A0A5K4FBK1_SCHMA Loading...

Gamma-tubulin complex component

AlphaFold DB , UniProt , Accession A0A5K4FBK1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 801 aa.

						>A0A5K4FBK1_SCHMA|A0A5K4FBK1
MFTRNYINFQSHSPSVETCDSNSPNEEFTKPGQDYTSNYSYPCRWDQLPSNKHIFTNHNFPSKLTCKSLQPEYWWSRYSSDLKDKSLKNHWLSYIGQRDDRYNLTEYQLIREIIWVLLGARGCFAMQLCKNQIVDICCKSHLTSVSHLSYDALDSLLRKFVDWNNHILFIRLVVHFVVNKMDCISHACVFSFASCLNGFLSQLDEFLHEMESKSRNPGIFTMISLYHCLIPWCNRVKILSKIIKDIVENNLDNLRQTSTTSTLLDALRHTSDLLEDCGFDQYIVQVLRSMFIITFHPFISSLVQLFSGSATFNDPLVKLFADINYNIPPGDPKFWSDAIKPRNKVLDSSCIPYMFLPIMDEVVDGLKANFLLIAVCEEIGDYSFLETVDAGPVCISLDSLLSEQYFRSKLSHQESYLSKNCYKGDGSRTTLKSLESQLKRFVCERRMLINQQLLKLLLHSHMRGPNGLRTVGNCLAVAGAVYLFGAGYNMDDFARQCFGNISFPRAKKLDLVDLTANLQSQLSDTFRNRHASHSLLHLESTFLAFDFLSVDQLIDDRPMELIFDLIGNLKLNYHLDWPANIILDEKSIGIYNDVFIFLLQIKYVKWSLENLHFSTLEKTVSTCFSTNHHLIILRIKMLFIFTNLHDFLAHRIEAIRTRFSSKWCLPEFYSTTSIDHNIPETYTFANLVQDHKNLLNELQSVCLLTESTSLLFTEIYNLCNMGLQLRELWSKDLSSPNCETSRFKVKIEFLSEQFDNHVQFLSTMLTRSVRLSTAKQLLYLSSSFKVAASFPTNIFKSIPSK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	24.5	Very low	245 Å²	245	176.3 Å²	176.3	100%	1.207	85%	0.852	S	S	*	*				0	112.5	0	-81.6	175.2	167.8	0	0	108.1
2	F	22.8	Very low	24.6	Very low	211 Å²	211	175.9 Å²	175.9	93%	0.925	85%	0.848	S	S	*	*			trans	-99	119.2	171.5	-85.9	-83.4	0	0	0	108.9
3	T	29.1	Very low	24.4	Very low	130 Å²	130	170.8 Å²	170.8	80%	0.798	84%	0.841	S	S	*	*			trans	-152.2	93.1	160.2	44.9	0	0	0	0	105.4
4	R	21.5	Very low	24.5	Very low	225 Å²	225	166.6 Å²	166.6	85%	0.849	83%	0.833	S	S	*	*				30.8	111.4	91.5	-83.2	-173.1	177.2	176	-0	113.2
5	N	28.9	Very low	24.5	Very low	173 Å²	173	162.2 Å²	162.2	93%	0.925	82%	0.824	S	S	*	*				-158.4	128.3	127.9	-90.3	-19.8	0	0	0	110.6
6	Y	21.6	Very low	24.4	Very low	202 Å²	202	160.2 Å²	160.2	79%	0.792	82%	0.822	S	S	*	*			trans	-95.2	158.3	-179.2	-104.7	-92.2	0	0	0	109.6
7	I	22.3	Very low	24.5	Very low	126 Å²	126	162.4 Å²	162.4	65%	0.646	83%	0.828	S	S	*	*			trans	69.1	116.5	141.3	-71.3	157.4	0	0	0	117.9
8	N	23.8	Very low	24.4	Very low	141 Å²	141	159.8 Å²	159.8	75%	0.754	82%	0.822	S	S	*	*				-177.8	135.4	88.5	-120.8	-25.2	0	0	0	112.5
9	F	20.4	Very low	24.4	Very low	206 Å²	206	157.8 Å²	157.8	90%	0.904	82%	0.822	S	S	*	*			trans	-75.1	129	162.1	-88.6	-97.4	0	0	0	108.7
10	Q	24.6	Very low	24.4	Very low	165 Å²	165	156.9 Å²	156.9	77%	0.771	82%	0.818	S	S	*	*			trans	-127.5	114.2	160.4	-84.3	-174.7	-18.7	0	0	109.5
11	S	22.7	Very low	24.4	Very low	115 Å²	115	154 Å²	154	80%	0.804	81%	0.811	S	S	*	*			trans	-64.9	126	165.3	48.1	0	0	0	0	110.8
12	H	26.5	Very low	24.2	Very low	172 Å²	172	150.3 Å²	150.3	80%	0.796	80%	0.796	S	S	*	*			trans	-117	109.2	158.5	-86.8	-67.8	0	0	0	108.9
13	S	21.9	Very low	24.2	Very low	109 Å²	109	145.7 Å²	145.7	76%	0.762	79%	0.79	S	S	*	*			trans	-77.5	147.4	151.5	44.3	0	0	0	0	108.9
14	P	25.3	Very low	24.2	Very low	112 Å²	112	144.3 Å²	144.3	73%	0.727	78%	0.784	S	S	*	*				-139.5	146.8	119.5	33.3	-18.5	0	0	0	114.2
15	S	25.2	Very low	24.4	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	78%	0.782	S	S	*	*			trans	47.6	107.4	148.3	54.9	0	0	0	0	118.2
16	V	22.6	Very low	24.1	Very low	130 Å²	130	141.2 Å²	141.2	79%	0.788	78%	0.778	S	S	*	*				44.6	91.5	68.5	-170.5	0	0	0	0	113.1
17	E	26.1	Very low	24.3	Very low	197 Å²	197	140.7 Å²	140.7	92%	0.921	78%	0.783	S	S	*	*			trans	-132.7	116.4	145.4	-82.8	-173.4	165.6	0	0	108.6
18	T	22	Very low	24.4	Very low	117 Å²	117	143.6 Å²	143.6	72%	0.718	79%	0.791	S	S	*	*			trans	-88.5	134.7	169.4	43.3	0	0	0	0	108.9
19	C	24.3	Very low	24.6	Very low	121 Å²	121	143.9 Å²	143.9	82%	0.818	80%	0.798	S	S	*	*			trans	-161	98.1	148.6	-96.3	0	0	0	0	109.8
20	D	24.2	Very low	24.9	Very low	140 Å²	140	143.6 Å²	143.6	75%	0.749	80%	0.796	S	S	*	*				52.3	108	123.8	-62	-17.2	0	0	0	121
21	S	25.4	Very low	25.4	Very low	97 Å²	97	141.8 Å²	141.8	68%	0.678	80%	0.799	S	S	*	*				32.6	112.5	123.1	61.7	0	0	0	0	118.5
22	N	26.4	Very low	25.6	Very low	166 Å²	166	139.5 Å²	139.5	89%	0.888	79%	0.794	S	S	*	*			trans	-145.1	92.6	143.4	-88.8	-36.9	0	0	0	109.5
23	S	24	Very low	25.7	Very low	114 Å²	114	140 Å²	140	80%	0.797	80%	0.796	S	S	*	*			trans	-101.3	131	153.2	53.6	0	0	0	0	107.4
24	P	27.5	Very low	26.1	Very low	102 Å²	102	142.4 Å²	142.4	66%	0.662	80%	0.801	S	S	*	*			trans	-143	148.7	130.6	28.6	-9.8	0	0	0	114.6
25	N	25.7	Very low	26.5	Very low	151 Å²	151	146.7 Å²	146.7	81%	0.807	80%	0.804	S	S	*	*			trans	90.9	80.8	149	-57.3	-10.1	0	0	0	118.4
26	E	23.2	Very low	26.8	Very low	182 Å²	182	148.2 Å²	148.2	85%	0.85	81%	0.809	S	S	*	*			trans	-68.4	123.8	142.7	-65.2	176.5	149.6	0	0	110
27	E	26.1	Very low	27.7	Very low	191 Å²	191	145 Å²	145	89%	0.893	79%	0.792	S	S	*	*			trans	-127	130.5	157.9	-89.6	-172	167.7	0	0	110.3
28	F	24.6	Very low	28.4	Very low	186 Å²	186	143.4 Å²	143.4	82%	0.816	79%	0.79	S	S	*	*			trans	-66.8	139.1	-174.9	-79.2	-105.8	0	0	0	113
29	T	27	Very low	29.6	Very low	147 Å²	147	142.3 Å²	142.3	90%	0.902	77%	0.773	S	S	*	*			trans	-134.5	130.2	148.2	17.1	0	0	0	0	110.9
30	K	27.3	Very low	30.4	Very low	200 Å²	200	141.6 Å²	141.6	87%	0.87	77%	0.77	S	S	*	*			trans	-80.5	168.8	-173.5	-93	-178.8	177.6	177.6	0	113
31	P	35.9	Very low	31.3	Very low	128 Å²	128	143.3 Å²	143.3	83%	0.831	77%	0.767	S	S	*	*			trans	-103.6	157.6	-156.1	38.8	-32.1	0	0	0	114.8
32	G	25.8	Very low	32.3	Very low	67 Å²	67	145 Å²	145	69%	0.691	78%	0.776	S	S	*	*			trans	157.2	106	159.5	0	0	0	0	0	112.9
33	Q	30.1	Very low	33.3	Very low	182 Å²	182	139 Å²	139	85%	0.85	75%	0.746	S	S	*	*			trans	178.1	140.2	134.6	-96.2	169.9	14.1	0	0	111.3
34	D	29.6	Very low	34.3	Very low	160 Å²	160	140.3 Å²	140.3	86%	0.856	73%	0.734	S	S	*	*			trans	-66.1	141.5	-163.1	-62.3	-62.6	0	0	0	115.7
35	Y	33.8	Very low	35.2	Very low	202 Å²	202	143.3 Å²	143.3	79%	0.792	73%	0.732	S	S	*	*			trans	-98.7	102.5	177.9	-71.5	-89.1	0	0	0	111.4
36	T	31.5	Very low	36.4	Very low	132 Å²	132	139.8 Å²	139.8	81%	0.81	71%	0.713	S	S	*	*			trans	-131.2	69.4	157.2	47.1	0	0	0	0	109.2	N38	T36-N38 PolarHBondContact O-N 3.39Å
37	S	41.2	Very low	37.7	Very low	62 Å²	62	136.1 Å²	136.1	43%	0.434	70%	0.696	S	S	.	*			trans	-82.9	109.6	170.2	41.7	0	0	0	0	110.4	Y39	S37-Y39 WeakPolarHBondContact O-CD2 3.31Å; S37-Y39 WeakPolarHBondContact O-CE2 3.49Å; S37-Y39 PolarHBondContact O-N 3.45Å; S37-Y39 WeakPolarHBondContact OG-CE2 3.4Å; S37-Y39 PolarHBondContact OG-OH 3.1Å
38	N	40	Very low	38.9	Very low	164 Å²	164	131.3 Å²	131.3	88%	0.877	68%	0.676	S	S	*	*			trans	-58.9	115.7	167.6	-69.7	-35.7	0	0	0	110.1	T36	T36-N38 PolarHBondContact O-N 3.39Å
39	Y	48.9	Very low	39.9	Very low	95 Å²	95	125.5 Å²	125.5	37%	0.373	66%	0.657	S	S	.	*			trans	-111.5	123.7	168	-62.3	-82.8	0	0	0	109.6	S37 Q47 P49	S37-Y39 WeakPolarHBondContact O-CD2 3.31Å; S37-Y39 WeakPolarHBondContact O-CE2 3.49Å; S37-Y39 PolarHBondContact O-N 3.45Å; S37-Y39 WeakPolarHBondContact OG-CE2 3.4Å; S37-Y39 PolarHBondContact OG-OH 3.1Å; Y39-Q47 WeakPolarHBondContact CE1-O 3.46Å; Y39-P49 HydrophobicContact CE2-CG 3.63Å
40	S	39.6	Very low	40.9	Very low	106 Å²	106	122 Å²	122	74%	0.741	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-88.5	127.8	166.5	47	0	0	0	0	109.4
41	Y	44.1	Very low	41.4	Very low	176 Å²	176	118.7 Å²	118.7	69%	0.69	63%	0.63	S	S	*	*	S	Bend	trans	-89.3	147.7	177.5	-71.6	-88.3	0	0	0	110.6
42	P	45.8	Very low	41.7	Very low	133 Å²	133	120.9 Å²	120.9	86%	0.864	63%	0.627	S	S	*	*	S	Bend	cis	-85.1	142.7	-0.8	31.6	-31.9	0	0	0	113.7
43	C	48.3	Very low	42.3	Very low	40 Å²	40	124.5 Å²	124.5	27%	0.27	63%	0.625	S	S	.	*			trans	-123.4	162	177.3	68.4	0	0	0	0	112.2	Q47	C43-Q47 HydrophobicContact CB-CB 4.48Å
44	R	44.2	Very low	42.6	Very low	141 Å²	141	122.9 Å²	122.9	53%	0.532	62%	0.621	S	S	.	*			trans	-73.8	145.9	-176.9	-147.5	-174.3	172	-153.5	10.7	110.1	D46 Q47	R44-D46 WeakPolarHBondContact CB-OD1 3.03Å; R44-D46 WeakPolarHBondContact CD-OD1 3.31Å; R44-D46 WeakPolarHBondContact CG-OD1 3.41Å; R44-D46 IonicContact CZ-OD2 2.68Å; R44-D46 IonicContact NE-OD1 2.81Å; R44-D46 IonicContact NE-OD2 3.65Å; R44-D46 IonicContact NH1-OD1 3.56Å; R44-D46 IonicContact NH1-OD2 3.57Å; R44-D46 PolarHBondContact NH1-OD2 3.42Å; R44-D46 PolarHBondContact O-N 2.67Å; R44-D46 VanDerWaalsContact O-N 3.16Å; R44-Q47 HydrophobicContact CB-CG 3.96Å; R44-Q47 VanDerWaalsContact N-OE1 3.11Å; R44-Q47 WeakPolarHBondContact O-CA 3.28Å; R44-Q47 VanDerWaalsContact O-CB 3.25Å; R44-Q47 WeakPolarHBondContact O-CB 3.07Å; R44-Q47 PolarHBondContact O-N 3.47Å
45	W	47.4	Very low	42.9	Very low	164 Å²	164	123.2 Å²	123.2	62%	0.621	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-61.8	-29.2	-172.1	75.5	-91.6	0	0	0	114.2	Q47 L48 K67	W45-Q47 PolarHBondContact O-N 2.91Å; W45-L48 HydrophobicContact CB-CD1 4.39Å; W45-L48 WeakPolarHBondContact O-CB 3.12Å; W45-L48 PolarHBondContact O-N 3.23Å; W45-K67 WeakPolarHBondContact CZ3-O 3.48Å
46	D	49.2	Very low	43.2	Very low	77 Å²	77	119.2 Å²	119.2	41%	0.412	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-70.6	-13.2	173.1	52.5	-35.4	0	0	0	113.1	R44	R44-D46 WeakPolarHBondContact CB-OD1 3.03Å; R44-D46 WeakPolarHBondContact CD-OD1 3.31Å; R44-D46 WeakPolarHBondContact CG-OD1 3.41Å; R44-D46 IonicContact CZ-OD2 2.68Å; R44-D46 IonicContact NE-OD1 2.81Å; R44-D46 IonicContact NE-OD2 3.65Å; R44-D46 IonicContact NH1-OD1 3.56Å; R44-D46 IonicContact NH1-OD2 3.57Å; R44-D46 PolarHBondContact NH1-OD2 3.42Å; R44-D46 PolarHBondContact O-N 2.67Å; R44-D46 VanDerWaalsContact O-N 3.16Å
47	Q	52.3	Low	43.6	Very low	105 Å²	105	120 Å²	120	49%	0.491	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-95.6	-8.8	175.4	-59.1	171.9	-15.7	0	0	112.9	Y39 C43 R44 W45	Y39-Q47 WeakPolarHBondContact CE1-O 3.46Å; C43-Q47 HydrophobicContact CB-CB 4.48Å; R44-Q47 HydrophobicContact CB-CG 3.96Å; R44-Q47 VanDerWaalsContact N-OE1 3.11Å; R44-Q47 WeakPolarHBondContact O-CA 3.28Å; R44-Q47 VanDerWaalsContact O-CB 3.25Å; R44-Q47 WeakPolarHBondContact O-CB 3.07Å; R44-Q47 PolarHBondContact O-N 3.47Å; W45-Q47 PolarHBondContact O-N 2.91Å
48	L	50.8	Low	43.4	Very low	90 Å²	90	125.5 Å²	125.5	47%	0.471	63%	0.63	S	S	.	*	S	Bend	trans	-69.5	126.7	172.6	-73.1	156.6	0	0	0	109	W45 S50	W45-L48 HydrophobicContact CB-CD1 4.39Å; W45-L48 WeakPolarHBondContact O-CB 3.12Å; W45-L48 PolarHBondContact O-N 3.23Å; L48-S50 PolarHBondContact O-N 3.37Å
49	P	45.7	Very low	43.4	Very low	65 Å²	65	126.2 Å²	126.2	42%	0.422	63%	0.633	S	S	.	*			trans	-62.6	131.8	178.3	24.5	-31.2	0	0	0	109.8	Y39 N51	Y39-P49 HydrophobicContact CE2-CG 3.63Å; P49-N51 PolarHBondContact O-N 2.84Å
50	S	47.1	Very low	42.9	Very low	72 Å²	72	129.3 Å²	129.3	50%	0.503	65%	0.649	S	S	.	*			trans	-62.2	104.8	171.5	57.1	0	0	0	0	108.7	L48 K52	L48-S50 PolarHBondContact O-N 3.37Å; S50-K52 PolarHBondContact O-N 3.38Å
51	N	37.5	Very low	43.1	Very low	131 Å²	131	127.9 Å²	127.9	70%	0.701	64%	0.637	S	S	*	*			trans	-66.7	81.6	168.5	-98.7	-10.7	0	0	0	108.6	P49 H53	P49-N51 PolarHBondContact O-N 2.84Å; N51-H53 PolarHBondContact O-N 3.44Å; N51-H53 VanDerWaalsContact O-N 3.15Å
52	K	43.7	Very low	43	Very low	174 Å²	174	124 Å²	124	76%	0.757	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	2.7	177.9	-74.8	-174.3	178.2	-179.6	0	113.4	S50	S50-K52 PolarHBondContact O-N 3.38Å
53	H	38.5	Very low	42.9	Very low	143 Å²	143	127.2 Å²	127.2	66%	0.662	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	17.1	-172	-74.6	-63.7	0	0	0	115.9	N51 F55	N51-H53 PolarHBondContact O-N 3.44Å; N51-H53 VanDerWaalsContact O-N 3.15Å; H53-F55 VanDerWaalsContact O-CD2 3.26Å; H53-F55 WeakPolarHBondContact O-CD2 3.31Å; H53-F55 PolarHBondContact O-N 3.24Å; H53-F55 VanDerWaalsContact O-N 3.1Å
54	I	35.2	Very low	42.8	Very low	148 Å²	148	128.9 Å²	128.9	76%	0.759	64%	0.642	S	S	*	*	S	Bend	trans	-80.1	100.5	164.5	-58.1	178.1	0	0	0	107.8
55	F	35.9	Very low	42.8	Very low	168 Å²	168	126 Å²	126	74%	0.737	64%	0.641	S	S	*	*			trans	-57.5	141.3	-175.3	-83.9	-93.8	0	0	0	113.7	H53 N57	H53-F55 VanDerWaalsContact O-CD2 3.26Å; H53-F55 WeakPolarHBondContact O-CD2 3.31Å; H53-F55 PolarHBondContact O-N 3.24Å; H53-F55 VanDerWaalsContact O-N 3.1Å; F55-N57 PolarHBondContact O-N 2.92Å
56	T	40.7	Very low	42.5	Very low	118 Å²	118	122.6 Å²	122.6	72%	0.724	64%	0.64	S	S	*	*			trans	-29.2	110.2	152.8	49.9	0	0	0	0	113.7
57	N	39.3	Very low	42.3	Very low	149 Å²	149	126.5 Å²	126.5	80%	0.797	65%	0.654	S	S	*	*			trans	-170.4	32.2	145.6	-100.4	-6.3	0	0	0	115.3	F55	F55-N57 PolarHBondContact O-N 2.92Å
58	H	37.4	Very low	42.1	Very low	177 Å²	177	124.7 Å²	124.7	82%	0.819	65%	0.653	S	S	*	*	S	Bend	trans	-147	130.9	155.4	-77.4	-61.8	0	0	0	108.3	F60	H58-F60 PolarHBondContact O-N 3.12Å
59	N	40.8	Very low	42.1	Very low	178 Å²	178	124.7 Å²	124.7	95%	0.952	65%	0.653	S	S	*	*			trans	-67.2	56.5	178.2	-80.2	-20.7	0	0	0	112.3
60	F	37.8	Very low	42.3	Very low	161 Å²	161	126 Å²	126	71%	0.706	65%	0.653	S	S	*	*	S	Bend	trans	-87	126.7	153.2	-95.7	-86.4	0	0	0	107.2	H58 S62	H58-F60 PolarHBondContact O-N 3.12Å; F60-S62 PolarHBondContact O-N 3.27Å
61	P	43.2	Very low	42.4	Very low	75 Å²	75	124.4 Å²	124.4	49%	0.487	64%	0.641	S	S	.	*			trans	-53.3	118.3	178.4	-20.9	28.9	0	0	0	109.4	K63 L64	P61-K63 PolarHBondContact O-N 3.29Å; P61-L64 HydrophobicContact CB-CD1 4.43Å; P61-L64 HydrophobicContact CG-CD1 4.26Å; P61-L64 PolarHBondContact O-N 3.43Å
62	S	42.2	Very low	43.1	Very low	96 Å²	96	123.2 Å²	123.2	67%	0.671	63%	0.631	S	S	*	*	H	α-helix	trans	-55.9	-13.9	177.5	50.5	0	0	0	0	113.8	F60 L64 T65	F60-S62 PolarHBondContact O-N 3.27Å; S62-L64 VanDerWaalsContact C-N 3.3Å; S62-T65 PolarHBondContact O-OG1 3.44Å
63	K	44.3	Very low	43.3	Very low	199 Å²	199	121.8 Å²	121.8	87%	0.865	62%	0.622	S	S	*	*	H	α-helix	trans	-67.8	-23.4	169.9	-76.6	-175.4	176.1	179.4	0	113.9	P61	P61-K63 PolarHBondContact O-N 3.29Å
64	L	44.6	Very low	43.8	Very low	75 Å²	75	119.9 Å²	119.9	39%	0.393	61%	0.609	S	S	.	*	H	α-helix	trans	-88.8	-27.9	179.5	-77.5	159	0	0	0	112.9	P61 S62 L69	P61-L64 HydrophobicContact CB-CD1 4.43Å; P61-L64 HydrophobicContact CG-CD1 4.26Å; P61-L64 PolarHBondContact O-N 3.43Å; S62-L64 VanDerWaalsContact C-N 3.3Å; L64-L69 VanDerWaalsContact O-CD1 3.25Å; L64-L69 WeakPolarHBondContact O-CD1 3.37Å; L64-L69 WeakPolarHBondContact O-CG 3.36Å
65	T	45.5	Very low	44.4	Very low	82 Å²	82	116.5 Å²	116.5	50%	0.503	59%	0.587	S	S	.	*	H	α-helix	trans	-85.5	-25.8	-166.6	43	0	0	0	0	115.2	S62	S62-T65 PolarHBondContact O-OG1 3.44Å
66	C	40.6	Very low	45.1	Very low	91 Å²	91	112.4 Å²	112.4	62%	0.615	58%	0.579	S	S	*	*	S	Bend	trans	-99.3	-13.2	-155.4	-89.2	0	0	0	0	119.2
67	K	44.6	Very low	45.4	Very low	159 Å²	159	117 Å²	117	69%	0.691	58%	0.583	S	S	*	*	S	Bend	trans	-148.1	-13.2	-175.1	-73.5	-165.7	177.1	-175.6	0	119.9	W45	W45-K67 WeakPolarHBondContact CZ3-O 3.48Å
68	S	48.8	Very low	45.9	Very low	67 Å²	67	118.4 Å²	118.4	47%	0.469	58%	0.579	S	S	.	*			trans	-148.2	21.3	-157.2	62.4	0	0	0	0	116.5	Q70	S68-Q70 PolarHBondContact O-N 3.46Å
69	L	50.3	Low	46.5	Very low	90 Å²	90	112.2 Å²	112.2	47%	0.471	56%	0.555	S	S	.	*	S	Bend	trans	-72.1	-26.2	-167.6	-83.7	159.8	0	0	0	114.2	L64 L87	L64-L69 VanDerWaalsContact O-CD1 3.25Å; L64-L69 WeakPolarHBondContact O-CD1 3.37Å; L64-L69 WeakPolarHBondContact O-CG 3.36Å; L69-L87 HydrophobicContact CD2-CD1 3.84Å
70	Q	51	Low	47	Very low	94 Å²	94	108.3 Å²	108.3	44%	0.439	54%	0.542	S	S	.	.			trans	-167.7	127.6	169.2	-141.9	176.8	-65.7	0	0	112.6	S68 H147	S68-Q70 PolarHBondContact O-N 3.46Å; Q70-H147 VanDerWaalsContact CD-CB 3.45Å; Q70-H147 VanDerWaalsContact OE1-CB 3.29Å
71	P	49.4	Very low	47.7	Very low	38 Å²	38	106.3 Å²	106.3	25%	0.247	54%	0.539	C	S	.	.			trans	-63.9	136.9	158.1	-11	25.5	0	0	0	109.2	W75 L82 K85	P71-W75 HydrophobicContact CB-CB 4.43Å; P71-L82 HydrophobicContact CB-CD1 4.41Å; P71-L82 HydrophobicContact CB-CD2 3.99Å; P71-L82 HydrophobicContact CG-CD2 3.57Å; P71-L82 HydrophobicContact CG-CG 4.48Å; P71-K85 HydrophobicContact CG-CB 4.36Å
72	E	51.7	Low	48.1	Very low	105 Å²	105	104.5 Å²	104.5	49%	0.491	53%	0.525	S	S	.	.			trans	-59	143.9	175	-50.3	161.6	121	0	0	109.5	W74 W75	E72-W74 PolarHBondContact O-N 3.4Å; E72-W74 VanDerWaalsContact OE2-CE2 3.24Å; E72-W74 WeakPolarHBondContact OE2-CZ2 3.47Å; E72-W74 PolarHBondContact OE2-NE1 2.93Å; E72-W75 WeakPolarHBondContact O-CB 3.18Å; E72-W75 PolarHBondContact O-N 2.93Å; E72-W75 PolarHBondContact OE2-NE1 3.21Å
73	Y	48.1	Very low	48.5	Very low	144 Å²	144	108 Å²	108	57%	0.565	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-55.2	-29.7	-166.6	73.9	-86.5	0	0	0	114.1	W75 S76 G218	Y73-W75 VanDerWaalsContact C-N 3.29Å; Y73-W75 PolarHBondContact O-N 3.09Å; Y73-S76 PolarHBondContact O-N 3.14Å; Y73-S76 PolarHBondContact O-OG 3.43Å; Y73-G218 WeakPolarHBondContact OH-CA 3.39Å
74	W	49.3	Very low	49.1	Very low	104 Å²	104	104.5 Å²	104.5	39%	0.394	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-72.6	-17.5	-179.3	50	-86.8	0	0	0	113.8	E72 S76 Y78	E72-W74 PolarHBondContact O-N 3.4Å; E72-W74 VanDerWaalsContact OE2-CE2 3.24Å; E72-W74 WeakPolarHBondContact OE2-CZ2 3.47Å; E72-W74 PolarHBondContact OE2-NE1 2.93Å; W74-S76 VanDerWaalsContact C-N 3.35Å; W74-Y78 WeakPolarHBondContact O-CD2 3.34Å
75	W	47.8	Very low	49.8	Very low	77 Å²	77	106.3 Å²	106.3	29%	0.292	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-74.3	-23.4	174	-68.1	100	0	0	0	113.6	P71 E72 Y73 R77 Y78 S79 L82	P71-W75 HydrophobicContact CB-CB 4.43Å; E72-W75 WeakPolarHBondContact O-CB 3.18Å; E72-W75 PolarHBondContact O-N 2.93Å; E72-W75 PolarHBondContact OE2-NE1 3.21Å; Y73-W75 VanDerWaalsContact C-N 3.29Å; Y73-W75 PolarHBondContact O-N 3.09Å; W75-R77 PolarHBondContact O-N 2.93Å; W75-R77 VanDerWaalsContact O-N 3.12Å; W75-Y78 PolarHBondContact O-N 2.85Å; W75-S79 PolarHBondContact O-N 3.39Å; W75-L82 HydrophobicContact CB-CD1 3.94Å; W75-L82 WeakPolarHBondContact O-CD1 3.46Å
76	S	49.6	Very low	50.9	Low	82 Å²	82	103.1 Å²	103.1	57%	0.573	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-61.1	-20.6	176.1	68.6	0	0	0	0	113.4	Y73 W74 Y78	Y73-S76 PolarHBondContact O-N 3.14Å; Y73-S76 PolarHBondContact O-OG 3.43Å; W74-S76 VanDerWaalsContact C-N 3.35Å; S76-Y78 VanDerWaalsContact C-N 3.27Å; S76-Y78 PolarHBondContact O-N 2.7Å
77	R	47.5	Very low	52.5	Low	214 Å²	214	101.4 Å²	101.4	81%	0.808	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-70.1	-22	173.7	-73.8	-173.1	173.4	171.9	-0.9	113.5	W75	W75-R77 PolarHBondContact O-N 2.93Å; W75-R77 VanDerWaalsContact O-N 3.12Å
78	Y	49.5	Very low	54.1	Low	178 Å²	178	93.9 Å²	93.9	70%	0.698	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-4.2	-168.4	-59.6	-72.7	0	0	0	114.2	W74 W75 S76	W74-Y78 WeakPolarHBondContact O-CD2 3.34Å; W75-Y78 PolarHBondContact O-N 2.85Å; S76-Y78 VanDerWaalsContact C-N 3.27Å; S76-Y78 PolarHBondContact O-N 2.7Å
79	S	49	Very low	55.4	Low	48 Å²	48	92.8 Å²	92.8	34%	0.336	45%	0.445	S	S	.	.			trans	-151.9	122.3	177.4	-179.1	0	0	0	0	112.4	W75 D81	W75-S79 PolarHBondContact O-N 3.39Å; S79-D81 VanDerWaalsContact C-N 3.26Å; S79-D81 PolarHBondContact O-N 3.44Å; S79-D81 PolarHBondContact OG-N 3.45Å
80	S	52.5	Low	56.6	Low	96 Å²	96	92.6 Å²	92.6	67%	0.671	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-63.4	-30.5	172.8	43.3	0	0	0	0	112.9	L82 K83	S80-L82 PolarHBondContact O-N 2.89Å; S80-K83 PolarHBondContact O-N 3.37Å
81	D	51	Low	57.9	Low	119 Å²	119	90.8 Å²	90.8	64%	0.636	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-73.5	-4.2	-176	-65.3	-10.2	0	0	0	113.5	S79	S79-D81 VanDerWaalsContact C-N 3.26Å; S79-D81 PolarHBondContact O-N 3.44Å; S79-D81 PolarHBondContact OG-N 3.45Å
82	L	51.7	Low	59.3	Low	36 Å²	36	89.2 Å²	89.2	19%	0.188	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-85.8	-13.4	177.8	-66.2	168.6	0	0	0	113.2	P71 W75 S80 D84 K85	P71-L82 HydrophobicContact CB-CD1 4.41Å; P71-L82 HydrophobicContact CB-CD2 3.99Å; P71-L82 HydrophobicContact CG-CD2 3.57Å; P71-L82 HydrophobicContact CG-CG 4.48Å; W75-L82 HydrophobicContact CB-CD1 3.94Å; W75-L82 WeakPolarHBondContact O-CD1 3.46Å; S80-L82 PolarHBondContact O-N 2.89Å; L82-D84 PolarHBondContact O-N 3Å; L82-K85 HydrophobicContact CD2-CD 4.27Å; L82-K85 PolarHBondContact O-N 3.03Å
83	K	52.2	Low	60.6	Low	171 Å²	171	88.4 Å²	88.4	74%	0.743	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-56.9	-39	178.5	-79.5	-174.8	177.2	179.1	0	111.8	S80 K85 S86 N89	S80-K83 PolarHBondContact O-N 3.37Å; K83-K85 VanDerWaalsContact C-N 3.31Å; K83-K85 PolarHBondContact O-N 2.92Å; K83-S86 PolarHBondContact O-OG 3.39Å; K83-N89 PolarHBondContact O-ND2 3.09Å
84	D	55.6	Low	62	Low	125 Å²	125	90.3 Å²	90.3	67%	0.668	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-77.9	-13.8	179.9	-67.8	-18.9	0	0	0	113.9	L82	L82-D84 PolarHBondContact O-N 3Å
85	K	59.5	Low	63.5	Low	112 Å²	112	89 Å²	89	49%	0.487	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-95.8	11.6	-179.8	-63.4	-175.1	-177.4	172.4	0	113.8	P71 L82 K83	P71-K85 HydrophobicContact CG-CB 4.36Å; L82-K85 HydrophobicContact CD2-CD 4.27Å; L82-K85 PolarHBondContact O-N 3.03Å; K83-K85 VanDerWaalsContact C-N 3.31Å; K83-K85 PolarHBondContact O-N 2.92Å
86	S	68.7	Low	65	Low	16 Å²	16	88.5 Å²	88.5	11%	0.112	45%	0.452	C	S	.	.	S	Bend	trans	-70.2	144	174.2	67.3	0	0	0	0	110.8	K83 K88 N89 H90 S146	K83-S86 PolarHBondContact O-OG 3.39Å; S86-K88 PolarHBondContact O-N 3.37Å; S86-N89 PolarHBondContact O-N 3.36Å; S86-N89 VanDerWaalsContact O-N 3.1Å; S86-N89 WeakPolarHBondContact OG-CB 3.42Å; S86-N89 PolarHBondContact OG-N 2.88Å; S86-N89 PolarHBondContact OG-ND2 2.87Å; S86-H90 PolarHBondContact O-N 2.91Å; S86-S146 WeakPolarHBondContact CB-O 3.48Å
87	L	75.2	Confident	66.3	Low	55 Å²	55	89.6 Å²	89.6	29%	0.288	45%	0.448	S	S	.	.	H	α-helix	trans	-52.6	-41.6	176	-179.7	70.4	0	0	0	110.5	L69 N89 H90 W91 S146 H147	L69-L87 HydrophobicContact CD2-CD1 3.84Å; L87-N89 PolarHBondContact O-N 2.87Å; L87-H90 PolarHBondContact O-N 3.5Å; L87-W91 VanDerWaalsContact O-CB 3.26Å; L87-W91 WeakPolarHBondContact O-CB 3.11Å; L87-W91 PolarHBondContact O-N 3.29Å; L87-S146 PolarHBondContact N-O 3.42Å; L87-H147 WeakPolarHBondContact CD2-O 3.32Å
88	K	77.8	Confident	67.6	Low	1 Å²	1	89.4 Å²	89.4	0%	0.004	45%	0.448	C	S	.	.	H	α-helix	trans	-56.7	-50.8	177.2	-170.2	-166.2	72.3	154.2	0	112.3	S86 H90 W91 L92 D99 N103 S144 S146 Y150	S86-K88 PolarHBondContact O-N 3.37Å; K88-H90 VanDerWaalsContact C-N 3.35Å; K88-H90 PolarHBondContact O-N 3.31Å; K88-W91 PolarHBondContact O-N 2.89Å; K88-L92 HydrophobicContact CD-CD1 4.37Å; K88-L92 HydrophobicContact CG-CD1 4.06Å; K88-L92 HydrophobicContact CG-CG 4.47Å; K88-L92 WeakPolarHBondContact O-CB 3.37Å; K88-L92 VanDerWaalsContact O-CG 3.32Å; K88-L92 WeakPolarHBondContact O-CG 3.26Å; K88-L92 PolarHBondContact O-N 3.07Å; K88-D99 IonicContact NZ-OD1 3.64Å; K88-D99 PolarHBondContact NZ-OD1 3.02Å; K88-D99 IonicContact NZ-OD2 3.98Å; K88-D99 PolarHBondContact NZ-OD2 3.5Å; K88-N103 WeakPolarHBondContact CE-OD1 3.27Å; K88-N103 VanDerWaalsContact NZ-CG 3.32Å; K88-N103 PolarHBondContact NZ-ND2 3.39Å; K88-N103 PolarHBondContact NZ-OD1 3.33Å; K88-S144 PolarHBondContact NZ-OG 2.75Å; K88-S146 PolarHBondContact N-O 2.95Å; K88-Y150 HydrophobicContact CD-CE1 4.07Å; K88-Y150 HydrophobicContact CG-CE1 4.3Å
89	N	75.7	Confident	68.7	Low	43 Å²	43	84 Å²	84	23%	0.23	43%	0.431	C	S	.	.	H	α-helix	trans	-69.2	-35.2	-177	-69.7	-6.8	0	0	0	111.9	K83 S86 L87 S93	K83-N89 PolarHBondContact O-ND2 3.09Å; S86-N89 PolarHBondContact O-N 3.36Å; S86-N89 VanDerWaalsContact O-N 3.1Å; S86-N89 WeakPolarHBondContact OG-CB 3.42Å; S86-N89 PolarHBondContact OG-N 2.88Å; S86-N89 PolarHBondContact OG-ND2 2.87Å; L87-N89 PolarHBondContact O-N 2.87Å; N89-S93 WeakPolarHBondContact O-CB 2.98Å; N89-S93 PolarHBondContact O-N 3.42Å; N89-S93 PolarHBondContact O-OG 2.83Å
90	H	75.2	Confident	70.1	Confident	86 Å²	86	88.1 Å²	88.1	40%	0.398	45%	0.449	S	S	.	.	H	α-helix	trans	-64.6	-39.9	171.2	-98.4	68.6	0	0	0	112.8	S86 L87 K88 S93 Y94	S86-H90 PolarHBondContact O-N 2.91Å; L87-H90 PolarHBondContact O-N 3.5Å; K88-H90 VanDerWaalsContact C-N 3.35Å; K88-H90 PolarHBondContact O-N 3.31Å; H90-S93 PolarHBondContact O-OG 2.89Å; H90-Y94 WeakPolarHBondContact O-CB 3.45Å; H90-Y94 PolarHBondContact O-N 3.31Å; H90-Y94 VanDerWaalsContact O-N 3.12Å
91	W	78.1	Confident	71.6	Confident	57 Å²	57	85.3 Å²	85.3	22%	0.216	42%	0.424	C	S	.	.	H	α-helix	trans	-69.3	-42.6	176.9	175.2	82.7	0	0	0	111.7	L87 K88 Y94 I95 Y150	L87-W91 VanDerWaalsContact O-CB 3.26Å; L87-W91 WeakPolarHBondContact O-CB 3.11Å; L87-W91 PolarHBondContact O-N 3.29Å; K88-W91 PolarHBondContact O-N 2.89Å; W91-Y94 WeakPolarHBondContact O-CB 3.28Å; W91-Y94 PolarHBondContact O-N 3.41Å; W91-I95 HydrophobicContact CD2-CD1 3.8Å; W91-I95 HydrophobicContact CE3-CD1 4.37Å; W91-I95 HydrophobicContact CG-CD1 4.36Å; W91-I95 HydrophobicContact CH2-CD1 3.81Å; W91-I95 HydrophobicContact CZ2-CD1 3.18Å; W91-I95 HydrophobicContact CZ3-CD1 4.37Å; W91-I95 WeakPolarHBondContact O-CG1 3.22Å; W91-I95 PolarHBondContact O-N 3.44Å; W91-Y150 AromaticContact CH2-CD2 3.81Å; W91-Y150 HydrophobicContact CH2-CD2 3.81Å; W91-Y150 AromaticContact CH2-CG 3.89Å; W91-Y150 HydrophobicContact CH2-CG 3.89Å; W91-Y150 HydrophobicContact CZ3-CD1 4.16Å; W91-Y150 AromaticContact CZ3-CD2 3.57Å; W91-Y150 HydrophobicContact CZ3-CD2 3.57Å; W91-Y150 HydrophobicContact CZ3-CE2 4.06Å; W91-Y150 AromaticContact CZ3-CG 3.63Å; W91-Y150 HydrophobicContact CZ3-CG 3.63Å
92	L	79.6	Confident	73	Confident	5 Å²	5	86.7 Å²	86.7	3%	0.026	42%	0.421	C	S	.	.	H	α-helix	trans	-62.5	-43.5	176.1	-76.9	172.7	0	0	0	112.3	K88 Y94 I95 G96 Q97 D99 Y150	K88-L92 HydrophobicContact CD-CD1 4.37Å; K88-L92 HydrophobicContact CG-CD1 4.06Å; K88-L92 HydrophobicContact CG-CG 4.47Å; K88-L92 WeakPolarHBondContact O-CB 3.37Å; K88-L92 VanDerWaalsContact O-CG 3.32Å; K88-L92 WeakPolarHBondContact O-CG 3.26Å; K88-L92 PolarHBondContact O-N 3.07Å; L92-Y94 VanDerWaalsContact C-N 3.32Å; L92-Y94 PolarHBondContact O-N 2.82Å; L92-I95 PolarHBondContact O-N 3.5Å; L92-G96 PolarHBondContact O-N 2.96Å; L92-Q97 HydrophobicContact CD2-CB 3.85Å; L92-Q97 PolarHBondContact O-N 3.24Å; L92-D99 HydrophobicContact CD1-CB 3.9Å; L92-Y150 WeakPolarHBondContact CD1-OH 3.36Å; L92-Y150 HydrophobicContact CD2-CD2 4.39Å; L92-Y150 HydrophobicContact CD2-CE2 3.61Å
93	S	78.8	Confident	74.4	Confident	87 Å²	87	89.3 Å²	89.3	61%	0.608	44%	0.435	S	S	*	.	H	α-helix	trans	-64.7	-37.6	176.7	67.8	0	0	0	0	112	N89 H90 G96	N89-S93 WeakPolarHBondContact O-CB 2.98Å; N89-S93 PolarHBondContact O-N 3.42Å; N89-S93 PolarHBondContact O-OG 2.83Å; H90-S93 PolarHBondContact O-OG 2.89Å; S93-G96 PolarHBondContact O-N 3.33Å
94	Y	78	Confident	75.9	Confident	185 Å²	185	82.6 Å²	82.6	73%	0.725	41%	0.407	S	S	*	.	H	α-helix	trans	-63.2	-39.8	174.6	177.7	-101.5	0	0	0	112.9	H90 W91 L92 G96	H90-Y94 WeakPolarHBondContact O-CB 3.45Å; H90-Y94 PolarHBondContact O-N 3.31Å; H90-Y94 VanDerWaalsContact O-N 3.12Å; W91-Y94 WeakPolarHBondContact O-CB 3.28Å; W91-Y94 PolarHBondContact O-N 3.41Å; L92-Y94 VanDerWaalsContact C-N 3.32Å; L92-Y94 PolarHBondContact O-N 2.82Å; Y94-G96 VanDerWaalsContact C-N 3.34Å
95	I	80.5	Confident	77.3	Confident	75 Å²	75	80.3 Å²	80.3	39%	0.385	40%	0.398	S	S	.	.	H	α-helix	trans	-81.3	-16.7	178.7	-64.9	177.4	0	0	0	112.1	W91 L92 Q97	W91-I95 HydrophobicContact CD2-CD1 3.8Å; W91-I95 HydrophobicContact CE3-CD1 4.37Å; W91-I95 HydrophobicContact CG-CD1 4.36Å; W91-I95 HydrophobicContact CH2-CD1 3.81Å; W91-I95 HydrophobicContact CZ2-CD1 3.18Å; W91-I95 HydrophobicContact CZ3-CD1 4.37Å; W91-I95 WeakPolarHBondContact O-CG1 3.22Å; W91-I95 PolarHBondContact O-N 3.44Å; L92-I95 PolarHBondContact O-N 3.5Å; I95-Q97 HydrophobicContact CG2-CB 4.42Å; I95-Q97 HydrophobicContact CG2-CG 3.91Å
96	G	78.1	Confident	78.5	Confident	67 Å²	67	77.1 Å²	77.1	69%	0.691	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	23.9	-174.7	0	0	0	0	0	113.6	L92 S93 Y94	L92-G96 PolarHBondContact O-N 2.96Å; S93-G96 PolarHBondContact O-N 3.33Å; Y94-G96 VanDerWaalsContact C-N 3.34Å
97	Q	77.4	Confident	79.3	Confident	105 Å²	105	81 Å²	81	49%	0.491	40%	0.398	S	S	.	.			trans	-96.9	147.3	176	-81.9	-179.4	3.7	0	0	111.7	L92 I95	L92-Q97 HydrophobicContact CD2-CB 3.85Å; L92-Q97 PolarHBondContact O-N 3.24Å; I95-Q97 HydrophobicContact CG2-CB 4.42Å; I95-Q97 HydrophobicContact CG2-CG 3.91Å
98	R	75.9	Confident	79.8	Confident	211 Å²	211	82.6 Å²	82.6	80%	0.796	40%	0.404	S	S	*	.			trans	-85.2	154.6	171.5	-68.7	-173.8	177.1	-175.2	-0.4	110.6	D100	R98-D100 PolarHBondContact O-N 3.2Å
99	D	72.5	Confident	80.3	Confident	64 Å²	64	82.6 Å²	82.6	34%	0.342	40%	0.404	S	S	.	.			trans	-75.6	91.7	175.8	-170	23.1	0	0	0	110.1	K88 L92 N103 Y150	K88-D99 IonicContact NZ-OD1 3.64Å; K88-D99 PolarHBondContact NZ-OD1 3.02Å; K88-D99 IonicContact NZ-OD2 3.98Å; K88-D99 PolarHBondContact NZ-OD2 3.5Å; L92-D99 HydrophobicContact CD1-CB 3.9Å; D99-N103 PolarHBondContact OD2-ND2 3.46Å; D99-N103 VanDerWaalsContact OD2-ND2 3.16Å; D99-Y150 PolarHBondContact OD1-OH 3.33Å; D99-Y150 VanDerWaalsContact OD1-OH 3.05Å
100	D	77.8	Confident	80.9	Confident	135 Å²	135	80.7 Å²	80.7	72%	0.722	39%	0.393	S	S	*	.			trans	-95.3	-2.2	-179.2	-61.4	-24.2	0	0	0	113.1	R98	R98-D100 PolarHBondContact O-N 3.2Å
101	R	83.2	Confident	81.5	Confident	36 Å²	36	83.1 Å²	83.1	14%	0.136	40%	0.399	C	S	.	.	S	Bend	trans	-107.7	144.1	-174.2	-58.2	-165.8	-173.9	-170.6	-1.9	111.5	N103 S140 T143 S144 Y150 D154	R101-N103 PolarHBondContact O-N 2.92Å; R101-S140 WeakPolarHBondContact CD-O 3.49Å; R101-S140 PolarHBondContact NE-O 3.45Å; R101-S140 PolarHBondContact NH1-O 3.48Å; R101-T143 WeakPolarHBondContact CD-O 3.42Å; R101-T143 PolarHBondContact NH1-O 2.99Å; R101-S144 PolarHBondContact O-OG 3.33Å; R101-Y150 HydrophobicContact CB-CE1 4.39Å; R101-Y150 HydrophobicContact CG-CE1 4.16Å; R101-Y150 HydrophobicContact CG-CE2 4.3Å; R101-D154 IonicContact CZ-OD1 3.98Å; R101-D154 IonicContact CZ-OD2 3.8Å; R101-D154 IonicContact NH1-OD1 3.82Å; R101-D154 PolarHBondContact NH1-OD1 2.99Å; R101-D154 IonicContact NH1-OD2 2.75Å; R101-D154 PolarHBondContact NH1-OD2 2.85Å; R101-D154 VanDerWaalsContact NH1-OD2 3.16Å; R101-D154 IonicContact NH2-OD1 3.52Å; R101-D154 IonicContact NH2-OD2 2.64Å; R101-D154 PolarHBondContact NH2-OD2 2.84Å
102	Y	81.6	Confident	82	Confident	148 Å²	148	82.7 Å²	82.7	58%	0.58	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	123.6	175.8	-65.2	-82.8	0	0	0	111.8	L104 F124 L142 S144	Y102-L104 PolarHBondContact O-N 3.42Å; Y102-F124 HydrophobicContact CD2-CE1 4.38Å; Y102-F124 AromaticContact CD2-CZ 3.62Å; Y102-F124 HydrophobicContact CD2-CZ 3.62Å; Y102-F124 HydrophobicContact CE2-CZ 4.24Å; Y102-F124 AromaticContact CG-CZ 3.92Å; Y102-F124 HydrophobicContact CG-CZ 3.92Å; Y102-L142 WeakPolarHBondContact CA-O 3.42Å; Y102-L142 VanDerWaalsContact CB-O 3.32Å; Y102-L142 WeakPolarHBondContact CB-O 3.39Å; Y102-L142 WeakPolarHBondContact CD2-O 3.26Å; Y102-L142 HydrophobicContact CE2-CD2 4.41Å; Y102-L142 PolarHBondContact N-O 2.87Å; Y102-S144 PolarHBondContact O-N 2.9Å; Y102-S144 PolarHBondContact O-OG 3.06Å
103	N	81.3	Confident	82.6	Confident	92 Å²	92	82.5 Å²	82.5	49%	0.492	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	111.6	175.3	-78.4	-58.6	0	0	0	111	K88 D99 R101 S144	K88-N103 WeakPolarHBondContact CE-OD1 3.27Å; K88-N103 VanDerWaalsContact NZ-CG 3.32Å; K88-N103 PolarHBondContact NZ-ND2 3.39Å; K88-N103 PolarHBondContact NZ-OD1 3.33Å; D99-N103 PolarHBondContact OD2-ND2 3.46Å; D99-N103 VanDerWaalsContact OD2-ND2 3.16Å; R101-N103 PolarHBondContact O-N 2.92Å; N103-S144 PolarHBondContact OD1-OG 2.78Å; N103-S144 VanDerWaalsContact OD1-OG 3.07Å
104	L	83.7	Confident	83.2	Confident	30 Å²	30	78.5 Å²	78.5	16%	0.157	37%	0.37	C	S	.	.			trans	-105	154.3	172.8	-63.3	180	0	0	0	110.9	Y102 L109 F124 T143 S144	Y102-L104 PolarHBondContact O-N 3.42Å; L104-L109 HydrophobicContact CB-CG 4.26Å; L104-L109 HydrophobicContact CD1-CD2 3.75Å; L104-L109 HydrophobicContact CD1-CG 4.24Å; L104-F124 HydrophobicContact CD1-CD1 3.92Å; L104-F124 HydrophobicContact CD1-CE1 4.13Å; L104-F124 HydrophobicContact CD2-CE1 4.43Å; L104-T143 HydrophobicContact CD1-CG2 3.6Å; L104-S144 PolarHBondContact N-O 3.08Å
105	T	84	Confident	83.7	Confident	76 Å²	76	76.7 Å²	76.7	47%	0.466	36%	0.362	S	S	.	.			trans	-78.9	154	167.8	64.8	0	0	0	0	110.4	Y107 Q108 L109	T105-Y107 VanDerWaalsContact C-N 3.25Å; T105-Y107 PolarHBondContact O-N 3.42Å; T105-Q108 WeakPolarHBondContact O-CB 3.45Å; T105-Q108 PolarHBondContact O-N 3.46Å; T105-Q108 VanDerWaalsContact O-N 3.12Å; T105-Q108 VanDerWaalsContact OG1-CD 3.32Å; T105-Q108 VanDerWaalsContact OG1-CG 3.24Å; T105-Q108 WeakPolarHBondContact OG1-CG 3.3Å; T105-Q108 PolarHBondContact OG1-N 3.48Å; T105-Q108 PolarHBondContact OG1-OE1 3.46Å; T105-L109 PolarHBondContact O-N 3.32Å; T105-L109 VanDerWaalsContact O-N 3.16Å
106	E	85	Confident	84.1	Confident	46 Å²	46	73.2 Å²	73.2	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-58.1	-39.5	176.8	-166.2	170.7	-177.3	0	0	112.2	Q108 L109 I110 H147 T221 M222	E106-Q108 PolarHBondContact O-N 2.95Å; E106-L109 PolarHBondContact O-N 2.8Å; E106-I110 HydrophobicContact CG-CD1 4.16Å; E106-I110 VanDerWaalsContact O-CG1 3.31Å; E106-I110 WeakPolarHBondContact O-CG1 3.42Å; E106-I110 PolarHBondContact O-N 2.94Å; E106-H147 IonicContact OE2-CE1 3.06Å; E106-H147 PolarHBondContact OE2-CE1 3.49Å; E106-H147 IonicContact OE2-NE2 3.78Å; E106-T221 WeakPolarHBondContact OE1-CA 3.41Å; E106-T221 WeakPolarHBondContact OE1-CB 3.32Å; E106-M222 HydrophobicContact CG-CB 4.43Å; E106-M222 HydrophobicContact CG-CE 3.82Å; E106-M222 HydrophobicContact CG-CG 3.69Å; E106-M222 HydrophobicContact CG-SD 4.25Å; E106-M222 PolarHBondContact OE1-N 3.33Å
107	Y	85.3	Confident	84.7	Confident	98 Å²	98	70.2 Å²	70.2	38%	0.384	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-42.3	174.7	174	-102.6	0	0	0	112.9	T105 L109 I110 R111 S214	T105-Y107 VanDerWaalsContact C-N 3.25Å; T105-Y107 PolarHBondContact O-N 3.42Å; Y107-L109 VanDerWaalsContact C-N 3.33Å; Y107-L109 PolarHBondContact O-N 3.49Å; Y107-I110 PolarHBondContact O-N 3.05Å; Y107-R111 PolarHBondContact O-N 3.25Å; Y107-S214 WeakPolarHBondContact CD2-O 3.33Å; Y107-S214 WeakPolarHBondContact CE2-O 3.48Å
108	Q	86.5	Confident	85.3	Confident	88 Å²	88	67.1 Å²	67.1	41%	0.411	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-44.2	176.1	-76.9	165.5	-26	0	0	110.9	T105 E106 R111 E112	T105-Q108 WeakPolarHBondContact O-CB 3.45Å; T105-Q108 PolarHBondContact O-N 3.46Å; T105-Q108 VanDerWaalsContact O-N 3.12Å; T105-Q108 VanDerWaalsContact OG1-CD 3.32Å; T105-Q108 VanDerWaalsContact OG1-CG 3.24Å; T105-Q108 WeakPolarHBondContact OG1-CG 3.3Å; T105-Q108 PolarHBondContact OG1-N 3.48Å; T105-Q108 PolarHBondContact OG1-OE1 3.46Å; E106-Q108 PolarHBondContact O-N 2.95Å; Q108-R111 PolarHBondContact O-N 3.27Å; Q108-E112 VanDerWaalsContact O-CG 3.25Å; Q108-E112 WeakPolarHBondContact O-CG 3.49Å; Q108-E112 PolarHBondContact O-N 3.24Å
109	L	87.5	Confident	85.7	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-42.3	176	-74.8	175.1	0	0	0	112.5	L104 T105 E106 Y107 R111 E112 I113 A125 V145 L153 M222	L104-L109 HydrophobicContact CB-CG 4.26Å; L104-L109 HydrophobicContact CD1-CD2 3.75Å; L104-L109 HydrophobicContact CD1-CG 4.24Å; T105-L109 PolarHBondContact O-N 3.32Å; T105-L109 VanDerWaalsContact O-N 3.16Å; E106-L109 PolarHBondContact O-N 2.8Å; Y107-L109 VanDerWaalsContact C-N 3.33Å; Y107-L109 PolarHBondContact O-N 3.49Å; L109-R111 VanDerWaalsContact C-N 3.3Å; L109-R111 PolarHBondContact O-N 3.45Å; L109-E112 PolarHBondContact O-N 2.95Å; L109-I113 WeakPolarHBondContact O-CB 3.26Å; L109-I113 WeakPolarHBondContact O-CD1 3.32Å; L109-I113 WeakPolarHBondContact O-CG1 3.49Å; L109-I113 PolarHBondContact O-N 3.42Å; L109-A125 HydrophobicContact CD2-CB 4.09Å; L109-V145 HydrophobicContact CD1-CG2 3.2Å; L109-L153 HydrophobicContact CD1-CD1 3.92Å; L109-M222 HydrophobicContact CB-SD 3.98Å; L109-M222 HydrophobicContact CD1-CE 4.39Å; L109-M222 HydrophobicContact CD1-SD 3.81Å
110	I	89.3	Confident	86.2	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-56.8	-45.8	175.3	-72.4	162.6	0	0	0	110.7	E106 Y107 I113 I114 F220 M222 L225	E106-I110 HydrophobicContact CG-CD1 4.16Å; E106-I110 VanDerWaalsContact O-CG1 3.31Å; E106-I110 WeakPolarHBondContact O-CG1 3.42Å; E106-I110 PolarHBondContact O-N 2.94Å; Y107-I110 PolarHBondContact O-N 3.05Å; I110-I113 PolarHBondContact O-N 3.23Å; I110-I114 HydrophobicContact CG2-CD1 3.9Å; I110-I114 WeakPolarHBondContact O-CG1 3.4Å; I110-I114 PolarHBondContact O-N 3.46Å; I110-F220 HydrophobicContact CD1-CD1 4.11Å; I110-F220 HydrophobicContact CG2-CD1 4.37Å; I110-F220 HydrophobicContact CG2-CE1 4.14Å; I110-M222 HydrophobicContact CD1-CG 4.35Å; I110-M222 HydrophobicContact CG1-CG 3.84Å; I110-L225 HydrophobicContact CG1-CD2 4.32Å; I110-L225 HydrophobicContact CG2-CD2 4.17Å
111	R	88.2	Confident	86.1	Confident	137 Å²	137	59.1 Å²	59.1	52%	0.517	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-44.2	177.4	-173.3	-177	178.2	-169.3	-1.3	112.2	Y107 Q108 L109 I113 I114 W115	Y107-R111 PolarHBondContact O-N 3.25Å; Q108-R111 PolarHBondContact O-N 3.27Å; L109-R111 VanDerWaalsContact C-N 3.3Å; L109-R111 PolarHBondContact O-N 3.45Å; R111-I113 VanDerWaalsContact C-N 3.33Å; R111-I113 PolarHBondContact O-N 3.41Å; R111-I114 PolarHBondContact O-N 3.01Å; R111-W115 VanDerWaalsContact O-CB 3.28Å; R111-W115 WeakPolarHBondContact O-CB 3.05Å; R111-W115 PolarHBondContact O-N 3.43Å
112	E	88.4	Confident	85.7	Confident	48 Å²	48	58.8 Å²	58.8	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-38.2	176.8	-66.9	-71.5	113.3	0	0	112	Q108 L109 V116 C123 F124	Q108-E112 VanDerWaalsContact O-CG 3.25Å; Q108-E112 WeakPolarHBondContact O-CG 3.49Å; Q108-E112 PolarHBondContact O-N 3.24Å; L109-E112 PolarHBondContact O-N 2.95Å; E112-V116 WeakPolarHBondContact O-CG2 3.5Å; E112-V116 PolarHBondContact O-N 3.45Å; E112-V116 VanDerWaalsContact O-N 3.13Å; E112-C123 HydrophobicContact CB-CB 4.49Å; E112-C123 WeakPolarHBondContact OE2-CB 3.28Å; E112-C123 PolarHBondContact OE2-SG 3.16Å; E112-F124 PolarHBondContact OE2-N 2.83Å
113	I	90.5	Very high	85.5	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-64.7	-50.8	176.6	-70.1	160.9	0	0	0	110.3	L109 I110 R111 W115 V116 L117 M126 L157 F160 L225	L109-I113 WeakPolarHBondContact O-CB 3.26Å; L109-I113 WeakPolarHBondContact O-CD1 3.32Å; L109-I113 WeakPolarHBondContact O-CG1 3.49Å; L109-I113 PolarHBondContact O-N 3.42Å; I110-I113 PolarHBondContact O-N 3.23Å; R111-I113 VanDerWaalsContact C-N 3.33Å; R111-I113 PolarHBondContact O-N 3.41Å; I113-W115 VanDerWaalsContact C-N 3.31Å; I113-W115 PolarHBondContact O-N 3.05Å; I113-V116 PolarHBondContact O-N 2.86Å; I113-L117 HydrophobicContact CG2-CD1 3.81Å; I113-L117 HydrophobicContact CG2-CG 4.39Å; I113-L117 VanDerWaalsContact O-CG 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.4Å; I113-L117 PolarHBondContact O-N 3.34Å; I113-M126 HydrophobicContact CG1-CE 3.81Å; I113-L157 HydrophobicContact CD1-CD2 4.06Å; I113-L157 HydrophobicContact CG1-CD2 4.35Å; I113-F160 HydrophobicContact CD1-CD2 3.8Å; I113-F160 HydrophobicContact CD1-CE2 3.82Å; I113-F160 HydrophobicContact CD1-CG 4.34Å; I113-F160 HydrophobicContact CD1-CZ 4.38Å; I113-F160 HydrophobicContact CG1-CD2 4.31Å; I113-F160 HydrophobicContact CG1-CG 4.43Å; I113-F160 HydrophobicContact CG2-CB 4.09Å; I113-F160 HydrophobicContact CG2-CD1 3.58Å; I113-F160 HydrophobicContact CG2-CD2 4.28Å; I113-F160 HydrophobicContact CG2-CE1 4.02Å; I113-F160 HydrophobicContact CG2-CG 3.73Å; I113-L225 HydrophobicContact CB-CD2 4.32Å; I113-L225 HydrophobicContact CD1-CD2 4.45Å; I113-L225 HydrophobicContact CG2-CD2 3.9Å
114	I	91.4	Very high	85.3	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-61	-42.4	179.5	-67.4	170.8	0	0	0	110.6	I110 R111 V116 L117 L118 L207 M210 E211 L225	I110-I114 HydrophobicContact CG2-CD1 3.9Å; I110-I114 WeakPolarHBondContact O-CG1 3.4Å; I110-I114 PolarHBondContact O-N 3.46Å; R111-I114 PolarHBondContact O-N 3.01Å; I114-V116 VanDerWaalsContact C-N 3.32Å; I114-V116 PolarHBondContact O-N 3.21Å; I114-L117 PolarHBondContact O-N 2.87Å; I114-L118 HydrophobicContact CG2-CD1 4.07Å; I114-L118 HydrophobicContact CG2-CG 4.39Å; I114-L118 WeakPolarHBondContact O-CG 3.35Å; I114-L118 PolarHBondContact O-N 3.31Å; I114-L207 HydrophobicContact CG2-CB 4.35Å; I114-M210 HydrophobicContact CD1-CB 4.29Å; I114-E211 HydrophobicContact CD1-CB 4.22Å; I114-E211 HydrophobicContact CG2-CB 4.34Å; I114-L225 HydrophobicContact CD1-CD1 4.31Å; I114-L225 HydrophobicContact CG1-CD1 4.3Å
115	W	89.5	Confident	84.8	Confident	148 Å²	148	51 Å²	51	56%	0.561	24%	0.24	S	C	*	.	H	α-helix	trans	-57.6	-43.1	177.2	-176	-95.5	0	0	0	112.8	R111 I113 A120	R111-W115 VanDerWaalsContact O-CB 3.28Å; R111-W115 WeakPolarHBondContact O-CB 3.05Å; R111-W115 PolarHBondContact O-N 3.43Å; I113-W115 VanDerWaalsContact C-N 3.31Å; I113-W115 PolarHBondContact O-N 3.05Å; W115-A120 HydrophobicContact CG-CB 4.06Å; W115-A120 WeakPolarHBondContact O-CB 3.39Å; W115-A120 PolarHBondContact O-N 2.65Å
116	V	88.7	Confident	84.6	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-67.3	-45.1	176.4	170.4	0	0	0	0	110.9	E112 I113 I114 L118 G119 A120 C123 M126 I136 N164	E112-V116 WeakPolarHBondContact O-CG2 3.5Å; E112-V116 PolarHBondContact O-N 3.45Å; E112-V116 VanDerWaalsContact O-N 3.13Å; I113-V116 PolarHBondContact O-N 2.86Å; I114-V116 VanDerWaalsContact C-N 3.32Å; I114-V116 PolarHBondContact O-N 3.21Å; V116-L118 VanDerWaalsContact C-N 3.28Å; V116-L118 PolarHBondContact O-N 3.37Å; V116-G119 WeakPolarHBondContact O-CA 3.45Å; V116-G119 PolarHBondContact O-N 2.83Å; V116-A120 PolarHBondContact O-N 3.37Å; V116-C123 HydrophobicContact CG2-CB 3.74Å; V116-C123 WeakPolarHBondContact CG2-SG 3.33Å; V116-M126 HydrophobicContact CB-SD 4.44Å; V116-M126 HydrophobicContact CG1-SD 4.25Å; V116-M126 HydrophobicContact CG2-CB 4.31Å; V116-M126 HydrophobicContact CG2-SD 4.34Å; V116-I136 HydrophobicContact CG1-CD1 3.85Å; V116-I136 HydrophobicContact CG1-CG2 4.47Å; V116-N164 HydrophobicContact CG1-CB 4.08Å; V116-N164 WeakPolarHBondContact CG1-ND2 3.4Å; V116-N164 PolarHBondContact O-OD1 3.25Å
117	L	90.4	Very high	84.3	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-31	178.6	-67.2	171.3	0	0	0	113.6	I113 I114 G119 N164 I167 L207 L229	I113-L117 HydrophobicContact CG2-CD1 3.81Å; I113-L117 HydrophobicContact CG2-CG 4.39Å; I113-L117 VanDerWaalsContact O-CG 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.4Å; I113-L117 PolarHBondContact O-N 3.34Å; I114-L117 PolarHBondContact O-N 2.87Å; L117-G119 PolarHBondContact O-N 3.08Å; L117-N164 HydrophobicContact CD2-CB 3.93Å; L117-I167 HydrophobicContact CB-CD1 4.44Å; L117-I167 HydrophobicContact CD2-CD1 3.68Å; L117-L207 HydrophobicContact CB-CD1 3.77Å; L117-L207 HydrophobicContact CB-CD2 4.12Å; L117-L207 HydrophobicContact CD1-CD2 3.99Å; L117-L229 HydrophobicContact CD1-CD1 3.69Å
118	L	90.8	Very high	83.6	Confident	40 Å²	40	46.7 Å²	46.7	21%	0.209	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-7.6	171.5	-73.1	169.8	0	0	0	113.2	I114 V116 R171 D204 L207	I114-L118 HydrophobicContact CG2-CD1 4.07Å; I114-L118 HydrophobicContact CG2-CG 4.39Å; I114-L118 WeakPolarHBondContact O-CG 3.35Å; I114-L118 PolarHBondContact O-N 3.31Å; V116-L118 VanDerWaalsContact C-N 3.28Å; V116-L118 PolarHBondContact O-N 3.37Å; L118-R171 PolarHBondContact O-NH2 2.76Å; L118-D204 HydrophobicContact CD2-CB 4.14Å; L118-L207 HydrophobicContact CD2-CB 3.87Å; L118-L207 HydrophobicContact CD2-CD1 3.94Å; L118-L207 HydrophobicContact CG-CB 4.35Å; L118-L207 HydrophobicContact CG-CD1 4.19Å
119	G	83.9	Confident	82.9	Confident	24 Å²	24	44.6 Å²	44.6	25%	0.247	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	110.4	12.2	174.3	0	0	0	0	0	114.9	V116 L117 R121	V116-G119 WeakPolarHBondContact O-CA 3.45Å; V116-G119 PolarHBondContact O-N 2.83Å; L117-G119 PolarHBondContact O-N 3.08Å; G119-R121 PolarHBondContact O-N 2.9Å
120	A	83.5	Confident	81.5	Confident	20 Å²	20	54.2 Å²	54.2	17%	0.165	26%	0.255	C	S	.	.			trans	-66.5	134.8	174.8	0	0	0	0	0	111.6	W115 V116 G122	W115-A120 HydrophobicContact CG-CB 4.06Å; W115-A120 WeakPolarHBondContact O-CB 3.39Å; W115-A120 PolarHBondContact O-N 2.65Å; V116-A120 PolarHBondContact O-N 3.37Å; A120-G122 PolarHBondContact O-N 3.33Å
121	R	75	Confident	80	Confident	197 Å²	197	61.6 Å²	61.6	74%	0.743	30%	0.295	S	S	*	.	S	Bend	trans	-74.5	-1.9	-178.9	-61.7	-177.1	179.4	175	0.3	113.9	G119 L128	G119-R121 PolarHBondContact O-N 2.9Å; R121-L128 VanDerWaalsContact O-CB 3.24Å; R121-L128 WeakPolarHBondContact O-CB 3.26Å; R121-L128 PolarHBondContact O-N 3.2Å; R121-L128 VanDerWaalsContact O-N 3.13Å
122	G	74.4	Confident	78.6	Confident	29 Å²	29	60.2 Å²	60.2	30%	0.299	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	174.5	158.9	177.1	0	0	0	0	0	112.8	A120 M126	A120-G122 PolarHBondContact O-N 3.33Å; G122-M126 CarbonylContact C-O 3.48Å; G122-M126 WeakPolarHBondContact CA-O 3.27Å
123	C	78.6	Confident	77.3	Confident	21 Å²	21	64.5 Å²	64.5	14%	0.142	32%	0.317	C	S	.	.			trans	-148.3	-176	179.4	80.2	0	0	0	0	108.3	E112 V116 M126	E112-C123 HydrophobicContact CB-CB 4.49Å; E112-C123 WeakPolarHBondContact OE2-CB 3.28Å; E112-C123 PolarHBondContact OE2-SG 3.16Å; V116-C123 HydrophobicContact CG2-CB 3.74Å; V116-C123 WeakPolarHBondContact CG2-SG 3.33Å; C123-M126 CarbonylContact C-O 3.55Å; C123-M126 PolarHBondContact N-O 3.43Å; C123-M126 PolarHBondContact SG-N 2.64Å
124	F	76.3	Confident	76	Confident	85 Å²	85	65.9 Å²	65.9	37%	0.373	33%	0.326	S	S	.	.	S	Bend	trans	-66.6	-40.8	179.4	-178.3	-99.3	0	0	0	111.6	Y102 L104 E112 T143	Y102-F124 HydrophobicContact CD2-CE1 4.38Å; Y102-F124 AromaticContact CD2-CZ 3.62Å; Y102-F124 HydrophobicContact CD2-CZ 3.62Å; Y102-F124 HydrophobicContact CE2-CZ 4.24Å; Y102-F124 AromaticContact CG-CZ 3.92Å; Y102-F124 HydrophobicContact CG-CZ 3.92Å; L104-F124 HydrophobicContact CD1-CD1 3.92Å; L104-F124 HydrophobicContact CD1-CE1 4.13Å; L104-F124 HydrophobicContact CD2-CE1 4.43Å; E112-F124 PolarHBondContact OE2-N 2.83Å; F124-T143 HydrophobicContact CD1-CG2 3.79Å; F124-T143 HydrophobicContact CE1-CG2 3.74Å
125	A	74.6	Confident	75.1	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.008	34%	0.338	C	S	.	.	S	Bend	trans	-84.1	-24.1	-177.7	0	0	0	0	0	114.1	L109 K139 T143	L109-A125 HydrophobicContact CD2-CB 4.09Å; A125-K139 PolarHBondContact O-N 3Å; A125-T143 HydrophobicContact CB-CG2 3.93Å
126	M	79.7	Confident	74.3	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	138.7	-170.8	-53.5	178.1	-178.4	0	0	110.1	I113 V116 G122 C123 I136 C137 L157 F160 V161	I113-M126 HydrophobicContact CG1-CE 3.81Å; V116-M126 HydrophobicContact CB-SD 4.44Å; V116-M126 HydrophobicContact CG1-SD 4.25Å; V116-M126 HydrophobicContact CG2-CB 4.31Å; V116-M126 HydrophobicContact CG2-SD 4.34Å; G122-M126 CarbonylContact C-O 3.48Å; G122-M126 WeakPolarHBondContact CA-O 3.27Å; C123-M126 CarbonylContact C-O 3.55Å; C123-M126 PolarHBondContact N-O 3.43Å; C123-M126 PolarHBondContact SG-N 2.64Å; M126-I136 HydrophobicContact CB-CG2 3.75Å; M126-C137 WeakPolarHBondContact CA-O 3.33Å; M126-L157 HydrophobicContact CE-CB 4.22Å; M126-L157 HydrophobicContact CE-CD2 3.69Å; M126-F160 HydrophobicContact CE-CB 4.22Å; M126-V161 HydrophobicContact CE-CG2 4.08Å; M126-V161 HydrophobicContact CG-CG2 4.07Å; M126-V161 HydrophobicContact SD-CG2 3.62Å
127	Q	78.5	Confident	73.7	Confident	85 Å²	85	62.8 Å²	62.8	40%	0.397	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	145.8	178.5	178.6	174.4	7.4	0	0	111.3	C129 C137	Q127-C129 PolarHBondContact O-N 3.23Å; Q127-C137 PolarHBondContact N-O 3.21Å; Q127-C137 PolarHBondContact O-N 3.46Å
128	L	70.9	Confident	72.7	Confident	42 Å²	42	63.8 Å²	63.8	22%	0.22	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	125	169.4	-166.5	78.6	0	0	0	110.8	R121 K130 Q132 I136	R121-L128 VanDerWaalsContact O-CB 3.24Å; R121-L128 WeakPolarHBondContact O-CB 3.26Å; R121-L128 PolarHBondContact O-N 3.2Å; R121-L128 VanDerWaalsContact O-N 3.13Å; L128-K130 PolarHBondContact O-N 2.68Å; L128-Q132 WeakPolarHBondContact CD2-O 3.44Å; L128-Q132 WeakPolarHBondContact CG-O 3.36Å; L128-I136 HydrophobicContact CB-CG1 4.38Å; L128-I136 HydrophobicContact CD1-CG1 3.99Å
129	C	70.5	Confident	71.8	Confident	45 Å²	45	64.2 Å²	64.2	30%	0.304	33%	0.33	S	S	.	.			trans	-62.7	129.2	173.8	-93.1	0	0	0	0	109.2	Q127 N131 Q132 D135 C137	Q127-C129 PolarHBondContact O-N 3.23Å; C129-N131 PolarHBondContact O-N 2.97Å; C129-Q132 PolarHBondContact O-N 2.79Å; C129-D135 WeakPolarHBondContact CB-O 3.42Å; C129-D135 PolarHBondContact N-O 2.74Å; C129-C137 HydrophobicContact CB-CB 4.48Å; C129-C137 WeakPolarHBondContact CB-SG 3.29Å; C129-C137 WeakPolarHBondContact SG-CB 3.43Å; C129-C137 CovalentContact SG-SG 2.06Å; C129-C137 PolarHBondContact SG-SG 3.3Å
130	K	57.8	Low	70.9	Confident	202 Å²	202	64.6 Å²	64.6	88%	0.878	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-16.7	-164.1	-72.4	-176.6	177.5	179.6	0	116.5	L128	L128-K130 PolarHBondContact O-N 2.68Å
131	N	57.7	Low	70.3	Confident	158 Å²	158	69.4 Å²	69.4	85%	0.845	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	8	-174.7	-66.8	1.9	0	0	0	114	C129	C129-N131 PolarHBondContact O-N 2.97Å
132	Q	60.2	Low	70.4	Confident	108 Å²	108	62 Å²	62	51%	0.505	32%	0.323	S	S	.	.			trans	-131.9	143.8	-176.2	-60.9	-165	19.8	0	0	111.7	L128 C129 D135	L128-Q132 WeakPolarHBondContact CD2-O 3.44Å; L128-Q132 WeakPolarHBondContact CG-O 3.36Å; C129-Q132 PolarHBondContact O-N 2.79Å; Q132-D135 HydrophobicContact CB-CB 3.8Å; Q132-D135 HydrophobicContact CG-CB 4.34Å; Q132-D135 PolarHBondContact OE1-OD2 3Å
133	I	61.2	Low	70.8	Confident	137 Å²	137	60.6 Å²	60.6	70%	0.703	31%	0.308	S	S	*	.	S	Bend	trans	-82.6	-22	-175.9	-42.4	176.2	0	0	0	111.7	L172	I133-L172 HydrophobicContact CB-CD1 3.78Å; I133-L172 HydrophobicContact CG2-CD1 3.33Å; I133-L172 HydrophobicContact CG2-CG 4.45Å
134	V	62.7	Low	71	Confident	32 Å²	32	59.6 Å²	59.6	19%	0.194	30%	0.302	C	S	.	.	S	Bend	trans	-124.2	-11.1	-169.7	-175	0	0	0	0	113.3	I136 N165 L168 F169 L172	V134-I136 PolarHBondContact O-N 3Å; V134-N165 HydrophobicContact CG1-CB 4.43Å; V134-N165 WeakPolarHBondContact CG1-O 3.06Å; V134-N165 VanDerWaalsContact O-CG 3.25Å; V134-N165 PolarHBondContact O-OD1 3.49Å; V134-L168 HydrophobicContact CG1-CB 4.18Å; V134-F169 HydrophobicContact CG1-CB 3.86Å; V134-F169 HydrophobicContact CG2-CD2 4.47Å; V134-L172 HydrophobicContact CG2-CD1 3.5Å; V134-L172 VanDerWaalsContact CG2-CD1 3.5Å
135	D	71.6	Confident	71.4	Confident	48 Å²	48	55.7 Å²	55.7	26%	0.257	29%	0.285	S	S	.	.			trans	-96.8	96.2	-171	-164.2	26.3	0	0	0	111.5	C129 Q132 N165	C129-D135 WeakPolarHBondContact CB-O 3.42Å; C129-D135 PolarHBondContact N-O 2.74Å; Q132-D135 HydrophobicContact CB-CB 3.8Å; Q132-D135 HydrophobicContact CG-CB 4.34Å; Q132-D135 PolarHBondContact OE1-OD2 3Å; D135-N165 PolarHBondContact OD1-ND2 3.1Å
136	I	74.6	Confident	71.6	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	139.6	167.5	-72.9	-164.4	0	0	0	108.5	V116 M126 L128 V134 V161 N164 N165 L168	V116-I136 HydrophobicContact CG1-CD1 3.85Å; V116-I136 HydrophobicContact CG1-CG2 4.47Å; M126-I136 HydrophobicContact CB-CG2 3.75Å; L128-I136 HydrophobicContact CB-CG1 4.38Å; L128-I136 HydrophobicContact CD1-CG1 3.99Å; V134-I136 PolarHBondContact O-N 3Å; I136-V161 HydrophobicContact CG2-CG1 4.43Å; I136-V161 HydrophobicContact CG2-CG2 4.23Å; I136-V161 WeakPolarHBondContact O-CG1 3.49Å; I136-N164 VanDerWaalsContact CD1-ND2 3.29Å; I136-N164 WeakPolarHBondContact CD1-ND2 2.97Å; I136-N165 PolarHBondContact N-OD1 2.91Å; I136-L168 HydrophobicContact CD1-CD1 3.69Å; I136-L168 HydrophobicContact CG1-CD1 3.86Å
137	C	74.7	Confident	71.7	Confident	37 Å²	37	60.2 Å²	60.2	25%	0.25	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.4	-176.6	-60.8	0	0	0	0	108.8	M126 Q127 C129 K139	M126-C137 WeakPolarHBondContact CA-O 3.33Å; Q127-C137 PolarHBondContact N-O 3.21Å; Q127-C137 PolarHBondContact O-N 3.46Å; C129-C137 HydrophobicContact CB-CB 4.48Å; C129-C137 WeakPolarHBondContact CB-SG 3.29Å; C129-C137 WeakPolarHBondContact SG-CB 3.43Å; C129-C137 CovalentContact SG-SG 2.06Å; C129-C137 PolarHBondContact SG-SG 3.3Å; C137-K139 PolarHBondContact O-N 3.18Å
138	C	69.9	Low	71.9	Confident	26 Å²	26	58.2 Å²	58.2	18%	0.176	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	130	172.1	-66.7	0	0	0	0	109.6	S140 V161	C138-S140 PolarHBondContact O-N 3.12Å; C138-V161 WeakPolarHBondContact SG-CG2 3.4Å
139	K	72.6	Confident	72.5	Confident	48 Å²	48	57.6 Å²	57.6	21%	0.209	30%	0.303	C	S	.	.			trans	-82.2	59.1	162	-62.3	-171.5	-172.1	166.2	0	109.5	A125 C137 H141 L142	A125-K139 PolarHBondContact O-N 3Å; C137-K139 PolarHBondContact O-N 3.18Å; K139-H141 PolarHBondContact O-N 3.25Å; K139-L142 HydrophobicContact CB-CB 4.34Å; K139-L142 HydrophobicContact CB-CD1 3.99Å; K139-L142 HydrophobicContact CB-CG 4.18Å; K139-L142 HydrophobicContact CD-CD1 3.48Å; K139-L142 VanDerWaalsContact CD-CD1 3.48Å; K139-L142 HydrophobicContact CD-CG 4.48Å; K139-L142 HydrophobicContact CG-CD1 4.38Å; K139-L142 PolarHBondContact O-N 3.28Å
140	S	64.4	Low	73.2	Confident	32 Å²	32	56.2 Å²	56.2	22%	0.224	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-47.6	-42.1	-177.9	45.6	0	0	0	0	111.9	R101 C138 L142 T143 D154	R101-S140 WeakPolarHBondContact CD-O 3.49Å; R101-S140 PolarHBondContact NE-O 3.45Å; R101-S140 PolarHBondContact NH1-O 3.48Å; C138-S140 PolarHBondContact O-N 3.12Å; S140-L142 PolarHBondContact O-N 3.01Å; S140-T143 PolarHBondContact O-N 3.37Å; S140-D154 WeakPolarHBondContact CA-OD1 2.95Å; S140-D154 WeakPolarHBondContact CB-OD1 3.19Å; S140-D154 WeakPolarHBondContact CB-OD2 3.4Å
141	H	70.9	Confident	74.4	Confident	121 Å²	121	51.7 Å²	51.7	56%	0.56	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-63	-9.1	179.4	65.8	-82.6	0	0	0	116.1	K139	K139-H141 PolarHBondContact O-N 3.25Å
142	L	77.8	Confident	75.8	Confident	42 Å²	42	46.1 Å²	46.1	22%	0.22	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-104.8	-24.6	-178.1	-65.2	-176.7	0	0	0	114.4	Y102 K139 S140	Y102-L142 WeakPolarHBondContact CA-O 3.42Å; Y102-L142 VanDerWaalsContact CB-O 3.32Å; Y102-L142 WeakPolarHBondContact CB-O 3.39Å; Y102-L142 WeakPolarHBondContact CD2-O 3.26Å; Y102-L142 HydrophobicContact CE2-CD2 4.41Å; Y102-L142 PolarHBondContact N-O 2.87Å; K139-L142 HydrophobicContact CB-CB 4.34Å; K139-L142 HydrophobicContact CB-CD1 3.99Å; K139-L142 HydrophobicContact CB-CG 4.18Å; K139-L142 HydrophobicContact CD-CD1 3.48Å; K139-L142 VanDerWaalsContact CD-CD1 3.48Å; K139-L142 HydrophobicContact CD-CG 4.48Å; K139-L142 HydrophobicContact CG-CD1 4.38Å; K139-L142 PolarHBondContact O-N 3.28Å; S140-L142 PolarHBondContact O-N 3.01Å
143	T	82.7	Confident	77.1	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.1	-167.1	55.7	0	0	0	0	112.5	R101 L104 F124 A125 S140	R101-T143 WeakPolarHBondContact CD-O 3.42Å; R101-T143 PolarHBondContact NH1-O 2.99Å; L104-T143 HydrophobicContact CD1-CG2 3.6Å; F124-T143 HydrophobicContact CD1-CG2 3.79Å; F124-T143 HydrophobicContact CE1-CG2 3.74Å; A125-T143 HydrophobicContact CB-CG2 3.93Å; S140-T143 PolarHBondContact O-N 3.37Å
144	S	82.5	Confident	78.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	158.9	170.9	64.7	0	0	0	0	111.9	K88 R101 Y102 N103 L104	K88-S144 PolarHBondContact NZ-OG 2.75Å; R101-S144 PolarHBondContact O-OG 3.33Å; Y102-S144 PolarHBondContact O-N 2.9Å; Y102-S144 PolarHBondContact O-OG 3.06Å; N103-S144 PolarHBondContact OD1-OG 2.78Å; N103-S144 VanDerWaalsContact OD1-OG 3.07Å; L104-S144 PolarHBondContact N-O 3.08Å
145	V	84	Confident	79.5	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.018	21%	0.212	C	C	.	.			trans	-128.5	146.1	174.8	-174.4	0	0	0	0	108.3	L109 H147 L153 M222	L109-V145 HydrophobicContact CD1-CG2 3.2Å; V145-H147 WeakPolarHBondContact CG1-CE1 3.31Å; V145-H147 WeakPolarHBondContact CG1-ND1 3.47Å; V145-H147 PolarHBondContact O-N 2.93Å; V145-L153 HydrophobicContact CG2-CD1 3.99Å; V145-L153 HydrophobicContact CG2-CD2 3.93Å; V145-M222 HydrophobicContact CG2-CE 4.49Å
146	S	80	Confident	80.3	Confident	59 Å²	59	35.4 Å²	35.4	41%	0.413	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.1	-175.1	54.5	0	0	0	0	115	S86 L87 K88	S86-S146 WeakPolarHBondContact CB-O 3.48Å; L87-S146 PolarHBondContact N-O 3.42Å; K88-S146 PolarHBondContact N-O 2.95Å
147	H	80.2	Confident	81	Confident	39 Å²	39	35.4 Å²	35.4	18%	0.181	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	5.5	-169.3	65.4	-100.2	0	0	0	114.9	Q70 L87 E106 V145	Q70-H147 VanDerWaalsContact CD-CB 3.45Å; Q70-H147 VanDerWaalsContact OE1-CB 3.29Å; L87-H147 WeakPolarHBondContact CD2-O 3.32Å; E106-H147 IonicContact OE2-CE1 3.06Å; E106-H147 PolarHBondContact OE2-CE1 3.49Å; E106-H147 IonicContact OE2-NE2 3.78Å; V145-H147 WeakPolarHBondContact CG1-CE1 3.31Å; V145-H147 WeakPolarHBondContact CG1-ND1 3.47Å; V145-H147 PolarHBondContact O-N 2.93Å
148	L	84	Confident	81.7	Confident	43 Å²	43	41.2 Å²	41.2	23%	0.225	22%	0.222	C	C	.	.	S	Bend	trans	-133.1	151.3	179.6	-66.9	174.3	0	0	0	111.2	A152 L153 M222	L148-A152 HydrophobicContact CD2-CB 4.44Å; L148-L153 HydrophobicContact CB-CB 4.46Å; L148-L153 HydrophobicContact CD1-CB 4.49Å; L148-L153 HydrophobicContact CD1-CD1 4.45Å; L148-M222 HydrophobicContact CD1-CE 4.01Å
149	S	83.6	Confident	82.6	Confident	29 Å²	29	44.4 Å²	44.4	20%	0.203	23%	0.233	C	C	.	.			trans	-68.8	160.1	163.9	64.8	0	0	0	0	110.7	D151 A152 L153	S149-D151 VanDerWaalsContact C-N 3.34Å; S149-D151 PolarHBondContact O-N 3.42Å; S149-A152 PolarHBondContact O-N 3.37Å; S149-A152 VanDerWaalsContact OG-CB 3.32Å; S149-A152 WeakPolarHBondContact OG-CB 3.2Å; S149-A152 PolarHBondContact OG-N 2.97Å; S149-L153 PolarHBondContact O-N 3.02Å; S149-L153 VanDerWaalsContact O-N 3.1Å
150	Y	84.8	Confident	83.5	Confident	15 Å²	15	42.2 Å²	42.2	6%	0.059	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-45.9	176.5	-68.6	-13.3	0	0	0	112.1	K88 W91 L92 D99 R101 A152 L153 D154	K88-Y150 HydrophobicContact CD-CE1 4.07Å; K88-Y150 HydrophobicContact CG-CE1 4.3Å; W91-Y150 AromaticContact CH2-CD2 3.81Å; W91-Y150 HydrophobicContact CH2-CD2 3.81Å; W91-Y150 AromaticContact CH2-CG 3.89Å; W91-Y150 HydrophobicContact CH2-CG 3.89Å; W91-Y150 HydrophobicContact CZ3-CD1 4.16Å; W91-Y150 AromaticContact CZ3-CD2 3.57Å; W91-Y150 HydrophobicContact CZ3-CD2 3.57Å; W91-Y150 HydrophobicContact CZ3-CE2 4.06Å; W91-Y150 AromaticContact CZ3-CG 3.63Å; W91-Y150 HydrophobicContact CZ3-CG 3.63Å; L92-Y150 WeakPolarHBondContact CD1-OH 3.36Å; L92-Y150 HydrophobicContact CD2-CD2 4.39Å; L92-Y150 HydrophobicContact CD2-CE2 3.61Å; D99-Y150 PolarHBondContact OD1-OH 3.33Å; D99-Y150 VanDerWaalsContact OD1-OH 3.05Å; R101-Y150 HydrophobicContact CB-CE1 4.39Å; R101-Y150 HydrophobicContact CG-CE1 4.16Å; R101-Y150 HydrophobicContact CG-CE2 4.3Å; Y150-A152 VanDerWaalsContact C-N 3.34Å; Y150-A152 PolarHBondContact O-N 3.18Å; Y150-L153 PolarHBondContact O-N 2.98Å; Y150-D154 VanDerWaalsContact O-CB 3.29Å; Y150-D154 WeakPolarHBondContact O-CB 3.32Å; Y150-D154 PolarHBondContact O-N 3.06Å
151	D	83	Confident	84.6	Confident	107 Å²	107	41.2 Å²	41.2	57%	0.572	22%	0.216	S	C	*	.	H	α-helix	trans	-65.2	-36.6	-178.3	-60.8	-42.8	0	0	0	112.7	S149 S155	S149-D151 VanDerWaalsContact C-N 3.34Å; S149-D151 PolarHBondContact O-N 3.42Å; D151-S155 WeakPolarHBondContact O-CB 3.06Å; D151-S155 PolarHBondContact O-N 2.84Å; D151-S155 PolarHBondContact O-OG 3.14Å
152	A	85.7	Confident	85.4	Confident	42 Å²	42	38.7 Å²	38.7	35%	0.347	21%	0.206	S	C	.	.	H	α-helix	trans	-68.3	-45.4	178.2	0	0	0	0	0	111.5	L148 S149 Y150 S155 L156	L148-A152 HydrophobicContact CD2-CB 4.44Å; S149-A152 PolarHBondContact O-N 3.37Å; S149-A152 VanDerWaalsContact OG-CB 3.32Å; S149-A152 WeakPolarHBondContact OG-CB 3.2Å; S149-A152 PolarHBondContact OG-N 2.97Å; Y150-A152 VanDerWaalsContact C-N 3.34Å; Y150-A152 PolarHBondContact O-N 3.18Å; A152-S155 PolarHBondContact O-N 2.91Å; A152-L156 PolarHBondContact O-N 3.04Å
153	L	87.8	Confident	85.9	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-48.6	175.3	177.8	64.1	0	0	0	111	L109 V145 L148 S149 Y150 S155 L156 L157 M222	L109-L153 HydrophobicContact CD1-CD1 3.92Å; V145-L153 HydrophobicContact CG2-CD1 3.99Å; V145-L153 HydrophobicContact CG2-CD2 3.93Å; L148-L153 HydrophobicContact CB-CB 4.46Å; L148-L153 HydrophobicContact CD1-CB 4.49Å; L148-L153 HydrophobicContact CD1-CD1 4.45Å; S149-L153 PolarHBondContact O-N 3.02Å; S149-L153 VanDerWaalsContact O-N 3.1Å; Y150-L153 PolarHBondContact O-N 2.98Å; L153-S155 VanDerWaalsContact C-N 3.29Å; L153-S155 PolarHBondContact O-N 3.35Å; L153-L156 PolarHBondContact O-N 3.43Å; L153-L156 VanDerWaalsContact O-N 3.14Å; L153-L157 HydrophobicContact CD1-CD1 4.04Å; L153-L157 HydrophobicContact CD1-CG 4.06Å; L153-L157 HydrophobicContact CG-CD1 3.91Å; L153-L157 HydrophobicContact CG-CG 4.31Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 2.95Å; L153-M222 HydrophobicContact CD1-CE 4.35Å; L153-M222 HydrophobicContact CD1-SD 4.44Å
154	D	86.3	Confident	86.3	Confident	8 Å²	8	37.5 Å²	37.5	4%	0.043	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-41.2	-179.9	-69.6	-16.8	0	0	0	110.8	R101 S140 Y150 R158	R101-D154 IonicContact CZ-OD1 3.98Å; R101-D154 IonicContact CZ-OD2 3.8Å; R101-D154 IonicContact NH1-OD1 3.82Å; R101-D154 PolarHBondContact NH1-OD1 2.99Å; R101-D154 IonicContact NH1-OD2 2.75Å; R101-D154 PolarHBondContact NH1-OD2 2.85Å; R101-D154 VanDerWaalsContact NH1-OD2 3.16Å; R101-D154 IonicContact NH2-OD1 3.52Å; R101-D154 IonicContact NH2-OD2 2.64Å; R101-D154 PolarHBondContact NH2-OD2 2.84Å; S140-D154 WeakPolarHBondContact CA-OD1 2.95Å; S140-D154 WeakPolarHBondContact CB-OD1 3.19Å; S140-D154 WeakPolarHBondContact CB-OD2 3.4Å; Y150-D154 VanDerWaalsContact O-CB 3.29Å; Y150-D154 WeakPolarHBondContact O-CB 3.32Å; Y150-D154 PolarHBondContact O-N 3.06Å; D154-R158 WeakPolarHBondContact O-CB 3.35Å; D154-R158 WeakPolarHBondContact O-CG 3.38Å; D154-R158 PolarHBondContact O-N 3.45Å
155	S	88.3	Confident	86.6	Confident	69 Å²	69	38.7 Å²	38.7	48%	0.483	21%	0.205	S	C	.	.	H	α-helix	trans	-64.3	-39.3	176.1	-62.9	0	0	0	0	112.5	D151 A152 L153	D151-S155 WeakPolarHBondContact O-CB 3.06Å; D151-S155 PolarHBondContact O-N 2.84Å; D151-S155 PolarHBondContact O-OG 3.14Å; A152-S155 PolarHBondContact O-N 2.91Å; L153-S155 VanDerWaalsContact C-N 3.29Å; L153-S155 PolarHBondContact O-N 3.35Å
156	L	88.9	Confident	87	Confident	21 Å²	21	39.9 Å²	39.9	11%	0.11	21%	0.211	C	C	.	.	H	α-helix	trans	-69.2	-46.3	177	-177.7	62.4	0	0	0	111.6	A152 L153 R158 K159 F160 M222 Y226	A152-L156 PolarHBondContact O-N 3.04Å; L153-L156 PolarHBondContact O-N 3.43Å; L153-L156 VanDerWaalsContact O-N 3.14Å; L156-R158 VanDerWaalsContact C-N 3.3Å; L156-R158 PolarHBondContact O-N 3.22Å; L156-K159 WeakPolarHBondContact O-CB 3.34Å; L156-K159 PolarHBondContact O-N 3.07Å; L156-K159 VanDerWaalsContact O-N 3.12Å; L156-F160 HydrophobicContact CD1-CE2 4.08Å; L156-F160 HydrophobicContact CG-CE2 3.99Å; L156-F160 WeakPolarHBondContact O-CD2 3.39Å; L156-M222 HydrophobicContact CD2-CB 3.93Å; L156-M222 HydrophobicContact CD2-CE 4.39Å; L156-M222 HydrophobicContact CD2-SD 4.33Å; L156-Y226 HydrophobicContact CD1-CD2 4.29Å
157	L	89.1	Confident	87.6	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-61.7	-38.1	178.2	-67.7	176.4	0	0	0	111.9	I113 M126 L153 K159 F160 V161	I113-L157 HydrophobicContact CD1-CD2 4.06Å; I113-L157 HydrophobicContact CG1-CD2 4.35Å; M126-L157 HydrophobicContact CE-CB 4.22Å; M126-L157 HydrophobicContact CE-CD2 3.69Å; L153-L157 HydrophobicContact CD1-CD1 4.04Å; L153-L157 HydrophobicContact CD1-CG 4.06Å; L153-L157 HydrophobicContact CG-CD1 3.91Å; L153-L157 HydrophobicContact CG-CG 4.31Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 2.95Å; L157-K159 PolarHBondContact O-N 3.31Å; L157-F160 PolarHBondContact O-N 3.09Å; L157-F160 VanDerWaalsContact O-N 3.13Å; L157-V161 PolarHBondContact O-N 3.03Å
158	R	88.5	Confident	88	Confident	160 Å²	160	36.4 Å²	36.4	60%	0.604	19%	0.188	S	C	*	.	H	α-helix	trans	-57.6	-33.5	175.1	-78	173.4	-161.1	-152.2	8.1	112.9	D154 L156 V161 D162	D154-R158 WeakPolarHBondContact O-CB 3.35Å; D154-R158 WeakPolarHBondContact O-CG 3.38Å; D154-R158 PolarHBondContact O-N 3.45Å; L156-R158 VanDerWaalsContact C-N 3.3Å; L156-R158 PolarHBondContact O-N 3.22Å; R158-V161 PolarHBondContact O-N 3.19Å; R158-D162 PolarHBondContact O-N 2.98Å
159	K	89.9	Confident	88.3	Confident	93 Å²	93	35.5 Å²	35.5	40%	0.404	18%	0.183	S	C	.	.	H	α-helix	trans	-65.5	-43.9	176.3	-62.8	-172.4	-178.5	-177.7	0	111.7	L156 L157 V161 D162 W163 Y226	L156-K159 WeakPolarHBondContact O-CB 3.34Å; L156-K159 PolarHBondContact O-N 3.07Å; L156-K159 VanDerWaalsContact O-N 3.12Å; L157-K159 PolarHBondContact O-N 3.31Å; K159-V161 VanDerWaalsContact C-N 3.33Å; K159-D162 PolarHBondContact O-N 3.32Å; K159-W163 VanDerWaalsContact O-CD1 3.27Å; K159-W163 VanDerWaalsContact O-CD2 3.28Å; K159-W163 PolarHBondContact O-N 3.07Å; K159-Y226 HydrophobicContact CB-CE2 4.18Å; K159-Y226 HydrophobicContact CD-CD2 4.32Å; K159-Y226 HydrophobicContact CD-CE2 3.4Å; K159-Y226 VanDerWaalsContact CD-CE2 3.4Å; K159-Y226 HydrophobicContact CG-CE2 4.45Å; K159-Y226 PolarHBondContact NZ-OH 2.94Å
