A0A087YGB2_POEFO Loading...

Adenylate cyclase type 5

Catalyzes the formation of the signaling molecule cAMP in response to G-protein signaling. Mediates signaling downstream of ADRB1. Regulates the increase of free cytosolic Ca(2+) in response to increased blood glucose levels and contributes to the regulation of Ca(2+)-dependent insulin secretion.

AlphaFold DB , UniProt , Accession A0A087YGB2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,202 aa.

						>A0A087YGB2_POEFO|A0A087YGB2
MSRSNSVSPPGLGAPGLRGGTEHRSAWGEADSVANGCPYSARSPRNLLTRTNSRWEEEAEDVDPERRPPPGRASTTVSSRVSFRSRSAWQDHGEEPESRGNSNPASAKRADLAEVRPKSVELGLEERRAKSRSDNNKGEREEDGVMPEVNVSLVACCVSVMHVFKSKKFQSEKLERLYQRYFFRLNQSSLTMLMGVLVLVFTVMLAFHCSGAPTVTYVVVFSLAIFLTLVLMVVCNRNAFHQDHMWMVCYAVILLVIVIQVIGVLLVQPRSASEGIWWTVFFIHVIYTLLPVRMRAAVITGVILSAIHVAISWMLNGVDSFLWKQIVSNILVFSCSNIVGVCTHYPAEGSQRQAFQETRECIQARLHSQRENQQQQERLLLSVLPRHVAMEMKADINAKQEDMMFHKIYIQKHDNVSILFADIEGFTSLASQCTAQELVMTLNELFARFDKLAAENHCLRIKILGDCYYCVSGLPEARADHAHCCVEMGLDMIEAISLVREVTGVNVNMRVGIHSGRVHCGVLGLRKWQFDVWSNDVTLANQMEAGGKAGRIHITKATLNYLNGDYDVEPGAGGERNAYLKRSNIETYLIVGCSQKRKEEKAMIAKMSRQRTNSVTHNSGHWADRAFHNHISKEMKRMGFEDPKDKNTQENLNPEDEVDEFLGRAIDARSIDRLRSEHVKKFLLTFREPDLEKKYSRQVDTRFGAYVACATLVFFFICFIQIVIVPISNLMIGFFITCFIILAGVMFISAVYCCFGIFPAPLQTLSKSIVQSRLNSTLVGVFTIIIVFLSAFINIFTCSSHDLRSCIKSELNISRDLVDACHAVLLNYNLDAQHGACGGDALICSFPEYFTCCVLLSLLACSVFLQVSSIGKLFLMLFIELLYLLIMEVPKVSLFDNQDLLVMANALNYTKPENGTSRCLVDNKVPLKIMTPVVITVFVLALYLHAQQVESTARLDFLWKLQATEEKEEMEELQAYNRRLLHNILPKDVAAHFLQRERRNDELYYQSCECVAVMFASISNFSEFYVELEANNEGVECLRLLNEIIADFDEIISEDQFRQLEKIKTIGSTYMAASGLNDSTYDKAGRSHIRAMADYAMRMMDQMKYINEHSFNNFKMKIGLNIGPVVAGVIGARKPQYDIWGNTVNVASRMDSTGVPERIQVTADLYQVLNSYSYTLEYRGVVTVKGKGEMMTYFLTAGPPGS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.6	Very low	29.8	Very low	232 Å²	232	135.5 Å²	135.5	100%	1.143	81%	0.808	S	S	*	*				0	158.4	0	-70.8	155.2	69.1	0	0	108.7
2	S	25.2	Very low	29.5	Very low	124 Å²	124	140 Å²	140	87%	0.867	82%	0.824	S	S	*	*			trans	53.5	135.1	164.1	44.4	0	0	0	0	120.8
3	R	28.4	Very low	29.1	Very low	237 Å²	237	135.4 Å²	135.4	89%	0.894	82%	0.824	S	S	*	*			trans	-99.2	-171.7	173.1	-72.3	175.1	160.2	179.4	-5.9	111.4
4	S	28.7	Very low	28.8	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	82%	0.824	S	S	*	*			trans	97.8	148.1	142.6	82.6	0	0	0	0	117.2
5	N	27.8	Very low	29.1	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	83%	0.827	S	S	*	*			cis	-166.6	147.5	-9.6	-115.3	8.3	0	0	0	112.9
6	S	25.7	Very low	28.8	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	82%	0.822	S	S	*	*			trans	59.3	168.3	152.7	60.8	0	0	0	0	118.5
7	V	26.2	Very low	28.5	Very low	128 Å²	128	130.7 Å²	130.7	78%	0.776	82%	0.821	S	S	*	*			cis	-145.6	162.3	24.2	177.7	0	0	0	0	111.8
8	S	25.1	Very low	28.3	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	82%	0.824	S	S	*	*			trans	-157.8	-176.9	167.2	-62.1	0	0	0	0	108.1
9	P	43.4	Very low	28.1	Very low	121 Å²	121	133.8 Å²	133.8	79%	0.786	83%	0.829	S	S	*	*			cis	-106.5	-134	-11.6	44.1	-29.9	0	0	0	108.4
10	P	42.3	Very low	27.9	Very low	129 Å²	129	130.7 Å²	130.7	84%	0.838	83%	0.825	S	S	*	*			cis	-115.9	-169.3	-18.1	40.9	-23.9	0	0	0	112.6
11	G	24.8	Very low	27.8	Very low	58 Å²	58	130.8 Å²	130.8	60%	0.598	82%	0.824	S	S	*	*			cis	162.3	176.8	-9	0	0	0	0	0	113.1
12	L	26.4	Very low	27.7	Very low	190 Å²	190	128.8 Å²	128.8	100%	0.995	81%	0.812	S	S	*	*			trans	62.7	139.4	-167.9	-64.8	90.2	0	0	0	114.8
13	G	24.9	Very low	27.6	Very low	80 Å²	80	131.4 Å²	131.4	83%	0.825	81%	0.81	S	S	*	*			cis	-171.7	151.2	-8	0	0	0	0	0	110.9
14	A	24.1	Very low	27.4	Very low	99 Å²	99	131.6 Å²	131.6	82%	0.818	81%	0.811	S	S	*	*			trans	-98.9	163	-179.8	0	0	0	0	0	111.3
15	P	33.4	Very low	27.4	Very low	135 Å²	135	131.4 Å²	131.4	88%	0.877	81%	0.81	S	S	*	*				-134.7	175.4	69.1	38.1	-23.3	0	0	0	114.5
16	G	24.3	Very low	27.3	Very low	72 Å²	72	129.1 Å²	129.1	74%	0.742	81%	0.81	S	S	*	*			trans	-148.7	-179.3	175.7	0	0	0	0	0	112.6
17	L	23.8	Very low	27.5	Very low	156 Å²	156	135.8 Å²	135.8	82%	0.817	82%	0.819	S	S	*	*			trans	-163.9	144.3	173.5	-107.1	164.3	0	0	0	112.3
18	R	24.5	Very low	27.7	Very low	231 Å²	231	133.2 Å²	133.2	87%	0.872	82%	0.818	S	S	*	*			trans	39.8	104.9	159.1	-68.8	170.2	178.6	-177.1	-2.1	117.3
19	G	25.5	Very low	27.7	Very low	89 Å²	89	136.4 Å²	136.4	92%	0.918	82%	0.821	S	S	*	*				88.2	95.6	56.9	0	0	0	0	0	111.5
20	G	24.2	Very low	26.9	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	83%	0.825	S	S	*	*			trans	-153.7	131.9	170.5	0	0	0	0	0	109.8
21	T	26.4	Very low	26	Very low	133 Å²	133	136 Å²	136	82%	0.816	82%	0.82	S	S	*	*			trans	-94.9	98	-174.3	46.4	0	0	0	0	111.3	H23	T21-H23 PolarHBondContact O-N 2.88Å
22	E	25.5	Very low	26.1	Very low	190 Å²	190	138.6 Å²	138.6	89%	0.888	83%	0.829	S	S	*	*			trans	-78.8	113.7	170.3	-68.1	-166.7	146.3	0	0	111	R24	E22-R24 PolarHBondContact O-N 3.12Å
23	H	24.7	Very low	26.1	Very low	179 Å²	179	135.7 Å²	135.7	83%	0.829	82%	0.819	S	S	*	*			trans	-72.5	103.7	166.6	-82.5	-95.3	0	0	0	109.7	T21 S25	T21-H23 PolarHBondContact O-N 2.88Å; H23-S25 PolarHBondContact O-N 2.93Å; H23-S25 VanDerWaalsContact O-N 3.13Å
24	R	24.2	Very low	26.1	Very low	240 Å²	240	136.1 Å²	136.1	91%	0.906	82%	0.815	S	S	*	*			trans	-65.6	106.5	165.9	-83.3	-176.6	162.6	-154	-6.8	109.9	E22	E22-R24 PolarHBondContact O-N 3.12Å
25	S	27.2	Very low	26.2	Very low	101 Å²	101	139 Å²	139	71%	0.706	82%	0.817	S	S	*	*			trans	-75.6	128.4	167.8	55.7	0	0	0	0	110.6	H23 W27	H23-S25 PolarHBondContact O-N 2.93Å; H23-S25 VanDerWaalsContact O-N 3.13Å; S25-W27 PolarHBondContact O-N 2.73Å
26	A	26.6	Very low	25.8	Very low	93 Å²	93	136.1 Å²	136.1	77%	0.769	81%	0.811	S	S	*	*	S	Bend	trans	-77	75.2	-174.1	0	0	0	0	0	113.7
27	W	29.1	Very low	25.7	Very low	249 Å²	249	139 Å²	139	94%	0.943	82%	0.819	S	S	*	*			trans	-145.2	93.3	166.5	-78	97.7	0	0	0	109.9	S25	S25-W27 PolarHBondContact O-N 2.73Å
28	G	31	Very low	26	Very low	73 Å²	73	136.4 Å²	136.4	75%	0.753	81%	0.811	S	S	*	*			trans	157.3	62.6	178	0	0	0	0	0	115.3
29	E	25	Very low	26	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	81%	0.812	S	S	*	*			trans	-155.6	109.9	159.1	-114	156	-137.9	0	0	108.2
30	A	26.2	Very low	25.8	Very low	105 Å²	105	137 Å²	137	87%	0.868	80%	0.804	S	S	*	*			trans	-137.3	61.4	174	0	0	0	0	0	107.1	S32	A30-S32 PolarHBondContact O-N 2.96Å
31	D	24.9	Very low	25.7	Very low	137 Å²	137	137.8 Å²	137.8	73%	0.733	80%	0.803	S	S	*	*			trans	-67.2	124.7	-174.6	-89	-12.9	0	0	0	111.3	V33	D31-V33 PolarHBondContact O-N 3.08Å
32	S	26.1	Very low	25.6	Very low	113 Å²	113	143.6 Å²	143.6	79%	0.79	81%	0.81	S	S	*	*			trans	-77.8	98	175.5	41.6	0	0	0	0	110.4	A30 A34	A30-S32 PolarHBondContact O-N 2.96Å; S32-A34 VanDerWaalsContact C-N 3.26Å; S32-A34 PolarHBondContact O-N 3.34Å
33	V	26.2	Very low	25.4	Very low	128 Å²	128	139.8 Å²	139.8	78%	0.776	80%	0.804	S	S	*	*			trans	-70	80.3	177	-174.7	0	0	0	0	110.8	D31	D31-V33 PolarHBondContact O-N 3.08Å
34	A	25.5	Very low	26	Very low	90 Å²	90	136.4 Å²	136.4	74%	0.744	80%	0.798	S	S	*	*			trans	-93.6	91.2	171.2	0	0	0	0	0	110.1	S32 G36	S32-A34 VanDerWaalsContact C-N 3.26Å; S32-A34 PolarHBondContact O-N 3.34Å; A34-G36 PolarHBondContact O-N 3.23Å
35	N	26.7	Very low	26	Very low	160 Å²	160	135.5 Å²	135.5	86%	0.856	80%	0.795	S	S	*	*			trans	-64.7	115	169.7	-86.1	-26.1	0	0	0	109.7
36	G	24.3	Very low	25.9	Very low	73 Å²	73	136.9 Å²	136.9	75%	0.753	79%	0.794	S	S	*	*			trans	-96.3	150	-176.6	0	0	0	0	0	114.1	A34	A34-G36 PolarHBondContact O-N 3.23Å
37	C	22.4	Very low	25.8	Very low	134 Å²	134	138.9 Å²	138.9	91%	0.905	79%	0.792	S	S	*	*			trans	-142	154.3	147.8	-115.2	0	0	0	0	109
38	P	30.1	Very low	25.6	Very low	101 Å²	101	133.5 Å²	133.5	66%	0.656	78%	0.78	S	S	*	*			trans	-103.1	168	-147.5	38.9	-37.8	0	0	0	114.7
39	Y	23.2	Very low	25.2	Very low	225 Å²	225	135.7 Å²	135.7	88%	0.882	78%	0.779	S	S	*	*				-168.1	146.3	115.6	-110.2	-71.5	0	0	0	115.4
40	S	22.8	Very low	25.1	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	78%	0.78	S	S	*	*			trans	47.6	100.1	153.6	-162.2	0	0	0	0	121.4
41	A	22.4	Very low	25	Very low	88 Å²	88	137.7 Å²	137.7	73%	0.727	77%	0.768	S	S	*	*			trans	-42.2	148	155.8	0	0	0	0	0	117.2
42	R	24.3	Very low	24.9	Very low	255 Å²	255	137.7 Å²	137.7	96%	0.962	77%	0.769	S	S	*	*				-166.4	154.7	114.3	-107.2	173.6	-179.3	174.5	0.9	112.7
43	S	20.1	Very low	24.8	Very low	109 Å²	109	138 Å²	138	76%	0.762	77%	0.771	S	S	*	*			trans	-139.4	178.7	174.2	63.6	0	0	0	0	108.6
44	P	38.5	Very low	24.8	Very low	109 Å²	109	142.2 Å²	142.2	71%	0.708	77%	0.773	S	S	*	*				-127.7	178.2	-52.5	36.3	-23.1	0	0	0	110.9
45	R	23.9	Very low	24.7	Very low	220 Å²	220	148.6 Å²	148.6	83%	0.83	78%	0.778	S	S	*	*			trans	172.1	143.4	137.7	-99.4	167.2	177.3	-171.3	-0.9	113.4
46	N	24.6	Very low	24.6	Very low	130 Å²	130	150.1 Å²	150.1	70%	0.695	78%	0.779	S	S	*	*			trans	49.9	143.6	131.1	-56.7	7.9	0	0	0	120.3
47	L	24.5	Very low	24.7	Very low	136 Å²	136	155.6 Å²	155.6	71%	0.712	79%	0.785	S	S	*	*			cis	-163.1	166.2	-4.9	-142.3	60.2	0	0	0	110.2
48	L	24	Very low	24.8	Very low	135 Å²	135	158.9 Å²	158.9	71%	0.707	79%	0.787	S	S	*	*			trans	31	107.8	150.5	-74.6	165.4	0	0	0	121.2
49	T	22.6	Very low	24.6	Very low	119 Å²	119	158.5 Å²	158.5	73%	0.73	79%	0.793	S	S	*	*				33.9	130.9	121.4	64.8	0	0	0	0	121.3
50	R	23.9	Very low	24.8	Very low	219 Å²	219	157 Å²	157	83%	0.826	79%	0.794	S	S	*	*				148.7	132.7	93.2	-152.5	-173.3	169.3	159	-3.2	114.6
51	T	24.1	Very low	25.2	Very low	102 Å²	102	159 Å²	159	63%	0.626	80%	0.796	S	S	*	*			trans	59.7	116.8	152.7	40.3	0	0	0	0	123.9
52	N	22.8	Very low	25.4	Very low	138 Å²	138	160.4 Å²	160.4	74%	0.738	80%	0.796	S	S	*	*				55.5	119.8	127	-60.6	12.8	0	0	0	123.7
53	S	24.1	Very low	25.5	Very low	119 Å²	119	155.3 Å²	155.3	83%	0.832	79%	0.787	S	S	*	*			trans	66.8	147.2	134.6	74.8	0	0	0	0	118.9
54	R	25.2	Very low	27	Very low	217 Å²	217	154.6 Å²	154.6	82%	0.819	78%	0.78	S	S	*	*			cis	-162.3	129.9	13.9	-169.7	-177.5	175	164.1	-1.4	111.2
55	W	25.2	Very low	26.4	Very low	224 Å²	224	156.4 Å²	156.4	85%	0.848	78%	0.779	S	S	*	*			trans	43.4	126.4	149.7	-62.8	55.1	0	0	0	123.1
56	E	22.8	Very low	26.5	Very low	191 Å²	191	156 Å²	156	89%	0.893	78%	0.777	S	S	*	*			trans	-134	142.7	130.9	-74	173.7	135.2	0	0	104.8
57	E	26.4	Very low	26.4	Very low	188 Å²	188	161.1 Å²	161.1	88%	0.879	79%	0.787	S	S	*	*			cis	103.8	108.7	26.2	-133.7	175.8	-124.7	0	0	114.5
58	E	24.6	Very low	27	Very low	203 Å²	203	160.2 Å²	160.2	95%	0.949	79%	0.79	S	S	*	*			trans	-167.6	158.6	155.4	-115.8	179.3	-166.8	0	0	110.3
59	A	27.4	Very low	27.9	Very low	93 Å²	93	159.2 Å²	159.2	77%	0.769	79%	0.791	S	S	*	*			trans	-145.7	-174.9	-169.8	0	0	0	0	0	111.5
60	E	27.6	Very low	28.9	Very low	194 Å²	194	159.6 Å²	159.6	91%	0.907	80%	0.796	S	S	*	*			cis	-140.9	-148	16.1	-60.9	178.2	118.7	0	0	110.6
61	D	29.5	Very low	29	Very low	151 Å²	151	153 Å²	153	81%	0.807	80%	0.796	S	S	*	*				-155.3	-165.9	-98.3	-170.6	21.6	0	0	0	110.9
62	V	28	Very low	29	Very low	117 Å²	117	160.1 Å²	160.1	71%	0.709	81%	0.811	S	S	*	*			trans	90.5	89.9	158.5	-162.6	0	0	0	0	119.8
63	D	25.8	Very low	29.1	Very low	147 Å²	147	157.9 Å²	157.9	79%	0.786	81%	0.812	S	S	*	*				33.8	171.7	102.5	-110.4	24.4	0	0	0	122.3
64	P	51.1	Low	29.1	Very low	94 Å²	94	157.3 Å²	157.3	61%	0.61	81%	0.808	S	S	*	*			cis	-144.1	179.4	-48.3	36.6	-16.5	0	0	0	117.9
65	E	26.6	Very low	29.1	Very low	147 Å²	147	153.3 Å²	153.3	69%	0.687	81%	0.808	S	S	*	*			trans	85.6	143.4	137.9	-109.1	-159.7	162	0	0	126.9
66	R	25.8	Very low	29.1	Very low	211 Å²	211	148.4 Å²	148.4	80%	0.796	80%	0.803	S	S	*	*			trans	96.9	157.2	151.9	-71.4	173.2	-157.2	-130	-10.1	123.1
67	R	23	Very low	29.2	Very low	238 Å²	238	145.7 Å²	145.7	90%	0.898	80%	0.799	S	S	*	*			trans	-120.9	-173.8	-161.6	-35.7	168.6	171.9	167.2	-4.8	110.9
68	P	35.8	Very low	29.1	Very low	118 Å²	118	141.8 Å²	141.8	77%	0.766	79%	0.792	S	S	*	*			cis	-128.2	-116.3	-9.1	27.6	0.3	0	0	0	115
69	P	44.8	Very low	29.1	Very low	113 Å²	113	137.5 Å²	137.5	73%	0.734	79%	0.785	S	S	*	*			trans	-127.3	-154.2	-135.8	44.9	-22.7	0	0	0	113.6
70	P	42.7	Very low	28.9	Very low	128 Å²	128	144.2 Å²	144.2	83%	0.831	79%	0.79	S	S	*	*			cis	-127	177.7	-18.8	41.3	-25.8	0	0	0	114.7
71	G	26.2	Very low	28.7	Very low	81 Å²	81	140.6 Å²	140.6	84%	0.835	78%	0.781	S	S	*	*			trans	-171	147.2	171.7	0	0	0	0	0	116
72	R	24.2	Very low	28.4	Very low	251 Å²	251	138.2 Å²	138.2	95%	0.947	78%	0.776	S	S	*	*			trans	-99.1	135	-166.7	-93.5	177.6	167.4	168.2	-5.5	116.5
73	A	24	Very low	28.1	Very low	91 Å²	91	142.1 Å²	142.1	75%	0.752	78%	0.784	S	S	*	*				56.6	120.9	128	0	0	0	0	0	124.4
74	S	25	Very low	27.9	Very low	107 Å²	107	146.2 Å²	146.2	75%	0.748	79%	0.789	S	S	*	*				173.8	110.3	125.9	30.7	0	0	0	0	109.6
75	T	25.2	Very low	26.5	Very low	132 Å²	132	147.6 Å²	147.6	81%	0.81	80%	0.8	S	S	*	*				56.8	125.9	92.1	57.9	0	0	0	0	114.5
76	T	25.1	Very low	26.3	Very low	122 Å²	122	152 Å²	152	75%	0.748	81%	0.81	S	S	*	*			cis	-144.4	139.8	27.9	29.6	0	0	0	0	113.3
77	V	24.7	Very low	26.2	Very low	133 Å²	133	147.8 Å²	147.8	81%	0.806	81%	0.813	S	S	*	*				62.8	130.4	103.1	-176.4	0	0	0	0	114.2
78	S	23.7	Very low	26.2	Very low	106 Å²	106	140.9 Å²	140.9	74%	0.741	81%	0.807	S	S	*	*			cis	-158.3	175.3	3.6	41.2	0	0	0	0	109.4
79	S	24.7	Very low	25.6	Very low	113 Å²	113	146.7 Å²	146.7	79%	0.79	81%	0.814	S	S	*	*			cis	-153.8	161	-21.1	38.8	0	0	0	0	108.3
80	R	24.2	Very low	24.7	Very low	235 Å²	235	149.3 Å²	149.3	89%	0.887	82%	0.816	S	S	*	*			trans	-102.4	136.3	-172.8	-90.5	-176.9	179.5	177.1	-0	112.2
81	V	23.4	Very low	23.8	Very low	118 Å²	118	148.7 Å²	148.7	72%	0.715	81%	0.806	S	S	*	*				66.6	113.4	81.9	-178.8	0	0	0	0	114.1
82	S	21.6	Very low	23.7	Very low	100 Å²	100	154.3 Å²	154.3	70%	0.699	81%	0.81	S	S	*	*			trans	0.8	147.8	140.5	177.5	0	0	0	0	118.8
83	F	21.8	Very low	23.6	Very low	200 Å²	200	145.7 Å²	145.7	88%	0.877	80%	0.8	S	S	*	*				-156.6	164.3	129	-120.2	-80.5	0	0	0	113.3
84	R	22.8	Very low	23.6	Very low	233 Å²	233	151.4 Å²	151.4	88%	0.879	81%	0.81	S	S	*	*			trans	-116.7	144.6	-176.4	-165.8	-172.3	-161.2	179.6	8.3	109.6
85	S	22	Very low	23.3	Very low	122 Å²	122	155.1 Å²	155.1	85%	0.853	82%	0.816	S	S	*	*			trans	-139.6	166.4	170	65.1	0	0	0	0	112
86	R	22.1	Very low	23.8	Very low	240 Å²	240	153.2 Å²	153.2	91%	0.906	81%	0.806	S	S	*	*			trans	-163	166.8	-171.3	-151	-176.8	-175.1	-160.3	1.4	111.5
87	S	22.6	Very low	23.7	Very low	122 Å²	122	156.2 Å²	156.2	85%	0.853	81%	0.812	S	S	*	*			trans	80.8	155.6	-179.5	85.7	0	0	0	0	114.3
88	A	22.8	Very low	23.6	Very low	93 Å²	93	153.8 Å²	153.8	77%	0.769	80%	0.8	S	S	*	*			cis	-141.4	-166.5	7.8	0	0	0	0	0	113
89	W	23.9	Very low	23.7	Very low	241 Å²	241	160.4 Å²	160.4	91%	0.913	81%	0.809	S	S	*	*			trans	-104.1	152.1	-178.6	-71.3	59.1	0	0	0	112.4
90	Q	25.1	Very low	23.7	Very low	168 Å²	168	158.8 Å²	158.8	79%	0.785	81%	0.81	S	S	*	*				158.8	131.1	113.8	-85.4	-164.6	-99.6	0	0	115.7
91	D	24.1	Very low	23.6	Very low	115 Å²	115	155.5 Å²	155.5	62%	0.615	81%	0.81	S	S	*	*			trans	54.9	154.7	139	-61.6	-53.4	0	0	0	126
92	H	24	Very low	23.7	Very low	199 Å²	199	155.7 Å²	155.7	92%	0.921	82%	0.817	S	S	*	*			trans	71.7	140.2	177.8	-50	-75.2	0	0	0	117.2
93	G	23.5	Very low	23.8	Very low	70 Å²	70	158.7 Å²	158.7	72%	0.722	83%	0.825	S	S	*	*			cis	170.9	136.7	-10.7	0	0	0	0	0	114.6
94	E	22.4	Very low	24.4	Very low	210 Å²	210	154.6 Å²	154.6	98%	0.981	82%	0.819	S	S	*	*			trans	68.3	173.5	160.6	-59.9	-173	161.4	0	0	120.7
95	E	20	Very low	24.4	Very low	185 Å²	185	148.1 Å²	148.1	86%	0.864	82%	0.815	S	S	*	*			trans	-125.2	-173.1	-150.2	-114.7	-177.6	-156.1	0	0	111.4
96	P	36	Very low	24.5	Very low	93 Å²	93	148.4 Å²	148.4	60%	0.604	82%	0.817	S	S	*	*			cis	-136.2	-165.9	-25.7	37.2	-17.6	0	0	0	113.5
97	E	21.9	Very low	24.7	Very low	185 Å²	185	141.6 Å²	141.6	86%	0.864	81%	0.812	S	S	*	*			trans	69	148.6	153	-83.2	-171	-157.7	0	0	120.7
98	S	23	Very low	24.8	Very low	81 Å²	81	145.8 Å²	145.8	57%	0.566	82%	0.815	S	S	*	*			cis	-160.1	173	-4.7	60	0	0	0	0	113.3
99	R	25.3	Very low	24.8	Very low	246 Å²	246	152.3 Å²	152.3	93%	0.928	82%	0.82	S	S	*	*			trans	71.8	136.8	158.2	-65.6	171.8	174.3	179.2	-0.8	121
100	G	24.7	Very low	24.8	Very low	78 Å²	78	145.6 Å²	145.6	80%	0.804	82%	0.815	S	S	*	*			trans	145.6	58.1	139.8	0	0	0	0	0	121.5
101	N	23	Very low	24.8	Very low	166 Å²	166	144.6 Å²	144.6	89%	0.888	82%	0.815	S	S	*	*			trans	-10.6	128.2	166.6	-86.6	-2.2	0	0	0	120
102	S	26.2	Very low	24.8	Very low	123 Å²	123	147.4 Å²	147.4	86%	0.86	83%	0.829	S	S	*	*				-172.3	155.1	114.4	33.1	0	0	0	0	113.2
103	N	22.4	Very low	24.9	Very low	162 Å²	162	142 Å²	142	87%	0.866	82%	0.819	S	S	*	*			trans	-113.2	172.9	-174.7	-98.4	-22.8	0	0	0	110.2
104	P	34.1	Very low	24.8	Very low	115 Å²	115	146.6 Å²	146.6	75%	0.747	82%	0.822	S	S	*	*			cis	-134.4	-176.9	-1.7	32	-10.1	0	0	0	116
105	A	22.5	Very low	24.9	Very low	97 Å²	97	143.3 Å²	143.3	80%	0.802	82%	0.816	S	S	*	*			trans	73.5	114.1	148.3	0	0	0	0	0	121.5
106	S	24.4	Very low	25	Very low	127 Å²	127	144 Å²	144	89%	0.888	81%	0.81	S	S	*	*			trans	-159.7	168.6	137	55.4	0	0	0	0	111.2
107	A	26.7	Very low	24.3	Very low	98 Å²	98	145.7 Å²	145.7	81%	0.81	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74.7	148.9	-165.2	0	0	0	0	0	115.2	R109	A107-R109 PolarHBondContact O-N 2.99Å
108	K	23.9	Very low	24.4	Very low	210 Å²	210	146.1 Å²	146.1	91%	0.913	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-74.2	119.8	162.7	-74.1	-176.8	175	-179.5	0	109.9
109	R	22.8	Very low	24.3	Very low	230 Å²	230	147.7 Å²	147.7	87%	0.868	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-66.1	150.8	154.3	-94.4	-179.4	169.3	151.4	-4.4	109.4	A107	A107-R109 PolarHBondContact O-N 2.99Å
110	A	24.9	Very low	24.3	Very low	99 Å²	99	141.8 Å²	141.8	82%	0.818	82%	0.822	S	S	*	*			trans	-126.8	111.3	168.5	0	0	0	0	0	107.7
111	D	24.6	Very low	24.2	Very low	148 Å²	148	146.5 Å²	146.5	79%	0.791	82%	0.823	S	S	*	*			trans	-82.2	126.5	180	-57.8	-50.1	0	0	0	110	A113	D111-A113 PolarHBondContact O-N 3.43Å
112	L	25.2	Very low	24.5	Very low	174 Å²	174	145 Å²	145	91%	0.911	82%	0.815	S	S	*	*			trans	-84.2	104	170	-96.2	163.3	0	0	0	108.9
113	A	25.4	Very low	24.4	Very low	84 Å²	84	142.3 Å²	142.3	69%	0.694	81%	0.806	S	S	*	*			trans	-79.2	137.6	-173.4	0	0	0	0	0	113.4	D111 V115	D111-A113 PolarHBondContact O-N 3.43Å; A113-V115 PolarHBondContact O-N 3.21Å
114	E	22.5	Very low	24.6	Very low	168 Å²	168	141.3 Å²	141.3	79%	0.785	80%	0.8	S	S	*	*			trans	-56.8	119.6	172.2	-170.5	-173.3	-162.2	0	0	111.6	R116	E114-R116 PolarHBondContact O-N 3.02Å; E114-R116 VanDerWaalsContact O-N 3.17Å
115	V	24.3	Very low	24.2	Very low	141 Å²	141	144.9 Å²	144.9	86%	0.855	81%	0.807	S	S	*	*			trans	-86.6	91.1	-174.9	-176.5	0	0	0	0	111.1	A113	A113-V115 PolarHBondContact O-N 3.21Å
116	R	20.7	Very low	24.4	Very low	199 Å²	199	148.9 Å²	148.9	75%	0.751	81%	0.809	S	S	*	*			trans	-77	142.5	157.1	-74	-174.3	178.1	-173.2	-1.5	110.5	E114 K118	E114-R116 PolarHBondContact O-N 3.02Å; E114-R116 VanDerWaalsContact O-N 3.17Å; R116-K118 PolarHBondContact O-N 2.86Å; R116-K118 VanDerWaalsContact O-N 3.12Å
117	P	21.9	Very low	24.4	Very low	129 Å²	129	154.3 Å²	154.3	84%	0.838	81%	0.81	S	S	*	*			trans	-65.5	114.1	176.9	27	-33.8	0	0	0	110.4
118	K	23	Very low	24.3	Very low	194 Å²	194	161.3 Å²	161.3	84%	0.843	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78.3	131.1	164.5	-75.8	-178.5	176	177.1	0	108.5	R116 V120	R116-K118 PolarHBondContact O-N 2.86Å; R116-K118 VanDerWaalsContact O-N 3.12Å; K118-V120 PolarHBondContact O-N 2.99Å
119	S	22.3	Very low	24.3	Very low	114 Å²	114	156.2 Å²	156.2	80%	0.797	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-57.9	120.2	168.1	53.4	0	0	0	0	109.8	E121	S119-E121 PolarHBondContact O-N 3.41Å
120	V	24.1	Very low	24.3	Very low	122 Å²	122	155.3 Å²	155.3	74%	0.739	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-68.7	117.2	179.6	178.3	0	0	0	0	109.6	K118	K118-V120 PolarHBondContact O-N 2.99Å
121	E	24.2	Very low	24.1	Very low	177 Å²	177	156 Å²	156	83%	0.827	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75	138.8	161.4	-72.3	-167.4	116.6	0	0	109.3	S119 G123	S119-E121 PolarHBondContact O-N 3.41Å; E121-G123 PolarHBondContact O-N 3.39Å
122	L	28.2	Very low	24.1	Very low	134 Å²	134	160.5 Å²	160.5	70%	0.702	82%	0.82	S	S	*	*			trans	-73	68.3	-177.4	-76.3	162.3	0	0	0	112.1
123	G	25	Very low	24	Very low	67 Å²	67	157.7 Å²	157.7	69%	0.691	82%	0.815	S	S	*	*			trans	-94	91.2	175.8	0	0	0	0	0	112.3	E121 E125	E121-G123 PolarHBondContact O-N 3.39Å; G123-E125 PolarHBondContact O-N 3Å; G123-E125 VanDerWaalsContact O-N 3.17Å
124	L	26.2	Very low	24.1	Very low	140 Å²	140	160.8 Å²	160.8	73%	0.733	82%	0.82	S	S	*	*			trans	-78.2	92.1	170.8	-76.9	164.8	0	0	0	110.6	E126	L124-E126 PolarHBondContact O-N 2.94Å
125	E	25.9	Very low	24.3	Very low	190 Å²	190	160.4 Å²	160.4	89%	0.888	82%	0.823	S	S	*	*			trans	-74.7	113.1	163	-72.5	-159.4	144	0	0	110.3	G123 R127	G123-E125 PolarHBondContact O-N 3Å; G123-E125 VanDerWaalsContact O-N 3.17Å; E125-R127 PolarHBondContact O-N 3.43Å
126	E	27.1	Very low	24.4	Very low	182 Å²	182	160.7 Å²	160.7	85%	0.85	82%	0.819	S	S	*	*			trans	-71	111.2	-178.5	-169.4	172.7	-153.2	0	0	110.5	L124 R128	L124-E126 PolarHBondContact O-N 2.94Å; E126-R128 PolarHBondContact O-N 3.24Å
127	R	23.6	Very low	24.6	Very low	241 Å²	241	160.5 Å²	160.5	91%	0.909	82%	0.824	S	S	*	*			trans	-60	99.3	178.7	-83.7	-176.1	170.3	176.8	-1.1	111.1	E125 A129	E125-R127 PolarHBondContact O-N 3.43Å; R127-A129 PolarHBondContact O-N 3.48Å
128	R	23.7	Very low	24.8	Very low	244 Å²	244	157.8 Å²	157.8	92%	0.921	82%	0.82	S	S	*	*			trans	-53.5	129.5	164.3	-97.4	-177.3	171.3	173.2	-2.1	109.8	E126 K130	E126-R128 PolarHBondContact O-N 3.24Å; R128-K130 PolarHBondContact O-N 3.24Å
129	A	24.3	Very low	24.9	Very low	104 Å²	104	158.2 Å²	158.2	86%	0.86	83%	0.825	S	S	*	*			trans	-60.8	126.1	-175.9	0	0	0	0	0	111.4	R127	R127-A129 PolarHBondContact O-N 3.48Å
130	K	22.9	Very low	25	Very low	211 Å²	211	163.6 Å²	163.6	92%	0.917	83%	0.828	S	S	*	*			trans	-90	107.5	175.6	-148.4	174.7	-170.9	179.6	0	108.4	R128	R128-K130 PolarHBondContact O-N 3.24Å
131	S	22	Very low	25	Very low	112 Å²	112	166.4 Å²	166.4	78%	0.783	83%	0.833	S	S	*	*			trans	-64.1	143.3	174	39.4	0	0	0	0	110.8
132	R	23.1	Very low	25	Very low	243 Å²	243	166.8 Å²	166.8	92%	0.917	84%	0.835	S	S	*	*			trans	-70.2	138.3	165	-83	178.6	164.9	155.9	-6.1	109.2
133	S	24.4	Very low	25	Very low	115 Å²	115	168.8 Å²	168.8	80%	0.804	85%	0.846	S	S	*	*			trans	-136	133	157.3	-175	0	0	0	0	107
134	D	26.2	Very low	24.9	Very low	150 Å²	150	169.2 Å²	169.2	80%	0.802	85%	0.85	S	S	*	*			trans	-80.2	166.9	177	-72.1	-63.5	0	0	0	111.8
135	N	27	Very low	24.8	Very low	160 Å²	160	169.3 Å²	169.3	86%	0.856	86%	0.857	S	S	*	*			trans	-67.6	129.6	-178.6	-71.3	-44.5	0	0	0	112.4
136	N	26.5	Very low	24.7	Very low	146 Å²	146	168.4 Å²	168.4	78%	0.781	85%	0.854	S	S	*	*				-154.1	157.5	129	-122.4	-39.6	0	0	0	114.4
137	K	26.1	Very low	24.7	Very low	195 Å²	195	165 Å²	165	85%	0.848	85%	0.848	S	S	*	*			trans	-31.2	135.8	-178	-63	163	-178.3	-178.6	0	116.9
138	G	24.4	Very low	24.8	Very low	73 Å²	73	161.3 Å²	161.3	75%	0.753	84%	0.841	S	S	*	*			trans	-90.3	-170.6	-179.8	0	0	0	0	0	116.8
139	E	25.6	Very low	25.1	Very low	202 Å²	202	155.9 Å²	155.9	94%	0.944	84%	0.835	S	S	*	*			trans	-161	-179.4	156.8	-113.8	164	-167.9	0	0	107.8
140	R	24.8	Very low	25.2	Very low	228 Å²	228	156.9 Å²	156.9	86%	0.86	83%	0.826	S	S	*	*			trans	-106.6	143.4	174.5	-61.9	175.1	177.7	171.9	-1.8	108.9
141	E	23.7	Very low	25.7	Very low	180 Å²	180	153.2 Å²	153.2	84%	0.841	82%	0.821	S	S	*	*				174.8	160.8	114.6	-98.5	166.9	-174.2	0	0	114.5
142	E	24.5	Very low	26.2	Very low	186 Å²	186	150.7 Å²	150.7	87%	0.869	80%	0.803	S	S	*	*			trans	62	150.6	160.7	-69.1	-174.2	162.1	0	0	123
143	D	28.3	Very low	26.6	Very low	175 Å²	175	145.7 Å²	145.7	94%	0.936	79%	0.794	S	S	*	*			trans	-80.1	130.6	-176.1	-77.6	-66.2	0	0	0	112.6
144	G	23.1	Very low	27.3	Very low	76 Å²	76	144.8 Å²	144.8	78%	0.784	78%	0.783	S	S	*	*			trans	-119.2	120.2	-178.4	0	0	0	0	0	113.6
145	V	24.6	Very low	27.9	Very low	143 Å²	143	140.3 Å²	140.3	87%	0.867	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-55.6	142	-179.8	177.5	0	0	0	0	112.9
146	M	23.6	Very low	28.3	Very low	171 Å²	171	136.3 Å²	136.3	84%	0.842	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-53.6	133.6	172	-78.2	-82.5	-176.4	0	0	111.7	E148	M146-E148 PolarHBondContact O-N 2.65Å
147	P	26.8	Very low	28.7	Very low	110 Å²	110	132.5 Å²	132.5	71%	0.714	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-69.1	131.5	-176.6	27.9	-34.7	0	0	0	112.1	V149	P147-V149 PolarHBondContact O-N 2.98Å
148	E	26	Very low	29.7	Very low	164 Å²	164	127.3 Å²	127.3	77%	0.766	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-61.1	117.5	172.7	-67.4	-170	144	0	0	111.3	M146 N150	M146-E148 PolarHBondContact O-N 2.65Å; E148-N150 PolarHBondContact O-N 2.92Å; E148-N150 PolarHBondContact OE2-ND2 3.29Å
149	V	29.3	Very low	30.9	Very low	129 Å²	129	127.3 Å²	127.3	78%	0.782	71%	0.708	S	S	*	*			trans	-80	76.9	171.9	-172.9	0	0	0	0	109	P147 V151	P147-V149 PolarHBondContact O-N 2.98Å; V149-V151 HydrophobicContact CG1-CG2 4.4Å; V149-V151 WeakPolarHBondContact O-CG2 3.29Å; V149-V151 PolarHBondContact O-N 2.9Å
150	N	26.1	Very low	32.1	Very low	126 Å²	126	121.4 Å²	121.4	67%	0.674	69%	0.685	S	S	*	*			trans	-64.9	98.7	172	-88.3	-64.6	0	0	0	110	E148 S152	E148-N150 PolarHBondContact O-N 2.92Å; E148-N150 PolarHBondContact OE2-ND2 3.29Å; N150-S152 PolarHBondContact O-N 3.32Å
151	V	33.3	Very low	33.2	Very low	134 Å²	134	117.3 Å²	117.3	81%	0.812	68%	0.677	S	S	*	*			trans	-71.8	75.2	-178.4	-171	0	0	0	0	110.5	V149	V149-V151 HydrophobicContact CG1-CG2 4.4Å; V149-V151 WeakPolarHBondContact O-CG2 3.29Å; V149-V151 PolarHBondContact O-N 2.9Å
152	S	32.5	Very low	34.7	Very low	59 Å²	59	114.1 Å²	114.1	41%	0.413	66%	0.662	S	S	.	*			trans	-65.8	135.2	176.3	178.1	0	0	0	0	111.3	N150 V154 A155 C156	N150-S152 PolarHBondContact O-N 3.32Å; S152-V154 PolarHBondContact O-N 3.36Å; S152-V154 VanDerWaalsContact O-N 3.14Å; S152-V154 WeakPolarHBondContact OG-CB 3.49Å; S152-V154 PolarHBondContact OG-N 3.11Å; S152-A155 WeakPolarHBondContact O-CB 3.48Å; S152-A155 PolarHBondContact O-N 3.05Å; S152-C156 PolarHBondContact O-N 2.8Å
153	L	31.9	Very low	36.1	Very low	137 Å²	137	107 Å²	107	72%	0.717	63%	0.632	S	S	*	*	H	α-helix	trans	-56.5	-29.5	173.4	-155	155.2	0	0	0	111.1	A155 C156 C157	L153-A155 PolarHBondContact O-N 3.47Å; L153-C156 WeakPolarHBondContact O-CB 3.45Å; L153-C156 PolarHBondContact O-N 2.87Å; L153-C157 PolarHBondContact O-N 3.33Å; L153-C157 PolarHBondContact O-SG 2.84Å
154	V	38.6	Very low	37.2	Very low	96 Å²	96	102.7 Å²	102.7	58%	0.582	61%	0.605	S	S	*	*	H	α-helix	trans	-62.6	-38.7	172.9	-175.6	0	0	0	0	112.1	S152 C156 C157 V158	S152-V154 PolarHBondContact O-N 3.36Å; S152-V154 VanDerWaalsContact O-N 3.14Å; S152-V154 WeakPolarHBondContact OG-CB 3.49Å; S152-V154 PolarHBondContact OG-N 3.11Å; V154-C156 VanDerWaalsContact C-N 3.31Å; V154-C156 PolarHBondContact O-N 3.49Å; V154-C157 PolarHBondContact O-N 3.17Å; V154-V158 HydrophobicContact CG1-CG2 4.33Å; V154-V158 WeakPolarHBondContact O-CB 3.39Å; V154-V158 VanDerWaalsContact O-CG2 3.32Å; V154-V158 WeakPolarHBondContact O-CG2 3.21Å; V154-V158 PolarHBondContact O-N 2.86Å
155	A	38.6	Very low	38.8	Very low	56 Å²	56	105 Å²	105	46%	0.463	59%	0.593	S	S	.	*	H	α-helix	trans	-67.9	-32.6	176.9	0	0	0	0	0	111.8	S152 L153 S159	S152-A155 WeakPolarHBondContact O-CB 3.48Å; S152-A155 PolarHBondContact O-N 3.05Å; L153-A155 PolarHBondContact O-N 3.47Å; A155-S159 WeakPolarHBondContact O-CB 3.39Å; A155-S159 PolarHBondContact O-N 2.83Å; A155-S159 PolarHBondContact O-OG 3.43Å
156	C	36.8	Very low	40.4	Very low	77 Å²	77	99.4 Å²	99.4	52%	0.52	56%	0.561	S	S	.	*	H	α-helix	trans	-64.8	-50.2	170	-171.1	0	0	0	0	111	S152 L153 V154 V158 S159 V160	S152-C156 PolarHBondContact O-N 2.8Å; L153-C156 WeakPolarHBondContact O-CB 3.45Å; L153-C156 PolarHBondContact O-N 2.87Å; V154-C156 VanDerWaalsContact C-N 3.31Å; V154-C156 PolarHBondContact O-N 3.49Å; C156-V158 PolarHBondContact O-N 3.38Å; C156-S159 WeakPolarHBondContact O-CB 3.25Å; C156-S159 PolarHBondContact O-N 3.25Å; C156-S159 VanDerWaalsContact O-N 3.12Å; C156-V160 WeakPolarHBondContact O-CG2 3.47Å; C156-V160 PolarHBondContact O-N 2.86Å
157	C	34	Very low	42.4	Very low	65 Å²	65	96.3 Å²	96.3	44%	0.439	54%	0.542	S	S	.	.	H	α-helix	trans	-59.1	-42.7	176.3	-67.4	0	0	0	0	112.9	L153 V154 S159 V160 M161	L153-C157 PolarHBondContact O-N 3.33Å; L153-C157 PolarHBondContact O-SG 2.84Å; V154-C157 PolarHBondContact O-N 3.17Å; C157-S159 VanDerWaalsContact C-N 3.33Å; C157-S159 PolarHBondContact O-N 3.48Å; C157-V160 PolarHBondContact O-N 2.84Å; C157-M161 WeakPolarHBondContact O-CG 3.47Å; C157-M161 PolarHBondContact O-N 3.13Å
158	V	47	Very low	44.8	Very low	86 Å²	86	96.2 Å²	96.2	52%	0.521	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-38	175.6	169.3	0	0	0	0	111.3	V154 C156 M161 H162	V154-V158 HydrophobicContact CG1-CG2 4.33Å; V154-V158 WeakPolarHBondContact O-CB 3.39Å; V154-V158 VanDerWaalsContact O-CG2 3.32Å; V154-V158 WeakPolarHBondContact O-CG2 3.21Å; V154-V158 PolarHBondContact O-N 2.86Å; C156-V158 PolarHBondContact O-N 3.38Å; V158-M161 PolarHBondContact O-N 3.38Å; V158-H162 WeakPolarHBondContact O-CB 3.26Å; V158-H162 PolarHBondContact O-N 3.28Å
159	S	49.3	Very low	47.3	Very low	74 Å²	74	89.6 Å²	89.6	52%	0.517	50%	0.499	S	S	.	.	H	α-helix	trans	-64.2	-42	174.2	-59.7	0	0	0	0	111.8	A155 C156 C157 H162 V163	A155-S159 WeakPolarHBondContact O-CB 3.39Å; A155-S159 PolarHBondContact O-N 2.83Å; A155-S159 PolarHBondContact O-OG 3.43Å; C156-S159 WeakPolarHBondContact O-CB 3.25Å; C156-S159 PolarHBondContact O-N 3.25Å; C156-S159 VanDerWaalsContact O-N 3.12Å; C157-S159 VanDerWaalsContact C-N 3.33Å; C157-S159 PolarHBondContact O-N 3.48Å; S159-H162 WeakPolarHBondContact O-CB 3.44Å; S159-H162 PolarHBondContact O-N 2.83Å; S159-H162 VanDerWaalsContact O-N 3.14Å; S159-V163 PolarHBondContact O-N 2.76Å
160	V	50.5	Low	49.5	Very low	77 Å²	77	93 Å²	93	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-41.2	173.4	171.5	0	0	0	0	111.4	C156 C157 H162 V163 F164	C156-V160 WeakPolarHBondContact O-CG2 3.47Å; C156-V160 PolarHBondContact O-N 2.86Å; C157-V160 PolarHBondContact O-N 2.84Å; V160-H162 VanDerWaalsContact C-N 3.26Å; V160-H162 PolarHBondContact O-N 2.93Å; V160-V163 WeakPolarHBondContact O-CB 3.31Å; V160-V163 PolarHBondContact O-N 3.09Å; V160-V163 VanDerWaalsContact O-N 3.13Å; V160-F164 HydrophobicContact CG1-CE2 3.91Å; V160-F164 WeakPolarHBondContact O-CD2 3.41Å; V160-F164 PolarHBondContact O-N 3.23Å
161	M	48	Very low	52.1	Low	142 Å²	142	89.3 Å²	89.3	70%	0.7	49%	0.491	S	S	*	.	H	α-helix	trans	-63.7	-32.1	172.4	-69.1	-175.1	83	0	0	112.4	C157 V158 V163 F164	C157-M161 WeakPolarHBondContact O-CG 3.47Å; C157-M161 PolarHBondContact O-N 3.13Å; V158-M161 PolarHBondContact O-N 3.38Å; M161-V163 VanDerWaalsContact C-N 3.34Å; M161-F164 PolarHBondContact O-N 2.87Å
162	H	55.8	Low	54.3	Low	113 Å²	113	87.5 Å²	87.5	52%	0.523	47%	0.474	S	S	.	.	H	α-helix	trans	-73.1	-23.9	174.6	-153.6	-64.7	0	0	0	113	V158 S159 V160 K165	V158-H162 WeakPolarHBondContact O-CB 3.26Å; V158-H162 PolarHBondContact O-N 3.28Å; S159-H162 WeakPolarHBondContact O-CB 3.44Å; S159-H162 PolarHBondContact O-N 2.83Å; S159-H162 VanDerWaalsContact O-N 3.14Å; V160-H162 VanDerWaalsContact C-N 3.26Å; V160-H162 PolarHBondContact O-N 2.93Å; H162-K165 VanDerWaalsContact O-CB 3.28Å; H162-K165 WeakPolarHBondContact O-CB 3.46Å; H162-K165 PolarHBondContact O-N 2.87Å
163	V	54.7	Low	56.6	Low	37 Å²	37	90 Å²	90	22%	0.224	48%	0.477	C	S	.	.	H	α-helix	trans	-65.5	-37	170.2	167.1	0	0	0	0	111.3	S159 V160 M161 K165 M294 Y345	S159-V163 PolarHBondContact O-N 2.76Å; V160-V163 WeakPolarHBondContact O-CB 3.31Å; V160-V163 PolarHBondContact O-N 3.09Å; V160-V163 VanDerWaalsContact O-N 3.13Å; M161-V163 VanDerWaalsContact C-N 3.34Å; V163-K165 PolarHBondContact O-N 3.3Å; V163-M294 HydrophobicContact CG1-CE 3.61Å; V163-M294 HydrophobicContact CG1-SD 4.33Å; V163-Y345 HydrophobicContact CG1-CD1 4.31Å; V163-Y345 HydrophobicContact CG1-CD2 4.03Å; V163-Y345 HydrophobicContact CG1-CE2 4.27Å; V163-Y345 HydrophobicContact CG1-CG 4.05Å; V163-Y345 HydrophobicContact CG2-CE1 4.16Å
164	F	51.5	Low	58.9	Low	84 Å²	84	84.3 Å²	84.3	37%	0.368	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-2.7	173.1	-61.9	-68.9	0	0	0	114.4	V160 M161 S166 R295 V298	V160-F164 HydrophobicContact CG1-CE2 3.91Å; V160-F164 WeakPolarHBondContact O-CD2 3.41Å; V160-F164 PolarHBondContact O-N 3.23Å; M161-F164 PolarHBondContact O-N 2.87Å; F164-S166 PolarHBondContact O-N 2.81Å; F164-R295 PolarHBondContact O-NE 2.98Å; F164-R295 PolarHBondContact O-NH2 3.29Å; F164-V298 HydrophobicContact CD1-CG1 4.33Å; F164-V298 HydrophobicContact CD1-CG2 4.33Å; F164-V298 HydrophobicContact CE1-CG1 3.91Å; F164-V298 HydrophobicContact CE1-CG2 4.04Å
165	K	55.7	Low	61.1	Low	124 Å²	124	79.9 Å²	79.9	54%	0.539	42%	0.42	S	S	.	.	S	Bend	trans	-87.2	81.9	174.5	-160.8	177.1	-178.6	-177.7	0	109.8	H162 V163 K167	H162-K165 VanDerWaalsContact O-CB 3.28Å; H162-K165 WeakPolarHBondContact O-CB 3.46Å; H162-K165 PolarHBondContact O-N 2.87Å; V163-K165 PolarHBondContact O-N 3.3Å; K165-K167 PolarHBondContact O-N 3.17Å
166	S	58.3	Low	63.2	Low	27 Å²	27	84.7 Å²	84.7	19%	0.189	43%	0.426	C	S	.	.			trans	-39.4	120.1	177.6	-179.4	0	0	0	0	112	F164 K168	F164-S166 PolarHBondContact O-N 2.81Å; S166-K168 PolarHBondContact O-N 3.44Å
167	K	66.3	Low	65.3	Low	106 Å²	106	82.2 Å²	82.2	46%	0.461	41%	0.408	S	S	.	.			trans	-67.8	115.9	176.7	-64.7	178.4	-179.8	177.5	0	108.2	K165 Y345 R352	K165-K167 PolarHBondContact O-N 3.17Å; K167-Y345 PolarHBondContact NZ-OH 3.41Å; K167-R352 PolarHBondContact O-NE 3.23Å; K167-R352 PolarHBondContact O-NH1 3.47Å; K167-R352 PolarHBondContact O-NH2 2.96Å; K167-R352 VanDerWaalsContact O-NH2 3.09Å
168	K	76	Confident	67.7	Low	108 Å²	108	79.3 Å²	79.3	47%	0.47	39%	0.387	S	S	.	.			trans	-115.7	141	169.6	-168.8	-158.7	174.3	-174	0	107.5	S166 E172 E175	S166-K168 PolarHBondContact O-N 3.44Å; K168-E172 IonicContact NZ-OE1 3.36Å; K168-E172 PolarHBondContact NZ-OE1 3.03Å; K168-E175 WeakPolarHBondContact CA-OE2 3.09Å; K168-E175 HydrophobicContact CG-CB 4.31Å; K168-E175 HydrophobicContact CG-CG 3.79Å
169	F	80.1	Confident	69.3	Low	24 Å²	24	77.8 Å²	77.8	11%	0.105	38%	0.375	C	S	.	.			trans	-63.4	147.2	167.9	-67.7	-73.4	0	0	0	110.6	S171 L174 E175 Y178 R352 F355 Q356	F169-S171 VanDerWaalsContact C-N 3.33Å; F169-L174 HydrophobicContact CB-CB 4.32Å; F169-L174 HydrophobicContact CB-CD2 4.15Å; F169-L174 HydrophobicContact CB-CG 4.22Å; F169-L174 HydrophobicContact CD1-CD2 3.85Å; F169-L174 HydrophobicContact CD1-CG 4.36Å; F169-L174 HydrophobicContact CD2-CG 4.36Å; F169-L174 HydrophobicContact CE1-CD2 4.45Å; F169-L174 HydrophobicContact CG-CD2 3.99Å; F169-L174 HydrophobicContact CG-CG 4.06Å; F169-E175 HydrophobicContact CB-CB 4.36Å; F169-E175 WeakPolarHBondContact CD2-OE2 3.34Å; F169-E175 PolarHBondContact N-OE2 3.42Å; F169-Y178 HydrophobicContact CD2-CG 4.39Å; F169-Y178 HydrophobicContact CE2-CD1 4.21Å; F169-Y178 HydrophobicContact CE2-CD2 4.07Å; F169-Y178 AromaticContact CE2-CG 3.72Å; F169-Y178 HydrophobicContact CE2-CG 3.72Å; F169-R352 HydrophobicContact CE2-CG 4.28Å; F169-R352 HydrophobicContact CZ-CB 4.13Å; F169-R352 HydrophobicContact CZ-CG 4.33Å; F169-F355 HydrophobicContact CE2-CD1 4.07Å; F169-F355 HydrophobicContact CE2-CE1 4.27Å; F169-F355 AromaticContact CZ-CD1 3.95Å; F169-F355 HydrophobicContact CZ-CD1 3.95Å; F169-F355 HydrophobicContact CZ-CE1 4.44Å; F169-Q356 HydrophobicContact CE1-CB 4.48Å
170	Q	74.6	Confident	70.7	Confident	202 Å²	202	77.7 Å²	77.7	94%	0.944	36%	0.363	S	S	*	.	S	Bend	trans	-66.7	-36.6	179.7	-67.4	-176	-3.7	0	0	111.6
171	S	80	Confident	72.1	Confident	47 Å²	47	74.3 Å²	74.3	33%	0.329	34%	0.342	S	S	.	.	S	Bend	trans	-78	125.7	171.5	171.8	0	0	0	0	111.5	F169 K173 L174 E175	F169-S171 VanDerWaalsContact C-N 3.33Å; S171-K173 VanDerWaalsContact C-N 3.34Å; S171-K173 PolarHBondContact OG-N 3.29Å; S171-L174 PolarHBondContact O-N 3.04Å; S171-L174 PolarHBondContact OG-N 3.24Å; S171-E175 PolarHBondContact O-N 3.5Å
172	E	80.3	Confident	73.6	Confident	97 Å²	97	68.7 Å²	68.7	45%	0.453	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-38.4	171	-78.7	-97.1	128.4	0	0	112.7	K168 R176	K168-E172 IonicContact NZ-OE1 3.36Å; K168-E172 PolarHBondContact NZ-OE1 3.03Å; E172-R176 VanDerWaalsContact O-CG 3.3Å; E172-R176 WeakPolarHBondContact O-CG 3.19Å; E172-R176 PolarHBondContact O-N 3.34Å; E172-R176 IonicContact OE2-CZ 2.77Å; E172-R176 IonicContact OE2-NE 3.55Å; E172-R176 IonicContact OE2-NH2 2.77Å; E172-R176 PolarHBondContact OE2-NH2 3.05Å
173	K	80.3	Confident	74.7	Confident	111 Å²	111	64.3 Å²	64.3	48%	0.483	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-47.5	176.9	-64.5	-179.8	-179.9	177.3	0	109.7	S171 R176 L177 D656	S171-K173 VanDerWaalsContact C-N 3.34Å; S171-K173 PolarHBondContact OG-N 3.29Å; K173-R176 PolarHBondContact O-N 3.01Å; K173-L177 PolarHBondContact O-N 3.45Å; K173-D656 WeakPolarHBondContact CD-OD1 3.33Å; K173-D656 IonicContact NZ-OD1 3.63Å; K173-D656 PolarHBondContact NZ-OD1 2.97Å; K173-D656 IonicContact NZ-OD2 3.4Å; K173-D656 PolarHBondContact NZ-OD2 3.45Å
174	L	81.4	Confident	75.7	Confident	17 Å²	17	65.9 Å²	65.9	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-66.7	-39.6	-178.2	-171.6	60.4	0	0	0	113	F169 S171 L177 Y178 F355	F169-L174 HydrophobicContact CB-CB 4.32Å; F169-L174 HydrophobicContact CB-CD2 4.15Å; F169-L174 HydrophobicContact CB-CG 4.22Å; F169-L174 HydrophobicContact CD1-CD2 3.85Å; F169-L174 HydrophobicContact CD1-CG 4.36Å; F169-L174 HydrophobicContact CD2-CG 4.36Å; F169-L174 HydrophobicContact CE1-CD2 4.45Å; F169-L174 HydrophobicContact CG-CD2 3.99Å; F169-L174 HydrophobicContact CG-CG 4.06Å; S171-L174 PolarHBondContact O-N 3.04Å; S171-L174 PolarHBondContact OG-N 3.24Å; L174-L177 PolarHBondContact O-N 3.13Å; L174-Y178 WeakPolarHBondContact O-CB 3.44Å; L174-Y178 PolarHBondContact O-N 3.18Å; L174-F355 HydrophobicContact CD1-CE1 3.52Å; L174-F355 HydrophobicContact CD1-CZ 3.88Å; L174-F355 HydrophobicContact CG-CE1 4.14Å
175	E	84.4	Confident	76.8	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.019	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-39.8	174	-178.8	73.5	-168.1	0	0	111.4	K168 F169 S171 Y178 Q179 R293 R352	K168-E175 WeakPolarHBondContact CA-OE2 3.09Å; K168-E175 HydrophobicContact CG-CB 4.31Å; K168-E175 HydrophobicContact CG-CG 3.79Å; F169-E175 HydrophobicContact CB-CB 4.36Å; F169-E175 WeakPolarHBondContact CD2-OE2 3.34Å; F169-E175 PolarHBondContact N-OE2 3.42Å; S171-E175 PolarHBondContact O-N 3.5Å; E175-Y178 PolarHBondContact O-N 3.27Å; E175-Q179 WeakPolarHBondContact O-CB 3.46Å; E175-Q179 VanDerWaalsContact O-CG 3.29Å; E175-Q179 WeakPolarHBondContact O-CG 3.38Å; E175-Q179 PolarHBondContact O-N 3.02Å; E175-R293 IonicContact OE1-CZ 2.66Å; E175-R293 IonicContact OE1-NE 2.82Å; E175-R293 IonicContact OE1-NH2 2.69Å; E175-R293 PolarHBondContact OE1-NH2 2.87Å; E175-R352 IonicContact OE1-CZ 3.45Å; E175-R352 IonicContact OE1-NH1 3.18Å; E175-R352 IonicContact OE1-NH2 3.46Å; E175-R352 PolarHBondContact OE1-NH2 2.9Å; E175-R352 IonicContact OE2-CZ 2.67Å; E175-R352 IonicContact OE2-NH1 2.66Å; E175-R352 PolarHBondContact OE2-NH1 2.98Å; E175-R352 IonicContact OE2-NH2 3.54Å
176	R	82.2	Confident	77.8	Confident	156 Å²	156	57.3 Å²	57.3	59%	0.589	26%	0.259	S	S	*	.	H	α-helix	trans	-64.9	-42.3	175.2	-66.4	169.8	-155.3	176.9	6.5	111.6	E172 K173 Q179 R180	E172-R176 VanDerWaalsContact O-CG 3.3Å; E172-R176 WeakPolarHBondContact O-CG 3.19Å; E172-R176 PolarHBondContact O-N 3.34Å; E172-R176 IonicContact OE2-CZ 2.77Å; E172-R176 IonicContact OE2-NE 3.55Å; E172-R176 IonicContact OE2-NH2 2.77Å; E172-R176 PolarHBondContact OE2-NH2 3.05Å; K173-R176 PolarHBondContact O-N 3.01Å; R176-Q179 PolarHBondContact O-N 3.06Å; R176-R180 PolarHBondContact O-N 3.28Å
177	L	81.2	Confident	78.8	Confident	25 Å²	25	58.8 Å²	58.8	13%	0.131	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-44	177.5	-160.7	68.9	0	0	0	111.5	K173 L174 R180 Y181 F355 D659 L662 I666	K173-L177 PolarHBondContact O-N 3.45Å; L174-L177 PolarHBondContact O-N 3.13Å; L177-R180 PolarHBondContact O-N 3.04Å; L177-Y181 PolarHBondContact O-N 2.65Å; L177-F355 HydrophobicContact CB-CZ 4.27Å; L177-F355 HydrophobicContact CD2-CZ 4.34Å; L177-F355 HydrophobicContact CG-CZ 4.3Å; L177-D659 HydrophobicContact CD2-CB 4.34Å; L177-L662 HydrophobicContact CD2-CB 4.09Å; L177-L662 HydrophobicContact CD2-CD2 3.74Å; L177-L662 HydrophobicContact CD2-CG 3.79Å; L177-I666 HydrophobicContact CD1-CD1 4.25Å; L177-I666 HydrophobicContact CG-CD1 4.03Å
178	Y	84.1	Confident	79.2	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-45	171.3	171.4	-102.5	0	0	0	112.1	F169 L174 E175 R180 Y181 F182 R352 F355	F169-Y178 HydrophobicContact CD2-CG 4.39Å; F169-Y178 HydrophobicContact CE2-CD1 4.21Å; F169-Y178 HydrophobicContact CE2-CD2 4.07Å; F169-Y178 AromaticContact CE2-CG 3.72Å; F169-Y178 HydrophobicContact CE2-CG 3.72Å; L174-Y178 WeakPolarHBondContact O-CB 3.44Å; L174-Y178 PolarHBondContact O-N 3.18Å; E175-Y178 PolarHBondContact O-N 3.27Å; Y178-R180 VanDerWaalsContact C-N 3.33Å; Y178-R180 PolarHBondContact O-N 3.36Å; Y178-Y181 HydrophobicContact CD2-CD1 4.11Å; Y178-Y181 HydrophobicContact CE2-CD1 4.29Å; Y178-Y181 WeakPolarHBondContact O-CB 3.29Å; Y178-Y181 PolarHBondContact O-N 3.06Å; Y178-F182 HydrophobicContact CE1-CB 4.26Å; Y178-F182 HydrophobicContact CE1-CG 4.47Å; Y178-F182 HydrophobicContact CE2-CB 4.41Å; Y178-F182 VanDerWaalsContact O-CB 3.23Å; Y178-F182 WeakPolarHBondContact O-CB 3.3Å; Y178-F182 PolarHBondContact O-N 2.8Å; Y178-F182 WeakPolarHBondContact OH-CD2 3.44Å; Y178-R352 HydrophobicContact CD1-CG 4.49Å; Y178-R352 HydrophobicContact CD2-CG 4.31Å; Y178-R352 HydrophobicContact CE1-CG 3.86Å; Y178-R352 HydrophobicContact CE2-CB 4.42Å; Y178-R352 HydrophobicContact CE2-CG 3.65Å; Y178-R352 VanDerWaalsContact CZ-CG 3.4Å; Y178-F355 HydrophobicContact CD2-CB 4.07Å; Y178-F355 AromaticContact CD2-CD1 3.84Å; Y178-F355 HydrophobicContact CD2-CD1 3.84Å; Y178-F355 HydrophobicContact CD2-CD2 4.36Å; Y178-F355 HydrophobicContact CD2-CE1 4.36Å; Y178-F355 AromaticContact CD2-CG 3.84Å; Y178-F355 HydrophobicContact CD2-CG 3.84Å; Y178-F355 HydrophobicContact CE2-CB 4.49Å; Y178-F355 HydrophobicContact CG-CD1 4.37Å; Y178-F355 HydrophobicContact CG-CE1 4.48Å
179	Q	80.7	Confident	79.3	Confident	54 Å²	54	50.7 Å²	50.7	25%	0.252	23%	0.233	S	C	.	.	H	α-helix	trans	-60.8	-42.1	178	-76.2	-174.1	-98.3	0	0	111.7	E175 R176 F182 F183 R293	E175-Q179 WeakPolarHBondContact O-CB 3.46Å; E175-Q179 VanDerWaalsContact O-CG 3.29Å; E175-Q179 WeakPolarHBondContact O-CG 3.38Å; E175-Q179 PolarHBondContact O-N 3.02Å; R176-Q179 PolarHBondContact O-N 3.06Å; Q179-F182 PolarHBondContact O-N 3.06Å; Q179-F183 HydrophobicContact CB-CE2 4.43Å; Q179-F183 WeakPolarHBondContact O-CD2 3.19Å; Q179-F183 PolarHBondContact O-N 3.44Å; Q179-R293 VanDerWaalsContact CD-NH2 3.32Å
180	R	79.6	Confident	79.4	Confident	72 Å²	72	49.6 Å²	49.6	27%	0.272	23%	0.228	S	C	.	.	H	α-helix	trans	-63.2	-43.9	176.5	-169.2	175.3	-178.6	-149	-3.9	112	R176 L177 Y178 R184 Q242 D667	R176-R180 PolarHBondContact O-N 3.28Å; L177-R180 PolarHBondContact O-N 3.04Å; Y178-R180 VanDerWaalsContact C-N 3.33Å; Y178-R180 PolarHBondContact O-N 3.36Å; R180-R184 PolarHBondContact O-N 3.28Å; R180-R184 VanDerWaalsContact O-N 3.14Å; R180-Q242 HydrophobicContact CG-CB 4.5Å; R180-Q242 VanDerWaalsContact CG-OE1 3.29Å; R180-D667 IonicContact CZ-OD1 2.85Å; R180-D667 IonicContact CZ-OD2 3.95Å; R180-D667 IonicContact NH1-OD1 2.79Å; R180-D667 IonicContact NH1-OD2 3.2Å; R180-D667 PolarHBondContact NH1-OD2 2.88Å; R180-D667 IonicContact NH2-OD1 3.65Å; R180-D667 PolarHBondContact NH2-OD1 3.48Å; R180-D667 IonicContact NH2-OD2 2.74Å; R180-D667 PolarHBondContact NH2-OD2 2.78Å
181	Y	78.9	Confident	79.9	Confident	7 Å²	7	40.9 Å²	40.9	3%	0.027	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-52.5	171.6	162.1	-118.6	0	0	0	112.1	L177 Y178 F183 R184 L185 F355 W959	L177-Y181 PolarHBondContact O-N 2.65Å; Y178-Y181 HydrophobicContact CD2-CD1 4.11Å; Y178-Y181 HydrophobicContact CE2-CD1 4.29Å; Y178-Y181 WeakPolarHBondContact O-CB 3.29Å; Y178-Y181 PolarHBondContact O-N 3.06Å; Y181-F183 PolarHBondContact O-N 2.73Å; Y181-R184 PolarHBondContact O-N 2.82Å; Y181-R184 VanDerWaalsContact O-N 3.1Å; Y181-L185 HydrophobicContact CE2-CB 4.3Å; Y181-L185 HydrophobicContact CE2-CD1 4.45Å; Y181-L185 HydrophobicContact CE2-CD2 4.48Å; Y181-L185 PolarHBondContact O-N 3.35Å; Y181-F355 HydrophobicContact CD1-CB 4.25Å; Y181-F355 AromaticContact CD1-CD2 3.6Å; Y181-F355 HydrophobicContact CD1-CD2 3.6Å; Y181-F355 HydrophobicContact CD1-CE2 4.32Å; Y181-F355 HydrophobicContact CD1-CG 4.2Å; Y181-F355 HydrophobicContact CE1-CB 4.15Å; Y181-F355 HydrophobicContact CE1-CD2 4.21Å; Y181-F355 HydrophobicContact CG-CD2 4.09Å; Y181-F355 HydrophobicContact CG-CE2 4.47Å; Y181-W959 AromaticContact CE2-CH2 3.84Å; Y181-W959 HydrophobicContact CE2-CH2 3.84Å; Y181-W959 AromaticContact CE2-CZ3 3.55Å; Y181-W959 HydrophobicContact CE2-CZ3 3.55Å; Y181-W959 AromaticContact CZ-CZ3 3.82Å; Y181-W959 WeakPolarHBondContact OH-CZ3 3.41Å
182	F	79.8	Confident	80	Confident	24 Å²	24	41.1 Å²	41.1	11%	0.105	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-38.2	-178	173.1	-99.4	0	0	0	113.1	Y178 Q179 N186 P291 Q351	Y178-F182 HydrophobicContact CE1-CB 4.26Å; Y178-F182 HydrophobicContact CE1-CG 4.47Å; Y178-F182 HydrophobicContact CE2-CB 4.41Å; Y178-F182 VanDerWaalsContact O-CB 3.23Å; Y178-F182 WeakPolarHBondContact O-CB 3.3Å; Y178-F182 PolarHBondContact O-N 2.8Å; Y178-F182 WeakPolarHBondContact OH-CD2 3.44Å; Q179-F182 PolarHBondContact O-N 3.06Å; F182-N186 WeakPolarHBondContact CD2-ND2 3.35Å; F182-N186 VanDerWaalsContact CE2-ND2 3.32Å; F182-N186 WeakPolarHBondContact CE2-ND2 3.45Å; F182-N186 WeakPolarHBondContact O-CB 3.46Å; F182-N186 PolarHBondContact O-N 3.09Å; F182-N186 VanDerWaalsContact O-N 3.15Å; F182-N186 PolarHBondContact O-ND2 2.93Å; F182-P291 HydrophobicContact CD1-CB 4.31Å; F182-P291 HydrophobicContact CE1-CB 3.53Å; F182-P291 HydrophobicContact CZ-CB 3.93Å; F182-Q351 VanDerWaalsContact CD2-OE1 3.28Å; F182-Q351 VanDerWaalsContact CE2-OE1 3.24Å
183	F	77.9	Confident	80.3	Confident	21 Å²	21	36.5 Å²	36.5	9%	0.092	16%	0.164	C	C	.	.	H	α-helix	trans	-69.4	-39.8	172.7	-73.4	-55.5	0	0	0	112.4	Q179 Y181 N186 Q187 M245 W246 P291	Q179-F183 HydrophobicContact CB-CE2 4.43Å; Q179-F183 WeakPolarHBondContact O-CD2 3.19Å; Q179-F183 PolarHBondContact O-N 3.44Å; Y181-F183 PolarHBondContact O-N 2.73Å; F183-N186 PolarHBondContact O-N 3.05Å; F183-Q187 PolarHBondContact O-N 2.92Å; F183-M245 HydrophobicContact CB-CB 4.4Å; F183-M245 HydrophobicContact CD1-CB 3.8Å; F183-M245 HydrophobicContact CD2-CB 4.3Å; F183-M245 HydrophobicContact CE1-CB 4.11Å; F183-M245 HydrophobicContact CG-CB 3.92Å; F183-M245 HydrophobicContact CZ-CB 4.49Å; F183-W246 HydrophobicContact CZ-CB 3.99Å; F183-P291 HydrophobicContact CD1-CB 4.2Å; F183-P291 HydrophobicContact CD1-CG 4.16Å; F183-P291 HydrophobicContact CE1-CB 4.2Å; F183-P291 HydrophobicContact CE1-CG 4.18Å; F183-P291 WeakPolarHBondContact CE1-O 3.49Å
184	R	76.4	Confident	80.7	Confident	69 Å²	69	31.2 Å²	31.2	26%	0.26	14%	0.141	S	C	.	.	H	α-helix	trans	-62.7	-42.8	176.1	-158.9	179.1	-132.7	-146.4	5.7	111.4	R180 Y181 N186 I666 D667 I671	R180-R184 PolarHBondContact O-N 3.28Å; R180-R184 VanDerWaalsContact O-N 3.14Å; Y181-R184 PolarHBondContact O-N 2.82Å; Y181-R184 VanDerWaalsContact O-N 3.1Å; R184-N186 PolarHBondContact O-N 3.02Å; R184-I666 PolarHBondContact NH1-O 2.96Å; R184-D667 PolarHBondContact NH1-O 2.77Å; R184-D667 PolarHBondContact NH2-O 2.96Å; R184-D667 IonicContact NH2-OD1 2.75Å; R184-I671 HydrophobicContact CG-CD1 4.34Å
185	L	74.1	Confident	81.1	Confident	12 Å²	12	31.9 Å²	31.9	6%	0.063	15%	0.152	C	C	.	.	H	α-helix	trans	-61.3	-41.4	176.6	-174.1	71.8	0	0	0	112.7	Y181 Q351 T952 L955	Y181-L185 HydrophobicContact CE2-CB 4.3Å; Y181-L185 HydrophobicContact CE2-CD1 4.45Å; Y181-L185 HydrophobicContact CE2-CD2 4.48Å; Y181-L185 PolarHBondContact O-N 3.35Å; L185-Q351 HydrophobicContact CD2-CG 4.48Å; L185-T952 HydrophobicContact CD2-CG2 3.98Å; L185-L955 HydrophobicContact CD1-CD2 3.66Å
186	N	77.4	Confident	81.3	Confident	16 Å²	16	32.1 Å²	32.1	9%	0.086	15%	0.153	C	C	.	.	H	α-helix	trans	-94.9	0.8	-174.9	-68.8	-56.6	0	0	0	114.7	F182 F183 R184 S188 S189 L190 P291	F182-N186 WeakPolarHBondContact CD2-ND2 3.35Å; F182-N186 VanDerWaalsContact CE2-ND2 3.32Å; F182-N186 WeakPolarHBondContact CE2-ND2 3.45Å; F182-N186 WeakPolarHBondContact O-CB 3.46Å; F182-N186 PolarHBondContact O-N 3.09Å; F182-N186 VanDerWaalsContact O-N 3.15Å; F182-N186 PolarHBondContact O-ND2 2.93Å; F183-N186 PolarHBondContact O-N 3.05Å; R184-N186 PolarHBondContact O-N 3.02Å; N186-S188 VanDerWaalsContact C-N 3.29Å; N186-S188 PolarHBondContact O-N 3.47Å; N186-S189 WeakPolarHBondContact O-CA 3.27Å; N186-S189 WeakPolarHBondContact O-CB 3.27Å; N186-S189 PolarHBondContact O-N 2.85Å; N186-L190 PolarHBondContact O-N 3.17Å; N186-P291 HydrophobicContact CB-CB 3.94Å; N186-P291 HydrophobicContact CB-CG 4.39Å
187	Q	79	Confident	81.6	Confident	58 Å²	58	24.8 Å²	24.8	27%	0.271	13%	0.126	S	C	.	.	H	α-helix	trans	-56.8	-41.9	179.8	-171.4	175	-1.7	0	0	112	F183 S189 L190 T191 C235	F183-Q187 PolarHBondContact O-N 2.92Å; Q187-S189 VanDerWaalsContact C-N 3.32Å; Q187-S189 PolarHBondContact O-N 3.4Å; Q187-L190 PolarHBondContact O-N 3.06Å; Q187-T191 PolarHBondContact O-N 2.81Å; Q187-T191 PolarHBondContact O-OG1 2.81Å; Q187-C235 PolarHBondContact NE2-O 2.78Å
188	S	75.9	Confident	82.2	Confident	42 Å²	42	24.8 Å²	24.8	29%	0.294	13%	0.127	S	C	.	.	H	α-helix	trans	-68.3	-25.5	173.9	178	0	0	0	0	113.7	N186 T191 M192	N186-S188 VanDerWaalsContact C-N 3.29Å; N186-S188 PolarHBondContact O-N 3.47Å; S188-T191 PolarHBondContact O-OG1 3.32Å; S188-M192 WeakPolarHBondContact O-CG 3.46Å; S188-M192 PolarHBondContact O-N 3.08Å
189	S	78.3	Confident	82.4	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.014	14%	0.143	C	C	.	.	H	α-helix	trans	-74.8	-42.3	173.8	-172.2	0	0	0	0	110.6	N186 Q187 T191 M192 L193	N186-S189 WeakPolarHBondContact O-CA 3.27Å; N186-S189 WeakPolarHBondContact O-CB 3.27Å; N186-S189 PolarHBondContact O-N 2.85Å; Q187-S189 VanDerWaalsContact C-N 3.32Å; Q187-S189 PolarHBondContact O-N 3.4Å; S189-T191 VanDerWaalsContact C-N 3.29Å; S189-T191 PolarHBondContact O-N 2.79Å; S189-M192 PolarHBondContact O-N 3.2Å; S189-L193 WeakPolarHBondContact O-CB 3.29Å; S189-L193 PolarHBondContact O-N 2.71Å
190	L	81.8	Confident	82.9	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-36.4	178.9	-172	64.7	0	0	0	112	N186 Q187 L193 M194 C235 M245 L290	N186-L190 PolarHBondContact O-N 3.17Å; Q187-L190 PolarHBondContact O-N 3.06Å; L190-L193 HydrophobicContact CD1-CD2 4.45Å; L190-L193 WeakPolarHBondContact O-CB 3.12Å; L190-L193 PolarHBondContact O-N 2.79Å; L190-M194 HydrophobicContact CD1-CE 3.7Å; L190-M194 HydrophobicContact CG-CE 4.29Å; L190-M194 WeakPolarHBondContact O-CG 3.48Å; L190-M194 PolarHBondContact O-N 3.16Å; L190-M194 VanDerWaalsContact O-N 3.08Å; L190-C235 VanDerWaalsContact CD2-SG 3.6Å; L190-M245 HydrophobicContact CD2-SD 4.03Å; L190-L290 HydrophobicContact CD1-CD1 3.98Å
191	T	83.6	Confident	83.3	Confident	19 Å²	19	22 Å²	22	12%	0.117	12%	0.119	C	C	.	.	H	α-helix	trans	-76.3	-35.8	177.3	55.7	0	0	0	0	112.9	Q187 S188 S189 L193 M194 G195 C235 N236	Q187-T191 PolarHBondContact O-N 2.81Å; Q187-T191 PolarHBondContact O-OG1 2.81Å; S188-T191 PolarHBondContact O-OG1 3.32Å; S189-T191 VanDerWaalsContact C-N 3.29Å; S189-T191 PolarHBondContact O-N 2.79Å; T191-L193 VanDerWaalsContact C-N 3.34Å; T191-M194 PolarHBondContact O-N 3.23Å; T191-G195 PolarHBondContact O-N 3.01Å; T191-C235 HydrophobicContact CG2-CB 3.96Å; T191-N236 WeakPolarHBondContact CG2-ND2 3.42Å
192	M	83.4	Confident	83.8	Confident	52 Å²	52	24.8 Å²	24.8	26%	0.256	14%	0.137	S	C	.	.	H	α-helix	trans	-60.9	-43.8	167.2	-71.8	-168.7	-57.3	0	0	111.2	S188 S189 M194 G195 V196 L944 Q948	S188-M192 WeakPolarHBondContact O-CG 3.46Å; S188-M192 PolarHBondContact O-N 3.08Å; S189-M192 PolarHBondContact O-N 3.2Å; M192-M194 PolarHBondContact O-N 2.9Å; M192-G195 PolarHBondContact O-N 3.48Å; M192-G195 VanDerWaalsContact O-N 3.12Å; M192-V196 WeakPolarHBondContact O-CG2 3.43Å; M192-V196 PolarHBondContact O-N 3.24Å; M192-L944 HydrophobicContact SD-CD2 4.09Å; M192-Q948 HydrophobicContact CE-CB 4.26Å
193	L	87	Confident	84.2	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-57.8	-45.7	177.3	172.6	57.7	0	0	0	112.4	S189 L190 T191 G195 V196 L197 V285 L289 L290	S189-L193 WeakPolarHBondContact O-CB 3.29Å; S189-L193 PolarHBondContact O-N 2.71Å; L190-L193 HydrophobicContact CD1-CD2 4.45Å; L190-L193 WeakPolarHBondContact O-CB 3.12Å; L190-L193 PolarHBondContact O-N 2.79Å; T191-L193 VanDerWaalsContact C-N 3.34Å; L193-G195 VanDerWaalsContact C-N 3.27Å; L193-G195 PolarHBondContact O-N 3.22Å; L193-V196 PolarHBondContact O-N 2.7Å; L193-L197 HydrophobicContact CD1-CD1 3.93Å; L193-L197 HydrophobicContact CD1-CG 3.89Å; L193-L197 HydrophobicContact CG-CD1 4.01Å; L193-L197 HydrophobicContact CG-CG 4.42Å; L193-L197 WeakPolarHBondContact O-CG 3Å; L193-L197 PolarHBondContact O-N 2.77Å; L193-V285 HydrophobicContact CD1-CB 4.42Å; L193-V285 HydrophobicContact CD1-CG1 3.41Å; L193-V285 VanDerWaalsContact CD1-CG1 3.41Å; L193-V285 HydrophobicContact CD1-CG2 4.2Å; L193-V285 HydrophobicContact CD2-CG1 4.28Å; L193-V285 HydrophobicContact CG-CG1 4.48Å; L193-L289 HydrophobicContact CB-CB 4.17Å; L193-L289 HydrophobicContact CB-CD1 4.48Å; L193-L289 HydrophobicContact CD1-CB 4.08Å; L193-L289 HydrophobicContact CD1-CD1 4Å; L193-L289 HydrophobicContact CD2-CB 3.99Å; L193-L289 HydrophobicContact CG-CB 4.29Å; L193-L290 HydrophobicContact CD2-CB 4.27Å; L193-L290 HydrophobicContact CD2-CD1 3.85Å
194	M	88.8	Confident	84.5	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.1	-39.3	176.6	-64.6	-46.8	109.5	0	0	111.7	L190 T191 M192 L197 V198 T228 M232 V252	L190-M194 HydrophobicContact CD1-CE 3.7Å; L190-M194 HydrophobicContact CG-CE 4.29Å; L190-M194 WeakPolarHBondContact O-CG 3.48Å; L190-M194 PolarHBondContact O-N 3.16Å; L190-M194 VanDerWaalsContact O-N 3.08Å; T191-M194 PolarHBondContact O-N 3.23Å; M192-M194 PolarHBondContact O-N 2.9Å; M194-L197 HydrophobicContact CE-CD1 4.25Å; M194-L197 PolarHBondContact O-N 3.26Å; M194-L197 HydrophobicContact SD-CD1 4.44Å; M194-V198 WeakPolarHBondContact O-CG2 3.24Å; M194-V198 PolarHBondContact O-N 3.24Å; M194-T228 HydrophobicContact CB-CG2 4.05Å; M194-T228 HydrophobicContact CG-CG2 4.44Å; M194-T228 HydrophobicContact SD-CG2 3.85Å; M194-M232 HydrophobicContact CB-CB 3.75Å; M194-M232 HydrophobicContact CB-CG 3.87Å; M194-M232 HydrophobicContact CB-SD 4.24Å; M194-M232 HydrophobicContact CG-CB 4.04Å; M194-M232 HydrophobicContact CG-CG 4.43Å; M194-V252 HydrophobicContact CE-CG1 4.2Å; M194-V252 HydrophobicContact CE-CG2 3.68Å; M194-V252 HydrophobicContact SD-CG2 3.9Å
195	G	88.5	Confident	85	Confident	31 Å²	31	22.1 Å²	22.1	32%	0.32	13%	0.13	S	C	.	.	H	α-helix	trans	-62.7	-42.5	175	0	0	0	0	0	113.3	T191 M192 L193 V198 L199	T191-G195 PolarHBondContact O-N 3.01Å; M192-G195 PolarHBondContact O-N 3.48Å; M192-G195 VanDerWaalsContact O-N 3.12Å; L193-G195 VanDerWaalsContact C-N 3.27Å; L193-G195 PolarHBondContact O-N 3.22Å; G195-V198 PolarHBondContact O-N 3.18Å; G195-L199 PolarHBondContact O-N 3.39Å
196	V	88.3	Confident	85.5	Confident	8 Å²	8	24.2 Å²	24.2	5%	0.048	15%	0.15	C	C	.	.	H	α-helix	trans	-67.8	-39.7	176.3	-178.9	0	0	0	0	111.4	M192 L193 L199 V200 F281 A941 L944	M192-V196 WeakPolarHBondContact O-CG2 3.43Å; M192-V196 PolarHBondContact O-N 3.24Å; L193-V196 PolarHBondContact O-N 2.7Å; V196-L199 WeakPolarHBondContact O-CB 3.46Å; V196-L199 PolarHBondContact O-N 3.24Å; V196-V200 HydrophobicContact CG1-CG2 4.47Å; V196-V200 WeakPolarHBondContact O-CG2 3.47Å; V196-V200 PolarHBondContact O-N 3.42Å; V196-F281 HydrophobicContact CG1-CE2 4.28Å; V196-F281 HydrophobicContact CG1-CZ 3.81Å; V196-A941 HydrophobicContact CG1-CB 4.2Å; V196-L944 HydrophobicContact CG2-CD1 3.49Å; V196-L944 VanDerWaalsContact CG2-CD1 3.49Å
197	L	90	Very high	85.8	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.016	15%	0.154	C	C	.	.	H	α-helix	trans	-63.1	-43.1	175.5	-73.5	171.3	0	0	0	111.7	L193 M194 L199 V200 F201 T228 V252 V256 F281 F282	L193-L197 HydrophobicContact CD1-CD1 3.93Å; L193-L197 HydrophobicContact CD1-CG 3.89Å; L193-L197 HydrophobicContact CG-CD1 4.01Å; L193-L197 HydrophobicContact CG-CG 4.42Å; L193-L197 WeakPolarHBondContact O-CG 3Å; L193-L197 PolarHBondContact O-N 2.77Å; M194-L197 HydrophobicContact CE-CD1 4.25Å; M194-L197 PolarHBondContact O-N 3.26Å; M194-L197 HydrophobicContact SD-CD1 4.44Å; L197-L199 VanDerWaalsContact C-N 3.33Å; L197-L199 PolarHBondContact O-N 3.16Å; L197-V200 PolarHBondContact O-N 3.15Å; L197-F201 HydrophobicContact CB-CE2 4.01Å; L197-F201 HydrophobicContact CB-CZ 4.29Å; L197-F201 HydrophobicContact CD2-CZ 4.07Å; L197-F201 WeakPolarHBondContact O-CD2 3.49Å; L197-F201 WeakPolarHBondContact O-CG 3.43Å; L197-F201 PolarHBondContact O-N 3.11Å; L197-T228 HydrophobicContact CB-CG2 4.05Å; L197-V252 HydrophobicContact CD1-CG1 3.95Å; L197-V256 HydrophobicContact CD2-CG2 4.47Å; L197-F281 HydrophobicContact CD2-CE1 4.34Å; L197-F282 HydrophobicContact CD2-CE1 4.34Å
