Å²	76	59.5 Å²	59.5	46%	0.461	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-88.5	154.9	165.1	-90.1	0	0	0	0	111.5	F848 T850 D877 G881 A882	F848-V879 HydrophobicContact CD2-CG2 4.45Å; F848-V879 HydrophobicContact CE2-CG2 3.55Å; F848-V879 HydrophobicContact CZ-CG2 3.9Å; T850-V879 HydrophobicContact CG2-CG2 4.26Å; D877-V879 PolarHBondContact O-N 3.47Å; V879-G881 PolarHBondContact O-N 3.36Å; V879-G881 VanDerWaalsContact O-N 3.15Å; V879-A882 HydrophobicContact CG2-CB 4.49Å; V879-A882 WeakPolarHBondContact O-CB 3.41Å; V879-A882 PolarHBondContact O-N 3.38Å; V879-A882 VanDerWaalsContact O-N 3.13Å
880	P	61	Low	69.6	Low	135 Å²	135	54.3 Å²	54.3	88%	0.877	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	120.1	175.2	-23.4	33.9	0	0	0	111.3
881	G	66.5	Low	69	Low	50 Å²	50	56.2 Å²	56.2	52%	0.515	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.7	15.7	-177.9	0	0	0	0	0	116	T850 A851 V879	T850-G881 WeakPolarHBondContact CA-O 3.36Å; A851-G881 PolarHBondContact N-O 3.08Å; V879-G881 PolarHBondContact O-N 3.36Å; V879-G881 VanDerWaalsContact O-N 3.15Å
882	A	76	Confident	68.1	Low	6 Å²	6	54.2 Å²	54.2	5%	0.05	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	140	171.5	0	0	0	0	0	112.9	F848 P872 Y873 V879	F848-A882 HydrophobicContact CB-CB 4.17Å; F848-A882 HydrophobicContact CD2-CB 3.65Å; F848-A882 HydrophobicContact CE2-CB 4.31Å; F848-A882 HydrophobicContact CG-CB 4.05Å; P872-A882 WeakPolarHBondContact CA-O 3.38Å; Y873-A882 PolarHBondContact N-O 2.98Å; V879-A882 HydrophobicContact CG2-CB 4.49Å; V879-A882 WeakPolarHBondContact O-CB 3.41Å; V879-A882 PolarHBondContact O-N 3.38Å; V879-A882 VanDerWaalsContact O-N 3.13Å
883	L	79.9	Confident	67.2	Low	17 Å²	17	51 Å²	51	9%	0.089	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.3	-177.9	-62.2	167.8	0	0	0	110.9	F848 I849 L854 I867 M870 A871	F848-L883 WeakPolarHBondContact CA-O 3.42Å; I849-L883 HydrophobicContact CG2-CB 4.3Å; I849-L883 PolarHBondContact N-O 3.15Å; I849-L883 WeakPolarHBondContact O-CB 3.43Å; I849-L883 PolarHBondContact O-N 2.76Å; L854-L883 HydrophobicContact CD1-CD1 3.67Å; I867-L883 HydrophobicContact CB-CD1 4.45Å; I867-L883 HydrophobicContact CG1-CD1 4.02Å; M870-L883 HydrophobicContact CB-CB 4.04Å; M870-L883 HydrophobicContact CB-CD1 4.47Å; M870-L883 HydrophobicContact CB-CD2 4.26Å; M870-L883 HydrophobicContact CB-CG 4.49Å; M870-L883 HydrophobicContact SD-CB 4.41Å; A871-L883 WeakPolarHBondContact O-CA 3.46Å