160	F	90.4	Very high	88.7	Confident	1 Å²	1	34.1 Å²	34.1	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-37	176.7	-67.1	-69	0	0	0	112.3	I113 M126 L156 L157 W163 N164 L225 Y226 L229	I113-F160 HydrophobicContact CD1-CD2 3.8Å; I113-F160 HydrophobicContact CD1-CE2 3.82Å; I113-F160 HydrophobicContact CD1-CG 4.34Å; I113-F160 HydrophobicContact CD1-CZ 4.38Å; I113-F160 HydrophobicContact CG1-CD2 4.31Å; I113-F160 HydrophobicContact CG1-CG 4.43Å; I113-F160 HydrophobicContact CG2-CB 4.09Å; I113-F160 HydrophobicContact CG2-CD1 3.58Å; I113-F160 HydrophobicContact CG2-CD2 4.28Å; I113-F160 HydrophobicContact CG2-CE1 4.02Å; I113-F160 HydrophobicContact CG2-CG 3.73Å; M126-F160 HydrophobicContact CE-CB 4.22Å; L156-F160 HydrophobicContact CD1-CE2 4.08Å; L156-F160 HydrophobicContact CG-CE2 3.99Å; L156-F160 WeakPolarHBondContact O-CD2 3.39Å; L157-F160 PolarHBondContact O-N 3.09Å; L157-F160 VanDerWaalsContact O-N 3.13Å; F160-W163 AromaticContact CD1-CE3 3.6Å; F160-W163 HydrophobicContact CD1-CE3 3.6Å; F160-W163 AromaticContact CD1-CZ3 3.64Å; F160-W163 HydrophobicContact CD1-CZ3 3.64Å; F160-W163 HydrophobicContact CE1-CE3 4.07Å; F160-W163 AromaticContact CE1-CZ3 3.59Å; F160-W163 HydrophobicContact CE1-CZ3 3.59Å; F160-W163 HydrophobicContact CG-CE3 4.43Å; F160-W163 PolarHBondContact O-N 3.2Å; F160-N164 VanDerWaalsContact O-CB 3.31Å; F160-N164 WeakPolarHBondContact O-CB 3.39Å; F160-N164 PolarHBondContact O-N 3.25Å; F160-L225 HydrophobicContact CE1-CD2 4.18Å; F160-L225 HydrophobicContact CE1-CG 4.3Å; F160-L225 HydrophobicContact CZ-CD2 4.18Å; F160-L225 HydrophobicContact CZ-CG 4.41Å; F160-Y226 HydrophobicContact CZ-CD2 4.34Å; F160-L229 HydrophobicContact CD1-CD1 4.32Å; F160-L229 HydrophobicContact CE1-CD1 3.88Å
161	V	87.7	Confident	89.1	Confident	12 Å²	12	36.1 Å²	36.1	7%	0.073	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-47.2	175.5	165.6	0	0	0	0	111.9	M126 I136 C138 L157 R158 K159 W163 N164 N165	M126-V161 HydrophobicContact CE-CG2 4.08Å; M126-V161 HydrophobicContact CG-CG2 4.07Å; M126-V161 HydrophobicContact SD-CG2 3.62Å; I136-V161 HydrophobicContact CG2-CG1 4.43Å; I136-V161 HydrophobicContact CG2-CG2 4.23Å; I136-V161 WeakPolarHBondContact O-CG1 3.49Å; C138-V161 WeakPolarHBondContact SG-CG2 3.4Å; L157-V161 PolarHBondContact O-N 3.03Å; R158-V161 PolarHBondContact O-N 3.19Å; K159-V161 VanDerWaalsContact C-N 3.33Å; V161-W163 VanDerWaalsContact C-N 3.29Å; V161-W163 PolarHBondContact O-N 3.12Å; V161-N164 PolarHBondContact O-N 2.98Å; V161-N165 VanDerWaalsContact O-CG 3.3Å; V161-N165 PolarHBondContact O-N 3.04Å; V161-N165 PolarHBondContact O-OD1 2.77Å
162	D	88	Confident	89.5	Confident	67 Å²	67	32.7 Å²	32.7	36%	0.358	16%	0.162	S	C	.	.	H	α-helix	trans	-54.8	-46.6	175.3	177	51.3	0	0	0	111.3	R158 K159 N164 N165 H166 K237	R158-D162 PolarHBondContact O-N 2.98Å; K159-D162 PolarHBondContact O-N 3.32Å; D162-N164 PolarHBondContact O-N 3.39Å; D162-N165 PolarHBondContact O-N 3.4Å; D162-H166 PolarHBondContact O-CD2 3.36Å; D162-H166 PolarHBondContact O-N 2.97Å; D162-H166 IonicContact OD1-NE2 3.18Å; D162-K237 WeakPolarHBondContact OD2-CE 3.43Å; D162-K237 IonicContact OD2-NZ 3.55Å; D162-K237 PolarHBondContact OD2-NZ 3.05Å
163	W	89.6	Confident	89.7	Confident	17 Å²	17	30.8 Å²	30.8	6%	0.064	15%	0.146	C	C	.	.	H	α-helix	trans	-63.3	-44	177.7	-58.7	-15.3	0	0	0	112.7	K159 F160 V161 N165 H166 I167 Y226 L229 I230 C233	K159-W163 VanDerWaalsContact O-CD1 3.27Å; K159-W163 VanDerWaalsContact O-CD2 3.28Å; K159-W163 PolarHBondContact O-N 3.07Å; F160-W163 AromaticContact CD1-CE3 3.6Å; F160-W163 HydrophobicContact CD1-CE3 3.6Å; F160-W163 AromaticContact CD1-CZ3 3.64Å; F160-W163 HydrophobicContact CD1-CZ3 3.64Å; F160-W163 HydrophobicContact CE1-CE3 4.07Å; F160-W163 AromaticContact CE1-CZ3 3.59Å; F160-W163 HydrophobicContact CE1-CZ3 3.59Å; F160-W163 HydrophobicContact CG-CE3 4.43Å; F160-W163 PolarHBondContact O-N 3.2Å; V161-W163 VanDerWaalsContact C-N 3.29Å; V161-W163 PolarHBondContact O-N 3.12Å; W163-N165 VanDerWaalsContact C-N 3.3Å; W163-N165 PolarHBondContact O-N 3.27Å; W163-H166 WeakPolarHBondContact O-CB 3.48Å; W163-H166 PolarHBondContact O-N 3.12Å; W163-H166 VanDerWaalsContact O-N 3.15Å; W163-I167 PolarHBondContact O-N 3.35Å; W163-I167 VanDerWaalsContact O-N 3.14Å; W163-Y226 AromaticContact CH2-CD2 3.2Å; W163-Y226 HydrophobicContact CH2-CD2 3.2Å; W163-Y226 AromaticContact CH2-CE2 3.18Å; W163-Y226 HydrophobicContact CH2-CE2 3.18Å; W163-Y226 HydrophobicContact CH2-CG 4.13Å; W163-Y226 AromaticContact CZ2-CD2 3.94Å; W163-Y226 HydrophobicContact CZ2-CD2 3.94Å; W163-Y226 AromaticContact CZ2-CE2 3.4Å; W163-Y226 HydrophobicContact CZ2-CE2 3.4Å; W163-Y226 AromaticContact CZ3-CD2 3.85Å; W163-Y226 HydrophobicContact CZ3-CD2 3.85Å; W163-Y226 HydrophobicContact CZ3-CE2 4.18Å; W163-L229 HydrophobicContact CE3-CB 4.48Å; W163-L229 HydrophobicContact CH2-CB 4.44Å; W163-L229 HydrophobicContact CZ3-CB 3.82Å; W163-L229 HydrophobicContact CZ3-CD1 4.43Å; W163-I230 HydrophobicContact CH2-CG1 4.4Å; W163-C233 HydrophobicContact CD2-CB 3.77Å; W163-C233 VanDerWaalsContact CE2-SG 3.53Å; W163-C233 HydrophobicContact CE3-CB 4.34Å; W163-C233 HydrophobicContact CG-CB 3.91Å; W163-C233 VanDerWaalsContact CG-SG 3.52Å; W163-C233 HydrophobicContact CH2-CB 4.47Å; W163-C233 HydrophobicContact CZ2-CB 4.01Å; W163-C233 VanDerWaalsContact CZ3-SG 3.51Å
164	N	90.2	Very high	89.8	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-39	178.3	-179.4	67.5	0	0	0	112.4	V116 L117 I136 F160 V161 D162 H166 I167 L168	V116-N164 HydrophobicContact CG1-CB 4.08Å; V116-N164 WeakPolarHBondContact CG1-ND2 3.4Å; V116-N164 PolarHBondContact O-OD1 3.25Å; L117-N164 HydrophobicContact CD2-CB 3.93Å; I136-N164 VanDerWaalsContact CD1-ND2 3.29Å; I136-N164 WeakPolarHBondContact CD1-ND2 2.97Å; F160-N164 VanDerWaalsContact O-CB 3.31Å; F160-N164 WeakPolarHBondContact O-CB 3.39Å; F160-N164 PolarHBondContact O-N 3.25Å; V161-N164 PolarHBondContact O-N 2.98Å; D162-N164 PolarHBondContact O-N 3.39Å; N164-H166 PolarHBondContact O-N 3.41Å; N164-I167 PolarHBondContact O-N 3.23Å; N164-I167 VanDerWaalsContact O-N 3.1Å; N164-L168 VanDerWaalsContact ND2-CD1 3.33Å; N164-L168 WeakPolarHBondContact ND2-CD1 3.16Å; N164-L168 WeakPolarHBondContact O-CB 3.26Å; N164-L168 PolarHBondContact O-N 3.3Å
165	N	89.2	Confident	90	Very high	25 Å²	25	36.5 Å²	36.5	13%	0.134	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-36.9	176.4	-70.3	-3.5	0	0	0	111.3	V134 D135 I136 V161 D162 W163 F169	V134-N165 HydrophobicContact CG1-CB 4.43Å; V134-N165 WeakPolarHBondContact CG1-O 3.06Å; V134-N165 VanDerWaalsContact O-CG 3.25Å; V134-N165 PolarHBondContact O-OD1 3.49Å; D135-N165 PolarHBondContact OD1-ND2 3.1Å; I136-N165 PolarHBondContact N-OD1 2.91Å; V161-N165 VanDerWaalsContact O-CG 3.3Å; V161-N165 PolarHBondContact O-N 3.04Å; V161-N165 PolarHBondContact O-OD1 2.77Å; D162-N165 PolarHBondContact O-N 3.4Å; W163-N165 VanDerWaalsContact C-N 3.3Å; W163-N165 PolarHBondContact O-N 3.27Å; N165-F169 WeakPolarHBondContact O-CB 3.5Å; N165-F169 PolarHBondContact O-N 3.45Å
166	H	91.7	Very high	90	Very high	29 Å²	29	33.9 Å²	33.9	13%	0.134	15%	0.153	C	C	.	.	H	α-helix	trans	-68.4	-40.4	173.5	-68.2	-78.8	0	0	0	112.9	D162 W163 N164 F169 I170 V236 S240	D162-H166 PolarHBondContact O-CD2 3.36Å; D162-H166 PolarHBondContact O-N 2.97Å; D162-H166 IonicContact OD1-NE2 3.18Å; W163-H166 WeakPolarHBondContact O-CB 3.48Å; W163-H166 PolarHBondContact O-N 3.12Å; W163-H166 VanDerWaalsContact O-N 3.15Å; N164-H166 PolarHBondContact O-N 3.41Å; H166-F169 WeakPolarHBondContact O-CB 3.3Å; H166-F169 PolarHBondContact O-N 3.41Å; H166-I170 WeakPolarHBondContact O-CG1 3.5Å; H166-I170 PolarHBondContact O-N 3.5Å; H166-V236 HydrophobicContact CB-CG1 3.66Å; H166-S240 PolarHBondContact CE1-OG 3.08Å; H166-S240 PolarHBondContact ND1-OG 3.39Å
167	I	92	Very high	90	Very high	6 Å²	6	33 Å²	33	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-48.4	176.6	-62.1	167.5	0	0	0	110.5	L117 W163 N164 F169 I170 R171 L200 L203 V236	L117-I167 HydrophobicContact CB-CD1 4.44Å; L117-I167 HydrophobicContact CD2-CD1 3.68Å; W163-I167 PolarHBondContact O-N 3.35Å; W163-I167 VanDerWaalsContact O-N 3.14Å; N164-I167 PolarHBondContact O-N 3.23Å; N164-I167 VanDerWaalsContact O-N 3.1Å; I167-F169 VanDerWaalsContact C-N 3.27Å; I167-F169 PolarHBondContact O-N 2.91Å; I167-I170 PolarHBondContact O-N 3.3Å; I167-I170 VanDerWaalsContact O-N 3.17Å; I167-R171 PolarHBondContact O-N 3.33Å; I167-L200 HydrophobicContact CG2-CD2 4.09Å; I167-L203 HydrophobicContact CD1-CD2 3.79Å; I167-L203 HydrophobicContact CG1-CD2 3.97Å; I167-L203 HydrophobicContact CG2-CD2 4.3Å; I167-V236 HydrophobicContact CG1-CG1 3.81Å; I167-V236 HydrophobicContact CG1-CG2 4.23Å
168	L	89.9	Confident	89.9	Confident	18 Å²	18	36.8 Å²	36.8	9%	0.094	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-38.3	177.8	-77.1	-177.5	0	0	0	111.9	V134 I136 N164 R171 L172	V134-L168 HydrophobicContact CG1-CB 4.18Å; I136-L168 HydrophobicContact CD1-CD1 3.69Å; I136-L168 HydrophobicContact CG1-CD1 3.86Å; N164-L168 VanDerWaalsContact ND2-CD1 3.33Å; N164-L168 WeakPolarHBondContact ND2-CD1 3.16Å; N164-L168 WeakPolarHBondContact O-CB 3.26Å; N164-L168 PolarHBondContact O-N 3.3Å; L168-R171 PolarHBondContact O-N 3.02Å; L168-L172 VanDerWaalsContact O-CB 3.25Å; L168-L172 WeakPolarHBondContact O-CB 3.14Å; L168-L172 PolarHBondContact O-N 3.35Å
169	F	90.9	Very high	89.9	Confident	25 Å²	25	33.9 Å²	33.9	11%	0.11	17%	0.168	C	C	.	.	H	α-helix	trans	-59.3	-47.9	174.5	-178.3	-111.4	0	0	0	111.8	V134 N165 H166 I167 L172 V173 I243 K244	V134-F169 HydrophobicContact CG1-CB 3.86Å; V134-F169 HydrophobicContact CG2-CD2 4.47Å; N165-F169 WeakPolarHBondContact O-CB 3.5Å; N165-F169 PolarHBondContact O-N 3.45Å; H166-F169 WeakPolarHBondContact O-CB 3.3Å; H166-F169 PolarHBondContact O-N 3.41Å; I167-F169 VanDerWaalsContact C-N 3.27Å; I167-F169 PolarHBondContact O-N 2.91Å; F169-L172 WeakPolarHBondContact O-CB 3.17Å; F169-L172 PolarHBondContact O-N 3.02Å; F169-V173 HydrophobicContact CE1-CG2 4.15Å; F169-V173 HydrophobicContact CE2-CG2 4.27Å; F169-V173 HydrophobicContact CZ-CG2 4.02Å; F169-V173 VanDerWaalsContact O-CG2 3.31Å; F169-V173 WeakPolarHBondContact O-CG2 2.99Å; F169-V173 PolarHBondContact O-N 3.2Å; F169-I243 HydrophobicContact CE1-CB 3.91Å; F169-I243 HydrophobicContact CE1-CG2 3.63Å; F169-I243 HydrophobicContact CZ-CG2 3.98Å; F169-K244 HydrophobicContact CD1-CG 4.08Å; F169-K244 HydrophobicContact CE1-CB 4.47Å; F169-K244 HydrophobicContact CE1-CD 4.42Å; F169-K244 HydrophobicContact CE1-CG 3.46Å; F169-K244 VanDerWaalsContact CE1-CG 3.46Å; F169-K244 HydrophobicContact CE2-CG 4.38Å; F169-K244 HydrophobicContact CZ-CG 3.63Å
170	I	92.1	Very high	89.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.2	-44.9	178.7	-62.7	173.8	0	0	0	110.5	H166 I167 L172 V173 V174 L196 L200 V236 L239 I243	H166-I170 WeakPolarHBondContact O-CG1 3.5Å; H166-I170 PolarHBondContact O-N 3.5Å; I167-I170 PolarHBondContact O-N 3.3Å; I167-I170 VanDerWaalsContact O-N 3.17Å; I170-L172 VanDerWaalsContact C-N 3.28Å; I170-L172 PolarHBondContact O-N 2.64Å; I170-V173 PolarHBondContact O-N 3.17Å; I170-V174 WeakPolarHBondContact O-CG2 3.28Å; I170-V174 PolarHBondContact O-N 3.01Å; I170-L196 HydrophobicContact CG2-CB 4.17Å; I170-L196 HydrophobicContact CG2-CD1 4.17Å; I170-L196 HydrophobicContact CG2-CD2 4.01Å; I170-L196 HydrophobicContact CG2-CG 4.35Å; I170-L200 HydrophobicContact CG2-CD1 3.93Å; I170-L200 HydrophobicContact CG2-CD2 4.28Å; I170-L200 HydrophobicContact CG2-CG 4.18Å; I170-V236 HydrophobicContact CD1-CG1 4.01Å; I170-L239 HydrophobicContact CD1-CB 4.01Å; I170-I243 HydrophobicContact CG1-CD1 4.27Å
171	R	92.7	Very high	89.3	Confident	56 Å²	56	36.5 Å²	36.5	21%	0.211	18%	0.18	C	C	.	.	H	α-helix	trans	-59.6	-39.5	175.8	-70.4	-171.7	-166.4	-88.9	0.8	112.1	L118 I167 L168 V174 H175 L200 D204	L118-R171 PolarHBondContact O-NH2 2.76Å; I167-R171 PolarHBondContact O-N 3.33Å; L168-R171 PolarHBondContact O-N 3.02Å; R171-V174 PolarHBondContact O-N 3.45Å; R171-H175 WeakPolarHBondContact O-CB 3.13Å; R171-H175 PolarHBondContact O-N 3.09Å; R171-L200 HydrophobicContact CG-CD1 3.68Å; R171-L200 HydrophobicContact CG-CD2 4.15Å; R171-D204 IonicContact CZ-OD1 3.19Å; R171-D204 IonicContact CZ-OD2 2.74Å; R171-D204 IonicContact NH1-OD1 2.75Å; R171-D204 IonicContact NH1-OD2 3.43Å; R171-D204 PolarHBondContact NH1-OD2 2.67Å; R171-D204 VanDerWaalsContact NH2-CG 3.3Å; R171-D204 IonicContact NH2-OD1 3.82Å; R171-D204 PolarHBondContact NH2-OD1 2.87Å; R171-D204 IonicContact NH2-OD2 3.58Å; R171-D204 PolarHBondContact NH2-OD2 2.93Å; R171-D204 VanDerWaalsContact NH2-OD2 3.16Å
172	L	90.3	Very high	89	Confident	36 Å²	36	41.8 Å²	41.8	19%	0.188	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-43.3	177.3	-173.3	161.2	0	0	0	111.1	I133 V134 L168 F169 I170 H175 F176 L251	I133-L172 HydrophobicContact CB-CD1 3.78Å; I133-L172 HydrophobicContact CG2-CD1 3.33Å; I133-L172 HydrophobicContact CG2-CG 4.45Å; V134-L172 HydrophobicContact CG2-CD1 3.5Å; V134-L172 VanDerWaalsContact CG2-CD1 3.5Å; L168-L172 VanDerWaalsContact O-CB 3.25Å; L168-L172 WeakPolarHBondContact O-CB 3.14Å; L168-L172 PolarHBondContact O-N 3.35Å; F169-L172 WeakPolarHBondContact O-CB 3.17Å; F169-L172 PolarHBondContact O-N 3.02Å; I170-L172 VanDerWaalsContact C-N 3.28Å; I170-L172 PolarHBondContact O-N 2.64Å; L172-H175 PolarHBondContact O-N 2.93Å; L172-F176 WeakPolarHBondContact O-CB 3.41Å; L172-F176 PolarHBondContact O-N 3.14Å; L172-L251 HydrophobicContact CD2-CD1 3.25Å; L172-L251 HydrophobicContact CD2-CD2 4.4Å; L172-L251 HydrophobicContact CD2-CG 4.44Å
173	V	90.3	Very high	88.5	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-48.5	176.1	172.6	0	0	0	0	110.6	F169 I170 H175 F176 V177 L196 I243 L251 L254	F169-V173 HydrophobicContact CE1-CG2 4.15Å; F169-V173 HydrophobicContact CE2-CG2 4.27Å; F169-V173 HydrophobicContact CZ-CG2 4.02Å; F169-V173 VanDerWaalsContact O-CG2 3.31Å; F169-V173 WeakPolarHBondContact O-CG2 2.99Å; F169-V173 PolarHBondContact O-N 3.2Å; I170-V173 PolarHBondContact O-N 3.17Å; V173-H175 VanDerWaalsContact C-N 3.33Å; V173-H175 PolarHBondContact O-N 3.35Å; V173-F176 WeakPolarHBondContact O-CB 3.44Å; V173-F176 PolarHBondContact O-N 3.19Å; V173-F176 VanDerWaalsContact O-N 3.15Å; V173-V177 WeakPolarHBondContact O-CG2 3.44Å; V173-V177 PolarHBondContact O-N 3.01Å; V173-L196 HydrophobicContact CG1-CD1 4.4Å; V173-I243 HydrophobicContact CG1-CG2 4.25Å; V173-I243 HydrophobicContact CG2-CG2 3.84Å; V173-L251 HydrophobicContact CG2-CD2 3.77Å; V173-L254 HydrophobicContact CG1-CD1 4.21Å
174	V	90.2	Very high	87.7	Confident	13 Å²	13	49.6 Å²	49.6	8%	0.079	25%	0.254	C	S	.	.	H	α-helix	trans	-57.4	-47.5	176.2	173.1	0	0	0	0	110.9	I170 R171 F176 V177 V178 L196 N197 L200	I170-V174 WeakPolarHBondContact O-CG2 3.28Å; I170-V174 PolarHBondContact O-N 3.01Å; R171-V174 PolarHBondContact O-N 3.45Å; V174-F176 VanDerWaalsContact C-N 3.33Å; V174-F176 PolarHBondContact O-N 3.27Å; V174-V177 PolarHBondContact O-N 3.04Å; V174-V178 HydrophobicContact CG1-CG2 4.4Å; V174-V178 WeakPolarHBondContact O-CG2 3.29Å; V174-V178 PolarHBondContact O-N 2.76Å; V174-L196 HydrophobicContact CG2-CB 3.54Å; V174-L196 HydrophobicContact CG2-CD1 4.04Å; V174-L196 HydrophobicContact CG2-CG 4.48Å; V174-N197 HydrophobicContact CG1-CB 4.17Å; V174-L200 HydrophobicContact CG2-CD1 4.34Å
175	H	90.3	Very high	86.9	Confident	115 Å²	115	53 Å²	53	53%	0.532	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-38.2	177.5	178.3	-77.9	0	0	0	112.5	R171 L172 V173 N179	R171-H175 WeakPolarHBondContact O-CB 3.13Å; R171-H175 PolarHBondContact O-N 3.09Å; L172-H175 PolarHBondContact O-N 2.93Å; V173-H175 VanDerWaalsContact C-N 3.33Å; V173-H175 PolarHBondContact O-N 3.35Å; H175-N179 PolarHBondContact CD2-ND2 2.74Å; H175-N179 PolarHBondContact CE1-ND2 3.37Å; H175-N179 VanDerWaalsContact CE1-ND2 3.25Å; H175-N179 PolarHBondContact NE2-ND2 3.02Å; H175-N179 VanDerWaalsContact O-CB 3.28Å; H175-N179 WeakPolarHBondContact O-CB 3.23Å; H175-N179 PolarHBondContact O-N 3.38Å; H175-N179 VanDerWaalsContact O-N 3.09Å
176	F	89.2	Confident	86.5	Confident	15 Å²	15	53.7 Å²	53.7	7%	0.066	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-48.6	176.5	176.6	-89.7	0	0	0	111.1	L172 V173 V174 K180 M181 L251	L172-F176 WeakPolarHBondContact O-CB 3.41Å; L172-F176 PolarHBondContact O-N 3.14Å; V173-F176 WeakPolarHBondContact O-CB 3.44Å; V173-F176 PolarHBondContact O-N 3.19Å; V173-F176 VanDerWaalsContact O-N 3.15Å; V174-F176 VanDerWaalsContact C-N 3.33Å; V174-F176 PolarHBondContact O-N 3.27Å; F176-K180 HydrophobicContact CD2-CB 4.39Å; F176-K180 HydrophobicContact CD2-CD 3.66Å; F176-K180 HydrophobicContact CD2-CG 4.45Å; F176-K180 HydrophobicContact CE2-CB 4.33Å; F176-K180 HydrophobicContact CE2-CD 3.65Å; F176-K180 VanDerWaalsContact O-CB 3.31Å; F176-K180 WeakPolarHBondContact O-CB 3.4Å; F176-K180 PolarHBondContact O-N 3.19Å; F176-M181 HydrophobicContact CD1-SD 4.18Å; F176-M181 HydrophobicContact CE1-CG 4.13Å; F176-M181 HydrophobicContact CE1-SD 3.88Å; F176-L251 HydrophobicContact CB-CD1 4.44Å; F176-L251 HydrophobicContact CD1-CB 4.06Å; F176-L251 HydrophobicContact CD2-CB 3.94Å; F176-L251 HydrophobicContact CD2-CD1 4.03Å; F176-L251 HydrophobicContact CE1-CB 3.93Å; F176-L251 WeakPolarHBondContact CE1-O 3.45Å; F176-L251 HydrophobicContact CE2-CB 3.82Å; F176-L251 HydrophobicContact CG-CB 4.08Å; F176-L251 HydrophobicContact CG-CD1 4.24Å; F176-L251 HydrophobicContact CZ-CB 3.82Å
177	V	87.8	Confident	86.2	Confident	1 Å²	1	54 Å²	54	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-50.4	179.9	176	0	0	0	0	110.7	V173 V174 N179 M181 V189 F190 A193 L254	V173-V177 WeakPolarHBondContact O-CG2 3.44Å; V173-V177 PolarHBondContact O-N 3.01Å; V174-V177 PolarHBondContact O-N 3.04Å; V177-N179 VanDerWaalsContact C-N 3.34Å; V177-N179 PolarHBondContact O-N 3.1Å; V177-M181 HydrophobicContact CB-SD 4.32Å; V177-M181 HydrophobicContact CG1-SD 4.33Å; V177-M181 HydrophobicContact CG2-SD 3.98Å; V177-M181 WeakPolarHBondContact O-CB 3.5Å; V177-M181 PolarHBondContact O-N 3.09Å; V177-V189 HydrophobicContact CG1-CG1 3.99Å; V177-V189 HydrophobicContact CG2-CG1 3.69Å; V177-F190 HydrophobicContact CG1-CD1 4.14Å; V177-F190 HydrophobicContact CG1-CD2 4Å; V177-F190 HydrophobicContact CG1-CE1 4.22Å; V177-F190 HydrophobicContact CG1-CE2 4.06Å; V177-F190 HydrophobicContact CG1-CG 4.04Å; V177-F190 HydrophobicContact CG1-CZ 4.18Å; V177-F190 WeakPolarHBondContact O-CZ 3.44Å; V177-A193 HydrophobicContact CB-CB 3.93Å; V177-A193 HydrophobicContact CG1-CB 3.77Å; V177-A193 HydrophobicContact CG2-CB 4.3Å; V177-L254 HydrophobicContact CG2-CD1 4.35Å
178	V	88.1	Confident	85.9	Confident	82 Å²	82	54.3 Å²	54.3	50%	0.497	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-35.6	-175.8	174.8	0	0	0	0	112.6	V174	V174-V178 HydrophobicContact CG1-CG2 4.4Å; V174-V178 WeakPolarHBondContact O-CG2 3.29Å; V174-V178 PolarHBondContact O-N 2.76Å
179	N	86.7	Confident	85.8	Confident	99 Å²	99	53.5 Å²	53.5	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-102.9	-17.7	-171.6	-66.1	-22.9	0	0	0	115.2	H175 V177	H175-N179 PolarHBondContact CD2-ND2 2.74Å; H175-N179 PolarHBondContact CE1-ND2 3.37Å; H175-N179 VanDerWaalsContact CE1-ND2 3.25Å; H175-N179 PolarHBondContact NE2-ND2 3.02Å; H175-N179 VanDerWaalsContact O-CB 3.28Å; H175-N179 WeakPolarHBondContact O-CB 3.23Å; H175-N179 PolarHBondContact O-N 3.38Å; H175-N179 VanDerWaalsContact O-N 3.09Å; V177-N179 VanDerWaalsContact C-N 3.34Å; V177-N179 PolarHBondContact O-N 3.1Å
180	K	86	Confident	85.6	Confident	136 Å²	136	54.2 Å²	54.2	59%	0.591	29%	0.289	S	S	*	.	H	α-helix	trans	-123.3	-2.5	-174.1	-65.1	-169.2	173.2	-173.5	0	115.3	F176 R255	F176-K180 HydrophobicContact CD2-CB 4.39Å; F176-K180 HydrophobicContact CD2-CD 3.66Å; F176-K180 HydrophobicContact CD2-CG 4.45Å; F176-K180 HydrophobicContact CE2-CB 4.33Å; F176-K180 HydrophobicContact CE2-CD 3.65Å; F176-K180 VanDerWaalsContact O-CB 3.31Å; F176-K180 WeakPolarHBondContact O-CB 3.4Å; F176-K180 PolarHBondContact O-N 3.19Å; K180-R255 PolarHBondContact O-NH2 3.26Å; K180-R255 VanDerWaalsContact O-NH2 3.09Å
181	M	83.4	Confident	85.4	Confident	12 Å²	12	55.6 Å²	55.6	6%	0.059	30%	0.299	C	S	.	.	S	Bend	trans	-118.4	153.7	179.8	-61.1	-178.9	65	0	0	110.5	F176 V177 H186 V189 F190 L254 R255	F176-M181 HydrophobicContact CD1-SD 4.18Å; F176-M181 HydrophobicContact CE1-CG 4.13Å; F176-M181 HydrophobicContact CE1-SD 3.88Å; V177-M181 HydrophobicContact CB-SD 4.32Å; V177-M181 HydrophobicContact CG1-SD 4.33Å; V177-M181 HydrophobicContact CG2-SD 3.98Å; V177-M181 WeakPolarHBondContact O-CB 3.5Å; V177-M181 PolarHBondContact O-N 3.09Å; M181-H186 HydrophobicContact CE-CB 3.65Å; M181-H186 VanDerWaalsContact CE-CD2 3.45Å; M181-H186 WeakPolarHBondContact CE-CD2 3.28Å; M181-H186 VanDerWaalsContact CE-CG 3.42Å; M181-V189 HydrophobicContact CE-CB 4.37Å; M181-V189 HydrophobicContact CE-CG1 4.16Å; M181-V189 HydrophobicContact SD-CG1 4.28Å; M181-F190 HydrophobicContact CB-CE2 3.82Å; M181-F190 HydrophobicContact CB-CZ 4.23Å; M181-F190 VanDerWaalsContact O-CZ 3.3Å; M181-F190 WeakPolarHBondContact O-CZ 3.3Å; M181-L254 HydrophobicContact CE-CB 4.47Å; M181-L254 HydrophobicContact SD-CB 4.41Å; M181-R255 HydrophobicContact CE-CG 3.99Å
182	D	80.7	Confident	85.3	Confident	123 Å²	123	53.2 Å²	53.2	66%	0.658	29%	0.29	S	S	*	.			trans	-89.6	131.1	175.4	-62.4	-39.6	0	0	0	110.2	I184 S185 H186 F190	D182-I184 VanDerWaalsContact C-N 3.3Å; D182-I184 PolarHBondContact O-N 3.45Å; D182-S185 PolarHBondContact O-OG 3.44Å; D182-H186 PolarHBondContact O-N 3.48Å; D182-F190 VanDerWaalsContact C-CE2 3.46Å; D182-F190 WeakPolarHBondContact O-CE2 3.31Å
183	C	77.4	Confident	85.2	Confident	77 Å²	77	51.7 Å²	51.7	52%	0.52	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-38.6	-176.6	-173.4	0	0	0	0	112.6	A187 F190	C183-A187 WeakPolarHBondContact O-CA 3.42Å; C183-A187 PolarHBondContact O-N 2.93Å; C183-A187 VanDerWaalsContact O-N 3.17Å; C183-F190 VanDerWaalsContact CA-CE2 3.41Å; C183-F190 HydrophobicContact CB-CD1 4.48Å; C183-F190 HydrophobicContact CB-CD2 4.31Å; C183-F190 HydrophobicContact CB-CE1 4.35Å; C183-F190 HydrophobicContact CB-CE2 4.19Å; C183-F190 HydrophobicContact CB-CG 4.44Å; C183-F190 HydrophobicContact CB-CZ 4.2Å
184	I	73.5	Confident	85.2	Confident	171 Å²	171	55.5 Å²	55.5	88%	0.877	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-41.8	-174.7	-58.9	169.3	0	0	0	111.1	D182	D182-I184 VanDerWaalsContact C-N 3.3Å; D182-I184 PolarHBondContact O-N 3.45Å
185	S	72.9	Confident	85.2	Confident	71 Å²	71	55.1 Å²	55.1	50%	0.497	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-23.1	-177.4	58.4	0	0	0	0	113.4	D182	D182-S185 PolarHBondContact O-OG 3.44Å
186	H	81.5	Confident	85.3	Confident	40 Å²	40	49.6 Å²	49.6	19%	0.185	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	40.3	-172.7	-56.6	-62.5	0	0	0	113.4	M181 D182 C188 V189 F190 R255	M181-H186 HydrophobicContact CE-CB 3.65Å; M181-H186 VanDerWaalsContact CE-CD2 3.45Å; M181-H186 WeakPolarHBondContact CE-CD2 3.28Å; M181-H186 VanDerWaalsContact CE-CG 3.42Å; D182-H186 PolarHBondContact O-N 3.48Å; H186-C188 PolarHBondContact O-N 2.81Å; H186-C188 VanDerWaalsContact O-N 3.11Å; H186-V189 HydrophobicContact CB-CB 4.31Å; H186-V189 HydrophobicContact CB-CG2 4.43Å; H186-V189 PolarHBondContact O-N 3.17Å; H186-F190 HydrophobicContact CB-CD2 4.43Å; H186-F190 PolarHBondContact O-N 3.43Å; H186-F190 VanDerWaalsContact O-N 3.09Å; H186-R255 PolarHBondContact CE1-O 3.49Å
187	A	84.5	Confident	85.3	Confident	35 Å²	35	52.9 Å²	52.9	29%	0.289	30%	0.299	S	S	.	.	H	α-helix	trans	-50.3	-40	-175.7	0	0	0	0	0	114	C183 F190 S191 P297	C183-A187 WeakPolarHBondContact O-CA 3.42Å; C183-A187 PolarHBondContact O-N 2.93Å; C183-A187 VanDerWaalsContact O-N 3.17Å; A187-F190 PolarHBondContact O-N 3Å; A187-S191 PolarHBondContact O-N 3.48Å; A187-S191 PolarHBondContact O-OG 2.81Å; A187-P297 HydrophobicContact CB-CB 3.82Å; A187-P297 HydrophobicContact CB-CG 4.14Å
188	C	85.7	Confident	85.4	Confident	13 Å²	13	54 Å²	54	9%	0.088	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-44.8	177.9	-55.4	0	0	0	0	112.2	H186 F190 S191 F192 T260 T294 F298	H186-C188 PolarHBondContact O-N 2.81Å; H186-C188 VanDerWaalsContact O-N 3.11Å; C188-F190 VanDerWaalsContact C-N 3.32Å; C188-F190 PolarHBondContact O-N 3.34Å; C188-S191 WeakPolarHBondContact O-CB 3.43Å; C188-S191 PolarHBondContact O-N 3.49Å; C188-F192 PolarHBondContact O-N 3.34Å; C188-T260 HydrophobicContact CB-CG2 3.5Å; C188-T260 VanDerWaalsContact CB-CG2 3.5Å; C188-T294 HydrophobicContact CB-CG2 4.29Å; C188-T294 WeakPolarHBondContact O-CG2 3.44Å; C188-F298 HydrophobicContact CB-CE2 4.18Å; C188-F298 WeakPolarHBondContact SG-CD2 3.48Å; C188-F298 WeakPolarHBondContact SG-CE2 3.41Å
189	V	87.8	Confident	85.6	Confident	2 Å²	2	50 Å²	50	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-36.2	179.2	-176.2	0	0	0	0	110.7	V177 M181 H186 F192 A193 L254	V177-V189 HydrophobicContact CG1-CG1 3.99Å; V177-V189 HydrophobicContact CG2-CG1 3.69Å; M181-V189 HydrophobicContact CE-CB 4.37Å; M181-V189 HydrophobicContact CE-CG1 4.16Å; M181-V189 HydrophobicContact SD-CG1 4.28Å; H186-V189 HydrophobicContact CB-CB 4.31Å; H186-V189 HydrophobicContact CB-CG2 4.43Å; H186-V189 PolarHBondContact O-N 3.17Å; V189-F192 PolarHBondContact O-N 3.34Å; V189-A193 WeakPolarHBondContact O-CB 3.48Å; V189-A193 PolarHBondContact O-N 3.34Å; V189-L254 HydrophobicContact CG1-CB 4.47Å
190	F	87.7	Confident	85.8	Confident	39 Å²	39	45.5 Å²	45.5	17%	0.171	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-44.3	172.3	-90.4	-89.1	0	0	0	112.5	V177 M181 D182 C183 H186 A187 C188 F192 A193 S194	V177-F190 HydrophobicContact CG1-CD1 4.14Å; V177-F190 HydrophobicContact CG1-CD2 4Å; V177-F190 HydrophobicContact CG1-CE1 4.22Å; V177-F190 HydrophobicContact CG1-CE2 4.06Å; V177-F190 HydrophobicContact CG1-CG 4.04Å; V177-F190 HydrophobicContact CG1-CZ 4.18Å; V177-F190 WeakPolarHBondContact O-CZ 3.44Å; M181-F190 HydrophobicContact CB-CE2 3.82Å; M181-F190 HydrophobicContact CB-CZ 4.23Å; M181-F190 VanDerWaalsContact O-CZ 3.3Å; M181-F190 WeakPolarHBondContact O-CZ 3.3Å; D182-F190 VanDerWaalsContact C-CE2 3.46Å; D182-F190 WeakPolarHBondContact O-CE2 3.31Å; C183-F190 VanDerWaalsContact CA-CE2 3.41Å; C183-F190 HydrophobicContact CB-CD1 4.48Å; C183-F190 HydrophobicContact CB-CD2 4.31Å; C183-F190 HydrophobicContact CB-CE1 4.35Å; C183-F190 HydrophobicContact CB-CE2 4.19Å; C183-F190 HydrophobicContact CB-CG 4.44Å; C183-F190 HydrophobicContact CB-CZ 4.2Å; H186-F190 HydrophobicContact CB-CD2 4.43Å; H186-F190 PolarHBondContact O-N 3.43Å; H186-F190 VanDerWaalsContact O-N 3.09Å; A187-F190 PolarHBondContact O-N 3Å; C188-F190 VanDerWaalsContact C-N 3.32Å; C188-F190 PolarHBondContact O-N 3.34Å; F190-F192 VanDerWaalsContact C-N 3.3Å; F190-F192 PolarHBondContact O-N 2.83Å; F190-A193 PolarHBondContact O-N 3.46Å; F190-S194 PolarHBondContact O-N 2.93Å
191	S	86.3	Confident	86.1	Confident	29 Å²	29	41.9 Å²	41.9	20%	0.203	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-43.2	173	-72.9	0	0	0	0	111.7	A187 C188 S194 C195 I293	A187-S191 PolarHBondContact O-N 3.48Å; A187-S191 PolarHBondContact O-OG 2.81Å; C188-S191 WeakPolarHBondContact O-CB 3.43Å; C188-S191 PolarHBondContact O-N 3.49Å; S191-S194 WeakPolarHBondContact O-CB 3.35Å; S191-S194 PolarHBondContact O-N 2.95Å; S191-C195 PolarHBondContact O-N 3.48Å; S191-C195 VanDerWaalsContact O-N 3.14Å; S191-C195 PolarHBondContact O-SG 3.25Å; S191-C195 VanDerWaalsContact O-SG 3.33Å; S191-I293 WeakPolarHBondContact CB-O 3.32Å; S191-I293 PolarHBondContact OG-O 3.45Å
192	F	91	Very high	86.4	Confident	7 Å²	7	42.7 Å²	42.7	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-45.4	175.1	180	-115.6	0	0	0	112.4	C188 V189 F190 S194 C195 L196 I243 L263 L267 M290 T294	C188-F192 PolarHBondContact O-N 3.34Å; V189-F192 PolarHBondContact O-N 3.34Å; F190-F192 VanDerWaalsContact C-N 3.3Å; F190-F192 PolarHBondContact O-N 2.83Å; F192-S194 VanDerWaalsContact C-N 3.29Å; F192-S194 PolarHBondContact O-N 2.79Å; F192-C195 WeakPolarHBondContact O-CB 3.2Å; F192-C195 PolarHBondContact O-N 3.44Å; F192-C195 VanDerWaalsContact O-N 3.12Å; F192-L196 HydrophobicContact CD1-CD1 3.95Å; F192-L196 HydrophobicContact CD1-CG 4.37Å; F192-L196 HydrophobicContact CE1-CD1 3.49Å; F192-L196 VanDerWaalsContact CE1-CD1 3.49Å; F192-L196 HydrophobicContact CE1-CD2 4.38Å; F192-L196 HydrophobicContact CE1-CG 4Å; F192-L196 HydrophobicContact CE2-CD2 4.26Å; F192-L196 HydrophobicContact CE2-CG 4.3Å; F192-L196 HydrophobicContact CZ-CD1 3.89Å; F192-L196 HydrophobicContact CZ-CD2 3.89Å; F192-L196 HydrophobicContact CZ-CG 3.95Å; F192-L196 PolarHBondContact O-N 2.88Å; F192-I243 HydrophobicContact CE1-CD1 4.16Å; F192-I243 HydrophobicContact CE1-CG1 3.99Å; F192-I243 HydrophobicContact CZ-CD1 4.13Å; F192-I243 HydrophobicContact CZ-CG1 3.95Å; F192-L263 HydrophobicContact CB-CD2 4.13Å; F192-L263 HydrophobicContact CD1-CD1 4.33Å; F192-L263 HydrophobicContact CD1-CD2 3.8Å; F192-L263 HydrophobicContact CD2-CD1 4.41Å; F192-L263 HydrophobicContact CD2-CD2 4.29Å; F192-L263 HydrophobicContact CE1-CD1 3.96Å; F192-L263 HydrophobicContact CE1-CD2 4.26Å; F192-L263 HydrophobicContact CE2-CD1 4.09Å; F192-L263 HydrophobicContact CG-CD2 3.81Å; F192-L263 HydrophobicContact CZ-CD1 3.84Å; F192-L267 HydrophobicContact CD2-CD1 4.07Å; F192-L267 HydrophobicContact CE2-CD1 4.03Å; F192-L267 HydrophobicContact CE2-CD2 4.09Å; F192-M290 HydrophobicContact CE2-SD 4.09Å; F192-T294 WeakPolarHBondContact CA-OG1 3.26Å; F192-T294 HydrophobicContact CB-CG2 4.02Å; F192-T294 WeakPolarHBondContact CB-OG1 3.35Å
193	A	89.2	Confident	87	Confident	3 Å²	3	37 Å²	37	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-35.6	177.5	0	0	0	0	0	112.4	V177 V189 F190 L196 N197	V177-A193 HydrophobicContact CB-CB 3.93Å; V177-A193 HydrophobicContact CG1-CB 3.77Å; V177-A193 HydrophobicContact CG2-CB 4.3Å; V189-A193 WeakPolarHBondContact O-CB 3.48Å; V189-A193 PolarHBondContact O-N 3.34Å; F190-A193 PolarHBondContact O-N 3.46Å; A193-L196 PolarHBondContact O-N 3.25Å; A193-N197 WeakPolarHBondContact O-CB 3.47Å; A193-N197 PolarHBondContact O-N 2.93Å
194	S	88.6	Confident	87.7	Confident	82 Å²	82	34.8 Å²	34.8	57%	0.573	21%	0.211	S	C	*	.	H	α-helix	trans	-61.7	-44.4	172.3	-174.4	0	0	0	0	111.6	F190 S191 F192 L196 N197 G198	F190-S194 PolarHBondContact O-N 2.93Å; S191-S194 WeakPolarHBondContact O-CB 3.35Å; S191-S194 PolarHBondContact O-N 2.95Å; F192-S194 VanDerWaalsContact C-N 3.29Å; F192-S194 PolarHBondContact O-N 2.79Å; S194-L196 PolarHBondContact O-N 3.1Å; S194-N197 PolarHBondContact O-N 3.36Å; S194-G198 PolarHBondContact O-N 2.9Å
195	C	90.2	Very high	88.7	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.034	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-40.7	175.1	-63.7	0	0	0	0	112.7	S191 F192 N197 G198 F199 M290 I293 F406	S191-C195 PolarHBondContact O-N 3.48Å; S191-C195 VanDerWaalsContact O-N 3.14Å; S191-C195 PolarHBondContact O-SG 3.25Å; S191-C195 VanDerWaalsContact O-SG 3.33Å; F192-C195 WeakPolarHBondContact O-CB 3.2Å; F192-C195 PolarHBondContact O-N 3.44Å; F192-C195 VanDerWaalsContact O-N 3.12Å; C195-N197 VanDerWaalsContact C-N 3.32Å; C195-G198 PolarHBondContact O-N 3.44Å; C195-F199 PolarHBondContact O-N 2.93Å; C195-M290 HydrophobicContact CB-CB 4.46Å; C195-M290 HydrophobicContact CB-CE 4.15Å; C195-M290 HydrophobicContact CB-CG 3.53Å; C195-I293 VanDerWaalsContact SG-CD1 3.59Å; C195-I293 VanDerWaalsContact SG-CG2 3.52Å; C195-F406 HydrophobicContact CB-CZ 4.35Å
196	L	92.4	Very high	89.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.7	-42.4	174.1	-70.3	179.1	0	0	0	111.4	I170 V173 V174 F192 A193 S194 G198 F199 L200 I243 M290	I170-L196 HydrophobicContact CG2-CB 4.17Å; I170-L196 HydrophobicContact CG2-CD1 4.17Å; I170-L196 HydrophobicContact CG2-CD2 4.01Å; I170-L196 HydrophobicContact CG2-CG 4.35Å; V173-L196 HydrophobicContact CG1-CD1 4.4Å; V174-L196 HydrophobicContact CG2-CB 3.54Å; V174-L196 HydrophobicContact CG2-CD1 4.04Å; V174-L196 HydrophobicContact CG2-CG 4.48Å; F192-L196 HydrophobicContact CD1-CD1 3.95Å; F192-L196 HydrophobicContact CD1-CG 4.37Å; F192-L196 HydrophobicContact CE1-CD1 3.49Å; F192-L196 VanDerWaalsContact CE1-CD1 3.49Å; F192-L196 HydrophobicContact CE1-CD2 4.38Å; F192-L196 HydrophobicContact CE1-CG 4Å; F192-L196 HydrophobicContact CE2-CD2 4.26Å; F192-L196 HydrophobicContact CE2-CG 4.3Å; F192-L196 HydrophobicContact CZ-CD1 3.89Å; F192-L196 HydrophobicContact CZ-CD2 3.89Å; F192-L196 HydrophobicContact CZ-CG 3.95Å; F192-L196 PolarHBondContact O-N 2.88Å; A193-L196 PolarHBondContact O-N 3.25Å; S194-L196 PolarHBondContact O-N 3.1Å; L196-G198 VanDerWaalsContact C-N 3.34Å; L196-F199 PolarHBondContact O-N 3.17Å; L196-L200 WeakPolarHBondContact O-CB 3.19Å; L196-L200 VanDerWaalsContact O-CG 3.28Å; L196-L200 WeakPolarHBondContact O-CG 3.26Å; L196-L200 PolarHBondContact O-N 3.23Å; L196-I243 HydrophobicContact CD1-CD1 3.78Å; L196-I243 HydrophobicContact CD2-CD1 4.07Å; L196-M290 HydrophobicContact CD2-CE 3.99Å; L196-M290 HydrophobicContact CD2-SD 4.49Å
197	N	90.6	Very high	90.2	Very high	83 Å²	83	28.8 Å²	28.8	44%	0.444	17%	0.171	S	C	.	.	H	α-helix	trans	-64.7	-38.8	176.6	-166.8	58.3	0	0	0	111.9	V174 A193 S194 C195 L200 S201	V174-N197 HydrophobicContact CG1-CB 4.17Å; A193-N197 WeakPolarHBondContact O-CB 3.47Å; A193-N197 PolarHBondContact O-N 2.93Å; S194-N197 PolarHBondContact O-N 3.36Å; C195-N197 VanDerWaalsContact C-N 3.32Å; N197-L200 PolarHBondContact O-N 3.28Å; N197-S201 WeakPolarHBondContact O-CB 3.3Å; N197-S201 PolarHBondContact O-N 2.96Å; N197-S201 PolarHBondContact O-OG 2.97Å
198	G	89.4	Confident	90.5	Very high	24 Å²	24	31.9 Å²	31.9	25%	0.247	18%	0.18	C	C	.	.	H	α-helix	trans	-61.9	-44.5	172.4	0	0	0	0	0	112.7	S194 C195 L196 S201 Q202	S194-G198 PolarHBondContact O-N 2.9Å; C195-G198 PolarHBondContact O-N 3.44Å; L196-G198 VanDerWaalsContact C-N 3.34Å; G198-S201 WeakPolarHBondContact O-CB 3.24Å; G198-S201 PolarHBondContact O-N 3.49Å; G198-Q202 PolarHBondContact O-N 3.04Å
199	F	91.5	Very high	90.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-44.5	174.6	174.7	-96.3	0	0	0	112.4	C195 L196 S201 Q202 L203 W232 R235 V236 L239 Y282 V286 M290	C195-F199 PolarHBondContact O-N 2.93Å; L196-F199 PolarHBondContact O-N 3.17Å; F199-S201 VanDerWaalsContact C-N 3.31Å; F199-S201 PolarHBondContact O-N 3.45Å; F199-Q202 PolarHBondContact O-N 2.9Å; F199-L203 PolarHBondContact O-N 2.77Å; F199-L203 VanDerWaalsContact O-N 3.14Å; F199-W232 HydrophobicContact CD2-CZ3 4.41Å; F199-W232 HydrophobicContact CE2-CE3 4.32Å; F199-W232 AromaticContact CE2-CZ3 3.78Å; F199-W232 HydrophobicContact CE2-CZ3 3.78Å; F199-W232 HydrophobicContact CZ-CE3 4.12Å; F199-W232 AromaticContact CZ-CZ3 3.96Å; F199-W232 HydrophobicContact CZ-CZ3 3.96Å; F199-R235 HydrophobicContact CE2-CB 4.28Å; F199-R235 HydrophobicContact CZ-CB 3.96Å; F199-V236 HydrophobicContact CE1-CG2 3.81Å; F199-V236 HydrophobicContact CZ-CG2 4.05Å; F199-L239 HydrophobicContact CD1-CD1 3.6Å; F199-L239 HydrophobicContact CD2-CD1 4.08Å; F199-L239 HydrophobicContact CE1-CD1 3.52Å; F199-L239 HydrophobicContact CE2-CD1 3.99Å; F199-L239 HydrophobicContact CG-CD1 3.88Å; F199-L239 HydrophobicContact CZ-CD1 3.72Å; F199-Y282 HydrophobicContact CE2-CE1 4.19Å; F199-V286 HydrophobicContact CD2-CG1 4.13Å; F199-M290 HydrophobicContact CB-CE 4.01Å
200	L	92.4	Very high	90.8	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-37.9	175.6	-73.3	169.2	0	0	0	112	I167 I170 R171 V174 L196 N197 Q202 L203 D204	I167-L200 HydrophobicContact CG2-CD2 4.09Å; I170-L200 HydrophobicContact CG2-CD1 3.93Å; I170-L200 HydrophobicContact CG2-CD2 4.28Å; I170-L200 HydrophobicContact CG2-CG 4.18Å; R171-L200 HydrophobicContact CG-CD1 3.68Å; R171-L200 HydrophobicContact CG-CD2 4.15Å; V174-L200 HydrophobicContact CG2-CD1 4.34Å; L196-L200 WeakPolarHBondContact O-CB 3.19Å; L196-L200 VanDerWaalsContact O-CG 3.28Å; L196-L200 WeakPolarHBondContact O-CG 3.26Å; L196-L200 PolarHBondContact O-N 3.23Å; N197-L200 PolarHBondContact O-N 3.28Å; L200-Q202 VanDerWaalsContact C-N 3.3Å; L200-Q202 PolarHBondContact O-N 2.83Å; L200-L203 WeakPolarHBondContact O-CB 3.47Å; L200-L203 PolarHBondContact O-N 3.42Å; L200-D204 WeakPolarHBondContact O-CB 3.17Å; L200-D204 VanDerWaalsContact O-CG 3.23Å; L200-D204 PolarHBondContact O-N 3.37Å
201	S	91.6	Very high	90.8	Very high	60 Å²	60	34.6 Å²	34.6	42%	0.42	19%	0.191	S	C	.	.	H	α-helix	trans	-62.7	-36.7	177.7	-59	0	0	0	0	112.2	N197 G198 F199 D204 E205	N197-S201 WeakPolarHBondContact O-CB 3.3Å; N197-S201 PolarHBondContact O-N 2.96Å; N197-S201 PolarHBondContact O-OG 2.97Å; G198-S201 WeakPolarHBondContact O-CB 3.24Å; G198-S201 PolarHBondContact O-N 3.49Å; F199-S201 VanDerWaalsContact C-N 3.31Å; F199-S201 PolarHBondContact O-N 3.45Å; S201-D204 PolarHBondContact O-N 3.02Å; S201-E205 PolarHBondContact O-N 2.84Å
202	Q	90.6	Very high	90.9	Very high	30 Å²	30	36.7 Å²	36.7	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-70.6	-37.9	174.3	-67.3	-176.9	7.7	0	0	112.8	G198 F199 L200 D204 E205 F206 W232 Y282 F406	G198-Q202 PolarHBondContact O-N 3.04Å; F199-Q202 PolarHBondContact O-N 2.9Å; L200-Q202 VanDerWaalsContact C-N 3.3Å; L200-Q202 PolarHBondContact O-N 2.83Å; Q202-D204 VanDerWaalsContact C-N 3.27Å; Q202-E205 PolarHBondContact O-N 3.08Å; Q202-F206 WeakPolarHBondContact O-CB 3.43Å; Q202-F206 PolarHBondContact O-N 3.16Å; Q202-W232 HydrophobicContact CB-CH2 3.91Å; Q202-Y282 PolarHBondContact OE1-OH 3.38Å; Q202-F406 VanDerWaalsContact NE2-CB 3.29Å; Q202-F406 PolarHBondContact NE2-O 3.14Å
203	L	92.7	Very high	90.6	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-42.5	172.6	176.8	64.5	0	0	0	110.2	I167 F199 L200 F206 L207 W232 V236	I167-L203 HydrophobicContact CD1-CD2 3.79Å; I167-L203 HydrophobicContact CG1-CD2 3.97Å; I167-L203 HydrophobicContact CG2-CD2 4.3Å; F199-L203 PolarHBondContact O-N 2.77Å; F199-L203 VanDerWaalsContact O-N 3.14Å; L200-L203 WeakPolarHBondContact O-CB 3.47Å; L200-L203 PolarHBondContact O-N 3.42Å; L203-F206 PolarHBondContact O-N 2.97Å; L203-L207 HydrophobicContact CD1-CD1 4.43Å; L203-L207 HydrophobicContact CD1-CG 4.34Å; L203-L207 HydrophobicContact CG-CD1 4.09Å; L203-L207 HydrophobicContact CG-CG 4.43Å; L203-L207 WeakPolarHBondContact O-CB 3.46Å; L203-L207 VanDerWaalsContact O-CG 3.27Å; L203-L207 WeakPolarHBondContact O-CG 3.1Å; L203-L207 PolarHBondContact O-N 3.39Å; L203-W232 HydrophobicContact CB-CE3 4.2Å; L203-W232 HydrophobicContact CB-CZ3 4.1Å; L203-W232 HydrophobicContact CD1-CB 4.02Å; L203-W232 HydrophobicContact CD1-CD2 3.82Å; L203-W232 HydrophobicContact CD1-CE3 3.75Å; L203-W232 HydrophobicContact CD1-CG 3.97Å; L203-W232 HydrophobicContact CD1-CZ3 4.46Å; L203-V236 HydrophobicContact CD2-CG2 4.11Å
204	D	92.7	Very high	90.4	Very high	30 Å²	30	40.4 Å²	40.4	16%	0.16	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-42.6	177.9	-69.5	-21	0	0	0	111.6	L118 R171 L200 S201 Q202 F206 L207 H208	L118-D204 HydrophobicContact CD2-CB 4.14Å; R171-D204 IonicContact CZ-OD1 3.19Å; R171-D204 IonicContact CZ-OD2 2.74Å; R171-D204 IonicContact NH1-OD1 2.75Å; R171-D204 IonicContact NH1-OD2 3.43Å; R171-D204 PolarHBondContact NH1-OD2 2.67Å; R171-D204 VanDerWaalsContact NH2-CG 3.3Å; R171-D204 IonicContact NH2-OD1 3.82Å; R171-D204 PolarHBondContact NH2-OD1 2.87Å; R171-D204 IonicContact NH2-OD2 3.58Å; R171-D204 PolarHBondContact NH2-OD2 2.93Å; R171-D204 VanDerWaalsContact NH2-OD2 3.16Å; L200-D204 WeakPolarHBondContact O-CB 3.17Å; L200-D204 VanDerWaalsContact O-CG 3.23Å; L200-D204 PolarHBondContact O-N 3.37Å; S201-D204 PolarHBondContact O-N 3.02Å; Q202-D204 VanDerWaalsContact C-N 3.27Å; D204-F206 VanDerWaalsContact C-N 3.35Å; D204-F206 PolarHBondContact O-N 2.92Å; D204-L207 PolarHBondContact O-N 3.47Å; D204-H208 PolarHBondContact O-CD2 3.36Å; D204-H208 PolarHBondContact O-N 3.36Å
205	E	93.2	Very high	90.2	Very high	137 Å²	137	43.8 Å²	43.8	64%	0.64	22%	0.223	S	C	*	.	H	α-helix	trans	-59.3	-44.3	172.7	-171.6	177.6	-179.5	0	0	111.8	S201 Q202 H208 E209	S201-E205 PolarHBondContact O-N 2.84Å; Q202-E205 PolarHBondContact O-N 3.08Å; E205-H208 PolarHBondContact O-N 2.9Å; E205-E209 PolarHBondContact O-N 2.98Å
206	F	92.8	Very high	89.5	Confident	19 Å²	19	48.6 Å²	48.6	8%	0.083	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-40.7	176.2	177.6	-97.2	0	0	0	112.4	Q202 L203 D204 H208 E209 M210 C228 L229 W232 H412	Q202-F206 WeakPolarHBondContact O-CB 3.43Å; Q202-F206 PolarHBondContact O-N 3.16Å; L203-F206 PolarHBondContact O-N 2.97Å; D204-F206 VanDerWaalsContact C-N 3.35Å; D204-F206 PolarHBondContact O-N 2.92Å; F206-H208 VanDerWaalsContact C-N 3.34Å; F206-E209 WeakPolarHBondContact O-CB 3.16Å; F206-E209 PolarHBondContact O-N 3.18Å; F206-M210 HydrophobicContact CD1-CG 4.19Å; F206-M210 HydrophobicContact CD2-CE 4.17Å; F206-M210 HydrophobicContact CE1-CE 4.47Å; F206-M210 HydrophobicContact CE1-CG 3.72Å; F206-M210 HydrophobicContact CE1-SD 4.3Å; F206-M210 HydrophobicContact CE2-CE 3.64Å; F206-M210 HydrophobicContact CE2-SD 4.34Å; F206-M210 HydrophobicContact CZ-CE 3.82Å; F206-M210 HydrophobicContact CZ-CG 3.93Å; F206-M210 HydrophobicContact CZ-SD 3.9Å; F206-M210 WeakPolarHBondContact O-CG 3.49Å; F206-M210 PolarHBondContact O-N 2.7Å; F206-C228 HydrophobicContact CZ-CB 4.22Å; F206-C228 WeakPolarHBondContact CZ-O 3.32Å; F206-L229 HydrophobicContact CD1-CD2 4.27Å; F206-L229 HydrophobicContact CE1-CD2 3.78Å; F206-W232 HydrophobicContact CB-CZ2 4.18Å; F206-W232 AromaticContact CD1-CD1 3.51Å; F206-W232 HydrophobicContact CD1-CG 4.29Å; F206-W232 AromaticContact CD1-NE1 3.43Å; F206-W232 AromaticContact CD2-NE1 3.52Å; F206-W232 AromaticContact CE1-CD1 3.43Å; F206-W232 VanDerWaalsContact CE1-CD1 3.43Å; F206-W232 HydrophobicContact CE1-CG 4.42Å; F206-W232 AromaticContact CE1-NE1 3.7Å; F206-W232 AromaticContact CE2-NE1 3.76Å; F206-W232 AromaticContact CG-CD1 3.93Å; F206-W232 AromaticContact CG-CE2 3.99Å; F206-W232 HydrophobicContact CG-CZ2 4.45Å; F206-W232 AromaticContact CG-NE1 3.32Å; F206-W232 VanDerWaalsContact CG-NE1 3.32Å; F206-W232 AromaticContact CZ-CD1 3.77Å; F206-W232 AromaticContact CZ-NE1 3.85Å; F206-H412 AromaticContact CD2-CE1 3.91Å; F206-H412 AromaticContact CE2-CE1 3.67Å
207	L	92.8	Very high	88.1	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-64.6	-39.1	176.6	-73.5	173.4	0	0	0	111.5	I114 L117 L118 L203 D204 E209 M210 E211 L229	I114-L207 HydrophobicContact CG2-CB 4.35Å; L117-L207 HydrophobicContact CB-CD1 3.77Å; L117-L207 HydrophobicContact CB-CD2 4.12Å; L117-L207 HydrophobicContact CD1-CD2 3.99Å; L118-L207 HydrophobicContact CD2-CB 3.87Å; L118-L207 HydrophobicContact CD2-CD1 3.94Å; L118-L207 HydrophobicContact CG-CB 4.35Å; L118-L207 HydrophobicContact CG-CD1 4.19Å; L203-L207 HydrophobicContact CD1-CD1 4.43Å; L203-L207 HydrophobicContact CD1-CG 4.34Å; L203-L207 HydrophobicContact CG-CD1 4.09Å; L203-L207 HydrophobicContact CG-CG 4.43Å; L203-L207 WeakPolarHBondContact O-CB 3.46Å; L203-L207 VanDerWaalsContact O-CG 3.27Å; L203-L207 WeakPolarHBondContact O-CG 3.1Å; L203-L207 PolarHBondContact O-N 3.39Å; D204-L207 PolarHBondContact O-N 3.47Å; L207-E209 VanDerWaalsContact C-N 3.34Å; L207-M210 PolarHBondContact O-N 3.11Å; L207-E211 PolarHBondContact O-N 2.88Å; L207-L229 HydrophobicContact CD2-CD2 3.81Å
208	H	91.5	Very high	86.9	Confident	100 Å²	100	52.2 Å²	52.2	46%	0.463	28%	0.283	S	S	.	.	H	α-helix	trans	-64.8	-36.1	171.8	-73.6	-49	0	0	0	112.6	D204 E205 F206 E211 S212	D204-H208 PolarHBondContact O-CD2 3.36Å; D204-H208 PolarHBondContact O-N 3.36Å; E205-H208 PolarHBondContact O-N 2.9Å; F206-H208 VanDerWaalsContact C-N 3.34Å; H208-E211 IonicContact ND1-OE2 3.94Å; H208-E211 WeakPolarHBondContact O-CB 3.37Å; H208-E211 PolarHBondContact O-N 2.96Å; H208-S212 PolarHBondContact O-N 3.41Å
209	E	90.3	Very high	86.1	Confident	66 Å²	66	58.2 Å²	58.2	31%	0.308	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-43.3	172.3	-164.8	-164.5	146.4	0	0	111.5	E205 F206 L207 E211 S212 K213 H412	E205-E209 PolarHBondContact O-N 2.98Å; F206-E209 WeakPolarHBondContact O-CB 3.16Å; F206-E209 PolarHBondContact O-N 3.18Å; L207-E209 VanDerWaalsContact C-N 3.34Å; E209-E211 VanDerWaalsContact C-N 3.34Å; E209-S212 WeakPolarHBondContact O-CB 3.08Å; E209-S212 PolarHBondContact O-N 3.34Å; E209-K213 PolarHBondContact O-N 3.19Å; E209-K213 WeakPolarHBondContact OE1-CE 3.2Å; E209-K213 IonicContact OE1-NZ 2.88Å; E209-K213 PolarHBondContact OE1-NZ 3.21Å; E209-H412 IonicContact OE1-CD2 3.96Å; E209-H412 IonicContact OE1-CE1 3.37Å; E209-H412 IonicContact OE1-NE2 2.76Å; E209-H412 PolarHBondContact OE1-NE2 3.28Å; E209-H412 IonicContact OE2-CD2 3.88Å; E209-H412 IonicContact OE2-CE1 2.87Å; E209-H412 IonicContact OE2-NE2 3.16Å; E209-H412 PolarHBondContact OE2-NE2 3.27Å
210	M	88.9	Confident	85.6	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-37.9	176	-66.3	-52.1	101.4	0	0	111.8	I114 F206 L207 S212 K213 S214 F220 L225 C228	I114-M210 HydrophobicContact CD1-CB 4.29Å; F206-M210 HydrophobicContact CD1-CG 4.19Å; F206-M210 HydrophobicContact CD2-CE 4.17Å; F206-M210 HydrophobicContact CE1-CE 4.47Å; F206-M210 HydrophobicContact CE1-CG 3.72Å; F206-M210 HydrophobicContact CE1-SD 4.3Å; F206-M210 HydrophobicContact CE2-CE 3.64Å; F206-M210 HydrophobicContact CE2-SD 4.34Å; F206-M210 HydrophobicContact CZ-CE 3.82Å; F206-M210 HydrophobicContact CZ-CG 3.93Å; F206-M210 HydrophobicContact CZ-SD 3.9Å; F206-M210 WeakPolarHBondContact O-CG 3.49Å; F206-M210 PolarHBondContact O-N 2.7Å; L207-M210 PolarHBondContact O-N 3.11Å; M210-S212 VanDerWaalsContact C-N 3.32Å; M210-S212 PolarHBondContact O-N 2.93Å; M210-K213 HydrophobicContact CE-CD 3.69Å; M210-K213 PolarHBondContact O-N 3.48Å; M210-K213 HydrophobicContact SD-CD 4.34Å; M210-S214 WeakPolarHBondContact O-CB 3.42Å; M210-S214 PolarHBondContact O-N 3.3Å; M210-F220 HydrophobicContact SD-CE2 4.35Å; M210-F220 HydrophobicContact SD-CZ 4.19Å; M210-L225 HydrophobicContact CB-CD1 4.24Å; M210-L225 HydrophobicContact CG-CD1 4.46Å; M210-C228 HydrophobicContact SD-CB 3.86Å
211	E	88.1	Confident	85.4	Confident	43 Å²	43	61.9 Å²	61.9	20%	0.201	33%	0.328	C	S	.	.	H	α-helix	trans	-59.4	-45.6	173.8	-163.2	-160.3	144	0	0	110.4	I114 L207 H208 E209 S214 R215	I114-E211 HydrophobicContact CD1-CB 4.22Å; I114-E211 HydrophobicContact CG2-CB 4.34Å; L207-E211 PolarHBondContact O-N 2.88Å; H208-E211 IonicContact ND1-OE2 3.94Å; H208-E211 WeakPolarHBondContact O-CB 3.37Å; H208-E211 PolarHBondContact O-N 2.96Å; E209-E211 VanDerWaalsContact C-N 3.34Å; E211-S214 PolarHBondContact O-N 3.38Å; E211-S214 PolarHBondContact O-OG 3.32Å; E211-R215 IonicContact OE1-CZ 3.87Å; E211-R215 IonicContact OE1-NH2 3.51Å; E211-R215 PolarHBondContact OE1-NH2 2.88Å
212	S	87.8	Confident	85.1	Confident	73 Å²	73	59.1 Å²	59.1	51%	0.51	31%	0.308	S	S	.	.	H	α-helix	trans	-61.3	-47.8	176	-174.1	0	0	0	0	112.1	H208 E209 M210 S214 R215	H208-S212 PolarHBondContact O-N 3.41Å; E209-S212 WeakPolarHBondContact O-CB 3.08Å; E209-S212 PolarHBondContact O-N 3.34Å; M210-S212 VanDerWaalsContact C-N 3.32Å; M210-S212 PolarHBondContact O-N 2.93Å; S212-S214 VanDerWaalsContact C-N 3.28Å; S212-S214 PolarHBondContact O-N 2.78Å; S212-R215 WeakPolarHBondContact O-CB 3.27Å; S212-R215 PolarHBondContact O-N 3.36Å
213	K	86.2	Confident	84.9	Confident	82 Å²	82	62 Å²	62	36%	0.357	32%	0.323	S	S	.	.	H	α-helix	trans	-60.9	-35.5	177.3	-77.3	174.1	172.1	168.1	0	112.8	E209 M210 R215 N216	E209-K213 PolarHBondContact O-N 3.19Å; E209-K213 WeakPolarHBondContact OE1-CE 3.2Å; E209-K213 IonicContact OE1-NZ 2.88Å; E209-K213 PolarHBondContact OE1-NZ 3.21Å; M210-K213 HydrophobicContact CE-CD 3.69Å; M210-K213 PolarHBondContact O-N 3.48Å; M210-K213 HydrophobicContact SD-CD 4.34Å; K213-R215 PolarHBondContact O-N 2.88Å; K213-N216 PolarHBondContact O-N 3.19Å
214	S	84.9	Confident	84.7	Confident	7 Å²	7	63 Å²	63	5%	0.049	33%	0.331	C	S	.	.	H	α-helix	trans	-67.6	-18	-179.7	77.4	0	0	0	0	114.3	Y107 M210 E211 S212 N216	Y107-S214 WeakPolarHBondContact CD2-O 3.33Å; Y107-S214 WeakPolarHBondContact CE2-O 3.48Å; M210-S214 WeakPolarHBondContact O-CB 3.42Å; M210-S214 PolarHBondContact O-N 3.3Å; E211-S214 PolarHBondContact O-N 3.38Å; E211-S214 PolarHBondContact O-OG 3.32Å; S212-S214 VanDerWaalsContact C-N 3.28Å; S212-S214 PolarHBondContact O-N 2.78Å; S214-N216 PolarHBondContact O-N 3.18Å
215	R	82.7	Confident	84.6	Confident	153 Å²	153	61.6 Å²	61.6	58%	0.577	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-17.2	177.4	-64.7	176.8	-174.5	175.3	3.5	112.7	E211 S212 K213	E211-R215 IonicContact OE1-CZ 3.87Å; E211-R215 IonicContact OE1-NH2 3.51Å; E211-R215 PolarHBondContact OE1-NH2 2.88Å; S212-R215 WeakPolarHBondContact O-CB 3.27Å; S212-R215 PolarHBondContact O-N 3.36Å; K213-R215 PolarHBondContact O-N 2.88Å
216	N	76.6	Confident	84.6	Confident	105 Å²	105	57.1 Å²	57.1	56%	0.561	30%	0.301	S	S	*	.	S	Bend	trans	-71.1	121.7	176.8	-72	-18.7	0	0	0	110.1	K213 S214 G218	K213-N216 PolarHBondContact O-N 3.19Å; S214-N216 PolarHBondContact O-N 3.18Å; N216-G218 PolarHBondContact O-N 2.84Å; N216-G218 VanDerWaalsContact O-N 3.12Å
217	P	63.7	Low	84.5	Confident	121 Å²	121	61.8 Å²	61.8	79%	0.786	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	116.8	-175.2	24.4	-32.2	0	0	0	111.2
218	G	65.1	Low	84.4	Confident	39 Å²	39	64.1 Å²	64.1	40%	0.402	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.8	-10.3	156.4	0	0	0	0	0	118.9	Y73 N216	Y73-G218 WeakPolarHBondContact OH-CA 3.39Å; N216-G218 PolarHBondContact O-N 2.84Å; N216-G218 VanDerWaalsContact O-N 3.12Å
219	I	71.6	Confident	84.4	Confident	149 Å²	149	59.5 Å²	59.5	76%	0.764	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-26.9	-176.1	-56.4	171.5	0	0	0	111.6
220	F	82.1	Confident	84.5	Confident	36 Å²	36	58.9 Å²	58.9	16%	0.158	32%	0.316	C	S	.	.			trans	-100.6	105.9	-173.5	-160.3	-99	0	0	0	111.4	I110 M210 S224 L225	I110-F220 HydrophobicContact CD1-CD1 4.11Å; I110-F220 HydrophobicContact CG2-CD1 4.37Å; I110-F220 HydrophobicContact CG2-CE1 4.14Å; M210-F220 HydrophobicContact SD-CE2 4.35Å; M210-F220 HydrophobicContact SD-CZ 4.19Å; F220-S224 WeakPolarHBondContact CA-OG 3.31Å; F220-S224 VanDerWaalsContact CD2-OG 3.26Å; F220-S224 WeakPolarHBondContact CD2-OG 3.17Å; F220-S224 WeakPolarHBondContact CG-OG 3.26Å; F220-L225 HydrophobicContact CE1-CB 3.76Å; F220-L225 HydrophobicContact CE1-CD1 3.95Å; F220-L225 HydrophobicContact CE1-CG 4.39Å; F220-L225 HydrophobicContact CZ-CB 3.88Å; F220-L225 HydrophobicContact CZ-CD1 3.88Å
221	T	86.6	Confident	84.5	Confident	45 Å²	45	61.5 Å²	61.5	28%	0.276	33%	0.332	S	S	.	.			trans	-101.5	166.2	179.8	55.3	0	0	0	0	111.6	E106 I223 S224 L225	E106-T221 WeakPolarHBondContact OE1-CA 3.41Å; E106-T221 WeakPolarHBondContact OE1-CB 3.32Å; T221-I223 PolarHBondContact O-N 3.25Å; T221-I223 WeakPolarHBondContact OG1-CG2 3.35Å; T221-S224 PolarHBondContact N-OG 2.78Å; T221-S224 WeakPolarHBondContact O-CB 3.18Å; T221-S224 PolarHBondContact O-N 2.96Å; T221-S224 PolarHBondContact O-OG 3.14Å; T221-S224 PolarHBondContact OG1-N 3.17Å; T221-L225 PolarHBondContact O-N 3.31Å
222	M	86.5	Confident	84.7	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-59	-32.5	172.7	-73.2	-179.9	-63.8	0	0	111.8	E106 L109 I110 V145 L148 L153 L156 Y226	E106-M222 HydrophobicContact CG-CB 4.43Å; E106-M222 HydrophobicContact CG-CE 3.82Å; E106-M222 HydrophobicContact CG-CG 3.69Å; E106-M222 HydrophobicContact CG-SD 4.25Å; E106-M222 PolarHBondContact OE1-N 3.33Å; L109-M222 HydrophobicContact CB-SD 3.98Å; L109-M222 HydrophobicContact CD1-CE 4.39Å; L109-M222 HydrophobicContact CD1-SD 3.81Å; I110-M222 HydrophobicContact CD1-CG 4.35Å; I110-M222 HydrophobicContact CG1-CG 3.84Å; V145-M222 HydrophobicContact CG2-CE 4.49Å; L148-M222 HydrophobicContact CD1-CE 4.01Å; L153-M222 HydrophobicContact CD1-CE 4.35Å; L153-M222 HydrophobicContact CD1-SD 4.44Å; L156-M222 HydrophobicContact CD2-CB 3.93Å; L156-M222 HydrophobicContact CD2-CE 4.39Å; L156-M222 HydrophobicContact CD2-SD 4.33Å; M222-Y226 WeakPolarHBondContact O-CB 3.4Å; M222-Y226 PolarHBondContact O-N 2.75Å
223	I	87.2	Confident	84.8	Confident	89 Å²	89	57.6 Å²	57.6	46%	0.456	31%	0.306	S	S	.	.	H	α-helix	trans	-70.4	-37.1	175.2	-143.7	74.2	0	0	0	111.1	T221 Y226 H227	T221-I223 PolarHBondContact O-N 3.25Å; T221-I223 WeakPolarHBondContact OG1-CG2 3.35Å; I223-Y226 WeakPolarHBondContact O-CB 3.48Å; I223-Y226 PolarHBondContact O-N 2.82Å; I223-H227 PolarHBondContact O-CD2 3.16Å; I223-H227 PolarHBondContact O-N 3.18Å
224	S	87.9	Confident	85	Confident	25 Å²	25	57.9 Å²	57.9	18%	0.175	31%	0.312	C	S	.	.	H	α-helix	trans	-64.9	-42.6	174.5	73.9	0	0	0	0	111.5	F220 T221 Y226 H227 C228	F220-S224 WeakPolarHBondContact CA-OG 3.31Å; F220-S224 VanDerWaalsContact CD2-OG 3.26Å; F220-S224 WeakPolarHBondContact CD2-OG 3.17Å; F220-S224 WeakPolarHBondContact CG-OG 3.26Å; T221-S224 PolarHBondContact N-OG 2.78Å; T221-S224 WeakPolarHBondContact O-CB 3.18Å; T221-S224 PolarHBondContact O-N 2.96Å; T221-S224 PolarHBondContact O-OG 3.14Å; T221-S224 PolarHBondContact OG1-N 3.17Å; S224-Y226 VanDerWaalsContact C-N 3.34Å; S224-Y226 PolarHBondContact O-N 3.06Å; S224-H227 PolarHBondContact O-N 3.32Å; S224-C228 WeakPolarHBondContact O-CB 3.07Å; S224-C228 PolarHBondContact O-N 2.74Å; S224-C228 PolarHBondContact O-SG 3.19Å
225	L	91	Very high	85.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.5	-46.8	172.4	179.7	67.5	0	0	0	111.2	I110 I113 I114 F160 M210 F220 T221 H227 C228 L229	I110-L225 HydrophobicContact CG1-CD2 4.32Å; I110-L225 HydrophobicContact CG2-CD2 4.17Å; I113-L225 HydrophobicContact CB-CD2 4.32Å; I113-L225 HydrophobicContact CD1-CD2 4.45Å; I113-L225 HydrophobicContact CG2-CD2 3.9Å; I114-L225 HydrophobicContact CD1-CD1 4.31Å; I114-L225 HydrophobicContact CG1-CD1 4.3Å; F160-L225 HydrophobicContact CE1-CD2 4.18Å; F160-L225 HydrophobicContact CE1-CG 4.3Å; F160-L225 HydrophobicContact CZ-CD2 4.18Å; F160-L225 HydrophobicContact CZ-CG 4.41Å; M210-L225 HydrophobicContact CB-CD1 4.24Å; M210-L225 HydrophobicContact CG-CD1 4.46Å; F220-L225 HydrophobicContact CE1-CB 3.76Å; F220-L225 HydrophobicContact CE1-CD1 3.95Å; F220-L225 HydrophobicContact CE1-CG 4.39Å; F220-L225 HydrophobicContact CZ-CB 3.88Å; F220-L225 HydrophobicContact CZ-CD1 3.88Å; T221-L225 PolarHBondContact O-N 3.31Å; L225-H227 PolarHBondContact O-N 2.6Å; L225-C228 PolarHBondContact O-N 2.74Å; L225-L229 HydrophobicContact CD1-CD1 3.78Å; L225-L229 HydrophobicContact CD1-CG 4.31Å; L225-L229 HydrophobicContact CD2-CD1 4.47Å; L225-L229 HydrophobicContact CG-CD1 3.81Å; L225-L229 WeakPolarHBondContact O-CB 3.33Å; L225-L229 WeakPolarHBondContact O-CG 3.29Å; L225-L229 PolarHBondContact O-N 3.15Å
226	Y	91.4	Very high	85.9	Confident	44 Å²	44	51.4 Å²	51.4	17%	0.173	29%	0.287	C	S	.	.	H	α-helix	trans	-56.2	-51.7	176.4	177.3	-97.1	0	0	0	111	L156 K159 F160 W163 M222 I223 S224 C228 L229 I230	L156-Y226 HydrophobicContact CD1-CD2 4.29Å; K159-Y226 HydrophobicContact CB-CE2 4.18Å; K159-Y226 HydrophobicContact CD-CD2 4.32Å; K159-Y226 HydrophobicContact CD-CE2 3.4Å; K159-Y226 VanDerWaalsContact CD-CE2 3.4Å; K159-Y226 HydrophobicContact CG-CE2 4.45Å; K159-Y226 PolarHBondContact NZ-OH 2.94Å; F160-Y226 HydrophobicContact CZ-CD2 4.34Å; W163-Y226 AromaticContact CH2-CD2 3.2Å; W163-Y226 HydrophobicContact CH2-CD2 3.2Å; W163-Y226 AromaticContact CH2-CE2 3.18Å; W163-Y226 HydrophobicContact CH2-CE2 3.18Å; W163-Y226 HydrophobicContact CH2-CG 4.13Å; W163-Y226 AromaticContact CZ2-CD2 3.94Å; W163-Y226 HydrophobicContact CZ2-CD2 3.94Å; W163-Y226 AromaticContact CZ2-CE2 3.4Å; W163-Y226 HydrophobicContact CZ2-CE2 3.4Å; W163-Y226 AromaticContact CZ3-CD2 3.85Å; W163-Y226 HydrophobicContact CZ3-CD2 3.85Å; W163-Y226 HydrophobicContact CZ3-CE2 4.18Å; M222-Y226 WeakPolarHBondContact O-CB 3.4Å; M222-Y226 PolarHBondContact O-N 2.75Å; I223-Y226 WeakPolarHBondContact O-CB 3.48Å; I223-Y226 PolarHBondContact O-N 2.82Å; S224-Y226 VanDerWaalsContact C-N 3.34Å; S224-Y226 PolarHBondContact O-N 3.06Å; Y226-C228 VanDerWaalsContact C-N 3.34Å; Y226-C228 PolarHBondContact O-N 3.48Å; Y226-L229 PolarHBondContact O-N 3.28Å; Y226-L229 VanDerWaalsContact O-N 3.11Å; Y226-I230 HydrophobicContact CD1-CD1 3.9Å; Y226-I230 HydrophobicContact CD1-CG1 4.23Å; Y226-I230 HydrophobicContact CE1-CD1 3.54Å; Y226-I230 HydrophobicContact CE1-CG1 3.91Å; Y226-I230 WeakPolarHBondContact O-CG1 3.36Å; Y226-I230 PolarHBondContact O-N 3.17Å; Y226-I230 VanDerWaalsContact O-N 3.08Å
227	H	90.8	Very high	86.7	Confident	116 Å²	116	49.5 Å²	49.5	54%	0.537	27%	0.273	S	S	.	.	H	α-helix	trans	-60.9	-39.3	179.4	-75.7	-60.5	0	0	0	113.2	I223 S224 L225 L229	I223-H227 PolarHBondContact O-CD2 3.16Å; I223-H227 PolarHBondContact O-N 3.18Å; S224-H227 PolarHBondContact O-N 3.32Å; L225-H227 PolarHBondContact O-N 2.6Å; H227-L229 VanDerWaalsContact C-N 3.32Å; H227-L229 PolarHBondContact O-N 2.81Å
228	C	90.9	Very high	88	Confident	51 Å²	51	45.5 Å²	45.5	35%	0.345	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-32.5	175.4	-70.5	0	0	0	0	112.9	F206 M210 S224 L225 Y226	F206-C228 HydrophobicContact CZ-CB 4.22Å; F206-C228 WeakPolarHBondContact CZ-O 3.32Å; M210-C228 HydrophobicContact SD-CB 3.86Å; S224-C228 WeakPolarHBondContact O-CB 3.07Å; S224-C228 PolarHBondContact O-N 2.74Å; S224-C228 PolarHBondContact O-SG 3.19Å; L225-C228 PolarHBondContact O-N 2.74Å; Y226-C228 VanDerWaalsContact C-N 3.34Å; Y226-C228 PolarHBondContact O-N 3.48Å
229	L	92.2	Very high	89.4	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-86.8	-20.8	-177.1	-75.3	170.1	0	0	0	114.4	L117 F160 W163 F206 L207 L225 Y226 H227 P231 W232 C233	L117-L229 HydrophobicContact CD1-CD1 3.69Å; F160-L229 HydrophobicContact CD1-CD1 4.32Å; F160-L229 HydrophobicContact CE1-CD1 3.88Å; W163-L229 HydrophobicContact CE3-CB 4.48Å; W163-L229 HydrophobicContact CH2-CB 4.44Å; W163-L229 HydrophobicContact CZ3-CB 3.82Å; W163-L229 HydrophobicContact CZ3-CD1 4.43Å; F206-L229 HydrophobicContact CD1-CD2 4.27Å; F206-L229 HydrophobicContact CE1-CD2 3.78Å; L207-L229 HydrophobicContact CD2-CD2 3.81Å; L225-L229 HydrophobicContact CD1-CD1 3.78Å; L225-L229 HydrophobicContact CD1-CG 4.31Å; L225-L229 HydrophobicContact CD2-CD1 4.47Å; L225-L229 HydrophobicContact CG-CD1 3.81Å; L225-L229 WeakPolarHBondContact O-CB 3.33Å; L225-L229 WeakPolarHBondContact O-CG 3.29Å; L225-L229 PolarHBondContact O-N 3.15Å; Y226-L229 PolarHBondContact O-N 3.28Å; Y226-L229 VanDerWaalsContact O-N 3.11Å; H227-L229 VanDerWaalsContact C-N 3.32Å; H227-L229 PolarHBondContact O-N 2.81Å; L229-P231 VanDerWaalsContact C-CD 3.5Å; L229-W232 WeakPolarHBondContact O-CB 3.49Å; L229-W232 PolarHBondContact O-N 2.86Å; L229-W232 VanDerWaalsContact O-N 3.07Å; L229-C233 PolarHBondContact O-N 3.45Å; L229-C233 PolarHBondContact O-SG 2.98Å
230	I	91.7	Very high	90.3	Very high	53 Å²	53	36.7 Å²	36.7	27%	0.272	19%	0.19	S	C	.	.	H	α-helix	trans	-46.9	-49.6	-177.7	-73.4	163.1	0	0	0	113.3	W163 Y226 W232 C233 N234	W163-I230 HydrophobicContact CH2-CG1 4.4Å; Y226-I230 HydrophobicContact CD1-CD1 3.9Å; Y226-I230 HydrophobicContact CD1-CG1 4.23Å; Y226-I230 HydrophobicContact CE1-CD1 3.54Å; Y226-I230 HydrophobicContact CE1-CG1 3.91Å; Y226-I230 WeakPolarHBondContact O-CG1 3.36Å; Y226-I230 PolarHBondContact O-N 3.17Å; Y226-I230 VanDerWaalsContact O-N 3.08Å; I230-W232 PolarHBondContact O-N 2.99Å; I230-C233 PolarHBondContact O-N 3.3Å; I230-N234 PolarHBondContact O-N 3.44Å; I230-N234 VanDerWaalsContact O-N 3.08Å
231	P	90.2	Very high	90.8	Very high	55 Å²	55	40.5 Å²	40.5	36%	0.357	21%	0.207	S	C	.	.	H	α-helix	trans	-61.8	-45.5	-179.6	-22.2	34.4	0	0	0	112.2	L229 C233 N234 R235	L229-P231 VanDerWaalsContact C-CD 3.5Å; P231-C233 VanDerWaalsContact C-N 3.28Å; P231-C233 PolarHBondContact O-N 3.2Å; P231-N234 PolarHBondContact O-N 3.21Å; P231-R235 WeakPolarHBondContact O-CD 3.5Å; P231-R235 VanDerWaalsContact O-CG 3.23Å; P231-R235 WeakPolarHBondContact O-CG 3.33Å; P231-R235 PolarHBondContact O-N 3.48Å
232	W	92.2	Very high	91	Very high	24 Å²	24	38.9 Å²	38.9	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-37.8	175.8	-78.1	106.4	0	0	0	112.8	F199 Q202 L203 F206 L229 I230 R235 V236	F199-W232 HydrophobicContact CD2-CZ3 4.41Å; F199-W232 HydrophobicContact CE2-CE3 4.32Å; F199-W232 AromaticContact CE2-CZ3 3.78Å; F199-W232 HydrophobicContact CE2-CZ3 3.78Å; F199-W232 HydrophobicContact CZ-CE3 4.12Å; F199-W232 AromaticContact CZ-CZ3 3.96Å; F199-W232 HydrophobicContact CZ-CZ3 3.96Å; Q202-W232 HydrophobicContact CB-CH2 3.91Å; L203-W232 HydrophobicContact CB-CE3 4.2Å; L203-W232 HydrophobicContact CB-CZ3 4.1Å; L203-W232 HydrophobicContact CD1-CB 4.02Å; L203-W232 HydrophobicContact CD1-CD2 3.82Å; L203-W232 HydrophobicContact CD1-CE3 3.75Å; L203-W232 HydrophobicContact CD1-CG 3.97Å; L203-W232 HydrophobicContact CD1-CZ3 4.46Å; F206-W232 HydrophobicContact CB-CZ2 4.18Å; F206-W232 AromaticContact CD1-CD1 3.51Å; F206-W232 HydrophobicContact CD1-CG 4.29Å; F206-W232 AromaticContact CD1-NE1 3.43Å; F206-W232 AromaticContact CD2-NE1 3.52Å; F206-W232 AromaticContact CE1-CD1 3.43Å; F206-W232 VanDerWaalsContact CE1-CD1 3.43Å; F206-W232 HydrophobicContact CE1-CG 4.42Å; F206-W232 AromaticContact CE1-NE1 3.7Å; F206-W232 AromaticContact CE2-NE1 3.76Å; F206-W232 AromaticContact CG-CD1 3.93Å; F206-W232 AromaticContact CG-CE2 3.99Å; F206-W232 HydrophobicContact CG-CZ2 4.45Å; F206-W232 AromaticContact CG-NE1 3.32Å; F206-W232 VanDerWaalsContact CG-NE1 3.32Å; F206-W232 AromaticContact CZ-CD1 3.77Å; F206-W232 AromaticContact CZ-NE1 3.85Å; L229-W232 WeakPolarHBondContact O-CB 3.49Å; L229-W232 PolarHBondContact O-N 2.86Å; L229-W232 VanDerWaalsContact O-N 3.07Å; I230-W232 PolarHBondContact O-N 2.99Å; W232-R235 WeakPolarHBondContact O-CB 3.46Å; W232-R235 PolarHBondContact O-N 2.93Å; W232-V236 WeakPolarHBondContact O-CB 3.33Å; W232-V236 VanDerWaalsContact O-CG2 3.24Å; W232-V236 WeakPolarHBondContact O-CG2 3.44Å; W232-V236 PolarHBondContact O-N 2.94Å
233	C	89.8	Confident	91.3	Very high	10 Å²	10	39 Å²	39	7%	0.068	20%	0.196	C	C	.	.	H	α-helix	trans	-67.9	-40.7	179.6	-63.1	0	0	0	0	111.5	W163 L229 I230 P231 K237	W163-C233 HydrophobicContact CD2-CB 3.77Å; W163-C233 VanDerWaalsContact CE2-SG 3.53Å; W163-C233 HydrophobicContact CE3-CB 4.34Å; W163-C233 HydrophobicContact CG-CB 3.91Å; W163-C233 VanDerWaalsContact CG-SG 3.52Å; W163-C233 HydrophobicContact CH2-CB 4.47Å; W163-C233 HydrophobicContact CZ2-CB 4.01Å; W163-C233 VanDerWaalsContact CZ3-SG 3.51Å; L229-C233 PolarHBondContact O-N 3.45Å; L229-C233 PolarHBondContact O-SG 2.98Å; I230-C233 PolarHBondContact O-N 3.3Å; P231-C233 VanDerWaalsContact C-N 3.28Å; P231-C233 PolarHBondContact O-N 3.2Å; C233-K237 VanDerWaalsContact O-CB 3.27Å; C233-K237 WeakPolarHBondContact O-CB 3.34Å; C233-K237 WeakPolarHBondContact O-CG 3.43Å; C233-K237 PolarHBondContact O-N 3.38Å
234	N	90.9	Very high	91.4	Very high	89 Å²	89	38.8 Å²	38.8	48%	0.476	19%	0.192	S	C	.	.	H	α-helix	trans	-63.3	-44.1	173.9	-67.7	-19.1	0	0	0	111.2	I230 P231 K237 I238	I230-N234 PolarHBondContact O-N 3.44Å; I230-N234 VanDerWaalsContact O-N 3.08Å; P231-N234 PolarHBondContact O-N 3.21Å; N234-K237 PolarHBondContact O-N 3.08Å; N234-I238 VanDerWaalsContact O-CG1 3.3Å; N234-I238 WeakPolarHBondContact O-CG1 3.47Å; N234-I238 PolarHBondContact O-N 2.93Å
235	R	92.8	Very high	91.4	Very high	21 Å²	21	41.7 Å²	41.7	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-50.7	176.5	-66.8	163.9	-176.1	-170	-4.8	112.1	F199 P231 W232 K237 I238 L239 D280 Y282 I283	F199-R235 HydrophobicContact CE2-CB 4.28Å; F199-R235 HydrophobicContact CZ-CB 3.96Å; P231-R235 WeakPolarHBondContact O-CD 3.5Å; P231-R235 VanDerWaalsContact O-CG 3.23Å; P231-R235 WeakPolarHBondContact O-CG 3.33Å; P231-R235 PolarHBondContact O-N 3.48Å; W232-R235 WeakPolarHBondContact O-CB 3.46Å; W232-R235 PolarHBondContact O-N 2.93Å; R235-K237 PolarHBondContact O-N 2.81Å; R235-I238 PolarHBondContact O-N 2.64Å; R235-L239 PolarHBondContact O-N 3.29Å; R235-D280 IonicContact CZ-OD2 3.81Å; R235-D280 IonicContact NE-OD2 3.74Å; R235-D280 PolarHBondContact NE-OD2 3.3Å; R235-D280 IonicContact NH2-OD1 2.72Å; R235-D280 PolarHBondContact NH2-OD1 3.45Å; R235-D280 IonicContact NH2-OD2 2.89Å; R235-D280 PolarHBondContact NH2-OD2 2.98Å; R235-Y282 HydrophobicContact CG-CD1 4.43Å; R235-I283 HydrophobicContact CB-CD1 4.09Å; R235-I283 HydrophobicContact CG-CB 4.23Å; R235-I283 HydrophobicContact CG-CD1 4.34Å
236	V	93	Very high	91.2	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-42.7	177.8	169.1	0	0	0	0	111	H166 I167 I170 F199 L203 W232 I238 L239 S240	H166-V236 HydrophobicContact CB-CG1 3.66Å; I167-V236 HydrophobicContact CG1-CG1 3.81Å; I167-V236 HydrophobicContact CG1-CG2 4.23Å; I170-V236 HydrophobicContact CD1-CG1 4.01Å; F199-V236 HydrophobicContact CE1-CG2 3.81Å; F199-V236 HydrophobicContact CZ-CG2 4.05Å; L203-V236 HydrophobicContact CD2-CG2 4.11Å; W232-V236 WeakPolarHBondContact O-CB 3.33Å; W232-V236 VanDerWaalsContact O-CG2 3.24Å; W232-V236 WeakPolarHBondContact O-CG2 3.44Å; W232-V236 PolarHBondContact O-N 2.94Å; V236-I238 PolarHBondContact O-N 3.36Å; V236-L239 PolarHBondContact O-N 2.85Å; V236-S240 VanDerWaalsContact O-CB 3.32Å; V236-S240 WeakPolarHBondContact O-CB 3.24Å; V236-S240 PolarHBondContact O-N 3.1Å; V236-S240 PolarHBondContact O-OG 3.32Å