198	V	92.1	Very high	85.8	Confident	25 Å²	25	24.9 Å²	24.9	15%	0.152	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-43.2	172.7	167.7	0	0	0	0	111.3	M194 G195 T202 I225 T228 L229	M194-V198 WeakPolarHBondContact O-CG2 3.24Å; M194-V198 PolarHBondContact O-N 3.24Å; G195-V198 PolarHBondContact O-N 3.18Å; V198-T202 WeakPolarHBondContact O-CB 3.44Å; V198-T202 PolarHBondContact O-N 3.19Å; V198-T202 PolarHBondContact O-OG1 2.96Å; V198-I225 HydrophobicContact CG1-CG2 4.23Å; V198-T228 HydrophobicContact CG2-CG2 3.74Å; V198-L229 HydrophobicContact CG1-CD2 4.49Å; V198-L229 HydrophobicContact CG2-CD2 4Å; V198-L229 HydrophobicContact CG2-CG 3.99Å
199	L	90	Very high	86	Confident	68 Å²	68	26 Å²	26	36%	0.356	16%	0.159	S	C	.	.	H	α-helix	trans	-60.2	-48.8	175.6	178.4	63.6	0	0	0	111.6	G195 V196 L197 T202 V203 L940	G195-L199 PolarHBondContact O-N 3.39Å; V196-L199 WeakPolarHBondContact O-CB 3.46Å; V196-L199 PolarHBondContact O-N 3.24Å; L197-L199 VanDerWaalsContact C-N 3.33Å; L197-L199 PolarHBondContact O-N 3.16Å; L199-T202 WeakPolarHBondContact O-CB 3.44Å; L199-T202 PolarHBondContact O-N 3.34Å; L199-V203 HydrophobicContact CD1-CG2 4.38Å; L199-V203 WeakPolarHBondContact O-CG2 3.36Å; L199-V203 PolarHBondContact O-N 3.29Å; L199-L940 HydrophobicContact CD2-CD2 3.75Å
200	V	89.3	Confident	85.9	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-47.7	180	171.3	0	0	0	0	111.5	V196 L197 T202 V203 M204 F281 V937	V196-V200 HydrophobicContact CG1-CG2 4.47Å; V196-V200 WeakPolarHBondContact O-CG2 3.47Å; V196-V200 PolarHBondContact O-N 3.42Å; L197-V200 PolarHBondContact O-N 3.15Å; V200-T202 VanDerWaalsContact C-N 3.25Å; V200-T202 PolarHBondContact O-N 2.95Å; V200-V203 PolarHBondContact O-N 2.99Å; V200-M204 HydrophobicContact CG1-CG 4.38Å; V200-M204 HydrophobicContact CG1-SD 3.97Å; V200-M204 VanDerWaalsContact O-CG 3.31Å; V200-M204 WeakPolarHBondContact O-CG 3.33Å; V200-M204 PolarHBondContact O-N 3.02Å; V200-F281 HydrophobicContact CB-CE1 4.37Å; V200-F281 HydrophobicContact CG1-CD1 4.46Å; V200-F281 HydrophobicContact CG1-CE1 4.3Å; V200-F281 HydrophobicContact CG2-CD1 4.43Å; V200-F281 HydrophobicContact CG2-CE1 3.78Å; V200-F281 HydrophobicContact CG2-CE2 4.29Å; V200-F281 HydrophobicContact CG2-CZ 3.71Å; V200-V937 HydrophobicContact CG2-CG1 3.76Å
201	F	89.9	Confident	85.3	Confident	1 Å²	1	30.6 Å²	30.6	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-63.4	-32.2	177	-57.4	-30.6	0	0	0	112.3	L197 M204 L205 F221 A224 I225 I259 F282	L197-F201 HydrophobicContact CB-CE2 4.01Å; L197-F201 HydrophobicContact CB-CZ 4.29Å; L197-F201 HydrophobicContact CD2-CZ 4.07Å; L197-F201 WeakPolarHBondContact O-CD2 3.49Å; L197-F201 WeakPolarHBondContact O-CG 3.43Å; L197-F201 PolarHBondContact O-N 3.11Å; F201-M204 HydrophobicContact CD1-SD 4.5Å; F201-L205 VanDerWaalsContact O-CB 3.24Å; F201-L205 WeakPolarHBondContact O-CB 3.31Å; F201-L205 PolarHBondContact O-N 3.03Å; F201-F221 HydrophobicContact CB-CD1 4.29Å; F201-F221 HydrophobicContact CD1-CD1 4.48Å; F201-A224 HydrophobicContact CD2-CB 4.11Å; F201-A224 HydrophobicContact CE2-CB 4.34Å; F201-I225 HydrophobicContact CB-CD1 4.16Å; F201-I225 HydrophobicContact CB-CG1 3.65Å; F201-I259 HydrophobicContact CD1-CD1 4.17Å; F201-I259 HydrophobicContact CD1-CG2 4.49Å; F201-I259 HydrophobicContact CD2-CD1 4.44Å; F201-I259 HydrophobicContact CE1-CD1 3.52Å; F201-I259 HydrophobicContact CE1-CG2 4.12Å; F201-I259 HydrophobicContact CE2-CD1 3.84Å; F201-I259 HydrophobicContact CZ-CD1 3.34Å; F201-F282 AromaticContact CE1-CE1 3.95Å; F201-F282 HydrophobicContact CE1-CE1 3.95Å; F201-F282 AromaticContact CE1-CZ 3.94Å; F201-F282 HydrophobicContact CE1-CZ 3.94Å
202	T	89.3	Confident	84.5	Confident	66 Å²	66	32.3 Å²	32.3	41%	0.405	21%	0.21	S	C	.	.	H	α-helix	trans	-69.2	-40.8	174.4	-55.5	0	0	0	0	111.7	V198 L199 V200 L205 A206	V198-T202 WeakPolarHBondContact O-CB 3.44Å; V198-T202 PolarHBondContact O-N 3.19Å; V198-T202 PolarHBondContact O-OG1 2.96Å; L199-T202 WeakPolarHBondContact O-CB 3.44Å; L199-T202 PolarHBondContact O-N 3.34Å; V200-T202 VanDerWaalsContact C-N 3.25Å; V200-T202 PolarHBondContact O-N 2.95Å; T202-L205 PolarHBondContact O-N 2.77Å; T202-A206 WeakPolarHBondContact O-CB 3.41Å; T202-A206 PolarHBondContact O-N 3.4Å
203	V	87.4	Confident	83.7	Confident	25 Å²	25	34 Å²	34	15%	0.152	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-44.2	175.3	169.2	0	0	0	0	111.2	L199 V200 A206 F207 V933	L199-V203 HydrophobicContact CD1-CG2 4.38Å; L199-V203 WeakPolarHBondContact O-CG2 3.36Å; L199-V203 PolarHBondContact O-N 3.29Å; V200-V203 PolarHBondContact O-N 2.99Å; V203-A206 PolarHBondContact O-N 3.29Å; V203-F207 HydrophobicContact CG1-CD2 4.02Å; V203-F207 HydrophobicContact CG1-CE2 3.49Å; V203-F207 VanDerWaalsContact CG1-CE2 3.49Å; V203-F207 HydrophobicContact CG1-CZ 3.94Å; V203-F207 WeakPolarHBondContact O-CD2 3.47Å; V203-F207 PolarHBondContact O-N 3.29Å; V203-V933 HydrophobicContact CG1-CG1 3.85Å
204	M	83.8	Confident	83.1	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-46.7	175	-65.9	176.4	85.2	0	0	111.4	V200 F201 A206 F207 H208 F221 W277 W278	V200-M204 HydrophobicContact CG1-CG 4.38Å; V200-M204 HydrophobicContact CG1-SD 3.97Å; V200-M204 VanDerWaalsContact O-CG 3.31Å; V200-M204 WeakPolarHBondContact O-CG 3.33Å; V200-M204 PolarHBondContact O-N 3.02Å; F201-M204 HydrophobicContact CD1-SD 4.5Å; M204-A206 VanDerWaalsContact C-N 3.33Å; M204-A206 PolarHBondContact O-N 3.4Å; M204-F207 PolarHBondContact O-N 2.8Å; M204-H208 PolarHBondContact O-CD2 3.3Å; M204-H208 VanDerWaalsContact O-CD2 3.23Å; M204-H208 PolarHBondContact O-N 3.08Å; M204-F221 HydrophobicContact CB-CE1 3.94Å; M204-F221 HydrophobicContact CB-CE2 4.17Å; M204-F221 HydrophobicContact CB-CZ 3.77Å; M204-F221 HydrophobicContact CE-CE1 4.08Å; M204-F221 HydrophobicContact CE-CZ 3.77Å; M204-F221 HydrophobicContact SD-CE1 3.91Å; M204-F221 HydrophobicContact SD-CZ 4.13Å; M204-W277 HydrophobicContact CG-CH2 4.02Å; M204-W277 HydrophobicContact CG-CZ2 4.36Å; M204-W278 HydrophobicContact CE-CB 4.19Å; M204-W278 HydrophobicContact CE-CD2 3.53Å; M204-W278 HydrophobicContact CE-CE3 3.57Å; M204-W278 HydrophobicContact CE-CG 3.84Å; M204-W278 HydrophobicContact CE-CZ3 4.13Å
205	L	87.2	Confident	82.9	Confident	28 Å²	28	41.9 Å²	41.9	15%	0.147	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-41.6	175	178.7	58.4	0	0	0	111.9	F201 T202 F207 H208 C209 V218 F221 I225	F201-L205 VanDerWaalsContact O-CB 3.24Å; F201-L205 WeakPolarHBondContact O-CB 3.31Å; F201-L205 PolarHBondContact O-N 3.03Å; T202-L205 PolarHBondContact O-N 2.77Å; L205-F207 PolarHBondContact O-N 3.09Å; L205-H208 PolarHBondContact O-N 3.43Å; L205-C209 VanDerWaalsContact O-CB 3.31Å; L205-C209 WeakPolarHBondContact O-CB 3.27Å; L205-C209 PolarHBondContact O-N 3.22Å; L205-C209 PolarHBondContact O-SG 3.46Å; L205-V218 HydrophobicContact CD1-CB 4.42Å; L205-V218 HydrophobicContact CD1-CG1 4.39Å; L205-V218 HydrophobicContact CD1-CG2 4.33Å; L205-F221 HydrophobicContact CB-CB 4.02Å; L205-F221 HydrophobicContact CB-CD2 4.48Å; L205-F221 HydrophobicContact CB-CG 4.42Å; L205-F221 HydrophobicContact CD1-CB 4.2Å; L205-F221 HydrophobicContact CD2-CB 4.44Å; L205-F221 HydrophobicContact CG-CB 4.45Å; L205-I225 HydrophobicContact CD2-CD1 4.19Å
206	A	85.3	Confident	82.5	Confident	56 Å²	56	44.2 Å²	44.2	46%	0.463	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-39.2	177.8	0	0	0	0	0	112.8	T202 V203 M204 C209 S210	T202-A206 WeakPolarHBondContact O-CB 3.41Å; T202-A206 PolarHBondContact O-N 3.4Å; V203-A206 PolarHBondContact O-N 3.29Å; M204-A206 VanDerWaalsContact C-N 3.33Å; M204-A206 PolarHBondContact O-N 3.4Å; A206-C209 PolarHBondContact O-N 2.94Å; A206-S210 PolarHBondContact O-N 3.22Å; A206-S210 VanDerWaalsContact O-N 3.16Å; A206-S210 PolarHBondContact O-OG 3.21Å
207	F	83.4	Confident	82.2	Confident	39 Å²	39	44 Å²	44	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-42.4	174.2	-67	-39.2	0	0	0	112.8	V203 M204 L205 C209 S210 G211 V925 M930 V933	V203-F207 HydrophobicContact CG1-CD2 4.02Å; V203-F207 HydrophobicContact CG1-CE2 3.49Å; V203-F207 VanDerWaalsContact CG1-CE2 3.49Å; V203-F207 HydrophobicContact CG1-CZ 3.94Å; V203-F207 WeakPolarHBondContact O-CD2 3.47Å; V203-F207 PolarHBondContact O-N 3.29Å; M204-F207 PolarHBondContact O-N 2.8Å; L205-F207 PolarHBondContact O-N 3.09Å; F207-C209 VanDerWaalsContact C-N 3.32Å; F207-C209 PolarHBondContact O-N 3.01Å; F207-S210 PolarHBondContact O-N 3.15Å; F207-S210 PolarHBondContact O-OG 3.04Å; F207-S210 VanDerWaalsContact O-OG 3.09Å; F207-G211 PolarHBondContact O-N 3.26Å; F207-V925 HydrophobicContact CB-CG2 4.22Å; F207-V925 HydrophobicContact CD1-CG1 4.07Å; F207-V925 HydrophobicContact CD1-CG2 4.42Å; F207-V925 HydrophobicContact CE1-CG1 4.4Å; F207-V925 WeakPolarHBondContact O-CG2 3.27Å; F207-M930 HydrophobicContact CE2-CG 4.12Å; F207-M930 HydrophobicContact CZ-CG 4.26Å; F207-V933 HydrophobicContact CE2-CG1 4.47Å; F207-V933 HydrophobicContact CZ-CB 3.98Å; F207-V933 HydrophobicContact CZ-CG1 3.81Å; F207-V933 HydrophobicContact CZ-CG2 4.44Å
208	H	77.9	Confident	82	Confident	49 Å²	49	46.2 Å²	46.2	23%	0.227	29%	0.293	C	S	.	.	H	α-helix	trans	-68.1	-31.5	175.8	-75.5	-74.5	0	0	0	112.8	M204 L205 Y217 F221	M204-H208 PolarHBondContact O-CD2 3.3Å; M204-H208 VanDerWaalsContact O-CD2 3.23Å; M204-H208 PolarHBondContact O-N 3.08Å; L205-H208 PolarHBondContact O-N 3.43Å; H208-Y217 AromaticContact CE1-CE1 3.6Å; H208-Y217 AromaticContact CE1-CE2 3.62Å; H208-Y217 AromaticContact CE1-CZ 3.36Å; H208-Y217 AromaticContact ND1-CD2 3.94Å; H208-Y217 AromaticContact ND1-CE2 3.9Å; H208-Y217 AromaticContact NE2-CD1 3.88Å; H208-Y217 AromaticContact NE2-CE1 3.52Å; H208-Y217 AromaticContact NE2-CZ 3.78Å; H208-F221 AromaticContact CD2-CE2 3.64Å
209	C	80.1	Confident	81.8	Confident	66 Å²	66	49.2 Å²	49.2	45%	0.446	31%	0.311	S	S	.	.	H	α-helix	trans	-76.6	-16.7	176.1	-73.9	0	0	0	0	114.4	L205 A206 F207	L205-C209 VanDerWaalsContact O-CB 3.31Å; L205-C209 WeakPolarHBondContact O-CB 3.27Å; L205-C209 PolarHBondContact O-N 3.22Å; L205-C209 PolarHBondContact O-SG 3.46Å; A206-C209 PolarHBondContact O-N 2.94Å; F207-C209 VanDerWaalsContact C-N 3.32Å; F207-C209 PolarHBondContact O-N 3.01Å
210	S	76.8	Confident	81.7	Confident	81 Å²	81	47.7 Å²	47.7	57%	0.566	30%	0.304	S	S	*	.	H	α-helix	trans	-93.8	-15.1	175.7	63.4	0	0	0	0	114	A206 F207 V925	A206-S210 PolarHBondContact O-N 3.22Å; A206-S210 VanDerWaalsContact O-N 3.16Å; A206-S210 PolarHBondContact O-OG 3.21Å; F207-S210 PolarHBondContact O-N 3.15Å; F207-S210 PolarHBondContact O-OG 3.04Å; F207-S210 VanDerWaalsContact O-OG 3.09Å; S210-V925 WeakPolarHBondContact OG-CG2 3.39Å
211	G	69.6	Low	81.6	Confident	20 Å²	20	47.7 Å²	47.7	21%	0.206	31%	0.305	C	S	.	.	S	Bend	trans	-85.9	-142.2	165.7	0	0	0	0	0	112.6	F207 P213 N923	F207-G211 PolarHBondContact O-N 3.26Å; G211-P213 WeakPolarHBondContact O-CD 3.43Å; G211-N923 WeakPolarHBondContact CA-O 3.49Å
212	A	66.9	Low	81.5	Confident	55 Å²	55	50.4 Å²	50.4	46%	0.455	32%	0.323	S	S	.	.			trans	-86.7	109.3	170.8	0	0	0	0	0	110.5	T214	A212-T214 PolarHBondContact O-N 3.17Å; A212-T214 VanDerWaalsContact O-N 3.11Å
213	P	66.5	Low	81.6	Confident	88 Å²	88	51.8 Å²	51.8	57%	0.571	33%	0.328	S	S	*	.			trans	-76.8	104.4	-169.8	29.6	-35.4	0	0	0	112.4	G211	G211-P213 WeakPolarHBondContact O-CD 3.43Å
214	T	74.8	Confident	81.8	Confident	48 Å²	48	50.7 Å²	50.7	29%	0.294	32%	0.321	S	S	.	.			trans	-83.1	125.4	172	34.2	0	0	0	0	111.1	A212 T216 Y217 V218	A212-T214 PolarHBondContact O-N 3.17Å; A212-T214 VanDerWaalsContact O-N 3.11Å; T214-T216 PolarHBondContact O-N 2.88Å; T214-T216 VanDerWaalsContact O-N 3.13Å; T214-Y217 PolarHBondContact O-N 3.02Å; T214-Y217 VanDerWaalsContact O-N 3.14Å; T214-Y217 WeakPolarHBondContact OG1-CD2 3.42Å; T214-V218 PolarHBondContact O-N 3.2Å
215	V	83	Confident	82.2	Confident	116 Å²	116	51.7 Å²	51.7	70%	0.703	33%	0.327	S	S	*	.	H	α-helix	trans	-56.3	-34.9	-171.4	-178.3	0	0	0	0	112.8	V218 V219	V215-V218 PolarHBondContact O-N 3.45Å; V215-V219 HydrophobicContact CG1-CG2 4.32Å; V215-V219 WeakPolarHBondContact O-CG2 3.32Å; V215-V219 PolarHBondContact O-N 2.88Å; V215-V219 VanDerWaalsContact O-N 3.08Å
216	T	82.1	Confident	82.5	Confident	80 Å²	80	56.5 Å²	56.5	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-49	177.4	37.7	0	0	0	0	112.9	T214 V219 V220	T214-T216 PolarHBondContact O-N 2.88Å; T214-T216 VanDerWaalsContact O-N 3.13Å; T216-V219 PolarHBondContact O-N 3.31Å; T216-V220 WeakPolarHBondContact O-CB 3.32Å; T216-V220 VanDerWaalsContact O-CG2 3.25Å; T216-V220 WeakPolarHBondContact O-CG2 3.36Å; T216-V220 PolarHBondContact O-N 3.11Å
217	Y	80.4	Confident	82.8	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.02	34%	0.343	C	S	.	.	H	α-helix	trans	-63.9	-43.3	178.7	-89.2	-69.7	0	0	0	112	H208 T214 V219 V220 F221 G263 L266 V267	H208-Y217 AromaticContact CE1-CE1 3.6Å; H208-Y217 AromaticContact CE1-CE2 3.62Å; H208-Y217 AromaticContact CE1-CZ 3.36Å; H208-Y217 AromaticContact ND1-CD2 3.94Å; H208-Y217 AromaticContact ND1-CE2 3.9Å; H208-Y217 AromaticContact NE2-CD1 3.88Å; H208-Y217 AromaticContact NE2-CE1 3.52Å; H208-Y217 AromaticContact NE2-CZ 3.78Å; T214-Y217 PolarHBondContact O-N 3.02Å; T214-Y217 VanDerWaalsContact O-N 3.14Å; T214-Y217 WeakPolarHBondContact OG1-CD2 3.42Å; Y217-V219 VanDerWaalsContact C-N 3.35Å; Y217-V219 PolarHBondContact O-N 2.78Å; Y217-V220 PolarHBondContact O-N 3.01Å; Y217-F221 HydrophobicContact CD1-CD2 4.1Å; Y217-F221 AromaticContact CD1-CE2 3.48Å; Y217-F221 HydrophobicContact CD1-CE2 3.48Å; Y217-F221 VanDerWaalsContact CD1-CE2 3.48Å; Y217-F221 HydrophobicContact CD1-CZ 4.28Å; Y217-F221 HydrophobicContact CE1-CE2 4.03Å; Y217-F221 HydrophobicContact CE1-CZ 4.48Å; Y217-F221 HydrophobicContact CG-CE2 4.45Å; Y217-F221 WeakPolarHBondContact O-CD2 3.39Å; Y217-F221 PolarHBondContact O-N 3.06Å; Y217-G263 PolarHBondContact OH-O 2.86Å; Y217-L266 HydrophobicContact CD2-CB 4.18Å; Y217-L266 HydrophobicContact CD2-CD1 4.34Å; Y217-L266 HydrophobicContact CE1-CB 4.42Å; Y217-L266 HydrophobicContact CE2-CB 3.35Å; Y217-L266 HydrophobicContact CE2-CD1 4.27Å; Y217-L266 HydrophobicContact CE2-CG 4.47Å; Y217-L266 WeakPolarHBondContact CE2-O 3.44Å; Y217-L266 VanDerWaalsContact OH-C 3.23Å; Y217-L266 WeakPolarHBondContact OH-CB 3.34Å; Y217-L266 PolarHBondContact OH-O 3.22Å; Y217-V267 PolarHBondContact OH-N 2.81Å
218	V	85.6	Confident	83.1	Confident	49 Å²	49	55.6 Å²	55.6	30%	0.297	34%	0.335	S	S	.	.	H	α-helix	trans	-60.7	-44.5	180	179.5	0	0	0	0	111	L205 T214 V215 S222	L205-V218 HydrophobicContact CD1-CB 4.42Å; L205-V218 HydrophobicContact CD1-CG1 4.39Å; L205-V218 HydrophobicContact CD1-CG2 4.33Å; T214-V218 PolarHBondContact O-N 3.2Å; V215-V218 PolarHBondContact O-N 3.45Å; V218-S222 WeakPolarHBondContact O-CB 3.42Å; V218-S222 PolarHBondContact O-N 2.91Å; V218-S222 VanDerWaalsContact O-N 3.12Å; V218-S222 PolarHBondContact O-OG 2.82Å
219	V	88	Confident	83.8	Confident	88 Å²	88	57 Å²	57	53%	0.533	34%	0.344	S	S	.	.	H	α-helix	trans	-65.5	-45.8	176.6	171.7	0	0	0	0	111.6	V215 T216 Y217 S222 L223	V215-V219 HydrophobicContact CG1-CG2 4.32Å; V215-V219 WeakPolarHBondContact O-CG2 3.32Å; V215-V219 PolarHBondContact O-N 2.88Å; V215-V219 VanDerWaalsContact O-N 3.08Å; T216-V219 PolarHBondContact O-N 3.31Å; Y217-V219 VanDerWaalsContact C-N 3.35Å; Y217-V219 PolarHBondContact O-N 2.78Å; V219-S222 PolarHBondContact O-N 2.87Å; V219-L223 WeakPolarHBondContact O-CB 3.22Å; V219-L223 PolarHBondContact O-N 2.82Å
220	V	87.9	Confident	84.3	Confident	35 Å²	35	57.1 Å²	57.1	21%	0.212	34%	0.343	C	S	.	.	H	α-helix	trans	-65.4	-47.8	-176.6	168.8	0	0	0	0	112	T216 Y217 L223 A224 I262	T216-V220 WeakPolarHBondContact O-CB 3.32Å; T216-V220 VanDerWaalsContact O-CG2 3.25Å; T216-V220 WeakPolarHBondContact O-CG2 3.36Å; T216-V220 PolarHBondContact O-N 3.11Å; Y217-V220 PolarHBondContact O-N 3.01Å; V220-L223 PolarHBondContact O-N 3.03Å; V220-A224 WeakPolarHBondContact O-CB 3.31Å; V220-A224 PolarHBondContact O-N 3.23Å; V220-I262 HydrophobicContact CG1-CD1 3.89Å; V220-I262 HydrophobicContact CG1-CG2 4.21Å; V220-I262 HydrophobicContact CG2-CD1 4.03Å; V220-I262 HydrophobicContact CG2-CG2 4.33Å
221	F	86.9	Confident	84.8	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.009	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-37.2	178.1	-74.8	-58.8	0	0	0	112.5	F201 M204 L205 H208 Y217 L223 A224 I225 I259	F201-F221 HydrophobicContact CB-CD1 4.29Å; F201-F221 HydrophobicContact CD1-CD1 4.48Å; M204-F221 HydrophobicContact CB-CE1 3.94Å; M204-F221 HydrophobicContact CB-CE2 4.17Å; M204-F221 HydrophobicContact CB-CZ 3.77Å; M204-F221 HydrophobicContact CE-CE1 4.08Å; M204-F221 HydrophobicContact CE-CZ 3.77Å; M204-F221 HydrophobicContact SD-CE1 3.91Å; M204-F221 HydrophobicContact SD-CZ 4.13Å; L205-F221 HydrophobicContact CB-CB 4.02Å; L205-F221 HydrophobicContact CB-CD2 4.48Å; L205-F221 HydrophobicContact CB-CG 4.42Å; L205-F221 HydrophobicContact CD1-CB 4.2Å; L205-F221 HydrophobicContact CD2-CB 4.44Å; L205-F221 HydrophobicContact CG-CB 4.45Å; H208-F221 AromaticContact CD2-CE2 3.64Å; Y217-F221 HydrophobicContact CD1-CD2 4.1Å; Y217-F221 AromaticContact CD1-CE2 3.48Å; Y217-F221 HydrophobicContact CD1-CE2 3.48Å; Y217-F221 VanDerWaalsContact CD1-CE2 3.48Å; Y217-F221 HydrophobicContact CD1-CZ 4.28Å; Y217-F221 HydrophobicContact CE1-CE2 4.03Å; Y217-F221 HydrophobicContact CE1-CZ 4.48Å; Y217-F221 HydrophobicContact CG-CE2 4.45Å; Y217-F221 WeakPolarHBondContact O-CD2 3.39Å; Y217-F221 PolarHBondContact O-N 3.06Å; F221-L223 VanDerWaalsContact C-N 3.34Å; F221-L223 PolarHBondContact O-N 3.23Å; F221-A224 PolarHBondContact O-N 2.9Å; F221-I225 VanDerWaalsContact O-CG1 3.3Å; F221-I225 WeakPolarHBondContact O-CG1 3.4Å; F221-I225 PolarHBondContact O-N 3.48Å; F221-I259 HydrophobicContact CE1-CG2 3.82Å
222	S	89.8	Confident	85.7	Confident	57 Å²	57	56.7 Å²	56.7	40%	0.399	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-42.1	175.3	-59.8	0	0	0	0	111.8	V218 V219 F226	V218-S222 WeakPolarHBondContact O-CB 3.42Å; V218-S222 PolarHBondContact O-N 2.91Å; V218-S222 VanDerWaalsContact O-N 3.12Å; V218-S222 PolarHBondContact O-OG 2.82Å; V219-S222 PolarHBondContact O-N 2.87Å; S222-F226 WeakPolarHBondContact O-CB 3.46Å; S222-F226 PolarHBondContact O-N 3.33Å
223	L	91.4	Very high	86.6	Confident	95 Å²	95	59.1 Å²	59.1	50%	0.497	34%	0.337	S	S	.	.	H	α-helix	trans	-66.4	-40.5	175	-178.4	60.6	0	0	0	111.8	V219 V220 F221 F226 L227	V219-L223 WeakPolarHBondContact O-CB 3.22Å; V219-L223 PolarHBondContact O-N 2.82Å; V220-L223 PolarHBondContact O-N 3.03Å; F221-L223 VanDerWaalsContact C-N 3.34Å; F221-L223 PolarHBondContact O-N 3.23Å; L223-F226 PolarHBondContact O-N 3.39Å; L223-L227 HydrophobicContact CD1-CD1 4.21Å; L223-L227 HydrophobicContact CD1-CG 4.21Å; L223-L227 HydrophobicContact CG-CD1 3.99Å; L223-L227 HydrophobicContact CG-CG 4.43Å; L223-L227 WeakPolarHBondContact O-CB 3.37Å; L223-L227 VanDerWaalsContact O-CG 3.28Å; L223-L227 WeakPolarHBondContact O-CG 3.33Å; L223-L227 PolarHBondContact O-N 2.91Å
224	A	90.1	Very high	87.5	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-44.4	175.8	0	0	0	0	0	112.8	F201 V220 F221 L227 T228 L255 I259	F201-A224 HydrophobicContact CD2-CB 4.11Å; F201-A224 HydrophobicContact CE2-CB 4.34Å; V220-A224 WeakPolarHBondContact O-CB 3.31Å; V220-A224 PolarHBondContact O-N 3.23Å; F221-A224 PolarHBondContact O-N 2.9Å; A224-L227 PolarHBondContact O-N 3.09Å; A224-T228 WeakPolarHBondContact O-CB 3.5Å; A224-T228 PolarHBondContact O-N 2.93Å; A224-T228 PolarHBondContact O-OG1 2.83Å; A224-L255 HydrophobicContact CB-CD1 4.25Å; A224-I259 HydrophobicContact CB-CD1 3.49Å; A224-I259 VanDerWaalsContact CB-CD1 3.49Å; A224-I259 HydrophobicContact CB-CG1 4.18Å
225	I	92.6	Very high	87.7	Confident	27 Å²	27	55 Å²	55	14%	0.138	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-48.5	175	-69.9	163.1	0	0	0	110.1	V198 F201 L205 F221 L227 T228 L229	V198-I225 HydrophobicContact CG1-CG2 4.23Å; F201-I225 HydrophobicContact CB-CD1 4.16Å; F201-I225 HydrophobicContact CB-CG1 3.65Å; L205-I225 HydrophobicContact CD2-CD1 4.19Å; F221-I225 VanDerWaalsContact O-CG1 3.3Å; F221-I225 WeakPolarHBondContact O-CG1 3.4Å; F221-I225 PolarHBondContact O-N 3.48Å; I225-L227 PolarHBondContact O-N 3.31Å; I225-T228 PolarHBondContact O-N 2.99Å; I225-L229 HydrophobicContact CG2-CD1 3.92Å; I225-L229 WeakPolarHBondContact O-CG 3.38Å; I225-L229 PolarHBondContact O-N 3.32Å
226	F	93.6	Very high	87.4	Confident	129 Å²	129	53.5 Å²	53.5	57%	0.566	30%	0.298	S	S	*	.	H	α-helix	trans	-58.7	-48.7	178	178.1	-100.3	0	0	0	112.6	S222 L223 T228 L229 V230	S222-F226 WeakPolarHBondContact O-CB 3.46Å; S222-F226 PolarHBondContact O-N 3.33Å; L223-F226 PolarHBondContact O-N 3.39Å; F226-T228 VanDerWaalsContact C-N 3.34Å; F226-T228 PolarHBondContact O-N 3.41Å; F226-L229 PolarHBondContact O-N 3.12Å; F226-V230 HydrophobicContact CD1-CG2 4.44Å; F226-V230 HydrophobicContact CE1-CG2 4.03Å; F226-V230 HydrophobicContact CE2-CG2 4.33Å; F226-V230 HydrophobicContact CZ-CG2 3.97Å; F226-V230 WeakPolarHBondContact O-CG2 3.21Å; F226-V230 PolarHBondContact O-N 2.91Å
227	L	92.1	Very high	87.3	Confident	73 Å²	73	58.3 Å²	58.3	38%	0.382	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-41.5	177.6	-71.3	170.7	0	0	0	111.8	L223 A224 I225 V230 L231 L255	L223-L227 HydrophobicContact CD1-CD1 4.21Å; L223-L227 HydrophobicContact CD1-CG 4.21Å; L223-L227 HydrophobicContact CG-CD1 3.99Å; L223-L227 HydrophobicContact CG-CG 4.43Å; L223-L227 WeakPolarHBondContact O-CB 3.37Å; L223-L227 VanDerWaalsContact O-CG 3.28Å; L223-L227 WeakPolarHBondContact O-CG 3.33Å; L223-L227 PolarHBondContact O-N 2.91Å; A224-L227 PolarHBondContact O-N 3.09Å; I225-L227 PolarHBondContact O-N 3.31Å; L227-V230 PolarHBondContact O-N 2.95Å; L227-L231 WeakPolarHBondContact O-CG 3.25Å; L227-L231 PolarHBondContact O-N 3.45Å; L227-L255 HydrophobicContact CB-CD2 4.36Å; L227-L255 HydrophobicContact CD1-CD1 4.26Å
228	T	89.9	Confident	86.5	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.012	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-39.4	179.1	-52	0	0	0	0	111.7	M194 L197 V198 A224 I225 F226 L231 M232 L255	M194-T228 HydrophobicContact CB-CG2 4.05Å; M194-T228 HydrophobicContact CG-CG2 4.44Å; M194-T228 HydrophobicContact SD-CG2 3.85Å; L197-T228 HydrophobicContact CB-CG2 4.05Å; V198-T228 HydrophobicContact CG2-CG2 3.74Å; A224-T228 WeakPolarHBondContact O-CB 3.5Å; A224-T228 PolarHBondContact O-N 2.93Å; A224-T228 PolarHBondContact O-OG1 2.83Å; I225-T228 PolarHBondContact O-N 2.99Å; F226-T228 VanDerWaalsContact C-N 3.34Å; F226-T228 PolarHBondContact O-N 3.41Å; T228-L231 PolarHBondContact O-N 2.79Å; T228-M232 WeakPolarHBondContact O-CB 3.42Å; T228-M232 PolarHBondContact O-N 3.4Å; T228-L255 WeakPolarHBondContact OG1-CD2 3.5Å
229	L	91.1	Very high	85.1	Confident	79 Å²	79	67.4 Å²	67.4	41%	0.414	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-40.5	173.6	-71.4	169.5	0	0	0	112.3	V198 I225 F226 M232 V233	V198-L229 HydrophobicContact CG1-CD2 4.49Å; V198-L229 HydrophobicContact CG2-CD2 4Å; V198-L229 HydrophobicContact CG2-CG 3.99Å; I225-L229 HydrophobicContact CG2-CD1 3.92Å; I225-L229 WeakPolarHBondContact O-CG 3.38Å; I225-L229 PolarHBondContact O-N 3.32Å; F226-L229 PolarHBondContact O-N 3.12Å; L229-M232 WeakPolarHBondContact O-CB 3.37Å; L229-M232 PolarHBondContact O-N 2.9Å; L229-V233 WeakPolarHBondContact O-CG2 3.27Å; L229-V233 PolarHBondContact O-N 3.31Å
230	V	90.5	Very high	84.1	Confident	68 Å²	68	66.6 Å²	66.6	41%	0.412	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-46	174.1	170.5	0	0	0	0	110.8	F226 L227 M232 V233 V234	F226-V230 HydrophobicContact CD1-CG2 4.44Å; F226-V230 HydrophobicContact CE1-CG2 4.03Å; F226-V230 HydrophobicContact CE2-CG2 4.33Å; F226-V230 HydrophobicContact CZ-CG2 3.97Å; F226-V230 WeakPolarHBondContact O-CG2 3.21Å; F226-V230 PolarHBondContact O-N 2.91Å; L227-V230 PolarHBondContact O-N 2.95Å; V230-M232 VanDerWaalsContact C-N 3.34Å; V230-M232 PolarHBondContact O-N 3.34Å; V230-V233 PolarHBondContact O-N 2.91Å; V230-V234 WeakPolarHBondContact O-CG2 3.12Å; V230-V234 PolarHBondContact O-N 2.86Å
231	L	88	Confident	82.9	Confident	35 Å²	35	70.8 Å²	70.8	18%	0.183	37%	0.373	C	S	.	.	H	α-helix	trans	-62.2	-39.5	175.8	-66.6	174.2	0	0	0	111.9	L227 T228 V233 V234 C235 V248 V252	L227-L231 WeakPolarHBondContact O-CG 3.25Å; L227-L231 PolarHBondContact O-N 3.45Å; T228-L231 PolarHBondContact O-N 2.79Å; L231-V233 VanDerWaalsContact C-N 3.35Å; L231-V233 PolarHBondContact O-N 2.71Å; L231-V234 PolarHBondContact O-N 2.76Å; L231-C235 PolarHBondContact O-N 3.28Å; L231-C235 PolarHBondContact O-SG 3.23Å; L231-V248 HydrophobicContact CD2-CG1 4.32Å; L231-V252 HydrophobicContact CD1-CG2 4Å
232	M	88.1	Confident	81.9	Confident	57 Å²	57	72.3 Å²	72.3	28%	0.281	38%	0.38	S	S	.	.	H	α-helix	trans	-60.4	-40.7	175.3	-168.9	-179.5	-178.4	0	0	112.7	M194 T228 L229 V230 N236	M194-M232 HydrophobicContact CB-CB 3.75Å; M194-M232 HydrophobicContact CB-CG 3.87Å; M194-M232 HydrophobicContact CB-SD 4.24Å; M194-M232 HydrophobicContact CG-CB 4.04Å; M194-M232 HydrophobicContact CG-CG 4.43Å; T228-M232 WeakPolarHBondContact O-CB 3.42Å; T228-M232 PolarHBondContact O-N 3.4Å; L229-M232 WeakPolarHBondContact O-CB 3.37Å; L229-M232 PolarHBondContact O-N 2.9Å; V230-M232 VanDerWaalsContact C-N 3.34Å; V230-M232 PolarHBondContact O-N 3.34Å; M232-N236 PolarHBondContact O-N 2.69Å; M232-N236 PolarHBondContact O-ND2 2.92Å
233	V	87.3	Confident	80.8	Confident	107 Å²	107	73.8 Å²	73.8	65%	0.648	38%	0.383	S	S	*	.	H	α-helix	trans	-69	-38.8	176.1	172.8	0	0	0	0	111.3	L229 V230 L231 N236 R237	L229-V233 WeakPolarHBondContact O-CG2 3.27Å; L229-V233 PolarHBondContact O-N 3.31Å; V230-V233 PolarHBondContact O-N 2.91Å; L231-V233 VanDerWaalsContact C-N 3.35Å; L231-V233 PolarHBondContact O-N 2.71Å; V233-N236 PolarHBondContact O-N 2.9Å; V233-R237 PolarHBondContact O-N 3.32Å
234	V	85.1	Confident	80	Confident	47 Å²	47	74.1 Å²	74.1	29%	0.285	38%	0.382	S	S	.	.	H	α-helix	trans	-62.4	-45.7	175.4	171.5	0	0	0	0	111.3	V230 L231 N236 R237 F240	V230-V234 WeakPolarHBondContact O-CG2 3.12Å; V230-V234 PolarHBondContact O-N 2.86Å; L231-V234 PolarHBondContact O-N 2.76Å; V234-N236 VanDerWaalsContact C-N 3.27Å; V234-N236 PolarHBondContact O-N 2.74Å; V234-R237 PolarHBondContact O-N 2.91Å; V234-F240 HydrophobicContact CG1-CD2 3.54Å; V234-F240 HydrophobicContact CG1-CE2 3.5Å; V234-F240 HydrophobicContact CG1-CG 4.09Å; V234-F240 HydrophobicContact CG1-CZ 4.02Å
235	C	78.8	Confident	79.4	Confident	1 Å²	1	74.5 Å²	74.5	1%	0.007	38%	0.384	C	S	.	.	H	α-helix	trans	-63.1	-27.2	178.4	-69.2	0	0	0	0	114.5	Q187 L190 T191 L231	Q187-C235 PolarHBondContact NE2-O 2.78Å; L190-C235 VanDerWaalsContact CD2-SG 3.6Å; T191-C235 HydrophobicContact CG2-CB 3.96Å; L231-C235 PolarHBondContact O-N 3.28Å; L231-C235 PolarHBondContact O-SG 3.23Å
236	N	76.3	Confident	78.9	Confident	86 Å²	86	79.1 Å²	79.1	46%	0.46	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.6	178.6	-79.1	-63.2	0	0	0	113.6	T191 M232 V233 V234 N238	T191-N236 WeakPolarHBondContact CG2-ND2 3.42Å; M232-N236 PolarHBondContact O-N 2.69Å; M232-N236 PolarHBondContact O-ND2 2.92Å; V233-N236 PolarHBondContact O-N 2.9Å; V234-N236 VanDerWaalsContact C-N 3.27Å; V234-N236 PolarHBondContact O-N 2.74Å; N236-N238 PolarHBondContact O-N 2.98Å
237	R	80.6	Confident	78.6	Confident	181 Å²	181	78 Å²	78	68%	0.683	40%	0.397	S	S	*	.			trans	-86.7	107.6	-177.3	-171	172.9	-176.9	146.8	0.9	110.8	V233 V234 A239 F240	V233-R237 PolarHBondContact O-N 3.32Å; V234-R237 PolarHBondContact O-N 2.91Å; R237-A239 HydrophobicContact CG-CB 4.41Å; R237-A239 PolarHBondContact O-N 3.32Å; R237-F240 WeakPolarHBondContact O-CB 3.46Å; R237-F240 PolarHBondContact O-N 3.13Å
238	N	62.1	Low	78.3	Confident	161 Å²	161	75 Å²	75	86%	0.861	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-17.2	178.8	-64.5	3.4	0	0	0	116	N236	N236-N238 PolarHBondContact O-N 2.98Å
239	A	57.8	Low	78.2	Confident	83 Å²	83	74.9 Å²	74.9	69%	0.686	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	0.1	177.6	0	0	0	0	0	114.5	R237	R237-A239 HydrophobicContact CG-CB 4.41Å; R237-A239 PolarHBondContact O-N 3.32Å
240	F	66.4	Low	78.2	Confident	72 Å²	72	76.3 Å²	76.3	32%	0.316	38%	0.382	S	S	.	.	S	Bend	trans	-81.8	119.4	175.5	-169.4	-89.5	0	0	0	109.9	V234 R237 Q242 H244 M245 V248	V234-F240 HydrophobicContact CG1-CD2 3.54Å; V234-F240 HydrophobicContact CG1-CE2 3.5Å; V234-F240 HydrophobicContact CG1-CG 4.09Å; V234-F240 HydrophobicContact CG1-CZ 4.02Å; R237-F240 WeakPolarHBondContact O-CB 3.46Å; R237-F240 PolarHBondContact O-N 3.13Å; F240-Q242 PolarHBondContact O-N 3.02Å; F240-H244 HydrophobicContact CD1-CB 4.47Å; F240-H244 HydrophobicContact CE1-CB 3.52Å; F240-H244 HydrophobicContact CZ-CB 3.64Å; F240-M245 HydrophobicContact CD1-CE 3.46Å; F240-M245 VanDerWaalsContact CD1-CE 3.46Å; F240-M245 HydrophobicContact CE1-CE 3.54Å; F240-M245 HydrophobicContact CG-CE 4.48Å; F240-V248 HydrophobicContact CE1-CG2 4.37Å; F240-V248 HydrophobicContact CZ-CG2 4.29Å
241	H	62.7	Low	78.2	Confident	123 Å²	123	75 Å²	75	57%	0.569	38%	0.378	S	S	*	.			trans	-62.9	131	-174.4	-130.5	-95.4	0	0	0	111.4	D243 H244	H241-D243 IonicContact CE1-OD2 3.69Å; H241-D243 PolarHBondContact CE1-OD2 2.79Å; H241-D243 IonicContact CG-OD2 3.87Å; H241-D243 IonicContact ND1-OD2 2.73Å; H241-D243 PolarHBondContact ND1-OD2 2.93Å; H241-D243 PolarHBondContact O-N 3.41Å; H241-D243 VanDerWaalsContact O-N 3.14Å; H241-H244 PolarHBondContact O-N 3.4Å
242	Q	65.3	Low	78.3	Confident	33 Å²	33	73.7 Å²	73.7	15%	0.154	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-60.7	-28.7	-174	-66.6	175.9	-50.1	0	0	112.3	R180 F240 H244 M245	R180-Q242 HydrophobicContact CG-CB 4.5Å; R180-Q242 VanDerWaalsContact CG-OE1 3.29Å; F240-Q242 PolarHBondContact O-N 3.02Å; Q242-H244 PolarHBondContact O-N 2.68Å; Q242-H244 VanDerWaalsContact O-N 3.08Å; Q242-M245 WeakPolarHBondContact O-CB 3.47Å; Q242-M245 PolarHBondContact O-N 3.02Å
243	D	66	Low	78.5	Confident	89 Å²	89	71.5 Å²	71.5	48%	0.476	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-64.6	-8.4	176.8	-49.5	-76.4	0	0	0	114.5	H241 W246	H241-D243 IonicContact CE1-OD2 3.69Å; H241-D243 PolarHBondContact CE1-OD2 2.79Å; H241-D243 IonicContact CG-OD2 3.87Å; H241-D243 IonicContact ND1-OD2 2.73Å; H241-D243 PolarHBondContact ND1-OD2 2.93Å; H241-D243 PolarHBondContact O-N 3.41Å; H241-D243 VanDerWaalsContact O-N 3.14Å; D243-W246 PolarHBondContact O-NE1 2.87Å
244	H	76.4	Confident	78.8	Confident	101 Å²	101	71.8 Å²	71.8	47%	0.468	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-103.1	-3	174	-59.7	-49.9	0	0	0	113.7	F240 H241 Q242 W246 M247	F240-H244 HydrophobicContact CD1-CB 4.47Å; F240-H244 HydrophobicContact CE1-CB 3.52Å; F240-H244 HydrophobicContact CZ-CB 3.64Å; H241-H244 PolarHBondContact O-N 3.4Å; Q242-H244 PolarHBondContact O-N 2.68Å; Q242-H244 VanDerWaalsContact O-N 3.08Å; H244-W246 VanDerWaalsContact C-N 3.25Å; H244-W246 PolarHBondContact O-N 3.09Å; H244-M247 WeakPolarHBondContact O-CB 3.41Å; H244-M247 PolarHBondContact O-N 3.42Å; H244-M247 VanDerWaalsContact O-N 3.08Å
245	M	76.6	Confident	79.1	Confident	11 Å²	11	70.8 Å²	70.8	5%	0.054	35%	0.351	C	S	.	.	H	α-helix	trans	-60.2	-30.6	-179.3	-79.6	-79.4	106.8	0	0	113.8	F183 L190 F240 Q242 M247 V248 C249	F183-M245 HydrophobicContact CB-CB 4.4Å; F183-M245 HydrophobicContact CD1-CB 3.8Å; F183-M245 HydrophobicContact CD2-CB 4.3Å; F183-M245 HydrophobicContact CE1-CB 4.11Å; F183-M245 HydrophobicContact CG-CB 3.92Å; F183-M245 HydrophobicContact CZ-CB 4.49Å; L190-M245 HydrophobicContact CD2-SD 4.03Å; F240-M245 HydrophobicContact CD1-CE 3.46Å; F240-M245 VanDerWaalsContact CD1-CE 3.46Å; F240-M245 HydrophobicContact CE1-CE 3.54Å; F240-M245 HydrophobicContact CG-CE 4.48Å; Q242-M245 WeakPolarHBondContact O-CB 3.47Å; Q242-M245 PolarHBondContact O-N 3.02Å; M245-M247 VanDerWaalsContact C-N 3.31Å; M245-M247 PolarHBondContact O-N 3.07Å; M245-V248 HydrophobicContact CE-CG2 4.19Å; M245-V248 PolarHBondContact O-N 3.35Å; M245-C249 PolarHBondContact O-N 3.48Å; M245-C249 PolarHBondContact O-SG 2.7Å
246	W	82.3	Confident	79.7	Confident	124 Å²	124	70.9 Å²	70.9	47%	0.47	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-34.5	175.9	65	-83.3	0	0	0	112.6	F183 D243 H244 V248 C249 Y250	F183-W246 HydrophobicContact CZ-CB 3.99Å; D243-W246 PolarHBondContact O-NE1 2.87Å; H244-W246 VanDerWaalsContact C-N 3.25Å; H244-W246 PolarHBondContact O-N 3.09Å; W246-V248 VanDerWaalsContact C-N 3.32Å; W246-V248 PolarHBondContact O-N 2.68Å; W246-C249 WeakPolarHBondContact O-CB 3.39Å; W246-C249 PolarHBondContact O-N 2.98Å; W246-Y250 AromaticContact CE3-CD2 3.82Å; W246-Y250 HydrophobicContact CE3-CD2 3.82Å; W246-Y250 AromaticContact CE3-CE2 3.86Å; W246-Y250 HydrophobicContact CE3-CE2 3.86Å; W246-Y250 HydrophobicContact CZ3-CD2 4.45Å; W246-Y250 WeakPolarHBondContact O-CD2 3.24Å; W246-Y250 PolarHBondContact O-N 3.44Å; W246-Y250 VanDerWaalsContact O-N 3.11Å
247	M	86.8	Confident	80.5	Confident	106 Å²	106	68.6 Å²	68.6	52%	0.522	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-40.5	175.8	-69.4	-69	-71.3	0	0	111.3	H244 M245 C249 Y250 A251	H244-M247 WeakPolarHBondContact O-CB 3.41Å; H244-M247 PolarHBondContact O-N 3.42Å; H244-M247 VanDerWaalsContact O-N 3.08Å; M245-M247 VanDerWaalsContact C-N 3.31Å; M245-M247 PolarHBondContact O-N 3.07Å; M247-C249 VanDerWaalsContact C-N 3.32Å; M247-C249 PolarHBondContact O-N 2.87Å; M247-Y250 PolarHBondContact O-N 2.91Å; M247-A251 WeakPolarHBondContact O-CB 3.43Å; M247-A251 PolarHBondContact O-N 2.83Å
248	V	85.9	Confident	81	Confident	8 Å²	8	63.1 Å²	63.1	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-61.7	-42.4	175.1	179.5	0	0	0	0	110.7	L231 F240 M245 W246 Y250 A251 V252	L231-V248 HydrophobicContact CD2-CG1 4.32Å; F240-V248 HydrophobicContact CE1-CG2 4.37Å; F240-V248 HydrophobicContact CZ-CG2 4.29Å; M245-V248 HydrophobicContact CE-CG2 4.19Å; M245-V248 PolarHBondContact O-N 3.35Å; W246-V248 VanDerWaalsContact C-N 3.32Å; W246-V248 PolarHBondContact O-N 2.68Å; V248-Y250 PolarHBondContact O-N 3.47Å; V248-A251 PolarHBondContact O-N 3.36Å; V248-V252 HydrophobicContact CG1-CG2 4.49Å; V248-V252 WeakPolarHBondContact O-CG2 3.4Å; V248-V252 PolarHBondContact O-N 2.84Å
249	C	87.5	Confident	82.3	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-42.1	179.4	-59.9	0	0	0	0	112.5	M245 W246 M247 V252 I253 L290 V292	M245-C249 PolarHBondContact O-N 3.48Å; M245-C249 PolarHBondContact O-SG 2.7Å; W246-C249 WeakPolarHBondContact O-CB 3.39Å; W246-C249 PolarHBondContact O-N 2.98Å; M247-C249 VanDerWaalsContact C-N 3.32Å; M247-C249 PolarHBondContact O-N 2.87Å; C249-V252 PolarHBondContact O-N 2.73Å; C249-I253 WeakPolarHBondContact O-CG1 3.38Å; C249-I253 PolarHBondContact O-N 3.14Å; C249-I253 VanDerWaalsContact O-N 3.09Å; C249-L290 HydrophobicContact CB-CD1 4.18Å; C249-L290 HydrophobicContact CB-CD2 4.38Å; C249-L290 HydrophobicContact CB-CG 4.23Å; C249-V292 HydrophobicContact CB-CG1 3.84Å
250	Y	90.8	Very high	83.9	Confident	110 Å²	110	51.7 Å²	51.7	43%	0.431	25%	0.253	S	S	.	.	H	α-helix	trans	-71.7	-31.5	175	-70.4	-68.5	0	0	0	113.2	W246 M247 V248 I253 L254 A296	W246-Y250 AromaticContact CE3-CD2 3.82Å; W246-Y250 HydrophobicContact CE3-CD2 3.82Å; W246-Y250 AromaticContact CE3-CE2 3.86Å; W246-Y250 HydrophobicContact CE3-CE2 3.86Å; W246-Y250 HydrophobicContact CZ3-CD2 4.45Å; W246-Y250 WeakPolarHBondContact O-CD2 3.24Å; W246-Y250 PolarHBondContact O-N 3.44Å; W246-Y250 VanDerWaalsContact O-N 3.11Å; M247-Y250 PolarHBondContact O-N 2.91Å; V248-Y250 PolarHBondContact O-N 3.47Å; Y250-I253 HydrophobicContact CD1-CD1 4.14Å; Y250-I253 HydrophobicContact CE1-CD1 4.49Å; Y250-I253 PolarHBondContact O-N 3.13Å; Y250-L254 WeakPolarHBondContact O-CB 3.28Å; Y250-L254 PolarHBondContact O-N 3.45Å; Y250-A296 HydrophobicContact CE1-CB 4.27Å
251	A	90.8	Very high	85	Confident	41 Å²	41	50.6 Å²	50.6	34%	0.339	25%	0.252	S	S	.	.	H	α-helix	trans	-64.3	-39.5	172.4	0	0	0	0	0	112	M247 V248 L254 L255	M247-A251 WeakPolarHBondContact O-CB 3.43Å; M247-A251 PolarHBondContact O-N 2.83Å; V248-A251 PolarHBondContact O-N 3.36Å; A251-L254 PolarHBondContact O-N 2.92Å; A251-L255 WeakPolarHBondContact O-CB 3.38Å; A251-L255 PolarHBondContact O-N 2.9Å
252	V	90.5	Very high	86.2	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-43.7	173.4	172.5	0	0	0	0	111.2	M194 L197 L231 V248 C249 L254 L255 V256 L290	M194-V252 HydrophobicContact CE-CG1 4.2Å; M194-V252 HydrophobicContact CE-CG2 3.68Å; M194-V252 HydrophobicContact SD-CG2 3.9Å; L197-V252 HydrophobicContact CD1-CG1 3.95Å; L231-V252 HydrophobicContact CD1-CG2 4Å; V248-V252 HydrophobicContact CG1-CG2 4.49Å; V248-V252 WeakPolarHBondContact O-CG2 3.4Å; V248-V252 PolarHBondContact O-N 2.84Å; C249-V252 PolarHBondContact O-N 2.73Å; V252-L254 PolarHBondContact O-N 3.48Å; V252-L255 PolarHBondContact O-N 3.01Å; V252-V256 WeakPolarHBondContact O-CG2 3.36Å; V252-V256 PolarHBondContact O-N 2.92Å; V252-L290 HydrophobicContact CB-CD1 4.37Å; V252-L290 HydrophobicContact CG1-CD1 4.18Å
253	I	92.7	Very high	87	Confident	10 Å²	10	45.4 Å²	45.4	5%	0.051	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-47	174	-73.7	167.5	0	0	0	111.1	C249 Y250 L255 V256 I257 L290 V292 T300	C249-I253 WeakPolarHBondContact O-CG1 3.38Å; C249-I253 PolarHBondContact O-N 3.14Å; C249-I253 VanDerWaalsContact O-N 3.09Å; Y250-I253 HydrophobicContact CD1-CD1 4.14Å; Y250-I253 HydrophobicContact CE1-CD1 4.49Å; Y250-I253 PolarHBondContact O-N 3.13Å; I253-L255 PolarHBondContact O-N 2.8Å; I253-V256 PolarHBondContact O-N 3.12Å; I253-I257 HydrophobicContact CG2-CD1 3.7Å; I253-I257 HydrophobicContact CG2-CG1 4.43Å; I253-I257 WeakPolarHBondContact O-CG1 3.32Å; I253-I257 PolarHBondContact O-N 3.26Å; I253-L290 HydrophobicContact CD1-CD2 3.64Å; I253-L290 HydrophobicContact CG1-CD2 3.57Å; I253-V292 HydrophobicContact CD1-CG1 4.29Å; I253-T300 HydrophobicContact CG1-CG2 4.4Å; I253-T300 HydrophobicContact CG2-CG2 3.59Å
254	L	93.2	Very high	88	Confident	113 Å²	113	41.3 Å²	41.3	59%	0.592	21%	0.207	S	C	*	.	H	α-helix	trans	-61.6	-44	179.3	-178.8	62.3	0	0	0	111.7	Y250 A251 V252 V256 I257 V258	Y250-L254 WeakPolarHBondContact O-CB 3.28Å; Y250-L254 PolarHBondContact O-N 3.45Å; A251-L254 PolarHBondContact O-N 2.92Å; V252-L254 PolarHBondContact O-N 3.48Å; L254-V256 PolarHBondContact O-N 3.39Å; L254-I257 PolarHBondContact O-N 3.33Å; L254-V258 HydrophobicContact CD1-CG2 4.49Å; L254-V258 WeakPolarHBondContact O-CG2 3.35Å; L254-V258 PolarHBondContact O-N 3.12Å
255	L	92.3	Very high	88.4	Confident	27 Å²	27	40.6 Å²	40.6	14%	0.141	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-45.4	176.4	-179	60.3	0	0	0	111.6	A224 L227 T228 A251 V252 I253 V258 I259	A224-L255 HydrophobicContact CB-CD1 4.25Å; L227-L255 HydrophobicContact CB-CD2 4.36Å; L227-L255 HydrophobicContact CD1-CD1 4.26Å; T228-L255 WeakPolarHBondContact OG1-CD2 3.5Å; A251-L255 WeakPolarHBondContact O-CB 3.38Å; A251-L255 PolarHBondContact O-N 2.9Å; V252-L255 PolarHBondContact O-N 3.01Å; I253-L255 PolarHBondContact O-N 2.8Å; L255-V258 PolarHBondContact O-N 3.02Å; L255-I259 HydrophobicContact CD1-CD1 3.87Å; L255-I259 HydrophobicContact CD1-CG1 4.36Å; L255-I259 HydrophobicContact CG-CD1 3.84Å; L255-I259 WeakPolarHBondContact O-CD1 3.35Å; L255-I259 VanDerWaalsContact O-CG1 3.26Å; L255-I259 WeakPolarHBondContact O-CG1 3.38Å; L255-I259 PolarHBondContact O-N 3.08Å
256	V	91.6	Very high	88.5	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-41.8	176.8	168.7	0	0	0	0	111.9	L197 V252 I253 L254 I259 Q260 F282 I286 L304	L197-V256 HydrophobicContact CD2-CG2 4.47Å; V252-V256 WeakPolarHBondContact O-CG2 3.36Å; V252-V256 PolarHBondContact O-N 2.92Å; I253-V256 PolarHBondContact O-N 3.12Å; L254-V256 PolarHBondContact O-N 3.39Å; V256-I259 PolarHBondContact O-N 3.18Å; V256-Q260 VanDerWaalsContact O-CB 3.31Å; V256-Q260 WeakPolarHBondContact O-CB 3.28Å; V256-Q260 PolarHBondContact O-N 3.34Å; V256-F282 HydrophobicContact CG1-CB 3.68Å; V256-F282 HydrophobicContact CG1-CD1 3.82Å; V256-F282 HydrophobicContact CG1-CD2 3.88Å; V256-F282 HydrophobicContact CG1-CE1 4.45Å; V256-F282 HydrophobicContact CG1-CE2 4.49Å; V256-F282 HydrophobicContact CG1-CG 3.53Å; V256-F282 HydrophobicContact CG2-CD1 4.4Å; V256-I286 HydrophobicContact CG1-CD1 4.15Å; V256-L304 HydrophobicContact CG1-CD1 4.39Å; V256-L304 HydrophobicContact CG1-CD2 4.42Å
257	I	92.6	Very high	88.3	Confident	37 Å²	37	38.7 Å²	38.7	19%	0.19	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-42.4	175.9	-68.5	166.7	0	0	0	111.3	I253 L254 Q260 V261 T300 L304 I307	I253-I257 HydrophobicContact CG2-CD1 3.7Å; I253-I257 HydrophobicContact CG2-CG1 4.43Å; I253-I257 WeakPolarHBondContact O-CG1 3.32Å; I253-I257 PolarHBondContact O-N 3.26Å; L254-I257 PolarHBondContact O-N 3.33Å; I257-Q260 WeakPolarHBondContact O-CB 3.45Å; I257-Q260 PolarHBondContact O-N 2.8Å; I257-V261 HydrophobicContact CG2-CG2 4.48Å; I257-V261 WeakPolarHBondContact O-CG2 3.35Å; I257-V261 PolarHBondContact O-N 2.93Å; I257-T300 HydrophobicContact CD1-CG2 4.36Å; I257-L304 HydrophobicContact CG1-CD2 3.86Å; I257-L304 HydrophobicContact CG1-CG 4.48Å; I257-I307 HydrophobicContact CG2-CD1 4.02Å
258	V	91.2	Very high	87.5	Confident	67 Å²	67	39.9 Å²	39.9	41%	0.406	21%	0.211	S	C	.	.	H	α-helix	trans	-63.5	-44	177.9	169.1	0	0	0	0	111.2	L254 L255 V261 I262	L254-V258 HydrophobicContact CD1-CG2 4.49Å; L254-V258 WeakPolarHBondContact O-CG2 3.35Å; L254-V258 PolarHBondContact O-N 3.12Å; L255-V258 PolarHBondContact O-N 3.02Å; V258-V261 PolarHBondContact O-N 2.92Å; V258-I262 HydrophobicContact CG1-CD1 3.73Å; V258-I262 WeakPolarHBondContact O-CG1 3.24Å; V258-I262 PolarHBondContact O-N 3.17Å
259	I	89.8	Confident	86.9	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-65.9	-39	177.1	-66.2	164.5	0	0	0	111.1	F201 F221 A224 L255 V256 G263 F282	F201-I259 HydrophobicContact CD1-CD1 4.17Å; F201-I259 HydrophobicContact CD1-CG2 4.49Å; F201-I259 HydrophobicContact CD2-CD1 4.44Å; F201-I259 HydrophobicContact CE1-CD1 3.52Å; F201-I259 HydrophobicContact CE1-CG2 4.12Å; F201-I259 HydrophobicContact CE2-CD1 3.84Å; F201-I259 HydrophobicContact CZ-CD1 3.34Å; F221-I259 HydrophobicContact CE1-CG2 3.82Å; A224-I259 HydrophobicContact CB-CD1 3.49Å; A224-I259 VanDerWaalsContact CB-CD1 3.49Å; A224-I259 HydrophobicContact CB-CG1 4.18Å; L255-I259 HydrophobicContact CD1-CD1 3.87Å; L255-I259 HydrophobicContact CD1-CG1 4.36Å; L255-I259 HydrophobicContact CG-CD1 3.84Å; L255-I259 WeakPolarHBondContact O-CD1 3.35Å; L255-I259 VanDerWaalsContact O-CG1 3.26Å; L255-I259 WeakPolarHBondContact O-CG1 3.38Å; L255-I259 PolarHBondContact O-N 3.08Å; V256-I259 PolarHBondContact O-N 3.18Å; I259-G263 WeakPolarHBondContact O-CA 3.18Å; I259-G263 PolarHBondContact O-N 3.07Å; I259-F282 HydrophobicContact CG2-CZ 4.35Å
260	Q	90.1	Very high	86.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-49	173.8	179.8	69.1	14.4	0	0	111.7	V256 I257 G263 V264 T279 L304 I307	V256-Q260 VanDerWaalsContact O-CB 3.31Å; V256-Q260 WeakPolarHBondContact O-CB 3.28Å; V256-Q260 PolarHBondContact O-N 3.34Å; I257-Q260 WeakPolarHBondContact O-CB 3.45Å; I257-Q260 PolarHBondContact O-N 2.8Å; Q260-G263 PolarHBondContact O-N 3.22Å; Q260-V264 WeakPolarHBondContact O-CG2 3.34Å; Q260-V264 PolarHBondContact O-N 3.36Å; Q260-V264 VanDerWaalsContact O-N 3.09Å; Q260-T279 PolarHBondContact NE2-OG1 3.12Å; Q260-L304 HydrophobicContact CB-CD2 3.84Å; Q260-L304 HydrophobicContact CG-CD2 3.79Å; Q260-I307 HydrophobicContact CG-CG2 4.27Å
261	V	90.4	Very high	85.9	Confident	48 Å²	48	38.9 Å²	38.9	29%	0.291	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-50.6	-178.9	169.1	0	0	0	0	111.1	I257 V258 G263 L265 I307	I257-V261 HydrophobicContact CG2-CG2 4.48Å; I257-V261 WeakPolarHBondContact O-CG2 3.35Å; I257-V261 PolarHBondContact O-N 2.93Å; V258-V261 PolarHBondContact O-N 2.92Å; V261-G263 VanDerWaalsContact C-N 3.34Å; V261-G263 PolarHBondContact O-N 3.41Å; V261-L265 HydrophobicContact CG1-CD1 3.65Å; V261-L265 HydrophobicContact CG1-CG 4.46Å; V261-L265 VanDerWaalsContact O-CB 3.31Å; V261-L265 WeakPolarHBondContact O-CB 3.48Å; V261-L265 VanDerWaalsContact O-CG 3.26Å; V261-L265 WeakPolarHBondContact O-CG 3.23Å; V261-L265 PolarHBondContact O-N 2.81Å; V261-I307 HydrophobicContact CG2-CD1 4.13Å; V261-I307 HydrophobicContact CG2-CG2 3.69Å
262	I	87	Confident	85.6	Confident	45 Å²	45	36.9 Å²	36.9	23%	0.231	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-40.9	179.5	-63.2	169.5	0	0	0	110.6	V220 V258 V264 L265 L266	V220-I262 HydrophobicContact CG1-CD1 3.89Å; V220-I262 HydrophobicContact CG1-CG2 4.21Å; V220-I262 HydrophobicContact CG2-CD1 4.03Å; V220-I262 HydrophobicContact CG2-CG2 4.33Å; V258-I262 HydrophobicContact CG1-CD1 3.73Å; V258-I262 WeakPolarHBondContact O-CG1 3.24Å; V258-I262 PolarHBondContact O-N 3.17Å; I262-V264 PolarHBondContact O-N 3.14Å; I262-L265 PolarHBondContact O-N 3.45Å; I262-L266 HydrophobicContact CG2-CD1 3.76Å; I262-L266 HydrophobicContact CG2-CG 4.49Å; I262-L266 PolarHBondContact O-N 2.85Å
263	G	83.4	Confident	85.3	Confident	2 Å²	2	36.9 Å²	36.9	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-39.1	-178.2	0	0	0	0	0	113.8	Y217 I259 Q260 V261 V267	Y217-G263 PolarHBondContact OH-O 2.86Å; I259-G263 WeakPolarHBondContact O-CA 3.18Å; I259-G263 PolarHBondContact O-N 3.07Å; Q260-G263 PolarHBondContact O-N 3.22Å; V261-G263 VanDerWaalsContact C-N 3.34Å; V261-G263 PolarHBondContact O-N 3.41Å; G263-V267 VanDerWaalsContact O-CG2 3.26Å; G263-V267 WeakPolarHBondContact O-CG2 3.21Å
264	V	86.1	Confident	84.9	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-86.8	-30.6	178.6	-175.9	0	0	0	0	112.3	Q260 I262 L266 V267 W278 I311	Q260-V264 WeakPolarHBondContact O-CG2 3.34Å; Q260-V264 PolarHBondContact O-N 3.36Å; Q260-V264 VanDerWaalsContact O-N 3.09Å; I262-V264 PolarHBondContact O-N 3.14Å; V264-L266 PolarHBondContact O-N 3.12Å; V264-V267 WeakPolarHBondContact O-CG2 3.4Å; V264-W278 HydrophobicContact CG2-CZ2 4.33Å; V264-I311 HydrophobicContact CB-CD1 4.4Å; V264-I311 HydrophobicContact CB-CG2 4.4Å; V264-I311 HydrophobicContact CG1-CB 3.94Å; V264-I311 HydrophobicContact CG1-CG2 3.71Å
265	L	85.7	Confident	84.6	Confident	87 Å²	87	32.2 Å²	32.2	46%	0.455	17%	0.168	S	C	.	.	H	α-helix	trans	-68.8	-28.1	178.8	-81.7	172.2	0	0	0	114.6	V261 I262 I311	V261-L265 HydrophobicContact CG1-CD1 3.65Å; V261-L265 HydrophobicContact CG1-CG 4.46Å; V261-L265 VanDerWaalsContact O-CB 3.31Å; V261-L265 WeakPolarHBondContact O-CB 3.48Å; V261-L265 VanDerWaalsContact O-CG 3.26Å; V261-L265 WeakPolarHBondContact O-CG 3.23Å; V261-L265 PolarHBondContact O-N 2.81Å; I262-L265 PolarHBondContact O-N 3.45Å; L265-I311 HydrophobicContact CD2-CD1 4.43Å; L265-I311 HydrophobicContact CD2-CG1 4.36Å; L265-I311 HydrophobicContact CD2-CG2 3.81Å; L265-I311 HydrophobicContact CG-CD1 4.16Å; L265-I311 HydrophobicContact CG-CG2 4.27Å
266	L	78.6	Confident	84.5	Confident	67 Å²	67	31 Å²	31	35%	0.351	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	13.2	-172.5	-62.2	179.2	0	0	0	113.6	Y217 I262 V264 Q268	Y217-L266 HydrophobicContact CD2-CB 4.18Å; Y217-L266 HydrophobicContact CD2-CD1 4.34Å; Y217-L266 HydrophobicContact CE1-CB 4.42Å; Y217-L266 HydrophobicContact CE2-CB 3.35Å; Y217-L266 HydrophobicContact CE2-CD1 4.27Å; Y217-L266 HydrophobicContact CE2-CG 4.47Å; Y217-L266 WeakPolarHBondContact CE2-O 3.44Å; Y217-L266 VanDerWaalsContact OH-C 3.23Å; Y217-L266 WeakPolarHBondContact OH-CB 3.34Å; Y217-L266 PolarHBondContact OH-O 3.22Å; I262-L266 HydrophobicContact CG2-CD1 3.76Å; I262-L266 HydrophobicContact CG2-CG 4.49Å; I262-L266 PolarHBondContact O-N 2.85Å; V264-L266 PolarHBondContact O-N 3.12Å; L266-Q268 PolarHBondContact O-N 3.45Å
267	V	76.6	Confident	84.4	Confident	27 Å²	27	32.1 Å²	32.1	16%	0.164	17%	0.166	C	C	.	.			trans	-61.2	126	-178.1	172.1	0	0	0	0	111.8	Y217 G263 V264 P269 E274	Y217-V267 PolarHBondContact OH-N 2.81Å; G263-V267 VanDerWaalsContact O-CG2 3.26Å; G263-V267 WeakPolarHBondContact O-CG2 3.21Å; V264-V267 WeakPolarHBondContact O-CG2 3.4Å; V267-P269 WeakPolarHBondContact CG1-O 3.34Å; V267-E274 HydrophobicContact CG1-CB 3.68Å; V267-E274 HydrophobicContact CG1-CG 4.06Å
268	Q	70	Confident	84.2	Confident	132 Å²	132	31.1 Å²	31.1	62%	0.617	16%	0.16	S	C	*	.	S	Bend	trans	-138	130.2	173.6	-62.9	-176.8	-58	0	0	109	L266	L266-Q268 PolarHBondContact O-N 3.45Å
269	P	73	Confident	84.3	Confident	12 Å²	12	27.9 Å²	27.9	8%	0.078	14%	0.14	C	C	.	.	S	Bend	cis	-64.3	157.9	-8	32.2	-39.9	0	0	0	112.7	V267 S271 V902 M903 A906 K924	V267-P269 WeakPolarHBondContact CG1-O 3.34Å; P269-S271 PolarHBondContact O-N 3.17Å; P269-V902 HydrophobicContact CG-CG1 4.12Å; P269-M903 HydrophobicContact CB-SD 4.02Å; P269-M903 HydrophobicContact CG-SD 3.62Å; P269-A906 HydrophobicContact CB-CB 3.56Å; P269-K924 HydrophobicContact CG-CD 4.2Å
270	R	76.9	Confident	84.4	Confident	69 Å²	69	27.9 Å²	27.9	26%	0.26	14%	0.141	S	C	.	.			trans	-65.9	127.6	177.4	72.4	-170.4	-170.8	75.7	14.3	111.3	D319 N905	R270-D319 IonicContact CZ-OD1 3.34Å; R270-D319 IonicContact CZ-OD2 3.5Å; R270-D319 IonicContact NH1-OD1 3.87Å; R270-D319 PolarHBondContact NH1-OD1 3.11Å; R270-D319 IonicContact NH1-OD2 3.74Å; R270-D319 PolarHBondContact NH1-OD2 3.33Å; R270-D319 IonicContact NH2-OD1 3.45Å; R270-D319 PolarHBondContact NH2-OD1 3.41Å; R270-D319 IonicContact NH2-OD2 2.76Å; R270-N905 PolarHBondContact NH2-ND2 2.94Å; R270-N905 PolarHBondContact NH2-O 2.83Å
271	S	82	Confident	84.5	Confident	15 Å²	15	28 Å²	28	11%	0.105	14%	0.141	C	C	.	.			trans	-155.9	152.4	166.8	179.3	0	0	0	0	109.3	P269 S273 N316	P269-S271 PolarHBondContact O-N 3.17Å; S271-S273 VanDerWaalsContact C-N 3.33Å; S271-S273 PolarHBondContact OG-N 3.47Å; S271-S273 PolarHBondContact OG-OG 3.23Å; S271-N316 WeakPolarHBondContact CA-OD1 3.38Å; S271-N316 PolarHBondContact N-OD1 3.22Å; S271-N316 PolarHBondContact O-ND2 2.82Å
272	A	84.7	Confident	84.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	-82.6	-8	173.8	0	0	0	0	0	113.7	N316 L322 Q325 N329	A272-N316 HydrophobicContact CB-CB 4.46Å; A272-N316 PolarHBondContact N-ND2 3.43Å; A272-L322 HydrophobicContact CB-CD1 3.58Å; A272-Q325 HydrophobicContact CB-CB 4.13Å; A272-N329 PolarHBondContact O-ND2 3.03Å
273	S	83.6	Confident	85	Confident	7 Å²	7	23.5 Å²	23.5	5%	0.049	12%	0.116	C	C	.	.	S	Bend	trans	-90	-19.7	177.3	53.8	0	0	0	0	114.3	S271 G275 I276 E848	S271-S273 VanDerWaalsContact C-N 3.33Å; S271-S273 PolarHBondContact OG-N 3.47Å; S271-S273 PolarHBondContact OG-OG 3.23Å; S273-G275 PolarHBondContact O-N 3.36Å; S273-I276 VanDerWaalsContact O-CD1 3.3Å; S273-I276 WeakPolarHBondContact O-CD1 3.42Å; S273-I276 VanDerWaalsContact O-CG1 3.25Å; S273-I276 WeakPolarHBondContact O-CG1 3.42Å; S273-I276 PolarHBondContact O-N 3Å; S273-E848 WeakPolarHBondContact CB-OE2 3.42Å; S273-E848 PolarHBondContact OG-OE2 3.25Å
274	E	83.9	Confident	85.3	Confident	23 Å²	23	23.7 Å²	23.7	11%	0.107	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	133.1	-178	-73.6	-64.5	168	0	0	111.3	V267 H308 K924	V267-E274 HydrophobicContact CG1-CB 3.68Å; V267-E274 HydrophobicContact CG1-CG 4.06Å; E274-H308 PolarHBondContact O-CE1 2.77Å; E274-K924 WeakPolarHBondContact OE1-CE 3.47Å; E274-K924 IonicContact OE1-NZ 2.72Å; E274-K924 PolarHBondContact OE1-NZ 2.94Å
275	G	86.7	Confident	85.5	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.01	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	3.5	179.8	0	0	0	0	0	117.3	S273 W277 W278 T279	S273-G275 PolarHBondContact O-N 3.36Å; G275-W277 VanDerWaalsContact C-N 3.26Å; G275-W277 PolarHBondContact O-N 3.03Å; G275-W278 VanDerWaalsContact CA-CH2 3.43Å; G275-T279 WeakPolarHBondContact O-CB 3.41Å; G275-T279 PolarHBondContact O-N 2.91Å; G275-T279 PolarHBondContact O-OG1 3.5Å
276	I	90.6	Very high	85.8	Confident	3 Å²	3	19.7 Å²	19.7	2%	0.015	10%	0.095	C	C	.	.	H	α-helix	trans	-53.1	-46.4	171.3	-65.9	164.5	0	0	0	110.5	S273 W278 T279 V280 N329 V332 F333 Y849	S273-I276 VanDerWaalsContact O-CD1 3.3Å; S273-I276 WeakPolarHBondContact O-CD1 3.42Å; S273-I276 VanDerWaalsContact O-CG1 3.25Å; S273-I276 WeakPolarHBondContact O-CG1 3.42Å; S273-I276 PolarHBondContact O-N 3Å; I276-W278 PolarHBondContact O-N 2.97Å; I276-T279 WeakPolarHBondContact O-CB 3.17Å; I276-T279 PolarHBondContact O-N 3.15Å; I276-V280 HydrophobicContact CG2-CG2 4.07Å; I276-V280 WeakPolarHBondContact O-CG2 3.38Å; I276-V280 PolarHBondContact O-N 3.5Å; I276-N329 VanDerWaalsContact CD1-OD1 3.24Å; I276-N329 WeakPolarHBondContact CD1-OD1 3.45Å; I276-V332 HydrophobicContact CG2-CG1 3.81Å; I276-F333 HydrophobicContact CG1-CZ 4.44Å; I276-F333 HydrophobicContact CG2-CE1 4.1Å; I276-Y849 HydrophobicContact CD1-CD1 4.47Å; I276-Y849 HydrophobicContact CD1-CE1 3.67Å
277	W	89.1	Confident	86.3	Confident	25 Å²	25	16.7 Å²	16.7	10%	0.095	8%	0.079	C	C	.	.	H	α-helix	trans	-63.7	-44.5	-171.9	72.9	-98.7	0	0	0	113.3	M204 G275 T279 V280 F281 L855 V934	M204-W277 HydrophobicContact CG-CH2 4.02Å; M204-W277 HydrophobicContact CG-CZ2 4.36Å; G275-W277 VanDerWaalsContact C-N 3.26Å; G275-W277 PolarHBondContact O-N 3.03Å; W277-T279 VanDerWaalsContact C-N 3.33Å; W277-V280 PolarHBondContact O-N 3.38Å; W277-F281 WeakPolarHBondContact O-CB 3.08Å; W277-F281 PolarHBondContact O-N 3.03Å; W277-L855 HydrophobicContact CB-CD1 4.13Å; W277-V934 HydrophobicContact CB-CG1 3.84Å; W277-V934 HydrophobicContact CD2-CB 4.42Å; W277-V934 HydrophobicContact CD2-CG1 3.75Å; W277-V934 HydrophobicContact CD2-CG2 3.7Å; W277-V934 HydrophobicContact CE3-CG1 3.82Å; W277-V934 HydrophobicContact CE3-CG2 4.04Å; W277-V934 HydrophobicContact CG-CG1 3.79Å; W277-V934 HydrophobicContact CG-CG2 4.17Å; W277-V934 HydrophobicContact CH2-CG2 4.26Å; W277-V934 HydrophobicContact CZ2-CG2 3.92Å; W277-V934 HydrophobicContact CZ3-CG2 4.31Å
278	W	89.6	Confident	86.8	Confident	16 Å²	16	16.6 Å²	16.6	6%	0.061	8%	0.079	C	C	.	.	H	α-helix	trans	-71.8	-31.3	177.6	67.7	68.5	0	0	0	111.5	M204 V264 G275 I276 F281 F282	M204-W278 HydrophobicContact CE-CB 4.19Å; M204-W278 HydrophobicContact CE-CD2 3.53Å; M204-W278 HydrophobicContact CE-CE3 3.57Å; M204-W278 HydrophobicContact CE-CG 3.84Å; M204-W278 HydrophobicContact CE-CZ3 4.13Å; V264-W278 HydrophobicContact CG2-CZ2 4.33Å; G275-W278 VanDerWaalsContact CA-CH2 3.43Å; I276-W278 PolarHBondContact O-N 2.97Å; W278-F281 PolarHBondContact O-N 3.06Å; W278-F282 HydrophobicContact CB-CE2 4.21Å; W278-F282 HydrophobicContact CB-CZ 4.49Å; W278-F282 AromaticContact CD1-CE2 3.73Å; W278-F282 HydrophobicContact CG-CE2 4.28Å; W278-F282 WeakPolarHBondContact O-CB 3.38Å; W278-F282 WeakPolarHBondContact O-CD2 3.24Å; W278-F282 WeakPolarHBondContact O-CG 3.43Å; W278-F282 PolarHBondContact O-N 3.1Å
279	T	92.2	Very high	87.5	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-63	-48.5	173.7	-50.3	0	0	0	0	110.9	Q260 G275 I276 W277 F281 F282 I283 H308 F333	Q260-T279 PolarHBondContact NE2-OG1 3.12Å; G275-T279 WeakPolarHBondContact O-CB 3.41Å; G275-T279 PolarHBondContact O-N 2.91Å; G275-T279 PolarHBondContact O-OG1 3.5Å; I276-T279 WeakPolarHBondContact O-CB 3.17Å; I276-T279 PolarHBondContact O-N 3.15Å; W277-T279 VanDerWaalsContact C-N 3.33Å; T279-F281 VanDerWaalsContact C-N 3.34Å; T279-F281 PolarHBondContact O-N 2.99Å; T279-F282 PolarHBondContact O-N 2.8Å; T279-I283 HydrophobicContact CG2-CD1 4.05Å; T279-I283 WeakPolarHBondContact O-CB 3.41Å; T279-I283 WeakPolarHBondContact O-CD1 3.4Å; T279-I283 VanDerWaalsContact O-CG1 3.24Å; T279-I283 WeakPolarHBondContact O-CG1 3.24Å; T279-I283 PolarHBondContact O-N 3.21Å; T279-H308 HydrophobicContact CG2-CB 4.18Å; T279-H308 PolarHBondContact OG1-ND1 2.93Å; T279-F333 HydrophobicContact CG2-CD1 4.05Å; T279-F333 HydrophobicContact CG2-CE1 3.52Å; T279-F333 HydrophobicContact CG2-CE2 4.42Å; T279-F333 HydrophobicContact CG2-CZ 3.74Å
280	V	93.1	Very high	88.2	Confident	4 Å²	4	10.4 Å²	10.4	2%	0.024	5%	0.049	C	C	.	.	H	α-helix	trans	-60.5	-43.1	174.9	169.9	0	0	0	0	111.2	I276 W277 I283 H284 V332 F333 L859 F938	I276-V280 HydrophobicContact CG2-CG2 4.07Å; I276-V280 WeakPolarHBondContact O-CG2 3.38Å; I276-V280 PolarHBondContact O-N 3.5Å; W277-V280 PolarHBondContact O-N 3.38Å; V280-I283 PolarHBondContact O-N 2.79Å; V280-H284 PolarHBondContact O-N 3.07Å; V280-V332 HydrophobicContact CG2-CG1 3.57Å; V280-F333 HydrophobicContact CG2-CD1 4.06Å; V280-F333 HydrophobicContact CG2-CE1 4.07Å; V280-L859 HydrophobicContact CG1-CD1 3.74Å; V280-F938 HydrophobicContact CG1-CE2 4.26Å; V280-F938 HydrophobicContact CG1-CZ 4.12Å