884	D	81.1	Confident	66	Low	34 Å²	34	50.4 Å²	50.4	18%	0.182	35%	0.345	C	S	.	.			trans	-97.1	125.3	177.2	179.8	19.3	0	0	0	112.2	A871 Y873 M886 S887	A871-D884 PolarHBondContact O-N 3.44Å; Y873-D884 HydrophobicContact CD2-CB 4.26Å; D884-M886 PolarHBondContact OD1-N 2.68Å; D884-S887 VanDerWaalsContact CG-OG 3.24Å; D884-S887 VanDerWaalsContact OD2-CB 3.24Å; D884-S887 WeakPolarHBondContact OD2-CB 3.32Å; D884-S887 PolarHBondContact OD2-N 3.46Å; D884-S887 PolarHBondContact OD2-OG 2.84Å
885	Y	74.4	Confident	65.2	Low	3 Å²	3	50.6 Å²	50.6	1%	0.012	33%	0.328	C	S	.	.	S	Bend	trans	-102.4	-12.7	177.3	66.8	-101	0	0	0	113.7	F839 K840 A843 K846 I849 S889	F839-Y885 HydrophobicContact CB-CD2 3.37Å; F839-Y885 HydrophobicContact CB-CE2 3.94Å; F839-Y885 HydrophobicContact CB-CG 3.93Å; F839-Y885 HydrophobicContact CG-CD2 4.25Å; K840-Y885 HydrophobicContact CB-CE2 4.27Å; A843-Y885 HydrophobicContact CB-CD1 4.45Å; A843-Y885 HydrophobicContact CB-CE1 3.78Å; K846-Y885 PolarHBondContact O-OH 2.73Å; I849-Y885 HydrophobicContact CB-CD1 4.47Å; I849-Y885 HydrophobicContact CG2-CD1 4.39Å; Y885-S889 WeakPolarHBondContact O-CB 3.46Å; Y885-S889 PolarHBondContact O-N 3.4Å; Y885-S889 VanDerWaalsContact O-N 3.08Å; Y885-S889 PolarHBondContact O-OG 3.14Å
886	M	73.4	Confident	63.5	Low	70 Å²	70	52.6 Å²	52.6	35%	0.345	34%	0.339	S	S	.	.	H	α-helix	trans	-74.5	-54.1	-178.9	-65.6	-170.1	-177.9	0	0	109.7	N847 D884 F888 S889 T890	N847-M886 HydrophobicContact CB-CE 4.33Å; D884-M886 PolarHBondContact OD1-N 2.68Å; M886-F888 PolarHBondContact O-N 2.71Å; M886-S889 PolarHBondContact O-N 3.14Å; M886-T890 PolarHBondContact O-N 3.22Å; M886-T890 PolarHBondContact O-OG1 3.26Å
887	S	71.2	Confident	62.3	Low	55 Å²	55	54.6 Å²	54.6	39%	0.385	34%	0.342	S	S	.	.	H	α-helix	trans	-54.3	-39.6	172.2	53.4	0	0	0	0	112.3	D884 A891	D884-S887 VanDerWaalsContact CG-OG 3.24Å; D884-S887 VanDerWaalsContact OD2-CB 3.24Å; D884-S887 WeakPolarHBondContact OD2-CB 3.32Å; D884-S887 PolarHBondContact OD2-N 3.46Å; D884-S887 PolarHBondContact OD2-OG 2.84Å; S887-A891 WeakPolarHBondContact O-CB 3.2Å; S887-A891 PolarHBondContact O-N 2.97Å
888	F	71.2	Confident	60.7	Low	20 Å²	20	60.1 Å²	60.1	9%	0.088	37%	0.37	C	S	.	.	H	α-helix	trans	-61.3	-43.3	175.7	-178.5	-97.8	0	0	0	113.3	L272 F839 Y865 R869 M870 M886 L892	L272-F888 HydrophobicContact CD2-CE1 3.64Å; L272-F888 HydrophobicContact CD2-CZ 3.5Å; L272-F888 VanDerWaalsContact CD2-CZ 3.5Å; F839-F888 HydrophobicContact CE1-CD1 4.43Å; F839-F888 HydrophobicContact CE1-CE1 4.5Å; F839-F888 HydrophobicContact CE2-CD1 4.39Å; F839-F888 HydrophobicContact CE2-CE1 4.44Å; F839-F888 AromaticContact CZ-CD1 3.94Å; F839-F888 HydrophobicContact CZ-CD1 3.94Å; F839-F888 AromaticContact CZ-CE1 3.8Å; F839-F888 HydrophobicContact CZ-CE1 3.8Å; Y865-F888 HydrophobicContact CE1-CZ 4.48Å; R869-F888 