237	K	92.6	Very high	90.8	Very high	64 Å²	64	40.6 Å²	40.6	28%	0.278	20%	0.203	S	C	.	.	H	α-helix	trans	-59.7	-45.8	178.6	-81	-177.7	177.9	-157.6	0	111.8	D162 C233 N234 R235 S240 K241	D162-K237 WeakPolarHBondContact OD2-CE 3.43Å; D162-K237 IonicContact OD2-NZ 3.55Å; D162-K237 PolarHBondContact OD2-NZ 3.05Å; C233-K237 VanDerWaalsContact O-CB 3.27Å; C233-K237 WeakPolarHBondContact O-CB 3.34Å; C233-K237 WeakPolarHBondContact O-CG 3.43Å; C233-K237 PolarHBondContact O-N 3.38Å; N234-K237 PolarHBondContact O-N 3.08Å; R235-K237 PolarHBondContact O-N 2.81Å; K237-S240 PolarHBondContact O-N 3.21Å; K237-S240 PolarHBondContact O-OG 3.17Å; K237-K241 VanDerWaalsContact O-CB 3.28Å; K237-K241 WeakPolarHBondContact O-CB 3.37Å; K237-K241 PolarHBondContact O-N 2.85Å
238	I	92.1	Very high	90.3	Very high	38 Å²	38	42.3 Å²	42.3	20%	0.195	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-53.2	176.7	-68	163.3	0	0	0	110.7	N234 R235 V236 S240 K241 I242 L274 I283 L287	N234-I238 VanDerWaalsContact O-CG1 3.3Å; N234-I238 WeakPolarHBondContact O-CG1 3.47Å; N234-I238 PolarHBondContact O-N 2.93Å; R235-I238 PolarHBondContact O-N 2.64Å; V236-I238 PolarHBondContact O-N 3.36Å; I238-S240 PolarHBondContact O-N 3.4Å; I238-K241 WeakPolarHBondContact O-CB 3.36Å; I238-K241 PolarHBondContact O-N 3.46Å; I238-K241 VanDerWaalsContact O-N 3.15Å; I238-I242 HydrophobicContact CG2-CD1 4.07Å; I238-I242 WeakPolarHBondContact O-CG1 3.35Å; I238-I242 PolarHBondContact O-N 3.41Å; I238-L274 HydrophobicContact CD1-CD1 4.21Å; I238-L274 HydrophobicContact CD1-CD2 4.25Å; I238-L274 HydrophobicContact CG2-CD1 4.05Å; I238-I283 HydrophobicContact CD1-CG1 4.4Å; I238-I283 HydrophobicContact CD1-CG2 4.24Å; I238-L287 HydrophobicContact CG2-CD1 4.38Å
239	L	93.2	Very high	89.6	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-60.6	-45.6	-180	-72.3	172.6	0	0	0	112.2	I170 F199 R235 V236 K241 I242 I243 I283 L287 M290	I170-L239 HydrophobicContact CD1-CB 4.01Å; F199-L239 HydrophobicContact CD1-CD1 3.6Å; F199-L239 HydrophobicContact CD2-CD1 4.08Å; F199-L239 HydrophobicContact CE1-CD1 3.52Å; F199-L239 HydrophobicContact CE2-CD1 3.99Å; F199-L239 HydrophobicContact CG-CD1 3.88Å; F199-L239 HydrophobicContact CZ-CD1 3.72Å; R235-L239 PolarHBondContact O-N 3.29Å; V236-L239 PolarHBondContact O-N 2.85Å; L239-K241 PolarHBondContact O-N 3.47Å; L239-I242 PolarHBondContact O-N 3.36Å; L239-I243 WeakPolarHBondContact O-CG1 3.39Å; L239-I243 PolarHBondContact O-N 2.88Å; L239-I243 VanDerWaalsContact O-N 3.07Å; L239-I283 HydrophobicContact CD1-CD1 4.32Å; L239-I283 HydrophobicContact CG-CD1 4.23Å; L239-L287 HydrophobicContact CD2-CD2 3.59Å; L239-M290 HydrophobicContact CD1-CE 4.18Å; L239-M290 HydrophobicContact CD2-CE 4.1Å; L239-M290 HydrophobicContact CD2-SD 3.65Å
240	S	91.9	Very high	89.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-32.9	178.7	75.1	0	0	0	0	112.3	H166 V236 K237 I238 K244	H166-S240 PolarHBondContact CE1-OG 3.08Å; H166-S240 PolarHBondContact ND1-OG 3.39Å; V236-S240 VanDerWaalsContact O-CB 3.32Å; V236-S240 WeakPolarHBondContact O-CB 3.24Å; V236-S240 PolarHBondContact O-N 3.1Å; V236-S240 PolarHBondContact O-OG 3.32Å; K237-S240 PolarHBondContact O-N 3.21Å; K237-S240 PolarHBondContact O-OG 3.17Å; I238-S240 PolarHBondContact O-N 3.4Å; S240-K244 WeakPolarHBondContact O-CB 3.33Å; S240-K244 WeakPolarHBondContact O-CG 3.33Å; S240-K244 PolarHBondContact O-N 3.3Å
241	K	92.4	Very high	88.6	Confident	117 Å²	117	50.3 Å²	50.3	51%	0.509	25%	0.251	S	S	.	.	H	α-helix	trans	-69.4	-46.8	178.3	178.2	57	175.3	157.6	0	110.3	K237 I238 L239 I243 K244 D245	K237-K241 VanDerWaalsContact O-CB 3.28Å; K237-K241 WeakPolarHBondContact O-CB 3.37Å; K237-K241 PolarHBondContact O-N 2.85Å; I238-K241 WeakPolarHBondContact O-CB 3.36Å; I238-K241 PolarHBondContact O-N 3.46Å; I238-K241 VanDerWaalsContact O-N 3.15Å; L239-K241 PolarHBondContact O-N 3.47Å; K241-I243 VanDerWaalsContact C-N 3.31Å; K241-I243 PolarHBondContact O-N 2.72Å; K241-K244 PolarHBondContact O-N 2.75Å; K241-D245 WeakPolarHBondContact CD-OD2 3.28Å; K241-D245 WeakPolarHBondContact CE-OD1 3.4Å; K241-D245 WeakPolarHBondContact CE-OD2 3.46Å; K241-D245 IonicContact NZ-OD1 2.71Å; K241-D245 PolarHBondContact NZ-OD1 3.36Å; K241-D245 IonicContact NZ-OD2 3.65Å; K241-D245 PolarHBondContact NZ-OD2 2.93Å; K241-D245 WeakPolarHBondContact O-CB 3.27Å; K241-D245 PolarHBondContact O-N 3.47Å
242	I	91.3	Very high	88.3	Confident	10 Å²	10	51 Å²	51	5%	0.051	25%	0.252	C	S	.	.	H	α-helix	trans	-52.9	-50.8	173.7	-66.5	166.7	0	0	0	110.3	I238 L239 K244 D245 I246 A266 L267 T270 L287	I238-I242 HydrophobicContact CG2-CD1 4.07Å; I238-I242 WeakPolarHBondContact O-CG1 3.35Å; I238-I242 PolarHBondContact O-N 3.41Å; L239-I242 PolarHBondContact O-N 3.36Å; I242-K244 PolarHBondContact O-N 3.27Å; I242-D245 PolarHBondContact O-N 2.9Å; I242-I246 HydrophobicContact CG2-CD1 3.85Å; I242-I246 VanDerWaalsContact O-CD1 3.28Å; I242-I246 WeakPolarHBondContact O-CD1 3.38Å; I242-I246 WeakPolarHBondContact O-CG1 3.31Å; I242-I246 PolarHBondContact O-N 3Å; I242-A266 HydrophobicContact CG2-CB 4.15Å; I242-L267 HydrophobicContact CG2-CD2 4.46Å; I242-T270 HydrophobicContact CD1-CG2 4.03Å; I242-T270 WeakPolarHBondContact CD1-OG1 2.91Å; I242-T270 HydrophobicContact CG1-CG2 3.96Å; I242-L287 HydrophobicContact CD1-CD2 3.7Å
243	I	91.1	Very high	87.9	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-41.3	-178.3	-60.3	163.6	0	0	0	111.5	F169 I170 V173 F192 L196 L239 K241 D245 I246 V247	F169-I243 HydrophobicContact CE1-CB 3.91Å; F169-I243 HydrophobicContact CE1-CG2 3.63Å; F169-I243 HydrophobicContact CZ-CG2 3.98Å; I170-I243 HydrophobicContact CG1-CD1 4.27Å; V173-I243 HydrophobicContact CG1-CG2 4.25Å; V173-I243 HydrophobicContact CG2-CG2 3.84Å; F192-I243 HydrophobicContact CE1-CD1 4.16Å; F192-I243 HydrophobicContact CE1-CG1 3.99Å; F192-I243 HydrophobicContact CZ-CD1 4.13Å; F192-I243 HydrophobicContact CZ-CG1 3.95Å; L196-I243 HydrophobicContact CD1-CD1 3.78Å; L196-I243 HydrophobicContact CD2-CD1 4.07Å; L239-I243 WeakPolarHBondContact O-CG1 3.39Å; L239-I243 PolarHBondContact O-N 2.88Å; L239-I243 VanDerWaalsContact O-N 3.07Å; K241-I243 VanDerWaalsContact C-N 3.31Å; K241-I243 PolarHBondContact O-N 2.72Å; I243-D245 VanDerWaalsContact C-N 3.32Å; I243-D245 PolarHBondContact O-N 2.9Å; I243-I246 PolarHBondContact O-N 3.23Å; I243-V247 HydrophobicContact CG2-CG2 3.98Å; I243-V247 VanDerWaalsContact O-CB 3.3Å; I243-V247 WeakPolarHBondContact O-CB 3.3Å; I243-V247 WeakPolarHBondContact O-CG2 3.48Å; I243-V247 PolarHBondContact O-N 3.03Å
244	K	89.7	Confident	87.6	Confident	85 Å²	85	51.5 Å²	51.5	37%	0.37	26%	0.255	S	S	.	.	H	α-helix	trans	-62.6	-39.2	177.8	-79.2	178	-179	-177.5	0	112.3	F169 S240 K241 I242 I246 V247 E248	F169-K244 HydrophobicContact CD1-CG 4.08Å; F169-K244 HydrophobicContact CE1-CB 4.47Å; F169-K244 HydrophobicContact CE1-CD 4.42Å; F169-K244 HydrophobicContact CE1-CG 3.46Å; F169-K244 VanDerWaalsContact CE1-CG 3.46Å; F169-K244 HydrophobicContact CE2-CG 4.38Å; F169-K244 HydrophobicContact CZ-CG 3.63Å; S240-K244 WeakPolarHBondContact O-CB 3.33Å; S240-K244 WeakPolarHBondContact O-CG 3.33Å; S240-K244 PolarHBondContact O-N 3.3Å; K241-K244 PolarHBondContact O-N 2.75Å; I242-K244 PolarHBondContact O-N 3.27Å; K244-I246 VanDerWaalsContact C-N 3.29Å; K244-I246 PolarHBondContact O-N 3.37Å; K244-V247 PolarHBondContact O-N 3.25Å; K244-E248 PolarHBondContact O-N 2.86Å
245	D	88.5	Confident	87.2	Confident	86 Å²	86	52.6 Å²	52.6	46%	0.46	25%	0.253	S	S	.	.	H	α-helix	trans	-68	-30.7	-179.5	-68.8	-13.7	0	0	0	111.9	K241 I242 I243	K241-D245 WeakPolarHBondContact CD-OD2 3.28Å; K241-D245 WeakPolarHBondContact CE-OD1 3.4Å; K241-D245 WeakPolarHBondContact CE-OD2 3.46Å; K241-D245 IonicContact NZ-OD1 2.71Å; K241-D245 PolarHBondContact NZ-OD1 3.36Å; K241-D245 IonicContact NZ-OD2 3.65Å; K241-D245 PolarHBondContact NZ-OD2 2.93Å; K241-D245 WeakPolarHBondContact O-CB 3.27Å; K241-D245 PolarHBondContact O-N 3.47Å; I242-D245 PolarHBondContact O-N 2.9Å; I243-D245 VanDerWaalsContact C-N 3.32Å; I243-D245 PolarHBondContact O-N 2.9Å
246	I	85.8	Confident	86.6	Confident	19 Å²	19	56.4 Å²	56.4	10%	0.097	27%	0.272	C	S	.	.	H	α-helix	trans	-82.1	-38.4	177.5	-62.6	157.1	0	0	0	111.8	I242 I243 K244 T259 L263 A266	I242-I246 HydrophobicContact CG2-CD1 3.85Å; I242-I246 VanDerWaalsContact O-CD1 3.28Å; I242-I246 WeakPolarHBondContact O-CD1 3.38Å; I242-I246 WeakPolarHBondContact O-CG1 3.31Å; I242-I246 PolarHBondContact O-N 3Å; I243-I246 PolarHBondContact O-N 3.23Å; K244-I246 VanDerWaalsContact C-N 3.29Å; K244-I246 PolarHBondContact O-N 3.37Å; I246-T259 HydrophobicContact CG2-CG2 4.49Å; I246-L263 HydrophobicContact CD1-CB 3.86Å; I246-L263 HydrophobicContact CD1-CD1 3.43Å; I246-L263 VanDerWaalsContact CD1-CD1 3.43Å; I246-L263 HydrophobicContact CD1-CG 4.25Å; I246-A266 HydrophobicContact CD1-CB 4.27Å
247	V	84.8	Confident	85.7	Confident	3 Å²	3	61 Å²	61	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-80	-26.9	-173.8	170.8	0	0	0	0	111.8	I243 K244 N249 N250 L251 N253 L254	I243-V247 HydrophobicContact CG2-CG2 3.98Å; I243-V247 VanDerWaalsContact O-CB 3.3Å; I243-V247 WeakPolarHBondContact O-CB 3.3Å; I243-V247 WeakPolarHBondContact O-CG2 3.48Å; I243-V247 PolarHBondContact O-N 3.03Å; K244-V247 PolarHBondContact O-N 3.25Å; V247-N249 PolarHBondContact O-N 3.23Å; V247-N250 WeakPolarHBondContact CG1-O 3.24Å; V247-N250 PolarHBondContact O-N 3.04Å; V247-L251 HydrophobicContact CG1-CD2 3.99Å; V247-L251 HydrophobicContact CG1-CG 4.29Å; V247-L251 HydrophobicContact CG2-CD2 4.5Å; V247-N253 PolarHBondContact O-ND2 3.04Å; V247-L254 HydrophobicContact CG2-CD1 4.3Å; V247-L254 HydrophobicContact CG2-CD2 4.03Å; V247-L254 HydrophobicContact CG2-CG 4.05Å
248	E	80.1	Confident	85.1	Confident	151 Å²	151	59.4 Å²	59.4	71%	0.706	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	35.9	179.9	-61.5	-172.4	171.7	0	0	113.8	K244	K244-E248 PolarHBondContact O-N 2.86Å
249	N	74.5	Confident	84.7	Confident	169 Å²	169	58.1 Å²	58.1	90%	0.904	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-3.6	-176.4	-45.7	-56.6	0	0	0	117.7	V247	V247-N249 PolarHBondContact O-N 3.23Å
250	N	82.3	Confident	84.2	Confident	73 Å²	73	58.6 Å²	58.6	39%	0.39	29%	0.293	S	S	.	.			trans	-118.4	109.5	174.5	-172	8	0	0	0	113	V247 D252 N253	V247-N250 WeakPolarHBondContact CG1-O 3.24Å; V247-N250 PolarHBondContact O-N 3.04Å; N250-D252 PolarHBondContact O-N 3.42Å; N250-D252 WeakPolarHBondContact OD1-CB 3.39Å; N250-D252 PolarHBondContact OD1-N 3.34Å; N250-D252 VanDerWaalsContact OD1-N 3.07Å; N250-N253 VanDerWaalsContact O-CB 3.22Å; N250-N253 WeakPolarHBondContact O-CB 3.45Å; N250-N253 PolarHBondContact O-N 3.32Å
251	L	81.9	Confident	83.9	Confident	34 Å²	34	58.6 Å²	58.6	18%	0.178	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-62.6	-23.6	179.1	-66.7	163.2	0	0	0	113.2	L172 V173 F176 V247 N253 L254	L172-L251 HydrophobicContact CD2-CD1 3.25Å; L172-L251 HydrophobicContact CD2-CD2 4.4Å; L172-L251 HydrophobicContact CD2-CG 4.44Å; V173-L251 HydrophobicContact CG2-CD2 3.77Å; F176-L251 HydrophobicContact CB-CD1 4.44Å; F176-L251 HydrophobicContact CD1-CB 4.06Å; F176-L251 HydrophobicContact CD2-CB 3.94Å; F176-L251 HydrophobicContact CD2-CD1 4.03Å; F176-L251 HydrophobicContact CE1-CB 3.93Å; F176-L251 WeakPolarHBondContact CE1-O 3.45Å; F176-L251 HydrophobicContact CE2-CB 3.82Å; F176-L251 HydrophobicContact CG-CB 4.08Å; F176-L251 HydrophobicContact CG-CD1 4.24Å; F176-L251 HydrophobicContact CZ-CB 3.82Å; V247-L251 HydrophobicContact CG1-CD2 3.99Å; V247-L251 HydrophobicContact CG1-CG 4.29Å; V247-L251 HydrophobicContact CG2-CD2 4.5Å; L251-N253 PolarHBondContact O-N 3.48Å; L251-L254 WeakPolarHBondContact O-CB 3.24Å; L251-L254 PolarHBondContact O-N 3.03Å
252	D	83.3	Confident	83.6	Confident	69 Å²	69	55.8 Å²	55.8	37%	0.369	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-65.8	-18.2	175.4	-69.1	-49	0	0	0	112.7	N250 L254 R255	N250-D252 PolarHBondContact O-N 3.42Å; N250-D252 WeakPolarHBondContact OD1-CB 3.39Å; N250-D252 PolarHBondContact OD1-N 3.34Å; N250-D252 VanDerWaalsContact OD1-N 3.07Å; D252-L254 PolarHBondContact O-N 2.9Å; D252-R255 WeakPolarHBondContact O-CB 3.39Å; D252-R255 PolarHBondContact O-N 3.05Å; D252-R255 IonicContact OD1-CZ 3.71Å; D252-R255 IonicContact OD1-NE 3.55Å; D252-R255 IonicContact OD1-NH1 2.67Å; D252-R255 PolarHBondContact OD1-NH1 3.03Å
253	N	84.7	Confident	83.5	Confident	36 Å²	36	55.5 Å²	55.5	19%	0.193	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-59.3	-30.9	175.2	-70.1	-11.8	0	0	0	111.4	V247 N250 L251 R255 Q256 T259	V247-N253 PolarHBondContact O-ND2 3.04Å; N250-N253 VanDerWaalsContact O-CB 3.22Å; N250-N253 WeakPolarHBondContact O-CB 3.45Å; N250-N253 PolarHBondContact O-N 3.32Å; L251-N253 PolarHBondContact O-N 3.48Å; N253-R255 PolarHBondContact O-N 3.11Å; N253-Q256 WeakPolarHBondContact O-CB 3.31Å; N253-Q256 PolarHBondContact O-N 3.44Å; N253-T259 HydrophobicContact CB-CG2 4.14Å; N253-T259 WeakPolarHBondContact O-CG2 3.46Å; N253-T259 PolarHBondContact O-OG1 3.48Å
254	L	82.7	Confident	83.4	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.042	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-60.1	-13.6	176.5	-65.8	173.6	0	0	0	114	V173 V177 M181 V189 V247 L251 D252 Q256	V173-L254 HydrophobicContact CG1-CD1 4.21Å; V177-L254 HydrophobicContact CG2-CD1 4.35Å; M181-L254 HydrophobicContact CE-CB 4.47Å; M181-L254 HydrophobicContact SD-CB 4.41Å; V189-L254 HydrophobicContact CG1-CB 4.47Å; V247-L254 HydrophobicContact CG2-CD1 4.3Å; V247-L254 HydrophobicContact CG2-CD2 4.03Å; V247-L254 HydrophobicContact CG2-CG 4.05Å; L251-L254 WeakPolarHBondContact O-CB 3.24Å; L251-L254 PolarHBondContact O-N 3.03Å; D252-L254 PolarHBondContact O-N 2.9Å; L254-Q256 VanDerWaalsContact C-N 3.32Å
255	R	81.7	Confident	83.3	Confident	112 Å²	112	52.2 Å²	52.2	42%	0.423	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-77.8	-17.3	174.2	-66	174.7	168.4	165.8	-4.6	112.9	K180 M181 H186 D252 N253	K180-R255 PolarHBondContact O-NH2 3.26Å; K180-R255 VanDerWaalsContact O-NH2 3.09Å; M181-R255 HydrophobicContact CE-CG 3.99Å; H186-R255 PolarHBondContact CE1-O 3.49Å; D252-R255 WeakPolarHBondContact O-CB 3.39Å; D252-R255 PolarHBondContact O-N 3.05Å; D252-R255 IonicContact OD1-CZ 3.71Å; D252-R255 IonicContact OD1-NE 3.55Å; D252-R255 IonicContact OD1-NH1 2.67Å; D252-R255 PolarHBondContact OD1-NH1 3.03Å; N253-R255 PolarHBondContact O-N 3.11Å
256	Q	81	Confident	83.3	Confident	102 Å²	102	49.4 Å²	49.4	48%	0.477	26%	0.26	S	S	.	.	S	Bend	trans	-84.5	140.2	-177.1	-58.8	-179.4	6	0	0	111.2	N253 L254 S258 T259	N253-Q256 WeakPolarHBondContact O-CB 3.31Å; N253-Q256 PolarHBondContact O-N 3.44Å; L254-Q256 VanDerWaalsContact C-N 3.32Å; Q256-S258 VanDerWaalsContact C-N 3.29Å; Q256-S258 PolarHBondContact O-N 2.87Å; Q256-S258 PolarHBondContact OE1-OG 2.87Å; Q256-T259 HydrophobicContact CB-CG2 4.22Å; Q256-T259 PolarHBondContact O-N 3.38Å; Q256-T259 VanDerWaalsContact O-N 3.13Å; Q256-T259 PolarHBondContact O-OG1 3.39Å
257	T	74	Confident	83.5	Confident	100 Å²	100	48.5 Å²	48.5	61%	0.613	26%	0.255	S	S	*	.	H	α-helix	trans	-61	-37.4	177	47.9	0	0	0	0	112.4	T259 T260 S261	T257-T259 PolarHBondContact O-N 3.13Å; T257-T260 WeakPolarHBondContact O-CB 3.18Å; T257-T260 PolarHBondContact O-N 2.88Å; T257-S261 PolarHBondContact O-N 3.16Å; T257-S261 PolarHBondContact O-OG 3.27Å
258	S	79.6	Confident	83.6	Confident	29 Å²	29	50.7 Å²	50.7	20%	0.203	26%	0.263	C	S	.	.	H	α-helix	trans	-58	-32.4	175.1	54.4	0	0	0	0	113.3	Q256 T260 S261 T262	Q256-S258 VanDerWaalsContact C-N 3.29Å; Q256-S258 PolarHBondContact O-N 2.87Å; Q256-S258 PolarHBondContact OE1-OG 2.87Å; S258-T260 VanDerWaalsContact C-N 3.34Å; S258-S261 VanDerWaalsContact C-OG 3.3Å; S258-S261 WeakPolarHBondContact CA-OG 3.4Å; S258-S261 PolarHBondContact O-OG 3.1Å; S258-T262 VanDerWaalsContact O-CG2 3.28Å; S258-T262 WeakPolarHBondContact O-CG2 3.41Å; S258-T262 PolarHBondContact O-N 3.38Å; S258-T262 VanDerWaalsContact O-N 3.1Å; S258-T262 PolarHBondContact O-OG1 3.27Å
259	T	83.5	Confident	84	Confident	12 Å²	12	49.4 Å²	49.4	7%	0.074	26%	0.257	C	S	.	.	H	α-helix	trans	-77	-24.8	176.7	66	0	0	0	0	112.9	I246 N253 Q256 T257 T262 L263	I246-T259 HydrophobicContact CG2-CG2 4.49Å; N253-T259 HydrophobicContact CB-CG2 4.14Å; N253-T259 WeakPolarHBondContact O-CG2 3.46Å; N253-T259 PolarHBondContact O-OG1 3.48Å; Q256-T259 HydrophobicContact CB-CG2 4.22Å; Q256-T259 PolarHBondContact O-N 3.38Å; Q256-T259 VanDerWaalsContact O-N 3.13Å; Q256-T259 PolarHBondContact O-OG1 3.39Å; T257-T259 PolarHBondContact O-N 3.13Å; T259-T262 VanDerWaalsContact CA-OG1 3.31Å; T259-T262 WeakPolarHBondContact CA-OG1 3.33Å; T259-T262 PolarHBondContact O-OG1 2.74Å; T259-T262 VanDerWaalsContact O-OG1 3.11Å; T259-L263 WeakPolarHBondContact O-CB 3.28Å; T259-L263 PolarHBondContact O-N 3.47Å
260	T	83.9	Confident	84.7	Confident	11 Å²	11	42.8 Å²	42.8	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-74.4	-40.1	177.3	-54.6	0	0	0	0	110.3	C188 T257 S258 L263 L264 F298	C188-T260 HydrophobicContact CB-CG2 3.5Å; C188-T260 VanDerWaalsContact CB-CG2 3.5Å; T257-T260 WeakPolarHBondContact O-CB 3.18Å; T257-T260 PolarHBondContact O-N 2.88Å; S258-T260 VanDerWaalsContact C-N 3.34Å; T260-L263 PolarHBondContact O-N 3.45Å; T260-L264 WeakPolarHBondContact O-CG 3.21Å; T260-L264 PolarHBondContact O-N 3.06Å; T260-F298 HydrophobicContact CG2-CE2 3.75Å; T260-F298 HydrophobicContact CG2-CZ 3.96Å
261	S	84.5	Confident	84.9	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.007	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-50.4	170.7	38.4	0	0	0	0	111.2	T257 S258 L263 L264 D265 S349 C350	T257-S261 PolarHBondContact O-N 3.16Å; T257-S261 PolarHBondContact O-OG 3.27Å; S258-S261 VanDerWaalsContact C-OG 3.3Å; S258-S261 WeakPolarHBondContact CA-OG 3.4Å; S258-S261 PolarHBondContact O-OG 3.1Å; S261-L263 VanDerWaalsContact C-N 3.25Å; S261-L263 PolarHBondContact O-N 3.22Å; S261-L264 PolarHBondContact O-N 3.44Å; S261-L264 VanDerWaalsContact O-N 3.12Å; S261-D265 WeakPolarHBondContact O-CB 3.28Å; S261-D265 PolarHBondContact O-N 3.2Å; S261-S349 PolarHBondContact OG-O 2.69Å; S261-C350 PolarHBondContact OG-O 3.32Å
262	T	87	Confident	85	Confident	57 Å²	57	39.6 Å²	39.6	35%	0.35	21%	0.206	S	C	.	.	H	α-helix	trans	-62.4	-32.7	178.1	60.6	0	0	0	0	112.6	S258 T259 A266	S258-T262 VanDerWaalsContact O-CG2 3.28Å; S258-T262 WeakPolarHBondContact O-CG2 3.41Å; S258-T262 PolarHBondContact O-N 3.38Å; S258-T262 VanDerWaalsContact O-N 3.1Å; S258-T262 PolarHBondContact O-OG1 3.27Å; T259-T262 VanDerWaalsContact CA-OG1 3.31Å; T259-T262 WeakPolarHBondContact CA-OG1 3.33Å; T259-T262 PolarHBondContact O-OG1 2.74Å; T259-T262 VanDerWaalsContact O-OG1 3.11Å; T262-A266 WeakPolarHBondContact O-CB 3.21Å; T262-A266 PolarHBondContact O-N 3.06Å
263	L	89.7	Confident	85.2	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-51.4	171.7	174.2	65.6	0	0	0	111.9	F192 I246 T259 T260 S261 D265 A266 L267 T294	F192-L263 HydrophobicContact CB-CD2 4.13Å; F192-L263 HydrophobicContact CD1-CD1 4.33Å; F192-L263 HydrophobicContact CD1-CD2 3.8Å; F192-L263 HydrophobicContact CD2-CD1 4.41Å; F192-L263 HydrophobicContact CD2-CD2 4.29Å; F192-L263 HydrophobicContact CE1-CD1 3.96Å; F192-L263 HydrophobicContact CE1-CD2 4.26Å; F192-L263 HydrophobicContact CE2-CD1 4.09Å; F192-L263 HydrophobicContact CG-CD2 3.81Å; F192-L263 HydrophobicContact CZ-CD1 3.84Å; I246-L263 HydrophobicContact CD1-CB 3.86Å; I246-L263 HydrophobicContact CD1-CD1 3.43Å; I246-L263 VanDerWaalsContact CD1-CD1 3.43Å; I246-L263 HydrophobicContact CD1-CG 4.25Å; T259-L263 WeakPolarHBondContact O-CB 3.28Å; T259-L263 PolarHBondContact O-N 3.47Å; T260-L263 PolarHBondContact O-N 3.45Å; S261-L263 VanDerWaalsContact C-N 3.25Å; S261-L263 PolarHBondContact O-N 3.22Å; L263-D265 VanDerWaalsContact C-N 3.29Å; L263-D265 PolarHBondContact O-N 3.29Å; L263-A266 PolarHBondContact O-N 2.89Å; L263-L267 HydrophobicContact CD1-CD1 4.16Å; L263-L267 HydrophobicContact CD1-CG 4.21Å; L263-L267 HydrophobicContact CG-CD1 4.18Å; L263-L267 WeakPolarHBondContact O-CB 3.28Å; L263-L267 VanDerWaalsContact O-CG 3.24Å; L263-L267 WeakPolarHBondContact O-CG 3.39Å; L263-L267 PolarHBondContact O-N 2.84Å; L263-T294 HydrophobicContact CD2-CG2 4.33Å
264	L	88.5	Confident	85.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-43.5	178	-75.4	169.5	0	0	0	111.4	T260 S261 L267 R268 F291 T294 F295 F298 P352	T260-L264 WeakPolarHBondContact O-CG 3.21Å; T260-L264 PolarHBondContact O-N 3.06Å; S261-L264 PolarHBondContact O-N 3.44Å; S261-L264 VanDerWaalsContact O-N 3.12Å; L264-L267 PolarHBondContact O-N 3.27Å; L264-R268 PolarHBondContact O-N 2.96Å; L264-F291 HydrophobicContact CB-CD2 4.29Å; L264-F291 HydrophobicContact CB-CE2 3.99Å; L264-F291 HydrophobicContact CD2-CD2 3.87Å; L264-F291 HydrophobicContact CD2-CE2 3.98Å; L264-F291 VanDerWaalsContact O-CD2 3.25Å; L264-F291 WeakPolarHBondContact O-CD2 3.21Å; L264-F291 WeakPolarHBondContact O-CE2 3.33Å; L264-T294 HydrophobicContact CD2-CG2 3.65Å; L264-T294 HydrophobicContact CG-CG2 4.24Å; L264-F295 HydrophobicContact CD1-CD2 3.94Å; L264-F295 HydrophobicContact CD2-CB 4Å; L264-F295 HydrophobicContact CD2-CD2 4.42Å; L264-F298 HydrophobicContact CD1-CD2 3.83Å; L264-F298 HydrophobicContact CD1-CE2 3.6Å; L264-P352 HydrophobicContact CD1-CB 4.19Å; L264-P352 HydrophobicContact CD1-CG 3.83Å
265	D	87.5	Confident	85.1	Confident	20 Å²	20	42 Å²	42	11%	0.107	22%	0.217	C	C	.	.	H	α-helix	trans	-68.1	-40.7	180	-64.1	-29.4	0	0	0	111.5	S261 L263 R268 H269 Y353	S261-D265 WeakPolarHBondContact O-CB 3.28Å; S261-D265 PolarHBondContact O-N 3.2Å; L263-D265 VanDerWaalsContact C-N 3.29Å; L263-D265 PolarHBondContact O-N 3.29Å; D265-R268 PolarHBondContact O-N 3.06Å; D265-H269 WeakPolarHBondContact O-CB 3.48Å; D265-H269 PolarHBondContact O-N 2.89Å; D265-Y353 HydrophobicContact CB-CD2 3.72Å; D265-Y353 HydrophobicContact CB-CE2 4.09Å; D265-Y353 WeakPolarHBondContact OD1-CD2 3.32Å; D265-Y353 PolarHBondContact OD1-N 2.97Å; D265-Y353 VanDerWaalsContact OD2-CD2 3.31Å; D265-Y353 WeakPolarHBondContact OD2-CD2 3.37Å
266	A	89.1	Confident	85.1	Confident	27 Å²	27	41.9 Å²	41.9	22%	0.223	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-42.7	174.1	0	0	0	0	0	111.4	I242 I246 T262 L263 T270	I242-A266 HydrophobicContact CG2-CB 4.15Å; I246-A266 HydrophobicContact CD1-CB 4.27Å; T262-A266 WeakPolarHBondContact O-CB 3.21Å; T262-A266 PolarHBondContact O-N 3.06Å; L263-A266 PolarHBondContact O-N 2.89Å; A266-T270 VanDerWaalsContact O-CB 3.25Å; A266-T270 WeakPolarHBondContact O-CB 3.3Å; A266-T270 VanDerWaalsContact O-CG2 3.23Å; A266-T270 WeakPolarHBondContact O-CG2 3.28Å; A266-T270 PolarHBondContact O-N 3.2Å; A266-T270 PolarHBondContact O-OG1 3.45Å
267	L	90.1	Very high	85.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-45.2	176.1	-71.5	172.5	0	0	0	111.5	F192 I242 L263 L264 T270 S271 L287 M290 F291	F192-L267 HydrophobicContact CD2-CD1 4.07Å; F192-L267 HydrophobicContact CE2-CD1 4.03Å; F192-L267 HydrophobicContact CE2-CD2 4.09Å; I242-L267 HydrophobicContact CG2-CD2 4.46Å; L263-L267 HydrophobicContact CD1-CD1 4.16Å; L263-L267 HydrophobicContact CD1-CG 4.21Å; L263-L267 HydrophobicContact CG-CD1 4.18Å; L263-L267 WeakPolarHBondContact O-CB 3.28Å; L263-L267 VanDerWaalsContact O-CG 3.24Å; L263-L267 WeakPolarHBondContact O-CG 3.39Å; L263-L267 PolarHBondContact O-N 2.84Å; L264-L267 PolarHBondContact O-N 3.27Å; L267-T270 PolarHBondContact O-OG1 3.49Å; L267-S271 VanDerWaalsContact O-CB 3.24Å; L267-S271 WeakPolarHBondContact O-CB 3.21Å; L267-S271 PolarHBondContact O-N 3.08Å; L267-L287 HydrophobicContact CD2-CD2 3.72Å; L267-M290 HydrophobicContact CD1-CB 4.27Å; L267-M290 HydrophobicContact CD2-CB 4.39Å; L267-F291 HydrophobicContact CB-CB 4.21Å; L267-F291 HydrophobicContact CB-CD2 4.41Å
268	R	86.4	Confident	85.2	Confident	49 Å²	49	39 Å²	39	19%	0.185	23%	0.229	C	C	.	.	H	α-helix	trans	-64.6	-52.5	177.1	-175.7	176.1	-179.2	168	4	111.4	L264 D265 T270 S271 D272 F291 E435	L264-R268 PolarHBondContact O-N 2.96Å; D265-R268 PolarHBondContact O-N 3.06Å; R268-T270 PolarHBondContact O-N 2.94Å; R268-S271 WeakPolarHBondContact O-CB 3.18Å; R268-S271 PolarHBondContact O-N 3.22Å; R268-D272 PolarHBondContact O-N 2.95Å; R268-F291 HydrophobicContact CB-CD2 4.07Å; R268-F291 HydrophobicContact CB-CE2 4.06Å; R268-E435 IonicContact CZ-OE2 2.68Å; R268-E435 IonicContact NH1-OE2 3.72Å; R268-E435 IonicContact NH2-OE2 2.63Å; R268-E435 PolarHBondContact NH2-OE2 3Å
269	H	88.5	Confident	85	Confident	124 Å²	124	43.4 Å²	43.4	57%	0.574	25%	0.245	S	C	*	.	H	α-helix	trans	-62.1	-43.9	-177.7	-180	-79.9	0	0	0	112.1	D265 D272 L273	D265-H269 WeakPolarHBondContact O-CB 3.48Å; D265-H269 PolarHBondContact O-N 2.89Å; H269-D272 PolarHBondContact O-N 2.62Å; H269-L273 VanDerWaalsContact O-CB 3.31Å; H269-L273 WeakPolarHBondContact O-CB 3.45Å; H269-L273 PolarHBondContact O-N 2.75Å
270	T	88.3	Confident	84.9	Confident	30 Å²	30	45.4 Å²	45.4	18%	0.184	26%	0.255	C	S	.	.	H	α-helix	trans	-68.2	-37.6	177.8	54.6	0	0	0	0	112.2	I242 A266 L267 R268 D272 L274	I242-T270 HydrophobicContact CD1-CG2 4.03Å; I242-T270 WeakPolarHBondContact CD1-OG1 2.91Å; I242-T270 HydrophobicContact CG1-CG2 3.96Å; A266-T270 VanDerWaalsContact O-CB 3.25Å; A266-T270 WeakPolarHBondContact O-CB 3.3Å; A266-T270 VanDerWaalsContact O-CG2 3.23Å; A266-T270 WeakPolarHBondContact O-CG2 3.28Å; A266-T270 PolarHBondContact O-N 3.2Å; A266-T270 PolarHBondContact O-OG1 3.45Å; L267-T270 PolarHBondContact O-OG1 3.49Å; R268-T270 PolarHBondContact O-N 2.94Å; T270-D272 VanDerWaalsContact C-N 3.35Å; T270-L274 WeakPolarHBondContact O-CB 3.3Å; T270-L274 WeakPolarHBondContact O-CD1 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.43Å; T270-L274 PolarHBondContact O-N 3.46Å
271	S	86.4	Confident	84.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-46.7	172.3	175.5	0	0	0	0	111.9	L267 R268 E275 R288	L267-S271 VanDerWaalsContact O-CB 3.24Å; L267-S271 WeakPolarHBondContact O-CB 3.21Å; L267-S271 PolarHBondContact O-N 3.08Å; R268-S271 WeakPolarHBondContact O-CB 3.18Å; R268-S271 PolarHBondContact O-N 3.22Å; S271-E275 PolarHBondContact O-N 2.87Å; S271-E275 VanDerWaalsContact O-N 3.13Å; S271-R288 WeakPolarHBondContact OG-CG 3.23Å; S271-R288 PolarHBondContact OG-NE 3.16Å
272	D	85.7	Confident	84.8	Confident	41 Å²	41	50.3 Å²	50.3	22%	0.219	28%	0.277	C	S	.	.	H	α-helix	trans	-69.8	-42.3	-177.2	-69.2	-20.1	0	0	0	110.9	R268 H269 T270 L274 E275 D276 R288	R268-D272 PolarHBondContact O-N 2.95Å; H269-D272 PolarHBondContact O-N 2.62Å; T270-D272 VanDerWaalsContact C-N 3.35Å; D272-L274 PolarHBondContact O-N 2.97Å; D272-E275 PolarHBondContact O-N 3.37Å; D272-D276 PolarHBondContact O-N 3.01Å; D272-R288 IonicContact OD1-NH2 3.98Å; D272-R288 PolarHBondContact OD1-NH2 2.83Å
273	L	86.3	Confident	84.8	Confident	93 Å²	93	47.7 Å²	47.7	49%	0.487	26%	0.26	S	S	.	.	H	α-helix	trans	-59.9	-43	175.5	-178.4	68.2	0	0	0	112.5	H269 D276 C277	H269-L273 VanDerWaalsContact O-CB 3.31Å; H269-L273 WeakPolarHBondContact O-CB 3.45Å; H269-L273 PolarHBondContact O-N 2.75Å; L273-D276 PolarHBondContact O-N 3.23Å; L273-C277 WeakPolarHBondContact O-CB 3.31Å; L273-C277 PolarHBondContact O-N 3.41Å; L273-C277 PolarHBondContact O-SG 3.18Å
274	L	85.2	Confident	84.6	Confident	20 Å²	20	47.9 Å²	47.9	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-35	179.9	-73	170.2	0	0	0	112.1	I238 T270 D272 G278 F279 I283 V284 L287	I238-L274 HydrophobicContact CD1-CD1 4.21Å; I238-L274 HydrophobicContact CD1-CD2 4.25Å; I238-L274 HydrophobicContact CG2-CD1 4.05Å; T270-L274 WeakPolarHBondContact O-CB 3.3Å; T270-L274 WeakPolarHBondContact O-CD1 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.43Å; T270-L274 PolarHBondContact O-N 3.46Å; D272-L274 PolarHBondContact O-N 2.97Å; L274-G278 PolarHBondContact O-N 2.96Å; L274-F279 HydrophobicContact CB-CB 4.28Å; L274-F279 HydrophobicContact CD2-CB 3.91Å; L274-F279 HydrophobicContact CD2-CD1 4.27Å; L274-F279 HydrophobicContact CD2-CD2 4.15Å; L274-F279 HydrophobicContact CD2-CG 3.86Å; L274-F279 WeakPolarHBondContact O-CB 3.41Å; L274-F279 PolarHBondContact O-N 2.69Å; L274-I283 HydrophobicContact CD1-CG2 4.09Å; L274-V284 HydrophobicContact CB-CG2 3.81Å; L274-L287 HydrophobicContact CD1-CD1 3.6Å
275	E	81.3	Confident	84.4	Confident	51 Å²	51	51.2 Å²	51.2	24%	0.238	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-48.6	173.2	-174.8	177.3	-126.5	0	0	111.3	S271 D272 C277 G278 V284 R288 R428	S271-E275 PolarHBondContact O-N 2.87Å; S271-E275 VanDerWaalsContact O-N 3.13Å; D272-E275 PolarHBondContact O-N 3.37Å; E275-C277 PolarHBondContact O-N 3.31Å; E275-G278 PolarHBondContact O-N 3.2Å; E275-V284 HydrophobicContact CB-CG1 4.23Å; E275-R288 VanDerWaalsContact CD-NH2 3.32Å; E275-R288 IonicContact OE1-CZ 2.86Å; E275-R288 IonicContact OE1-NH1 3.07Å; E275-R288 PolarHBondContact OE1-NH1 2.93Å; E275-R288 IonicContact OE1-NH2 2.64Å; E275-R288 IonicContact OE2-CZ 3.71Å; E275-R288 IonicContact OE2-NH1 3Å; E275-R288 PolarHBondContact OE2-NH1 3.22Å; E275-R288 IonicContact OE2-NH2 3.63Å; E275-R288 PolarHBondContact OE2-NH2 3.01Å; E275-R428 WeakPolarHBondContact OE2-CD 3.06Å
276	D	80.2	Confident	84.3	Confident	109 Å²	109	50.6 Å²	50.6	58%	0.583	27%	0.274	S	S	*	.	H	α-helix	trans	-62	-31.8	179.5	-72.3	-22.5	0	0	0	111.8	D272 L273 G278 R428	D272-D276 PolarHBondContact O-N 3.01Å; L273-D276 PolarHBondContact O-N 3.23Å; D276-G278 VanDerWaalsContact C-N 3.31Å; D276-R428 IonicContact OD1-NH1 2.67Å
277	C	83.5	Confident	84.3	Confident	75 Å²	75	49.3 Å²	49.3	51%	0.507	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-3.4	175.7	-65	0	0	0	0	113.8	L273 E275 F279	L273-C277 WeakPolarHBondContact O-CB 3.31Å; L273-C277 PolarHBondContact O-N 3.41Å; L273-C277 PolarHBondContact O-SG 3.18Å; E275-C277 PolarHBondContact O-N 3.31Å; C277-F279 HydrophobicContact CB-CD2 3.54Å; C277-F279 HydrophobicContact CB-CE2 3.88Å; C277-F279 PolarHBondContact O-N 3.27Å
278	G	75.1	Confident	84.1	Confident	66 Å²	66	49.6 Å²	49.6	68%	0.68	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	32.2	-179.5	0	0	0	0	0	114.5	L274 E275 D276	L274-G278 PolarHBondContact O-N 2.96Å; E275-G278 PolarHBondContact O-N 3.2Å; D276-G278 VanDerWaalsContact C-N 3.31Å
279	F	74.4	Confident	84	Confident	122 Å²	122	47.8 Å²	47.8	54%	0.535	26%	0.26	S	S	.	.			trans	-73.8	-178	177.7	-92.9	-98.4	0	0	0	112.7	L274 C277 Q281	L274-F279 HydrophobicContact CB-CB 4.28Å; L274-F279 HydrophobicContact CD2-CB 3.91Å; L274-F279 HydrophobicContact CD2-CD1 4.27Å; L274-F279 HydrophobicContact CD2-CD2 4.15Å; L274-F279 HydrophobicContact CD2-CG 3.86Å; L274-F279 WeakPolarHBondContact O-CB 3.41Å; L274-F279 PolarHBondContact O-N 2.69Å; C277-F279 HydrophobicContact CB-CD2 3.54Å; C277-F279 HydrophobicContact CB-CE2 3.88Å; C277-F279 PolarHBondContact O-N 3.27Å; F279-Q281 PolarHBondContact O-N 2.99Å
280	D	81	Confident	84	Confident	54 Å²	54	41.9 Å²	41.9	29%	0.289	23%	0.232	S	C	.	.			trans	-46.7	108	177.3	-176	-4.7	0	0	0	112.9	R235 Y282 I283 V284	R235-D280 IonicContact CZ-OD2 3.81Å; R235-D280 IonicContact NE-OD2 3.74Å; R235-D280 PolarHBondContact NE-OD2 3.3Å; R235-D280 IonicContact NH2-OD1 2.72Å; R235-D280 PolarHBondContact NH2-OD1 3.45Å; R235-D280 IonicContact NH2-OD2 2.89Å; R235-D280 PolarHBondContact NH2-OD2 2.98Å; D280-Y282 PolarHBondContact O-N 2.86Å; D280-Y282 VanDerWaalsContact O-N 3.12Å; D280-Y282 WeakPolarHBondContact OD1-CB 3.41Å; D280-Y282 PolarHBondContact OD1-N 3.22Å; D280-Y282 VanDerWaalsContact OD1-N 3.1Å; D280-I283 HydrophobicContact CB-CG2 4.11Å; D280-I283 VanDerWaalsContact O-CG2 3.23Å; D280-I283 WeakPolarHBondContact O-CG2 3.34Å; D280-I283 PolarHBondContact O-N 3.1Å; D280-I283 VanDerWaalsContact O-N 3.1Å; D280-V284 PolarHBondContact O-N 2.7Å
281	Q	82.4	Confident	84	Confident	102 Å²	102	40.5 Å²	40.5	48%	0.477	22%	0.224	S	C	.	.	H	α-helix	trans	-59.1	-28.7	-177.3	-70.1	-174.9	-16	0	0	112.9	F279 V284 Q285	F279-Q281 PolarHBondContact O-N 2.99Å; Q281-V284 PolarHBondContact O-N 3.14Å; Q281-Q285 WeakPolarHBondContact O-CG 3.47Å; Q281-Q285 PolarHBondContact O-N 3.46Å
282	Y	83.8	Confident	83.9	Confident	13 Å²	13	41 Å²	41	5%	0.051	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-43.2	178.1	165.9	-86.6	0	0	0	111.4	F199 Q202 R235 D280 V284 Q285 V286 L410	F199-Y282 HydrophobicContact CE2-CE1 4.19Å; Q202-Y282 PolarHBondContact OE1-OH 3.38Å; R235-Y282 HydrophobicContact CG-CD1 4.43Å; D280-Y282 PolarHBondContact O-N 2.86Å; D280-Y282 VanDerWaalsContact O-N 3.12Å; D280-Y282 WeakPolarHBondContact OD1-CB 3.41Å; D280-Y282 PolarHBondContact OD1-N 3.22Å; D280-Y282 VanDerWaalsContact OD1-N 3.1Å; Y282-V284 VanDerWaalsContact C-N 3.32Å; Y282-V284 PolarHBondContact O-N 2.84Å; Y282-Q285 PolarHBondContact O-N 3.5Å; Y282-V286 HydrophobicContact CD1-CG2 4.27Å; Y282-V286 HydrophobicContact CD2-CG2 4.47Å; Y282-V286 HydrophobicContact CE1-CG2 3.8Å; Y282-V286 HydrophobicContact CE2-CG2 4.06Å; Y282-V286 WeakPolarHBondContact O-CG2 3.47Å; Y282-V286 PolarHBondContact O-N 3.45Å; Y282-L410 HydrophobicContact CD2-CD1 3.35Å; Y282-L410 HydrophobicContact CE2-CD1 3.86Å; Y282-L410 HydrophobicContact CG-CD1 3.82Å
283	I	87.1	Confident	83.8	Confident	1 Å²	1	41 Å²	41	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-68.7	-35.1	179.4	-164.6	58.5	0	0	0	111.3	R235 I238 L239 L274 D280 Q285 V286 L287	R235-I283 HydrophobicContact CB-CD1 4.09Å; R235-I283 HydrophobicContact CG-CB 4.23Å; R235-I283 HydrophobicContact CG-CD1 4.34Å; I238-I283 HydrophobicContact CD1-CG1 4.4Å; I238-I283 HydrophobicContact CD1-CG2 4.24Å; L239-I283 HydrophobicContact CD1-CD1 4.32Å; L239-I283 HydrophobicContact CG-CD1 4.23Å; L274-I283 HydrophobicContact CD1-CG2 4.09Å; D280-I283 HydrophobicContact CB-CG2 4.11Å; D280-I283 VanDerWaalsContact O-CG2 3.23Å; D280-I283 WeakPolarHBondContact O-CG2 3.34Å; D280-I283 PolarHBondContact O-N 3.1Å; D280-I283 VanDerWaalsContact O-N 3.1Å; I283-Q285 VanDerWaalsContact C-N 3.33Å; I283-Q285 PolarHBondContact O-N 2.99Å; I283-V286 HydrophobicContact CD1-CB 4.33Å; I283-V286 HydrophobicContact CD1-CG1 4.39Å; I283-V286 PolarHBondContact O-N 3.05Å; I283-L287 HydrophobicContact CG1-CD1 4.26Å; I283-L287 HydrophobicContact CG1-CG 4.31Å; I283-L287 WeakPolarHBondContact O-CB 3.21Å; I283-L287 VanDerWaalsContact O-CG 3.29Å; I283-L287 WeakPolarHBondContact O-CG 3.41Å; I283-L287 PolarHBondContact O-N 3.17Å
284	V	85.9	Confident	83.9	Confident	8 Å²	8	36.6 Å²	36.6	5%	0.048	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-47	174	177.2	0	0	0	0	110	L274 E275 D280 Q281 Y282 V286 L287 R288	L274-V284 HydrophobicContact CB-CG2 3.81Å; E275-V284 HydrophobicContact CB-CG1 4.23Å; D280-V284 PolarHBondContact O-N 2.7Å; Q281-V284 PolarHBondContact O-N 3.14Å; Y282-V284 VanDerWaalsContact C-N 3.32Å; Y282-V284 PolarHBondContact O-N 2.84Å; V284-V286 PolarHBondContact O-N 3.42Å; V284-L287 PolarHBondContact O-N 3.18Å; V284-R288 WeakPolarHBondContact O-CG 3.43Å; V284-R288 PolarHBondContact O-N 3.14Å
285	Q	83.6	Confident	83.9	Confident	70 Å²	70	35.6 Å²	35.6	33%	0.327	20%	0.198	S	C	.	.	H	α-helix	trans	-62.7	-42.1	176.6	-71.4	175.3	1.4	0	0	112.7	Q281 Y282 I283 R288 S289	Q281-Q285 WeakPolarHBondContact O-CG 3.47Å; Q281-Q285 PolarHBondContact O-N 3.46Å; Y282-Q285 PolarHBondContact O-N 3.5Å; I283-Q285 VanDerWaalsContact C-N 3.33Å; I283-Q285 PolarHBondContact O-N 2.99Å; Q285-R288 PolarHBondContact O-N 3.41Å; Q285-S289 WeakPolarHBondContact O-CB 3.35Å; Q285-S289 PolarHBondContact O-N 3.33Å; Q285-S289 PolarHBondContact O-OG 3.29Å
286	V	86.4	Confident	84	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-42.3	176.4	170.9	0	0	0	0	111.7	F199 Y282 I283 V284 S289 M290	F199-V286 HydrophobicContact CD2-CG1 4.13Å; Y282-V286 HydrophobicContact CD1-CG2 4.27Å; Y282-V286 HydrophobicContact CD2-CG2 4.47Å; Y282-V286 HydrophobicContact CE1-CG2 3.8Å; Y282-V286 HydrophobicContact CE2-CG2 4.06Å; Y282-V286 WeakPolarHBondContact O-CG2 3.47Å; Y282-V286 PolarHBondContact O-N 3.45Å; I283-V286 HydrophobicContact CD1-CB 4.33Å; I283-V286 HydrophobicContact CD1-CG1 4.39Å; I283-V286 PolarHBondContact O-N 3.05Å; V284-V286 PolarHBondContact O-N 3.42Å; V286-S289 PolarHBondContact O-N 3.47Å; V286-S289 PolarHBondContact O-OG 2.76Å; V286-M290 HydrophobicContact CG1-CE 3.54Å; V286-M290 HydrophobicContact CG1-CG 4.43Å; V286-M290 HydrophobicContact CG1-SD 4.01Å; V286-M290 VanDerWaalsContact O-CB 3.3Å; V286-M290 WeakPolarHBondContact O-CB 3.45Å; V286-M290 WeakPolarHBondContact O-CG 3.48Å; V286-M290 PolarHBondContact O-N 2.94Å
287	L	89.2	Confident	84.1	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-39.2	178	-70.6	172.3	0	0	0	111.8	I238 L239 I242 L267 L274 I283 V284 M290 F291	I238-L287 HydrophobicContact CG2-CD1 4.38Å; L239-L287 HydrophobicContact CD2-CD2 3.59Å; I242-L287 HydrophobicContact CD1-CD2 3.7Å; L267-L287 HydrophobicContact CD2-CD2 3.72Å; L274-L287 HydrophobicContact CD1-CD1 3.6Å; I283-L287 HydrophobicContact CG1-CD1 4.26Å; I283-L287 HydrophobicContact CG1-CG 4.31Å; I283-L287 WeakPolarHBondContact O-CB 3.21Å; I283-L287 VanDerWaalsContact O-CG 3.29Å; I283-L287 WeakPolarHBondContact O-CG 3.41Å; I283-L287 PolarHBondContact O-N 3.17Å; V284-L287 PolarHBondContact O-N 3.18Å; L287-M290 WeakPolarHBondContact O-CB 3.5Å; L287-M290 PolarHBondContact O-N 3.39Å; L287-F291 WeakPolarHBondContact O-CB 3.41Å; L287-F291 PolarHBondContact O-N 2.83Å
288	R	85.2	Confident	84.1	Confident	6 Å²	6	30 Å²	30	2%	0.023	16%	0.161	C	C	.	.	H	α-helix	trans	-66.2	-42.9	174.9	-69.3	-175.6	168.2	158.1	-1.6	112.1	S271 D272 E275 V284 Q285 F291 I292 S427 L431	S271-R288 WeakPolarHBondContact OG-CG 3.23Å; S271-R288 PolarHBondContact OG-NE 3.16Å; D272-R288 IonicContact OD1-NH2 3.98Å; D272-R288 PolarHBondContact OD1-NH2 2.83Å; E275-R288 VanDerWaalsContact CD-NH2 3.32Å; E275-R288 IonicContact OE1-CZ 2.86Å; E275-R288 IonicContact OE1-NH1 3.07Å; E275-R288 PolarHBondContact OE1-NH1 2.93Å; E275-R288 IonicContact OE1-NH2 2.64Å; E275-R288 IonicContact OE2-CZ 3.71Å; E275-R288 IonicContact OE2-NH1 3Å; E275-R288 PolarHBondContact OE2-NH1 3.22Å; E275-R288 IonicContact OE2-NH2 3.63Å; E275-R288 PolarHBondContact OE2-NH2 3.01Å; V284-R288 WeakPolarHBondContact O-CG 3.43Å; V284-R288 PolarHBondContact O-N 3.14Å; Q285-R288 PolarHBondContact O-N 3.41Å; R288-F291 WeakPolarHBondContact O-CB 3.44Å; R288-F291 PolarHBondContact O-N 3.2Å; R288-I292 VanDerWaalsContact O-CG1 3.31Å; R288-I292 WeakPolarHBondContact O-CG1 3.32Å; R288-I292 PolarHBondContact O-N 2.98Å; R288-S427 PolarHBondContact NH1-OG 3.42Å; R288-L431 HydrophobicContact CG-CD1 4Å
289	S	83.9	Confident	84.4	Confident	11 Å²	11	26.9 Å²	26.9	8%	0.077	13%	0.129	C	C	.	.	H	α-helix	trans	-65.7	-41.4	176.4	68.6	0	0	0	0	111.3	Q285 V286 F291 I292 I293	Q285-S289 WeakPolarHBondContact O-CB 3.35Å; Q285-S289 PolarHBondContact O-N 3.33Å; Q285-S289 PolarHBondContact O-OG 3.29Å; V286-S289 PolarHBondContact O-N 3.47Å; V286-S289 PolarHBondContact O-OG 2.76Å; S289-F291 VanDerWaalsContact C-N 3.34Å; S289-F291 PolarHBondContact O-N 3.24Å; S289-I292 PolarHBondContact O-N 3.39Å; S289-I293 WeakPolarHBondContact O-CB 3.47Å; S289-I293 WeakPolarHBondContact O-CD1 3.37Å; S289-I293 VanDerWaalsContact O-CG1 3.27Å; S289-I293 WeakPolarHBondContact O-CG1 3.23Å; S289-I293 PolarHBondContact O-N 2.67Å
290	M	88.4	Confident	84.6	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-56.2	-47.7	171.2	-79.8	177.2	-178	0	0	111.3	F192 C195 L196 F199 L239 L267 V286 L287 T294	F192-M290 HydrophobicContact CE2-SD 4.09Å; C195-M290 HydrophobicContact CB-CB 4.46Å; C195-M290 HydrophobicContact CB-CE 4.15Å; C195-M290 HydrophobicContact CB-CG 3.53Å; L196-M290 HydrophobicContact CD2-CE 3.99Å; L196-M290 HydrophobicContact CD2-SD 4.49Å; F199-M290 HydrophobicContact CB-CE 4.01Å; L239-M290 HydrophobicContact CD1-CE 4.18Å; L239-M290 HydrophobicContact CD2-CE 4.1Å; L239-M290 HydrophobicContact CD2-SD 3.65Å; L267-M290 HydrophobicContact CD1-CB 4.27Å; L267-M290 HydrophobicContact CD2-CB 4.39Å; V286-M290 HydrophobicContact CG1-CE 3.54Å; V286-M290 HydrophobicContact CG1-CG 4.43Å; V286-M290 HydrophobicContact CG1-SD 4.01Å; V286-M290 VanDerWaalsContact O-CB 3.3Å; V286-M290 WeakPolarHBondContact O-CB 3.45Å; V286-M290 WeakPolarHBondContact O-CG 3.48Å; V286-M290 PolarHBondContact O-N 2.94Å; L287-M290 WeakPolarHBondContact O-CB 3.5Å; L287-M290 PolarHBondContact O-N 3.39Å; M290-T294 WeakPolarHBondContact O-CB 3.17Å; M290-T294 PolarHBondContact O-N 3.18Å; M290-T294 PolarHBondContact O-OG1 3.03Å
291	F	89	Confident	84.6	Confident	2 Å²	2	23 Å²	23	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-57.8	-52.8	176.4	174.5	-90.5	0	0	0	111.4	L264 L267 R268 L287 R288 S289 I293 T294 F295 M354 L431 L434	L264-F291 HydrophobicContact CB-CD2 4.29Å; L264-F291 HydrophobicContact CB-CE2 3.99Å; L264-F291 HydrophobicContact CD2-CD2 3.87Å; L264-F291 HydrophobicContact CD2-CE2 3.98Å; L264-F291 VanDerWaalsContact O-CD2 3.25Å; L264-F291 WeakPolarHBondContact O-CD2 3.21Å; L264-F291 WeakPolarHBondContact O-CE2 3.33Å; L267-F291 HydrophobicContact CB-CB 4.21Å; L267-F291 HydrophobicContact CB-CD2 4.41Å; R268-F291 HydrophobicContact CB-CD2 4.07Å; R268-F291 HydrophobicContact CB-CE2 4.06Å; L287-F291 WeakPolarHBondContact O-CB 3.41Å; L287-F291 PolarHBondContact O-N 2.83Å; R288-F291 WeakPolarHBondContact O-CB 3.44Å; R288-F291 PolarHBondContact O-N 3.2Å; S289-F291 VanDerWaalsContact C-N 3.34Å; S289-F291 PolarHBondContact O-N 3.24Å; F291-I293 PolarHBondContact O-N 3.01Å; F291-T294 PolarHBondContact O-N 3.3Å; F291-F295 HydrophobicContact CE1-CB 4.44Å; F291-F295 HydrophobicContact CZ-CD2 4.48Å; F291-F295 HydrophobicContact CZ-CG 4.43Å; F291-F295 WeakPolarHBondContact O-CB 3.23Å; F291-F295 PolarHBondContact O-N 3.43Å; F291-M354 HydrophobicContact CE1-CE 3.5Å; F291-M354 HydrophobicContact CE1-SD 4.12Å; F291-M354 HydrophobicContact CZ-CE 3.52Å; F291-M354 HydrophobicContact CZ-SD 3.98Å; F291-L431 HydrophobicContact CD1-CD2 3.54Å; F291-L431 HydrophobicContact CE1-CD2 3.75Å; F291-L434 HydrophobicContact CE1-CD2 4.37Å
292	I	84	Confident	84.6	Confident	11 Å²	11	18.2 Å²	18.2	6%	0.056	10%	0.099	C	C	.	.	H	α-helix	trans	-60.4	-46.5	-176.9	-66.8	166.1	0	0	0	111.2	R288 S289 F295 H296 L397 L400 L431 L434	R288-I292 VanDerWaalsContact O-CG1 3.31Å; R288-I292 WeakPolarHBondContact O-CG1 3.32Å; R288-I292 PolarHBondContact O-N 2.98Å; S289-I292 PolarHBondContact O-N 3.39Å; I292-F295 PolarHBondContact O-N 3.4Å; I292-H296 PolarHBondContact O-N 3.38Å; I292-L397 HydrophobicContact CG2-CD2 3.93Å; I292-L400 HydrophobicContact CD1-CD2 4.38Å; I292-L431 HydrophobicContact CG1-CD2 4.28Å; I292-L434 HydrophobicContact CG1-CD2 4.41Å
293	I	85.1	Confident	84.4	Confident	40 Å²	40	19 Å²	19	21%	0.205	11%	0.105	C	C	.	.	H	α-helix	trans	-68.7	-38.7	-178.8	-65.7	164	0	0	0	111.2	S191 C195 S289 F291 F295 H296 P297 L401 F406	S191-I293 WeakPolarHBondContact CB-O 3.32Å; S191-I293 PolarHBondContact OG-O 3.45Å; C195-I293 VanDerWaalsContact SG-CD1 3.59Å; C195-I293 VanDerWaalsContact SG-CG2 3.52Å; S289-I293 WeakPolarHBondContact O-CB 3.47Å; S289-I293 WeakPolarHBondContact O-CD1 3.37Å; S289-I293 VanDerWaalsContact O-CG1 3.27Å; S289-I293 WeakPolarHBondContact O-CG1 3.23Å; S289-I293 PolarHBondContact O-N 2.67Å; F291-I293 PolarHBondContact O-N 3.01Å; I293-F295 VanDerWaalsContact C-N 3.31Å; I293-H296 PolarHBondContact O-N 3.19Å; I293-P297 WeakPolarHBondContact O-CD 3.42Å; I293-L401 HydrophobicContact CD1-CD2 4.28Å; I293-L401 HydrophobicContact CG1-CD2 3.58Å; I293-F406 HydrophobicContact CD1-CE2 4.19Å
294	T	87.1	Confident	84.1	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-69	-31.5	176.4	-55.8	0	0	0	0	111.6	C188 F192 L263 L264 M290 F291 P297	C188-T294 HydrophobicContact CB-CG2 4.29Å; C188-T294 WeakPolarHBondContact O-CG2 3.44Å; F192-T294 WeakPolarHBondContact CA-OG1 3.26Å; F192-T294 HydrophobicContact CB-CG2 4.02Å; F192-T294 WeakPolarHBondContact CB-OG1 3.35Å; L263-T294 HydrophobicContact CD2-CG2 4.33Å; L264-T294 HydrophobicContact CD2-CG2 3.65Å; L264-T294 HydrophobicContact CG-CG2 4.24Å; M290-T294 WeakPolarHBondContact O-CB 3.17Å; M290-T294 PolarHBondContact O-N 3.18Å; M290-T294 PolarHBondContact O-OG1 3.03Å; F291-T294 PolarHBondContact O-N 3.3Å; T294-P297 WeakPolarHBondContact O-CD 3.3Å
295	F	86	Confident	84	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-81.8	-24.8	179	-171	-110.3	0	0	0	113.2	L264 F291 I292 I293 P297 F298 I299 M354 F355 L434 L438	L264-F295 HydrophobicContact CD1-CD2 3.94Å; L264-F295 HydrophobicContact CD2-CB 4Å; L264-F295 HydrophobicContact CD2-CD2 4.42Å; F291-F295 HydrophobicContact CE1-CB 4.44Å; F291-F295 HydrophobicContact CZ-CD2 4.48Å; F291-F295 HydrophobicContact CZ-CG 4.43Å; F291-F295 WeakPolarHBondContact O-CB 3.23Å; F291-F295 PolarHBondContact O-N 3.43Å; I292-F295 PolarHBondContact O-N 3.4Å; I293-F295 VanDerWaalsContact C-N 3.31Å; F295-P297 VanDerWaalsContact C-CD 3.5Å; F295-F298 HydrophobicContact CD2-CB 4.39Å; F295-F298 HydrophobicContact CD2-CD2 4.29Å; F295-F298 HydrophobicContact CE2-CB 4.38Å; F295-F298 WeakPolarHBondContact O-CB 3.39Å; F295-F298 PolarHBondContact O-N 3.05Å; F295-I299 HydrophobicContact CD1-CD1 3.5Å; F295-I299 VanDerWaalsContact CD1-CD1 3.5Å; F295-I299 HydrophobicContact CD1-CG1 3.61Å; F295-I299 HydrophobicContact CE1-CD1 3.57Å; F295-I299 HydrophobicContact CE1-CG1 3.4Å; F295-I299 VanDerWaalsContact CE1-CG1 3.4Å; F295-I299 HydrophobicContact CZ-CG1 4.31Å; F295-I299 PolarHBondContact O-N 2.91Å; F295-M354 HydrophobicContact CD1-SD 4.08Å; F295-M354 HydrophobicContact CE1-CG 4.5Å; F295-M354 HydrophobicContact CE1-SD 3.5Å; F295-M354 VanDerWaalsContact CE1-SD 3.5Å; F295-M354 HydrophobicContact CE2-CB 4.45Å; F295-M354 HydrophobicContact CE2-SD 4.21Å; F295-M354 HydrophobicContact CZ-CB 4.36Å; F295-M354 HydrophobicContact CZ-CG 4.05Å; F295-M354 HydrophobicContact CZ-SD 3.59Å; F295-M354 VanDerWaalsContact CZ-SD 3.59Å; F295-F355 HydrophobicContact CD2-CE2 4.48Å; F295-F355 HydrophobicContact CE1-CZ 4.45Å; F295-F355 HydrophobicContact CE2-CD2 4.03Å; F295-F355 AromaticContact CE2-CE2 3.31Å; F295-F355 HydrophobicContact CE2-CE2 3.31Å; F295-F355 AromaticContact CE2-CZ 3.68Å; F295-F355 HydrophobicContact CE2-CZ 3.68Å; F295-F355 HydrophobicContact CZ-CD2 4.27Å; F295-F355 HydrophobicContact CZ-CE1 4.06Å; F295-F355 AromaticContact CZ-CE2 3.54Å; F295-F355 HydrophobicContact CZ-CE2 3.54Å; F295-F355 AromaticContact CZ-CZ 3.4Å; F295-F355 HydrophobicContact CZ-CZ 3.4Å; F295-L434 HydrophobicContact CD1-CD2 4.34Å; F295-L438 HydrophobicContact CE1-CD2 4.38Å; F295-L438 HydrophobicContact CZ-CD2 4.22Å
296	H	83.3	Confident	83.9	Confident	69 Å²	69	20.4 Å²	20.4	32%	0.319	11%	0.112	S	C	.	.	H	α-helix	trans	-50.5	-45.3	-177.7	179.3	-71.4	0	0	0	114.4	I292 I293 F298 I299 S300	I292-H296 PolarHBondContact O-N 3.38Å; I293-H296 PolarHBondContact O-N 3.19Å; H296-F298 VanDerWaalsContact C-N 3.29Å; H296-F298 PolarHBondContact O-N 2.93Å; H296-I299 WeakPolarHBondContact O-CB 3.38Å; H296-I299 PolarHBondContact O-N 2.93Å; H296-I299 VanDerWaalsContact O-N 3.09Å; H296-S300 PolarHBondContact O-N 3.45Å
297	P	81.9	Confident	83.4	Confident	18 Å²	18	21.1 Å²	21.1	12%	0.117	12%	0.117	C	C	.	.	H	α-helix	trans	-59.3	-37.5	177.4	-23.4	34.8	0	0	0	113.1	A187 I293 T294 F295 I299 S300 S301	A187-P297 HydrophobicContact CB-CB 3.82Å; A187-P297 HydrophobicContact CB-CG 4.14Å; I293-P297 WeakPolarHBondContact O-CD 3.42Å; T294-P297 WeakPolarHBondContact O-CD 3.3Å; F295-P297 VanDerWaalsContact C-CD 3.5Å; P297-I299 VanDerWaalsContact C-N 3.34Å; P297-I299 PolarHBondContact O-N 3.33Å; P297-S300 PolarHBondContact O-N 3Å; P297-S301 PolarHBondContact O-N 2.94Å; P297-S301 PolarHBondContact O-OG 3.21Å; P297-S301 VanDerWaalsContact O-OG 3.06Å
298	F	83.3	Confident	82.4	Confident	29 Å²	29	21.5 Å²	21.5	13%	0.127	12%	0.121	C	C	.	.	H	α-helix	trans	-62.7	-39.9	174.3	-77.7	-63.9	0	0	0	112.3	C188 T260 L264 F295 H296 S301 L302 L319 P352 F355	C188-F298 HydrophobicContact CB-CE2 4.18Å; C188-F298 WeakPolarHBondContact SG-CD2 3.48Å; C188-F298 WeakPolarHBondContact SG-CE2 3.41Å; T260-F298 HydrophobicContact CG2-CE2 3.75Å; T260-F298 HydrophobicContact CG2-CZ 3.96Å; L264-F298 HydrophobicContact CD1-CD2 3.83Å; L264-F298 HydrophobicContact CD1-CE2 3.6Å; F295-F298 HydrophobicContact CD2-CB 4.39Å; F295-F298 HydrophobicContact CD2-CD2 4.29Å; F295-F298 HydrophobicContact CE2-CB 4.38Å; F295-F298 WeakPolarHBondContact O-CB 3.39Å; F295-F298 PolarHBondContact O-N 3.05Å; H296-F298 VanDerWaalsContact C-N 3.29Å; H296-F298 PolarHBondContact O-N 2.93Å; F298-S301 PolarHBondContact O-N 3.18Å; F298-L302 WeakPolarHBondContact O-CB 3.36Å; F298-L302 PolarHBondContact O-N 2.85Å; F298-L319 HydrophobicContact CD1-CD2 4.17Å; F298-L319 HydrophobicContact CE1-CD2 3.87Å; F298-P352 HydrophobicContact CE2-CG 4.5Å; F298-F355 HydrophobicContact CB-CE2 4.15Å; F298-F355 HydrophobicContact CB-CZ 4.14Å; F298-F355 HydrophobicContact CG-CE2 4.45Å
299	I	80.8	Confident	81.7	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-48	175.3	-62.7	175.6	0	0	0	110.1	F295 H296 P297 S301 L302 V303 I395 L397 L434 L438	F295-I299 HydrophobicContact CD1-CD1 3.5Å; F295-I299 VanDerWaalsContact CD1-CD1 3.5Å; F295-I299 HydrophobicContact CD1-CG1 3.61Å; F295-I299 HydrophobicContact CE1-CD1 3.57Å; F295-I299 HydrophobicContact CE1-CG1 3.4Å; F295-I299 VanDerWaalsContact CE1-CG1 3.4Å; F295-I299 HydrophobicContact CZ-CG1 4.31Å; F295-I299 PolarHBondContact O-N 2.91Å; H296-I299 WeakPolarHBondContact O-CB 3.38Å; H296-I299 PolarHBondContact O-N 2.93Å; H296-I299 VanDerWaalsContact O-N 3.09Å; P297-I299 VanDerWaalsContact C-N 3.34Å; P297-I299 PolarHBondContact O-N 3.33Å; I299-S301 VanDerWaalsContact C-N 3.25Å; I299-S301 PolarHBondContact O-N 3.5Å; I299-L302 WeakPolarHBondContact O-CB 3.29Å; I299-L302 PolarHBondContact O-N 2.83Å; I299-L302 VanDerWaalsContact O-N 3.15Å; I299-V303 HydrophobicContact CG2-CG2 4.32Å; I299-V303 WeakPolarHBondContact O-CG2 3.39Å; I299-V303 PolarHBondContact O-N 3.46Å; I299-I395 HydrophobicContact CG2-CD1 3.57Å; I299-L397 HydrophobicContact CB-CD1 4.46Å; I299-L397 HydrophobicContact CD1-CD1 3.91Å; I299-L397 HydrophobicContact CD1-CD2 4.24Å; I299-L397 HydrophobicContact CG2-CD1 4.08Å; I299-L434 HydrophobicContact CD1-CD1 4.12Å; I299-L438 HydrophobicContact CG1-CD1 4.43Å
300	S	80.3	Confident	81.1	Confident	65 Å²	65	24.6 Å²	24.6	46%	0.455	14%	0.144	S	C	.	.	H	α-helix	trans	-57.6	-41.9	178.9	-173	0	0	0	0	111.5	H296 P297 V303 Q304	H296-S300 PolarHBondContact O-N 3.45Å; P297-S300 PolarHBondContact O-N 3Å; S300-V303 WeakPolarHBondContact O-CB 3.27Å; S300-V303 PolarHBondContact O-N 3.38Å; S300-Q304 PolarHBondContact O-N 3.47Å; S300-Q304 VanDerWaalsContact O-N 3.14Å
301	S	79.7	Confident	80.5	Confident	31 Å²	31	28.5 Å²	28.5	22%	0.217	17%	0.168	C	C	.	.	H	α-helix	trans	-72.2	-36.5	177.2	-55	0	0	0	0	113	P297 F298 I299 V303 Q304 L305 L316	P297-S301 PolarHBondContact O-N 2.94Å; P297-S301 PolarHBondContact O-OG 3.21Å; P297-S301 VanDerWaalsContact O-OG 3.06Å; F298-S301 PolarHBondContact O-N 3.18Å; I299-S301 VanDerWaalsContact C-N 3.25Å; I299-S301 PolarHBondContact O-N 3.5Å; S301-V303 VanDerWaalsContact C-N 3.26Å; S301-V303 PolarHBondContact O-N 3.05Å; S301-Q304 CarbonylContact O-C 3.56Å; S301-Q304 WeakPolarHBondContact O-CB 3.37Å; S301-Q304 PolarHBondContact O-N 3.08Å; S301-Q304 VanDerWaalsContact O-N 3.14Å; S301-L305 WeakPolarHBondContact O-CG 3.32Å; S301-L305 PolarHBondContact O-N 3.4Å; S301-L316 WeakPolarHBondContact OG-CD1 3.36Å
302	L	82	Confident	79.7	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-58.8	-41.9	172.5	-171.9	88.1	0	0	0	110.8	F298 I299 Q304 L305 F306 F320 F355 V362 L438 F441 V442	F298-L302 WeakPolarHBondContact O-CB 3.36Å; F298-L302 PolarHBondContact O-N 2.85Å; I299-L302 WeakPolarHBondContact O-CB 3.29Å; I299-L302 PolarHBondContact O-N 2.83Å; I299-L302 VanDerWaalsContact O-N 3.15Å; L302-Q304 VanDerWaalsContact C-N 3.3Å; L302-Q304 PolarHBondContact O-N 3.48Å; L302-L305 PolarHBondContact O-N 3.32Å; L302-L305 VanDerWaalsContact O-N 3.15Å; L302-F306 HydrophobicContact CD1-CE2 4.14Å; L302-F306 HydrophobicContact CD2-CE2 4.42Å; L302-F306 HydrophobicContact CG-CD2 4.05Å; L302-F306 HydrophobicContact CG-CE2 4.02Å; L302-F306 VanDerWaalsContact O-CD2 3.29Å; L302-F306 WeakPolarHBondContact O-CD2 3.41Å; L302-F306 PolarHBondContact O-N 3.18Å; L302-F306 VanDerWaalsContact O-N 3.09Å; L302-F320 HydrophobicContact CD1-CE1 4.25Å; L302-F320 HydrophobicContact CD1-CE2 3.95Å; L302-F320 HydrophobicContact CD1-CZ 3.62Å; L302-F355 HydrophobicContact CD1-CE1 4.26Å; L302-F355 HydrophobicContact CD2-CE1 4.33Å; L302-V362 HydrophobicContact CD1-CG1 4.23Å; L302-V362 HydrophobicContact CD1-CG2 4.26Å; L302-L438 HydrophobicContact CD2-CD1 3.91Å; L302-F441 HydrophobicContact CD2-CD1 4.34Å; L302-F441 HydrophobicContact CD2-CE1 4.25Å; L302-V442 HydrophobicContact CD2-CG2 3.83Å
303	V	81.1	Confident	79.1	Confident	29 Å²	29	34.8 Å²	34.8	18%	0.176	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-42.2	175.8	173.3	0	0	0	0	110.8	I299 S300 S301 L305 F306 S307 V393 F441	I299-V303 HydrophobicContact CG2-CG2 4.32Å; I299-V303 WeakPolarHBondContact O-CG2 3.39Å; I299-V303 PolarHBondContact O-N 3.46Å; S300-V303 WeakPolarHBondContact O-CB 3.27Å; S300-V303 PolarHBondContact O-N 3.38Å; S301-V303 VanDerWaalsContact C-N 3.26Å; S301-V303 PolarHBondContact O-N 3.05Å; V303-L305 VanDerWaalsContact C-N 3.34Å; V303-F306 CarbonylContact O-C 3.43Å; V303-F306 PolarHBondContact O-N 3.04Å; V303-S307 PolarHBondContact O-N 3.26Å; V303-S307 VanDerWaalsContact O-N 3.08Å; V303-V393 HydrophobicContact CB-CG2 4.19Å; V303-V393 HydrophobicContact CG1-CG2 3.83Å; V303-V393 HydrophobicContact CG2-CB 4.48Å; V303-V393 HydrophobicContact CG2-CG1 4.21Å; V303-V393 HydrophobicContact CG2-CG2 3.48Å; V303-V393 VanDerWaalsContact CG2-CG2 3.48Å; V303-F441 HydrophobicContact CB-CZ 4.12Å; V303-F441 HydrophobicContact CG1-CZ 4.29Å; V303-F441 HydrophobicContact CG2-CE1 3.9Å; V303-F441 HydrophobicContact CG2-CE2 4.15Å; V303-F441 HydrophobicContact CG2-CZ 3.47Å; V303-F441 VanDerWaalsContact CG2-CZ 3.47Å
304	Q	80.5	Confident	78.6	Confident	105 Å²	105	34 Å²	34	49%	0.491	20%	0.197	S	C	.	.	H	α-helix	trans	-69	-28.2	175.2	-172.2	-178.6	-4	0	0	113.3	S300 S301 L302 F306 S307	S300-Q304 PolarHBondContact O-N 3.47Å; S300-Q304 VanDerWaalsContact O-N 3.14Å; S301-Q304 CarbonylContact O-C 3.56Å; S301-Q304 WeakPolarHBondContact O-CB 3.37Å; S301-Q304 PolarHBondContact O-N 3.08Å; S301-Q304 VanDerWaalsContact O-N 3.14Å; L302-Q304 VanDerWaalsContact C-N 3.3Å; L302-Q304 PolarHBondContact O-N 3.48Å; Q304-F306 VanDerWaalsContact C-N 3.29Å; Q304-S307 PolarHBondContact O-N 3.16Å; Q304-S307 PolarHBondContact O-OG 3.24Å
305	L	82.8	Confident	77.9	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-72.9	-26.5	172.8	-70.7	177.9	0	0	0	112.5	S301 L302 V303 A310 D314 L316 V317 F320 L366 N369	S301-L305 WeakPolarHBondContact O-CG 3.32Å; S301-L305 PolarHBondContact O-N 3.4Å; L302-L305 PolarHBondContact O-N 3.32Å; L302-L305 VanDerWaalsContact O-N 3.15Å; V303-L305 VanDerWaalsContact C-N 3.34Å; L305-A310 WeakPolarHBondContact O-CB 3.21Å; L305-D314 HydrophobicContact CD2-CB 3.99Å; L305-L316 HydrophobicContact CD1-CB 3.98Å; L305-V317 HydrophobicContact CD2-CG2 3.66Å; L305-F320 HydrophobicContact CD1-CD2 4.32Å; L305-F320 HydrophobicContact CD1-CE2 4.04Å; L305-L366 HydrophobicContact CB-CD2 3.88Å; L305-N369 PolarHBondContact O-ND2 3.16Å
306	F	81.7	Confident	77.1	Confident	2 Å²	2	41 Å²	41	1%	0.009	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-0.1	173.4	-79.8	-68.2	0	0	0	113.6	L302 V303 Q304 V362 V388 F441 V442 R445 I449	L302-F306 HydrophobicContact CD1-CE2 4.14Å; L302-F306 HydrophobicContact CD2-CE2 4.42Å; L302-F306 HydrophobicContact CG-CD2 4.05Å; L302-F306 HydrophobicContact CG-CE2 4.02Å; L302-F306 VanDerWaalsContact O-CD2 3.29Å; L302-F306 WeakPolarHBondContact O-CD2 3.41Å; L302-F306 PolarHBondContact O-N 3.18Å; L302-F306 VanDerWaalsContact O-N 3.09Å; V303-F306 CarbonylContact O-C 3.43Å; V303-F306 PolarHBondContact O-N 3.04Å; Q304-F306 VanDerWaalsContact C-N 3.29Å; F306-V362 HydrophobicContact CE2-CG1 4.43Å; F306-V362 HydrophobicContact CE2-CG2 4.43Å; F306-V362 HydrophobicContact CZ-CG1 4.37Å; F306-V362 HydrophobicContact CZ-CG2 4.48Å; F306-V388 WeakPolarHBondContact O-CG1 3.3Å; F306-F441 HydrophobicContact CD2-CE1 4.36Å; F306-V442 HydrophobicContact CE2-CG1 4.43Å; F306-V442 HydrophobicContact CE2-CG2 4.2Å; F306-V442 HydrophobicContact CZ-CG1 4.12Å; F306-R445 HydrophobicContact CB-CB 4.29Å; F306-R445 HydrophobicContact CB-CG 4.42Å; F306-R445 HydrophobicContact CD1-CB 4.03Å; F306-R445 HydrophobicContact CG-CB 4.12Å; F306-I449 HydrophobicContact CD1-CD1 3.63Å; F306-I449 HydrophobicContact CE1-CD1 4.36Å
307	S	75.5	Confident	76.7	Confident	21 Å²	21	37.7 Å²	37.7	15%	0.147	22%	0.223	C	C	.	.	S	Bend	trans	-80.3	158.5	170	69.3	0	0	0	0	110.2	V303 Q304 S309 A310 N369 D389	V303-S307 PolarHBondContact O-N 3.26Å; V303-S307 VanDerWaalsContact O-N 3.08Å; Q304-S307 PolarHBondContact O-N 3.16Å; Q304-S307 PolarHBondContact O-OG 3.24Å; S307-S309 PolarHBondContact O-N 2.89Å; S307-S309 PolarHBondContact OG-OG 3Å; S307-A310 PolarHBondContact O-N 3.44Å; S307-N369 PolarHBondContact O-ND2 3.47Å; S307-D389 VanDerWaalsContact CA-OD1 3.31Å; S307-D389 WeakPolarHBondContact CA-OD1 3.49Å; S307-D389 WeakPolarHBondContact CB-OD1 3.41Å
308	G	68.8	Low	76.3	Confident	9 Å²	9	41.7 Å²	41.7	9%	0.093	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-3.9	175.8	0	0	0	0	0	113.8	D389	G308-D389 PolarHBondContact N-OD1 2.94Å
309	S	70.5	Confident	75.8	Confident	73 Å²	73	41.4 Å²	41.4	51%	0.51	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	8.4	178.5	65.7	0	0	0	0	114.2	S307 T311	S307-S309 PolarHBondContact O-N 2.89Å; S307-S309 PolarHBondContact OG-OG 3Å; S309-T311 PolarHBondContact O-N 3.35Å
310	A	71.3	Confident	75.6	Confident	8 Å²	8	41.6 Å²	41.6	7%	0.066	24%	0.24	C	C	.	.			trans	-67	129.1	-176.6	0	0	0	0	0	111.4	L305 S307 F370 I373	L305-A310 WeakPolarHBondContact O-CB 3.21Å; S307-A310 PolarHBondContact O-N 3.44Å; A310-F370 HydrophobicContact CB-CE1 4.06Å; A310-I373 HydrophobicContact CB-CD1 4.3Å; A310-I373 WeakPolarHBondContact O-CD1 3.24Å
311	T	75.8	Confident	75.5	Confident	83 Å²	83	38.6 Å²	38.6	51%	0.509	22%	0.218	S	C	.	.			trans	-94.3	137.6	176	62	0	0	0	0	110.7	S309 N313 D314	S309-T311 PolarHBondContact O-N 3.35Å; T311-N313 PolarHBondContact O-N 2.97Å; T311-N313 VanDerWaalsContact O-N 3.11Å; T311-D314 VanDerWaalsContact O-CB 3.31Å; T311-D314 WeakPolarHBondContact O-CB 3.27Å; T311-D314 PolarHBondContact O-N 3.4Å; T311-D314 PolarHBondContact OG1-N 3.22Å
312	F	73	Confident	75.5	Confident	30 Å²	30	40.5 Å²	40.5	13%	0.132	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.5	176.8	-174.4	-111.5	0	0	0	113.1	I323 Y325 P329 F334 I339 F370	F312-I323 HydrophobicContact CE1-CG2 3.78Å; F312-I323 HydrophobicContact CE2-CG2 3.71Å; F312-I323 HydrophobicContact CZ-CG2 3.25Å; F312-Y325 HydrophobicContact CD1-CD1 4.21Å; F312-Y325 HydrophobicContact CD1-CE1 4.45Å; F312-Y325 AromaticContact CE1-CD1 3.87Å; F312-Y325 HydrophobicContact CE1-CD1 3.87Å; F312-Y325 HydrophobicContact CE1-CE1 4.34Å; F312-P329 HydrophobicContact CD2-CG 4.4Å; F312-F334 HydrophobicContact CD2-CE2 4.44Å; F312-F334 AromaticContact CE2-CE2 3.77Å; F312-F334 HydrophobicContact CE2-CE2 3.77Å; F312-F334 HydrophobicContact CE2-CZ 4.48Å; F312-F334 HydrophobicContact CZ-CE2 4.35Å; F312-I339 HydrophobicContact CE2-CD1 4.05Å; F312-I339 HydrophobicContact CE2-CG1 4.18Å; F312-F370 HydrophobicContact CB-CD1 4.45Å; F312-F370 HydrophobicContact CB-CE1 4.44Å; F312-F370 HydrophobicContact CD2-CD1 4.49Å; F312-F370 HydrophobicContact CD2-CD2 4.02Å; F312-F370 HydrophobicContact CD2-CE2 4.2Å; F312-F370 HydrophobicContact CD2-CG 4.18Å
313	N	71.4	Confident	75.4	Confident	114 Å²	114	41.7 Å²	41.7	61%	0.61	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	5.1	179.3	-66.3	-16.9	0	0	0	113.8	T311 P315	T311-N313 PolarHBondContact O-N 2.97Å; T311-N313 VanDerWaalsContact O-N 3.11Å; N313-P315 WeakPolarHBondContact O-CD 3.49Å
314	D	74.4	Confident	75.5	Confident	25 Å²	25	43.2 Å²	43.2	13%	0.134	24%	0.239	C	C	.	.			trans	-59.7	124.6	179.8	-170.6	-39.8	0	0	0	110.1	L305 T311 L316 V317	L305-D314 HydrophobicContact CD2-CB 3.99Å; T311-D314 VanDerWaalsContact O-CB 3.31Å; T311-D314 WeakPolarHBondContact O-CB 3.27Å; T311-D314 PolarHBondContact O-N 3.4Å; T311-D314 PolarHBondContact OG1-N 3.22Å; D314-L316 PolarHBondContact O-N 2.85Å; D314-L316 WeakPolarHBondContact OD1-CB 3.38Å; D314-L316 WeakPolarHBondContact OD1-CG 3.21Å; D314-L316 PolarHBondContact OD1-N 2.93Å; D314-V317 HydrophobicContact CB-CG2 4.01Å; D314-V317 PolarHBondContact O-N 3.18Å; D314-V317 VanDerWaalsContact O-N 3.08Å
315	P	70.9	Confident	75.5	Confident	97 Å²	97	42.7 Å²	42.7	63%	0.63	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-27.8	178	-26.8	34.2	0	0	0	114.2	N313 K318	N313-P315 WeakPolarHBondContact O-CD 3.49Å; P315-K318 WeakPolarHBondContact O-CB 3.38Å; P315-K318 PolarHBondContact O-N 2.85Å
316	L	71	Confident	75.5	Confident	48 Å²	48	49.2 Å²	49.2	25%	0.251	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-22.9	-177	-63	175.7	0	0	0	113.3	S301 L305 D314 K318 L319 F320	S301-L316 WeakPolarHBondContact OG-CD1 3.36Å; L305-L316 HydrophobicContact CD1-CB 3.98Å; D314-L316 PolarHBondContact O-N 2.85Å; D314-L316 WeakPolarHBondContact OD1-CB 3.38Å; D314-L316 WeakPolarHBondContact OD1-CG 3.21Å; D314-L316 PolarHBondContact OD1-N 2.93Å; L316-K318 PolarHBondContact O-N 3.25Å; L316-L319 WeakPolarHBondContact O-CB 3.34Å; L316-L319 PolarHBondContact O-N 3.45Å; L316-F320 WeakPolarHBondContact O-CD2 3.44Å
317	V	73.9	Confident	75.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-33.9	173.4	-175	0	0	0	0	109.8	L305 D314 L319 F320 A321 I323 L366 F370	L305-V317 HydrophobicContact CD2-CG2 3.66Å; D314-V317 HydrophobicContact CB-CG2 4.01Å; D314-V317 PolarHBondContact O-N 3.18Å; D314-V317 VanDerWaalsContact O-N 3.08Å; V317-L319 PolarHBondContact O-N 3.36Å; V317-F320 PolarHBondContact O-N 3.26Å; V317-A321 PolarHBondContact O-N 3Å; V317-I323 HydrophobicContact CB-CD1 3.65Å; V317-I323 HydrophobicContact CG1-CD1 3.29Å; V317-I323 HydrophobicContact CG1-CG1 4.02Å; V317-L366 HydrophobicContact CG1-CD1 4.28Å; V317-F370 HydrophobicContact CG1-CE2 4.1Å; V317-F370 HydrophobicContact CG1-CZ 4.29Å; V317-F370 HydrophobicContact CG2-CE2 4.41Å; V317-F370 HydrophobicContact CG2-CZ 3.79Å
318	K	74.4	Confident	76.2	Confident	103 Å²	103	52.1 Å²	52.1	45%	0.448	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-22.7	175.1	-59.6	-179	176.5	177.9	0	113.3	P315 L316 F320 A321 I323 Y325 R342	P315-K318 WeakPolarHBondContact O-CB 3.38Å; P315-K318 PolarHBondContact O-N 2.85Å; L316-K318 PolarHBondContact O-N 3.25Å; K318-F320 VanDerWaalsContact C-N 3.31Å; K318-A321 WeakPolarHBondContact CA-O 3.47Å; K318-I323 HydrophobicContact CG-CD1 4.42Å; K318-Y325 WeakPolarHBondContact CE-OH 3.35Å; K318-R342 PolarHBondContact O-NE 3.36Å; K318-R342 PolarHBondContact O-NH2 3.44Å
319	L	72.5	Confident	76.8	Confident	22 Å²	22	52.8 Å²	52.8	12%	0.115	29%	0.289	C	S	.	.	H	α-helix	trans	-65.4	-39.7	175.4	-170.4	67.3	0	0	0	110.5	F298 L316 V317 C350 I351	F298-L319 HydrophobicContact CD1-CD2 4.17Å; F298-L319 HydrophobicContact CE1-CD2 3.87Å; L316-L319 WeakPolarHBondContact O-CB 3.34Å; L316-L319 PolarHBondContact O-N 3.45Å; V317-L319 PolarHBondContact O-N 3.36Å; L319-C350 VanDerWaalsContact CD1-O 3.24Å; L319-C350 WeakPolarHBondContact CD1-O 3.47Å; L319-I351 HydrophobicContact CD1-CG1 4.44Å; L319-I351 WeakPolarHBondContact O-CD1 3.47Å; L319-I351 VanDerWaalsContact O-CG1 3.31Å; L319-I351 WeakPolarHBondContact O-CG1 3.43Å
320	F	75.7	Confident	77.5	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-95	-33.4	-173.9	-58.1	-74.4	0	0	0	113.4	L302 L305 L316 V317 K318 R342 F355 M359 V362 V363	L302-F320 HydrophobicContact CD1-CE1 4.25Å; L302-F320 HydrophobicContact CD1-CE2 3.95Å; L302-F320 HydrophobicContact CD1-CZ 3.62Å; L305-F320 HydrophobicContact CD1-CD2 4.32Å; L305-F320 HydrophobicContact CD1-CE2 4.04Å; L316-F320 WeakPolarHBondContact O-CD2 3.44Å; V317-F320 PolarHBondContact O-N 3.26Å; K318-F320 VanDerWaalsContact C-N 3.31Å; F320-R342 PolarHBondContact O-N 3.1Å; F320-F355 HydrophobicContact CE1-CB 4.2Å; F320-F355 AromaticContact CE1-CD1 3.71Å; F320-F355 HydrophobicContact CE1-CD1 3.71Å; F320-F355 HydrophobicContact CE1-CD2 4.28Å; F320-F355 HydrophobicContact CE1-CE1 4.11Å; F320-F355 AromaticContact CE1-CG 3.83Å; F320-F355 HydrophobicContact CE1-CG 3.83Å; F320-F355 HydrophobicContact CZ-CD1 4.22Å; F320-F355 HydrophobicContact CZ-CE1 4.15Å; F320-F355 HydrophobicContact CZ-CG 4.49Å; F320-F355 HydrophobicContact CZ-CZ 4.31Å; F320-M359 HydrophobicContact CB-CE 4.31Å; F320-M359 HydrophobicContact CD1-CE 4.43Å; F320-M359 HydrophobicContact CD1-SD 3.72Å; F320-M359 HydrophobicContact CE1-SD 4.48Å; F320-M359 WeakPolarHBondContact O-CE 3.31Å; F320-V362 HydrophobicContact CB-CG1 4.18Å; F320-V362 HydrophobicContact CD1-CG1 3.98Å; F320-V362 HydrophobicContact CD2-CG1 4.22Å; F320-V362 HydrophobicContact CE1-CG1 4.45Å; F320-V362 HydrophobicContact CG-CG1 3.85Å; F320-V363 HydrophobicContact CB-CG2 4.45Å