281	F	92.2	Very high	88.5	Confident	1 Å²	1	7.6 Å²	7.6	0%	0.004	4%	0.04	C	C	.	.	H	α-helix	trans	-60.5	-49.6	176.4	173.7	-93.9	0	0	0	112.5	V196 L197 V200 W277 W278 T279 I283 H284 V285 F938 A941	V196-F281 HydrophobicContact CG1-CE2 4.28Å; V196-F281 HydrophobicContact CG1-CZ 3.81Å; L197-F281 HydrophobicContact CD2-CE1 4.34Å; V200-F281 HydrophobicContact CB-CE1 4.37Å; V200-F281 HydrophobicContact CG1-CD1 4.46Å; V200-F281 HydrophobicContact CG1-CE1 4.3Å; V200-F281 HydrophobicContact CG2-CD1 4.43Å; V200-F281 HydrophobicContact CG2-CE1 3.78Å; V200-F281 HydrophobicContact CG2-CE2 4.29Å; V200-F281 HydrophobicContact CG2-CZ 3.71Å; W277-F281 WeakPolarHBondContact O-CB 3.08Å; W277-F281 PolarHBondContact O-N 3.03Å; W278-F281 PolarHBondContact O-N 3.06Å; T279-F281 VanDerWaalsContact C-N 3.34Å; T279-F281 PolarHBondContact O-N 2.99Å; F281-I283 PolarHBondContact O-N 2.96Å; F281-H284 PolarHBondContact O-N 3.29Å; F281-V285 HydrophobicContact CD1-CG2 4.28Å; F281-V285 HydrophobicContact CD2-CG2 4.42Å; F281-V285 HydrophobicContact CE1-CG2 3.72Å; F281-V285 HydrophobicContact CE2-CG2 3.89Å; F281-V285 HydrophobicContact CZ-CG2 3.49Å; F281-V285 VanDerWaalsContact CZ-CG2 3.49Å; F281-V285 WeakPolarHBondContact O-CB 3.4Å; F281-V285 WeakPolarHBondContact O-CG2 3.5Å; F281-V285 PolarHBondContact O-N 3.38Å; F281-F938 HydrophobicContact CB-CD2 4.38Å; F281-F938 HydrophobicContact CB-CE2 4.09Å; F281-F938 HydrophobicContact CD2-CD2 4.09Å; F281-F938 HydrophobicContact CD2-CE2 4.29Å; F281-A941 HydrophobicContact CE2-CB 3.73Å
282	F	93.1	Very high	88.7	Confident	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-62.5	-41.5	177.9	-66.4	-35.6	0	0	0	112.3	L197 F201 V256 I259 W278 T279 V285 I286 L304	L197-F282 HydrophobicContact CD2-CE1 4.34Å; F201-F282 AromaticContact CE1-CE1 3.95Å; F201-F282 HydrophobicContact CE1-CE1 3.95Å; F201-F282 AromaticContact CE1-CZ 3.94Å; F201-F282 HydrophobicContact CE1-CZ 3.94Å; V256-F282 HydrophobicContact CG1-CB 3.68Å; V256-F282 HydrophobicContact CG1-CD1 3.82Å; V256-F282 HydrophobicContact CG1-CD2 3.88Å; V256-F282 HydrophobicContact CG1-CE1 4.45Å; V256-F282 HydrophobicContact CG1-CE2 4.49Å; V256-F282 HydrophobicContact CG1-CG 3.53Å; V256-F282 HydrophobicContact CG2-CD1 4.4Å; I259-F282 HydrophobicContact CG2-CZ 4.35Å; W278-F282 HydrophobicContact CB-CE2 4.21Å; W278-F282 HydrophobicContact CB-CZ 4.49Å; W278-F282 AromaticContact CD1-CE2 3.73Å; W278-F282 HydrophobicContact CG-CE2 4.28Å; W278-F282 WeakPolarHBondContact O-CB 3.38Å; W278-F282 WeakPolarHBondContact O-CD2 3.24Å; W278-F282 WeakPolarHBondContact O-CG 3.43Å; W278-F282 PolarHBondContact O-N 3.1Å; T279-F282 PolarHBondContact O-N 2.8Å; F282-V285 PolarHBondContact O-N 3.38Å; F282-I286 WeakPolarHBondContact O-CD1 3.29Å; F282-I286 VanDerWaalsContact O-CG1 3.29Å; F282-I286 WeakPolarHBondContact O-CG1 3.44Å; F282-I286 PolarHBondContact O-N 3.37Å; F282-I286 VanDerWaalsContact O-N 3.1Å; F282-L304 HydrophobicContact CB-CD1 4.2Å
283	I	93.4	Very high	88.7	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-57	-53.6	173.5	-70.4	165.7	0	0	0	109.7	T279 V280 F281 V285 I286 Y287 L304 S305 F333	T279-I283 HydrophobicContact CG2-CD1 4.05Å; T279-I283 WeakPolarHBondContact O-CB 3.41Å; T279-I283 WeakPolarHBondContact O-CD1 3.4Å; T279-I283 VanDerWaalsContact O-CG1 3.24Å; T279-I283 WeakPolarHBondContact O-CG1 3.24Å; T279-I283 PolarHBondContact O-N 3.21Å; V280-I283 PolarHBondContact O-N 2.79Å; F281-I283 PolarHBondContact O-N 2.96Å; I283-V285 PolarHBondContact O-N 3.25Å; I283-I286 PolarHBondContact O-N 2.73Å; I283-Y287 HydrophobicContact CG2-CD2 3.98Å; I283-Y287 HydrophobicContact CG2-CE2 3.8Å; I283-Y287 VanDerWaalsContact O-CD2 3.22Å; I283-Y287 WeakPolarHBondContact O-CD2 3.48Å; I283-Y287 PolarHBondContact O-N 2.81Å; I283-L304 HydrophobicContact CG1-CB 4.27Å; I283-L304 HydrophobicContact CG1-CD1 4.31Å; I283-S305 WeakPolarHBondContact CD1-OG 3.49Å; I283-F333 HydrophobicContact CD1-CD1 4.2Å
284	H	90.6	Very high	88.8	Confident	5 Å²	5	11.9 Å²	11.9	2%	0.023	5%	0.054	C	C	.	.	H	α-helix	trans	-56.5	-51.7	179.3	180	81.9	0	0	0	112.1	V280 F281 I286 Y287 T288 L859	V280-H284 PolarHBondContact O-N 3.07Å; F281-H284 PolarHBondContact O-N 3.29Å; H284-I286 VanDerWaalsContact C-N 3.27Å; H284-I286 PolarHBondContact O-N 3.06Å; H284-Y287 PolarHBondContact O-N 3.43Å; H284-T288 PolarHBondContact CD2-OG1 3.32Å; H284-T288 VanDerWaalsContact CD2-OG1 3.26Å; H284-T288 WeakPolarHBondContact CE1-CG2 3.24Å; H284-T288 PolarHBondContact NE2-OG1 3.49Å; H284-T288 PolarHBondContact O-N 3.03Å; H284-T288 PolarHBondContact O-OG1 2.86Å; H284-L859 HydrophobicContact CB-CD2 4.04Å; H284-L859 WeakPolarHBondContact ND1-CD2 3.22Å
285	V	90	Very high	88.9	Confident	3 Å²	3	17.4 Å²	17.4	2%	0.018	7%	0.073	C	C	.	.	H	α-helix	trans	-51.7	-42.8	179.3	152.3	0	0	0	0	112.9	L193 F281 F282 I283 Y287 T288 L289 L290	L193-V285 HydrophobicContact CD1-CB 4.42Å; L193-V285 HydrophobicContact CD1-CG1 3.41Å; L193-V285 VanDerWaalsContact CD1-CG1 3.41Å; L193-V285 HydrophobicContact CD1-CG2 4.2Å; L193-V285 HydrophobicContact CD2-CG1 4.28Å; L193-V285 HydrophobicContact CG-CG1 4.48Å; F281-V285 HydrophobicContact CD1-CG2 4.28Å; F281-V285 HydrophobicContact CD2-CG2 4.42Å; F281-V285 HydrophobicContact CE1-CG2 3.72Å; F281-V285 HydrophobicContact CE2-CG2 3.89Å; F281-V285 HydrophobicContact CZ-CG2 3.49Å; F281-V285 VanDerWaalsContact CZ-CG2 3.49Å; F281-V285 WeakPolarHBondContact O-CB 3.4Å; F281-V285 WeakPolarHBondContact O-CG2 3.5Å; F281-V285 PolarHBondContact O-N 3.38Å; F282-V285 PolarHBondContact O-N 3.38Å; I283-V285 PolarHBondContact O-N 3.25Å; V285-Y287 VanDerWaalsContact C-N 3.33Å; V285-T288 PolarHBondContact O-N 2.78Å; V285-L289 HydrophobicContact CG2-CD1 4.48Å; V285-L289 PolarHBondContact O-N 3.3Å; V285-L290 PolarHBondContact O-N 3.34Å
286	I	91.1	Very high	89	Confident	4 Å²	4	18 Å²	18	2%	0.021	8%	0.079	C	C	.	.	H	α-helix	trans	-72.2	-28.5	-178.1	-70.7	164.3	0	0	0	111.8	V256 F282 I283 H284 A297 T300 L304	V256-I286 HydrophobicContact CG1-CD1 4.15Å; F282-I286 WeakPolarHBondContact O-CD1 3.29Å; F282-I286 VanDerWaalsContact O-CG1 3.29Å; F282-I286 WeakPolarHBondContact O-CG1 3.44Å; F282-I286 PolarHBondContact O-N 3.37Å; F282-I286 VanDerWaalsContact O-N 3.1Å; I283-I286 PolarHBondContact O-N 2.73Å; H284-I286 VanDerWaalsContact C-N 3.27Å; H284-I286 PolarHBondContact O-N 3.06Å; I286-A297 HydrophobicContact CG2-CB 4.27Å; I286-T300 HydrophobicContact CD1-CG2 3.76Å; I286-T300 HydrophobicContact CG2-CG2 4.19Å; I286-L304 HydrophobicContact CD1-CD1 3.61Å
287	Y	90.6	Very high	89	Confident	4 Å²	4	17.9 Å²	17.9	2%	0.016	8%	0.078	C	C	.	.	H	α-helix	trans	-81.4	-30.7	172	-77.2	-75	0	0	0	113.8	I283 H284 V285 A297 V298 N337 V341 H344	I283-Y287 HydrophobicContact CG2-CD2 3.98Å; I283-Y287 HydrophobicContact CG2-CE2 3.8Å; I283-Y287 VanDerWaalsContact O-CD2 3.22Å; I283-Y287 WeakPolarHBondContact O-CD2 3.48Å; I283-Y287 PolarHBondContact O-N 2.81Å; H284-Y287 PolarHBondContact O-N 3.43Å; V285-Y287 VanDerWaalsContact C-N 3.33Å; Y287-A297 HydrophobicContact CD1-CB 3.72Å; Y287-A297 HydrophobicContact CE1-CB 3.94Å; Y287-A297 HydrophobicContact CG-CB 4.37Å; Y287-V298 HydrophobicContact CE1-CG2 3.87Å; Y287-V298 WeakPolarHBondContact OH-CA 3.24Å; Y287-N337 HydrophobicContact CE2-CB 4.37Å; Y287-N337 WeakPolarHBondContact CE2-OD1 3.41Å; Y287-N337 PolarHBondContact OH-OD1 2.92Å; Y287-V341 HydrophobicContact CE1-CG2 3.72Å; Y287-H344 HydrophobicContact CD1-CB 4.34Å; Y287-H344 PolarHBondContact O-CD2 3.07Å
288	T	87.2	Confident	89.2	Confident	25 Å²	25	17.8 Å²	17.8	15%	0.153	8%	0.08	C	C	.	.	H	α-helix	trans	-111.5	-32.1	-166.7	60.6	0	0	0	0	116.2	H284 V285 T343	H284-T288 PolarHBondContact CD2-OG1 3.32Å; H284-T288 VanDerWaalsContact CD2-OG1 3.26Å; H284-T288 WeakPolarHBondContact CE1-CG2 3.24Å; H284-T288 PolarHBondContact NE2-OG1 3.49Å; H284-T288 PolarHBondContact O-N 3.03Å; H284-T288 PolarHBondContact O-OG1 2.86Å; V285-T288 PolarHBondContact O-N 2.78Å; T288-T343 HydrophobicContact CG2-CG2 3.79Å
289	L	84.1	Confident	89.3	Confident	7 Å²	7	22 Å²	22	4%	0.037	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-19.5	-173.7	-65.5	-179.5	0	0	0	114	L193 V285 H945	L193-L289 HydrophobicContact CB-CB 4.17Å; L193-L289 HydrophobicContact CB-CD1 4.48Å; L193-L289 HydrophobicContact CD1-CB 4.08Å; L193-L289 HydrophobicContact CD1-CD1 4Å; L193-L289 HydrophobicContact CD2-CB 3.99Å; L193-L289 HydrophobicContact CG-CB 4.29Å; V285-L289 HydrophobicContact CG2-CD1 4.48Å; V285-L289 PolarHBondContact O-N 3.3Å; L289-H945 HydrophobicContact CD2-CB 4.02Å
290	L	86.6	Confident	89.3	Confident	7 Å²	7	22.5 Å²	22.5	4%	0.037	11%	0.106	C	C	.	.	S	Bend	trans	-91.3	125.1	-179	-163.1	75.3	0	0	0	111.2	L190 L193 C249 V252 I253 V285 V292	L190-L290 HydrophobicContact CD1-CD1 3.98Å; L193-L290 HydrophobicContact CD2-CB 4.27Å; L193-L290 HydrophobicContact CD2-CD1 3.85Å; C249-L290 HydrophobicContact CB-CD1 4.18Å; C249-L290 HydrophobicContact CB-CD2 4.38Å; C249-L290 HydrophobicContact CB-CG 4.23Å; V252-L290 HydrophobicContact CB-CD1 4.37Å; V252-L290 HydrophobicContact CG1-CD1 4.18Å; I253-L290 HydrophobicContact CD1-CD2 3.64Å; I253-L290 HydrophobicContact CG1-CD2 3.57Å; V285-L290 PolarHBondContact O-N 3.34Å; L290-V292 HydrophobicContact CB-CG2 4.46Å; L290-V292 HydrophobicContact CD2-CG1 3.74Å; L290-V292 HydrophobicContact CD2-CG2 4.13Å; L290-V292 HydrophobicContact CG-CG1 4.04Å; L290-V292 HydrophobicContact CG-CG2 4.44Å; L290-V292 PolarHBondContact O-N 2.62Å
291	P	83.4	Confident	89.4	Confident	9 Å²	9	22.3 Å²	22.3	6%	0.058	11%	0.105	C	C	.	.			trans	-79.1	68.1	-177.3	31.4	-33.4	0	0	0	112.1	F182 F183 N186	F182-P291 HydrophobicContact CD1-CB 4.31Å; F182-P291 HydrophobicContact CE1-CB 3.53Å; F182-P291 HydrophobicContact CZ-CB 3.93Å; F183-P291 HydrophobicContact CD1-CB 4.2Å; F183-P291 HydrophobicContact CD1-CG 4.16Å; F183-P291 HydrophobicContact CE1-CB 4.2Å; F183-P291 HydrophobicContact CE1-CG 4.18Å; F183-P291 WeakPolarHBondContact CE1-O 3.49Å; N186-P291 HydrophobicContact CB-CB 3.94Å; N186-P291 HydrophobicContact CB-CG 4.39Å
292	V	86.1	Confident	89.5	Confident	8 Å²	8	26.2 Å²	26.2	5%	0.048	13%	0.129	C	C	.	.			trans	-113.9	154.7	176.2	-69.1	0	0	0	0	112.2	C249 I253 L290 A296 A297 H344	C249-V292 HydrophobicContact CB-CG1 3.84Å; I253-V292 HydrophobicContact CD1-CG1 4.29Å; L290-V292 HydrophobicContact CB-CG2 4.46Å; L290-V292 HydrophobicContact CD2-CG1 3.74Å; L290-V292 HydrophobicContact CD2-CG2 4.13Å; L290-V292 HydrophobicContact CG-CG1 4.04Å; L290-V292 HydrophobicContact CG-CG2 4.44Å; L290-V292 PolarHBondContact O-N 2.62Å; V292-A296 HydrophobicContact CB-CB 4.35Å; V292-A297 HydrophobicContact CG2-CB 4.11Å; V292-H344 PolarHBondContact O-NE2 3.21Å; V292-H344 VanDerWaalsContact O-NE2 3.14Å
293	R	85.3	Confident	89.5	Confident	100 Å²	100	29.7 Å²	29.7	38%	0.377	15%	0.146	S	C	.	.			trans	-64.3	142.6	172.4	-72.2	-179.5	169.9	131.5	1.4	110.2	E175 Q179 R295 A296 A297	E175-R293 IonicContact OE1-CZ 2.66Å; E175-R293 IonicContact OE1-NE 2.82Å; E175-R293 IonicContact OE1-NH2 2.69Å; E175-R293 PolarHBondContact OE1-NH2 2.87Å; Q179-R293 VanDerWaalsContact CD-NH2 3.32Å; R293-R295 PolarHBondContact O-N 3.26Å; R293-A296 WeakPolarHBondContact O-CB 3.43Å; R293-A296 PolarHBondContact O-N 3.28Å; R293-A297 PolarHBondContact O-N 3.12Å
294	M	85.6	Confident	89.6	Confident	5 Å²	5	29.7 Å²	29.7	3%	0.025	15%	0.146	C	C	.	.	H	α-helix	trans	-45.1	-42.7	-177.6	-170.8	-172.9	-175.4	0	0	114.7	V163 A296 A297 V298 V341 H344 Y345	V163-M294 HydrophobicContact CG1-CE 3.61Å; V163-M294 HydrophobicContact CG1-SD 4.33Å; M294-A296 VanDerWaalsContact C-N 3.33Å; M294-A296 PolarHBondContact O-N 2.93Å; M294-A297 PolarHBondContact O-N 2.84Å; M294-V298 HydrophobicContact CG-CG2 4.36Å; M294-V298 WeakPolarHBondContact O-CG2 3.47Å; M294-V298 PolarHBondContact O-N 3.34Å; M294-V341 HydrophobicContact CE-CB 4.29Å; M294-V341 HydrophobicContact CE-CG1 3.63Å; M294-V341 HydrophobicContact CE-CG2 4.05Å; M294-H344 VanDerWaalsContact CA-CE1 3.49Å; M294-H344 WeakPolarHBondContact CA-CE1 3.37Å; M294-H344 PolarHBondContact N-CE1 3.44Å; M294-Y345 HydrophobicContact CE-CD2 4.32Å; M294-Y345 HydrophobicContact CE-CG 4.38Å; M294-Y345 HydrophobicContact SD-CD2 3.77Å; M294-Y345 HydrophobicContact SD-CG 4.34Å
295	R	86.9	Confident	89.8	Confident	138 Å²	138	30.1 Å²	30.1	52%	0.521	15%	0.15	S	C	.	.	H	α-helix	trans	-60.3	-37.8	179.1	-75.5	178.7	171.5	-176.8	-7.2	113.5	F164 R293 I299	F164-R295 PolarHBondContact O-NE 2.98Å; F164-R295 PolarHBondContact O-NH2 3.29Å; R293-R295 PolarHBondContact O-N 3.26Å; R295-I299 WeakPolarHBondContact O-CB 3.31Å; R295-I299 WeakPolarHBondContact O-CD1 3.29Å; R295-I299 VanDerWaalsContact O-CG1 3.24Å; R295-I299 WeakPolarHBondContact O-CG1 3.41Å; R295-I299 PolarHBondContact O-N 3.26Å; R295-I299 VanDerWaalsContact O-N 3.09Å
296	A	89	Confident	90	Very high	15 Å²	15	32.6 Å²	32.6	12%	0.124	17%	0.171	C	C	.	.	H	α-helix	trans	-71.3	-41.6	178.5	0	0	0	0	0	111.1	Y250 V292 R293 M294 T300	Y250-A296 HydrophobicContact CE1-CB 4.27Å; V292-A296 HydrophobicContact CB-CB 4.35Å; R293-A296 WeakPolarHBondContact O-CB 3.43Å; R293-A296 PolarHBondContact O-N 3.28Å; M294-A296 VanDerWaalsContact C-N 3.33Å; M294-A296 PolarHBondContact O-N 2.93Å; A296-T300 VanDerWaalsContact O-CB 3.32Å; A296-T300 WeakPolarHBondContact O-CB 3.3Å; A296-T300 PolarHBondContact O-N 3.24Å; A296-T300 PolarHBondContact O-OG1 3.32Å
297	A	90.7	Very high	90.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-47.4	174.8	0	0	0	0	0	111.7	I286 Y287 V292 R293 M294 T300 G301	I286-A297 HydrophobicContact CG2-CB 4.27Å; Y287-A297 HydrophobicContact CD1-CB 3.72Å; Y287-A297 HydrophobicContact CE1-CB 3.94Å; Y287-A297 HydrophobicContact CG-CB 4.37Å; V292-A297 HydrophobicContact CG2-CB 4.11Å; R293-A297 PolarHBondContact O-N 3.12Å; M294-A297 PolarHBondContact O-N 2.84Å; A297-T300 PolarHBondContact O-N 3.08Å; A297-G301 PolarHBondContact O-N 3.24Å
298	V	91.9	Very high	90.3	Very high	23 Å²	23	34 Å²	34	14%	0.139	18%	0.178	C	C	.	.	H	α-helix	trans	-60.9	-49.3	177.9	173.1	0	0	0	0	112.3	F164 Y287 M294 T300 G301 V302 V341	F164-V298 HydrophobicContact CD1-CG1 4.33Å; F164-V298 HydrophobicContact CD1-CG2 4.33Å; F164-V298 HydrophobicContact CE1-CG1 3.91Å; F164-V298 HydrophobicContact CE1-CG2 4.04Å; Y287-V298 HydrophobicContact CE1-CG2 3.87Å; Y287-V298 WeakPolarHBondContact OH-CA 3.24Å; M294-V298 HydrophobicContact CG-CG2 4.36Å; M294-V298 WeakPolarHBondContact O-CG2 3.47Å; M294-V298 PolarHBondContact O-N 3.34Å; V298-T300 VanDerWaalsContact C-N 3.3Å; V298-T300 PolarHBondContact O-N 3.01Å; V298-G301 PolarHBondContact O-N 2.86Å; V298-V302 WeakPolarHBondContact O-CG2 3.47Å; V298-V302 PolarHBondContact O-N 3.27Å; V298-V341 HydrophobicContact CG2-CG2 3.79Å
299	I	92.1	Very high	90.6	Very high	104 Å²	104	34.1 Å²	34.1	53%	0.533	18%	0.179	S	C	.	.	H	α-helix	trans	-60.5	-43.4	179.1	-70.5	166.9	0	0	0	110.4	R295 I303	R295-I299 WeakPolarHBondContact O-CB 3.31Å; R295-I299 WeakPolarHBondContact O-CD1 3.29Å; R295-I299 VanDerWaalsContact O-CG1 3.24Å; R295-I299 WeakPolarHBondContact O-CG1 3.41Å; R295-I299 PolarHBondContact O-N 3.26Å; R295-I299 VanDerWaalsContact O-N 3.09Å; I299-I303 HydrophobicContact CG2-CD1 3.69Å; I299-I303 WeakPolarHBondContact O-CB 3.43Å; I299-I303 VanDerWaalsContact O-CG1 3.23Å; I299-I303 WeakPolarHBondContact O-CG1 3.02Å; I299-I303 PolarHBondContact O-N 3.45Å
300	T	93	Very high	91	Very high	11 Å²	11	36.8 Å²	36.8	7%	0.067	20%	0.202	C	C	.	.	H	α-helix	trans	-67.2	-43.7	179.8	-53.8	0	0	0	0	112.2	I253 I257 I286 A296 A297 V298 V302 I303 L304	I253-T300 HydrophobicContact CG1-CG2 4.4Å; I253-T300 HydrophobicContact CG2-CG2 3.59Å; I257-T300 HydrophobicContact CD1-CG2 4.36Å; I286-T300 HydrophobicContact CD1-CG2 3.76Å; I286-T300 HydrophobicContact CG2-CG2 4.19Å; A296-T300 VanDerWaalsContact O-CB 3.32Å; A296-T300 WeakPolarHBondContact O-CB 3.3Å; A296-T300 PolarHBondContact O-N 3.24Å; A296-T300 PolarHBondContact O-OG1 3.32Å; A297-T300 PolarHBondContact O-N 3.08Å; V298-T300 VanDerWaalsContact C-N 3.3Å; V298-T300 PolarHBondContact O-N 3.01Å; T300-V302 PolarHBondContact O-N 3.24Å; T300-I303 PolarHBondContact O-N 3.41Å; T300-L304 HydrophobicContact CG2-CD1 4.25Å; T300-L304 WeakPolarHBondContact O-CG 3.47Å; T300-L304 PolarHBondContact O-N 3.48Å
301	G	93.8	Very high	91.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-39.7	178.2	0	0	0	0	0	112.9	A297 V298 S305 N337	A297-G301 PolarHBondContact O-N 3.24Å; V298-G301 PolarHBondContact O-N 2.86Å; G301-S305 WeakPolarHBondContact O-CB 3.48Å; G301-S305 PolarHBondContact O-N 2.81Å; G301-S305 VanDerWaalsContact O-N 3.14Å; G301-S305 PolarHBondContact O-OG 2.85Å; G301-N337 WeakPolarHBondContact CA-OD1 3.48Å
302	V	94.3	Very high	91.5	Very high	83 Å²	83	37.2 Å²	37.2	50%	0.503	20%	0.203	S	C	.	.	H	α-helix	trans	-66.7	-42.5	172.9	173	0	0	0	0	111.3	V298 T300 S305 A306	V298-V302 WeakPolarHBondContact O-CG2 3.47Å; V298-V302 PolarHBondContact O-N 3.27Å; T300-V302 PolarHBondContact O-N 3.24Å; V302-S305 WeakPolarHBondContact O-CB 3.48Å; V302-S305 PolarHBondContact O-N 3.28Å; V302-A306 WeakPolarHBondContact O-CB 3.48Å; V302-A306 PolarHBondContact O-N 3.46Å
303	I	94.8	Very high	91.7	Very high	72 Å²	72	43.6 Å²	43.6	37%	0.369	23%	0.227	S	C	.	.	H	α-helix	trans	-61.1	-47.6	176.8	-74.5	168.3	0	0	0	111.6	I299 T300 S305 A306 I307	I299-I303 HydrophobicContact CG2-CD1 3.69Å; I299-I303 WeakPolarHBondContact O-CB 3.43Å; I299-I303 VanDerWaalsContact O-CG1 3.23Å; I299-I303 WeakPolarHBondContact O-CG1 3.02Å; I299-I303 PolarHBondContact O-N 3.45Å; T300-I303 PolarHBondContact O-N 3.41Å; I303-S305 VanDerWaalsContact C-N 3.3Å; I303-S305 PolarHBondContact O-N 3.38Å; I303-A306 PolarHBondContact O-N 2.92Å; I303-I307 HydrophobicContact CG2-CD1 3.6Å; I303-I307 HydrophobicContact CG2-CG1 4.31Å; I303-I307 WeakPolarHBondContact O-CB 3.31Å; I303-I307 VanDerWaalsContact O-CG1 3.26Å; I303-I307 WeakPolarHBondContact O-CG1 3.34Å; I303-I307 PolarHBondContact O-N 3.14Å
304	L	94.4	Very high	91.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.4	-41.3	177	-72.1	170.5	0	0	0	112	V256 I257 Q260 F282 I283 I286 T300 H308	V256-L304 HydrophobicContact CG1-CD1 4.39Å; V256-L304 HydrophobicContact CG1-CD2 4.42Å; I257-L304 HydrophobicContact CG1-CD2 3.86Å; I257-L304 HydrophobicContact CG1-CG 4.48Å; Q260-L304 HydrophobicContact CB-CD2 3.84Å; Q260-L304 HydrophobicContact CG-CD2 3.79Å; F282-L304 HydrophobicContact CB-CD1 4.2Å; I283-L304 HydrophobicContact CG1-CB 4.27Å; I283-L304 HydrophobicContact CG1-CD1 4.31Å; I286-L304 HydrophobicContact CD1-CD1 3.61Å; T300-L304 HydrophobicContact CG2-CD1 4.25Å; T300-L304 WeakPolarHBondContact O-CG 3.47Å; T300-L304 PolarHBondContact O-N 3.48Å; L304-H308 PolarHBondContact O-N 3.4Å; L304-H308 VanDerWaalsContact O-N 3.13Å
305	S	95.4	Very high	91.9	Very high	14 Å²	14	49.5 Å²	49.5	10%	0.098	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-46.3	177	-51.3	0	0	0	0	111.6	I283 G301 V302 I303 H308 V309 N337	I283-S305 WeakPolarHBondContact CD1-OG 3.49Å; G301-S305 WeakPolarHBondContact O-CB 3.48Å; G301-S305 PolarHBondContact O-N 2.81Å; G301-S305 VanDerWaalsContact O-N 3.14Å; G301-S305 PolarHBondContact O-OG 2.85Å; V302-S305 WeakPolarHBondContact O-CB 3.48Å; V302-S305 PolarHBondContact O-N 3.28Å; I303-S305 VanDerWaalsContact C-N 3.3Å; I303-S305 PolarHBondContact O-N 3.38Å; S305-H308 PolarHBondContact O-N 3.16Å; S305-V309 WeakPolarHBondContact O-CG2 3.37Å; S305-V309 PolarHBondContact O-N 3.14Å; S305-N337 PolarHBondContact OG-ND2 2.99Å; S305-N337 VanDerWaalsContact OG-ND2 3.15Å
306	A	94.6	Very high	91.8	Very high	56 Å²	56	43 Å²	43	46%	0.463	24%	0.238	S	C	.	.	H	α-helix	trans	-67.7	-40.2	-179.3	0	0	0	0	0	112.2	V302 I303 V309 A310	V302-A306 WeakPolarHBondContact O-CB 3.48Å; V302-A306 PolarHBondContact O-N 3.46Å; I303-A306 PolarHBondContact O-N 2.92Å; A306-V309 PolarHBondContact O-N 3.25Å; A306-A310 WeakPolarHBondContact O-CB 3.49Å; A306-A310 PolarHBondContact O-N 3Å
307	I	93.8	Very high	91.3	Very high	38 Å²	38	45 Å²	45	20%	0.195	26%	0.26	C	S	.	.	H	α-helix	trans	-58.2	-50.3	174.3	-75.4	170.7	0	0	0	110.5	I257 Q260 V261 I303 I311	I257-I307 HydrophobicContact CG2-CD1 4.02Å; Q260-I307 HydrophobicContact CG-CG2 4.27Å; V261-I307 HydrophobicContact CG2-CD1 4.13Å; V261-I307 HydrophobicContact CG2-CG2 3.69Å; I303-I307 HydrophobicContact CG2-CD1 3.6Å; I303-I307 HydrophobicContact CG2-CG1 4.31Å; I303-I307 WeakPolarHBondContact O-CB 3.31Å; I303-I307 VanDerWaalsContact O-CG1 3.26Å; I303-I307 WeakPolarHBondContact O-CG1 3.34Å; I303-I307 PolarHBondContact O-N 3.14Å; I307-I311 HydrophobicContact CG2-CD1 3.7Å; I307-I311 WeakPolarHBondContact O-CD1 3.37Å; I307-I311 VanDerWaalsContact O-CG1 3.3Å; I307-I311 WeakPolarHBondContact O-CG1 3.49Å; I307-I311 PolarHBondContact O-N 2.66Å; I307-I311 VanDerWaalsContact O-N 3.09Å
308	H	93.4	Very high	90.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.7	-52.9	178.8	-176.8	106.7	0	0	0	111.1	E274 T279 L304 S305 A310 I311 S312 N329 F333	E274-H308 PolarHBondContact O-CE1 2.77Å; T279-H308 HydrophobicContact CG2-CB 4.18Å; T279-H308 PolarHBondContact OG1-ND1 2.93Å; L304-H308 PolarHBondContact O-N 3.4Å; L304-H308 VanDerWaalsContact O-N 3.13Å; S305-H308 PolarHBondContact O-N 3.16Å; H308-A310 VanDerWaalsContact C-N 3.34Å; H308-A310 PolarHBondContact O-N 3.22Å; H308-I311 PolarHBondContact O-N 2.84Å; H308-S312 PolarHBondContact NE2-OG 2.88Å; H308-S312 WeakPolarHBondContact O-CB 3.43Å; H308-S312 PolarHBondContact O-N 2.83Å; H308-S312 PolarHBondContact O-OG 2.7Å; H308-S312 VanDerWaalsContact O-OG 3.12Å; H308-N329 PolarHBondContact NE2-ND2 3.4Å; H308-F333 HydrophobicContact CB-CE2 3.93Å; H308-F333 HydrophobicContact CB-CZ 4.16Å; H308-F333 AromaticContact CD2-CE2 3.46Å; H308-F333 VanDerWaalsContact CD2-CE2 3.46Å; H308-F333 WeakPolarHBondContact CD2-CE2 3.43Å; H308-F333 AromaticContact CD2-CZ 3.57Å; H308-F333 AromaticContact CG-CE2 3.7Å; H308-F333 AromaticContact CG-CZ 3.63Å; H308-F333 AromaticContact ND1-CZ 3.97Å; H308-F333 AromaticContact NE2-CZ 3.89Å
309	V	93.6	Very high	90.2	Very high	27 Å²	27	51 Å²	51	16%	0.164	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-40.2	-176.7	173	0	0	0	0	111.9	S305 A306 W313 I326 I330 F333	S305-V309 WeakPolarHBondContact O-CG2 3.37Å; S305-V309 PolarHBondContact O-N 3.14Å; A306-V309 PolarHBondContact O-N 3.25Å; V309-W313 VanDerWaalsContact O-CB 3.28Å; V309-W313 WeakPolarHBondContact O-CB 3.44Å; V309-W313 PolarHBondContact O-N 3.2Å; V309-I326 HydrophobicContact CG1-CD1 4.46Å; V309-I326 HydrophobicContact CG1-CG2 4.21Å; V309-I330 HydrophobicContact CG1-CD1 4.29Å; V309-I330 HydrophobicContact CG1-CG1 4.21Å; V309-I330 HydrophobicContact CG2-CG1 4Å; V309-F333 HydrophobicContact CG2-CD2 4.01Å; V309-F333 HydrophobicContact CG2-CE2 4.01Å
310	A	92.8	Very high	89.6	Confident	62 Å²	62	50.6 Å²	50.6	51%	0.512	30%	0.303	S	S	.	.	H	α-helix	trans	-67.1	-42.1	179.3	0	0	0	0	0	112.9	A306 H308 M314	A306-A310 WeakPolarHBondContact O-CB 3.49Å; A306-A310 PolarHBondContact O-N 3Å; H308-A310 VanDerWaalsContact C-N 3.34Å; H308-A310 PolarHBondContact O-N 3.22Å; A310-M314 WeakPolarHBondContact O-CB 3.45Å; A310-M314 PolarHBondContact O-N 3.43Å
311	I	91.1	Very high	89.1	Confident	22 Å²	22	50.7 Å²	50.7	11%	0.113	30%	0.302	C	S	.	.	H	α-helix	trans	-69.7	-46	177.5	-61.6	163.3	0	0	0	110.2	V264 L265 I307 H308 W313 M314 L315	V264-I311 HydrophobicContact CB-CD1 4.4Å; V264-I311 HydrophobicContact CB-CG2 4.4Å; V264-I311 HydrophobicContact CG1-CB 3.94Å; V264-I311 HydrophobicContact CG1-CG2 3.71Å; L265-I311 HydrophobicContact CD2-CD1 4.43Å; L265-I311 HydrophobicContact CD2-CG1 4.36Å; L265-I311 HydrophobicContact CD2-CG2 3.81Å; L265-I311 HydrophobicContact CG-CD1 4.16Å; L265-I311 HydrophobicContact CG-CG2 4.27Å; I307-I311 HydrophobicContact CG2-CD1 3.7Å; I307-I311 WeakPolarHBondContact O-CD1 3.37Å; I307-I311 VanDerWaalsContact O-CG1 3.3Å; I307-I311 WeakPolarHBondContact O-CG1 3.49Å; I307-I311 PolarHBondContact O-N 2.66Å; I307-I311 VanDerWaalsContact O-N 3.09Å; H308-I311 PolarHBondContact O-N 2.84Å; I311-W313 VanDerWaalsContact C-N 3.27Å; I311-W313 PolarHBondContact O-N 2.69Å; I311-M314 PolarHBondContact O-N 2.9Å; I311-M314 VanDerWaalsContact O-N 3.07Å; I311-L315 HydrophobicContact CG2-CD1 3.64Å; I311-L315 HydrophobicContact CG2-CG 4.03Å; I311-L315 WeakPolarHBondContact O-CG 3.43Å; I311-L315 PolarHBondContact O-N 3.39Å
312	S	89.8	Confident	88.7	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-32.8	178.6	-63.4	0	0	0	0	112.7	H308 N316	H308-S312 PolarHBondContact NE2-OG 2.88Å; H308-S312 WeakPolarHBondContact O-CB 3.43Å; H308-S312 PolarHBondContact O-N 2.83Å; H308-S312 PolarHBondContact O-OG 2.7Å; H308-S312 VanDerWaalsContact O-OG 3.12Å; S312-N316 WeakPolarHBondContact O-CB 3.47Å; S312-N316 PolarHBondContact O-N 3.22Å; S312-N316 PolarHBondContact O-ND2 2.94Å
313	W	90.4	Very high	88.4	Confident	142 Å²	142	55.6 Å²	55.6	54%	0.538	31%	0.312	S	S	.	.	H	α-helix	trans	-66.5	-47.9	169.5	178.4	-81	0	0	0	112.1	V309 I311 L315 G317 L322 W323 I326	V309-W313 VanDerWaalsContact O-CB 3.28Å; V309-W313 WeakPolarHBondContact O-CB 3.44Å; V309-W313 PolarHBondContact O-N 3.2Å; I311-W313 VanDerWaalsContact C-N 3.27Å; I311-W313 PolarHBondContact O-N 2.69Å; W313-L315 PolarHBondContact O-N 2.97Å; W313-G317 PolarHBondContact O-N 2.98Å; W313-L322 HydrophobicContact CE3-CD2 4.42Å; W313-W323 HydrophobicContact CZ3-CE3 4.49Å; W313-I326 HydrophobicContact CB-CD1 4.37Å; W313-I326 HydrophobicContact CE3-CG1 4.28Å; W313-I326 HydrophobicContact CE3-CG2 4.33Å
314	M	88.8	Confident	88.1	Confident	158 Å²	158	55.7 Å²	55.7	78%	0.778	31%	0.31	S	S	*	.	H	α-helix	trans	-64.8	-37.5	-177.6	-179	175.7	169.2	0	0	113.3	A310 I311	A310-M314 WeakPolarHBondContact O-CB 3.45Å; A310-M314 PolarHBondContact O-N 3.43Å; I311-M314 PolarHBondContact O-N 2.9Å; I311-M314 VanDerWaalsContact O-N 3.07Å
315	L	85.4	Confident	87.8	Confident	71 Å²	71	55.8 Å²	55.8	37%	0.372	31%	0.31	S	S	.	.	H	α-helix	trans	-82.6	-24.2	-176.8	-65.9	-179.6	0	0	0	114.3	I311 W313	I311-L315 HydrophobicContact CG2-CD1 3.64Å; I311-L315 HydrophobicContact CG2-CG 4.03Å; I311-L315 WeakPolarHBondContact O-CG 3.43Å; I311-L315 PolarHBondContact O-N 3.39Å; W313-L315 PolarHBondContact O-N 2.97Å
316	N	84.4	Confident	87.7	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.011	31%	0.307	C	S	.	.	H	α-helix	trans	-118.7	11.2	-171.2	-55.6	-75	0	0	0	113.9	S271 A272 S312 V318 D319 L322	S271-N316 WeakPolarHBondContact CA-OD1 3.38Å; S271-N316 PolarHBondContact N-OD1 3.22Å; S271-N316 PolarHBondContact O-ND2 2.82Å; A272-N316 HydrophobicContact CB-CB 4.46Å; A272-N316 PolarHBondContact N-ND2 3.43Å; S312-N316 WeakPolarHBondContact O-CB 3.47Å; S312-N316 PolarHBondContact O-N 3.22Å; S312-N316 PolarHBondContact O-ND2 2.94Å; N316-V318 PolarHBondContact O-N 3.34Å; N316-D319 PolarHBondContact O-N 3.5Å; N316-L322 HydrophobicContact CB-CD1 3.8Å
317	G	79.5	Confident	87.6	Confident	57 Å²	57	54.1 Å²	54.1	59%	0.588	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	7.6	-177	0	0	0	0	0	117.6	W313	W313-G317 PolarHBondContact O-N 2.98Å
318	V	78.6	Confident	87.6	Confident	129 Å²	129	52.3 Å²	52.3	78%	0.782	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-23.9	175.6	-176.5	0	0	0	0	111.6	N316	N316-V318 PolarHBondContact O-N 3.34Å
319	D	80.1	Confident	87.6	Confident	19 Å²	19	52.3 Å²	52.3	10%	0.102	29%	0.285	C	S	.	.			trans	-85.3	127.1	-171.6	-53.1	-61.7	0	0	0	112.5	R270 N316 F321 L322 N905	R270-D319 IonicContact CZ-OD1 3.34Å; R270-D319 IonicContact CZ-OD2 3.5Å; R270-D319 IonicContact NH1-OD1 3.87Å; R270-D319 PolarHBondContact NH1-OD1 3.11Å; R270-D319 IonicContact NH1-OD2 3.74Å; R270-D319 PolarHBondContact NH1-OD2 3.33Å; R270-D319 IonicContact NH2-OD1 3.45Å; R270-D319 PolarHBondContact NH2-OD1 3.41Å; R270-D319 IonicContact NH2-OD2 2.76Å; N316-D319 PolarHBondContact O-N 3.5Å; D319-F321 HydrophobicContact CB-CD1 4.34Å; D319-F321 HydrophobicContact CB-CD2 4.46Å; D319-F321 HydrophobicContact CB-CE1 3.93Å; D319-F321 HydrophobicContact CB-CE2 4.06Å; D319-F321 HydrophobicContact CB-CZ 3.78Å; D319-F321 PolarHBondContact O-N 3.15Å; D319-L322 VanDerWaalsContact O-CB 3.24Å; D319-L322 WeakPolarHBondContact O-CB 3.38Å; D319-L322 PolarHBondContact O-N 2.84Å; D319-L322 VanDerWaalsContact O-N 3.13Å; D319-N905 PolarHBondContact OD1-ND2 3.13Å
320	S	79.1	Confident	87.7	Confident	97 Å²	97	54.7 Å²	54.7	68%	0.678	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-32.8	-177.3	60.6	0	0	0	0	113.9	L322 D831	S320-L322 VanDerWaalsContact C-N 3.35Å; S320-D831 PolarHBondContact OG-OD2 3.2Å
321	F	82.4	Confident	87.8	Confident	12 Å²	12	53.3 Å²	53.3	5%	0.053	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-3.9	-177	55.8	-98.5	0	0	0	113.9	D319 W323 K324 L830 D831 F846	D319-F321 HydrophobicContact CB-CD1 4.34Å; D319-F321 HydrophobicContact CB-CD2 4.46Å; D319-F321 HydrophobicContact CB-CE1 3.93Å; D319-F321 HydrophobicContact CB-CE2 4.06Å; D319-F321 HydrophobicContact CB-CZ 3.78Å; D319-F321 PolarHBondContact O-N 3.15Å; F321-W323 PolarHBondContact O-N 2.91Å; F321-K324 HydrophobicContact CB-CD 4.42Å; F321-K324 WeakPolarHBondContact O-CB 3.43Å; F321-K324 PolarHBondContact O-N 3.25Å; F321-L830 HydrophobicContact CD1-CB 4.34Å; F321-L830 HydrophobicContact CE1-CB 4.01Å; F321-L830 HydrophobicContact CE2-CD2 4.37Å; F321-L830 HydrophobicContact CZ-CB 4.3Å; F321-L830 HydrophobicContact CZ-CD2 4.18Å; F321-D831 HydrophobicContact CD1-CB 4.26Å; F321-F846 HydrophobicContact CB-CZ 3.99Å; F321-F846 AromaticContact CD2-CE1 3.65Å; F321-F846 HydrophobicContact CD2-CE1 3.65Å; F321-F846 AromaticContact CD2-CZ 3.48Å; F321-F846 HydrophobicContact CD2-CZ 3.48Å; F321-F846 VanDerWaalsContact CD2-CZ 3.48Å; F321-F846 AromaticContact CE2-CE1 3.86Å; F321-F846 HydrophobicContact CE2-CE1 3.86Å; F321-F846 HydrophobicContact CE2-CZ 4.12Å; F321-F846 HydrophobicContact CG-CE1 4.39Å; F321-F846 AromaticContact CG-CZ 3.81Å; F321-F846 HydrophobicContact CG-CZ 3.81Å
322	L	86.6	Confident	88	Confident	13 Å²	13	52.3 Å²	52.3	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-49.6	-39	-175.5	177.6	64.8	0	0	0	113.1	A272 W313 N316 D319 S320 K324 Q325 I326	A272-L322 HydrophobicContact CB-CD1 3.58Å; W313-L322 HydrophobicContact CE3-CD2 4.42Å; N316-L322 HydrophobicContact CB-CD1 3.8Å; D319-L322 VanDerWaalsContact O-CB 3.24Å; D319-L322 WeakPolarHBondContact O-CB 3.38Å; D319-L322 PolarHBondContact O-N 2.84Å; D319-L322 VanDerWaalsContact O-N 3.13Å; S320-L322 VanDerWaalsContact C-N 3.35Å; L322-K324 VanDerWaalsContact C-N 3.29Å; L322-K324 PolarHBondContact O-N 3.44Å; L322-Q325 PolarHBondContact O-N 3.23Å; L322-Q325 VanDerWaalsContact O-N 3.14Å; L322-I326 HydrophobicContact CD1-CD1 4.15Å; L322-I326 HydrophobicContact CD1-CG1 3.65Å; L322-I326 HydrophobicContact CG-CG1 3.78Å; L322-I326 WeakPolarHBondContact O-CG1 3.43Å; L322-I326 PolarHBondContact O-N 2.93Å
323	W	87.3	Confident	88.3	Confident	173 Å²	173	52.3 Å²	52.3	66%	0.655	27%	0.274	S	S	*	.	H	α-helix	trans	-58.2	-38.3	179.5	-179	-109.1	0	0	0	113	W313 F321 Q325 I326 V327	W313-W323 HydrophobicContact CZ3-CE3 4.49Å; F321-W323 PolarHBondContact O-N 2.91Å; W323-Q325 PolarHBondContact O-N 3.02Å; W323-I326 PolarHBondContact O-N 3.19Å; W323-V327 HydrophobicContact CD2-CG2 3.83Å; W323-V327 VanDerWaalsContact CE2-CG2 3.47Å; W323-V327 HydrophobicContact CE3-CG2 4.23Å; W323-V327 HydrophobicContact CG-CG2 4.37Å; W323-V327 HydrophobicContact CH2-CG2 4.03Å; W323-V327 HydrophobicContact CZ2-CG2 3.59Å; W323-V327 HydrophobicContact CZ3-CG2 4.33Å; W323-V327 WeakPolarHBondContact O-CB 3.47Å; W323-V327 WeakPolarHBondContact O-CG2 3.39Å; W323-V327 PolarHBondContact O-N 3.23Å
324	K	88.6	Confident	88.5	Confident	75 Å²	75	47.9 Å²	47.9	33%	0.326	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-45.9	176.8	-58.7	174.9	-178.1	173	0	110.3	F321 L322 S328 V723 I724 D831 F846	F321-K324 HydrophobicContact CB-CD 4.42Å; F321-K324 WeakPolarHBondContact O-CB 3.43Å; F321-K324 PolarHBondContact O-N 3.25Å; L322-K324 VanDerWaalsContact C-N 3.29Å; L322-K324 PolarHBondContact O-N 3.44Å; K324-S328 WeakPolarHBondContact O-CB 3.43Å; K324-S328 PolarHBondContact O-N 3.13Å; K324-S328 PolarHBondContact O-OG 3.46Å; K324-V723 HydrophobicContact CB-CG1 4.38Å; K324-V723 WeakPolarHBondContact O-CG1 3.31Å; K324-I724 HydrophobicContact CB-CD1 4.39Å; K324-D831 IonicContact NZ-OD1 2.62Å; K324-D831 PolarHBondContact NZ-OD1 3.1Å; K324-F846 HydrophobicContact CD-CE2 4.42Å
325	Q	89.5	Confident	88.8	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-48.5	178.8	-67.9	-178.6	-52.4	0	0	111.6	A272 L322 W323 V327 S328 N329 F846 Y849	A272-Q325 HydrophobicContact CB-CB 4.13Å; L322-Q325 PolarHBondContact O-N 3.23Å; L322-Q325 VanDerWaalsContact O-N 3.14Å; W323-Q325 PolarHBondContact O-N 3.02Å; Q325-V327 PolarHBondContact O-N 3.28Å; Q325-S328 WeakPolarHBondContact O-CB 3.24Å; Q325-S328 PolarHBondContact O-N 3.01Å; Q325-S328 VanDerWaalsContact O-N 3.15Å; Q325-N329 VanDerWaalsContact O-CG 3.23Å; Q325-N329 PolarHBondContact O-N 2.93Å; Q325-N329 PolarHBondContact O-OD1 2.73Å; Q325-F846 HydrophobicContact CG-CD1 4.14Å; Q325-F846 HydrophobicContact CG-CE1 4.01Å; Q325-Y849 WeakPolarHBondContact CA-OH 3.41Å; Q325-Y849 WeakPolarHBondContact CB-OH 3.49Å; Q325-Y849 HydrophobicContact CG-CE2 4.28Å; Q325-Y849 PolarHBondContact O-OH 2.86Å
326	I	92.1	Very high	89.2	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-44.9	-178.3	-69.1	-69.1	0	0	0	112.2	V309 W313 L322 W323 S328 N329 I330	V309-I326 HydrophobicContact CG1-CD1 4.46Å; V309-I326 HydrophobicContact CG1-CG2 4.21Å; W313-I326 HydrophobicContact CB-CD1 4.37Å; W313-I326 HydrophobicContact CE3-CG1 4.28Å; W313-I326 HydrophobicContact CE3-CG2 4.33Å; L322-I326 HydrophobicContact CD1-CD1 4.15Å; L322-I326 HydrophobicContact CD1-CG1 3.65Å; L322-I326 HydrophobicContact CG-CG1 3.78Å; L322-I326 WeakPolarHBondContact O-CG1 3.43Å; L322-I326 PolarHBondContact O-N 2.93Å; W323-I326 PolarHBondContact O-N 3.19Å; I326-S328 VanDerWaalsContact C-N 3.29Å; I326-S328 PolarHBondContact O-N 2.78Å; I326-N329 PolarHBondContact O-N 2.85Å; I326-I330 HydrophobicContact CG2-CD1 3.89Å; I326-I330 VanDerWaalsContact O-CG1 3.28Å; I326-I330 WeakPolarHBondContact O-CG1 3.41Å; I326-I330 PolarHBondContact O-N 3.11Å
327	V	93.6	Very high	89.7	Confident	32 Å²	32	37.8 Å²	37.8	19%	0.194	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-43	174.5	170.9	0	0	0	0	110.6	W323 Q325 I330 L331 V723	W323-V327 HydrophobicContact CD2-CG2 3.83Å; W323-V327 VanDerWaalsContact CE2-CG2 3.47Å; W323-V327 HydrophobicContact CE3-CG2 4.23Å; W323-V327 HydrophobicContact CG-CG2 4.37Å; W323-V327 HydrophobicContact CH2-CG2 4.03Å; W323-V327 HydrophobicContact CZ2-CG2 3.59Å; W323-V327 HydrophobicContact CZ3-CG2 4.33Å; W323-V327 WeakPolarHBondContact O-CB 3.47Å; W323-V327 WeakPolarHBondContact O-CG2 3.39Å; W323-V327 PolarHBondContact O-N 3.23Å; Q325-V327 PolarHBondContact O-N 3.28Å; V327-I330 PolarHBondContact O-N 2.93Å; V327-L331 HydrophobicContact CG1-CD1 4.17Å; V327-L331 WeakPolarHBondContact O-CG 2.97Å; V327-L331 PolarHBondContact O-N 2.69Å; V327-V723 HydrophobicContact CB-CG1 4.38Å; V327-V723 HydrophobicContact CG1-CG1 4.29Å; V327-V723 HydrophobicContact CG1-CG2 4.2Å
328	S	92.9	Very high	90.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.7	-40	179.7	-57.3	0	0	0	0	112.3	K324 Q325 I326 L331 V332 V723 I724	K324-S328 WeakPolarHBondContact O-CB 3.43Å; K324-S328 PolarHBondContact O-N 3.13Å; K324-S328 PolarHBondContact O-OG 3.46Å; Q325-S328 WeakPolarHBondContact O-CB 3.24Å; Q325-S328 PolarHBondContact O-N 3.01Å; Q325-S328 VanDerWaalsContact O-N 3.15Å; I326-S328 VanDerWaalsContact C-N 3.29Å; I326-S328 PolarHBondContact O-N 2.78Å; S328-L331 PolarHBondContact O-N 2.95Å; S328-V332 VanDerWaalsContact O-CG2 3.32Å; S328-V332 WeakPolarHBondContact O-CG2 3.41Å; S328-V332 PolarHBondContact O-N 2.74Å; S328-V723 WeakPolarHBondContact OG-CG1 3.44Å; S328-I724 WeakPolarHBondContact OG-CD1 3.44Å; S328-I724 VanDerWaalsContact OG-CG1 3.29Å; S328-I724 WeakPolarHBondContact OG-CG1 3.38Å
329	N	94.1	Very high	91	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-43.3	174.5	-67.2	11	0	0	0	111.4	A272 I276 H308 Q325 I326 L331 V332 F333 Y849	A272-N329 PolarHBondContact O-ND2 3.03Å; I276-N329 VanDerWaalsContact CD1-OD1 3.24Å; I276-N329 WeakPolarHBondContact CD1-OD1 3.45Å; H308-N329 PolarHBondContact NE2-ND2 3.4Å; Q325-N329 VanDerWaalsContact O-CG 3.23Å; Q325-N329 PolarHBondContact O-N 2.93Å; Q325-N329 PolarHBondContact O-OD1 2.73Å; I326-N329 PolarHBondContact O-N 2.85Å; N329-L331 VanDerWaalsContact C-N 3.3Å; N329-L331 PolarHBondContact O-N 2.81Å; N329-V332 PolarHBondContact O-N 3.25Å; N329-F333 HydrophobicContact CB-CD2 4.44Å; N329-F333 HydrophobicContact CB-CE2 3.97Å; N329-F333 HydrophobicContact CB-CZ 4.49Å; N329-F333 WeakPolarHBondContact O-CD2 3.24Å; N329-F333 VanDerWaalsContact O-CG 3.26Å; N329-F333 WeakPolarHBondContact O-CG 3.24Å; N329-F333 PolarHBondContact O-N 3.16Å; N329-Y849 WeakPolarHBondContact OD1-CE1 3.36Å; N329-Y849 PolarHBondContact OD1-OH 3.07Å
330	I	95.3	Very high	91.5	Very high	77 Å²	77	31 Å²	31	40%	0.395	16%	0.16	S	C	.	.	H	α-helix	trans	-59.8	-41.9	175.2	-69.1	164.5	0	0	0	110.5	V309 I326 V327 S334	V309-I330 HydrophobicContact CG1-CD1 4.29Å; V309-I330 HydrophobicContact CG1-CG1 4.21Å; V309-I330 HydrophobicContact CG2-CG1 4Å; I326-I330 HydrophobicContact CG2-CD1 3.89Å; I326-I330 VanDerWaalsContact O-CG1 3.28Å; I326-I330 WeakPolarHBondContact O-CG1 3.41Å; I326-I330 PolarHBondContact O-N 3.11Å; V327-I330 PolarHBondContact O-N 2.93Å; I330-S334 WeakPolarHBondContact O-CB 3.36Å; I330-S334 PolarHBondContact O-N 2.9Å; I330-S334 PolarHBondContact O-OG 3.13Å
331	L	95.4	Very high	92.1	Very high	32 Å²	32	27.5 Å²	27.5	17%	0.168	14%	0.135	C	C	.	.	H	α-helix	trans	-65.6	-46.5	176.2	-68.7	171.9	0	0	0	112.1	V327 S328 N329 S334 C335 F716 F719 I720	V327-L331 HydrophobicContact CG1-CD1 4.17Å; V327-L331 WeakPolarHBondContact O-CG 2.97Å; V327-L331 PolarHBondContact O-N 2.69Å; S328-L331 PolarHBondContact O-N 2.95Å; N329-L331 VanDerWaalsContact C-N 3.3Å; N329-L331 PolarHBondContact O-N 2.81Å; L331-S334 PolarHBondContact O-N 2.75Å; L331-C335 WeakPolarHBondContact O-CB 3.44Å; L331-C335 PolarHBondContact O-N 2.95Å; L331-F716 HydrophobicContact CB-CD1 4.09Å; L331-F716 HydrophobicContact CB-CE1 4.48Å; L331-F716 HydrophobicContact CD2-CD1 3.86Å; L331-F716 HydrophobicContact CD2-CE1 3.81Å; L331-F719 HydrophobicContact CD1-CB 3.94Å; L331-I720 HydrophobicContact CB-CD1 4.18Å; L331-I720 HydrophobicContact CB-CG1 3.67Å; L331-I720 HydrophobicContact CD1-CG1 4.02Å
332	V	95	Very high	92.4	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-59.7	-47.4	177.3	170	0	0	0	0	111.5	I276 V280 S328 N329 C335 S336 I720 C852 L856	I276-V332 HydrophobicContact CG2-CG1 3.81Å; V280-V332 HydrophobicContact CG2-CG1 3.57Å; S328-V332 VanDerWaalsContact O-CG2 3.32Å; S328-V332 WeakPolarHBondContact O-CG2 3.41Å; S328-V332 PolarHBondContact O-N 2.74Å; N329-V332 PolarHBondContact O-N 3.25Å; V332-C335 PolarHBondContact O-N 3.34Å; V332-S336 WeakPolarHBondContact O-CB 3.49Å; V332-S336 PolarHBondContact O-N 2.68Å; V332-S336 PolarHBondContact O-OG 3.04Å; V332-I720 HydrophobicContact CG2-CD1 3.54Å; V332-I720 HydrophobicContact CG2-CG1 4.29Å; V332-C852 HydrophobicContact CG2-CB 4.41Å; V332-L856 HydrophobicContact CG1-CD2 4.49Å; V332-L856 HydrophobicContact CG2-CD1 4.38Å
333	F	95.8	Very high	92.5	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.018	14%	0.143	C	C	.	.	H	α-helix	trans	-72	-34.1	-179.8	-58	-35.4	0	0	0	112.6	I276 T279 V280 I283 H308 V309 N329 S336 N337	I276-F333 HydrophobicContact CG1-CZ 4.44Å; I276-F333 HydrophobicContact CG2-CE1 4.1Å; T279-F333 HydrophobicContact CG2-CD1 4.05Å; T279-F333 HydrophobicContact CG2-CE1 3.52Å; T279-F333 HydrophobicContact CG2-CE2 4.42Å; T279-F333 HydrophobicContact CG2-CZ 3.74Å; V280-F333 HydrophobicContact CG2-CD1 4.06Å; V280-F333 HydrophobicContact CG2-CE1 4.07Å; I283-F333 HydrophobicContact CD1-CD1 4.2Å; H308-F333 HydrophobicContact CB-CE2 3.93Å; H308-F333 HydrophobicContact CB-CZ 4.16Å; H308-F333 AromaticContact CD2-CE2 3.46Å; H308-F333 VanDerWaalsContact CD2-CE2 3.46Å; H308-F333 WeakPolarHBondContact CD2-CE2 3.43Å; H308-F333 AromaticContact CD2-CZ 3.57Å; H308-F333 AromaticContact CG-CE2 3.7Å; H308-F333 AromaticContact CG-CZ 3.63Å; H308-F333 AromaticContact ND1-CZ 3.97Å; H308-F333 AromaticContact NE2-CZ 3.89Å; V309-F333 HydrophobicContact CG2-CD2 4.01Å; V309-F333 HydrophobicContact CG2-CE2 4.01Å; N329-F333 HydrophobicContact CB-CD2 4.44Å; N329-F333 HydrophobicContact CB-CE2 3.97Å; N329-F333 HydrophobicContact CB-CZ 4.49Å; N329-F333 WeakPolarHBondContact O-CD2 3.24Å; N329-F333 VanDerWaalsContact O-CG 3.26Å; N329-F333 WeakPolarHBondContact O-CG 3.24Å; N329-F333 PolarHBondContact O-N 3.16Å; F333-S336 PolarHBondContact O-N 2.92Å; F333-N337 WeakPolarHBondContact O-CB 3.42Å; F333-N337 PolarHBondContact O-N 3.16Å; F333-N337 PolarHBondContact O-ND2 3.4Å
334	S	94.9	Very high	92.5	Very high	48 Å²	48	21 Å²	21	34%	0.336	12%	0.116	S	C	.	.	H	α-helix	trans	-62.5	-48.1	172.2	-62.1	0	0	0	0	111.1	I330 L331 S336 N337 I338	I330-S334 WeakPolarHBondContact O-CB 3.36Å; I330-S334 PolarHBondContact O-N 2.9Å; I330-S334 PolarHBondContact O-OG 3.13Å; L331-S334 PolarHBondContact O-N 2.75Å; S334-S336 VanDerWaalsContact C-N 3.34Å; S334-S336 PolarHBondContact O-N 2.85Å; S334-N337 PolarHBondContact O-N 3.25Å; S334-I338 WeakPolarHBondContact O-CD1 3.49Å; S334-I338 VanDerWaalsContact O-CG1 3.31Å; S334-I338 WeakPolarHBondContact O-CG1 3.45Å; S334-I338 PolarHBondContact O-N 3.09Å
335	C	95.1	Very high	92.4	Very high	1 Å²	1	21 Å²	21	1%	0.007	11%	0.114	C	C	.	.	H	α-helix	trans	-57.6	-46.5	174.8	-169.1	0	0	0	0	111.6	L331 V332 N337 I338 V339 F716 L856	L331-C335 WeakPolarHBondContact O-CB 3.44Å; L331-C335 PolarHBondContact O-N 2.95Å; V332-C335 PolarHBondContact O-N 3.34Å; C335-N337 PolarHBondContact O-N 3.24Å; C335-I338 PolarHBondContact O-N 3.3Å; C335-V339 WeakPolarHBondContact O-CG2 3.36Å; C335-V339 PolarHBondContact O-N 2.89Å; C335-F716 HydrophobicContact CB-CB 3.9Å; C335-F716 HydrophobicContact CB-CD1 4.15Å; C335-F716 HydrophobicContact CB-CD2 3.48Å; C335-F716 VanDerWaalsContact CB-CD2 3.48Å; C335-F716 HydrophobicContact CB-CE2 3.94Å; C335-F716 HydrophobicContact CB-CG 3.59Å; C335-F716 HydrophobicContact CB-CZ 4.47Å; C335-F716 VanDerWaalsContact SG-CD2 3.54Å; C335-L856 HydrophobicContact CB-CD1 4.23Å; C335-L856 HydrophobicContact CB-CD2 3.98Å
336	S	93.9	Very high	92.1	Very high	4 Å²	4	21.8 Å²	21.8	3%	0.028	12%	0.119	C	C	.	.	H	α-helix	trans	-62.7	-40.9	-179.6	-57.4	0	0	0	0	112.6	V332 F333 S334 G340	V332-S336 WeakPolarHBondContact O-CB 3.49Å; V332-S336 PolarHBondContact O-N 2.68Å; V332-S336 PolarHBondContact O-OG 3.04Å; F333-S336 PolarHBondContact O-N 2.92Å; S334-S336 VanDerWaalsContact C-N 3.34Å; S334-S336 PolarHBondContact O-N 2.85Å; S336-G340 PolarHBondContact O-N 2.81Å
337	N	94	Very high	91.6	Very high	15 Å²	15	22.8 Å²	22.8	8%	0.08	13%	0.128	C	C	.	.	H	α-helix	trans	-67.6	-40.5	174.6	-83.8	-85.4	0	0	0	112.1	Y287 G301 S305 F333 S334 C335 G340 V341	Y287-N337 HydrophobicContact CE2-CB 4.37Å; Y287-N337 WeakPolarHBondContact CE2-OD1 3.41Å; Y287-N337 PolarHBondContact OH-OD1 2.92Å; G301-N337 WeakPolarHBondContact CA-OD1 3.48Å; S305-N337 PolarHBondContact OG-ND2 2.99Å; S305-N337 VanDerWaalsContact OG-ND2 3.15Å; F333-N337 WeakPolarHBondContact O-CB 3.42Å; F333-N337 PolarHBondContact O-N 3.16Å; F333-N337 PolarHBondContact O-ND2 3.4Å; S334-N337 PolarHBondContact O-N 3.25Å; C335-N337 PolarHBondContact O-N 3.24Å; N337-G340 PolarHBondContact O-N 3.14Å; N337-V341 WeakPolarHBondContact O-CG2 3.35Å; N337-V341 PolarHBondContact O-N 3.31Å
338	I	92.5	Very high	91.1	Very high	59 Å²	59	22.2 Å²	22.2	30%	0.303	12%	0.123	S	C	.	.	H	α-helix	trans	-64.8	-44.9	177.9	-71.5	162.9	0	0	0	110.7	S334 C335 G340 V341 C342 L712 F716	S334-I338 WeakPolarHBondContact O-CD1 3.49Å; S334-I338 VanDerWaalsContact O-CG1 3.31Å; S334-I338 WeakPolarHBondContact O-CG1 3.45Å; S334-I338 PolarHBondContact O-N 3.09Å; C335-I338 PolarHBondContact O-N 3.3Å; I338-G340 VanDerWaalsContact C-N 3.33Å; I338-G340 PolarHBondContact O-N 3.32Å; I338-V341 PolarHBondContact O-N 3.2Å; I338-C342 WeakPolarHBondContact O-CB 3.39Å; I338-C342 PolarHBondContact O-N 2.74Å; I338-C342 PolarHBondContact O-SG 2.91Å; I338-C342 VanDerWaalsContact O-SG 3.35Å; I338-L712 HydrophobicContact CD1-CD2 4.42Å; I338-L712 HydrophobicContact CG2-CD1 4.18Å; I338-L712 HydrophobicContact CG2-CD2 4.15Å; I338-F716 HydrophobicContact CD1-CE2 3.7Å; I338-F716 HydrophobicContact CD1-CZ 3.85Å
339	V	92.6	Very high	90.5	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-40.2	174.5	172.2	0	0	0	0	111.6	C335 C342 T343 V713 L859 V863	C335-V339 WeakPolarHBondContact O-CG2 3.36Å; C335-V339 PolarHBondContact O-N 2.89Å; V339-C342 PolarHBondContact O-N 3.32Å; V339-T343 WeakPolarHBondContact O-CB 3.09Å; V339-T343 PolarHBondContact O-N 2.92Å; V339-T343 PolarHBondContact O-OG1 2.85Å; V339-V713 HydrophobicContact CG2-CG2 3.41Å; V339-V713 VanDerWaalsContact CG2-CG2 3.41Å; V339-L859 HydrophobicContact CG1-CB 4.12Å; V339-V863 HydrophobicContact CG1-CG2 3.72Å
340	G	91.9	Very high	89.8	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-58.2	-49	173.1	0	0	0	0	0	112.7	S336 N337 I338 T343 H344	S336-G340 PolarHBondContact O-N 2.81Å; N337-G340 PolarHBondContact O-N 3.14Å; I338-G340 VanDerWaalsContact C-N 3.33Å; I338-G340 PolarHBondContact O-N 3.32Å; G340-T343 PolarHBondContact O-N 3.1Å; G340-H344 WeakPolarHBondContact O-CB 3.48Å; G340-H344 PolarHBondContact O-N 3.1Å
341	V	90.7	Very high	89	Confident	25 Å²	25	21.8 Å²	21.8	15%	0.152	13%	0.127	C	C	.	.	H	α-helix	trans	-59.3	-46.7	174	160.8	0	0	0	0	112.1	Y287 M294 V298 N337 I338 T343 H344 Y345	Y287-V341 HydrophobicContact CE1-CG2 3.72Å; M294-V341 HydrophobicContact CE-CB 4.29Å; M294-V341 HydrophobicContact CE-CG1 3.63Å; M294-V341 HydrophobicContact CE-CG2 4.05Å; V298-V341 HydrophobicContact CG2-CG2 3.79Å; N337-V341 WeakPolarHBondContact O-CG2 3.35Å; N337-V341 PolarHBondContact O-N 3.31Å; I338-V341 PolarHBondContact O-N 3.2Å; V341-T343 PolarHBondContact O-N 3.21Å; V341-H344 PolarHBondContact O-N 3.16Å; V341-Y345 WeakPolarHBondContact O-CB 3.14Å; V341-Y345 PolarHBondContact O-N 3.49Å
342	C	88.8	Confident	88.4	Confident	41 Å²	41	21 Å²	21	28%	0.277	12%	0.122	S	C	.	.	H	α-helix	trans	-66.6	-20.1	178.4	-72.5	0	0	0	0	113.5	I338 V339 P346 C709 V863	I338-C342 WeakPolarHBondContact O-CB 3.39Å; I338-C342 PolarHBondContact O-N 2.74Å; I338-C342 PolarHBondContact O-SG 2.91Å; I338-C342 VanDerWaalsContact O-SG 3.35Å; V339-C342 PolarHBondContact O-N 3.32Å; C342-P346 WeakPolarHBondContact O-CD 3.32Å; C342-P346 VanDerWaalsContact O-CG 3.26Å; C342-P346 WeakPolarHBondContact O-CG 3.36Å; C342-C709 HydrophobicContact CB-CB 4.26Å; C342-C709 VanDerWaalsContact CB-SG 3.52Å; C342-C709 VanDerWaalsContact SG-SG 3.67Å; C342-V863 HydrophobicContact CB-CG1 4.46Å
343	T	88.5	Confident	87.8	Confident	3 Å²	3	25 Å²	25	2%	0.018	14%	0.141	C	C	.	.	H	α-helix	trans	-89.5	-45.6	174.9	-52.5	0	0	0	0	111.4	T288 V339 G340 V341 S862 L865	T288-T343 HydrophobicContact CG2-CG2 3.79Å; V339-T343 WeakPolarHBondContact O-CB 3.09Å; V339-T343 PolarHBondContact O-N 2.92Å; V339-T343 PolarHBondContact O-OG1 2.85Å; G340-T343 PolarHBondContact O-N 3.1Å; V341-T343 PolarHBondContact O-N 3.21Å; T343-S862 PolarHBondContact OG1-OG 3.2Å; T343-L865 HydrophobicContact CG2-CD2 4.12Å
344	H	87.9	Confident	86.9	Confident	17 Å²	17	25.6 Å²	25.6	8%	0.079	15%	0.146	C	C	.	.	H	α-helix	trans	-72.2	-47.9	-176	-178.4	-87.3	0	0	0	113.5	Y287 V292 M294 G340 V341 A347 E348	Y287-H344 HydrophobicContact CD1-CB 4.34Å; Y287-H344 PolarHBondContact O-CD2 3.07Å; V292-H344 PolarHBondContact O-NE2 3.21Å; V292-H344 VanDerWaalsContact O-NE2 3.14Å; M294-H344 VanDerWaalsContact CA-CE1 3.49Å; M294-H344 WeakPolarHBondContact CA-CE1 3.37Å; M294-H344 PolarHBondContact N-CE1 3.44Å; G340-H344 WeakPolarHBondContact O-CB 3.48Å; G340-H344 PolarHBondContact O-N 3.1Å; V341-H344 PolarHBondContact O-N 3.16Å; H344-A347 PolarHBondContact O-N 2.79Å; H344-A347 VanDerWaalsContact O-N 3.08Å; H344-E348 IonicContact CE1-OE2 2.58Å; H344-E348 PolarHBondContact CE1-OE2 2.9Å; H344-E348 PolarHBondContact O-N 2.88Å
345	Y	85.6	Confident	86.3	Confident	74 Å²	74	23.7 Å²	23.7	29%	0.29	13%	0.132	S	C	.	.	H	α-helix	trans	-62	-42.7	-172.7	173.8	-102.5	0	0	0	113.9	V163 K167 M294 V341 A347 G349	V163-Y345 HydrophobicContact CG1-CD1 4.31Å; V163-Y345 HydrophobicContact CG1-CD2 4.03Å; V163-Y345 HydrophobicContact CG1-CE2 4.27Å; V163-Y345 HydrophobicContact CG1-CG 4.05Å; V163-Y345 HydrophobicContact CG2-CE1 4.16Å; K167-Y345 PolarHBondContact NZ-OH 3.41Å; M294-Y345 HydrophobicContact CE-CD2 4.32Å; M294-Y345 HydrophobicContact CE-CG 4.38Å; M294-Y345 HydrophobicContact SD-CD2 3.77Å; M294-Y345 HydrophobicContact SD-CG 4.34Å; V341-Y345 WeakPolarHBondContact O-CB 3.14Å; V341-Y345 PolarHBondContact O-N 3.49Å; Y345-A347 VanDerWaalsContact C-N 3.31Å; Y345-A347 PolarHBondContact O-N 3.41Å; Y345-G349 PolarHBondContact O-N 2.64Å
346	P	83.7	Confident	85.6	Confident	19 Å²	19	27.8 Å²	27.8	12%	0.123	15%	0.151	C	C	.	.	H	α-helix	trans	-65	-34	173.8	-22.6	35.9	0	0	0	113	C342 G349 S350 R702 L865	C342-P346 WeakPolarHBondContact O-CD 3.32Å; C342-P346 VanDerWaalsContact O-CG 3.26Å; C342-P346 WeakPolarHBondContact O-CG 3.36Å; P346-G349 PolarHBondContact O-N 3.43Å; P346-S350 PolarHBondContact O-N 3.1Å; P346-S350 PolarHBondContact O-OG 3.36Å; P346-R702 PolarHBondContact O-NH1 2.86Å; P346-L865 HydrophobicContact CB-CD1 4Å
347	A	81.3	Confident	84.9	Confident	25 Å²	25	30.3 Å²	30.3	21%	0.207	16%	0.162	C	C	.	.	H	α-helix	trans	-73.1	-47.1	-178.5	0	0	0	0	0	112.9	H344 Y345 G349 S350 Q351	H344-A347 PolarHBondContact O-N 2.79Å; H344-A347 VanDerWaalsContact O-N 3.08Å; Y345-A347 VanDerWaalsContact C-N 3.31Å; Y345-A347 PolarHBondContact O-N 3.41Å; A347-G349 PolarHBondContact O-N 3.19Å; A347-S350 PolarHBondContact O-N 2.63Å; A347-S350 PolarHBondContact O-OG 2.96Å; A347-Q351 WeakPolarHBondContact O-CG 3.38Å; A347-Q351 PolarHBondContact O-N 3.13Å; A347-Q351 VanDerWaalsContact O-N 3.12Å
348	E	83	Confident	84	Confident	19 Å²	19	30.8 Å²	30.8	9%	0.089	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-36.6	169.9	-173.2	178.3	173.4	0	0	109.8	H344 R352	H344-E348 IonicContact CE1-OE2 2.58Å; H344-E348 PolarHBondContact CE1-OE2 2.9Å; H344-E348 PolarHBondContact O-N 2.88Å; E348-R352 HydrophobicContact CG-CG 4.44Å; E348-R352 WeakPolarHBondContact O-CB 3.38Å; E348-R352 WeakPolarHBondContact O-CG 3.37Å; E348-R352 PolarHBondContact O-N 3.24Å; E348-R352 VanDerWaalsContact O-N 3.11Å; E348-R352 IonicContact OE1-CZ 2.9Å; E348-R352 VanDerWaalsContact OE1-CZ 3.3Å; E348-R352 IonicContact OE1-NE 2.96Å; E348-R352 PolarHBondContact OE1-NE 3.48Å; E348-R352 IonicContact OE1-NH2 2.69Å; E348-R352 PolarHBondContact OE1-NH2 3.41Å
349	G	81.1	Confident	83.4	Confident	11 Å²	11	29.3 Å²	29.3	11%	0.113	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-45	176.9	0	0	0	0	0	114.9	Y345 P346 A347 Q353	Y345-G349 PolarHBondContact O-N 2.64Å; P346-G349 PolarHBondContact O-N 3.43Å; A347-G349 PolarHBondContact O-N 3.19Å; G349-Q353 PolarHBondContact O-N 2.86Å
350	S	78.3	Confident	82.8	Confident	40 Å²	40	34 Å²	34	28%	0.28	18%	0.178	S	C	.	.	H	α-helix	trans	-73.8	-41.6	178.3	53.2	0	0	0	0	112.2	P346 A347 R352 Q353 A354	P346-S350 PolarHBondContact O-N 3.1Å; P346-S350 PolarHBondContact O-OG 3.36Å; A347-S350 PolarHBondContact O-N 2.63Å; A347-S350 PolarHBondContact O-OG 2.96Å; S350-R352 VanDerWaalsContact C-N 3.34Å; S350-R352 PolarHBondContact O-N 3.32Å; S350-Q353 WeakPolarHBondContact O-CB 3.48Å; S350-Q353 PolarHBondContact O-N 3.48Å; S350-Q353 VanDerWaalsContact O-N 3.1Å; S350-A354 PolarHBondContact O-N 2.91Å
351	Q	79.1	Confident	81.9	Confident	18 Å²	18	35 Å²	35	8%	0.084	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-37.8	-179.9	-70	174.1	1.2	0	0	112.6	F182 L185 A347 F355	F182-Q351 VanDerWaalsContact CD2-OE1 3.28Å; F182-Q351 VanDerWaalsContact CE2-OE1 3.24Å; L185-Q351 HydrophobicContact CD2-CG 4.48Å; A347-Q351 WeakPolarHBondContact O-CG 3.38Å; A347-Q351 PolarHBondContact O-N 3.13Å; A347-Q351 VanDerWaalsContact O-N 3.12Å; Q351-F355 WeakPolarHBondContact O-CB 3.15Å; Q351-F355 PolarHBondContact O-N 3.07Å; Q351-F355 VanDerWaalsContact O-N 3.16Å
352	R	83.8	Confident	81.1	Confident	15 Å²	15	34.3 Å²	34.3	6%	0.057	18%	0.18	C	C	.	.	H	α-helix	trans	-67.3	-36.4	173.5	-74.6	-178.9	177.7	-88.8	4.2	112.3	K167 F169 E175 Y178 E348 S350 Q356	K167-R352 PolarHBondContact O-NE 3.23Å; K167-R352 PolarHBondContact O-NH1 3.47Å; K167-R352 PolarHBondContact O-NH2 2.96Å; K167-R352 VanDerWaalsContact O-NH2 3.09Å; F169-R352 HydrophobicContact CE2-CG 4.28Å; F169-R352 HydrophobicContact CZ-CB 4.13Å; F169-R352 HydrophobicContact CZ-CG 4.33Å; E175-R352 IonicContact OE1-CZ 3.45Å; E175-R352 IonicContact OE1-NH1 3.18Å; E175-R352 IonicContact OE1-NH2 3.46Å; E175-R352 PolarHBondContact OE1-NH2 2.9Å; E175-R352 IonicContact OE2-CZ 2.67Å; E175-R352 IonicContact OE2-NH1 2.66Å; E175-R352 PolarHBondContact OE2-NH1 2.98Å; E175-R352 IonicContact OE2-NH2 3.54Å; Y178-R352 HydrophobicContact CD1-CG 4.49Å; Y178-R352 HydrophobicContact CD2-CG 4.31Å; Y178-R352 HydrophobicContact CE1-CG 3.86Å; Y178-R352 HydrophobicContact CE2-CB 4.42Å; Y178-R352 HydrophobicContact CE2-CG 3.65Å; Y178-R352 VanDerWaalsContact CZ-CG 3.4Å; E348-R352 HydrophobicContact CG-CG 4.44Å; E348-R352 WeakPolarHBondContact O-CB 3.38Å; E348-R352 WeakPolarHBondContact O-CG 3.37Å; E348-R352 PolarHBondContact O-N 3.24Å; E348-R352 VanDerWaalsContact O-N 3.11Å; E348-R352 IonicContact OE1-CZ 2.9Å; E348-R352 VanDerWaalsContact OE1-CZ 3.3Å; E348-R352 IonicContact OE1-NE 2.96Å; E348-R352 PolarHBondContact OE1-NE 3.48Å; E348-R352 IonicContact OE1-NH2 2.69Å; E348-R352 PolarHBondContact OE1-NH2 3.41Å; S350-R352 VanDerWaalsContact C-N 3.34Å; S350-R352 PolarHBondContact O-N 3.32Å; R352-Q356 PolarHBondContact O-N 2.76Å; R352-Q356 VanDerWaalsContact O-N 3.12Å
353	Q	82.1	Confident	80.7	Confident	86 Å²	86	35.7 Å²	35.7	40%	0.402	18%	0.182	S	C	.	.	H	α-helix	trans	-67.2	-50.2	175.8	178.6	177.3	-10.2	0	0	111.5	G349 S350 F355 Q356 E357	G349-Q353 PolarHBondContact O-N 2.86Å; S350-Q353 WeakPolarHBondContact O-CB 3.48Å; S350-Q353 PolarHBondContact O-N 3.48Å; S350-Q353 VanDerWaalsContact O-N 3.1Å; Q353-F355 VanDerWaalsContact C-N 3.28Å; Q353-F355 PolarHBondContact O-N 2.67Å; Q353-Q356 PolarHBondContact O-N 3.12Å; Q353-E357 HydrophobicContact CG-CG 4.27Å; Q353-E357 WeakPolarHBondContact CG-OE1 3.25Å; Q353-E357 PolarHBondContact NE2-OE1 3.23Å; Q353-E357 WeakPolarHBondContact O-CG 3.46Å; Q353-E357 PolarHBondContact O-N 3.02Å
354	A	76.6	Confident	79.8	Confident	15 Å²	15	38.2 Å²	38.2	12%	0.124	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-39.8	179	0	0	0	0	0	112.2	S350 T358 D956	S350-A354 PolarHBondContact O-N 2.91Å; A354-T358 WeakPolarHBondContact O-CB 3.36Å; A354-T358 PolarHBondContact O-N 3.44Å; A354-T358 PolarHBondContact O-OG1 2.93Å; A354-D956 HydrophobicContact CB-CB 4.32Å; A354-D956 WeakPolarHBondContact CB-OD1 3.2Å
355	F	81.3	Confident	79.1	Confident	8 Å²	8	39.4 Å²	39.4	4%	0.035	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-42.7	173.3	176.3	-100	0	0	0	112.8	F169 L174 L177 Y178 Y181 Q351 Q353 T358 R359 L662 I666	F169-F355 HydrophobicContact CE2-CD1 4.07Å; F169-F355 HydrophobicContact CE2-CE1 4.27Å; F169-F355 AromaticContact CZ-CD1 3.95Å; F169-F355 HydrophobicContact CZ-CD1 3.95Å; F169-F355 HydrophobicContact CZ-CE1 4.44Å; L174-F355 HydrophobicContact CD1-CE1 3.52Å; L174-F355 HydrophobicContact CD1-CZ 3.88Å; L174-F355 HydrophobicContact CG-CE1 4.14Å; L177-F355 HydrophobicContact CB-CZ 4.27Å; L177-F355 HydrophobicContact CD2-CZ 4.34Å; L177-F355 HydrophobicContact CG-CZ 4.3Å; Y178-F355 HydrophobicContact CD2-CB 4.07Å; Y178-F355 AromaticContact CD2-CD1 3.84Å; Y178-F355 HydrophobicContact CD2-CD1 3.84Å; Y178-F355 HydrophobicContact CD2-CD2 4.36Å; Y178-F355 HydrophobicContact CD2-CE1 4.36Å; Y178-F355 AromaticContact CD2-CG 3.84Å; Y178-F355 HydrophobicContact CD2-CG 3.84Å; Y178-F355 HydrophobicContact CE2-CB 4.49Å; Y178-F355 HydrophobicContact CG-CD1 4.37Å; Y178-F355 HydrophobicContact CG-CE1 4.48Å; Y181-F355 HydrophobicContact CD1-CB 4.25Å; Y181-F355 AromaticContact CD1-CD2 3.6Å; Y181-F355 HydrophobicContact CD1-CD2 3.6Å; Y181-F355 HydrophobicContact CD1-CE2 4.32Å; Y181-F355 HydrophobicContact CD1-CG 4.2Å; Y181-F355 HydrophobicContact CE1-CB 4.15Å; Y181-F355 HydrophobicContact CE1-CD2 4.21Å; Y181-F355 HydrophobicContact CG-CD2 4.09Å; Y181-F355 HydrophobicContact CG-CE2 4.47Å; Q351-F355 WeakPolarHBondContact O-CB 3.15Å; Q351-F355 PolarHBondContact O-N 3.07Å; Q351-F355 VanDerWaalsContact O-N 3.16Å; Q353-F355 VanDerWaalsContact C-N 3.28Å; Q353-F355 PolarHBondContact O-N 2.67Å; F355-T358 PolarHBondContact O-N 3.02Å; F355-R359 PolarHBondContact O-N 2.92Å; F355-L662 HydrophobicContact CE2-CD2 4.1Å; F355-L662 HydrophobicContact CZ-CD2 4.11Å; F355-I666 HydrophobicContact CE2-CD1 4.25Å