HydrophobicContact CB-CE2 4.08Å; M870-F888 HydrophobicContact CE-CB 4.26Å; M870-F888 HydrophobicContact CE-CD1 3.74Å; M870-F888 HydrophobicContact CE-CE1 4.23Å; M870-F888 HydrophobicContact CE-CG 3.92Å; M870-F888 HydrophobicContact CG-CB 4.17Å; M870-F888 HydrophobicContact CG-CD2 4.08Å; M870-F888 HydrophobicContact CG-CG 4.1Å; M886-F888 PolarHBondContact O-N 2.71Å; F888-L892 HydrophobicContact CD1-CD1 4.48Å; F888-L892 HydrophobicContact CE1-CD1 3.89Å; F888-L892 HydrophobicContact CE2-CD1 4.41Å; F888-L892 HydrophobicContact CZ-CD1 3.85Å; F888-L892 WeakPolarHBondContact O-CB 3.19Å; F888-L892 PolarHBondContact O-N 3.36Å
889	S	65.3	Low	60.7	Low	0 Å²	0	61.2 Å²	61.2	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-73.8	-39	-178.2	-56.6	0	0	0	0	112.3	F839 Y885 M886 L892 Y893	F839-S889 WeakPolarHBondContact CD2-OG 3.09Å; Y885-S889 WeakPolarHBondContact O-CB 3.46Å; Y885-S889 PolarHBondContact O-N 3.4Å; Y885-S889 VanDerWaalsContact O-N 3.08Å; Y885-S889 PolarHBondContact O-OG 3.14Å; M886-S889 PolarHBondContact O-N 3.14Å; S889-L892 WeakPolarHBondContact O-CB 3.36Å; S889-L892 PolarHBondContact O-N 3.49Å; S889-Y893 PolarHBondContact O-N 3.02Å
890	T	67.3	Low	60.5	Low	33 Å²	33	60.4 Å²	60.4	20%	0.202	36%	0.364	C	S	.	.	H	α-helix	trans	-69.6	-40.9	177.4	-63	0	0	0	0	111.7	M886 L892 Y893 G894 E895	M886-T890 PolarHBondContact O-N 3.22Å; M886-T890 PolarHBondContact O-OG1 3.26Å; T890-L892 PolarHBondContact O-N 3.39Å; T890-Y893 CarbonylContact O-C 3.44Å; T890-Y893 PolarHBondContact O-N 3.49Å; T890-Y893 VanDerWaalsContact O-N 3.17Å; T890-G894 PolarHBondContact O-N 3.29Å; T890-E895 HydrophobicContact CG2-CB 4.02Å; T890-E895 WeakPolarHBondContact CG2-O 3.44Å; T890-E895 PolarHBondContact O-N 3.32Å
891	A	63.3	Low	60.5	Low	51 Å²	51	56.2 Å²	56.2	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-62.1	-29	170.3	0	0	0	0	0	112.5	P357 S887 Y893	P357-A891 WeakPolarHBondContact CD-O 3.15Å; S887-A891 WeakPolarHBondContact O-CB 3.2Å; S887-A891 PolarHBondContact O-N 2.97Å; A891-Y893 VanDerWaalsContact C-N 3.33Å
892	L	56.5	Low	60.1	Low	9 Å²	9	56.6 Å²	56.6	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-70.3	-27.3	176.6	-134.7	100	0	0	0	113.4	V271 R356 F888 S889 T890	V271-L892 HydrophobicContact CG1-CD2 3.18Å; R356-L892 WeakPolarHBondContact CA-O 3.46Å; R356-L892 WeakPolarHBondContact CB-O 3.32Å; R356-L892 WeakPolarHBondContact CD-O 3.35Å; R356-L892 WeakPolarHBondContact CG-O 3.1Å; R356-L892 VanDerWaalsContact CZ-CD2 3.44Å; R356-L892 VanDerWaalsContact NH2-CD2 3.35Å; F888-L892 HydrophobicContact CD1-CD1 4.48Å; F888-L892 HydrophobicContact CE1-CD1 3.89Å; F888-L892 HydrophobicContact CE2-CD1 4.41Å; F888-L892 HydrophobicContact CZ-CD1 3.85Å; F888-L892 WeakPolarHBondContact O-CB 3.19Å; F888-L892 PolarHBondContact O-N 3.36Å; S889-L892 WeakPolarHBondContact O-CB 3.36Å; S889-L892 PolarHBondContact O-N 3.49Å; T890-L892 PolarHBondContact O-N 3.39Å