321	A	79.3	Confident	78.3	Confident	1 Å²	1	53 Å²	53	1%	0.008	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	151.4	-170.7	0	0	0	0	0	113.8	V317 K318 I323 I339 K340 V363	V317-A321 PolarHBondContact O-N 3Å; K318-A321 WeakPolarHBondContact CA-O 3.47Å; A321-I323 HydrophobicContact CB-CG1 4.46Å; A321-I339 HydrophobicContact CB-CG2 3.41Å; A321-I339 VanDerWaalsContact CB-CG2 3.41Å; A321-K340 CarbonylContact C-O 3.52Å; A321-K340 VanDerWaalsContact CA-O 3.28Å; A321-K340 WeakPolarHBondContact CA-O 3.4Å; A321-K340 WeakPolarHBondContact CB-O 3.24Å; A321-V363 HydrophobicContact CB-CG2 4.11Å
322	D	80	Confident	78.7	Confident	72 Å²	72	51.4 Å²	51.4	39%	0.385	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	117.8	160.3	-68.5	-36	0	0	0	108.5	K340 R342	D322-K340 PolarHBondContact N-O 2.88Å; D322-K340 PolarHBondContact O-N 3.25Å; D322-R342 IonicContact OD1-CZ 3.25Å
323	I	79.7	Confident	79.4	Confident	25 Å²	25	56 Å²	56	13%	0.128	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124.5	-176.4	-51.2	172.2	0	0	0	109	F312 V317 K318 A321 Y325 A338	F312-I323 HydrophobicContact CE1-CG2 3.78Å; F312-I323 HydrophobicContact CE2-CG2 3.71Å; F312-I323 HydrophobicContact CZ-CG2 3.25Å; V317-I323 HydrophobicContact CB-CD1 3.65Å; V317-I323 HydrophobicContact CG1-CD1 3.29Å; V317-I323 HydrophobicContact CG1-CG1 4.02Å; K318-I323 HydrophobicContact CG-CD1 4.42Å; A321-I323 HydrophobicContact CB-CG1 4.46Å; I323-Y325 HydrophobicContact CB-CE1 4.35Å; I323-Y325 HydrophobicContact CB-CE2 4.26Å; I323-Y325 HydrophobicContact CD1-CE1 4.43Å; I323-Y325 HydrophobicContact CG2-CD1 4.06Å; I323-Y325 HydrophobicContact CG2-CE1 3.85Å; I323-Y325 HydrophobicContact CG2-CE2 4.47Å; I323-Y325 HydrophobicContact CG2-CG 4.44Å; I323-Y325 PolarHBondContact O-N 2.95Å; I323-A338 WeakPolarHBondContact CA-O 3.23Å
324	N	82.1	Confident	80.2	Confident	61 Å²	61	50.6 Å²	50.6	33%	0.326	27%	0.274	S	S	.	.			trans	-89	96.8	166.9	-174.2	0.2	0	0	0	109.8	N326 I327 A338	N324-N326 PolarHBondContact O-N 3.11Å; N324-N326 WeakPolarHBondContact OD1-CB 3.28Å; N324-N326 PolarHBondContact OD1-N 3.32Å; N324-N326 PolarHBondContact OD1-ND2 3.17Å; N324-I327 HydrophobicContact CB-CD1 4.47Å; N324-I327 WeakPolarHBondContact ND2-CD1 3.48Å; N324-I327 PolarHBondContact O-N 2.99Å; N324-I327 VanDerWaalsContact O-N 3.1Å; N324-A338 PolarHBondContact N-O 2.92Å
325	Y	80.4	Confident	80.9	Confident	94 Å²	94	50.7 Å²	50.7	37%	0.369	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.9	179.9	-66	-72.4	0	0	0	114.8	F312 K318 I323 I327	F312-Y325 HydrophobicContact CD1-CD1 4.21Å; F312-Y325 HydrophobicContact CD1-CE1 4.45Å; F312-Y325 AromaticContact CE1-CD1 3.87Å; F312-Y325 HydrophobicContact CE1-CD1 3.87Å; F312-Y325 HydrophobicContact CE1-CE1 4.34Å; K318-Y325 WeakPolarHBondContact CE-OH 3.35Å; I323-Y325 HydrophobicContact CB-CE1 4.35Å; I323-Y325 HydrophobicContact CB-CE2 4.26Å; I323-Y325 HydrophobicContact CD1-CE1 4.43Å; I323-Y325 HydrophobicContact CG2-CD1 4.06Å; I323-Y325 HydrophobicContact CG2-CE1 3.85Å; I323-Y325 HydrophobicContact CG2-CE2 4.47Å; I323-Y325 HydrophobicContact CG2-CG 4.44Å; I323-Y325 PolarHBondContact O-N 2.95Å; Y325-I327 PolarHBondContact O-N 3.32Å
326	N	84	Confident	81.5	Confident	140 Å²	140	49.2 Å²	49.2	75%	0.749	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.5	176.3	-59.1	-30	0	0	0	112.8	N324 P328	N324-N326 PolarHBondContact O-N 3.11Å; N324-N326 WeakPolarHBondContact OD1-CB 3.28Å; N324-N326 PolarHBondContact OD1-N 3.32Å; N324-N326 PolarHBondContact OD1-ND2 3.17Å; N326-P328 WeakPolarHBondContact O-CD 3.22Å
327	I	84.9	Confident	82.2	Confident	18 Å²	18	50.1 Å²	50.1	9%	0.092	27%	0.27	C	S	.	.	S	Bend	trans	-115.6	92.2	-176.9	-54	178	0	0	0	107.9	N324 Y325 D331 K333 F334 D337 A338	N324-I327 HydrophobicContact CB-CD1 4.47Å; N324-I327 WeakPolarHBondContact ND2-CD1 3.48Å; N324-I327 PolarHBondContact O-N 2.99Å; N324-I327 VanDerWaalsContact O-N 3.1Å; Y325-I327 PolarHBondContact O-N 3.32Å; I327-D331 HydrophobicContact CG2-CB 3.63Å; I327-K333 HydrophobicContact CG2-CB 4.37Å; I327-F334 HydrophobicContact CG2-CB 4.29Å; I327-D337 HydrophobicContact CD1-CB 3.73Å; I327-A338 HydrophobicContact CB-CB 3.92Å; I327-A338 HydrophobicContact CG2-CB 3.86Å
328	P	86	Confident	82.7	Confident	66 Å²	66	50.1 Å²	50.1	43%	0.429	27%	0.27	S	S	.	.			trans	-67.1	163.3	177.3	28.9	-35.2	0	0	0	111.3	N326 G330 D331	N326-P328 WeakPolarHBondContact O-CD 3.22Å; P328-G330 PolarHBondContact O-N 3.1Å; P328-G330 VanDerWaalsContact O-N 3.1Å; P328-D331 HydrophobicContact CG-CB 4.25Å; P328-D331 VanDerWaalsContact O-CB 3.3Å; P328-D331 WeakPolarHBondContact O-CB 3.27Å; P328-D331 PolarHBondContact O-N 3.41Å
329	P	82.6	Confident	83.2	Confident	22 Å²	22	45.2 Å²	45.2	14%	0.143	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-28.7	173.7	-29.6	37.6	0	0	0	115.2	F312 D331 F334 F370 A374 W577	F312-P329 HydrophobicContact CD2-CG 4.4Å; P329-D331 VanDerWaalsContact C-N 3.28Å; P329-D331 PolarHBondContact O-N 2.66Å; P329-F334 VanDerWaalsContact CA-CD2 3.45Å; P329-F334 HydrophobicContact CB-CD2 4.39Å; P329-F334 HydrophobicContact CB-CE2 4.25Å; P329-F334 HydrophobicContact CB-CZ 4.46Å; P329-F334 HydrophobicContact CG-CD2 4.47Å; P329-F334 HydrophobicContact CG-CE2 4.02Å; P329-F334 HydrophobicContact CG-CZ 4.41Å; P329-F370 HydrophobicContact CG-CB 4.37Å; P329-A374 HydrophobicContact CB-CB 3.55Å; P329-W577 PolarHBondContact O-NE1 3.37Å
330	G	84.5	Confident	83.7	Confident	39 Å²	39	49.4 Å²	49.4	40%	0.402	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.6	175.5	0	0	0	0	0	115.3	P328 W577	P328-G330 PolarHBondContact O-N 3.1Å; P328-G330 VanDerWaalsContact O-N 3.1Å; G330-W577 PolarHBondContact O-NE1 2.89Å
331	D	87.1	Confident	83.9	Confident	46 Å²	46	51.8 Å²	51.8	25%	0.246	28%	0.282	C	S	.	.	S	Bend	trans	-85.1	135.9	178.2	-169.5	-51.2	0	0	0	110.5	I327 P328 P329 K333 F334	I327-D331 HydrophobicContact CG2-CB 3.63Å; P328-D331 HydrophobicContact CG-CB 4.25Å; P328-D331 VanDerWaalsContact O-CB 3.3Å; P328-D331 WeakPolarHBondContact O-CB 3.27Å; P328-D331 PolarHBondContact O-N 3.41Å; P329-D331 VanDerWaalsContact C-N 3.28Å; P329-D331 PolarHBondContact O-N 2.66Å; D331-K333 PolarHBondContact O-N 3.31Å; D331-K333 VanDerWaalsContact O-N 3.14Å; D331-K333 WeakPolarHBondContact OD1-CB 3.49Å; D331-K333 PolarHBondContact OD1-N 3.15Å; D331-F334 WeakPolarHBondContact O-CB 3.35Å; D331-F334 PolarHBondContact O-N 2.93Å
332	P	84.1	Confident	83.6	Confident	50 Å²	50	54.2 Å²	54.2	33%	0.325	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.6	174.9	20.8	-33.4	0	0	0	114.1	F334 N580	P332-F334 PolarHBondContact O-N 3.2Å; P332-N580 HydrophobicContact CB-CB 4.3Å
333	K	87.8	Confident	82.9	Confident	128 Å²	128	55.5 Å²	55.5	56%	0.557	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	1.5	178.7	-61.8	179.1	-177.3	171.4	0	113.3	I327 D331 W335 S336 D337	I327-K333 HydrophobicContact CG2-CB 4.37Å; D331-K333 PolarHBondContact O-N 3.31Å; D331-K333 VanDerWaalsContact O-N 3.14Å; D331-K333 WeakPolarHBondContact OD1-CB 3.49Å; D331-K333 PolarHBondContact OD1-N 3.15Å; K333-W335 PolarHBondContact O-N 2.96Å; K333-S336 PolarHBondContact O-N 3.47Å; K333-S336 PolarHBondContact O-OG 3.49Å; K333-S336 VanDerWaalsContact O-OG 3.11Å; K333-D337 PolarHBondContact O-N 2.92Å
334	F	89.1	Confident	82.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.314	C	S	.	.	I	π-helix	trans	-54.7	-51.2	-178	176.4	-102.1	0	0	0	112.1	F312 I327 P329 D331 P332 S336 A338 I339 F370 L371	F312-F334 HydrophobicContact CD2-CE2 4.44Å; F312-F334 AromaticContact CE2-CE2 3.77Å; F312-F334 HydrophobicContact CE2-CE2 3.77Å; F312-F334 HydrophobicContact CE2-CZ 4.48Å; F312-F334 HydrophobicContact CZ-CE2 4.35Å; I327-F334 HydrophobicContact CG2-CB 4.29Å; P329-F334 VanDerWaalsContact CA-CD2 3.45Å; P329-F334 HydrophobicContact CB-CD2 4.39Å; P329-F334 HydrophobicContact CB-CE2 4.25Å; P329-F334 HydrophobicContact CB-CZ 4.46Å; P329-F334 HydrophobicContact CG-CD2 4.47Å; P329-F334 HydrophobicContact CG-CE2 4.02Å; P329-F334 HydrophobicContact CG-CZ 4.41Å; D331-F334 WeakPolarHBondContact O-CB 3.35Å; D331-F334 PolarHBondContact O-N 2.93Å; P332-F334 PolarHBondContact O-N 3.2Å; F334-S336 VanDerWaalsContact C-N 3.35Å; F334-S336 PolarHBondContact O-N 3.3Å; F334-A338 HydrophobicContact CB-CB 4.42Å; F334-A338 HydrophobicContact CD2-CB 3.29Å; F334-A338 HydrophobicContact CE2-CB 3.7Å; F334-A338 HydrophobicContact CG-CB 4.05Å; F334-A338 WeakPolarHBondContact O-CB 3.33Å; F334-A338 PolarHBondContact O-N 3.32Å; F334-A338 VanDerWaalsContact O-N 3.07Å; F334-I339 HydrophobicContact CE2-CD1 4.17Å; F334-I339 HydrophobicContact CE2-CG1 4.36Å; F334-I339 HydrophobicContact CZ-CD1 3.83Å; F334-I339 HydrophobicContact CZ-CG1 4.41Å; F334-F370 HydrophobicContact CE1-CB 4.41Å; F334-F370 HydrophobicContact CZ-CB 3.79Å; F334-F370 HydrophobicContact CZ-CD2 4.47Å; F334-L371 HydrophobicContact CE1-CB 4.27Å
335	W	88	Confident	81	Confident	27 Å²	27	62.9 Å²	62.9	10%	0.102	34%	0.336	C	S	.	.	I	π-helix	trans	-63.3	-39.7	-174.8	-170.9	-97	0	0	0	113	K333 K367 L371 I581 F684 A685	K333-W335 PolarHBondContact O-N 2.96Å; W335-K367 HydrophobicContact CE3-CB 4.14Å; W335-K367 HydrophobicContact CH2-CB 4.07Å; W335-K367 HydrophobicContact CZ3-CB 3.66Å; W335-K367 PolarHBondContact O-NZ 2.92Å; W335-L371 HydrophobicContact CE3-CD2 4.25Å; W335-I581 HydrophobicContact CB-CG2 3.85Å; W335-F684 HydrophobicContact CB-CE1 4.46Å; W335-F684 AromaticContact CD2-CD1 3.46Å; W335-F684 HydrophobicContact CD2-CD1 3.46Å; W335-F684 VanDerWaalsContact CD2-CD1 3.46Å; W335-F684 AromaticContact CD2-CE1 3.51Å; W335-F684 HydrophobicContact CD2-CE1 3.51Å; W335-F684 AromaticContact CE2-CD1 3.52Å; W335-F684 AromaticContact CE2-CE1 3.93Å; W335-F684 AromaticContact CE3-CD1 3.42Å; W335-F684 HydrophobicContact CE3-CD1 3.42Å; W335-F684 VanDerWaalsContact CE3-CD1 3.42Å; W335-F684 AromaticContact CE3-CE1 3.63Å; W335-F684 HydrophobicContact CE3-CE1 3.63Å; W335-F684 HydrophobicContact CG-CD1 4.26Å; W335-F684 AromaticContact CG-CE1 3.85Å; W335-F684 HydrophobicContact CG-CE1 3.85Å; W335-F684 HydrophobicContact CH2-CB 3.99Å; W335-F684 AromaticContact CH2-CD1 3.59Å; W335-F684 HydrophobicContact CH2-CD1 3.59Å; W335-F684 HydrophobicContact CH2-CG 4.26Å; W335-F684 HydrophobicContact CZ2-CB 4.38Å; W335-F684 AromaticContact CZ2-CD1 3.62Å; W335-F684 HydrophobicContact CZ2-CD1 3.62Å; W335-F684 HydrophobicContact CZ2-CE1 4.46Å; W335-F684 HydrophobicContact CZ2-CG 4.49Å; W335-F684 HydrophobicContact CZ3-CB 4.33Å; W335-F684 AromaticContact CZ3-CD1 3.46Å; W335-F684 HydrophobicContact CZ3-CD1 3.46Å; W335-F684 VanDerWaalsContact CZ3-CD1 3.46Å; W335-F684 HydrophobicContact CZ3-CE1 4.16Å; W335-F684 HydrophobicContact CZ3-CG 4.25Å; W335-A685 HydrophobicContact CZ2-CB 3.9Å
336	S	84.2	Confident	79.7	Confident	66 Å²	66	64.6 Å²	64.6	46%	0.462	35%	0.352	S	S	.	.	I	π-helix	trans	-77	-45.5	-178.6	53.9	0	0	0	0	112.9	K333 F334	K333-S336 PolarHBondContact O-N 3.47Å; K333-S336 PolarHBondContact O-OG 3.49Å; K333-S336 VanDerWaalsContact O-OG 3.11Å; F334-S336 VanDerWaalsContact C-N 3.35Å; F334-S336 PolarHBondContact O-N 3.3Å
337	D	86.9	Confident	78.4	Confident	67 Å²	67	60 Å²	60	36%	0.358	33%	0.327	S	S	.	.	I	π-helix	trans	-122.5	-19.4	-159.9	-65.1	-53.8	0	0	0	115.3	I327 K333	I327-D337 HydrophobicContact CD1-CB 3.73Å; K333-D337 PolarHBondContact O-N 2.92Å
338	A	83.6	Confident	77.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.336	C	S	.	.	I	π-helix	trans	-71.3	-41.1	-172.8	0	0	0	0	0	113.7	I323 N324 I327 F334	I323-A338 WeakPolarHBondContact CA-O 3.23Å; N324-A338 PolarHBondContact N-O 2.92Å; I327-A338 HydrophobicContact CB-CB 3.92Å; I327-A338 HydrophobicContact CG2-CB 3.86Å; F334-A338 HydrophobicContact CB-CB 4.42Å; F334-A338 HydrophobicContact CD2-CB 3.29Å; F334-A338 HydrophobicContact CE2-CB 3.7Å; F334-A338 HydrophobicContact CG-CB 4.05Å; F334-A338 WeakPolarHBondContact O-CB 3.33Å; F334-A338 PolarHBondContact O-N 3.32Å; F334-A338 VanDerWaalsContact O-N 3.07Å
339	I	84.7	Confident	76	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	123.2	-174.5	-53.4	178.7	0	0	0	108.9	F312 A321 F334 V363 K367 F370	F312-I339 HydrophobicContact CE2-CD1 4.05Å; F312-I339 HydrophobicContact CE2-CG1 4.18Å; A321-I339 HydrophobicContact CB-CG2 3.41Å; A321-I339 VanDerWaalsContact CB-CG2 3.41Å; F334-I339 HydrophobicContact CE2-CD1 4.17Å; F334-I339 HydrophobicContact CE2-CG1 4.36Å; F334-I339 HydrophobicContact CZ-CD1 3.83Å; F334-I339 HydrophobicContact CZ-CG1 4.41Å; I339-V363 HydrophobicContact CG2-CG1 3.78Å; I339-K367 HydrophobicContact CB-CG 3.98Å; I339-K367 HydrophobicContact CD1-CG 4.04Å; I339-K367 HydrophobicContact CG1-CG 4.48Å; I339-K367 HydrophobicContact CG2-CG 4.35Å; I339-K367 WeakPolarHBondContact O-CE 3.41Å; I339-K367 PolarHBondContact O-NZ 3.44Å; I339-F370 HydrophobicContact CD1-CD2 3.62Å; I339-F370 HydrophobicContact CD1-CE2 3.96Å
340	K	83	Confident	75.3	Confident	110 Å²	110	61.4 Å²	61.4	48%	0.478	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.5	173.7	-67.2	-179.8	-176.8	175.7	0	109.7	A321 D322 R342	A321-K340 CarbonylContact C-O 3.52Å; A321-K340 VanDerWaalsContact CA-O 3.28Å; A321-K340 WeakPolarHBondContact CA-O 3.4Å; A321-K340 WeakPolarHBondContact CB-O 3.24Å; D322-K340 PolarHBondContact N-O 2.88Å; D322-K340 PolarHBondContact O-N 3.25Å; K340-R342 PolarHBondContact O-N 3.4Å
341	P	80.3	Confident	74.8	Confident	55 Å²	55	59.9 Å²	59.9	36%	0.357	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	134.4	172	27.2	-32.9	0	0	0	108.8	V363	P341-V363 HydrophobicContact CB-CG2 4.19Å
342	R	72.1	Confident	74.4	Confident	53 Å²	53	57.7 Å²	57.7	20%	0.2	31%	0.311	C	S	.	.			trans	-60.6	145.6	178.3	-173.2	-178.9	-81.9	-94.3	3.2	110.3	K318 F320 D322 K340 K344 D347	K318-R342 PolarHBondContact O-NE 3.36Å; K318-R342 PolarHBondContact O-NH2 3.44Å; F320-R342 PolarHBondContact O-N 3.1Å; D322-R342 IonicContact OD1-CZ 3.25Å; K340-R342 PolarHBondContact O-N 3.4Å; R342-K344 PolarHBondContact O-N 3.19Å; R342-K344 VanDerWaalsContact O-N 3.09Å; R342-D347 WeakPolarHBondContact CD-OD2 3.38Å; R342-D347 HydrophobicContact CG-CB 3.84Å; R342-D347 WeakPolarHBondContact CG-OD2 3.35Å; R342-D347 IonicContact CZ-OD2 3.59Å; R342-D347 IonicContact NE-OD2 3.33Å; R342-D347 IonicContact NH1-OD2 3.54Å; R342-D347 PolarHBondContact NH1-OD2 2.85Å
343	N	66.5	Low	74.3	Confident	98 Å²	98	61.6 Å²	61.6	52%	0.524	32%	0.32	S	S	.	.			trans	-60	113.7	-178.2	-86.3	-31.4	0	0	0	112.1	V345 L346 D347	N343-V345 PolarHBondContact O-N 3.19Å; N343-L346 HydrophobicContact CB-CB 4.26Å; N343-L346 HydrophobicContact CB-CD1 4.24Å; N343-L346 PolarHBondContact O-N 3.47Å; N343-D347 PolarHBondContact O-N 3.09Å
344	K	62.6	Low	74	Confident	109 Å²	109	55.7 Å²	55.7	47%	0.474	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.6	179.9	-64.7	-178.8	-177.8	176.6	0	114.2	R342 D360	R342-K344 PolarHBondContact O-N 3.19Å; R342-K344 VanDerWaalsContact O-N 3.09Å; K344-D360 IonicContact NZ-OD1 3.17Å; K344-D360 IonicContact NZ-OD2 3.58Å; K344-D360 PolarHBondContact NZ-OD2 3.4Å
345	V	58.4	Low	73.7	Confident	132 Å²	132	55.7 Å²	55.7	80%	0.8	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-39.5	-173.8	-176.7	0	0	0	0	113.1	N343	N343-V345 PolarHBondContact O-N 3.19Å
346	L	53.6	Low	73.4	Confident	131 Å²	131	56.2 Å²	56.2	69%	0.686	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-32.7	-171.4	-75.7	154.7	0	0	0	112.6	N343	N343-L346 HydrophobicContact CB-CB 4.26Å; N343-L346 HydrophobicContact CB-CD1 4.24Å; N343-L346 PolarHBondContact O-N 3.47Å
347	D	56.6	Low	73.4	Confident	43 Å²	43	56.4 Å²	56.4	23%	0.23	30%	0.299	C	S	.	.			trans	-115.5	20.6	-169.1	-64.6	-20.6	0	0	0	114	R342 N343 S349 C350	R342-D347 WeakPolarHBondContact CD-OD2 3.38Å; R342-D347 HydrophobicContact CG-CB 3.84Å; R342-D347 WeakPolarHBondContact CG-OD2 3.35Å; R342-D347 IonicContact CZ-OD2 3.59Å; R342-D347 IonicContact NE-OD2 3.33Å; R342-D347 IonicContact NH1-OD2 3.54Å; R342-D347 PolarHBondContact NH1-OD2 2.85Å; N343-D347 PolarHBondContact O-N 3.09Å; D347-S349 PolarHBondContact O-N 3.41Å; D347-C350 PolarHBondContact O-N 3.12Å
348	S	57.1	Low	73.3	Confident	42 Å²	42	53.5 Å²	53.5	29%	0.294	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-20.6	178.5	60.1	0	0	0	0	113.3	C350	S348-C350 VanDerWaalsContact C-N 3.33Å; S348-C350 PolarHBondContact O-N 3.41Å
349	S	63.9	Low	73.3	Confident	61 Å²	61	53.7 Å²	53.7	43%	0.427	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-24.4	177.3	61	0	0	0	0	114.1	S261 D347	S261-S349 PolarHBondContact OG-O 2.69Å; D347-S349 PolarHBondContact O-N 3.41Å
350	C	68	Low	73.5	Confident	33 Å²	33	57.1 Å²	57.1	22%	0.223	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-20.5	-175.1	-65.9	0	0	0	0	113.7	S261 L319 D347 S348	S261-C350 PolarHBondContact OG-O 3.32Å; L319-C350 VanDerWaalsContact CD1-O 3.24Å; L319-C350 WeakPolarHBondContact CD1-O 3.47Å; D347-C350 PolarHBondContact O-N 3.12Å; S348-C350 VanDerWaalsContact C-N 3.33Å; S348-C350 PolarHBondContact O-N 3.41Å
351	I	73.3	Confident	73.7	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.031	29%	0.289	C	S	.	.	S	Bend	trans	-110.1	124.7	-173.4	-60.2	161.2	0	0	0	109	L319 Y353 F355 L356 M359	L319-I351 HydrophobicContact CD1-CG1 4.44Å; L319-I351 WeakPolarHBondContact O-CD1 3.47Å; L319-I351 VanDerWaalsContact O-CG1 3.31Å; L319-I351 WeakPolarHBondContact O-CG1 3.43Å; I351-Y353 PolarHBondContact O-N 3.38Å; I351-F355 HydrophobicContact CG2-CB 3.78Å; I351-L356 HydrophobicContact CB-CD2 4.39Å; I351-L356 HydrophobicContact CG2-CD2 4.14Å; I351-M359 HydrophobicContact CD1-CE 3.54Å; I351-M359 HydrophobicContact CD1-SD 4.05Å; I351-M359 HydrophobicContact CG2-SD 3.97Å
352	P	79.7	Confident	74.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	27%	0.272	C	S	.	.			trans	-54.7	136.4	172.8	-22.7	30.9	0	0	0	111.5	L264 F298 M354 F355	L264-P352 HydrophobicContact CD1-CB 4.19Å; L264-P352 HydrophobicContact CD1-CG 3.83Å; F298-P352 HydrophobicContact CE2-CG 4.5Å; P352-M354 PolarHBondContact O-N 2.9Å; P352-F355 HydrophobicContact CB-CD2 4.1Å; P352-F355 HydrophobicContact CG-CD2 4.01Å; P352-F355 HydrophobicContact CG-CE2 4.3Å; P352-F355 PolarHBondContact O-N 3.18Å
353	Y	80.3	Confident	74.9	Confident	131 Å²	131	49 Å²	49	51%	0.514	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.2	-177.3	-81.5	-69.1	0	0	0	113.5	D265 I351 F355 L356	D265-Y353 HydrophobicContact CB-CD2 3.72Å; D265-Y353 HydrophobicContact CB-CE2 4.09Å; D265-Y353 WeakPolarHBondContact OD1-CD2 3.32Å; D265-Y353 PolarHBondContact OD1-N 2.97Å; D265-Y353 VanDerWaalsContact OD2-CD2 3.31Å; D265-Y353 WeakPolarHBondContact OD2-CD2 3.37Å; I351-Y353 PolarHBondContact O-N 3.38Å; Y353-F355 VanDerWaalsContact C-N 3.26Å; Y353-F355 PolarHBondContact O-N 3.11Å; Y353-L356 HydrophobicContact CD1-CD1 3.53Å; Y353-L356 HydrophobicContact CE1-CD1 4.02Å; Y353-L356 PolarHBondContact O-N 3.07Å
354	M	81.2	Confident	76	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.02	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.9	177.4	-175	166.6	-78.3	0	0	113.8	F291 F295 P352 L434 L438	F291-M354 HydrophobicContact CE1-CE 3.5Å; F291-M354 HydrophobicContact CE1-SD 4.12Å; F291-M354 HydrophobicContact CZ-CE 3.52Å; F291-M354 HydrophobicContact CZ-SD 3.98Å; F295-M354 HydrophobicContact CD1-SD 4.08Å; F295-M354 HydrophobicContact CE1-CG 4.5Å; F295-M354 HydrophobicContact CE1-SD 3.5Å; F295-M354 VanDerWaalsContact CE1-SD 3.5Å; F295-M354 HydrophobicContact CE2-CB 4.45Å; F295-M354 HydrophobicContact CE2-SD 4.21Å; F295-M354 HydrophobicContact CZ-CB 4.36Å; F295-M354 HydrophobicContact CZ-CG 4.05Å; F295-M354 HydrophobicContact CZ-SD 3.59Å; F295-M354 VanDerWaalsContact CZ-SD 3.59Å; P352-M354 PolarHBondContact O-N 2.9Å; M354-L434 HydrophobicContact CE-CD2 4.23Å; M354-L434 HydrophobicContact SD-CD2 4.15Å; M354-L434 HydrophobicContact SD-CG 4.49Å; M354-L438 HydrophobicContact CG-CD2 4.06Å; M354-L438 HydrophobicContact SD-CD2 4.45Å
355	F	83.6	Confident	77.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-24.2	179.8	-74.5	-66.3	0	0	0	113.4	F295 F298 L302 F320 I351 P352 Y353 P357 I358 M359 L438	F295-F355 HydrophobicContact CD2-CE2 4.48Å; F295-F355 HydrophobicContact CE1-CZ 4.45Å; F295-F355 HydrophobicContact CE2-CD2 4.03Å; F295-F355 AromaticContact CE2-CE2 3.31Å; F295-F355 HydrophobicContact CE2-CE2 3.31Å; F295-F355 AromaticContact CE2-CZ 3.68Å; F295-F355 HydrophobicContact CE2-CZ 3.68Å; F295-F355 HydrophobicContact CZ-CD2 4.27Å; F295-F355 HydrophobicContact CZ-CE1 4.06Å; F295-F355 AromaticContact CZ-CE2 3.54Å; F295-F355 HydrophobicContact CZ-CE2 3.54Å; F295-F355 AromaticContact CZ-CZ 3.4Å; F295-F355 HydrophobicContact CZ-CZ 3.4Å; F298-F355 HydrophobicContact CB-CE2 4.15Å; F298-F355 HydrophobicContact CB-CZ 4.14Å; F298-F355 HydrophobicContact CG-CE2 4.45Å; L302-F355 HydrophobicContact CD1-CE1 4.26Å; L302-F355 HydrophobicContact CD2-CE1 4.33Å; F320-F355 HydrophobicContact CE1-CB 4.2Å; F320-F355 AromaticContact CE1-CD1 3.71Å; F320-F355 HydrophobicContact CE1-CD1 3.71Å; F320-F355 HydrophobicContact CE1-CD2 4.28Å; F320-F355 HydrophobicContact CE1-CE1 4.11Å; F320-F355 AromaticContact CE1-CG 3.83Å; F320-F355 HydrophobicContact CE1-CG 3.83Å; F320-F355 HydrophobicContact CZ-CD1 4.22Å; F320-F355 HydrophobicContact CZ-CE1 4.15Å; F320-F355 HydrophobicContact CZ-CG 4.49Å; F320-F355 HydrophobicContact CZ-CZ 4.31Å; I351-F355 HydrophobicContact CG2-CB 3.78Å; P352-F355 HydrophobicContact CB-CD2 4.1Å; P352-F355 HydrophobicContact CG-CD2 4.01Å; P352-F355 HydrophobicContact CG-CE2 4.3Å; P352-F355 PolarHBondContact O-N 3.18Å; Y353-F355 VanDerWaalsContact C-N 3.26Å; Y353-F355 PolarHBondContact O-N 3.11Å; F355-P357 VanDerWaalsContact C-N 3.34Å; F355-P357 VanDerWaalsContact O-N 3.17Å; F355-I358 HydrophobicContact CD1-CD1 3.89Å; F355-I358 HydrophobicContact CD1-CG1 4.25Å; F355-I358 HydrophobicContact CE1-CD1 4.45Å; F355-I358 WeakPolarHBondContact O-CG1 3.08Å; F355-I358 PolarHBondContact O-N 2.82Å; F355-M359 HydrophobicContact CB-SD 4.33Å; F355-M359 WeakPolarHBondContact O-CG 3.3Å; F355-M359 PolarHBondContact O-N 3.25Å; F355-M359 VanDerWaalsContact O-N 3.12Å; F355-L438 HydrophobicContact CD1-CD2 4.22Å; F355-L438 HydrophobicContact CE1-CD1 4.5Å; F355-L438 HydrophobicContact CE1-CD2 4Å
356	L	82.7	Confident	78.8	Confident	38 Å²	38	33.8 Å²	33.8	20%	0.199	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-51.5	-41.2	-174.7	-64.8	-177.7	0	0	0	114.9	I351 Y353 I358	I351-L356 HydrophobicContact CB-CD2 4.39Å; I351-L356 HydrophobicContact CG2-CD2 4.14Å; Y353-L356 HydrophobicContact CD1-CD1 3.53Å; Y353-L356 HydrophobicContact CE1-CD1 4.02Å; Y353-L356 PolarHBondContact O-N 3.07Å; L356-I358 PolarHBondContact O-N 2.81Å
357	P	83.2	Confident	80.6	Confident	70 Å²	70	28.9 Å²	28.9	46%	0.455	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-69.9	-19	179.5	-19.2	33.4	0	0	0	114.5	F355	F355-P357 VanDerWaalsContact C-N 3.34Å; F355-P357 VanDerWaalsContact O-N 3.17Å
358	I	85.7	Confident	82.2	Confident	7 Å²	7	26.9 Å²	26.9	4%	0.036	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-112.8	2.5	-174.5	62.5	176.3	0	0	0	113.3	F355 L356 D360 E361 V362 L438 K439 V442	F355-I358 HydrophobicContact CD1-CD1 3.89Å; F355-I358 HydrophobicContact CD1-CG1 4.25Å; F355-I358 HydrophobicContact CE1-CD1 4.45Å; F355-I358 WeakPolarHBondContact O-CG1 3.08Å; F355-I358 PolarHBondContact O-N 2.82Å; L356-I358 PolarHBondContact O-N 2.81Å; I358-D360 PolarHBondContact O-N 2.78Å; I358-E361 VanDerWaalsContact C-OE2 3.31Å; I358-E361 VanDerWaalsContact CA-OE2 3.24Å; I358-E361 WeakPolarHBondContact CA-OE2 3.15Å; I358-E361 PolarHBondContact O-N 3.1Å; I358-V362 HydrophobicContact CG1-CG2 4.35Å; I358-V362 VanDerWaalsContact O-CG2 3.3Å; I358-V362 WeakPolarHBondContact O-CG2 3.44Å; I358-V362 PolarHBondContact O-N 3.42Å; I358-L438 HydrophobicContact CD1-CD2 3.45Å; I358-L438 VanDerWaalsContact CD1-CD2 3.45Å; I358-L438 HydrophobicContact CD1-CG 3.6Å; I358-K439 HydrophobicContact CG2-CB 3.95Å; I358-K439 HydrophobicContact CG2-CD 4.49Å; I358-K439 HydrophobicContact CG2-CG 3.98Å; I358-V442 HydrophobicContact CD1-CG2 4.1Å
359	M	84	Confident	83.9	Confident	3 Å²	3	24.9 Å²	24.9	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-55.4	-47.4	-176	-74.4	-69.4	-64.5	0	0	112.7	F320 I351 F355 E361 V362 V363	F320-M359 HydrophobicContact CB-CE 4.31Å; F320-M359 HydrophobicContact CD1-CE 4.43Å; F320-M359 HydrophobicContact CD1-SD 3.72Å; F320-M359 HydrophobicContact CE1-SD 4.48Å; F320-M359 WeakPolarHBondContact O-CE 3.31Å; I351-M359 HydrophobicContact CD1-CE 3.54Å; I351-M359 HydrophobicContact CD1-SD 4.05Å; I351-M359 HydrophobicContact CG2-SD 3.97Å; F355-M359 HydrophobicContact CB-SD 4.33Å; F355-M359 WeakPolarHBondContact O-CG 3.3Å; F355-M359 PolarHBondContact O-N 3.25Å; F355-M359 VanDerWaalsContact O-N 3.12Å; M359-E361 VanDerWaalsContact C-N 3.33Å; M359-E361 PolarHBondContact O-N 2.79Å; M359-V362 PolarHBondContact O-N 2.96Å; M359-V363 VanDerWaalsContact O-CG2 3.3Å; M359-V363 WeakPolarHBondContact O-CG2 3.41Å; M359-V363 PolarHBondContact O-N 3.5Å
360	D	86.8	Confident	85.1	Confident	73 Å²	73	22.2 Å²	22.2	39%	0.39	11%	0.113	S	C	.	.	H	α-helix	trans	-67.8	-38	-174.7	-60.8	-37.4	0	0	0	110.3	K344 I358 D364	K344-D360 IonicContact NZ-OD1 3.17Å; K344-D360 IonicContact NZ-OD2 3.58Å; K344-D360 PolarHBondContact NZ-OD2 3.4Å; I358-D360 PolarHBondContact O-N 2.78Å; D360-D364 WeakPolarHBondContact O-CB 3.23Å; D360-D364 PolarHBondContact O-N 3.4Å
361	E	88	Confident	86.2	Confident	41 Å²	41	20.6 Å²	20.6	19%	0.192	10%	0.102	C	C	.	.	H	α-helix	trans	-69.9	-36.5	174.2	-61.2	95.4	155.6	0	0	113	I358 M359 G365 V442 R446	I358-E361 VanDerWaalsContact C-OE2 3.31Å; I358-E361 VanDerWaalsContact CA-OE2 3.24Å; I358-E361 WeakPolarHBondContact CA-OE2 3.15Å; I358-E361 PolarHBondContact O-N 3.1Å; M359-E361 VanDerWaalsContact C-N 3.33Å; M359-E361 PolarHBondContact O-N 2.79Å; E361-G365 PolarHBondContact O-N 2.88Å; E361-V442 HydrophobicContact CB-CG1 4Å; E361-R446 VanDerWaalsContact CG-NH1 3.33Å
362	V	88.8	Confident	87	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-62.1	-48.9	174.2	171.3	0	0	0	0	109.8	L302 F306 F320 I358 M359 D364 G365 L366 V442	L302-V362 HydrophobicContact CD1-CG1 4.23Å; L302-V362 HydrophobicContact CD1-CG2 4.26Å; F306-V362 HydrophobicContact CE2-CG1 4.43Å; F306-V362 HydrophobicContact CE2-CG2 4.43Å; F306-V362 HydrophobicContact CZ-CG1 4.37Å; F306-V362 HydrophobicContact CZ-CG2 4.48Å; F320-V362 HydrophobicContact CB-CG1 4.18Å; F320-V362 HydrophobicContact CD1-CG1 3.98Å; F320-V362 HydrophobicContact CD2-CG1 4.22Å; F320-V362 HydrophobicContact CE1-CG1 4.45Å; F320-V362 HydrophobicContact CG-CG1 3.85Å; I358-V362 HydrophobicContact CG1-CG2 4.35Å; I358-V362 VanDerWaalsContact O-CG2 3.3Å; I358-V362 WeakPolarHBondContact O-CG2 3.44Å; I358-V362 PolarHBondContact O-N 3.42Å; M359-V362 PolarHBondContact O-N 2.96Å; V362-D364 PolarHBondContact O-N 3.34Å; V362-G365 PolarHBondContact O-N 3.38Å; V362-L366 HydrophobicContact CG1-CD1 3.78Å; V362-L366 HydrophobicContact CG1-CG 4.21Å; V362-L366 VanDerWaalsContact O-CG 3.26Å; V362-L366 WeakPolarHBondContact O-CG 3.49Å; V362-L366 PolarHBondContact O-N 3.1Å; V362-V442 HydrophobicContact CG2-CG1 3.75Å; V362-V442 HydrophobicContact CG2-CG2 4.01Å
363	V	89.1	Confident	87.4	Confident	5 Å²	5	21.1 Å²	21.1	3%	0.03	10%	0.104	C	C	.	.	H	α-helix	trans	-63.3	-43.7	-178.9	173.1	0	0	0	0	112.1	F320 A321 I339 P341 M359 G365 L366 K367	F320-V363 HydrophobicContact CB-CG2 4.45Å; A321-V363 HydrophobicContact CB-CG2 4.11Å; I339-V363 HydrophobicContact CG2-CG1 3.78Å; P341-V363 HydrophobicContact CB-CG2 4.19Å; M359-V363 VanDerWaalsContact O-CG2 3.3Å; M359-V363 WeakPolarHBondContact O-CG2 3.41Å; M359-V363 PolarHBondContact O-N 3.5Å; V363-G365 VanDerWaalsContact C-N 3.33Å; V363-G365 PolarHBondContact O-N 2.92Å; V363-L366 PolarHBondContact O-N 3.1Å; V363-K367 WeakPolarHBondContact O-CG 3.47Å; V363-K367 PolarHBondContact O-N 2.95Å
364	D	89.6	Confident	87.8	Confident	20 Å²	20	15.3 Å²	15.3	11%	0.107	8%	0.084	C	C	.	.	H	α-helix	trans	-63.2	-40.5	175.9	-172.1	52.9	0	0	0	111.9	D360 V362 K367 A368 R446	D360-D364 WeakPolarHBondContact O-CB 3.23Å; D360-D364 PolarHBondContact O-N 3.4Å; V362-D364 PolarHBondContact O-N 3.34Å; D364-K367 PolarHBondContact O-N 3.14Å; D364-A368 PolarHBondContact O-N 3.31Å; D364-R446 IonicContact OD2-CZ 2.86Å; D364-R446 IonicContact OD2-NE 2.75Å; D364-R446 PolarHBondContact OD2-NE 3.34Å; D364-R446 IonicContact OD2-NH2 2.62Å; D364-R446 PolarHBondContact OD2-NH2 3.07Å
365	G	90	Very high	88.1	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.4	-40.4	175.1	0	0	0	0	0	113.2	E361 V362 V363 A368 N369	E361-G365 PolarHBondContact O-N 2.88Å; V362-G365 PolarHBondContact O-N 3.38Å; V363-G365 VanDerWaalsContact C-N 3.33Å; V363-G365 PolarHBondContact O-N 2.92Å; G365-A368 PolarHBondContact O-N 3.4Å; G365-N369 WeakPolarHBondContact O-CB 3.35Å; G365-N369 PolarHBondContact O-N 3.01Å
366	L	90.1	Very high	88.2	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67.5	-41.7	176	-68.6	173.9	0	0	0	112.1	L305 V317 V362 V363 A368 N369 F370	L305-L366 HydrophobicContact CB-CD2 3.88Å; V317-L366 HydrophobicContact CG1-CD1 4.28Å; V362-L366 HydrophobicContact CG1-CD1 3.78Å; V362-L366 HydrophobicContact CG1-CG 4.21Å; V362-L366 VanDerWaalsContact O-CG 3.26Å; V362-L366 WeakPolarHBondContact O-CG 3.49Å; V362-L366 PolarHBondContact O-N 3.1Å; V363-L366 PolarHBondContact O-N 3.1Å; L366-A368 VanDerWaalsContact C-N 3.32Å; L366-A368 PolarHBondContact O-N 3.26Å; L366-N369 PolarHBondContact O-N 2.72Å; L366-F370 HydrophobicContact CB-CD2 4.4Å; L366-F370 HydrophobicContact CB-CE2 4Å; L366-F370 WeakPolarHBondContact O-CD2 3.4Å; L366-F370 WeakPolarHBondContact O-CG 3.39Å; L366-F370 PolarHBondContact O-N 3.09Å
367	K	91.1	Very high	88.3	Confident	28 Å²	28	19.1 Å²	19.1	12%	0.122	10%	0.101	C	C	.	.	H	α-helix	trans	-55.6	-48.8	172.5	-77	-178.2	175.3	-161.6	0	111.4	W335 I339 V363 D364 N369 L371	W335-K367 HydrophobicContact CE3-CB 4.14Å; W335-K367 HydrophobicContact CH2-CB 4.07Å; W335-K367 HydrophobicContact CZ3-CB 3.66Å; W335-K367 PolarHBondContact O-NZ 2.92Å; I339-K367 HydrophobicContact CB-CG 3.98Å; I339-K367 HydrophobicContact CD1-CG 4.04Å; I339-K367 HydrophobicContact CG1-CG 4.48Å; I339-K367 HydrophobicContact CG2-CG 4.35Å; I339-K367 WeakPolarHBondContact O-CE 3.41Å; I339-K367 PolarHBondContact O-NZ 3.44Å; V363-K367 WeakPolarHBondContact O-CG 3.47Å; V363-K367 PolarHBondContact O-N 2.95Å; D364-K367 PolarHBondContact O-N 3.14Å; K367-N369 VanDerWaalsContact C-N 3.32Å; K367-N369 PolarHBondContact O-N 2.86Å; K367-L371 WeakPolarHBondContact O-CB 3.49Å; K367-L371 PolarHBondContact O-N 2.9Å
368	A	91	Very high	88.3	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.9	-38.6	178.1	0	0	0	0	0	111.7	D364 G365 L366 L372 I449 L453	D364-A368 PolarHBondContact O-N 3.31Å; G365-A368 PolarHBondContact O-N 3.4Å; L366-A368 VanDerWaalsContact C-N 3.32Å; L366-A368 PolarHBondContact O-N 3.26Å; A368-L372 VanDerWaalsContact O-CB 3.29Å; A368-L372 WeakPolarHBondContact O-CB 3.49Å; A368-L372 PolarHBondContact O-N 3.1Å; A368-I449 HydrophobicContact CB-CG2 3.81Å; A368-L453 HydrophobicContact CB-CD2 3.98Å
369	N	90.8	Very high	88	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.2	-49.7	179.1	-161.7	27.6	0	0	0	111.9	L305 S307 G365 L366 K367 L371 L372 I373 I449	L305-N369 PolarHBondContact O-ND2 3.16Å; S307-N369 PolarHBondContact O-ND2 3.47Å; G365-N369 WeakPolarHBondContact O-CB 3.35Å; G365-N369 PolarHBondContact O-N 3.01Å; L366-N369 PolarHBondContact O-N 2.72Å; K367-N369 VanDerWaalsContact C-N 3.32Å; K367-N369 PolarHBondContact O-N 2.86Å; N369-L371 VanDerWaalsContact C-N 3.29Å; N369-L371 PolarHBondContact O-N 2.8Å; N369-L372 WeakPolarHBondContact O-CB 3.4Å; N369-L372 PolarHBondContact O-N 3.46Å; N369-L372 VanDerWaalsContact O-N 3.13Å; N369-I373 VanDerWaalsContact O-CG1 3.31Å; N369-I373 WeakPolarHBondContact O-CG1 3.41Å; N369-I373 PolarHBondContact O-N 2.84Å; N369-I449 HydrophobicContact CB-CD1 4.09Å; N369-I449 HydrophobicContact CB-CG2 4.12Å
370	F	90.8	Very high	87.8	Confident	5 Å²	5	25.4 Å²	25.4	2%	0.022	14%	0.139	C	C	.	.	H	α-helix	trans	-63.5	-37.2	178.7	-65.7	-47.7	0	0	0	112.4	A310 F312 V317 P329 F334 I339 L366 A374	A310-F370 HydrophobicContact CB-CE1 4.06Å; F312-F370 HydrophobicContact CB-CD1 4.45Å; F312-F370 HydrophobicContact CB-CE1 4.44Å; F312-F370 HydrophobicContact CD2-CD1 4.49Å; F312-F370 HydrophobicContact CD2-CD2 4.02Å; F312-F370 HydrophobicContact CD2-CE2 4.2Å; F312-F370 HydrophobicContact CD2-CG 4.18Å; V317-F370 HydrophobicContact CG1-CE2 4.1Å; V317-F370 HydrophobicContact CG1-CZ 4.29Å; V317-F370 HydrophobicContact CG2-CE2 4.41Å; V317-F370 HydrophobicContact CG2-CZ 3.79Å; P329-F370 HydrophobicContact CG-CB 4.37Å; F334-F370 HydrophobicContact CE1-CB 4.41Å; F334-F370 HydrophobicContact CZ-CB 3.79Å; F334-F370 HydrophobicContact CZ-CD2 4.47Å; I339-F370 HydrophobicContact CD1-CD2 3.62Å; I339-F370 HydrophobicContact CD1-CE2 3.96Å; L366-F370 HydrophobicContact CB-CD2 4.4Å; L366-F370 HydrophobicContact CB-CE2 4Å; L366-F370 WeakPolarHBondContact O-CD2 3.4Å; L366-F370 WeakPolarHBondContact O-CG 3.39Å; L366-F370 PolarHBondContact O-N 3.09Å; F370-A374 WeakPolarHBondContact O-CB 3.26Å; F370-A374 PolarHBondContact O-N 3.49Å
371	L	90.4	Very high	87.5	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.3	-41.8	174	-175.3	59.6	0	0	0	111.2	F334 W335 K367 N369 A374 V375 L453 W577 I581 F684	F334-L371 HydrophobicContact CE1-CB 4.27Å; W335-L371 HydrophobicContact CE3-CD2 4.25Å; K367-L371 WeakPolarHBondContact O-CB 3.49Å; K367-L371 PolarHBondContact O-N 2.9Å; N369-L371 VanDerWaalsContact C-N 3.29Å; N369-L371 PolarHBondContact O-N 2.8Å; L371-A374 PolarHBondContact O-N 2.98Å; L371-V375 HydrophobicContact CD1-CG2 4.32Å; L371-V375 WeakPolarHBondContact O-CG2 3.37Å; L371-V375 PolarHBondContact O-N 3.16Å; L371-L453 HydrophobicContact CB-CD1 4.41Å; L371-L453 HydrophobicContact CD2-CD1 4.19Å; L371-L453 HydrophobicContact CD2-CD2 4.08Å; L371-L453 HydrophobicContact CG-CD1 3.99Å; L371-L453 HydrophobicContact CG-CD2 4.5Å; L371-W577 HydrophobicContact CD1-CZ2 3.87Å; L371-I581 HydrophobicContact CD1-CD1 3.48Å; L371-I581 VanDerWaalsContact CD1-CD1 3.48Å; L371-I581 HydrophobicContact CD2-CD1 4.11Å; L371-I581 HydrophobicContact CG-CD1 4.44Å; L371-F684 HydrophobicContact CD2-CD1 4.44Å; L371-F684 HydrophobicContact CD2-CE1 4.11Å; L371-F684 HydrophobicContact CD2-CZ 4.15Å
372	L	89.8	Confident	87.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.5	-47.4	175.7	178.5	64.4	0	0	0	111.6	A368 N369 A374 V375 C376 F384 L385 V388 I449 Q452 L453 L456	A368-L372 VanDerWaalsContact O-CB 3.29Å; A368-L372 WeakPolarHBondContact O-CB 3.49Å; A368-L372 PolarHBondContact O-N 3.1Å; N369-L372 WeakPolarHBondContact O-CB 3.4Å; N369-L372 PolarHBondContact O-N 3.46Å; N369-L372 VanDerWaalsContact O-N 3.13Å; L372-A374 PolarHBondContact O-N 2.88Å; L372-V375 PolarHBondContact O-N 3.36Å; L372-C376 WeakPolarHBondContact O-CB 3.48Å; L372-C376 PolarHBondContact O-N 3.38Å; L372-C376 PolarHBondContact O-SG 3.34Å; L372-F384 HydrophobicContact CD1-CB 4.36Å; L372-L385 HydrophobicContact CD2-CD2 3.95Å; L372-L385 HydrophobicContact CG-CD2 3.82Å; L372-V388 HydrophobicContact CD2-CG2 3.99Å; L372-I449 HydrophobicContact CD2-CG2 4.22Å; L372-Q452 HydrophobicContact CD1-CB 4.41Å; L372-Q452 HydrophobicContact CD2-CB 4.16Å; L372-L453 HydrophobicContact CB-CD1 4.23Å; L372-L453 HydrophobicContact CD1-CB 4.39Å; L372-L453 HydrophobicContact CD1-CD1 4.48Å; L372-L456 HydrophobicContact CD1-CD2 3.89Å
373	I	88.4	Confident	86.9	Confident	17 Å²	17	29.7 Å²	29.7	9%	0.087	16%	0.159	C	C	.	.	H	α-helix	trans	-58.1	-49.5	177.7	-67.6	166.6	0	0	0	110.1	A310 N369 V375 C376 E377 L385	A310-I373 HydrophobicContact CB-CD1 4.3Å; A310-I373 WeakPolarHBondContact O-CD1 3.24Å; N369-I373 VanDerWaalsContact O-CG1 3.31Å; N369-I373 WeakPolarHBondContact O-CG1 3.41Å; N369-I373 PolarHBondContact O-N 2.84Å; I373-V375 VanDerWaalsContact C-N 3.32Å; I373-V375 PolarHBondContact O-N 2.91Å; I373-C376 PolarHBondContact O-N 3.37Å; I373-E377 HydrophobicContact CG2-CG 4.34Å; I373-E377 WeakPolarHBondContact O-CG 3.31Å; I373-E377 PolarHBondContact O-N 2.92Å; I373-L385 HydrophobicContact CG1-CD1 4.27Å; I373-L385 HydrophobicContact CG1-CD2 3.86Å
374	A	87.9	Confident	86.5	Confident	10 Å²	10	30.4 Å²	30.4	8%	0.083	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-40.6	179	0	0	0	0	0	112.6	P329 F370 L371 L372 E377 E378 W577	P329-A374 HydrophobicContact CB-CB 3.55Å; F370-A374 WeakPolarHBondContact O-CB 3.26Å; F370-A374 PolarHBondContact O-N 3.49Å; L371-A374 PolarHBondContact O-N 2.98Å; L372-A374 PolarHBondContact O-N 2.88Å; A374-E377 PolarHBondContact O-N 2.75Å; A374-E378 WeakPolarHBondContact O-CG 3.35Å; A374-E378 PolarHBondContact O-N 3.4Å; A374-E378 VanDerWaalsContact O-N 3.08Å; A374-W577 HydrophobicContact CB-CH2 3.95Å; A374-W577 HydrophobicContact CB-CZ2 4.01Å
375	V	87.5	Confident	86.1	Confident	3 Å²	3	30 Å²	30	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-69.6	-38	179.5	179.9	0	0	0	0	110.2	L371 L372 I373 E378 I379 L456 L457 L468 W577 P578	L371-V375 HydrophobicContact CD1-CG2 4.32Å; L371-V375 WeakPolarHBondContact O-CG2 3.37Å; L371-V375 PolarHBondContact O-N 3.16Å; L372-V375 PolarHBondContact O-N 3.36Å; I373-V375 VanDerWaalsContact C-N 3.32Å; I373-V375 PolarHBondContact O-N 2.91Å; V375-E378 PolarHBondContact O-N 3.38Å; V375-I379 HydrophobicContact CG1-CD1 3.72Å; V375-I379 HydrophobicContact CG1-CG1 4.44Å; V375-I379 VanDerWaalsContact O-CG1 3.24Å; V375-I379 WeakPolarHBondContact O-CG1 3.36Å; V375-I379 PolarHBondContact O-N 3.36Å; V375-L456 HydrophobicContact CB-CD2 3.9Å; V375-L456 HydrophobicContact CG1-CD2 3.39Å; V375-L456 HydrophobicContact CG1-CG 3.85Å; V375-L457 HydrophobicContact CG1-CD2 4.41Å; V375-L457 HydrophobicContact CG2-CD2 4.13Å; V375-L468 HydrophobicContact CG1-CD1 4.3Å; V375-W577 HydrophobicContact CB-CH2 4.01Å; V375-W577 HydrophobicContact CB-CZ3 4.45Å; V375-W577 HydrophobicContact CG2-CH2 3.32Å; V375-W577 HydrophobicContact CG2-CZ2 3.9Å; V375-W577 HydrophobicContact CG2-CZ3 3.96Å; V375-P578 HydrophobicContact CG2-CB 4.36Å; V375-P578 HydrophobicContact CG2-CG 4.46Å
376	C	86.3	Confident	85.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.4	-39.3	175.3	-63.8	0	0	0	0	112	L372 I373 I379 G380 D381 Y382 L385	L372-C376 WeakPolarHBondContact O-CB 3.48Å; L372-C376 PolarHBondContact O-N 3.38Å; L372-C376 PolarHBondContact O-SG 3.34Å; I373-C376 PolarHBondContact O-N 3.37Å; C376-I379 PolarHBondContact O-N 2.95Å; C376-G380 WeakPolarHBondContact O-CA 3.43Å; C376-G380 PolarHBondContact O-N 2.89Å; C376-D381 WeakPolarHBondContact CB-O 3.19Å; C376-D381 PolarHBondContact O-N 3.24Å; C376-Y382 HydrophobicContact CB-CD1 4.21Å; C376-L385 HydrophobicContact CB-CD1 4.16Å; C376-L385 HydrophobicContact CB-CG 4.13Å
377	E	85.3	Confident	84.8	Confident	118 Å²	118	39.8 Å²	39.8	55%	0.551	21%	0.21	S	C	*	.	H	α-helix	trans	-61.9	-43.2	175.5	-75.9	178.3	170	0	0	112.2	I373 A374 G380 Y382	I373-E377 HydrophobicContact CG2-CG 4.34Å; I373-E377 WeakPolarHBondContact O-CG 3.31Å; I373-E377 PolarHBondContact O-N 2.92Å; A374-E377 PolarHBondContact O-N 2.75Å; E377-G380 PolarHBondContact O-N 3.36Å; E377-Y382 HydrophobicContact CG-CE1 4.15Å
378	E	82.1	Confident	84	Confident	121 Å²	121	38.5 Å²	38.5	57%	0.565	20%	0.204	S	C	*	.	H	α-helix	trans	-69.5	-36	178	-72.6	-71.3	161.3	0	0	112.7	A374 V375 L468 W577	A374-E378 WeakPolarHBondContact O-CG 3.35Å; A374-E378 PolarHBondContact O-N 3.4Å; A374-E378 VanDerWaalsContact O-N 3.08Å; V375-E378 PolarHBondContact O-N 3.38Å; E378-L468 HydrophobicContact CB-CD1 3.81Å; E378-W577 HydrophobicContact CB-CZ3 3.96Å; E378-W577 HydrophobicContact CG-CE3 4.24Å; E378-W577 HydrophobicContact CG-CH2 4.25Å; E378-W577 HydrophobicContact CG-CZ3 3.62Å
379	I	80.9	Confident	82.9	Confident	41 Å²	41	42.2 Å²	42.2	21%	0.21	22%	0.224	C	C	.	.	H	α-helix	trans	-76.3	-30.6	176.7	-64.1	170.1	0	0	0	111.5	V375 C376 D381 L456 M462 L468	V375-I379 HydrophobicContact CG1-CD1 3.72Å; V375-I379 HydrophobicContact CG1-CG1 4.44Å; V375-I379 VanDerWaalsContact O-CG1 3.24Å; V375-I379 WeakPolarHBondContact O-CG1 3.36Å; V375-I379 PolarHBondContact O-N 3.36Å; C376-I379 PolarHBondContact O-N 2.95Å; I379-D381 VanDerWaalsContact C-N 3.31Å; I379-D381 HydrophobicContact CG2-CB 3.79Å; I379-L456 HydrophobicContact CD1-CD1 3.7Å; I379-L456 HydrophobicContact CD1-CD2 4.3Å; I379-L456 HydrophobicContact CD1-CG 4.15Å; I379-M462 HydrophobicContact CG2-CE 4.4Å; I379-M462 HydrophobicContact CG2-CG 4.41Å; I379-L468 HydrophobicContact CD1-CD1 4.18Å; I379-L468 HydrophobicContact CG1-CD1 3.57Å; I379-L468 HydrophobicContact CG1-CG 4.19Å
380	G	78	Confident	81	Confident	51 Å²	51	46.3 Å²	46.3	53%	0.526	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	17.2	-170	0	0	0	0	0	114	C376 E377	C376-G380 WeakPolarHBondContact O-CA 3.43Å; C376-G380 PolarHBondContact O-N 2.89Å; E377-G380 PolarHBondContact O-N 3.36Å
381	D	80.6	Confident	79.3	Confident	38 Å²	38	47.2 Å²	47.2	20%	0.203	27%	0.269	C	S	.	.			trans	-114.2	110	176.1	-175.2	-0.6	0	0	0	110.2	C376 I379 S383 M462	C376-D381 WeakPolarHBondContact CB-O 3.19Å; C376-D381 PolarHBondContact O-N 3.24Å; I379-D381 VanDerWaalsContact C-N 3.31Å; I379-D381 HydrophobicContact CG2-CB 3.79Å; D381-S383 VanDerWaalsContact CG-OG 3.28Å; D381-S383 WeakPolarHBondContact OD1-CB 3.49Å; D381-S383 PolarHBondContact OD1-N 2.86Å; D381-S383 PolarHBondContact OD1-OG 3.45Å; D381-S383 PolarHBondContact OD2-OG 2.94Å; D381-M462 HydrophobicContact CB-CE 3.94Å; D381-M462 VanDerWaalsContact OD2-CE 3.27Å; D381-M462 WeakPolarHBondContact OD2-CE 3.41Å
382	Y	82.8	Confident	77.5	Confident	116 Å²	116	52.8 Å²	52.8	46%	0.455	31%	0.305	S	S	.	.			trans	-96	3.8	-178	-60.8	-73	0	0	0	113.4	C376 E377 F384 L385 E386	C376-Y382 HydrophobicContact CB-CD1 4.21Å; E377-Y382 HydrophobicContact CG-CE1 4.15Å; Y382-F384 PolarHBondContact O-N 3.26Å; Y382-L385 HydrophobicContact CD1-CD1 3.72Å; Y382-L385 HydrophobicContact CE1-CD1 4.4Å; Y382-L385 WeakPolarHBondContact O-CB 3.5Å; Y382-L385 PolarHBondContact O-N 2.86Å; Y382-E386 PolarHBondContact O-N 3.32Å; Y382-E386 VanDerWaalsContact O-N 3.15Å
383	S	82	Confident	75.7	Confident	51 Å²	51	55.4 Å²	55.4	36%	0.357	32%	0.321	S	S	.	.	H	α-helix	trans	-56.8	-35.9	-180	59.7	0	0	0	0	112.6	D381 L385 E386 T387	D381-S383 VanDerWaalsContact CG-OG 3.28Å; D381-S383 WeakPolarHBondContact OD1-CB 3.49Å; D381-S383 PolarHBondContact OD1-N 2.86Å; D381-S383 PolarHBondContact OD1-OG 3.45Å; D381-S383 PolarHBondContact OD2-OG 2.94Å; S383-L385 VanDerWaalsContact C-N 3.34Å; S383-L385 PolarHBondContact O-N 3.22Å; S383-E386 PolarHBondContact O-N 2.93Å; S383-T387 WeakPolarHBondContact O-CG2 3.3Å; S383-T387 PolarHBondContact O-N 3.42Å
384	F	80.2	Confident	73.9	Confident	19 Å²	19	59.2 Å²	59.2	8%	0.083	35%	0.348	C	S	.	.	H	α-helix	trans	-65.4	-35.3	176	-61.9	-87.2	0	0	0	112.5	L372 Y382 T387 L456	L372-F384 HydrophobicContact CD1-CB 4.36Å; Y382-F384 PolarHBondContact O-N 3.26Å; F384-T387 PolarHBondContact O-OG1 3.49Å; F384-L456 HydrophobicContact CD2-CD1 3.9Å; F384-L456 HydrophobicContact CE1-CD1 4.22Å; F384-L456 HydrophobicContact CE2-CD1 3.54Å; F384-L456 HydrophobicContact CG-CD1 4.41Å; F384-L456 HydrophobicContact CZ-CD1 3.71Å
385	L	81.2	Confident	72.3	Confident	13 Å²	13	59 Å²	59	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-71.5	-38.6	176.7	-61.5	-174.8	0	0	0	111.8	L372 I373 C376 Y382 S383 T387 V388 D389	L372-L385 HydrophobicContact CD2-CD2 3.95Å; L372-L385 HydrophobicContact CG-CD2 3.82Å; I373-L385 HydrophobicContact CG1-CD1 4.27Å; I373-L385 HydrophobicContact CG1-CD2 3.86Å; C376-L385 HydrophobicContact CB-CD1 4.16Å; C376-L385 HydrophobicContact CB-CG 4.13Å; Y382-L385 HydrophobicContact CD1-CD1 3.72Å; Y382-L385 HydrophobicContact CE1-CD1 4.4Å; Y382-L385 WeakPolarHBondContact O-CB 3.5Å; Y382-L385 PolarHBondContact O-N 2.86Å; S383-L385 VanDerWaalsContact C-N 3.34Å; S383-L385 PolarHBondContact O-N 3.22Å; L385-T387 PolarHBondContact O-N 3.36Å; L385-V388 WeakPolarHBondContact O-CA 2.8Å; L385-V388 WeakPolarHBondContact O-CB 3.29Å; L385-V388 PolarHBondContact O-N 3.02Å; L385-D389 PolarHBondContact O-N 3.03Å; L385-D389 VanDerWaalsContact O-N 3.08Å
386	E	77.8	Confident	70.6	Confident	137 Å²	137	61.1 Å²	61.1	64%	0.64	36%	0.361	S	S	*	.	H	α-helix	trans	-60.1	-35.6	176.8	-66.8	-178.8	178.2	0	0	112	Y382 S383 V388 D389 A390	Y382-E386 PolarHBondContact O-N 3.32Å; Y382-E386 VanDerWaalsContact O-N 3.15Å; S383-E386 PolarHBondContact O-N 2.93Å; E386-V388 VanDerWaalsContact C-N 3.26Å; E386-V388 PolarHBondContact O-N 2.69Å; E386-D389 PolarHBondContact O-N 3.41Å; E386-A390 PolarHBondContact O-N 2.8Å
387	T	75.2	Confident	68.9	Low	67 Å²	67	61.7 Å²	61.7	41%	0.411	36%	0.363	S	S	.	.	H	α-helix	trans	-67.5	-26.2	175.3	68.3	0	0	0	0	113.4	S383 F384 L385 Q452	S383-T387 WeakPolarHBondContact O-CG2 3.3Å; S383-T387 PolarHBondContact O-N 3.42Å; F384-T387 PolarHBondContact O-OG1 3.49Å; L385-T387 PolarHBondContact O-N 3.36Å; T387-Q452 VanDerWaalsContact OG1-CD 3.31Å; T387-Q452 PolarHBondContact OG1-NE2 2.6Å
388	V	74.3	Confident	67.2	Low	1 Å²	1	62.2 Å²	62.2	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-78.6	-36.2	176.1	178.2	0	0	0	0	110.4	F306 L372 L385 E386 A390 R445 I449 Q452	F306-V388 WeakPolarHBondContact O-CG1 3.3Å; L372-V388 HydrophobicContact CD2-CG2 3.99Å; L385-V388 WeakPolarHBondContact O-CA 2.8Å; L385-V388 WeakPolarHBondContact O-CB 3.29Å; L385-V388 PolarHBondContact O-N 3.02Å; E386-V388 VanDerWaalsContact C-N 3.26Å; E386-V388 PolarHBondContact O-N 2.69Å; V388-A390 VanDerWaalsContact C-N 3.33Å; V388-A390 PolarHBondContact O-N 2.94Å; V388-R445 PolarHBondContact O-NH1 3.49Å; V388-I449 HydrophobicContact CG1-CD1 4.15Å; V388-I449 HydrophobicContact CG1-CG1 3.64Å; V388-I449 HydrophobicContact CG2-CG1 4.18Å; V388-Q452 HydrophobicContact CG2-CG 4.16Å
389	D	68.4	Low	65.7	Low	78 Å²	78	59.5 Å²	59.5	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-71	-22.4	-177.7	-77.2	-15.2	0	0	0	114.4	S307 G308 L385 E386 G391	S307-D389 VanDerWaalsContact CA-OD1 3.31Å; S307-D389 WeakPolarHBondContact CA-OD1 3.49Å; S307-D389 WeakPolarHBondContact CB-OD1 3.41Å; G308-D389 PolarHBondContact N-OD1 2.94Å; L385-D389 PolarHBondContact O-N 3.03Å; L385-D389 VanDerWaalsContact O-N 3.08Å; E386-D389 PolarHBondContact O-N 3.41Å; D389-G391 PolarHBondContact O-N 2.87Å
390	A	51.3	Low	64.1	Low	86 Å²	86	58.4 Å²	58.4	71%	0.711	36%	0.359	S	S	*	.			trans	-71.9	20.5	-162	0	0	0	0	0	118.2	E386 V388	E386-A390 PolarHBondContact O-N 2.8Å; V388-A390 VanDerWaalsContact C-N 3.33Å; V388-A390 PolarHBondContact O-N 2.94Å
391	G	55.8	Low	62.7	Low	25 Å²	25	59.4 Å²	59.4	26%	0.258	35%	0.352	S	S	.	.			trans	-125.9	119.6	-179.7	0	0	0	0	0	113.7	D389 R445	D389-G391 PolarHBondContact O-N 2.87Å; G391-R445 PolarHBondContact O-NH2 2.99Å
392	P	52.5	Low	61	Low	117 Å²	117	61.5 Å²	61.5	76%	0.76	37%	0.37	S	S	*	.			trans	-60.1	152.1	160.1	26.9	-31.6	0	0	0	109.5	C394	P392-C394 PolarHBondContact O-N 3.12Å
393	V	51.2	Low	59.1	Low	54 Å²	54	61.3 Å²	61.3	33%	0.327	37%	0.373	S	S	.	.			trans	-53.4	114	-177.8	-174.3	0	0	0	0	110.2	V303 I395	V303-V393 HydrophobicContact CB-CG2 4.19Å; V303-V393 HydrophobicContact CG1-CG2 3.83Å; V303-V393 HydrophobicContact CG2-CB 4.48Å; V303-V393 HydrophobicContact CG2-CG1 4.21Å; V303-V393 HydrophobicContact CG2-CG2 3.48Å; V303-V393 VanDerWaalsContact CG2-CG2 3.48Å; V393-I395 HydrophobicContact CG1-CB 3.5Å; V393-I395 HydrophobicContact CG1-CD1 3.86Å; V393-I395 HydrophobicContact CG1-CG1 3.67Å; V393-I395 PolarHBondContact O-N 2.89Å
394	C	50	Low	57.3	Low	97 Å²	97	65.7 Å²	65.7	66%	0.655	39%	0.388	S	S	*	.	S	Bend	trans	-67.6	-8.4	172.2	-72	0	0	0	0	113.2	P392 S396	P392-C394 PolarHBondContact O-N 3.12Å; C394-S396 PolarHBondContact O-N 2.9Å; C394-S396 VanDerWaalsContact O-N 3.14Å
395	I	53.9	Low	55.7	Low	5 Å²	5	67.7 Å²	67.7	3%	0.026	40%	0.395	C	S	.	.	S	Bend	trans	-72.5	103.4	169.1	-47	168.7	0	0	0	105.9	I299 V393 L397 L434 Q437 L438 F441	I299-I395 HydrophobicContact CG2-CD1 3.57Å; V393-I395 HydrophobicContact CG1-CB 3.5Å; V393-I395 HydrophobicContact CG1-CD1 3.86Å; V393-I395 HydrophobicContact CG1-CG1 3.67Å; V393-I395 PolarHBondContact O-N 2.89Å; I395-L397 HydrophobicContact CB-CD1 4.49Å; I395-L397 HydrophobicContact CG2-CD1 4.19Å; I395-L397 HydrophobicContact CG2-CG 4.1Å; I395-L397 PolarHBondContact O-N 3.13Å; I395-L434 HydrophobicContact CG2-CD1 3.74Å; I395-Q437 HydrophobicContact CG1-CB 4.48Å; I395-Q437 HydrophobicContact CG2-CB 4.27Å; I395-L438 HydrophobicContact CD1-CD1 4.04Å; I395-F441 HydrophobicContact CD1-CB 4.14Å; I395-F441 HydrophobicContact CD1-CD1 4.37Å; I395-F441 HydrophobicContact CD1-CG 4.12Å; I395-F441 HydrophobicContact CG1-CB 4.08Å; I395-F441 HydrophobicContact CG1-CG 4.33Å
396	S	53.8	Low	53.9	Low	49 Å²	49	70 Å²	70	34%	0.343	41%	0.405	S	S	.	.			trans	-71.5	71.8	177	69.9	0	0	0	0	110.2	C394 D398 S399 L400	C394-S396 PolarHBondContact O-N 2.9Å; C394-S396 VanDerWaalsContact O-N 3.14Å; S396-D398 PolarHBondContact O-N 2.68Å; S396-S399 WeakPolarHBondContact CB-OG 3.31Å; S396-S399 PolarHBondContact O-N 3.36Å; S396-S399 PolarHBondContact O-OG 3.41Å; S396-S399 PolarHBondContact OG-OG 2.83Å; S396-L400 PolarHBondContact O-N 3.16Å
397	L	50.4	Low	51.9	Low	11 Å²	11	72.8 Å²	72.8	6%	0.058	41%	0.409	C	S	.	.	H	α-helix	trans	-62.7	-31.4	168	-79.5	145.1	0	0	0	109.8	I292 I299 I395 S399 L400 L401	I292-L397 HydrophobicContact CG2-CD2 3.93Å; I299-L397 HydrophobicContact CB-CD1 4.46Å; I299-L397 HydrophobicContact CD1-CD1 3.91Å; I299-L397 HydrophobicContact CD1-CD2 4.24Å; I299-L397 HydrophobicContact CG2-CD1 4.08Å; I395-L397 HydrophobicContact CB-CD1 4.49Å; I395-L397 HydrophobicContact CG2-CD1 4.19Å; I395-L397 HydrophobicContact CG2-CG 4.1Å; I395-L397 PolarHBondContact O-N 3.13Å; L397-S399 VanDerWaalsContact C-N 3.34Å; L397-S399 PolarHBondContact O-N 2.85Å; L397-L400 HydrophobicContact CD2-CD1 4.46Å; L397-L400 CarbonylContact O-C 3.51Å; L397-L400 WeakPolarHBondContact O-CA 3.19Å; L397-L400 WeakPolarHBondContact O-CB 3.25Å; L397-L400 PolarHBondContact O-N 3.37Å; L397-L401 HydrophobicContact CB-CD1 4.39Å; L397-L401 WeakPolarHBondContact O-CB 3.29Å; L397-L401 VanDerWaalsContact O-CG 3.29Å; L397-L401 WeakPolarHBondContact O-CG 3.25Å; L397-L401 PolarHBondContact O-N 3.29Å
398	D	48.5	Very low	50.2	Low	130 Å²	130	72.6 Å²	72.6	70%	0.695	41%	0.411	S	S	*	.	H	α-helix	trans	-62.3	-36.3	176.5	-69.5	-21.1	0	0	0	112.9	S396 L400 L401 S402	S396-D398 PolarHBondContact O-N 2.68Å; D398-L400 VanDerWaalsContact C-N 3.28Å; D398-L400 PolarHBondContact O-N 3.05Å; D398-L401 PolarHBondContact O-N 3.48Å; D398-S402 WeakPolarHBondContact O-CA 3.19Å; D398-S402 WeakPolarHBondContact O-CB 3.49Å; D398-S402 PolarHBondContact O-N 3.4Å; D398-S402 PolarHBondContact O-OG 2.88Å
399	S	50	Low	48.3	Very low	64 Å²	64	81.9 Å²	81.9	45%	0.448	45%	0.451	S	S	.	.	H	α-helix	trans	-70.5	-27.3	172.5	67.1	0	0	0	0	112.3	S396 L397	S396-S399 WeakPolarHBondContact CB-OG 3.31Å; S396-S399 PolarHBondContact O-N 3.36Å; S396-S399 PolarHBondContact O-OG 3.41Å; S396-S399 PolarHBondContact OG-OG 2.83Å; L397-S399 VanDerWaalsContact C-N 3.34Å; L397-S399 PolarHBondContact O-N 2.85Å
400	L	47.7	Very low	46.7	Very low	17 Å²	17	82.4 Å²	82.4	9%	0.089	45%	0.454	C	S	.	.	H	α-helix	trans	-80.8	-28.7	177.4	-69	159.9	0	0	0	112.7	I292 S396 L397 D398 Y405 T430 L434	I292-L400 HydrophobicContact CD1-CD2 4.38Å; S396-L400 PolarHBondContact O-N 3.16Å; L397-L400 HydrophobicContact CD2-CD1 4.46Å; L397-L400 CarbonylContact O-C 3.51Å; L397-L400 WeakPolarHBondContact O-CA 3.19Å; L397-L400 WeakPolarHBondContact O-CB 3.25Å; L397-L400 PolarHBondContact O-N 3.37Å; D398-L400 VanDerWaalsContact C-N 3.28Å; D398-L400 PolarHBondContact O-N 3.05Å; L400-Y405 WeakPolarHBondContact O-CE2 3.41Å; L400-T430 HydrophobicContact CD2-CG2 3.96Å; L400-L434 HydrophobicContact CD1-CD1 4.14Å
401	L	49.2	Very low	45.7	Very low	72 Å²	72	82.6 Å²	82.6	38%	0.377	45%	0.45	S	S	.	.	H	α-helix	trans	-95.4	-27.7	-179.7	-66.5	173.1	0	0	0	112.6	I293 L397 D398 E403	I293-L401 HydrophobicContact CD1-CD2 4.28Å; I293-L401 HydrophobicContact CG1-CD2 3.58Å; L397-L401 HydrophobicContact CB-CD1 4.39Å; L397-L401 WeakPolarHBondContact O-CB 3.29Å; L397-L401 VanDerWaalsContact O-CG 3.29Å; L397-L401 WeakPolarHBondContact O-CG 3.25Å; L397-L401 PolarHBondContact O-N 3.29Å; D398-L401 PolarHBondContact O-N 3.48Å; L401-E403 VanDerWaalsContact C-N 3.26Å; L401-E403 PolarHBondContact O-N 3.31Å
402	S	45.1	Very low	44.6	Very low	83 Å²	83	86.3 Å²	86.3	58%	0.58	46%	0.46	S	S	*	.	S	Bend	trans	-73.8	-14.3	180	59.7	0	0	0	0	113.7	D398 Q404	D398-S402 WeakPolarHBondContact O-CA 3.19Å; D398-S402 WeakPolarHBondContact O-CB 3.49Å; D398-S402 PolarHBondContact O-N 3.4Å; D398-S402 PolarHBondContact O-OG 2.88Å; S402-Q404 PolarHBondContact O-N 3.28Å; S402-Q404 VanDerWaalsContact O-N 3.12Å
403	E	43.7	Very low	43.4	Very low	112 Å²	112	89.3 Å²	89.3	52%	0.523	46%	0.464	S	S	.	.	S	Bend	trans	-70.2	112.5	160.9	-86.8	-171	-157.7	0	0	108.2	L401 Y405	L401-E403 VanDerWaalsContact C-N 3.26Å; L401-E403 PolarHBondContact O-N 3.31Å; E403-Y405 HydrophobicContact CB-CD1 4.38Å; E403-Y405 HydrophobicContact CB-CD2 3.69Å; E403-Y405 HydrophobicContact CB-CE1 3.96Å; E403-Y405 HydrophobicContact CB-CE2 3.25Å; E403-Y405 HydrophobicContact CB-CG 4.25Å; E403-Y405 VanDerWaalsContact CD-OH 3.25Å; E403-Y405 HydrophobicContact CG-CE2 4.4Å; E403-Y405 WeakPolarHBondContact O-CD2 3.45Å; E403-Y405 PolarHBondContact O-N 3.47Å; E403-Y405 WeakPolarHBondContact OE2-CE1 3.48Å; E403-Y405 PolarHBondContact OE2-OH 2.82Å
404	Q	42.7	Very low	42.3	Very low	143 Å²	143	91.8 Å²	91.8	67%	0.668	47%	0.472	S	S	*	.			trans	-63.4	56.1	177.7	-58.6	175.3	-10.1	0	0	111	S402 F406 R407 S408	S402-Q404 PolarHBondContact O-N 3.28Å; S402-Q404 VanDerWaalsContact O-N 3.12Å; Q404-F406 VanDerWaalsContact C-N 3.28Å; Q404-F406 PolarHBondContact O-N 3.17Å; Q404-R407 HydrophobicContact CB-CB 4.07Å; Q404-R407 CarbonylContact O-C 3.51Å; Q404-R407 WeakPolarHBondContact O-CA 3.47Å; Q404-R407 WeakPolarHBondContact O-CB 3.22Å; Q404-R407 PolarHBondContact O-N 2.86Å; Q404-S408 PolarHBondContact O-N 3.42Å
405	Y	46.7	Very low	41.1	Very low	60 Å²	60	91.3 Å²	91.3	24%	0.235	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-64.1	-32.7	-171.2	-72.7	-67.4	0	0	0	112.4	L400 E403 R407	L400-Y405 WeakPolarHBondContact O-CE2 3.41Å; E403-Y405 HydrophobicContact CB-CD1 4.38Å; E403-Y405 HydrophobicContact CB-CD2 3.69Å; E403-Y405 HydrophobicContact CB-CE1 3.96Å; E403-Y405 HydrophobicContact CB-CE2 3.25Å; E403-Y405 HydrophobicContact CB-CG 4.25Å; E403-Y405 VanDerWaalsContact CD-OH 3.25Å; E403-Y405 HydrophobicContact CG-CE2 4.4Å; E403-Y405 WeakPolarHBondContact O-CD2 3.45Å; E403-Y405 PolarHBondContact O-N 3.47Å; E403-Y405 WeakPolarHBondContact OE2-CE1 3.48Å; E403-Y405 PolarHBondContact OE2-OH 2.82Å; Y405-R407 PolarHBondContact O-N 3.32Å
406	F	43.9	Very low	40.2	Very low	62 Å²	62	102.4 Å²	102.4	27%	0.272	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-77.1	3.8	171.7	-69.6	-78.2	0	0	0	113.3	C195 Q202 I293 Q404	C195-F406 HydrophobicContact CB-CZ 4.35Å; Q202-F406 VanDerWaalsContact NE2-CB 3.29Å; Q202-F406 PolarHBondContact NE2-O 3.14Å; I293-F406 HydrophobicContact CD1-CE2 4.19Å; Q404-F406 VanDerWaalsContact C-N 3.28Å; Q404-F406 PolarHBondContact O-N 3.17Å
407	R	35.6	Very low	38.9	Very low	195 Å²	195	108.1 Å²	108.1	74%	0.736	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-126.3	5.6	-178.8	-87.2	-168.8	-177.3	-174	3.3	114.1	Q404 Y405 K409	Q404-R407 HydrophobicContact CB-CB 4.07Å; Q404-R407 CarbonylContact O-C 3.51Å; Q404-R407 WeakPolarHBondContact O-CA 3.47Å; Q404-R407 WeakPolarHBondContact O-CB 3.22Å; Q404-R407 PolarHBondContact O-N 2.86Å; Y405-R407 PolarHBondContact O-N 3.32Å; R407-K409 PolarHBondContact O-N 2.92Å
408	S	40.1	Very low	37.8	Very low	63 Å²	63	110.5 Å²	110.5	44%	0.441	56%	0.556	S	S	.	*			trans	-61.2	96.4	165	63.1	0	0	0	0	107.2	Q404 L410	Q404-S408 PolarHBondContact O-N 3.42Å; S408-L410 VanDerWaalsContact C-N 3.25Å; S408-L410 PolarHBondContact O-N 3.3Å
409	K	33.7	Very low	37	Very low	196 Å²	196	114.2 Å²	114.2	85%	0.852	57%	0.566	S	S	*	*			trans	-60.5	96	171.7	-77.8	-178.2	173.9	-177.8	0	105.4	R407 S411	R407-K409 PolarHBondContact O-N 2.92Å; K409-S411 PolarHBondContact O-N 3.32Å
410	L	35.3	Very low	35.7	Very low	90 Å²	90	117.5 Å²	117.5	47%	0.471	58%	0.578	S	S	.	*			trans	-56	108.9	172.5	-95.6	147.8	0	0	0	107.2	Y282 S408 H412	Y282-L410 HydrophobicContact CD2-CD1 3.35Å; Y282-L410 HydrophobicContact CE2-CD1 3.86Å; Y282-L410 HydrophobicContact CG-CD1 3.82Å; S408-L410 VanDerWaalsContact C-N 3.25Å; S408-L410 PolarHBondContact O-N 3.3Å; L410-H412 PolarHBondContact O-N 3.08Å
411	S	29.2	Very low	34.7	Very low	90 Å²	90	122.5 Å²	122.5	63%	0.629	61%	0.613	S	S	*	*			trans	-61.3	108.1	171.4	46.6	0	0	0	0	108.3	K409 Q413	K409-S411 PolarHBondContact O-N 3.32Å; S411-Q413 VanDerWaalsContact C-N 3.3Å; S411-Q413 PolarHBondContact O-N 3.42Å
412	H	33.4	Very low	33.8	Very low	103 Å²	103	126 Å²	126	48%	0.477	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.4	80.8	172.4	-68.4	-68.3	0	0	0	111.2	F206 E209 L410	F206-H412 AromaticContact CD2-CE1 3.91Å; F206-H412 AromaticContact CE2-CE1 3.67Å; E209-H412 IonicContact OE1-CD2 3.96Å; E209-H412 IonicContact OE1-CE1 3.37Å; E209-H412 IonicContact OE1-NE2 2.76Å; E209-H412 PolarHBondContact OE1-NE2 3.28Å; E209-H412 IonicContact OE2-CD2 3.88Å; E209-H412 IonicContact OE2-CE1 2.87Å; E209-H412 IonicContact OE2-NE2 3.16Å; E209-H412 PolarHBondContact OE2-NE2 3.27Å; L410-H412 PolarHBondContact O-N 3.08Å
413	Q	27	Very low	33.2	Very low	180 Å²	180	131.9 Å²	131.9	84%	0.841	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.7	10.7	158.2	-105.5	162	12.1	0	0	118.5	S411 S415	S411-Q413 VanDerWaalsContact C-N 3.3Å; S411-Q413 PolarHBondContact O-N 3.42Å; Q413-S415 PolarHBondContact O-N 3.38Å
414	E	28.1	Very low	32.8	Very low	106 Å²	106	128.1 Å²	128.1	50%	0.495	63%	0.629	S	S	.	*			trans	-80.7	72.1	171.9	-70.5	-163.1	-149.4	0	0	111.7	Y416 S418 Y422	E414-Y416 PolarHBondContact O-N 2.97Å; E414-S418 PolarHBondContact OE2-OG 3.27Å; E414-Y422 PolarHBondContact OE1-OH 2.85Å
415	S	25.5	Very low	32.7	Very low	86 Å²	86	127.4 Å²	127.4	60%	0.601	63%	0.63	S	S	*	*			trans	-70.2	113.7	163.1	51.1	0	0	0	0	110.1	Q413 L417	Q413-S415 PolarHBondContact O-N 3.38Å; S415-L417 PolarHBondContact O-N 2.74Å
416	Y	33.7	Very low	32.8	Very low	239 Å²	239	126.6 Å²	126.6	94%	0.937	64%	0.64	S	S	*	*	S	Bend	trans	42.1	6.9	150.2	-73	-78.5	0	0	0	122	E414	E414-Y416 PolarHBondContact O-N 2.97Å
417	L	28	Very low	33.1	Very low	169 Å²	169	124.8 Å²	124.8	89%	0.885	64%	0.635	S	S	*	*			trans	-129.6	3.8	-175.5	-75.5	173	0	0	0	116	S415	S415-L417 PolarHBondContact O-N 2.74Å
418	S	27.5	Very low	33.9	Very low	60 Å²	60	120.2 Å²	120.2	42%	0.42	62%	0.618	S	S	.	*			trans	-103.5	82.7	169.4	44.6	0	0	0	0	111	E414 N420	E414-S418 PolarHBondContact OE2-OG 3.27Å; S418-N420 PolarHBondContact O-N 3.04Å
419	K	30.1	Very low	34.7	Very low	208 Å²	208	120.8 Å²	120.8	90%	0.904	62%	0.619	S	S	*	*			trans	-70.8	18.3	162.7	-99.5	-172.9	179.3	-178	0	113.4	C421	K419-C421 PolarHBondContact O-N 3.49Å
420	N	24.1	Very low	36.3	Very low	133 Å²	133	112.8 Å²	112.8	71%	0.711	59%	0.586	S	S	*	*	S	Bend	trans	-100.7	95.5	-176.1	-75	-8.6	0	0	0	110.9	S418 Y422	S418-N420 PolarHBondContact O-N 3.04Å; N420-Y422 PolarHBondContact O-N 3.25Å
421	C	25.1	Very low	38	Very low	122 Å²	122	108.8 Å²	108.8	82%	0.824	57%	0.566	S	S	*	*			trans	44.7	63.8	140.7	-58.8	0	0	0	0	117.4	K419	K419-C421 PolarHBondContact O-N 3.49Å
422	Y	31.1	Very low	40.3	Very low	147 Å²	147	110.7 Å²	110.7	58%	0.576	56%	0.562	S	S	*	*			trans	-75.1	125.7	148.5	-84.1	-85.8	0	0	0	108.4	E414 N420 G424	E414-Y422 PolarHBondContact OE1-OH 2.85Å; N420-Y422 PolarHBondContact O-N 3.25Å; Y422-G424 PolarHBondContact O-N 2.92Å
423	K	32.4	Very low	42.4	Very low	205 Å²	205	108 Å²	108	89%	0.891	56%	0.555	S	S	*	*			trans	-63.1	77.8	178.7	-68.7	178.7	176.2	178.5	0	110.6	D425	K423-D425 PolarHBondContact O-N 3.35Å
424	G	36	Very low	44.9	Very low	34 Å²	34	99.5 Å²	99.5	35%	0.351	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.8	176	0	0	0	0	0	114.3	Y422 G426	Y422-G424 PolarHBondContact O-N 2.92Å; G424-G426 PolarHBondContact O-N 3.42Å
425	D	40.3	Very low	47.5	Very low	128 Å²	128	97.6 Å²	97.6	68%	0.684	51%	0.506	S	S	*	.	H	α-helix	trans	-67.9	-18.6	-176.1	-120.6	-9.8	0	0	0	114.2	K423 S427 T429	K423-D425 PolarHBondContact O-N 3.35Å; D425-S427 PolarHBondContact O-N 3.1Å; D425-T429 WeakPolarHBondContact O-CB 3.49Å; D425-T429 WeakPolarHBondContact O-CG2 3.45Å; D425-T429 PolarHBondContact O-N 2.73Å; D425-T429 PolarHBondContact O-OG1 3.37Å
426	G	49.4	Very low	50.2	Low	43 Å²	43	96.7 Å²	96.7	44%	0.443	50%	0.5	S	S	.	.	H	α-helix	trans	-69.5	-28.3	-174.4	0	0	0	0	0	115.4	G424 T429 T430	G424-G426 PolarHBondContact O-N 3.42Å; G426-T429 WeakPolarHBondContact CA-OG1 3.42Å; G426-T429 PolarHBondContact O-OG1 3.28Å; G426-T430 WeakPolarHBondContact O-CG2 3.3Å; G426-T430 PolarHBondContact O-N 3.38Å
427	S	50.1	Low	52.5	Low	23 Å²	23	87.5 Å²	87.5	16%	0.161	47%	0.466	C	S	.	.	H	α-helix	trans	-97.5	-27.5	-171.8	67.4	0	0	0	0	114.5	R288 D425 T429 T430 L431	R288-S427 PolarHBondContact NH1-OG 3.42Å; D425-S427 PolarHBondContact O-N 3.1Å; S427-T429 VanDerWaalsContact C-N 3.3Å; S427-T430 PolarHBondContact O-N 3.19Å; S427-T430 PolarHBondContact O-OG1 3.11Å; S427-L431 PolarHBondContact O-N 2.94Å
428	R	51.8	Low	55.2	Low	99 Å²	99	79.5 Å²	79.5	37%	0.374	42%	0.424	S	S	.	.	H	α-helix	trans	-71.8	-33.6	168.6	-167.1	179	-173.6	163.7	4.5	110.7	E275 D276 T430 K432	E275-R428 WeakPolarHBondContact OE2-CD 3.06Å; D276-R428 IonicContact OD1-NH1 2.67Å; R428-T430 VanDerWaalsContact C-N 3.3Å; R428-K432 PolarHBondContact O-N 3.18Å
429	T	57	Low	58.1	Low	75 Å²	75	81.5 Å²	81.5	46%	0.46	43%	0.425	S	S	.	.	H	α-helix	trans	-66.2	-30.6	171.3	50.8	0	0	0	0	111.7	D425 G426 S427 S433	D425-T429 WeakPolarHBondContact O-CB 3.49Å; D425-T429 WeakPolarHBondContact O-CG2 3.45Å; D425-T429 PolarHBondContact O-N 2.73Å; D425-T429 PolarHBondContact O-OG1 3.37Å; G426-T429 WeakPolarHBondContact CA-OG1 3.42Å; G426-T429 PolarHBondContact O-OG1 3.28Å; S427-T429 VanDerWaalsContact C-N 3.3Å; T429-S433 WeakPolarHBondContact O-CA 3.43Å; T429-S433 WeakPolarHBondContact O-CB 3.36Å; T429-S433 PolarHBondContact O-N 2.79Å
430	T	66.4	Low	60.7	Low	29 Å²	29	79.5 Å²	79.5	18%	0.178	41%	0.412	C	S	.	.	H	α-helix	trans	-69.1	-41.8	176.1	63.4	0	0	0	0	113.7	L400 G426 S427 R428 S433 L434	L400-T430 HydrophobicContact CD2-CG2 3.96Å; G426-T430 WeakPolarHBondContact O-CG2 3.3Å; G426-T430 PolarHBondContact O-N 3.38Å; S427-T430 PolarHBondContact O-N 3.19Å; S427-T430 PolarHBondContact O-OG1 3.11Å; R428-T430 VanDerWaalsContact C-N 3.3Å; T430-S433 CarbonylContact O-C 3.56Å; T430-S433 WeakPolarHBondContact O-CB 3.45Å; T430-S433 PolarHBondContact O-N 3.15Å; T430-L434 WeakPolarHBondContact O-CB 3.47Å; T430-L434 PolarHBondContact O-N 2.96Å
431	L	72.1	Confident	63.6	Low	6 Å²	6	73.3 Å²	73.3	3%	0.031	38%	0.379	C	S	.	.	H	α-helix	trans	-67.1	-42.4	176.5	-75.8	175.9	0	0	0	112.3	R288 F291 I292 S427 S433 L434 E435	R288-L431 HydrophobicContact CG-CD1 4Å; F291-L431 HydrophobicContact CD1-CD2 3.54Å; F291-L431 HydrophobicContact CE1-CD2 3.75Å; I292-L431 HydrophobicContact CG1-CD2 4.28Å; S427-L431 PolarHBondContact O-N 2.94Å; L431-S433 VanDerWaalsContact C-N 3.29Å; L431-S433 PolarHBondContact O-N 3.38Å; L431-L434 WeakPolarHBondContact O-CB 3.29Å; L431-L434 PolarHBondContact O-N 3.38Å; L431-E435 PolarHBondContact O-N 3.3Å
432	K	76.8	Confident	66.6	Low	129 Å²	129	67.6 Å²	67.6	56%	0.561	34%	0.34	S	S	*	.	H	α-helix	trans	-65	-35.5	173.2	-71.4	-177.6	177.9	179.8	0	111.8	R428 S436	R428-K432 PolarHBondContact O-N 3.18Å; K432-S436 WeakPolarHBondContact O-CB 3.42Å; K432-S436 PolarHBondContact O-N 3.41Å; K432-S436 PolarHBondContact O-OG 3.06Å
433	S	78.3	Confident	69.3	Low	47 Å²	47	62.5 Å²	62.5	33%	0.329	33%	0.326	S	S	.	.	H	α-helix	trans	-65.9	-39.7	172.4	-176.5	0	0	0	0	111.5	T429 T430 L431 S436 Q437	T429-S433 WeakPolarHBondContact O-CA 3.43Å; T429-S433 WeakPolarHBondContact O-CB 3.36Å; T429-S433 PolarHBondContact O-N 2.79Å; T430-S433 CarbonylContact O-C 3.56Å; T430-S433 WeakPolarHBondContact O-CB 3.45Å; T430-S433 PolarHBondContact O-N 3.15Å; L431-S433 VanDerWaalsContact C-N 3.29Å; L431-S433 PolarHBondContact O-N 3.38Å; S433-S436 WeakPolarHBondContact CA-OG 3.41Å; S433-S436 PolarHBondContact O-N 3.48Å; S433-S436 PolarHBondContact O-OG 2.84Å; S433-Q437 VanDerWaalsContact O-CB 3.26Å; S433-Q437 WeakPolarHBondContact O-CB 3.43Å; S433-Q437 WeakPolarHBondContact O-CG 3.29Å; S433-Q437 PolarHBondContact O-N 2.81Å