356	Q	81.6	Confident	78.5	Confident	88 Å²	88	37.2 Å²	37.2	41%	0.411	20%	0.2	S	C	.	.	H	α-helix	trans	-67.9	-46.6	177.3	-179.6	173	-21.6	0	0	112.1	F169 R352 Q353 T358 R359 E360	F169-Q356 HydrophobicContact CE1-CB 4.48Å; R352-Q356 PolarHBondContact O-N 2.76Å; R352-Q356 VanDerWaalsContact O-N 3.12Å; Q353-Q356 PolarHBondContact O-N 3.12Å; Q356-T358 PolarHBondContact O-N 3.49Å; Q356-R359 PolarHBondContact O-N 3.17Å; Q356-R359 VanDerWaalsContact O-N 3.09Å; Q356-E360 HydrophobicContact CG-CG 4.44Å; Q356-E360 VanDerWaalsContact CG-OE1 3.3Å; Q356-E360 WeakPolarHBondContact CG-OE1 3.28Å; Q356-E360 PolarHBondContact NE2-OE1 3.1Å; Q356-E360 WeakPolarHBondContact O-CG 3.15Å; Q356-E360 PolarHBondContact O-N 2.95Å
357	E	77.8	Confident	77.8	Confident	56 Å²	56	41.2 Å²	41.2	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-58	-38.8	175.5	-68.8	177.3	-179.8	0	0	111.4	Q353 E360 C361 K960	Q353-E357 HydrophobicContact CG-CG 4.27Å; Q353-E357 WeakPolarHBondContact CG-OE1 3.25Å; Q353-E357 PolarHBondContact NE2-OE1 3.23Å; Q353-E357 WeakPolarHBondContact O-CG 3.46Å; Q353-E357 PolarHBondContact O-N 3.02Å; E357-E360 PolarHBondContact O-N 2.67Å; E357-C361 WeakPolarHBondContact O-CB 3.37Å; E357-C361 PolarHBondContact O-N 3.32Å; E357-K960 IonicContact OE1-NZ 3.31Å; E357-K960 PolarHBondContact OE1-NZ 3.46Å; E357-K960 IonicContact OE2-NZ 2.67Å; E357-K960 PolarHBondContact OE2-NZ 3.47Å
358	T	75.8	Confident	77	Confident	25 Å²	25	40 Å²	40	15%	0.153	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-41.7	174.8	-57.5	0	0	0	0	112	A354 F355 Q356 I362	A354-T358 WeakPolarHBondContact O-CB 3.36Å; A354-T358 PolarHBondContact O-N 3.44Å; A354-T358 PolarHBondContact O-OG1 2.93Å; F355-T358 PolarHBondContact O-N 3.02Å; Q356-T358 PolarHBondContact O-N 3.49Å; T358-I362 HydrophobicContact CG2-CD1 3.97Å; T358-I362 WeakPolarHBondContact O-CG1 3.24Å; T358-I362 PolarHBondContact O-N 2.95Å
359	R	81.1	Confident	76.2	Confident	28 Å²	28	43.9 Å²	43.9	11%	0.106	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-44.2	175.4	-177.1	179.6	-173.6	-102.5	9.3	111.7	F355 Q356 C361 I362 Q363 V658 D659 L662	F355-R359 PolarHBondContact O-N 2.92Å; Q356-R359 PolarHBondContact O-N 3.17Å; Q356-R359 VanDerWaalsContact O-N 3.09Å; R359-C361 VanDerWaalsContact C-N 3.35Å; R359-I362 PolarHBondContact O-N 3.02Å; R359-Q363 VanDerWaalsContact O-CB 3.27Å; R359-Q363 WeakPolarHBondContact O-CB 3.24Å; R359-Q363 PolarHBondContact O-N 3.2Å; R359-V658 HydrophobicContact CG-CG1 4Å; R359-D659 IonicContact CZ-OD1 2.8Å; R359-D659 IonicContact NE-OD1 2.78Å; R359-D659 PolarHBondContact NE-OD1 2.94Å; R359-D659 IonicContact NH2-OD1 3.02Å; R359-D659 PolarHBondContact NH2-OD1 3.16Å; R359-D659 IonicContact NH2-OD2 2.81Å; R359-L662 HydrophobicContact CB-CD2 3.97Å; R359-L662 HydrophobicContact CG-CD2 4.07Å
360	E	78.8	Confident	75.6	Confident	101 Å²	101	47.7 Å²	47.7	47%	0.472	24%	0.236	S	C	.	.	H	α-helix	trans	-64	-39.4	179	-72.2	175.5	-163.9	0	0	111.6	Q356 E357 Q363 A364	Q356-E360 HydrophobicContact CG-CG 4.44Å; Q356-E360 VanDerWaalsContact CG-OE1 3.3Å; Q356-E360 WeakPolarHBondContact CG-OE1 3.28Å; Q356-E360 PolarHBondContact NE2-OE1 3.1Å; Q356-E360 WeakPolarHBondContact O-CG 3.15Å; Q356-E360 PolarHBondContact O-N 2.95Å; E357-E360 PolarHBondContact O-N 2.67Å; E360-Q363 PolarHBondContact O-N 3.47Å; E360-A364 WeakPolarHBondContact O-CB 3.41Å; E360-A364 PolarHBondContact O-N 3.5Å
361	C	73.1	Confident	74.8	Confident	20 Å²	20	48.7 Å²	48.7	14%	0.135	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-52.3	170.2	176.8	0	0	0	0	111.9	E357 R359 Q363 A364 R365 A963	E357-C361 WeakPolarHBondContact O-CB 3.37Å; E357-C361 PolarHBondContact O-N 3.32Å; R359-C361 VanDerWaalsContact C-N 3.35Å; C361-Q363 VanDerWaalsContact C-N 3.3Å; C361-Q363 PolarHBondContact O-N 3.43Å; C361-A364 PolarHBondContact O-N 3.45Å; C361-R365 WeakPolarHBondContact O-CB 3.44Å; C361-R365 PolarHBondContact O-N 3.02Å; C361-A963 HydrophobicContact CB-CB 3.9Å; C361-A963 PolarHBondContact SG-O 3.31Å
362	I	73.9	Confident	74	Confident	11 Å²	11	48.8 Å²	48.8	6%	0.056	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-37.4	179.7	-71.7	167.1	0	0	0	111.6	T358 R359 R365 L366 F661 L662	T358-I362 HydrophobicContact CG2-CD1 3.97Å; T358-I362 WeakPolarHBondContact O-CG1 3.24Å; T358-I362 PolarHBondContact O-N 2.95Å; R359-I362 PolarHBondContact O-N 3.02Å; I362-R365 PolarHBondContact O-N 2.9Å; I362-L366 HydrophobicContact CG2-CD1 3.9Å; I362-L366 HydrophobicContact CG2-CG 4.46Å; I362-L366 WeakPolarHBondContact O-CB 3.43Å; I362-L366 WeakPolarHBondContact O-CG 3.35Å; I362-L366 PolarHBondContact O-N 3.42Å; I362-F661 HydrophobicContact CG2-CD1 3.83Å; I362-F661 HydrophobicContact CG2-CE1 4.38Å; I362-L662 HydrophobicContact CD1-CD1 3.94Å
363	Q	80.1	Confident	72.9	Confident	71 Å²	71	52.7 Å²	52.7	33%	0.332	26%	0.256	S	S	.	.	H	α-helix	trans	-64.1	-48.1	175	-179.1	168.9	-3.9	0	0	111.7	R359 E360 C361 R365 L366 H367 V658	R359-Q363 VanDerWaalsContact O-CB 3.27Å; R359-Q363 WeakPolarHBondContact O-CB 3.24Å; R359-Q363 PolarHBondContact O-N 3.2Å; E360-Q363 PolarHBondContact O-N 3.47Å; C361-Q363 VanDerWaalsContact C-N 3.3Å; C361-Q363 PolarHBondContact O-N 3.43Å; Q363-R365 VanDerWaalsContact C-N 3.31Å; Q363-R365 PolarHBondContact O-N 2.93Å; Q363-L366 PolarHBondContact O-N 3.31Å; Q363-H367 VanDerWaalsContact O-CB 3.27Å; Q363-H367 WeakPolarHBondContact O-CB 3.46Å; Q363-H367 PolarHBondContact O-N 3.02Å; Q363-V658 HydrophobicContact CB-CG1 4.14Å; Q363-V658 HydrophobicContact CB-CG2 4.04Å; Q363-V658 HydrophobicContact CG-CG2 4.11Å
364	A	71	Confident	71.8	Confident	55 Å²	55	53 Å²	53	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-39.6	174.9	0	0	0	0	0	111.8	E360 C361 S368	E360-A364 WeakPolarHBondContact O-CB 3.41Å; E360-A364 PolarHBondContact O-N 3.5Å; C361-A364 PolarHBondContact O-N 3.45Å; A364-S368 VanDerWaalsContact O-CB 3.3Å; A364-S368 WeakPolarHBondContact O-CB 3.41Å; A364-S368 PolarHBondContact O-N 2.93Å
365	R	73	Confident	71	Confident	43 Å²	43	56 Å²	56	16%	0.162	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-46.9	178.1	-161	-173.3	74	-176	2.5	112	C361 I362 Q363 Q369 F661 E966 M970	C361-R365 WeakPolarHBondContact O-CB 3.44Å; C361-R365 PolarHBondContact O-N 3.02Å; I362-R365 PolarHBondContact O-N 2.9Å; Q363-R365 VanDerWaalsContact C-N 3.31Å; Q363-R365 PolarHBondContact O-N 2.93Å; R365-Q369 WeakPolarHBondContact O-CB 3.15Å; R365-Q369 WeakPolarHBondContact O-CG 3.4Å; R365-Q369 PolarHBondContact O-N 3.24Å; R365-F661 VanDerWaalsContact NH2-CE1 3.27Å; R365-F661 VanDerWaalsContact NH2-CZ 3.26Å; R365-E966 WeakPolarHBondContact CD-OE2 3.42Å; R365-E966 IonicContact CZ-OE2 2.95Å; R365-E966 IonicContact NE-OE2 2.65Å; R365-E966 IonicContact NH1-OE1 3.37Å; R365-E966 IonicContact NH1-OE2 3.84Å; R365-E966 PolarHBondContact NH1-OE2 3.43Å; R365-M970 HydrophobicContact CB-CE 4.48Å; R365-M970 HydrophobicContact CG-CE 3.62Å
366	L	71.5	Confident	69.8	Low	28 Å²	28	56.9 Å²	56.9	15%	0.147	27%	0.273	C	S	.	.	H	α-helix	trans	-67.6	-40.6	177.3	-74.6	170	0	0	0	112	I362 Q363 Q369 R370 V658 F661	I362-L366 HydrophobicContact CG2-CD1 3.9Å; I362-L366 HydrophobicContact CG2-CG 4.46Å; I362-L366 WeakPolarHBondContact O-CB 3.43Å; I362-L366 WeakPolarHBondContact O-CG 3.35Å; I362-L366 PolarHBondContact O-N 3.42Å; Q363-L366 PolarHBondContact O-N 3.31Å; L366-Q369 PolarHBondContact O-N 2.67Å; L366-R370 WeakPolarHBondContact O-CB 3.47Å; L366-R370 PolarHBondContact O-N 2.88Å; L366-V658 HydrophobicContact CD1-CG2 3.94Å; L366-F661 HydrophobicContact CD1-CB 4.06Å; L366-F661 HydrophobicContact CD1-CD1 4.48Å; L366-F661 HydrophobicContact CD1-CG 4.16Å
367	H	70.8	Confident	68.8	Low	102 Å²	102	56.3 Å²	56.3	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-52.8	173.5	-169.6	-76.2	0	0	0	110.9	Q363 Q369 R370 E371	Q363-H367 VanDerWaalsContact O-CB 3.27Å; Q363-H367 WeakPolarHBondContact O-CB 3.46Å; Q363-H367 PolarHBondContact O-N 3.02Å; H367-Q369 PolarHBondContact O-N 3.24Å; H367-R370 WeakPolarHBondContact O-CB 3.33Å; H367-R370 PolarHBondContact O-N 3.14Å; H367-R370 VanDerWaalsContact O-N 3.11Å; H367-E371 IonicContact CE1-OE1 3.57Å; H367-E371 IonicContact CE1-OE2 2.69Å; H367-E371 PolarHBondContact CE1-OE2 2.95Å; H367-E371 IonicContact CG-OE2 2.67Å; H367-E371 IonicContact ND1-OE1 2.96Å; H367-E371 IonicContact ND1-OE2 2.63Å; H367-E371 PolarHBondContact ND1-OE2 3.41Å; H367-E371 PolarHBondContact O-N 3.13Å
368	S	64.1	Low	68.1	Low	0 Å²	0	62.2 Å²	62.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-70.5	-31.3	-178.5	-168	0	0	0	0	113.1	A364 R370 N372 M970 Q974	A364-S368 VanDerWaalsContact O-CB 3.3Å; A364-S368 WeakPolarHBondContact O-CB 3.41Å; A364-S368 PolarHBondContact O-N 2.93Å; S368-R370 VanDerWaalsContact C-N 3.32Å; S368-N372 WeakPolarHBondContact O-CB 3.43Å; S368-N372 PolarHBondContact O-N 2.97Å; S368-N372 PolarHBondContact O-ND2 3.5Å; S368-N372 PolarHBondContact OG-ND2 3.34Å; S368-M970 WeakPolarHBondContact CB-SD 3.39Å; S368-M970 WeakPolarHBondContact OG-CG 3.36Å; S368-M970 PolarHBondContact OG-SD 3.3Å; S368-Q974 WeakPolarHBondContact OG-CG 3.49Å; S368-Q974 PolarHBondContact OG-NE2 3.43Å
369	Q	65.2	Low	67.4	Low	100 Å²	100	63.5 Å²	63.5	47%	0.467	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-40.3	169.2	-81.2	-172.3	-63.4	0	0	111.2	R365 L366 H367 Q373 M970	R365-Q369 WeakPolarHBondContact O-CB 3.15Å; R365-Q369 WeakPolarHBondContact O-CG 3.4Å; R365-Q369 PolarHBondContact O-N 3.24Å; L366-Q369 PolarHBondContact O-N 2.67Å; H367-Q369 PolarHBondContact O-N 3.24Å; Q369-Q373 VanDerWaalsContact O-CB 3.25Å; Q369-Q373 WeakPolarHBondContact O-CB 3.46Å; Q369-Q373 PolarHBondContact O-N 2.86Å; Q369-M970 HydrophobicContact CG-CE 4.23Å
370	R	68.3	Low	66.5	Low	92 Å²	92	63 Å²	63	35%	0.347	30%	0.296	S	S	.	.	H	α-helix	trans	-66.1	-47.1	176.7	-167	-172.4	-65.8	166.3	-4.6	111.5	L366 H367 S368 Q374 E657	L366-R370 WeakPolarHBondContact O-CB 3.47Å; L366-R370 PolarHBondContact O-N 2.88Å; H367-R370 WeakPolarHBondContact O-CB 3.33Å; H367-R370 PolarHBondContact O-N 3.14Å; H367-R370 VanDerWaalsContact O-N 3.11Å; S368-R370 VanDerWaalsContact C-N 3.32Å; R370-Q374 HydrophobicContact CG-CG 4.41Å; R370-Q374 VanDerWaalsContact O-CB 3.25Å; R370-Q374 WeakPolarHBondContact O-CB 3.46Å; R370-Q374 VanDerWaalsContact O-CG 3.29Å; R370-Q374 WeakPolarHBondContact O-CG 3.2Å; R370-Q374 PolarHBondContact O-N 3.19Å; R370-E657 IonicContact CZ-OE2 2.97Å; R370-E657 IonicContact NH2-OE2 3.3Å; R370-E657 PolarHBondContact NH2-OE2 3.36Å
371	E	62.1	Low	65.9	Low	61 Å²	61	61.1 Å²	61.1	29%	0.285	29%	0.289	S	S	.	.	H	α-helix	trans	-57.5	-54.7	173.5	-71.6	174.1	115.3	0	0	111	H367 Q373 Q374 Q375	H367-E371 IonicContact CE1-OE1 3.57Å; H367-E371 IonicContact CE1-OE2 2.69Å; H367-E371 PolarHBondContact CE1-OE2 2.95Å; H367-E371 IonicContact CG-OE2 2.67Å; H367-E371 IonicContact ND1-OE1 2.96Å; H367-E371 IonicContact ND1-OE2 2.63Å; H367-E371 PolarHBondContact ND1-OE2 3.41Å; H367-E371 PolarHBondContact O-N 3.13Å; E371-Q373 PolarHBondContact O-N 3.43Å; E371-Q374 PolarHBondContact O-N 3.13Å; E371-Q375 WeakPolarHBondContact O-CB 3.26Å; E371-Q375 WeakPolarHBondContact O-CG 3.38Å; E371-Q375 PolarHBondContact O-N 2.95Å
372	N	61.7	Low	65.5	Low	19 Å²	19	60.8 Å²	60.8	10%	0.102	29%	0.286	C	S	.	.	I	π-helix	trans	-60.2	-48.1	-178	-70	-29	0	0	0	111.3	S368 Q376 L973 N977	S368-N372 WeakPolarHBondContact O-CB 3.43Å; S368-N372 PolarHBondContact O-N 2.97Å; S368-N372 PolarHBondContact O-ND2 3.5Å; S368-N372 PolarHBondContact OG-ND2 3.34Å; N372-Q376 WeakPolarHBondContact O-CA 3.34Å; N372-Q376 WeakPolarHBondContact O-CB 3.32Å; N372-Q376 PolarHBondContact O-N 2.94Å; N372-L973 WeakPolarHBondContact ND2-CD2 3.3Å; N372-N977 PolarHBondContact OD1-ND2 2.75Å
373	Q	61.6	Low	65.1	Low	97 Å²	97	61.5 Å²	61.5	45%	0.453	29%	0.291	S	S	.	.	I	π-helix	trans	-69.8	-40.8	-178.5	-166	177.1	37	0	0	112.6	Q369 E371	Q369-Q373 VanDerWaalsContact O-CB 3.25Å; Q369-Q373 WeakPolarHBondContact O-CB 3.46Å; Q369-Q373 PolarHBondContact O-N 2.86Å; E371-Q373 PolarHBondContact O-N 3.43Å
374	Q	59.5	Low	64.7	Low	94 Å²	94	58.2 Å²	58.2	44%	0.439	28%	0.276	S	S	.	.	I	π-helix	trans	-75.7	-38.3	-179.4	-67	-171.5	5.5	0	0	112.9	R370 E371 R378	R370-Q374 HydrophobicContact CG-CG 4.41Å; R370-Q374 VanDerWaalsContact O-CB 3.25Å; R370-Q374 WeakPolarHBondContact O-CB 3.46Å; R370-Q374 VanDerWaalsContact O-CG 3.29Å; R370-Q374 WeakPolarHBondContact O-CG 3.2Å; R370-Q374 PolarHBondContact O-N 3.19Å; E371-Q374 PolarHBondContact O-N 3.13Å; Q374-R378 VanDerWaalsContact O-CB 3.29Å; Q374-R378 WeakPolarHBondContact O-CB 3.49Å; Q374-R378 VanDerWaalsContact O-CD 3.24Å; Q374-R378 WeakPolarHBondContact O-CD 3.48Å; Q374-R378 WeakPolarHBondContact O-CG 3.43Å
375	Q	58.6	Low	64.7	Low	78 Å²	78	56.4 Å²	56.4	36%	0.364	26%	0.259	S	S	.	.	I	π-helix	trans	-85.7	-50.1	-177.8	-60.8	179.6	3.1	0	0	111.8	E371 E377 R378 L379	E371-Q375 WeakPolarHBondContact O-CB 3.26Å; E371-Q375 WeakPolarHBondContact O-CG 3.38Å; E371-Q375 PolarHBondContact O-N 2.95Å; Q375-E377 PolarHBondContact O-N 3.43Å; Q375-R378 PolarHBondContact O-N 2.95Å; Q375-L379 HydrophobicContact CB-CD1 4.08Å; Q375-L379 VanDerWaalsContact O-CB 3.24Å; Q375-L379 WeakPolarHBondContact O-CB 3.22Å; Q375-L379 WeakPolarHBondContact O-CD1 3.23Å; Q375-L379 VanDerWaalsContact O-CG 3.28Å; Q375-L379 WeakPolarHBondContact O-CG 3.49Å; Q375-L379 PolarHBondContact O-N 3.05Å
376	Q	56.5	Low	64.5	Low	26 Å²	26	60.5 Å²	60.5	12%	0.121	28%	0.275	C	S	.	.	I	π-helix	trans	-62.4	-47.7	-173.3	-164.1	-162.1	38.5	0	0	111.5	N372 L380 N977 L980	N372-Q376 WeakPolarHBondContact O-CA 3.34Å; N372-Q376 WeakPolarHBondContact O-CB 3.32Å; N372-Q376 PolarHBondContact O-N 2.94Å; Q376-L380 WeakPolarHBondContact O-CB 3.27Å; Q376-L380 PolarHBondContact O-N 2.96Å; Q376-N977 PolarHBondContact NE2-OD1 3.18Å; Q376-L980 HydrophobicContact CG-CD2 4.24Å
377	E	61	Low	64.5	Low	76 Å²	76	62 Å²	62	36%	0.355	28%	0.281	S	S	.	.	H	α-helix	trans	-68.8	-43.1	-179.8	-63.1	-160.9	154.3	0	0	112	Q375 L381	Q375-E377 PolarHBondContact O-N 3.43Å; E377-L381 HydrophobicContact CB-CD1 4.46Å; E377-L381 WeakPolarHBondContact O-CB 3.49Å; E377-L381 WeakPolarHBondContact O-CD1 3.3Å; E377-L381 WeakPolarHBondContact O-CG 3.26Å; E377-L381 PolarHBondContact O-N 3.38Å
378	R	63	Low	64.6	Low	179 Å²	179	57.4 Å²	57.4	68%	0.675	26%	0.26	S	S	*	.	H	α-helix	trans	-63.7	-45.2	178	-71.5	-177.9	177.8	162.9	-2	112	Q374 Q375 S382	Q374-R378 VanDerWaalsContact O-CB 3.29Å; Q374-R378 WeakPolarHBondContact O-CB 3.49Å; Q374-R378 VanDerWaalsContact O-CD 3.24Å; Q374-R378 WeakPolarHBondContact O-CD 3.48Å; Q374-R378 WeakPolarHBondContact O-CG 3.43Å; Q375-R378 PolarHBondContact O-N 2.95Å; R378-S382 WeakPolarHBondContact O-CB 3.48Å; R378-S382 PolarHBondContact O-N 3.44Å; R378-S382 PolarHBondContact O-OG 3.47Å
379	L	60.9	Low	65	Low	52 Å²	52	57.5 Å²	57.5	27%	0.272	26%	0.261	S	S	.	.	H	α-helix	trans	-71.6	-44.9	-177.4	-68.5	162.6	0	0	0	111.4	Q375 L381 S382 V383 L981	Q375-L379 HydrophobicContact CB-CD1 4.08Å; Q375-L379 VanDerWaalsContact O-CB 3.24Å; Q375-L379 WeakPolarHBondContact O-CB 3.22Å; Q375-L379 WeakPolarHBondContact O-CD1 3.23Å; Q375-L379 VanDerWaalsContact O-CG 3.28Å; Q375-L379 WeakPolarHBondContact O-CG 3.49Å; Q375-L379 PolarHBondContact O-N 3.05Å; L379-L381 PolarHBondContact O-N 3.02Å; L379-S382 PolarHBondContact O-N 3.27Å; L379-S382 PolarHBondContact O-OG 2.9Å; L379-V383 PolarHBondContact O-N 2.92Å; L379-L981 HydrophobicContact CD1-CD1 4.08Å; L379-L981 HydrophobicContact CD1-CD2 4.45Å
380	L	62.8	Low	65.2	Low	18 Å²	18	57.4 Å²	57.4	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-44.8	178.7	-172.6	65.2	0	0	0	111.8	Q376 S382 V383 L384 A389 L980	Q376-L380 WeakPolarHBondContact O-CB 3.27Å; Q376-L380 PolarHBondContact O-N 2.96Å; L380-S382 VanDerWaalsContact C-N 3.28Å; L380-S382 PolarHBondContact O-N 3.1Å; L380-V383 PolarHBondContact O-N 3.16Å; L380-L384 HydrophobicContact CD1-CD1 4.04Å; L380-L384 PolarHBondContact O-N 3.22Å; L380-A389 HydrophobicContact CD2-CB 4.04Å; L380-A389 HydrophobicContact CG-CB 3.89Å; L380-L980 HydrophobicContact CD1-CD1 4.5Å; L380-L980 HydrophobicContact CD1-CD2 4.43Å
381	L	64.7	Low	65.6	Low	62 Å²	62	56.6 Å²	56.6	33%	0.325	26%	0.262	S	S	.	.	H	α-helix	trans	-74.6	-14.4	178.4	-60.2	174.2	0	0	0	113.7	E377 L379 R386 A389	E377-L381 HydrophobicContact CB-CD1 4.46Å; E377-L381 WeakPolarHBondContact O-CB 3.49Å; E377-L381 WeakPolarHBondContact O-CD1 3.3Å; E377-L381 WeakPolarHBondContact O-CG 3.26Å; E377-L381 PolarHBondContact O-N 3.38Å; L379-L381 PolarHBondContact O-N 3.02Å; L381-R386 HydrophobicContact CD2-CB 3.8Å; L381-R386 HydrophobicContact CD2-CG 3.81Å; L381-A389 HydrophobicContact CD2-CB 3.83Å
382	S	64.6	Low	66	Low	13 Å²	13	54 Å²	54	9%	0.091	25%	0.249	C	C	.	.	H	α-helix	trans	-75.6	-29.5	171.8	74.5	0	0	0	0	112.4	R378 L379 L380 R1133 K1134	R378-S382 WeakPolarHBondContact O-CB 3.48Å; R378-S382 PolarHBondContact O-N 3.44Å; R378-S382 PolarHBondContact O-OG 3.47Å; L379-S382 PolarHBondContact O-N 3.27Å; L379-S382 PolarHBondContact O-OG 2.9Å; L380-S382 VanDerWaalsContact C-N 3.28Å; L380-S382 PolarHBondContact O-N 3.1Å; S382-R1133 VanDerWaalsContact CB-O 3.29Å; S382-R1133 WeakPolarHBondContact CB-O 3.14Å; S382-K1134 VanDerWaalsContact O-CD 3.25Å; S382-K1134 WeakPolarHBondContact O-CD 3.34Å; S382-K1134 WeakPolarHBondContact O-CG 3.32Å
383	V	65.8	Low	66.3	Low	25 Å²	25	55.4 Å²	55.4	15%	0.152	26%	0.255	C	S	.	.	H	α-helix	trans	-98	-42.4	-178.2	-178.3	0	0	0	0	111.9	L379 L380 W528 I984	L379-V383 PolarHBondContact O-N 2.92Å; L380-V383 PolarHBondContact O-N 3.16Å; V383-W528 VanDerWaalsContact CG1-O 3.23Å; V383-W528 WeakPolarHBondContact CG1-O 3.39Å; V383-I984 HydrophobicContact CG2-CD1 3.95Å; V383-I984 HydrophobicContact CG2-CG1 4.18Å; V383-I984 HydrophobicContact CG2-CG2 3.6Å
384	L	71.8	Confident	66.7	Low	3 Å²	3	53.6 Å²	53.6	2%	0.016	26%	0.257	C	S	.	.	S	Bend	trans	-116.3	138.7	-173.1	-60.7	-178.1	0	0	0	111.8	L380 A389 M392 V522 F530	L380-L384 HydrophobicContact CD1-CD1 4.04Å; L380-L384 PolarHBondContact O-N 3.22Å; L384-A389 HydrophobicContact CB-CB 4.1Å; L384-M392 HydrophobicContact CD1-SD 3.54Å; L384-M392 VanDerWaalsContact CD1-SD 3.54Å; L384-V522 HydrophobicContact CD2-CG2 3.54Å; L384-F530 HydrophobicContact CD2-CB 4.26Å
385	P	71.1	Confident	67.1	Low	16 Å²	16	51.6 Å²	51.6	10%	0.104	25%	0.249	C	C	.	.			trans	-56.4	145.9	170.5	-25.6	35.7	0	0	0	112.2	H387 V388 A389 F530	P385-H387 VanDerWaalsContact C-N 3.26Å; P385-H387 VanDerWaalsContact CB-CE1 3.44Å; P385-H387 WeakPolarHBondContact CB-CE1 3.15Å; P385-H387 PolarHBondContact O-N 2.8Å; P385-H387 VanDerWaalsContact O-N 3.08Å; P385-V388 HydrophobicContact CB-CG2 4.48Å; P385-V388 PolarHBondContact O-N 3.08Å; P385-V388 VanDerWaalsContact O-N 3.13Å; P385-A389 WeakPolarHBondContact O-CB 3.46Å; P385-A389 PolarHBondContact O-N 2.93Å; P385-F530 HydrophobicContact CG-CB 4.31Å; P385-F530 HydrophobicContact CG-CD1 3.81Å; P385-F530 HydrophobicContact CG-CD2 3.67Å; P385-F530 HydrophobicContact CG-CE1 3.92Å; P385-F530 HydrophobicContact CG-CE2 3.78Å; P385-F530 HydrophobicContact CG-CG 3.66Å; P385-F530 HydrophobicContact CG-CZ 3.88Å
386	R	69.8	Low	67.5	Low	129 Å²	129	50.3 Å²	50.3	49%	0.487	24%	0.244	S	C	.	.	H	α-helix	trans	-56	-32.7	-169.4	-173.4	169.4	-175.5	154.7	6	115	L381 M390	L381-R386 HydrophobicContact CD2-CB 3.8Å; L381-R386 HydrophobicContact CD2-CG 3.81Å; R386-M390 HydrophobicContact CG-CG 4.27Å; R386-M390 WeakPolarHBondContact O-CB 2.87Å; R386-M390 WeakPolarHBondContact O-CG 3.16Å; R386-M390 PolarHBondContact O-N 3.14Å; R386-M390 VanDerWaalsContact O-N 3.14Å
387	H	70.9	Confident	67.8	Low	61 Å²	61	53.6 Å²	53.6	28%	0.282	26%	0.262	S	S	.	.	H	α-helix	trans	-68.5	-53.2	177.4	55.7	-86.1	0	0	0	111	P385 A389 M390 E391 P475	P385-H387 VanDerWaalsContact C-N 3.26Å; P385-H387 VanDerWaalsContact CB-CE1 3.44Å; P385-H387 WeakPolarHBondContact CB-CE1 3.15Å; P385-H387 PolarHBondContact O-N 2.8Å; P385-H387 VanDerWaalsContact O-N 3.08Å; H387-A389 VanDerWaalsContact C-N 3.34Å; H387-A389 PolarHBondContact O-N 3.29Å; H387-M390 PolarHBondContact O-N 3.34Å; H387-E391 PolarHBondContact O-N 2.99Å; H387-P475 VanDerWaalsContact CE1-CB 3.48Å; H387-P475 WeakPolarHBondContact CE1-CB 3.25Å
388	V	73.3	Confident	67.9	Low	5 Å²	5	53.7 Å²	53.7	3%	0.03	28%	0.276	C	S	.	.	H	α-helix	trans	-58.1	-46.4	176	-165.6	0	0	0	0	111	P385 M390 E391 M392 Y409 V522 F530	P385-V388 HydrophobicContact CB-CG2 4.48Å; P385-V388 PolarHBondContact O-N 3.08Å; P385-V388 VanDerWaalsContact O-N 3.13Å; V388-M390 VanDerWaalsContact C-N 3.29Å; V388-M390 PolarHBondContact O-N 2.65Å; V388-E391 PolarHBondContact O-N 3.44Å; V388-M392 HydrophobicContact CG1-CG 4.11Å; V388-M392 HydrophobicContact CG1-SD 3.8Å; V388-M392 WeakPolarHBondContact O-CB 3.31Å; V388-M392 WeakPolarHBondContact O-CG 3.3Å; V388-M392 PolarHBondContact O-N 2.9Å; V388-Y409 HydrophobicContact CG1-CG 4.46Å; V388-V522 HydrophobicContact CG1-CG2 4.07Å; V388-F530 HydrophobicContact CG2-CD2 4.29Å; V388-F530 HydrophobicContact CG2-CE2 4.2Å
389	A	72	Confident	67.4	Low	1 Å²	1	53.9 Å²	53.9	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-57.2	-39.9	179.8	0	0	0	0	0	113.2	L380 L381 L384 P385 H387 K393	L380-A389 HydrophobicContact CD2-CB 4.04Å; L380-A389 HydrophobicContact CG-CB 3.89Å; L381-A389 HydrophobicContact CD2-CB 3.83Å; L384-A389 HydrophobicContact CB-CB 4.1Å; P385-A389 WeakPolarHBondContact O-CB 3.46Å; P385-A389 PolarHBondContact O-N 2.93Å; H387-A389 VanDerWaalsContact C-N 3.34Å; H387-A389 PolarHBondContact O-N 3.29Å; A389-K393 WeakPolarHBondContact O-CB 3.17Å; A389-K393 PolarHBondContact O-N 3.46Å; A389-K393 VanDerWaalsContact O-N 3.16Å
390	M	69.9	Low	66.8	Low	99 Å²	99	57.3 Å²	57.3	49%	0.488	30%	0.296	S	S	.	.	H	α-helix	trans	-77.9	-35.5	179.5	-69.9	-66.8	-62.6	0	0	112.4	R386 H387 V388 A394	R386-M390 HydrophobicContact CG-CG 4.27Å; R386-M390 WeakPolarHBondContact O-CB 2.87Å; R386-M390 WeakPolarHBondContact O-CG 3.16Å; R386-M390 PolarHBondContact O-N 3.14Å; R386-M390 VanDerWaalsContact O-N 3.14Å; H387-M390 PolarHBondContact O-N 3.34Å; V388-M390 VanDerWaalsContact C-N 3.29Å; V388-M390 PolarHBondContact O-N 2.65Å; M390-A394 PolarHBondContact O-N 3.29Å; M390-A394 VanDerWaalsContact O-N 3.08Å
391	E	75.2	Confident	66.1	Low	75 Å²	75	64.3 Å²	64.3	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-64.4	-55.2	174.6	-165.4	-174	161.1	0	0	110.6	H387 V388 K393 A394 D395 K407 Y409	H387-E391 PolarHBondContact O-N 2.99Å; V388-E391 PolarHBondContact O-N 3.44Å; E391-K393 VanDerWaalsContact C-N 3.25Å; E391-K393 PolarHBondContact O-N 3.33Å; E391-A394 WeakPolarHBondContact O-CA 3.12Å; E391-A394 WeakPolarHBondContact O-CB 3.12Å; E391-A394 PolarHBondContact O-N 3.29Å; E391-D395 PolarHBondContact O-N 2.79Å; E391-K407 WeakPolarHBondContact OE1-CE 3.29Å; E391-K407 IonicContact OE1-NZ 2.67Å; E391-K407 PolarHBondContact OE1-NZ 2.92Å; E391-Y409 HydrophobicContact CG-CD1 4.32Å; E391-Y409 HydrophobicContact CG-CE1 4.17Å
392	M	70.4	Confident	65.2	Low	6 Å²	6	69.7 Å²	69.7	3%	0.03	36%	0.358	C	S	.	.	H	α-helix	trans	-55.2	-40.6	176.4	-66.5	-177.7	82.4	0	0	112.1	L384 V388 A394 I396 Y409 V522 W528	L384-M392 HydrophobicContact CD1-SD 3.54Å; L384-M392 VanDerWaalsContact CD1-SD 3.54Å; V388-M392 HydrophobicContact CG1-CG 4.11Å; V388-M392 HydrophobicContact CG1-SD 3.8Å; V388-M392 WeakPolarHBondContact O-CB 3.31Å; V388-M392 WeakPolarHBondContact O-CG 3.3Å; V388-M392 PolarHBondContact O-N 2.9Å; M392-A394 VanDerWaalsContact C-N 3.31Å; M392-A394 PolarHBondContact O-N 3.16Å; M392-I396 HydrophobicContact CB-CD1 4.49Å; M392-I396 WeakPolarHBondContact O-CB 3.39Å; M392-I396 VanDerWaalsContact O-CD1 3.28Å; M392-I396 WeakPolarHBondContact O-CD1 3.46Å; M392-I396 WeakPolarHBondContact O-CG1 3.42Å; M392-I396 PolarHBondContact O-N 3.42Å; M392-I396 VanDerWaalsContact O-N 3.07Å; M392-Y409 HydrophobicContact CB-CE1 4.32Å; M392-Y409 HydrophobicContact CE-CD2 4.13Å; M392-Y409 HydrophobicContact CE-CE2 3.97Å; M392-Y409 HydrophobicContact CG-CD1 3.72Å; M392-Y409 HydrophobicContact CG-CD2 3.94Å; M392-Y409 HydrophobicContact CG-CE1 3.52Å; M392-Y409 HydrophobicContact CG-CE2 3.79Å; M392-Y409 HydrophobicContact CG-CG 3.92Å; M392-Y409 HydrophobicContact SD-CD2 4.25Å; M392-Y409 HydrophobicContact SD-CE2 4.42Å; M392-Y409 HydrophobicContact SD-CG 4.45Å; M392-V522 HydrophobicContact SD-CG2 4.45Å; M392-W528 HydrophobicContact CE-CD2 3.68Å; M392-W528 HydrophobicContact CE-CE3 3.63Å; M392-W528 HydrophobicContact CE-CG 4.39Å; M392-W528 HydrophobicContact CE-CH2 3.83Å; M392-W528 HydrophobicContact CE-CZ2 3.87Å; M392-W528 HydrophobicContact CE-CZ3 3.7Å
393	K	69.6	Low	64.7	Low	48 Å²	48	75.9 Å²	75.9	21%	0.209	39%	0.387	C	S	.	.	H	α-helix	trans	-64.5	-33.9	176.5	-177.3	174.4	179.4	171.9	0	112.5	A389 E391 N397	A389-K393 WeakPolarHBondContact O-CB 3.17Å; A389-K393 PolarHBondContact O-N 3.46Å; A389-K393 VanDerWaalsContact O-N 3.16Å; E391-K393 VanDerWaalsContact C-N 3.25Å; E391-K393 PolarHBondContact O-N 3.33Å; K393-N397 VanDerWaalsContact O-CB 3.3Å; K393-N397 WeakPolarHBondContact O-CB 3.22Å; K393-N397 PolarHBondContact O-N 3.07Å; K393-N397 PolarHBondContact O-ND2 2.89Å; K393-N397 PolarHBondContact O-OD1 3.05Å
394	A	68.8	Low	63.9	Low	60 Å²	60	83.4 Å²	83.4	50%	0.496	42%	0.423	S	S	.	.	H	α-helix	trans	-72.6	-48.1	176.6	0	0	0	0	0	111.6	M390 E391 M392 N397 A398	M390-A394 PolarHBondContact O-N 3.29Å; M390-A394 VanDerWaalsContact O-N 3.08Å; E391-A394 WeakPolarHBondContact O-CA 3.12Å; E391-A394 WeakPolarHBondContact O-CB 3.12Å; E391-A394 PolarHBondContact O-N 3.29Å; M392-A394 VanDerWaalsContact C-N 3.31Å; M392-A394 PolarHBondContact O-N 3.16Å; A394-N397 PolarHBondContact O-N 3.41Å; A394-A398 PolarHBondContact O-N 2.97Å; A394-A398 VanDerWaalsContact O-N 3.14Å
395	D	68.8	Low	63.3	Low	52 Å²	52	89.9 Å²	89.9	28%	0.278	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-45.6	-178.7	-65.5	-58.8	0	0	0	112.4	E391 N397 A398 K407 Y409	E391-D395 PolarHBondContact O-N 2.79Å; D395-N397 VanDerWaalsContact C-N 3.3Å; D395-N397 PolarHBondContact O-N 2.77Å; D395-A398 WeakPolarHBondContact O-CB 3.41Å; D395-A398 PolarHBondContact O-N 2.88Å; D395-A398 VanDerWaalsContact O-N 3.13Å; D395-K407 IonicContact OD1-NZ 2.92Å; D395-K407 PolarHBondContact OD1-NZ 3.17Å; D395-K407 IonicContact OD2-NZ 2.83Å; D395-K407 PolarHBondContact OD2-NZ 3.15Å; D395-Y409 VanDerWaalsContact OD2-CE1 3.3Å; D395-Y409 WeakPolarHBondContact OD2-CE1 3.3Å; D395-Y409 PolarHBondContact OD2-OH 3.35Å
396	I	65.8	Low	63.3	Low	50 Å²	50	92 Å²	92	26%	0.256	46%	0.459	S	S	.	.	H	α-helix	trans	-66.6	-35.4	-179.2	-57.5	160.5	0	0	0	110.8	M392 A398 W528 Y976	M392-I396 HydrophobicContact CB-CD1 4.49Å; M392-I396 WeakPolarHBondContact O-CB 3.39Å; M392-I396 VanDerWaalsContact O-CD1 3.28Å; M392-I396 WeakPolarHBondContact O-CD1 3.46Å; M392-I396 WeakPolarHBondContact O-CG1 3.42Å; M392-I396 PolarHBondContact O-N 3.42Å; M392-I396 VanDerWaalsContact O-N 3.07Å; I396-A398 VanDerWaalsContact C-N 3.27Å; I396-A398 PolarHBondContact O-N 3.39Å; I396-W528 HydrophobicContact CD1-CH2 3.77Å; I396-W528 HydrophobicContact CD1-CZ3 4.11Å; I396-Y976 HydrophobicContact CG2-CE2 3.62Å; I396-Y976 WeakPolarHBondContact CG2-OH 3.26Å
397	N	63	Low	63.4	Low	96 Å²	96	89.9 Å²	89.9	51%	0.513	45%	0.454	S	S	.	.	H	α-helix	trans	-68.8	-23.4	175.5	-77.6	0.7	0	0	0	113.2	K393 A394 D395 K399	K393-N397 VanDerWaalsContact O-CB 3.3Å; K393-N397 WeakPolarHBondContact O-CB 3.22Å; K393-N397 PolarHBondContact O-N 3.07Å; K393-N397 PolarHBondContact O-ND2 2.89Å; K393-N397 PolarHBondContact O-OD1 3.05Å; A394-N397 PolarHBondContact O-N 3.41Å; D395-N397 VanDerWaalsContact C-N 3.3Å; D395-N397 PolarHBondContact O-N 2.77Å; N397-K399 PolarHBondContact O-N 3.41Å
398	A	63.7	Low	63.8	Low	78 Å²	78	88.1 Å²	88.1	65%	0.645	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.3	-176.8	0	0	0	0	0	114.2	A394 D395 I396	A394-A398 PolarHBondContact O-N 2.97Å; A394-A398 VanDerWaalsContact O-N 3.14Å; D395-A398 WeakPolarHBondContact O-CB 3.41Å; D395-A398 PolarHBondContact O-N 2.88Å; D395-A398 VanDerWaalsContact O-N 3.13Å; I396-A398 VanDerWaalsContact C-N 3.27Å; I396-A398 PolarHBondContact O-N 3.39Å
399	K	52.3	Low	64.2	Low	182 Å²	182	89.1 Å²	89.1	79%	0.791	45%	0.449	S	S	*	.			trans	58.4	94.5	-165.5	-67	-175.5	177.3	177.4	0	111.5	N397 E401	N397-K399 PolarHBondContact O-N 3.41Å; K399-E401 PolarHBondContact O-N 2.93Å; K399-E401 VanDerWaalsContact O-N 3.13Å
400	Q	48.5	Very low	64.8	Low	124 Å²	124	90.6 Å²	90.6	58%	0.579	46%	0.457	S	S	*	.			trans	-56.8	112.4	179.6	-162.4	167.7	-7.4	0	0	110.9
401	E	48.6	Very low	65.5	Low	166 Å²	166	89.7 Å²	89.7	78%	0.776	45%	0.451	S	S	*	.			trans	-67.7	157.1	165.8	-62.2	-175.1	142.5	0	0	109.8	K399 M403	K399-E401 PolarHBondContact O-N 2.93Å; K399-E401 VanDerWaalsContact O-N 3.13Å; E401-M403 PolarHBondContact O-N 2.8Å
402	D	45.1	Very low	66	Low	175 Å²	175	89.3 Å²	89.3	94%	0.936	45%	0.449	S	S	*	.			trans	-65	88.9	-172.6	-65.4	-46.8	0	0	0	112.7
403	M	54.7	Low	66.9	Low	142 Å²	142	90.3 Å²	90.3	70%	0.7	45%	0.453	S	S	*	.			trans	-80.9	135.9	175.3	-69.5	-83.7	-177.6	0	0	110.9	E401 F405	E401-M403 PolarHBondContact O-N 2.8Å; M403-F405 PolarHBondContact O-N 3.17Å; M403-F405 VanDerWaalsContact O-N 3.17Å
404	M	48.8	Very low	67.9	Low	183 Å²	183	91.5 Å²	91.5	90%	0.901	46%	0.462	S	S	*	.	S	Bend	trans	-70.8	-4.2	177.7	-72.6	-180	-77.8	0	0	115
405	F	58.2	Low	68.9	Low	140 Å²	140	92.7 Å²	92.7	61%	0.614	46%	0.46	S	S	*	.	S	Bend	trans	-145.2	150.3	176.8	-66.6	-76.1	0	0	0	109.9	M403 E1043	M403-F405 PolarHBondContact O-N 3.17Å; M403-F405 VanDerWaalsContact O-N 3.17Å; F405-E1043 HydrophobicContact CD1-CG 4.34Å
406	H	70.9	Confident	70.2	Confident	59 Å²	59	90.2 Å²	90.2	27%	0.273	45%	0.447	S	S	.	.			trans	-73.8	132.9	175.9	-66	102.4	0	0	0	111.3	I408 L525 E1043	H406-I408 PolarHBondContact O-N 2.85Å; H406-I408 VanDerWaalsContact O-N 3.1Å; H406-L525 HydrophobicContact CB-CD2 4.46Å; H406-L525 VanDerWaalsContact CD2-CD2 3.49Å; H406-L525 WeakPolarHBondContact CD2-CD2 3.31Å; H406-E1043 IonicContact CE1-OE2 3.65Å; H406-E1043 IonicContact CG-OE2 3.06Å; H406-E1043 PolarHBondContact N-OE1 3.33Å; H406-E1043 IonicContact ND1-OE2 3.65Å; H406-E1043 PolarHBondContact ND1-OE2 2.88Å
407	K	73.6	Confident	71.7	Confident	86 Å²	86	87.9 Å²	87.9	37%	0.374	44%	0.435	S	S	.	.			trans	-66.7	113.2	178.2	-175	-177.1	173.6	-169.5	0	109.8	E391 D395 Y409	E391-K407 WeakPolarHBondContact OE1-CE 3.29Å; E391-K407 IonicContact OE1-NZ 2.67Å; E391-K407 PolarHBondContact OE1-NZ 2.92Å; D395-K407 IonicContact OD1-NZ 2.92Å; D395-K407 PolarHBondContact OD1-NZ 3.17Å; D395-K407 IonicContact OD2-NZ 2.83Å; D395-K407 PolarHBondContact OD2-NZ 3.15Å; K407-Y409 HydrophobicContact CD-CE1 3.99Å; K407-Y409 HydrophobicContact CG-CE2 4.41Å; K407-Y409 WeakPolarHBondContact O-CD2 3.37Å; K407-Y409 VanDerWaalsContact O-CE2 3.23Å; K407-Y409 WeakPolarHBondContact O-CE2 3.11Å
408	I	78.6	Confident	73.3	Confident	23 Å²	23	83.3 Å²	83.3	12%	0.118	41%	0.41	C	S	.	.			trans	-83.1	142.4	170.9	54.9	161.9	0	0	0	111.5	H406 I410 L523 V1035 R1039 N1042	H406-I408 PolarHBondContact O-N 2.85Å; H406-I408 VanDerWaalsContact O-N 3.1Å; I408-I410 HydrophobicContact CB-CD1 4.4Å; I408-I410 HydrophobicContact CB-CG1 4.3Å; I408-I410 HydrophobicContact CD1-CD1 3.82Å; I408-I410 HydrophobicContact CD1-CG1 4.24Å; I408-L523 HydrophobicContact CG2-CD2 4.32Å; I408-V1035 HydrophobicContact CD1-CG1 4Å; I408-R1039 HydrophobicContact CD1-CB 3.84Å; I408-R1039 HydrophobicContact CD1-CG 4.19Å; I408-R1039 HydrophobicContact CG1-CG 4.5Å; I408-R1039 HydrophobicContact CG2-CG 4.46Å; I408-N1042 HydrophobicContact CG2-CB 3.51Å; I408-N1042 VanDerWaalsContact CG2-CG 3.41Å
409	Y	81.9	Confident	74.9	Confident	26 Å²	26	79.6 Å²	79.6	10%	0.102	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	89.6	177.7	-57.8	-94.7	0	0	0	108.4	V388 E391 M392 D395 K407 G521 V522	V388-Y409 HydrophobicContact CG1-CG 4.46Å; E391-Y409 HydrophobicContact CG-CD1 4.32Å; E391-Y409 HydrophobicContact CG-CE1 4.17Å; M392-Y409 HydrophobicContact CB-CE1 4.32Å; M392-Y409 HydrophobicContact CE-CD2 4.13Å; M392-Y409 HydrophobicContact CE-CE2 3.97Å; M392-Y409 HydrophobicContact CG-CD1 3.72Å; M392-Y409 HydrophobicContact CG-CD2 3.94Å; M392-Y409 HydrophobicContact CG-CE1 3.52Å; M392-Y409 HydrophobicContact CG-CE2 3.79Å; M392-Y409 HydrophobicContact CG-CG 3.92Å; M392-Y409 HydrophobicContact SD-CD2 4.25Å; M392-Y409 HydrophobicContact SD-CE2 4.42Å; M392-Y409 HydrophobicContact SD-CG 4.45Å; D395-Y409 VanDerWaalsContact OD2-CE1 3.3Å; D395-Y409 WeakPolarHBondContact OD2-CE1 3.3Å; D395-Y409 PolarHBondContact OD2-OH 3.35Å; K407-Y409 HydrophobicContact CD-CE1 3.99Å; K407-Y409 HydrophobicContact CG-CE2 4.41Å; K407-Y409 WeakPolarHBondContact O-CD2 3.37Å; K407-Y409 VanDerWaalsContact O-CE2 3.23Å; K407-Y409 WeakPolarHBondContact O-CE2 3.11Å; Y409-G521 CarbonylContact O-C 3.53Å; Y409-G521 WeakPolarHBondContact O-CA 3.27Å; Y409-V522 PolarHBondContact O-N 3.37Å; Y409-V522 VanDerWaalsContact O-N 3.09Å
410	I	84	Confident	76.9	Confident	33 Å²	33	71.3 Å²	71.3	17%	0.169	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.8	-176.6	-53.8	-175.2	0	0	0	110	I408 H519 C520 L523 L1038	I408-I410 HydrophobicContact CB-CD1 4.4Å; I408-I410 HydrophobicContact CB-CG1 4.3Å; I408-I410 HydrophobicContact CD1-CD1 3.82Å; I408-I410 HydrophobicContact CD1-CG1 4.24Å; I410-H519 HydrophobicContact CG2-CB 3.85Å; I410-C520 WeakPolarHBondContact CA-O 3.35Å; I410-L523 HydrophobicContact CD1-CD2 4.06Å; I410-L1038 HydrophobicContact CD1-CB 3.64Å; I410-L1038 HydrophobicContact CD1-CD1 3.97Å; I410-L1038 HydrophobicContact CD1-CG 4.46Å
411	Q	84.6	Confident	79.1	Confident	79 Å²	79	65.4 Å²	65.4	37%	0.369	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.1	173.7	-58.9	-171.4	-0.4	0	0	109.4	H519 C520	Q411-H519 CarbonylContact O-C 3.33Å; Q411-H519 WeakPolarHBondContact O-CA 3.23Å; Q411-C520 PolarHBondContact N-O 3Å; Q411-C520 PolarHBondContact O-N 3.35Å
412	K	86.6	Confident	81.2	Confident	67 Å²	67	58.5 Å²	58.5	29%	0.291	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.7	177.9	-173	-163.3	178.2	-152.5	0	110.1	D414 E1033	K412-D414 WeakPolarHBondContact CE-OD1 3.41Å; K412-D414 WeakPolarHBondContact CE-OD2 3.48Å; K412-D414 IonicContact NZ-OD1 2.77Å; K412-D414 PolarHBondContact NZ-OD1 3.24Å; K412-D414 IonicContact NZ-OD2 3.2Å; K412-D414 PolarHBondContact NZ-OD2 3.45Å; K412-E1033 VanDerWaalsContact CD-OE2 3.24Å; K412-E1033 WeakPolarHBondContact CD-OE2 3.32Å; K412-E1033 WeakPolarHBondContact CE-OE1 3.33Å; K412-E1033 VanDerWaalsContact CE-OE2 3.23Å; K412-E1033 WeakPolarHBondContact CE-OE2 3.41Å; K412-E1033 IonicContact NZ-OE1 2.73Å; K412-E1033 PolarHBondContact NZ-OE1 3.16Å; K412-E1033 IonicContact NZ-OE2 3.19Å; K412-E1033 PolarHBondContact NZ-OE2 3.02Å
413	H	89.2	Confident	83.3	Confident	28 Å²	28	50.5 Å²	50.5	13%	0.13	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	120.1	172.6	-64.6	-102.4	0	0	0	110.5	V416 L474 P475 R517 V518 C520	H413-V416 HydrophobicContact CB-CG1 3.91Å; H413-L474 HydrophobicContact CB-CD2 3.54Å; H413-L474 VanDerWaalsContact CD2-CD2 3.43Å; H413-L474 WeakPolarHBondContact CD2-CD2 3.38Å; H413-P475 PolarHBondContact CE1-O 2.86Å; H413-R517 WeakPolarHBondContact O-CA 3.47Å; H413-V518 HydrophobicContact CB-CG2 4.25Å; H413-V518 PolarHBondContact N-O 3.45Å; H413-V518 PolarHBondContact O-N 2.97Å; H413-C520 PolarHBondContact CD2-SG 3.47Å
414	D	89.2	Confident	84.8	Confident	72 Å²	72	47.6 Å²	47.6	39%	0.385	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	153.2	172.3	-65.5	-58.5	0	0	0	110.5	K412 R517	K412-D414 WeakPolarHBondContact CE-OD1 3.41Å; K412-D414 WeakPolarHBondContact CE-OD2 3.48Å; K412-D414 IonicContact NZ-OD1 2.77Å; K412-D414 PolarHBondContact NZ-OD1 3.24Å; K412-D414 IonicContact NZ-OD2 3.2Å; K412-D414 PolarHBondContact NZ-OD2 3.45Å; D414-R517 WeakPolarHBondContact OD1-CB 3.46Å
415	N	91.3	Very high	86.4	Confident	85 Å²	85	40.1 Å²	40.1	46%	0.455	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	61	52.5	-179.4	-47.2	-54.4	0	0	0	113.9	H481 G516 Y561	N415-H481 PolarHBondContact O-CD2 3.09Å; N415-G516 WeakPolarHBondContact CA-O 3.2Å; N415-G516 PolarHBondContact N-O 3.4Å; N415-G516 VanDerWaalsContact N-O 3.09Å; N415-Y561 PolarHBondContact OD1-OH 3.44Å; N415-Y561 VanDerWaalsContact OD1-OH 3.06Å
416	V	95.8	Very high	87.5	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	171.3	169.8	-60.4	0	0	0	0	111.2	H413 I418 V471 S472 L474 S515 G516 V518	H413-V416 HydrophobicContact CB-CG1 3.91Å; V416-I418 HydrophobicContact CG2-CD1 4.32Å; V416-I418 HydrophobicContact CG2-CG1 4.06Å; V416-V471 HydrophobicContact CB-CG1 3.9Å; V416-V471 HydrophobicContact CG1-CG1 4.4Å; V416-V471 HydrophobicContact CG2-CG1 4.21Å; V416-S472 CarbonylContact C-O 3.55Å; V416-S472 WeakPolarHBondContact CA-O 3.39Å; V416-S472 WeakPolarHBondContact CB-O 3.32Å; V416-L474 HydrophobicContact CG1-CD2 4.19Å; V416-L474 HydrophobicContact CG1-CG 4.26Å; V416-S515 VanDerWaalsContact O-CA 3.31Å; V416-S515 WeakPolarHBondContact O-CA 3.46Å; V416-G516 WeakPolarHBondContact CG2-O 3.45Å; V416-G516 PolarHBondContact N-O 3.45Å; V416-G516 PolarHBondContact O-N 3.11Å; V416-G516 VanDerWaalsContact O-N 3.15Å; V416-V518 HydrophobicContact CB-CG2 4.5Å; V416-V518 HydrophobicContact CG1-CG2 4.08Å; V416-V518 HydrophobicContact CG2-CB 4.33Å; V416-V518 HydrophobicContact CG2-CG1 3.8Å; V416-V518 HydrophobicContact CG2-CG2 3.76Å
417	S	96.9	Very high	87.7	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.6	164.6	-71.7	0	0	0	0	112.4	V471 S472 H481 C485 H514 S515	S417-V471 CarbonylContact O-C 3.51Å; S417-V471 VanDerWaalsContact O-CA 3.24Å; S417-V471 WeakPolarHBondContact O-CA 3.45Å; S417-V471 WeakPolarHBondContact O-CG1 3.38Å; S417-S472 PolarHBondContact N-O 2.81Å; S417-S472 PolarHBondContact O-N 3.47Å; S417-H481 PolarHBondContact OG-ND1 2.86Å; S417-C485 PolarHBondContact O-SG 3.12Å; S417-C485 VanDerWaalsContact O-SG 3.33Å; S417-H514 CarbonylContact C-O 3.49Å; S417-H514 WeakPolarHBondContact CA-O 3.31Å; S417-S515 VanDerWaalsContact OG-CB 3.27Å; S417-S515 WeakPolarHBondContact OG-CB 3.29Å; S417-S515 PolarHBondContact OG-OG 3.04Å
418	I	96.8	Very high	87.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	115.2	-156.8	-55.1	173.5	0	0	0	106.5	V416 F420 Y469 V471 I513 H514 V518 D536 V537 A540	V416-I418 HydrophobicContact CG2-CD1 4.32Å; V416-I418 HydrophobicContact CG2-CG1 4.06Å; I418-F420 HydrophobicContact CG2-CD2 4.36Å; I418-F420 HydrophobicContact CG2-CE2 4.08Å; I418-Y469 HydrophobicContact CG2-CE2 3.55Å; I418-Y469 VanDerWaalsContact CG2-OH 3.31Å; I418-Y469 WeakPolarHBondContact CG2-OH 3.4Å; I418-V471 HydrophobicContact CG2-CG2 4.45Å; I418-I513 WeakPolarHBondContact O-CA 3.46Å; I418-H514 PolarHBondContact N-O 2.88Å; I418-H514 PolarHBondContact O-N 3.27Å; I418-V518 HydrophobicContact CD1-CG1 3.73Å; I418-V518 HydrophobicContact CG1-CG1 4.32Å; I418-D536 HydrophobicContact CD1-CB 4.05Å; I418-V537 HydrophobicContact CD1-CG2 4.16Å; I418-A540 HydrophobicContact CB-CB 3.85Å; I418-A540 HydrophobicContact CG2-CB 3.41Å; I418-A540 VanDerWaalsContact CG2-CB 3.41Å
419	L	96.6	Very high	87.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.5	-175	-177.2	156	0	0	0	110.5	A421 Y469 C470 C485 M488 M492 V511 G512 I513	L419-A421 HydrophobicContact CD2-CB 3.82Å; L419-Y469 VanDerWaalsContact O-CD2 3.24Å; L419-Y469 WeakPolarHBondContact O-CD2 3.45Å; L419-C470 PolarHBondContact N-O 3.4Å; L419-C470 PolarHBondContact O-N 3.4Å; L419-C470 VanDerWaalsContact O-N 3.08Å; L419-C485 HydrophobicContact CB-CB 4.44Å; L419-C485 HydrophobicContact CD1-CB 4.29Å; L419-C485 WeakPolarHBondContact CD1-O 2.94Å; L419-M488 HydrophobicContact CD1-CB 4.39Å; L419-M488 HydrophobicContact CD1-CG 4.25Å; L419-M492 HydrophobicContact CD2-SD 3.93Å; L419-V511 HydrophobicContact CD1-CG1 3.98Å; L419-V511 HydrophobicContact CD2-CG1 4.21Å; L419-V511 HydrophobicContact CG-CG1 3.9Å; L419-G512 WeakPolarHBondContact CA-O 3.39Å; L419-I513 HydrophobicContact CB-CG1 4.33Å; L419-I513 HydrophobicContact CD1-CD1 3.93Å; L419-I513 HydrophobicContact CD1-CG1 4.06Å; L419-I513 HydrophobicContact CG-CG1 4.09Å
420	F	95.8	Very high	87.7	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.035	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.4	164.8	-76.7	-91.8	0	0	0	108.8	I418 L464 Y469 G512 V537 A540 N541 E544	I418-F420 HydrophobicContact CG2-CD2 4.36Å; I418-F420 HydrophobicContact CG2-CE2 4.08Å; F420-L464 HydrophobicContact CE1-CD1 4.34Å; F420-Y469 AromaticContact CD1-CD2 3.58Å; F420-Y469 HydrophobicContact CD1-CD2 3.58Å; F420-Y469 HydrophobicContact CD1-CE2 4.26Å; F420-Y469 HydrophobicContact CD1-CG 4.01Å; F420-Y469 AromaticContact CD2-CD2 3.67Å; F420-Y469 HydrophobicContact CD2-CD2 3.67Å; F420-Y469 AromaticContact CD2-CE2 3.6Å; F420-Y469 HydrophobicContact CD2-CE2 3.6Å; F420-Y469 HydrophobicContact CE1-CD1 4.2Å; F420-Y469 AromaticContact CE1-CD2 3.47Å; F420-Y469 HydrophobicContact CE1-CD2 3.47Å; F420-Y469 VanDerWaalsContact CE1-CD2 3.47Å; F420-Y469 AromaticContact CE1-CE2 3.92Å; F420-Y469 HydrophobicContact CE1-CE2 3.92Å; F420-Y469 AromaticContact CE1-CG 3.67Å; F420-Y469 HydrophobicContact CE1-CG 3.67Å; F420-Y469 AromaticContact CE2-CD2 3.57Å; F420-Y469 HydrophobicContact CE2-CD2 3.57Å; F420-Y469 AromaticContact CE2-CE2 3.2Å; F420-Y469 HydrophobicContact CE2-CE2 3.2Å; F420-Y469 HydrophobicContact CE2-CG 4.46Å; F420-Y469 AromaticContact CE2-CZ 3.81Å; F420-Y469 AromaticContact CG-CD2 3.68Å; F420-Y469 HydrophobicContact CG-CD2 3.68Å; F420-Y469 HydrophobicContact CG-CE2 4.12Å; F420-Y469 HydrophobicContact CZ-CD1 4.2Å; F420-Y469 AromaticContact CZ-CD2 3.47Å; F420-Y469 HydrophobicContact CZ-CD2 3.47Å; F420-Y469 VanDerWaalsContact CZ-CD2 3.47Å; F420-Y469 HydrophobicContact CZ-CE1 4.08Å; F420-Y469 AromaticContact CZ-CE2 3.38Å; F420-Y469 HydrophobicContact CZ-CE2 3.38Å; F420-Y469 AromaticContact CZ-CG 3.92Å; F420-Y469 HydrophobicContact CZ-CG 3.92Å; F420-Y469 AromaticContact CZ-CZ 3.7Å; F420-G512 PolarHBondContact N-O 3.12Å; F420-G512 PolarHBondContact O-N 3.03Å; F420-V537 HydrophobicContact CE2-CG1 4.08Å; F420-V537 WeakPolarHBondContact CE2-O 3.48Å; F420-V537 HydrophobicContact CZ-CG1 4.01Å; F420-A540 HydrophobicContact CD2-CB 3.68Å; F420-A540 HydrophobicContact CE2-CB 3.85Å; F420-N541 HydrophobicContact CD1-CB 4.49Å; F420-N541 HydrophobicContact CD2-CB 4.13Å; F420-N541 HydrophobicContact CE1-CB 4.28Å; F420-N541 HydrophobicContact CE2-CB 3.89Å; F420-N541 HydrophobicContact CG-CB 4.42Å; F420-N541 HydrophobicContact CZ-CB 3.98Å; F420-E544 HydrophobicContact CB-CB 3.91Å; F420-E544 HydrophobicContact CB-CG 4.47Å
421	A	94.1	Very high	87.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122.1	175.7	0	0	0	0	0	112.2	L419 C467 Y468 M492 M509 R510 V511	L419-A421 HydrophobicContact CD2-CB 3.82Å; A421-C467 CarbonylContact O-C 3.47Å; A421-C467 WeakPolarHBondContact O-CA 3.39Å; A421-C467 PolarHBondContact O-SG 2.82Å; A421-Y468 PolarHBondContact N-O 3.26Å; A421-Y468 PolarHBondContact O-N 2.95Å; A421-M492 HydrophobicContact CB-CE 3.91Å; A421-M492 HydrophobicContact CB-SD 3.95Å; A421-M509 HydrophobicContact CB-CE 3.52Å; A421-R510 CarbonylContact C-O 3.48Å; A421-R510 WeakPolarHBondContact CA-O 3.37Å; A421-V511 HydrophobicContact CB-CG1 4.43Å; A421-V511 HydrophobicContact CB-CG2 4.02Å
422	D	92.3	Very high	86.7	Confident	21 Å²	21	38.9 Å²	38.9	11%	0.112	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.5	-172.8	-175.7	48.2	0	0	0	112.5	E424 C467 M509 R510 E544	D422-E424 PolarHBondContact O-N 2.61Å; D422-C467 HydrophobicContact CB-CB 4.35Å; D422-M509 WeakPolarHBondContact O-CA 3.34Å; D422-R510 PolarHBondContact N-O 3.03Å; D422-R510 PolarHBondContact O-N 3.07Å; D422-R510 IonicContact OD2-CZ 3.3Å; D422-R510 IonicContact OD2-NH2 2.74Å; D422-R510 PolarHBondContact OD2-NH2 3.21Å; D422-E544 HydrophobicContact CB-CG 3.89Å; D422-E544 WeakPolarHBondContact CB-OE1 3.33Å
423	I	89.3	Confident	86.1	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.036	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	100.7	-175.7	-57.9	169.7	0	0	0	110	G425 F426 L445 D466 V507 N508 M509	I423-G425 PolarHBondContact O-N 3.16Å; I423-F426 HydrophobicContact CB-CB 4.04Å; I423-F426 HydrophobicContact CG2-CB 3.96Å; I423-F426 WeakPolarHBondContact O-CB 3.41Å; I423-F426 PolarHBondContact O-N 2.89Å; I423-L445 HydrophobicContact CD1-CD2 3.79Å; I423-D466 HydrophobicContact CB-CB 4.37Å; I423-V507 HydrophobicContact CG2-CB 4.33Å; I423-V507 HydrophobicContact CG2-CG1 4.42Å; I423-N508 CarbonylContact C-O 3.59Å; I423-N508 WeakPolarHBondContact CA-O 3.41Å; I423-M509 HydrophobicContact CB-SD 4.5Å; I423-M509 HydrophobicContact CG1-SD 3.68Å
424	E	86.9	Confident	85.5	Confident	81 Å²	81	39.9 Å²	39.9	38%	0.379	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	124.2	171.6	-171.9	162.6	-83.3	0	0	110.6	D422 V507 N508 R510 A549	D422-E424 PolarHBondContact O-N 2.61Å; E424-V507 WeakPolarHBondContact O-CA 3.49Å; E424-N508 HydrophobicContact CB-CB 4.43Å; E424-N508 PolarHBondContact N-O 2.96Å; E424-N508 PolarHBondContact O-N 3.04Å; E424-R510 IonicContact OE1-CZ 3.68Å; E424-R510 IonicContact OE1-NH1 3.55Å; E424-R510 PolarHBondContact OE1-NH1 2.83Å; E424-A549 HydrophobicContact CB-CB 4.24Å; E424-A549 HydrophobicContact CG-CB 4.48Å; E424-A549 WeakPolarHBondContact OE2-CB 3.45Å
425	G	81.5	Confident	84.7	Confident	26 Å²	26	37.4 Å²	37.4	27%	0.268	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	95	-1.9	-176.2	0	0	0	0	0	115.1	I423 T427 S428 L429	I423-G425 PolarHBondContact O-N 3.16Å; G425-T427 VanDerWaalsContact C-N 3.32Å; G425-T427 PolarHBondContact O-N 2.79Å; G425-S428 WeakPolarHBondContact O-CB 3.3Å; G425-S428 PolarHBondContact O-N 3.37Å; G425-L429 PolarHBondContact O-N 3.4Å; G425-L429 VanDerWaalsContact O-N 3.15Å
426	F	81.5	Confident	83.9	Confident	9 Å²	9	37.5 Å²	37.5	4%	0.039	22%	0.224	C	C	.	.	H	α-helix	trans	-55.6	-41.1	-177	176.9	-105	0	0	0	114.3	I423 S428 L429 A430 L438 L442 D466	I423-F426 HydrophobicContact CB-CB 4.04Å; I423-F426 HydrophobicContact CG2-CB 3.96Å; I423-F426 WeakPolarHBondContact O-CB 3.41Å; I423-F426 PolarHBondContact O-N 2.89Å; F426-S428 PolarHBondContact O-N 2.93Å; F426-L429 HydrophobicContact CD2-CD2 4.44Å; F426-L429 WeakPolarHBondContact O-CB 3.5Å; F426-L429 PolarHBondContact O-N 3.27Å; F426-L429 VanDerWaalsContact O-N 3.13Å; F426-A430 HydrophobicContact CE1-CB 4.07Å; F426-A430 HydrophobicContact CE2-CB 4.3Å; F426-A430 HydrophobicContact CZ-CB 3.95Å; F426-A430 WeakPolarHBondContact O-CB 3.47Å; F426-A430 PolarHBondContact O-N 3.25Å; F426-L438 HydrophobicContact CE2-CD1 3.8Å; F426-L438 HydrophobicContact CZ-CD1 4.12Å; F426-L442 HydrophobicContact CD2-CD2 4.4Å; F426-L442 HydrophobicContact CE2-CD1 3.91Å; F426-L442 HydrophobicContact CE2-CD2 3.76Å; F426-L442 HydrophobicContact CE2-CG 4.17Å; F426-L442 HydrophobicContact CZ-CD1 4Å; F426-D466 HydrophobicContact CB-CB 3.85Å; F426-D466 HydrophobicContact CD1-CB 3.58Å; F426-D466 WeakPolarHBondContact CD1-OD2 3.24Å; F426-D466 HydrophobicContact CD2-CB 4.35Å; F426-D466 HydrophobicContact CE1-CB 4.2Å; F426-D466 HydrophobicContact CG-CB 3.64Å
427	T	76.3	Confident	83.2	Confident	86 Å²	86	42.2 Å²	42.2	53%	0.528	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-25.4	178.1	52.1	0	0	0	0	113.4	G425 S431	G425-T427 VanDerWaalsContact C-N 3.32Å; G425-T427 PolarHBondContact O-N 2.79Å; T427-S431 PolarHBondContact O-N 2.85Å
428	S	76.9	Confident	82.4	Confident	59 Å²	59	42.6 Å²	42.6	41%	0.413	25%	0.247	S	C	.	.	H	α-helix	trans	-77.3	-45.3	171.7	-58	0	0	0	0	111.2	G425 F426 S431 Q432	G425-S428 WeakPolarHBondContact O-CB 3.3Å; G425-S428 PolarHBondContact O-N 3.37Å; F426-S428 PolarHBondContact O-N 2.93Å; S428-S431 PolarHBondContact O-N 3.04Å; S428-S431 VanDerWaalsContact O-N 3.12Å; S428-S431 PolarHBondContact O-OG 2.66Å; S428-Q432 PolarHBondContact O-N 2.76Å
429	L	78.5	Confident	81.5	Confident	9 Å²	9	42.6 Å²	42.6	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-56.2	-51.9	174.6	179	67.1	0	0	0	111.5	G425 F426 S431 Q432 C433 V505 V507	G425-L429 PolarHBondContact O-N 3.4Å; G425-L429 VanDerWaalsContact O-N 3.15Å; F426-L429 HydrophobicContact CD2-CD2 4.44Å; F426-L429 WeakPolarHBondContact O-CB 3.5Å; F426-L429 PolarHBondContact O-N 3.27Å; F426-L429 VanDerWaalsContact O-N 3.13Å; L429-S431 PolarHBondContact O-N 3.23Å; L429-S431 VanDerWaalsContact O-N 3.07Å; L429-Q432 PolarHBondContact O-N 3.04Å; L429-C433 PolarHBondContact O-N 3.1Å; L429-C433 VanDerWaalsContact O-N 3.16Å; L429-C433 PolarHBondContact O-SG 3.18Å; L429-V505 HydrophobicContact CB-CG1 4.31Å; L429-V505 HydrophobicContact CD1-CB 4.09Å; L429-V505 HydrophobicContact CD1-CG1 4.38Å; L429-V505 HydrophobicContact CD1-CG2 3.82Å; L429-V507 HydrophobicContact CB-CG1 4.4Å; L429-V507 HydrophobicContact CD2-CG1 4.35Å
430	A	77	Confident	80.7	Confident	31 Å²	31	47.4 Å²	47.4	26%	0.256	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-9.8	178.9	0	0	0	0	0	114.3	F426 L438	F426-A430 HydrophobicContact CE1-CB 4.07Å; F426-A430 HydrophobicContact CE2-CB 4.3Å; F426-A430 HydrophobicContact CZ-CB 3.95Å; F426-A430 WeakPolarHBondContact O-CB 3.47Å; F426-A430 PolarHBondContact O-N 3.25Å; A430-L438 HydrophobicContact CB-CD1 4.01Å; A430-L438 HydrophobicContact CB-CD2 3.86Å
431	S	72.8	Confident	80	Confident	89 Å²	89	48.9 Å²	48.9	62%	0.622	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-10.5	172.6	74.5	0	0	0	0	114	T427 S428 L429	T427-S431 PolarHBondContact O-N 2.85Å; S428-S431 PolarHBondContact O-N 3.04Å; S428-S431 VanDerWaalsContact O-N 3.12Å; S428-S431 PolarHBondContact O-OG 2.66Å; L429-S431 PolarHBondContact O-N 3.23Å; L429-S431 VanDerWaalsContact O-N 3.07Å
432	Q	75.9	Confident	79.4	Confident	138 Å²	138	49 Å²	49	65%	0.645	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-23.5	-175.9	-65.7	176.9	11	0	0	113.1	S428 L429	S428-Q432 PolarHBondContact O-N 2.76Å; L429-Q432 PolarHBondContact O-N 3.04Å
433	C	73.3	Confident	78.8	Confident	36 Å²	36	49.1 Å²	49.1	24%	0.243	28%	0.282	C	S	.	.	S	Bend	trans	-87.6	150.3	175.1	-59	0	0	0	0	112.6	L429 E437 L438	L429-C433 PolarHBondContact O-N 3.1Å; L429-C433 VanDerWaalsContact O-N 3.16Å; L429-C433 PolarHBondContact O-SG 3.18Å; C433-E437 HydrophobicContact CB-CB 4.15Å; C433-L438 HydrophobicContact CB-CB 4.1Å
434	T	77.8	Confident	78.4	Confident	79 Å²	79	53.8 Å²	53.8	49%	0.485	30%	0.304	S	S	.	.			trans	-69.5	164.5	161.9	64.6	0	0	0	0	111.5	Q436 E437 L438	T434-Q436 PolarHBondContact O-N 2.85Å; T434-E437 VanDerWaalsContact CB-OE2 3.25Å; T434-E437 WeakPolarHBondContact CB-OE2 3.23Å; T434-E437 VanDerWaalsContact CG2-OE2 3.29Å; T434-E437 WeakPolarHBondContact CG2-OE2 3.47Å; T434-E437 PolarHBondContact N-OE2 3.45Å; T434-E437 PolarHBondContact O-N 3.47Å; T434-E437 WeakPolarHBondContact OG1-CG 3.15Å; T434-E437 PolarHBondContact OG1-N 3.13Å; T434-E437 PolarHBondContact OG1-OE2 2.94Å; T434-L438 WeakPolarHBondContact O-CB 3.44Å; T434-L438 PolarHBondContact O-N 3.45Å
435	A	71.8	Confident	78.4	Confident	21 Å²	21	50.2 Å²	50.2	17%	0.174	29%	0.287	C	S	.	.	H	α-helix	trans	-53.6	-38.8	176.7	0	0	0	0	0	113.4	V439 V1126	A435-V439 WeakPolarHBondContact O-CG2 3.28Å; A435-V439 PolarHBondContact O-N 2.87Å; A435-V1126 HydrophobicContact CB-CB 4.36Å; A435-V1126 HydrophobicContact CB-CG1 3.86Å; A435-V1126 HydrophobicContact CB-CG2 3.56Å
436	Q	75.1	Confident	78.6	Confident	87 Å²	87	49 Å²	49	41%	0.407	27%	0.274	S	S	.	.	H	α-helix	trans	-69.8	-51.8	178.1	-179.5	174.2	-18.7	0	0	111.5	T434 L438 V439 M440 Y1005	T434-Q436 PolarHBondContact O-N 2.85Å; Q436-L438 VanDerWaalsContact C-N 3.29Å; Q436-L438 PolarHBondContact O-N 2.87Å; Q436-V439 PolarHBondContact O-N 2.9Å; Q436-M440 HydrophobicContact CG-CG 4.38Å; Q436-M440 HydrophobicContact CG-SD 3.77Å; Q436-M440 WeakPolarHBondContact O-CB 3.22Å; Q436-M440 VanDerWaalsContact O-CG 3.3Å; Q436-M440 WeakPolarHBondContact O-CG 3.36Å; Q436-M440 PolarHBondContact O-N 3.03Å; Q436-Y1005 HydrophobicContact CB-CD2 4.1Å; Q436-Y1005 HydrophobicContact CB-CE2 3.58Å; Q436-Y1005 HydrophobicContact CG-CE1 4.16Å; Q436-Y1005 HydrophobicContact CG-CE2 3.83Å; Q436-Y1005 PolarHBondContact OE1-OH 3.13Å
437	E	81	Confident	78.6	Confident	99 Å²	99	50.4 Å²	50.4	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-38.7	-178.8	-67.7	159.4	142.8	0	0	111.7	C433 T434 M440 T441	C433-E437 HydrophobicContact CB-CB 4.15Å; T434-E437 VanDerWaalsContact CB-OE2 3.25Å; T434-E437 WeakPolarHBondContact CB-OE2 3.23Å; T434-E437 VanDerWaalsContact CG2-OE2 3.29Å; T434-E437 WeakPolarHBondContact CG2-OE2 3.47Å; T434-E437 PolarHBondContact N-OE2 3.45Å; T434-E437 PolarHBondContact O-N 3.47Å; T434-E437 WeakPolarHBondContact OG1-CG 3.15Å; T434-E437 PolarHBondContact OG1-N 3.13Å; T434-E437 PolarHBondContact OG1-OE2 2.94Å; E437-M440 PolarHBondContact O-N 3.46Å; E437-T441 VanDerWaalsContact O-CB 3.3Å; E437-T441 WeakPolarHBondContact O-CB 3.38Å; E437-T441 PolarHBondContact O-N 2.82Å; E437-T441 PolarHBondContact O-OG1 3.15Å
438	L	79.2	Confident	79.1	Confident	8 Å²	8	50.9 Å²	50.9	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-49.3	176.1	-176.1	61.4	0	0	0	111.5	F426 A430 C433 T434 Q436 T441 L442	F426-L438 HydrophobicContact CE2-CD1 3.8Å; F426-L438 HydrophobicContact CZ-CD1 4.12Å; A430-L438 HydrophobicContact CB-CD1 4.01Å; A430-L438 HydrophobicContact CB-CD2 3.86Å; C433-L438 HydrophobicContact CB-CB 4.1Å; T434-L438 WeakPolarHBondContact O-CB 3.44Å; T434-L438 PolarHBondContact O-N 3.45Å; Q436-L438 VanDerWaalsContact C-N 3.29Å; Q436-L438 PolarHBondContact O-N 2.87Å; L438-T441 PolarHBondContact O-N 3.22Å; L438-L442 HydrophobicContact CD1-CD1 4.16Å; L438-L442 HydrophobicContact CD1-CG 4.31Å; L438-L442 HydrophobicContact CG-CD1 4.15Å; L438-L442 VanDerWaalsContact O-CB 3.3Å; L438-L442 WeakPolarHBondContact O-CB 3.26Å; L438-L442 VanDerWaalsContact O-CG 3.31Å; L438-L442 WeakPolarHBondContact O-CG 3.19Å; L438-L442 PolarHBondContact O-N 3.18Å
439	V	78.8	Confident	79.7	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-67.5	-37.7	178.6	173.5	0	0	0	0	111.6	A435 Q436 N443 V1126	A435-V439 WeakPolarHBondContact O-CG2 3.28Å; A435-V439 PolarHBondContact O-N 2.87Å; Q436-V439 PolarHBondContact O-N 2.9Å; V439-N443 WeakPolarHBondContact O-CB 3.42Å; V439-N443 PolarHBondContact O-N 3.24Å; V439-V1126 HydrophobicContact CG2-CG1 3.76Å
440	M	79.2	Confident	80.1	Confident	101 Å²	101	49.2 Å²	49.2	50%	0.498	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-46.7	175.9	-70.3	-179.3	74.8	0	0	111.6	Q436 E437 N443 E444 L1003	Q436-M440 HydrophobicContact CG-CG 4.38Å; Q436-M440 HydrophobicContact CG-SD 3.77Å; Q436-M440 WeakPolarHBondContact O-CB 3.22Å; Q436-M440 VanDerWaalsContact O-CG 3.3Å; Q436-M440 WeakPolarHBondContact O-CG 3.36Å; Q436-M440 PolarHBondContact O-N 3.03Å; E437-M440 PolarHBondContact O-N 3.46Å; M440-N443 PolarHBondContact O-N 3.43Å; M440-E444 PolarHBondContact O-N 2.92Å; M440-L1003 HydrophobicContact CG-CD1 4.3Å
441	T	80.6	Confident	80.5	Confident	39 Å²	39	53.4 Å²	53.4	24%	0.239	28%	0.279	C	S	.	.	H	α-helix	trans	-64.7	-45	178.5	-54.8	0	0	0	0	111.5	E437 L438 E444 L445 V499 T503	E437-T441 VanDerWaalsContact O-CB 3.3Å; E437-T441 WeakPolarHBondContact O-CB 3.38Å; E437-T441 PolarHBondContact O-N 2.82Å; E437-T441 PolarHBondContact O-OG1 3.15Å; L438-T441 PolarHBondContact O-N 3.22Å; T441-E444 PolarHBondContact O-N 2.73Å; T441-L445 WeakPolarHBondContact O-CB 3.46Å; T441-L445 PolarHBondContact O-N 3.22Å; T441-V499 HydrophobicContact CG2-CG1 4.26Å; T441-T503 HydrophobicContact CG2-CG2 4.29Å
442	L	80.9	Confident	81.3	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-42.5	176	-76.2	178.1	0	0	0	112	F426 L438 E444 L445 F446 I1130	F426-L442 HydrophobicContact CD2-CD2 4.4Å; F426-L442 HydrophobicContact CE2-CD1 3.91Å; F426-L442 HydrophobicContact CE2-CD2 3.76Å; F426-L442 HydrophobicContact CE2-CG 4.17Å; F426-L442 HydrophobicContact CZ-CD1 4Å; L438-L442 HydrophobicContact CD1-CD1 4.16Å; L438-L442 HydrophobicContact CD1-CG 4.31Å; L438-L442 HydrophobicContact CG-CD1 4.15Å; L438-L442 VanDerWaalsContact O-CB 3.3Å; L438-L442 WeakPolarHBondContact O-CB 3.26Å; L438-L442 VanDerWaalsContact O-CG 3.31Å; L438-L442 WeakPolarHBondContact O-CG 3.19Å; L438-L442 PolarHBondContact O-N 3.18Å; L442-E444 PolarHBondContact O-N 2.96Å; L442-L445 PolarHBondContact O-N 3.03Å; L442-F446 HydrophobicContact CB-CD2 4.14Å; L442-F446 HydrophobicContact CB-CE2 4.1Å; L442-F446 HydrophobicContact CD2-CD2 4.46Å; L442-F446 HydrophobicContact CD2-CE2 3.76Å; L442-F446 HydrophobicContact CD2-CZ 4.11Å; L442-F446 HydrophobicContact CG-CE2 4.38Å; L442-F446 WeakPolarHBondContact O-CB 3.47Å; L442-F446 WeakPolarHBondContact O-CD2 3.41Å; L442-F446 WeakPolarHBondContact O-CG 3.49Å; L442-F446 PolarHBondContact O-N 2.98Å; L442-I1130 HydrophobicContact CB-CD1 3.88Å; L442-I1130 HydrophobicContact CD1-CD1 4.45Å
443	N	80.1	Confident	82	Confident	22 Å²	22	44.1 Å²	44.1	12%	0.118	23%	0.227	C	C	.	.	H	α-helix	trans	-67.4	-35.4	178.7	-177	79.7	0	0	0	112	V439 M440 A447 L1003 G1131	V439-N443 WeakPolarHBondContact O-CB 3.42Å; V439-N443 PolarHBondContact O-N 3.24Å; M440-N443 PolarHBondContact O-N 3.43Å; N443-A447 WeakPolarHBondContact O-CB 3.48Å; N443-A447 PolarHBondContact O-N 3.46Å; N443-L1003 HydrophobicContact CB-CD1 4.01Å; N443-G1131 PolarHBondContact OD1-N 2.92Å