893	Y	56.4	Low	59.1	Low	40 Å²	40	59.8 Å²	59.8	16%	0.157	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	11	-178	-79.9	-96.1	0	0	0	113.1	S354 N355 A832 V835 S889 T890 A891 E895	S354-Y893 WeakPolarHBondContact O-CE1 3.46Å; N355-Y893 HydrophobicContact CB-CD1 3.54Å; N355-Y893 HydrophobicContact CB-CE1 3.91Å; N355-Y893 CarbonylContact O-C 3.59Å; N355-Y893 WeakPolarHBondContact O-CA 3.31Å; A832-Y893 HydrophobicContact CB-CD1 3.86Å; A832-Y893 HydrophobicContact CB-CE1 4.45Å; V835-Y893 HydrophobicContact CB-CD2 4.39Å; V835-Y893 HydrophobicContact CB-CE2 3.75Å; V835-Y893 HydrophobicContact CG1-CE2 3.86Å; V835-Y893 HydrophobicContact CG2-CE1 4.43Å; V835-Y893 HydrophobicContact CG2-CE2 3.75Å; V835-Y893 WeakPolarHBondContact CG2-OH 2.76Å; S889-Y893 PolarHBondContact O-N 3.02Å; T890-Y893 CarbonylContact O-C 3.44Å; T890-Y893 PolarHBondContact O-N 3.49Å; T890-Y893 VanDerWaalsContact O-N 3.17Å; A891-Y893 VanDerWaalsContact C-N 3.33Å; Y893-E895 PolarHBondContact O-N 3.03Å; Y893-E895 VanDerWaalsContact O-N 3.17Å
894	G	50.6	Low	57.7	Low	41 Å²	41	62.6 Å²	62.6	42%	0.423	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-2.1	172.6	0	0	0	0	0	117	T890 S896	T890-G894 PolarHBondContact O-N 3.29Å; G894-S896 PolarHBondContact O-N 3.38Å
895	E	42.3	Very low	56.1	Low	112 Å²	112	64.6 Å²	64.6	52%	0.523	37%	0.371	S	S	.	.			trans	-81.3	36.3	-178.1	-65.1	-175.7	159.8	0	0	113.7	T890 Y893 D897	T890-E895 HydrophobicContact CG2-CB 4.02Å; T890-E895 WeakPolarHBondContact CG2-O 3.44Å; T890-E895 PolarHBondContact O-N 3.32Å; Y893-E895 PolarHBondContact O-N 3.03Å; Y893-E895 VanDerWaalsContact O-N 3.17Å; E895-D897 PolarHBondContact O-N 2.97Å
896	S	32.9	Very low	54.6	Low	64 Å²	64	69.4 Å²	69.4	45%	0.448	40%	0.399	S	S	.	.			trans	-86.3	103.7	173.8	-59.3	0	0	0	0	109.6	G894 L898	G894-S896 PolarHBondContact O-N 3.38Å; S896-L898 PolarHBondContact O-N 2.93Å
897	D	32.8	Very low	53.1	Low	173 Å²	173	69.3 Å²	69.3	93%	0.925	40%	0.404	S	S	*	.			trans	-57.5	103.8	168.1	-92.2	-29.7	0	0	0	110	E895	E895-D897 PolarHBondContact O-N 2.97Å
898	L	27.4	Very low	51.4	Low	234 Å²	234	70.6 Å²	70.6	100%	1.225	41%	0.405	S	S	*	.			trans	-149.7	0	171.3	-120.4	172.7	0	0	0	111.1	S896	S896-L898 PolarHBondContact O-N 2.93Å

Retrieved 898 of 898 residues in 324.4 ms (Link to these results)

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