434	L	79.2	Confident	71.9	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-44.3	175.8	-178.5	66.9	0	0	0	110.6	F291 I292 F295 I299 M354 I395 L400 T430 L431 S436 Q437 L438	F291-L434 HydrophobicContact CE1-CD2 4.37Å; I292-L434 HydrophobicContact CG1-CD2 4.41Å; F295-L434 HydrophobicContact CD1-CD2 4.34Å; I299-L434 HydrophobicContact CD1-CD1 4.12Å; M354-L434 HydrophobicContact CE-CD2 4.23Å; M354-L434 HydrophobicContact SD-CD2 4.15Å; M354-L434 HydrophobicContact SD-CG 4.49Å; I395-L434 HydrophobicContact CG2-CD1 3.74Å; L400-L434 HydrophobicContact CD1-CD1 4.14Å; T430-L434 WeakPolarHBondContact O-CB 3.47Å; T430-L434 PolarHBondContact O-N 2.96Å; L431-L434 WeakPolarHBondContact O-CB 3.29Å; L431-L434 PolarHBondContact O-N 3.38Å; L434-S436 PolarHBondContact O-N 3.22Å; L434-Q437 PolarHBondContact O-N 3.36Å; L434-L438 VanDerWaalsContact O-CB 3.24Å; L434-L438 WeakPolarHBondContact O-CB 3.43Å; L434-L438 PolarHBondContact O-N 3.12Å
435	E	82.7	Confident	74.2	Confident	66 Å²	66	56.3 Å²	56.3	31%	0.308	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-43	176.1	-170.2	177.3	146.2	0	0	111.6	R268 L431 L438 K439	R268-E435 IonicContact CZ-OE2 2.68Å; R268-E435 IonicContact NH1-OE2 3.72Å; R268-E435 IonicContact NH2-OE2 2.63Å; R268-E435 PolarHBondContact NH2-OE2 3Å; L431-E435 PolarHBondContact O-N 3.3Å; E435-L438 PolarHBondContact O-N 2.89Å; E435-K439 WeakPolarHBondContact O-CB 3.41Å; E435-K439 PolarHBondContact O-N 3.46Å
436	S	82.7	Confident	76.6	Confident	68 Å²	68	52.4 Å²	52.4	48%	0.476	27%	0.265	S	S	.	.	H	α-helix	trans	-69.9	-37.9	177.3	70.9	0	0	0	0	112.9	K432 S433 L434 R440	K432-S436 WeakPolarHBondContact O-CB 3.42Å; K432-S436 PolarHBondContact O-N 3.41Å; K432-S436 PolarHBondContact O-OG 3.06Å; S433-S436 WeakPolarHBondContact CA-OG 3.41Å; S433-S436 PolarHBondContact O-N 3.48Å; S433-S436 PolarHBondContact O-OG 2.84Å; L434-S436 PolarHBondContact O-N 3.22Å; S436-R440 VanDerWaalsContact O-CB 3.25Å; S436-R440 WeakPolarHBondContact O-CB 3.22Å; S436-R440 PolarHBondContact O-N 3.27Å
437	Q	82.5	Confident	78.5	Confident	46 Å²	46	52.8 Å²	52.8	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-42	173.1	-76.7	177.9	-0.1	0	0	111.7	I395 S433 L434 R440 F441	I395-Q437 HydrophobicContact CG1-CB 4.48Å; I395-Q437 HydrophobicContact CG2-CB 4.27Å; S433-Q437 VanDerWaalsContact O-CB 3.26Å; S433-Q437 WeakPolarHBondContact O-CB 3.43Å; S433-Q437 WeakPolarHBondContact O-CG 3.29Å; S433-Q437 PolarHBondContact O-N 2.81Å; L434-Q437 PolarHBondContact O-N 3.36Å; Q437-R440 PolarHBondContact O-N 3.39Å; Q437-F441 VanDerWaalsContact O-CB 3.28Å; Q437-F441 WeakPolarHBondContact O-CB 3.5Å; Q437-F441 PolarHBondContact O-N 2.9Å
438	L	84.1	Confident	80.3	Confident	1 Å²	1	54 Å²	54	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-47.5	176.6	-174.5	71.8	0	0	0	110.7	F295 I299 L302 M354 F355 I358 I395 L434 E435 R440 F441 V442	F295-L438 HydrophobicContact CE1-CD2 4.38Å; F295-L438 HydrophobicContact CZ-CD2 4.22Å; I299-L438 HydrophobicContact CG1-CD1 4.43Å; L302-L438 HydrophobicContact CD2-CD1 3.91Å; M354-L438 HydrophobicContact CG-CD2 4.06Å; M354-L438 HydrophobicContact SD-CD2 4.45Å; F355-L438 HydrophobicContact CD1-CD2 4.22Å; F355-L438 HydrophobicContact CE1-CD1 4.5Å; F355-L438 HydrophobicContact CE1-CD2 4Å; I358-L438 HydrophobicContact CD1-CD2 3.45Å; I358-L438 VanDerWaalsContact CD1-CD2 3.45Å; I358-L438 HydrophobicContact CD1-CG 3.6Å; I395-L438 HydrophobicContact CD1-CD1 4.04Å; L434-L438 VanDerWaalsContact O-CB 3.24Å; L434-L438 WeakPolarHBondContact O-CB 3.43Å; L434-L438 PolarHBondContact O-N 3.12Å; E435-L438 PolarHBondContact O-N 2.89Å; L438-R440 VanDerWaalsContact C-N 3.35Å; L438-R440 PolarHBondContact O-N 3.33Å; L438-F441 PolarHBondContact O-N 3.38Å; L438-V442 WeakPolarHBondContact O-CG2 3.43Å; L438-V442 PolarHBondContact O-N 2.89Å
439	K	87.5	Confident	82.1	Confident	101 Å²	101	49.3 Å²	49.3	44%	0.439	24%	0.243	S	C	.	.	H	α-helix	trans	-59.3	-46.6	175.3	-177.5	171.8	-176.5	169.9	0	111.4	I358 E435 V442 C443	I358-K439 HydrophobicContact CG2-CB 3.95Å; I358-K439 HydrophobicContact CG2-CD 4.49Å; I358-K439 HydrophobicContact CG2-CG 3.98Å; E435-K439 WeakPolarHBondContact O-CB 3.41Å; E435-K439 PolarHBondContact O-N 3.46Å; K439-V442 PolarHBondContact O-N 3.18Å; K439-C443 WeakPolarHBondContact O-CB 3.25Å; K439-C443 PolarHBondContact O-N 3.41Å; K439-C443 PolarHBondContact O-SG 3.42Å
440	R	85.4	Confident	83.7	Confident	166 Å²	166	45.7 Å²	45.7	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-59.4	-47.3	177	-179	176.7	177.3	165.4	2	111.5	S436 Q437 L438 C443 E444	S436-R440 VanDerWaalsContact O-CB 3.25Å; S436-R440 WeakPolarHBondContact O-CB 3.22Å; S436-R440 PolarHBondContact O-N 3.27Å; Q437-R440 PolarHBondContact O-N 3.39Å; L438-R440 VanDerWaalsContact C-N 3.35Å; L438-R440 PolarHBondContact O-N 3.33Å; R440-C443 PolarHBondContact O-N 3.06Å; R440-E444 HydrophobicContact CG-CG 4.3Å; R440-E444 WeakPolarHBondContact CG-OE1 3.19Å; R440-E444 IonicContact CZ-OE1 3.6Å; R440-E444 IonicContact NE-OE1 3.84Å; R440-E444 PolarHBondContact NE-OE1 3.05Å; R440-E444 IonicContact NH2-OE1 2.81Å; R440-E444 PolarHBondContact NH2-OE1 3.5Å; R440-E444 WeakPolarHBondContact O-CB 3.45Å; R440-E444 WeakPolarHBondContact O-CG 3.27Å; R440-E444 PolarHBondContact O-N 3.45Å
441	F	85.8	Confident	84.8	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-58.1	-50	177.8	172.1	-95.4	0	0	0	111.7	L302 V303 F306 I395 Q437 L438 C443 E444 R445	L302-F441 HydrophobicContact CD2-CD1 4.34Å; L302-F441 HydrophobicContact CD2-CE1 4.25Å; V303-F441 HydrophobicContact CB-CZ 4.12Å; V303-F441 HydrophobicContact CG1-CZ 4.29Å; V303-F441 HydrophobicContact CG2-CE1 3.9Å; V303-F441 HydrophobicContact CG2-CE2 4.15Å; V303-F441 HydrophobicContact CG2-CZ 3.47Å; V303-F441 VanDerWaalsContact CG2-CZ 3.47Å; F306-F441 HydrophobicContact CD2-CE1 4.36Å; I395-F441 HydrophobicContact CD1-CB 4.14Å; I395-F441 HydrophobicContact CD1-CD1 4.37Å; I395-F441 HydrophobicContact CD1-CG 4.12Å; I395-F441 HydrophobicContact CG1-CB 4.08Å; I395-F441 HydrophobicContact CG1-CG 4.33Å; Q437-F441 VanDerWaalsContact O-CB 3.28Å; Q437-F441 WeakPolarHBondContact O-CB 3.5Å; Q437-F441 PolarHBondContact O-N 2.9Å; L438-F441 PolarHBondContact O-N 3.38Å; F441-C443 PolarHBondContact O-N 3.44Å; F441-E444 PolarHBondContact O-N 3.06Å; F441-R445 HydrophobicContact CD1-CG 4.45Å; F441-R445 HydrophobicContact CD2-CG 4.18Å; F441-R445 HydrophobicContact CE1-CG 4.04Å; F441-R445 HydrophobicContact CE2-CG 3.76Å; F441-R445 HydrophobicContact CZ-CG 3.66Å; F441-R445 WeakPolarHBondContact O-CB 3.31Å; F441-R445 WeakPolarHBondContact O-CG 3.49Å; F441-R445 PolarHBondContact O-N 3.5Å
442	V	87.4	Confident	85.5	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-43.7	178.5	171.2	0	0	0	0	111	L302 F306 I358 E361 V362 L438 K439 R446	L302-V442 HydrophobicContact CD2-CG2 3.83Å; F306-V442 HydrophobicContact CE2-CG1 4.43Å; F306-V442 HydrophobicContact CE2-CG2 4.2Å; F306-V442 HydrophobicContact CZ-CG1 4.12Å; I358-V442 HydrophobicContact CD1-CG2 4.1Å; E361-V442 HydrophobicContact CB-CG1 4Å; V362-V442 HydrophobicContact CG2-CG1 3.75Å; V362-V442 HydrophobicContact CG2-CG2 4.01Å; L438-V442 WeakPolarHBondContact O-CG2 3.43Å; L438-V442 PolarHBondContact O-N 2.89Å; K439-V442 PolarHBondContact O-N 3.18Å; V442-R446 WeakPolarHBondContact O-CB 3.42Å; V442-R446 PolarHBondContact O-N 3.1Å
443	C	88.3	Confident	86.2	Confident	41 Å²	41	40.5 Å²	40.5	28%	0.277	20%	0.196	S	C	.	.	H	α-helix	trans	-62.1	-47.9	176.6	-70.4	0	0	0	0	112	K439 R440 F441 R446 M447	K439-C443 WeakPolarHBondContact O-CB 3.25Å; K439-C443 PolarHBondContact O-N 3.41Å; K439-C443 PolarHBondContact O-SG 3.42Å; R440-C443 PolarHBondContact O-N 3.06Å; F441-C443 PolarHBondContact O-N 3.44Å; C443-R446 PolarHBondContact O-N 3.33Å; C443-M447 WeakPolarHBondContact O-CB 3.24Å; C443-M447 WeakPolarHBondContact O-CG 3.44Å; C443-M447 PolarHBondContact O-N 2.82Å
444	E	85.8	Confident	86.8	Confident	79 Å²	79	38.4 Å²	38.4	37%	0.369	18%	0.181	S	C	.	.	H	α-helix	trans	-61.2	-45.5	179.1	-75.3	175.3	174.7	0	0	111.3	R440 F441 M447 L448	R440-E444 HydrophobicContact CG-CG 4.3Å; R440-E444 WeakPolarHBondContact CG-OE1 3.19Å; R440-E444 IonicContact CZ-OE1 3.6Å; R440-E444 IonicContact NE-OE1 3.84Å; R440-E444 PolarHBondContact NE-OE1 3.05Å; R440-E444 IonicContact NH2-OE1 2.81Å; R440-E444 PolarHBondContact NH2-OE1 3.5Å; R440-E444 WeakPolarHBondContact O-CB 3.45Å; R440-E444 WeakPolarHBondContact O-CG 3.27Å; R440-E444 PolarHBondContact O-N 3.45Å; F441-E444 PolarHBondContact O-N 3.06Å; E444-M447 PolarHBondContact O-N 3.39Å; E444-L448 WeakPolarHBondContact O-CB 3.41Å; E444-L448 PolarHBondContact O-N 2.91Å
445	R	85.7	Confident	87.1	Confident	29 Å²	29	42 Å²	42	11%	0.109	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-46.1	177.6	-69.5	-59.7	-176.2	172.9	5.4	112.8	F306 V388 G391 F441 M447 L448 I449	F306-R445 HydrophobicContact CB-CB 4.29Å; F306-R445 HydrophobicContact CB-CG 4.42Å; F306-R445 HydrophobicContact CD1-CB 4.03Å; F306-R445 HydrophobicContact CG-CB 4.12Å; V388-R445 PolarHBondContact O-NH1 3.49Å; G391-R445 PolarHBondContact O-NH2 2.99Å; F441-R445 HydrophobicContact CD1-CG 4.45Å; F441-R445 HydrophobicContact CD2-CG 4.18Å; F441-R445 HydrophobicContact CE1-CG 4.04Å; F441-R445 HydrophobicContact CE2-CG 3.76Å; F441-R445 HydrophobicContact CZ-CG 3.66Å; F441-R445 WeakPolarHBondContact O-CB 3.31Å; F441-R445 WeakPolarHBondContact O-CG 3.49Å; F441-R445 PolarHBondContact O-N 3.5Å; R445-M447 VanDerWaalsContact C-N 3.29Å; R445-M447 PolarHBondContact O-N 3.33Å; R445-L448 PolarHBondContact O-N 3.38Å; R445-I449 WeakPolarHBondContact O-CD1 3.04Å; R445-I449 VanDerWaalsContact O-CG1 3.29Å; R445-I449 WeakPolarHBondContact O-CG1 3.32Å; R445-I449 PolarHBondContact O-N 3.04Å
446	R	89.1	Confident	87.2	Confident	46 Å²	46	39.3 Å²	39.3	17%	0.174	19%	0.185	C	C	.	.	H	α-helix	trans	-55.7	-45.8	174.5	174.7	-174.5	170.3	-157.5	-1.3	111.1	E361 D364 V442 C443 N450	E361-R446 VanDerWaalsContact CG-NH1 3.33Å; D364-R446 IonicContact OD2-CZ 2.86Å; D364-R446 IonicContact OD2-NE 2.75Å; D364-R446 PolarHBondContact OD2-NE 3.34Å; D364-R446 IonicContact OD2-NH2 2.62Å; D364-R446 PolarHBondContact OD2-NH2 3.07Å; V442-R446 WeakPolarHBondContact O-CB 3.42Å; V442-R446 PolarHBondContact O-N 3.1Å; C443-R446 PolarHBondContact O-N 3.33Å; R446-N450 WeakPolarHBondContact O-CB 3.45Å; R446-N450 PolarHBondContact O-N 2.72Å; R446-N450 PolarHBondContact O-ND2 3.38Å
447	M	89.4	Confident	87.5	Confident	52 Å²	52	36.2 Å²	36.2	26%	0.256	16%	0.162	S	C	.	.	H	α-helix	trans	-66.3	-45.3	-179.9	-68.9	-63.7	168.5	0	0	111.3	C443 E444 R445 I449 N450 Q451 T683	C443-M447 WeakPolarHBondContact O-CB 3.24Å; C443-M447 WeakPolarHBondContact O-CG 3.44Å; C443-M447 PolarHBondContact O-N 2.82Å; E444-M447 PolarHBondContact O-N 3.39Å; R445-M447 VanDerWaalsContact C-N 3.29Å; R445-M447 PolarHBondContact O-N 3.33Å; M447-I449 PolarHBondContact O-N 2.78Å; M447-N450 PolarHBondContact O-N 2.95Å; M447-Q451 WeakPolarHBondContact O-CB 3.29Å; M447-Q451 VanDerWaalsContact O-CG 3.22Å; M447-Q451 WeakPolarHBondContact O-CG 3.37Å; M447-Q451 PolarHBondContact O-N 3.08Å; M447-T683 HydrophobicContact CE-CG2 4.26Å; M447-T683 HydrophobicContact SD-CG2 4.11Å
448	L	87.7	Confident	87.5	Confident	48 Å²	48	34 Å²	34	25%	0.251	15%	0.152	S	C	.	.	H	α-helix	trans	-58.5	-47.9	177.8	-175.7	67.4	0	0	0	112.1	E444 R445 N450 Q451 Q452	E444-L448 WeakPolarHBondContact O-CB 3.41Å; E444-L448 PolarHBondContact O-N 2.91Å; R445-L448 PolarHBondContact O-N 3.38Å; L448-N450 PolarHBondContact O-N 2.98Å; L448-Q451 WeakPolarHBondContact O-CB 3.42Å; L448-Q451 PolarHBondContact O-N 2.88Å; L448-Q452 WeakPolarHBondContact O-CG 3.48Å; L448-Q452 PolarHBondContact O-N 2.98Å
449	I	90.1	Very high	87	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.8	-45.8	178.4	-68.4	164.8	0	0	0	110.6	F306 A368 N369 L372 V388 R445 M447 Q451 Q452 L453	F306-I449 HydrophobicContact CD1-CD1 3.63Å; F306-I449 HydrophobicContact CE1-CD1 4.36Å; A368-I449 HydrophobicContact CB-CG2 3.81Å; N369-I449 HydrophobicContact CB-CD1 4.09Å; N369-I449 HydrophobicContact CB-CG2 4.12Å; L372-I449 HydrophobicContact CD2-CG2 4.22Å; V388-I449 HydrophobicContact CG1-CD1 4.15Å; V388-I449 HydrophobicContact CG1-CG1 3.64Å; V388-I449 HydrophobicContact CG2-CG1 4.18Å; R445-I449 WeakPolarHBondContact O-CD1 3.04Å; R445-I449 VanDerWaalsContact O-CG1 3.29Å; R445-I449 WeakPolarHBondContact O-CG1 3.32Å; R445-I449 PolarHBondContact O-N 3.04Å; M447-I449 PolarHBondContact O-N 2.78Å; I449-Q451 VanDerWaalsContact C-N 3.31Å; I449-Q451 PolarHBondContact O-N 3.04Å; I449-Q452 PolarHBondContact O-N 2.73Å; I449-L453 VanDerWaalsContact O-CB 3.3Å; I449-L453 WeakPolarHBondContact O-CB 3.44Å; I449-L453 PolarHBondContact O-N 3.25Å
450	N	91.7	Very high	85.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.8	-38.2	177.5	-87.4	-83.1	0	0	0	112.1	R446 M447 L448 L453 L454 T683 F684	R446-N450 WeakPolarHBondContact O-CB 3.45Å; R446-N450 PolarHBondContact O-N 2.72Å; R446-N450 PolarHBondContact O-ND2 3.38Å; M447-N450 PolarHBondContact O-N 2.95Å; L448-N450 PolarHBondContact O-N 2.98Å; N450-L453 PolarHBondContact O-N 3.33Å; N450-L454 VanDerWaalsContact O-CB 3.25Å; N450-L454 WeakPolarHBondContact O-CB 3.34Å; N450-L454 WeakPolarHBondContact O-CG 3.21Å; N450-L454 PolarHBondContact O-N 3.02Å; N450-T683 HydrophobicContact CB-CG2 4.35Å; N450-T683 WeakPolarHBondContact OD1-CA 3.2Å; N450-T683 WeakPolarHBondContact OD1-CB 3.43Å; N450-F684 PolarHBondContact OD1-N 3.14Å
451	Q	89.3	Confident	84.2	Confident	33 Å²	33	29.9 Å²	29.9	15%	0.154	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-44.7	175.9	-73.8	168.7	18.1	0	0	111.6	M447 L448 I449 K455 E680	M447-Q451 WeakPolarHBondContact O-CB 3.29Å; M447-Q451 VanDerWaalsContact O-CG 3.22Å; M447-Q451 WeakPolarHBondContact O-CG 3.37Å; M447-Q451 PolarHBondContact O-N 3.08Å; L448-Q451 WeakPolarHBondContact O-CB 3.42Å; L448-Q451 PolarHBondContact O-N 2.88Å; I449-Q451 VanDerWaalsContact C-N 3.31Å; I449-Q451 PolarHBondContact O-N 3.04Å; Q451-K455 WeakPolarHBondContact O-CB 3.31Å; Q451-K455 VanDerWaalsContact O-CG 3.23Å; Q451-K455 WeakPolarHBondContact O-CG 3.04Å; Q451-K455 PolarHBondContact O-N 3.34Å; Q451-E680 VanDerWaalsContact NE2-CA 3.29Å; Q451-E680 VanDerWaalsContact NE2-CG 3.33Å; Q451-E680 PolarHBondContact NE2-O 3.2Å
452	Q	87.2	Confident	82.4	Confident	22 Å²	22	34.4 Å²	34.4	10%	0.103	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-43.7	177.2	-62.5	-55.3	-15.6	0	0	111.5	L372 T387 V388 L448 I449 L454 K455 L456	L372-Q452 HydrophobicContact CD1-CB 4.41Å; L372-Q452 HydrophobicContact CD2-CB 4.16Å; T387-Q452 VanDerWaalsContact OG1-CD 3.31Å; T387-Q452 PolarHBondContact OG1-NE2 2.6Å; V388-Q452 HydrophobicContact CG2-CG 4.16Å; L448-Q452 WeakPolarHBondContact O-CG 3.48Å; L448-Q452 PolarHBondContact O-N 2.98Å; I449-Q452 PolarHBondContact O-N 2.73Å; Q452-L454 PolarHBondContact O-N 2.84Å; Q452-K455 PolarHBondContact O-N 2.81Å; Q452-L456 WeakPolarHBondContact O-CB 3.26Å; Q452-L456 PolarHBondContact O-N 3.49Å
453	L	90.2	Very high	80.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.1	-48.3	175.2	179.2	65.3	0	0	0	111.9	A368 L371 L372 I449 N450 L456 L457 F684	A368-L453 HydrophobicContact CB-CD2 3.98Å; L371-L453 HydrophobicContact CB-CD1 4.41Å; L371-L453 HydrophobicContact CD2-CD1 4.19Å; L371-L453 HydrophobicContact CD2-CD2 4.08Å; L371-L453 HydrophobicContact CG-CD1 3.99Å; L371-L453 HydrophobicContact CG-CD2 4.5Å; L372-L453 HydrophobicContact CB-CD1 4.23Å; L372-L453 HydrophobicContact CD1-CB 4.39Å; L372-L453 HydrophobicContact CD1-CD1 4.48Å; I449-L453 VanDerWaalsContact O-CB 3.3Å; I449-L453 WeakPolarHBondContact O-CB 3.44Å; I449-L453 PolarHBondContact O-N 3.25Å; N450-L453 PolarHBondContact O-N 3.33Å; L453-L456 PolarHBondContact O-N 2.64Å; L453-L457 HydrophobicContact CD1-CD1 3.69Å; L453-L457 HydrophobicContact CD1-CG 3.99Å; L453-L457 HydrophobicContact CG-CD1 3.89Å; L453-L457 HydrophobicContact CG-CG 4.41Å; L453-L457 WeakPolarHBondContact O-CB 3.4Å; L453-L457 VanDerWaalsContact O-CG 3.27Å; L453-L457 WeakPolarHBondContact O-CG 3.36Å; L453-L457 PolarHBondContact O-N 3Å; L453-F684 HydrophobicContact CD2-CB 3.91Å; L453-F684 HydrophobicContact CD2-CD2 4.28Å; L453-F684 HydrophobicContact CD2-CG 4.1Å
454	L	90.7	Very high	78.4	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-66.8	-37.5	179.1	-73.1	172.7	0	0	0	112	N450 Q452 L458 W663 I678 Y682 F684 L687	N450-L454 VanDerWaalsContact O-CB 3.25Å; N450-L454 WeakPolarHBondContact O-CB 3.34Å; N450-L454 WeakPolarHBondContact O-CG 3.21Å; N450-L454 PolarHBondContact O-N 3.02Å; Q452-L454 PolarHBondContact O-N 2.84Å; L454-L458 HydrophobicContact CB-CD1 4.44Å; L454-L458 HydrophobicContact CD2-CD1 4.01Å; L454-L458 WeakPolarHBondContact O-CB 3.37Å; L454-L458 WeakPolarHBondContact O-CG 3.48Å; L454-L458 PolarHBondContact O-N 2.81Å; L454-W663 HydrophobicContact CD1-CZ3 4.1Å; L454-W663 HydrophobicContact CD2-CZ3 3.95Å; L454-I678 HydrophobicContact CB-CD1 4.03Å; L454-I678 HydrophobicContact CD1-CG2 4.44Å; L454-Y682 VanDerWaalsContact CD1-O 3.31Å; L454-Y682 WeakPolarHBondContact CD1-O 3.46Å; L454-F684 HydrophobicContact CD2-CB 4.47Å; L454-F684 HydrophobicContact CD2-CD2 4.22Å; L454-L687 HydrophobicContact CD2-CB 4.46Å; L454-L687 HydrophobicContact CD2-CD2 4.03Å
455	K	86	Confident	76.6	Confident	77 Å²	77	49.2 Å²	49.2	34%	0.335	25%	0.246	S	C	.	.	H	α-helix	trans	-58.9	-49.4	172.4	-79.6	172	179.9	176.7	0	110.7	Q451 Q452 H459	Q451-K455 WeakPolarHBondContact O-CB 3.31Å; Q451-K455 VanDerWaalsContact O-CG 3.23Å; Q451-K455 WeakPolarHBondContact O-CG 3.04Å; Q451-K455 PolarHBondContact O-N 3.34Å; Q452-K455 PolarHBondContact O-N 2.81Å; K455-H459 VanDerWaalsContact O-CB 3.28Å; K455-H459 WeakPolarHBondContact O-CB 2.82Å; K455-H459 PolarHBondContact O-N 2.78Å; K455-H459 PolarHBondContact O-ND1 3.28Å
456	L	85.2	Confident	75	Confident	10 Å²	10	54 Å²	54	5%	0.052	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-41	-179.8	-169.3	61	0	0	0	113	L372 V375 I379 F384 Q452 L453	L372-L456 HydrophobicContact CD1-CD2 3.89Å; V375-L456 HydrophobicContact CB-CD2 3.9Å; V375-L456 HydrophobicContact CG1-CD2 3.39Å; V375-L456 HydrophobicContact CG1-CG 3.85Å; I379-L456 HydrophobicContact CD1-CD1 3.7Å; I379-L456 HydrophobicContact CD1-CD2 4.3Å; I379-L456 HydrophobicContact CD1-CG 4.15Å; F384-L456 HydrophobicContact CD2-CD1 3.9Å; F384-L456 HydrophobicContact CE1-CD1 4.22Å; F384-L456 HydrophobicContact CE2-CD1 3.54Å; F384-L456 HydrophobicContact CG-CD1 4.41Å; F384-L456 HydrophobicContact CZ-CD1 3.71Å; Q452-L456 WeakPolarHBondContact O-CB 3.26Å; Q452-L456 PolarHBondContact O-N 3.49Å; L453-L456 PolarHBondContact O-N 2.64Å
457	L	87.6	Confident	73.8	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-82.4	-29.8	-176.6	-67.6	-178	0	0	0	114.1	V375 L453 T470 V471 G472 P578 F684	V375-L457 HydrophobicContact CG1-CD2 4.41Å; V375-L457 HydrophobicContact CG2-CD2 4.13Å; L453-L457 HydrophobicContact CD1-CD1 3.69Å; L453-L457 HydrophobicContact CD1-CG 3.99Å; L453-L457 HydrophobicContact CG-CD1 3.89Å; L453-L457 HydrophobicContact CG-CG 4.41Å; L453-L457 WeakPolarHBondContact O-CB 3.4Å; L453-L457 VanDerWaalsContact O-CG 3.27Å; L453-L457 WeakPolarHBondContact O-CG 3.36Å; L453-L457 PolarHBondContact O-N 3Å; L457-T470 WeakPolarHBondContact O-CB 3.48Å; L457-V471 HydrophobicContact CB-CB 4.24Å; L457-V471 HydrophobicContact CB-CG2 4.04Å; L457-V471 HydrophobicContact CD1-CG2 4.34Å; L457-V471 HydrophobicContact CD2-CG2 3.86Å; L457-V471 HydrophobicContact CG-CG2 4.3Å; L457-V471 WeakPolarHBondContact O-CB 3.4Å; L457-V471 PolarHBondContact O-N 3.03Å; L457-G472 PolarHBondContact O-N 2.96Å; L457-P578 HydrophobicContact CD2-CB 4.08Å; L457-P578 HydrophobicContact CD2-CG 3.65Å; L457-F684 HydrophobicContact CD1-CD2 3.77Å; L457-F684 HydrophobicContact CD1-CE2 3.41Å; L457-F684 VanDerWaalsContact CD1-CE2 3.41Å; L457-F684 HydrophobicContact CD1-CZ 4.34Å
458	L	83.7	Confident	72.7	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-102.1	-33.8	-174.3	-63.4	174	0	0	0	113.6	L454 W663 L665 I678 L687	L454-L458 HydrophobicContact CB-CD1 4.44Å; L454-L458 HydrophobicContact CD2-CD1 4.01Å; L454-L458 WeakPolarHBondContact O-CB 3.37Å; L454-L458 WeakPolarHBondContact O-CG 3.48Å; L454-L458 PolarHBondContact O-N 2.81Å; L458-W663 HydrophobicContact CD1-CE3 3.73Å; L458-W663 HydrophobicContact CD1-CZ3 4.34Å; L458-L665 HydrophobicContact CD2-CD2 4.07Å; L458-I678 HydrophobicContact CB-CD1 4.3Å; L458-I678 HydrophobicContact CD1-CD1 3.43Å; L458-I678 VanDerWaalsContact CD1-CD1 3.43Å; L458-I678 HydrophobicContact CG-CD1 4.44Å; L458-L687 HydrophobicContact CD1-CD2 4.42Å; L458-L687 HydrophobicContact CD2-CD2 4.12Å
459	H	74.3	Confident	72.3	Confident	22 Å²	22	52.5 Å²	52.5	10%	0.102	28%	0.278	C	S	.	.	S	Bend	trans	-90.7	139.9	-179.4	-60.6	71.9	0	0	0	110.2	K455 H461 Y669	K455-H459 VanDerWaalsContact O-CB 3.28Å; K455-H459 WeakPolarHBondContact O-CB 2.82Å; K455-H459 PolarHBondContact O-N 2.78Å; K455-H459 PolarHBondContact O-ND1 3.28Å; H459-H461 PolarHBondContact O-N 3.28Å; H459-Y669 PolarHBondContact CD2-OH 3.39Å; H459-Y669 PolarHBondContact NE2-OH 2.73Å
460	S	61.3	Low	71.9	Confident	60 Å²	60	53.1 Å²	53.1	42%	0.42	28%	0.282	S	S	.	.			trans	-72.6	78	171.8	48.7	0	0	0	0	110
461	H	51.6	Low	71.7	Confident	99 Å²	99	53.2 Å²	53.2	46%	0.458	28%	0.282	S	S	.	.			trans	-93.2	135	162.2	-65.1	27.6	0	0	0	105.7	H459	H459-H461 PolarHBondContact O-N 3.28Å
462	M	48.5	Very low	71.6	Confident	99 Å²	99	51.6 Å²	51.6	49%	0.488	28%	0.275	S	S	.	.			trans	92.3	93.2	173	-44.5	-55.2	-107.4	0	0	117.7	I379 D381 G464	I379-M462 HydrophobicContact CG2-CE 4.4Å; I379-M462 HydrophobicContact CG2-CG 4.41Å; D381-M462 HydrophobicContact CB-CE 3.94Å; D381-M462 VanDerWaalsContact OD2-CE 3.27Å; D381-M462 WeakPolarHBondContact OD2-CE 3.41Å; M462-G464 PolarHBondContact O-N 3.03Å
463	R	47	Very low	71.4	Confident	257 Å²	257	51.3 Å²	51.3	97%	0.97	27%	0.274	S	S	*	.			trans	-77.3	42.3	153.9	-76.9	179.8	171.3	171.8	-2	111.7
464	G	45	Very low	71.3	Confident	36 Å²	36	51.3 Å²	51.3	37%	0.371	27%	0.274	S	S	.	.			trans	-82.3	152	175	0	0	0	0	0	111.5	M462 N466 G467	M462-G464 PolarHBondContact O-N 3.03Å; G464-N466 PolarHBondContact O-N 3.44Å; G464-N466 VanDerWaalsContact O-N 3.16Å; G464-G467 PolarHBondContact O-N 3.3Å
465	P	48.4	Very low	71.3	Confident	139 Å²	139	51.5 Å²	51.5	90%	0.903	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.5	173.4	24.9	-33.1	0	0	0	113.4
466	N	51.7	Low	71.3	Confident	128 Å²	128	48 Å²	48	68%	0.684	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	19.2	174.3	-61.5	-1	0	0	0	112.5	G464 L468	G464-N466 PolarHBondContact O-N 3.44Å; G464-N466 VanDerWaalsContact O-N 3.16Å; N466-L468 PolarHBondContact O-N 2.97Å
467	G	62.6	Low	71.4	Confident	40 Å²	40	47.7 Å²	47.7	41%	0.412	26%	0.259	S	S	.	.			trans	-61.2	107.4	-174	0	0	0	0	0	111.8	G464	G464-G467 PolarHBondContact O-N 3.3Å
468	L	67.8	Low	71.5	Confident	48 Å²	48	47.7 Å²	47.7	25%	0.251	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-54.5	140.3	169.3	-68.9	170.9	0	0	0	109.5	V375 E378 I379 N466 T470 W577	V375-L468 HydrophobicContact CG1-CD1 4.3Å; E378-L468 HydrophobicContact CB-CD1 3.81Å; I379-L468 HydrophobicContact CD1-CD1 4.18Å; I379-L468 HydrophobicContact CG1-CD1 3.57Å; I379-L468 HydrophobicContact CG1-CG 4.19Å; N466-L468 PolarHBondContact O-N 2.97Å; L468-T470 PolarHBondContact O-N 2.94Å; L468-W577 HydrophobicContact CD1-CE3 4.49Å; L468-W577 HydrophobicContact CD1-CZ3 4.07Å
469	R	78.2	Confident	71.8	Confident	27 Å²	27	47.8 Å²	47.8	10%	0.102	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-67	122.1	172	-67.8	-171.8	-75	163.3	-4.4	109.1	E539 H574 D576	R469-E539 VanDerWaalsContact CD-OE1 3.3Å; R469-E539 WeakPolarHBondContact CD-OE1 3.47Å; R469-E539 VanDerWaalsContact CD-OE2 3.26Å; R469-E539 WeakPolarHBondContact CD-OE2 3.29Å; R469-E539 IonicContact NH1-OE2 3.23Å; R469-E539 PolarHBondContact NH1-OE2 3.38Å; R469-H574 PolarHBondContact NH1-O 2.94Å; R469-H574 PolarHBondContact NH2-O 3.37Å; R469-D576 IonicContact CZ-OD2 3.42Å; R469-D576 IonicContact NE-OD2 2.63Å; R469-D576 PolarHBondContact NE-OD2 2.92Å; R469-D576 IonicContact NH2-OD1 3.68Å; R469-D576 IonicContact NH2-OD2 3.16Å; R469-D576 PolarHBondContact NH2-OD2 3.09Å
470	T	81.8	Confident	72.3	Confident	14 Å²	14	46.8 Å²	46.8	9%	0.086	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-71.9	141	-178.2	67.4	0	0	0	0	110	L457 L468 G472 N473 C474	L457-T470 WeakPolarHBondContact O-CB 3.48Å; L468-T470 PolarHBondContact O-N 2.94Å; T470-G472 PolarHBondContact O-N 3.46Å; T470-N473 PolarHBondContact O-N 3.18Å; T470-N473 VanDerWaalsContact O-N 3.08Å; T470-N473 WeakPolarHBondContact OG1-CB 3.13Å; T470-N473 PolarHBondContact OG1-N 3.39Å; T470-N473 PolarHBondContact OG1-ND2 3.03Å; T470-N473 PolarHBondContact OG1-OD1 3.11Å; T470-C474 PolarHBondContact O-N 2.89Å; T470-C474 PolarHBondContact O-SG 3.47Å; T470-C474 VanDerWaalsContact O-SG 3.42Å
471	V	88	Confident	73.7	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-54.9	-38.5	174.3	-178.8	0	0	0	0	110.3	L457 N473 C474 L475 P578 I582	L457-V471 HydrophobicContact CB-CB 4.24Å; L457-V471 HydrophobicContact CB-CG2 4.04Å; L457-V471 HydrophobicContact CD1-CG2 4.34Å; L457-V471 HydrophobicContact CD2-CG2 3.86Å; L457-V471 HydrophobicContact CG-CG2 4.3Å; L457-V471 WeakPolarHBondContact O-CB 3.4Å; L457-V471 PolarHBondContact O-N 3.03Å; V471-N473 PolarHBondContact O-N 3.46Å; V471-C474 PolarHBondContact O-N 3.01Å; V471-L475 HydrophobicContact CG1-CD1 3.95Å; V471-L475 HydrophobicContact CG1-CG 4.22Å; V471-L475 WeakPolarHBondContact O-CB 3.5Å; V471-L475 VanDerWaalsContact O-CG 3.31Å; V471-L475 WeakPolarHBondContact O-CG 3.32Å; V471-L475 PolarHBondContact O-N 2.83Å; V471-P578 HydrophobicContact CG2-CG 4.3Å; V471-I582 HydrophobicContact CG1-CB 4.3Å; V471-I582 HydrophobicContact CG1-CD1 3.6Å; V471-I582 HydrophobicContact CG1-CG1 4.03Å
472	G	86.5	Confident	75.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.4	-43	177.1	0	0	0	0	0	113.4	L457 T470 A476	L457-G472 PolarHBondContact O-N 2.96Å; T470-G472 PolarHBondContact O-N 3.46Å; G472-A476 WeakPolarHBondContact O-CB 3.42Å; G472-A476 PolarHBondContact O-N 3.07Å
473	N	84	Confident	77.6	Confident	16 Å²	16	34.9 Å²	34.9	9%	0.086	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-45.3	174.9	-70.3	-8.1	0	0	0	111	T470 V471 L475 A476 V477 L535 P666	T470-N473 PolarHBondContact O-N 3.18Å; T470-N473 VanDerWaalsContact O-N 3.08Å; T470-N473 WeakPolarHBondContact OG1-CB 3.13Å; T470-N473 PolarHBondContact OG1-N 3.39Å; T470-N473 PolarHBondContact OG1-ND2 3.03Å; T470-N473 PolarHBondContact OG1-OD1 3.11Å; V471-N473 PolarHBondContact O-N 3.46Å; N473-L475 PolarHBondContact O-N 2.82Å; N473-A476 WeakPolarHBondContact O-CB 3.17Å; N473-A476 PolarHBondContact O-N 3.07Å; N473-V477 VanDerWaalsContact O-CG2 3.24Å; N473-V477 WeakPolarHBondContact O-CG2 3.48Å; N473-V477 PolarHBondContact O-N 3.49Å; N473-L535 WeakPolarHBondContact ND2-CD1 3.42Å; N473-P666 WeakPolarHBondContact OD1-CG 3.35Å
474	C	88.1	Confident	79.5	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.2	-39.4	-178.2	-59.9	0	0	0	0	112.4	T470 V471 V477 A478 Y573 L575 A579 L583	T470-C474 PolarHBondContact O-N 2.89Å; T470-C474 PolarHBondContact O-SG 3.47Å; T470-C474 VanDerWaalsContact O-SG 3.42Å; V471-C474 PolarHBondContact O-N 3.01Å; C474-V477 PolarHBondContact O-N 2.94Å; C474-A478 WeakPolarHBondContact O-CB 2.82Å; C474-A478 PolarHBondContact O-N 3.33Å; C474-Y573 WeakPolarHBondContact CA-OH 3.47Å; C474-Y573 HydrophobicContact CB-CE1 4.04Å; C474-Y573 PolarHBondContact SG-OH 2.95Å; C474-Y573 VanDerWaalsContact SG-OH 3.34Å; C474-L575 HydrophobicContact CB-CD2 3.97Å; C474-A579 HydrophobicContact CB-CB 3.94Å; C474-A579 VanDerWaalsContact SG-CB 3.57Å; C474-L583 HydrophobicContact CB-CD1 3.76Å
475	L	90.3	Very high	81.2	Confident	5 Å²	5	23.1 Å²	23.1	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-63.8	-40.2	173.2	-74.5	175.7	0	0	0	112.3	V471 N473 A478 G479 I582 L583 F659 L665 L687	V471-L475 HydrophobicContact CG1-CD1 3.95Å; V471-L475 HydrophobicContact CG1-CG 4.22Å; V471-L475 WeakPolarHBondContact O-CB 3.5Å; V471-L475 VanDerWaalsContact O-CG 3.31Å; V471-L475 WeakPolarHBondContact O-CG 3.32Å; V471-L475 PolarHBondContact O-N 2.83Å; N473-L475 PolarHBondContact O-N 2.82Å; L475-A478 PolarHBondContact O-N 3.49Å; L475-G479 PolarHBondContact O-N 2.86Å; L475-I582 HydrophobicContact CD2-CG2 4.24Å; L475-L583 HydrophobicContact CD2-CD1 4.28Å; L475-L583 HydrophobicContact CD2-CD2 3.93Å; L475-L583 HydrophobicContact CD2-CG 4.01Å; L475-F659 HydrophobicContact CD1-CE1 4.24Å; L475-F659 HydrophobicContact CD1-CZ 4.3Å; L475-L665 HydrophobicContact CB-CD1 4Å; L475-L665 HydrophobicContact CB-CD2 4.36Å; L475-L687 HydrophobicContact CD1-CD1 4.32Å
476	A	85.6	Confident	82.7	Confident	4 Å²	4	17.3 Å²	17.3	3%	0.033	11%	0.107	C	C	.	.	H	α-helix	trans	-62.5	-52.1	175.3	0	0	0	0	0	111.1	G472 N473 A478 G479 A480 L665 E667	G472-A476 WeakPolarHBondContact O-CB 3.42Å; G472-A476 PolarHBondContact O-N 3.07Å; N473-A476 WeakPolarHBondContact O-CB 3.17Å; N473-A476 PolarHBondContact O-N 3.07Å; A476-A478 VanDerWaalsContact C-N 3.29Å; A476-A478 PolarHBondContact O-N 2.63Å; A476-G479 CarbonylContact O-C 3.45Å; A476-G479 WeakPolarHBondContact O-CA 3.41Å; A476-G479 PolarHBondContact O-N 3.41Å; A476-A480 PolarHBondContact O-N 3.37Å; A476-L665 HydrophobicContact CB-CB 4.48Å; A476-E667 HydrophobicContact CB-CG 4.04Å
477	V	87.5	Confident	84.2	Confident	4 Å²	4	12.6 Å²	12.6	2%	0.024	9%	0.088	C	C	.	.	H	α-helix	trans	-56.1	-44.8	176.5	174.9	0	0	0	0	111.4	N473 C474 G479 A480 V481 L536 E539 L543 Y573	N473-V477 VanDerWaalsContact O-CG2 3.24Å; N473-V477 WeakPolarHBondContact O-CG2 3.48Å; N473-V477 PolarHBondContact O-N 3.49Å; C474-V477 PolarHBondContact O-N 2.94Å; V477-G479 VanDerWaalsContact C-N 3.27Å; V477-G479 PolarHBondContact O-N 3.48Å; V477-A480 PolarHBondContact O-N 3.04Å; V477-V481 HydrophobicContact CG1-CG2 4.1Å; V477-V481 WeakPolarHBondContact O-CB 3.4Å; V477-V481 WeakPolarHBondContact O-CG2 3.28Å; V477-V481 PolarHBondContact O-N 3.09Å; V477-L536 HydrophobicContact CB-CD2 4.25Å; V477-L536 HydrophobicContact CG2-CD2 3.64Å; V477-E539 HydrophobicContact CB-CB 4.43Å; V477-E539 HydrophobicContact CG1-CB 4.21Å; V477-E539 HydrophobicContact CG2-CB 3.44Å; V477-E539 VanDerWaalsContact CG2-CB 3.44Å; V477-E539 HydrophobicContact CG2-CG 3.64Å; V477-L543 HydrophobicContact CG1-CD1 4.16Å; V477-Y573 HydrophobicContact CB-CE1 4.4Å; V477-Y573 HydrophobicContact CG1-CE1 4.24Å; V477-Y573 HydrophobicContact CG1-CE2 4.43Å
478	A	90	Very high	85.1	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.008	10%	0.101	C	C	.	.	H	α-helix	trans	-58.3	-43.7	178.1	0	0	0	0	0	110.9	C474 L475 A476 Y482 Y591	C474-A478 WeakPolarHBondContact O-CB 2.82Å; C474-A478 PolarHBondContact O-N 3.33Å; L475-A478 PolarHBondContact O-N 3.49Å; A476-A478 VanDerWaalsContact C-N 3.29Å; A476-A478 PolarHBondContact O-N 2.63Å; A478-Y482 HydrophobicContact CB-CD2 4.28Å; A478-Y482 WeakPolarHBondContact O-CB 3.48Å; A478-Y482 PolarHBondContact O-N 3.15Å; A478-Y591 HydrophobicContact CB-CE2 4.35Å
479	G	89	Confident	85.8	Confident	4 Å²	4	18.3 Å²	18.3	4%	0.041	10%	0.098	C	C	.	.	H	α-helix	trans	-65.3	-44.1	172.4	0	0	0	0	0	114.2	L475 A476 V477 L483 G485 R656	L475-G479 PolarHBondContact O-N 2.86Å; A476-G479 CarbonylContact O-C 3.45Å; A476-G479 WeakPolarHBondContact O-CA 3.41Å; A476-G479 PolarHBondContact O-N 3.41Å; V477-G479 VanDerWaalsContact C-N 3.27Å; V477-G479 PolarHBondContact O-N 3.48Å; G479-L483 VanDerWaalsContact O-CB 3.27Å; G479-L483 WeakPolarHBondContact O-CB 3.48Å; G479-L483 PolarHBondContact O-N 2.86Å; G479-G485 PolarHBondContact O-N 3.14Å; G479-R656 WeakPolarHBondContact O-CD 3.5Å
480	A	86.5	Confident	86.2	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.2	-39.3	-179.4	0	0	0	0	0	113	A476 V477 F484 G485 A486 L536 E667	A476-A480 PolarHBondContact O-N 3.37Å; V477-A480 PolarHBondContact O-N 3.04Å; A480-F484 CarbonylContact O-C 3.57Å; A480-G485 PolarHBondContact O-N 2.88Å; A480-A486 HydrophobicContact CB-CB 4.12Å; A480-A486 PolarHBondContact O-N 3.19Å; A480-L536 HydrophobicContact CB-CD1 4.17Å; A480-L536 HydrophobicContact CB-CD2 3.92Å; A480-E667 WeakPolarHBondContact CB-OE1 3.1Å
481	V	89.6	Confident	86.4	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-94.4	-63	-172.4	-175.1	0	0	0	0	111.1	V477 L483 F484 M490 L518 L522 L543 L571	V477-V481 HydrophobicContact CG1-CG2 4.1Å; V477-V481 WeakPolarHBondContact O-CB 3.4Å; V477-V481 WeakPolarHBondContact O-CG2 3.28Å; V477-V481 PolarHBondContact O-N 3.09Å; V481-L483 VanDerWaalsContact C-N 3.27Å; V481-L483 PolarHBondContact O-N 3.25Å; V481-F484 PolarHBondContact O-N 3.14Å; V481-M490 HydrophobicContact CG1-CE 4.02Å; V481-M490 HydrophobicContact CG1-SD 4.21Å; V481-M490 WeakPolarHBondContact O-CE 3.12Å; V481-L518 HydrophobicContact CG1-CD1 4.17Å; V481-L522 HydrophobicContact CG2-CD1 3.87Å; V481-L522 HydrophobicContact CG2-CD2 4.14Å; V481-L543 HydrophobicContact CB-CD1 4.49Å; V481-L543 HydrophobicContact CG1-CD1 4.26Å; V481-L543 HydrophobicContact CG2-CD1 3.9Å; V481-L571 HydrophobicContact CG1-CD2 3.56Å
482	Y	91.5	Very high	86.3	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-64.3	-32.7	-175.4	-69.1	-87.2	0	0	0	112.6	A478 L571 Y573 Y591 F595	A478-Y482 HydrophobicContact CB-CD2 4.28Å; A478-Y482 WeakPolarHBondContact O-CB 3.48Å; A478-Y482 PolarHBondContact O-N 3.15Å; Y482-L571 HydrophobicContact CD1-CD2 4.13Å; Y482-L571 HydrophobicContact CE1-CB 3.77Å; Y482-L571 HydrophobicContact CE1-CD2 3.81Å; Y482-L571 HydrophobicContact CE1-CG 3.95Å; Y482-L571 HydrophobicContact CE2-CD2 4.36Å; Y482-L571 PolarHBondContact OH-O 3.13Å; Y482-Y573 WeakPolarHBondContact OH-CB 3.34Å; Y482-Y573 PolarHBondContact OH-N 2.92Å; Y482-Y591 HydrophobicContact CG-CD1 4.44Å; Y482-Y591 HydrophobicContact CG-CG 4.36Å; Y482-F595 HydrophobicContact CD1-CB 3.86Å; Y482-F595 HydrophobicContact CD1-CG 4.28Å; Y482-F595 WeakPolarHBondContact O-CB 3.12Å
483	L	91.3	Very high	86.4	Confident	7 Å²	7	21.3 Å²	21.3	4%	0.037	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	12.9	-179	-48.4	-177.8	0	0	0	113.6	G479 V481 G485 Y591 V594 I652 R656 L698	G479-L483 VanDerWaalsContact O-CB 3.27Å; G479-L483 WeakPolarHBondContact O-CB 3.48Å; G479-L483 PolarHBondContact O-N 2.86Å; V481-L483 VanDerWaalsContact C-N 3.27Å; V481-L483 PolarHBondContact O-N 3.25Å; L483-G485 PolarHBondContact O-N 3.45Å; L483-G485 VanDerWaalsContact O-N 3.11Å; L483-Y591 HydrophobicContact CD1-CE1 4.14Å; L483-Y591 HydrophobicContact CD2-CD1 3.97Å; L483-Y591 HydrophobicContact CD2-CE1 4.09Å; L483-Y591 HydrophobicContact CG-CD1 4.32Å; L483-Y591 HydrophobicContact CG-CE1 4.12Å; L483-V594 HydrophobicContact CD2-CB 4.47Å; L483-V594 HydrophobicContact CD2-CG1 3.64Å; L483-I652 HydrophobicContact CB-CG2 3.67Å; L483-I652 HydrophobicContact CD1-CG2 4.25Å; L483-I652 HydrophobicContact CD2-CG2 4.15Å; L483-I652 HydrophobicContact CG-CG2 4.25Å; L483-R656 HydrophobicContact CD1-CB 4.15Å; L483-R656 HydrophobicContact CD1-CG 4.15Å; L483-L698 HydrophobicContact CD1-CD1 3.91Å; L483-L698 HydrophobicContact CD1-CD2 4.27Å; L483-L698 HydrophobicContact CD2-CD1 3.86Å; L483-L698 HydrophobicContact CD2-CD2 4.2Å
484	F	87.1	Confident	86.5	Confident	29 Å²	29	20.6 Å²	20.6	13%	0.127	11%	0.112	C	C	.	.			trans	56.7	21.1	-175.3	-72.8	-96.4	0	0	0	114.4	A480 V481 A486 G487 M490 A494 F595 L598 L599 K602	A480-F484 CarbonylContact O-C 3.57Å; V481-F484 PolarHBondContact O-N 3.14Å; F484-A486 PolarHBondContact O-N 3.24Å; F484-G487 PolarHBondContact O-N 2.98Å; F484-M490 HydrophobicContact CB-CB 4.46Å; F484-M490 HydrophobicContact CD1-CB 3.5Å; F484-M490 VanDerWaalsContact CD1-CB 3.5Å; F484-M490 HydrophobicContact CD1-CE 4.4Å; F484-M490 HydrophobicContact CD1-CG 4.5Å; F484-M490 HydrophobicContact CE1-CB 4.07Å; F484-M490 HydrophobicContact CE1-CE 4.24Å; F484-M490 HydrophobicContact CG-CB 4.3Å; F484-A494 HydrophobicContact CE1-CB 4.3Å; F484-F595 HydrophobicContact CD2-CD2 4.43Å; F484-F595 AromaticContact CE2-CD2 3.78Å; F484-F595 HydrophobicContact CE2-CD2 3.78Å; F484-F595 AromaticContact CE2-CE2 3.86Å; F484-F595 HydrophobicContact CE2-CE2 3.86Å; F484-F595 HydrophobicContact CZ-CD2 4.31Å; F484-F595 AromaticContact CZ-CE2 3.91Å; F484-F595 HydrophobicContact CZ-CE2 3.91Å; F484-L598 HydrophobicContact CD2-CB 4.03Å; F484-L598 HydrophobicContact CD2-CD1 3.79Å; F484-L598 HydrophobicContact CE2-CB 3.79Å; F484-L598 HydrophobicContact CE2-CD1 4.34Å; F484-L599 HydrophobicContact CZ-CD1 4.07Å; F484-K602 VanDerWaalsContact CD1-NZ 3.28Å; F484-K602 HydrophobicContact CE1-CD 4.04Å; F484-K602 HydrophobicContact CZ-CD 4.4Å
485	G	80.7	Confident	86.4	Confident	17 Å²	17	26.5 Å²	26.5	18%	0.175	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.1	-178	0	0	0	0	0	115.2	G479 A480 L483 G487 R656	G479-G485 PolarHBondContact O-N 3.14Å; A480-G485 PolarHBondContact O-N 2.88Å; L483-G485 PolarHBondContact O-N 3.45Å; L483-G485 VanDerWaalsContact O-N 3.11Å; G485-G487 PolarHBondContact O-N 2.67Å; G485-R656 PolarHBondContact O-NH2 2.86Å
486	A	78.7	Confident	86.1	Confident	17 Å²	17	29.6 Å²	29.6	14%	0.14	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	0.9	172.8	0	0	0	0	0	113.6	A480 F484 Y488 N489 M490	A480-A486 HydrophobicContact CB-CB 4.12Å; A480-A486 PolarHBondContact O-N 3.19Å; F484-A486 PolarHBondContact O-N 3.24Å; A486-Y488 PolarHBondContact O-N 2.74Å; A486-N489 PolarHBondContact O-ND2 3.35Å; A486-M490 HydrophobicContact CB-CG 3.84Å
487	G	82.8	Confident	86	Confident	28 Å²	28	29.5 Å²	29.5	29%	0.289	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	-116.3	170.8	0	0	0	0	0	112.4	F484 G485 N489 M490 D491	F484-G487 PolarHBondContact O-N 2.98Å; G485-G487 PolarHBondContact O-N 2.67Å; G487-N489 VanDerWaalsContact C-N 3.27Å; G487-N489 PolarHBondContact O-N 2.92Å; G487-N489 VanDerWaalsContact O-N 3.14Å; G487-M490 PolarHBondContact O-N 2.84Å; G487-D491 PolarHBondContact O-N 3.19Å
488	Y	81.8	Confident	85.9	Confident	173 Å²	173	29.4 Å²	29.4	68%	0.678	15%	0.147	S	C	*	.	H	α-helix	trans	-50.6	-40.8	-174.8	-63	-70.6	0	0	0	114.2	A486 M490 D491 D492	A486-Y488 PolarHBondContact O-N 2.74Å; Y488-M490 VanDerWaalsContact C-N 3.33Å; Y488-M490 PolarHBondContact O-N 3.47Å; Y488-D491 CarbonylContact O-C 3.6Å; Y488-D491 WeakPolarHBondContact O-CB 3.32Å; Y488-D491 PolarHBondContact O-N 2.87Å; Y488-D491 VanDerWaalsContact O-N 3.16Å; Y488-D492 PolarHBondContact O-N 2.75Å
489	N	83	Confident	85.2	Confident	35 Å²	35	30.3 Å²	30.3	19%	0.187	16%	0.156	C	C	.	.	H	α-helix	trans	-67.5	-37.7	-177.8	-47.9	-53.9	0	0	0	111.6	A486 G487 D491 D492 F493 T525	A486-N489 PolarHBondContact O-ND2 3.35Å; G487-N489 VanDerWaalsContact C-N 3.27Å; G487-N489 PolarHBondContact O-N 2.92Å; G487-N489 VanDerWaalsContact O-N 3.14Å; N489-D491 VanDerWaalsContact C-N 3.34Å; N489-D492 PolarHBondContact O-N 2.75Å; N489-F493 WeakPolarHBondContact O-CB 3.38Å; N489-F493 PolarHBondContact O-N 3.39Å; N489-T525 HydrophobicContact CB-CG2 4.2Å; N489-T525 WeakPolarHBondContact ND2-CG2 3.19Å
490	M	86.2	Confident	84.5	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-77.8	-23.5	176	-66.3	-60.8	-59.1	0	0	111.7	V481 F484 A486 G487 Y488 F493 A494 L518 L522 F595 K602	V481-M490 HydrophobicContact CG1-CE 4.02Å; V481-M490 HydrophobicContact CG1-SD 4.21Å; V481-M490 WeakPolarHBondContact O-CE 3.12Å; F484-M490 HydrophobicContact CB-CB 4.46Å; F484-M490 HydrophobicContact CD1-CB 3.5Å; F484-M490 VanDerWaalsContact CD1-CB 3.5Å; F484-M490 HydrophobicContact CD1-CE 4.4Å; F484-M490 HydrophobicContact CD1-CG 4.5Å; F484-M490 HydrophobicContact CE1-CB 4.07Å; F484-M490 HydrophobicContact CE1-CE 4.24Å; F484-M490 HydrophobicContact CG-CB 4.3Å; A486-M490 HydrophobicContact CB-CG 3.84Å; G487-M490 PolarHBondContact O-N 2.84Å; Y488-M490 VanDerWaalsContact C-N 3.33Å; Y488-M490 PolarHBondContact O-N 3.47Å; M490-F493 HydrophobicContact CE-CD1 3.95Å; M490-F493 HydrophobicContact CE-CE1 4.48Å; M490-A494 WeakPolarHBondContact O-CB 3.3Å; M490-A494 PolarHBondContact O-N 3.04Å; M490-L518 HydrophobicContact CE-CD1 4.46Å; M490-L522 HydrophobicContact SD-CD2 4.46Å; M490-F595 HydrophobicContact CE-CE2 3.98Å; M490-K602 PolarHBondContact O-NZ 3.07Å
491	D	86.7	Confident	83.8	Confident	43 Å²	43	33.9 Å²	33.9	23%	0.23	17%	0.174	C	C	.	.	H	α-helix	trans	-68.5	-44.3	167.2	-66.1	-30.3	0	0	0	111.9	G487 Y488 N489 A494 R495 K602	G487-D491 PolarHBondContact O-N 3.19Å; Y488-D491 CarbonylContact O-C 3.6Å; Y488-D491 WeakPolarHBondContact O-CB 3.32Å; Y488-D491 PolarHBondContact O-N 2.87Å; Y488-D491 VanDerWaalsContact O-N 3.16Å; N489-D491 VanDerWaalsContact C-N 3.34Å; D491-A494 PolarHBondContact O-N 2.95Å; D491-R495 VanDerWaalsContact O-CG 3.3Å; D491-R495 WeakPolarHBondContact O-CG 3.36Å; D491-R495 PolarHBondContact O-N 3.18Å; D491-K602 VanDerWaalsContact OD1-CE 3.26Å; D491-K602 WeakPolarHBondContact OD1-CE 3.07Å; D491-K602 IonicContact OD1-NZ 2.64Å; D491-K602 PolarHBondContact OD1-NZ 2.81Å
492	D	85.9	Confident	82.5	Confident	60 Å²	60	35.8 Å²	35.8	32%	0.321	19%	0.188	S	C	.	.	H	α-helix	trans	-68.3	-44.2	177.9	-73.8	-29	0	0	0	112	Y488 N489 A494 R495 Q496	Y488-D492 PolarHBondContact O-N 2.75Å; N489-D492 PolarHBondContact O-N 2.75Å; D492-A494 VanDerWaalsContact C-N 3.32Å; D492-A494 PolarHBondContact O-N 3.02Å; D492-R495 PolarHBondContact O-N 3.05Å; D492-R495 IonicContact OD1-CZ 3.82Å; D492-R495 IonicContact OD1-NH1 2.64Å; D492-R495 PolarHBondContact OD1-NH1 2.85Å; D492-Q496 WeakPolarHBondContact O-CG 3.43Å; D492-Q496 PolarHBondContact O-N 3.37Å
493	F	87.7	Confident	80.8	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-54.4	-49	169.8	165.8	-104.3	0	0	0	111.3	N489 M490 R495 Q496 C497 L518 Q521 F545 F595	N489-F493 WeakPolarHBondContact O-CB 3.38Å; N489-F493 PolarHBondContact O-N 3.39Å; M490-F493 HydrophobicContact CE-CD1 3.95Å; M490-F493 HydrophobicContact CE-CE1 4.48Å; F493-R495 VanDerWaalsContact C-N 3.35Å; F493-R495 PolarHBondContact O-N 3.34Å; F493-Q496 PolarHBondContact O-N 3.08Å; F493-C497 HydrophobicContact CE2-CB 4.44Å; F493-C497 HydrophobicContact CZ-CB 4.25Å; F493-C497 WeakPolarHBondContact O-CB 3.3Å; F493-C497 PolarHBondContact O-N 3.06Å; F493-L518 HydrophobicContact CD1-CD1 4.34Å; F493-L518 HydrophobicContact CD2-CB 3.77Å; F493-L518 HydrophobicContact CD2-CD1 4.41Å; F493-L518 HydrophobicContact CD2-CG 4.47Å; F493-L518 HydrophobicContact CE1-CD1 4.12Å; F493-L518 HydrophobicContact CE2-CB 3.7Å; F493-L518 HydrophobicContact CE2-CD1 4.2Å; F493-L518 HydrophobicContact CE2-CG 4.49Å; F493-L518 HydrophobicContact CG-CB 4.49Å; F493-L518 HydrophobicContact CG-CD1 4.49Å; F493-L518 HydrophobicContact CZ-CB 4.37Å; F493-L518 HydrophobicContact CZ-CD1 4.05Å; F493-Q521 HydrophobicContact CB-CB 4.47Å; F493-Q521 HydrophobicContact CB-CG 4.08Å; F493-F545 HydrophobicContact CE1-CE2 4.45Å; F493-F545 AromaticContact CE1-CZ 3.95Å; F493-F545 HydrophobicContact CE1-CZ 3.95Å; F493-F545 AromaticContact CE2-CE2 3.89Å; F493-F545 HydrophobicContact CE2-CE2 3.89Å; F493-F545 HydrophobicContact CE2-CZ 4.2Å; F493-F545 HydrophobicContact CZ-CE1 4.46Å; F493-F545 AromaticContact CZ-CE2 3.5Å; F493-F545 HydrophobicContact CZ-CE2 3.5Å; F493-F545 AromaticContact CZ-CZ 3.35Å; F493-F545 HydrophobicContact CZ-CZ 3.35Å; F493-F595 HydrophobicContact CE1-CZ 4.36Å
494	A	86.8	Confident	78.8	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-43.6	179.5	0	0	0	0	0	111.6	F484 M490 D491 D492 Q496 C497 F498 K602	F484-A494 HydrophobicContact CE1-CB 4.3Å; M490-A494 WeakPolarHBondContact O-CB 3.3Å; M490-A494 PolarHBondContact O-N 3.04Å; D491-A494 PolarHBondContact O-N 2.95Å; D492-A494 VanDerWaalsContact C-N 3.32Å; D492-A494 PolarHBondContact O-N 3.02Å; A494-Q496 PolarHBondContact O-N 2.85Å; A494-C497 PolarHBondContact O-N 2.92Å; A494-F498 HydrophobicContact CB-CD2 4.41Å; A494-F498 HydrophobicContact CB-CE2 3.76Å; A494-F498 HydrophobicContact CB-CZ 3.88Å; A494-F498 WeakPolarHBondContact O-CB 3.19Å; A494-F498 WeakPolarHBondContact O-CD1 3.28Å; A494-F498 WeakPolarHBondContact O-CD2 3.41Å; A494-F498 WeakPolarHBondContact O-CG 3.45Å; A494-F498 PolarHBondContact O-N 3.45Å; A494-K602 HydrophobicContact CB-CD 3.83Å
495	R	86.3	Confident	76.7	Confident	123 Å²	123	58.2 Å²	58.2	46%	0.464	29%	0.293	S	S	.	.	H	α-helix	trans	-60	-42.4	176.8	-71.8	170.7	-168.7	124.1	7.3	112.4	D491 D492 F493 G499	D491-R495 VanDerWaalsContact O-CG 3.3Å; D491-R495 WeakPolarHBondContact O-CG 3.36Å; D491-R495 PolarHBondContact O-N 3.18Å; D492-R495 PolarHBondContact O-N 3.05Å; D492-R495 IonicContact OD1-CZ 3.82Å; D492-R495 IonicContact OD1-NH1 2.64Å; D492-R495 PolarHBondContact OD1-NH1 2.85Å; F493-R495 VanDerWaalsContact C-N 3.35Å; F493-R495 PolarHBondContact O-N 3.34Å; R495-G499 PolarHBondContact O-N 3.33Å
496	Q	83.7	Confident	75.2	Confident	71 Å²	71	59.8 Å²	59.8	33%	0.332	31%	0.305	S	S	.	.	H	α-helix	trans	-66.8	-46.1	177	-70.5	174.5	7.9	0	0	111.4	D492 F493 A494 F498 G499 N500	D492-Q496 WeakPolarHBondContact O-CG 3.43Å; D492-Q496 PolarHBondContact O-N 3.37Å; F493-Q496 PolarHBondContact O-N 3.08Å; A494-Q496 PolarHBondContact O-N 2.85Å; Q496-F498 VanDerWaalsContact C-N 3.34Å; Q496-F498 PolarHBondContact O-N 2.94Å; Q496-G499 PolarHBondContact O-N 2.88Å; Q496-N500 PolarHBondContact O-N 3.26Å
497	C	83.7	Confident	73.9	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.014	34%	0.339	C	S	.	.	H	α-helix	trans	-55.8	-48.5	175.1	-178.9	0	0	0	0	111.1	F493 A494 G499 N500 I501 L514	F493-C497 HydrophobicContact CE2-CB 4.44Å; F493-C497 HydrophobicContact CZ-CB 4.25Å; F493-C497 WeakPolarHBondContact O-CB 3.3Å; F493-C497 PolarHBondContact O-N 3.06Å; A494-C497 PolarHBondContact O-N 2.92Å; C497-G499 PolarHBondContact O-N 3.15Å; C497-N500 PolarHBondContact O-N 2.89Å; C497-I501 VanDerWaalsContact O-CG1 3.29Å; C497-I501 WeakPolarHBondContact O-CG1 3.41Å; C497-I501 PolarHBondContact O-N 3.43Å; C497-L514 HydrophobicContact CB-CD2 3.99Å
498	F	84.8	Confident	72.8	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.009	36%	0.363	C	S	.	.	H	α-helix	trans	-67	-35.7	178.4	-55.9	-26.3	0	0	0	112.9	A494 Q496 N500 I501 S502 L599 K602 Y603 W606	A494-F498 HydrophobicContact CB-CD2 4.41Å; A494-F498 HydrophobicContact CB-CE2 3.76Å; A494-F498 HydrophobicContact CB-CZ 3.88Å; A494-F498 WeakPolarHBondContact O-CB 3.19Å; A494-F498 WeakPolarHBondContact O-CD1 3.28Å; A494-F498 WeakPolarHBondContact O-CD2 3.41Å; A494-F498 WeakPolarHBondContact O-CG 3.45Å; A494-F498 PolarHBondContact O-N 3.45Å; Q496-F498 VanDerWaalsContact C-N 3.34Å; Q496-F498 PolarHBondContact O-N 2.94Å; F498-N500 VanDerWaalsContact C-N 3.33Å; F498-N500 PolarHBondContact O-N 3.47Å; F498-I501 HydrophobicContact CD1-CD1 4.47Å; F498-I501 PolarHBondContact O-N 2.95Å; F498-S502 WeakPolarHBondContact O-CB 3.43Å; F498-S502 PolarHBondContact O-N 2.91Å; F498-L599 HydrophobicContact CE1-CD1 3.52Å; F498-L599 HydrophobicContact CE1-CG 4.01Å; F498-L599 HydrophobicContact CZ-CD1 3.68Å; F498-L599 HydrophobicContact CZ-CG 4.41Å; F498-K602 HydrophobicContact CE2-CB 4.23Å; F498-K602 HydrophobicContact CE2-CD 4.25Å; F498-K602 HydrophobicContact CE2-CG 3.92Å; F498-K602 HydrophobicContact CZ-CB 4Å; F498-K602 HydrophobicContact CZ-CD 4.28Å; F498-K602 HydrophobicContact CZ-CG 4.12Å; F498-Y603 HydrophobicContact CB-CD2 4Å; F498-Y603 HydrophobicContact CB-CE2 4.31Å; F498-Y603 AromaticContact CD1-CD2 3.46Å; F498-Y603 HydrophobicContact CD1-CD2 3.46Å; F498-Y603 VanDerWaalsContact CD1-CD2 3.46Å; F498-Y603 HydrophobicContact CD1-CE2 4.35Å; F498-Y603 HydrophobicContact CD1-CG 4.16Å; F498-Y603 HydrophobicContact CD2-CD2 4.45Å; F498-Y603 HydrophobicContact CE1-CD2 4Å; F498-Y603 HydrophobicContact CE1-CG 4.25Å; F498-Y603 AromaticContact CG-CD2 3.72Å; F498-Y603 HydrophobicContact CG-CD2 3.72Å; F498-Y603 HydrophobicContact CG-CE2 4.49Å; F498-W606 HydrophobicContact CB-CD2 3.62Å; F498-W606 HydrophobicContact CB-CE3 3.6Å; F498-W606 HydrophobicContact CB-CG 4.31Å; F498-W606 HydrophobicContact CB-CH2 3.89Å; F498-W606 HydrophobicContact CB-CZ2 3.88Å; F498-W606 HydrophobicContact CB-CZ3 3.75Å; F498-W606 HydrophobicContact CD2-CB 3.75Å; F498-W606 AromaticContact CD2-CD2 3.84Å; F498-W606 HydrophobicContact CD2-CD2 3.84Å; F498-W606 HydrophobicContact CD2-CE3 4.34Å; F498-W606 AromaticContact CD2-CG 3.61Å; F498-W606 HydrophobicContact CD2-CG 3.61Å; F498-W606 HydrophobicContact CE2-CB 4.11Å; F498-W606 HydrophobicContact CE2-CG 4.39Å; F498-W606 HydrophobicContact CG-CD2 4.16Å; F498-W606 HydrophobicContact CG-CE3 4.28Å; F498-W606 HydrophobicContact CG-CG 4.39Å; F498-W606 WeakPolarHBondContact O-CH2 3.34Å
499	G	76.1	Confident	72	Confident	20 Å²	20	69 Å²	69	21%	0.206	34%	0.338	C	S	.	.	H	α-helix	trans	-56.1	-47.8	171.5	0	0	0	0	0	111.7	R495 Q496 C497 S502 F503	R495-G499 PolarHBondContact O-N 3.33Å; Q496-G499 PolarHBondContact O-N 2.88Å; C497-G499 PolarHBondContact O-N 3.15Å; G499-S502 PolarHBondContact O-N 3.4Å; G499-F503 WeakPolarHBondContact O-CD2 3.34Å; G499-F503 VanDerWaalsContact O-CE2 3.28Å; G499-F503 WeakPolarHBondContact O-CE2 3.05Å
500	N	73.3	Confident	71.6	Confident	68 Å²	68	71 Å²	71	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-65.5	-40.5	178.8	-68.2	-10.2	0	0	0	112.5	Q496 C497 F498 S502	Q496-N500 PolarHBondContact O-N 3.26Å; C497-N500 PolarHBondContact O-N 2.89Å; F498-N500 VanDerWaalsContact C-N 3.33Å; F498-N500 PolarHBondContact O-N 3.47Å; N500-S502 VanDerWaalsContact C-N 3.32Å; N500-S502 PolarHBondContact O-N 3.31Å
501	I	71.4	Confident	71.2	Confident	11 Å²	11	72.9 Å²	72.9	6%	0.056	36%	0.359	C	S	.	.	H	α-helix	trans	-68.1	-32.4	176.8	-65	163.6	0	0	0	111.6	C497 F498 F503 L509 I562 I566 Y603	C497-I501 VanDerWaalsContact O-CG1 3.29Å; C497-I501 WeakPolarHBondContact O-CG1 3.41Å; C497-I501 PolarHBondContact O-N 3.43Å; F498-I501 HydrophobicContact CD1-CD1 4.47Å; F498-I501 PolarHBondContact O-N 2.95Å; I501-F503 VanDerWaalsContact C-N 3.3Å; I501-F503 PolarHBondContact O-N 3.31Å; I501-L509 HydrophobicContact CD1-CD1 4.38Å; I501-L509 HydrophobicContact CG1-CD1 3.45Å; I501-L509 VanDerWaalsContact CG1-CD1 3.45Å; I501-I562 HydrophobicContact CG2-CG2 3.34Å; I501-I566 HydrophobicContact CD1-CD1 4.09Å; I501-I566 HydrophobicContact CD1-CG1 3.96Å; I501-Y603 HydrophobicContact CG2-CE2 4.1Å
502	S	63.9	Low	71	Confident	40 Å²	40	75.8 Å²	75.8	28%	0.28	38%	0.378	S	S	.	.	H	α-helix	trans	-69.8	-22.5	-171	-174.2	0	0	0	0	114.4	F498 G499 N500 P504 R726	F498-S502 WeakPolarHBondContact O-CB 3.43Å; F498-S502 PolarHBondContact O-N 2.91Å; G499-S502 PolarHBondContact O-N 3.4Å; N500-S502 VanDerWaalsContact C-N 3.32Å; N500-S502 PolarHBondContact O-N 3.31Å; S502-P504 WeakPolarHBondContact O-CD 3.43Å; S502-R726 VanDerWaalsContact CA-NH2 3.31Å; S502-R726 PolarHBondContact O-NH2 2.95Å; S502-R726 PolarHBondContact OG-NH2 3.42Å
503	F	55.1	Low	70.9	Confident	142 Å²	142	77 Å²	77	62%	0.623	38%	0.384	S	S	*	.			trans	-68.4	123.2	-177.7	-74.1	-77.9	0	0	0	111.4	G499 I501 R505 A506	G499-F503 WeakPolarHBondContact O-CD2 3.34Å; G499-F503 VanDerWaalsContact O-CE2 3.28Å; G499-F503 WeakPolarHBondContact O-CE2 3.05Å; I501-F503 VanDerWaalsContact C-N 3.3Å; I501-F503 PolarHBondContact O-N 3.31Å; F503-R505 PolarHBondContact O-N 2.94Å; F503-A506 WeakPolarHBondContact O-CB 3.31Å; F503-A506 PolarHBondContact O-N 3.46Å
504	P	48.6	Very low	70.8	Confident	139 Å²	139	77 Å²	77	90%	0.903	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-7.6	178.2	-22	31.2	0	0	0	115.1	S502	S502-P504 WeakPolarHBondContact O-CD 3.43Å
505	R	43.6	Very low	70.7	Confident	227 Å²	227	78 Å²	78	86%	0.857	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	14	178.3	-81.4	-174.1	172.9	170	-1.3	113.3	F503 K507	F503-R505 PolarHBondContact O-N 2.94Å; R505-K507 PolarHBondContact O-N 3.31Å
506	A	50.1	Low	70.7	Confident	51 Å²	51	74.2 Å²	74.2	42%	0.421	39%	0.386	S	S	.	.			trans	-65.3	77.2	173.9	0	0	0	0	0	110.1	F503 K508	F503-A506 WeakPolarHBondContact O-CB 3.31Å; F503-A506 PolarHBondContact O-N 3.46Å; A506-K508 PolarHBondContact O-N 2.82Å
507	K	50.7	Low	70.8	Confident	197 Å²	197	73 Å²	73	86%	0.857	38%	0.382	S	S	*	.	S	Bend	trans	-72	-3.8	-178	-85.9	-169.2	172.8	-171	0	113.3	R505	R505-K507 PolarHBondContact O-N 3.31Å
508	K	59	Low	71	Confident	185 Å²	185	73 Å²	73	80%	0.804	38%	0.381	S	S	*	.	S	Bend	trans	-168.6	131.8	168.9	-99	156	-168.3	-165.3	0	107	A506 D510	A506-K508 PolarHBondContact O-N 2.82Å; K508-D510 PolarHBondContact O-N 3.47Å
509	L	65	Low	71.1	Confident	28 Å²	28	75.5 Å²	75.5	15%	0.147	39%	0.393	C	S	.	.			trans	-72.3	116	165.5	-162.1	77.8	0	0	0	106.7	I501 L511 L514 F547 L569	I501-L509 HydrophobicContact CD1-CD1 4.38Å; I501-L509 HydrophobicContact CG1-CD1 3.45Å; I501-L509 VanDerWaalsContact CG1-CD1 3.45Å; L509-L511 PolarHBondContact O-N 3.38Å; L509-L514 HydrophobicContact CD1-CD1 4.24Å; L509-L514 HydrophobicContact CD2-CD1 3.37Å; L509-L514 HydrophobicContact CG-CD1 3.55Å; L509-L514 HydrophobicContact CG-CG 4.47Å; L509-F547 HydrophobicContact CB-CZ 4.11Å; L509-F547 HydrophobicContact CD2-CE1 4.41Å; L509-F547 HydrophobicContact CD2-CZ 3.83Å; L509-L569 HydrophobicContact CD2-CD1 4.44Å; L509-L569 HydrophobicContact CD2-CD2 3.85Å
510	D	75.7	Confident	71.6	Confident	77 Å²	77	76.9 Å²	76.9	41%	0.412	40%	0.399	S	S	.	.			trans	-77.6	105.8	178.9	-165.7	-22.8	0	0	0	109.7	K508 V512 D513 L514	K508-D510 PolarHBondContact O-N 3.47Å; D510-V512 PolarHBondContact O-N 2.74Å; D510-V512 WeakPolarHBondContact OD1-CB 3.38Å; D510-V512 PolarHBondContact OD1-N 3.2Å; D510-D513 HydrophobicContact CB-CB 3.98Å; D510-D513 PolarHBondContact O-N 2.8Å; D510-D513 PolarHBondContact OD1-N 3.29Å; D510-L514 WeakPolarHBondContact O-CG 3.04Å; D510-L514 PolarHBondContact O-N 2.89Å
511	L	77.8	Confident	72	Confident	41 Å²	41	74.9 Å²	74.9	22%	0.215	39%	0.388	C	S	.	.	H	α-helix	trans	-63.3	-30.4	178.2	-69.5	176.9	0	0	0	112.3	L509 T515 F545 F547 L569	L509-L511 PolarHBondContact O-N 3.38Å; L511-T515 VanDerWaalsContact O-CB 3.26Å; L511-T515 WeakPolarHBondContact O-CB 3.42Å; L511-T515 PolarHBondContact O-N 3.25Å; L511-T515 PolarHBondContact O-OG1 3.14Å; L511-F545 HydrophobicContact CD2-CB 3.91Å; L511-F547 HydrophobicContact CD1-CD2 3.59Å; L511-F547 HydrophobicContact CD1-CE2 3.84Å; L511-F547 HydrophobicContact CD1-CG 4.5Å; L511-F547 HydrophobicContact CD2-CD2 3.91Å; L511-F547 HydrophobicContact CD2-CE2 3.56Å; L511-F547 HydrophobicContact CD2-CZ 3.95Å; L511-F547 HydrophobicContact CG-CD2 3.95Å; L511-F547 HydrophobicContact CG-CE2 3.66Å; L511-F547 HydrophobicContact CG-CZ 4.48Å; L511-L569 HydrophobicContact CD2-CD2 4.16Å
512	V	82.2	Confident	72.5	Confident	105 Å²	105	74.4 Å²	74.4	64%	0.636	39%	0.386	S	S	*	.	H	α-helix	trans	-69.2	-46	179.1	-177.7	0	0	0	0	109	D510 L514 T515 A516	D510-V512 PolarHBondContact O-N 2.74Å; D510-V512 WeakPolarHBondContact OD1-CB 3.38Å; D510-V512 PolarHBondContact OD1-N 3.2Å; V512-L514 PolarHBondContact O-N 3.09Å; V512-T515 PolarHBondContact O-N 3.26Å; V512-A516 VanDerWaalsContact O-CB 3.28Å; V512-A516 WeakPolarHBondContact O-CB 3.24Å; V512-A516 PolarHBondContact O-N 3Å
513	D	83.3	Confident	73.2	Confident	85 Å²	85	74 Å²	74	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-63.5	-41.7	175.5	-72.9	-14.2	0	0	0	111.7	D510 A516 N517	D510-D513 HydrophobicContact CB-CB 3.98Å; D510-D513 PolarHBondContact O-N 2.8Å; D510-D513 PolarHBondContact OD1-N 3.29Å; D513-A516 PolarHBondContact O-N 3.29Å; D513-N517 VanDerWaalsContact O-CB 3.26Å; D513-N517 WeakPolarHBondContact O-CB 3.4Å; D513-N517 PolarHBondContact O-N 3.46Å; D513-N517 PolarHBondContact O-ND2 3.05Å
514	L	85	Confident	73.9	Confident	3 Å²	3	70.1 Å²	70.1	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-62.4	-43.5	176.2	-76.1	178.2	0	0	0	112.4	C497 L509 D510 V512 N517 L518 F545	C497-L514 HydrophobicContact CB-CD2 3.99Å; L509-L514 HydrophobicContact CD1-CD1 4.24Å; L509-L514 HydrophobicContact CD2-CD1 3.37Å; L509-L514 HydrophobicContact CG-CD1 3.55Å; L509-L514 HydrophobicContact CG-CG 4.47Å; D510-L514 WeakPolarHBondContact O-CG 3.04Å; D510-L514 PolarHBondContact O-N 2.89Å; V512-L514 PolarHBondContact O-N 3.09Å; L514-N517 PolarHBondContact O-N 3.12Å; L514-L518 PolarHBondContact O-N 3.38Å; L514-F545 HydrophobicContact CB-CD2 3.96Å; L514-F545 HydrophobicContact CB-CE2 4.47Å
515	T	85.9	Confident	74.5	Confident	20 Å²	20	64.3 Å²	64.3	12%	0.123	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-47.9	176.7	-60.8	0	0	0	0	110.4	L511 V512 N517 L518 Q519 L543 A544 F545	L511-T515 VanDerWaalsContact O-CB 3.26Å; L511-T515 WeakPolarHBondContact O-CB 3.42Å; L511-T515 PolarHBondContact O-N 3.25Å; L511-T515 PolarHBondContact O-OG1 3.14Å; V512-T515 PolarHBondContact O-N 3.26Å; T515-N517 VanDerWaalsContact C-N 3.33Å; T515-N517 PolarHBondContact O-N 3.37Å; T515-L518 PolarHBondContact O-N 2.72Å; T515-Q519 HydrophobicContact CG2-CG 4.41Å; T515-Q519 WeakPolarHBondContact O-CB 3.34Å; T515-Q519 VanDerWaalsContact O-CG 3.22Å; T515-Q519 WeakPolarHBondContact O-CG 3.17Å; T515-Q519 PolarHBondContact O-N 3.17Å; T515-L543 WeakPolarHBondContact CG2-O 3.21Å; T515-A544 HydrophobicContact CG2-CB 4.2Å; T515-F545 PolarHBondContact OG1-N 3.32Å
516	A	86.7	Confident	74.8	Confident	45 Å²	45	59.4 Å²	59.4	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-62.1	-39.1	177.5	0	0	0	0	0	112.3	V512 D513 Q519 S520	V512-A516 VanDerWaalsContact O-CB 3.28Å; V512-A516 WeakPolarHBondContact O-CB 3.24Å; V512-A516 PolarHBondContact O-N 3Å; D513-A516 PolarHBondContact O-N 3.29Å; A516-Q519 PolarHBondContact O-N 3.09Å; A516-S520 VanDerWaalsContact O-CB 3.31Å; A516-S520 WeakPolarHBondContact O-CB 3.41Å; A516-S520 PolarHBondContact O-N 3.38Å
517	N	85.9	Confident	74.9	Confident	46 Å²	46	67.1 Å²	67.1	25%	0.246	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-46.7	176.5	-74.3	-33.1	0	0	0	111.3	D513 L514 T515 Q519 S520 Q521	D513-N517 VanDerWaalsContact O-CB 3.26Å; D513-N517 WeakPolarHBondContact O-CB 3.4Å; D513-N517 PolarHBondContact O-N 3.46Å; D513-N517 PolarHBondContact O-ND2 3.05Å; L514-N517 PolarHBondContact O-N 3.12Å; T515-N517 VanDerWaalsContact C-N 3.33Å; T515-N517 PolarHBondContact O-N 3.37Å; N517-Q519 VanDerWaalsContact C-N 3.34Å; N517-Q519 PolarHBondContact O-N 3.28Å; N517-S520 PolarHBondContact O-N 3.49Å; N517-Q521 VanDerWaalsContact O-CG 3.32Å; N517-Q521 WeakPolarHBondContact O-CG 3.46Å; N517-Q521 PolarHBondContact O-N 3.37Å
518	L	86.8	Confident	75	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-46.4	175.6	-179.2	137	0	0	0	111.1	V481 M490 F493 L514 T515 S520 Q521 L522 L543 F545 L571	V481-L518 HydrophobicContact CG1-CD1 4.17Å; M490-L518 HydrophobicContact CE-CD1 4.46Å; F493-L518 HydrophobicContact CD1-CD1 4.34Å; F493-L518 HydrophobicContact CD2-CB 3.77Å; F493-L518 HydrophobicContact CD2-CD1 4.41Å; F493-L518 HydrophobicContact CD2-CG 4.47Å; F493-L518 HydrophobicContact CE1-CD1 4.12Å; F493-L518 HydrophobicContact CE2-CB 3.7Å; F493-L518 HydrophobicContact CE2-CD1 4.2Å; F493-L518 HydrophobicContact CE2-CG 4.49Å; F493-L518 HydrophobicContact CG-CB 4.49Å; F493-L518 HydrophobicContact CG-CD1 4.49Å; F493-L518 HydrophobicContact CZ-CB 4.37Å; F493-L518 HydrophobicContact CZ-CD1 4.05Å; L514-L518 PolarHBondContact O-N 3.38Å; T515-L518 PolarHBondContact O-N 2.72Å; L518-S520 PolarHBondContact O-N 2.95Å; L518-Q521 PolarHBondContact O-N 2.94Å; L518-L522 HydrophobicContact CD2-CD1 3.59Å; L518-L522 HydrophobicContact CD2-CG 4.47Å; L518-L522 HydrophobicContact CG-CD1 4.14Å; L518-L522 WeakPolarHBondContact O-CG 3.5Å; L518-L522 PolarHBondContact O-N 3.35Å; L518-L543 HydrophobicContact CD2-CB 3.87Å; L518-L543 HydrophobicContact CD2-CD1 3.99Å; L518-F545 HydrophobicContact CB-CE2 3.94Å; L518-F545 HydrophobicContact CD1-CE2 3.62Å; L518-F545 HydrophobicContact CD1-CZ 3.65Å; L518-F545 HydrophobicContact CG-CE2 4.32Å; L518-L571 HydrophobicContact CD1-CD1 4.49Å
519	Q	87.4	Confident	74.4	Confident	54 Å²	54	64.1 Å²	64.1	25%	0.252	32%	0.322	S	S	.	.	H	α-helix	trans	-60.5	-43.8	177	-72.8	176.7	-3.1	0	0	112	T515 A516 N517 L522 S523 S540 L543	T515-Q519 HydrophobicContact CG2-CG 4.41Å; T515-Q519 WeakPolarHBondContact O-CB 3.34Å; T515-Q519 VanDerWaalsContact O-CG 3.22Å; T515-Q519 WeakPolarHBondContact O-CG 3.17Å; T515-Q519 PolarHBondContact O-N 3.17Å; A516-Q519 PolarHBondContact O-N 3.09Å; N517-Q519 VanDerWaalsContact C-N 3.34Å; N517-Q519 PolarHBondContact O-N 3.28Å; Q519-L522 PolarHBondContact O-N 2.81Å; Q519-S523 VanDerWaalsContact O-CB 3.26Å; Q519-S523 WeakPolarHBondContact O-CB 3.38Å; Q519-S523 PolarHBondContact O-N 2.75Å; Q519-S523 PolarHBondContact O-OG 2.91Å; Q519-S540 VanDerWaalsContact CG-O 3.31Å; Q519-S540 WeakPolarHBondContact CG-O 3.19Å; Q519-S540 PolarHBondContact NE2-O 3.47Å; Q519-L543 PolarHBondContact NE2-O 2.92Å
520	S	85.2	Confident	73.3	Confident	49 Å²	49	72.4 Å²	72.4	34%	0.343	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-50.9	175.4	-171.6	0	0	0	0	111.1	A516 N517 L518 L522 S523 D524	A516-S520 VanDerWaalsContact O-CB 3.31Å; A516-S520 WeakPolarHBondContact O-CB 3.41Å; A516-S520 PolarHBondContact O-N 3.38Å; N517-S520 PolarHBondContact O-N 3.49Å; L518-S520 PolarHBondContact O-N 2.95Å; S520-L522 VanDerWaalsContact C-N 3.29Å; S520-L522 PolarHBondContact O-N 3.38Å; S520-S523 WeakPolarHBondContact CA-OG 3.24Å; S520-S523 PolarHBondContact O-N 2.95Å; S520-S523 VanDerWaalsContact O-N 3.08Å; S520-S523 PolarHBondContact O-OG 3.45Å; S520-D524 WeakPolarHBondContact O-CB 3.38Å; S520-D524 PolarHBondContact O-N 3.33Å; S520-D524 PolarHBondContact OG-OD2 2.98Å
521	Q	83.1	Confident	71.8	Confident	26 Å²	26	71.1 Å²	71.1	12%	0.121	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-38.1	-179.6	-68	-51.6	-50	0	0	112.3	F493 N517 L518 T525	F493-Q521 HydrophobicContact CB-CB 4.47Å; F493-Q521 HydrophobicContact CB-CG 4.08Å; N517-Q521 VanDerWaalsContact O-CG 3.32Å; N517-Q521 WeakPolarHBondContact O-CG 3.46Å; N517-Q521 PolarHBondContact O-N 3.37Å; L518-Q521 PolarHBondContact O-N 2.94Å; Q521-T525 VanDerWaalsContact O-CG2 3.32Å; Q521-T525 WeakPolarHBondContact O-CG2 3.25Å
522	L	81.5	Confident	70.1	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.01	38%	0.379	C	S	.	.	H	α-helix	trans	-72.9	-33.8	175.6	-66.8	177.9	0	0	0	112.2	V481 M490 L518 Q519 S520 T525 L543	V481-L522 HydrophobicContact CG2-CD1 3.87Å; V481-L522 HydrophobicContact CG2-CD2 4.14Å; M490-L522 HydrophobicContact SD-CD2 4.46Å; L518-L522 HydrophobicContact CD2-CD1 3.59Å; L518-L522 HydrophobicContact CD2-CG 4.47Å; L518-L522 HydrophobicContact CG-CD1 4.14Å; L518-L522 WeakPolarHBondContact O-CG 3.5Å; L518-L522 PolarHBondContact O-N 3.35Å; Q519-L522 PolarHBondContact O-N 2.81Å; S520-L522 VanDerWaalsContact C-N 3.29Å; S520-L522 PolarHBondContact O-N 3.38Å; L522-T525 WeakPolarHBondContact O-CB 3.29Å; L522-T525 WeakPolarHBondContact O-CG2 3.35Å; L522-T525 PolarHBondContact O-OG1 3.4Å; L522-L543 HydrophobicContact CD1-CD1 3.7Å
523	S	77.9	Confident	68.4	Low	30 Å²	30	72.9 Å²	72.9	21%	0.21	37%	0.37	C	S	.	.	H	α-helix	trans	-71.9	-37.5	177.4	75.4	0	0	0	0	113	Q519 S520 T525 F526 H537	Q519-S523 VanDerWaalsContact O-CB 3.26Å; Q519-S523 WeakPolarHBondContact O-CB 3.38Å; Q519-S523 PolarHBondContact O-N 2.75Å; Q519-S523 PolarHBondContact O-OG 2.91Å; S520-S523 WeakPolarHBondContact CA-OG 3.24Å; S520-S523 PolarHBondContact O-N 2.95Å; S520-S523 VanDerWaalsContact O-N 3.08Å; S520-S523 PolarHBondContact O-OG 3.45Å; S523-T525 PolarHBondContact O-N 3.36Å; S523-F526 PolarHBondContact O-N 2.94Å; S523-H537 VanDerWaalsContact CA-CD2 3.49Å; S523-H537 WeakPolarHBondContact CA-CD2 2.98Å; S523-H537 VanDerWaalsContact CB-CD2 3.42Å; S523-H537 WeakPolarHBondContact CB-CD2 3.44Å
524	D	69.9	Low	67.1	Low	62 Å²	62	70.9 Å²	70.9	33%	0.332	36%	0.362	S	S	.	.	H	α-helix	trans	-66.3	-22.7	-178.9	-76.7	-35	0	0	0	112.6	S520 F526 R527	S520-D524 WeakPolarHBondContact O-CB 3.38Å; S520-D524 PolarHBondContact O-N 3.33Å; S520-D524 PolarHBondContact OG-OD2 2.98Å; D524-F526 PolarHBondContact O-N 2.81Å; D524-F526 VanDerWaalsContact O-N 3.14Å; D524-R527 PolarHBondContact O-N 3.34Å; D524-R527 VanDerWaalsContact O-N 3.09Å
525	T	61.8	Low	66	Low	17 Å²	17	73.2 Å²	73.2	10%	0.104	38%	0.375	C	S	.	.	H	α-helix	trans	-53.7	-33.3	173.5	68.4	0	0	0	0	113.2	N489 Q521 L522 S523 R529	N489-T525 HydrophobicContact CB-CG2 4.2Å; N489-T525 WeakPolarHBondContact ND2-CG2 3.19Å; Q521-T525 VanDerWaalsContact O-CG2 3.32Å; Q521-T525 WeakPolarHBondContact O-CG2 3.25Å; L522-T525 WeakPolarHBondContact O-CB 3.29Å; L522-T525 WeakPolarHBondContact O-CG2 3.35Å; L522-T525 PolarHBondContact O-OG1 3.4Å; S523-T525 PolarHBondContact O-N 3.36Å; T525-R529 PolarHBondContact O-N 3.46Å
526	F	50.2	Low	65.1	Low	123 Å²	123	73 Å²	73	54%	0.539	37%	0.373	S	S	.	.	H	α-helix	trans	-74.4	-33.5	-179.2	-172	-94.2	0	0	0	112.6	S523 D524 N528 H537	S523-F526 PolarHBondContact O-N 2.94Å; D524-F526 PolarHBondContact O-N 2.81Å; D524-F526 VanDerWaalsContact O-N 3.14Å; F526-N528 VanDerWaalsContact C-N 3.31Å; F526-N528 PolarHBondContact O-N 2.62Å; F526-H537 HydrophobicContact CB-CB 4.46Å