444	E	82.3	Confident	82.6	Confident	105 Å²	105	45.5 Å²	45.5	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-46.5	172.6	-161.4	-166.6	143.6	0	0	111.7	M440 T441 L442 A447 R448	M440-E444 PolarHBondContact O-N 2.92Å; T441-E444 PolarHBondContact O-N 2.73Å; L442-E444 PolarHBondContact O-N 2.96Å; E444-A447 PolarHBondContact O-N 2.89Å; E444-R448 VanDerWaalsContact O-CG 3.31Å; E444-R448 WeakPolarHBondContact O-CG 3.42Å; E444-R448 PolarHBondContact O-N 2.85Å; E444-R448 IonicContact OE1-CZ 2.9Å; E444-R448 IonicContact OE1-NE 3.92Å; E444-R448 PolarHBondContact OE1-NE 3.28Å; E444-R448 IonicContact OE1-NH2 2.68Å; E444-R448 PolarHBondContact OE1-NH2 2.77Å
445	L	85.3	Confident	83.2	Confident	6 Å²	6	46.9 Å²	46.9	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-48.4	177.9	178.4	57.2	0	0	0	111.8	I423 T441 L442 R448 F449 I496 V499	I423-L445 HydrophobicContact CD1-CD2 3.79Å; T441-L445 WeakPolarHBondContact O-CB 3.46Å; T441-L445 PolarHBondContact O-N 3.22Å; L442-L445 PolarHBondContact O-N 3.03Å; L445-R448 WeakPolarHBondContact O-CB 3.46Å; L445-R448 PolarHBondContact O-N 3.01Å; L445-F449 HydrophobicContact CD1-CD1 4.12Å; L445-F449 HydrophobicContact CD1-CE1 3.47Å; L445-F449 VanDerWaalsContact CD1-CE1 3.47Å; L445-F449 HydrophobicContact CD1-CE2 3.99Å; L445-F449 HydrophobicContact CD1-CZ 3.39Å; L445-F449 HydrophobicContact CD2-CE2 4.37Å; L445-F449 HydrophobicContact CD2-CZ 4.32Å; L445-F449 HydrophobicContact CG-CD2 4.46Å; L445-F449 HydrophobicContact CG-CE1 4.3Å; L445-F449 HydrophobicContact CG-CE2 3.96Å; L445-F449 HydrophobicContact CG-CZ 3.87Å; L445-F449 WeakPolarHBondContact O-CG 3.26Å; L445-F449 PolarHBondContact O-N 2.91Å; L445-I496 HydrophobicContact CD1-CD1 4.1Å; L445-I496 HydrophobicContact CD2-CD1 3.63Å; L445-V499 HydrophobicContact CD1-CG2 4.03Å
446	F	86.6	Confident	84.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-72	-29	178.5	-65	-45.3	0	0	0	112.8	L442 R448 F449 D450 I463 Y468 I1130	L442-F446 HydrophobicContact CB-CD2 4.14Å; L442-F446 HydrophobicContact CB-CE2 4.1Å; L442-F446 HydrophobicContact CD2-CD2 4.46Å; L442-F446 HydrophobicContact CD2-CE2 3.76Å; L442-F446 HydrophobicContact CD2-CZ 4.11Å; L442-F446 HydrophobicContact CG-CE2 4.38Å; L442-F446 WeakPolarHBondContact O-CB 3.47Å; L442-F446 WeakPolarHBondContact O-CD2 3.41Å; L442-F446 WeakPolarHBondContact O-CG 3.49Å; L442-F446 PolarHBondContact O-N 2.98Å; F446-R448 VanDerWaalsContact C-N 3.33Å; F446-F449 AromaticContact CD1-CD2 3.8Å; F446-F449 HydrophobicContact CD1-CD2 3.8Å; F446-F449 HydrophobicContact CD1-CE2 4.33Å; F446-F449 HydrophobicContact CE1-CD2 4.22Å; F446-F449 HydrophobicContact CE1-CE2 4.38Å; F446-F449 PolarHBondContact O-N 3.41Å; F446-D450 WeakPolarHBondContact O-CB 3.3Å; F446-D450 VanDerWaalsContact O-CG 3.28Å; F446-D450 PolarHBondContact O-N 3.03Å; F446-I463 HydrophobicContact CB-CD1 4.15Å; F446-I463 HydrophobicContact CD1-CD1 4.25Å; F446-I463 HydrophobicContact CD2-CD1 3.87Å; F446-I463 HydrophobicContact CE1-CG2 4.45Å; F446-I463 HydrophobicContact CE2-CD1 4.25Å; F446-I463 HydrophobicContact CE2-CG2 3.89Å; F446-I463 HydrophobicContact CG-CD1 3.85Å; F446-I463 HydrophobicContact CZ-CG2 3.84Å; F446-Y468 AromaticContact CD1-CD2 3.68Å; F446-Y468 HydrophobicContact CD1-CD2 3.68Å; F446-Y468 HydrophobicContact CD1-CE2 4.41Å; F446-Y468 HydrophobicContact CE1-CD2 4.08Å; F446-I1130 HydrophobicContact CB-CG2 4.09Å; F446-I1130 HydrophobicContact CD2-CD1 3.98Å; F446-I1130 HydrophobicContact CD2-CG2 3.9Å; F446-I1130 HydrophobicContact CE2-CD1 4.22Å; F446-I1130 HydrophobicContact CG-CG2 4.45Å
447	A	82.4	Confident	84.8	Confident	40 Å²	40	48 Å²	48	33%	0.331	25%	0.245	S	C	.	.	H	α-helix	trans	-67.6	-33.5	169.3	0	0	0	0	0	112.4	N443 E444 K451	N443-A447 WeakPolarHBondContact O-CB 3.48Å; N443-A447 PolarHBondContact O-N 3.46Å; E444-A447 PolarHBondContact O-N 2.89Å; A447-K451 PolarHBondContact O-N 2.85Å
448	R	85.2	Confident	85.3	Confident	95 Å²	95	43.7 Å²	43.7	36%	0.358	23%	0.225	S	C	.	.	H	α-helix	trans	-67.3	-44.3	169.9	-69.3	163.1	175	-109.1	11.1	110.9	E444 L445 F446 K451 L452 L498	E444-R448 VanDerWaalsContact O-CG 3.31Å; E444-R448 WeakPolarHBondContact O-CG 3.42Å; E444-R448 PolarHBondContact O-N 2.85Å; E444-R448 IonicContact OE1-CZ 2.9Å; E444-R448 IonicContact OE1-NE 3.92Å; E444-R448 PolarHBondContact OE1-NE 3.28Å; E444-R448 IonicContact OE1-NH2 2.68Å; E444-R448 PolarHBondContact OE1-NH2 2.77Å; L445-R448 WeakPolarHBondContact O-CB 3.46Å; L445-R448 PolarHBondContact O-N 3.01Å; F446-R448 VanDerWaalsContact C-N 3.33Å; R448-K451 WeakPolarHBondContact O-CB 3.46Å; R448-K451 PolarHBondContact O-N 3.02Å; R448-L452 WeakPolarHBondContact O-CG 3.34Å; R448-L452 PolarHBondContact O-N 3.45Å; R448-L498 VanDerWaalsContact NH1-CD2 3.34Å
449	F	89.9	Confident	85.8	Confident	1 Å²	1	45 Å²	45	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-37.9	175.4	-66.7	-9.4	0	0	0	113	L445 F446 K451 L452 A453 Y468 M492 A495 M509	L445-F449 HydrophobicContact CD1-CD1 4.12Å; L445-F449 HydrophobicContact CD1-CE1 3.47Å; L445-F449 VanDerWaalsContact CD1-CE1 3.47Å; L445-F449 HydrophobicContact CD1-CE2 3.99Å; L445-F449 HydrophobicContact CD1-CZ 3.39Å; L445-F449 HydrophobicContact CD2-CE2 4.37Å; L445-F449 HydrophobicContact CD2-CZ 4.32Å; L445-F449 HydrophobicContact CG-CD2 4.46Å; L445-F449 HydrophobicContact CG-CE1 4.3Å; L445-F449 HydrophobicContact CG-CE2 3.96Å; L445-F449 HydrophobicContact CG-CZ 3.87Å; L445-F449 WeakPolarHBondContact O-CG 3.26Å; L445-F449 PolarHBondContact O-N 2.91Å; F446-F449 AromaticContact CD1-CD2 3.8Å; F446-F449 HydrophobicContact CD1-CD2 3.8Å; F446-F449 HydrophobicContact CD1-CE2 4.33Å; F446-F449 HydrophobicContact CE1-CD2 4.22Å; F446-F449 HydrophobicContact CE1-CE2 4.38Å; F446-F449 PolarHBondContact O-N 3.41Å; F449-K451 VanDerWaalsContact C-N 3.26Å; F449-K451 PolarHBondContact O-N 2.91Å; F449-L452 HydrophobicContact CD1-CD1 4.39Å; F449-L452 PolarHBondContact O-N 2.78Å; F449-A453 VanDerWaalsContact O-CB 3.24Å; F449-A453 WeakPolarHBondContact O-CB 3.44Å; F449-A453 PolarHBondContact O-N 2.84Å; F449-Y468 HydrophobicContact CB-CD2 4.1Å; F449-Y468 HydrophobicContact CB-CE1 4.24Å; F449-Y468 HydrophobicContact CB-CE2 3.7Å; F449-Y468 HydrophobicContact CD2-CD1 4.49Å; F449-Y468 AromaticContact CD2-CD2 3.98Å; F449-Y468 HydrophobicContact CD2-CD2 3.98Å; F449-Y468 HydrophobicContact CD2-CE2 4.45Å; F449-Y468 AromaticContact CD2-CG 3.99Å; F449-Y468 HydrophobicContact CD2-CG 3.99Å; F449-Y468 PolarHBondContact O-OH 2.96Å; F449-M492 HydrophobicContact CB-CE 4.35Å; F449-M492 HydrophobicContact CD1-CE 4.22Å; F449-M492 HydrophobicContact CD1-CG 4.09Å; F449-M492 HydrophobicContact CD2-CE 3.4Å; F449-M492 HydrophobicContact CE1-CB 4.21Å; F449-M492 HydrophobicContact CE1-CE 4.36Å; F449-M492 HydrophobicContact CE1-CG 4.07Å; F449-M492 HydrophobicContact CE2-CE 3.59Å; F449-M492 HydrophobicContact CG-CE 3.76Å; F449-M492 HydrophobicContact CG-CG 4.49Å; F449-M492 HydrophobicContact CZ-CB 4.49Å; F449-M492 HydrophobicContact CZ-CE 4.07Å; F449-M492 HydrophobicContact CZ-CG 4.46Å; F449-A495 HydrophobicContact CE1-CB 4.09Å; F449-M509 HydrophobicContact CE2-CE 3.69Å; F449-M509 HydrophobicContact CE2-SD 4.41Å; F449-M509 HydrophobicContact CZ-CE 3.59Å; F449-M509 HydrophobicContact CZ-SD 4.25Å
450	D	86.6	Confident	86.2	Confident	33 Å²	33	45.8 Å²	45.8	18%	0.176	24%	0.235	C	C	.	.	H	α-helix	trans	-57.9	-40.8	172.7	-81.8	-3.4	0	0	0	111	F446 A454 R460 Y468	F446-D450 WeakPolarHBondContact O-CB 3.3Å; F446-D450 VanDerWaalsContact O-CG 3.28Å; F446-D450 PolarHBondContact O-N 3.03Å; D450-A454 PolarHBondContact O-N 3.26Å; D450-A454 VanDerWaalsContact O-N 3.13Å; D450-R460 VanDerWaalsContact OD1-CD 3.28Å; D450-R460 WeakPolarHBondContact OD1-CD 3.29Å; D450-R460 IonicContact OD1-CZ 3.61Å; D450-R460 IonicContact OD1-NE 2.84Å; D450-R460 IonicContact OD1-NH1 3.27Å; D450-R460 PolarHBondContact OD1-NH1 2.81Å; D450-R460 IonicContact OD2-NH1 3.88Å; D450-R460 PolarHBondContact OD2-NH1 3.32Å; D450-Y468 PolarHBondContact OD1-OH 3.36Å
451	K	86.3	Confident	86.7	Confident	119 Å²	119	41.7 Å²	41.7	52%	0.517	22%	0.215	S	C	.	.	H	α-helix	trans	-67.2	-50.4	176.1	-171.4	-167.5	174.3	-101	0	111.5	A447 R448 F449 A453 A454 E455	A447-K451 PolarHBondContact O-N 2.85Å; R448-K451 WeakPolarHBondContact O-CB 3.46Å; R448-K451 PolarHBondContact O-N 3.02Å; F449-K451 VanDerWaalsContact C-N 3.26Å; F449-K451 PolarHBondContact O-N 2.91Å; K451-A453 VanDerWaalsContact C-N 3.26Å; K451-A453 PolarHBondContact O-N 3.26Å; K451-A454 PolarHBondContact O-N 2.69Å; K451-A454 VanDerWaalsContact O-N 3.14Å; K451-E455 WeakPolarHBondContact CE-OE1 3.25Å; K451-E455 IonicContact NZ-OE1 2.72Å; K451-E455 PolarHBondContact NZ-OE1 2.79Å; K451-E455 IonicContact NZ-OE2 3.94Å; K451-E455 PolarHBondContact NZ-OE2 3.4Å; K451-E455 WeakPolarHBondContact O-CG 3.29Å; K451-E455 PolarHBondContact O-N 2.8Å
452	L	90.1	Very high	86.9	Confident	28 Å²	28	40 Å²	40	15%	0.147	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-36.7	178.4	-69.5	174.4	0	0	0	112	R448 F449 E455 N456 M488 D491 A495	R448-L452 WeakPolarHBondContact O-CG 3.34Å; R448-L452 PolarHBondContact O-N 3.45Å; F449-L452 HydrophobicContact CD1-CD1 4.39Å; F449-L452 PolarHBondContact O-N 2.78Å; L452-E455 PolarHBondContact O-N 2.89Å; L452-N456 WeakPolarHBondContact O-CB 3.39Å; L452-N456 PolarHBondContact O-N 3.41Å; L452-N456 PolarHBondContact O-ND2 2.94Å; L452-N456 VanDerWaalsContact O-ND2 3.09Å; L452-M488 HydrophobicContact CB-CE 4.16Å; L452-M488 HydrophobicContact CB-SD 3.73Å; L452-D491 HydrophobicContact CD1-CB 3.89Å; L452-D491 HydrophobicContact CD2-CB 3.9Å; L452-D491 HydrophobicContact CG-CB 4.36Å; L452-A495 HydrophobicContact CD1-CB 4Å
453	A	90	Very high	87.1	Confident	3 Å²	3	40 Å²	40	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-43.1	175.2	0	0	0	0	0	111.3	F449 K451 H457 C458 M488	F449-A453 VanDerWaalsContact O-CB 3.24Å; F449-A453 WeakPolarHBondContact O-CB 3.44Å; F449-A453 PolarHBondContact O-N 2.84Å; K451-A453 VanDerWaalsContact C-N 3.26Å; K451-A453 PolarHBondContact O-N 3.26Å; A453-H457 CarbonylContact O-C 3.58Å; A453-H457 WeakPolarHBondContact O-CA 3.34Å; A453-H457 PolarHBondContact O-N 2.98Å; A453-C458 CarbonylContact C-O 3.59Å; A453-C458 HydrophobicContact CB-CB 4.27Å; A453-C458 WeakPolarHBondContact CB-O 3.24Å; A453-C458 PolarHBondContact O-N 3.28Å; A453-C458 VanDerWaalsContact O-O 3.14Å; A453-M488 HydrophobicContact CB-CE 3.75Å; A453-M488 HydrophobicContact CB-SD 4.23Å; A453-M488 PolarHBondContact N-SD 2.91Å; A453-M488 VanDerWaalsContact N-SD 3.45Å
454	A	86.5	Confident	87.2	Confident	66 Å²	66	41 Å²	41	55%	0.545	21%	0.209	S	C	.	.	H	α-helix	trans	-65.5	-38.7	174.3	0	0	0	0	0	112.8	D450 K451 H457	D450-A454 PolarHBondContact O-N 3.26Å; D450-A454 VanDerWaalsContact O-N 3.13Å; K451-A454 PolarHBondContact O-N 2.69Å; K451-A454 VanDerWaalsContact O-N 3.14Å; A454-H457 PolarHBondContact O-N 2.82Å
455	E	88.6	Confident	87.1	Confident	108 Å²	108	36.8 Å²	36.8	51%	0.505	20%	0.195	S	C	.	.	H	α-helix	trans	-70.6	-36.2	178.8	-71.9	178.2	149.1	0	0	112.6	K451 L452	K451-E455 WeakPolarHBondContact CE-OE1 3.25Å; K451-E455 IonicContact NZ-OE1 2.72Å; K451-E455 PolarHBondContact NZ-OE1 2.79Å; K451-E455 IonicContact NZ-OE2 3.94Å; K451-E455 PolarHBondContact NZ-OE2 3.4Å; K451-E455 WeakPolarHBondContact O-CG 3.29Å; K451-E455 PolarHBondContact O-N 2.8Å; L452-E455 PolarHBondContact O-N 2.89Å
456	N	90.4	Very high	86.9	Confident	26 Å²	26	38 Å²	38	14%	0.139	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	4.4	175.2	-73.8	-70.3	0	0	0	114.5	L452 C458 C484 E487 M488 D491	L452-N456 WeakPolarHBondContact O-CB 3.39Å; L452-N456 PolarHBondContact O-N 3.41Å; L452-N456 PolarHBondContact O-ND2 2.94Å; L452-N456 VanDerWaalsContact O-ND2 3.09Å; N456-C458 PolarHBondContact O-N 2.83Å; N456-C484 WeakPolarHBondContact O-CB 3.21Å; N456-C484 PolarHBondContact O-SG 2.9Å; N456-E487 WeakPolarHBondContact OD1-CB 3.34Å; N456-M488 HydrophobicContact CB-CB 3.96Å; N456-D491 PolarHBondContact ND2-OD2 3.2Å
457	H	90.6	Very high	87	Confident	106 Å²	106	38.6 Å²	38.6	49%	0.491	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	39.7	-177	-47.9	-61.4	0	0	0	115.4	A453 A454 S472 R478	A453-H457 CarbonylContact O-C 3.58Å; A453-H457 WeakPolarHBondContact O-CA 3.34Å; A453-H457 PolarHBondContact O-N 2.98Å; A454-H457 PolarHBondContact O-N 2.82Å; H457-S472 PolarHBondContact O-OG 3.46Å; H457-S472 VanDerWaalsContact O-OG 3.12Å; H457-R478 PolarHBondContact CD2-NH2 3.06Å
458	C	91.4	Very high	87.4	Confident	8 Å²	8	36.8 Å²	36.8	5%	0.054	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.5	166.5	-64.1	0	0	0	0	110.2	A453 N456 C470	A453-C458 CarbonylContact C-O 3.59Å; A453-C458 HydrophobicContact CB-CB 4.27Å; A453-C458 WeakPolarHBondContact CB-O 3.24Å; A453-C458 PolarHBondContact O-N 3.28Å; A453-C458 VanDerWaalsContact O-O 3.14Å; N456-C458 PolarHBondContact O-N 2.83Å; C458-C470 HydrophobicContact CB-CB 4.16Å
459	L	89.1	Confident	87.7	Confident	36 Å²	36	32.4 Å²	32.4	19%	0.188	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	116.5	170.5	179.4	63.4	0	0	0	109.3	I461 C470 V471 L474 F530	L459-I461 HydrophobicContact CD2-CD1 4.08Å; L459-I461 HydrophobicContact CG-CD1 4.14Å; L459-I461 PolarHBondContact O-N 3.04Å; L459-C470 CarbonylContact O-C 3.59Å; L459-C470 VanDerWaalsContact O-CA 3.24Å; L459-C470 WeakPolarHBondContact O-CA 3.37Å; L459-C470 VanDerWaalsContact O-CB 3.29Å; L459-C470 WeakPolarHBondContact O-CB 3.46Å; L459-V471 PolarHBondContact N-O 3.13Å; L459-V471 PolarHBondContact O-N 2.66Å; L459-L474 HydrophobicContact CD2-CB 3.92Å; L459-F530 HydrophobicContact CD2-CE1 3.86Å
460	R	88.8	Confident	87.9	Confident	17 Å²	17	32.4 Å²	32.4	6%	0.064	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	122.8	165.7	-170.3	-173.1	92.7	-160.2	11.3	109	D450 Y468 K1134	D450-R460 VanDerWaalsContact OD1-CD 3.28Å; D450-R460 WeakPolarHBondContact OD1-CD 3.29Å; D450-R460 IonicContact OD1-CZ 3.61Å; D450-R460 IonicContact OD1-NE 2.84Å; D450-R460 IonicContact OD1-NH1 3.27Å; D450-R460 PolarHBondContact OD1-NH1 2.81Å; D450-R460 IonicContact OD2-NH1 3.88Å; D450-R460 PolarHBondContact OD2-NH1 3.32Å; R460-Y468 VanDerWaalsContact CD-CE2 3.43Å; R460-Y468 HydrophobicContact CG-CE1 4.34Å; R460-Y468 HydrophobicContact CG-CE2 3.87Å; R460-K1134 PolarHBondContact NH2-O 3.02Å
461	I	87.9	Confident	88.2	Confident	15 Å²	15	30.8 Å²	30.8	8%	0.077	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-60.4	171.3	-50.9	-57.2	0	0	0	108.1	L459 Y469 V471 L474 F530 V532	L459-I461 HydrophobicContact CD2-CD1 4.08Å; L459-I461 HydrophobicContact CG-CD1 4.14Å; L459-I461 PolarHBondContact O-N 3.04Å; I461-Y469 HydrophobicContact CB-CD1 3.74Å; I461-Y469 HydrophobicContact CB-CE1 3.87Å; I461-Y469 HydrophobicContact CG1-CD1 4.24Å; I461-Y469 HydrophobicContact CG1-CE1 3.97Å; I461-Y469 HydrophobicContact CG2-CD1 4.11Å; I461-Y469 HydrophobicContact CG2-CE1 4.02Å; I461-Y469 PolarHBondContact N-O 2.93Å; I461-V471 HydrophobicContact CD1-CB 4.36Å; I461-V471 HydrophobicContact CD1-CG2 4.23Å; I461-V471 HydrophobicContact CG1-CB 4.34Å; I461-V471 HydrophobicContact CG1-CG2 3.8Å; I461-L474 HydrophobicContact CD1-CD1 4.26Å; I461-F530 HydrophobicContact CD1-CD1 4.19Å; I461-F530 HydrophobicContact CD1-CE1 3.92Å; I461-V532 HydrophobicContact CD1-CG1 4.05Å; I461-V532 HydrophobicContact CG1-CG1 4.4Å; I461-V532 HydrophobicContact CG2-CG1 4.45Å
462	K	85.4	Confident	88.7	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.009	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	158.8	-165.2	-153.5	146.6	172.8	160.3	0	113.3	L464 Y469 D531 T1065	K462-L464 HydrophobicContact CD-CD2 4.07Å; K462-L464 HydrophobicContact CG-CD2 3.86Å; K462-L464 HydrophobicContact CG-CG 4.32Å; K462-Y469 HydrophobicContact CB-CD1 4.45Å; K462-Y469 PolarHBondContact N-O 3.36Å; K462-Y469 PolarHBondContact O-N 3.4Å; K462-D531 VanDerWaalsContact CD-OD2 3.24Å; K462-D531 WeakPolarHBondContact CD-OD2 3.18Å; K462-D531 WeakPolarHBondContact CE-OD2 3.45Å; K462-D531 IonicContact NZ-OD2 3.73Å; K462-D531 PolarHBondContact NZ-OD2 2.58Å; K462-T1065 WeakPolarHBondContact CE-O 3.25Å; K462-T1065 PolarHBondContact NZ-O 3.28Å
463	I	85.4	Confident	88.7	Confident	4 Å²	4	23.9 Å²	23.9	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.3	163.2	-58.2	173.8	0	0	0	107.6	F446 Y468 K1064 I1130	F446-I463 HydrophobicContact CB-CD1 4.15Å; F446-I463 HydrophobicContact CD1-CD1 4.25Å; F446-I463 HydrophobicContact CD2-CD1 3.87Å; F446-I463 HydrophobicContact CE1-CG2 4.45Å; F446-I463 HydrophobicContact CE2-CD1 4.25Å; F446-I463 HydrophobicContact CE2-CG2 3.89Å; F446-I463 HydrophobicContact CG-CD1 3.85Å; F446-I463 HydrophobicContact CZ-CG2 3.84Å; I463-Y468 HydrophobicContact CD1-CD2 4.48Å; I463-Y468 HydrophobicContact CG1-CD2 4.16Å; I463-K1064 PolarHBondContact O-NZ 3.46Å; I463-I1130 HydrophobicContact CD1-CG2 4.06Å
464	L	83	Confident	88.5	Confident	42 Å²	42	24.3 Å²	24.3	22%	0.22	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	71.7	-174.2	-63.3	178.2	0	0	0	108.9	F420 K462 D466 C467 K1064 I1066	F420-L464 HydrophobicContact CE1-CD1 4.34Å; K462-L464 HydrophobicContact CD-CD2 4.07Å; K462-L464 HydrophobicContact CG-CD2 3.86Å; K462-L464 HydrophobicContact CG-CG 4.32Å; L464-D466 PolarHBondContact O-N 3.13Å; L464-C467 HydrophobicContact CB-CB 4.43Å; L464-C467 PolarHBondContact N-O 2.74Å; L464-C467 PolarHBondContact O-N 3.22Å; L464-K1064 HydrophobicContact CD2-CD 4.2Å; L464-I1066 HydrophobicContact CD1-CG2 4.31Å; L464-I1066 HydrophobicContact CD2-CD1 4.05Å; L464-I1066 HydrophobicContact CD2-CG1 4.03Å; L464-I1066 HydrophobicContact CD2-CG2 4.17Å
465	G	78.6	Confident	88	Confident	18 Å²	18	23.6 Å²	23.6	19%	0.186	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	-109	-174.6	0	0	0	0	0	111.2	W1140	G465-W1140 PolarHBondContact O-NE1 2.69Å
466	D	82.2	Confident	87.8	Confident	30 Å²	30	24.4 Å²	24.4	16%	0.16	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-23.4	172.4	21.9	11.7	0	0	0	113.5	I423 F426 L464	I423-D466 HydrophobicContact CB-CB 4.37Å; F426-D466 HydrophobicContact CB-CB 3.85Å; F426-D466 HydrophobicContact CD1-CB 3.58Å; F426-D466 WeakPolarHBondContact CD1-OD2 3.24Å; F426-D466 HydrophobicContact CD2-CB 4.35Å; F426-D466 HydrophobicContact CE1-CB 4.2Å; F426-D466 HydrophobicContact CG-CB 3.64Å; L464-D466 PolarHBondContact O-N 3.13Å
467	C	88.1	Confident	87.6	Confident	14 Å²	14	27.1 Å²	27.1	10%	0.095	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	127.9	-175.3	-175.5	0	0	0	0	112.7	A421 D422 L464	A421-C467 CarbonylContact O-C 3.47Å; A421-C467 WeakPolarHBondContact O-CA 3.39Å; A421-C467 PolarHBondContact O-SG 2.82Å; D422-C467 HydrophobicContact CB-CB 4.35Å; L464-C467 HydrophobicContact CB-CB 4.43Å; L464-C467 PolarHBondContact N-O 2.74Å; L464-C467 PolarHBondContact O-N 3.22Å
468	Y	91.2	Very high	87.6	Confident	1 Å²	1	25.5 Å²	25.5	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.6	174.1	-175.4	-86.1	0	0	0	110.2	A421 F446 F449 D450 R460 I463 C470 M488 M492	A421-Y468 PolarHBondContact N-O 3.26Å; A421-Y468 PolarHBondContact O-N 2.95Å; F446-Y468 AromaticContact CD1-CD2 3.68Å; F446-Y468 HydrophobicContact CD1-CD2 3.68Å; F446-Y468 HydrophobicContact CD1-CE2 4.41Å; F446-Y468 HydrophobicContact CE1-CD2 4.08Å; F449-Y468 HydrophobicContact CB-CD2 4.1Å; F449-Y468 HydrophobicContact CB-CE1 4.24Å; F449-Y468 HydrophobicContact CB-CE2 3.7Å; F449-Y468 HydrophobicContact CD2-CD1 4.49Å; F449-Y468 AromaticContact CD2-CD2 3.98Å; F449-Y468 HydrophobicContact CD2-CD2 3.98Å; F449-Y468 HydrophobicContact CD2-CE2 4.45Å; F449-Y468 AromaticContact CD2-CG 3.99Å; F449-Y468 HydrophobicContact CD2-CG 3.99Å; F449-Y468 PolarHBondContact O-OH 2.96Å; D450-Y468 PolarHBondContact OD1-OH 3.36Å; R460-Y468 VanDerWaalsContact CD-CE2 3.43Å; R460-Y468 HydrophobicContact CG-CE1 4.34Å; R460-Y468 HydrophobicContact CG-CE2 3.87Å; I463-Y468 HydrophobicContact CD1-CD2 4.48Å; I463-Y468 HydrophobicContact CG1-CD2 4.16Å; Y468-C470 HydrophobicContact CE1-CB 4.1Å; Y468-M488 HydrophobicContact CE1-CE 3.94Å; Y468-M492 HydrophobicContact CD1-CE 3.38Å; Y468-M492 HydrophobicContact CE1-CE 4.03Å; Y468-M492 HydrophobicContact CG-CE 3.83Å
469	Y	91.3	Very high	87.5	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.4	-171.8	178.7	-127.6	0	0	0	113.2	I418 L419 F420 I461 K462 V471 V532 V537	I418-Y469 HydrophobicContact CG2-CE2 3.55Å; I418-Y469 VanDerWaalsContact CG2-OH 3.31Å; I418-Y469 WeakPolarHBondContact CG2-OH 3.4Å; L419-Y469 VanDerWaalsContact O-CD2 3.24Å; L419-Y469 WeakPolarHBondContact O-CD2 3.45Å; F420-Y469 AromaticContact CD1-CD2 3.58Å; F420-Y469 HydrophobicContact CD1-CD2 3.58Å; F420-Y469 HydrophobicContact CD1-CE2 4.26Å; F420-Y469 HydrophobicContact CD1-CG 4.01Å; F420-Y469 AromaticContact CD2-CD2 3.67Å; F420-Y469 HydrophobicContact CD2-CD2 3.67Å; F420-Y469 AromaticContact CD2-CE2 3.6Å; F420-Y469 HydrophobicContact CD2-CE2 3.6Å; F420-Y469 HydrophobicContact CE1-CD1 4.2Å; F420-Y469 AromaticContact CE1-CD2 3.47Å; F420-Y469 HydrophobicContact CE1-CD2 3.47Å; F420-Y469 VanDerWaalsContact CE1-CD2 3.47Å; F420-Y469 AromaticContact CE1-CE2 3.92Å; F420-Y469 HydrophobicContact CE1-CE2 3.92Å; F420-Y469 AromaticContact CE1-CG 3.67Å; F420-Y469 HydrophobicContact CE1-CG 3.67Å; F420-Y469 AromaticContact CE2-CD2 3.57Å; F420-Y469 HydrophobicContact CE2-CD2 3.57Å; F420-Y469 AromaticContact CE2-CE2 3.2Å; F420-Y469 HydrophobicContact CE2-CE2 3.2Å; F420-Y469 HydrophobicContact CE2-CG 4.46Å; F420-Y469 AromaticContact CE2-CZ 3.81Å; F420-Y469 AromaticContact CG-CD2 3.68Å; F420-Y469 HydrophobicContact CG-CD2 3.68Å; F420-Y469 HydrophobicContact CG-CE2 4.12Å; F420-Y469 HydrophobicContact CZ-CD1 4.2Å; F420-Y469 AromaticContact CZ-CD2 3.47Å; F420-Y469 HydrophobicContact CZ-CD2 3.47Å; F420-Y469 VanDerWaalsContact CZ-CD2 3.47Å; F420-Y469 HydrophobicContact CZ-CE1 4.08Å; F420-Y469 AromaticContact CZ-CE2 3.38Å; F420-Y469 HydrophobicContact CZ-CE2 3.38Å; F420-Y469 AromaticContact CZ-CG 3.92Å; F420-Y469 HydrophobicContact CZ-CG 3.92Å; F420-Y469 AromaticContact CZ-CZ 3.7Å; I461-Y469 HydrophobicContact CB-CD1 3.74Å; I461-Y469 HydrophobicContact CB-CE1 3.87Å; I461-Y469 HydrophobicContact CG1-CD1 4.24Å; I461-Y469 HydrophobicContact CG1-CE1 3.97Å; I461-Y469 HydrophobicContact CG2-CD1 4.11Å; I461-Y469 HydrophobicContact CG2-CE1 4.02Å; I461-Y469 PolarHBondContact N-O 2.93Å; K462-Y469 HydrophobicContact CB-CD1 4.45Å; K462-Y469 PolarHBondContact N-O 3.36Å; K462-Y469 PolarHBondContact O-N 3.4Å; Y469-V471 HydrophobicContact CE2-CG2 4.31Å; Y469-V532 HydrophobicContact CE1-CG2 3.71Å; Y469-V532 WeakPolarHBondContact OH-CG2 3.38Å; Y469-V537 WeakPolarHBondContact OH-CG1 3.45Å
470	C	93.3	Very high	87.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	159.6	-179.8	70.8	0	0	0	0	113.7	L419 C458 L459 Y468	L419-C470 PolarHBondContact N-O 3.4Å; L419-C470 PolarHBondContact O-N 3.4Å; L419-C470 VanDerWaalsContact O-N 3.08Å; C458-C470 HydrophobicContact CB-CB 4.16Å; L459-C470 CarbonylContact O-C 3.59Å; L459-C470 VanDerWaalsContact O-CA 3.24Å; L459-C470 WeakPolarHBondContact O-CA 3.37Å; L459-C470 VanDerWaalsContact O-CB 3.29Å; L459-C470 WeakPolarHBondContact O-CB 3.46Å; Y468-C470 HydrophobicContact CE1-CB 4.1Å
471	V	94.9	Very high	87.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.1	-178.4	179.4	0	0	0	0	110	V416 S417 I418 L459 I461 Y469 L474 V532	V416-V471 HydrophobicContact CB-CG1 3.9Å; V416-V471 HydrophobicContact CG1-CG1 4.4Å; V416-V471 HydrophobicContact CG2-CG1 4.21Å; S417-V471 CarbonylContact O-C 3.51Å; S417-V471 VanDerWaalsContact O-CA 3.24Å; S417-V471 WeakPolarHBondContact O-CA 3.45Å; S417-V471 WeakPolarHBondContact O-CG1 3.38Å; I418-V471 HydrophobicContact CG2-CG2 4.45Å; L459-V471 PolarHBondContact N-O 3.13Å; L459-V471 PolarHBondContact O-N 2.66Å; I461-V471 HydrophobicContact CD1-CB 4.36Å; I461-V471 HydrophobicContact CD1-CG2 4.23Å; I461-V471 HydrophobicContact CG1-CB 4.34Å; I461-V471 HydrophobicContact CG1-CG2 3.8Å; Y469-V471 HydrophobicContact CE2-CG2 4.31Å; V471-L474 HydrophobicContact CB-CD1 4.01Å; V471-L474 HydrophobicContact CB-CG 4.41Å; V471-L474 HydrophobicContact CG1-CB 4.4Å; V471-L474 HydrophobicContact CG1-CD1 3.7Å; V471-L474 HydrophobicContact CG1-CG 3.75Å; V471-L474 HydrophobicContact CG2-CD1 4.49Å; V471-V532 HydrophobicContact CG2-CG2 4.44Å
472	S	95.3	Very high	88.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.9	169	-163.5	0	0	0	0	110.6	V416 S417 H457 H481 C484 C485	V416-S472 CarbonylContact C-O 3.55Å; V416-S472 WeakPolarHBondContact CA-O 3.39Å; V416-S472 WeakPolarHBondContact CB-O 3.32Å; S417-S472 PolarHBondContact N-O 2.81Å; S417-S472 PolarHBondContact O-N 3.47Å; H457-S472 PolarHBondContact O-OG 3.46Å; H457-S472 VanDerWaalsContact O-OG 3.12Å; S472-H481 WeakPolarHBondContact CB-O 3.28Å; S472-C484 VanDerWaalsContact OG-CB 3.25Å; S472-C484 WeakPolarHBondContact OG-CB 3.45Å; S472-C485 VanDerWaalsContact CB-SG 3.53Å
473	G	89.9	Confident	88.6	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.01	19%	0.186	C	C	.	.	S	Bend	trans	92.4	7.8	-168.2	0	0	0	0	0	114.7	E476	G473-E476 CarbonylContact C-O 3.55Å; G473-E476 CarbonylContact O-C 3.55Å
474	L	86.6	Confident	89	Confident	12 Å²	12	30.9 Å²	30.9	6%	0.063	19%	0.189	C	C	.	.			trans	-118.6	141.7	170.1	-69	-175.6	0	0	0	111.4	H413 V416 L459 I461 V471 E476 V518 C520 V532	H413-L474 HydrophobicContact CB-CD2 3.54Å; H413-L474 VanDerWaalsContact CD2-CD2 3.43Å; H413-L474 WeakPolarHBondContact CD2-CD2 3.38Å; V416-L474 HydrophobicContact CG1-CD2 4.19Å; V416-L474 HydrophobicContact CG1-CG 4.26Å; L459-L474 HydrophobicContact CD2-CB 3.92Å; I461-L474 HydrophobicContact CD1-CD1 4.26Å; V471-L474 HydrophobicContact CB-CD1 4.01Å; V471-L474 HydrophobicContact CB-CG 4.41Å; V471-L474 HydrophobicContact CG1-CB 4.4Å; V471-L474 HydrophobicContact CG1-CD1 3.7Å; V471-L474 HydrophobicContact CG1-CG 3.75Å; V471-L474 HydrophobicContact CG2-CD1 4.49Å; L474-E476 VanDerWaalsContact C-N 3.32Å; L474-V518 HydrophobicContact CD1-CG2 4.13Å; L474-V518 HydrophobicContact CD2-CG2 4.13Å; L474-V518 HydrophobicContact CG-CG2 4.43Å; L474-C520 HydrophobicContact CD1-CB 4.1Å; L474-V532 HydrophobicContact CD1-CG1 3.87Å
475	P	76.2	Confident	89.6	Confident	51 Å²	51	28.9 Å²	28.9	33%	0.331	18%	0.178	S	C	.	.	S	Bend	cis	-80.7	-11.2	-12.3	35.8	-35.5	0	0	0	112.8	H387 H413	H387-P475 VanDerWaalsContact CE1-CB 3.48Å; H387-P475 WeakPolarHBondContact CE1-CB 3.25Å; H413-P475 PolarHBondContact CE1-O 2.86Å
476	E	83.3	Confident	90.3	Very high	125 Å²	125	28 Å²	28	58%	0.584	17%	0.169	S	C	*	.	S	Bend	trans	-94.8	121.2	178	-70.7	172.1	-164.8	0	0	109.8	G473 L474 F627	G473-E476 CarbonylContact C-O 3.55Å; G473-E476 CarbonylContact O-C 3.55Å; L474-E476 VanDerWaalsContact C-N 3.32Å; E476-F627 VanDerWaalsContact OE1-CZ 3.3Å; E476-F627 WeakPolarHBondContact OE1-CZ 3.38Å
477	A	86.3	Confident	90.8	Very high	83 Å²	83	27.4 Å²	27.4	69%	0.686	17%	0.165	S	C	*	.			trans	-65.3	139.8	176.4	0	0	0	0	0	110.8
478	R	90.7	Very high	91.1	Very high	73 Å²	73	26.8 Å²	26.8	28%	0.275	16%	0.161	S	C	.	.			trans	-148.1	147.6	-173	68.4	-169.1	-64	126	5.2	111	H457 D480 H481	H457-R478 PolarHBondContact CD2-NH2 3.06Å; R478-D480 WeakPolarHBondContact CB-OD1 3.29Å; R478-D480 WeakPolarHBondContact CG-OD1 3.43Å; R478-D480 IonicContact CZ-OD1 2.67Å; R478-D480 VanDerWaalsContact CZ-OD1 3.3Å; R478-D480 IonicContact CZ-OD2 3.91Å; R478-D480 IonicContact NE-OD1 3.55Å; R478-D480 PolarHBondContact NE-OD1 3.04Å; R478-D480 IonicContact NE-OD2 3.79Å; R478-D480 IonicContact NH2-OD1 3.06Å; R478-D480 PolarHBondContact NH2-OD1 3.31Å; R478-D480 VanDerWaalsContact NH2-OD1 3.15Å; R478-D480 IonicContact NH2-OD2 3.81Å; R478-D480 PolarHBondContact NH2-OD2 3.38Å; R478-H481 HydrophobicContact CG-CB 3.93Å; R478-H481 PolarHBondContact O-CD2 2.83Å; R478-H481 VanDerWaalsContact O-CD2 3.24Å
479	A	89.2	Confident	91.2	Very high	99 Å²	99	26.7 Å²	26.7	82%	0.818	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-18.7	-174.7	0	0	0	0	0	114.6
480	D	92.1	Very high	91.2	Very high	64 Å²	64	29.2 Å²	29.2	34%	0.342	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	13.8	-179.2	60.6	-23.5	0	0	0	113.1	R478 A482 H483 C484	R478-D480 WeakPolarHBondContact CB-OD1 3.29Å; R478-D480 WeakPolarHBondContact CG-OD1 3.43Å; R478-D480 IonicContact CZ-OD1 2.67Å; R478-D480 VanDerWaalsContact CZ-OD1 3.3Å; R478-D480 IonicContact CZ-OD2 3.91Å; R478-D480 IonicContact NE-OD1 3.55Å; R478-D480 PolarHBondContact NE-OD1 3.04Å; R478-D480 IonicContact NE-OD2 3.79Å; R478-D480 IonicContact NH2-OD1 3.06Å; R478-D480 PolarHBondContact NH2-OD1 3.31Å; R478-D480 VanDerWaalsContact NH2-OD1 3.15Å; R478-D480 IonicContact NH2-OD2 3.81Å; R478-D480 PolarHBondContact NH2-OD2 3.38Å; D480-A482 VanDerWaalsContact C-N 3.29Å; D480-A482 PolarHBondContact O-N 3.23Å; D480-A482 VanDerWaalsContact O-N 3.17Å; D480-H483 WeakPolarHBondContact O-CB 3.24Å; D480-H483 PolarHBondContact O-N 2.99Å; D480-C484 PolarHBondContact O-N 2.9Å
481	H	94.7	Very high	91.1	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.019	19%	0.188	C	C	.	.	H	α-helix	trans	-52.5	-41	-172.2	62.5	80.8	0	0	0	113.8	N415 S417 S472 R478 C485 Y561	N415-H481 PolarHBondContact O-CD2 3.09Å; S417-H481 PolarHBondContact OG-ND1 2.86Å; S472-H481 WeakPolarHBondContact CB-O 3.28Å; R478-H481 HydrophobicContact CG-CB 3.93Å; R478-H481 PolarHBondContact O-CD2 2.83Å; R478-H481 VanDerWaalsContact O-CD2 3.24Å; H481-C485 PolarHBondContact O-N 2.67Å; H481-Y561 AromaticContact CE1-CD1 3.85Å; H481-Y561 AromaticContact CE1-CD2 3.73Å; H481-Y561 AromaticContact CE1-CG 3.64Å; H481-Y561 AromaticContact NE2-CD1 3.63Å; H481-Y561 AromaticContact NE2-CE1 3.8Å; H481-Y561 AromaticContact NE2-CG 3.91Å
482	A	94.8	Very high	91	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71.2	-39.2	179.6	0	0	0	0	0	111.8	D480 C485 V486 T558 Y561 L562	D480-A482 VanDerWaalsContact C-N 3.29Å; D480-A482 PolarHBondContact O-N 3.23Å; D480-A482 VanDerWaalsContact O-N 3.17Å; A482-C485 PolarHBondContact O-N 3.03Å; A482-V486 WeakPolarHBondContact O-CG2 3.44Å; A482-V486 PolarHBondContact O-N 3.11Å; A482-T558 HydrophobicContact CB-CG2 4.39Å; A482-Y561 HydrophobicContact CB-CG 4.49Å; A482-L562 HydrophobicContact CB-CD2 3.87Å; A482-L562 HydrophobicContact CB-CG 4.45Å
483	H	93.8	Very high	90.7	Very high	17 Å²	17	33.3 Å²	33.3	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-46.3	175.1	-61.3	85.8	0	0	0	111.1	D480 C485 V486 E487 Y561 D565 Y566 R597	D480-H483 WeakPolarHBondContact O-CB 3.24Å; D480-H483 PolarHBondContact O-N 2.99Å; H483-C485 VanDerWaalsContact C-N 3.33Å; H483-C485 PolarHBondContact O-N 2.84Å; H483-V486 PolarHBondContact O-N 2.86Å; H483-V486 VanDerWaalsContact O-N 3.09Å; H483-E487 VanDerWaalsContact O-CG 3.24Å; H483-E487 WeakPolarHBondContact O-CG 3.45Å; H483-E487 PolarHBondContact O-N 3.38Å; H483-Y561 PolarHBondContact CE1-O 2.87Å; H483-Y561 VanDerWaalsContact CE1-O 3.23Å; H483-D565 IonicContact CD2-OD2 3.62Å; H483-D565 IonicContact NE2-OD2 3.98Å; H483-D565 PolarHBondContact NE2-OD2 2.71Å; H483-D565 VanDerWaalsContact NE2-OD2 3.09Å; H483-Y566 AromaticContact CD2-CE2 3.73Å; H483-R597 PolarHBondContact CD2-NH1 3.5Å
484	C	94.2	Very high	90.6	Very high	11 Å²	11	40.2 Å²	40.2	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-51.5	-48.5	174.9	-78.1	0	0	0	0	112.6	N456 S472 D480 M488	N456-C484 WeakPolarHBondContact O-CB 3.21Å; N456-C484 PolarHBondContact O-SG 2.9Å; S472-C484 VanDerWaalsContact OG-CB 3.25Å; S472-C484 WeakPolarHBondContact OG-CB 3.45Å; D480-C484 PolarHBondContact O-N 2.9Å; C484-M488 VanDerWaalsContact O-CB 3.27Å; C484-M488 WeakPolarHBondContact O-CB 3.45Å; C484-M488 PolarHBondContact O-N 2.67Å
485	C	94.7	Very high	90.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66	-38.6	176.5	-75.1	0	0	0	0	113.1	S417 L419 S472 H481 A482 H483 G489 I513	S417-C485 PolarHBondContact O-SG 3.12Å; S417-C485 VanDerWaalsContact O-SG 3.33Å; L419-C485 HydrophobicContact CB-CB 4.44Å; L419-C485 HydrophobicContact CD1-CB 4.29Å; L419-C485 WeakPolarHBondContact CD1-O 2.94Å; S472-C485 VanDerWaalsContact CB-SG 3.53Å; H481-C485 PolarHBondContact O-N 2.67Å; A482-C485 PolarHBondContact O-N 3.03Å; H483-C485 VanDerWaalsContact C-N 3.33Å; H483-C485 PolarHBondContact O-N 2.84Å; C485-G489 PolarHBondContact O-N 2.91Å; C485-I513 HydrophobicContact CB-CD1 4.14Å; C485-I513 HydrophobicContact CB-CG2 3.94Å; C485-I513 WeakPolarHBondContact O-CD1 3.45Å
486	V	93.9	Very high	91.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-45.1	178	165.9	0	0	0	0	111.8	A482 H483 G489 L490 I513 I552 L562 Y566 I590	A482-V486 WeakPolarHBondContact O-CG2 3.44Å; A482-V486 PolarHBondContact O-N 3.11Å; H483-V486 PolarHBondContact O-N 2.86Å; H483-V486 VanDerWaalsContact O-N 3.09Å; V486-G489 PolarHBondContact O-N 3.04Å; V486-L490 WeakPolarHBondContact O-CG 3.47Å; V486-L490 PolarHBondContact O-N 2.98Å; V486-L490 VanDerWaalsContact O-N 3.08Å; V486-I513 HydrophobicContact CG2-CD1 3.98Å; V486-I552 WeakPolarHBondContact O-CD1 3.21Å; V486-L562 HydrophobicContact CB-CD2 4.41Å; V486-L562 HydrophobicContact CG2-CD1 3.91Å; V486-L562 HydrophobicContact CG2-CD2 3.81Å; V486-Y566 HydrophobicContact CG1-CD1 4.01Å; V486-Y566 HydrophobicContact CG1-CD2 4.49Å; V486-Y566 HydrophobicContact CG1-CE1 3.54Å; V486-Y566 HydrophobicContact CG1-CE2 4.07Å; V486-Y566 HydrophobicContact CG1-CG 4.46Å; V486-I590 HydrophobicContact CB-CD1 4.21Å; V486-I590 HydrophobicContact CG1-CD1 3.5Å; V486-I590 VanDerWaalsContact CG1-CD1 3.5Å; V486-I590 HydrophobicContact CG2-CD1 3.61Å
487	E	92.9	Very high	91.2	Very high	17 Å²	17	33.9 Å²	33.9	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-65.4	-44.5	178.9	-56.3	-79	-156.2	0	0	110.2	N456 H483 G489 L490 D491 Y566 R597 K601	N456-E487 WeakPolarHBondContact OD1-CB 3.34Å; H483-E487 VanDerWaalsContact O-CG 3.24Å; H483-E487 WeakPolarHBondContact O-CG 3.45Å; H483-E487 PolarHBondContact O-N 3.38Å; E487-G489 VanDerWaalsContact C-N 3.29Å; E487-G489 PolarHBondContact O-N 3.11Å; E487-L490 WeakPolarHBondContact O-CB 3.46Å; E487-L490 PolarHBondContact O-N 2.84Å; E487-D491 PolarHBondContact O-N 2.98Å; E487-Y566 VanDerWaalsContact CD-OH 3.24Å; E487-Y566 PolarHBondContact OE1-OH 3.21Å; E487-Y566 VanDerWaalsContact OE1-OH 3.05Å; E487-R597 IonicContact OE1-CZ 2.65Å; E487-R597 IonicContact OE1-NE 2.86Å; E487-R597 PolarHBondContact OE1-NE 3.35Å; E487-R597 IonicContact OE1-NH2 3.84Å; E487-R597 PolarHBondContact OE1-NH2 3.13Å; E487-K601 WeakPolarHBondContact OE1-CE 3.18Å; E487-K601 IonicContact OE1-NZ 2.76Å; E487-K601 PolarHBondContact OE1-NZ 2.67Å; E487-K601 IonicContact OE2-NZ 3.38Å; E487-K601 PolarHBondContact OE2-NZ 3.08Å
488	M	93.7	Very high	90.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-53.9	-43.7	170.7	177.8	63.5	-176.3	0	0	112.5	L419 L452 A453 N456 Y468 C484 L490 D491 M492	L419-M488 HydrophobicContact CD1-CB 4.39Å; L419-M488 HydrophobicContact CD1-CG 4.25Å; L452-M488 HydrophobicContact CB-CE 4.16Å; L452-M488 HydrophobicContact CB-SD 3.73Å; A453-M488 HydrophobicContact CB-CE 3.75Å; A453-M488 HydrophobicContact CB-SD 4.23Å; A453-M488 PolarHBondContact N-SD 2.91Å; A453-M488 VanDerWaalsContact N-SD 3.45Å; N456-M488 HydrophobicContact CB-CB 3.96Å; Y468-M488 HydrophobicContact CE1-CE 3.94Å; C484-M488 VanDerWaalsContact O-CB 3.27Å; C484-M488 WeakPolarHBondContact O-CB 3.45Å; C484-M488 PolarHBondContact O-N 2.67Å; M488-L490 VanDerWaalsContact C-N 3.31Å; M488-L490 PolarHBondContact O-N 2.88Å; M488-D491 PolarHBondContact O-N 2.92Å; M488-M492 HydrophobicContact CE-CE 4.12Å; M488-M492 HydrophobicContact CE-CG 3.82Å; M488-M492 HydrophobicContact CE-SD 3.75Å; M488-M492 HydrophobicContact CG-SD 4.29Å; M488-M492 WeakPolarHBondContact O-CB 3.23Å; M488-M492 VanDerWaalsContact O-CG 3.24Å; M488-M492 WeakPolarHBondContact O-CG 3.44Å; M488-M492 PolarHBondContact O-N 3.21Å; M488-M492 HydrophobicContact SD-CG 4.36Å
489	G	93.1	Very high	90.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-31.8	177.4	0	0	0	0	0	113.8	C485 V486 E487 I493	C485-G489 PolarHBondContact O-N 2.91Å; V486-G489 PolarHBondContact O-N 3.04Å; E487-G489 VanDerWaalsContact C-N 3.29Å; E487-G489 PolarHBondContact O-N 3.11Å; G489-I493 WeakPolarHBondContact O-CD1 3.2Å; G489-I493 WeakPolarHBondContact O-CG1 3.17Å; G489-I493 PolarHBondContact O-N 2.91Å
490	L	91.4	Very high	89.8	Confident	57 Å²	57	30 Å²	30	30%	0.298	15%	0.153	S	C	.	.	H	α-helix	trans	-72.1	-49	174.4	-67.7	172.6	0	0	0	110.3	V486 E487 M488 M492 I493 E494 I552	V486-L490 WeakPolarHBondContact O-CG 3.47Å; V486-L490 PolarHBondContact O-N 2.98Å; V486-L490 VanDerWaalsContact O-N 3.08Å; E487-L490 WeakPolarHBondContact O-CB 3.46Å; E487-L490 PolarHBondContact O-N 2.84Å; M488-L490 VanDerWaalsContact C-N 3.31Å; M488-L490 PolarHBondContact O-N 2.88Å; L490-M492 VanDerWaalsContact C-N 3.26Å; L490-M492 PolarHBondContact O-N 2.82Å; L490-I493 PolarHBondContact O-N 3.19Å; L490-E494 PolarHBondContact O-N 3.3Å; L490-I552 HydrophobicContact CD2-CD1 3.68Å; L490-I552 HydrophobicContact CG-CD1 3.7Å
491	D	91.9	Very high	89.3	Confident	52 Å²	52	33.6 Å²	33.6	28%	0.278	17%	0.168	S	C	.	.	H	α-helix	trans	-61.3	-34.3	-179.7	-65.1	-12.4	0	0	0	112	L452 N456 E487 M488 E494 A495	L452-D491 HydrophobicContact CD1-CB 3.89Å; L452-D491 HydrophobicContact CD2-CB 3.9Å; L452-D491 HydrophobicContact CG-CB 4.36Å; N456-D491 PolarHBondContact ND2-OD2 3.2Å; E487-D491 PolarHBondContact O-N 2.98Å; M488-D491 PolarHBondContact O-N 2.92Å; D491-E494 PolarHBondContact O-N 2.97Å; D491-A495 VanDerWaalsContact O-CB 3.24Å; D491-A495 WeakPolarHBondContact O-CB 3.29Å; D491-A495 PolarHBondContact O-N 3.4Å
492	M	92.3	Very high	88.4	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.2	-38.3	172.8	-74.9	179.1	107.3	0	0	113.1	L419 A421 F449 Y468 M488 L490 I496 M509	L419-M492 HydrophobicContact CD2-SD 3.93Å; A421-M492 HydrophobicContact CB-CE 3.91Å; A421-M492 HydrophobicContact CB-SD 3.95Å; F449-M492 HydrophobicContact CB-CE 4.35Å; F449-M492 HydrophobicContact CD1-CE 4.22Å; F449-M492 HydrophobicContact CD1-CG 4.09Å; F449-M492 HydrophobicContact CD2-CE 3.4Å; F449-M492 HydrophobicContact CE1-CB 4.21Å; F449-M492 HydrophobicContact CE1-CE 4.36Å; F449-M492 HydrophobicContact CE1-CG 4.07Å; F449-M492 HydrophobicContact CE2-CE 3.59Å; F449-M492 HydrophobicContact CG-CE 3.76Å; F449-M492 HydrophobicContact CG-CG 4.49Å; F449-M492 HydrophobicContact CZ-CB 4.49Å; F449-M492 HydrophobicContact CZ-CE 4.07Å; F449-M492 HydrophobicContact CZ-CG 4.46Å; Y468-M492 HydrophobicContact CD1-CE 3.38Å; Y468-M492 HydrophobicContact CE1-CE 4.03Å; Y468-M492 HydrophobicContact CG-CE 3.83Å; M488-M492 HydrophobicContact CE-CE 4.12Å; M488-M492 HydrophobicContact CE-CG 3.82Å; M488-M492 HydrophobicContact CE-SD 3.75Å; M488-M492 HydrophobicContact CG-SD 4.29Å; M488-M492 WeakPolarHBondContact O-CB 3.23Å; M488-M492 VanDerWaalsContact O-CG 3.24Å; M488-M492 WeakPolarHBondContact O-CG 3.44Å; M488-M492 PolarHBondContact O-N 3.21Å; M488-M492 HydrophobicContact SD-CG 4.36Å; L490-M492 VanDerWaalsContact C-N 3.26Å; L490-M492 PolarHBondContact O-N 2.82Å; M492-I496 PolarHBondContact O-N 3.31Å; M492-M509 HydrophobicContact CB-CE 3.95Å; M492-M509 HydrophobicContact CE-CE 3.6Å; M492-M509 HydrophobicContact CG-CE 4.4Å; M492-M509 HydrophobicContact SD-CE 4.13Å
493	I	89.9	Confident	87.3	Confident	33 Å²	33	41.3 Å²	41.3	17%	0.169	22%	0.215	C	C	.	.	H	α-helix	trans	-72	-33.4	177.4	-68.8	164.7	0	0	0	110.7	G489 L490 I496 M509 V511 I552	G489-I493 WeakPolarHBondContact O-CD1 3.2Å; G489-I493 WeakPolarHBondContact O-CG1 3.17Å; G489-I493 PolarHBondContact O-N 2.91Å; L490-I493 PolarHBondContact O-N 3.19Å; I493-I496 WeakPolarHBondContact O-CG2 3.49Å; I493-M509 HydrophobicContact CG1-CB 4.16Å; I493-V511 HydrophobicContact CD1-CG2 4.01Å; I493-V511 HydrophobicContact CG1-CG2 4.12Å; I493-I552 HydrophobicContact CD1-CG1 3.92Å
494	E	87.9	Confident	86.4	Confident	147 Å²	147	43.8 Å²	43.8	69%	0.687	25%	0.245	S	C	*	.	H	α-helix	trans	-68.9	-46.8	171	-169.6	171.3	154.3	0	0	111	L490 D491 I496 S497	L490-E494 PolarHBondContact O-N 3.3Å; D491-E494 PolarHBondContact O-N 2.97Å; E494-I496 PolarHBondContact O-N 3.13Å; E494-S497 WeakPolarHBondContact O-CB 3.45Å; E494-S497 PolarHBondContact O-N 3.37Å; E494-S497 VanDerWaalsContact O-N 3.09Å; E494-S497 PolarHBondContact O-OG 2.9Å
495	A	87.7	Confident	85.6	Confident	17 Å²	17	44.3 Å²	44.3	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-64.3	-36.1	-177.5	0	0	0	0	0	114.2	F449 L452 D491 S497	F449-A495 HydrophobicContact CE1-CB 4.09Å; L452-A495 HydrophobicContact CD1-CB 4Å; D491-A495 VanDerWaalsContact O-CB 3.24Å; D491-A495 WeakPolarHBondContact O-CB 3.29Å; D491-A495 PolarHBondContact O-N 3.4Å; A495-S497 VanDerWaalsContact C-N 3.29Å; A495-S497 PolarHBondContact O-N 2.83Å
496	I	87.5	Confident	85.1	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-69.8	-26.2	174.7	-162.1	69.7	0	0	0	112.2	L445 M492 I493 E494 L498 V499 R500 V507 M509	L445-I496 HydrophobicContact CD1-CD1 4.1Å; L445-I496 HydrophobicContact CD2-CD1 3.63Å; M492-I496 PolarHBondContact O-N 3.31Å; I493-I496 WeakPolarHBondContact O-CG2 3.49Å; E494-I496 PolarHBondContact O-N 3.13Å; I496-L498 VanDerWaalsContact C-N 3.3Å; I496-L498 PolarHBondContact O-N 2.8Å; I496-V499 HydrophobicContact CD1-CB 4.29Å; I496-V499 PolarHBondContact O-N 3.42Å; I496-V499 VanDerWaalsContact O-N 3.1Å; I496-R500 PolarHBondContact O-N 3.41Å; I496-V507 HydrophobicContact CD1-CG2 4.16Å; I496-V507 HydrophobicContact CG1-CG2 4.04Å; I496-M509 HydrophobicContact CB-CG 3.77Å; I496-M509 HydrophobicContact CG1-CG 3.95Å; I496-M509 HydrophobicContact CG2-CB 4.18Å; I496-M509 HydrophobicContact CG2-CG 3.6Å
497	S	83.2	Confident	84.8	Confident	34 Å²	34	50.6 Å²	50.6	24%	0.238	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-34.4	-179.3	77.3	0	0	0	0	112.3	E494 A495 R500 E501	E494-S497 WeakPolarHBondContact O-CB 3.45Å; E494-S497 PolarHBondContact O-N 3.37Å; E494-S497 VanDerWaalsContact O-N 3.09Å; E494-S497 PolarHBondContact O-OG 2.9Å; A495-S497 VanDerWaalsContact C-N 3.29Å; A495-S497 PolarHBondContact O-N 2.83Å; S497-R500 WeakPolarHBondContact O-CB 3.18Å; S497-R500 PolarHBondContact O-N 3.04Å; S497-E501 WeakPolarHBondContact O-CG 3.4Å; S497-E501 PolarHBondContact O-N 3.12Å; S497-E501 VanDerWaalsContact O-N 3.12Å
498	L	77.7	Confident	84.6	Confident	69 Å²	69	51.6 Å²	51.6	36%	0.361	29%	0.288	S	S	.	.	H	α-helix	trans	-66.5	-37.3	171.7	-170.8	75.6	0	0	0	112.4	R448 I496 R500 E501 V502	R448-L498 VanDerWaalsContact NH1-CD2 3.34Å; I496-L498 VanDerWaalsContact C-N 3.3Å; I496-L498 PolarHBondContact O-N 2.8Å; L498-R500 VanDerWaalsContact C-N 3.33Å; L498-R500 PolarHBondContact O-N 3.44Å; L498-E501 PolarHBondContact O-N 2.98Å; L498-V502 HydrophobicContact CG-CG2 4.49Å; L498-V502 WeakPolarHBondContact O-CG2 3.25Å; L498-V502 PolarHBondContact O-N 3.27Å
499	V	77.2	Confident	84.4	Confident	18 Å²	18	51.6 Å²	51.6	11%	0.109	29%	0.288	C	S	.	.	H	α-helix	trans	-66	-37.8	176.2	178.1	0	0	0	0	110.9	T441 L445 I496 E501 V502 T503	T441-V499 HydrophobicContact CG2-CG1 4.26Å; L445-V499 HydrophobicContact CD1-CG2 4.03Å; I496-V499 HydrophobicContact CD1-CB 4.29Å; I496-V499 PolarHBondContact O-N 3.42Å; I496-V499 VanDerWaalsContact O-N 3.1Å; V499-E501 VanDerWaalsContact C-N 3.34Å; V499-E501 PolarHBondContact O-N 3.29Å; V499-V502 PolarHBondContact O-N 3.05Å; V499-T503 HydrophobicContact CG1-CG2 3.92Å; V499-T503 WeakPolarHBondContact O-CB 3.26Å; V499-T503 WeakPolarHBondContact O-CG2 3.4Å; V499-T503 PolarHBondContact O-N 3.3Å; V499-T503 PolarHBondContact O-OG1 3.06Å
500	R	82.2	Confident	84.4	Confident	87 Å²	87	53.4 Å²	53.4	33%	0.328	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-41.2	171.2	173.9	179.4	68.8	-160.1	-1.1	112.1	I496 S497 L498 G504 V505 N506 V507	I496-R500 PolarHBondContact O-N 3.41Å; S497-R500 WeakPolarHBondContact O-CB 3.18Å; S497-R500 PolarHBondContact O-N 3.04Å; L498-R500 VanDerWaalsContact C-N 3.33Å; L498-R500 PolarHBondContact O-N 3.44Å; R500-G504 WeakPolarHBondContact O-CA 3.5Å; R500-G504 PolarHBondContact O-N 3.16Å; R500-V505 WeakPolarHBondContact CG-O 3.5Å; R500-N506 WeakPolarHBondContact CD-OD1 3.24Å; R500-V507 HydrophobicContact CB-CG2 4.05Å
501	E	80.3	Confident	84.6	Confident	140 Å²	140	50.7 Å²	50.7	65%	0.654	28%	0.28	S	S	*	.	H	α-helix	trans	-67.2	-39.2	177.2	-72.5	172.8	-171.1	0	0	112.9	S497 L498 V499	S497-E501 WeakPolarHBondContact O-CG 3.4Å; S497-E501 PolarHBondContact O-N 3.12Å; S497-E501 VanDerWaalsContact O-N 3.12Å; L498-E501 PolarHBondContact O-N 2.98Å; V499-E501 VanDerWaalsContact C-N 3.34Å; V499-E501 PolarHBondContact O-N 3.29Å
502	V	76.6	Confident	84.8	Confident	118 Å²	118	48.2 Å²	48.2	72%	0.715	27%	0.267	S	S	*	.	H	α-helix	trans	-77.7	-39.6	-179.3	172.2	0	0	0	0	112.7	L498 V499	L498-V502 HydrophobicContact CG-CG2 4.49Å; L498-V502 WeakPolarHBondContact O-CG2 3.25Å; L498-V502 PolarHBondContact O-N 3.27Å; V499-V502 PolarHBondContact O-N 3.05Å
503	T	71	Confident	85.1	Confident	48 Å²	48	48.2 Å²	48.2	29%	0.294	27%	0.267	S	S	.	.	H	α-helix	trans	-88.1	-19	-177	61.5	0	0	0	0	113.8	T441 V499 V505	T441-T503 HydrophobicContact CG2-CG2 4.29Å; V499-T503 HydrophobicContact CG1-CG2 3.92Å; V499-T503 WeakPolarHBondContact O-CB 3.26Å; V499-T503 WeakPolarHBondContact O-CG2 3.4Å; V499-T503 PolarHBondContact O-N 3.3Å; V499-T503 PolarHBondContact O-OG1 3.06Å; T503-V505 PolarHBondContact O-N 2.66Å; T503-V505 VanDerWaalsContact O-N 3.14Å; T503-V505 PolarHBondContact OG1-N 3.03Å
504	G	74.4	Confident	85.4	Confident	69 Å²	69	47.1 Å²	47.1	71%	0.711	26%	0.261	S	S	*	.			trans	70.9	-5.1	-172.9	0	0	0	0	0	114.9	R500	R500-G504 WeakPolarHBondContact O-CA 3.5Å; R500-G504 PolarHBondContact O-N 3.16Å
505	V	79.1	Confident	85.8	Confident	22 Å²	22	40.3 Å²	40.3	13%	0.133	23%	0.23	C	C	.	.	S	Bend	trans	-86.6	129.6	177.3	-175.7	0	0	0	0	109.1	L429 R500 T503 V507	L429-V505 HydrophobicContact CB-CG1 4.31Å; L429-V505 HydrophobicContact CD1-CB 4.09Å; L429-V505 HydrophobicContact CD1-CG1 4.38Å; L429-V505 HydrophobicContact CD1-CG2 3.82Å; R500-V505 WeakPolarHBondContact CG-O 3.5Å; T503-V505 PolarHBondContact O-N 2.66Å; T503-V505 VanDerWaalsContact O-N 3.14Å; T503-V505 PolarHBondContact OG1-N 3.03Å; V505-V507 HydrophobicContact CG1-CG1 4.08Å; V505-V507 PolarHBondContact O-N 2.87Å
506	N	83.2	Confident	86.1	Confident	130 Å²	130	40.2 Å²	40.2	70%	0.695	23%	0.23	S	C	*	.			trans	-73.4	72.5	-179.9	-174.4	41.8	0	0	0	112.6	R500	R500-N506 WeakPolarHBondContact CD-OD1 3.24Å
507	V	87.2	Confident	86.2	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	25%	0.247	C	C	.	.			trans	-87.8	154.1	171.7	-66.1	0	0	0	0	111.9	I423 E424 L429 I496 R500 V505	I423-V507 HydrophobicContact CG2-CB 4.33Å; I423-V507 HydrophobicContact CG2-CG1 4.42Å; E424-V507 WeakPolarHBondContact O-CA 3.49Å; L429-V507 HydrophobicContact CB-CG1 4.4Å; L429-V507 HydrophobicContact CD2-CG1 4.35Å; I496-V507 HydrophobicContact CD1-CG2 4.16Å; I496-V507 HydrophobicContact CG1-CG2 4.04Å; R500-V507 HydrophobicContact CB-CG2 4.05Å; V505-V507 HydrophobicContact CG1-CG1 4.08Å; V505-V507 PolarHBondContact O-N 2.87Å
508	N	89.1	Confident	86.6	Confident	38 Å²	38	43 Å²	43	20%	0.203	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	174.1	177.2	-162.2	-1	0	0	0	109.9	I423 E424 A549 G550	I423-N508 CarbonylContact C-O 3.59Å; I423-N508 WeakPolarHBondContact CA-O 3.41Å; E424-N508 HydrophobicContact CB-CB 4.43Å; E424-N508 PolarHBondContact N-O 2.96Å; E424-N508 PolarHBondContact O-N 3.04Å; N508-A549 HydrophobicContact CB-CB 4.1Å; N508-A549 WeakPolarHBondContact ND2-CB 3.38Å; N508-G550 PolarHBondContact ND2-N 3.08Å; N508-G550 WeakPolarHBondContact OD1-CA 3.44Å; N508-G550 PolarHBondContact OD1-N 3.37Å
509	M	90.4	Very high	87.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.5	180	-76.2	-81.7	-84.5	0	0	111.5	A421 D422 I423 F449 M492 I493 I496 V511 A549 G550	A421-M509 HydrophobicContact CB-CE 3.52Å; D422-M509 WeakPolarHBondContact O-CA 3.34Å; I423-M509 HydrophobicContact CB-SD 4.5Å; I423-M509 HydrophobicContact CG1-SD 3.68Å; F449-M509 HydrophobicContact CE2-CE 3.69Å; F449-M509 HydrophobicContact CE2-SD 4.41Å; F449-M509 HydrophobicContact CZ-CE 3.59Å; F449-M509 HydrophobicContact CZ-SD 4.25Å; M492-M509 HydrophobicContact CB-CE 3.95Å; M492-M509 HydrophobicContact CE-CE 3.6Å; M492-M509 HydrophobicContact CG-CE 4.4Å; M492-M509 HydrophobicContact SD-CE 4.13Å; I493-M509 HydrophobicContact CG1-CB 4.16Å; I496-M509 HydrophobicContact CB-CG 3.77Å; I496-M509 HydrophobicContact CG1-CG 3.95Å; I496-M509 HydrophobicContact CG2-CB 4.18Å; I496-M509 HydrophobicContact CG2-CG 3.6Å; M509-V511 HydrophobicContact CB-CG2 4.47Å; M509-A549 CarbonylContact O-C 3.58Å; M509-A549 WeakPolarHBondContact O-CA 3.13Å; M509-G550 PolarHBondContact O-N 2.82Å
510	R	93.3	Very high	87.8	Confident	39 Å²	39	39.1 Å²	39.1	15%	0.147	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	133.2	160.9	-68.6	-167.7	-56.2	-83.3	-11.4	108.1	A421 D422 E424 E544 A549	A421-R510 CarbonylContact C-O 3.48Å; A421-R510 WeakPolarHBondContact CA-O 3.37Å; D422-R510 PolarHBondContact N-O 3.03Å; D422-R510 PolarHBondContact O-N 3.07Å; D422-R510 IonicContact OD2-CZ 3.3Å; D422-R510 IonicContact OD2-NH2 2.74Å; D422-R510 PolarHBondContact OD2-NH2 3.21Å; E424-R510 IonicContact OE1-CZ 3.68Å; E424-R510 IonicContact OE1-NH1 3.55Å; E424-R510 PolarHBondContact OE1-NH1 2.83Å; R510-E544 HydrophobicContact CB-CG 4.29Å; R510-E544 WeakPolarHBondContact CB-OE1 3.48Å; R510-E544 IonicContact CZ-OE1 2.71Å; R510-E544 VanDerWaalsContact CZ-OE1 3.27Å; R510-E544 IonicContact NE-OE1 3.15Å; R510-E544 PolarHBondContact NE-OE1 3.13Å; R510-E544 IonicContact NH2-OE1 2.77Å; R510-E544 PolarHBondContact NH2-OE1 2.76Å; R510-A549 HydrophobicContact CG-CB 3.89Å
511	V	95.4	Very high	88.1	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.9	-179.7	-173.8	0	0	0	0	109.9	L419 A421 I493 M509 I513 I552 H553	L419-V511 HydrophobicContact CD1-CG1 3.98Å; L419-V511 HydrophobicContact CD2-CG1 4.21Å; L419-V511 HydrophobicContact CG-CG1 3.9Å; A421-V511 HydrophobicContact CB-CG1 4.43Å; A421-V511 HydrophobicContact CB-CG2 4.02Å; I493-V511 HydrophobicContact CD1-CG2 4.01Å; I493-V511 HydrophobicContact CG1-CG2 4.12Å; M509-V511 HydrophobicContact CB-CG2 4.47Å; V511-I513 HydrophobicContact CG1-CD1 4.43Å; V511-I513 HydrophobicContact CG1-CG1 4.14Å; V511-I552 HydrophobicContact CB-CG1 4.29Å; V511-I552 HydrophobicContact CG1-CG1 4.46Å; V511-I552 HydrophobicContact CG1-CG2 4.2Å; V511-H553 PolarHBondContact O-N 3.45Å
512	G	96.3	Very high	88.4	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.2	173.9	0	0	0	0	0	111.2	L419 F420 H553	L419-G512 WeakPolarHBondContact CA-O 3.39Å; F420-G512 PolarHBondContact N-O 3.12Å; F420-G512 PolarHBondContact O-N 3.03Å; G512-H553 WeakPolarHBondContact CA-O 3.42Å
513	I	96.9	Very high	88.8	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134	177.8	-49.2	178	0	0	0	110.5	I418 L419 C485 V486 V511 I552 H553 I554 T555 T558	I418-I513 WeakPolarHBondContact O-CA 3.46Å; L419-I513 HydrophobicContact CB-CG1 4.33Å; L419-I513 HydrophobicContact CD1-CD1 3.93Å; L419-I513 HydrophobicContact CD1-CG1 4.06Å; L419-I513 HydrophobicContact CG-CG1 4.09Å; C485-I513 HydrophobicContact CB-CD1 4.14Å; C485-I513 HydrophobicContact CB-CG2 3.94Å; C485-I513 WeakPolarHBondContact O-CD1 3.45Å; V486-I513 HydrophobicContact CG2-CD1 3.98Å; V511-I513 HydrophobicContact CG1-CD1 4.43Å; V511-I513 HydrophobicContact CG1-CG1 4.14Å; I513-I552 HydrophobicContact CD1-CG2 3.43Å; I513-I552 VanDerWaalsContact CD1-CG2 3.43Å; I513-I552 HydrophobicContact CG1-CG2 3.87Å; I513-H553 PolarHBondContact N-O 3.48Å; I513-I554 HydrophobicContact CB-CG2 4.14Å; I513-I554 WeakPolarHBondContact O-CA 3.06Å; I513-T555 PolarHBondContact O-N 3.45Å; I513-T558 HydrophobicContact CG2-CG2 4.01Å
514	H	96.8	Very high	89.5	Confident	10 Å²	10	21.3 Å²	21.3	5%	0.046	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	162.2	168.3	-176.5	47.9	0	0	0	110.9	S417 I418 D536 A540 T555 T558	S417-H514 CarbonylContact C-O 3.49Å; S417-H514 WeakPolarHBondContact CA-O 3.31Å; I418-H514 PolarHBondContact N-O 2.88Å; I418-H514 PolarHBondContact O-N 3.27Å; H514-D536 PolarHBondContact CD2-O 2.73Å; H514-D536 VanDerWaalsContact CD2-O 3.31Å; H514-D536 IonicContact NE2-OD1 2.65Å; H514-A540 HydrophobicContact CB-CB 3.79Å; H514-T555 HydrophobicContact CB-CG2 4.26Å; H514-T555 WeakPolarHBondContact ND1-CG2 3.46Å; H514-T555 PolarHBondContact ND1-OG1 2.89Å; H514-T558 VanDerWaalsContact C-OG1 3.23Å; H514-T558 VanDerWaalsContact CA-OG1 3.27Å; H514-T558 WeakPolarHBondContact CA-OG1 3.41Å
515	S	95.9	Very high	89.9	Confident	4 Å²	4	20.4 Å²	20.4	3%	0.028	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	125.5	-176.4	-53.2	0	0	0	0	109.5	V416 S417 A557 T558	V416-S515 VanDerWaalsContact O-CA 3.31Å; V416-S515 WeakPolarHBondContact O-CA 3.46Å; S417-S515 VanDerWaalsContact OG-CB 3.27Å; S417-S515 WeakPolarHBondContact OG-CB 3.29Å; S417-S515 PolarHBondContact OG-OG 3.04Å; S515-A557 WeakPolarHBondContact O-CB 3.39Å; S515-T558 WeakPolarHBondContact CB-OG1 3.39Å; S515-T558 PolarHBondContact N-OG1 3.49Å; S515-T558 VanDerWaalsContact N-OG1 3.16Å; S515-T558 VanDerWaalsContact OG-CA 3.31Å; S515-T558 WeakPolarHBondContact OG-CA 3.5Å; S515-T558 WeakPolarHBondContact OG-CB 3.45Å; S515-T558 WeakPolarHBondContact OG-CG2 3.41Å; S515-T558 PolarHBondContact OG-OG1 2.84Å
516	G	93.6	Very high	90	Very high	14 Å²	14	23.6 Å²	23.6	14%	0.144	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.5	-143.8	-164.4	0	0	0	0	0	112.2	N415 V416 D536	N415-G516 WeakPolarHBondContact CA-O 3.2Å; N415-G516 PolarHBondContact N-O 3.4Å; N415-G516 VanDerWaalsContact N-O 3.09Å; V416-G516 WeakPolarHBondContact CG2-O 3.45Å; V416-G516 PolarHBondContact N-O 3.45Å; V416-G516 PolarHBondContact O-N 3.11Å; V416-G516 VanDerWaalsContact O-N 3.15Å; G516-D536 VanDerWaalsContact CA-OD2 3.22Å; G516-D536 WeakPolarHBondContact CA-OD2 3.07Å
517	R	91.1	Very high	90	Very high	96 Å²	96	18.4 Å²	18.4	36%	0.362	9%	0.085	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	157.9	-180	60.3	175.1	174.2	-115.1	0.4	112.6	H413 D414 S534 D536 E1027	H413-R517 WeakPolarHBondContact O-CA 3.47Å; D414-R517 WeakPolarHBondContact OD1-CB 3.46Å; R517-S534 WeakPolarHBondContact O-CB 3.45Å; R517-S534 PolarHBondContact O-OG 2.82Å; R517-D536 PolarHBondContact N-OD2 2.97Å; R517-E1027 IonicContact CZ-OE2 2.8Å; R517-E1027 IonicContact NE-OE2 3.65Å; R517-E1027 PolarHBondContact NE-OE2 2.69Å; R517-E1027 IonicContact NH2-OE2 2.73Å; R517-E1027 PolarHBondContact NH2-OE2 2.97Å
518	V	91.8	Very high	89.5	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.006	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.2	175.4	-66.5	0	0	0	0	112.3	H413 V416 I418 L474 V532 V537	H413-V518 HydrophobicContact CB-CG2 4.25Å; H413-V518 PolarHBondContact N-O 3.45Å; H413-V518 PolarHBondContact O-N 2.97Å; V416-V518 HydrophobicContact CB-CG2 4.5Å; V416-V518 HydrophobicContact CG1-CG2 4.08Å; V416-V518 HydrophobicContact CG2-CB 4.33Å; V416-V518 HydrophobicContact CG2-CG1 3.8Å; V416-V518 HydrophobicContact CG2-CG2 3.76Å; I418-V518 HydrophobicContact CD1-CG1 3.73Å; I418-V518 HydrophobicContact CG1-CG1 4.32Å; L474-V518 HydrophobicContact CD1-CG2 4.13Å; L474-V518 HydrophobicContact CD2-CG2 4.13Å; L474-V518 HydrophobicContact CG-CG2 4.43Å; V518-V532 HydrophobicContact CB-CB 4.44Å; V518-V537 HydrophobicContact CG1-CG2 3.66Å
519	H	90.4	Very high	89	Confident	3 Å²	3	20.5 Å²	20.5	1%	0.014	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.5	155.6	-62.2	94.6	0	0	0	108.1	I410 Q411 V532 W533 Y1025 E1033 L1038	I410-H519 HydrophobicContact CG2-CB 3.85Å; Q411-H519 CarbonylContact O-C 3.33Å; Q411-H519 WeakPolarHBondContact O-CA 3.23Å; H519-V532 CarbonylContact O-C 3.58Å; H519-V532 VanDerWaalsContact O-CA 3.24Å; H519-V532 WeakPolarHBondContact O-CA 3.46Å; H519-W533 WeakPolarHBondContact CB-O 3.47Å; H519-W533 PolarHBondContact N-O 2.85Å; H519-W533 PolarHBondContact O-N 2.96Å; H519-Y1025 PolarHBondContact ND1-OH 3.37Å; H519-E1033 PolarHBondContact CE1-O 3.05Å; H519-E1033 VanDerWaalsContact CE1-O 3.23Å; H519-L1038 HydrophobicContact CB-CD1 3.79Å
520	C	88.4	Confident	88.8	Confident	2 Å²	2	21 Å²	21	1%	0.014	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.9	178.4	68.8	0	0	0	0	111.2	I410 Q411 H413 L474 F530 D531 V532	I410-C520 WeakPolarHBondContact CA-O 3.35Å; Q411-C520 PolarHBondContact N-O 3Å; Q411-C520 PolarHBondContact O-N 3.35Å; H413-C520 PolarHBondContact CD2-SG 3.47Å; L474-C520 HydrophobicContact CD1-CB 4.1Å; C520-F530 HydrophobicContact CB-CE1 4.28Å; C520-F530 HydrophobicContact CB-CE2 3.99Å; C520-F530 HydrophobicContact CB-CZ 3.54Å; C520-D531 WeakPolarHBondContact CA-O 3.37Å; C520-V532 HydrophobicContact CB-CB 4.46Å; C520-V532 HydrophobicContact CB-CG1 3.58Å
521	G	88.1	Confident	88.5	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.4	-161.5	-170	0	0	0	0	0	115.4	Y409 F530 D531	Y409-G521 CarbonylContact O-C 3.53Å; Y409-G521 WeakPolarHBondContact O-CA 3.27Å; G521-F530 WeakPolarHBondContact O-CA 3.34Å; G521-D531 PolarHBondContact N-O 2.89Å; G521-D531 PolarHBondContact O-N 3Å
522	V	87	Confident	88.3	Confident	5 Å²	5	20.1 Å²	20.1	3%	0.03	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.6	177.9	-176.7	0	0	0	0	109.1	L384 V388 M392 Y409 W528	L384-V522 HydrophobicContact CD2-CG2 3.54Å; V388-V522 HydrophobicContact CG1-CG2 4.07Å; M392-V522 HydrophobicContact SD-CG2 4.45Å; Y409-V522 PolarHBondContact O-N 3.37Å; Y409-V522 VanDerWaalsContact O-N 3.09Å; V522-W528 HydrophobicContact CG1-CB 3.85Å; V522-W528 HydrophobicContact CG1-CG 3.89Å