527	R	52.2	Low	64.3	Low	214 Å²	214	74.6 Å²	74.6	81%	0.808	37%	0.372	S	S	*	.	H	α-helix	trans	-68.4	-32.5	-179.2	-74.5	-171.8	175.6	-151.3	1.5	112.3	D524	D524-R527 PolarHBondContact O-N 3.34Å; D524-R527 VanDerWaalsContact O-N 3.09Å
528	N	51.6	Low	63.7	Low	142 Å²	142	77.5 Å²	77.5	76%	0.759	39%	0.387	S	S	*	.	H	α-helix	trans	-99.9	-19.9	-169.8	-71.3	-20.8	0	0	0	115	F526	F526-N528 VanDerWaalsContact C-N 3.31Å; F526-N528 PolarHBondContact O-N 2.62Å
529	R	48	Very low	63.3	Low	177 Å²	177	77.8 Å²	77.8	67%	0.668	39%	0.388	S	S	*	.			trans	-109.1	118.6	175.2	-72.8	-172.4	-170.4	180	5.4	110.5	T525 A531	T525-R529 PolarHBondContact O-N 3.46Å; R529-A531 HydrophobicContact CB-CB 4.21Å; R529-A531 PolarHBondContact O-N 2.8Å
530	H	41.1	Very low	63	Low	202 Å²	202	75.4 Å²	75.4	94%	0.935	38%	0.378	S	S	*	.			trans	-60.7	18.8	162.2	-69.3	-66.9	0	0	0	114.1	S532	H530-S532 PolarHBondContact O-N 3.1Å
531	A	44.8	Very low	62.9	Low	49 Å²	49	77.3 Å²	77.3	41%	0.405	39%	0.387	S	S	.	.			trans	-86.3	96.3	173.5	0	0	0	0	0	108.1	R529 H533	R529-A531 HydrophobicContact CB-CB 4.21Å; R529-A531 PolarHBondContact O-N 2.8Å; A531-H533 PolarHBondContact O-N 2.73Å
532	S	41.4	Very low	62.9	Low	89 Å²	89	79.3 Å²	79.3	62%	0.622	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	20.4	177.2	36.7	0	0	0	0	116.2	H530	H530-S532 PolarHBondContact O-N 3.1Å
533	H	46.5	Very low	63.2	Low	95 Å²	95	79.2 Å²	79.2	44%	0.44	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	-4.3	-168.8	-63.7	-76.9	0	0	0	115.9	A531 L535	A531-H533 PolarHBondContact O-N 2.73Å; H533-L535 PolarHBondContact O-N 2.99Å
534	S	55.6	Low	63.7	Low	42 Å²	42	79.8 Å²	79.8	29%	0.294	40%	0.402	S	S	.	.			trans	-81	88.3	175.1	-161	0	0	0	0	110.2	L536	S534-L536 PolarHBondContact O-N 3.04Å; S534-L536 VanDerWaalsContact O-N 3.09Å; S534-L536 VanDerWaalsContact OG-CD1 3.3Å; S534-L536 WeakPolarHBondContact OG-CD1 3.43Å; S534-L536 VanDerWaalsContact OG-CG 3.28Å; S534-L536 WeakPolarHBondContact OG-CG 3.26Å
535	L	62.4	Low	64.5	Low	53 Å²	53	77.4 Å²	77.4	28%	0.277	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	4.1	174.1	-62.7	171.4	0	0	0	112.7	N473 H533 H537 L538 E539	N473-L535 WeakPolarHBondContact ND2-CD1 3.42Å; H533-L535 PolarHBondContact O-N 2.99Å; L535-H537 PolarHBondContact O-N 2.76Å; L535-H537 VanDerWaalsContact O-N 3.17Å; L535-L538 HydrophobicContact CD2-CD1 3.8Å; L535-L538 PolarHBondContact O-N 3.39Å; L535-E539 PolarHBondContact O-N 3.3Å
536	L	67.3	Low	65.5	Low	16 Å²	16	80 Å²	80	8%	0.084	40%	0.402	C	S	.	.	H	α-helix	trans	-52.7	-35.5	176.7	-65.6	-179.3	0	0	0	112.7	V477 A480 S534 L538 E539 S540	V477-L536 HydrophobicContact CB-CD2 4.25Å; V477-L536 HydrophobicContact CG2-CD2 3.64Å; A480-L536 HydrophobicContact CB-CD1 4.17Å; A480-L536 HydrophobicContact CB-CD2 3.92Å; S534-L536 PolarHBondContact O-N 3.04Å; S534-L536 VanDerWaalsContact O-N 3.09Å; S534-L536 VanDerWaalsContact OG-CD1 3.3Å; S534-L536 WeakPolarHBondContact OG-CD1 3.43Å; S534-L536 VanDerWaalsContact OG-CG 3.28Å; S534-L536 WeakPolarHBondContact OG-CG 3.26Å; L536-L538 PolarHBondContact O-N 3.03Å; L536-E539 PolarHBondContact O-N 3.48Å; L536-S540 PolarHBondContact O-N 3.09Å
537	H	69.8	Low	66.7	Low	78 Å²	78	76 Å²	76	36%	0.361	38%	0.384	S	S	.	.	H	α-helix	trans	-59.1	-45.2	176.5	173.4	-68.6	0	0	0	111.9	S523 F526 L535 E539 S540	S523-H537 VanDerWaalsContact CA-CD2 3.49Å; S523-H537 WeakPolarHBondContact CA-CD2 2.98Å; S523-H537 VanDerWaalsContact CB-CD2 3.42Å; S523-H537 WeakPolarHBondContact CB-CD2 3.44Å; F526-H537 HydrophobicContact CB-CB 4.46Å; L535-H537 PolarHBondContact O-N 2.76Å; L535-H537 VanDerWaalsContact O-N 3.17Å; H537-E539 VanDerWaalsContact C-N 3.31Å; H537-E539 PolarHBondContact O-N 3.46Å; H537-S540 WeakPolarHBondContact O-CB 3.48Å; H537-S540 PolarHBondContact O-N 2.98Å; H537-S540 PolarHBondContact O-OG 3.36Å
538	L	72.8	Confident	67.4	Low	106 Å²	106	71.2 Å²	71.2	56%	0.555	37%	0.374	S	S	*	.	H	α-helix	trans	-66	-40.5	-178.9	-64.2	173.2	0	0	0	110.6	L535 L536 S540 T541	L535-L538 HydrophobicContact CD2-CD1 3.8Å; L535-L538 PolarHBondContact O-N 3.39Å; L536-L538 PolarHBondContact O-N 3.03Å; L538-S540 VanDerWaalsContact C-N 3.31Å; L538-S540 PolarHBondContact O-N 2.94Å; L538-T541 PolarHBondContact O-OG1 3.25Å
539	E	79.2	Confident	67.8	Low	7 Å²	7	67 Å²	67	3%	0.033	36%	0.355	C	S	.	.	H	α-helix	trans	-75.5	-20	-177.9	-63.9	-68.3	172	0	0	113.1	R469 V477 L535 L536 H537 T541 F542 Y573	R469-E539 VanDerWaalsContact CD-OE1 3.3Å; R469-E539 WeakPolarHBondContact CD-OE1 3.47Å; R469-E539 VanDerWaalsContact CD-OE2 3.26Å; R469-E539 WeakPolarHBondContact CD-OE2 3.29Å; R469-E539 IonicContact NH1-OE2 3.23Å; R469-E539 PolarHBondContact NH1-OE2 3.38Å; V477-E539 HydrophobicContact CB-CB 4.43Å; V477-E539 HydrophobicContact CG1-CB 4.21Å; V477-E539 HydrophobicContact CG2-CB 3.44Å; V477-E539 VanDerWaalsContact CG2-CB 3.44Å; V477-E539 HydrophobicContact CG2-CG 3.64Å; L535-E539 PolarHBondContact O-N 3.3Å; L536-E539 PolarHBondContact O-N 3.48Å; H537-E539 VanDerWaalsContact C-N 3.31Å; H537-E539 PolarHBondContact O-N 3.46Å; E539-T541 PolarHBondContact O-N 3.11Å; E539-F542 PolarHBondContact O-N 2.9Å; E539-F542 VanDerWaalsContact O-N 3.09Å; E539-Y573 PolarHBondContact OE2-OH 3.34Å; E539-Y573 VanDerWaalsContact OE2-OH 3.11Å
540	S	81	Confident	67.9	Low	4 Å²	4	63.5 Å²	63.5	3%	0.028	35%	0.354	C	S	.	.	H	α-helix	trans	-56.1	-36.6	179.2	72.3	0	0	0	0	112.9	Q519 L536 H537 L538 F542 L543	Q519-S540 VanDerWaalsContact CG-O 3.31Å; Q519-S540 WeakPolarHBondContact CG-O 3.19Å; Q519-S540 PolarHBondContact NE2-O 3.47Å; L536-S540 PolarHBondContact O-N 3.09Å; H537-S540 WeakPolarHBondContact O-CB 3.48Å; H537-S540 PolarHBondContact O-N 2.98Å; H537-S540 PolarHBondContact O-OG 3.36Å; L538-S540 VanDerWaalsContact C-N 3.31Å; L538-S540 PolarHBondContact O-N 2.94Å; S540-F542 PolarHBondContact O-N 2.91Å; S540-L543 WeakPolarHBondContact O-CB 3.3Å; S540-L543 PolarHBondContact O-N 3.26Å; S540-L543 VanDerWaalsContact O-N 3.12Å
541	T	81.9	Confident	68	Low	89 Å²	89	61 Å²	61	55%	0.546	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.2	-178.5	60.9	0	0	0	0	114	L538 E539	L538-T541 PolarHBondContact O-OG1 3.25Å; E539-T541 PolarHBondContact O-N 3.11Å
542	F	84.7	Confident	67.9	Low	68 Å²	68	66.1 Å²	66.1	30%	0.298	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	1.1	178.9	-60.9	-80.4	0	0	0	113.3	E539 S540 Y573 H574	E539-F542 PolarHBondContact O-N 2.9Å; E539-F542 VanDerWaalsContact O-N 3.09Å; S540-F542 PolarHBondContact O-N 2.91Å; F542-Y573 HydrophobicContact CB-CD2 4.13Å; F542-Y573 HydrophobicContact CB-CE2 4.01Å; F542-H574 HydrophobicContact CB-CB 4.33Å; F542-H574 HydrophobicContact CD1-CB 4.44Å; F542-H574 PolarHBondContact O-N 3.33Å
543	L	87.7	Confident	68.1	Low	1 Å²	1	66.5 Å²	66.5	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.8	176.4	-66.7	165.7	0	0	0	109.5	V477 V481 T515 L518 Q519 L522 S540 L571 N572 Y573	V477-L543 HydrophobicContact CG1-CD1 4.16Å; V481-L543 HydrophobicContact CB-CD1 4.49Å; V481-L543 HydrophobicContact CG1-CD1 4.26Å; V481-L543 HydrophobicContact CG2-CD1 3.9Å; T515-L543 WeakPolarHBondContact CG2-O 3.21Å; L518-L543 HydrophobicContact CD2-CB 3.87Å; L518-L543 HydrophobicContact CD2-CD1 3.99Å; Q519-L543 PolarHBondContact NE2-O 2.92Å; L522-L543 HydrophobicContact CD1-CD1 3.7Å; S540-L543 WeakPolarHBondContact O-CB 3.3Å; S540-L543 PolarHBondContact O-N 3.26Å; S540-L543 VanDerWaalsContact O-N 3.12Å; L543-L571 HydrophobicContact CB-CD1 4.27Å; L543-L571 HydrophobicContact CD2-CD1 4.34Å; L543-L571 HydrophobicContact CD2-CD2 4.34Å; L543-L571 HydrophobicContact CD2-CG 4.28Å; L543-N572 WeakPolarHBondContact CA-O 3.31Å; L543-Y573 HydrophobicContact CD2-CD2 3.64Å; L543-Y573 HydrophobicContact CD2-CE2 4.45Å; L543-Y573 HydrophobicContact CD2-CG 3.76Å; L543-Y573 HydrophobicContact CG-CD2 4.12Å
544	A	87.2	Confident	67.9	Low	42 Å²	42	69.6 Å²	69.6	35%	0.347	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	140.9	177.3	0	0	0	0	0	111.1	T515 N572	T515-A544 HydrophobicContact CG2-CB 4.2Å; A544-N572 PolarHBondContact N-O 3.37Å; A544-N572 WeakPolarHBondContact O-CB 3.41Å; A544-N572 PolarHBondContact O-N 3.36Å
545	F	86.5	Confident	67.2	Low	12 Å²	12	73.6 Å²	73.6	5%	0.053	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	145.8	172.5	-74.8	-76.8	0	0	0	111.7	F493 L511 L514 T515 L518 K570 L571 F595	F493-F545 HydrophobicContact CE1-CE2 4.45Å; F493-F545 AromaticContact CE1-CZ 3.95Å; F493-F545 HydrophobicContact CE1-CZ 3.95Å; F493-F545 AromaticContact CE2-CE2 3.89Å; F493-F545 HydrophobicContact CE2-CE2 3.89Å; F493-F545 HydrophobicContact CE2-CZ 4.2Å; F493-F545 HydrophobicContact CZ-CE1 4.46Å; F493-F545 AromaticContact CZ-CE2 3.5Å; F493-F545 HydrophobicContact CZ-CE2 3.5Å; F493-F545 AromaticContact CZ-CZ 3.35Å; F493-F545 HydrophobicContact CZ-CZ 3.35Å; L511-F545 HydrophobicContact CD2-CB 3.91Å; L514-F545 HydrophobicContact CB-CD2 3.96Å; L514-F545 HydrophobicContact CB-CE2 4.47Å; T515-F545 PolarHBondContact OG1-N 3.32Å; L518-F545 HydrophobicContact CB-CE2 3.94Å; L518-F545 HydrophobicContact CD1-CE2 3.62Å; L518-F545 HydrophobicContact CD1-CZ 3.65Å; L518-F545 HydrophobicContact CG-CE2 4.32Å; F545-K570 CarbonylContact C-O 3.51Å; F545-K570 WeakPolarHBondContact CA-O 3.49Å; F545-L571 HydrophobicContact CD1-CB 4.27Å; F545-L571 HydrophobicContact CD1-CD1 4.11Å; F545-L571 HydrophobicContact CD2-CD1 4.38Å; F545-L571 HydrophobicContact CE1-CB 3.99Å; F545-L571 HydrophobicContact CE1-CD1 3.89Å; F545-L571 HydrophobicContact CE1-CG 4.43Å; F545-L571 HydrophobicContact CE2-CD1 4.18Å; F545-L571 HydrophobicContact CG-CD1 4.35Å; F545-L571 HydrophobicContact CZ-CD1 3.92Å; F545-F595 AromaticContact CE1-CE1 3.95Å; F545-F595 HydrophobicContact CE1-CE1 3.95Å; F545-F595 HydrophobicContact CE1-CZ 4.16Å; F545-F595 HydrophobicContact CZ-CE1 4.48Å; F545-F595 HydrophobicContact CZ-CZ 4.24Å
546	D	82.7	Confident	66.1	Low	72 Å²	72	78.9 Å²	78.9	39%	0.385	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	167.6	178.6	-163.3	7.3	0	0	0	110.1	K570 N572	D546-K570 PolarHBondContact N-O 2.9Å; D546-K570 PolarHBondContact O-N 3.24Å; D546-N572 WeakPolarHBondContact CB-ND2 3.43Å; D546-N572 PolarHBondContact OD2-ND2 2.94Å
547	F	77.3	Confident	64.9	Low	38 Å²	38	84.8 Å²	84.8	17%	0.167	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137	175.1	-78	-63.4	0	0	0	111.6	L509 L511 S549 L565 N568 L569	L509-F547 HydrophobicContact CB-CZ 4.11Å; L509-F547 HydrophobicContact CD2-CE1 4.41Å; L509-F547 HydrophobicContact CD2-CZ 3.83Å; L511-F547 HydrophobicContact CD1-CD2 3.59Å; L511-F547 HydrophobicContact CD1-CE2 3.84Å; L511-F547 HydrophobicContact CD1-CG 4.5Å; L511-F547 HydrophobicContact CD2-CD2 3.91Å; L511-F547 HydrophobicContact CD2-CE2 3.56Å; L511-F547 HydrophobicContact CD2-CZ 3.95Å; L511-F547 HydrophobicContact CG-CD2 3.95Å; L511-F547 HydrophobicContact CG-CE2 3.66Å; L511-F547 HydrophobicContact CG-CZ 4.48Å; F547-S549 VanDerWaalsContact C-N 3.33Å; F547-S549 PolarHBondContact O-N 3.49Å; F547-L565 HydrophobicContact CE1-CD2 4.3Å; F547-L565 HydrophobicContact CZ-CD2 4.39Å; F547-N568 WeakPolarHBondContact CA-O 3.45Å; F547-N568 HydrophobicContact CD1-CB 4.12Å; F547-L569 HydrophobicContact CD1-CD2 4.22Å; F547-L569 HydrophobicContact CE1-CD2 3.62Å; F547-L569 HydrophobicContact CE1-CG 4.22Å; F547-L569 HydrophobicContact CZ-CD2 4.04Å
548	L	65.9	Low	64	Low	114 Å²	114	84.6 Å²	84.6	60%	0.597	45%	0.449	S	S	*	.	S	Bend	trans	-67.1	-31	175.7	-75.9	164.5	0	0	0	113.3	N568 K570	L548-N568 PolarHBondContact N-O 3.43Å; L548-K570 HydrophobicContact CD2-CD 4.03Å; L548-K570 HydrophobicContact CG-CB 4.34Å
549	S	59.5	Low	62.8	Low	52 Å²	52	81.4 Å²	81.4	36%	0.364	43%	0.432	S	S	.	.			trans	-148.5	130.1	175.4	65.9	0	0	0	0	111.2	F547	F547-S549 VanDerWaalsContact C-N 3.33Å; F547-S549 PolarHBondContact O-N 3.49Å
550	V	50.2	Low	61.4	Low	105 Å²	105	86.2 Å²	86.2	64%	0.636	45%	0.454	S	S	*	.	S	Bend	trans	-89.5	-18.8	177.7	-179.1	0	0	0	0	111.4	Q552	V550-Q552 PolarHBondContact O-N 3.49Å
551	D	44.3	Very low	60.1	Low	150 Å²	150	88.4 Å²	88.4	80%	0.802	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	7	-158.2	-70.1	-23.4	0	0	0	116.8
552	Q	42.9	Very low	59.2	Low	156 Å²	156	85.4 Å²	85.4	73%	0.729	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	8.8	179.2	-67.9	-167.1	-1.8	0	0	115.8	V550 I554	V550-Q552 PolarHBondContact O-N 3.49Å; Q552-I554 PolarHBondContact O-N 2.95Å
553	L	45.5	Very low	58.4	Low	96 Å²	96	82.2 Å²	82.2	50%	0.503	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	22.4	-177.4	-71.8	168.9	0	0	0	115.5	L565	L553-L565 HydrophobicContact CD2-CD2 3.74Å; L553-L565 HydrophobicContact CD2-CG 4.37Å
554	I	40.7	Very low	57.6	Low	161 Å²	161	85.2 Å²	85.2	83%	0.826	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-8.5	-171.1	-62.8	-179.2	0	0	0	115.4	Q552	Q552-I554 PolarHBondContact O-N 2.95Å
555	D	41.3	Very low	56.9	Low	125 Å²	125	85.1 Å²	85.1	67%	0.668	44%	0.441	S	S	*	.	S	Bend	trans	-102.9	129.2	-177	-135.1	-5.3	0	0	0	113.9	R557 L561	D555-R557 PolarHBondContact O-N 2.85Å; D555-L561 WeakPolarHBondContact O-CD1 3.24Å
556	D	40.6	Very low	56.5	Low	165 Å²	165	84.6 Å²	84.6	88%	0.882	44%	0.439	S	S	*	.			trans	-69	53.4	-172.9	-93	-33.7	0	0	0	113.8
557	R	42	Very low	56.4	Low	139 Å²	139	82.3 Å²	82.3	53%	0.525	43%	0.432	S	S	.	.			trans	-118.4	96.5	171.6	-66.1	-160.1	-67	139.5	10	111.1	D555 M559 E560 L561	D555-R557 PolarHBondContact O-N 2.85Å; R557-M559 PolarHBondContact O-N 3.32Å; R557-M559 VanDerWaalsContact O-N 3.1Å; R557-E560 IonicContact CZ-OE1 2.97Å; R557-E560 IonicContact CZ-OE2 3.66Å; R557-E560 VanDerWaalsContact NH1-CD 3.27Å; R557-E560 IonicContact NH1-OE1 3.89Å; R557-E560 PolarHBondContact NH1-OE1 2.92Å; R557-E560 IonicContact NH1-OE2 3.7Å; R557-E560 PolarHBondContact NH1-OE2 2.93Å; R557-E560 IonicContact NH2-OE2 3.54Å; R557-E560 PolarHBondContact NH2-OE2 2.97Å; R557-L561 WeakPolarHBondContact O-CD1 3.44Å; R557-L561 WeakPolarHBondContact O-CG 3.41Å
558	P	50.5	Low	56.6	Low	74 Å²	74	82.8 Å²	82.8	48%	0.481	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-7.8	-156.4	24.9	-35.4	0	0	0	118.7	I562 K731	P558-I562 WeakPolarHBondContact O-CG1 3.32Å; P558-K731 VanDerWaalsContact CG-NZ 3.31Å
559	M	46.7	Very low	57.5	Low	39 Å²	39	77.5 Å²	77.5	19%	0.192	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-34.9	-170.6	-75.1	-65.8	-67.1	0	0	116.2	R557 L561 I562 L723	R557-M559 PolarHBondContact O-N 3.32Å; R557-M559 VanDerWaalsContact O-N 3.1Å; M559-L561 PolarHBondContact O-N 3.24Å; M559-I562 PolarHBondContact O-N 3.49Å; M559-I562 HydrophobicContact SD-CD1 3.57Å; M559-I562 VanDerWaalsContact SD-CD1 3.57Å; M559-I562 HydrophobicContact SD-CG1 4.3Å; M559-L723 HydrophobicContact CE-CB 3.92Å
560	E	50.1	Low	58.8	Low	109 Å²	109	78.5 Å²	78.5	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-50.8	-42.1	163.3	-75.1	174.5	-159.5	0	0	108	R557 I562 D564	R557-E560 IonicContact CZ-OE1 2.97Å; R557-E560 IonicContact CZ-OE2 3.66Å; R557-E560 VanDerWaalsContact NH1-CD 3.27Å; R557-E560 IonicContact NH1-OE1 3.89Å; R557-E560 PolarHBondContact NH1-OE1 2.92Å; R557-E560 IonicContact NH1-OE2 3.7Å; R557-E560 PolarHBondContact NH1-OE2 2.93Å; R557-E560 IonicContact NH2-OE2 3.54Å; R557-E560 PolarHBondContact NH2-OE2 2.97Å; E560-I562 PolarHBondContact O-N 2.88Å; E560-D564 VanDerWaalsContact O-CB 3.26Å; E560-D564 WeakPolarHBondContact O-CB 3.44Å; E560-D564 PolarHBondContact O-N 3.31Å; E560-D564 VanDerWaalsContact O-N 3.16Å
561	L	53.8	Low	60.7	Low	50 Å²	50	73.5 Å²	73.5	26%	0.262	38%	0.377	S	S	.	.	H	α-helix	trans	-55.5	-33.5	173.8	-66.4	174.3	0	0	0	116.2	D555 R557 M559 L565	D555-L561 WeakPolarHBondContact O-CD1 3.24Å; R557-L561 WeakPolarHBondContact O-CD1 3.44Å; R557-L561 WeakPolarHBondContact O-CG 3.41Å; M559-L561 PolarHBondContact O-N 3.24Å; L561-L565 WeakPolarHBondContact O-CA 3.34Å; L561-L565 WeakPolarHBondContact O-CB 3.17Å; L561-L565 WeakPolarHBondContact O-CD1 3.31Å; L561-L565 WeakPolarHBondContact O-CG 3.41Å; L561-L565 PolarHBondContact O-N 3.49Å
562	I	62.5	Low	62.8	Low	25 Å²	25	68.7 Å²	68.7	13%	0.128	35%	0.351	C	S	.	.	H	α-helix	trans	-79.8	-42.1	-171.9	-61.1	-177.5	0	0	0	112.4	I501 P558 M559 E560 D564 L565 I566 Y603	I501-I562 HydrophobicContact CG2-CG2 3.34Å; P558-I562 WeakPolarHBondContact O-CG1 3.32Å; M559-I562 PolarHBondContact O-N 3.49Å; M559-I562 HydrophobicContact SD-CD1 3.57Å; M559-I562 VanDerWaalsContact SD-CD1 3.57Å; M559-I562 HydrophobicContact SD-CG1 4.3Å; E560-I562 PolarHBondContact O-N 2.88Å; I562-D564 VanDerWaalsContact C-N 3.3Å; I562-L565 WeakPolarHBondContact O-CB 3.27Å; I562-L565 PolarHBondContact O-N 2.77Å; I562-I566 PolarHBondContact O-N 3.12Å; I562-Y603 HydrophobicContact CG2-CE1 3.99Å; I562-Y603 WeakPolarHBondContact CG2-OH 3.16Å
563	F	69.2	Low	65.1	Low	2 Å²	2	61.8 Å²	61.8	1%	0.009	32%	0.318	C	S	.	.	H	α-helix	trans	-69.2	-37	174.4	-159.1	-98.3	0	0	0	110.4	I566 G567 Q600 V604 Y716 C719 L723	F563-I566 PolarHBondContact O-N 2.69Å; F563-G567 PolarHBondContact O-N 3.09Å; F563-Q600 HydrophobicContact CD2-CG 4.39Å; F563-Q600 HydrophobicContact CE1-CB 4.37Å; F563-Q600 HydrophobicContact CE1-CG 3.9Å; F563-Q600 VanDerWaalsContact CE1-NE2 3.33Å; F563-Q600 HydrophobicContact CE2-CB 3.66Å; F563-Q600 HydrophobicContact CE2-CG 3.74Å; F563-Q600 HydrophobicContact CZ-CB 3.5Å; F563-Q600 HydrophobicContact CZ-CG 3.49Å; F563-Q600 VanDerWaalsContact CZ-CG 3.49Å; F563-V604 HydrophobicContact CE2-CG2 4.13Å; F563-Y716 HydrophobicContact CD1-CD2 4.15Å; F563-Y716 AromaticContact CD1-CE2 3.41Å; F563-Y716 HydrophobicContact CD1-CE2 3.41Å; F563-Y716 VanDerWaalsContact CD1-CE2 3.41Å; F563-Y716 AromaticContact CD1-CZ 3.68Å; F563-Y716 AromaticContact CE1-CD2 3.44Å; F563-Y716 HydrophobicContact CE1-CD2 3.44Å; F563-Y716 VanDerWaalsContact CE1-CD2 3.44Å; F563-Y716 AromaticContact CE1-CE2 3.13Å; F563-Y716 HydrophobicContact CE1-CE2 3.13Å; F563-Y716 HydrophobicContact CE1-CG 4.39Å; F563-Y716 AromaticContact CE1-CZ 3.86Å; F563-Y716 HydrophobicContact CZ-CD2 4.3Å; F563-Y716 HydrophobicContact CZ-CE2 4.33Å; F563-C719 HydrophobicContact CE2-CB 3.79Å; F563-C719 HydrophobicContact CZ-CB 3.73Å; F563-L723 HydrophobicContact CB-CD1 4.06Å; F563-L723 HydrophobicContact CD2-CD1 3.69Å; F563-L723 HydrophobicContact CG-CD1 4.26Å
564	D	69.6	Low	67.1	Low	64 Å²	64	62.8 Å²	62.8	34%	0.342	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-37.1	172.3	-63.9	-16.4	0	0	0	111.7	E560 I562 I566 G567 N568 Y716	E560-D564 VanDerWaalsContact O-CB 3.26Å; E560-D564 WeakPolarHBondContact O-CB 3.44Å; E560-D564 PolarHBondContact O-N 3.31Å; E560-D564 VanDerWaalsContact O-N 3.16Å; I562-D564 VanDerWaalsContact C-N 3.3Å; D564-I566 PolarHBondContact O-N 3.18Å; D564-G567 CarbonylContact O-C 3.55Å; D564-G567 WeakPolarHBondContact O-CA 3.48Å; D564-G567 PolarHBondContact O-N 3.06Å; D564-N568 VanDerWaalsContact O-CB 3.31Å; D564-N568 WeakPolarHBondContact O-CB 3.43Å; D564-N568 PolarHBondContact O-N 2.99Å; D564-N568 PolarHBondContact O-ND2 3.45Å; D564-Y716 PolarHBondContact OD1-OH 3.42Å
565	L	72.2	Confident	69.3	Low	39 Å²	39	56.2 Å²	56.2	20%	0.204	29%	0.286	C	S	.	.	H	α-helix	trans	-60	-46.1	174.5	-87.2	166.7	0	0	0	111.1	F547 L553 L561 I562 N568 L569	F547-L565 HydrophobicContact CE1-CD2 4.3Å; F547-L565 HydrophobicContact CZ-CD2 4.39Å; L553-L565 HydrophobicContact CD2-CD2 3.74Å; L553-L565 HydrophobicContact CD2-CG 4.37Å; L561-L565 WeakPolarHBondContact O-CA 3.34Å; L561-L565 WeakPolarHBondContact O-CB 3.17Å; L561-L565 WeakPolarHBondContact O-CD1 3.31Å; L561-L565 WeakPolarHBondContact O-CG 3.41Å; L561-L565 PolarHBondContact O-N 3.49Å; I562-L565 WeakPolarHBondContact O-CB 3.27Å; I562-L565 PolarHBondContact O-N 2.77Å; L565-N568 PolarHBondContact O-N 3.3Å; L565-L569 PolarHBondContact O-N 2.8Å
566	I	78.8	Confident	71.5	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-41.6	174.3	-63.4	174.9	0	0	0	110.1	I501 I562 F563 D564 N568 L569 L599 Q600 Y603	I501-I566 HydrophobicContact CD1-CD1 4.09Å; I501-I566 HydrophobicContact CD1-CG1 3.96Å; I562-I566 PolarHBondContact O-N 3.12Å; F563-I566 PolarHBondContact O-N 2.69Å; D564-I566 PolarHBondContact O-N 3.18Å; I566-N568 PolarHBondContact O-N 3.22Å; I566-L569 WeakPolarHBondContact O-CB 3.43Å; I566-L569 PolarHBondContact O-N 2.71Å; I566-L569 VanDerWaalsContact O-N 3.15Å; I566-L599 HydrophobicContact CG2-CB 4.37Å; I566-L599 HydrophobicContact CG2-CD2 3.86Å; I566-L599 HydrophobicContact CG2-CG 4.06Å; I566-Q600 HydrophobicContact CB-CG 4.5Å; I566-Q600 HydrophobicContact CG2-CG 3.81Å; I566-Y603 HydrophobicContact CD1-CD1 3.5Å; I566-Y603 HydrophobicContact CD1-CD2 4.1Å; I566-Y603 HydrophobicContact CD1-CE1 3.98Å; I566-Y603 HydrophobicContact CD1-CG 3.54Å
567	G	80.5	Confident	73.7	Confident	24 Å²	24	47.3 Å²	47.3	25%	0.247	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-29.7	175.8	0	0	0	0	0	113.8	F563 D564	F563-G567 PolarHBondContact O-N 3.09Å; D564-G567 CarbonylContact O-C 3.55Å; D564-G567 WeakPolarHBondContact O-CA 3.48Å; D564-G567 PolarHBondContact O-N 3.06Å
568	N	80.8	Confident	75.8	Confident	49 Å²	49	40.8 Å²	40.8	26%	0.262	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-7.4	179.9	-70.9	-25.9	0	0	0	113.7	F547 L548 D564 L565 I566	F547-N568 WeakPolarHBondContact CA-O 3.45Å; F547-N568 HydrophobicContact CD1-CB 4.12Å; L548-N568 PolarHBondContact N-O 3.43Å; D564-N568 VanDerWaalsContact O-CB 3.31Å; D564-N568 WeakPolarHBondContact O-CB 3.43Å; D564-N568 PolarHBondContact O-N 2.99Å; D564-N568 PolarHBondContact O-ND2 3.45Å; L565-N568 PolarHBondContact O-N 3.3Å; I566-N568 PolarHBondContact O-N 3.22Å
569	L	84.9	Confident	77.5	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	139.2	175.2	-73.3	172.1	0	0	0	110	L509 L511 F547 L565 I566 I596 L599	L509-L569 HydrophobicContact CD2-CD1 4.44Å; L509-L569 HydrophobicContact CD2-CD2 3.85Å; L511-L569 HydrophobicContact CD2-CD2 4.16Å; F547-L569 HydrophobicContact CD1-CD2 4.22Å; F547-L569 HydrophobicContact CE1-CD2 3.62Å; F547-L569 HydrophobicContact CE1-CG 4.22Å; F547-L569 HydrophobicContact CZ-CD2 4.04Å; L565-L569 PolarHBondContact O-N 2.8Å; I566-L569 WeakPolarHBondContact O-CB 3.43Å; I566-L569 PolarHBondContact O-N 2.71Å; I566-L569 VanDerWaalsContact O-N 3.15Å; L569-I596 HydrophobicContact CB-CD1 3.73Å; L569-I596 WeakPolarHBondContact O-CD1 3.05Å; L569-I596 WeakPolarHBondContact O-CG1 3.44Å; L569-L599 HydrophobicContact CD1-CD2 4.15Å
570	K	87.2	Confident	79.6	Confident	73 Å²	73	37 Å²	37	32%	0.317	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128.4	171.4	-172.1	-178.1	179.4	-171.3	0	108.5	F545 D546 L548 N572	F545-K570 CarbonylContact C-O 3.51Å; F545-K570 WeakPolarHBondContact CA-O 3.49Å; D546-K570 PolarHBondContact N-O 2.9Å; D546-K570 PolarHBondContact O-N 3.24Å; L548-K570 HydrophobicContact CD2-CD 4.03Å; L548-K570 HydrophobicContact CG-CB 4.34Å; K570-N572 WeakPolarHBondContact CD-OD1 3.06Å; K570-N572 WeakPolarHBondContact CE-OD1 3.03Å
571	L	90.3	Very high	81.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	109.4	169.7	-179.8	63.2	0	0	0	107.9	V481 Y482 L518 L543 F545 N592 F595	V481-L571 HydrophobicContact CG1-CD2 3.56Å; Y482-L571 HydrophobicContact CD1-CD2 4.13Å; Y482-L571 HydrophobicContact CE1-CB 3.77Å; Y482-L571 HydrophobicContact CE1-CD2 3.81Å; Y482-L571 HydrophobicContact CE1-CG 3.95Å; Y482-L571 HydrophobicContact CE2-CD2 4.36Å; Y482-L571 PolarHBondContact OH-O 3.13Å; L518-L571 HydrophobicContact CD1-CD1 4.49Å; L543-L571 HydrophobicContact CB-CD1 4.27Å; L543-L571 HydrophobicContact CD2-CD1 4.34Å; L543-L571 HydrophobicContact CD2-CD2 4.34Å; L543-L571 HydrophobicContact CD2-CG 4.28Å; F545-L571 HydrophobicContact CD1-CB 4.27Å; F545-L571 HydrophobicContact CD1-CD1 4.11Å; F545-L571 HydrophobicContact CD2-CD1 4.38Å; F545-L571 HydrophobicContact CE1-CB 3.99Å; F545-L571 HydrophobicContact CE1-CD1 3.89Å; F545-L571 HydrophobicContact CE1-CG 4.43Å; F545-L571 HydrophobicContact CE2-CD1 4.18Å; F545-L571 HydrophobicContact CG-CD1 4.35Å; F545-L571 HydrophobicContact CZ-CD1 3.92Å; L571-N592 PolarHBondContact N-OD1 2.62Å; L571-N592 PolarHBondContact O-ND2 2.94Å; L571-N592 PolarHBondContact O-OD1 3.42Å; L571-N592 VanDerWaalsContact O-OD1 3.08Å; L571-F595 HydrophobicContact CB-CE1 4.45Å
572	N	89.7	Confident	83.3	Confident	48 Å²	48	30.7 Å²	30.7	26%	0.257	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.4	174.2	-69.3	-28.9	0	0	0	108.9	L543 A544 D546 K570	L543-N572 WeakPolarHBondContact CA-O 3.31Å; A544-N572 PolarHBondContact N-O 3.37Å; A544-N572 WeakPolarHBondContact O-CB 3.41Å; A544-N572 PolarHBondContact O-N 3.36Å; D546-N572 WeakPolarHBondContact CB-ND2 3.43Å; D546-N572 PolarHBondContact OD2-ND2 2.94Å; K570-N572 WeakPolarHBondContact CD-OD1 3.06Å; K570-N572 WeakPolarHBondContact CE-OD1 3.03Å
573	Y	90.3	Very high	84.6	Confident	11 Å²	11	29.7 Å²	29.7	4%	0.043	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	108.2	167.8	-175.6	-158.7	0	0	0	108.1	C474 V477 Y482 E539 F542 L543 L575	C474-Y573 WeakPolarHBondContact CA-OH 3.47Å; C474-Y573 HydrophobicContact CB-CE1 4.04Å; C474-Y573 PolarHBondContact SG-OH 2.95Å; C474-Y573 VanDerWaalsContact SG-OH 3.34Å; V477-Y573 HydrophobicContact CB-CE1 4.4Å; V477-Y573 HydrophobicContact CG1-CE1 4.24Å; V477-Y573 HydrophobicContact CG1-CE2 4.43Å; Y482-Y573 WeakPolarHBondContact OH-CB 3.34Å; Y482-Y573 PolarHBondContact OH-N 2.92Å; E539-Y573 PolarHBondContact OE2-OH 3.34Å; E539-Y573 VanDerWaalsContact OE2-OH 3.11Å; F542-Y573 HydrophobicContact CB-CD2 4.13Å; F542-Y573 HydrophobicContact CB-CE2 4.01Å; L543-Y573 HydrophobicContact CD2-CD2 3.64Å; L543-Y573 HydrophobicContact CD2-CE2 4.45Å; L543-Y573 HydrophobicContact CD2-CG 3.76Å; L543-Y573 HydrophobicContact CG-CD2 4.12Å; Y573-L575 HydrophobicContact CD1-CD1 4.24Å; Y573-L575 HydrophobicContact CD1-CD2 3.58Å; Y573-L575 HydrophobicContact CD1-CG 3.94Å; Y573-L575 HydrophobicContact CD2-CD2 4.29Å; Y573-L575 HydrophobicContact CE1-CD2 3.32Å; Y573-L575 HydrophobicContact CE1-CG 4.2Å; Y573-L575 HydrophobicContact CE2-CD2 4.04Å; Y573-L575 HydrophobicContact CG-CD2 4.06Å; Y573-L575 HydrophobicContact CG-CG 4.18Å; Y573-L575 PolarHBondContact O-N 3.25Å
574	H	88.1	Confident	85.6	Confident	118 Å²	118	32.7 Å²	32.7	55%	0.546	17%	0.17	S	C	.	.			trans	-70.2	117.8	178.3	-171.6	57.2	0	0	0	108.8	R469 F542 D576	R469-H574 PolarHBondContact NH1-O 2.94Å; R469-H574 PolarHBondContact NH2-O 3.37Å; F542-H574 HydrophobicContact CB-CB 4.33Å; F542-H574 HydrophobicContact CD1-CB 4.44Å; F542-H574 PolarHBondContact O-N 3.33Å; H574-D576 IonicContact NE2-OD1 3.78Å
575	L	86.7	Confident	86.6	Confident	22 Å²	22	38.1 Å²	38.1	12%	0.115	19%	0.193	C	C	.	.			trans	-120.5	126.6	-175.1	-71.4	177.4	0	0	0	111.2	C474 Y573 A579 N580 L583 I588	C474-L575 HydrophobicContact CB-CD2 3.97Å; Y573-L575 HydrophobicContact CD1-CD1 4.24Å; Y573-L575 HydrophobicContact CD1-CD2 3.58Å; Y573-L575 HydrophobicContact CD1-CG 3.94Å; Y573-L575 HydrophobicContact CD2-CD2 4.29Å; Y573-L575 HydrophobicContact CE1-CD2 3.32Å; Y573-L575 HydrophobicContact CE1-CG 4.2Å; Y573-L575 HydrophobicContact CE2-CD2 4.04Å; Y573-L575 HydrophobicContact CG-CD2 4.06Å; Y573-L575 HydrophobicContact CG-CG 4.18Å; Y573-L575 PolarHBondContact O-N 3.25Å; L575-A579 HydrophobicContact CD2-CB 4.11Å; L575-N580 HydrophobicContact CB-CB 4.42Å; L575-L583 HydrophobicContact CD1-CB 3.33Å; L575-L583 HydrophobicContact CD1-CD1 3.87Å; L575-L583 HydrophobicContact CD1-CG 4.24Å; L575-L583 WeakPolarHBondContact CD1-O 3.15Å; L575-L583 HydrophobicContact CD2-CD1 4.33Å; L575-I588 HydrophobicContact CD1-CD1 3.63Å; L575-I588 HydrophobicContact CD1-CG1 4.27Å
576	D	86.5	Confident	87.5	Confident	71 Å²	71	44.1 Å²	44.1	38%	0.38	22%	0.217	S	C	.	.			trans	-92.5	164.7	172.4	-55.8	-47.3	0	0	0	110.6	R469 H574 A579 N580	R469-D576 IonicContact CZ-OD2 3.42Å; R469-D576 IonicContact NE-OD2 2.63Å; R469-D576 PolarHBondContact NE-OD2 2.92Å; R469-D576 IonicContact NH2-OD1 3.68Å; R469-D576 IonicContact NH2-OD2 3.16Å; R469-D576 PolarHBondContact NH2-OD2 3.09Å; H574-D576 IonicContact NE2-OD1 3.78Å; D576-A579 WeakPolarHBondContact O-CB 3.12Å; D576-A579 PolarHBondContact O-N 3.21Å; D576-N580 PolarHBondContact O-N 3.35Å
577	W	86.7	Confident	88.2	Confident	32 Å²	32	44.2 Å²	44.2	12%	0.121	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	138.8	166.1	-173.2	94.4	0	0	0	109.7	P329 G330 L371 A374 V375 E378 L468 N580	P329-W577 PolarHBondContact O-NE1 3.37Å; G330-W577 PolarHBondContact O-NE1 2.89Å; L371-W577 HydrophobicContact CD1-CZ2 3.87Å; A374-W577 HydrophobicContact CB-CH2 3.95Å; A374-W577 HydrophobicContact CB-CZ2 4.01Å; V375-W577 HydrophobicContact CB-CH2 4.01Å; V375-W577 HydrophobicContact CB-CZ3 4.45Å; V375-W577 HydrophobicContact CG2-CH2 3.32Å; V375-W577 HydrophobicContact CG2-CZ2 3.9Å; V375-W577 HydrophobicContact CG2-CZ3 3.96Å; E378-W577 HydrophobicContact CB-CZ3 3.96Å; E378-W577 HydrophobicContact CG-CE3 4.24Å; E378-W577 HydrophobicContact CG-CH2 4.25Å; E378-W577 HydrophobicContact CG-CZ3 3.62Å; L468-W577 HydrophobicContact CD1-CE3 4.49Å; L468-W577 HydrophobicContact CD1-CZ3 4.07Å; W577-N580 WeakPolarHBondContact CA-OD1 3.4Å
578	P	86.9	Confident	88.7	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.019	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	cis	-94.6	3	8.1	36.1	-35.1	0	0	0	115.2	V375 L457 V471 N580 I581	V375-P578 HydrophobicContact CG2-CB 4.36Å; V375-P578 HydrophobicContact CG2-CG 4.46Å; L457-P578 HydrophobicContact CD2-CB 4.08Å; L457-P578 HydrophobicContact CD2-CG 3.65Å; V471-P578 HydrophobicContact CG2-CG 4.3Å; P578-N580 VanDerWaalsContact C-N 3.27Å; P578-N580 PolarHBondContact O-N 3.11Å; P578-I581 HydrophobicContact CB-CD1 3.85Å; P578-I581 WeakPolarHBondContact O-CB 3.36Å; P578-I581 VanDerWaalsContact O-CG1 3.3Å; P578-I581 WeakPolarHBondContact O-CG1 3.28Å; P578-I581 PolarHBondContact O-N 2.97Å
579	A	87.2	Confident	89.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-61.4	-35.8	-176.9	0	0	0	0	0	112.9	C474 L575 D576 I581 I582 L583	C474-A579 HydrophobicContact CB-CB 3.94Å; C474-A579 VanDerWaalsContact SG-CB 3.57Å; L575-A579 HydrophobicContact CD2-CB 4.11Å; D576-A579 WeakPolarHBondContact O-CB 3.12Å; D576-A579 PolarHBondContact O-N 3.21Å; A579-I581 PolarHBondContact O-N 3.36Å; A579-I581 VanDerWaalsContact O-N 3.16Å; A579-I582 PolarHBondContact O-N 3.01Å; A579-L583 PolarHBondContact O-N 3.1Å
580	N	89.6	Confident	89.7	Confident	34 Å²	34	44.5 Å²	44.5	18%	0.182	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-66.6	-8	178.4	65.4	0.8	0	0	0	115.1	P332 L575 D576 W577 P578 L583	P332-N580 HydrophobicContact CB-CB 4.3Å; L575-N580 HydrophobicContact CB-CB 4.42Å; D576-N580 PolarHBondContact O-N 3.35Å; W577-N580 WeakPolarHBondContact CA-OD1 3.4Å; P578-N580 VanDerWaalsContact C-N 3.27Å; P578-N580 PolarHBondContact O-N 3.11Å; N580-L583 WeakPolarHBondContact CA-O 3.31Å
581	I	89.9	Confident	90	Very high	18 Å²	18	41.3 Å²	41.3	9%	0.092	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-68.7	-39	172.9	-59.9	171.2	0	0	0	110.7	W335 L371 P578 A579 F684	W335-I581 HydrophobicContact CB-CG2 3.85Å; L371-I581 HydrophobicContact CD1-CD1 3.48Å; L371-I581 VanDerWaalsContact CD1-CD1 3.48Å; L371-I581 HydrophobicContact CD2-CD1 4.11Å; L371-I581 HydrophobicContact CG-CD1 4.44Å; P578-I581 HydrophobicContact CB-CD1 3.85Å; P578-I581 WeakPolarHBondContact O-CB 3.36Å; P578-I581 VanDerWaalsContact O-CG1 3.3Å; P578-I581 WeakPolarHBondContact O-CG1 3.28Å; P578-I581 PolarHBondContact O-N 2.97Å; A579-I581 PolarHBondContact O-N 3.36Å; A579-I581 VanDerWaalsContact O-N 3.16Å; I581-F684 HydrophobicContact CG2-CE1 4.11Å; I581-F684 HydrophobicContact CG2-CZ 3.94Å
582	I	91.3	Very high	90.2	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.041	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-44.4	179.9	-55.1	-163.6	0	0	0	110.7	V471 L475 A579 D584 F684 L687 V688 H691	V471-I582 HydrophobicContact CG1-CB 4.3Å; V471-I582 HydrophobicContact CG1-CD1 3.6Å; V471-I582 HydrophobicContact CG1-CG1 4.03Å; L475-I582 HydrophobicContact CD2-CG2 4.24Å; A579-I582 PolarHBondContact O-N 3.01Å; I582-D584 VanDerWaalsContact C-N 3.33Å; I582-D584 PolarHBondContact O-N 2.8Å; I582-F684 HydrophobicContact CD1-CE2 3.68Å; I582-F684 HydrophobicContact CD1-CZ 3.77Å; I582-F684 HydrophobicContact CG1-CE2 4.17Å; I582-F684 HydrophobicContact CG1-CZ 3.77Å; I582-L687 HydrophobicContact CD1-CD2 3.32Å; I582-L687 HydrophobicContact CD1-CG 3.64Å; I582-V688 HydrophobicContact CD1-CG2 4.44Å; I582-V688 HydrophobicContact CG1-CG2 4.37Å; I582-H691 HydrophobicContact CG2-CB 4.05Å; I582-H691 WeakPolarHBondContact CG2-ND1 3.39Å; I582-H691 PolarHBondContact O-CE1 2.9Å
583	L	91.3	Very high	90.3	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	22%	0.216	C	C	.	.	S	Bend	trans	-91.9	70.1	177.8	-69.5	173.5	0	0	0	109.6	C474 L475 L575 A579 N580 S587 Y591	C474-L583 HydrophobicContact CB-CD1 3.76Å; L475-L583 HydrophobicContact CD2-CD1 4.28Å; L475-L583 HydrophobicContact CD2-CD2 3.93Å; L475-L583 HydrophobicContact CD2-CG 4.01Å; L575-L583 HydrophobicContact CD1-CB 3.33Å; L575-L583 HydrophobicContact CD1-CD1 3.87Å; L575-L583 HydrophobicContact CD1-CG 4.24Å; L575-L583 WeakPolarHBondContact CD1-O 3.15Å; L575-L583 HydrophobicContact CD2-CD1 4.33Å; A579-L583 PolarHBondContact O-N 3.1Å; N580-L583 WeakPolarHBondContact CA-O 3.31Å; L583-S587 VanDerWaalsContact CA-OG 3.31Å; L583-S587 WeakPolarHBondContact CA-OG 3.43Å; L583-Y591 HydrophobicContact CD2-CD2 4.33Å; L583-Y591 HydrophobicContact CD2-CE2 3.75Å
584	D	90.1	Very high	90.5	Very high	66 Å²	66	42.9 Å²	42.9	35%	0.353	21%	0.214	S	C	.	.			trans	-72.4	169.3	173.3	70	-17.2	0	0	0	112.4	I582 K586 S587 I588	I582-D584 VanDerWaalsContact C-N 3.33Å; I582-D584 PolarHBondContact O-N 2.8Å; D584-K586 PolarHBondContact O-N 2.63Å; D584-K586 VanDerWaalsContact O-N 3.1Å; D584-S587 PolarHBondContact N-OG 3.32Å; D584-S587 PolarHBondContact O-N 3.19Å; D584-S587 VanDerWaalsContact O-N 3.16Å; D584-S587 PolarHBondContact O-OG 3.43Å; D584-S587 WeakPolarHBondContact OD1-CB 3.28Å; D584-S587 PolarHBondContact OD1-N 3.27Å; D584-S587 PolarHBondContact OD1-OG 3.47Å; D584-I588 WeakPolarHBondContact O-CG1 3.38Å; D584-I588 PolarHBondContact O-N 3Å
585	E	89.5	Confident	90.7	Very high	178 Å²	178	37.2 Å²	37.2	83%	0.832	19%	0.188	S	C	*	.	H	α-helix	trans	-55.6	-32.4	178.1	-65.5	178.6	171.3	0	0	112.9	G589	E585-G589 PolarHBondContact O-N 2.88Å
586	K	91.2	Very high	90.9	Very high	165 Å²	165	36.9 Å²	36.9	72%	0.717	19%	0.186	S	C	*	.	H	α-helix	trans	-69.4	-47.1	178.9	-63.7	-179.5	179.2	178.4	0	111.7	D584 G589 I590	D584-K586 PolarHBondContact O-N 2.63Å; D584-K586 VanDerWaalsContact O-N 3.1Å; K586-G589 PolarHBondContact O-N 3.35Å; K586-I590 WeakPolarHBondContact O-CG1 3.42Å; K586-I590 PolarHBondContact O-N 3.27Å; K586-I590 VanDerWaalsContact O-N 3.09Å
587	S	92.6	Very high	91.2	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.014	17%	0.17	C	C	.	.	H	α-helix	trans	-65.3	-39.8	177.8	56.3	0	0	0	0	112.2	L583 D584 G589 I590 Y591 L695	L583-S587 VanDerWaalsContact CA-OG 3.31Å; L583-S587 WeakPolarHBondContact CA-OG 3.43Å; D584-S587 PolarHBondContact N-OG 3.32Å; D584-S587 PolarHBondContact O-N 3.19Å; D584-S587 VanDerWaalsContact O-N 3.16Å; D584-S587 PolarHBondContact O-OG 3.43Å; D584-S587 WeakPolarHBondContact OD1-CB 3.28Å; D584-S587 PolarHBondContact OD1-N 3.27Å; D584-S587 PolarHBondContact OD1-OG 3.47Å; S587-G589 VanDerWaalsContact C-N 3.28Å; S587-G589 PolarHBondContact O-N 2.88Å; S587-I590 PolarHBondContact O-N 3.25Å; S587-Y591 WeakPolarHBondContact O-CD2 3.32Å; S587-Y591 PolarHBondContact O-N 3.48Å; S587-L695 VanDerWaalsContact CB-CD1 3.44Å
588	I	93	Very high	91.4	Very high	28 Å²	28	33 Å²	33	14%	0.144	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-37	173.2	-61.9	169.9	0	0	0	111.2	L575 D584 Y591 N592	L575-I588 HydrophobicContact CD1-CD1 3.63Å; L575-I588 HydrophobicContact CD1-CG1 4.27Å; D584-I588 WeakPolarHBondContact O-CG1 3.38Å; D584-I588 PolarHBondContact O-N 3Å; I588-Y591 PolarHBondContact O-N 2.91Å; I588-N592 WeakPolarHBondContact CG2-ND2 3.45Å; I588-N592 WeakPolarHBondContact O-CB 3.32Å; I588-N592 PolarHBondContact O-N 3.14Å; I588-N592 PolarHBondContact O-ND2 3.33Å
589	G	91.8	Very high	91.6	Very high	26 Å²	26	32.9 Å²	32.9	27%	0.268	17%	0.167	S	C	.	.	H	α-helix	trans	-56.9	-49.9	171.8	0	0	0	0	0	111.8	E585 K586 S587 Y591 N592 D593	E585-G589 PolarHBondContact O-N 2.88Å; K586-G589 PolarHBondContact O-N 3.35Å; S587-G589 VanDerWaalsContact C-N 3.28Å; S587-G589 PolarHBondContact O-N 2.88Å; G589-Y591 PolarHBondContact O-N 3.43Å; G589-N592 WeakPolarHBondContact O-CB 3.42Å; G589-N592 PolarHBondContact O-N 3.12Å; G589-N592 VanDerWaalsContact O-N 3.14Å; G589-D593 VanDerWaalsContact O-CG 3.26Å; G589-D593 PolarHBondContact O-N 3.05Å
590	I	93	Very high	91.7	Very high	29 Å²	29	33.6 Å²	33.6	15%	0.149	17%	0.17	C	C	.	.	H	α-helix	trans	-60.9	-43.6	177.8	-62.8	174	0	0	0	111.7	K586 S587 N592 D593 V594 L695 Q699	K586-I590 WeakPolarHBondContact O-CG1 3.42Å; K586-I590 PolarHBondContact O-N 3.27Å; K586-I590 VanDerWaalsContact O-N 3.09Å; S587-I590 PolarHBondContact O-N 3.25Å; I590-N592 VanDerWaalsContact C-N 3.31Å; I590-N592 PolarHBondContact O-N 3.38Å; I590-D593 PolarHBondContact O-N 2.98Å; I590-V594 WeakPolarHBondContact O-CG2 3.5Å; I590-V594 PolarHBondContact O-N 3.37Å; I590-L695 HydrophobicContact CB-CD2 4.31Å; I590-L695 HydrophobicContact CD1-CB 4.19Å; I590-L695 HydrophobicContact CD1-CD1 4.29Å; I590-L695 HydrophobicContact CG2-CB 4.26Å; I590-L695 HydrophobicContact CG2-CD2 3.99Å; I590-Q699 HydrophobicContact CG2-CG 3.47Å; I590-Q699 VanDerWaalsContact CG2-CG 3.47Å
591	Y	95.3	Very high	91.8	Very high	5 Å²	5	32 Å²	32	2%	0.02	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-40.1	176	-83.8	-63.9	0	0	0	112.3	A478 Y482 L483 L583 S587 I588 G589 V594 F595 H691 L694 L695 L698	A478-Y591 HydrophobicContact CB-CE2 4.35Å; Y482-Y591 HydrophobicContact CG-CD1 4.44Å; Y482-Y591 HydrophobicContact CG-CG 4.36Å; L483-Y591 HydrophobicContact CD1-CE1 4.14Å; L483-Y591 HydrophobicContact CD2-CD1 3.97Å; L483-Y591 HydrophobicContact CD2-CE1 4.09Å; L483-Y591 HydrophobicContact CG-CD1 4.32Å; L483-Y591 HydrophobicContact CG-CE1 4.12Å; L583-Y591 HydrophobicContact CD2-CD2 4.33Å; L583-Y591 HydrophobicContact CD2-CE2 3.75Å; S587-Y591 WeakPolarHBondContact O-CD2 3.32Å; S587-Y591 PolarHBondContact O-N 3.48Å; I588-Y591 PolarHBondContact O-N 2.91Å; G589-Y591 PolarHBondContact O-N 3.43Å; Y591-V594 PolarHBondContact O-N 2.89Å; Y591-F595 VanDerWaalsContact O-CB 3.28Å; Y591-F595 WeakPolarHBondContact O-CB 3.45Å; Y591-F595 PolarHBondContact O-N 3.31Å; Y591-H691 AromaticContact CE2-NE2 3.65Å; Y591-H691 PolarHBondContact OH-NE2 3.12Å; Y591-L694 WeakPolarHBondContact OH-CD2 3.31Å; Y591-L695 HydrophobicContact CD2-CD2 4.01Å; Y591-L695 HydrophobicContact CE1-CD2 4.28Å; Y591-L695 HydrophobicContact CE2-CD2 3.63Å; Y591-L695 HydrophobicContact CG-CD2 4.48Å; Y591-L698 HydrophobicContact CE1-CD1 4.19Å
592	N	93.6	Very high	91.9	Very high	9 Å²	9	32.2 Å²	32.2	5%	0.048	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-47.9	174.5	-88.3	-71.7	0	0	0	111.7	L571 I588 G589 I590 V594 F595 I596	L571-N592 PolarHBondContact N-OD1 2.62Å; L571-N592 PolarHBondContact O-ND2 2.94Å; L571-N592 PolarHBondContact O-OD1 3.42Å; L571-N592 VanDerWaalsContact O-OD1 3.08Å; I588-N592 WeakPolarHBondContact CG2-ND2 3.45Å; I588-N592 WeakPolarHBondContact O-CB 3.32Å; I588-N592 PolarHBondContact O-N 3.14Å; I588-N592 PolarHBondContact O-ND2 3.33Å; G589-N592 WeakPolarHBondContact O-CB 3.42Å; G589-N592 PolarHBondContact O-N 3.12Å; G589-N592 VanDerWaalsContact O-N 3.14Å; I590-N592 VanDerWaalsContact C-N 3.31Å; I590-N592 PolarHBondContact O-N 3.38Å; N592-V594 VanDerWaalsContact C-N 3.26Å; N592-V594 PolarHBondContact O-N 3.38Å; N592-F595 PolarHBondContact O-N 2.9Å; N592-F595 VanDerWaalsContact O-N 3.1Å; N592-I596 WeakPolarHBondContact O-CB 3.25Å; N592-I596 WeakPolarHBondContact O-CG1 3.46Å; N592-I596 PolarHBondContact O-N 3.35Å
593	D	92	Very high	91.8	Very high	83 Å²	83	31.8 Å²	31.8	44%	0.444	16%	0.16	S	C	.	.	H	α-helix	trans	-57.4	-42.6	179.2	-61.8	-26.7	0	0	0	111.2	G589 I590 F597 L704	G589-D593 VanDerWaalsContact O-CG 3.26Å; G589-D593 PolarHBondContact O-N 3.05Å; I590-D593 PolarHBondContact O-N 2.98Å; D593-F597 WeakPolarHBondContact O-CB 3.42Å; D593-F597 PolarHBondContact O-N 2.88Å; D593-L704 HydrophobicContact CB-CD1 3.62Å; D593-L704 HydrophobicContact CB-CD2 4.38Å
594	V	93.3	Very high	91.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.4	-47.4	175.2	170.8	0	0	0	0	111.3	L483 I590 Y591 N592 I596 F597 L598 I652 L698 C702 L704	L483-V594 HydrophobicContact CD2-CB 4.47Å; L483-V594 HydrophobicContact CD2-CG1 3.64Å; I590-V594 WeakPolarHBondContact O-CG2 3.5Å; I590-V594 PolarHBondContact O-N 3.37Å; Y591-V594 PolarHBondContact O-N 2.89Å; N592-V594 VanDerWaalsContact C-N 3.26Å; N592-V594 PolarHBondContact O-N 3.38Å; V594-I596 PolarHBondContact O-N 2.94Å; V594-F597 PolarHBondContact O-N 3.47Å; V594-L598 HydrophobicContact CG1-CD1 4.15Å; V594-L598 WeakPolarHBondContact O-CG 3.47Å; V594-L598 PolarHBondContact O-N 3.44Å; V594-I652 HydrophobicContact CG1-CD1 4.41Å; V594-L698 HydrophobicContact CG2-CB 4.2Å; V594-C702 HydrophobicContact CG2-CB 4.24Å; V594-L704 HydrophobicContact CB-CD1 4.44Å; V594-L704 HydrophobicContact CG2-CD1 3.64Å
595	F	93.5	Very high	91.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.6	-46.4	-179.8	172.2	-101.4	0	0	0	111.8	Y482 F484 M490 F493 F545 L571 Y591 N592 L598 L599	Y482-F595 HydrophobicContact CD1-CB 3.86Å; Y482-F595 HydrophobicContact CD1-CG 4.28Å; Y482-F595 WeakPolarHBondContact O-CB 3.12Å; F484-F595 HydrophobicContact CD2-CD2 4.43Å; F484-F595 AromaticContact CE2-CD2 3.78Å; F484-F595 HydrophobicContact CE2-CD2 3.78Å; F484-F595 AromaticContact CE2-CE2 3.86Å; F484-F595 HydrophobicContact CE2-CE2 3.86Å; F484-F595 HydrophobicContact CZ-CD2 4.31Å; F484-F595 AromaticContact CZ-CE2 3.91Å; F484-F595 HydrophobicContact CZ-CE2 3.91Å; M490-F595 HydrophobicContact CE-CE2 3.98Å; F493-F595 HydrophobicContact CE1-CZ 4.36Å; F545-F595 AromaticContact CE1-CE1 3.95Å; F545-F595 HydrophobicContact CE1-CE1 3.95Å; F545-F595 HydrophobicContact CE1-CZ 4.16Å; F545-F595 HydrophobicContact CZ-CE1 4.48Å; F545-F595 HydrophobicContact CZ-CZ 4.24Å; L571-F595 HydrophobicContact CB-CE1 4.45Å; Y591-F595 VanDerWaalsContact O-CB 3.28Å; Y591-F595 WeakPolarHBondContact O-CB 3.45Å; Y591-F595 PolarHBondContact O-N 3.31Å; N592-F595 PolarHBondContact O-N 2.9Å; N592-F595 VanDerWaalsContact O-N 3.1Å; F595-L598 PolarHBondContact O-N 2.91Å; F595-L599 HydrophobicContact CE1-CD2 4.13Å; F595-L599 HydrophobicContact CZ-CD2 4.31Å; F595-L599 VanDerWaalsContact O-CB 3.32Å; F595-L599 WeakPolarHBondContact O-CB 3.49Å; F595-L599 PolarHBondContact O-N 3.31Å
596	I	91.4	Very high	91.8	Very high	15 Å²	15	23.3 Å²	23.3	8%	0.077	12%	0.116	C	C	.	.	H	α-helix	trans	-65.4	-43.6	179	-65.5	-52.4	0	0	0	111.3	L569 N592 V594 L598 L599 Q600	L569-I596 HydrophobicContact CB-CD1 3.73Å; L569-I596 WeakPolarHBondContact O-CD1 3.05Å; L569-I596 WeakPolarHBondContact O-CG1 3.44Å; N592-I596 WeakPolarHBondContact O-CB 3.25Å; N592-I596 WeakPolarHBondContact O-CG1 3.46Å; N592-I596 PolarHBondContact O-N 3.35Å; V594-I596 PolarHBondContact O-N 2.94Å; I596-L598 VanDerWaalsContact C-N 3.33Å; I596-L598 PolarHBondContact O-N 3.45Å; I596-L599 PolarHBondContact O-N 3.27Å; I596-Q600 HydrophobicContact CG2-CG 4.44Å; I596-Q600 WeakPolarHBondContact O-CB 3.47Å; I596-Q600 WeakPolarHBondContact O-CG 3.38Å; I596-Q600 PolarHBondContact O-N 3.33Å
597	F	91.5	Very high	91.6	Very high	6 Å²	6	15.5 Å²	15.5	3%	0.026	8%	0.082	C	C	.	.	H	α-helix	trans	-58.5	-44.3	175.6	178.7	-115.6	0	0	0	112.4	D593 V594 Q600 I601 L648 C702 F712	D593-F597 WeakPolarHBondContact O-CB 3.42Å; D593-F597 PolarHBondContact O-N 2.88Å; V594-F597 PolarHBondContact O-N 3.47Å; F597-Q600 PolarHBondContact O-N 3.27Å; F597-I601 HydrophobicContact CD1-CD1 4.05Å; F597-I601 HydrophobicContact CD2-CD1 4.15Å; F597-I601 HydrophobicContact CE1-CD1 3.59Å; F597-I601 HydrophobicContact CE2-CD1 3.71Å; F597-I601 HydrophobicContact CG-CD1 4.34Å; F597-I601 HydrophobicContact CZ-CD1 3.42Å; F597-I601 VanDerWaalsContact CZ-CD1 3.42Å; F597-I601 PolarHBondContact O-N 2.88Å; F597-L648 HydrophobicContact CD1-CD1 4.44Å; F597-L648 HydrophobicContact CE1-CD1 3.61Å; F597-L648 HydrophobicContact CE1-CD2 4.37Å; F597-L648 HydrophobicContact CZ-CD1 4.21Å; F597-C702 HydrophobicContact CD1-CB 3.7Å; F597-C702 WeakPolarHBondContact CD1-O 3.42Å; F597-C702 HydrophobicContact CE1-CB 4.04Å; F597-C702 VanDerWaalsContact CE1-O 3.23Å; F597-C702 WeakPolarHBondContact CE1-O 3.29Å; F597-F712 HydrophobicContact CD2-CD2 4.04Å; F597-F712 AromaticContact CD2-CE2 3.43Å; F597-F712 HydrophobicContact CD2-CE2 3.43Å; F597-F712 VanDerWaalsContact CD2-CE2 3.43Å; F597-F712 HydrophobicContact CD2-CZ 4.37Å; F597-F712 AromaticContact CE2-CD2 3.78Å; F597-F712 HydrophobicContact CE2-CD2 3.78Å; F597-F712 AromaticContact CE2-CE2 3.63Å; F597-F712 HydrophobicContact CE2-CE2 3.63Å; F597-F712 HydrophobicContact CG-CE2 4.35Å
598	L	91.8	Very high	91.4	Very high	14 Å²	14	15.4 Å²	15.4	7%	0.073	8%	0.081	C	C	.	.	H	α-helix	trans	-64.7	-43.4	175.7	-70.8	176.9	0	0	0	112.3	F484 V594 F595 I596 Q600 I601 K602 L648 I652	F484-L598 HydrophobicContact CD2-CB 4.03Å; F484-L598 HydrophobicContact CD2-CD1 3.79Å; F484-L598 HydrophobicContact CE2-CB 3.79Å; F484-L598 HydrophobicContact CE2-CD1 4.34Å; V594-L598 HydrophobicContact CG1-CD1 4.15Å; V594-L598 WeakPolarHBondContact O-CG 3.47Å; V594-L598 PolarHBondContact O-N 3.44Å; F595-L598 PolarHBondContact O-N 2.91Å; I596-L598 VanDerWaalsContact C-N 3.33Å; I596-L598 PolarHBondContact O-N 3.45Å; L598-Q600 VanDerWaalsContact C-N 3.31Å; L598-Q600 PolarHBondContact O-N 2.81Å; L598-I601 PolarHBondContact O-N 3.33Å; L598-K602 VanDerWaalsContact O-CB 3.26Å; L598-K602 WeakPolarHBondContact O-CB 3.45Å; L598-K602 PolarHBondContact O-N 2.72Å; L598-L648 HydrophobicContact CD2-CB 4.18Å; L598-L648 HydrophobicContact CD2-CD1 4.44Å; L598-I652 HydrophobicContact CD1-CD1 3.68Å; L598-I652 HydrophobicContact CD2-CD1 3.62Å; L598-I652 HydrophobicContact CG-CD1 4.01Å
599	L	91	Very high	91.2	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-62.1	-40.8	179.9	-170	67.1	0	0	0	111.3	F484 F498 I566 L569 F595 I596 K602 Y603	F484-L599 HydrophobicContact CZ-CD1 4.07Å; F498-L599 HydrophobicContact CE1-CD1 3.52Å; F498-L599 HydrophobicContact CE1-CG 4.01Å; F498-L599 HydrophobicContact CZ-CD1 3.68Å; F498-L599 HydrophobicContact CZ-CG 4.41Å; I566-L599 HydrophobicContact CG2-CB 4.37Å; I566-L599 HydrophobicContact CG2-CD2 3.86Å; I566-L599 HydrophobicContact CG2-CG 4.06Å; L569-L599 HydrophobicContact CD1-CD2 4.15Å; F595-L599 HydrophobicContact CE1-CD2 4.13Å; F595-L599 HydrophobicContact CZ-CD2 4.31Å; F595-L599 VanDerWaalsContact O-CB 3.32Å; F595-L599 WeakPolarHBondContact O-CB 3.49Å; F595-L599 PolarHBondContact O-N 3.31Å; I596-L599 PolarHBondContact O-N 3.27Å; L599-K602 PolarHBondContact O-N 3.46Å; L599-Y603 VanDerWaalsContact O-CB 3.31Å; L599-Y603 WeakPolarHBondContact O-CB 3.32Å; L599-Y603 PolarHBondContact O-N 3.35Å
600	Q	89.8	Confident	90.9	Very high	15 Å²	15	19.9 Å²	19.9	7%	0.07	10%	0.097	C	C	.	.	H	α-helix	trans	-59.9	-50.5	175.5	-79.9	176.8	-14	0	0	112.5	F563 I566 I596 F597 L598 K602 Y603 V604	F563-Q600 HydrophobicContact CD2-CG 4.39Å; F563-Q600 HydrophobicContact CE1-CB 4.37Å; F563-Q600 HydrophobicContact CE1-CG 3.9Å; F563-Q600 VanDerWaalsContact CE1-NE2 3.33Å; F563-Q600 HydrophobicContact CE2-CB 3.66Å; F563-Q600 HydrophobicContact CE2-CG 3.74Å; F563-Q600 HydrophobicContact CZ-CB 3.5Å; F563-Q600 HydrophobicContact CZ-CG 3.49Å; F563-Q600 VanDerWaalsContact CZ-CG 3.49Å; I566-Q600 HydrophobicContact CB-CG 4.5Å; I566-Q600 HydrophobicContact CG2-CG 3.81Å; I596-Q600 HydrophobicContact CG2-CG 4.44Å; I596-Q600 WeakPolarHBondContact O-CB 3.47Å; I596-Q600 WeakPolarHBondContact O-CG 3.38Å; I596-Q600 PolarHBondContact O-N 3.33Å; F597-Q600 PolarHBondContact O-N 3.27Å; L598-Q600 VanDerWaalsContact C-N 3.31Å; L598-Q600 PolarHBondContact O-N 2.81Å; Q600-K602 VanDerWaalsContact C-N 3.31Å; Q600-K602 PolarHBondContact O-N 3.31Å; Q600-Y603 PolarHBondContact O-N 3.31Å; Q600-V604 WeakPolarHBondContact O-CG2 3.49Å; Q600-V604 PolarHBondContact O-N 3.23Å; Q600-V604 VanDerWaalsContact O-N 3.1Å
601	I	90.5	Very high	90.3	Very high	2 Å²	2	19 Å²	19	1%	0.01	9%	0.092	C	C	.	.	H	α-helix	trans	-62.7	-42.8	179	-70.5	162.3	0	0	0	110.7	F597 L598 Y603 V604 K605 L644 H645 L648	F597-I601 HydrophobicContact CD1-CD1 4.05Å; F597-I601 HydrophobicContact CD2-CD1 4.15Å; F597-I601 HydrophobicContact CE1-CD1 3.59Å; F597-I601 HydrophobicContact CE2-CD1 3.71Å; F597-I601 HydrophobicContact CG-CD1 4.34Å; F597-I601 HydrophobicContact CZ-CD1 3.42Å; F597-I601 VanDerWaalsContact CZ-CD1 3.42Å; F597-I601 PolarHBondContact O-N 2.88Å; L598-I601 PolarHBondContact O-N 3.33Å; I601-Y603 VanDerWaalsContact C-N 3.33Å; I601-Y603 PolarHBondContact O-N 2.68Å; I601-V604 PolarHBondContact O-N 3.23Å; I601-K605 PolarHBondContact O-N 2.54Å; I601-L644 HydrophobicContact CB-CD2 4.42Å; I601-L644 HydrophobicContact CD1-CD2 3.47Å; I601-L644 VanDerWaalsContact CD1-CD2 3.47Å; I601-L644 HydrophobicContact CG1-CD2 3.94Å; I601-L644 HydrophobicContact CG2-CD2 3.63Å; I601-H645 HydrophobicContact CG2-CB 4.04Å; I601-L648 HydrophobicContact CD1-CD1 3.38Å
602	K	91.4	Very high	89.5	Confident	21 Å²	21	24 Å²	24	9%	0.091	12%	0.115	C	C	.	.	H	α-helix	trans	-65.8	-36.8	179	-162.4	-177.6	-170.9	171.4	0	111.8	F484 M490 D491 A494 F498 L598 L599 Q600 K605 W606	F484-K602 VanDerWaalsContact CD1-NZ 3.28Å; F484-K602 HydrophobicContact CE1-CD 4.04Å; F484-K602 HydrophobicContact CZ-CD 4.4Å; M490-K602 PolarHBondContact O-NZ 3.07Å; D491-K602 VanDerWaalsContact OD1-CE 3.26Å; D491-K602 WeakPolarHBondContact OD1-CE 3.07Å; D491-K602 IonicContact OD1-NZ 2.64Å; D491-K602 PolarHBondContact OD1-NZ 2.81Å; A494-K602 HydrophobicContact CB-CD 3.83Å; F498-K602 HydrophobicContact CE2-CB 4.23Å; F498-K602 HydrophobicContact CE2-CD 4.25Å; F498-K602 HydrophobicContact CE2-CG 3.92Å; F498-K602 HydrophobicContact CZ-CB 4Å; F498-K602 HydrophobicContact CZ-CD 4.28Å; F498-K602 HydrophobicContact CZ-CG 4.12Å; L598-K602 VanDerWaalsContact O-CB 3.26Å; L598-K602 WeakPolarHBondContact O-CB 3.45Å; L598-K602 PolarHBondContact O-N 2.72Å; L599-K602 PolarHBondContact O-N 3.46Å; Q600-K602 VanDerWaalsContact C-N 3.31Å; Q600-K602 PolarHBondContact O-N 3.31Å; K602-K605 PolarHBondContact O-N 3.44Å; K602-W606 VanDerWaalsContact O-CB 3.32Å; K602-W606 WeakPolarHBondContact O-CB 3.41Å; K602-W606 PolarHBondContact O-N 3.18Å
603	Y	89.9	Confident	88.4	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.2	-42.8	175.2	176.8	-117.2	0	0	0	112.4	F498 I501 I562 I566 L599 Q600 I601 W606 S607 L723 R726	F498-Y603 HydrophobicContact CB-CD2 4Å; F498-Y603 HydrophobicContact CB-CE2 4.31Å; F498-Y603 AromaticContact CD1-CD2 3.46Å; F498-Y603 HydrophobicContact CD1-CD2 3.46Å; F498-Y603 VanDerWaalsContact CD1-CD2 3.46Å; F498-Y603 HydrophobicContact CD1-CE2 4.35Å; F498-Y603 HydrophobicContact CD1-CG 4.16Å; F498-Y603 HydrophobicContact CD2-CD2 4.45Å; F498-Y603 HydrophobicContact CE1-CD2 4Å; F498-Y603 HydrophobicContact CE1-CG 4.25Å; F498-Y603 AromaticContact CG-CD2 3.72Å; F498-Y603 HydrophobicContact CG-CD2 3.72Å; F498-Y603 HydrophobicContact CG-CE2 4.49Å; I501-Y603 HydrophobicContact CG2-CE2 4.1Å; I562-Y603 HydrophobicContact CG2-CE1 3.99Å; I562-Y603 WeakPolarHBondContact CG2-OH 3.16Å; I566-Y603 HydrophobicContact CD1-CD1 3.5Å; I566-Y603 HydrophobicContact CD1-CD2 4.1Å; I566-Y603 HydrophobicContact CD1-CE1 3.98Å; I566-Y603 HydrophobicContact CD1-CG 3.54Å; L599-Y603 VanDerWaalsContact O-CB 3.31Å; L599-Y603 WeakPolarHBondContact O-CB 3.32Å; L599-Y603 PolarHBondContact O-N 3.35Å; Q600-Y603 PolarHBondContact O-N 3.31Å; I601-Y603 VanDerWaalsContact C-N 3.33Å; I601-Y603 PolarHBondContact O-N 2.68Å; Y603-W606 HydrophobicContact CD2-CE3 4.4Å; Y603-W606 HydrophobicContact CE2-CE3 4.39Å; Y603-W606 HydrophobicContact CE2-CZ3 4.39Å; Y603-S607 WeakPolarHBondContact O-CB 3.42Å; Y603-S607 PolarHBondContact O-N 3.49Å; Y603-S607 PolarHBondContact O-OG 3.22Å; Y603-L723 HydrophobicContact CD1-CD1 4.46Å; Y603-L723 HydrophobicContact CD1-CD2 4.02Å; Y603-L723 HydrophobicContact CE1-CD1 4.1Å; Y603-L723 HydrophobicContact CE1-CD2 3.61Å; Y603-R726 VanDerWaalsContact CZ-NH1 3.34Å; Y603-R726 PolarHBondContact OH-NH1 3.07Å
604	V	90	Very high	87.1	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.1	-45.8	176.6	177.9	0	0	0	0	110.5	F563 Q600 I601 W606 S607 L608 F641 C719 L723	F563-V604 HydrophobicContact CE2-CG2 4.13Å; Q600-V604 WeakPolarHBondContact O-CG2 3.49Å; Q600-V604 PolarHBondContact O-N 3.23Å; Q600-V604 VanDerWaalsContact O-N 3.1Å; I601-V604 PolarHBondContact O-N 3.23Å; V604-W606 PolarHBondContact O-N 2.94Å; V604-S607 PolarHBondContact O-N 3.43Å; V604-L608 HydrophobicContact CG1-CD1 4.1Å; V604-L608 WeakPolarHBondContact O-CG 3.46Å; V604-L608 PolarHBondContact O-N 3.36Å; V604-F641 HydrophobicContact CB-CD1 4.44Å; V604-F641 HydrophobicContact CB-CE1 4.39Å; V604-F641 HydrophobicContact CG1-CD1 4.07Å; V604-F641 HydrophobicContact CG1-CD2 3.73Å; V604-F641 HydrophobicContact CG1-CE1 3.89Å; V604-F641 HydrophobicContact CG1-CE2 3.52Å; V604-F641 HydrophobicContact CG1-CG 4.02Å; V604-F641 HydrophobicContact CG1-CZ 3.62Å; V604-C719 HydrophobicContact CG2-CB 3.8Å; V604-L723 HydrophobicContact CG2-CD2 4.27Å; V604-L723 HydrophobicContact CG2-CG 4.2Å
605	K	91.4	Very high	85.7	Confident	29 Å²	29	29.7 Å²	29.7	13%	0.126	15%	0.149	C	C	.	.	H	α-helix	trans	-55.1	-53.5	174.8	-178.2	180	175.7	-179.4	0	111.3	I601 K602 S607 L608 E609 L638 F641 H645 D646	I601-K605 PolarHBondContact O-N 2.54Å; K602-K605 PolarHBondContact O-N 3.44Å; K605-S607 VanDerWaalsContact C-N 3.34Å; K605-S607 PolarHBondContact O-N 3.15Å; K605-L608 PolarHBondContact O-N 2.91Å; K605-E609 WeakPolarHBondContact CE-OE1 3.33Å; K605-E609 WeakPolarHBondContact CG-OE1 3.46Å; K605-E609 WeakPolarHBondContact O-CG 3.33Å; K605-E609 PolarHBondContact O-N 3.43Å; K605-L638 HydrophobicContact CG-CD1 4.31Å; K605-F641 HydrophobicContact CB-CB 4.37Å; K605-H645 HydrophobicContact CD-CB 4.08Å; K605-D646 IonicContact NZ-OD1 3.41Å; K605-D646 PolarHBondContact NZ-OD1 3.02Å
606	W	90.3	Very high	84	Confident	40 Å²	40	29.9 Å²	29.9	15%	0.152	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-40.9	178.2	177.8	90.8	0	0	0	112.8	F498 K602 Y603 V604 L608 E609 N610	F498-W606 HydrophobicContact CB-CD2 3.62Å; F498-W606 HydrophobicContact CB-CE3 3.6Å; F498-W606 HydrophobicContact CB-CG 4.31Å; F498-W606 HydrophobicContact CB-CH2 3.89Å; F498-W606 HydrophobicContact CB-CZ2 3.88Å; F498-W606 HydrophobicContact CB-CZ3 3.75Å; F498-W606 HydrophobicContact CD2-CB 3.75Å; F498-W606 AromaticContact CD2-CD2 3.84Å; F498-W606 HydrophobicContact CD2-CD2 3.84Å; F498-W606 HydrophobicContact CD2-CE3 4.34Å; F498-W606 AromaticContact CD2-CG 3.61Å; F498-W606 HydrophobicContact CD2-CG 3.61Å; F498-W606 HydrophobicContact CE2-CB 4.11Å; F498-W606 HydrophobicContact CE2-CG 4.39Å; F498-W606 HydrophobicContact CG-CD2 4.16Å; F498-W606 HydrophobicContact CG-CE3 4.28Å; F498-W606 HydrophobicContact CG-CG 4.39Å; F498-W606 WeakPolarHBondContact O-CH2 3.34Å; K602-W606 VanDerWaalsContact O-CB 3.32Å; K602-W606 WeakPolarHBondContact O-CB 3.41Å; K602-W606 PolarHBondContact O-N 3.18Å; Y603-W606 HydrophobicContact CD2-CE3 4.4Å; Y603-W606 HydrophobicContact CE2-CE3 4.39Å; Y603-W606 HydrophobicContact CE2-CZ3 4.39Å; V604-W606 PolarHBondContact O-N 2.94Å; W606-L608 VanDerWaalsContact C-N 3.3Å; W606-L608 PolarHBondContact O-N 3.4Å; W606-E609 PolarHBondContact O-N 2.99Å; W606-N610 WeakPolarHBondContact CH2-ND2 3.22Å; W606-N610 WeakPolarHBondContact CZ2-ND2 3.35Å; W606-N610 PolarHBondContact NE1-ND2 2.81Å; W606-N610 PolarHBondContact O-N 3.35Å; W606-N610 PolarHBondContact O-ND2 3.24Å
607	S	86.5	Confident	82.4	Confident	1 Å²	1	37 Å²	37	1%	0.007	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-39.3	178.2	-73.1	0	0	0	0	112.1	Y603 V604 K605 L611 R726	Y603-S607 WeakPolarHBondContact O-CB 3.42Å; Y603-S607 PolarHBondContact O-N 3.49Å; Y603-S607 PolarHBondContact O-OG 3.22Å; V604-S607 PolarHBondContact O-N 3.43Å; K605-S607 VanDerWaalsContact C-N 3.34Å; K605-S607 PolarHBondContact O-N 3.15Å; S607-L611 WeakPolarHBondContact O-CG 3.32Å; S607-R726 PolarHBondContact OG-NH1 3.27Å
608	L	88.5	Confident	80.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-73.9	-38.2	176.2	-67.2	170.6	0	0	0	111.8	V604 K605 W606 N610 L611 R634 M637 L638 F641 L725	V604-L608 HydrophobicContact CG1-CD1 4.1Å; V604-L608 WeakPolarHBondContact O-CG 3.46Å; V604-L608 PolarHBondContact O-N 3.36Å; K605-L608 PolarHBondContact O-N 2.91Å; W606-L608 VanDerWaalsContact C-N 3.3Å; W606-L608 PolarHBondContact O-N 3.4Å; L608-N610 VanDerWaalsContact C-N 3.33Å; L608-N610 PolarHBondContact O-N 2.8Å; L608-L611 HydrophobicContact CD2-CD1 4.16Å; L608-L611 PolarHBondContact O-N 3.49Å; L608-R634 PolarHBondContact O-NE 2.84Å; L608-R634 PolarHBondContact O-NH2 2.8Å; L608-M637 HydrophobicContact CD1-CB 3.72Å; L608-M637 HydrophobicContact CD2-CB 4.39Å; L608-M637 HydrophobicContact CD2-SD 4.35Å; L608-L638 HydrophobicContact CB-CD1 4.3Å; L608-F641 HydrophobicContact CD1-CD2 3.6Å; L608-F641 HydrophobicContact CD1-CE2 4.14Å; L608-L725 HydrophobicContact CD2-CD2 3.88Å
609	E	88.4	Confident	78.7	Confident	79 Å²	79	47.4 Å²	47.4	37%	0.369	23%	0.232	S	C	.	.	H	α-helix	trans	-60.5	-41.2	177.3	-74.5	172.9	176	0	0	111.9	K605 W606 L611 R634 L638	K605-E609 WeakPolarHBondContact CE-OE1 3.33Å; K605-E609 WeakPolarHBondContact CG-OE1 3.46Å; K605-E609 WeakPolarHBondContact O-CG 3.33Å; K605-E609 PolarHBondContact O-N 3.43Å; W606-E609 PolarHBondContact O-N 2.99Å; E609-L611 VanDerWaalsContact C-N 3.25Å; E609-L611 PolarHBondContact O-N 3.4Å; E609-R634 PolarHBondContact O-NH2 2.8Å; E609-L638 HydrophobicContact CG-CD1 3.58Å; E609-L638 HydrophobicContact CG-CD2 4.33Å
610	N	84.9	Confident	76.8	Confident	68 Å²	68	48.2 Å²	48.2	36%	0.364	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	1.8	-178.3	-70.8	-24.6	0	0	0	115.7	W606 L608 H612	W606-N610 WeakPolarHBondContact CH2-ND2 3.22Å; W606-N610 WeakPolarHBondContact CZ2-ND2 3.35Å; W606-N610 PolarHBondContact NE1-ND2 2.81Å; W606-N610 PolarHBondContact O-N 3.35Å; W606-N610 PolarHBondContact O-ND2 3.24Å; L608-N610 VanDerWaalsContact C-N 3.33Å; L608-N610 PolarHBondContact O-N 2.8Å; N610-H612 PolarHBondContact O-CD2 2.88Å; N610-H612 PolarHBondContact O-N 3.02Å
611	L	82.4	Confident	75	Confident	11 Å²	11	54.1 Å²	54.1	6%	0.058	28%	0.28	C	S	.	.			trans	-75	96.6	172.2	-57.7	-179.6	0	0	0	109.7	S607 L608 E609 R634 L725 R726 W729	S607-L611 WeakPolarHBondContact O-CG 3.32Å; L608-L611 HydrophobicContact CD2-CD1 4.16Å; L608-L611 PolarHBondContact O-N 3.49Å; E609-L611 VanDerWaalsContact C-N 3.25Å; E609-L611 PolarHBondContact O-N 3.4Å; L611-R634 HydrophobicContact CD1-CG 4.44Å; L611-R634 PolarHBondContact O-NE 3.27Å; L611-L725 HydrophobicContact CD1-CG 4.45Å; L611-R726 HydrophobicContact CD2-CB 4.17Å; L611-R726 HydrophobicContact CD2-CG 4.09Å; L611-W729 HydrophobicContact CB-CD2 3.94Å; L611-W729 HydrophobicContact CB-CE3 4.27Å; L611-W729 HydrophobicContact CB-CG 4.37Å; L611-W729 HydrophobicContact CB-CH2 4.32Å; L611-W729 HydrophobicContact CB-CZ2 4.03Å; L611-W729 HydrophobicContact CB-CZ3 4.45Å; L611-W729 HydrophobicContact CD1-CB 4.48Å; L611-W729 HydrophobicContact CD1-CD2 4.13Å; L611-W729 HydrophobicContact CD1-CE3 3.96Å; L611-W729 HydrophobicContact CD1-CG 4.37Å; L611-W729 HydrophobicContact CD2-CB 3.94Å; L611-W729 HydrophobicContact CD2-CD2 4.21Å; L611-W729 HydrophobicContact CD2-CG 3.78Å; L611-W729 HydrophobicContact CG-CD2 4.3Å; L611-W729 HydrophobicContact CG-CG 4.38Å
612	H	77.8	Confident	73.3	Confident	109 Å²	109	55.8 Å²	55.8	51%	0.505	29%	0.291	S	S	.	.			trans	-84.1	138.4	-179.7	-65.3	-62.2	0	0	0	113	N610 S614 T615 W729	N610-H612 PolarHBondContact O-CD2 2.88Å; N610-H612 PolarHBondContact O-N 3.02Å; H612-S614 VanDerWaalsContact C-N 3.32Å; H612-S614 PolarHBondContact O-N 2.63Å; H612-T615 WeakPolarHBondContact O-CB 3.47Å; H612-T615 PolarHBondContact O-N 2.9Å; H612-T615 PolarHBondContact O-OG1 3.3Å; H612-W729 WeakPolarHBondContact O-CZ2 3.28Å; H612-W729 PolarHBondContact O-NE1 2.86Å
613	F	70.8	Confident	71.8	Confident	97 Å²	97	58.4 Å²	58.4	43%	0.425	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-32.5	178.9	-53.9	-67.7	0	0	0	113.6	T615 L616 E617 I631 W729	F613-T615 PolarHBondContact O-N 3.45Å; F613-T615 VanDerWaalsContact O-N 3.12Å; F613-L616 HydrophobicContact CD1-CD1 4.48Å; F613-L616 VanDerWaalsContact O-CB 3.31Å; F613-L616 WeakPolarHBondContact O-CB 3.1Å; F613-L616 PolarHBondContact O-N 3.42Å; F613-E617 PolarHBondContact O-N 2.82Å; F613-I631 HydrophobicContact CD1-CD1 3.84Å; F613-I631 HydrophobicContact CD1-CG1 3.86Å; F613-I631 HydrophobicContact CE1-CB 4.34Å; F613-I631 HydrophobicContact CE1-CD1 4.04Å; F613-I631 HydrophobicContact CE1-CG1 3.76Å; F613-I631 HydrophobicContact CE1-CG2 3.81Å; F613-W729 HydrophobicContact CD1-CH2 4.47Å
614	S	64.8	Low	70.8	Confident	57 Å²	57	65.9 Å²	65.9	40%	0.399	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-24.4	178.1	55.2	0	0	0	0	112.8	H612 K618	H612-S614 VanDerWaalsContact C-N 3.32Å; H612-S614 PolarHBondContact O-N 2.63Å; S614-K618 VanDerWaalsContact O-CG 3.31Å; S614-K618 WeakPolarHBondContact O-CG 3.24Å; S614-K618 PolarHBondContact O-N 2.75Å
615	T	62.5	Low	69.9	Low	59 Å²	59	68.4 Å²	68.4	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-70.2	-34.3	174	-41.8	0	0	0	0	111.6	H612 F613 T619	H612-T615 WeakPolarHBondContact O-CB 3.47Å; H612-T615 PolarHBondContact O-N 2.9Å; H612-T615 PolarHBondContact O-OG1 3.3Å; F613-T615 PolarHBondContact O-N 3.45Å; F613-T615 VanDerWaalsContact O-N 3.12Å; T615-T619 PolarHBondContact O-OG1 3.31Å
616	L	58.8	Low	69	Low	4 Å²	4	67.4 Å²	67.4	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-69.6	-44.2	176.3	-67.5	165.2	0	0	0	111.3	F613 K618 V620 L630 I631 W729 L733	F613-L616 HydrophobicContact CD1-CD1 4.48Å; F613-L616 VanDerWaalsContact O-CB 3.31Å; F613-L616 WeakPolarHBondContact O-CB 3.1Å; F613-L616 PolarHBondContact O-N 3.42Å; L616-K618 VanDerWaalsContact C-N 3.3Å; L616-K618 PolarHBondContact O-N 2.87Å; L616-V620 PolarHBondContact O-N 2.9Å; L616-L630 HydrophobicContact CD2-CD1 4.08Å; L616-I631 HydrophobicContact CD1-CD1 4.21Å; L616-I631 HydrophobicContact CD1-CG1 4.04Å; L616-W729 HydrophobicContact CD1-CH2 3.36Å; L616-W729 HydrophobicContact CD1-CZ2 3.39Å; L616-W729 HydrophobicContact CD1-CZ3 4.15Å; L616-W729 HydrophobicContact CD2-CD2 4.42Å; L616-W729 HydrophobicContact CD2-CH2 4.38Å; L616-W729 HydrophobicContact CD2-CZ2 4.15Å; L616-W729 HydrophobicContact CG-CH2 4Å; L616-W729 HydrophobicContact CG-CZ2 3.55Å; L616-L733 HydrophobicContact CD2-CD1 4Å; L616-L733 HydrophobicContact CD2-CD2 3.7Å
617	E	57.4	Low	68.3	Low	163 Å²	163	66.8 Å²	66.8	76%	0.762	36%	0.357	S	S	*	.	H	α-helix	trans	-65.3	-32.4	-177.3	-70.2	-179.9	169.4	0	0	113	F613	F613-E617 PolarHBondContact O-N 2.82Å
618	K	54.4	Low	67.8	Low	178 Å²	178	69.1 Å²	69.1	77%	0.774	37%	0.368	S	S	*	.	H	α-helix	trans	-82.6	-27.7	-174.3	-74	177.4	-178.7	-179.2	0	114.8	S614 L616	S614-K618 VanDerWaalsContact O-CG 3.31Å; S614-K618 WeakPolarHBondContact O-CG 3.24Å; S614-K618 PolarHBondContact O-N 2.75Å; L616-K618 VanDerWaalsContact C-N 3.3Å; L616-K618 PolarHBondContact O-N 2.87Å
619	T	51.4	Low	67.4	Low	62 Å²	62	71.7 Å²	71.7	38%	0.38	38%	0.38	S	S	.	.	H	α-helix	trans	-110	-25.4	-166.8	48.2	0	0	0	0	113.3	T615 L733	T615-T619 PolarHBondContact O-OG1 3.31Å; T619-L733 WeakPolarHBondContact CB-O 3.36Å; T619-L733 WeakPolarHBondContact OG1-CD2 3.38Å
620	V	50.3	Low	67.1	Low	17 Å²	17	67.9 Å²	67.9	10%	0.103	36%	0.362	C	S	.	.			trans	-128.8	92.9	-167.2	159	0	0	0	0	108.2	L616 T622 L733	L616-V620 PolarHBondContact O-N 2.9Å; V620-T622 HydrophobicContact CG1-CG2 4.33Å; V620-T622 WeakPolarHBondContact CG1-OG1 3.24Å; V620-T622 PolarHBondContact O-N 3.24Å; V620-L733 HydrophobicContact CB-CD2 3.64Å; V620-L733 HydrophobicContact CB-CG 4.48Å; V620-L733 HydrophobicContact CG1-CD2 4.28Å; V620-L733 HydrophobicContact CG2-CB 4.16Å; V620-L733 HydrophobicContact CG2-CD2 3.31Å; V620-L733 HydrophobicContact CG2-CG 3.65Å
621	S	52.3	Low	67	Low	139 Å²	139	66.9 Å²	66.9	97%	0.972	36%	0.356	S	S	*	.			trans	-66.3	26	163.2	-31.1	0	0	0	0	112.2
622	T	54.3	Low	67	Low	38 Å²	38	68.3 Å²	68.3	23%	0.233	36%	0.363	C	S	.	.			trans	-108.7	144.7	-159.6	127.3	0	0	0	0	108.9	V620 F624 T740	V620-T622 HydrophobicContact CG1-CG2 4.33Å; V620-T622 WeakPolarHBondContact CG1-OG1 3.24Å; V620-T622 PolarHBondContact O-N 3.24Å; T622-F624 PolarHBondContact O-N 3.3Å; T622-T740 HydrophobicContact CG2-CG2 3.19Å
623	C	60.7	Low	67.4	Low	76 Å²	76	63.2 Å²	63.2	51%	0.514	34%	0.34	S	S	.	.			trans	-29.6	122.8	-161.2	-163.7	0	0	0	0	115	S625 T626	C623-S625 PolarHBondContact O-N 3.4Å; C623-S625 PolarHBondContact SG-OG 2.86Å; C623-T626 PolarHBondContact O-N 3.01Å