523	L	86.1	Confident	88	Confident	8 Å²	8	21 Å²	21	4%	0.042	10%	0.096	C	C	.	.			trans	-126.6	152.4	175.5	-61	-179	0	0	0	111.4	I408 I410 W533 L1041 N1042 I1045	I408-L523 HydrophobicContact CG2-CD2 4.32Å; I410-L523 HydrophobicContact CD1-CD2 4.06Å; L523-W533 HydrophobicContact CB-CH2 4.5Å; L523-W533 HydrophobicContact CB-CZ2 4.35Å; L523-W533 HydrophobicContact CD1-CD2 4.42Å; L523-W533 HydrophobicContact CD1-CH2 3.91Å; L523-W533 HydrophobicContact CD1-CZ2 3.35Å; L523-W533 HydrophobicContact CG-CH2 3.67Å; L523-W533 HydrophobicContact CG-CZ2 3.61Å; L523-W533 HydrophobicContact CG-CZ3 4.41Å; L523-L1041 HydrophobicContact CD1-CD2 4.14Å; L523-L1041 HydrophobicContact CD1-CG 4.4Å; L523-N1042 WeakPolarHBondContact CA-OD1 3.32Å; L523-N1042 HydrophobicContact CD2-CB 3.97Å; L523-I1045 HydrophobicContact CB-CD1 4.42Å; L523-I1045 HydrophobicContact CD1-CD1 4.4Å
524	G	85.3	Confident	87.6	Confident	6 Å²	6	21.3 Å²	21.3	6%	0.062	10%	0.098	C	C	.	.	S	Bend	trans	82.7	169.2	177	0	0	0	0	0	114.4	W528 N1042	G524-W528 VanDerWaalsContact O-CD1 3.24Å; G524-W528 PolarHBondContact O-NE1 3.05Å; G524-N1042 PolarHBondContact N-OD1 3.17Å
525	L	82.9	Confident	87.2	Confident	50 Å²	50	23.6 Å²	23.6	26%	0.262	11%	0.11	S	C	.	.	S	Bend	trans	-92	-30.5	-178.5	-53.1	-177.2	0	0	0	111.6	H406 W528 N983 A1046 D1049 E1050	H406-L525 HydrophobicContact CB-CD2 4.46Å; H406-L525 VanDerWaalsContact CD2-CD2 3.49Å; H406-L525 WeakPolarHBondContact CD2-CD2 3.31Å; L525-W528 PolarHBondContact O-NE1 3.46Å; L525-N983 PolarHBondContact O-ND2 3.27Å; L525-N983 PolarHBondContact O-OD1 2.74Å; L525-A1046 HydrophobicContact CD1-CB 3.99Å; L525-A1046 HydrophobicContact CD2-CB 4.39Å; L525-A1046 HydrophobicContact CG-CB 3.9Å; L525-D1049 HydrophobicContact CB-CB 4.09Å; L525-D1049 PolarHBondContact N-OD2 2.87Å; L525-E1050 HydrophobicContact CD1-CG 4.22Å
526	R	81.6	Confident	87	Confident	89 Å²	89	25 Å²	25	34%	0.336	12%	0.117	S	C	.	.	S	Bend	trans	-115.4	144.4	-174.7	-59.4	-179.2	109.2	-170.6	14.6	112.4	N983 D1049 I1052 S1053 K1062	R526-N983 WeakPolarHBondContact CA-OD1 3.25Å; R526-D1049 HydrophobicContact CB-CB 4.28Å; R526-D1049 WeakPolarHBondContact CD-O 3.4Å; R526-D1049 HydrophobicContact CG-CB 3.99Å; R526-D1049 PolarHBondContact N-OD2 2.82Å; R526-I1052 PolarHBondContact NH1-O 2.88Å; R526-S1053 WeakPolarHBondContact CD-OG 3.45Å; R526-S1053 PolarHBondContact NE-OG 3.38Å; R526-S1053 PolarHBondContact NH1-OG 3.25Å; R526-S1053 VanDerWaalsContact NH1-OG 3.13Å; R526-S1053 PolarHBondContact NH2-OG 2.85Å; R526-K1062 HydrophobicContact CB-CD 4.19Å; R526-K1062 WeakPolarHBondContact O-CE 3.34Å; R526-K1062 PolarHBondContact O-NZ 3.43Å
527	K	81.5	Confident	86.9	Confident	21 Å²	21	25 Å²	25	9%	0.091	12%	0.115	C	C	.	.	S	Bend	trans	58.4	50.7	179.1	-54.6	-57.8	-172.4	-173.5	0	112.9	Q529 N983 E1061 K1062	K527-Q529 PolarHBondContact O-N 3.29Å; K527-N983 WeakPolarHBondContact CA-O 3.36Å; K527-N983 PolarHBondContact N-O 2.71Å; K527-N983 PolarHBondContact N-OD1 2.65Å; K527-E1061 WeakPolarHBondContact CE-OE1 3.43Å; K527-E1061 IonicContact NZ-OE1 2.59Å; K527-E1061 PolarHBondContact NZ-OE1 3.45Å; K527-K1062 HydrophobicContact CB-CD 4.12Å; K527-K1062 HydrophobicContact CB-CG 4.41Å; K527-K1062 WeakPolarHBondContact CE-O 3.43Å; K527-K1062 HydrophobicContact CG-CB 4.01Å; K527-K1062 HydrophobicContact CG-CD 4.02Å; K527-K1062 HydrophobicContact CG-CG 4.03Å; K527-K1062 WeakPolarHBondContact CG-O 3.39Å
528	W	77.9	Confident	86.8	Confident	49 Å²	49	23.6 Å²	23.6	19%	0.186	12%	0.117	C	C	.	.			trans	-50.8	121.3	175.2	-67.5	-23.1	0	0	0	111.6	V383 M392 I396 V522 G524 L525 L980 N983	V383-W528 VanDerWaalsContact CG1-O 3.23Å; V383-W528 WeakPolarHBondContact CG1-O 3.39Å; M392-W528 HydrophobicContact CE-CD2 3.68Å; M392-W528 HydrophobicContact CE-CE3 3.63Å; M392-W528 HydrophobicContact CE-CG 4.39Å; M392-W528 HydrophobicContact CE-CH2 3.83Å; M392-W528 HydrophobicContact CE-CZ2 3.87Å; M392-W528 HydrophobicContact CE-CZ3 3.7Å; I396-W528 HydrophobicContact CD1-CH2 3.77Å; I396-W528 HydrophobicContact CD1-CZ3 4.11Å; V522-W528 HydrophobicContact CG1-CB 3.85Å; V522-W528 HydrophobicContact CG1-CG 3.89Å; G524-W528 VanDerWaalsContact O-CD1 3.24Å; G524-W528 PolarHBondContact O-NE1 3.05Å; L525-W528 PolarHBondContact O-NE1 3.46Å; W528-L980 HydrophobicContact CE3-CD1 4.38Å; W528-L980 HydrophobicContact CZ3-CD1 3.85Å; W528-N983 VanDerWaalsContact CD2-ND2 3.32Å
529	Q	78.6	Confident	86.8	Confident	33 Å²	33	24.3 Å²	24.3	15%	0.154	12%	0.121	C	C	.	.			trans	-136.1	138.5	176.3	-70.9	169.2	20.3	0	0	106.8	K527 I1063	K527-Q529 PolarHBondContact O-N 3.29Å; Q529-I1063 PolarHBondContact NE2-O 2.65Å
530	F	85.2	Confident	86.9	Confident	10 Å²	10	24.2 Å²	24.2	4%	0.044	12%	0.12	C	C	.	.			trans	-75.3	123.4	170.2	-178.6	-100.6	0	0	0	109	L384 P385 V388 L459 I461 C520 G521	L384-F530 HydrophobicContact CD2-CB 4.26Å; P385-F530 HydrophobicContact CG-CB 4.31Å; P385-F530 HydrophobicContact CG-CD1 3.81Å; P385-F530 HydrophobicContact CG-CD2 3.67Å; P385-F530 HydrophobicContact CG-CE1 3.92Å; P385-F530 HydrophobicContact CG-CE2 3.78Å; P385-F530 HydrophobicContact CG-CG 3.66Å; P385-F530 HydrophobicContact CG-CZ 3.88Å; V388-F530 HydrophobicContact CG2-CD2 4.29Å; V388-F530 HydrophobicContact CG2-CE2 4.2Å; L459-F530 HydrophobicContact CD2-CE1 3.86Å; I461-F530 HydrophobicContact CD1-CD1 4.19Å; I461-F530 HydrophobicContact CD1-CE1 3.92Å; C520-F530 HydrophobicContact CB-CE1 4.28Å; C520-F530 HydrophobicContact CB-CE2 3.99Å; C520-F530 HydrophobicContact CB-CZ 3.54Å; G521-F530 WeakPolarHBondContact O-CA 3.34Å
531	D	88.2	Confident	87.1	Confident	14 Å²	14	27.3 Å²	27.3	8%	0.075	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	175.5	-177	-141.9	-27.8	0	0	0	111.1	K462 C520 G521 W533	K462-D531 VanDerWaalsContact CD-OD2 3.24Å; K462-D531 WeakPolarHBondContact CD-OD2 3.18Å; K462-D531 WeakPolarHBondContact CE-OD2 3.45Å; K462-D531 IonicContact NZ-OD2 3.73Å; K462-D531 PolarHBondContact NZ-OD2 2.58Å; C520-D531 WeakPolarHBondContact CA-O 3.37Å; G521-D531 PolarHBondContact N-O 2.89Å; G521-D531 PolarHBondContact O-N 3Å; D531-W533 HydrophobicContact CB-CH2 3.73Å; D531-W533 HydrophobicContact CB-CZ2 3.76Å; D531-W533 HydrophobicContact CB-CZ3 4.43Å; D531-W533 VanDerWaalsContact O-CZ3 3.24Å; D531-W533 WeakPolarHBondContact O-CZ3 3.31Å
532	V	90.2	Very high	87.2	Confident	7 Å²	7	29.8 Å²	29.8	4%	0.042	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.2	-176.1	-53.9	0	0	0	0	113.8	I461 Y469 V471 L474 V518 H519 C520 V537	I461-V532 HydrophobicContact CD1-CG1 4.05Å; I461-V532 HydrophobicContact CG1-CG1 4.4Å; I461-V532 HydrophobicContact CG2-CG1 4.45Å; Y469-V532 HydrophobicContact CE1-CG2 3.71Å; Y469-V532 WeakPolarHBondContact OH-CG2 3.38Å; V471-V532 HydrophobicContact CG2-CG2 4.44Å; L474-V532 HydrophobicContact CD1-CG1 3.87Å; V518-V532 HydrophobicContact CB-CB 4.44Å; H519-V532 CarbonylContact O-C 3.58Å; H519-V532 VanDerWaalsContact O-CA 3.24Å; H519-V532 WeakPolarHBondContact O-CA 3.46Å; C520-V532 HydrophobicContact CB-CB 4.46Å; C520-V532 HydrophobicContact CB-CG1 3.58Å; V532-V537 HydrophobicContact CG2-CG1 4.39Å; V532-V537 HydrophobicContact CG2-CG2 3.94Å
533	W	89.9	Confident	87.6	Confident	20 Å²	20	29.6 Å²	29.6	8%	0.076	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	127.2	-174.5	-55.2	-94.8	0	0	0	111.6	H519 L523 D531 L1038	H519-W533 WeakPolarHBondContact CB-O 3.47Å; H519-W533 PolarHBondContact N-O 2.85Å; H519-W533 PolarHBondContact O-N 2.96Å; L523-W533 HydrophobicContact CB-CH2 4.5Å; L523-W533 HydrophobicContact CB-CZ2 4.35Å; L523-W533 HydrophobicContact CD1-CD2 4.42Å; L523-W533 HydrophobicContact CD1-CH2 3.91Å; L523-W533 HydrophobicContact CD1-CZ2 3.35Å; L523-W533 HydrophobicContact CG-CH2 3.67Å; L523-W533 HydrophobicContact CG-CZ2 3.61Å; L523-W533 HydrophobicContact CG-CZ3 4.41Å; D531-W533 HydrophobicContact CB-CH2 3.73Å; D531-W533 HydrophobicContact CB-CZ2 3.76Å; D531-W533 HydrophobicContact CB-CZ3 4.43Å; D531-W533 VanDerWaalsContact O-CZ3 3.24Å; D531-W533 WeakPolarHBondContact O-CZ3 3.31Å; W533-L1038 HydrophobicContact CB-CD1 4.05Å; W533-L1038 HydrophobicContact CB-CD2 3.87Å; W533-L1038 HydrophobicContact CD2-CD2 4.33Å; W533-L1038 HydrophobicContact CE3-CD1 4.48Å; W533-L1038 HydrophobicContact CG-CD1 4.41Å; W533-L1038 HydrophobicContact CG-CD2 3.81Å
534	S	89	Confident	87.9	Confident	6 Å²	6	29.9 Å²	29.9	4%	0.042	15%	0.148	C	C	.	.	S	Bend	trans	-171.7	166.5	160.6	174.1	0	0	0	0	108.7	R517 D536 V537 T538 E1027	R517-S534 WeakPolarHBondContact O-CB 3.45Å; R517-S534 PolarHBondContact O-OG 2.82Å; S534-D536 PolarHBondContact O-N 3.35Å; S534-D536 PolarHBondContact OG-N 3.43Å; S534-V537 WeakPolarHBondContact O-CB 3.14Å; S534-V537 PolarHBondContact O-N 3.48Å; S534-T538 PolarHBondContact O-N 3.15Å; S534-T538 PolarHBondContact O-OG1 3.34Å; S534-E1027 PolarHBondContact OG-OE1 3.05Å
535	N	87.9	Confident	88.1	Confident	57 Å²	57	32 Å²	32	31%	0.305	17%	0.165	S	C	.	.	H	α-helix	trans	-52.9	-34.7	163	-67	-71.9	0	0	0	112.4	V537 T538 L539 E1027	N535-V537 PolarHBondContact O-N 2.91Å; N535-T538 WeakPolarHBondContact O-CA 3.33Å; N535-T538 WeakPolarHBondContact O-CB 3.41Å; N535-T538 PolarHBondContact O-N 2.89Å; N535-T538 VanDerWaalsContact O-N 3.11Å; N535-L539 PolarHBondContact O-N 3.34Å; N535-E1027 PolarHBondContact N-OE1 2.96Å; N535-E1027 VanDerWaalsContact ND2-CD 3.34Å; N535-E1027 PolarHBondContact ND2-OE1 3.31Å
536	D	91.9	Very high	88.4	Confident	33 Å²	33	29.7 Å²	29.7	18%	0.176	15%	0.153	C	C	.	.	H	α-helix	trans	-67.5	-34	179.8	-68.1	-11.1	0	0	0	112.3	I418 H514 G516 R517 S534 T538 L539 A540	I418-D536 HydrophobicContact CD1-CB 4.05Å; H514-D536 PolarHBondContact CD2-O 2.73Å; H514-D536 VanDerWaalsContact CD2-O 3.31Å; H514-D536 IonicContact NE2-OD1 2.65Å; G516-D536 VanDerWaalsContact CA-OD2 3.22Å; G516-D536 WeakPolarHBondContact CA-OD2 3.07Å; R517-D536 PolarHBondContact N-OD2 2.97Å; S534-D536 PolarHBondContact O-N 3.35Å; S534-D536 PolarHBondContact OG-N 3.43Å; D536-T538 VanDerWaalsContact C-N 3.33Å; D536-L539 PolarHBondContact O-N 2.89Å; D536-A540 PolarHBondContact O-N 2.94Å
537	V	91.5	Very high	88.8	Confident	16 Å²	16	25.9 Å²	25.9	10%	0.097	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-41.9	171.2	-178.6	0	0	0	0	110.5	I418 F420 Y469 V518 V532 S534 N535 A540 N541	I418-V537 HydrophobicContact CD1-CG2 4.16Å; F420-V537 HydrophobicContact CE2-CG1 4.08Å; F420-V537 WeakPolarHBondContact CE2-O 3.48Å; F420-V537 HydrophobicContact CZ-CG1 4.01Å; Y469-V537 WeakPolarHBondContact OH-CG1 3.45Å; V518-V537 HydrophobicContact CG1-CG2 3.66Å; V532-V537 HydrophobicContact CG2-CG1 4.39Å; V532-V537 HydrophobicContact CG2-CG2 3.94Å; S534-V537 WeakPolarHBondContact O-CB 3.14Å; S534-V537 PolarHBondContact O-N 3.48Å; N535-V537 PolarHBondContact O-N 2.91Å; V537-A540 PolarHBondContact O-N 2.96Å; V537-N541 PolarHBondContact O-N 3.24Å; V537-N541 VanDerWaalsContact O-N 3.14Å
538	T	89.1	Confident	89.2	Confident	65 Å²	65	29 Å²	29	40%	0.399	16%	0.155	S	C	.	.	H	α-helix	trans	-64.5	-42.2	177.8	-56.7	0	0	0	0	110.9	S534 N535 D536 N541 Q542	S534-T538 PolarHBondContact O-N 3.15Å; S534-T538 PolarHBondContact O-OG1 3.34Å; N535-T538 WeakPolarHBondContact O-CA 3.33Å; N535-T538 WeakPolarHBondContact O-CB 3.41Å; N535-T538 PolarHBondContact O-N 2.89Å; N535-T538 VanDerWaalsContact O-N 3.11Å; D536-T538 VanDerWaalsContact C-N 3.33Å; T538-N541 PolarHBondContact O-N 2.98Å; T538-Q542 WeakPolarHBondContact O-CG 3.5Å; T538-Q542 PolarHBondContact O-N 3.37Å; T538-Q542 VanDerWaalsContact O-N 3.07Å
539	L	91.3	Very high	89.8	Confident	17 Å²	17	27.9 Å²	27.9	9%	0.089	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-41.7	175.1	179.4	55	0	0	0	112	N535 D536 N541 Q542 M543 T555 Y579 L580 I585	N535-L539 PolarHBondContact O-N 3.34Å; D536-L539 PolarHBondContact O-N 2.89Å; L539-N541 VanDerWaalsContact C-N 3.33Å; L539-N541 PolarHBondContact O-N 3.43Å; L539-Q542 PolarHBondContact O-N 3.09Å; L539-M543 HydrophobicContact CD1-CG 4.31Å; L539-M543 VanDerWaalsContact O-CG 3.28Å; L539-M543 WeakPolarHBondContact O-CG 3.28Å; L539-M543 PolarHBondContact O-N 3.14Å; L539-T555 HydrophobicContact CD2-CG2 4.27Å; L539-T555 HydrophobicContact CG-CG2 4.31Å; L539-Y579 HydrophobicContact CD1-CE1 4.19Å; L539-L580 HydrophobicContact CD1-CD2 3.59Å; L539-I585 HydrophobicContact CD1-CG1 4.16Å; L539-I585 HydrophobicContact CD1-CG2 4.45Å; L539-I585 HydrophobicContact CD2-CD1 4.47Å
540	A	93.9	Very high	90.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-41.2	176.4	0	0	0	0	0	112.8	I418 F420 H514 D536 V537 M543 E544	I418-A540 HydrophobicContact CB-CB 3.85Å; I418-A540 HydrophobicContact CG2-CB 3.41Å; I418-A540 VanDerWaalsContact CG2-CB 3.41Å; F420-A540 HydrophobicContact CD2-CB 3.68Å; F420-A540 HydrophobicContact CE2-CB 3.85Å; H514-A540 HydrophobicContact CB-CB 3.79Å; D536-A540 PolarHBondContact O-N 2.94Å; V537-A540 PolarHBondContact O-N 2.96Å; A540-M543 WeakPolarHBondContact O-CB 3.45Å; A540-M543 PolarHBondContact O-N 3.35Å; A540-E544 PolarHBondContact O-N 2.88Å
541	N	91.6	Very high	90.6	Very high	68 Å²	68	30.1 Å²	30.1	36%	0.364	17%	0.171	S	C	.	.	H	α-helix	trans	-63.6	-46.2	174.6	-176.1	-1	0	0	0	111.3	F420 V537 T538 L539 M543 E544 A545	F420-N541 HydrophobicContact CD1-CB 4.49Å; F420-N541 HydrophobicContact CD2-CB 4.13Å; F420-N541 HydrophobicContact CE1-CB 4.28Å; F420-N541 HydrophobicContact CE2-CB 3.89Å; F420-N541 HydrophobicContact CG-CB 4.42Å; F420-N541 HydrophobicContact CZ-CB 3.98Å; V537-N541 PolarHBondContact O-N 3.24Å; V537-N541 VanDerWaalsContact O-N 3.14Å; T538-N541 PolarHBondContact O-N 2.98Å; L539-N541 VanDerWaalsContact C-N 3.33Å; L539-N541 PolarHBondContact O-N 3.43Å; N541-M543 PolarHBondContact O-N 3.1Å; N541-E544 PolarHBondContact O-N 2.76Å; N541-A545 PolarHBondContact O-N 2.85Å; N541-A545 VanDerWaalsContact O-N 3.12Å
542	Q	91.3	Very high	90.9	Very high	52 Å²	52	29.6 Å²	29.6	24%	0.243	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-24.8	175.2	-62.2	-58.2	-34.6	0	0	113.1	T538 L539 G546 N577 Y579 L580	T538-Q542 WeakPolarHBondContact O-CG 3.5Å; T538-Q542 PolarHBondContact O-N 3.37Å; T538-Q542 VanDerWaalsContact O-N 3.07Å; L539-Q542 PolarHBondContact O-N 3.09Å; Q542-G546 PolarHBondContact O-N 3.05Å; Q542-N577 PolarHBondContact O-ND2 3.43Å; Q542-N577 PolarHBondContact OE1-ND2 2.71Å; Q542-N577 PolarHBondContact OE1-OD1 3.16Å; Q542-Y579 HydrophobicContact CB-CD1 3.94Å; Q542-Y579 HydrophobicContact CB-CG 4.45Å; Q542-Y579 HydrophobicContact CG-CD1 3.72Å; Q542-Y579 HydrophobicContact CG-CE1 4.26Å; Q542-Y579 HydrophobicContact CG-CG 3.88Å; Q542-L580 HydrophobicContact CB-CD2 4.3Å
543	M	93.9	Very high	91.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-73.2	-35.8	173.8	-76.2	-64.5	-65.6	0	0	113.4	L539 A540 N541 G547 H553 I554 T555 L580 T587	L539-M543 HydrophobicContact CD1-CG 4.31Å; L539-M543 VanDerWaalsContact O-CG 3.28Å; L539-M543 WeakPolarHBondContact O-CG 3.28Å; L539-M543 PolarHBondContact O-N 3.14Å; A540-M543 WeakPolarHBondContact O-CB 3.45Å; A540-M543 PolarHBondContact O-N 3.35Å; N541-M543 PolarHBondContact O-N 3.1Å; M543-G547 PolarHBondContact O-N 3.31Å; M543-H553 HydrophobicContact CE-CB 4.27Å; M543-H553 WeakPolarHBondContact CE-ND1 3.48Å; M543-H553 PolarHBondContact O-ND1 3.38Å; M543-I554 WeakPolarHBondContact CE-O 3.4Å; M543-T555 HydrophobicContact CE-CG2 3.89Å; M543-T555 HydrophobicContact CG-CG2 3.67Å; M543-T555 HydrophobicContact SD-CG2 3.77Å; M543-L580 HydrophobicContact CG-CD2 4.31Å; M543-L580 HydrophobicContact SD-CD1 3.75Å; M543-L580 HydrophobicContact SD-CD2 3.8Å; M543-L580 HydrophobicContact SD-CG 4.47Å; M543-T587 HydrophobicContact CE-CG2 3.7Å; M543-T587 HydrophobicContact SD-CG2 3.42Å; M543-T587 WeakPolarHBondContact SD-CG2 3.49Å
544	E	93.7	Very high	91.4	Very high	14 Å²	14	28.3 Å²	28.3	7%	0.065	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-52.9	168	177.8	-71.8	125.8	0	0	109.5	F420 D422 R510 A540 N541 G546 G547	F420-E544 HydrophobicContact CB-CB 3.91Å; F420-E544 HydrophobicContact CB-CG 4.47Å; D422-E544 HydrophobicContact CB-CG 3.89Å; D422-E544 WeakPolarHBondContact CB-OE1 3.33Å; R510-E544 HydrophobicContact CB-CG 4.29Å; R510-E544 WeakPolarHBondContact CB-OE1 3.48Å; R510-E544 IonicContact CZ-OE1 2.71Å; R510-E544 VanDerWaalsContact CZ-OE1 3.27Å; R510-E544 IonicContact NE-OE1 3.15Å; R510-E544 PolarHBondContact NE-OE1 3.13Å; R510-E544 IonicContact NH2-OE1 2.77Å; R510-E544 PolarHBondContact NH2-OE1 2.76Å; A540-E544 PolarHBondContact O-N 2.88Å; N541-E544 PolarHBondContact O-N 2.76Å; E544-G546 PolarHBondContact O-N 3.28Å; E544-G546 VanDerWaalsContact O-N 3.11Å; E544-G547 WeakPolarHBondContact O-CA 3.34Å; E544-G547 PolarHBondContact O-N 3.35Å
545	A	88.7	Confident	91.7	Very high	52 Å²	52	28.2 Å²	28.2	43%	0.43	16%	0.162	S	C	.	.	H	α-helix	trans	-63.4	-23.6	-174.8	0	0	0	0	0	113.4	N541	N541-A545 PolarHBondContact O-N 2.85Å; N541-A545 VanDerWaalsContact O-N 3.12Å
546	G	89.1	Confident	92	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	3.5	170.9	0	0	0	0	0	115	Q542 E544 H553 R576	Q542-G546 PolarHBondContact O-N 3.05Å; E544-G546 PolarHBondContact O-N 3.28Å; E544-G546 VanDerWaalsContact O-N 3.11Å; G546-H553 PolarHBondContact O-CE1 2.89Å; G546-H553 VanDerWaalsContact O-CE1 3.31Å; G546-R576 PolarHBondContact O-NE 3.38Å; G546-R576 PolarHBondContact O-NH2 2.89Å
547	G	89.9	Confident	92.1	Very high	9 Å²	9	29 Å²	29	9%	0.093	17%	0.167	C	C	.	.			trans	-72.7	-172	-176.4	0	0	0	0	0	114.7	M543 E544 R576	M543-G547 PolarHBondContact O-N 3.31Å; E544-G547 WeakPolarHBondContact O-CA 3.34Å; E544-G547 PolarHBondContact O-N 3.35Å; G547-R576 PolarHBondContact O-NE 2.84Å
548	K	90.6	Very high	92.2	Very high	87 Å²	87	28.2 Å²	28.2	38%	0.378	16%	0.163	S	C	.	.			trans	-130.9	139.4	169.5	-63.6	-177.2	-172.7	168	0	107.6	R551 L589	K548-R551 HydrophobicContact CB-CB 4.41Å; K548-R551 PolarHBondContact O-N 3.38Å; K548-L589 HydrophobicContact CD-CD1 3.71Å; K548-L589 HydrophobicContact CG-CD1 4.31Å
549	A	90.3	Very high	92.5	Very high	26 Å²	26	26.5 Å²	26.5	22%	0.215	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	145.7	-177.5	0	0	0	0	0	112.1	E424 N508 M509 R510 R551	E424-A549 HydrophobicContact CB-CB 4.24Å; E424-A549 HydrophobicContact CG-CB 4.48Å; E424-A549 WeakPolarHBondContact OE2-CB 3.45Å; N508-A549 HydrophobicContact CB-CB 4.1Å; N508-A549 WeakPolarHBondContact ND2-CB 3.38Å; M509-A549 CarbonylContact O-C 3.58Å; M509-A549 WeakPolarHBondContact O-CA 3.13Å; R510-A549 HydrophobicContact CG-CB 3.89Å; A549-R551 PolarHBondContact O-N 2.85Å
550	G	89	Confident	92.6	Very high	26 Å²	26	30.5 Å²	30.5	27%	0.268	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	12.6	-172.1	0	0	0	0	0	114.1	N508 M509	N508-G550 PolarHBondContact ND2-N 3.08Å; N508-G550 WeakPolarHBondContact OD1-CA 3.44Å; N508-G550 PolarHBondContact OD1-N 3.37Å; M509-G550 PolarHBondContact O-N 2.82Å
551	R	91.4	Very high	92.5	Very high	64 Å²	64	34.6 Å²	34.6	24%	0.242	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	147.6	-179.1	-58.3	-66.3	-62.9	-66.9	-9.6	110.8	K548 A549 E569 L589 I590	K548-R551 HydrophobicContact CB-CB 4.41Å; K548-R551 PolarHBondContact O-N 3.38Å; A549-R551 PolarHBondContact O-N 2.85Å; R551-E569 IonicContact CZ-OE1 3.09Å; R551-E569 IonicContact NH1-OE1 3.64Å; R551-E569 PolarHBondContact NH1-OE1 3.4Å; R551-E569 IonicContact NH2-OE1 3.77Å; R551-E569 PolarHBondContact NH2-OE1 2.84Å; R551-L589 HydrophobicContact CB-CD2 4.1Å; R551-I590 VanDerWaalsContact CZ-O 3.29Å; R551-I590 PolarHBondContact NE-O 2.81Å; R551-I590 PolarHBondContact NH2-O 2.92Å
552	I	94.6	Very high	92.4	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.015	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.9	176.4	-53.3	175.3	0	0	0	109.1	V486 L490 I493 V511 I513 I554 L589 I590	V486-I552 WeakPolarHBondContact O-CD1 3.21Å; L490-I552 HydrophobicContact CD2-CD1 3.68Å; L490-I552 HydrophobicContact CG-CD1 3.7Å; I493-I552 HydrophobicContact CD1-CG1 3.92Å; V511-I552 HydrophobicContact CB-CG1 4.29Å; V511-I552 HydrophobicContact CG1-CG1 4.46Å; V511-I552 HydrophobicContact CG1-CG2 4.2Å; I513-I552 HydrophobicContact CD1-CG2 3.43Å; I513-I552 VanDerWaalsContact CD1-CG2 3.43Å; I513-I552 HydrophobicContact CG1-CG2 3.87Å; I552-I554 HydrophobicContact CG2-CG2 3.85Å; I552-L589 WeakPolarHBondContact O-CA 3.45Å; I552-I590 HydrophobicContact CB-CB 4.29Å; I552-I590 HydrophobicContact CB-CD1 4.16Å; I552-I590 HydrophobicContact CB-CG1 4.32Å; I552-I590 HydrophobicContact CD1-CD1 4.47Å; I552-I590 HydrophobicContact CG2-CD1 4.04Å; I552-I590 PolarHBondContact O-N 3.36Å
553	H	95.6	Very high	92.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.2	-177.6	-169.9	-141.8	0	0	0	109.9	V511 G512 I513 M543 G546 Y588 L589	V511-H553 PolarHBondContact O-N 3.45Å; G512-H553 WeakPolarHBondContact CA-O 3.42Å; I513-H553 PolarHBondContact N-O 3.48Å; M543-H553 HydrophobicContact CE-CB 4.27Å; M543-H553 WeakPolarHBondContact CE-ND1 3.48Å; M543-H553 PolarHBondContact O-ND1 3.38Å; G546-H553 PolarHBondContact O-CE1 2.89Å; G546-H553 VanDerWaalsContact O-CE1 3.31Å; H553-Y588 WeakPolarHBondContact CA-O 3.29Å; H553-Y588 PolarHBondContact CD2-O 3.12Å; H553-L589 HydrophobicContact CB-CD2 3.79Å
554	I	96.1	Very high	91.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	149.9	-171.3	73.5	174.6	0	0	0	111.9	I513 M543 I552 T558 L559 L562 V568 T587 Y588 I590	I513-I554 HydrophobicContact CB-CG2 4.14Å; I513-I554 WeakPolarHBondContact O-CA 3.06Å; M543-I554 WeakPolarHBondContact CE-O 3.4Å; I552-I554 HydrophobicContact CG2-CG2 3.85Å; I554-T558 HydrophobicContact CB-CG2 4.06Å; I554-T558 HydrophobicContact CG2-CG2 4.26Å; I554-L559 HydrophobicContact CD1-CB 4.08Å; I554-L559 HydrophobicContact CD1-CD1 4.29Å; I554-L562 HydrophobicContact CD1-CD1 3.65Å; I554-V568 HydrophobicContact CD1-CG1 4.33Å; I554-T587 WeakPolarHBondContact O-CA 3.23Å; I554-Y588 PolarHBondContact N-O 3.2Å; I554-Y588 PolarHBondContact O-N 2.86Å; I554-I590 HydrophobicContact CD1-CD1 4.33Å; I554-I590 HydrophobicContact CD1-CG1 4.14Å; I554-I590 HydrophobicContact CG2-CD1 3.95Å; I554-I590 HydrophobicContact CG2-CG1 4.17Å
555	T	95.3	Very high	91.2	Very high	4 Å²	4	37.4 Å²	37.4	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	166.6	172.3	80.4	0	0	0	0	111.5	I513 H514 L539 M543 A557 T558 L559 I585	I513-T555 PolarHBondContact O-N 3.45Å; H514-T555 HydrophobicContact CB-CG2 4.26Å; H514-T555 WeakPolarHBondContact ND1-CG2 3.46Å; H514-T555 PolarHBondContact ND1-OG1 2.89Å; L539-T555 HydrophobicContact CD2-CG2 4.27Å; L539-T555 HydrophobicContact CG-CG2 4.31Å; M543-T555 HydrophobicContact CE-CG2 3.89Å; M543-T555 HydrophobicContact CG-CG2 3.67Å; M543-T555 HydrophobicContact SD-CG2 3.77Å; T555-A557 PolarHBondContact O-N 2.92Å; T555-A557 PolarHBondContact OG1-N 2.76Å; T555-T558 PolarHBondContact O-N 3.4Å; T555-L559 PolarHBondContact O-N 2.96Å; T555-I585 HydrophobicContact CG2-CG2 4.21Å
556	K	93	Very high	91.2	Very high	73 Å²	73	35.4 Å²	35.4	32%	0.317	20%	0.2	S	C	.	.	H	α-helix	trans	-53.6	-36.6	170.6	-174.6	49.1	156.7	-89.1	0	113.6	L559 N560 E586 Y588	K556-L559 HydrophobicContact CD-CD2 4.3Å; K556-L559 PolarHBondContact O-N 3.4Å; K556-N560 PolarHBondContact O-N 3.49Å; K556-N560 PolarHBondContact O-OD1 3.44Å; K556-E586 HydrophobicContact CB-CB 3.81Å; K556-E586 HydrophobicContact CG-CB 4.45Å; K556-E586 WeakPolarHBondContact CG-OE2 3.38Å; K556-E586 PolarHBondContact N-O 3.45Å; K556-E586 IonicContact NZ-OE2 2.76Å; K556-E586 PolarHBondContact NZ-OE2 3.4Å; K556-Y588 HydrophobicContact CB-CE2 4.1Å; K556-Y588 HydrophobicContact CD-CE2 3.9Å; K556-Y588 PolarHBondContact NZ-OH 2.98Å
557	A	93.8	Very high	91.1	Very high	33 Å²	33	38.5 Å²	38.5	27%	0.273	22%	0.217	S	C	.	.	H	α-helix	trans	-60.6	-47.7	177.1	0	0	0	0	0	111.5	S515 T555 N560 Y561	S515-A557 WeakPolarHBondContact O-CB 3.39Å; T555-A557 PolarHBondContact O-N 2.92Å; T555-A557 PolarHBondContact OG1-N 2.76Å; A557-N560 PolarHBondContact O-N 2.86Å; A557-Y561 WeakPolarHBondContact O-CD2 3.39Å; A557-Y561 PolarHBondContact O-N 3.32Å
558	T	94.9	Very high	91.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-45.7	174.2	-55.8	0	0	0	0	111.7	A482 I513 H514 S515 I554 T555 N560 Y561 L562	A482-T558 HydrophobicContact CB-CG2 4.39Å; I513-T558 HydrophobicContact CG2-CG2 4.01Å; H514-T558 VanDerWaalsContact C-OG1 3.23Å; H514-T558 VanDerWaalsContact CA-OG1 3.27Å; H514-T558 WeakPolarHBondContact CA-OG1 3.41Å; S515-T558 WeakPolarHBondContact CB-OG1 3.39Å; S515-T558 PolarHBondContact N-OG1 3.49Å; S515-T558 VanDerWaalsContact N-OG1 3.16Å; S515-T558 VanDerWaalsContact OG-CA 3.31Å; S515-T558 WeakPolarHBondContact OG-CA 3.5Å; S515-T558 WeakPolarHBondContact OG-CB 3.45Å; S515-T558 WeakPolarHBondContact OG-CG2 3.41Å; S515-T558 PolarHBondContact OG-OG1 2.84Å; I554-T558 HydrophobicContact CB-CG2 4.06Å; I554-T558 HydrophobicContact CG2-CG2 4.26Å; T555-T558 PolarHBondContact O-N 3.4Å; T558-N560 PolarHBondContact O-N 3.47Å; T558-Y561 PolarHBondContact O-N 3.21Å; T558-L562 HydrophobicContact CG2-CD1 4.32Å; T558-L562 HydrophobicContact CG2-CG 4.48Å; T558-L562 WeakPolarHBondContact O-CG 3.5Å; T558-L562 PolarHBondContact O-N 2.84Å
559	L	93.9	Very high	91.3	Very high	29 Å²	29	39.4 Å²	39.4	15%	0.152	22%	0.223	C	C	.	.	H	α-helix	trans	-56.3	-38.1	178.7	179.8	60.2	0	0	0	112.7	I554 T555 K556 Y561 L562 V568 Y588	I554-L559 HydrophobicContact CD1-CB 4.08Å; I554-L559 HydrophobicContact CD1-CD1 4.29Å; T555-L559 PolarHBondContact O-N 2.96Å; K556-L559 HydrophobicContact CD-CD2 4.3Å; K556-L559 PolarHBondContact O-N 3.4Å; L559-Y561 VanDerWaalsContact C-N 3.33Å; L559-Y561 PolarHBondContact O-N 3.45Å; L559-L562 PolarHBondContact O-N 3.39Å; L559-V568 HydrophobicContact CD1-CG1 4.13Å; L559-V568 HydrophobicContact CD1-CG2 3.95Å; L559-V568 HydrophobicContact CD2-CG2 4.24Å; L559-Y588 HydrophobicContact CB-CD2 4.45Å; L559-Y588 HydrophobicContact CD2-CD1 3.98Å; L559-Y588 HydrophobicContact CD2-CD2 3.73Å; L559-Y588 HydrophobicContact CD2-CE1 3.88Å; L559-Y588 HydrophobicContact CD2-CE2 3.65Å; L559-Y588 HydrophobicContact CD2-CG 3.89Å
560	N	93.4	Very high	91.4	Very high	101 Å²	101	43.3 Å²	43.3	54%	0.54	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-38.5	177	-65.2	-12.9	0	0	0	112.2	K556 A557 T558 L562	K556-N560 PolarHBondContact O-N 3.49Å; K556-N560 PolarHBondContact O-OD1 3.44Å; A557-N560 PolarHBondContact O-N 2.86Å; T558-N560 PolarHBondContact O-N 3.47Å; N560-L562 VanDerWaalsContact C-N 3.31Å; N560-L562 PolarHBondContact O-N 3.45Å
561	Y	92.7	Very high	91.2	Very high	86 Å²	86	42.1 Å²	42.1	34%	0.337	23%	0.234	S	C	.	.	H	α-helix	trans	-73.5	-18.7	176.3	-70.6	-67.6	0	0	0	113.9	N415 H481 A482 H483 A557 T558 L559 N563	N415-Y561 PolarHBondContact OD1-OH 3.44Å; N415-Y561 VanDerWaalsContact OD1-OH 3.06Å; H481-Y561 AromaticContact CE1-CD1 3.85Å; H481-Y561 AromaticContact CE1-CD2 3.73Å; H481-Y561 AromaticContact CE1-CG 3.64Å; H481-Y561 AromaticContact NE2-CD1 3.63Å; H481-Y561 AromaticContact NE2-CE1 3.8Å; H481-Y561 AromaticContact NE2-CG 3.91Å; A482-Y561 HydrophobicContact CB-CG 4.49Å; H483-Y561 PolarHBondContact CE1-O 2.87Å; H483-Y561 VanDerWaalsContact CE1-O 3.23Å; A557-Y561 WeakPolarHBondContact O-CD2 3.39Å; A557-Y561 PolarHBondContact O-N 3.32Å; T558-Y561 PolarHBondContact O-N 3.21Å; L559-Y561 VanDerWaalsContact C-N 3.33Å; L559-Y561 PolarHBondContact O-N 3.45Å; Y561-N563 VanDerWaalsContact C-N 3.29Å; Y561-N563 PolarHBondContact O-N 3.18Å
562	L	90	Very high	91	Very high	1 Å²	1	41 Å²	41	1%	0.005	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.7	179.4	-63	176.2	0	0	0	114	A482 V486 I554 T558 L559 N560 G564 D565 Y566 I590	A482-L562 HydrophobicContact CB-CD2 3.87Å; A482-L562 HydrophobicContact CB-CG 4.45Å; V486-L562 HydrophobicContact CB-CD2 4.41Å; V486-L562 HydrophobicContact CG2-CD1 3.91Å; V486-L562 HydrophobicContact CG2-CD2 3.81Å; I554-L562 HydrophobicContact CD1-CD1 3.65Å; T558-L562 HydrophobicContact CG2-CD1 4.32Å; T558-L562 HydrophobicContact CG2-CG 4.48Å; T558-L562 WeakPolarHBondContact O-CG 3.5Å; T558-L562 PolarHBondContact O-N 2.84Å; L559-L562 PolarHBondContact O-N 3.39Å; N560-L562 VanDerWaalsContact C-N 3.31Å; N560-L562 PolarHBondContact O-N 3.45Å; L562-G564 PolarHBondContact O-N 3.45Å; L562-D565 VanDerWaalsContact O-CB 3.31Å; L562-D565 WeakPolarHBondContact O-CB 3.47Å; L562-D565 PolarHBondContact O-N 2.82Å; L562-Y566 HydrophobicContact CB-CD2 4.14Å; L562-Y566 HydrophobicContact CD1-CD2 4.1Å; L562-Y566 HydrophobicContact CD2-CD2 4.14Å; L562-Y566 HydrophobicContact CD2-CE2 3.84Å; L562-Y566 HydrophobicContact CG-CD2 4.34Å; L562-I590 HydrophobicContact CD1-CD1 4.5Å
563	N	85.9	Confident	90.4	Very high	123 Å²	123	40.9 Å²	40.9	66%	0.658	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	19.8	172.5	-62.6	-44.5	0	0	0	116.5	Y561	Y561-N563 VanDerWaalsContact C-N 3.29Å; Y561-N563 PolarHBondContact O-N 3.18Å
564	G	82.4	Confident	89.9	Confident	56 Å²	56	41.9 Å²	41.9	58%	0.577	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.6	14.8	-176.6	0	0	0	0	0	115.2	L562 Y566	L562-G564 PolarHBondContact O-N 3.45Å; G564-Y566 VanDerWaalsContact C-N 3.3Å; G564-Y566 PolarHBondContact O-N 3.22Å
565	D	85	Confident	89.5	Confident	13 Å²	13	49.6 Å²	49.6	7%	0.07	28%	0.284	C	S	.	.			trans	-72.9	-15.8	-177.1	-84.9	-5.9	0	0	0	115.2	H483 L562 S594 K596 R597	H483-D565 IonicContact CD2-OD2 3.62Å; H483-D565 IonicContact NE2-OD2 3.98Å; H483-D565 PolarHBondContact NE2-OD2 2.71Å; H483-D565 VanDerWaalsContact NE2-OD2 3.09Å; L562-D565 VanDerWaalsContact O-CB 3.31Å; L562-D565 WeakPolarHBondContact O-CB 3.47Å; L562-D565 PolarHBondContact O-N 2.82Å; D565-S594 VanDerWaalsContact O-CB 3.25Å; D565-S594 WeakPolarHBondContact O-CB 3.19Å; D565-S594 PolarHBondContact O-N 3.13Å; D565-K596 IonicContact OD1-NZ 3.41Å; D565-K596 PolarHBondContact OD1-NZ 2.9Å; D565-R597 HydrophobicContact CB-CB 4.47Å; D565-R597 IonicContact OD2-CZ 3.57Å; D565-R597 IonicContact OD2-NH1 2.83Å; D565-R597 PolarHBondContact OD2-NH1 3.19Å
566	Y	87.6	Confident	89.2	Confident	9 Å²	9	53.8 Å²	53.8	4%	0.035	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.3	-176.2	-58.9	-92.7	0	0	0	110.7	H483 V486 E487 L562 G564 I590 G592 R597	H483-Y566 AromaticContact CD2-CE2 3.73Å; V486-Y566 HydrophobicContact CG1-CD1 4.01Å; V486-Y566 HydrophobicContact CG1-CD2 4.49Å; V486-Y566 HydrophobicContact CG1-CE1 3.54Å; V486-Y566 HydrophobicContact CG1-CE2 4.07Å; V486-Y566 HydrophobicContact CG1-CG 4.46Å; E487-Y566 VanDerWaalsContact CD-OH 3.24Å; E487-Y566 PolarHBondContact OE1-OH 3.21Å; E487-Y566 VanDerWaalsContact OE1-OH 3.05Å; L562-Y566 HydrophobicContact CB-CD2 4.14Å; L562-Y566 HydrophobicContact CD1-CD2 4.1Å; L562-Y566 HydrophobicContact CD2-CD2 4.14Å; L562-Y566 HydrophobicContact CD2-CE2 3.84Å; L562-Y566 HydrophobicContact CG-CD2 4.34Å; G564-Y566 VanDerWaalsContact C-N 3.3Å; G564-Y566 PolarHBondContact O-N 3.22Å; Y566-I590 HydrophobicContact CD1-CG2 4.39Å; Y566-G592 CarbonylContact C-O 3.57Å; Y566-G592 WeakPolarHBondContact CA-O 3.26Å; Y566-R597 PolarHBondContact OH-NE 3.48Å; Y566-R597 PolarHBondContact OH-NH2 3.07Å
567	D	87.8	Confident	88.9	Confident	65 Å²	65	51 Å²	51	35%	0.348	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124.3	175.9	-48.9	-45	0	0	0	108.2	V591 G592 S594	D567-V591 WeakPolarHBondContact O-CB 3.38Å; D567-V591 PolarHBondContact O-N 3.45Å; D567-G592 PolarHBondContact N-O 2.92Å; D567-G592 PolarHBondContact O-N 2.91Å; D567-S594 WeakPolarHBondContact OD1-CA 3.29Å; D567-S594 WeakPolarHBondContact OD1-CB 3.26Å; D567-S594 PolarHBondContact OD1-OG 2.9Å; D567-S594 WeakPolarHBondContact OD2-CA 3.43Å
568	V	91.8	Very high	88.5	Confident	49 Å²	49	52.5 Å²	52.5	30%	0.297	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	144.8	-173.7	-62.9	0	0	0	0	112.4	I554 L559 Y588 L589 I590	I554-V568 HydrophobicContact CD1-CG1 4.33Å; L559-V568 HydrophobicContact CD1-CG1 4.13Å; L559-V568 HydrophobicContact CD1-CG2 3.95Å; L559-V568 HydrophobicContact CD2-CG2 4.24Å; V568-Y588 HydrophobicContact CG2-CD1 4.13Å; V568-L589 WeakPolarHBondContact CA-O 3.45Å; V568-I590 HydrophobicContact CG1-CG1 4.2Å
569	E	92.9	Very high	88.1	Confident	67 Å²	67	56.4 Å²	56.4	31%	0.313	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	157.6	171.4	68.6	-178.4	173.2	0	0	111	R551 G571 Y588 L589 V591	R551-E569 IonicContact CZ-OE1 3.09Å; R551-E569 IonicContact NH1-OE1 3.64Å; R551-E569 PolarHBondContact NH1-OE1 3.4Å; R551-E569 IonicContact NH2-OE1 3.77Å; R551-E569 PolarHBondContact NH2-OE1 2.84Å; E569-G571 PolarHBondContact O-N 2.87Å; E569-Y588 CarbonylContact O-C 3.6Å; E569-Y588 VanDerWaalsContact O-CA 3.3Å; E569-Y588 WeakPolarHBondContact O-CA 3.42Å; E569-L589 HydrophobicContact CG-CB 3.78Å; E569-L589 PolarHBondContact N-O 3.43Å; E569-L589 PolarHBondContact O-N 3.31Å; E569-V591 HydrophobicContact CB-CG2 3.89Å; E569-V591 HydrophobicContact CG-CG2 3.88Å
570	P	91.6	Very high	87.8	Confident	108 Å²	108	55 Å²	55	70%	0.701	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.8	125.7	172.5	-24.4	35.1	0	0	0	111.9
571	G	86.1	Confident	87.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.			trans	-79.9	-25.2	-172.2	0	0	0	0	0	114.4	E569 G573 R576 T587	E569-G571 PolarHBondContact O-N 2.87Å; G571-G573 PolarHBondContact O-N 3.48Å; G571-R576 VanDerWaalsContact O-CZ 3.26Å; G571-R576 PolarHBondContact O-NH1 3.22Å; G571-R576 PolarHBondContact O-NH2 3.23Å; G571-T587 WeakPolarHBondContact CA-O 3.34Å; G571-T587 PolarHBondContact N-O 2.95Å
572	A	86.8	Confident	87.2	Confident	41 Å²	41	63.6 Å²	63.6	34%	0.339	34%	0.337	S	S	.	.			trans	50.2	37.4	-176.1	0	0	0	0	0	113.7	G574 E575 R576	A572-G574 PolarHBondContact O-N 2.88Å; A572-E575 HydrophobicContact CB-CG 4.36Å; A572-E575 PolarHBondContact O-N 3Å; A572-E575 VanDerWaalsContact O-N 3.08Å; A572-R576 PolarHBondContact O-NH1 2.95Å
573	G	82.5	Confident	86.9	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-58.4	-32.8	-174.8	0	0	0	0	0	114	G571 E575 R576 N577 T587	G571-G573 PolarHBondContact O-N 3.48Å; G573-E575 PolarHBondContact O-N 3.48Å; G573-R576 PolarHBondContact O-N 3.35Å; G573-N577 PolarHBondContact O-N 3.16Å; G573-T587 PolarHBondContact N-OG1 3.34Å
574	G	84.4	Confident	87	Confident	21 Å²	21	67.2 Å²	67.2	22%	0.216	36%	0.36	C	S	.	.	H	α-helix	trans	-67.9	-9.3	176.8	0	0	0	0	0	115.6	A572 K581	A572-G574 PolarHBondContact O-N 2.88Å; G574-K581 WeakPolarHBondContact O-CB 3.44Å; G574-K581 VanDerWaalsContact O-CD 3.32Å; G574-K581 WeakPolarHBondContact O-CD 3.19Å; G574-K581 WeakPolarHBondContact O-CG 3.49Å
575	E	87.4	Confident	87.3	Confident	163 Å²	163	67 Å²	67	76%	0.762	35%	0.345	S	S	*	.	H	α-helix	trans	-82.2	-30.4	168.9	-62.5	-177.7	157.2	0	0	111.8	A572 G573	A572-E575 HydrophobicContact CB-CG 4.36Å; A572-E575 PolarHBondContact O-N 3Å; A572-E575 VanDerWaalsContact O-N 3.08Å; G573-E575 PolarHBondContact O-N 3.48Å
576	R	88.4	Confident	87.6	Confident	91 Å²	91	71.4 Å²	71.4	34%	0.343	37%	0.365	S	S	.	.	H	α-helix	trans	-100.7	-25.9	-173	-60.9	-172.9	-60	-76.8	-1.6	113.5	G546 G547 G571 A572 G573	G546-R576 PolarHBondContact O-NE 3.38Å; G546-R576 PolarHBondContact O-NH2 2.89Å; G547-R576 PolarHBondContact O-NE 2.84Å; G571-R576 VanDerWaalsContact O-CZ 3.26Å; G571-R576 PolarHBondContact O-NH1 3.22Å; G571-R576 PolarHBondContact O-NH2 3.23Å; A572-R576 PolarHBondContact O-NH1 2.95Å; G573-R576 PolarHBondContact O-N 3.35Å
577	N	88.3	Confident	87.9	Confident	15 Å²	15	71.6 Å²	71.6	8%	0.08	37%	0.368	C	S	.	.			trans	-129.1	123.7	179.5	-172.9	-34.2	0	0	0	111.6	Q542 G573 Y579 L580 K581	Q542-N577 PolarHBondContact O-ND2 3.43Å; Q542-N577 PolarHBondContact OE1-ND2 2.71Å; Q542-N577 PolarHBondContact OE1-OD1 3.16Å; G573-N577 PolarHBondContact O-N 3.16Å; N577-Y579 VanDerWaalsContact C-N 3.34Å; N577-Y579 PolarHBondContact O-N 3.38Å; N577-Y579 WeakPolarHBondContact OD1-CB 3.48Å; N577-Y579 PolarHBondContact OD1-N 2.88Å; N577-L580 HydrophobicContact CB-CB 4.28Å; N577-L580 HydrophobicContact CB-CD1 3.9Å; N577-L580 HydrophobicContact CB-CG 3.94Å; N577-L580 PolarHBondContact O-N 3.4Å; N577-K581 PolarHBondContact O-N 2.96Å; N577-K581 VanDerWaalsContact O-N 3.12Å
578	A	85.2	Confident	88.2	Confident	64 Å²	64	70.6 Å²	70.6	53%	0.529	36%	0.359	S	S	.	.	H	α-helix	trans	-66.6	-28.3	-178.9	0	0	0	0	0	114.1	R582	A578-R582 VanDerWaalsContact O-CG 3.28Å; A578-R582 WeakPolarHBondContact O-CG 3.22Å; A578-R582 PolarHBondContact O-N 3.01Å
579	Y	85.5	Confident	88.3	Confident	82 Å²	82	68.2 Å²	68.2	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-67.6	-51.1	174	-177.7	-88.1	0	0	0	110.5	L539 Q542 N577 K581 R582 S583	L539-Y579 HydrophobicContact CD1-CE1 4.19Å; Q542-Y579 HydrophobicContact CB-CD1 3.94Å; Q542-Y579 HydrophobicContact CB-CG 4.45Å; Q542-Y579 HydrophobicContact CG-CD1 3.72Å; Q542-Y579 HydrophobicContact CG-CE1 4.26Å; Q542-Y579 HydrophobicContact CG-CG 3.88Å; N577-Y579 VanDerWaalsContact C-N 3.34Å; N577-Y579 PolarHBondContact O-N 3.38Å; N577-Y579 WeakPolarHBondContact OD1-CB 3.48Å; N577-Y579 PolarHBondContact OD1-N 2.88Å; Y579-K581 PolarHBondContact O-N 2.9Å; Y579-R582 PolarHBondContact O-N 2.72Å; Y579-R582 VanDerWaalsContact O-N 3.11Å; Y579-S583 PolarHBondContact O-N 3.41Å; Y579-S583 PolarHBondContact O-OG 3.38Å
580	L	88.7	Confident	88.3	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-33.9	176.7	-59.2	-178.8	0	0	0	111.9	L539 Q542 M543 N577 N584 I585 T587	L539-L580 HydrophobicContact CD1-CD2 3.59Å; Q542-L580 HydrophobicContact CB-CD2 4.3Å; M543-L580 HydrophobicContact CG-CD2 4.31Å; M543-L580 HydrophobicContact SD-CD1 3.75Å; M543-L580 HydrophobicContact SD-CD2 3.8Å; M543-L580 HydrophobicContact SD-CG 4.47Å; N577-L580 HydrophobicContact CB-CB 4.28Å; N577-L580 HydrophobicContact CB-CD1 3.9Å; N577-L580 HydrophobicContact CB-CG 3.94Å; N577-L580 PolarHBondContact O-N 3.4Å; L580-N584 PolarHBondContact O-N 2.67Å; L580-I585 HydrophobicContact CD2-CB 4.41Å; L580-I585 HydrophobicContact CD2-CG1 4.47Å; L580-I585 PolarHBondContact O-N 3.27Å; L580-T587 HydrophobicContact CD1-CG2 4.4Å
581	K	87.9	Confident	87.9	Confident	149 Å²	149	64.5 Å²	64.5	65%	0.648	32%	0.324	S	S	*	.	H	α-helix	trans	-68.1	-47.5	174.3	-159.5	179.1	-170.6	165.4	0	113.2	G574 N577 Y579 N584	G574-K581 WeakPolarHBondContact O-CB 3.44Å; G574-K581 VanDerWaalsContact O-CD 3.32Å; G574-K581 WeakPolarHBondContact O-CD 3.19Å; G574-K581 WeakPolarHBondContact O-CG 3.49Å; N577-K581 PolarHBondContact O-N 2.96Å; N577-K581 VanDerWaalsContact O-N 3.12Å; Y579-K581 PolarHBondContact O-N 2.9Å; K581-N584 PolarHBondContact O-N 3.42Å
582	R	85.1	Confident	87.1	Confident	218 Å²	218	65.6 Å²	65.6	82%	0.823	34%	0.335	S	S	*	.	H	α-helix	trans	-65.7	-41.5	-179.7	-73.5	172	-172.8	-176.6	3.1	111.9	A578 Y579 N584	A578-R582 VanDerWaalsContact O-CG 3.28Å; A578-R582 WeakPolarHBondContact O-CG 3.22Å; A578-R582 PolarHBondContact O-N 3.01Å; Y579-R582 PolarHBondContact O-N 2.72Å; Y579-R582 VanDerWaalsContact O-N 3.11Å; R582-N584 VanDerWaalsContact C-N 3.26Å; R582-N584 PolarHBondContact O-N 3.2Å
583	S	83.2	Confident	86.1	Confident	52 Å²	52	64.5 Å²	64.5	36%	0.364	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	3.3	-179.6	-53.5	0	0	0	0	113.7	Y579 I585	Y579-S583 PolarHBondContact O-N 3.41Å; Y579-S583 PolarHBondContact O-OG 3.38Å; S583-I585 VanDerWaalsContact C-N 3.31Å; S583-I585 WeakPolarHBondContact O-CD1 3.46Å; S583-I585 PolarHBondContact O-N 2.91Å
584	N	88.4	Confident	85	Confident	147 Å²	147	65.9 Å²	65.9	79%	0.786	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	43.7	177.7	-164.7	51.4	0	0	0	114.5	L580 K581 R582	L580-N584 PolarHBondContact O-N 2.67Å; K581-N584 PolarHBondContact O-N 3.42Å; R582-N584 VanDerWaalsContact C-N 3.26Å; R582-N584 PolarHBondContact O-N 3.2Å
585	I	88.9	Confident	83.6	Confident	51 Å²	51	71 Å²	71	26%	0.262	35%	0.353	S	S	.	.			trans	-81.8	122.4	-172.9	-55.3	-62.7	0	0	0	111.3	L539 T555 L580 S583 T587	L539-I585 HydrophobicContact CD1-CG1 4.16Å; L539-I585 HydrophobicContact CD1-CG2 4.45Å; L539-I585 HydrophobicContact CD2-CD1 4.47Å; T555-I585 HydrophobicContact CG2-CG2 4.21Å; L580-I585 HydrophobicContact CD2-CB 4.41Å; L580-I585 HydrophobicContact CD2-CG1 4.47Å; L580-I585 PolarHBondContact O-N 3.27Å; S583-I585 VanDerWaalsContact C-N 3.31Å; S583-I585 WeakPolarHBondContact O-CD1 3.46Å; S583-I585 PolarHBondContact O-N 2.91Å; I585-T587 HydrophobicContact CG2-CG2 4.05Å; I585-T587 PolarHBondContact O-N 2.97Å
586	E	90.6	Very high	81.9	Confident	106 Å²	106	69.4 Å²	69.4	50%	0.495	34%	0.343	S	S	.	.			trans	-64.8	126.1	166.9	-81	-171.5	-175.5	0	0	111.1	K556 Y588	K556-E586 HydrophobicContact CB-CB 3.81Å; K556-E586 HydrophobicContact CG-CB 4.45Å; K556-E586 WeakPolarHBondContact CG-OE2 3.38Å; K556-E586 PolarHBondContact N-O 3.45Å; K556-E586 IonicContact NZ-OE2 2.76Å; K556-E586 PolarHBondContact NZ-OE2 3.4Å; E586-Y588 HydrophobicContact CB-CE2 4.26Å; E586-Y588 PolarHBondContact OE2-OH 3.39Å
587	T	93.9	Very high	80.7	Confident	14 Å²	14	67 Å²	67	9%	0.086	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.2	-171.7	46.2	0	0	0	0	111.5	M543 I554 G571 G573 L580 I585	M543-T587 HydrophobicContact CE-CG2 3.7Å; M543-T587 HydrophobicContact SD-CG2 3.42Å; M543-T587 WeakPolarHBondContact SD-CG2 3.49Å; I554-T587 WeakPolarHBondContact O-CA 3.23Å; G571-T587 WeakPolarHBondContact CA-O 3.34Å; G571-T587 PolarHBondContact N-O 2.95Å; G573-T587 PolarHBondContact N-OG1 3.34Å; L580-T587 HydrophobicContact CD1-CG2 4.4Å; I585-T587 HydrophobicContact CG2-CG2 4.05Å; I585-T587 PolarHBondContact O-N 2.97Å
588	Y	94.9	Very high	79.2	Confident	43 Å²	43	71.3 Å²	71.3	17%	0.169	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153.3	-174	-59.9	-91.2	0	0	0	110.5	H553 I554 K556 L559 V568 E569 E586	H553-Y588 WeakPolarHBondContact CA-O 3.29Å; H553-Y588 PolarHBondContact CD2-O 3.12Å; I554-Y588 PolarHBondContact N-O 3.2Å; I554-Y588 PolarHBondContact O-N 2.86Å; K556-Y588 HydrophobicContact CB-CE2 4.1Å; K556-Y588 HydrophobicContact CD-CE2 3.9Å; K556-Y588 PolarHBondContact NZ-OH 2.98Å; L559-Y588 HydrophobicContact CB-CD2 4.45Å; L559-Y588 HydrophobicContact CD2-CD1 3.98Å; L559-Y588 HydrophobicContact CD2-CD2 3.73Å; L559-Y588 HydrophobicContact CD2-CE1 3.88Å; L559-Y588 HydrophobicContact CD2-CE2 3.65Å; L559-Y588 HydrophobicContact CD2-CG 3.89Å; V568-Y588 HydrophobicContact CG2-CD1 4.13Å; E569-Y588 CarbonylContact O-C 3.6Å; E569-Y588 VanDerWaalsContact O-CA 3.3Å; E569-Y588 WeakPolarHBondContact O-CA 3.42Å; E586-Y588 HydrophobicContact CB-CE2 4.26Å; E586-Y588 PolarHBondContact OE2-OH 3.39Å
589	L	94.3	Very high	77.7	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.2	171.4	-69.8	159.7	0	0	0	109.3	K548 R551 I552 H553 V568 E569	K548-L589 HydrophobicContact CD-CD1 3.71Å; K548-L589 HydrophobicContact CG-CD1 4.31Å; R551-L589 HydrophobicContact CB-CD2 4.1Å; I552-L589 WeakPolarHBondContact O-CA 3.45Å; H553-L589 HydrophobicContact CB-CD2 3.79Å; V568-L589 WeakPolarHBondContact CA-O 3.45Å; E569-L589 HydrophobicContact CG-CB 3.78Å; E569-L589 PolarHBondContact N-O 3.43Å; E569-L589 PolarHBondContact O-N 3.31Å
590	I	92.1	Very high	76.5	Confident	7 Å²	7	74.8 Å²	74.8	4%	0.036	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.9	176.3	-58.1	-177.3	0	0	0	109.3	V486 R551 I552 I554 L562 Y566 V568	V486-I590 HydrophobicContact CB-CD1 4.21Å; V486-I590 HydrophobicContact CG1-CD1 3.5Å; V486-I590 VanDerWaalsContact CG1-CD1 3.5Å; V486-I590 HydrophobicContact CG2-CD1 3.61Å; R551-I590 VanDerWaalsContact CZ-O 3.29Å; R551-I590 PolarHBondContact NE-O 2.81Å; R551-I590 PolarHBondContact NH2-O 2.92Å; I552-I590 HydrophobicContact CB-CB 4.29Å; I552-I590 HydrophobicContact CB-CD1 4.16Å; I552-I590 HydrophobicContact CB-CG1 4.32Å; I552-I590 HydrophobicContact CD1-CD1 4.47Å; I552-I590 HydrophobicContact CG2-CD1 4.04Å; I552-I590 PolarHBondContact O-N 3.36Å; I554-I590 HydrophobicContact CD1-CD1 4.33Å; I554-I590 HydrophobicContact CD1-CG1 4.14Å; I554-I590 HydrophobicContact CG2-CD1 3.95Å; I554-I590 HydrophobicContact CG2-CG1 4.17Å; L562-I590 HydrophobicContact CD1-CD1 4.5Å; Y566-I590 HydrophobicContact CD1-CG2 4.39Å; V568-I590 HydrophobicContact CG1-CG1 4.2Å
591	V	82.6	Confident	75	Confident	90 Å²	90	79 Å²	79	55%	0.545	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-37.3	178.9	-172.2	0	0	0	0	110.5	D567 E569	D567-V591 WeakPolarHBondContact O-CB 3.38Å; D567-V591 PolarHBondContact O-N 3.45Å; E569-V591 HydrophobicContact CB-CG2 3.89Å; E569-V591 HydrophobicContact CG-CG2 3.88Å
592	G	70.1	Confident	73.6	Confident	22 Å²	22	74.1 Å²	74.1	23%	0.227	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.9	179.1	174.8	0	0	0	0	0	113.9	Y566 D567	Y566-G592 CarbonylContact C-O 3.57Å; Y566-G592 WeakPolarHBondContact CA-O 3.26Å; D567-G592 PolarHBondContact N-O 2.92Å; D567-G592 PolarHBondContact O-N 2.91Å
593	C	64.8	Low	72.3	Confident	19 Å²	19	69.5 Å²	69.5	13%	0.128	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	134.4	168	-70.9	0	0	0	0	110.3	K598	C593-K598 HydrophobicContact CB-CG 4.06Å; C593-K598 WeakPolarHBondContact O-CE 3.44Å; C593-K598 PolarHBondContact O-NZ 2.91Å
594	S	60.8	Low	71.3	Confident	28 Å²	28	72 Å²	72	20%	0.196	36%	0.364	C	S	.	.			trans	-66.2	159	177.5	-156.9	0	0	0	0	112.3	D565 D567 K596 R597 K598	D565-S594 VanDerWaalsContact O-CB 3.25Å; D565-S594 WeakPolarHBondContact O-CB 3.19Å; D565-S594 PolarHBondContact O-N 3.13Å; D567-S594 WeakPolarHBondContact OD1-CA 3.29Å; D567-S594 WeakPolarHBondContact OD1-CB 3.26Å; D567-S594 PolarHBondContact OD1-OG 2.9Å; D567-S594 WeakPolarHBondContact OD2-CA 3.43Å; S594-K596 VanDerWaalsContact C-N 3.26Å; S594-K596 PolarHBondContact O-N 3.36Å; S594-R597 PolarHBondContact O-N 2.88Å; S594-K598 PolarHBondContact O-N 3.02Å
595	Q	54.5	Low	69.8	Low	130 Å²	130	67.2 Å²	67.2	61%	0.607	35%	0.345	S	S	*	.	H	α-helix	trans	-49.9	-47.4	-177.2	-142.2	81.3	-21.8	0	0	111.7	R597 K598 E599	Q595-R597 PolarHBondContact O-N 3.32Å; Q595-K598 WeakPolarHBondContact O-CB 3.3Å; Q595-K598 PolarHBondContact O-N 2.73Å; Q595-E599 PolarHBondContact O-N 2.76Å; Q595-E599 VanDerWaalsContact O-N 3.08Å
596	K	52.7	Low	68.3	Low	129 Å²	129	71.9 Å²	71.9	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-55.1	-47.7	176.6	179.8	-169.8	165.9	-133.5	0	112.7	D565 S594 E599 E600	D565-K596 IonicContact OD1-NZ 3.41Å; D565-K596 PolarHBondContact OD1-NZ 2.9Å; S594-K596 VanDerWaalsContact C-N 3.26Å; S594-K596 PolarHBondContact O-N 3.36Å; K596-E599 PolarHBondContact O-N 2.83Å; K596-E600 WeakPolarHBondContact O-CB 3.45Å; K596-E600 PolarHBondContact O-N 3.41Å
597	R	61.6	Low	66.5	Low	39 Å²	39	72.6 Å²	72.6	15%	0.147	37%	0.368	C	S	.	.	H	α-helix	trans	-76.5	-24.5	-179	-172.6	162.7	175.6	110.5	1.4	112.9	H483 E487 D565 Y566 S594 Q595 K601	H483-R597 PolarHBondContact CD2-NH1 3.5Å; E487-R597 IonicContact OE1-CZ 2.65Å; E487-R597 IonicContact OE1-NE 2.86Å; E487-R597 PolarHBondContact OE1-NE 3.35Å; E487-R597 IonicContact OE1-NH2 3.84Å; E487-R597 PolarHBondContact OE1-NH2 3.13Å; D565-R597 HydrophobicContact CB-CB 4.47Å; D565-R597 IonicContact OD2-CZ 3.57Å; D565-R597 IonicContact OD2-NH1 2.83Å; D565-R597 PolarHBondContact OD2-NH1 3.19Å; Y566-R597 PolarHBondContact OH-NE 3.48Å; Y566-R597 PolarHBondContact OH-NH2 3.07Å; S594-R597 PolarHBondContact O-N 2.88Å; Q595-R597 PolarHBondContact O-N 3.32Å; R597-K601 VanDerWaalsContact O-CB 3.29Å; R597-K601 WeakPolarHBondContact O-CB 3.36Å; R597-K601 PolarHBondContact O-N 2.96Å
598	K	58	Low	64.4	Low	107 Å²	107	75 Å²	75	47%	0.465	39%	0.385	S	S	.	.	H	α-helix	trans	-65.3	-43	168	-71.9	168.7	174.8	132.1	0	111.2	C593 S594 Q595 A602	C593-K598 HydrophobicContact CB-CG 4.06Å; C593-K598 WeakPolarHBondContact O-CE 3.44Å; C593-K598 PolarHBondContact O-NZ 2.91Å; S594-K598 PolarHBondContact O-N 3.02Å; Q595-K598 WeakPolarHBondContact O-CB 3.3Å; Q595-K598 PolarHBondContact O-N 2.73Å; K598-A602 VanDerWaalsContact O-CB 3.29Å; K598-A602 WeakPolarHBondContact O-CB 3.3Å; K598-A602 PolarHBondContact O-N 3.48Å
599	E	54.2	Low	62.4	Low	126 Å²	126	81.7 Å²	81.7	59%	0.589	41%	0.41	S	S	*	.	H	α-helix	trans	-65.9	-42.6	175	-70	171.8	-170.1	0	0	111.8	Q595 K596 A602 M603	Q595-E599 PolarHBondContact O-N 2.76Å; Q595-E599 VanDerWaalsContact O-N 3.08Å; K596-E599 PolarHBondContact O-N 2.83Å; E599-A602 CarbonylContact O-C 3.14Å; E599-A602 WeakPolarHBondContact O-CB 3.39Å; E599-A602 PolarHBondContact O-N 3.04Å; E599-M603 WeakPolarHBondContact O-CG 3.21Å; E599-M603 PolarHBondContact O-N 3.14Å
600	E	58.4	Low	60.2	Low	93 Å²	93	88.5 Å²	88.5	44%	0.435	44%	0.442	S	S	.	.	H	α-helix	trans	-66	-46.1	176.8	-168.5	164.3	-149.6	0	0	112.3	K596 A602 M603 I604	K596-E600 WeakPolarHBondContact O-CB 3.45Å; K596-E600 PolarHBondContact O-N 3.41Å; E600-A602 VanDerWaalsContact C-N 3.26Å; E600-A602 PolarHBondContact O-N 2.8Å; E600-M603 PolarHBondContact O-N 2.98Å; E600-M603 VanDerWaalsContact O-N 3.12Å; E600-I604 HydrophobicContact CG-CD1 4.02Å; E600-I604 WeakPolarHBondContact O-CG1 3.43Å; E600-I604 PolarHBondContact O-N 3.35Å
601	K	59.1	Low	58	Low	88 Å²	88	97.6 Å²	97.6	38%	0.383	48%	0.476	S	S	.	.	H	α-helix	trans	-57.2	-38.1	168.8	-86.8	-171.5	171	-179	0	111.7	E487 R597 I604 A605	E487-K601 WeakPolarHBondContact OE1-CE 3.18Å; E487-K601 IonicContact OE1-NZ 2.76Å; E487-K601 PolarHBondContact OE1-NZ 2.67Å; E487-K601 IonicContact OE2-NZ 3.38Å; E487-K601 PolarHBondContact OE2-NZ 3.08Å; R597-K601 VanDerWaalsContact O-CB 3.29Å; R597-K601 WeakPolarHBondContact O-CB 3.36Å; R597-K601 PolarHBondContact O-N 2.96Å; K601-I604 PolarHBondContact O-N 3.25Å; K601-A605 WeakPolarHBondContact O-CB 3.27Å; K601-A605 PolarHBondContact O-N 2.8Å
602	A	57.9	Low	56.1	Low	48 Å²	48	96.8 Å²	96.8	40%	0.397	47%	0.471	S	S	.	.	H	α-helix	trans	-69.1	-33.4	176.5	0	0	0	0	0	113	K598 E599 E600 K606	K598-A602 VanDerWaalsContact O-CB 3.29Å; K598-A602 WeakPolarHBondContact O-CB 3.3Å; K598-A602 PolarHBondContact O-N 3.48Å; E599-A602 CarbonylContact O-C 3.14Å; E599-A602 WeakPolarHBondContact O-CB 3.39Å; E599-A602 PolarHBondContact O-N 3.04Å; E600-A602 VanDerWaalsContact C-N 3.26Å; E600-A602 PolarHBondContact O-N 2.8Å; A602-K606 WeakPolarHBondContact O-CB 3.33Å; A602-K606 VanDerWaalsContact O-CG 3.26Å; A602-K606 WeakPolarHBondContact O-CG 3.49Å; A602-K606 PolarHBondContact O-N 3.04Å
603	M	58.4	Low	54.9	Low	121 Å²	121	101.5 Å²	101.5	60%	0.596	49%	0.491	S	S	*	.	H	α-helix	trans	-69.7	-47.4	170.7	-68.3	-157.8	-168.3	0	0	111.8	E599 E600 A605 K606 M607	E599-M603 WeakPolarHBondContact O-CG 3.21Å; E599-M603 PolarHBondContact O-N 3.14Å; E600-M603 PolarHBondContact O-N 2.98Å; E600-M603 VanDerWaalsContact O-N 3.12Å; M603-A605 VanDerWaalsContact C-N 3.33Å; M603-A605 PolarHBondContact O-N 2.73Å; M603-K606 WeakPolarHBondContact O-CB 3.47Å; M603-K606 PolarHBondContact O-N 3.14Å; M603-K606 VanDerWaalsContact O-N 3.11Å; M603-M607 WeakPolarHBondContact O-CG 3.22Å; M603-M607 PolarHBondContact O-N 2.82Å
604	I	61.4	Low	53.9	Low	103 Å²	103	105.1 Å²	105.1	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-41.6	178	-66.6	166.4	0	0	0	110.4	E600 K601 K606 M607 S608	E600-I604 HydrophobicContact CG-CD1 4.02Å; E600-I604 WeakPolarHBondContact O-CG1 3.43Å; E600-I604 PolarHBondContact O-N 3.35Å; K601-I604 PolarHBondContact O-N 3.25Å; I604-K606 PolarHBondContact O-N 3.02Å; I604-M607 PolarHBondContact O-N 2.94Å; I604-S608 WeakPolarHBondContact O-CB 3.4Å; I604-S608 PolarHBondContact O-N 3.35Å
605	A	57.6	Low	52.9	Low	47 Å²	47	107.2 Å²	107.2	39%	0.388	53%	0.528	S	S	.	.	H	α-helix	trans	-66.2	-33.9	174.3	0	0	0	0	0	112.7	K601 M603 R609	K601-A605 WeakPolarHBondContact O-CB 3.27Å; K601-A605 PolarHBondContact O-N 2.8Å; M603-A605 VanDerWaalsContact C-N 3.33Å; M603-A605 PolarHBondContact O-N 2.73Å; A605-R609 VanDerWaalsContact O-CB 3.29Å; A605-R609 WeakPolarHBondContact O-CB 3.44Å; A605-R609 VanDerWaalsContact O-CG 3.27Å; A605-R609 WeakPolarHBondContact O-CG 3.16Å; A605-R609 PolarHBondContact O-N 2.85Å
606	K	57.5	Low	52	Low	149 Å²	149	106.2 Å²	106.2	65%	0.648	53%	0.531	S	S	*	.	H	α-helix	trans	-66.6	-47.5	171.1	-80.8	171.9	178.8	176.8	0	111.7	A602 M603 I604 S608 R609 Q610	A602-K606 WeakPolarHBondContact O-CB 3.33Å; A602-K606 VanDerWaalsContact O-CG 3.26Å; A602-K606 WeakPolarHBondContact O-CG 3.49Å; A602-K606 PolarHBondContact O-N 3.04Å; M603-K606 WeakPolarHBondContact O-CB 3.47Å; M603-K606 PolarHBondContact O-N 3.14Å; M603-K606 VanDerWaalsContact O-N 3.11Å; I604-K606 PolarHBondContact O-N 3.02Å; K606-S608 VanDerWaalsContact C-N 3.34Å; K606-S608 PolarHBondContact O-N 3.29Å; K606-R609 PolarHBondContact O-N 3.36Å; K606-Q610 WeakPolarHBondContact O-CG 3.34Å; K606-Q610 PolarHBondContact O-N 3.29Å
607	M	52.7	Low	51.2	Low	121 Å²	121	108.7 Å²	108.7	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-62.9	-40.3	175.9	-66.4	-172.7	-163.4	0	0	111.9	M603 I604 Q610 R611	M603-M607 WeakPolarHBondContact O-CG 3.22Å; M603-M607 PolarHBondContact O-N 2.82Å; I604-M607 PolarHBondContact O-N 2.94Å; M607-Q610 PolarHBondContact O-N 3.24Å; M607-R611 PolarHBondContact O-N 3.49Å
608	S	49	Very low	50	Low	64 Å²	64	113.2 Å²	113.2	45%	0.448	57%	0.572	S	S	.	*	H	α-helix	trans	-65.1	-43.4	176	-170.6	0	0	0	0	111.3	I604 K606 Q610 R611 T612	I604-S608 WeakPolarHBondContact O-CB 3.4Å; I604-S608 PolarHBondContact O-N 3.35Å; K606-S608 VanDerWaalsContact C-N 3.34Å; K606-S608 PolarHBondContact O-N 3.29Å; S608-Q610 VanDerWaalsContact C-N 3.34Å; S608-Q610 PolarHBondContact O-N 2.87Å; S608-R611 CarbonylContact O-C 3.58Å; S608-R611 WeakPolarHBondContact O-CA 3.47Å; S608-R611 WeakPolarHBondContact O-CB 3.38Å; S608-R611 PolarHBondContact O-N 3.11Å; S608-T612 PolarHBondContact O-N 3.1Å; S608-T612 PolarHBondContact O-OG1 2.67Å
609	R	53.2	Low	48.5	Very low	184 Å²	184	114.2 Å²	114.2	69%	0.694	59%	0.592	S	S	*	*	H	α-helix	trans	-63.7	-34.2	172.2	-76.8	177.4	175.6	-173.9	-0.7	113.2	A605 K606 R611 T612 N613	A605-R609 VanDerWaalsContact O-CB 3.29Å; A605-R609 WeakPolarHBondContact O-CB 3.44Å; A605-R609 VanDerWaalsContact O-CG 3.27Å; A605-R609 WeakPolarHBondContact O-CG 3.16Å; A605-R609 PolarHBondContact O-N 2.85Å; K606-R609 PolarHBondContact O-N 3.36Å; R609-R611 VanDerWaalsContact C-N 3.34Å; R609-T612 WeakPolarHBondContact CA-OG1 3.23Å; R609-T612 PolarHBondContact O-OG1 3.23Å; R609-N613 VanDerWaalsContact O-CB 3.27Å; R609-N613 WeakPolarHBondContact O-CB 3.3Å; R609-N613 VanDerWaalsContact O-CG 3.23Å; R609-N613 PolarHBondContact O-N 3.34Å
610	Q	48.3	Very low	47.6	Very low	144 Å²	144	111 Å²	111	67%	0.673	59%	0.592	S	S	*	*	H	α-helix	trans	-68.1	-32.7	170.5	-74	179.1	-63.1	0	0	112.4	K606 M607 S608 S614	K606-Q610 WeakPolarHBondContact O-CG 3.34Å; K606-Q610 PolarHBondContact O-N 3.29Å; M607-Q610 PolarHBondContact O-N 3.24Å; S608-Q610 VanDerWaalsContact C-N 3.34Å; S608-Q610 PolarHBondContact O-N 2.87Å; Q610-S614 PolarHBondContact O-OG 3.17Å
611	R	44.9	Very low	46.5	Very low	198 Å²	198	113.6 Å²	113.6	75%	0.747	60%	0.604	S	S	*	*	H	α-helix	trans	-74.3	-37.1	173.1	-101	-177.5	172.7	174.8	-0.9	113.6	M607 S608 R609 S614 V615	M607-R611 PolarHBondContact O-N 3.49Å; S608-R611 CarbonylContact O-C 3.58Å; S608-R611 WeakPolarHBondContact O-CA 3.47Å; S608-R611 WeakPolarHBondContact O-CB 3.38Å; S608-R611 PolarHBondContact O-N 3.11Å; R609-R611 VanDerWaalsContact C-N 3.34Å; R611-S614 PolarHBondContact O-OG 3.2Å; R611-S614 VanDerWaalsContact O-OG 3.05Å; R611-V615 WeakPolarHBondContact O-CG2 3.45Å
612	T	43.8	Very low	45.1	Very low	73 Å²	73	116.6 Å²	116.6	45%	0.448	61%	0.613	S	S	.	*	H	α-helix	trans	-76.5	-36.1	178.8	53.7	0	0	0	0	111.8	S608 R609 S614 V615 T616	S608-T612 PolarHBondContact O-N 3.1Å; S608-T612 PolarHBondContact O-OG1 2.67Å; R609-T612 WeakPolarHBondContact CA-OG1 3.23Å; R609-T612 PolarHBondContact O-OG1 3.23Å; T612-S614 PolarHBondContact O-N 3.11Å; T612-S614 VanDerWaalsContact O-N 3.13Å; T612-V615 PolarHBondContact O-N 3.45Å; T612-T616 PolarHBondContact O-N 3.45Å
613	N	43.3	Very low	43.9	Very low	121 Å²	121	118.2 Å²	118.2	65%	0.647	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-12	174.9	-76.1	0.7	0	0	0	114.4	R609 T616	R609-N613 VanDerWaalsContact O-CB 3.27Å; R609-N613 WeakPolarHBondContact O-CB 3.3Å; R609-N613 VanDerWaalsContact O-CG 3.23Å; R609-N613 PolarHBondContact O-N 3.34Å; N613-T616 PolarHBondContact O-OG1 2.92Å
614	S	45	Very low	42.9	Very low	94 Å²	94	116.7 Å²	116.7	66%	0.657	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	3	170.9	58.4	0	0	0	0	114.1	Q610 R611 T612	Q610-S614 PolarHBondContact O-OG 3.17Å; R611-S614 PolarHBondContact O-OG 3.2Å; R611-S614 VanDerWaalsContact O-OG 3.05Å; T612-S614 PolarHBondContact O-N 3.11Å; T612-S614 VanDerWaalsContact O-N 3.13Å
615	V	40.5	Very low	41.5	Very low	72 Å²	72	118.1 Å²	118.1	44%	0.436	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123.4	7.1	-177.3	-179	0	0	0	0	112	R611 T612 H617 N618 W622	R611-V615 WeakPolarHBondContact O-CG2 3.45Å; T612-V615 PolarHBondContact O-N 3.45Å; V615-H617 PolarHBondContact O-N 3.04Å; V615-N618 PolarHBondContact O-N 3.27Å; V615-W622 HydrophobicContact CG1-CZ2 4.09Å
616	T	35.2	Very low	40.2	Very low	109 Å²	109	120.1 Å²	120.1	67%	0.669	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	19.8	-178.4	33.7	0	0	0	0	116.3	T612 N613	T612-T616 PolarHBondContact O-N 3.45Å; N613-T616 PolarHBondContact O-OG1 2.92Å
617	H	36.1	Very low	39.1	Very low	182 Å²	182	119.4 Å²	119.4	84%	0.843	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.4	23.7	174.3	-134	-66.9	0	0	0	115.8	V615	V615-H617 PolarHBondContact O-N 3.04Å
618	N	35.7	Very low	38	Very low	134 Å²	134	117.6 Å²	117.6	72%	0.717	62%	0.623	S	S	*	*			trans	-162.2	90.7	152.8	-108.3	-20.5	0	0	0	111.6	V615 W622	V615-N618 PolarHBondContact O-N 3.27Å; N618-W622 PolarHBondContact O-NE1 2.94Å
619	S	27	Very low	37	Very low	128 Å²	128	120.3 Å²	120.3	90%	0.895	63%	0.633	S	S	*	*			trans	-101	135.8	175.2	-170.6	0	0	0	0	111
620	G	34.3	Very low	36.1	Very low	57 Å²	57	118.4 Å²	118.4	59%	0.588	63%	0.631	S	S	*	*	S	Bend	trans	109.3	56.2	-179.3	0	0	0	0	0	115.4
621	H	36.3	Very low	35.3	Very low	148 Å²	148	113.4 Å²	113.4	69%	0.685	61%	0.609	S	S	*	*			trans	175.3	63.5	154.5	-101.9	75.4	0	0	0	109.5
622	W	29.4	Very low	34.8	Very low	151 Å²	151	105.3 Å²	105.3	57%	0.572	58%	0.582	S	S	*	*			trans	-128.6	7.6	-169.8	-77.9	97.9	0	0	0	116.1	V615 N618	V615-W622 HydrophobicContact CG1-CZ2 4.09Å; N618-W622 PolarHBondContact O-NE1 2.94Å
623	A	32.6	Very low	34.3	Very low	83 Å²	83	109.5 Å²	109.5	69%	0.686	59%	0.594	S	S	*	*	S	Bend	trans	-83.5	-40.1	173.3	0	0	0	0	0	112.9
624	D	37.1	Very low	33.8	Very low	89 Å²	89	108.4 Å²	108.4	48%	0.476	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-12.7	-164	-49.4	-74.7	0	0	0	115.5	A626 F627 H628	D624-A626 PolarHBondContact O-N 3.29Å; D624-F627 PolarHBondContact O-N 3.24Å; D624-H628 WeakPolarHBondContact O-CB 3.34Å; D624-H628 PolarHBondContact O-N 3.37Å
625	R	32.3	Very low	33.3	Very low	132 Å²	132	106 Å²	106	50%	0.498	56%	0.564	S	S	.	*	H	α-helix	trans	-69.7	-26.7	-166.1	-72.5	-174.8	177.4	-172.1	-3.3	115.1	N629	R625-N629 VanDerWaalsContact O-CG 3.27Å; R625-N629 PolarHBondContact O-ND2 3.04Å
626	A	30.3	Very low	33	Very low	89 Å²	89	110 Å²	110	74%	0.736	58%	0.576	S	S	*	*	H	α-helix	trans	-70.1	-48.9	178.4	0	0	0	0	0	111.3	D624	D624-A626 PolarHBondContact O-N 3.29Å
627	F	33.5	Very low	32.9	Very low	135 Å²	135	115.5 Å²	115.5	59%	0.592	59%	0.585	S	S	*	*	H	α-helix	trans	-70.4	-41.6	178.9	-111	-102.3	0	0	0	112.6	E476 D624 N629 I631	E476-F627 VanDerWaalsContact OE1-CZ 3.3Å; E476-F627 WeakPolarHBondContact OE1-CZ 3.38Å; D624-F627 PolarHBondContact O-N 3.24Å; F627-N629 VanDerWaalsContact C-N 3.35Å; F627-N629 PolarHBondContact O-N 3.43Å; F627-I631 HydrophobicContact CD1-CD1 4.25Å; F627-I631 WeakPolarHBondContact O-CD1 3.4Å; F627-I631 WeakPolarHBondContact O-CG1 3.33Å
628	H	29.8	Very low	32.7	Very low	83 Å²	83	113 Å²	113	38%	0.384	58%	0.575	S	S	.	*	H	α-helix	trans	-67.5	-27.4	-175.8	-92.1	-46	0	0	0	115.1	D624 H630 I631 S632	D624-H628 WeakPolarHBondContact O-CB 3.34Å; D624-H628 PolarHBondContact O-N 3.37Å; H628-H630 PolarHBondContact O-N 3.31Å; H628-I631 PolarHBondContact O-N 3.28Å; H628-S632 WeakPolarHBondContact O-CB 3.49Å; H628-S632 PolarHBondContact O-N 2.97Å
629	N	29.2	Very low	32.4	Very low	120 Å²	120	109.8 Å²	109.8	64%	0.642	57%	0.573	S	S	*	*	H	α-helix	trans	-70.5	-27	-171.9	-82	-13.2	0	0	0	114.3	R625 F627	R625-N629 VanDerWaalsContact O-CG 3.27Å; R625-N629 PolarHBondContact O-ND2 3.04Å; F627-N629 VanDerWaalsContact C-N 3.35Å; F627-N629 PolarHBondContact O-N 3.43Å
630	H	33	Very low	32.6	Very low	145 Å²	145	109.5 Å²	109.5	67%	0.671	56%	0.556	S	S	*	*	H	α-helix	trans	-76.9	-50.9	166.6	-102.1	-89.6	0	0	0	110.7	H628 S632 K633 E634	H628-H630 PolarHBondContact O-N 3.31Å; H630-S632 VanDerWaalsContact C-N 3.25Å; H630-S632 PolarHBondContact O-N 3.1Å; H630-S632 VanDerWaalsContact O-N 3.12Å; H630-K633 WeakPolarHBondContact O-CA 3.46Å; H630-K633 VanDerWaalsContact O-CB 3.29Å; H630-K633 WeakPolarHBondContact O-CB 3.49Å; H630-K633 PolarHBondContact O-N 2.87Å; H630-E634 PolarHBondContact O-N 3.02Å
631	I	33.3	Very low	32.4	Very low	39 Å²	39	115.5 Å²	115.5	20%	0.2	57%	0.568	C	S	.	*	H	α-helix	trans	-51.9	-39.6	-178.8	-64.5	170.6	0	0	0	112.8	F627 H628 K633 E634 M635	F627-I631 HydrophobicContact CD1-CD1 4.25Å; F627-I631 WeakPolarHBondContact O-CD1 3.4Å; F627-I631 WeakPolarHBondContact O-CG1 3.33Å; H628-I631 PolarHBondContact O-N 3.28Å; I631-K633 PolarHBondContact O-N 3.05Å; I631-E634 PolarHBondContact O-N 3.1Å; I631-M635 HydrophobicContact CG2-CG 4.06Å; I631-M635 HydrophobicContact CG2-SD 3.7Å; I631-M635 WeakPolarHBondContact O-CB 3.47Å; I631-M635 WeakPolarHBondContact O-CG 3.48Å; I631-M635 PolarHBondContact O-N 2.69Å
632	S	32.9	Very low	32	Very low	27 Å²	27	110.4 Å²	110.4	19%	0.189	55%	0.546	C	S	.	.	H	α-helix	trans	-62	-25.9	178.2	-167.6	0	0	0	0	113.1	H628 H630 K636 D642	H628-S632 WeakPolarHBondContact O-CB 3.49Å; H628-S632 PolarHBondContact O-N 2.97Å; H630-S632 VanDerWaalsContact C-N 3.25Å; H630-S632 PolarHBondContact O-N 3.1Å; H630-S632 VanDerWaalsContact O-N 3.12Å; S632-K636 PolarHBondContact O-N 3.08Å; S632-D642 PolarHBondContact OG-OD1 2.84Å
633	K	33.5	Very low	32.3	Very low	161 Å²	161	106.1 Å²	106.1	70%	0.7	54%	0.538	S	S	*	.	H	α-helix	trans	-81.6	-38.1	179.6	-135.6	175.2	-174.4	179.8	0	112.3	H630 I631	H630-K633 WeakPolarHBondContact O-CA 3.46Å; H630-K633 VanDerWaalsContact O-CB 3.29Å; H630-K633 WeakPolarHBondContact O-CB 3.49Å; H630-K633 PolarHBondContact O-N 2.87Å; I631-K633 PolarHBondContact O-N 3.05Å
634	E	33.9	Very low	32.3	Very low	98 Å²	98	109.3 Å²	109.3	46%	0.458	54%	0.536	S	S	.	.	H	α-helix	trans	-68.8	-43.7	167.5	-89.4	64.9	-119.9	0	0	111.9	H630 I631 K636 R637 M638	H630-E634 PolarHBondContact O-N 3.02Å; I631-E634 PolarHBondContact O-N 3.1Å; E634-K636 VanDerWaalsContact C-N 3.31Å; E634-K636 PolarHBondContact O-N 2.65Å; E634-R637 WeakPolarHBondContact O-CA 3.13Å; E634-R637 WeakPolarHBondContact O-CB 3.39Å; E634-R637 PolarHBondContact O-N 3.07Å; E634-M638 HydrophobicContact CB-CE 4.26Å; E634-M638 PolarHBondContact O-N 3.03Å
635	M	33.1	Very low	32.2	Very low	43 Å²	43	110.4 Å²	110.4	21%	0.212	54%	0.542	C	S	.	.	H	α-helix	trans	-58.3	-40.5	178.4	-78.9	177.9	64	0	0	112.5	I631 R637 M638 G639 F640	I631-M635 HydrophobicContact CG2-CG 4.06Å; I631-M635 HydrophobicContact CG2-SD 3.7Å; I631-M635 WeakPolarHBondContact O-CB 3.47Å; I631-M635 WeakPolarHBondContact O-CG 3.48Å; I631-M635 PolarHBondContact O-N 2.69Å; M635-R637 PolarHBondContact O-N 3.25Å; M635-M638 CarbonylContact O-C 3.49Å; M635-M638 PolarHBondContact O-N 3.01Å; M635-G639 PolarHBondContact O-N 3.41Å; M635-G639 VanDerWaalsContact O-N 3.11Å; M635-F640 HydrophobicContact CB-CB 4.47Å; M635-F640 HydrophobicContact CE-CB 3.82Å; M635-F640 PolarHBondContact O-N 3.31Å
636	K	33.8	Very low	32.6	Very low	158 Å²	158	109.3 Å²	109.3	69%	0.687	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.9	174.2	-81.8	-176.8	173.3	176.9	0	114.9	S632 E634	S632-K636 PolarHBondContact O-N 3.08Å; E634-K636 VanDerWaalsContact C-N 3.31Å; E634-K636 PolarHBondContact O-N 2.65Å
637	R	33.8	Very low	32.8	Very low	224 Å²	224	111 Å²	111	85%	0.845	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-14.2	168.2	-82	-176.2	160	-163.9	-7.3	113.6	E634 M635	E634-R637 WeakPolarHBondContact O-CA 3.13Å; E634-R637 WeakPolarHBondContact O-CB 3.39Å; E634-R637 PolarHBondContact O-N 3.07Å; M635-R637 PolarHBondContact O-N 3.25Å
638	M	32	Very low	33.1	Very low	130 Å²	130	110.3 Å²	110.3	64%	0.64	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	10.3	-180	-65.9	-175.3	-72.3	0	0	113.8	E634 M635 F640	E634-M638 HydrophobicContact CB-CE 4.26Å; E634-M638 PolarHBondContact O-N 3.03Å; M635-M638 CarbonylContact O-C 3.49Å; M635-M638 PolarHBondContact O-N 3.01Å; M638-F640 HydrophobicContact CB-CD2 4.34Å; M638-F640 VanDerWaalsContact O-CD2 3.3Å; M638-F640 WeakPolarHBondContact O-CD2 3.43Å
639	G	28.7	Very low	33.7	Very low	65 Å²	65	111 Å²	111	67%	0.67	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	15.1	170.1	0	0	0	0	0	116.6	M635	M635-G639 PolarHBondContact O-N 3.41Å; M635-G639 VanDerWaalsContact O-N 3.11Å
640	F	32.8	Very low	34.3	Very low	123 Å²	123	112.5 Å²	112.5	54%	0.539	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-99.9	134.7	179	-71	-91.7	0	0	0	112.5	M635 M638	M635-F640 HydrophobicContact CB-CB 4.47Å; M635-F640 HydrophobicContact CE-CB 3.82Å; M635-F640 PolarHBondContact O-N 3.31Å; M638-F640 HydrophobicContact CB-CD2 4.34Å; M638-F640 VanDerWaalsContact O-CD2 3.3Å; M638-F640 WeakPolarHBondContact O-CD2 3.43Å
641	E	29.1	Very low	34.7	Very low	182 Å²	182	112.9 Å²	112.9	85%	0.85	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-78.9	157.8	-179.4	-65.7	-174.6	135	0	0	113.4
642	D	28.4	Very low	35.4	Very low	42 Å²	42	115.3 Å²	115.3	23%	0.225	57%	0.571	C	S	.	*	P	Polyproline II helix	trans	-81.1	142.3	-171.2	-157.6	50.1	0	0	0	110.7	S632 K644	S632-D642 PolarHBondContact OG-OD1 2.84Å; D642-K644 PolarHBondContact O-N 2.85Å; D642-K644 IonicContact OD2-NZ 2.76Å; D642-K644 PolarHBondContact OD2-NZ 3.34Å
643	P	36.1	Very low	36.9	Very low	60 Å²	60	117.6 Å²	117.6	39%	0.39	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-64.2	-7.3	-172.8	-25.2	35	0	0	0	116.7	D645 K646	P643-D645 PolarHBondContact O-N 3.48Å; P643-K646 WeakPolarHBondContact O-CB 3.37Å; P643-K646 PolarHBondContact O-N 2.88Å
644	K	31.2	Very low	38.4	Very low	151 Å²	151	113 Å²	113	66%	0.657	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-71.8	-27.4	-169	-65.4	-167.3	-170.3	83.4	0	114.6	D642 K646	D642-K644 PolarHBondContact O-N 2.85Å; D642-K644 IonicContact OD2-NZ 2.76Å; D642-K644 PolarHBondContact OD2-NZ 3.34Å; K644-K646 VanDerWaalsContact C-N 3.27Å; K644-K646 PolarHBondContact O-N 3.43Å
645	D	35	Very low	40.1	Very low	112 Å²	112	112.7 Å²	112.7	60%	0.599	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-77	-16.8	-178.4	-61.2	-57.1	0	0	0	112.5	P643 N647 T648	P643-D645 PolarHBondContact O-N 3.48Å; D645-N647 VanDerWaalsContact C-N 3.29Å; D645-N647 PolarHBondContact O-N 3.26Å; D645-T648 PolarHBondContact O-N 2.94Å; D645-T648 VanDerWaalsContact O-N 3.1Å; D645-T648 PolarHBondContact O-OG1 3.12Å
646	K	41.7	Very low	42.1	Very low	108 Å²	108	112.8 Å²	112.8	47%	0.47	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-60.8	-30	-177.8	-67.6	-171.2	172.8	-174.6	0	114.4	P643 K644 T648 Q649 E650	P643-K646 WeakPolarHBondContact O-CB 3.37Å; P643-K646 PolarHBondContact O-N 2.88Å; K644-K646 VanDerWaalsContact C-N 3.27Å; K644-K646 PolarHBondContact O-N 3.43Å; K646-T648 PolarHBondContact O-N 3.19Å; K646-Q649 PolarHBondContact O-N 3.2Å; K646-E650 PolarHBondContact O-N 2.56Å
647	N	33.8	Very low	44	Very low	126 Å²	126	107.6 Å²	107.6	67%	0.674	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-61.7	-14.4	177.1	-75.6	29	0	0	0	113.6	D645	D645-N647 VanDerWaalsContact C-N 3.29Å; D645-N647 PolarHBondContact O-N 3.26Å
648	T	39.7	Very low	46.1	Very low	120 Å²	120	97.2 Å²	97.2	74%	0.736	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-94.4	-18.3	172.8	-22.8	0	0	0	0	112.8	D645 K646	D645-T648 PolarHBondContact O-N 2.94Å; D645-T648 VanDerWaalsContact O-N 3.1Å; D645-T648 PolarHBondContact O-OG1 3.12Å; K646-T648 PolarHBondContact O-N 3.19Å
649	Q	41.8	Very low	48.3	Very low	98 Å²	98	91.7 Å²	91.7	46%	0.458	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-24.3	-170.3	-165.8	167.3	-10.1	0	0	112.7	K646 N651 L652 E657	K646-Q649 PolarHBondContact O-N 3.2Å; Q649-N651 PolarHBondContact O-N 3.32Å; Q649-L652 HydrophobicContact CG-CD1 4.35Å; Q649-L652 PolarHBondContact O-N 3.32Å; Q649-L652 VanDerWaalsContact O-N 3.11Å; Q649-E657 PolarHBondContact NE2-OE1 3.28Å
650	E	41.8	Very low	50.7	Low	150 Å²	150	93.2 Å²	93.2	70%	0.701	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-4.8	177.4	-72.5	-175.3	162.7	0	0	115.1	K646	K646-E650 PolarHBondContact O-N 2.56Å
651	N	41.5	Very low	52.5	Low	154 Å²	154	91 Å²	91	82%	0.824	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	5.1	174.4	-80.5	-53.8	0	0	0	114.4	Q649	Q649-N651 PolarHBondContact O-N 3.32Å
652	L	49.3	Very low	54.7	Low	89 Å²	89	82.7 Å²	82.7	47%	0.466	42%	0.422	S	S	.	.	S	Bend	trans	-82.8	134	173	-73.9	170	0	0	0	110.9	Q649	Q649-L652 HydrophobicContact CG-CD1 4.35Å; Q649-L652 PolarHBondContact O-N 3.32Å; Q649-L652 VanDerWaalsContact O-N 3.11Å
653	N	64.8	Low	56.7	Low	76 Å²	76	81.2 Å²	81.2	41%	0.406	42%	0.416	S	S	.	.			trans	-57.8	130.9	170.2	177	20.9	0	0	0	109	E655 D656 E657	N653-E655 PolarHBondContact O-N 3.46Å; N653-D656 HydrophobicContact CB-CB 4.42Å; N653-D656 WeakPolarHBondContact O-CB 3.46Å; N653-D656 PolarHBondContact O-N 3.31Å; N653-E657 PolarHBondContact O-N 2.98Å
654	P	64.9	Low	58.4	Low	65 Å²	65	86 Å²	86	42%	0.422	43%	0.426	S	S	.	.	H	α-helix	trans	-53.9	-28.7	179.3	17	-32.1	0	0	0	114.4	D656 V658	P654-D656 VanDerWaalsContact C-N 3.34Å; P654-V658 VanDerWaalsContact O-CG2 3.29Å; P654-V658 WeakPolarHBondContact O-CG2 3.29Å; P654-V658 PolarHBondContact O-N 2.88Å; P654-V658 VanDerWaalsContact O-N 3.15Å
655	E	68.7	Low	60	Low	90 Å²	90	79.6 Å²	79.6	42%	0.421	40%	0.402	S	S	.	.	H	α-helix	trans	-68	-30.7	173.8	-57.3	-165.3	110.7	0	0	113.7	N653 D659	N653-E655 PolarHBondContact O-N 3.46Å; E655-D659 WeakPolarHBondContact O-CB 3.46Å; E655-D659 PolarHBondContact O-N 2.76Å
656	D	74.2	Confident	61.6	Low	46 Å²	46	75.2 Å²	75.2	25%	0.246	38%	0.378	C	S	.	.	H	α-helix	trans	-76	-34.5	178.4	-84.5	-53.3	0	0	0	111.8	K173 N653 P654 D659 E660	K173-D656 WeakPolarHBondContact CD-OD1 3.33Å; K173-D656 IonicContact NZ-OD1 3.63Å; K173-D656 PolarHBondContact NZ-OD1 2.97Å; K173-D656 IonicContact NZ-OD2 3.4Å; K173-D656 PolarHBondContact NZ-OD2 3.45Å; N653-D656 HydrophobicContact CB-CB 4.42Å; N653-D656 WeakPolarHBondContact O-CB 3.46Å; N653-D656 PolarHBondContact O-N 3.31Å; P654-D656 VanDerWaalsContact C-N 3.34Å; D656-D659 PolarHBondContact O-N 3.09Å; D656-E660 WeakPolarHBondContact O-CB 3.48Å; D656-E660 PolarHBondContact O-N 3.15Å
657	E	74.4	Confident	62.6	Low	48 Å²	48	72.9 Å²	72.9	22%	0.224	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-38.5	170.6	-176.8	171.4	-115.9	0	0	111.4	R370 Q649 N653 F661	R370-E657 IonicContact CZ-OE2 2.97Å; R370-E657 IonicContact NH2-OE2 3.3Å; R370-E657 PolarHBondContact NH2-OE2 3.36Å; Q649-E657 PolarHBondContact NE2-OE1 3.28Å; N653-E657 PolarHBondContact O-N 2.98Å; E657-F661 VanDerWaalsContact O-CB 3.26Å; E657-F661 WeakPolarHBondContact O-CB 3.38Å; E657-F661 PolarHBondContact O-N 2.88Å
658	V	77.4	Confident	63.7	Low	6 Å²	6	70.8 Å²	70.8	4%	0.036	37%	0.371	C	S	.	.	H	α-helix	trans	-64.1	-48	172.8	169.2	0	0	0	0	111.4	R359 Q363 L366 P654 F661 L662	R359-V658 HydrophobicContact CG-CG1 4Å; Q363-V658 HydrophobicContact CB-CG1 4.14Å; Q363-V658 HydrophobicContact CB-CG2 4.04Å; Q363-V658 HydrophobicContact CG-CG2 4.11Å; L366-V658 HydrophobicContact CD1-CG2 3.94Å; P654-V658 VanDerWaalsContact O-CG2 3.29Å; P654-V658 WeakPolarHBondContact O-CG2 3.29Å; P654-V658 PolarHBondContact O-N 2.88Å; P654-V658 VanDerWaalsContact O-N 3.15Å; V658-F661 PolarHBondContact O-N 2.94Å; V658-L662 WeakPolarHBondContact O-CB 3.38Å; V658-L662 PolarHBondContact O-N 2.98Å
659	D	78.6	Confident	64.3	Low	15 Å²	15	69 Å²	69	8%	0.08	35%	0.351	C	S	.	.	H	α-helix	trans	-67.4	-35.6	-179.2	-78.5	6.6	0	0	0	111.6	L177 R359 E655 D656 G663	L177-D659 HydrophobicContact CD2-CB 4.34Å; R359-D659 IonicContact CZ-OD1 2.8Å; R359-D659 IonicContact NE-OD1 2.78Å; R359-D659 PolarHBondContact NE-OD1 2.94Å; R359-D659 IonicContact NH2-OD1 3.02Å; R359-D659 PolarHBondContact NH2-OD1 3.16Å; R359-D659 IonicContact NH2-OD2 2.81Å; E655-D659 WeakPolarHBondContact O-CB 3.46Å; E655-D659 PolarHBondContact O-N 2.76Å; D656-D659 PolarHBondContact O-N 3.09Å; D659-G663 PolarHBondContact O-N 3.08Å
660	E	78.9	Confident	65.2	Low	97 Å²	97	66.8 Å²	66.8	45%	0.453	35%	0.346	S	S	.	.	H	α-helix	trans	-69.2	-46.7	172.4	-166.8	-172	169.9	0	0	111.8	D656 L662 G663 R664	D656-E660 WeakPolarHBondContact O-CB 3.48Å; D656-E660 PolarHBondContact O-N 3.15Å; E660-L662 VanDerWaalsContact C-N 3.28Å; E660-L662 PolarHBondContact O-N 2.87Å; E660-G663 WeakPolarHBondContact O-CA 3.38Å; E660-G663 PolarHBondContact O-N 3.33Å; E660-G663 VanDerWaalsContact O-N 3.08Å; E660-R664 HydrophobicContact CG-CG 4.46Å; E660-R664 WeakPolarHBondContact O-CG 3.4Å; E660-R664 PolarHBondContact O-N 3.08Å; E660-R664 IonicContact OE1-CZ 3.65Å; E660-R664 IonicContact OE1-NE 3.81Å; E660-R664 PolarHBondContact OE1-NE 3.1Å; E660-R664 IonicContact OE1-NH2 2.62Å; E660-R664 PolarHBondContact OE1-NH2 3.25Å; E660-R664 IonicContact OE2-NH2 2.73Å
661	F	71.8	Confident	66.2	Low	77 Å²	77	60.4 Å²	60.4	34%	0.338	32%	0.317	S	S	.	.	H	α-helix	trans	-58.9	-42.8	176.7	-174.7	-81.8	0	0	0	111	I362 R365 L366 E657 V658 G663 R664 A665	I362-F661 HydrophobicContact CG2-CD1 3.83Å; I362-F661 HydrophobicContact CG2-CE1 4.38Å; R365-F661 VanDerWaalsContact NH2-CE1 3.27Å; R365-F661 VanDerWaalsContact NH2-CZ 3.26Å; L366-F661 HydrophobicContact CD1-CB 4.06Å; L366-F661 HydrophobicContact CD1-CD1 4.48Å; L366-F661 HydrophobicContact CD1-CG 4.16Å; E657-F661 VanDerWaalsContact O-CB 3.26Å; E657-F661 WeakPolarHBondContact O-CB 3.38Å; E657-F661 PolarHBondContact O-N 2.88Å; V658-F661 PolarHBondContact O-N 2.94Å; F661-G663 VanDerWaalsContact C-N 3.34Å; F661-R664 PolarHBondContact O-N 3.42Å; F661-A665 HydrophobicContact CD1-CB 4.45Å; F661-A665 HydrophobicContact CE1-CB 4.23Å; F661-A665 VanDerWaalsContact O-CB 3.22Å; F661-A665 WeakPolarHBondContact O-CB 3.42Å; F661-A665 PolarHBondContact O-N 2.72Å
662	L	74.4	Confident	67	Low	7 Å²	7	58 Å²	58	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-62.9	-39.6	174.7	179.6	54.6	0	0	0	111.3	L177 F355 R359 I362 V658 E660 A665 I666	L177-L662 HydrophobicContact CD2-CB 4.09Å; L177-L662 HydrophobicContact CD2-CD2 3.74Å; L177-L662 HydrophobicContact CD2-CG 3.79Å; F355-L662 HydrophobicContact CE2-CD2 4.1Å; F355-L662 HydrophobicContact CZ-CD2 4.11Å; R359-L662 HydrophobicContact CB-CD2 3.97Å; R359-L662 HydrophobicContact CG-CD2 4.07Å; I362-L662 HydrophobicContact CD1-CD1 3.94Å; V658-L662 WeakPolarHBondContact O-CB 3.38Å; V658-L662 PolarHBondContact O-N 2.98Å; E660-L662 VanDerWaalsContact C-N 3.28Å; E660-L662 PolarHBondContact O-N 2.87Å; L662-A665 PolarHBondContact O-N 2.77Å; L662-I666 HydrophobicContact CD1-CD1 4.02Å; L662-I666 HydrophobicContact CD1-CG1 4.17Å; L662-I666 HydrophobicContact CG-CD1 3.94Å; L662-I666 WeakPolarHBondContact O-CB 3.38Å; L662-I666 WeakPolarHBondContact O-CD1 3.4Å; L662-I666 WeakPolarHBondContact O-CG1 3.19Å; L662-I666 PolarHBondContact O-N 3.17Å
663	G	70.8	Confident	67.8	Low	10 Å²	10	61 Å²	61	10%	0.103	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-51.2	171.2	0	0	0	0	0	113.4	D659 E660 F661 A665 I666 D667	D659-G663 PolarHBondContact O-N 3.08Å; E660-G663 WeakPolarHBondContact O-CA 3.38Å; E660-G663 PolarHBondContact O-N 3.33Å; E660-G663 VanDerWaalsContact O-N 3.08Å; F661-G663 VanDerWaalsContact C-N 3.34Å; G663-A665 VanDerWaalsContact C-N 3.28Å; G663-A665 PolarHBondContact O-N 3.3Å; G663-I666 PolarHBondContact O-N 3.39Å; G663-D667 PolarHBondContact O-N 3.05Å
664	R	71.4	Confident	67.9	Low	160 Å²	160	58.6 Å²	58.6	60%	0.604	30%	0.296	S	S	*	.	H	α-helix	trans	-59.9	-38.5	175.6	-65.4	178.9	-174.2	-168.7	7.1	111.4	E660 F661 D667 A668	E660-R664 HydrophobicContact CG-CG 4.46Å; E660-R664 WeakPolarHBondContact O-CG 3.4Å; E660-R664 PolarHBondContact O-N 3.08Å; E660-R664 IonicContact OE1-CZ 3.65Å; E660-R664 IonicContact OE1-NE 3.81Å; E660-R664 PolarHBondContact OE1-NE 3.1Å; E660-R664 IonicContact OE1-NH2 2.62Å; E660-R664 PolarHBondContact OE1-NH2 3.25Å; E660-R664 IonicContact OE2-NH2 2.73Å; F661-R664 PolarHBondContact O-N 3.42Å; R664-D667 PolarHBondContact O-N 3.23Å; R664-A668 VanDerWaalsContact O-CB 3.28Å; R664-A668 WeakPolarHBondContact O-CB 3.35Å; R664-A668 PolarHBondContact O-N 2.88Å
665	A	66.3	Low	68.1	Low	18 Å²	18	58.6 Å²	58.6	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-70.8	-39.1	177.6	0	0	0	0	0	112.8	F661 L662 G663 D667 R669	F661-A665 HydrophobicContact CD1-CB 4.45Å; F661-A665 HydrophobicContact CE1-CB 4.23Å; F661-A665 VanDerWaalsContact O-CB 3.22Å; F661-A665 WeakPolarHBondContact O-CB 3.42Å; F661-A665 PolarHBondContact O-N 2.72Å; L662-A665 PolarHBondContact O-N 2.77Å; G663-A665 VanDerWaalsContact C-N 3.28Å; G663-A665 PolarHBondContact O-N 3.3Å; A665-D667 VanDerWaalsContact C-N 3.27Å; A665-D667 PolarHBondContact O-N 2.88Å; A665-R669 VanDerWaalsContact O-CB 3.23Å; A665-R669 WeakPolarHBondContact O-CB 3.41Å; A665-R669 WeakPolarHBondContact O-CG 3.48Å; A665-R669 PolarHBondContact O-N 2.96Å
666	I	67.6	Low	68	Low	19 Å²	19	56.5 Å²	56.5	10%	0.097	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-38.6	172.1	-74.2	159.8	0	0	0	110.5	L177 R184 F355 L662 G663	L177-I666 HydrophobicContact CD1-CD1 4.25Å; L177-I666 HydrophobicContact CG-CD1 4.03Å; R184-I666 PolarHBondContact NH1-O 2.96Å; F355-I666 HydrophobicContact CE2-CD1 4.25Å; L662-I666 HydrophobicContact CD1-CD1 4.02Å; L662-I666 HydrophobicContact CD1-CG1 4.17Å; L662-I666 HydrophobicContact CG-CD1 3.94Å; L662-I666 WeakPolarHBondContact O-CB 3.38Å; L662-I666 WeakPolarHBondContact O-CD1 3.4Å; L662-I666 WeakPolarHBondContact O-CG1 3.19Å; L662-I666 PolarHBondContact O-N 3.17Å; G663-I666 PolarHBondContact O-N 3.39Å
667	D	63.7	Low	68	Low	60 Å²	60	57.9 Å²	57.9	32%	0.321	29%	0.288	S	S	.	.	H	α-helix	trans	-74.1	-45.2	178.3	-84	-36.7	0	0	0	113.1	R180 R184 G663 R664 A665	R180-D667 IonicContact CZ-OD1 2.85Å; R180-D667 IonicContact CZ-OD2 3.95Å; R180-D667 IonicContact NH1-OD1 2.79Å; R180-D667 IonicContact NH1-OD2 3.2Å; R180-D667 PolarHBondContact NH1-OD2 2.88Å; R180-D667 IonicContact NH2-OD1 3.65Å; R180-D667 PolarHBondContact NH2-OD1 3.48Å; R180-D667 IonicContact NH2-OD2 2.74Å; R180-D667 PolarHBondContact NH2-OD2 2.78Å; R184-D667 PolarHBondContact NH1-O 2.77Å; R184-D667 PolarHBondContact NH2-O 2.96Å; R184-D667 IonicContact NH2-OD1 2.75Å; G663-D667 PolarHBondContact O-N 3.05Å; R664-D667 PolarHBondContact O-N 3.23Å; A665-D667 VanDerWaalsContact C-N 3.27Å; A665-D667 PolarHBondContact O-N 2.88Å
668	A	55.2	Low	67.9	Low	82 Å²	82	58 Å²	58	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-79	-34	-176.2	0	0	0	0	0	114.5	R664 S670	R664-A668 VanDerWaalsContact O-CB 3.28Å; R664-A668 WeakPolarHBondContact O-CB 3.35Å; R664-A668 PolarHBondContact O-N 2.88Å; A668-S670 PolarHBondContact O-N 3.26Å
669	R	53.8	Low	68	Low	83 Å²	83	58.2 Å²	58.2	31%	0.313	29%	0.29	S	S	.	.	S	Bend	trans	-73.1	99.1	172.1	-70.4	-175.4	175.2	-165.2	-4.5	108.9	A665 I671 L674 E966	A665-R669 VanDerWaalsContact O-CB 3.23Å; A665-R669 WeakPolarHBondContact O-CB 3.41Å; A665-R669 WeakPolarHBondContact O-CG 3.48Å; A665-R669 PolarHBondContact O-N 2.96Å; R669-I671 PolarHBondContact O-N 3.21Å; R669-L674 HydrophobicContact CB-CD1 4.44Å; R669-E966 IonicContact NH2-OE1 3.12Å
670	S	59.9	Low	68	Low	50 Å²	50	61.6 Å²	61.6	35%	0.35	30%	0.304	S	S	.	.			trans	-66.9	100	167.2	32.2	0	0	0	0	109.1	A668 D672 R673 L674	A668-S670 PolarHBondContact O-N 3.26Å; S670-D672 PolarHBondContact O-N 3.27Å; S670-R673 WeakPolarHBondContact O-CB 3.28Å; S670-R673 PolarHBondContact O-N 3.37Å; S670-R673 WeakPolarHBondContact OG-CB 3.41Å; S670-L674 PolarHBondContact O-N 3.09Å
671	I	62.5	Low	67.7	Low	16 Å²	16	65.5 Å²	65.5	8%	0.082	32%	0.319	C	S	.	.	H	α-helix	trans	-48.4	-43.8	177.8	-68	173.5	0	0	0	110.7	R184 R669 R673 L674 R675 L955 W959	R184-I671 HydrophobicContact CG-CD1 4.34Å; R669-I671 PolarHBondContact O-N 3.21Å; I671-R673 VanDerWaalsContact C-N 3.3Å; I671-R673 PolarHBondContact O-N 2.81Å; I671-L674 PolarHBondContact O-N 3.32Å; I671-R675 VanDerWaalsContact O-CB 3.26Å; I671-R675 WeakPolarHBondContact O-CB 3.39Å; I671-R675 PolarHBondContact O-N 3.38Å; I671-L955 HydrophobicContact CG2-CD2 3.59Å; I671-W959 HydrophobicContact CD1-CH2 4.16Å; I671-W959 HydrophobicContact CG1-CH2 3.99Å; I671-W959 HydrophobicContact CG1-CZ2 4.05Å
672	D	59.6	Low	67.5	Low	104 Å²	104	68.6 Å²	68.6	56%	0.556	33%	0.333	S	S	*	.	H	α-helix	trans	-67.1	-26	179.8	-57.3	-67.4	0	0	0	114	S670 R675 S676	S670-D672 PolarHBondContact O-N 3.27Å; D672-R675 IonicContact OD1-NH1 2.69Å; D672-S676 WeakPolarHBondContact O-CB 3.41Å; D672-S676 PolarHBondContact O-N 3.43Å; D672-S676 PolarHBondContact O-OG 2.94Å
673	R	65.6	Low	67.4	Low	151 Å²	151	72.6 Å²	72.6	57%	0.57	35%	0.354	S	S	*	.	H	α-helix	trans	-71.1	-54.3	175.8	-156.3	-173.6	83.2	-159	0.4	110.1	S670 I671 R675 S676 E677	S670-R673 WeakPolarHBondContact O-CB 3.28Å; S670-R673 PolarHBondContact O-N 3.37Å; S670-R673 WeakPolarHBondContact OG-CB 3.41Å; I671-R673 VanDerWaalsContact C-N 3.3Å; I671-R673 PolarHBondContact O-N 2.81Å; R673-R675 VanDerWaalsContact C-N 3.29Å; R673-R675 PolarHBondContact O-N 3.25Å; R673-S676 CarbonylContact O-C 3.5Å; R673-S676 WeakPolarHBondContact O-CA 3.29Å; R673-S676 PolarHBondContact O-N 2.89Å; R673-S676 PolarHBondContact O-OG 3.49Å; R673-E677 WeakPolarHBondContact CD-OE1 3.45Å; R673-E677 HydrophobicContact CG-CG 4.48Å; R673-E677 WeakPolarHBondContact CG-OE1 3.48Å; R673-E677 IonicContact CZ-OE1 2.7Å; R673-E677 IonicContact NE-OE1 2.84Å; R673-E677 PolarHBondContact NE-OE1 3.45Å; R673-E677 IonicContact NE-OE2 2.66Å; R673-E677 IonicContact NH2-OE1 2.77Å; R673-E677 WeakPolarHBondContact O-CB 3.27Å; R673-E677 VanDerWaalsContact O-CG 3.29Å; R673-E677 WeakPolarHBondContact O-CG 3.4Å; R673-E677 PolarHBondContact O-N 2.9Å
674	L	66.8	Low	67.8	Low	27 Å²	27	72.4 Å²	72.4	14%	0.141	35%	0.351	C	S	.	.	H	α-helix	trans	-52	-46.4	173.7	-84.2	153	0	0	0	112.1	R669 S670 I671 E677 H678 L958	R669-L674 HydrophobicContact CB-CD1 4.44Å; S670-L674 PolarHBondContact O-N 3.09Å; I671-L674 PolarHBondContact O-N 3.32Å; L674-E677 WeakPolarHBondContact CA-OE2 3.39Å; L674-E677 PolarHBondContact N-OE2 3.16Å; L674-E677 PolarHBondContact O-N 3.49Å; L674-H678 PolarHBondContact O-N 3.43Å; L674-H678 VanDerWaalsContact O-N 3.1Å; L674-H678 PolarHBondContact O-ND1 2.78Å; L674-L958 HydrophobicContact CD2-CD2 4.37Å
675	R	69	Low	68.3	Low	64 Å²	64	66.4 Å²	66.4	24%	0.242	33%	0.332	C	S	.	.	H	α-helix	trans	-60	-45	174.4	-169.4	-176.5	-167.6	-178.3	7.7	111.4	I671 D672 R673 V679 S951	I671-R675 VanDerWaalsContact O-CB 3.26Å; I671-R675 WeakPolarHBondContact O-CB 3.39Å; I671-R675 PolarHBondContact O-N 3.38Å; D672-R675 IonicContact OD1-NH1 2.69Å; R673-R675 VanDerWaalsContact C-N 3.29Å; R673-R675 PolarHBondContact O-N 3.25Å; R675-V679 VanDerWaalsContact O-CB 3.27Å; R675-V679 WeakPolarHBondContact O-CB 3.35Å; R675-V679 PolarHBondContact O-N 3.32Å; R675-V679 VanDerWaalsContact O-N 3.15Å; R675-S951 PolarHBondContact NE-OG 3.32Å; R675-S951 PolarHBondContact NH2-OG 3.27Å
676	S	67.3	Low	69.2	Low	47 Å²	47	65.7 Å²	65.7	33%	0.329	33%	0.325	S	S	.	.	H	α-helix	trans	-70	-33.6	179.3	78	0	0	0	0	113.6	D672 R673 R687	D672-S676 WeakPolarHBondContact O-CB 3.41Å; D672-S676 PolarHBondContact O-N 3.43Å; D672-S676 PolarHBondContact O-OG 2.94Å; R673-S676 CarbonylContact O-C 3.5Å; R673-S676 WeakPolarHBondContact O-CA 3.29Å; R673-S676 PolarHBondContact O-N 2.89Å; R673-S676 PolarHBondContact O-OG 3.49Å; S676-R687 PolarHBondContact O-NH2 3.49Å
677	E	73.3	Confident	69.9	Low	74 Å²	74	72 Å²	72	35%	0.346	35%	0.348	S	S	.	.	H	α-helix	trans	-70.1	-53.6	-179.5	-73.8	159.4	166.3	0	0	110.5	R673 L674 R687	R673-E677 WeakPolarHBondContact CD-OE1 3.45Å; R673-E677 HydrophobicContact CG-CG 4.48Å; R673-E677 WeakPolarHBondContact CG-OE1 3.48Å; R673-E677 IonicContact CZ-OE1 2.7Å; R673-E677 IonicContact NE-OE1 2.84Å; R673-E677 PolarHBondContact NE-OE1 3.45Å; R673-E677 IonicContact NE-OE2 2.66Å; R673-E677 IonicContact NH2-OE1 2.77Å; R673-E677 WeakPolarHBondContact O-CB 3.27Å; R673-E677 VanDerWaalsContact O-CG 3.29Å; R673-E677 WeakPolarHBondContact O-CG 3.4Å; R673-E677 PolarHBondContact O-N 2.9Å; L674-E677 WeakPolarHBondContact CA-OE2 3.39Å; L674-E677 PolarHBondContact N-OE2 3.16Å; L674-E677 PolarHBondContact O-N 3.49Å; E677-R687 WeakPolarHBondContact O-CD 3.44Å; E677-R687 PolarHBondContact O-NE 3.15Å
678	H	73.3	Confident	70.9	Confident	51 Å²	51	74.2 Å²	74.2	24%	0.236	36%	0.356	C	S	.	.	H	α-helix	trans	-93.7	-20.9	-168.3	-56.8	82.2	0	0	0	114.3	L674 F686 R687 L958	L674-H678 PolarHBondContact O-N 3.43Å; L674-H678 VanDerWaalsContact O-N 3.1Å; L674-H678 PolarHBondContact O-ND1 2.78Å; H678-F686 CarbonylContact O-C 3.52Å; H678-F686 WeakPolarHBondContact O-CA 3.39Å; H678-R687 PolarHBondContact O-N 2.98Å; H678-L958 HydrophobicContact CB-CD2 4.05Å
679	V	77.6	Confident	72.2	Confident	10 Å²	10	74.9 Å²	74.9	6%	0.061	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-114.9	144.4	-172.6	-175.2	0	0	0	0	111.9	R675 L684 F686	R675-V679 VanDerWaalsContact O-CB 3.27Å; R675-V679 WeakPolarHBondContact O-CB 3.35Å; R675-V679 PolarHBondContact O-N 3.32Å; R675-V679 VanDerWaalsContact O-N 3.15Å; V679-L684 HydrophobicContact CG1-CD2 4.09Å; V679-L684 VanDerWaalsContact CG1-O 3.22Å; V679-L684 WeakPolarHBondContact CG1-O 3.37Å; V679-F686 HydrophobicContact CG2-CD1 4.05Å; V679-F686 HydrophobicContact CG2-CE1 3.99Å
680	K	80	Confident	73.7	Confident	86 Å²	86	75.4 Å²	75.4	37%	0.374	36%	0.363	S	S	.	.			trans	-82.5	121.8	174.2	-62.8	175.3	-156.9	141.1	0	110.3	F682 L684 T685 F686 R687	K680-F682 VanDerWaalsContact C-N 3.3Å; K680-F682 PolarHBondContact O-N 2.97Å; K680-F682 VanDerWaalsContact O-N 3.07Å; K680-L684 VanDerWaalsContact O-CA 3.32Å; K680-L684 WeakPolarHBondContact O-CA 3.32Å; K680-L684 PolarHBondContact O-N 3.4Å; K680-T685 WeakPolarHBondContact CB-O 3.42Å; K680-T685 WeakPolarHBondContact CD-OG1 3.48Å; K680-T685 WeakPolarHBondContact CG-O 3.44Å; K680-T685 PolarHBondContact N-O 2.9Å; K680-T685 PolarHBondContact NZ-OG1 3.28Å; K680-T685 VanDerWaalsContact NZ-OG1 3.08Å; K680-F686 WeakPolarHBondContact CE-O 3.16Å; K680-F686 PolarHBondContact NZ-O 3.36Å; K680-R687 HydrophobicContact CG-CG 4.08Å
681	K	71.1	Confident	74.8	Confident	180 Å²	180	73.8 Å²	73.8	78%	0.783	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-38.9	-171.5	-70.5	-172.6	175.1	-175.9	0	116
682	F	68.8	Low	76	Confident	142 Å²	142	75.2 Å²	75.2	62%	0.623	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-49.9	-176.3	-176.6	-108	0	0	0	113	K680 L684	K680-F682 VanDerWaalsContact C-N 3.3Å; K680-F682 PolarHBondContact O-N 2.97Å; K680-F682 VanDerWaalsContact O-N 3.07Å; F682-L684 VanDerWaalsContact C-N 3.27Å; F682-L684 PolarHBondContact O-N 3.29Å
683	L	72.9	Confident	77.1	Confident	90 Å²	90	75.6 Å²	75.6	47%	0.471	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.9	-176	-124.1	73.7	0	0	0	114.3	T685	L683-T685 PolarHBondContact O-N 3.3Å
684	L	78.9	Confident	78	Confident	7 Å²	7	72.2 Å²	72.2	4%	0.037	34%	0.342	C	S	.	.			trans	50.2	-4.4	-170.5	-66.1	-173.9	0	0	0	117.5	V679 K680 F682 Q947 E950 R954	V679-L684 HydrophobicContact CG1-CD2 4.09Å; V679-L684 VanDerWaalsContact CG1-O 3.22Å; V679-L684 WeakPolarHBondContact CG1-O 3.37Å; K680-L684 VanDerWaalsContact O-CA 3.32Å; K680-L684 WeakPolarHBondContact O-CA 3.32Å; K680-L684 PolarHBondContact O-N 3.4Å; F682-L684 VanDerWaalsContact C-N 3.27Å; F682-L684 PolarHBondContact O-N 3.29Å; L684-Q947 HydrophobicContact CD1-CG 3.77Å; L684-Q947 WeakPolarHBondContact CD1-O 3.27Å; L684-Q947 HydrophobicContact CG-CG 4.43Å; L684-E950 HydrophobicContact CB-CG 4.31Å; L684-E950 HydrophobicContact CD1-CB 3.94Å; L684-E950 HydrophobicContact CD1-CG 3.97Å; L684-R954 WeakPolarHBondContact O-CD 3.21Å; L684-R954 PolarHBondContact O-NE 3.38Å; L684-R954 PolarHBondContact O-NH1 2.96Å
685	T	81.6	Confident	78.8	Confident	34 Å²	34	71.1 Å²	71.1	21%	0.209	34%	0.336	C	S	.	.			trans	-60.5	149.3	170.5	52.1	0	0	0	0	111.7	K680 L683 E692	K680-T685 WeakPolarHBondContact CB-O 3.42Å; K680-T685 WeakPolarHBondContact CD-OG1 3.48Å; K680-T685 WeakPolarHBondContact CG-O 3.44Å; K680-T685 PolarHBondContact N-O 2.9Å; K680-T685 PolarHBondContact NZ-OG1 3.28Å; K680-T685 VanDerWaalsContact NZ-OG1 3.08Å; L683-T685 PolarHBondContact O-N 3.3Å; T685-E692 WeakPolarHBondContact CA-OE2 3.33Å; T685-E692 WeakPolarHBondContact CB-OE2 3.16Å
686	F	84.1	Confident	79.3	Confident	3 Å²	3	70.9 Å²	70.9	1%	0.013	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-60.9	151.7	169.9	-69	-69.1	0	0	0	110.2	H678 V679 K680 L691 E692 Y695 R954 F957	H678-F686 CarbonylContact O-C 3.52Å; H678-F686 WeakPolarHBondContact O-CA 3.39Å; V679-F686 HydrophobicContact CG2-CD1 4.05Å; V679-F686 HydrophobicContact CG2-CE1 3.99Å; K680-F686 WeakPolarHBondContact CE-O 3.16Å; K680-F686 PolarHBondContact NZ-O 3.36Å; F686-L691 HydrophobicContact CB-CB 4Å; F686-L691 HydrophobicContact CD1-CB 4.43Å; F686-L691 HydrophobicContact CD1-CD1 4.4Å; F686-L691 HydrophobicContact CD2-CB 4.13Å; F686-L691 HydrophobicContact CG-CB 3.94Å; F686-E692 WeakPolarHBondContact CD2-OE2 3.24Å; F686-E692 PolarHBondContact N-OE2 2.99Å; F686-Y695 HydrophobicContact CD2-CD1 4.37Å; F686-Y695 AromaticContact CE2-CD1 3.82Å; F686-Y695 HydrophobicContact CE2-CD1 3.82Å; F686-Y695 HydrophobicContact CE2-CD2 4.41Å; F686-Y695 AromaticContact CE2-CG 3.78Å; F686-Y695 HydrophobicContact CE2-CG 3.78Å; F686-R954 HydrophobicContact CE1-CB 4.33Å; F686-R954 HydrophobicContact CE2-CB 4.47Å; F686-R954 HydrophobicContact CE2-CG 4.17Å; F686-R954 HydrophobicContact CZ-CB 3.8Å; F686-R954 HydrophobicContact CZ-CG 4Å; F686-F957 HydrophobicContact CE2-CD1 4.01Å; F686-F957 HydrophobicContact CE2-CE1 4.35Å; F686-F957 AromaticContact CZ-CD1 3.83Å; F686-F957 HydrophobicContact CZ-CD1 3.83Å; F686-F957 HydrophobicContact CZ-CE1 4.47Å
687	R	82.3	Confident	79.9	Confident	151 Å²	151	77.2 Å²	77.2	57%	0.57	36%	0.361	S	S	*	.	S	Bend	trans	-69.6	-38.1	174	-64.8	-165.4	-170.9	-167.7	5	111.5	S676 E677 H678 K680	S676-R687 PolarHBondContact O-NH2 3.49Å; E677-R687 WeakPolarHBondContact O-CD 3.44Å; E677-R687 PolarHBondContact O-NE 3.15Å; H678-R687 PolarHBondContact O-N 2.98Å; K680-R687 HydrophobicContact CG-CG 4.08Å
688	E	84.9	Confident	80.1	Confident	107 Å²	107	76.9 Å²	76.9	50%	0.5	36%	0.36	S	S	.	.	S	Bend	trans	-88.1	134	179.7	-67.9	168.9	-165.2	0	0	111.5	D690 L691 E692	E688-D690 PolarHBondContact O-N 2.92Å; E688-L691 HydrophobicContact CB-CB 4.36Å; E688-L691 HydrophobicContact CB-CD1 4.19Å; E688-L691 HydrophobicContact CB-CG 4.11Å; E688-L691 WeakPolarHBondContact OE2-CD1 2.96Å; E688-E692 PolarHBondContact O-N 3.1Å
689	P	84.1	Confident	80.4	Confident	96 Å²	96	76.8 Å²	76.8	62%	0.623	36%	0.363	S	S	*	.	H	α-helix	trans	-69.6	-33.2	-177.7	28.7	-34.4	0	0	0	112.3	E692 K693	P689-E692 PolarHBondContact O-N 3.04Å; P689-K693 WeakPolarHBondContact O-CB 3.23Å; P689-K693 PolarHBondContact O-N 3.47Å
690	D	84.1	Confident	80.4	Confident	94 Å²	94	76.7 Å²	76.7	50%	0.503	36%	0.362	S	S	.	.	H	α-helix	trans	-74.4	-29.5	-178.1	-68.1	-67.3	0	0	0	112.9	E688 K693 K694	E688-D690 PolarHBondContact O-N 2.92Å; D690-K693 PolarHBondContact O-N 3.38Å; D690-K693 IonicContact OD1-NZ 3.6Å; D690-K694 WeakPolarHBondContact O-CG 3.47Å; D690-K694 PolarHBondContact O-N 2.95Å
691	L	84.2	Confident	80.1	Confident	16 Å²	16	77.6 Å²	77.6	8%	0.084	37%	0.374	C	S	.	.	H	α-helix	trans	-65.7	-42.4	168.3	-66.5	-176.8	0	0	0	111.6	F686 E688 K693 K694 Y695 L958 L961	F686-L691 HydrophobicContact CB-CB 4Å; F686-L691 HydrophobicContact CD1-CB 4.43Å; F686-L691 HydrophobicContact CD1-CD1 4.4Å; F686-L691 HydrophobicContact CD2-CB 4.13Å; F686-L691 HydrophobicContact CG-CB 3.94Å; E688-L691 HydrophobicContact CB-CB 4.36Å; E688-L691 HydrophobicContact CB-CD1 4.19Å; E688-L691 HydrophobicContact CB-CG 4.11Å; E688-L691 WeakPolarHBondContact OE2-CD1 2.96Å; L691-K693 VanDerWaalsContact C-N 3.27Å; L691-K693 PolarHBondContact O-N 3.16Å; L691-K694 HydrophobicContact CD2-CD 4.48Å; L691-K694 PolarHBondContact O-N 3.32Å; L691-Y695 VanDerWaalsContact O-CB 3.25Å; L691-Y695 WeakPolarHBondContact O-CB 3.47Å; L691-Y695 PolarHBondContact O-N 3.07Å; L691-L958 HydrophobicContact CD1-CD1 4.49Å; L691-L961 HydrophobicContact CD2-CD2 3.53Å
692	E	86	Confident	80.6	Confident	45 Å²	45	72.8 Å²	72.8	21%	0.21	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-32.3	173.9	-160.1	72.4	-147.1	0	0	111.7	T685 F686 E688 P689 Y695 S696 R954	T685-E692 WeakPolarHBondContact CA-OE2 3.33Å; T685-E692 WeakPolarHBondContact CB-OE2 3.16Å; F686-E692 WeakPolarHBondContact CD2-OE2 3.24Å; F686-E692 PolarHBondContact N-OE2 2.99Å; E688-E692 PolarHBondContact O-N 3.1Å; P689-E692 PolarHBondContact O-N 3.04Å; E692-Y695 PolarHBondContact O-N 2.69Å; E692-S696 VanDerWaalsContact O-CB 3.28Å; E692-S696 WeakPolarHBondContact O-CB 3.49Å; E692-S696 PolarHBondContact O-N 3.3Å; E692-S696 PolarHBondContact O-OG 2.71Å; E692-R954 VanDerWaalsContact CD-NH1 3.32Å; E692-R954 IonicContact OE1-CZ 3.84Å; E692-R954 IonicContact OE1-NH1 3Å; E692-R954 PolarHBondContact OE1-NH1 3.45Å; E692-R954 VanDerWaalsContact OE1-NH1 3.12Å; E692-R954 IonicContact OE1-NH2 3.84Å; E692-R954 PolarHBondContact OE1-NH2 3.31Å; E692-R954 IonicContact OE2-CZ 3.72Å; E692-R954 IonicContact OE2-NH1 2.65Å; E692-R954 PolarHBondContact OE2-NH1 2.9Å; E692-R954 IonicContact OE2-NH2 2.82Å
693	K	83.7	Confident	81.4	Confident	113 Å²	113	66.2 Å²	66.2	49%	0.491	32%	0.323	S	S	.	.	H	α-helix	trans	-73.7	-36.2	175.2	-171.9	179.1	172.8	-171.4	0	113.2	P689 D690 L691 S696 R697	P689-K693 WeakPolarHBondContact O-CB 3.23Å; P689-K693 PolarHBondContact O-N 3.47Å; D690-K693 PolarHBondContact O-N 3.38Å; D690-K693 IonicContact OD1-NZ 3.6Å; L691-K693 VanDerWaalsContact C-N 3.27Å; L691-K693 PolarHBondContact O-N 3.16Å; K693-S696 WeakPolarHBondContact CA-OG 3.26Å; K693-S696 PolarHBondContact O-OG 2.99Å; K693-R697 WeakPolarHBondContact O-CG 3.45Å
694	K	84.8	Confident	82	Confident	79 Å²	79	63 Å²	63	34%	0.343	31%	0.312	S	S	.	.	H	α-helix	trans	-64.8	-46.7	167.9	-70	179.4	175.8	176.5	0	109.6	D690 L691 R697 F957 L961 E965	D690-K694 WeakPolarHBondContact O-CG 3.47Å; D690-K694 PolarHBondContact O-N 2.95Å; L691-K694 HydrophobicContact CD2-CD 4.48Å; L691-K694 PolarHBondContact O-N 3.32Å; K694-R697 PolarHBondContact O-N 2.87Å; K694-F957 HydrophobicContact CB-CE1 4.49Å; K694-F957 HydrophobicContact CB-CZ 3.74Å; K694-L961 HydrophobicContact CD-CD1 4.02Å; K694-L961 HydrophobicContact CD-CD2 3.88Å; K694-E965 IonicContact NZ-OE1 3.51Å; K694-E965 PolarHBondContact NZ-OE1 3.28Å
695	Y	83.8	Confident	82.3	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-69.8	-33.2	-177	-178	-124.6	0	0	0	114.9	F686 L691 E692 R697 Q698 R773 R954 F957	F686-Y695 HydrophobicContact CD2-CD1 4.37Å; F686-Y695 AromaticContact CE2-CD1 3.82Å; F686-Y695 HydrophobicContact CE2-CD1 3.82Å; F686-Y695 HydrophobicContact CE2-CD2 4.41Å; F686-Y695 AromaticContact CE2-CG 3.78Å; F686-Y695 HydrophobicContact CE2-CG 3.78Å; L691-Y695 VanDerWaalsContact O-CB 3.25Å; L691-Y695 WeakPolarHBondContact O-CB 3.47Å; L691-Y695 PolarHBondContact O-N 3.07Å; E692-Y695 PolarHBondContact O-N 2.69Å; Y695-R697 PolarHBondContact O-N 3.29Å; Y695-Q698 WeakPolarHBondContact O-CB 3.27Å; Y695-Q698 PolarHBondContact O-N 3.33Å; Y695-R773 VanDerWaalsContact CD1-NH1 3.31Å; Y695-R773 PolarHBondContact O-NH1 3.31Å; Y695-R773 PolarHBondContact OH-NH2 3.47Å; Y695-R773 VanDerWaalsContact OH-NH2 3.12Å; Y695-R954 HydrophobicContact CD1-CG 4.43Å; Y695-R954 HydrophobicContact CE1-CG 3.68Å; Y695-R954 HydrophobicContact CE2-CG 4.35Å; Y695-F957 HydrophobicContact CD2-CB 4.01Å; Y695-F957 HydrophobicContact CD2-CD1 4.01Å; Y695-F957 AromaticContact CD2-CD2 3.76Å; Y695-F957 HydrophobicContact CD2-CD2 3.76Å; Y695-F957 HydrophobicContact CD2-CE1 4.5Å; Y695-F957 HydrophobicContact CD2-CE2 4.27Å; Y695-F957 AromaticContact CD2-CG 3.63Å; Y695-F957 HydrophobicContact CD2-CG 3.63Å; Y695-F957 HydrophobicContact CE2-CB 4.17Å; Y695-F957 HydrophobicContact CE2-CG 4.29Å; Y695-F957 HydrophobicContact CG-CD1 4.4Å; Y695-F957 HydrophobicContact CG-CG 4.44Å
696	S	79.5	Confident	82.7	Confident	59 Å²	59	64.4 Å²	64.4	41%	0.413	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-15.3	176.2	48.4	0	0	0	0	113.7	E692 K693	E692-S696 VanDerWaalsContact O-CB 3.28Å; E692-S696 WeakPolarHBondContact O-CB 3.49Å; E692-S696 PolarHBondContact O-N 3.3Å; E692-S696 PolarHBondContact O-OG 2.71Å; K693-S696 WeakPolarHBondContact CA-OG 3.26Å; K693-S696 PolarHBondContact O-OG 2.99Å
697	R	79.7	Confident	83	Confident	181 Å²	181	64.3 Å²	64.3	68%	0.683	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-0.7	172.2	-69.2	174.6	168.4	-161	-7.5	113.8	K693 K694 Y695 V699	K693-R697 WeakPolarHBondContact O-CG 3.45Å; K694-R697 PolarHBondContact O-N 2.87Å; Y695-R697 PolarHBondContact O-N 3.29Å; R697-V699 PolarHBondContact O-N 3.22Å
698	Q	77.4	Confident	83.4	Confident	67 Å²	67	58.9 Å²	58.9	31%	0.313	31%	0.313	S	S	.	.			trans	-69.1	126.9	177.7	-170	173	5.8	0	0	110.6	Y695	Y695-Q698 WeakPolarHBondContact O-CB 3.27Å; Y695-Q698 PolarHBondContact O-N 3.33Å
699	V	79.3	Confident	83.7	Confident	49 Å²	49	54 Å²	54	30%	0.297	29%	0.29	S	S	.	.			trans	-83	138	-176.4	179.5	0	0	0	0	111.1	R697 T701 V770 Q771	R697-V699 PolarHBondContact O-N 3.22Å; V699-T701 HydrophobicContact CG1-CG2 4.45Å; V699-T701 PolarHBondContact O-N 3.37Å; V699-V770 HydrophobicContact CG1-CG1 4.14Å; V699-Q771 HydrophobicContact CG2-CB 4.48Å; V699-Q771 HydrophobicContact CG2-CG 4.43Å
700	D	77.4	Confident	84.1	Confident	8 Å²	8	49.4 Å²	49.4	4%	0.043	26%	0.261	C	S	.	.			trans	-96.6	83.2	177	-165.7	-1.9	0	0	0	112.1	R702 F703 Y706 Q866	D700-R702 PolarHBondContact O-N 3.19Å; D700-R702 PolarHBondContact OD1-N 3.38Å; D700-F703 HydrophobicContact CB-CB 4.24Å; D700-F703 WeakPolarHBondContact O-CB 3.33Å; D700-F703 PolarHBondContact O-N 3.45Å; D700-F703 VanDerWaalsContact O-N 3.11Å; D700-Y706 WeakPolarHBondContact OD2-CE2 3.36Å; D700-Q866 HydrophobicContact CB-CG 4.38Å; D700-Q866 VanDerWaalsContact CB-NE2 3.32Å; D700-Q866 VanDerWaalsContact CG-CD 3.42Å; D700-Q866 PolarHBondContact OD1-NE2 2.61Å; D700-Q866 WeakPolarHBondContact OD2-CG 3.22Å
701	T	74.1	Confident	84.5	Confident	104 Å²	104	45.6 Å²	45.6	64%	0.638	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-9.7	179.6	59	0	0	0	0	114.3	V699	V699-T701 HydrophobicContact CG1-CG2 4.45Å; V699-T701 PolarHBondContact O-N 3.37Å
702	R	81.4	Confident	84.9	Confident	80 Å²	80	48.1 Å²	48.1	30%	0.302	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	0.6	-179.5	-59.3	-178.5	-170.2	167.3	1.9	113.3	P346 D700 G704 A705 Y706	P346-R702 PolarHBondContact O-NH1 2.86Å; D700-R702 PolarHBondContact O-N 3.19Å; D700-R702 PolarHBondContact OD1-N 3.38Å; R702-G704 VanDerWaalsContact C-N 3.32Å; R702-G704 PolarHBondContact O-N 3.3Å; R702-A705 WeakPolarHBondContact O-CB 3.48Å; R702-A705 PolarHBondContact O-N 3.37Å; R702-Y706 HydrophobicContact CB-CE1 4.33Å; R702-Y706 HydrophobicContact CB-CE2 4.2Å; R702-Y706 WeakPolarHBondContact CB-OH 3.34Å
703	F	86	Confident	85.4	Confident	4 Å²	4	46 Å²	46	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-49.2	-47.3	-174.3	179.5	-108.1	0	0	0	114	D700 A705 Y706 V707 I769 V770 S776 V779 F864	D700-F703 HydrophobicContact CB-CB 4.24Å; D700-F703 WeakPolarHBondContact O-CB 3.33Å; D700-F703 PolarHBondContact O-N 3.45Å; D700-F703 VanDerWaalsContact O-N 3.11Å; F703-A705 PolarHBondContact O-N 2.94Å; F703-Y706 WeakPolarHBondContact O-CB 3.11Å; F703-Y706 PolarHBondContact O-N 2.89Å; F703-V707 HydrophobicContact CD1-CG2 4.3Å; F703-V707 HydrophobicContact CE1-CG2 3.77Å; F703-V707 HydrophobicContact CE2-CG2 4.25Å; F703-V707 HydrophobicContact CZ-CG2 3.74Å; F703-V707 PolarHBondContact O-N 2.92Å; F703-I769 HydrophobicContact CE1-CG2 4.06Å; F703-V770 HydrophobicContact CD1-CG2 4.49Å; F703-S776 WeakPolarHBondContact CE2-O 3.23Å; F703-S776 WeakPolarHBondContact CZ-O 3.37Å; F703-V779 HydrophobicContact CE1-CB 4.5Å; F703-V779 HydrophobicContact CE1-CG1 4.16Å; F703-V779 HydrophobicContact CZ-CB 3.98Å; F703-V779 HydrophobicContact CZ-CG1 3.88Å; F703-F864 HydrophobicContact CE2-CD1 4.26Å; F703-F864 AromaticContact CE2-CE1 3.99Å; F703-F864 HydrophobicContact CE2-CE1 3.99Å
704	G	84.8	Confident	85.9	Confident	23 Å²	23	40.8 Å²	40.8	24%	0.237	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-25.9	179.7	0	0	0	0	0	114.6	R702 A708	R702-G704 VanDerWaalsContact C-N 3.32Å; R702-G704 PolarHBondContact O-N 3.3Å; G704-A708 WeakPolarHBondContact O-CB 3.29Å; G704-A708 PolarHBondContact O-N 3.44Å
705	A	86.1	Confident	86.4	Confident	62 Å²	62	40.9 Å²	40.9	51%	0.512	22%	0.222	S	C	.	.	H	α-helix	trans	-74.1	-29.3	174.7	0	0	0	0	0	112.4	R702 F703 A708 C709	R702-A705 WeakPolarHBondContact O-CB 3.48Å; R702-A705 PolarHBondContact O-N 3.37Å; F703-A705 PolarHBondContact O-N 2.94Å; A705-A708 PolarHBondContact O-N 3.37Å; A705-C709 PolarHBondContact O-N 2.67Å
706	Y	89.4	Confident	87	Confident	8 Å²	8	42 Å²	42	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-72.8	-42	175.3	-49.4	-38.5	0	0	0	111.1	D700 R702 F703 A708 C709 A710 V863 F864 L865	D700-Y706 WeakPolarHBondContact OD2-CE2 3.36Å; R702-Y706 HydrophobicContact CB-CE1 4.33Å; R702-Y706 HydrophobicContact CB-CE2 4.2Å; R702-Y706 WeakPolarHBondContact CB-OH 3.34Å; F703-Y706 WeakPolarHBondContact O-CB 3.11Å; F703-Y706 PolarHBondContact O-N 2.89Å; Y706-A708 VanDerWaalsContact C-N 3.28Å; Y706-A708 PolarHBondContact O-N 3.1Å; Y706-C709 PolarHBondContact O-N 2.94Å; Y706-A710 PolarHBondContact O-N 3.47Å; Y706-V863 HydrophobicContact CD1-CG1 3.75Å; Y706-V863 VanDerWaalsContact CD1-O 3.23Å; Y706-V863 WeakPolarHBondContact CD1-O 3.29Å; Y706-V863 HydrophobicContact CG-CG1 4.26Å; Y706-F864 HydrophobicContact CD2-CD1 4.34Å; Y706-F864 HydrophobicContact CG-CD1 4.45Å; Y706-L865 HydrophobicContact CE1-CG 4.45Å
707	V	90.6	Very high	87.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.2	-38.7	171.5	-172.9	0	0	0	0	110.7	F703 C709 A710 T711 V745 M746 T783 F864	F703-V707 HydrophobicContact CD1-CG2 4.3Å; F703-V707 HydrophobicContact CE1-CG2 3.77Å; F703-V707 HydrophobicContact CE2-CG2 4.25Å; F703-V707 HydrophobicContact CZ-CG2 3.74Å; F703-V707 PolarHBondContact O-N 2.92Å; V707-C709 PolarHBondContact O-N 2.89Å; V707-A710 PolarHBondContact O-N 3.14Å; V707-T711 WeakPolarHBondContact O-CB 3.3Å; V707-T711 PolarHBondContact O-N 3.46Å; V707-T711 PolarHBondContact O-OG1 3.45Å; V707-V745 HydrophobicContact CG1-CG1 3.92Å; V707-M746 HydrophobicContact CB-SD 3.69Å; V707-M746 HydrophobicContact CG1-CG 3.93Å; V707-M746 HydrophobicContact CG1-SD 3.54Å; V707-M746 VanDerWaalsContact CG1-SD 3.54Å; V707-T783 HydrophobicContact CG1-CG2 4.21Å; V707-F864 HydrophobicContact CG2-CE1 4.2Å; V707-F864 HydrophobicContact CG2-CZ 4.45Å
708	A	90.1	Very high	88.4	Confident	38 Å²	38	31 Å²	31	31%	0.314	18%	0.178	S	C	.	.	H	α-helix	trans	-62.3	-44.8	176.7	0	0	0	0	0	111.7	G704 A705 Y706 T711 L712 M746	G704-A708 WeakPolarHBondContact O-CB 3.29Å; G704-A708 PolarHBondContact O-N 3.44Å; A705-A708 PolarHBondContact O-N 3.37Å; Y706-A708 VanDerWaalsContact C-N 3.28Å; Y706-A708 PolarHBondContact O-N 3.1Å; A708-T711 PolarHBondContact O-N 2.82Å; A708-L712 WeakPolarHBondContact O-CB 3.1Å; A708-L712 PolarHBondContact O-N 2.96Å; A708-M746 WeakPolarHBondContact CA-SD 3.39Å; A708-M746 HydrophobicContact CB-CE 3.72Å; A708-M746 HydrophobicContact CB-SD 3.83Å; A708-M746 PolarHBondContact N-SD 3Å
709	C	91.1	Very high	89.2	Confident	4 Å²	4	33.1 Å²	33.1	3%	0.027	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-43.9	175.7	-171.2	0	0	0	0	112	C342 A705 Y706 V707 T711 L712 V713 V863	C342-C709 HydrophobicContact CB-CB 4.26Å; C342-C709 VanDerWaalsContact CB-SG 3.52Å; C342-C709 VanDerWaalsContact SG-SG 3.67Å; A705-C709 PolarHBondContact O-N 2.67Å; Y706-C709 PolarHBondContact O-N 2.94Å; V707-C709 PolarHBondContact O-N 2.89Å; C709-T711 VanDerWaalsContact C-N 3.32Å; C709-T711 PolarHBondContact O-N 3.43Å; C709-L712 WeakPolarHBondContact O-CA 3.47Å; C709-L712 VanDerWaalsContact O-CB 3.32Å; C709-L712 WeakPolarHBondContact O-CB 3.41Å; C709-L712 PolarHBondContact O-N 3.04Å; C709-L712 VanDerWaalsContact O-N 3.07Å; C709-V713 WeakPolarHBondContact O-CG2 3.34Å; C709-V713 PolarHBondContact O-N 2.98Å; C709-V863 HydrophobicContact CB-CG1 3.89Å
710	A	91.9	Very high	89.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-39.5	175.8	0	0	0	0	0	112.5	Y706 V707 L712 V713 F714 T783 V787 F864	Y706-A710 PolarHBondContact O-N 3.47Å; V707-A710 PolarHBondContact O-N 3.14Å; A710-L712 VanDerWaalsContact C-N 3.31Å; A710-L712 PolarHBondContact O-N 3.33Å; A710-V713 PolarHBondContact O-N 3.22Å; A710-F714 PolarHBondContact O-N 3.37Å; A710-T783 HydrophobicContact CB-CG2 3.78Å; A710-V787 HydrophobicContact CB-CG2 4.47Å; A710-F864 HydrophobicContact CB-CE2 4.09Å; A710-F864 HydrophobicContact CB-CZ 4.24Å
711	T	92.8	Very high	90.5	Very high	13 Å²	13	30.5 Å²	30.5	8%	0.08	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-33.9	173.5	-50.2	0	0	0	0	111.9	V707 A708 C709 F714 F715 L742 M746	V707-T711 WeakPolarHBondContact O-CB 3.3Å; V707-T711 PolarHBondContact O-N 3.46Å; V707-T711 PolarHBondContact O-OG1 3.45Å; A708-T711 PolarHBondContact O-N 2.82Å; C709-T711 VanDerWaalsContact C-N 3.32Å; C709-T711 PolarHBondContact O-N 3.43Å; T711-F714 WeakPolarHBondContact O-CB 3.23Å; T711-F714 PolarHBondContact O-N 3.17Å; T711-F715 HydrophobicContact CG2-CD2 4.48Å; T711-F715 HydrophobicContact CG2-CE2 4.06Å; T711-F715 WeakPolarHBondContact O-CD2 3.48Å; T711-F715 PolarHBondContact O-N 3.13Å; T711-L742 HydrophobicContact CG2-CB 4.08Å; T711-M746 WeakPolarHBondContact OG1-CG 3.48Å
712	L	93.8	Very high	91.3	Very high	69 Å²	69	29.3 Å²	29.3	36%	0.361	16%	0.159	S	C	.	.	H	α-helix	trans	-69.1	-40.5	175	-157.1	167.7	0	0	0	111.4	I338 A708 C709 A710 F715 F716	I338-L712 HydrophobicContact CD1-CD2 4.42Å; I338-L712 HydrophobicContact CG2-CD1 4.18Å; I338-L712 HydrophobicContact CG2-CD2 4.15Å; A708-L712 WeakPolarHBondContact O-CB 3.1Å; A708-L712 PolarHBondContact O-N 2.96Å; C709-L712 WeakPolarHBondContact O-CA 3.47Å; C709-L712 VanDerWaalsContact O-CB 3.32Å; C709-L712 WeakPolarHBondContact O-CB 3.41Å; C709-L712 PolarHBondContact O-N 3.04Å; C709-L712 VanDerWaalsContact O-N 3.07Å; A710-L712 VanDerWaalsContact C-N 3.31Å; A710-L712 PolarHBondContact O-N 3.33Å; L712-F715 PolarHBondContact O-N 2.93Å; L712-F716 HydrophobicContact CD2-CD2 3.62Å; L712-F716 HydrophobicContact CD2-CE2 3.35Å; L712-F716 HydrophobicContact CD2-CZ 4.5Å; L712-F716 PolarHBondContact O-N 3.11Å
713	V	94.8	Very high	91.7	Very high	1 Å²	1	28 Å²	28	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-61.1	-42.4	171.9	174.8	0	0	0	0	111.3	V339 C709 A710 F715 F716 I717 V787 L856 A860	V339-V713 HydrophobicContact CG2-CG2 3.41Å; V339-V713 VanDerWaalsContact CG2-CG2 3.41Å; C709-V713 WeakPolarHBondContact O-CG2 3.34Å; C709-V713 PolarHBondContact O-N 2.98Å; A710-V713 PolarHBondContact O-N 3.22Å; V713-F715 VanDerWaalsContact C-N 3.33Å; V713-F715 PolarHBondContact O-N 3.12Å; V713-F716 PolarHBondContact O-N 2.94Å; V713-I717 HydrophobicContact CG1-CD1 3.82Å; V713-I717 HydrophobicContact CG1-CG1 4.38Å; V713-I717 WeakPolarHBondContact O-CG1 3.13Å; V713-I717 PolarHBondContact O-N 3.39Å; V713-V787 HydrophobicContact CG1-CG1 4.05Å; V713-L856 HydrophobicContact CG1-CB 4.2Å; V713-A860 HydrophobicContact CG1-CB 4.41Å; V713-A860 HydrophobicContact CG2-CB 4.47Å
714	F	95.6	Very high	91.8	Very high	3 Å²	3	28.6 Å²	28.6	1%	0.013	16%	0.163	C	C	.	.	H	α-helix	trans	-55.3	-45.3	173.6	165.1	-93	0	0	0	112.2	A710 T711 F716 I717 C718 F735 C738 F739 L742 V787 S790	A710-F714 PolarHBondContact O-N 3.37Å; T711-F714 WeakPolarHBondContact O-CB 3.23Å; T711-F714 PolarHBondContact O-N 3.17Å; F714-F716 PolarHBondContact O-N 2.78Å; F714-I717 PolarHBondContact O-N 3.5Å; F714-C718 WeakPolarHBondContact CZ-SG 3.1Å; F714-C718 PolarHBondContact O-N 3.32Å; F714-C718 PolarHBondContact O-SG 3.35Å; F714-F735 WeakPolarHBondContact CZ-O 3.48Å; F714-C738 HydrophobicContact CD2-CB 4.33Å; F714-C738 HydrophobicContact CE2-CB 3.4Å; F714-C738 HydrophobicContact CZ-CB 3.67Å; F714-F739 HydrophobicContact CE1-CB 4.03Å; F714-F739 HydrophobicContact CZ-CB 4.34Å; F714-L742 HydrophobicContact CB-CD1 3.77Å; F714-L742 HydrophobicContact CD1-CD1 3.8Å; F714-L742 HydrophobicContact CD2-CD1 3.72Å; F714-L742 HydrophobicContact CE1-CD1 4.35Å; F714-L742 HydrophobicContact CE2-CD1 4.28Å; F714-L742 HydrophobicContact CG-CD1 3.47Å; F714-L742 VanDerWaalsContact CG-CD1 3.47Å; F714-V787 HydrophobicContact CB-CG2 4.24Å; F714-S790 WeakPolarHBondContact CD2-OG 3.48Å
715	F	95.2	Very high	91.8	Very high	82 Å²	82	27.8 Å²	27.8	36%	0.36	15%	0.154	S	C	.	.	H	α-helix	trans	-60.7	-43.2	176.2	-76.8	-64.1	0	0	0	112.7	T711 L712 V713 I717 C718 F719 F739	T711-F715 HydrophobicContact CG2-CD2 4.48Å; T711-F715 HydrophobicContact CG2-CE2 4.06Å; T711-F715 WeakPolarHBondContact O-CD2 3.48Å; T711-F715 PolarHBondContact O-N 3.13Å; L712-F715 PolarHBondContact O-N 2.93Å; V713-F715 VanDerWaalsContact C-N 3.33Å; V713-F715 PolarHBondContact O-N 3.12Å; F715-I717 PolarHBondContact O-N 3.07Å; F715-C718 PolarHBondContact O-N 2.98Å; F715-F719 HydrophobicContact CB-CD2 4.46Å; F715-F719 HydrophobicContact CB-CE2 4.14Å; F715-F719 WeakPolarHBondContact O-CD2 3.48Å; F715-F719 WeakPolarHBondContact O-CG 3.4Å; F715-F719 PolarHBondContact O-N 3.41Å; F715-F739 HydrophobicContact CE1-CD2 4.09Å; F715-F739 HydrophobicContact CE1-CE2 4.33Å; F715-F739 AromaticContact CZ-CD2 3.66Å; F715-F739 HydrophobicContact CZ-CD2 3.66Å; F715-F739 AromaticContact CZ-CE2 3.61Å; F715-F739 HydrophobicContact CZ-CE2 3.61Å
716	F	95.7	Very high	91.7	Very high	27 Å²	27	27.4 Å²	27.4	12%	0.118	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-44.1	174.5	-84.1	-65.9	0	0	0	112.4	L331 C335 I338 L712 V713 F714 C718 F719 I720	L331-F716 HydrophobicContact CB-CD1 4.09Å; L331-F716 HydrophobicContact CB-CE1 4.48Å; L331-F716 HydrophobicContact CD2-CD1 3.86Å; L331-F716 HydrophobicContact CD2-CE1 3.81Å; C335-F716 HydrophobicContact CB-CB 3.9Å; C335-F716 HydrophobicContact CB-CD1 4.15Å; C335-F716 HydrophobicContact CB-CD2 3.48Å; C335-F716 VanDerWaalsContact CB-CD2 3.48Å; C335-F716 HydrophobicContact CB-CE2 3.94Å; C335-F716 HydrophobicContact CB-CG 3.59Å; C335-F716 HydrophobicContact CB-CZ 4.47Å; C335-F716 VanDerWaalsContact SG-CD2 3.54Å; I338-F716 HydrophobicContact CD1-CE2 3.7Å; I338-F716 HydrophobicContact CD1-CZ 3.85Å; L712-F716 HydrophobicContact CD2-CD2 3.62Å; L712-F716 HydrophobicContact CD2-CE2 3.35Å; L712-F716 HydrophobicContact CD2-CZ 4.5Å; L712-F716 PolarHBondContact O-N 3.11Å; V713-F716 PolarHBondContact O-N 2.94Å; F714-F716 PolarHBondContact O-N 2.78Å; F716-C718 VanDerWaalsContact C-N 3.3Å; F716-C718 PolarHBondContact O-N 2.94Å; F716-F719 PolarHBondContact O-N 2.81Å; F716-I720 WeakPolarHBondContact O-CB 3.47Å; F716-I720 WeakPolarHBondContact O-CD1 3.43Å; F716-I720 VanDerWaalsContact O-CG1 3.24Å; F716-I720 WeakPolarHBondContact O-CG1 3.43Å; F716-I720 PolarHBondContact O-N 2.64Å
717	I	94.7	Very high	91.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.5	-40.2	176.6	-72.7	171.5	0	0	0	111.3	V713 F714 F715 Q721 V787 A791 C853 L856	V713-I717 HydrophobicContact CG1-CD1 3.82Å; V713-I717 HydrophobicContact CG1-CG1 4.38Å; V713-I717 WeakPolarHBondContact O-CG1 3.13Å; V713-I717 PolarHBondContact O-N 3.39Å; F714-I717 PolarHBondContact O-N 3.5Å; F715-I717 PolarHBondContact O-N 3.07Å; I717-Q721 WeakPolarHBondContact O-CG 3.46Å; I717-Q721 PolarHBondContact O-N 3.39Å; I717-Q721 VanDerWaalsContact O-N 3.17Å; I717-Q721 PolarHBondContact O-NE2 3.42Å; I717-V787 HydrophobicContact CD1-CG1 3.77Å; I717-A791 HydrophobicContact CD1-CB 4.36Å; I717-A791 HydrophobicContact CG2-CB 4.26Å; I717-C853 HydrophobicContact CG1-CB 4.3Å; I717-C853 HydrophobicContact CG2-CB 4.2Å; I717-L856 HydrophobicContact CD1-CB 4.17Å; I717-L856 HydrophobicContact CG1-CB 4.2Å; I717-L856 HydrophobicContact CG1-CD1 4.23Å
718	C	94	Very high	91.2	Very high	10 Å²	10	32.9 Å²	32.9	7%	0.068	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-46.8	174.1	-68.1	0	0	0	0	112.1	F714 F715 F716 Q721 I722 F735	F714-C718 WeakPolarHBondContact CZ-SG 3.1Å; F714-C718 PolarHBondContact O-N 3.32Å; F714-C718 PolarHBondContact O-SG 3.35Å; F715-C718 PolarHBondContact O-N 2.98Å; F716-C718 VanDerWaalsContact C-N 3.3Å; F716-C718 PolarHBondContact O-N 2.94Å; C718-Q721 PolarHBondContact O-N 3.47Å; C718-I722 WeakPolarHBondContact O-CB 3.38Å; C718-I722 WeakPolarHBondContact O-CD1 3.35Å; C718-I722 VanDerWaalsContact O-CG1 3.24Å; C718-I722 WeakPolarHBondContact O-CG1 3.34Å; C718-I722 PolarHBondContact O-N 3.46Å; C718-F735 HydrophobicContact CB-CD2 4.01Å; C718-F735 HydrophobicContact CB-CE2 3.95Å; C718-F735 HydrophobicContact CB-CG 4.5Å; C718-F735 HydrophobicContact CB-CZ 4.38Å; C718-F735 VanDerWaalsContact SG-CG 3.59Å
719	F	94.3	Very high	91.1	Very high	110 Å²	110	38.2 Å²	38.2	48%	0.482	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-41.4	179.3	-69.3	-54.2	0	0	0	112.7	L331 F715 F716 Q721 I722 V723	L331-F719 HydrophobicContact CD1-CB 3.94Å; F715-F719 HydrophobicContact CB-CD2 4.46Å; F715-F719 HydrophobicContact CB-CE2 4.14Å; F715-F719 WeakPolarHBondContact O-CD2 3.48Å; F715-F719 WeakPolarHBondContact O-CG 3.4Å; F715-F719 PolarHBondContact O-N 3.41Å; F716-F719 PolarHBondContact O-N 2.81Å; F719-Q721 PolarHBondContact O-N 3.31Å; F719-I722 PolarHBondContact O-N 3.08Å; F719-V723 WeakPolarHBondContact O-CG2 3.42Å; F719-V723 PolarHBondContact O-N 2.83Å; F719-V723 VanDerWaalsContact O-N 3.13Å