624	F	68.4	Low	68.2	Low	156 Å²	156	60 Å²	60	68%	0.684	33%	0.325	S	S	*	.	H	α-helix	trans	-42	-36	174	177.6	-96	0	0	0	113.1	T622 T626 H628	T622-F624 PolarHBondContact O-N 3.3Å; F624-T626 PolarHBondContact O-N 3.35Å; F624-H628 VanDerWaalsContact O-CB 3.27Å; F624-H628 WeakPolarHBondContact O-CB 3.23Å; F624-H628 PolarHBondContact O-N 3.27Å
625	S	71.6	Confident	69.3	Low	54 Å²	54	61.5 Å²	61.5	38%	0.378	33%	0.328	S	S	.	.	H	α-helix	trans	-61.3	-40.3	177.9	69.7	0	0	0	0	114.5	C623 H629	C623-S625 PolarHBondContact O-N 3.4Å; C623-S625 PolarHBondContact SG-OG 2.86Å; S625-H629 PolarHBondContact O-N 3.39Å
626	T	72.2	Confident	70.5	Confident	8 Å²	8	59.1 Å²	59.1	5%	0.049	31%	0.312	C	S	.	.	H	α-helix	trans	-73.8	-43.3	-177.7	-50.2	0	0	0	0	111.3	C623 F624 H628 H629 L630 F743 I747	C623-T626 PolarHBondContact O-N 3.01Å; F624-T626 PolarHBondContact O-N 3.35Å; T626-H628 VanDerWaalsContact C-N 3.32Å; T626-H628 PolarHBondContact O-N 2.97Å; T626-H629 PolarHBondContact O-N 2.91Å; T626-L630 PolarHBondContact O-N 2.97Å; T626-F743 HydrophobicContact CG2-CD1 3.85Å; T626-F743 HydrophobicContact CG2-CE1 3.85Å; T626-I747 HydrophobicContact CG2-CD1 3.62Å
627	N	75.1	Confident	72	Confident	27 Å²	27	58.9 Å²	58.9	14%	0.144	31%	0.311	C	S	.	.	H	α-helix	trans	-61.2	-43.9	175.6	-71.7	-11.1	0	0	0	110.8	H629 L630 I631	N627-H629 VanDerWaalsContact C-N 3.33Å; N627-H629 PolarHBondContact O-N 3.05Å; N627-L630 PolarHBondContact O-N 3.06Å; N627-I631 VanDerWaalsContact O-CG1 3.26Å; N627-I631 WeakPolarHBondContact O-CG1 3.25Å; N627-I631 PolarHBondContact O-N 2.98Å; N627-I631 VanDerWaalsContact O-N 3.08Å
628	H	77.4	Confident	73.6	Confident	50 Å²	50	52.8 Å²	52.8	23%	0.231	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-41.6	176	-172.2	-98.4	0	0	0	112.3	F624 T626 I631 I632 F795	F624-H628 VanDerWaalsContact O-CB 3.27Å; F624-H628 WeakPolarHBondContact O-CB 3.23Å; F624-H628 PolarHBondContact O-N 3.27Å; T626-H628 VanDerWaalsContact C-N 3.32Å; T626-H628 PolarHBondContact O-N 2.97Å; H628-I631 PolarHBondContact O-N 3.28Å; H628-I632 WeakPolarHBondContact CE1-CD1 3.48Å; H628-I632 WeakPolarHBondContact ND1-CD1 3.3Å; H628-I632 WeakPolarHBondContact O-CG1 3.49Å; H628-I632 PolarHBondContact O-N 3.04Å; H628-I632 VanDerWaalsContact O-N 3.08Å; H628-F795 AromaticContact CE1-CD1 3.51Å; H628-F795 AromaticContact CE1-CD2 3.49Å; H628-F795 VanDerWaalsContact CE1-CD2 3.49Å; H628-F795 WeakPolarHBondContact CE1-CD2 3.43Å; H628-F795 AromaticContact CE1-CE1 3.61Å; H628-F795 AromaticContact CE1-CE2 3.62Å; H628-F795 AromaticContact CE1-CG 3.39Å; H628-F795 WeakPolarHBondContact CE1-CG 3.18Å; H628-F795 AromaticContact CE1-CZ 3.65Å; H628-F795 AromaticContact ND1-CG 3.89Å
629	H	78.9	Confident	75.3	Confident	53 Å²	53	47.4 Å²	47.4	25%	0.245	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-42.7	177.4	-166.1	98.9	0	0	0	112.6	S625 T626 N627 I631 I632 L633 I747	S625-H629 PolarHBondContact O-N 3.39Å; T626-H629 PolarHBondContact O-N 2.91Å; N627-H629 VanDerWaalsContact C-N 3.33Å; N627-H629 PolarHBondContact O-N 3.05Å; H629-I631 VanDerWaalsContact C-N 3.33Å; H629-I631 PolarHBondContact O-N 2.53Å; H629-I632 PolarHBondContact O-N 2.67Å; H629-L633 WeakPolarHBondContact O-CB 3.5Å; H629-L633 PolarHBondContact O-N 3.28Å; H629-I747 WeakPolarHBondContact CD2-CG2 3.42Å
630	L	81.8	Confident	77.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-42.5	174.5	-77.3	170.7	0	0	0	112.4	L616 T626 N627 I632 L633 R634 L725 W729 F743 I747	L616-L630 HydrophobicContact CD2-CD1 4.08Å; T626-L630 PolarHBondContact O-N 2.97Å; N627-L630 PolarHBondContact O-N 3.06Å; L630-I632 VanDerWaalsContact C-N 3.35Å; L630-L633 PolarHBondContact O-N 3.48Å; L630-R634 WeakPolarHBondContact O-CB 3.45Å; L630-R634 PolarHBondContact O-N 3.48Å; L630-L725 HydrophobicContact CD2-CD1 3.64Å; L630-W729 HydrophobicContact CB-CE3 4.49Å; L630-W729 HydrophobicContact CB-CZ3 4.1Å; L630-F743 HydrophobicContact CD1-CE1 4.07Å; L630-F743 HydrophobicContact CD1-CZ 3.97Å; L630-I747 HydrophobicContact CD1-CD1 3.94Å; L630-I747 HydrophobicContact CD2-CD1 3.61Å; L630-I747 HydrophobicContact CD2-CG1 3.8Å; L630-I747 HydrophobicContact CD2-CG2 4.08Å; L630-I747 HydrophobicContact CG-CD1 3.7Å; L630-I747 HydrophobicContact CG-CG1 4.4Å; L630-I747 HydrophobicContact CG-CG2 4.48Å
631	I	82.9	Confident	79	Confident	46 Å²	46	43.8 Å²	43.8	24%	0.236	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-44.3	178.7	-67.7	170.4	0	0	0	110.5	F613 L616 N627 H628 H629 R634 I635 W729	F613-I631 HydrophobicContact CD1-CD1 3.84Å; F613-I631 HydrophobicContact CD1-CG1 3.86Å; F613-I631 HydrophobicContact CE1-CB 4.34Å; F613-I631 HydrophobicContact CE1-CD1 4.04Å; F613-I631 HydrophobicContact CE1-CG1 3.76Å; F613-I631 HydrophobicContact CE1-CG2 3.81Å; L616-I631 HydrophobicContact CD1-CD1 4.21Å; L616-I631 HydrophobicContact CD1-CG1 4.04Å; N627-I631 VanDerWaalsContact O-CG1 3.26Å; N627-I631 WeakPolarHBondContact O-CG1 3.25Å; N627-I631 PolarHBondContact O-N 2.98Å; N627-I631 VanDerWaalsContact O-N 3.08Å; H628-I631 PolarHBondContact O-N 3.28Å; H629-I631 VanDerWaalsContact C-N 3.33Å; H629-I631 PolarHBondContact O-N 2.53Å; I631-R634 PolarHBondContact O-N 2.68Å; I631-I635 HydrophobicContact CG2-CD1 3.86Å; I631-I635 VanDerWaalsContact O-CG1 3.29Å; I631-I635 WeakPolarHBondContact O-CG1 3.22Å; I631-I635 PolarHBondContact O-N 2.72Å; I631-W729 HydrophobicContact CG1-CH2 4.48Å
632	I	83.4	Confident	80.8	Confident	41 Å²	41	39 Å²	39	21%	0.21	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-47.4	176.7	-68.1	163.2	0	0	0	110.9	H628 H629 L630 R634 I635 K636 F795	H628-I632 WeakPolarHBondContact CE1-CD1 3.48Å; H628-I632 WeakPolarHBondContact ND1-CD1 3.3Å; H628-I632 WeakPolarHBondContact O-CG1 3.49Å; H628-I632 PolarHBondContact O-N 3.04Å; H628-I632 VanDerWaalsContact O-N 3.08Å; H629-I632 PolarHBondContact O-N 2.67Å; L630-I632 VanDerWaalsContact C-N 3.35Å; I632-R634 VanDerWaalsContact C-N 3.28Å; I632-R634 PolarHBondContact O-N 3.47Å; I632-I635 PolarHBondContact O-N 3.31Å; I632-I635 VanDerWaalsContact O-N 3.12Å; I632-K636 HydrophobicContact CG2-CD 4.45Å; I632-K636 HydrophobicContact CG2-CG 4.33Å; I632-K636 WeakPolarHBondContact O-CG 3.45Å; I632-K636 PolarHBondContact O-N 2.76Å; I632-F795 HydrophobicContact CD1-CD2 3.28Å; I632-F795 HydrophobicContact CD1-CE2 3.45Å; I632-F795 VanDerWaalsContact CD1-CE2 3.45Å; I632-F795 HydrophobicContact CD1-CG 4.24Å; I632-F795 HydrophobicContact CD1-CZ 4.5Å; I632-F795 HydrophobicContact CG1-CE2 4.36Å
633	L	85.9	Confident	82.5	Confident	2 Å²	2	38 Å²	38	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-42.2	-179.9	-173.4	59.3	0	0	0	110.9	H629 L630 K636 M637 L725 L750 F754	H629-L633 WeakPolarHBondContact O-CB 3.5Å; H629-L633 PolarHBondContact O-N 3.28Å; L630-L633 PolarHBondContact O-N 3.48Å; L633-K636 PolarHBondContact O-N 2.88Å; L633-M637 HydrophobicContact CD1-CE 3.94Å; L633-M637 HydrophobicContact CD2-CE 4.26Å; L633-M637 HydrophobicContact CG-CE 3.98Å; L633-M637 HydrophobicContact CG-SD 4.35Å; L633-M637 WeakPolarHBondContact O-CB 3.35Å; L633-M637 WeakPolarHBondContact O-CG 3.36Å; L633-M637 PolarHBondContact O-N 3.49Å; L633-L725 HydrophobicContact CD2-CD1 3.95Å; L633-L725 HydrophobicContact CG-CD1 4.42Å; L633-L725 HydrophobicContact CG-CD2 4.28Å; L633-L750 HydrophobicContact CD2-CD2 4.1Å; L633-L750 HydrophobicContact CD2-CG 4.21Å; L633-F754 HydrophobicContact CD1-CD1 4.27Å
634	R	88.5	Confident	83.8	Confident	29 Å²	29	34.5 Å²	34.5	11%	0.109	17%	0.172	C	C	.	.	H	α-helix	trans	-58.2	-48.8	172.3	179.1	-174.2	172.8	-100	4.2	111.9	L608 E609 L611 L630 I631 I632 K636 M637 L638 L725	L608-R634 PolarHBondContact O-NE 2.84Å; L608-R634 PolarHBondContact O-NH2 2.8Å; E609-R634 PolarHBondContact O-NH2 2.8Å; L611-R634 HydrophobicContact CD1-CG 4.44Å; L611-R634 PolarHBondContact O-NE 3.27Å; L630-R634 WeakPolarHBondContact O-CB 3.45Å; L630-R634 PolarHBondContact O-N 3.48Å; I631-R634 PolarHBondContact O-N 2.68Å; I632-R634 VanDerWaalsContact C-N 3.28Å; I632-R634 PolarHBondContact O-N 3.47Å; R634-K636 VanDerWaalsContact C-N 3.34Å; R634-K636 PolarHBondContact O-N 3.01Å; R634-M637 PolarHBondContact O-N 2.98Å; R634-L638 WeakPolarHBondContact O-CB 3.11Å; R634-L638 PolarHBondContact O-N 3.45Å; R634-L725 HydrophobicContact CB-CD2 4.05Å
635	I	87.5	Confident	84.9	Confident	90 Å²	90	28.8 Å²	28.8	46%	0.462	15%	0.148	S	C	.	.	H	α-helix	trans	-61.3	-43.7	-180	-69.3	165.6	0	0	0	110.6	I631 I632 F639	I631-I635 HydrophobicContact CG2-CD1 3.86Å; I631-I635 VanDerWaalsContact O-CG1 3.29Å; I631-I635 WeakPolarHBondContact O-CG1 3.22Å; I631-I635 PolarHBondContact O-N 2.72Å; I632-I635 PolarHBondContact O-N 3.31Å; I632-I635 VanDerWaalsContact O-N 3.12Å; I635-F639 WeakPolarHBondContact O-CB 3.42Å; I635-F639 PolarHBondContact O-N 3.37Å
636	K	87.1	Confident	85.7	Confident	8 Å²	8	29.4 Å²	29.4	4%	0.035	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-52.4	175.5	-73.8	-174.3	170.8	-161.3	0	111.7	I632 L633 R634 F639 I640 F754 D755 F790	I632-K636 HydrophobicContact CG2-CD 4.45Å; I632-K636 HydrophobicContact CG2-CG 4.33Å; I632-K636 WeakPolarHBondContact O-CG 3.45Å; I632-K636 PolarHBondContact O-N 2.76Å; L633-K636 PolarHBondContact O-N 2.88Å; R634-K636 VanDerWaalsContact C-N 3.34Å; R634-K636 PolarHBondContact O-N 3.01Å; K636-F639 WeakPolarHBondContact O-CB 3.25Å; K636-F639 PolarHBondContact O-N 2.86Å; K636-I640 PolarHBondContact O-N 3.03Å; K636-F754 HydrophobicContact CB-CE1 4.26Å; K636-D755 IonicContact NZ-OD1 3.28Å; K636-D755 PolarHBondContact NZ-OD1 2.87Å; K636-D755 IonicContact NZ-OD2 2.67Å; K636-D755 PolarHBondContact NZ-OD2 3.14Å; K636-F790 HydrophobicContact CD-CB 4.26Å; K636-F790 VanDerWaalsContact CE-CB 3.45Å; K636-F790 HydrophobicContact CG-CB 4.26Å; K636-F790 HydrophobicContact CG-CD2 3.86Å; K636-F790 HydrophobicContact CG-CE2 4.48Å; K636-F790 HydrophobicContact CG-CG 4.13Å
637	M	90.7	Very high	86.5	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-47.5	180	-71.9	-178.1	172	0	0	111.3	L608 L633 R634 F639 I640 F641 M721 L725 L750 F754	L608-M637 HydrophobicContact CD1-CB 3.72Å; L608-M637 HydrophobicContact CD2-CB 4.39Å; L608-M637 HydrophobicContact CD2-SD 4.35Å; L633-M637 HydrophobicContact CD1-CE 3.94Å; L633-M637 HydrophobicContact CD2-CE 4.26Å; L633-M637 HydrophobicContact CG-CE 3.98Å; L633-M637 HydrophobicContact CG-SD 4.35Å; L633-M637 WeakPolarHBondContact O-CB 3.35Å; L633-M637 WeakPolarHBondContact O-CG 3.36Å; L633-M637 PolarHBondContact O-N 3.49Å; R634-M637 PolarHBondContact O-N 2.98Å; M637-F639 VanDerWaalsContact C-N 3.3Å; M637-F639 PolarHBondContact O-N 3.46Å; M637-I640 PolarHBondContact O-N 3.32Å; M637-I640 VanDerWaalsContact O-N 3.14Å; M637-F641 HydrophobicContact CB-CD2 4.46Å; M637-F641 WeakPolarHBondContact O-CD2 3.22Å; M637-F641 PolarHBondContact O-N 3.25Å; M637-M721 HydrophobicContact CE-CB 4.14Å; M637-L725 HydrophobicContact CE-CB 4.44Å; M637-L725 HydrophobicContact SD-CB 3.94Å; M637-L725 HydrophobicContact SD-CD2 3.49Å; M637-L725 WeakPolarHBondContact SD-CD2 2.86Å; M637-L725 HydrophobicContact SD-CG 4.33Å; M637-L750 HydrophobicContact CE-CD2 4.43Å; M637-L750 HydrophobicContact CE-CG 4.3Å; M637-F754 HydrophobicContact CB-CE2 4.4Å; M637-F754 HydrophobicContact CB-CZ 4.15Å; M637-F754 HydrophobicContact CE-CB 4.08Å; M637-F754 HydrophobicContact CE-CD2 3.66Å; M637-F754 HydrophobicContact CE-CE2 4.19Å; M637-F754 HydrophobicContact CE-CG 3.82Å; M637-F754 HydrophobicContact CG-CD1 4.35Å; M637-F754 HydrophobicContact CG-CD2 4Å; M637-F754 HydrophobicContact CG-CE1 3.94Å; M637-F754 HydrophobicContact CG-CE2 3.57Å; M637-F754 HydrophobicContact CG-CG 4.36Å; M637-F754 HydrophobicContact CG-CZ 3.52Å
638	L	90.8	Very high	87.2	Confident	34 Å²	34	29.1 Å²	29.1	18%	0.178	14%	0.144	C	C	.	.	H	α-helix	trans	-61.4	-39.8	179.4	-176.7	61.8	0	0	0	111.8	K605 L608 E609 R634 I640 T642	K605-L638 HydrophobicContact CG-CD1 4.31Å; L608-L638 HydrophobicContact CB-CD1 4.3Å; E609-L638 HydrophobicContact CG-CD1 3.58Å; E609-L638 HydrophobicContact CG-CD2 4.33Å; R634-L638 WeakPolarHBondContact O-CB 3.11Å; R634-L638 PolarHBondContact O-N 3.45Å; L638-I640 PolarHBondContact O-N 2.92Å; L638-T642 WeakPolarHBondContact O-CB 3.3Å; L638-T642 PolarHBondContact O-N 3.23Å; L638-T642 PolarHBondContact O-OG1 3.2Å
639	F	89.7	Confident	87.8	Confident	65 Å²	65	28.7 Å²	28.7	29%	0.285	15%	0.149	S	C	.	.	H	α-helix	trans	-58.2	-46.9	174.4	176.2	-98	0	0	0	111.4	I635 K636 M637 N643 V786 A787 F790	I635-F639 WeakPolarHBondContact O-CB 3.42Å; I635-F639 PolarHBondContact O-N 3.37Å; K636-F639 WeakPolarHBondContact O-CB 3.25Å; K636-F639 PolarHBondContact O-N 2.86Å; M637-F639 VanDerWaalsContact C-N 3.3Å; M637-F639 PolarHBondContact O-N 3.46Å; F639-N643 WeakPolarHBondContact CD2-ND2 3.42Å; F639-N643 VanDerWaalsContact CE2-ND2 3.28Å; F639-N643 WeakPolarHBondContact CE2-ND2 3.46Å; F639-N643 VanDerWaalsContact CZ-ND2 3.3Å; F639-N643 WeakPolarHBondContact CZ-ND2 3.32Å; F639-N643 PolarHBondContact O-N 2.99Å; F639-N643 VanDerWaalsContact O-N 3.13Å; F639-N643 PolarHBondContact O-ND2 3.36Å; F639-V786 HydrophobicContact CE1-CB 4.27Å; F639-V786 HydrophobicContact CE1-CG1 4.08Å; F639-V786 HydrophobicContact CZ-CB 4.3Å; F639-V786 HydrophobicContact CZ-CG1 3.94Å; F639-A787 HydrophobicContact CD1-CB 4.18Å; F639-A787 HydrophobicContact CE1-CB 4.27Å; F639-F790 AromaticContact CD1-CE2 3.84Å; F639-F790 HydrophobicContact CD1-CE2 3.84Å; F639-F790 HydrophobicContact CD1-CZ 4.31Å; F639-F790 HydrophobicContact CE1-CE2 4.29Å; F639-F790 HydrophobicContact CG-CE2 4.23Å; F639-F790 HydrophobicContact CG-CZ 4.36Å
640	I	89	Confident	88.3	Confident	3 Å²	3	33 Å²	33	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-51.7	179.5	-62.1	-173.7	0	0	0	111.3	K636 M637 L638 T642 N643 L644 F754 V758 F784 A787	K636-I640 PolarHBondContact O-N 3.03Å; M637-I640 PolarHBondContact O-N 3.32Å; M637-I640 VanDerWaalsContact O-N 3.14Å; L638-I640 PolarHBondContact O-N 2.92Å; I640-T642 VanDerWaalsContact C-N 3.3Å; I640-T642 PolarHBondContact O-N 3.39Å; I640-N643 PolarHBondContact O-N 3.19Å; I640-L644 VanDerWaalsContact O-CB 3.31Å; I640-L644 WeakPolarHBondContact O-CB 3.28Å; I640-L644 PolarHBondContact O-N 2.91Å; I640-F754 HydrophobicContact CD1-CE1 3.91Å; I640-F754 HydrophobicContact CD1-CE2 4.44Å; I640-F754 HydrophobicContact CD1-CZ 3.48Å; I640-F754 VanDerWaalsContact CD1-CZ 3.48Å; I640-F754 HydrophobicContact CG1-CZ 4.32Å; I640-V758 HydrophobicContact CD1-CB 4.1Å; I640-V758 HydrophobicContact CD1-CG1 3.63Å; I640-V758 HydrophobicContact CD1-CG2 3.23Å; I640-F784 HydrophobicContact CG2-CE1 3.82Å; I640-F784 HydrophobicContact CG2-CE2 4.11Å; I640-F784 HydrophobicContact CG2-CZ 3.56Å; I640-A787 HydrophobicContact CD1-CB 3.52Å; I640-A787 HydrophobicContact CG1-CB 3.54Å
641	F	90.9	Very high	88.6	Confident	1 Å²	1	36.4 Å²	36.4	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-65.3	-33.6	-177.4	-75.5	-66.3	0	0	0	112.9	V604 K605 L608 M637 H645 L718	V604-F641 HydrophobicContact CB-CD1 4.44Å; V604-F641 HydrophobicContact CB-CE1 4.39Å; V604-F641 HydrophobicContact CG1-CD1 4.07Å; V604-F641 HydrophobicContact CG1-CD2 3.73Å; V604-F641 HydrophobicContact CG1-CE1 3.89Å; V604-F641 HydrophobicContact CG1-CE2 3.52Å; V604-F641 HydrophobicContact CG1-CG 4.02Å; V604-F641 HydrophobicContact CG1-CZ 3.62Å; K605-F641 HydrophobicContact CB-CB 4.37Å; L608-F641 HydrophobicContact CD1-CD2 3.6Å; L608-F641 HydrophobicContact CD1-CE2 4.14Å; M637-F641 HydrophobicContact CB-CD2 4.46Å; M637-F641 WeakPolarHBondContact O-CD2 3.22Å; M637-F641 PolarHBondContact O-N 3.25Å; F641-H645 WeakPolarHBondContact O-CB 3.38Å; F641-H645 PolarHBondContact O-N 3.07Å; F641-L718 HydrophobicContact CZ-CB 3.97Å; F641-L718 WeakPolarHBondContact CZ-O 3.42Å
642	T	91	Very high	89	Confident	37 Å²	37	34.2 Å²	34.2	23%	0.227	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-51.1	173.8	-59.4	0	0	0	0	110.5	L638 I640 L644 H645 D646	L638-T642 WeakPolarHBondContact O-CB 3.3Å; L638-T642 PolarHBondContact O-N 3.23Å; L638-T642 PolarHBondContact O-OG1 3.2Å; I640-T642 VanDerWaalsContact C-N 3.3Å; I640-T642 PolarHBondContact O-N 3.39Å; T642-L644 VanDerWaalsContact C-N 3.33Å; T642-L644 PolarHBondContact O-N 3.21Å; T642-H645 PolarHBondContact O-N 3.03Å; T642-D646 WeakPolarHBondContact CG2-OD2 3.31Å; T642-D646 WeakPolarHBondContact O-CB 3.45Å; T642-D646 PolarHBondContact O-N 2.96Å
643	N	88.9	Confident	89.3	Confident	17 Å²	17	35.4 Å²	35.4	9%	0.091	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-38.6	178.5	-77.4	-71.5	0	0	0	112.9	F639 I640 F647 Y779 S783	F639-N643 WeakPolarHBondContact CD2-ND2 3.42Å; F639-N643 VanDerWaalsContact CE2-ND2 3.28Å; F639-N643 WeakPolarHBondContact CE2-ND2 3.46Å; F639-N643 VanDerWaalsContact CZ-ND2 3.3Å; F639-N643 WeakPolarHBondContact CZ-ND2 3.32Å; F639-N643 PolarHBondContact O-N 2.99Å; F639-N643 VanDerWaalsContact O-N 3.13Å; F639-N643 PolarHBondContact O-ND2 3.36Å; I640-N643 PolarHBondContact O-N 3.19Å; N643-F647 WeakPolarHBondContact O-CB 3.31Å; N643-F647 PolarHBondContact O-N 3.36Å; N643-Y779 PolarHBondContact OD1-OH 3.17Å; N643-S783 PolarHBondContact OD1-OG 3.31Å
644	L	89.1	Confident	89.4	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-68	-47.2	178.5	-174.1	151	0	0	0	111	I601 I640 T642 F647 L648 I715 L780 F784	I601-L644 HydrophobicContact CB-CD2 4.42Å; I601-L644 HydrophobicContact CD1-CD2 3.47Å; I601-L644 VanDerWaalsContact CD1-CD2 3.47Å; I601-L644 HydrophobicContact CG1-CD2 3.94Å; I601-L644 HydrophobicContact CG2-CD2 3.63Å; I640-L644 VanDerWaalsContact O-CB 3.31Å; I640-L644 WeakPolarHBondContact O-CB 3.28Å; I640-L644 PolarHBondContact O-N 2.91Å; T642-L644 VanDerWaalsContact C-N 3.33Å; T642-L644 PolarHBondContact O-N 3.21Å; L644-F647 PolarHBondContact O-N 3.5Å; L644-L648 HydrophobicContact CD2-CD1 3.64Å; L644-L648 HydrophobicContact CD2-CG 4.45Å; L644-L648 WeakPolarHBondContact O-CG 3.42Å; L644-L648 PolarHBondContact O-N 3.37Å; L644-I715 HydrophobicContact CD1-CD1 4.12Å; L644-I715 HydrophobicContact CD1-CG1 4.19Å; L644-I715 HydrophobicContact CD1-CG2 4.25Å; L644-L780 HydrophobicContact CB-CD1 4.31Å; L644-F784 HydrophobicContact CD1-CE2 4.33Å; L644-F784 HydrophobicContact CD1-CZ 4.15Å
645	H	91.1	Very high	89.5	Confident	36 Å²	36	36.7 Å²	36.7	17%	0.167	19%	0.19	C	C	.	.	H	α-helix	trans	-57.5	-50.5	174.3	172.4	-84.9	0	0	0	111.2	I601 K605 F641 T642 F647 L648 A649	I601-H645 HydrophobicContact CG2-CB 4.04Å; K605-H645 HydrophobicContact CD-CB 4.08Å; F641-H645 WeakPolarHBondContact O-CB 3.38Å; F641-H645 PolarHBondContact O-N 3.07Å; T642-H645 PolarHBondContact O-N 3.03Å; H645-F647 VanDerWaalsContact C-N 3.32Å; H645-F647 PolarHBondContact O-N 3.38Å; H645-L648 PolarHBondContact O-N 2.97Å; H645-A649 VanDerWaalsContact O-CB 3.28Å; H645-A649 WeakPolarHBondContact O-CB 3.33Å; H645-A649 PolarHBondContact O-N 3.36Å
646	D	88.9	Confident	89.6	Confident	66 Å²	66	33.4 Å²	33.4	35%	0.353	17%	0.172	S	C	.	.	H	α-helix	trans	-67	-36.1	-175.6	-62.2	-9.2	0	0	0	111.3	K605 T642 H650	K605-D646 IonicContact NZ-OD1 3.41Å; K605-D646 PolarHBondContact NZ-OD1 3.02Å; T642-D646 WeakPolarHBondContact CG2-OD2 3.31Å; T642-D646 WeakPolarHBondContact O-CB 3.45Å; T642-D646 PolarHBondContact O-N 2.96Å; D646-H650 WeakPolarHBondContact O-CB 3.41Å; D646-H650 PolarHBondContact O-N 3.45Å
647	F	88.5	Confident	89.7	Confident	24 Å²	24	34.9 Å²	34.9	11%	0.105	18%	0.182	C	C	.	.	H	α-helix	trans	-60	-50.6	171.4	171.4	-97.9	0	0	0	112.1	N643 L644 H645 R651 Q776 L777 Y779 L780	N643-F647 WeakPolarHBondContact O-CB 3.31Å; N643-F647 PolarHBondContact O-N 3.36Å; L644-F647 PolarHBondContact O-N 3.5Å; H645-F647 VanDerWaalsContact C-N 3.32Å; H645-F647 PolarHBondContact O-N 3.38Å; F647-R651 HydrophobicContact CD2-CG 4.38Å; F647-R651 HydrophobicContact CE1-CG 4.37Å; F647-R651 HydrophobicContact CE2-CG 4Å; F647-R651 HydrophobicContact CZ-CG 3.99Å; F647-R651 WeakPolarHBondContact O-CB 3.46Å; F647-R651 WeakPolarHBondContact O-CG 3.23Å; F647-R651 PolarHBondContact O-N 3.37Å; F647-R651 VanDerWaalsContact O-N 3.11Å; F647-Q776 WeakPolarHBondContact CE2-O 3.5Å; F647-L777 HydrophobicContact CE1-CD2 4.34Å; F647-L777 HydrophobicContact CZ-CD2 3.87Å; F647-Y779 HydrophobicContact CD2-CD1 4.49Å; F647-L780 HydrophobicContact CB-CD1 4.29Å; F647-L780 HydrophobicContact CD1-CD1 4.48Å; F647-L780 HydrophobicContact CD1-CD2 4.1Å; F647-L780 HydrophobicContact CD2-CB 4.34Å; F647-L780 HydrophobicContact CE1-CD2 4.19Å; F647-L780 HydrophobicContact CG-CB 4.36Å; F647-L780 HydrophobicContact CG-CD1 4.38Å
648	L	89.7	Confident	89.6	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-48.6	-179.3	-70.6	173.8	0	0	0	111.6	F597 L598 I601 L644 H645 H650 R651 I652 V701	F597-L648 HydrophobicContact CD1-CD1 4.44Å; F597-L648 HydrophobicContact CE1-CD1 3.61Å; F597-L648 HydrophobicContact CE1-CD2 4.37Å; F597-L648 HydrophobicContact CZ-CD1 4.21Å; L598-L648 HydrophobicContact CD2-CB 4.18Å; L598-L648 HydrophobicContact CD2-CD1 4.44Å; I601-L648 HydrophobicContact CD1-CD1 3.38Å; L644-L648 HydrophobicContact CD2-CD1 3.64Å; L644-L648 HydrophobicContact CD2-CG 4.45Å; L644-L648 WeakPolarHBondContact O-CG 3.42Å; L644-L648 PolarHBondContact O-N 3.37Å; H645-L648 PolarHBondContact O-N 2.97Å; L648-H650 VanDerWaalsContact C-N 3.33Å; L648-H650 PolarHBondContact O-N 3.39Å; L648-R651 PolarHBondContact O-N 2.88Å; L648-R651 VanDerWaalsContact O-N 3.16Å; L648-I652 WeakPolarHBondContact O-CB 3.43Å; L648-I652 VanDerWaalsContact O-CG1 3.28Å; L648-I652 WeakPolarHBondContact O-CG1 3.29Å; L648-I652 PolarHBondContact O-N 3.42Å; L648-V701 HydrophobicContact CD2-CG1 4.03Å; L648-V701 WeakPolarHBondContact CD2-O 3.45Å
649	A	89.2	Confident	89.6	Confident	41 Å²	41	40.4 Å²	40.4	34%	0.339	20%	0.201	S	C	.	.	H	α-helix	trans	-57.2	-46	179.3	0	0	0	0	0	111.3	H645 R651 E653	H645-A649 VanDerWaalsContact O-CB 3.28Å; H645-A649 WeakPolarHBondContact O-CB 3.33Å; H645-A649 PolarHBondContact O-N 3.36Å; A649-R651 PolarHBondContact O-N 3.22Å; A649-E653 WeakPolarHBondContact O-CB 3.17Å; A649-E653 PolarHBondContact O-N 3.29Å
650	H	89.4	Confident	89.5	Confident	143 Å²	143	37.5 Å²	37.5	66%	0.662	19%	0.189	S	C	*	.	H	α-helix	trans	-65.8	-37.6	178.6	-169.8	71.4	0	0	0	112.8	D646 L648 A654	D646-H650 WeakPolarHBondContact O-CB 3.41Å; D646-H650 PolarHBondContact O-N 3.45Å; L648-H650 VanDerWaalsContact C-N 3.33Å; L648-H650 PolarHBondContact O-N 3.39Å; H650-A654 VanDerWaalsContact O-CB 3.3Å; H650-A654 WeakPolarHBondContact O-CB 3.27Å; H650-A654 PolarHBondContact O-N 2.92Å
651	R	88.6	Confident	89.4	Confident	71 Å²	71	40.1 Å²	40.1	27%	0.268	21%	0.207	S	C	.	.	H	α-helix	trans	-70.3	-46.1	178.8	-74.5	-74.1	178.8	-160.5	-8.9	112.3	F647 L648 A649 E653 A654 I655 V701 Q776	F647-R651 HydrophobicContact CD2-CG 4.38Å; F647-R651 HydrophobicContact CE1-CG 4.37Å; F647-R651 HydrophobicContact CE2-CG 4Å; F647-R651 HydrophobicContact CZ-CG 3.99Å; F647-R651 WeakPolarHBondContact O-CB 3.46Å; F647-R651 WeakPolarHBondContact O-CG 3.23Å; F647-R651 PolarHBondContact O-N 3.37Å; F647-R651 VanDerWaalsContact O-N 3.11Å; L648-R651 PolarHBondContact O-N 2.88Å; L648-R651 VanDerWaalsContact O-N 3.16Å; A649-R651 PolarHBondContact O-N 3.22Å; R651-E653 VanDerWaalsContact C-N 3.32Å; R651-A654 PolarHBondContact O-N 3.16Å; R651-I655 WeakPolarHBondContact O-CG1 3.49Å; R651-I655 PolarHBondContact O-N 2.63Å; R651-V701 HydrophobicContact CB-CG1 3.82Å; R651-Q776 VanDerWaalsContact NH2-CA 3.28Å; R651-Q776 VanDerWaalsContact NH2-CB 3.31Å; R651-Q776 PolarHBondContact NH2-O 2.86Å
652	I	91	Very high	89.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-42.7	179.4	-68.6	172.7	0	0	0	109.7	L483 V594 L598 L648 A654 I655 R656 L698 V701 C702	L483-I652 HydrophobicContact CB-CG2 3.67Å; L483-I652 HydrophobicContact CD1-CG2 4.25Å; L483-I652 HydrophobicContact CD2-CG2 4.15Å; L483-I652 HydrophobicContact CG-CG2 4.25Å; V594-I652 HydrophobicContact CG1-CD1 4.41Å; L598-I652 HydrophobicContact CD1-CD1 3.68Å; L598-I652 HydrophobicContact CD2-CD1 3.62Å; L598-I652 HydrophobicContact CG-CD1 4.01Å; L648-I652 WeakPolarHBondContact O-CB 3.43Å; L648-I652 VanDerWaalsContact O-CG1 3.28Å; L648-I652 WeakPolarHBondContact O-CG1 3.29Å; L648-I652 PolarHBondContact O-N 3.42Å; I652-A654 VanDerWaalsContact C-N 3.34Å; I652-A654 PolarHBondContact O-N 3.18Å; I652-I655 PolarHBondContact O-N 3.39Å; I652-R656 VanDerWaalsContact O-CB 3.28Å; I652-R656 WeakPolarHBondContact O-CB 3.38Å; I652-R656 PolarHBondContact O-N 3.14Å; I652-L698 HydrophobicContact CB-CD2 4.45Å; I652-L698 HydrophobicContact CG1-CD2 4.15Å; I652-L698 HydrophobicContact CG2-CD2 4.03Å; I652-V701 HydrophobicContact CG1-CG1 4.33Å; I652-C702 VanDerWaalsContact CD1-SG 3.54Å
653	E	89.8	Confident	89.1	Confident	65 Å²	65	42 Å²	42	30%	0.304	21%	0.213	S	C	.	.	H	α-helix	trans	-62.9	-40.1	174.7	-175.5	58.6	-163.4	0	0	111.9	A649 R651 I655 R656 T657	A649-E653 WeakPolarHBondContact O-CB 3.17Å; A649-E653 PolarHBondContact O-N 3.29Å; R651-E653 VanDerWaalsContact C-N 3.32Å; E653-I655 PolarHBondContact O-N 3.13Å; E653-R656 PolarHBondContact O-N 2.99Å; E653-R656 IonicContact OE1-CZ 2.82Å; E653-R656 IonicContact OE1-NE 3.03Å; E653-R656 IonicContact OE1-NH2 3.69Å; E653-R656 PolarHBondContact OE1-NH2 2.92Å; E653-R656 IonicContact OE2-CZ 2.75Å; E653-R656 IonicContact OE2-NE 2.74Å; E653-R656 PolarHBondContact OE2-NE 3.28Å; E653-R656 IonicContact OE2-NH2 3.93Å; E653-R656 PolarHBondContact OE2-NH2 3.27Å; E653-R656 VanDerWaalsContact OE2-NH2 3.17Å; E653-T657 HydrophobicContact CG-CG2 4.22Å; E653-T657 VanDerWaalsContact O-CB 3.31Å; E653-T657 WeakPolarHBondContact O-CB 3.35Å; E653-T657 VanDerWaalsContact O-CG2 3.23Å; E653-T657 WeakPolarHBondContact O-CG2 3.41Å; E653-T657 PolarHBondContact O-N 3.41Å; E653-T657 PolarHBondContact O-OG1 3.46Å; E653-T657 WeakPolarHBondContact OE1-CG2 3.36Å
654	A	89.1	Confident	88.7	Confident	46 Å²	46	42 Å²	42	38%	0.38	21%	0.213	S	C	.	.	H	α-helix	trans	-63.7	-39.9	174.9	0	0	0	0	0	112.8	H650 R651 I652 T657 R658	H650-A654 VanDerWaalsContact O-CB 3.3Å; H650-A654 WeakPolarHBondContact O-CB 3.27Å; H650-A654 PolarHBondContact O-N 2.92Å; R651-A654 PolarHBondContact O-N 3.16Å; I652-A654 VanDerWaalsContact C-N 3.34Å; I652-A654 PolarHBondContact O-N 3.18Å; A654-T657 WeakPolarHBondContact CA-OG1 3.22Å; A654-T657 PolarHBondContact O-OG1 3.26Å; A654-R658 VanDerWaalsContact O-CB 3.27Å; A654-R658 WeakPolarHBondContact O-CB 3.33Å; A654-R658 PolarHBondContact O-N 2.97Å; A654-R658 VanDerWaalsContact O-N 3.12Å
655	I	90.2	Very high	88.3	Confident	13 Å²	13	41.9 Å²	41.9	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-66.8	-48.4	176.5	-68.5	165.3	0	0	0	110.2	R651 I652 E653 R658 F659 L694 E697 L698 V701	R651-I655 WeakPolarHBondContact O-CG1 3.49Å; R651-I655 PolarHBondContact O-N 2.63Å; I652-I655 PolarHBondContact O-N 3.39Å; E653-I655 PolarHBondContact O-N 3.13Å; I655-R658 PolarHBondContact O-N 3.4Å; I655-F659 PolarHBondContact O-N 3.45Å; I655-F659 VanDerWaalsContact O-N 3.09Å; I655-L694 HydrophobicContact CG2-CD1 3.99Å; I655-L694 HydrophobicContact CG2-CG 4.05Å; I655-E697 HydrophobicContact CD1-CB 4.18Å; I655-L698 HydrophobicContact CB-CD2 4.49Å; I655-L698 HydrophobicContact CD1-CD2 4.37Å; I655-L698 HydrophobicContact CG2-CD2 4.18Å; I655-L698 HydrophobicContact CG2-CG 4.32Å; I655-V701 HydrophobicContact CD1-CG2 3.84Å
656	R	89.5	Confident	87.1	Confident	20 Å²	20	40.7 Å²	40.7	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-58.1	-53.4	178.6	-173.9	-173.9	81	102.5	5.2	111.1	G479 L483 G485 I652 E653 R658 F659 S660 E667	G479-R656 WeakPolarHBondContact O-CD 3.5Å; L483-R656 HydrophobicContact CD1-CB 4.15Å; L483-R656 HydrophobicContact CD1-CG 4.15Å; G485-R656 PolarHBondContact O-NH2 2.86Å; I652-R656 VanDerWaalsContact O-CB 3.28Å; I652-R656 WeakPolarHBondContact O-CB 3.38Å; I652-R656 PolarHBondContact O-N 3.14Å; E653-R656 PolarHBondContact O-N 2.99Å; E653-R656 IonicContact OE1-CZ 2.82Å; E653-R656 IonicContact OE1-NE 3.03Å; E653-R656 IonicContact OE1-NH2 3.69Å; E653-R656 PolarHBondContact OE1-NH2 2.92Å; E653-R656 IonicContact OE2-CZ 2.75Å; E653-R656 IonicContact OE2-NE 2.74Å; E653-R656 PolarHBondContact OE2-NE 3.28Å; E653-R656 IonicContact OE2-NH2 3.93Å; E653-R656 PolarHBondContact OE2-NH2 3.27Å; E653-R656 VanDerWaalsContact OE2-NH2 3.17Å; R656-R658 VanDerWaalsContact C-N 3.35Å; R656-R658 PolarHBondContact O-N 2.96Å; R656-F659 PolarHBondContact O-N 3.42Å; R656-S660 WeakPolarHBondContact O-CB 3.33Å; R656-S660 PolarHBondContact O-N 3.27Å; R656-S660 PolarHBondContact O-OG 3.1Å; R656-S660 VanDerWaalsContact O-OG 3.1Å; R656-E667 IonicContact CZ-OE2 2.84Å; R656-E667 IonicContact NH1-OE1 3.47Å; R656-E667 IonicContact NH1-OE2 3.17Å; R656-E667 PolarHBondContact NH1-OE2 3.12Å
657	T	87.8	Confident	85.8	Confident	40 Å²	40	40.5 Å²	40.5	25%	0.245	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-40.5	-179.6	50.2	0	0	0	0	112.5	E653 A654 F659 S660 S661 F668	E653-T657 HydrophobicContact CG-CG2 4.22Å; E653-T657 VanDerWaalsContact O-CB 3.31Å; E653-T657 WeakPolarHBondContact O-CB 3.35Å; E653-T657 VanDerWaalsContact O-CG2 3.23Å; E653-T657 WeakPolarHBondContact O-CG2 3.41Å; E653-T657 PolarHBondContact O-N 3.41Å; E653-T657 PolarHBondContact O-OG1 3.46Å; E653-T657 WeakPolarHBondContact OE1-CG2 3.36Å; A654-T657 WeakPolarHBondContact CA-OG1 3.22Å; A654-T657 PolarHBondContact O-OG1 3.26Å; T657-F659 PolarHBondContact O-N 3.39Å; T657-S660 PolarHBondContact O-N 2.97Å; T657-S661 VanDerWaalsContact O-CB 3.24Å; T657-S661 WeakPolarHBondContact O-CB 3.46Å; T657-S661 PolarHBondContact O-N 3.02Å; T657-S661 PolarHBondContact O-OG 2.96Å; T657-S661 VanDerWaalsContact O-OG 3.07Å; T657-F668 HydrophobicContact CG2-CE2 4.28Å; T657-F668 HydrophobicContact CG2-CZ 4.42Å
658	R	89.8	Confident	84.1	Confident	132 Å²	132	42.8 Å²	42.8	50%	0.498	22%	0.215	S	C	.	.	H	α-helix	trans	-61.4	-41.5	175.5	-175	-175.2	68	175.2	2.1	112.4	A654 I655 R656 S661 K662 E697	A654-R658 VanDerWaalsContact O-CB 3.27Å; A654-R658 WeakPolarHBondContact O-CB 3.33Å; A654-R658 PolarHBondContact O-N 2.97Å; A654-R658 VanDerWaalsContact O-N 3.12Å; I655-R658 PolarHBondContact O-N 3.4Å; R656-R658 VanDerWaalsContact C-N 3.35Å; R656-R658 PolarHBondContact O-N 2.96Å; R658-S661 PolarHBondContact O-OG 2.87Å; R658-S661 VanDerWaalsContact O-OG 3.11Å; R658-K662 WeakPolarHBondContact O-CB 3.35Å; R658-K662 PolarHBondContact O-N 3.28Å; R658-E697 IonicContact CZ-OE1 3.3Å; R658-E697 IonicContact CZ-OE2 3.89Å; R658-E697 IonicContact NH1-OE1 3.25Å; R658-E697 IonicContact NH1-OE2 3.2Å; R658-E697 IonicContact NH2-OE1 3.79Å; R658-E697 PolarHBondContact NH2-OE1 2.84Å; R658-E697 IonicContact NH2-OE2 2.87Å; R658-E697 PolarHBondContact NH2-OE2 2.83Å
659	F	91.5	Very high	82.2	Confident	17 Å²	17	45.2 Å²	45.2	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-69.7	-48.9	176.7	179.9	-95.4	0	0	0	111.3	L475 I655 R656 T657 S661 K662 W663 L665 L687 D690 H691 L694	L475-F659 HydrophobicContact CD1-CE1 4.24Å; L475-F659 HydrophobicContact CD1-CZ 4.3Å; I655-F659 PolarHBondContact O-N 3.45Å; I655-F659 VanDerWaalsContact O-N 3.09Å; R656-F659 PolarHBondContact O-N 3.42Å; T657-F659 PolarHBondContact O-N 3.39Å; F659-S661 VanDerWaalsContact C-N 3.31Å; F659-S661 PolarHBondContact O-N 3.1Å; F659-K662 PolarHBondContact O-N 3.12Å; F659-W663 AromaticContact CD2-CD1 3.82Å; F659-W663 AromaticContact CE2-CD1 3.58Å; F659-W663 AromaticContact CE2-NE1 3.75Å; F659-W663 AromaticContact CZ-CD1 3.86Å; F659-W663 PolarHBondContact O-N 2.94Å; F659-W663 VanDerWaalsContact O-N 3.1Å; F659-L665 HydrophobicContact CD1-CD1 4.07Å; F659-L665 HydrophobicContact CE1-CD1 3.98Å; F659-L687 HydrophobicContact CZ-CD1 4.09Å; F659-D690 HydrophobicContact CD2-CB 4.4Å; F659-D690 HydrophobicContact CE2-CB 4.01Å; F659-H691 HydrophobicContact CE2-CB 4.25Å; F659-H691 HydrophobicContact CZ-CB 4.21Å; F659-L694 HydrophobicContact CB-CD1 3.37Å; F659-L694 HydrophobicContact CD1-CD1 3.98Å; F659-L694 HydrophobicContact CD2-CB 4.26Å; F659-L694 HydrophobicContact CD2-CD1 3.95Å; F659-L694 HydrophobicContact CG-CD1 3.5Å
660	S	87.2	Confident	80.1	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.028	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-38.4	178.7	-61.2	0	0	0	0	112.6	R656 T657 C664 L665	R656-S660 WeakPolarHBondContact O-CB 3.33Å; R656-S660 PolarHBondContact O-N 3.27Å; R656-S660 PolarHBondContact O-OG 3.1Å; R656-S660 VanDerWaalsContact O-OG 3.1Å; T657-S660 PolarHBondContact O-N 2.97Å; S660-C664 WeakPolarHBondContact O-CA 3.49Å; S660-C664 PolarHBondContact O-N 2.67Å; S660-L665 PolarHBondContact O-N 3.5Å
661	S	86.2	Confident	77.8	Confident	58 Å²	58	46.9 Å²	46.9	41%	0.406	24%	0.244	S	C	.	.	H	α-helix	trans	-71.2	-36.5	177	69.2	0	0	0	0	112.5	T657 R658 F659 W663	T657-S661 VanDerWaalsContact O-CB 3.24Å; T657-S661 WeakPolarHBondContact O-CB 3.46Å; T657-S661 PolarHBondContact O-N 3.02Å; T657-S661 PolarHBondContact O-OG 2.96Å; T657-S661 VanDerWaalsContact O-OG 3.07Å; R658-S661 PolarHBondContact O-OG 2.87Å; R658-S661 VanDerWaalsContact O-OG 3.11Å; F659-S661 VanDerWaalsContact C-N 3.31Å; F659-S661 PolarHBondContact O-N 3.1Å; S661-W663 VanDerWaalsContact C-N 3.35Å
662	K	88	Confident	75.5	Confident	79 Å²	79	47.1 Å²	47.1	34%	0.343	25%	0.253	S	S	.	.	H	α-helix	trans	-65.3	-39.9	178.2	-178.6	176.4	-177	-177.4	0	111.5	R658 F659 Y682 D690	R658-K662 WeakPolarHBondContact O-CB 3.35Å; R658-K662 PolarHBondContact O-N 3.28Å; F659-K662 PolarHBondContact O-N 3.12Å; K662-Y682 HydrophobicContact CD-CE1 4.26Å; K662-Y682 VanDerWaalsContact CE-CE1 3.4Å; K662-Y682 WeakPolarHBondContact CE-OH 3.28Å; K662-Y682 HydrophobicContact CG-CE1 3.85Å; K662-D690 WeakPolarHBondContact CE-OD2 3.3Å; K662-D690 IonicContact NZ-OD1 2.85Å; K662-D690 PolarHBondContact NZ-OD1 2.66Å; K662-D690 IonicContact NZ-OD2 2.66Å; K662-D690 PolarHBondContact NZ-OD2 3.47Å
663	W	87.5	Confident	73.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	7.9	-177.3	-67.6	103.6	0	0	0	114.1	L454 L458 F659 S661 L665 I678 Y682 N686 L687 D690	L454-W663 HydrophobicContact CD1-CZ3 4.1Å; L454-W663 HydrophobicContact CD2-CZ3 3.95Å; L458-W663 HydrophobicContact CD1-CE3 3.73Å; L458-W663 HydrophobicContact CD1-CZ3 4.34Å; F659-W663 AromaticContact CD2-CD1 3.82Å; F659-W663 AromaticContact CE2-CD1 3.58Å; F659-W663 AromaticContact CE2-NE1 3.75Å; F659-W663 AromaticContact CZ-CD1 3.86Å; F659-W663 PolarHBondContact O-N 2.94Å; F659-W663 VanDerWaalsContact O-N 3.1Å; S661-W663 VanDerWaalsContact C-N 3.35Å; W663-L665 HydrophobicContact CB-CD2 4.26Å; W663-L665 HydrophobicContact CB-CG 4.29Å; W663-L665 PolarHBondContact O-N 3.18Å; W663-I678 HydrophobicContact CZ3-CG2 4.45Å; W663-Y682 HydrophobicContact CE3-CD1 4.35Å; W663-Y682 AromaticContact CH2-CD1 3.55Å; W663-Y682 HydrophobicContact CH2-CD1 3.55Å; W663-Y682 HydrophobicContact CH2-CE1 4.46Å; W663-Y682 HydrophobicContact CH2-CG 4.36Å; W663-Y682 AromaticContact CZ2-CD1 3.86Å; W663-Y682 HydrophobicContact CZ2-CD1 3.86Å; W663-Y682 HydrophobicContact CZ2-CE1 4.34Å; W663-Y682 AromaticContact CZ3-CD1 3.83Å; W663-Y682 HydrophobicContact CZ3-CD1 3.83Å; W663-N686 HydrophobicContact CH2-CB 4.1Å; W663-N686 HydrophobicContact CZ2-CB 4.24Å; W663-L687 HydrophobicContact CD2-CD1 3.43Å; W663-L687 VanDerWaalsContact CD2-CD1 3.43Å; W663-L687 HydrophobicContact CD2-CG 4.49Å; W663-L687 HydrophobicContact CE3-CB 4.33Å; W663-L687 HydrophobicContact CE3-CD1 3.76Å; W663-L687 HydrophobicContact CE3-CG 4.47Å; W663-L687 HydrophobicContact CG-CD1 3.79Å; W663-L687 VanDerWaalsContact CH2-CA 3.42Å; W663-L687 HydrophobicContact CH2-CB 3.43Å; W663-L687 VanDerWaalsContact CH2-CB 3.43Å; W663-L687 HydrophobicContact CH2-CD1 4.23Å; W663-L687 HydrophobicContact CH2-CG 4.37Å; W663-L687 VanDerWaalsContact CH2-N 3.29Å; W663-L687 HydrophobicContact CZ2-CB 3.68Å; W663-L687 HydrophobicContact CZ2-CD1 3.98Å; W663-L687 HydrophobicContact CZ2-CG 4.43Å; W663-L687 VanDerWaalsContact CZ2-N 3.31Å; W663-L687 HydrophobicContact CZ3-CB 3.79Å; W663-L687 HydrophobicContact CZ3-CD1 4.13Å; W663-L687 HydrophobicContact CZ3-CG 4.39Å; W663-D690 HydrophobicContact CZ2-CB 4.38Å; W663-D690 VanDerWaalsContact CZ2-OD2 3.25Å; W663-D690 WeakPolarHBondContact CZ2-OD2 3.37Å; W663-D690 PolarHBondContact NE1-OD2 3.5Å
664	C	79.7	Confident	71.1	Confident	16 Å²	16	55.3 Å²	55.3	11%	0.108	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	44.4	179.8	-61.3	0	0	0	0	113	S660 Y669 H676	S660-C664 WeakPolarHBondContact O-CA 3.49Å; S660-C664 PolarHBondContact O-N 2.67Å; C664-Y669 PolarHBondContact O-OH 3.39Å; C664-H676 HydrophobicContact CB-CB 4.12Å
665	L	81.6	Confident	69.3	Low	1 Å²	1	59.8 Å²	59.8	1%	0.005	33%	0.325	C	S	.	.			trans	-63.1	155.3	-177.5	-65.9	-175.3	0	0	0	111.6	L458 L475 A476 F659 S660 W663 E667 F668	L458-L665 HydrophobicContact CD2-CD2 4.07Å; L475-L665 HydrophobicContact CB-CD1 4Å; L475-L665 HydrophobicContact CB-CD2 4.36Å; A476-L665 HydrophobicContact CB-CB 4.48Å; F659-L665 HydrophobicContact CD1-CD1 4.07Å; F659-L665 HydrophobicContact CE1-CD1 3.98Å; S660-L665 PolarHBondContact O-N 3.5Å; W663-L665 HydrophobicContact CB-CD2 4.26Å; W663-L665 HydrophobicContact CB-CG 4.29Å; W663-L665 PolarHBondContact O-N 3.18Å; L665-E667 PolarHBondContact O-N 3.37Å; L665-F668 WeakPolarHBondContact O-CB 3.02Å; L665-F668 PolarHBondContact O-N 2.83Å
666	P	66.8	Low	67.7	Low	11 Å²	11	61.6 Å²	61.6	7%	0.071	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-49.9	-31.5	-172.3	-29.8	31.6	0	0	0	117.6	N473 F668 Y669	N473-P666 WeakPolarHBondContact OD1-CG 3.35Å; P666-F668 PolarHBondContact O-N 3.02Å; P666-Y669 VanDerWaalsContact CA-CD2 3.43Å; P666-Y669 HydrophobicContact CB-CD2 4.23Å; P666-Y669 HydrophobicContact CB-CE2 4.2Å; P666-Y669 HydrophobicContact CG-CE2 4.38Å; P666-Y669 WeakPolarHBondContact O-CD2 3.32Å; P666-Y669 PolarHBondContact O-N 3.41Å
667	E	61.5	Low	66.6	Low	63 Å²	63	65.8 Å²	65.8	29%	0.294	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-65.8	-19.2	177.5	-68.9	174.7	-178.1	0	0	114	A476 A480 R656 L665	A476-E667 HydrophobicContact CB-CG 4.04Å; A480-E667 WeakPolarHBondContact CB-OE1 3.1Å; R656-E667 IonicContact CZ-OE2 2.84Å; R656-E667 IonicContact NH1-OE1 3.47Å; R656-E667 IonicContact NH1-OE2 3.17Å; R656-E667 PolarHBondContact NH1-OE2 3.12Å; L665-E667 PolarHBondContact O-N 3.37Å
668	F	52.5	Low	66	Low	71 Å²	71	64.9 Å²	64.9	31%	0.311	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-95.4	0.4	-180	-103.6	-91.1	0	0	0	114.3	T657 L665 P666 S670	T657-F668 HydrophobicContact CG2-CE2 4.28Å; T657-F668 HydrophobicContact CG2-CZ 4.42Å; L665-F668 WeakPolarHBondContact O-CB 3.02Å; L665-F668 PolarHBondContact O-N 2.83Å; P666-F668 PolarHBondContact O-N 3.02Å; F668-S670 PolarHBondContact O-N 3.31Å
669	Y	50.1	Low	65.4	Low	57 Å²	57	61.5 Å²	61.5	22%	0.224	35%	0.346	C	S	.	.			trans	-73.3	61.4	170.3	-63	-59.4	0	0	0	110.8	H459 C664 P666 T671 H676	H459-Y669 PolarHBondContact CD2-OH 3.39Å; H459-Y669 PolarHBondContact NE2-OH 2.73Å; C664-Y669 PolarHBondContact O-OH 3.39Å; P666-Y669 VanDerWaalsContact CA-CD2 3.43Å; P666-Y669 HydrophobicContact CB-CD2 4.23Å; P666-Y669 HydrophobicContact CB-CE2 4.2Å; P666-Y669 HydrophobicContact CG-CE2 4.38Å; P666-Y669 WeakPolarHBondContact O-CD2 3.32Å; P666-Y669 PolarHBondContact O-N 3.41Å; Y669-T671 PolarHBondContact O-N 3.15Å; Y669-T671 VanDerWaalsContact O-N 3.14Å; Y669-H676 HydrophobicContact CD1-CB 4.48Å; Y669-H676 HydrophobicContact CE1-CB 4.07Å
670	S	44.1	Very low	64.6	Low	70 Å²	70	67.3 Å²	67.3	49%	0.49	37%	0.373	S	S	.	.			trans	-83.3	77.9	177.3	58.8	0	0	0	0	110.7	F668 T672	F668-S670 PolarHBondContact O-N 3.31Å; S670-T672 PolarHBondContact O-N 2.72Å; S670-T672 PolarHBondContact O-OG1 3.28Å
671	T	42.1	Very low	64.3	Low	150 Å²	150	71.7 Å²	71.7	92%	0.92	40%	0.4	S	S	*	.	S	Bend	trans	52.1	-7	159.7	53.4	0	0	0	0	119.8	Y669	Y669-T671 PolarHBondContact O-N 3.15Å; Y669-T671 VanDerWaalsContact O-N 3.14Å
672	T	39.5	Very low	64.3	Low	76 Å²	76	71.4 Å²	71.4	47%	0.466	39%	0.39	S	S	.	.			trans	-87.3	118.5	177.7	46.9	0	0	0	0	106.7	S670 I674	S670-T672 PolarHBondContact O-N 2.72Å; S670-T672 PolarHBondContact O-OG1 3.28Å; T672-I674 PolarHBondContact O-N 3.15Å
673	S	44.1	Very low	64.4	Low	126 Å²	126	67.8 Å²	67.8	88%	0.881	38%	0.375	S	S	*	.			trans	-63.7	47	170.9	58.7	0	0	0	0	112.4
674	I	45.3	Very low	64.6	Low	111 Å²	111	67.8 Å²	67.8	57%	0.569	38%	0.375	S	S	*	.			trans	-93.2	119.1	166.3	-59	172.2	0	0	0	103.6	T672 H676	T672-I674 PolarHBondContact O-N 3.15Å; I674-H676 VanDerWaalsContact C-N 3.3Å; I674-H676 PolarHBondContact O-CD2 3.34Å; I674-H676 PolarHBondContact O-N 2.89Å
675	D	50.8	Low	65.2	Low	141 Å²	141	68.3 Å²	68.3	75%	0.754	38%	0.38	S	S	*	.			trans	-54.7	98.4	172.5	-66.5	-39.5	0	0	0	108.1	N677	D675-N677 PolarHBondContact O-N 3.4Å
676	H	56.1	Low	65.8	Low	50 Å²	50	71.5 Å²	71.5	23%	0.231	40%	0.397	C	S	.	.			trans	-76.5	59.3	177.9	-74.3	-69.4	0	0	0	109.1	C664 Y669 I674	C664-H676 HydrophobicContact CB-CB 4.12Å; Y669-H676 HydrophobicContact CD1-CB 4.48Å; Y669-H676 HydrophobicContact CE1-CB 4.07Å; I674-H676 VanDerWaalsContact C-N 3.3Å; I674-H676 PolarHBondContact O-CD2 3.34Å; I674-H676 PolarHBondContact O-N 2.89Å
677	N	67.5	Low	67	Low	108 Å²	108	71 Å²	71	58%	0.578	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-82.3	124.9	174.5	-72.3	-21.6	0	0	0	108.1	D675	D675-N677 PolarHBondContact O-N 3.4Å
678	I	73.9	Confident	68.5	Low	22 Å²	22	68.8 Å²	68.8	11%	0.113	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-53.9	134.2	169.1	-59.9	161.3	0	0	0	107.4	L454 L458 W663 E680 Y682	L454-I678 HydrophobicContact CB-CD1 4.03Å; L454-I678 HydrophobicContact CD1-CG2 4.44Å; L458-I678 HydrophobicContact CB-CD1 4.3Å; L458-I678 HydrophobicContact CD1-CD1 3.43Å; L458-I678 VanDerWaalsContact CD1-CD1 3.43Å; L458-I678 HydrophobicContact CG-CD1 4.44Å; W663-I678 HydrophobicContact CZ3-CG2 4.45Å; I678-E680 PolarHBondContact O-N 2.87Å; I678-Y682 HydrophobicContact CG2-CD1 4.29Å; I678-Y682 HydrophobicContact CG2-CG 4.09Å
679	P	78.3	Confident	70.5	Confident	60 Å²	60	70 Å²	70	39%	0.39	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-58	136.8	179.3	-20	30.2	0	0	0	110.5	T681 Y682	P679-T681 PolarHBondContact O-N 3.35Å; P679-Y682 HydrophobicContact CB-CD2 3.63Å; P679-Y682 HydrophobicContact CB-CE2 3.61Å; P679-Y682 HydrophobicContact CG-CD2 3.92Å; P679-Y682 HydrophobicContact CG-CE2 3.56Å; P679-Y682 WeakPolarHBondContact O-CB 3.47Å; P679-Y682 WeakPolarHBondContact O-CD2 3.48Å; P679-Y682 PolarHBondContact O-N 3.31Å
680	E	74.5	Confident	72.6	Confident	139 Å²	139	68.7 Å²	68.7	65%	0.65	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.8	-174	-75.5	-172.9	-172.2	0	0	115.1	Q451 I678 Y682	Q451-E680 VanDerWaalsContact NE2-CA 3.29Å; Q451-E680 VanDerWaalsContact NE2-CG 3.33Å; Q451-E680 PolarHBondContact NE2-O 3.2Å; I678-E680 PolarHBondContact O-N 2.87Å; E680-Y682 VanDerWaalsContact C-N 3.35Å
681	T	79.4	Confident	75	Confident	96 Å²	96	65.6 Å²	65.6	59%	0.589	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-6.2	-179.5	56	0	0	0	0	114.1	P679	P679-T681 PolarHBondContact O-N 3.35Å
682	Y	87.7	Confident	77.5	Confident	53 Å²	53	63.7 Å²	63.7	21%	0.208	35%	0.345	C	S	.	.			trans	-85.5	135.3	-174.3	-76.7	-131.3	0	0	0	110	L454 K662 W663 I678 P679 E680	L454-Y682 VanDerWaalsContact CD1-O 3.31Å; L454-Y682 WeakPolarHBondContact CD1-O 3.46Å; K662-Y682 HydrophobicContact CD-CE1 4.26Å; K662-Y682 VanDerWaalsContact CE-CE1 3.4Å; K662-Y682 WeakPolarHBondContact CE-OH 3.28Å; K662-Y682 HydrophobicContact CG-CE1 3.85Å; W663-Y682 HydrophobicContact CE3-CD1 4.35Å; W663-Y682 AromaticContact CH2-CD1 3.55Å; W663-Y682 HydrophobicContact CH2-CD1 3.55Å; W663-Y682 HydrophobicContact CH2-CE1 4.46Å; W663-Y682 HydrophobicContact CH2-CG 4.36Å; W663-Y682 AromaticContact CZ2-CD1 3.86Å; W663-Y682 HydrophobicContact CZ2-CD1 3.86Å; W663-Y682 HydrophobicContact CZ2-CE1 4.34Å; W663-Y682 AromaticContact CZ3-CD1 3.83Å; W663-Y682 HydrophobicContact CZ3-CD1 3.83Å; I678-Y682 HydrophobicContact CG2-CD1 4.29Å; I678-Y682 HydrophobicContact CG2-CG 4.09Å; P679-Y682 HydrophobicContact CB-CD2 3.63Å; P679-Y682 HydrophobicContact CB-CE2 3.61Å; P679-Y682 HydrophobicContact CG-CD2 3.92Å; P679-Y682 HydrophobicContact CG-CE2 3.56Å; P679-Y682 WeakPolarHBondContact O-CB 3.47Å; P679-Y682 WeakPolarHBondContact O-CD2 3.48Å; P679-Y682 PolarHBondContact O-N 3.31Å; E680-Y682 VanDerWaalsContact C-N 3.35Å
683	T	89.9	Confident	80.1	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.012	34%	0.339	C	S	.	.			trans	-112.8	161.9	176.4	62.7	0	0	0	0	110.6	M447 N450 A685 N686 L687	M447-T683 HydrophobicContact CE-CG2 4.26Å; M447-T683 HydrophobicContact SD-CG2 4.11Å; N450-T683 HydrophobicContact CB-CG2 4.35Å; N450-T683 WeakPolarHBondContact OD1-CA 3.2Å; N450-T683 WeakPolarHBondContact OD1-CB 3.43Å; T683-A685 PolarHBondContact O-N 2.9Å; T683-N686 PolarHBondContact N-ND2 3.03Å; T683-N686 WeakPolarHBondContact O-CB 3.24Å; T683-N686 PolarHBondContact O-N 3.47Å; T683-N686 VanDerWaalsContact OG1-CG 3.26Å; T683-N686 PolarHBondContact OG1-N 3.39Å; T683-N686 PolarHBondContact OG1-ND2 2.9Å; T683-N686 PolarHBondContact OG1-OD1 3.1Å; T683-L687 PolarHBondContact O-N 2.95Å
684	F	92.2	Very high	82.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-32.9	172.9	-173.2	-96.6	0	0	0	111.8	W335 L371 N450 L453 L454 L457 I581 I582 N686 L687 V688	W335-F684 HydrophobicContact CB-CE1 4.46Å; W335-F684 AromaticContact CD2-CD1 3.46Å; W335-F684 HydrophobicContact CD2-CD1 3.46Å; W335-F684 VanDerWaalsContact CD2-CD1 3.46Å; W335-F684 AromaticContact CD2-CE1 3.51Å; W335-F684 HydrophobicContact CD2-CE1 3.51Å; W335-F684 AromaticContact CE2-CD1 3.52Å; W335-F684 AromaticContact CE2-CE1 3.93Å; W335-F684 AromaticContact CE3-CD1 3.42Å; W335-F684 HydrophobicContact CE3-CD1 3.42Å; W335-F684 VanDerWaalsContact CE3-CD1 3.42Å; W335-F684 AromaticContact CE3-CE1 3.63Å; W335-F684 HydrophobicContact CE3-CE1 3.63Å; W335-F684 HydrophobicContact CG-CD1 4.26Å; W335-F684 AromaticContact CG-CE1 3.85Å; W335-F684 HydrophobicContact CG-CE1 3.85Å; W335-F684 HydrophobicContact CH2-CB 3.99Å; W335-F684 AromaticContact CH2-CD1 3.59Å; W335-F684 HydrophobicContact CH2-CD1 3.59Å; W335-F684 HydrophobicContact CH2-CG 4.26Å; W335-F684 HydrophobicContact CZ2-CB 4.38Å; W335-F684 AromaticContact CZ2-CD1 3.62Å; W335-F684 HydrophobicContact CZ2-CD1 3.62Å; W335-F684 HydrophobicContact CZ2-CE1 4.46Å; W335-F684 HydrophobicContact CZ2-CG 4.49Å; W335-F684 HydrophobicContact CZ3-CB 4.33Å; W335-F684 AromaticContact CZ3-CD1 3.46Å; W335-F684 HydrophobicContact CZ3-CD1 3.46Å; W335-F684 VanDerWaalsContact CZ3-CD1 3.46Å; W335-F684 HydrophobicContact CZ3-CE1 4.16Å; W335-F684 HydrophobicContact CZ3-CG 4.25Å; L371-F684 HydrophobicContact CD2-CD1 4.44Å; L371-F684 HydrophobicContact CD2-CE1 4.11Å; L371-F684 HydrophobicContact CD2-CZ 4.15Å; N450-F684 PolarHBondContact OD1-N 3.14Å; L453-F684 HydrophobicContact CD2-CB 3.91Å; L453-F684 HydrophobicContact CD2-CD2 4.28Å; L453-F684 HydrophobicContact CD2-CG 4.1Å; L454-F684 HydrophobicContact CD2-CB 4.47Å; L454-F684 HydrophobicContact CD2-CD2 4.22Å; L457-F684 HydrophobicContact CD1-CD2 3.77Å; L457-F684 HydrophobicContact CD1-CE2 3.41Å; L457-F684 VanDerWaalsContact CD1-CE2 3.41Å; L457-F684 HydrophobicContact CD1-CZ 4.34Å; I581-F684 HydrophobicContact CG2-CE1 4.11Å; I581-F684 HydrophobicContact CG2-CZ 3.94Å; I582-F684 HydrophobicContact CD1-CE2 3.68Å; I582-F684 HydrophobicContact CD1-CZ 3.77Å; I582-F684 HydrophobicContact CG1-CE2 4.17Å; I582-F684 HydrophobicContact CG1-CZ 3.77Å; F684-N686 VanDerWaalsContact C-N 3.27Å; F684-N686 PolarHBondContact O-N 2.79Å; F684-L687 HydrophobicContact CD2-CD2 4.18Å; F684-L687 HydrophobicContact CE2-CD2 4.17Å; F684-L687 WeakPolarHBondContact O-CB 3.49Å; F684-L687 PolarHBondContact O-N 3.26Å; F684-L687 VanDerWaalsContact O-N 3.1Å; F684-V688 HydrophobicContact CD1-CG2 3.99Å; F684-V688 HydrophobicContact CE1-CG2 3.6Å; F684-V688 HydrophobicContact CZ-CG2 4.09Å; F684-V688 PolarHBondContact O-N 3.05Å
685	A	91.5	Very high	84.9	Confident	28 Å²	28	52.6 Å²	52.6	23%	0.231	27%	0.274	C	S	.	.	H	α-helix	trans	-55.9	-41.6	170.4	0	0	0	0	0	112.3	W335 T683 L687 V688 Q689	W335-A685 HydrophobicContact CZ2-CB 3.9Å; T683-A685 PolarHBondContact O-N 2.9Å; A685-L687 VanDerWaalsContact C-N 3.34Å; A685-L687 PolarHBondContact O-N 3.49Å; A685-V688 PolarHBondContact O-N 3.13Å; A685-Q689 WeakPolarHBondContact O-CB 3.38Å; A685-Q689 PolarHBondContact O-N 3.3Å
686	N	93.4	Very high	86.9	Confident	67 Å²	67	50.2 Å²	50.2	36%	0.358	26%	0.261	S	S	.	.	H	α-helix	trans	-64.8	-38.5	177.3	-62.6	-13.9	0	0	0	111.3	W663 T683 F684 Q689 D690	W663-N686 HydrophobicContact CH2-CB 4.1Å; W663-N686 HydrophobicContact CZ2-CB 4.24Å; T683-N686 PolarHBondContact N-ND2 3.03Å; T683-N686 WeakPolarHBondContact O-CB 3.24Å; T683-N686 PolarHBondContact O-N 3.47Å; T683-N686 VanDerWaalsContact OG1-CG 3.26Å; T683-N686 PolarHBondContact OG1-N 3.39Å; T683-N686 PolarHBondContact OG1-ND2 2.9Å; T683-N686 PolarHBondContact OG1-OD1 3.1Å; F684-N686 VanDerWaalsContact C-N 3.27Å; F684-N686 PolarHBondContact O-N 2.79Å; N686-Q689 PolarHBondContact O-N 3.05Å; N686-D690 VanDerWaalsContact O-CB 3.29Å; N686-D690 WeakPolarHBondContact O-CB 3.48Å; N686-D690 VanDerWaalsContact O-CG 3.24Å; N686-D690 PolarHBondContact O-N 2.87Å
687	L	93.5	Very high	88.5	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-49	176.8	179.1	62	0	0	0	111.4	L454 L458 L475 I582 F659 W663 T683 F684 A685 Q689 D690 H691	L454-L687 HydrophobicContact CD2-CB 4.46Å; L454-L687 HydrophobicContact CD2-CD2 4.03Å; L458-L687 HydrophobicContact CD1-CD2 4.42Å; L458-L687 HydrophobicContact CD2-CD2 4.12Å; L475-L687 HydrophobicContact CD1-CD1 4.32Å; I582-L687 HydrophobicContact CD1-CD2 3.32Å; I582-L687 HydrophobicContact CD1-CG 3.64Å; F659-L687 HydrophobicContact CZ-CD1 4.09Å; W663-L687 HydrophobicContact CD2-CD1 3.43Å; W663-L687 VanDerWaalsContact CD2-CD1 3.43Å; W663-L687 HydrophobicContact CD2-CG 4.49Å; W663-L687 HydrophobicContact CE3-CB 4.33Å; W663-L687 HydrophobicContact CE3-CD1 3.76Å; W663-L687 HydrophobicContact CE3-CG 4.47Å; W663-L687 HydrophobicContact CG-CD1 3.79Å; W663-L687 VanDerWaalsContact CH2-CA 3.42Å; W663-L687 HydrophobicContact CH2-CB 3.43Å; W663-L687 VanDerWaalsContact CH2-CB 3.43Å; W663-L687 HydrophobicContact CH2-CD1 4.23Å; W663-L687 HydrophobicContact CH2-CG 4.37Å; W663-L687 VanDerWaalsContact CH2-N 3.29Å; W663-L687 HydrophobicContact CZ2-CB 3.68Å; W663-L687 HydrophobicContact CZ2-CD1 3.98Å; W663-L687 HydrophobicContact CZ2-CG 4.43Å; W663-L687 VanDerWaalsContact CZ2-N 3.31Å; W663-L687 HydrophobicContact CZ3-CB 3.79Å; W663-L687 HydrophobicContact CZ3-CD1 4.13Å; W663-L687 HydrophobicContact CZ3-CG 4.39Å; T683-L687 PolarHBondContact O-N 2.95Å; F684-L687 HydrophobicContact CD2-CD2 4.18Å; F684-L687 HydrophobicContact CE2-CD2 4.17Å; F684-L687 WeakPolarHBondContact O-CB 3.49Å; F684-L687 PolarHBondContact O-N 3.26Å; F684-L687 VanDerWaalsContact O-N 3.1Å; A685-L687 VanDerWaalsContact C-N 3.34Å; A685-L687 PolarHBondContact O-N 3.49Å; L687-Q689 VanDerWaalsContact C-N 3.3Å; L687-Q689 PolarHBondContact O-N 2.89Å; L687-D690 PolarHBondContact O-N 3.32Å; L687-H691 WeakPolarHBondContact O-CB 3.37Å; L687-H691 PolarHBondContact O-N 3.07Å
688	V	92.6	Very high	89.7	Confident	18 Å²	18	45.8 Å²	45.8	11%	0.109	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-42	177.9	175.2	0	0	0	0	110.9	I582 F684 A685 K692	I582-V688 HydrophobicContact CD1-CG2 4.44Å; I582-V688 HydrophobicContact CG1-CG2 4.37Å; F684-V688 HydrophobicContact CD1-CG2 3.99Å; F684-V688 HydrophobicContact CE1-CG2 3.6Å; F684-V688 HydrophobicContact CZ-CG2 4.09Å; F684-V688 PolarHBondContact O-N 3.05Å; A685-V688 PolarHBondContact O-N 3.13Å; V688-K692 HydrophobicContact CG1-CD 4.47Å; V688-K692 WeakPolarHBondContact O-CG 3.48Å; V688-K692 PolarHBondContact O-N 3.04Å; V688-K692 VanDerWaalsContact O-N 3.07Å
689	Q	93.5	Very high	90.4	Very high	96 Å²	96	46.7 Å²	46.7	45%	0.449	24%	0.241	S	C	.	.	H	α-helix	trans	-69.2	-42.4	179	-173.3	57.7	47.4	0	0	112.4	A685 N686 L687 H691 K692 N693	A685-Q689 WeakPolarHBondContact O-CB 3.38Å; A685-Q689 PolarHBondContact O-N 3.3Å; N686-Q689 PolarHBondContact O-N 3.05Å; L687-Q689 VanDerWaalsContact C-N 3.3Å; L687-Q689 PolarHBondContact O-N 2.89Å; Q689-H691 VanDerWaalsContact C-N 3.34Å; Q689-K692 PolarHBondContact O-N 3.47Å; Q689-N693 PolarHBondContact NE2-OD1 3.26Å; Q689-N693 WeakPolarHBondContact O-CB 3.42Å; Q689-N693 PolarHBondContact O-N 3.48Å; Q689-N693 PolarHBondContact O-ND2 2.87Å; Q689-N693 PolarHBondContact O-OD1 3.35Å
690	D	93.9	Very high	90.8	Very high	29 Å²	29	46.6 Å²	46.6	16%	0.155	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-38.8	176.9	-77.8	-26.3	0	0	0	111.9	F659 K662 W663 N686 L687 N693 L694	F659-D690 HydrophobicContact CD2-CB 4.4Å; F659-D690 HydrophobicContact CE2-CB 4.01Å; K662-D690 WeakPolarHBondContact CE-OD2 3.3Å; K662-D690 IonicContact NZ-OD1 2.85Å; K662-D690 PolarHBondContact NZ-OD1 2.66Å; K662-D690 IonicContact NZ-OD2 2.66Å; K662-D690 PolarHBondContact NZ-OD2 3.47Å; W663-D690 HydrophobicContact CZ2-CB 4.38Å; W663-D690 VanDerWaalsContact CZ2-OD2 3.25Å; W663-D690 WeakPolarHBondContact CZ2-OD2 3.37Å; W663-D690 PolarHBondContact NE1-OD2 3.5Å; N686-D690 VanDerWaalsContact O-CB 3.29Å; N686-D690 WeakPolarHBondContact O-CB 3.48Å; N686-D690 VanDerWaalsContact O-CG 3.24Å; N686-D690 PolarHBondContact O-N 2.87Å; L687-D690 PolarHBondContact O-N 3.32Å; D690-N693 PolarHBondContact O-N 3.28Å; D690-L694 WeakPolarHBondContact O-CB 3.48Å; D690-L694 PolarHBondContact O-N 3.47Å
691	H	95.3	Very high	91.4	Very high	5 Å²	5	41.3 Å²	41.3	2%	0.023	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-45.9	174.5	177.8	-117.3	0	0	0	111	I582 Y591 F659 L687 Q689 N693 L694 L695	I582-H691 HydrophobicContact CG2-CB 4.05Å; I582-H691 WeakPolarHBondContact CG2-ND1 3.39Å; I582-H691 PolarHBondContact O-CE1 2.9Å; Y591-H691 AromaticContact CE2-NE2 3.65Å; Y591-H691 PolarHBondContact OH-NE2 3.12Å; F659-H691 HydrophobicContact CE2-CB 4.25Å; F659-H691 HydrophobicContact CZ-CB 4.21Å; L687-H691 WeakPolarHBondContact O-CB 3.37Å; L687-H691 PolarHBondContact O-N 3.07Å; Q689-H691 VanDerWaalsContact C-N 3.34Å; H691-N693 VanDerWaalsContact C-N 3.3Å; H691-N693 PolarHBondContact O-N 2.85Å; H691-L694 WeakPolarHBondContact O-CB 3.49Å; H691-L694 PolarHBondContact O-N 3.28Å; H691-L694 VanDerWaalsContact O-N 3.16Å; H691-L695 WeakPolarHBondContact O-CG 3.23Å; H691-L695 PolarHBondContact O-N 2.99Å
692	K	94	Very high	91.6	Very high	111 Å²	111	36.7 Å²	36.7	48%	0.483	19%	0.191	S	C	.	.	H	α-helix	trans	-58.8	-41.6	173.4	-74	176.5	-179.5	179.9	0	112.2	V688 Q689 L695 N696	V688-K692 HydrophobicContact CG1-CD 4.47Å; V688-K692 WeakPolarHBondContact O-CG 3.48Å; V688-K692 PolarHBondContact O-N 3.04Å; V688-K692 VanDerWaalsContact O-N 3.07Å; Q689-K692 PolarHBondContact O-N 3.47Å; K692-L695 PolarHBondContact O-N 2.94Å; K692-N696 PolarHBondContact O-N 2.99Å; K692-N696 PolarHBondContact O-ND2 3.36Å
693	N	94.8	Very high	91.4	Very high	63 Å²	63	35.6 Å²	35.6	34%	0.337	19%	0.188	S	C	.	.	H	α-helix	trans	-64.2	-41.2	176.4	-66.5	-18.1	0	0	0	111.6	Q689 D690 H691 N696 E697	Q689-N693 PolarHBondContact NE2-OD1 3.26Å; Q689-N693 WeakPolarHBondContact O-CB 3.42Å; Q689-N693 PolarHBondContact O-N 3.48Å; Q689-N693 PolarHBondContact O-ND2 2.87Å; Q689-N693 PolarHBondContact O-OD1 3.35Å; D690-N693 PolarHBondContact O-N 3.28Å; H691-N693 VanDerWaalsContact C-N 3.3Å; H691-N693 PolarHBondContact O-N 2.85Å; N693-N696 PolarHBondContact O-N 2.93Å; N693-E697 WeakPolarHBondContact O-CB 3.45Å; N693-E697 WeakPolarHBondContact O-CG 3.43Å; N693-E697 PolarHBondContact O-N 2.81Å
694	L	94.6	Very high	91.1	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-47.2	173.8	168.7	140	0	0	0	111.3	Y591 I655 F659 D690 H691 N696 E697 L698	Y591-L694 WeakPolarHBondContact OH-CD2 3.31Å; I655-L694 HydrophobicContact CG2-CD1 3.99Å; I655-L694 HydrophobicContact CG2-CG 4.05Å; F659-L694 HydrophobicContact CB-CD1 3.37Å; F659-L694 HydrophobicContact CD1-CD1 3.98Å; F659-L694 HydrophobicContact CD2-CB 4.26Å; F659-L694 HydrophobicContact CD2-CD1 3.95Å; F659-L694 HydrophobicContact CG-CD1 3.5Å; D690-L694 WeakPolarHBondContact O-CB 3.48Å; D690-L694 PolarHBondContact O-N 3.47Å; H691-L694 WeakPolarHBondContact O-CB 3.49Å; H691-L694 PolarHBondContact O-N 3.28Å; H691-L694 VanDerWaalsContact O-N 3.16Å; L694-N696 PolarHBondContact O-N 3.19Å; L694-E697 PolarHBondContact O-N 3.25Å; L694-L698 HydrophobicContact CD2-CD1 3.56Å; L694-L698 HydrophobicContact CD2-CG 4.44Å; L694-L698 HydrophobicContact CG-CD1 4.01Å; L694-L698 HydrophobicContact CG-CG 4.4Å; L694-L698 WeakPolarHBondContact O-CB 3.46Å; L694-L698 VanDerWaalsContact O-CG 3.29Å; L694-L698 WeakPolarHBondContact O-CG 3.19Å; L694-L698 PolarHBondContact O-N 2.75Å
695	L	94.8	Very high	90.7	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-44.5	179	-66.2	174.4	0	0	0	111.8	S587 I590 Y591 H691 K692 E697 L698 Q699	S587-L695 VanDerWaalsContact CB-CD1 3.44Å; I590-L695 HydrophobicContact CB-CD2 4.31Å; I590-L695 HydrophobicContact CD1-CB 4.19Å; I590-L695 HydrophobicContact CD1-CD1 4.29Å; I590-L695 HydrophobicContact CG2-CB 4.26Å; I590-L695 HydrophobicContact CG2-CD2 3.99Å; Y591-L695 HydrophobicContact CD2-CD2 4.01Å; Y591-L695 HydrophobicContact CE1-CD2 4.28Å; Y591-L695 HydrophobicContact CE2-CD2 3.63Å; Y591-L695 HydrophobicContact CG-CD2 4.48Å; H691-L695 WeakPolarHBondContact O-CG 3.23Å; H691-L695 PolarHBondContact O-N 2.99Å; K692-L695 PolarHBondContact O-N 2.94Å; L695-E697 VanDerWaalsContact C-N 3.34Å; L695-E697 PolarHBondContact O-N 3.17Å; L695-L698 PolarHBondContact O-N 3.06Å; L695-Q699 WeakPolarHBondContact O-CG 3.24Å; L695-Q699 PolarHBondContact O-N 2.81Å
696	N	92.8	Very high	90.1	Very high	91 Å²	91	47 Å²	47	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-61.6	-42	176.5	-69.5	-22	0	0	0	111.8	K692 N693 L694 S700	K692-N696 PolarHBondContact O-N 2.99Å; K692-N696 PolarHBondContact O-ND2 3.36Å; N693-N696 PolarHBondContact O-N 2.93Å; L694-N696 PolarHBondContact O-N 3.19Å; N696-S700 WeakPolarHBondContact O-CB 3.5Å; N696-S700 PolarHBondContact O-N 3.39Å
697	E	90.8	Very high	89.3	Confident	66 Å²	66	49 Å²	49	31%	0.308	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-43.6	175.2	-76.7	-171.5	-157.3	0	0	111.5	I655 R658 N693 L694 L695 S700 V701	I655-E697 HydrophobicContact CD1-CB 4.18Å; R658-E697 IonicContact CZ-OE1 3.3Å; R658-E697 IonicContact CZ-OE2 3.89Å; R658-E697 IonicContact NH1-OE1 3.25Å; R658-E697 IonicContact NH1-OE2 3.2Å; R658-E697 IonicContact NH2-OE1 3.79Å; R658-E697 PolarHBondContact NH2-OE1 2.84Å; R658-E697 IonicContact NH2-OE2 2.87Å; R658-E697 PolarHBondContact NH2-OE2 2.83Å; N693-E697 WeakPolarHBondContact O-CB 3.45Å; N693-E697 WeakPolarHBondContact O-CG 3.43Å; N693-E697 PolarHBondContact O-N 2.81Å; L694-E697 PolarHBondContact O-N 3.25Å; L695-E697 VanDerWaalsContact C-N 3.34Å; L695-E697 PolarHBondContact O-N 3.17Å; E697-S700 PolarHBondContact O-N 3.06Å; E697-S700 PolarHBondContact O-OG 2.63Å; E697-V701 WeakPolarHBondContact O-CG2 3.35Å; E697-V701 PolarHBondContact O-N 3.31Å
698	L	91.5	Very high	88.6	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-45.4	176.8	-72.5	172.9	0	0	0	112	L483 Y591 V594 I652 I655 L694 L695 S700 V701 C702	L483-L698 HydrophobicContact CD1-CD1 3.91Å; L483-L698 HydrophobicContact CD1-CD2 4.27Å; L483-L698 HydrophobicContact CD2-CD1 3.86Å; L483-L698 HydrophobicContact CD2-CD2 4.2Å; Y591-L698 HydrophobicContact CE1-CD1 4.19Å; V594-L698 HydrophobicContact CG2-CB 4.2Å; I652-L698 HydrophobicContact CB-CD2 4.45Å; I652-L698 HydrophobicContact CG1-CD2 4.15Å; I652-L698 HydrophobicContact CG2-CD2 4.03Å; I655-L698 HydrophobicContact CB-CD2 4.49Å; I655-L698 HydrophobicContact CD1-CD2 4.37Å; I655-L698 HydrophobicContact CG2-CD2 4.18Å; I655-L698 HydrophobicContact CG2-CG 4.32Å; L694-L698 HydrophobicContact CD2-CD1 3.56Å; L694-L698 HydrophobicContact CD2-CG 4.44Å; L694-L698 HydrophobicContact CG-CD1 4.01Å; L694-L698 HydrophobicContact CG-CG 4.4Å; L694-L698 WeakPolarHBondContact O-CB 3.46Å; L694-L698 VanDerWaalsContact O-CG 3.29Å; L694-L698 WeakPolarHBondContact O-CG 3.19Å; L694-L698 PolarHBondContact O-N 2.75Å; L695-L698 PolarHBondContact O-N 3.06Å; L698-S700 VanDerWaalsContact C-N 3.3Å; L698-S700 PolarHBondContact O-N 3.29Å; L698-V701 PolarHBondContact O-N 2.88Å; L698-C702 VanDerWaalsContact O-CB 3.27Å; L698-C702 WeakPolarHBondContact O-CB 3.46Å; L698-C702 PolarHBondContact O-N 3.13Å; L698-C702 PolarHBondContact O-SG 2.95Å
699	Q	90.2	Very high	88.1	Confident	40 Å²	40	52.3 Å²	52.3	19%	0.187	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-40.7	175.2	-72.6	-178.4	-52.2	0	0	111.8	I590 L695 L703 L704 T705	I590-Q699 HydrophobicContact CG2-CG 3.47Å; I590-Q699 VanDerWaalsContact CG2-CG 3.47Å; L695-Q699 WeakPolarHBondContact O-CG 3.24Å; L695-Q699 PolarHBondContact O-N 2.81Å; Q699-L703 PolarHBondContact O-N 2.93Å; Q699-L703 VanDerWaalsContact O-N 3.1Å; Q699-L704 HydrophobicContact CB-CB 4.34Å; Q699-L704 HydrophobicContact CG-CB 4.46Å; Q699-L704 PolarHBondContact O-N 3.37Å; Q699-T705 HydrophobicContact CB-CG2 4.07Å
700	S	85.8	Confident	87.7	Confident	58 Å²	58	51.9 Å²	51.9	41%	0.406	28%	0.283	S	S	.	.	H	α-helix	trans	-66.5	-40.7	178.4	77.3	0	0	0	0	112.7	N696 E697 L698 L703	N696-S700 WeakPolarHBondContact O-CB 3.5Å; N696-S700 PolarHBondContact O-N 3.39Å; E697-S700 PolarHBondContact O-N 3.06Å; E697-S700 PolarHBondContact O-OG 2.63Å; L698-S700 VanDerWaalsContact C-N 3.3Å; L698-S700 PolarHBondContact O-N 3.29Å; S700-L703 PolarHBondContact O-N 3.33Å
701	V	86.4	Confident	87.1	Confident	28 Å²	28	52.1 Å²	52.1	17%	0.17	28%	0.284	C	S	.	.	H	α-helix	trans	-72.3	-39.8	178.9	169.9	0	0	0	0	111.3	L648 R651 I652 I655 E697 L698 L703	L648-V701 HydrophobicContact CD2-CG1 4.03Å; L648-V701 WeakPolarHBondContact CD2-O 3.45Å; R651-V701 HydrophobicContact CB-CG1 3.82Å; I652-V701 HydrophobicContact CG1-CG1 4.33Å; I655-V701 HydrophobicContact CD1-CG2 3.84Å; E697-V701 WeakPolarHBondContact O-CG2 3.35Å; E697-V701 PolarHBondContact O-N 3.31Å; L698-V701 PolarHBondContact O-N 2.88Å; V701-L703 PolarHBondContact O-N 2.94Å
702	C	85.3	Confident	86.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	6.2	178.6	-59.2	0	0	0	0	113.2	V594 F597 I652 L698 L704	V594-C702 HydrophobicContact CG2-CB 4.24Å; F597-C702 HydrophobicContact CD1-CB 3.7Å; F597-C702 WeakPolarHBondContact CD1-O 3.42Å; F597-C702 HydrophobicContact CE1-CB 4.04Å; F597-C702 VanDerWaalsContact CE1-O 3.23Å; F597-C702 WeakPolarHBondContact CE1-O 3.29Å; I652-C702 VanDerWaalsContact CD1-SG 3.54Å; L698-C702 VanDerWaalsContact O-CB 3.27Å; L698-C702 WeakPolarHBondContact O-CB 3.46Å; L698-C702 PolarHBondContact O-N 3.13Å; L698-C702 PolarHBondContact O-SG 2.95Å; C702-L704 HydrophobicContact CB-CD1 3.91Å; C702-L704 HydrophobicContact CB-CG 3.96Å; C702-L704 PolarHBondContact O-N 2.74Å
703	L	83.4	Confident	86.2	Confident	30 Å²	30	52.6 Å²	52.6	16%	0.157	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	25.7	176.4	-51.3	171.3	0	0	0	114.2	Q699 S700 V701 T705 T708 L711 F712 I715	Q699-L703 PolarHBondContact O-N 2.93Å; Q699-L703 VanDerWaalsContact O-N 3.1Å; S700-L703 PolarHBondContact O-N 3.33Å; V701-L703 PolarHBondContact O-N 2.94Å; L703-T705 VanDerWaalsContact C-N 3.3Å; L703-T705 PolarHBondContact O-N 3.41Å; L703-T708 VanDerWaalsContact CA-OG1 3.23Å; L703-T708 WeakPolarHBondContact CA-OG1 3.02Å; L703-T708 HydrophobicContact CD2-CG2 3.82Å; L703-T708 PolarHBondContact O-OG1 3.33Å; L703-L711 HydrophobicContact CD1-CB 4.23Å; L703-L711 HydrophobicContact CD2-CD1 4.27Å; L703-F712 HydrophobicContact CB-CB 4.36Å; L703-I715 HydrophobicContact CD1-CD1 3.29Å
704	L	83.5	Confident	85.8	Confident	46 Å²	46	51 Å²	51	24%	0.241	28%	0.283	C	S	.	.			trans	-86.7	1.2	-179.2	-59.6	171.4	0	0	0	113	D593 V594 Q699 C702 F712	D593-L704 HydrophobicContact CB-CD1 3.62Å; D593-L704 HydrophobicContact CB-CD2 4.38Å; V594-L704 HydrophobicContact CB-CD1 4.44Å; V594-L704 HydrophobicContact CG2-CD1 3.64Å; Q699-L704 HydrophobicContact CB-CB 4.34Å; Q699-L704 HydrophobicContact CG-CB 4.46Å; Q699-L704 PolarHBondContact O-N 3.37Å; C702-L704 HydrophobicContact CB-CD1 3.91Å; C702-L704 HydrophobicContact CB-CG 3.96Å; C702-L704 PolarHBondContact O-N 2.74Å; L704-F712 HydrophobicContact CD2-CD2 4.44Å; L704-F712 HydrophobicContact CD2-CE2 4Å
705	T	82.8	Confident	85.4	Confident	40 Å²	40	51.2 Å²	51.2	25%	0.245	28%	0.284	C	S	.	.	S	Bend	trans	-81.8	151.6	175.3	55.8	0	0	0	0	112.1	Q699 L703 S707 T708 S709	Q699-T705 HydrophobicContact CB-CG2 4.07Å; L703-T705 VanDerWaalsContact C-N 3.3Å; L703-T705 PolarHBondContact O-N 3.41Å; T705-S707 PolarHBondContact O-N 3Å; T705-S707 VanDerWaalsContact O-N 3.15Å; T705-S707 PolarHBondContact OG1-OG 3.13Å; T705-T708 PolarHBondContact N-OG1 3.49Å; T705-T708 PolarHBondContact O-N 3.22Å; T705-T708 PolarHBondContact O-OG1 3.25Å; T705-T708 WeakPolarHBondContact OG1-CG2 3.35Å; T705-T708 PolarHBondContact OG1-OG1 3.38Å; T705-S709 PolarHBondContact O-N 2.9Å
706	E	79.6	Confident	85	Confident	182 Å²	182	54 Å²	54	85%	0.85	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-55.9	-34.8	177.8	-66.4	179.2	-178.5	0	0	112.7	T708 S709	E706-T708 VanDerWaalsContact C-N 3.28Å; E706-T708 PolarHBondContact O-N 3.19Å; E706-S709 VanDerWaalsContact O-CB 3.3Å; E706-S709 WeakPolarHBondContact O-CB 3.47Å; E706-S709 PolarHBondContact O-N 3.49Å; E706-S709 PolarHBondContact O-OG 3.39Å
707	S	76.7	Confident	84.8	Confident	109 Å²	109	52 Å²	52	76%	0.762	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-68.8	-23.1	178.1	58.2	0	0	0	0	113.9	T705	T705-S707 PolarHBondContact O-N 3Å; T705-S707 VanDerWaalsContact O-N 3.15Å; T705-S707 PolarHBondContact OG1-OG 3.13Å
708	T	79.4	Confident	84.7	Confident	23 Å²	23	49 Å²	49	14%	0.141	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-101.5	2	179.9	52.6	0	0	0	0	113.1	L703 T705 E706 L710 L711 F712	L703-T708 VanDerWaalsContact CA-OG1 3.23Å; L703-T708 WeakPolarHBondContact CA-OG1 3.02Å; L703-T708 HydrophobicContact CD2-CG2 3.82Å; L703-T708 PolarHBondContact O-OG1 3.33Å; T705-T708 PolarHBondContact N-OG1 3.49Å; T705-T708 PolarHBondContact O-N 3.22Å; T705-T708 PolarHBondContact O-OG1 3.25Å; T705-T708 WeakPolarHBondContact OG1-CG2 3.35Å; T705-T708 PolarHBondContact OG1-OG1 3.38Å; E706-T708 VanDerWaalsContact C-N 3.28Å; E706-T708 PolarHBondContact O-N 3.19Å; T708-L710 VanDerWaalsContact C-N 3.26Å; T708-L710 PolarHBondContact O-N 3.19Å; T708-L711 WeakPolarHBondContact O-CB 3.36Å; T708-L711 PolarHBondContact O-N 3.13Å; T708-F712 PolarHBondContact O-N 3.48Å
709	S	81.2	Confident	84.5	Confident	65 Å²	65	49 Å²	49	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-51.2	-39.8	-179	55	0	0	0	0	114.1	T705 E706 F712 T713	T705-S709 PolarHBondContact O-N 2.9Å; E706-S709 VanDerWaalsContact O-CB 3.3Å; E706-S709 WeakPolarHBondContact O-CB 3.47Å; E706-S709 PolarHBondContact O-N 3.49Å; E706-S709 PolarHBondContact O-OG 3.39Å; S709-F712 PolarHBondContact O-N 2.96Å; S709-T713 WeakPolarHBondContact O-CB 3.41Å; S709-T713 PolarHBondContact O-N 3.36Å; S709-T713 PolarHBondContact O-OG1 3.07Å
710	L	84.6	Confident	84.4	Confident	88 Å²	88	49.1 Å²	49.1	46%	0.461	27%	0.272	S	S	.	.	H	α-helix	trans	-64.4	-45.1	176.5	-177	144.8	0	0	0	111.6	T708 F712 T713 E714 F760	T708-L710 VanDerWaalsContact C-N 3.26Å; T708-L710 PolarHBondContact O-N 3.19Å; L710-F712 VanDerWaalsContact C-N 3.34Å; L710-F712 PolarHBondContact O-N 3.45Å; L710-T713 PolarHBondContact O-N 2.97Å; L710-E714 WeakPolarHBondContact O-CG 3.31Å; L710-E714 PolarHBondContact O-N 3.08Å; L710-E714 VanDerWaalsContact O-N 3.1Å; L710-F760 HydrophobicContact CD2-CE1 3.88Å; L710-F760 HydrophobicContact CD2-CZ 4.08Å
711	L	82.7	Confident	84.5	Confident	33 Å²	33	47.1 Å²	47.1	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-65.5	-39.6	177.2	-69.3	174.4	0	0	0	111.6	L703 T708 E714 I715 L761 M764	L703-L711 HydrophobicContact CD1-CB 4.23Å; L703-L711 HydrophobicContact CD2-CD1 4.27Å; T708-L711 WeakPolarHBondContact O-CB 3.36Å; T708-L711 PolarHBondContact O-N 3.13Å; L711-E714 PolarHBondContact O-N 3.28Å; L711-I715 WeakPolarHBondContact O-CG1 3.27Å; L711-I715 PolarHBondContact O-N 3.37Å; L711-L761 HydrophobicContact CD2-CD2 3.76Å; L711-M764 HydrophobicContact CD2-CB 4.39Å
712	F	85	Confident	84.6	Confident	56 Å²	56	45.8 Å²	45.8	25%	0.246	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-46.7	174.8	-177.9	-89.5	0	0	0	111.4	F597 L703 L704 T708 S709 L710 E714 I715 Y716	F597-F712 HydrophobicContact CD2-CD2 4.04Å; F597-F712 AromaticContact CD2-CE2 3.43Å; F597-F712 HydrophobicContact CD2-CE2 3.43Å; F597-F712 VanDerWaalsContact CD2-CE2 3.43Å; F597-F712 HydrophobicContact CD2-CZ 4.37Å; F597-F712 AromaticContact CE2-CD2 3.78Å; F597-F712 HydrophobicContact CE2-CD2 3.78Å; F597-F712 AromaticContact CE2-CE2 3.63Å; F597-F712 HydrophobicContact CE2-CE2 3.63Å; F597-F712 HydrophobicContact CG-CE2 4.35Å; L703-F712 HydrophobicContact CB-CB 4.36Å; L704-F712 HydrophobicContact CD2-CD2 4.44Å; L704-F712 HydrophobicContact CD2-CE2 4Å; T708-F712 PolarHBondContact O-N 3.48Å; S709-F712 PolarHBondContact O-N 2.96Å; L710-F712 VanDerWaalsContact C-N 3.34Å; L710-F712 PolarHBondContact O-N 3.45Å; F712-E714 VanDerWaalsContact C-N 3.32Å; F712-E714 PolarHBondContact O-N 3.41Å; F712-I715 PolarHBondContact O-N 2.89Å; F712-Y716 HydrophobicContact CE1-CD2 4.48Å; F712-Y716 WeakPolarHBondContact O-CB 3.28Å; F712-Y716 PolarHBondContact O-N 3.11Å
713	T	85.1	Confident	84.6	Confident	71 Å²	71	46 Å²	46	44%	0.436	25%	0.25	S	C	.	.	H	α-helix	trans	-61	-40.6	178.7	-54.6	0	0	0	0	112	S709 L710 Y716 N717	S709-T713 WeakPolarHBondContact O-CB 3.41Å; S709-T713 PolarHBondContact O-N 3.36Å; S709-T713 PolarHBondContact O-OG1 3.07Å; L710-T713 PolarHBondContact O-N 2.97Å; T713-Y716 WeakPolarHBondContact O-CB 3.31Å; T713-Y716 PolarHBondContact O-N 3.48Å; T713-N717 VanDerWaalsContact O-CG 3.23Å; T713-N717 PolarHBondContact O-N 3.21Å; T713-N717 PolarHBondContact O-ND2 3.33Å
714	E	85.2	Confident	84.6	Confident	29 Å²	29	49.2 Å²	49.2	14%	0.136	26%	0.263	C	S	.	.	H	α-helix	trans	-66.8	-42.6	176.5	-69.3	-63.1	136.5	0	0	112.5	L710 L711 F712 Y716 N717 L718 H757 F760 L761	L710-E714 WeakPolarHBondContact O-CG 3.31Å; L710-E714 PolarHBondContact O-N 3.08Å; L710-E714 VanDerWaalsContact O-N 3.1Å; L711-E714 PolarHBondContact O-N 3.28Å; F712-E714 VanDerWaalsContact C-N 3.32Å; F712-E714 PolarHBondContact O-N 3.41Å; E714-Y716 VanDerWaalsContact C-N 3.32Å; E714-N717 PolarHBondContact O-N 3.27Å; E714-L718 WeakPolarHBondContact O-CG 3.2Å; E714-L718 PolarHBondContact O-N 3.23Å; E714-H757 IonicContact OE2-CE1 3.99Å; E714-H757 IonicContact OE2-CG 2.72Å; E714-H757 IonicContact OE2-ND1 3.06Å; E714-H757 PolarHBondContact OE2-ND1 3.37Å; E714-F760 HydrophobicContact CG-CD1 3.83Å; E714-F760 HydrophobicContact CG-CE1 3.68Å; E714-L761 HydrophobicContact CB-CD1 4.08Å; E714-L761 HydrophobicContact CB-CD2 3.69Å; E714-L761 HydrophobicContact CB-CG 3.95Å; E714-L761 HydrophobicContact CG-CD2 4.34Å
715	I	86.7	Confident	84.7	Confident	13 Å²	13	47 Å²	47	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-39.4	175.1	-69.4	165.2	0	0	0	110.6	L644 L703 L711 F712 N717 L718 C719 L761	L644-I715 HydrophobicContact CD1-CD1 4.12Å; L644-I715 HydrophobicContact CD1-CG1 4.19Å; L644-I715 HydrophobicContact CD1-CG2 4.25Å; L703-I715 HydrophobicContact CD1-CD1 3.29Å; L711-I715 WeakPolarHBondContact O-CG1 3.27Å; L711-I715 PolarHBondContact O-N 3.37Å; F712-I715 PolarHBondContact O-N 2.89Å; I715-N717 VanDerWaalsContact C-N 3.33Å; I715-N717 PolarHBondContact O-N 2.69Å; I715-L718 WeakPolarHBondContact O-CB 3.37Å; I715-L718 PolarHBondContact O-N 3.08Å; I715-C719 PolarHBondContact O-N 2.9Å; I715-C719 PolarHBondContact O-SG 3.28Å; I715-L761 HydrophobicContact CG1-CD1 4.42Å
716	Y	86.4	Confident	84.7	Confident	67 Å²	67	46.5 Å²	46.5	26%	0.263	25%	0.246	S	C	.	.	H	α-helix	trans	-58.7	-44.7	173.8	-173.1	-87.8	0	0	0	111.5	F563 D564 F712 T713 E714 L718 C719 N720	F563-Y716 HydrophobicContact CD1-CD2 4.15Å; F563-Y716 AromaticContact CD1-CE2 3.41Å; F563-Y716 HydrophobicContact CD1-CE2 3.41Å; F563-Y716 VanDerWaalsContact CD1-CE2 3.41Å; F563-Y716 AromaticContact CD1-CZ 3.68Å; F563-Y716 AromaticContact CE1-CD2 3.44Å; F563-Y716 HydrophobicContact CE1-CD2 3.44Å; F563-Y716 VanDerWaalsContact CE1-CD2 3.44Å; F563-Y716 AromaticContact CE1-CE2 3.13Å; F563-Y716 HydrophobicContact CE1-CE2 3.13Å; F563-Y716 HydrophobicContact CE1-CG 4.39Å; F563-Y716 AromaticContact CE1-CZ 3.86Å; F563-Y716 HydrophobicContact CZ-CD2 4.3Å; F563-Y716 HydrophobicContact CZ-CE2 4.33Å; D564-Y716 PolarHBondContact OD1-OH 3.42Å; F712-Y716 HydrophobicContact CE1-CD2 4.48Å; F712-Y716 WeakPolarHBondContact O-CB 3.28Å; F712-Y716 PolarHBondContact O-N 3.11Å; T713-Y716 WeakPolarHBondContact O-CB 3.31Å; T713-Y716 PolarHBondContact O-N 3.48Å; E714-Y716 VanDerWaalsContact C-N 3.32Å; Y716-L718 PolarHBondContact O-N 3Å; Y716-C719 WeakPolarHBondContact O-CB 3.45Å; Y716-C719 PolarHBondContact O-N 3.34Å; Y716-C719 VanDerWaalsContact O-N 3.17Å; Y716-N720 WeakPolarHBondContact CD1-ND2 3.46Å; Y716-N720 WeakPolarHBondContact CE1-ND2 3.38Å; Y716-N720 PolarHBondContact O-N 3.28Å
717	N	87.9	Confident	84.5	Confident	49 Å²	49	40.6 Å²	40.6	26%	0.262	22%	0.218	S	C	.	.	H	α-helix	trans	-61.9	-42.2	174.7	-69.7	-26.8	0	0	0	111.9	T713 E714 I715 C719 N720 M721	T713-N717 VanDerWaalsContact O-CG 3.23Å; T713-N717 PolarHBondContact O-N 3.21Å; T713-N717 PolarHBondContact O-ND2 3.33Å; E714-N717 PolarHBondContact O-N 3.27Å; I715-N717 VanDerWaalsContact C-N 3.33Å; I715-N717 PolarHBondContact O-N 2.69Å; N717-C719 VanDerWaalsContact C-N 3.33Å; N717-C719 PolarHBondContact O-N 3.34Å; N717-N720 PolarHBondContact O-N 2.85Å; N717-M721 HydrophobicContact CB-CE 4.39Å; N717-M721 WeakPolarHBondContact O-CG 3.49Å; N717-M721 PolarHBondContact O-N 2.86Å
718	L	89.3	Confident	84.5	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-60.3	-43.2	173	-69.1	-174.2	0	0	0	111.8	F641 E714 I715 Y716 N720 M721 G722 F754 H757 V758 L761 F784	F641-L718 HydrophobicContact CZ-CB 3.97Å; F641-L718 WeakPolarHBondContact CZ-O 3.42Å; E714-L718 WeakPolarHBondContact O-CG 3.2Å; E714-L718 PolarHBondContact O-N 3.23Å; I715-L718 WeakPolarHBondContact O-CB 3.37Å; I715-L718 PolarHBondContact O-N 3.08Å; Y716-L718 PolarHBondContact O-N 3Å; L718-N720 VanDerWaalsContact C-N 3.31Å; L718-N720 PolarHBondContact O-N 3.47Å; L718-M721 PolarHBondContact O-N 3Å; L718-G722 PolarHBondContact O-N 3.2Å; L718-F754 HydrophobicContact CD2-CD2 3.65Å; L718-F754 HydrophobicContact CD2-CE2 3.72Å; L718-H757 HydrophobicContact CD2-CB 3.57Å; L718-H757 HydrophobicContact CG-CB 4.38Å; L718-V758 HydrophobicContact CD1-CG2 4.42Å; L718-V758 HydrophobicContact CD2-CG2 4.01Å; L718-L761 HydrophobicContact CD1-CD1 3.4Å; L718-L761 VanDerWaalsContact CD1-CD1 3.4Å; L718-L761 HydrophobicContact CG-CD1 4.11Å; L718-F784 HydrophobicContact CD1-CE1 4.07Å; L718-F784 HydrophobicContact CD1-CZ 4.42Å
719	C	88.3	Confident	84.4	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-57.1	-47	177.1	-74.3	0	0	0	0	110.6	F563 V604 I715 Y716 N717 M721 G722 L723	F563-C719 HydrophobicContact CE2-CB 3.79Å; F563-C719 HydrophobicContact CZ-CB 3.73Å; V604-C719 HydrophobicContact CG2-CB 3.8Å; I715-C719 PolarHBondContact O-N 2.9Å; I715-C719 PolarHBondContact O-SG 3.28Å; Y716-C719 WeakPolarHBondContact O-CB 3.45Å; Y716-C719 PolarHBondContact O-N 3.34Å; Y716-C719 VanDerWaalsContact O-N 3.17Å; N717-C719 VanDerWaalsContact C-N 3.33Å; N717-C719 PolarHBondContact O-N 3.34Å; C719-M721 VanDerWaalsContact C-N 3.35Å; C719-M721 PolarHBondContact O-N 3.02Å; C719-G722 PolarHBondContact O-N 2.75Å; C719-L723 WeakPolarHBondContact O-CG 3.24Å; C719-L723 PolarHBondContact O-N 3.42Å
720	N	87.6	Confident	83.9	Confident	41 Å²	41	35.3 Å²	35.3	22%	0.219	18%	0.179	C	C	.	.	H	α-helix	trans	-61.7	-40.3	176.5	-71.3	-25.7	0	0	0	112.5	Y716 N717 L718 G722 L723 Q724	Y716-N720 WeakPolarHBondContact CD1-ND2 3.46Å; Y716-N720 WeakPolarHBondContact CE1-ND2 3.38Å; Y716-N720 PolarHBondContact O-N 3.28Å; N717-N720 PolarHBondContact O-N 2.85Å; L718-N720 VanDerWaalsContact C-N 3.31Å; L718-N720 PolarHBondContact O-N 3.47Å; N720-G722 VanDerWaalsContact C-N 3.34Å; N720-G722 PolarHBondContact O-N 2.69Å; N720-L723 PolarHBondContact O-N 2.06Å; N720-Q724 VanDerWaalsContact O-CG 3.3Å; N720-Q724 WeakPolarHBondContact O-CG 3.49Å; N720-Q724 PolarHBondContact O-N 3.01Å
721	M	88.2	Confident	82.8	Confident	17 Å²	17	35.6 Å²	35.6	8%	0.084	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-38.3	174.9	-68.2	175.6	-160.3	0	0	112.4	M637 N717 L718 C719 L723 Q724 L725 L750 Q753 F754 H757	M637-M721 HydrophobicContact CE-CB 4.14Å; N717-M721 HydrophobicContact CB-CE 4.39Å; N717-M721 WeakPolarHBondContact O-CG 3.49Å; N717-M721 PolarHBondContact O-N 2.86Å; L718-M721 PolarHBondContact O-N 3Å; C719-M721 VanDerWaalsContact C-N 3.35Å; C719-M721 PolarHBondContact O-N 3.02Å; M721-L723 VanDerWaalsContact C-N 3.31Å; M721-L723 PolarHBondContact O-N 3.41Å; M721-Q724 PolarHBondContact O-N 3.43Å; M721-L725 PolarHBondContact O-N 3.13Å; M721-L750 HydrophobicContact CB-CD1 3.85Å; M721-L750 HydrophobicContact CG-CD1 3.94Å; M721-Q753 HydrophobicContact CE-CB 4.12Å; M721-Q753 HydrophobicContact SD-CB 4.21Å; M721-F754 HydrophobicContact CB-CD2 4.43Å; M721-F754 HydrophobicContact SD-CB 4.11Å; M721-F754 HydrophobicContact SD-CD2 4.42Å; M721-H757 WeakPolarHBondContact CE-CD2 3.15Å; M721-H757 VanDerWaalsContact CE-NE2 3.27Å; M721-H757 WeakPolarHBondContact CE-NE2 3.49Å
722	G	87.2	Confident	81.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-39.7	172.9	0	0	0	0	0	112.5	L718 C719 N720 R726	L718-G722 PolarHBondContact O-N 3.2Å; C719-G722 PolarHBondContact O-N 2.75Å; N720-G722 VanDerWaalsContact C-N 3.34Å; N720-G722 PolarHBondContact O-N 2.69Å; G722-R726 PolarHBondContact O-N 3Å
723	L	85.2	Confident	79.8	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.026	17%	0.169	C	C	.	.	H	α-helix	trans	-73.9	-36.1	175.7	-64.6	-178	0	0	0	113.1	M559 F563 Y603 V604 C719 N720 M721 L725 R726 E727	M559-L723 HydrophobicContact CE-CB 3.92Å; F563-L723 HydrophobicContact CB-CD1 4.06Å; F563-L723 HydrophobicContact CD2-CD1 3.69Å; F563-L723 HydrophobicContact CG-CD1 4.26Å; Y603-L723 HydrophobicContact CD1-CD1 4.46Å; Y603-L723 HydrophobicContact CD1-CD2 4.02Å; Y603-L723 HydrophobicContact CE1-CD1 4.1Å; Y603-L723 HydrophobicContact CE1-CD2 3.61Å; V604-L723 HydrophobicContact CG2-CD2 4.27Å; V604-L723 HydrophobicContact CG2-CG 4.2Å; C719-L723 WeakPolarHBondContact O-CG 3.24Å; C719-L723 PolarHBondContact O-N 3.42Å; N720-L723 PolarHBondContact O-N 2.06Å; M721-L723 VanDerWaalsContact C-N 3.31Å; M721-L723 PolarHBondContact O-N 3.41Å; L723-L725 VanDerWaalsContact C-N 3.28Å; L723-L725 PolarHBondContact O-N 3.25Å; L723-R726 WeakPolarHBondContact O-CB 3.25Å; L723-R726 PolarHBondContact O-N 2.71Å; L723-R726 VanDerWaalsContact O-N 3.14Å; L723-E727 PolarHBondContact O-N 3.16Å
724	Q	84.2	Confident	78.1	Confident	96 Å²	96	34.5 Å²	34.5	45%	0.449	18%	0.178	S	C	.	.	H	α-helix	trans	-59.7	-39.8	171.8	-74.2	173.8	22.4	0	0	111.2	N720 M721 R726 E727 L728 L750	N720-Q724 VanDerWaalsContact O-CG 3.3Å; N720-Q724 WeakPolarHBondContact O-CG 3.49Å; N720-Q724 PolarHBondContact O-N 3.01Å; M721-Q724 PolarHBondContact O-N 3.43Å; Q724-R726 VanDerWaalsContact C-N 3.31Å; Q724-R726 PolarHBondContact O-N 2.99Å; Q724-E727 PolarHBondContact O-N 3.47Å; Q724-L728 WeakPolarHBondContact O-CG 3.4Å; Q724-L728 PolarHBondContact O-N 2.98Å; Q724-L750 HydrophobicContact CB-CD1 4.21Å; Q724-L750 HydrophobicContact CB-CD2 4.37Å
725	L	85.4	Confident	76.3	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-43.1	174.2	-178.4	61.9	0	0	0	111.6	L608 L611 L630 L633 R634 M637 M721 L723 E727 L728 W729 L750	L608-L725 HydrophobicContact CD2-CD2 3.88Å; L611-L725 HydrophobicContact CD1-CG 4.45Å; L630-L725 HydrophobicContact CD2-CD1 3.64Å; L633-L725 HydrophobicContact CD2-CD1 3.95Å; L633-L725 HydrophobicContact CG-CD1 4.42Å; L633-L725 HydrophobicContact CG-CD2 4.28Å; R634-L725 HydrophobicContact CB-CD2 4.05Å; M637-L725 HydrophobicContact CE-CB 4.44Å; M637-L725 HydrophobicContact SD-CB 3.94Å; M637-L725 HydrophobicContact SD-CD2 3.49Å; M637-L725 WeakPolarHBondContact SD-CD2 2.86Å; M637-L725 HydrophobicContact SD-CG 4.33Å; M721-L725 PolarHBondContact O-N 3.13Å; L723-L725 VanDerWaalsContact C-N 3.28Å; L723-L725 PolarHBondContact O-N 3.25Å; L725-E727 VanDerWaalsContact C-N 3.33Å; L725-E727 PolarHBondContact O-N 3.33Å; L725-L728 PolarHBondContact O-N 3.48Å; L725-W729 WeakPolarHBondContact O-CB 3.18Å; L725-W729 PolarHBondContact O-N 3.45Å; L725-L750 HydrophobicContact CB-CD2 4.06Å; L725-L750 HydrophobicContact CD1-CD2 4.35Å
726	R	82.1	Confident	74.6	Confident	29 Å²	29	41.1 Å²	41.1	11%	0.109	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-37.5	175.7	168.3	173.9	166.7	-151.8	-14.1	112.4	S502 Y603 S607 L611 G722 L723 Q724 W729 S730	S502-R726 VanDerWaalsContact CA-NH2 3.31Å; S502-R726 PolarHBondContact O-NH2 2.95Å; S502-R726 PolarHBondContact OG-NH2 3.42Å; Y603-R726 VanDerWaalsContact CZ-NH1 3.34Å; Y603-R726 PolarHBondContact OH-NH1 3.07Å; S607-R726 PolarHBondContact OG-NH1 3.27Å; L611-R726 HydrophobicContact CD2-CB 4.17Å; L611-R726 HydrophobicContact CD2-CG 4.09Å; G722-R726 PolarHBondContact O-N 3Å; L723-R726 WeakPolarHBondContact O-CB 3.25Å; L723-R726 PolarHBondContact O-N 2.71Å; L723-R726 VanDerWaalsContact O-N 3.14Å; Q724-R726 VanDerWaalsContact C-N 3.31Å; Q724-R726 PolarHBondContact O-N 2.99Å; R726-W729 WeakPolarHBondContact O-CB 3.45Å; R726-W729 PolarHBondContact O-N 3.24Å; R726-S730 PolarHBondContact O-N 3.12Å; R726-S730 VanDerWaalsContact O-N 3.09Å; R726-S730 PolarHBondContact O-OG 3.29Å
727	E	76.7	Confident	72.9	Confident	58 Å²	58	44.7 Å²	44.7	27%	0.271	25%	0.249	S	C	.	.	H	α-helix	trans	-65.8	-47.2	176.1	-175.2	173.8	-166.4	0	0	111.5	L723 Q724 L725 W729 S730 K731	L723-E727 PolarHBondContact O-N 3.16Å; Q724-E727 PolarHBondContact O-N 3.47Å; L725-E727 VanDerWaalsContact C-N 3.33Å; L725-E727 PolarHBondContact O-N 3.33Å; E727-W729 PolarHBondContact O-N 2.86Å; E727-S730 PolarHBondContact O-N 3.32Å; E727-S730 PolarHBondContact O-OG 3.4Å; E727-K731 HydrophobicContact CG-CD 3.83Å; E727-K731 HydrophobicContact CG-CG 4.2Å; E727-K731 PolarHBondContact O-N 3.3Å; E727-K731 WeakPolarHBondContact OE1-CD 3.4Å; E727-K731 WeakPolarHBondContact OE1-CE 3.42Å; E727-K731 IonicContact OE1-NZ 2.68Å; E727-K731 PolarHBondContact OE1-NZ 2.92Å
728	L	76.7	Confident	71.1	Confident	21 Å²	21	44.3 Å²	44.3	11%	0.11	25%	0.25	C	C	.	.	H	α-helix	trans	-58	-34.6	174.2	-69.1	175.5	0	0	0	111.5	Q724 L725 D732 F743 K746 I747 L750	Q724-L728 WeakPolarHBondContact O-CG 3.4Å; Q724-L728 PolarHBondContact O-N 2.98Å; L725-L728 PolarHBondContact O-N 3.48Å; L728-D732 WeakPolarHBondContact CD2-OD2 3.31Å; L728-F743 HydrophobicContact CB-CE2 4.3Å; L728-F743 HydrophobicContact CD2-CE2 4.3Å; L728-K746 HydrophobicContact CD2-CB 4.49Å; L728-K746 HydrophobicContact CD2-CD 3.99Å; L728-I747 HydrophobicContact CD1-CG1 4.24Å; L728-L750 HydrophobicContact CD1-CD2 3.85Å
729	W	77.3	Confident	69.6	Low	7 Å²	7	50 Å²	50	3%	0.027	28%	0.276	C	S	.	.	H	α-helix	trans	-70.5	-27.7	175.7	-158.8	-72.8	0	0	0	113.8	L611 H612 F613 L616 L630 I631 L725 R726 E727 L733	L611-W729 HydrophobicContact CB-CD2 3.94Å; L611-W729 HydrophobicContact CB-CE3 4.27Å; L611-W729 HydrophobicContact CB-CG 4.37Å; L611-W729 HydrophobicContact CB-CH2 4.32Å; L611-W729 HydrophobicContact CB-CZ2 4.03Å; L611-W729 HydrophobicContact CB-CZ3 4.45Å; L611-W729 HydrophobicContact CD1-CB 4.48Å; L611-W729 HydrophobicContact CD1-CD2 4.13Å; L611-W729 HydrophobicContact CD1-CE3 3.96Å; L611-W729 HydrophobicContact CD1-CG 4.37Å; L611-W729 HydrophobicContact CD2-CB 3.94Å; L611-W729 HydrophobicContact CD2-CD2 4.21Å; L611-W729 HydrophobicContact CD2-CG 3.78Å; L611-W729 HydrophobicContact CG-CD2 4.3Å; L611-W729 HydrophobicContact CG-CG 4.38Å; H612-W729 WeakPolarHBondContact O-CZ2 3.28Å; H612-W729 PolarHBondContact O-NE1 2.86Å; F613-W729 HydrophobicContact CD1-CH2 4.47Å; L616-W729 HydrophobicContact CD1-CH2 3.36Å; L616-W729 HydrophobicContact CD1-CZ2 3.39Å; L616-W729 HydrophobicContact CD1-CZ3 4.15Å; L616-W729 HydrophobicContact CD2-CD2 4.42Å; L616-W729 HydrophobicContact CD2-CH2 4.38Å; L616-W729 HydrophobicContact CD2-CZ2 4.15Å; L616-W729 HydrophobicContact CG-CH2 4Å; L616-W729 HydrophobicContact CG-CZ2 3.55Å; L630-W729 HydrophobicContact CB-CE3 4.49Å; L630-W729 HydrophobicContact CB-CZ3 4.1Å; I631-W729 HydrophobicContact CG1-CH2 4.48Å; L725-W729 WeakPolarHBondContact O-CB 3.18Å; L725-W729 PolarHBondContact O-N 3.45Å; R726-W729 WeakPolarHBondContact O-CB 3.45Å; R726-W729 PolarHBondContact O-N 3.24Å; E727-W729 PolarHBondContact O-N 2.86Å; W729-L733 WeakPolarHBondContact O-CD1 3.43Å
730	S	69.9	Low	68.3	Low	59 Å²	59	53.1 Å²	53.1	41%	0.413	30%	0.296	S	S	.	.	H	α-helix	trans	-103.9	-47.3	-171.7	52	0	0	0	0	114.2	R726 E727 S734	R726-S730 PolarHBondContact O-N 3.12Å; R726-S730 VanDerWaalsContact O-N 3.09Å; R726-S730 PolarHBondContact O-OG 3.29Å; E727-S730 PolarHBondContact O-N 3.32Å; E727-S730 PolarHBondContact O-OG 3.4Å; S730-S734 PolarHBondContact O-OG 3.3Å
731	K	61.8	Low	67.3	Low	94 Å²	94	55 Å²	55	41%	0.409	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-49.3	-176.3	-70.7	-172.8	-174	169.1	0	112.9	P558 E727 L733 S734 S735	P558-K731 VanDerWaalsContact CG-NZ 3.31Å; E727-K731 HydrophobicContact CG-CD 3.83Å; E727-K731 HydrophobicContact CG-CG 4.2Å; E727-K731 PolarHBondContact O-N 3.3Å; E727-K731 WeakPolarHBondContact OE1-CD 3.4Å; E727-K731 WeakPolarHBondContact OE1-CE 3.42Å; E727-K731 IonicContact OE1-NZ 2.68Å; E727-K731 PolarHBondContact OE1-NZ 2.92Å; K731-L733 VanDerWaalsContact C-N 3.34Å; K731-L733 PolarHBondContact O-N 2.91Å; K731-S734 PolarHBondContact O-N 3.46Å; K731-S735 PolarHBondContact O-N 3.32Å
732	D	52.7	Low	66.4	Low	38 Å²	38	62 Å²	62	20%	0.203	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-19.9	-171.4	-81.3	-3.6	0	0	0	112.6	L728 F743 K746	L728-D732 WeakPolarHBondContact CD2-OD2 3.31Å; D732-F743 HydrophobicContact CB-CD2 3.69Å; D732-F743 HydrophobicContact CB-CE2 3.49Å; D732-F743 VanDerWaalsContact CB-CE2 3.49Å; D732-K746 IonicContact OD2-NZ 2.97Å; D732-K746 PolarHBondContact OD2-NZ 3.32Å
733	L	51.5	Low	65.7	Low	8 Å²	8	62.3 Å²	62.3	4%	0.042	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-25	170	-84.9	117.2	0	0	0	113.5	L616 T619 V620 W729 K731 F743	L616-L733 HydrophobicContact CD2-CD1 4Å; L616-L733 HydrophobicContact CD2-CD2 3.7Å; T619-L733 WeakPolarHBondContact CB-O 3.36Å; T619-L733 WeakPolarHBondContact OG1-CD2 3.38Å; V620-L733 HydrophobicContact CB-CD2 3.64Å; V620-L733 HydrophobicContact CB-CG 4.48Å; V620-L733 HydrophobicContact CG1-CD2 4.28Å; V620-L733 HydrophobicContact CG2-CB 4.16Å; V620-L733 HydrophobicContact CG2-CD2 3.31Å; V620-L733 HydrophobicContact CG2-CG 3.65Å; W729-L733 WeakPolarHBondContact O-CD1 3.43Å; K731-L733 VanDerWaalsContact C-N 3.34Å; K731-L733 PolarHBondContact O-N 2.91Å; L733-F743 HydrophobicContact CD1-CZ 4.48Å
734	S	50	Low	65.1	Low	91 Å²	91	66.2 Å²	66.2	64%	0.636	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-13.2	-177.6	-55.1	0	0	0	0	113.3	S730 K731 P736	S730-S734 PolarHBondContact O-OG 3.3Å; K731-S734 PolarHBondContact O-N 3.46Å; S734-P736 WeakPolarHBondContact O-CD 3.47Å
735	S	48.2	Very low	64.8	Low	52 Å²	52	66 Å²	66	36%	0.364	36%	0.361	S	S	.	.			trans	-85.1	118.8	-178.6	144.5	0	0	0	0	110.9	K731 N737 C738	K731-S735 PolarHBondContact O-N 3.32Å; S735-N737 PolarHBondContact O-N 2.9Å; S735-N737 VanDerWaalsContact O-N 3.1Å; S735-N737 PolarHBondContact OG-N 3.29Å; S735-C738 PolarHBondContact O-N 3.49Å
736	P	50.8	Low	64.6	Low	128 Å²	128	70.2 Å²	70.2	83%	0.831	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.5	-179.7	24.8	-32.7	0	0	0	114.4	S734	S734-P736 WeakPolarHBondContact O-CD 3.47Å
737	N	49.3	Very low	64.5	Low	143 Å²	143	68.9 Å²	68.9	77%	0.765	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	29.8	-178.7	-72.1	-5.9	0	0	0	113.4	S735 E739	S735-N737 PolarHBondContact O-N 2.9Å; S735-N737 VanDerWaalsContact O-N 3.1Å; S735-N737 PolarHBondContact OG-N 3.29Å; N737-E739 PolarHBondContact O-N 3.41Å
738	C	51.4	Low	64.8	Low	40 Å²	40	70.1 Å²	70.1	27%	0.27	38%	0.38	S	S	.	.			trans	-65.7	100.6	179.5	-168.3	0	0	0	0	111	S735 T740	S735-C738 PolarHBondContact O-N 3.49Å; C738-T740 PolarHBondContact O-N 3.39Å
739	E	56.9	Low	65.2	Low	121 Å²	121	74.9 Å²	74.9	57%	0.565	40%	0.4	S	S	*	.			trans	-60.2	100.9	164.6	-72.3	178.5	171.9	0	0	108.3	N737 S741 R742 F743	N737-E739 PolarHBondContact O-N 3.41Å; E739-S741 PolarHBondContact O-N 2.97Å; E739-S741 VanDerWaalsContact O-N 3.1Å; E739-R742 HydrophobicContact CB-CB 3.98Å; E739-R742 PolarHBondContact O-N 2.94Å; E739-F743 PolarHBondContact O-N 2.64Å
740	T	61.3	Low	65.6	Low	68 Å²	68	74.8 Å²	74.8	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-51.3	-35.7	-178.1	23.5	0	0	0	0	113.4	T622 C738 K744	T622-T740 HydrophobicContact CG2-CG2 3.19Å; C738-T740 PolarHBondContact O-N 3.39Å; T740-K744 VanDerWaalsContact O-CB 3.27Å; T740-K744 WeakPolarHBondContact O-CB 3.47Å; T740-K744 PolarHBondContact O-N 2.84Å
741	S	65.8	Low	66.3	Low	80 Å²	80	72.4 Å²	72.4	56%	0.559	38%	0.383	S	S	*	.	H	α-helix	trans	-65.1	-49.3	176.1	53.5	0	0	0	0	111.8	E739 F743 K744 V745	E739-S741 PolarHBondContact O-N 2.97Å; E739-S741 VanDerWaalsContact O-N 3.1Å; S741-F743 PolarHBondContact O-N 3.12Å; S741-K744 PolarHBondContact O-N 2.99Å; S741-V745 VanDerWaalsContact O-CG2 3.28Å; S741-V745 WeakPolarHBondContact O-CG2 3.42Å; S741-V745 PolarHBondContact O-N 2.87Å
742	R	70.3	Confident	67.5	Low	164 Å²	164	73.5 Å²	73.5	62%	0.619	39%	0.39	S	S	*	.	H	α-helix	trans	-65.4	-39.4	-179.9	-168.2	174.7	-177.6	168	-0.7	111.8	E739 V745 K746	E739-R742 HydrophobicContact CB-CB 3.98Å; E739-R742 PolarHBondContact O-N 2.94Å; R742-V745 PolarHBondContact O-N 3.04Å; R742-K746 WeakPolarHBondContact O-CG 3.18Å; R742-K746 PolarHBondContact O-N 3.19Å; R742-K746 VanDerWaalsContact O-N 3.09Å
743	F	71.6	Confident	69.1	Low	6 Å²	6	74.6 Å²	74.6	3%	0.026	39%	0.394	C	S	.	.	H	α-helix	trans	-64.9	-45.6	175.9	-176.4	-114.4	0	0	0	112	T626 L630 L728 D732 L733 E739 S741 V745 K746 I747	T626-F743 HydrophobicContact CG2-CD1 3.85Å; T626-F743 HydrophobicContact CG2-CE1 3.85Å; L630-F743 HydrophobicContact CD1-CE1 4.07Å; L630-F743 HydrophobicContact CD1-CZ 3.97Å; L728-F743 HydrophobicContact CB-CE2 4.3Å; L728-F743 HydrophobicContact CD2-CE2 4.3Å; D732-F743 HydrophobicContact CB-CD2 3.69Å; D732-F743 HydrophobicContact CB-CE2 3.49Å; D732-F743 VanDerWaalsContact CB-CE2 3.49Å; L733-F743 HydrophobicContact CD1-CZ 4.48Å; E739-F743 PolarHBondContact O-N 2.64Å; S741-F743 PolarHBondContact O-N 3.12Å; F743-V745 PolarHBondContact O-N 2.9Å; F743-K746 PolarHBondContact O-N 3.07Å; F743-I747 HydrophobicContact CD1-CD1 3.66Å; F743-I747 HydrophobicContact CD2-CD1 4.36Å; F743-I747 HydrophobicContact CE1-CD1 3.34Å; F743-I747 HydrophobicContact CE2-CD1 4.07Å; F743-I747 HydrophobicContact CG-CD1 4.18Å; F743-I747 HydrophobicContact CZ-CD1 3.58Å; F743-I747 HydrophobicContact CZ-CG1 4.47Å; F743-I747 WeakPolarHBondContact O-CG1 3.26Å; F743-I747 PolarHBondContact O-N 3.02Å; F743-I747 VanDerWaalsContact O-N 3.12Å
744	K	72.8	Confident	70.9	Confident	87 Å²	87	74.3 Å²	74.3	38%	0.378	39%	0.392	S	S	.	.	H	α-helix	trans	-60	-43.4	175.5	-176.1	174	174.6	176.2	0	112.2	T740 S741 K746 I747 E748	T740-K744 VanDerWaalsContact O-CB 3.27Å; T740-K744 WeakPolarHBondContact O-CB 3.47Å; T740-K744 PolarHBondContact O-N 2.84Å; S741-K744 PolarHBondContact O-N 2.99Å; K744-K746 PolarHBondContact O-N 3.03Å; K744-I747 PolarHBondContact O-N 2.71Å; K744-E748 WeakPolarHBondContact CE-OE1 3.49Å; K744-E748 HydrophobicContact CG-CG 4.44Å; K744-E748 WeakPolarHBondContact O-CG 3.43Å; K744-E748 PolarHBondContact O-N 3.04Å
745	V	79.1	Confident	72.6	Confident	93 Å²	93	71.1 Å²	71.1	56%	0.564	37%	0.368	S	S	*	.	H	α-helix	trans	-61.8	-42.4	177.1	171.3	0	0	0	0	111.8	S741 R742 F743 I747 E748 F749	S741-V745 VanDerWaalsContact O-CG2 3.28Å; S741-V745 WeakPolarHBondContact O-CG2 3.42Å; S741-V745 PolarHBondContact O-N 2.87Å; R742-V745 PolarHBondContact O-N 3.04Å; F743-V745 PolarHBondContact O-N 2.9Å; V745-I747 VanDerWaalsContact C-N 3.33Å; V745-I747 PolarHBondContact O-N 3.4Å; V745-E748 PolarHBondContact O-N 2.89Å; V745-F749 VanDerWaalsContact O-CB 3.29Å; V745-F749 WeakPolarHBondContact O-CB 3.49Å; V745-F749 PolarHBondContact O-N 3.12Å
746	K	81.2	Confident	74.5	Confident	87 Å²	87	72.3 Å²	72.3	38%	0.378	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-41.2	175.9	-73.3	-177.5	-170.6	176.6	0	112.3	L728 D732 R742 F743 K744 L750	L728-K746 HydrophobicContact CD2-CB 4.49Å; L728-K746 HydrophobicContact CD2-CD 3.99Å; D732-K746 IonicContact OD2-NZ 2.97Å; D732-K746 PolarHBondContact OD2-NZ 3.32Å; R742-K746 WeakPolarHBondContact O-CG 3.18Å; R742-K746 PolarHBondContact O-N 3.19Å; R742-K746 VanDerWaalsContact O-N 3.09Å; F743-K746 PolarHBondContact O-N 3.07Å; K744-K746 PolarHBondContact O-N 3.03Å; K746-L750 WeakPolarHBondContact O-CB 3.15Å; K746-L750 PolarHBondContact O-N 3.24Å
747	I	79.9	Confident	76.3	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-69.1	-45.4	180	-67.2	164.2	0	0	0	110.9	T626 H629 L630 L728 F743 K744 V745 F749 L750 S751	T626-I747 HydrophobicContact CG2-CD1 3.62Å; H629-I747 WeakPolarHBondContact CD2-CG2 3.42Å; L630-I747 HydrophobicContact CD1-CD1 3.94Å; L630-I747 HydrophobicContact CD2-CD1 3.61Å; L630-I747 HydrophobicContact CD2-CG1 3.8Å; L630-I747 HydrophobicContact CD2-CG2 4.08Å; L630-I747 HydrophobicContact CG-CD1 3.7Å; L630-I747 HydrophobicContact CG-CG1 4.4Å; L630-I747 HydrophobicContact CG-CG2 4.48Å; L728-I747 HydrophobicContact CD1-CG1 4.24Å; F743-I747 HydrophobicContact CD1-CD1 3.66Å; F743-I747 HydrophobicContact CD2-CD1 4.36Å; F743-I747 HydrophobicContact CE1-CD1 3.34Å; F743-I747 HydrophobicContact CE2-CD1 4.07Å; F743-I747 HydrophobicContact CG-CD1 4.18Å; F743-I747 HydrophobicContact CZ-CD1 3.58Å; F743-I747 HydrophobicContact CZ-CG1 4.47Å; F743-I747 WeakPolarHBondContact O-CG1 3.26Å; F743-I747 PolarHBondContact O-N 3.02Å; F743-I747 VanDerWaalsContact O-N 3.12Å; K744-I747 PolarHBondContact O-N 2.71Å; V745-I747 VanDerWaalsContact C-N 3.33Å; V745-I747 PolarHBondContact O-N 3.4Å; I747-F749 VanDerWaalsContact C-N 3.29Å; I747-F749 PolarHBondContact O-N 3.27Å; I747-L750 PolarHBondContact O-N 3.21Å; I747-S751 PolarHBondContact O-N 3.04Å
748	E	82.1	Confident	78.1	Confident	84 Å²	84	61 Å²	61	39%	0.393	30%	0.302	S	S	.	.	H	α-helix	trans	-60.8	-42.2	176.9	-73.8	178.8	175.1	0	0	110.7	K744 V745 S751 E752	K744-E748 WeakPolarHBondContact CE-OE1 3.49Å; K744-E748 HydrophobicContact CG-CG 4.44Å; K744-E748 WeakPolarHBondContact O-CG 3.43Å; K744-E748 PolarHBondContact O-N 3.04Å; V745-E748 PolarHBondContact O-N 2.89Å; E748-S751 PolarHBondContact O-N 3.21Å; E748-E752 WeakPolarHBondContact O-CB 3.35Å; E748-E752 PolarHBondContact O-N 2.79Å
749	F	84.7	Confident	79.8	Confident	121 Å²	121	64.7 Å²	64.7	53%	0.531	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-45.8	174	-178.3	-100.3	0	0	0	112.3	V745 I747 S751 E752 Q753	V745-F749 VanDerWaalsContact O-CB 3.29Å; V745-F749 WeakPolarHBondContact O-CB 3.49Å; V745-F749 PolarHBondContact O-N 3.12Å; I747-F749 VanDerWaalsContact C-N 3.29Å; I747-F749 PolarHBondContact O-N 3.27Å; F749-S751 VanDerWaalsContact C-N 3.34Å; F749-S751 PolarHBondContact O-N 3.5Å; F749-E752 PolarHBondContact O-N 2.89Å; F749-Q753 HydrophobicContact CD1-CG 4.16Å; F749-Q753 HydrophobicContact CE1-CG 3.79Å; F749-Q753 HydrophobicContact CE2-CG 4.19Å; F749-Q753 HydrophobicContact CZ-CG 3.82Å; F749-Q753 VanDerWaalsContact CZ-NE2 3.28Å; F749-Q753 WeakPolarHBondContact O-CB 3.47Å; F749-Q753 VanDerWaalsContact O-CG 3.29Å; F749-Q753 WeakPolarHBondContact O-CG 3.24Å; F749-Q753 PolarHBondContact O-N 3.16Å
750	L	86.4	Confident	81.2	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-41	177	-178.8	63.2	0	0	0	111.8	L633 M637 M721 Q724 L725 L728 K746 I747 F754	L633-L750 HydrophobicContact CD2-CD2 4.1Å; L633-L750 HydrophobicContact CD2-CG 4.21Å; M637-L750 HydrophobicContact CE-CD2 4.43Å; M637-L750 HydrophobicContact CE-CG 4.3Å; M721-L750 HydrophobicContact CB-CD1 3.85Å; M721-L750 HydrophobicContact CG-CD1 3.94Å; Q724-L750 HydrophobicContact CB-CD1 4.21Å; Q724-L750 HydrophobicContact CB-CD2 4.37Å; L725-L750 HydrophobicContact CB-CD2 4.06Å; L725-L750 HydrophobicContact CD1-CD2 4.35Å; L728-L750 HydrophobicContact CD1-CD2 3.85Å; K746-L750 WeakPolarHBondContact O-CB 3.15Å; K746-L750 PolarHBondContact O-N 3.24Å; I747-L750 PolarHBondContact O-N 3.21Å; L750-F754 VanDerWaalsContact O-CB 3.24Å; L750-F754 WeakPolarHBondContact O-CB 3.02Å; L750-F754 PolarHBondContact O-N 3.47Å
751	S	85.5	Confident	82.4	Confident	8 Å²	8	59 Å²	59	6%	0.056	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-44.4	175.8	-173.5	0	0	0	0	111.5	I747 E748 F749 F754 D755	I747-S751 PolarHBondContact O-N 3.04Å; E748-S751 PolarHBondContact O-N 3.21Å; F749-S751 VanDerWaalsContact C-N 3.34Å; F749-S751 PolarHBondContact O-N 3.5Å; S751-F754 PolarHBondContact O-N 3.27Å; S751-D755 WeakPolarHBondContact O-CB 3.12Å; S751-D755 VanDerWaalsContact O-CG 3.26Å; S751-D755 PolarHBondContact O-N 2.76Å; S751-D755 VanDerWaalsContact O-OD2 3.13Å; S751-D755 PolarHBondContact OG-OD2 2.87Å
752	E	86	Confident	83.3	Confident	118 Å²	118	55.8 Å²	55.8	55%	0.551	26%	0.26	S	S	*	.	H	α-helix	trans	-64.1	-45.4	179.4	-174.3	177.4	-174.8	0	0	111.5	E748 F749 D755 N756	E748-E752 WeakPolarHBondContact O-CB 3.35Å; E748-E752 PolarHBondContact O-N 2.79Å; F749-E752 PolarHBondContact O-N 2.89Å; E752-D755 PolarHBondContact O-N 2.91Å; E752-N756 WeakPolarHBondContact O-CB 3.36Å; E752-N756 PolarHBondContact O-N 2.69Å; E752-N756 PolarHBondContact O-ND2 2.88Å
753	Q	87.1	Confident	84	Confident	61 Å²	61	51.6 Å²	51.6	29%	0.285	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-49.1	174.8	-69.5	-63.7	-12.2	0	0	111.2	M721 F749 D755 N756 H757	M721-Q753 HydrophobicContact CE-CB 4.12Å; M721-Q753 HydrophobicContact SD-CB 4.21Å; F749-Q753 HydrophobicContact CD1-CG 4.16Å; F749-Q753 HydrophobicContact CE1-CG 3.79Å; F749-Q753 HydrophobicContact CE2-CG 4.19Å; F749-Q753 HydrophobicContact CZ-CG 3.82Å; F749-Q753 VanDerWaalsContact CZ-NE2 3.28Å; F749-Q753 WeakPolarHBondContact O-CB 3.47Å; F749-Q753 VanDerWaalsContact O-CG 3.29Å; F749-Q753 WeakPolarHBondContact O-CG 3.24Å; F749-Q753 PolarHBondContact O-N 3.16Å; Q753-D755 PolarHBondContact O-N 3.46Å; Q753-N756 WeakPolarHBondContact O-CB 3.48Å; Q753-N756 PolarHBondContact O-N 3.48Å; Q753-H757 PolarHBondContact O-CD2 2.71Å; Q753-H757 PolarHBondContact O-N 3.1Å
754	F	88.1	Confident	84.5	Confident	1 Å²	1	54 Å²	54	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-47.9	178.2	-179.6	-99.8	0	0	0	112	L633 K636 M637 I640 L718 M721 L750 S751 N756 H757 V758	L633-F754 HydrophobicContact CD1-CD1 4.27Å; K636-F754 HydrophobicContact CB-CE1 4.26Å; M637-F754 HydrophobicContact CB-CE2 4.4Å; M637-F754 HydrophobicContact CB-CZ 4.15Å; M637-F754 HydrophobicContact CE-CB 4.08Å; M637-F754 HydrophobicContact CE-CD2 3.66Å; M637-F754 HydrophobicContact CE-CE2 4.19Å; M637-F754 HydrophobicContact CE-CG 3.82Å; M637-F754 HydrophobicContact CG-CD1 4.35Å; M637-F754 HydrophobicContact CG-CD2 4Å; M637-F754 HydrophobicContact CG-CE1 3.94Å; M637-F754 HydrophobicContact CG-CE2 3.57Å; M637-F754 HydrophobicContact CG-CG 4.36Å; M637-F754 HydrophobicContact CG-CZ 3.52Å; I640-F754 HydrophobicContact CD1-CE1 3.91Å; I640-F754 HydrophobicContact CD1-CE2 4.44Å; I640-F754 HydrophobicContact CD1-CZ 3.48Å; I640-F754 VanDerWaalsContact CD1-CZ 3.48Å; I640-F754 HydrophobicContact CG1-CZ 4.32Å; L718-F754 HydrophobicContact CD2-CD2 3.65Å; L718-F754 HydrophobicContact CD2-CE2 3.72Å; M721-F754 HydrophobicContact CB-CD2 4.43Å; M721-F754 HydrophobicContact SD-CB 4.11Å; M721-F754 HydrophobicContact SD-CD2 4.42Å; L750-F754 VanDerWaalsContact O-CB 3.24Å; L750-F754 WeakPolarHBondContact O-CB 3.02Å; L750-F754 PolarHBondContact O-N 3.47Å; S751-F754 PolarHBondContact O-N 3.27Å; F754-N756 VanDerWaalsContact C-N 3.3Å; F754-N756 PolarHBondContact O-N 2.87Å; F754-H757 PolarHBondContact O-N 3.37Å; F754-V758 HydrophobicContact CD1-CG2 4.04Å; F754-V758 HydrophobicContact CD2-CG2 4.31Å; F754-V758 HydrophobicContact CE1-CG2 3.69Å; F754-V758 HydrophobicContact CE2-CG2 3.98Å; F754-V758 HydrophobicContact CG-CG2 4.35Å; F754-V758 HydrophobicContact CZ-CG2 3.66Å; F754-V758 WeakPolarHBondContact O-CB 3.33Å; F754-V758 WeakPolarHBondContact O-CG2 3.11Å; F754-V758 PolarHBondContact O-N 3.37Å
755	D	86.9	Confident	84.8	Confident	25 Å²	25	50.4 Å²	50.4	13%	0.134	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-37.1	178.8	-71.4	-41.4	0	0	0	111.3	K636 S751 E752 Q753 V758 Q759 T792	K636-D755 IonicContact NZ-OD1 3.28Å; K636-D755 PolarHBondContact NZ-OD1 2.87Å; K636-D755 IonicContact NZ-OD2 2.67Å; K636-D755 PolarHBondContact NZ-OD2 3.14Å; S751-D755 WeakPolarHBondContact O-CB 3.12Å; S751-D755 VanDerWaalsContact O-CG 3.26Å; S751-D755 PolarHBondContact O-N 2.76Å; S751-D755 VanDerWaalsContact O-OD2 3.13Å; S751-D755 PolarHBondContact OG-OD2 2.87Å; E752-D755 PolarHBondContact O-N 2.91Å; Q753-D755 PolarHBondContact O-N 3.46Å; D755-V758 PolarHBondContact O-N 3.41Å; D755-Q759 VanDerWaalsContact O-CB 3.23Å; D755-Q759 WeakPolarHBondContact O-CB 3.33Å; D755-Q759 PolarHBondContact O-N 3.48Å; D755-T792 WeakPolarHBondContact OD2-CG2 3.47Å
756	N	88.2	Confident	84.9	Confident	77 Å²	77	46.7 Å²	46.7	41%	0.412	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-48.9	174.6	-71.4	-26.2	0	0	0	112.4	E752 Q753 F754 Q759 F760	E752-N756 WeakPolarHBondContact O-CB 3.36Å; E752-N756 PolarHBondContact O-N 2.69Å; E752-N756 PolarHBondContact O-ND2 2.88Å; Q753-N756 WeakPolarHBondContact O-CB 3.48Å; Q753-N756 PolarHBondContact O-N 3.48Å; F754-N756 VanDerWaalsContact C-N 3.3Å; F754-N756 PolarHBondContact O-N 2.87Å; N756-Q759 PolarHBondContact O-N 3.4Å; N756-F760 WeakPolarHBondContact O-CB 3.32Å; N756-F760 PolarHBondContact O-N 3.37Å
757	H	87.7	Confident	84.8	Confident	33 Å²	33	50.2 Å²	50.2	15%	0.153	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-39.6	178	-77.9	-80.6	0	0	0	112	E714 L718 M721 Q753 F754 F760 L761	E714-H757 IonicContact OE2-CE1 3.99Å; E714-H757 IonicContact OE2-CG 2.72Å; E714-H757 IonicContact OE2-ND1 3.06Å; E714-H757 PolarHBondContact OE2-ND1 3.37Å; L718-H757 HydrophobicContact CD2-CB 3.57Å; L718-H757 HydrophobicContact CG-CB 4.38Å; M721-H757 WeakPolarHBondContact CE-CD2 3.15Å; M721-H757 VanDerWaalsContact CE-NE2 3.27Å; M721-H757 WeakPolarHBondContact CE-NE2 3.49Å; Q753-H757 PolarHBondContact O-CD2 2.71Å; Q753-H757 PolarHBondContact O-N 3.1Å; F754-H757 PolarHBondContact O-N 3.37Å; H757-F760 PolarHBondContact O-N 3.16Å; H757-L761 WeakPolarHBondContact O-CB 3.25Å; H757-L761 WeakPolarHBondContact O-CG 3.23Å; H757-L761 PolarHBondContact O-N 2.75Å
758	V	87.4	Confident	84.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-41.5	175.9	171.1	0	0	0	0	111.4	I640 L718 F754 D755 S762 F784 A787 A788	I640-V758 HydrophobicContact CD1-CB 4.1Å; I640-V758 HydrophobicContact CD1-CG1 3.63Å; I640-V758 HydrophobicContact CD1-CG2 3.23Å; L718-V758 HydrophobicContact CD1-CG2 4.42Å; L718-V758 HydrophobicContact CD2-CG2 4.01Å; F754-V758 HydrophobicContact CD1-CG2 4.04Å; F754-V758 HydrophobicContact CD2-CG2 4.31Å; F754-V758 HydrophobicContact CE1-CG2 3.69Å; F754-V758 HydrophobicContact CE2-CG2 3.98Å; F754-V758 HydrophobicContact CG-CG2 4.35Å; F754-V758 HydrophobicContact CZ-CG2 3.66Å; F754-V758 WeakPolarHBondContact O-CB 3.33Å; F754-V758 WeakPolarHBondContact O-CG2 3.11Å; F754-V758 PolarHBondContact O-N 3.37Å; D755-V758 PolarHBondContact O-N 3.41Å; V758-S762 WeakPolarHBondContact O-CB 3.18Å; V758-S762 PolarHBondContact O-N 2.96Å; V758-F784 HydrophobicContact CG1-CD1 4.22Å; V758-A787 HydrophobicContact CG1-CB 3.92Å; V758-A788 HydrophobicContact CG1-CB 4.25Å
759	Q	86.7	Confident	84	Confident	117 Å²	117	49.8 Å²	49.8	55%	0.547	24%	0.243	S	C	.	.	H	α-helix	trans	-65.8	-42.2	175.7	-173.2	171.4	-1.4	0	0	111	D755 N756 S762 T763	D755-Q759 VanDerWaalsContact O-CB 3.23Å; D755-Q759 WeakPolarHBondContact O-CB 3.33Å; D755-Q759 PolarHBondContact O-N 3.48Å; N756-Q759 PolarHBondContact O-N 3.4Å; Q759-S762 PolarHBondContact O-N 3.06Å; Q759-T763 WeakPolarHBondContact O-CG2 3.29Å; Q759-T763 PolarHBondContact O-N 3.36Å; Q759-T763 PolarHBondContact O-OG1 3.28Å
760	F	86.9	Confident	83.3	Confident	69 Å²	69	53.9 Å²	53.9	30%	0.303	26%	0.255	S	S	.	.	H	α-helix	trans	-58.6	-53.6	174.1	-179.6	-106.4	0	0	0	111.6	L710 E714 N756 H757 S762 T763 M764	L710-F760 HydrophobicContact CD2-CE1 3.88Å; L710-F760 HydrophobicContact CD2-CZ 4.08Å; E714-F760 HydrophobicContact CG-CD1 3.83Å; E714-F760 HydrophobicContact CG-CE1 3.68Å; N756-F760 WeakPolarHBondContact O-CB 3.32Å; N756-F760 PolarHBondContact O-N 3.37Å; H757-F760 PolarHBondContact O-N 3.16Å; F760-S762 VanDerWaalsContact C-N 3.32Å; F760-S762 PolarHBondContact O-N 2.64Å; F760-T763 PolarHBondContact O-N 3.05Å; F760-T763 VanDerWaalsContact O-N 3.16Å; F760-T763 PolarHBondContact O-OG1 3.19Å; F760-M764 HydrophobicContact CD1-CG 4.43Å; F760-M764 HydrophobicContact CD2-CE 4.44Å; F760-M764 HydrophobicContact CD2-CG 4.49Å; F760-M764 HydrophobicContact CE1-CE 4.49Å; F760-M764 HydrophobicContact CE1-CG 4.07Å; F760-M764 HydrophobicContact CE2-CE 3.45Å; F760-M764 VanDerWaalsContact CE2-CE 3.45Å; F760-M764 HydrophobicContact CE2-CG 4.15Å; F760-M764 HydrophobicContact CZ-CE 3.49Å; F760-M764 VanDerWaalsContact CZ-CE 3.49Å; F760-M764 HydrophobicContact CZ-CG 3.93Å; F760-M764 WeakPolarHBondContact O-CG 3.19Å; F760-M764 PolarHBondContact O-N 3.07Å
761	L	86.2	Confident	82.3	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-40.4	176.5	-78.5	170	0	0	0	112.5	L711 E714 I715 L718 H757 T763 M764 L765 F784	L711-L761 HydrophobicContact CD2-CD2 3.76Å; E714-L761 HydrophobicContact CB-CD1 4.08Å; E714-L761 HydrophobicContact CB-CD2 3.69Å; E714-L761 HydrophobicContact CB-CG 3.95Å; E714-L761 HydrophobicContact CG-CD2 4.34Å; I715-L761 HydrophobicContact CG1-CD1 4.42Å; L718-L761 HydrophobicContact CD1-CD1 3.4Å; L718-L761 VanDerWaalsContact CD1-CD1 3.4Å; L718-L761 HydrophobicContact CG-CD1 4.11Å; H757-L761 WeakPolarHBondContact O-CB 3.25Å; H757-L761 WeakPolarHBondContact O-CG 3.23Å; H757-L761 PolarHBondContact O-N 2.75Å; L761-T763 PolarHBondContact O-N 3.34Å; L761-M764 PolarHBondContact O-N 3.34Å; L761-L765 VanDerWaalsContact O-CB 3.26Å; L761-L765 WeakPolarHBondContact O-CB 3.36Å; L761-L765 VanDerWaalsContact O-CG 3.24Å; L761-L765 WeakPolarHBondContact O-CG 3.38Å; L761-L765 PolarHBondContact O-N 3.43Å; L761-F784 HydrophobicContact CB-CD1 3.84Å; L761-F784 HydrophobicContact CB-CE1 3.8Å; L761-F784 HydrophobicContact CD1-CE1 3.68Å; L761-F784 HydrophobicContact CD1-CZ 4.21Å; L761-F784 HydrophobicContact CG-CE1 4.4Å
762	S	85.3	Confident	81.1	Confident	11 Å²	11	62.3 Å²	62.3	8%	0.077	30%	0.303	C	S	.	.	H	α-helix	trans	-59.7	-46.8	175.1	-179.2	0	0	0	0	111.6	V758 Q759 F760 T766 K785	V758-S762 WeakPolarHBondContact O-CB 3.18Å; V758-S762 PolarHBondContact O-N 2.96Å; Q759-S762 PolarHBondContact O-N 3.06Å; F760-S762 VanDerWaalsContact C-N 3.32Å; F760-S762 PolarHBondContact O-N 2.64Å; S762-T766 WeakPolarHBondContact O-CB 3.5Å; S762-T766 PolarHBondContact O-N 2.65Å; S762-T766 PolarHBondContact O-OG1 3.29Å; S762-K785 WeakPolarHBondContact OG-CA 3.45Å; S762-K785 WeakPolarHBondContact OG-CG 3.32Å
763	T	85.3	Confident	79.5	Confident	77 Å²	77	63.6 Å²	63.6	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-42.1	177.4	61.5	0	0	0	0	112.1	Q759 F760 L761 T766 R767	Q759-T763 WeakPolarHBondContact O-CG2 3.29Å; Q759-T763 PolarHBondContact O-N 3.36Å; Q759-T763 PolarHBondContact O-OG1 3.28Å; F760-T763 PolarHBondContact O-N 3.05Å; F760-T763 VanDerWaalsContact O-N 3.16Å; F760-T763 PolarHBondContact O-OG1 3.19Å; L761-T763 PolarHBondContact O-N 3.34Å; T763-T766 PolarHBondContact O-N 3.21Å; T763-R767 VanDerWaalsContact O-CB 3.29Å; T763-R767 WeakPolarHBondContact O-CB 3.45Å; T763-R767 PolarHBondContact O-N 3.46Å
764	M	80.8	Confident	78.2	Confident	57 Å²	57	61.9 Å²	61.9	28%	0.281	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-52.6	178	-75.9	-62.5	177.6	0	0	111.7	L711 F760 L761 T766 R767 S768	L711-M764 HydrophobicContact CD2-CB 4.39Å; F760-M764 HydrophobicContact CD1-CG 4.43Å; F760-M764 HydrophobicContact CD2-CE 4.44Å; F760-M764 HydrophobicContact CD2-CG 4.49Å; F760-M764 HydrophobicContact CE1-CE 4.49Å; F760-M764 HydrophobicContact CE1-CG 4.07Å; F760-M764 HydrophobicContact CE2-CE 3.45Å; F760-M764 VanDerWaalsContact CE2-CE 3.45Å; F760-M764 HydrophobicContact CE2-CG 4.15Å; F760-M764 HydrophobicContact CZ-CE 3.49Å; F760-M764 VanDerWaalsContact CZ-CE 3.49Å; F760-M764 HydrophobicContact CZ-CG 3.93Å; F760-M764 WeakPolarHBondContact O-CG 3.19Å; F760-M764 PolarHBondContact O-N 3.07Å; L761-M764 PolarHBondContact O-N 3.34Å; M764-T766 VanDerWaalsContact C-N 3.28Å; M764-T766 PolarHBondContact O-N 3.24Å; M764-R767 PolarHBondContact O-N 2.97Å; M764-R767 VanDerWaalsContact O-N 3.12Å; M764-S768 WeakPolarHBondContact O-CB 2.85Å; M764-S768 PolarHBondContact O-N 3.12Å; M764-S768 PolarHBondContact O-OG 2.8Å; M764-S768 VanDerWaalsContact O-OG 3.06Å
765	L	79.7	Confident	77	Confident	10 Å²	10	70.4 Å²	70.4	5%	0.052	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-40	177	-70.5	172.7	0	0	0	111.6	L761 S768 V769 L780 F784	L761-L765 VanDerWaalsContact O-CB 3.26Å; L761-L765 WeakPolarHBondContact O-CB 3.36Å; L761-L765 VanDerWaalsContact O-CG 3.24Å; L761-L765 WeakPolarHBondContact O-CG 3.38Å; L761-L765 PolarHBondContact O-N 3.43Å; L765-S768 PolarHBondContact O-N 3.5Å; L765-V769 WeakPolarHBondContact O-CB 3.32Å; L765-V769 VanDerWaalsContact O-CG2 3.24Å; L765-V769 WeakPolarHBondContact O-CG2 3.41Å; L765-V769 PolarHBondContact O-N 3.26Å; L765-L780 HydrophobicContact CD1-CD2 4.14Å; L765-L780 HydrophobicContact CD1-CG 4.1Å; L765-L780 HydrophobicContact CD2-CD2 4.4Å; L765-F784 HydrophobicContact CD1-CB 4.29Å; L765-F784 HydrophobicContact CD1-CD2 3.67Å; L765-F784 HydrophobicContact CD1-CE2 4.11Å; L765-F784 HydrophobicContact CD1-CG 3.93Å
766	T	80.7	Confident	75.9	Confident	15 Å²	15	74.6 Å²	74.6	9%	0.092	37%	0.371	C	S	.	.	H	α-helix	trans	-64.5	-41.9	176.2	-57.7	0	0	0	0	111.9	S762 T763 M764 R770 S781 K785	S762-T766 WeakPolarHBondContact O-CB 3.5Å; S762-T766 PolarHBondContact O-N 2.65Å; S762-T766 PolarHBondContact O-OG1 3.29Å; T763-T766 PolarHBondContact O-N 3.21Å; M764-T766 VanDerWaalsContact C-N 3.28Å; M764-T766 PolarHBondContact O-N 3.24Å; T766-R770 WeakPolarHBondContact O-CB 3.44Å; T766-R770 VanDerWaalsContact O-CG 3.27Å; T766-R770 WeakPolarHBondContact O-CG 3.47Å; T766-R770 PolarHBondContact O-N 3.48Å; T766-S781 PolarHBondContact OG1-OG 3.17Å; T766-K785 WeakPolarHBondContact OG1-CE 2.95Å
767	R	79.4	Confident	75	Confident	162 Å²	162	73.1 Å²	73.1	61%	0.611	36%	0.363	S	S	*	.	H	α-helix	trans	-67	-41.6	177.2	-170.9	176.6	-177.3	175.2	0.1	110.7	T763 M764 R770 L771	T763-R767 VanDerWaalsContact O-CB 3.29Å; T763-R767 WeakPolarHBondContact O-CB 3.45Å; T763-R767 PolarHBondContact O-N 3.46Å; M764-R767 PolarHBondContact O-N 2.97Å; M764-R767 VanDerWaalsContact O-N 3.12Å; R767-R770 PolarHBondContact O-N 3.3Å; R767-L771 HydrophobicContact CG-CD1 3.71Å; R767-L771 HydrophobicContact CG-CG 4.31Å; R767-L771 WeakPolarHBondContact O-CB 3.38Å; R767-L771 WeakPolarHBondContact O-CG 3.26Å; R767-L771 PolarHBondContact O-N 3.1Å
768	S	73.4	Confident	74.3	Confident	44 Å²	44	76.4 Å²	76.4	31%	0.308	38%	0.381	S	S	.	.	H	α-helix	trans	-61.8	-45.1	175	-61.8	0	0	0	0	112	M764 L765 R770 L771 S772	M764-S768 WeakPolarHBondContact O-CB 2.85Å; M764-S768 PolarHBondContact O-N 3.12Å; M764-S768 PolarHBondContact O-OG 2.8Å; M764-S768 VanDerWaalsContact O-OG 3.06Å; L765-S768 PolarHBondContact O-N 3.5Å; S768-R770 VanDerWaalsContact C-N 3.27Å; S768-R770 PolarHBondContact O-N 2.94Å; S768-L771 PolarHBondContact O-N 2.91Å; S768-S772 WeakPolarHBondContact O-CB 3.25Å; S768-S772 PolarHBondContact O-N 3.5Å; S768-S772 PolarHBondContact O-OG 2.84Å
769	V	71.8	Confident	73.7	Confident	33 Å²	33	82 Å²	82	20%	0.2	40%	0.403	C	S	.	.	H	α-helix	trans	-64.8	-28.9	175	171.7	0	0	0	0	112.5	L765 S772 L777 L778	L765-V769 WeakPolarHBondContact O-CB 3.32Å; L765-V769 VanDerWaalsContact O-CG2 3.24Å; L765-V769 WeakPolarHBondContact O-CG2 3.41Å; L765-V769 PolarHBondContact O-N 3.26Å; V769-S772 CarbonylContact C-O 3.56Å; V769-L777 HydrophobicContact CG2-CB 3.56Å; V769-L778 HydrophobicContact CG1-CD1 4.44Å
770	R	70	Confident	73.3	Confident	206 Å²	206	77 Å²	77	78%	0.777	38%	0.38	S	S	*	.	H	α-helix	trans	-79.4	-38.4	176.6	-76.7	175.4	178.5	174.4	0.6	113.1	T766 R767 S768	T766-R770 WeakPolarHBondContact O-CB 3.44Å; T766-R770 VanDerWaalsContact O-CG 3.27Å; T766-R770 WeakPolarHBondContact O-CG 3.47Å; T766-R770 PolarHBondContact O-N 3.48Å; R767-R770 PolarHBondContact O-N 3.3Å; S768-R770 VanDerWaalsContact C-N 3.27Å; S768-R770 PolarHBondContact O-N 2.94Å
771	L	65.6	Low	72.9	Confident	137 Å²	137	73.9 Å²	73.9	72%	0.717	37%	0.367	S	S	*	.	H	α-helix	trans	-83.9	-37.3	-177	-71.8	171.4	0	0	0	112.6	R767 S768	R767-L771 HydrophobicContact CG-CD1 3.71Å; R767-L771 HydrophobicContact CG-CG 4.31Å; R767-L771 WeakPolarHBondContact O-CB 3.38Å; R767-L771 WeakPolarHBondContact O-CG 3.26Å; R767-L771 PolarHBondContact O-N 3.1Å; S768-L771 PolarHBondContact O-N 2.91Å
772	S	60.3	Low	72.6	Confident	53 Å²	53	76.1 Å²	76.1	37%	0.371	38%	0.383	S	S	.	.	S	Bend	trans	-104.5	143.4	178.3	71	0	0	0	0	109.5	S768 V769 A774	S768-S772 WeakPolarHBondContact O-CB 3.25Å; S768-S772 PolarHBondContact O-N 3.5Å; S768-S772 PolarHBondContact O-OG 2.84Å; V769-S772 CarbonylContact C-O 3.56Å; S772-A774 PolarHBondContact O-N 3.24Å; S772-A774 VanDerWaalsContact OG-CB 3.25Å; S772-A774 WeakPolarHBondContact OG-CB 3.4Å
773	T	51.9	Low	72.4	Confident	145 Å²	145	76 Å²	76	89%	0.89	38%	0.382	S	S	*	.			trans	-67.2	25.6	172.1	46	0	0	0	0	113	K775	T773-K775 PolarHBondContact O-N 3.49Å
774	A	60	Low	72.2	Confident	26 Å²	26	72.5 Å²	72.5	22%	0.215	36%	0.36	C	S	.	.			trans	-74	65.4	177	0	0	0	0	0	111	S772 Q776 L777	S772-A774 PolarHBondContact O-N 3.24Å; S772-A774 VanDerWaalsContact OG-CB 3.25Å; S772-A774 WeakPolarHBondContact OG-CB 3.4Å; A774-Q776 PolarHBondContact O-N 2.85Å; A774-L777 HydrophobicContact CB-CD1 4.23Å; A774-L777 HydrophobicContact CB-CG 4.42Å; A774-L777 PolarHBondContact O-N 3.39Å
775	K	62.4	Low	72.2	Confident	179 Å²	179	74.2 Å²	74.2	78%	0.778	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-47.5	-25.3	165.6	-70.2	-176.7	179.1	179	0	111.7	T773 L777 L778	T773-K775 PolarHBondContact O-N 3.49Å; K775-L777 PolarHBondContact O-N 3.28Å; K775-L778 WeakPolarHBondContact O-CB 3.49Å; K775-L778 PolarHBondContact O-N 3.39Å
776	Q	64.6	Low	72.3	Confident	113 Å²	113	77 Å²	77	53%	0.528	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-63.4	-34.9	-179.6	-61.3	-175.8	1.6	0	0	114.2	F647 R651 A774 L778	F647-Q776 WeakPolarHBondContact CE2-O 3.5Å; R651-Q776 VanDerWaalsContact NH2-CA 3.28Å; R651-Q776 VanDerWaalsContact NH2-CB 3.31Å; R651-Q776 PolarHBondContact NH2-O 2.86Å; A774-Q776 PolarHBondContact O-N 2.85Å; Q776-L778 VanDerWaalsContact C-N 3.3Å
777	L	69.5	Low	72.2	Confident	47 Å²	47	76.5 Å²	76.5	25%	0.246	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-85.1	-1.5	179.7	-69	173.9	0	0	0	113	F647 V769 A774 K775 Y779 L780 S781	F647-L777 HydrophobicContact CE1-CD2 4.34Å; F647-L777 HydrophobicContact CZ-CD2 3.87Å; V769-L777 HydrophobicContact CG2-CB 3.56Å; A774-L777 HydrophobicContact CB-CD1 4.23Å; A774-L777 HydrophobicContact CB-CG 4.42Å; A774-L777 PolarHBondContact O-N 3.39Å; K775-L777 PolarHBondContact O-N 3.28Å; L777-Y779 VanDerWaalsContact C-N 3.33Å; L777-Y779 PolarHBondContact O-N 3.44Å; L777-L780 HydrophobicContact CD2-CD2 4.48Å; L777-L780 PolarHBondContact O-N 3.47Å; L777-S781 VanDerWaalsContact O-CB 3.3Å; L777-S781 WeakPolarHBondContact O-CB 3.48Å; L777-S781 PolarHBondContact O-N 3.38Å
778	L	72.5	Confident	72.1	Confident	101 Å²	101	70.8 Å²	70.8	53%	0.529	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-39.1	-174	-167.4	144.1	0	0	0	112.1	V769 K775 Q776 S782	V769-L778 HydrophobicContact CG1-CD1 4.44Å; K775-L778 WeakPolarHBondContact O-CB 3.49Å; K775-L778 PolarHBondContact O-N 3.39Å; Q776-L778 VanDerWaalsContact C-N 3.3Å; L778-S782 WeakPolarHBondContact O-CB 3.4Å; L778-S782 PolarHBondContact O-N 3.37Å; L778-S782 PolarHBondContact O-OG 3.03Å
779	Y	75.3	Confident	72.2	Confident	118 Å²	118	72.4 Å²	72.4	46%	0.463	38%	0.379	S	S	.	.	H	α-helix	trans	-60.9	-53.9	174.9	-179.4	-100.4	0	0	0	111	N643 F647 L777 S781 S782 S783	N643-Y779 PolarHBondContact OD1-OH 3.17Å; F647-Y779 HydrophobicContact CD2-CD1 4.49Å; L777-Y779 VanDerWaalsContact C-N 3.33Å; L777-Y779 PolarHBondContact O-N 3.44Å; Y779-S781 PolarHBondContact O-N 3.22Å; Y779-S782 PolarHBondContact O-N 2.82Å; Y779-S782 VanDerWaalsContact O-N 3.1Å; Y779-S782 PolarHBondContact O-OG 3.47Å; Y779-S783 PolarHBondContact O-N 2.98Å; Y779-S783 PolarHBondContact O-OG 3.3Å
780	L	78.9	Confident	72.1	Confident	13 Å²	13	74 Å²	74	7%	0.068	38%	0.384	C	S	.	.	H	α-helix	trans	-60.1	-46.2	178.7	-168.6	66.7	0	0	0	111.8	L644 F647 L765 L777 S782 S783 F784	L644-L780 HydrophobicContact CB-CD1 4.31Å; F647-L780 HydrophobicContact CB-CD1 4.29Å; F647-L780 HydrophobicContact CD1-CD1 4.48Å; F647-L780 HydrophobicContact CD1-CD2 4.1Å; F647-L780 HydrophobicContact CD2-CB 4.34Å; F647-L780 HydrophobicContact CE1-CD2 4.19Å; F647-L780 HydrophobicContact CG-CB 4.36Å; F647-L780 HydrophobicContact CG-CD1 4.38Å; L765-L780 HydrophobicContact CD1-CD2 4.14Å; L765-L780 HydrophobicContact CD1-CG 4.1Å; L765-L780 HydrophobicContact CD2-CD2 4.4Å; L777-L780 HydrophobicContact CD2-CD2 4.48Å; L777-L780 PolarHBondContact O-N 3.47Å; L780-S782 VanDerWaalsContact C-N 3.27Å; L780-S782 PolarHBondContact O-N 3.32Å; L780-S783 PolarHBondContact O-N 2.91Å; L780-S783 VanDerWaalsContact O-N 3.17Å; L780-F784 HydrophobicContact CD1-CD2 3.99Å; L780-F784 HydrophobicContact CD1-CE2 3.7Å; L780-F784 HydrophobicContact CG-CD2 3.93Å; L780-F784 HydrophobicContact CG-CE2 3.92Å; L780-F784 WeakPolarHBondContact O-CD2 3.25Å; L780-F784 PolarHBondContact O-N 3.07Å
781	S	78.5	Confident	71.6	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-58.4	-39.2	175.8	177	0	0	0	0	111.9	T766 L777 Y779 K785	T766-S781 PolarHBondContact OG1-OG 3.17Å; L777-S781 VanDerWaalsContact O-CB 3.3Å; L777-S781 WeakPolarHBondContact O-CB 3.48Å; L777-S781 PolarHBondContact O-N 3.38Å; Y779-S781 PolarHBondContact O-N 3.22Å; S781-K785 VanDerWaalsContact O-CG 3.29Å; S781-K785 WeakPolarHBondContact O-CG 3.05Å; S781-K785 PolarHBondContact O-N 3.49Å
782	S	78.6	Confident	71.1	Confident	49 Å²	49	64.5 Å²	64.5	34%	0.343	36%	0.355	S	S	.	.	H	α-helix	trans	-66.7	-42.1	176.4	74.2	0	0	0	0	112.1	L778 Y779 L780 K785 V786	L778-S782 WeakPolarHBondContact O-CB 3.4Å; L778-S782 PolarHBondContact O-N 3.37Å; L778-S782 PolarHBondContact O-OG 3.03Å; Y779-S782 PolarHBondContact O-N 2.82Å; Y779-S782 VanDerWaalsContact O-N 3.1Å; Y779-S782 PolarHBondContact O-OG 3.47Å; L780-S782 VanDerWaalsContact C-N 3.27Å; L780-S782 PolarHBondContact O-N 3.32Å; S782-K785 WeakPolarHBondContact O-CB 3.4Å; S782-K785 PolarHBondContact O-N 3.3Å; S782-V786 WeakPolarHBondContact O-CG2 3.49Å; S782-V786 PolarHBondContact O-N 2.93Å
783	S	80.7	Confident	70.7	Confident	8 Å²	8	66.6 Å²	66.6	6%	0.056	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-43.4	177.1	-54.3	0	0	0	0	111.5	N643 Y779 L780 K785 V786 A787	N643-S783 PolarHBondContact OD1-OG 3.31Å; Y779-S783 PolarHBondContact O-N 2.98Å; Y779-S783 PolarHBondContact O-OG 3.3Å; L780-S783 PolarHBondContact O-N 2.91Å; L780-S783 VanDerWaalsContact O-N 3.17Å; S783-K785 VanDerWaalsContact C-N 3.34Å; S783-K785 PolarHBondContact O-N 3.12Å; S783-V786 PolarHBondContact O-N 3.06Å; S783-A787 WeakPolarHBondContact O-CB 3.46Å; S783-A787 PolarHBondContact O-N 3.34Å
784	F	82.1	Confident	70.6	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-65.5	-33.4	174.8	-87.8	-92.5	0	0	0	113	I640 L644 L718 V758 L761 L765 L780 A787 A788	I640-F784 HydrophobicContact CG2-CE1 3.82Å; I640-F784 HydrophobicContact CG2-CE2 4.11Å; I640-F784 HydrophobicContact CG2-CZ 3.56Å; L644-F784 HydrophobicContact CD1-CE2 4.33Å; L644-F784 HydrophobicContact CD1-CZ 4.15Å; L718-F784 HydrophobicContact CD1-CE1 4.07Å; L718-F784 HydrophobicContact CD1-CZ 4.42Å; V758-F784 HydrophobicContact CG1-CD1 4.22Å; L761-F784 HydrophobicContact CB-CD1 3.84Å; L761-F784 HydrophobicContact CB-CE1 3.8Å; L761-F784 HydrophobicContact CD1-CE1 3.68Å; L761-F784 HydrophobicContact CD1-CZ 4.21Å; L761-F784 HydrophobicContact CG-CE1 4.4Å; L765-F784 HydrophobicContact CD1-CB 4.29Å; L765-F784 HydrophobicContact CD1-CD2 3.67Å; L765-F784 HydrophobicContact CD1-CE2 4.11Å; L765-F784 HydrophobicContact CD1-CG 3.93Å; L780-F784 HydrophobicContact CD1-CD2 3.99Å; L780-F784 HydrophobicContact CD1-CE2 3.7Å; L780-F784 HydrophobicContact CG-CD2 3.93Å; L780-F784 HydrophobicContact CG-CE2 3.92Å; L780-F784 WeakPolarHBondContact O-CD2 3.25Å; L780-F784 PolarHBondContact O-N 3.07Å; F784-A787 PolarHBondContact O-N 3.4Å; F784-A788 VanDerWaalsContact O-CB 3.32Å; F784-A788 WeakPolarHBondContact O-CB 3.42Å; F784-A788 PolarHBondContact O-N 3.15Å
785	K	81.4	Confident	70.1	Confident	92 Å²	92	66.6 Å²	66.6	40%	0.4	35%	0.349	S	S	.	.	H	α-helix	trans	-66.4	-45.3	171.9	-77.1	175.2	-171	174	0	112.6	S762 T766 S781 S782 S783 A787 A788 S789	S762-K785 WeakPolarHBondContact OG-CA 3.45Å; S762-K785 WeakPolarHBondContact OG-CG 3.32Å; T766-K785 WeakPolarHBondContact OG1-CE 2.95Å; S781-K785 VanDerWaalsContact O-CG 3.29Å; S781-K785 WeakPolarHBondContact O-CG 3.05Å; S781-K785 PolarHBondContact O-N 3.49Å; S782-K785 WeakPolarHBondContact O-CB 3.4Å; S782-K785 PolarHBondContact O-N 3.3Å; S783-K785 VanDerWaalsContact C-N 3.34Å; S783-K785 PolarHBondContact O-N 3.12Å; K785-A787 VanDerWaalsContact C-N 3.26Å; K785-A787 PolarHBondContact O-N 2.97Å; K785-A788 PolarHBondContact O-N 3.41Å; K785-S789 WeakPolarHBondContact O-CB 3.45Å; K785-S789 PolarHBondContact O-N 2.87Å; K785-S789 PolarHBondContact O-OG 3.23Å
786	V	81.5	Confident	69.4	Low	70 Å²	70	66.4 Å²	66.4	42%	0.424	35%	0.348	S	S	.	.	H	α-helix	trans	-59.7	-44	175.5	172.2	0	0	0	0	109.4	F639 S782 S783 S789 F790	F639-V786 HydrophobicContact CE1-CB 4.27Å; F639-V786 HydrophobicContact CE1-CG1 4.08Å; F639-V786 HydrophobicContact CZ-CB 4.3Å; F639-V786 HydrophobicContact CZ-CG1 3.94Å; S782-V786 WeakPolarHBondContact O-CG2 3.49Å; S782-V786 PolarHBondContact O-N 2.93Å; S783-V786 PolarHBondContact O-N 3.06Å; V786-S789 WeakPolarHBondContact CA-OG 3.11Å; V786-S789 PolarHBondContact O-N 3.05Å; V786-S789 VanDerWaalsContact O-N 3.1Å; V786-S789 PolarHBondContact O-OG 3.16Å; V786-F790 PolarHBondContact O-N 3.01Å
787	A	77.4	Confident	68.3	Low	3 Å²	3	65.3 Å²	65.3	3%	0.025	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-46.1	177.9	0	0	0	0	0	113	F639 I640 V758 S783 F784 K785 S789 F790	F639-A787 HydrophobicContact CD1-CB 4.18Å; F639-A787 HydrophobicContact CE1-CB 4.27Å; I640-A787 HydrophobicContact CD1-CB 3.52Å; I640-A787 HydrophobicContact CG1-CB 3.54Å; V758-A787 HydrophobicContact CG1-CB 3.92Å; S783-A787 WeakPolarHBondContact O-CB 3.46Å; S783-A787 PolarHBondContact O-N 3.34Å; F784-A787 PolarHBondContact O-N 3.4Å; K785-A787 VanDerWaalsContact C-N 3.26Å; K785-A787 PolarHBondContact O-N 2.97Å; A787-S789 PolarHBondContact O-N 2.81Å; A787-F790 VanDerWaalsContact CA-CD2 3.47Å; A787-F790 HydrophobicContact CB-CD2 4.33Å; A787-F790 HydrophobicContact CB-CE2 4.37Å; A787-F790 WeakPolarHBondContact O-CB 3.33Å; A787-F790 VanDerWaalsContact O-CD2 3.3Å; A787-F790 WeakPolarHBondContact O-CD2 3.12Å; A787-F790 PolarHBondContact O-N 2.92Å; A787-F790 VanDerWaalsContact O-N 3.16Å
788	A	77.3	Confident	67	Low	42 Å²	42	67.5 Å²	67.5	35%	0.347	36%	0.364	S	S	.	.	H	α-helix	trans	-63.7	-24.6	175.1	0	0	0	0	0	112.9	V758 F784 K785	V758-A788 HydrophobicContact CG1-CB 4.25Å; F784-A788 VanDerWaalsContact O-CB 3.32Å; F784-A788 WeakPolarHBondContact O-CB 3.42Å; F784-A788 PolarHBondContact O-N 3.15Å; K785-A788 PolarHBondContact O-N 3.41Å
789	S	75.9	Confident	65.4	Low	79 Å²	79	67.4 Å²	67.4	55%	0.552	37%	0.369	S	S	*	.	H	α-helix	trans	-86.4	-7.4	177.5	74.3	0	0	0	0	114.4	K785 V786 A787 P791	K785-S789 WeakPolarHBondContact O-CB 3.45Å; K785-S789 PolarHBondContact O-N 2.87Å; K785-S789 PolarHBondContact O-OG 3.23Å; V786-S789 WeakPolarHBondContact CA-OG 3.11Å; V786-S789 PolarHBondContact O-N 3.05Å; V786-S789 VanDerWaalsContact O-N 3.1Å; V786-S789 PolarHBondContact O-OG 3.16Å; A787-S789 PolarHBondContact O-N 2.81Å; S789-P791 VanDerWaalsContact O-CD 3.24Å; S789-P791 WeakPolarHBondContact O-CD 3.13Å
790	F	70.7	Confident	63.7	Low	66 Å²	66	67.6 Å²	67.6	29%	0.289	39%	0.388	S	S	.	.	S	Bend	trans	-59.4	115.8	174.9	-79.9	-63.7	0	0	0	108.7	K636 F639 V786 A787 T792	K636-F790 HydrophobicContact CD-CB 4.26Å; K636-F790 VanDerWaalsContact CE-CB 3.45Å; K636-F790 HydrophobicContact CG-CB 4.26Å; K636-F790 HydrophobicContact CG-CD2 3.86Å; K636-F790 HydrophobicContact CG-CE2 4.48Å; K636-F790 HydrophobicContact CG-CG 4.13Å; F639-F790 AromaticContact CD1-CE2 3.84Å; F639-F790 HydrophobicContact CD1-CE2 3.84Å; F639-F790 HydrophobicContact CD1-CZ 4.31Å; F639-F790 HydrophobicContact CE1-CE2 4.29Å; F639-F790 HydrophobicContact CG-CE2 4.23Å; F639-F790 HydrophobicContact CG-CZ 4.36Å; V786-F790 PolarHBondContact O-N 3.01Å; A787-F790 VanDerWaalsContact CA-CD2 3.47Å; A787-F790 HydrophobicContact CB-CD2 4.33Å; A787-F790 HydrophobicContact CB-CE2 4.37Å; A787-F790 WeakPolarHBondContact O-CB 3.33Å; A787-F790 VanDerWaalsContact O-CD2 3.3Å; A787-F790 WeakPolarHBondContact O-CD2 3.12Å; A787-F790 PolarHBondContact O-N 2.92Å; A787-F790 VanDerWaalsContact O-N 3.16Å; F790-T792 PolarHBondContact O-N 2.74Å
791	P	59.4	Low	61.5	Low	72 Å²	72	80.1 Å²	80.1	47%	0.468	44%	0.442	S	S	.	.			trans	-70.8	116.9	-174.6	-2.7	16.9	0	0	0	108.3	S789 N793 I794	S789-P791 VanDerWaalsContact O-CD 3.24Å; S789-P791 WeakPolarHBondContact O-CD 3.13Å; P791-N793 PolarHBondContact O-N 3.39Å; P791-I794 HydrophobicContact CB-CD1 4.26Å; P791-I794 HydrophobicContact CB-CG1 3.62Å; P791-I794 HydrophobicContact CG-CD1 3.68Å; P791-I794 HydrophobicContact CG-CG1 3.58Å
792	T	55.1	Low	60.7	Low	71 Å²	71	84 Å²	84	44%	0.436	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-57.5	-27.8	168.1	47.4	0	0	0	0	111.3	D755 F790	D755-T792 WeakPolarHBondContact OD2-CG2 3.47Å; F790-T792 PolarHBondContact O-N 2.74Å
793	N	52.1	Low	59.8	Low	98 Å²	98	85.8 Å²	85.8	52%	0.524	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-90.9	-0.1	-170.4	-73.7	-30.3	0	0	0	116	P791 F795	P791-N793 PolarHBondContact O-N 3.39Å; N793-F795 PolarHBondContact O-N 3.32Å
794	I	49.6	Very low	58.6	Low	85 Å²	85	90.1 Å²	90.1	44%	0.436	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-54.5	-25.9	-179.5	-58.7	-174.2	0	0	0	111.2	P791 S797	P791-I794 HydrophobicContact CB-CD1 4.26Å; P791-I794 HydrophobicContact CB-CG1 3.62Å; P791-I794 HydrophobicContact CG-CD1 3.68Å; P791-I794 HydrophobicContact CG-CG1 3.58Å; I794-S797 PolarHBondContact O-OG 3.31Å; I794-S797 VanDerWaalsContact O-OG 3.08Å
795	F	48.8	Very low	57.2	Low	85 Å²	85	95.2 Å²	95.2	37%	0.373	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-122.2	5.4	-167	-55.8	-69.9	0	0	0	116.5	H628 I632 N793 S797 I798	H628-F795 AromaticContact CE1-CD1 3.51Å; H628-F795 AromaticContact CE1-CD2 3.49Å; H628-F795 VanDerWaalsContact CE1-CD2 3.49Å; H628-F795 WeakPolarHBondContact CE1-CD2 3.43Å; H628-F795 AromaticContact CE1-CE1 3.61Å; H628-F795 AromaticContact CE1-CE2 3.62Å; H628-F795 AromaticContact CE1-CG 3.39Å; H628-F795 WeakPolarHBondContact CE1-CG 3.18Å; H628-F795 AromaticContact CE1-CZ 3.65Å; H628-F795 AromaticContact ND1-CG 3.89Å; I632-F795 HydrophobicContact CD1-CD2 3.28Å; I632-F795 HydrophobicContact CD1-CE2 3.45Å; I632-F795 VanDerWaalsContact CD1-CE2 3.45Å; I632-F795 HydrophobicContact CD1-CG 4.24Å; I632-F795 HydrophobicContact CD1-CZ 4.5Å; I632-F795 HydrophobicContact CG1-CE2 4.36Å; N793-F795 PolarHBondContact O-N 3.32Å; F795-S797 PolarHBondContact O-N 3.1Å; F795-I798 HydrophobicContact CB-CD1 4.47Å; F795-I798 HydrophobicContact CD1-CD1 3.48Å; F795-I798 VanDerWaalsContact CD1-CD1 3.48Å; F795-I798 HydrophobicContact CD1-CG1 4Å; F795-I798 HydrophobicContact CE1-CD1 4.15Å; F795-I798 HydrophobicContact CG-CD1 4.4Å
796	K	47.8	Very low	55.7	Low	176 Å²	176	95.4 Å²	95.4	77%	0.765	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-15.6	160.3	-78.6	-175.1	178.3	175.7	0	111.7
797	S	42.1	Very low	54	Low	90 Å²	90	97.1 Å²	97.1	63%	0.629	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	3	-177.2	61.9	0	0	0	0	115	I794 F795 P799	I794-S797 PolarHBondContact O-OG 3.31Å; I794-S797 VanDerWaalsContact O-OG 3.08Å; F795-S797 PolarHBondContact O-N 3.1Å; S797-P799 WeakPolarHBondContact O-CD 3.26Å
798	I	41.3	Very low	52.3	Low	92 Å²	92	103.8 Å²	103.8	47%	0.472	57%	0.57	S	S	.	*	S	Bend	trans	-77.5	107.9	167.3	-59.5	178.5	0	0	0	106.4	F795 S800	F795-I798 HydrophobicContact CB-CD1 4.47Å; F795-I798 HydrophobicContact CD1-CD1 3.48Å; F795-I798 VanDerWaalsContact CD1-CD1 3.48Å; F795-I798 HydrophobicContact CD1-CG1 4Å; F795-I798 HydrophobicContact CE1-CD1 4.15Å; F795-I798 HydrophobicContact CG-CD1 4.4Å; I798-S800 PolarHBondContact O-N 3.15Å
799	P	38.3	Very low	50.4	Low	100 Å²	100	108.5 Å²	108.5	65%	0.649	59%	0.588	S	S	*	*			trans	-60.6	131	175.5	26.4	-32.4	0	0	0	108.1	S797 K801	S797-P799 WeakPolarHBondContact O-CD 3.26Å; P799-K801 PolarHBondContact O-N 2.76Å
800	S	39.4	Very low	48.3	Very low	121 Å²	121	111 Å²	111	85%	0.846	59%	0.591	S	S	*	*			trans	-49.2	109.7	163.8	50.9	0	0	0	0	108	I798	I798-S800 PolarHBondContact O-N 3.15Å
801	K	34.6	Very low	46.2	Very low	276 Å²	276	115.1 Å²	115.1	100%	1.2	62%	0.618	S	S	*	*			trans	-82.6	0	160.9	-87	-170.2	174.9	-177.7	0	108.9	P799	P799-K801 PolarHBondContact O-N 2.76Å

Retrieved 801 of 801 residues in 1172.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).