720	I	93.1	Very high	90.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-47.1	175.6	-67.9	157.9	0	0	0	110.2	L331 V332 F716 V723 I724 Y849 L856	L331-I720 HydrophobicContact CB-CD1 4.18Å; L331-I720 HydrophobicContact CB-CG1 3.67Å; L331-I720 HydrophobicContact CD1-CG1 4.02Å; V332-I720 HydrophobicContact CG2-CD1 3.54Å; V332-I720 HydrophobicContact CG2-CG1 4.29Å; F716-I720 WeakPolarHBondContact O-CB 3.47Å; F716-I720 WeakPolarHBondContact O-CD1 3.43Å; F716-I720 VanDerWaalsContact O-CG1 3.24Å; F716-I720 WeakPolarHBondContact O-CG1 3.43Å; F716-I720 PolarHBondContact O-N 2.64Å; I720-V723 PolarHBondContact O-N 2.94Å; I720-I724 WeakPolarHBondContact O-CB 3.45Å; I720-I724 WeakPolarHBondContact O-CG1 3.32Å; I720-I724 PolarHBondContact O-N 3.23Å; I720-Y849 HydrophobicContact CG2-CD1 4.24Å; I720-L856 HydrophobicContact CD1-CD1 3.66Å
721	Q	91.1	Very high	90.7	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	22%	0.222	C	C	.	.	H	α-helix	trans	-68.9	-34.9	179.9	-75.4	178.5	77.9	0	0	113.1	I717 C718 F719 V723 I724 V725 F735 S790 N794 F850	I717-Q721 WeakPolarHBondContact O-CG 3.46Å; I717-Q721 PolarHBondContact O-N 3.39Å; I717-Q721 VanDerWaalsContact O-N 3.17Å; I717-Q721 PolarHBondContact O-NE2 3.42Å; C718-Q721 PolarHBondContact O-N 3.47Å; F719-Q721 PolarHBondContact O-N 3.31Å; Q721-V723 VanDerWaalsContact C-N 3.26Å; Q721-V723 PolarHBondContact O-N 3.06Å; Q721-I724 PolarHBondContact O-N 3.09Å; Q721-V725 HydrophobicContact CB-CG2 4.34Å; Q721-V725 HydrophobicContact CG-CG2 4.41Å; Q721-V725 WeakPolarHBondContact O-CA 3.28Å; Q721-V725 VanDerWaalsContact O-CB 3.26Å; Q721-V725 WeakPolarHBondContact O-CB 3.27Å; Q721-V725 PolarHBondContact O-N 2.93Å; Q721-F735 HydrophobicContact CB-CZ 4.16Å; Q721-S790 PolarHBondContact NE2-O 3.11Å; Q721-N794 PolarHBondContact OE1-ND2 3.19Å; Q721-F850 HydrophobicContact CG-CE1 4.43Å
722	I	90.7	Very high	90.6	Very high	79 Å²	79	45.6 Å²	45.6	41%	0.405	24%	0.237	S	C	.	.	H	α-helix	trans	-66.2	-27.3	174.3	-70.2	163.2	0	0	0	112.2	C718 F719 M731 F735	C718-I722 WeakPolarHBondContact O-CB 3.38Å; C718-I722 WeakPolarHBondContact O-CD1 3.35Å; C718-I722 VanDerWaalsContact O-CG1 3.24Å; C718-I722 WeakPolarHBondContact O-CG1 3.34Å; C718-I722 PolarHBondContact O-N 3.46Å; F719-I722 PolarHBondContact O-N 3.08Å; I722-M731 HydrophobicContact CG1-CE 3.86Å; I722-M731 HydrophobicContact CG1-SD 4.44Å; I722-F735 HydrophobicContact CG1-CE2 4.4Å
723	V	90.2	Very high	90.5	Very high	52 Å²	52	44 Å²	44	32%	0.315	24%	0.236	S	C	.	.	H	α-helix	trans	-82.9	-34	176.9	171.2	0	0	0	0	112.7	K324 V327 S328 F719 I720 Q721	K324-V723 HydrophobicContact CB-CG1 4.38Å; K324-V723 WeakPolarHBondContact O-CG1 3.31Å; V327-V723 HydrophobicContact CB-CG1 4.38Å; V327-V723 HydrophobicContact CG1-CG1 4.29Å; V327-V723 HydrophobicContact CG1-CG2 4.2Å; S328-V723 WeakPolarHBondContact OG-CG1 3.44Å; F719-V723 WeakPolarHBondContact O-CG2 3.42Å; F719-V723 PolarHBondContact O-N 2.83Å; F719-V723 VanDerWaalsContact O-N 3.13Å; I720-V723 PolarHBondContact O-N 2.94Å; Q721-V723 VanDerWaalsContact C-N 3.26Å; Q721-V723 PolarHBondContact O-N 3.06Å
724	I	87.7	Confident	90.3	Very high	18 Å²	18	46.4 Å²	46.4	9%	0.092	25%	0.247	C	C	.	.	H	α-helix	trans	-95.7	-39.8	-174.1	-68	-65.4	0	0	0	113.6	K324 S328 I720 Q721 F846 Y849	K324-I724 HydrophobicContact CB-CD1 4.39Å; S328-I724 WeakPolarHBondContact OG-CD1 3.44Å; S328-I724 VanDerWaalsContact OG-CG1 3.29Å; S328-I724 WeakPolarHBondContact OG-CG1 3.38Å; I720-I724 WeakPolarHBondContact O-CB 3.45Å; I720-I724 WeakPolarHBondContact O-CG1 3.32Å; I720-I724 PolarHBondContact O-N 3.23Å; Q721-I724 PolarHBondContact O-N 3.09Å; I724-F846 HydrophobicContact CD1-CB 4.44Å; I724-F846 HydrophobicContact CD1-CD2 4.24Å; I724-F846 HydrophobicContact CD1-CG 4.47Å; I724-F846 HydrophobicContact CG2-CB 3.88Å; I724-F846 HydrophobicContact CG2-CD2 4.28Å; I724-Y849 HydrophobicContact CD1-CD2 3.78Å; I724-Y849 HydrophobicContact CD1-CE2 3.84Å; I724-Y849 HydrophobicContact CD1-CG 4.17Å; I724-Y849 HydrophobicContact CG1-CD1 4.4Å; I724-Y849 HydrophobicContact CG1-CD2 4.03Å; I724-Y849 HydrophobicContact CG1-CG 3.96Å; I724-Y849 HydrophobicContact CG2-CD2 4.3Å
725	V	85.1	Confident	90.2	Very high	6 Å²	6	47 Å²	47	4%	0.036	25%	0.25	C	C	.	.	S	Bend	trans	-102.9	133.7	-169.5	-171.6	0	0	0	0	109.4	Q721 I727 F850	Q721-V725 HydrophobicContact CB-CG2 4.34Å; Q721-V725 HydrophobicContact CG-CG2 4.41Å; Q721-V725 WeakPolarHBondContact O-CA 3.28Å; Q721-V725 VanDerWaalsContact O-CB 3.26Å; Q721-V725 WeakPolarHBondContact O-CB 3.27Å; Q721-V725 PolarHBondContact O-N 2.93Å; V725-I727 PolarHBondContact O-N 2.76Å; V725-F850 HydrophobicContact CG2-CE1 3.97Å; V725-F850 HydrophobicContact CG2-CZ 3.66Å
726	P	83.4	Confident	90.2	Very high	53 Å²	53	47.5 Å²	47.5	34%	0.344	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-61.8	138.4	175.6	27	-35.7	0	0	0	111.3	S728 L842 I843	P726-S728 PolarHBondContact O-N 3.39Å; P726-L842 HydrophobicContact CB-CD2 3.75Å; P726-L842 HydrophobicContact CG-CB 3.95Å; P726-L842 HydrophobicContact CG-CD2 3.7Å; P726-L842 HydrophobicContact CG-CG 4.47Å; P726-I843 WeakPolarHBondContact CG-O 3.45Å
727	I	84.6	Confident	90.1	Very high	110 Å²	110	49.8 Å²	49.8	56%	0.564	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-67	128.7	-169.3	-60.1	175.4	0	0	0	111.1	V725 M731 I732	V725-I727 PolarHBondContact O-N 2.76Å; I727-M731 HydrophobicContact CB-CE 4.18Å; I727-M731 HydrophobicContact CG1-CE 4.05Å; I727-M731 HydrophobicContact CG2-CE 4.08Å; I727-I732 HydrophobicContact CG2-CD1 3.64Å; I727-I732 HydrophobicContact CG2-CG1 4.17Å
728	S	85.9	Confident	90.1	Very high	14 Å²	14	50.1 Å²	50.1	10%	0.098	27%	0.273	C	S	.	.			trans	-125	153.7	175.4	76.1	0	0	0	0	112.3	P726 L730 M731 I732	P726-S728 PolarHBondContact O-N 3.39Å; S728-L730 PolarHBondContact O-N 3Å; S728-M731 WeakPolarHBondContact O-CB 3.4Å; S728-M731 PolarHBondContact O-N 3.4Å; S728-M731 WeakPolarHBondContact OG-CB 3.42Å; S728-M731 PolarHBondContact OG-N 2.97Å; S728-I732 PolarHBondContact O-N 3.09Å
729	N	87.7	Confident	90.1	Very high	149 Å²	149	54 Å²	54	80%	0.797	29%	0.29	S	S	*	.	H	α-helix	trans	-63.1	-31.9	177.5	-67.9	-16	0	0	0	112.2	G733	N729-G733 PolarHBondContact O-N 2.75Å
730	L	87.1	Confident	90.1	Very high	95 Å²	95	54 Å²	54	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-43.7	175.5	-173.4	66.4	0	0	0	111.2	S728 G733 F734 T797	S728-L730 PolarHBondContact O-N 3Å; L730-G733 PolarHBondContact O-N 2.97Å; L730-F734 VanDerWaalsContact O-CB 3.31Å; L730-F734 WeakPolarHBondContact O-CB 3.48Å; L730-F734 PolarHBondContact O-N 3.44Å; L730-T797 HydrophobicContact CB-CG2 4.17Å; L730-T797 HydrophobicContact CD2-CG2 3.77Å
731	M	87.8	Confident	90.2	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-57.7	-51.9	176.6	-178.7	172.6	76.1	0	0	111.5	I722 I727 S728 F734 F735 N794	I722-M731 HydrophobicContact CG1-CE 3.86Å; I722-M731 HydrophobicContact CG1-SD 4.44Å; I727-M731 HydrophobicContact CB-CE 4.18Å; I727-M731 HydrophobicContact CG1-CE 4.05Å; I727-M731 HydrophobicContact CG2-CE 4.08Å; S728-M731 WeakPolarHBondContact O-CB 3.4Å; S728-M731 PolarHBondContact O-N 3.4Å; S728-M731 WeakPolarHBondContact OG-CB 3.42Å; S728-M731 PolarHBondContact OG-N 2.97Å; M731-F734 PolarHBondContact O-N 2.97Å; M731-F735 HydrophobicContact CG-CD2 3.69Å; M731-F735 HydrophobicContact CG-CE1 4.44Å; M731-F735 HydrophobicContact CG-CE2 3.35Å; M731-F735 HydrophobicContact CG-CG 4.38Å; M731-F735 HydrophobicContact CG-CZ 3.78Å; M731-F735 WeakPolarHBondContact O-CB 3.22Å; M731-F735 VanDerWaalsContact O-CG 3.27Å; M731-F735 WeakPolarHBondContact O-CG 3.44Å; M731-F735 PolarHBondContact O-N 3.45Å; M731-F735 HydrophobicContact SD-CE2 3.75Å; M731-F735 HydrophobicContact SD-CZ 4.23Å; M731-N794 VanDerWaalsContact CA-OD1 3.22Å; M731-N794 WeakPolarHBondContact CA-OD1 3.49Å; M731-N794 WeakPolarHBondContact CB-OD1 3.36Å; M731-N794 WeakPolarHBondContact CG-OD1 3.43Å
732	I	89.5	Confident	90.2	Very high	76 Å²	76	57.2 Å²	57.2	39%	0.39	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-48.6	-178.2	-65.2	172.1	0	0	0	110.5	I727 S728 F734 F735 I736	I727-I732 HydrophobicContact CG2-CD1 3.64Å; I727-I732 HydrophobicContact CG2-CG1 4.17Å; S728-I732 PolarHBondContact O-N 3.09Å; I732-F734 PolarHBondContact O-N 3.12Å; I732-F735 PolarHBondContact O-N 3.36Å; I732-I736 HydrophobicContact CG2-CD1 3.67Å; I732-I736 HydrophobicContact CG2-CG1 4.42Å; I732-I736 WeakPolarHBondContact O-CB 3.37Å; I732-I736 VanDerWaalsContact O-CG1 3.31Å; I732-I736 WeakPolarHBondContact O-CG1 3.36Å; I732-I736 PolarHBondContact O-N 2.69Å
733	G	91.9	Very high	90.3	Very high	35 Å²	35	55.3 Å²	55.3	36%	0.361	31%	0.306	S	S	.	.	H	α-helix	trans	-61.5	-42.3	180	0	0	0	0	0	113	N729 L730 T737	N729-G733 PolarHBondContact O-N 2.75Å; L730-G733 PolarHBondContact O-N 2.97Å; G733-T737 WeakPolarHBondContact O-CB 3.32Å; G733-T737 PolarHBondContact O-N 2.96Å; G733-T737 PolarHBondContact O-OG1 3.42Å
734	F	92	Very high	90.3	Very high	51 Å²	51	54.2 Å²	54.2	22%	0.224	31%	0.305	C	S	.	.	H	α-helix	trans	-69	-43.2	178.9	-166.9	-92	0	0	0	112.1	L730 M731 I732 T737 C738 L789 I793	L730-F734 VanDerWaalsContact O-CB 3.31Å; L730-F734 WeakPolarHBondContact O-CB 3.48Å; L730-F734 PolarHBondContact O-N 3.44Å; M731-F734 PolarHBondContact O-N 2.97Å; I732-F734 PolarHBondContact O-N 3.12Å; F734-T737 PolarHBondContact O-N 3.46Å; F734-C738 VanDerWaalsContact CD1-SG 3.57Å; F734-C738 WeakPolarHBondContact CE1-SG 3.16Å; F734-C738 WeakPolarHBondContact O-CB 3.5Å; F734-C738 PolarHBondContact O-N 2.92Å; F734-C738 PolarHBondContact O-SG 3.04Å; F734-L789 HydrophobicContact CE1-CB 4.22Å; F734-L789 HydrophobicContact CZ-CB 3.86Å; F734-I793 HydrophobicContact CD1-CB 4.28Å; F734-I793 HydrophobicContact CD1-CG1 4.27Å; F734-I793 HydrophobicContact CD1-CG2 3.65Å; F734-I793 HydrophobicContact CD2-CG1 4.1Å; F734-I793 HydrophobicContact CE1-CB 4.28Å; F734-I793 HydrophobicContact CE1-CG1 4.44Å; F734-I793 HydrophobicContact CE1-CG2 3.99Å; F734-I793 HydrophobicContact CE2-CD1 4.45Å; F734-I793 HydrophobicContact CE2-CG1 4.29Å; F734-I793 HydrophobicContact CG-CG1 4.09Å; F734-I793 HydrophobicContact CG-CG2 4.13Å; F734-I793 HydrophobicContact CZ-CG1 4.47Å
735	F	93.4	Very high	90.4	Very high	17 Å²	17	54.4 Å²	54.4	8%	0.075	31%	0.307	C	S	.	.	H	α-helix	trans	-64.6	-41.5	177.1	-70.6	-10.7	0	0	0	112.4	F714 C718 Q721 I722 M731 I732 T737 C738 F739 N794	F714-F735 WeakPolarHBondContact CZ-O 3.48Å; C718-F735 HydrophobicContact CB-CD2 4.01Å; C718-F735 HydrophobicContact CB-CE2 3.95Å; C718-F735 HydrophobicContact CB-CG 4.5Å; C718-F735 HydrophobicContact CB-CZ 4.38Å; C718-F735 VanDerWaalsContact SG-CG 3.59Å; Q721-F735 HydrophobicContact CB-CZ 4.16Å; I722-F735 HydrophobicContact CG1-CE2 4.4Å; M731-F735 HydrophobicContact CG-CD2 3.69Å; M731-F735 HydrophobicContact CG-CE1 4.44Å; M731-F735 HydrophobicContact CG-CE2 3.35Å; M731-F735 HydrophobicContact CG-CG 4.38Å; M731-F735 HydrophobicContact CG-CZ 3.78Å; M731-F735 WeakPolarHBondContact O-CB 3.22Å; M731-F735 VanDerWaalsContact O-CG 3.27Å; M731-F735 WeakPolarHBondContact O-CG 3.44Å; M731-F735 PolarHBondContact O-N 3.45Å; M731-F735 HydrophobicContact SD-CE2 3.75Å; M731-F735 HydrophobicContact SD-CZ 4.23Å; I732-F735 PolarHBondContact O-N 3.36Å; F735-T737 PolarHBondContact O-N 2.91Å; F735-C738 PolarHBondContact O-N 3.26Å; F735-F739 WeakPolarHBondContact O-CB 3.37Å; F735-F739 PolarHBondContact O-N 2.88Å; F735-N794 VanDerWaalsContact CZ-ND2 3.28Å; F735-N794 WeakPolarHBondContact CZ-ND2 3.37Å
736	I	93.7	Very high	90.6	Very high	91 Å²	91	56.2 Å²	56.2	47%	0.467	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-44.3	174.4	-69.6	170.7	0	0	0	110.7	I732 F739 I740	I732-I736 HydrophobicContact CG2-CD1 3.67Å; I732-I736 HydrophobicContact CG2-CG1 4.42Å; I732-I736 WeakPolarHBondContact O-CB 3.37Å; I732-I736 VanDerWaalsContact O-CG1 3.31Å; I732-I736 WeakPolarHBondContact O-CG1 3.36Å; I732-I736 PolarHBondContact O-N 2.69Å; I736-F739 PolarHBondContact O-N 3.1Å; I736-I740 HydrophobicContact CG2-CD1 3.87Å; I736-I740 WeakPolarHBondContact O-CG1 3.43Å; I736-I740 PolarHBondContact O-N 3.39Å
737	T	94.2	Very high	90.8	Very high	76 Å²	76	58.6 Å²	58.6	47%	0.466	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-47	178	-56.2	0	0	0	0	111.5	G733 F734 F735 I740 I741	G733-T737 WeakPolarHBondContact O-CB 3.32Å; G733-T737 PolarHBondContact O-N 2.96Å; G733-T737 PolarHBondContact O-OG1 3.42Å; F734-T737 PolarHBondContact O-N 3.46Å; F735-T737 PolarHBondContact O-N 2.91Å; T737-I740 PolarHBondContact O-N 3.11Å; T737-I741 HydrophobicContact CG2-CD1 4.11Å; T737-I741 WeakPolarHBondContact O-CG1 3.42Å; T737-I741 PolarHBondContact O-N 3.12Å
738	C	94.1	Very high	90.9	Very high	6 Å²	6	55.4 Å²	55.4	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-42	177.3	-67.4	0	0	0	0	112.2	F714 F734 F735 I740 I741 L742 I786	F714-C738 HydrophobicContact CD2-CB 4.33Å; F714-C738 HydrophobicContact CE2-CB 3.4Å; F714-C738 HydrophobicContact CZ-CB 3.67Å; F734-C738 VanDerWaalsContact CD1-SG 3.57Å; F734-C738 WeakPolarHBondContact CE1-SG 3.16Å; F734-C738 WeakPolarHBondContact O-CB 3.5Å; F734-C738 PolarHBondContact O-N 2.92Å; F734-C738 PolarHBondContact O-SG 3.04Å; F735-C738 PolarHBondContact O-N 3.26Å; C738-I740 PolarHBondContact O-N 3.28Å; C738-I741 PolarHBondContact O-N 2.84Å; C738-L742 WeakPolarHBondContact O-CB 3.17Å; C738-L742 VanDerWaalsContact O-CG 3.28Å; C738-L742 WeakPolarHBondContact O-CG 3.48Å; C738-L742 PolarHBondContact O-N 2.68Å; C738-I786 HydrophobicContact CB-CG2 3.78Å
739	F	94.3	Very high	90.7	Very high	93 Å²	93	55 Å²	55	41%	0.408	30%	0.302	S	S	.	.	H	α-helix	trans	-59.5	-45.9	176.5	170	-117.9	0	0	0	111.9	F714 F715 F735 I736 I741 L742 A743	F714-F739 HydrophobicContact CE1-CB 4.03Å; F714-F739 HydrophobicContact CZ-CB 4.34Å; F715-F739 HydrophobicContact CE1-CD2 4.09Å; F715-F739 HydrophobicContact CE1-CE2 4.33Å; F715-F739 AromaticContact CZ-CD2 3.66Å; F715-F739 HydrophobicContact CZ-CD2 3.66Å; F715-F739 AromaticContact CZ-CE2 3.61Å; F715-F739 HydrophobicContact CZ-CE2 3.61Å; F735-F739 WeakPolarHBondContact O-CB 3.37Å; F735-F739 PolarHBondContact O-N 2.88Å; I736-F739 PolarHBondContact O-N 3.1Å; F739-I741 VanDerWaalsContact C-N 3.34Å; F739-I741 PolarHBondContact O-N 2.97Å; F739-L742 PolarHBondContact O-N 3.47Å; F739-A743 HydrophobicContact CE2-CB 4.11Å; F739-A743 HydrophobicContact CZ-CB 4.38Å; F739-A743 WeakPolarHBondContact O-CB 3.47Å; F739-A743 PolarHBondContact O-N 3.38Å
740	I	94.6	Very high	90.4	Very high	108 Å²	108	50.2 Å²	50.2	55%	0.554	28%	0.283	S	S	*	.	H	α-helix	trans	-59.8	-44.4	178.3	-69	165.3	0	0	0	111.1	I736 T737 C738 G744	I736-I740 HydrophobicContact CG2-CD1 3.87Å; I736-I740 WeakPolarHBondContact O-CG1 3.43Å; I736-I740 PolarHBondContact O-N 3.39Å; T737-I740 PolarHBondContact O-N 3.11Å; C738-I740 PolarHBondContact O-N 3.28Å; I740-G744 PolarHBondContact O-N 3.12Å
741	I	94.5	Very high	90.3	Very high	69 Å²	69	45.7 Å²	45.7	35%	0.354	26%	0.259	S	S	.	.	H	α-helix	trans	-66.9	-48.3	179.7	-61.6	164.7	0	0	0	110.9	T737 C738 F739 A743 G744 V745 F782 I786	T737-I741 HydrophobicContact CG2-CD1 4.11Å; T737-I741 WeakPolarHBondContact O-CG1 3.42Å; T737-I741 PolarHBondContact O-N 3.12Å; C738-I741 PolarHBondContact O-N 2.84Å; F739-I741 VanDerWaalsContact C-N 3.34Å; F739-I741 PolarHBondContact O-N 2.97Å; I741-A743 PolarHBondContact O-N 3.36Å; I741-G744 PolarHBondContact O-N 3.41Å; I741-G744 VanDerWaalsContact O-N 3.16Å; I741-V745 WeakPolarHBondContact O-CG2 3.28Å; I741-V745 PolarHBondContact O-N 3.43Å; I741-F782 HydrophobicContact CG2-CE1 3.83Å; I741-F782 HydrophobicContact CG2-CZ 4.1Å; I741-I786 HydrophobicContact CB-CD1 4.34Å; I741-I786 HydrophobicContact CG2-CD1 3.54Å
742	L	92.6	Very high	89.8	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-62.8	-41.1	179.1	-69.4	170.9	0	0	0	111.7	T711 F714 C738 F739 G744 V745 M746 T783 I786	T711-L742 HydrophobicContact CG2-CB 4.08Å; F714-L742 HydrophobicContact CB-CD1 3.77Å; F714-L742 HydrophobicContact CD1-CD1 3.8Å; F714-L742 HydrophobicContact CD2-CD1 3.72Å; F714-L742 HydrophobicContact CE1-CD1 4.35Å; F714-L742 HydrophobicContact CE2-CD1 4.28Å; F714-L742 HydrophobicContact CG-CD1 3.47Å; F714-L742 VanDerWaalsContact CG-CD1 3.47Å; C738-L742 WeakPolarHBondContact O-CB 3.17Å; C738-L742 VanDerWaalsContact O-CG 3.28Å; C738-L742 WeakPolarHBondContact O-CG 3.48Å; C738-L742 PolarHBondContact O-N 2.68Å; F739-L742 PolarHBondContact O-N 3.47Å; L742-G744 VanDerWaalsContact C-N 3.33Å; L742-G744 PolarHBondContact O-N 2.98Å; L742-V745 PolarHBondContact O-N 3.08Å; L742-M746 VanDerWaalsContact O-CB 3.31Å; L742-M746 WeakPolarHBondContact O-CB 3.45Å; L742-M746 WeakPolarHBondContact O-CG 3.35Å; L742-M746 PolarHBondContact O-N 2.89Å; L742-T783 HydrophobicContact CD2-CG2 3.75Å; L742-I786 HydrophobicContact CD1-CG2 4.04Å; L742-I786 HydrophobicContact CD2-CB 4.35Å; L742-I786 HydrophobicContact CD2-CD1 4.49Å; L742-I786 HydrophobicContact CD2-CG2 4.16Å; L742-I786 HydrophobicContact CG-CG2 3.98Å
743	A	91.2	Very high	89	Confident	39 Å²	39	50.3 Å²	50.3	32%	0.322	29%	0.287	S	S	.	.	H	α-helix	trans	-62.2	-38.6	173.9	0	0	0	0	0	112.1	F739 I741 M746 F747	F739-A743 HydrophobicContact CE2-CB 4.11Å; F739-A743 HydrophobicContact CZ-CB 4.38Å; F739-A743 WeakPolarHBondContact O-CB 3.47Å; F739-A743 PolarHBondContact O-N 3.38Å; I741-A743 PolarHBondContact O-N 3.36Å; A743-M746 PolarHBondContact O-N 3.21Å; A743-F747 WeakPolarHBondContact O-CB 3.46Å; A743-F747 PolarHBondContact O-N 2.85Å
744	G	90.9	Very high	88.1	Confident	30 Å²	30	51.3 Å²	51.3	31%	0.309	29%	0.288	S	S	.	.	H	α-helix	trans	-63.4	-47.7	173.9	0	0	0	0	0	113.1	I740 I741 L742 M746 F747 I748	I740-G744 PolarHBondContact O-N 3.12Å; I741-G744 PolarHBondContact O-N 3.41Å; I741-G744 VanDerWaalsContact O-N 3.16Å; L742-G744 VanDerWaalsContact C-N 3.33Å; L742-G744 PolarHBondContact O-N 2.98Å; G744-M746 VanDerWaalsContact C-N 3.31Å; G744-M746 PolarHBondContact O-N 3.47Å; G744-F747 PolarHBondContact O-N 2.72Å; G744-I748 WeakPolarHBondContact O-CG1 3.44Å; G744-I748 PolarHBondContact O-N 2.67Å
745	V	90.4	Very high	86.9	Confident	21 Å²	21	53 Å²	53	13%	0.127	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-39.5	175.9	-179.7	0	0	0	0	111	V707 I741 L742 S749 V779 F782	V707-V745 HydrophobicContact CG1-CG1 3.92Å; I741-V745 WeakPolarHBondContact O-CG2 3.28Å; I741-V745 PolarHBondContact O-N 3.43Å; L742-V745 PolarHBondContact O-N 3.08Å; V745-S749 WeakPolarHBondContact O-CB 3.46Å; V745-S749 PolarHBondContact O-N 3.03Å; V745-S749 PolarHBondContact O-OG 3.43Å; V745-V779 HydrophobicContact CG1-CG1 3.44Å; V745-V779 VanDerWaalsContact CG1-CG1 3.44Å; V745-F782 HydrophobicContact CG2-CE1 4.49Å
746	M	88.4	Confident	85.6	Confident	45 Å²	45	55.9 Å²	55.9	22%	0.222	33%	0.331	C	S	.	.	H	α-helix	trans	-61.6	-46.1	173.7	-90.1	-55.4	-53.9	0	0	112.9	V707 A708 T711 L742 A743 G744 S749 A750	V707-M746 HydrophobicContact CB-SD 3.69Å; V707-M746 HydrophobicContact CG1-CG 3.93Å; V707-M746 HydrophobicContact CG1-SD 3.54Å; V707-M746 VanDerWaalsContact CG1-SD 3.54Å; A708-M746 WeakPolarHBondContact CA-SD 3.39Å; A708-M746 HydrophobicContact CB-CE 3.72Å; A708-M746 HydrophobicContact CB-SD 3.83Å; A708-M746 PolarHBondContact N-SD 3Å; T711-M746 WeakPolarHBondContact OG1-CG 3.48Å; L742-M746 VanDerWaalsContact O-CB 3.31Å; L742-M746 WeakPolarHBondContact O-CB 3.45Å; L742-M746 WeakPolarHBondContact O-CG 3.35Å; L742-M746 PolarHBondContact O-N 2.89Å; A743-M746 PolarHBondContact O-N 3.21Å; G744-M746 VanDerWaalsContact C-N 3.31Å; G744-M746 PolarHBondContact O-N 3.47Å; M746-S749 PolarHBondContact O-N 2.98Å; M746-A750 WeakPolarHBondContact O-CB 3.3Å; M746-A750 PolarHBondContact O-N 2.97Å
747	F	87.4	Confident	84.7	Confident	103 Å²	103	58 Å²	58	45%	0.452	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-48.8	178.4	177.6	-110.1	0	0	0	111.4	A743 G744 S749 A750 V751 F758 L762	A743-F747 WeakPolarHBondContact O-CB 3.46Å; A743-F747 PolarHBondContact O-N 2.85Å; G744-F747 PolarHBondContact O-N 2.72Å; F747-S749 PolarHBondContact O-N 3.03Å; F747-A750 PolarHBondContact O-N 3.21Å; F747-A750 VanDerWaalsContact O-N 3.11Å; F747-V751 HydrophobicContact CZ-CG2 4.47Å; F747-V751 WeakPolarHBondContact O-CG2 3.48Å; F747-V751 PolarHBondContact O-N 2.59Å; F747-F758 AromaticContact CE2-CE1 3.82Å; F747-F758 HydrophobicContact CE2-CE1 3.82Å; F747-F758 HydrophobicContact CE2-CZ 4.1Å; F747-F758 HydrophobicContact CZ-CD1 4.21Å; F747-F758 AromaticContact CZ-CE1 3.69Å; F747-F758 HydrophobicContact CZ-CE1 3.69Å; F747-F758 HydrophobicContact CZ-CZ 4.39Å; F747-L762 HydrophobicContact CE1-CD2 3.73Å; F747-L762 HydrophobicContact CZ-CD2 4.14Å
748	I	86.8	Confident	84.1	Confident	42 Å²	42	57 Å²	57	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-36.4	176.1	-65.1	164.1	0	0	0	111.2	G744 L762 L765 S766 I769	G744-I748 WeakPolarHBondContact O-CG1 3.44Å; G744-I748 PolarHBondContact O-N 2.67Å; I748-L762 HydrophobicContact CG1-CD1 4.24Å; I748-L765 HydrophobicContact CD1-CD2 4.23Å; I748-L765 HydrophobicContact CG2-CD2 4.28Å; I748-L765 HydrophobicContact CG2-CG 4.27Å; I748-S766 VanDerWaalsContact O-CB 3.31Å; I748-S766 WeakPolarHBondContact O-CB 3.39Å; I748-S766 PolarHBondContact O-OG 3.24Å; I748-I769 HydrophobicContact CG2-CD1 3.74Å
749	S	83.2	Confident	83.7	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.049	36%	0.355	C	S	.	.	H	α-helix	trans	-71.3	-35.4	176.4	-57	0	0	0	0	112.8	V745 M746 F747	V745-S749 WeakPolarHBondContact O-CB 3.46Å; V745-S749 PolarHBondContact O-N 3.03Å; V745-S749 PolarHBondContact O-OG 3.43Å; M746-S749 PolarHBondContact O-N 2.98Å; F747-S749 PolarHBondContact O-N 3.03Å
750	A	80.8	Confident	83.1	Confident	47 Å²	47	59.1 Å²	59.1	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-73.2	-29.4	179.1	0	0	0	0	0	113.3	M746 F747 Y752 C753	M746-A750 WeakPolarHBondContact O-CB 3.3Å; M746-A750 PolarHBondContact O-N 2.97Å; F747-A750 PolarHBondContact O-N 3.21Å; F747-A750 VanDerWaalsContact O-N 3.11Å; A750-Y752 PolarHBondContact O-N 3.03Å; A750-C753 WeakPolarHBondContact O-CB 3.44Å; A750-C753 PolarHBondContact O-N 2.98Å
751	V	83.7	Confident	82.6	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.006	36%	0.363	C	S	.	.	H	α-helix	trans	-54.9	-32.9	175.9	167.3	0	0	0	0	112.3	F747 C753 C754 F755 F758 L762	F747-V751 HydrophobicContact CZ-CG2 4.47Å; F747-V751 WeakPolarHBondContact O-CG2 3.48Å; F747-V751 PolarHBondContact O-N 2.59Å; V751-C753 VanDerWaalsContact C-N 3.27Å; V751-C753 PolarHBondContact O-N 2.98Å; V751-C754 CarbonylContact O-C 3.4Å; V751-C754 VanDerWaalsContact O-C 3.3Å; V751-C754 PolarHBondContact O-N 3.33Å; V751-F755 PolarHBondContact O-N 3.35Å; V751-F758 HydrophobicContact CB-CD2 4.27Å; V751-F758 HydrophobicContact CG1-CB 3.97Å; V751-F758 HydrophobicContact CG1-CD2 4.05Å; V751-F758 HydrophobicContact CG1-CG 4.15Å; V751-F758 HydrophobicContact CG2-CB 4.47Å; V751-F758 HydrophobicContact CG2-CD1 4.22Å; V751-F758 HydrophobicContact CG2-CD2 3.84Å; V751-F758 HydrophobicContact CG2-CE1 4.47Å; V751-F758 HydrophobicContact CG2-CE2 4.11Å; V751-F758 HydrophobicContact CG2-CG 3.9Å; V751-F758 HydrophobicContact CG2-CZ 4.41Å; V751-L762 HydrophobicContact CG1-CG 4.24Å; V751-L762 HydrophobicContact CG2-CD2 3.72Å; V751-L762 HydrophobicContact CG2-CG 4.03Å
752	Y	78.4	Confident	82	Confident	67 Å²	67	57.2 Å²	57.2	26%	0.263	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-57.7	-39.1	176.5	-172.1	-101.6	0	0	0	112.6	A750 C754 S766 V770	A750-Y752 PolarHBondContact O-N 3.03Å; Y752-C754 VanDerWaalsContact C-N 3.28Å; Y752-C754 PolarHBondContact O-N 3.23Å; Y752-S766 WeakPolarHBondContact CB-OG 3.33Å; Y752-S766 PolarHBondContact N-OG 3.27Å; Y752-S766 VanDerWaalsContact N-OG 3.13Å; Y752-V770 HydrophobicContact CD1-CB 4.5Å; Y752-V770 HydrophobicContact CD1-CG1 3.96Å; Y752-V770 HydrophobicContact CD1-CG2 4.43Å; Y752-V770 HydrophobicContact CD2-CB 3.84Å; Y752-V770 HydrophobicContact CD2-CG1 4.06Å; Y752-V770 HydrophobicContact CD2-CG2 4.03Å; Y752-V770 HydrophobicContact CE1-CG1 3.74Å; Y752-V770 HydrophobicContact CE2-CB 3.93Å; Y752-V770 HydrophobicContact CE2-CG1 3.85Å; Y752-V770 HydrophobicContact CG-CB 4.14Å; Y752-V770 HydrophobicContact CG-CG1 4.12Å; Y752-V770 HydrophobicContact CG-CG2 3.94Å
753	C	71.5	Confident	81.5	Confident	107 Å²	107	59.2 Å²	59.2	72%	0.723	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-74.1	-18.4	178.3	-59.1	0	0	0	0	113.2	A750 V751	A750-C753 WeakPolarHBondContact O-CB 3.44Å; A750-C753 PolarHBondContact O-N 2.98Å; V751-C753 VanDerWaalsContact C-N 3.27Å; V751-C753 PolarHBondContact O-N 2.98Å
754	C	73.6	Confident	81.2	Confident	56 Å²	56	61.8 Å²	61.8	38%	0.378	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-122.3	38	-173.4	-67.2	0	0	0	0	111.5	V751 Y752 G756 I757 F758	V751-C754 CarbonylContact O-C 3.4Å; V751-C754 VanDerWaalsContact O-C 3.3Å; V751-C754 PolarHBondContact O-N 3.33Å; Y752-C754 VanDerWaalsContact C-N 3.28Å; Y752-C754 PolarHBondContact O-N 3.23Å; C754-G756 PolarHBondContact O-N 3.41Å; C754-I757 HydrophobicContact CB-CD1 4.35Å; C754-I757 PolarHBondContact O-N 2.83Å; C754-F758 HydrophobicContact CB-CD2 4.16Å; C754-F758 HydrophobicContact CB-CE2 3.78Å
755	F	67.5	Low	80.9	Confident	86 Å²	86	64.4 Å²	64.4	38%	0.377	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-29	-166.3	-162.4	-94.5	0	0	0	115.2	V751 Q763 K767	V751-F755 PolarHBondContact O-N 3.35Å; F755-Q763 HydrophobicContact CD2-CB 4.3Å; F755-Q763 HydrophobicContact CD2-CG 4.47Å; F755-Q763 VanDerWaalsContact CE1-OE1 3.27Å; F755-Q763 HydrophobicContact CE2-CB 3.77Å; F755-Q763 HydrophobicContact CE2-CG 4.34Å; F755-Q763 HydrophobicContact CZ-CB 3.94Å; F755-Q763 HydrophobicContact CZ-CG 4.41Å; F755-Q763 VanDerWaalsContact O-CD 3.23Å; F755-Q763 PolarHBondContact O-NE2 3.01Å; F755-Q763 VanDerWaalsContact O-NE2 3.09Å; F755-K767 HydrophobicContact CE2-CB 4.33Å; F755-K767 HydrophobicContact CE2-CD 4.3Å; F755-K767 HydrophobicContact CZ-CD 4.39Å
756	G	66.5	Low	80.7	Confident	79 Å²	79	63.4 Å²	63.4	81%	0.814	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.1	-179.9	0	0	0	0	0	116.9	C754	C754-G756 PolarHBondContact O-N 3.41Å
757	I	74.9	Confident	80.5	Confident	135 Å²	135	65.6 Å²	65.6	69%	0.692	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-23.6	-170.5	-59.4	177.1	0	0	0	112.8	C754	C754-I757 HydrophobicContact CB-CD1 4.35Å; C754-I757 PolarHBondContact O-N 2.83Å
758	F	80.7	Confident	80.4	Confident	56 Å²	56	63.6 Å²	63.6	25%	0.246	38%	0.384	C	S	.	.	S	Bend	trans	-107.8	156.8	-167.7	-69.5	-76.6	0	0	0	113.2	F747 V751 C754 L762 Q763	F747-F758 AromaticContact CE2-CE1 3.82Å; F747-F758 HydrophobicContact CE2-CE1 3.82Å; F747-F758 HydrophobicContact CE2-CZ 4.1Å; F747-F758 HydrophobicContact CZ-CD1 4.21Å; F747-F758 AromaticContact CZ-CE1 3.69Å; F747-F758 HydrophobicContact CZ-CE1 3.69Å; F747-F758 HydrophobicContact CZ-CZ 4.39Å; V751-F758 HydrophobicContact CB-CD2 4.27Å; V751-F758 HydrophobicContact CG1-CB 3.97Å; V751-F758 HydrophobicContact CG1-CD2 4.05Å; V751-F758 HydrophobicContact CG1-CG 4.15Å; V751-F758 HydrophobicContact CG2-CB 4.47Å; V751-F758 HydrophobicContact CG2-CD1 4.22Å; V751-F758 HydrophobicContact CG2-CD2 3.84Å; V751-F758 HydrophobicContact CG2-CE1 4.47Å; V751-F758 HydrophobicContact CG2-CE2 4.11Å; V751-F758 HydrophobicContact CG2-CG 3.9Å; V751-F758 HydrophobicContact CG2-CZ 4.41Å; C754-F758 HydrophobicContact CB-CD2 4.16Å; C754-F758 HydrophobicContact CB-CE2 3.78Å; F758-L762 HydrophobicContact CB-CD2 4.28Å; F758-L762 HydrophobicContact CD1-CD2 4.09Å; F758-L762 HydrophobicContact CG-CD2 4.39Å; F758-Q763 WeakPolarHBondContact O-CG 3.36Å; F758-Q763 PolarHBondContact O-NE2 2.97Å
759	P	85.1	Confident	80.3	Confident	83 Å²	83	62.8 Å²	62.8	54%	0.539	38%	0.38	S	S	.	.			trans	-66.1	146.4	-178.8	26.5	-35.3	0	0	0	113.2	P761 L762 Q763	P759-P761 VanDerWaalsContact C-CD 3.5Å; P759-L762 HydrophobicContact CG-CB 4.33Å; P759-L762 WeakPolarHBondContact O-CB 3.32Å; P759-L762 PolarHBondContact O-N 3.49Å; P759-Q763 PolarHBondContact O-N 3.34Å; P759-Q763 VanDerWaalsContact O-N 3.13Å
760	A	82.3	Confident	80.3	Confident	59 Å²	59	62.7 Å²	62.7	49%	0.488	38%	0.379	S	S	.	.	H	α-helix	trans	-47.3	-42.6	-174.6	0	0	0	0	0	117.1	L762 Q763 T764	A760-L762 VanDerWaalsContact C-N 3.31Å; A760-L762 PolarHBondContact O-N 2.87Å; A760-Q763 PolarHBondContact O-N 3.28Å; A760-T764 WeakPolarHBondContact O-CB 3.48Å; A760-T764 PolarHBondContact O-N 3.36Å; A760-T764 PolarHBondContact O-OG1 3.12Å
761	P	84.4	Confident	80.3	Confident	100 Å²	100	64.7 Å²	64.7	65%	0.649	38%	0.38	S	S	*	.	H	α-helix	trans	-63.1	-35.8	176.1	22.6	-34.1	0	0	0	112.9	P759 T764 L765	P759-P761 VanDerWaalsContact C-CD 3.5Å; P761-T764 PolarHBondContact O-N 2.77Å; P761-L765 WeakPolarHBondContact O-CB 3.4Å; P761-L765 PolarHBondContact O-N 2.79Å
762	L	81.8	Confident	80.2	Confident	38 Å²	38	66.5 Å²	66.5	20%	0.199	39%	0.393	C	S	.	.	H	α-helix	trans	-73.7	-39.4	178.9	-166.8	66.9	0	0	0	111.3	F747 I748 V751 F758 P759 A760 T764 S766	F747-L762 HydrophobicContact CE1-CD2 3.73Å; F747-L762 HydrophobicContact CZ-CD2 4.14Å; I748-L762 HydrophobicContact CG1-CD1 4.24Å; V751-L762 HydrophobicContact CG1-CG 4.24Å; V751-L762 HydrophobicContact CG2-CD2 3.72Å; V751-L762 HydrophobicContact CG2-CG 4.03Å; F758-L762 HydrophobicContact CB-CD2 4.28Å; F758-L762 HydrophobicContact CD1-CD2 4.09Å; F758-L762 HydrophobicContact CG-CD2 4.39Å; P759-L762 HydrophobicContact CG-CB 4.33Å; P759-L762 WeakPolarHBondContact O-CB 3.32Å; P759-L762 PolarHBondContact O-N 3.49Å; A760-L762 VanDerWaalsContact C-N 3.31Å; A760-L762 PolarHBondContact O-N 2.87Å; L762-T764 VanDerWaalsContact C-N 3.31Å; L762-T764 PolarHBondContact O-N 2.85Å; L762-S766 VanDerWaalsContact O-CB 3.27Å; L762-S766 WeakPolarHBondContact O-CB 3.36Å; L762-S766 PolarHBondContact O-N 2.75Å
763	Q	82.2	Confident	80.4	Confident	43 Å²	43	64.8 Å²	64.8	20%	0.201	39%	0.386	C	S	.	.	H	α-helix	trans	-56.5	-46	168.9	-63.6	178.1	15.4	0	0	111.3	F755 F758 P759 A760 S766 K767	F755-Q763 HydrophobicContact CD2-CB 4.3Å; F755-Q763 HydrophobicContact CD2-CG 4.47Å; F755-Q763 VanDerWaalsContact CE1-OE1 3.27Å; F755-Q763 HydrophobicContact CE2-CB 3.77Å; F755-Q763 HydrophobicContact CE2-CG 4.34Å; F755-Q763 HydrophobicContact CZ-CB 3.94Å; F755-Q763 HydrophobicContact CZ-CG 4.41Å; F755-Q763 VanDerWaalsContact O-CD 3.23Å; F755-Q763 PolarHBondContact O-NE2 3.01Å; F755-Q763 VanDerWaalsContact O-NE2 3.09Å; F758-Q763 WeakPolarHBondContact O-CG 3.36Å; F758-Q763 PolarHBondContact O-NE2 2.97Å; P759-Q763 PolarHBondContact O-N 3.34Å; P759-Q763 VanDerWaalsContact O-N 3.13Å; A760-Q763 PolarHBondContact O-N 3.28Å; Q763-S766 PolarHBondContact O-N 3.12Å; Q763-K767 WeakPolarHBondContact O-CB 3.46Å; Q763-K767 PolarHBondContact O-N 2.91Å
764	T	84.9	Confident	80.9	Confident	93 Å²	93	64.9 Å²	64.9	57%	0.571	38%	0.379	S	S	*	.	H	α-helix	trans	-67.3	-43.6	-176.2	-57.5	0	0	0	0	111.6	A760 P761 L762 S768	A760-T764 WeakPolarHBondContact O-CB 3.48Å; A760-T764 PolarHBondContact O-N 3.36Å; A760-T764 PolarHBondContact O-OG1 3.12Å; P761-T764 PolarHBondContact O-N 2.77Å; L762-T764 VanDerWaalsContact C-N 3.31Å; L762-T764 PolarHBondContact O-N 2.85Å; T764-S768 VanDerWaalsContact O-CB 3.3Å; T764-S768 WeakPolarHBondContact O-CB 3.46Å; T764-S768 PolarHBondContact O-N 3.36Å
765	L	85.3	Confident	81.6	Confident	85 Å²	85	64.6 Å²	64.6	45%	0.445	37%	0.374	S	S	.	.	H	α-helix	trans	-60.1	-50.1	173.6	179.3	62.7	0	0	0	111.3	I748 P761 K767 S768 I769	I748-L765 HydrophobicContact CD1-CD2 4.23Å; I748-L765 HydrophobicContact CG2-CD2 4.28Å; I748-L765 HydrophobicContact CG2-CG 4.27Å; P761-L765 WeakPolarHBondContact O-CB 3.4Å; P761-L765 PolarHBondContact O-N 2.79Å; L765-K767 PolarHBondContact O-N 2.71Å; L765-S768 PolarHBondContact O-N 3.26Å; L765-I769 HydrophobicContact CD1-CD1 4.07Å; L765-I769 HydrophobicContact CG-CD1 4.07Å; L765-I769 WeakPolarHBondContact O-CG1 3.43Å; L765-I769 PolarHBondContact O-N 3.33Å
766	S	86	Confident	82.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-59.5	-46.7	179.2	-170.2	0	0	0	0	112	I748 Y752 L762 Q763 S768 I769 V770	I748-S766 VanDerWaalsContact O-CB 3.31Å; I748-S766 WeakPolarHBondContact O-CB 3.39Å; I748-S766 PolarHBondContact O-OG 3.24Å; Y752-S766 WeakPolarHBondContact CB-OG 3.33Å; Y752-S766 PolarHBondContact N-OG 3.27Å; Y752-S766 VanDerWaalsContact N-OG 3.13Å; L762-S766 VanDerWaalsContact O-CB 3.27Å; L762-S766 WeakPolarHBondContact O-CB 3.36Å; L762-S766 PolarHBondContact O-N 2.75Å; Q763-S766 PolarHBondContact O-N 3.12Å; S766-S768 PolarHBondContact O-N 2.85Å; S766-I769 PolarHBondContact O-N 3.33Å; S766-V770 WeakPolarHBondContact O-CG2 3.21Å; S766-V770 PolarHBondContact O-N 3.49Å
767	K	84	Confident	83.5	Confident	90 Å²	90	58.6 Å²	58.6	39%	0.391	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-43.4	175.5	-177.1	173.6	178.3	178.7	0	112.4	F755 Q763 L765 I769 V770 Q771	F755-K767 HydrophobicContact CE2-CB 4.33Å; F755-K767 HydrophobicContact CE2-CD 4.3Å; F755-K767 HydrophobicContact CZ-CD 4.39Å; Q763-K767 WeakPolarHBondContact O-CB 3.46Å; Q763-K767 PolarHBondContact O-N 2.91Å; L765-K767 PolarHBondContact O-N 2.71Å; K767-I769 VanDerWaalsContact C-N 3.31Å; K767-I769 PolarHBondContact O-N 2.93Å; K767-V770 PolarHBondContact O-N 3.31Å; K767-Q771 HydrophobicContact CG-CG 4.07Å; K767-Q771 VanDerWaalsContact O-CB 3.31Å; K767-Q771 WeakPolarHBondContact O-CB 3.3Å; K767-Q771 WeakPolarHBondContact O-CG 3.37Å; K767-Q771 PolarHBondContact O-N 2.97Å
768	S	85	Confident	84.2	Confident	61 Å²	61	57.3 Å²	57.3	43%	0.427	32%	0.322	S	S	.	.	H	α-helix	trans	-63.2	-35	176.9	-175	0	0	0	0	112.8	T764 L765 S766 S772 N775	T764-S768 VanDerWaalsContact O-CB 3.3Å; T764-S768 WeakPolarHBondContact O-CB 3.46Å; T764-S768 PolarHBondContact O-N 3.36Å; L765-S768 PolarHBondContact O-N 3.26Å; S766-S768 PolarHBondContact O-N 2.85Å; S768-S772 WeakPolarHBondContact O-CB 3.43Å; S768-N775 PolarHBondContact O-ND2 3.39Å
769	I	84.8	Confident	84.7	Confident	25 Å²	25	56.1 Å²	56.1	13%	0.128	32%	0.319	C	S	.	.	H	α-helix	trans	-71.8	-47.1	175.8	-67.5	163.3	0	0	0	111.1	F703 I748 L765 S766 K767 S776 V779	F703-I769 HydrophobicContact CE1-CG2 4.06Å; I748-I769 HydrophobicContact CG2-CD1 3.74Å; L765-I769 HydrophobicContact CD1-CD1 4.07Å; L765-I769 HydrophobicContact CG-CD1 4.07Å; L765-I769 WeakPolarHBondContact O-CG1 3.43Å; L765-I769 PolarHBondContact O-N 3.33Å; S766-I769 PolarHBondContact O-N 3.33Å; K767-I769 VanDerWaalsContact C-N 3.31Å; K767-I769 PolarHBondContact O-N 2.93Å; I769-S776 WeakPolarHBondContact O-CB 3.46Å; I769-S776 PolarHBondContact O-N 3.19Å; I769-V779 HydrophobicContact CG2-CB 4.46Å; I769-V779 HydrophobicContact CG2-CG2 4.06Å
770	V	82.6	Confident	85	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.03	29%	0.294	C	S	.	.	H	α-helix	trans	-78.2	-36.1	-173.3	177.8	0	0	0	0	113.2	V699 F703 Y752 S766 K767	V699-V770 HydrophobicContact CG1-CG1 4.14Å; F703-V770 HydrophobicContact CD1-CG2 4.49Å; Y752-V770 HydrophobicContact CD1-CB 4.5Å; Y752-V770 HydrophobicContact CD1-CG1 3.96Å; Y752-V770 HydrophobicContact CD1-CG2 4.43Å; Y752-V770 HydrophobicContact CD2-CB 3.84Å; Y752-V770 HydrophobicContact CD2-CG1 4.06Å; Y752-V770 HydrophobicContact CD2-CG2 4.03Å; Y752-V770 HydrophobicContact CE1-CG1 3.74Å; Y752-V770 HydrophobicContact CE2-CB 3.93Å; Y752-V770 HydrophobicContact CE2-CG1 3.85Å; Y752-V770 HydrophobicContact CG-CB 4.14Å; Y752-V770 HydrophobicContact CG-CG1 4.12Å; Y752-V770 HydrophobicContact CG-CG2 3.94Å; S766-V770 WeakPolarHBondContact O-CG2 3.21Å; S766-V770 PolarHBondContact O-N 3.49Å; K767-V770 PolarHBondContact O-N 3.31Å
771	Q	80.9	Confident	85.5	Confident	90 Å²	90	51.5 Å²	51.5	42%	0.421	28%	0.284	S	S	.	.	H	α-helix	trans	-77.7	-22.4	-179.4	-67.7	-166.8	-56.1	0	0	114.1	V699 K767	V699-Q771 HydrophobicContact CG2-CB 4.48Å; V699-Q771 HydrophobicContact CG2-CG 4.43Å; K767-Q771 HydrophobicContact CG-CG 4.07Å; K767-Q771 VanDerWaalsContact O-CB 3.31Å; K767-Q771 WeakPolarHBondContact O-CB 3.3Å; K767-Q771 WeakPolarHBondContact O-CG 3.37Å; K767-Q771 PolarHBondContact O-N 2.97Å
772	S	81.9	Confident	85.9	Confident	39 Å²	39	51.8 Å²	51.8	27%	0.273	28%	0.275	S	S	.	.			trans	-99.9	112	176.3	172.8	0	0	0	0	110.3	S768 L774 N775 S776	S768-S772 WeakPolarHBondContact O-CB 3.43Å; S772-L774 PolarHBondContact O-N 3.47Å; S772-N775 WeakPolarHBondContact CB-ND2 3.5Å; S772-N775 PolarHBondContact O-N 2.99Å; S772-N775 VanDerWaalsContact OG-CG 3.31Å; S772-N775 PolarHBondContact OG-N 3.48Å; S772-N775 PolarHBondContact OG-OD1 3.34Å; S772-S776 PolarHBondContact O-N 3.32Å; S772-S776 PolarHBondContact O-OG 3.37Å
773	R	82.5	Confident	86.4	Confident	30 Å²	30	50 Å²	50	11%	0.113	27%	0.266	C	S	.	.	H	α-helix	trans	-56.9	-32.8	175.2	-172.2	174.5	-179.1	179	1	112.7	Y695 S776 T777 Q866	Y695-R773 VanDerWaalsContact CD1-NH1 3.31Å; Y695-R773 PolarHBondContact O-NH1 3.31Å; Y695-R773 PolarHBondContact OH-NH2 3.47Å; Y695-R773 VanDerWaalsContact OH-NH2 3.12Å; R773-S776 WeakPolarHBondContact CA-OG 3.34Å; R773-S776 PolarHBondContact O-OG 3.14Å; R773-T777 HydrophobicContact CG-CG2 4.28Å; R773-T777 WeakPolarHBondContact O-CB 3.37Å; R773-T777 WeakPolarHBondContact O-CG2 3.44Å; R773-T777 PolarHBondContact O-N 2.97Å; R773-T777 PolarHBondContact O-OG1 3.08Å; R773-T777 VanDerWaalsContact O-OG1 3.13Å; R773-Q866 PolarHBondContact NE-O 3.17Å; R773-Q866 PolarHBondContact NH2-O 3.47Å
774	L	83.1	Confident	86.9	Confident	110 Å²	110	48.2 Å²	48.2	58%	0.576	26%	0.258	S	S	*	.	H	α-helix	trans	-65.5	-46.5	175	-170.3	151.3	0	0	0	110.4	S772 T777 L778	S772-L774 PolarHBondContact O-N 3.47Å; L774-T777 PolarHBondContact O-N 2.81Å; L774-T777 PolarHBondContact O-OG1 3.47Å; L774-L778 HydrophobicContact CD2-CD1 3.64Å; L774-L778 HydrophobicContact CD2-CG 4.24Å; L774-L778 WeakPolarHBondContact O-CG 3.39Å; L774-L778 PolarHBondContact O-N 3.44Å
775	N	86.6	Confident	87.4	Confident	50 Å²	50	46.3 Å²	46.3	27%	0.267	24%	0.243	S	C	.	.	H	α-helix	trans	-65.6	-44.6	-179.4	-60.9	-4.6	0	0	0	111.5	S768 S772 T777 L778 V779	S768-N775 PolarHBondContact O-ND2 3.39Å; S772-N775 WeakPolarHBondContact CB-ND2 3.5Å; S772-N775 PolarHBondContact O-N 2.99Å; S772-N775 VanDerWaalsContact OG-CG 3.31Å; S772-N775 PolarHBondContact OG-N 3.48Å; S772-N775 PolarHBondContact OG-OD1 3.34Å; N775-T777 PolarHBondContact O-N 3.31Å; N775-L778 PolarHBondContact O-N 3.44Å; N775-V779 WeakPolarHBondContact O-CG2 3.49Å; N775-V779 PolarHBondContact O-N 2.94Å
776	S	87.4	Confident	87.8	Confident	5 Å²	5	42.9 Å²	42.9	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-38.9	176.4	66.7	0	0	0	0	112.3	F703 I769 S772 R773 V779 G780	F703-S776 WeakPolarHBondContact CE2-O 3.23Å; F703-S776 WeakPolarHBondContact CZ-O 3.37Å; I769-S776 WeakPolarHBondContact O-CB 3.46Å; I769-S776 PolarHBondContact O-N 3.19Å; S772-S776 PolarHBondContact O-N 3.32Å; S772-S776 PolarHBondContact O-OG 3.37Å; R773-S776 WeakPolarHBondContact CA-OG 3.34Å; R773-S776 PolarHBondContact O-OG 3.14Å; S776-V779 PolarHBondContact O-N 2.83Å; S776-G780 PolarHBondContact O-N 3.43Å
777	T	88.1	Confident	88.2	Confident	34 Å²	34	42.9 Å²	42.9	21%	0.209	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-41.5	174.4	62.7	0	0	0	0	112.4	R773 L774 N775 G780 V781 V867	R773-T777 HydrophobicContact CG-CG2 4.28Å; R773-T777 WeakPolarHBondContact O-CB 3.37Å; R773-T777 WeakPolarHBondContact O-CG2 3.44Å; R773-T777 PolarHBondContact O-N 2.97Å; R773-T777 PolarHBondContact O-OG1 3.08Å; R773-T777 VanDerWaalsContact O-OG1 3.13Å; L774-T777 PolarHBondContact O-N 2.81Å; L774-T777 PolarHBondContact O-OG1 3.47Å; N775-T777 PolarHBondContact O-N 3.31Å; T777-G780 PolarHBondContact O-N 2.95Å; T777-V781 VanDerWaalsContact O-CG2 3.28Å; T777-V781 WeakPolarHBondContact O-CG2 3.4Å; T777-V781 PolarHBondContact O-N 3.49Å; T777-V867 HydrophobicContact CG2-CB 4.44Å; T777-V867 HydrophobicContact CG2-CG1 4.5Å; T777-V867 HydrophobicContact CG2-CG2 3.93Å
778	L	89.8	Confident	88.6	Confident	107 Å²	107	38.6 Å²	38.6	56%	0.56	21%	0.207	S	C	*	.	H	α-helix	trans	-62.8	-45.4	176.2	-71.9	176.8	0	0	0	112.1	L774 N775 G780 V781 F782	L774-L778 HydrophobicContact CD2-CD1 3.64Å; L774-L778 HydrophobicContact CD2-CG 4.24Å; L774-L778 WeakPolarHBondContact O-CG 3.39Å; L774-L778 PolarHBondContact O-N 3.44Å; N775-L778 PolarHBondContact O-N 3.44Å; L778-G780 VanDerWaalsContact C-N 3.33Å; L778-G780 PolarHBondContact O-N 3.3Å; L778-V781 PolarHBondContact O-N 3.42Å; L778-F782 WeakPolarHBondContact O-CB 3.01Å; L778-F782 PolarHBondContact O-N 3.35Å
779	V	90.7	Very high	89	Confident	31 Å²	31	38.6 Å²	38.6	19%	0.188	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-37.3	177.3	174.7	0	0	0	0	111.3	F703 V745 I769 N775 S776 T783	F703-V779 HydrophobicContact CE1-CB 4.5Å; F703-V779 HydrophobicContact CE1-CG1 4.16Å; F703-V779 HydrophobicContact CZ-CB 3.98Å; F703-V779 HydrophobicContact CZ-CG1 3.88Å; V745-V779 HydrophobicContact CG1-CG1 3.44Å; V745-V779 VanDerWaalsContact CG1-CG1 3.44Å; I769-V779 HydrophobicContact CG2-CB 4.46Å; I769-V779 HydrophobicContact CG2-CG2 4.06Å; N775-V779 WeakPolarHBondContact O-CG2 3.49Å; N775-V779 PolarHBondContact O-N 2.94Å; S776-V779 PolarHBondContact O-N 2.83Å; V779-T783 WeakPolarHBondContact O-CB 3.25Å; V779-T783 PolarHBondContact O-N 3.32Å; V779-T783 PolarHBondContact O-OG1 2.95Å
780	G	90.6	Very high	89.4	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-46.4	173.2	0	0	0	0	0	112.9	S776 T777 L778 T783 I784	S776-G780 PolarHBondContact O-N 3.43Å; T777-G780 PolarHBondContact O-N 2.95Å; L778-G780 VanDerWaalsContact C-N 3.33Å; L778-G780 PolarHBondContact O-N 3.3Å; G780-T783 WeakPolarHBondContact O-CB 3.5Å; G780-T783 PolarHBondContact O-N 3Å; G780-I784 WeakPolarHBondContact O-CG1 3.43Å; G780-I784 PolarHBondContact O-N 3.18Å
781	V	92.5	Very high	89.8	Confident	45 Å²	45	37.2 Å²	37.2	27%	0.273	19%	0.194	S	C	.	.	H	α-helix	trans	-60.7	-45.9	175.6	170.5	0	0	0	0	111.1	T777 L778 T783 I784 I785 L875	T777-V781 VanDerWaalsContact O-CG2 3.28Å; T777-V781 WeakPolarHBondContact O-CG2 3.4Å; T777-V781 PolarHBondContact O-N 3.49Å; L778-V781 PolarHBondContact O-N 3.42Å; V781-T783 VanDerWaalsContact C-N 3.34Å; V781-T783 PolarHBondContact O-N 2.98Å; V781-I784 PolarHBondContact O-N 3.35Å; V781-I785 HydrophobicContact CG1-CD1 3.8Å; V781-I785 WeakPolarHBondContact O-CG1 3.43Å; V781-I785 PolarHBondContact O-N 3.37Å; V781-L875 HydrophobicContact CG1-CD1 4.24Å; V781-L875 HydrophobicContact CG1-CD2 4.43Å; V781-L875 HydrophobicContact CG2-CD2 4.27Å
782	F	92.8	Very high	90.1	Very high	106 Å²	106	33.3 Å²	33.3	47%	0.465	18%	0.176	S	C	.	.	H	α-helix	trans	-59.6	-43.2	175.6	178.3	-108.8	0	0	0	112.2	I741 V745 L778 I785 I786	I741-F782 HydrophobicContact CG2-CE1 3.83Å; I741-F782 HydrophobicContact CG2-CZ 4.1Å; V745-F782 HydrophobicContact CG2-CE1 4.49Å; L778-F782 WeakPolarHBondContact O-CB 3.01Å; L778-F782 PolarHBondContact O-N 3.35Å; F782-I785 PolarHBondContact O-N 2.93Å; F782-I786 HydrophobicContact CD1-CD1 3.99Å; F782-I786 HydrophobicContact CE1-CD1 3.59Å; F782-I786 HydrophobicContact CE2-CD1 4.28Å; F782-I786 HydrophobicContact CZ-CD1 3.75Å; F782-I786 WeakPolarHBondContact O-CG1 3.37Å; F782-I786 PolarHBondContact O-N 3.19Å; F782-I786 VanDerWaalsContact O-N 3.17Å
783	T	92.8	Very high	90.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.4	-49.9	174.9	-56.9	0	0	0	0	111	V707 A710 L742 V779 G780 V781 I785 I786 V787 F864	V707-T783 HydrophobicContact CG1-CG2 4.21Å; A710-T783 HydrophobicContact CB-CG2 3.78Å; L742-T783 HydrophobicContact CD2-CG2 3.75Å; V779-T783 WeakPolarHBondContact O-CB 3.25Å; V779-T783 PolarHBondContact O-N 3.32Å; V779-T783 PolarHBondContact O-OG1 2.95Å; G780-T783 WeakPolarHBondContact O-CB 3.5Å; G780-T783 PolarHBondContact O-N 3Å; V781-T783 VanDerWaalsContact C-N 3.34Å; V781-T783 PolarHBondContact O-N 2.98Å; T783-I785 VanDerWaalsContact C-N 3.35Å; T783-I785 PolarHBondContact O-N 3.38Å; T783-I786 PolarHBondContact O-N 3.06Å; T783-V787 WeakPolarHBondContact O-CG2 3.28Å; T783-V787 PolarHBondContact O-N 2.95Å; T783-F864 HydrophobicContact CG2-CZ 4.48Å
784	I	93.6	Very high	90.5	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-61.1	-42.1	179.2	-67.1	161.9	0	0	0	111.4	G780 V781 I786 V787 F788 C861 F864 L875 I879	G780-I784 WeakPolarHBondContact O-CG1 3.43Å; G780-I784 PolarHBondContact O-N 3.18Å; V781-I784 PolarHBondContact O-N 3.35Å; I784-I786 VanDerWaalsContact C-N 3.3Å; I784-I786 PolarHBondContact O-N 3.46Å; I784-V787 PolarHBondContact O-N 3.08Å; I784-V787 VanDerWaalsContact O-N 3.17Å; I784-F788 PolarHBondContact O-N 2.78Å; I784-C861 HydrophobicContact CD1-CB 4.48Å; I784-C861 VanDerWaalsContact CG2-SG 3.59Å; I784-F864 HydrophobicContact CD1-CD2 3.77Å; I784-F864 HydrophobicContact CD1-CE2 3.93Å; I784-F864 HydrophobicContact CG1-CD2 4.16Å; I784-F864 HydrophobicContact CG1-CE2 3.8Å; I784-L875 HydrophobicContact CB-CD2 4.11Å; I784-L875 HydrophobicContact CD1-CD2 3.71Å; I784-L875 HydrophobicContact CG2-CD2 3.83Å; I784-L875 HydrophobicContact CG2-CG 4.4Å; I784-I879 HydrophobicContact CG2-CD1 4.02Å
785	I	93.6	Very high	90.8	Very high	53 Å²	53	26.3 Å²	26.3	27%	0.272	14%	0.138	S	C	.	.	H	α-helix	trans	-60.9	-39.2	178.9	-70.7	167.5	0	0	0	111	V781 F782 T783 F788 L789 L875	V781-I785 HydrophobicContact CG1-CD1 3.8Å; V781-I785 WeakPolarHBondContact O-CG1 3.43Å; V781-I785 PolarHBondContact O-N 3.37Å; F782-I785 PolarHBondContact O-N 2.93Å; T783-I785 VanDerWaalsContact C-N 3.35Å; T783-I785 PolarHBondContact O-N 3.38Å; I785-F788 PolarHBondContact O-N 3.3Å; I785-L789 HydrophobicContact CG2-CD1 3.94Å; I785-L789 HydrophobicContact CG2-CG 4.32Å; I785-L789 WeakPolarHBondContact O-CB 3.36Å; I785-L789 VanDerWaalsContact O-CG 3.25Å; I785-L789 WeakPolarHBondContact O-CG 3.47Å; I785-L789 PolarHBondContact O-N 3.38Å; I785-L875 HydrophobicContact CD1-CD1 4.41Å; I785-L875 HydrophobicContact CG1-CD1 4.07Å
786	I	93.8	Very high	90.7	Very high	12 Å²	12	28.8 Å²	28.8	6%	0.062	15%	0.146	C	C	.	.	H	α-helix	trans	-63.8	-44.6	175	-66	164.9	0	0	0	111.3	C738 I741 L742 F782 T783 I784 F788 L789 S790	C738-I786 HydrophobicContact CB-CG2 3.78Å; I741-I786 HydrophobicContact CB-CD1 4.34Å; I741-I786 HydrophobicContact CG2-CD1 3.54Å; L742-I786 HydrophobicContact CD1-CG2 4.04Å; L742-I786 HydrophobicContact CD2-CB 4.35Å; L742-I786 HydrophobicContact CD2-CD1 4.49Å; L742-I786 HydrophobicContact CD2-CG2 4.16Å; L742-I786 HydrophobicContact CG-CG2 3.98Å; F782-I786 HydrophobicContact CD1-CD1 3.99Å; F782-I786 HydrophobicContact CE1-CD1 3.59Å; F782-I786 HydrophobicContact CE2-CD1 4.28Å; F782-I786 HydrophobicContact CZ-CD1 3.75Å; F782-I786 WeakPolarHBondContact O-CG1 3.37Å; F782-I786 PolarHBondContact O-N 3.19Å; F782-I786 VanDerWaalsContact O-N 3.17Å; T783-I786 PolarHBondContact O-N 3.06Å; I784-I786 VanDerWaalsContact C-N 3.3Å; I784-I786 PolarHBondContact O-N 3.46Å; I786-F788 VanDerWaalsContact C-N 3.31Å; I786-F788 PolarHBondContact O-N 3.45Å; I786-L789 PolarHBondContact O-N 3.23Å; I786-S790 PolarHBondContact O-N 3.12Å; I786-S790 VanDerWaalsContact O-N 3.07Å
787	V	94.4	Very high	90.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-37.1	177.2	-178.6	0	0	0	0	111.5	A710 V713 F714 I717 T783 I784 S790 A791	A710-V787 HydrophobicContact CB-CG2 4.47Å; V713-V787 HydrophobicContact CG1-CG1 4.05Å; F714-V787 HydrophobicContact CB-CG2 4.24Å; I717-V787 HydrophobicContact CD1-CG1 3.77Å; T783-V787 WeakPolarHBondContact O-CG2 3.28Å; T783-V787 PolarHBondContact O-N 2.95Å; I784-V787 PolarHBondContact O-N 3.08Å; I784-V787 VanDerWaalsContact O-N 3.17Å; V787-S790 PolarHBondContact O-OG 2.92Å; V787-S790 VanDerWaalsContact O-OG 3.1Å; V787-A791 PolarHBondContact O-N 3.29Å
788	F	94.1	Very high	90.3	Very high	1 Å²	1	28.3 Å²	28.3	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-70.1	-45.2	174.9	169.1	-122	0	0	0	112.2	I784 I785 I786 S790 A791 F792 V854 I879 L882	I784-F788 PolarHBondContact O-N 2.78Å; I785-F788 PolarHBondContact O-N 3.3Å; I786-F788 VanDerWaalsContact C-N 3.31Å; I786-F788 PolarHBondContact O-N 3.45Å; F788-S790 VanDerWaalsContact C-N 3.28Å; F788-S790 PolarHBondContact O-N 3.17Å; F788-A791 VanDerWaalsContact O-CB 3.23Å; F788-A791 WeakPolarHBondContact O-CB 3.25Å; F788-A791 PolarHBondContact O-N 3.18Å; F788-F792 AromaticContact CD1-CE1 3.92Å; F788-F792 HydrophobicContact CD1-CE1 3.92Å; F788-F792 HydrophobicContact CD2-CD1 4.06Å; F788-F792 HydrophobicContact CD2-CE1 4.25Å; F788-F792 HydrophobicContact CE1-CD1 4.16Å; F788-F792 AromaticContact CE1-CE1 3.49Å; F788-F792 HydrophobicContact CE1-CE1 3.49Å; F788-F792 VanDerWaalsContact CE1-CE1 3.49Å; F788-F792 HydrophobicContact CE1-CZ 4.35Å; F788-F792 AromaticContact CE2-CD1 3.61Å; F788-F792 HydrophobicContact CE2-CD1 3.61Å; F788-F792 AromaticContact CE2-CE1 3.83Å; F788-F792 HydrophobicContact CE2-CE1 3.83Å; F788-F792 HydrophobicContact CG-CD1 4.5Å; F788-F792 HydrophobicContact CG-CE1 4.29Å; F788-F792 AromaticContact CZ-CD1 3.68Å; F788-F792 HydrophobicContact CZ-CD1 3.68Å; F788-F792 AromaticContact CZ-CE1 3.44Å; F788-F792 HydrophobicContact CZ-CE1 3.44Å; F788-F792 VanDerWaalsContact CZ-CE1 3.44Å; F788-F792 HydrophobicContact CZ-CZ 4.4Å; F788-F792 VanDerWaalsContact O-CD1 3.24Å; F788-F792 WeakPolarHBondContact O-CD1 3.46Å; F788-V854 HydrophobicContact CD2-CG1 4.48Å; F788-V854 HydrophobicContact CD2-CG2 4.41Å; F788-V854 HydrophobicContact CE2-CG1 4.16Å; F788-V854 HydrophobicContact CE2-CG2 4.08Å; F788-I879 HydrophobicContact CB-CD1 4.33Å; F788-I879 HydrophobicContact CB-CG1 4.32Å; F788-I879 HydrophobicContact CD1-CG1 3.82Å; F788-I879 HydrophobicContact CD2-CB 4.47Å; F788-I879 HydrophobicContact CD2-CG1 4.29Å; F788-I879 HydrophobicContact CD2-CG2 3.68Å; F788-I879 HydrophobicContact CE1-CB 4.46Å; F788-I879 HydrophobicContact CE1-CG1 4.17Å; F788-I879 HydrophobicContact CE2-CB 4.44Å; F788-I879 HydrophobicContact CE2-CG2 3.67Å; F788-I879 HydrophobicContact CG-CD1 4.39Å; F788-I879 HydrophobicContact CG-CG1 3.87Å; F788-I879 HydrophobicContact CG-CG2 4.15Å; F788-I879 HydrophobicContact CZ-CB 4.42Å; F788-I879 HydrophobicContact CZ-CG2 4.09Å; F788-I879 WeakPolarHBondContact CZ-O 3.49Å; F788-L882 HydrophobicContact CE1-CB 4.42Å; F788-L882 HydrophobicContact CE1-CD2 4.04Å; F788-L882 HydrophobicContact CE1-CG 4.3Å; F788-L882 HydrophobicContact CZ-CB 4.47Å
789	L	92.9	Very high	89.9	Confident	61 Å²	61	24.6 Å²	24.6	32%	0.319	13%	0.127	S	C	.	.	H	α-helix	trans	-58.4	-41.3	177.5	-71.3	168.1	0	0	0	111.5	F734 I785 I786 A791 F792 I793	F734-L789 HydrophobicContact CE1-CB 4.22Å; F734-L789 HydrophobicContact CZ-CB 3.86Å; I785-L789 HydrophobicContact CG2-CD1 3.94Å; I785-L789 HydrophobicContact CG2-CG 4.32Å; I785-L789 WeakPolarHBondContact O-CB 3.36Å; I785-L789 VanDerWaalsContact O-CG 3.25Å; I785-L789 WeakPolarHBondContact O-CG 3.47Å; I785-L789 PolarHBondContact O-N 3.38Å; I786-L789 PolarHBondContact O-N 3.23Å; L789-A791 PolarHBondContact O-N 2.92Å; L789-F792 HydrophobicContact CD2-CE1 3.99Å; L789-F792 HydrophobicContact CD2-CZ 3.79Å; L789-F792 PolarHBondContact O-N 3.48Å; L789-I793 WeakPolarHBondContact O-CB 3.26Å; L789-I793 PolarHBondContact O-N 2.9Å; L789-I793 VanDerWaalsContact O-N 3.08Å
790	S	92.1	Very high	89.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.3	-18.6	176	76.7	0	0	0	0	113.8	F714 Q721 I786 V787 F788	F714-S790 WeakPolarHBondContact CD2-OG 3.48Å; Q721-S790 PolarHBondContact NE2-O 3.11Å; I786-S790 PolarHBondContact O-N 3.12Å; I786-S790 VanDerWaalsContact O-N 3.07Å; V787-S790 PolarHBondContact O-OG 2.92Å; V787-S790 VanDerWaalsContact O-OG 3.1Å; F788-S790 VanDerWaalsContact C-N 3.28Å; F788-S790 PolarHBondContact O-N 3.17Å
791	A	91.6	Very high	88.7	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-74.1	-25.2	178.8	0	0	0	0	0	114.1	I717 V787 F788 L789 C853 V854	I717-A791 HydrophobicContact CD1-CB 4.36Å; I717-A791 HydrophobicContact CG2-CB 4.26Å; V787-A791 PolarHBondContact O-N 3.29Å; F788-A791 VanDerWaalsContact O-CB 3.23Å; F788-A791 WeakPolarHBondContact O-CB 3.25Å; F788-A791 PolarHBondContact O-N 3.18Å; L789-A791 PolarHBondContact O-N 2.92Å; A791-C853 HydrophobicContact CB-CB 3.89Å; A791-V854 HydrophobicContact CB-CG2 4.1Å
792	F	87	Confident	88.2	Confident	9 Å²	9	30.2 Å²	30.2	4%	0.039	15%	0.154	C	C	.	.	H	α-helix	trans	-127	-15.5	-176.8	75.7	-93.1	0	0	0	115.9	F788 L789 N794 I795 F796 Y883 I886	F788-F792 AromaticContact CD1-CE1 3.92Å; F788-F792 HydrophobicContact CD1-CE1 3.92Å; F788-F792 HydrophobicContact CD2-CD1 4.06Å; F788-F792 HydrophobicContact CD2-CE1 4.25Å; F788-F792 HydrophobicContact CE1-CD1 4.16Å; F788-F792 AromaticContact CE1-CE1 3.49Å; F788-F792 HydrophobicContact CE1-CE1 3.49Å; F788-F792 VanDerWaalsContact CE1-CE1 3.49Å; F788-F792 HydrophobicContact CE1-CZ 4.35Å; F788-F792 AromaticContact CE2-CD1 3.61Å; F788-F792 HydrophobicContact CE2-CD1 3.61Å; F788-F792 AromaticContact CE2-CE1 3.83Å; F788-F792 HydrophobicContact CE2-CE1 3.83Å; F788-F792 HydrophobicContact CG-CD1 4.5Å; F788-F792 HydrophobicContact CG-CE1 4.29Å; F788-F792 AromaticContact CZ-CD1 3.68Å; F788-F792 HydrophobicContact CZ-CD1 3.68Å; F788-F792 AromaticContact CZ-CE1 3.44Å; F788-F792 HydrophobicContact CZ-CE1 3.44Å; F788-F792 VanDerWaalsContact CZ-CE1 3.44Å; F788-F792 HydrophobicContact CZ-CZ 4.4Å; F788-F792 VanDerWaalsContact O-CD1 3.24Å; F788-F792 WeakPolarHBondContact O-CD1 3.46Å; L789-F792 HydrophobicContact CD2-CE1 3.99Å; L789-F792 HydrophobicContact CD2-CZ 3.79Å; L789-F792 PolarHBondContact O-N 3.48Å; F792-N794 PolarHBondContact O-N 3.32Å; F792-I795 WeakPolarHBondContact O-CB 3.42Å; F792-I795 WeakPolarHBondContact O-CG2 3.24Å; F792-I795 PolarHBondContact O-N 2.97Å; F792-F796 HydrophobicContact CD2-CE2 4.15Å; F792-F796 AromaticContact CE2-CE2 3.93Å; F792-F796 HydrophobicContact CE2-CE2 3.93Å; F792-F796 HydrophobicContact CE2-CZ 4.41Å; F792-Y883 HydrophobicContact CB-CD2 4.41Å; F792-I886 HydrophobicContact CD2-CD1 3.91Å; F792-I886 HydrophobicContact CE2-CD1 3.41Å; F792-I886 VanDerWaalsContact CE2-CD1 3.41Å; F792-I886 HydrophobicContact CZ-CD1 4.01Å
793	I	87.8	Confident	87.6	Confident	30 Å²	30	25.7 Å²	25.7	15%	0.154	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-50.1	-34	-173.4	-169.3	64.7	0	0	0	114.4	F734 L789 I795 F796	F734-I793 HydrophobicContact CD1-CB 4.28Å; F734-I793 HydrophobicContact CD1-CG1 4.27Å; F734-I793 HydrophobicContact CD1-CG2 3.65Å; F734-I793 HydrophobicContact CD2-CG1 4.1Å; F734-I793 HydrophobicContact CE1-CB 4.28Å; F734-I793 HydrophobicContact CE1-CG1 4.44Å; F734-I793 HydrophobicContact CE1-CG2 3.99Å; F734-I793 HydrophobicContact CE2-CD1 4.45Å; F734-I793 HydrophobicContact CE2-CG1 4.29Å; F734-I793 HydrophobicContact CG-CG1 4.09Å; F734-I793 HydrophobicContact CG-CG2 4.13Å; F734-I793 HydrophobicContact CZ-CG1 4.47Å; L789-I793 WeakPolarHBondContact O-CB 3.26Å; L789-I793 PolarHBondContact O-N 2.9Å; L789-I793 VanDerWaalsContact O-N 3.08Å; I793-I795 PolarHBondContact O-N 2.92Å; I793-F796 HydrophobicContact CD1-CD2 4.24Å; I793-F796 WeakPolarHBondContact O-CD2 3.34Å; I793-F796 PolarHBondContact O-N 3.38Å
794	N	86.1	Confident	87.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-73.7	-14	-177.2	-60.9	-49	0	0	0	113.5	Q721 M731 F735 F792 F796 T797 F850	Q721-N794 PolarHBondContact OE1-ND2 3.19Å; M731-N794 VanDerWaalsContact CA-OD1 3.22Å; M731-N794 WeakPolarHBondContact CA-OD1 3.49Å; M731-N794 WeakPolarHBondContact CB-OD1 3.36Å; M731-N794 WeakPolarHBondContact CG-OD1 3.43Å; F735-N794 VanDerWaalsContact CZ-ND2 3.28Å; F735-N794 WeakPolarHBondContact CZ-ND2 3.37Å; F792-N794 PolarHBondContact O-N 3.32Å; N794-F796 PolarHBondContact O-N 3.49Å; N794-T797 PolarHBondContact O-N 2.98Å; N794-T797 PolarHBondContact O-OG1 3.21Å; N794-F850 HydrophobicContact CB-CE1 4.26Å
795	I	87.9	Confident	86.6	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-61.5	-24.7	174.5	-152.8	175.4	0	0	0	112.6	F792 I793 T797 C798 F850 I886 M887 K891 L894	F792-I795 WeakPolarHBondContact O-CB 3.42Å; F792-I795 WeakPolarHBondContact O-CG2 3.24Å; F792-I795 PolarHBondContact O-N 2.97Å; I793-I795 PolarHBondContact O-N 2.92Å; I795-T797 VanDerWaalsContact C-N 3.28Å; I795-T797 PolarHBondContact O-N 2.88Å; I795-C798 WeakPolarHBondContact O-CB 3.19Å; I795-C798 PolarHBondContact O-N 3.14Å; I795-F850 HydrophobicContact CB-CE2 4.46Å; I795-F850 HydrophobicContact CD1-CD2 4.38Å; I795-F850 HydrophobicContact CG1-CD2 4.27Å; I795-F850 HydrophobicContact CG1-CE2 4.2Å; I795-I886 HydrophobicContact CG2-CG2 4.11Å; I795-M887 HydrophobicContact CD1-CE 3.81Å; I795-M887 HydrophobicContact CD1-SD 3.27Å; I795-M887 WeakPolarHBondContact CD1-SD 3.38Å; I795-K891 HydrophobicContact CD1-CB 4.32Å; I795-K891 HydrophobicContact CD1-CG 4.35Å; I795-K891 HydrophobicContact CG1-CG 4.38Å; I795-K891 VanDerWaalsContact O-CE 3.29Å; I795-K891 WeakPolarHBondContact O-CE 3.39Å; I795-L894 HydrophobicContact CD1-CD2 3.84Å; I795-L894 HydrophobicContact CG1-CD2 3.7Å
796	F	85.9	Confident	86.1	Confident	102 Å²	102	29.8 Å²	29.8	45%	0.447	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-70.8	-23.6	174.9	-63.6	-65.4	0	0	0	112.9	F792 I793 N794 I886	F792-F796 HydrophobicContact CD2-CE2 4.15Å; F792-F796 AromaticContact CE2-CE2 3.93Å; F792-F796 HydrophobicContact CE2-CE2 3.93Å; F792-F796 HydrophobicContact CE2-CZ 4.41Å; I793-F796 HydrophobicContact CD1-CD2 4.24Å; I793-F796 WeakPolarHBondContact O-CD2 3.34Å; I793-F796 PolarHBondContact O-N 3.38Å; N794-F796 PolarHBondContact O-N 3.49Å; F796-I886 HydrophobicContact CE1-CG2 4.32Å; F796-I886 HydrophobicContact CZ-CD1 4.13Å; F796-I886 HydrophobicContact CZ-CG1 4.45Å; F796-I886 HydrophobicContact CZ-CG2 4.1Å
797	T	84.1	Confident	85.5	Confident	27 Å²	27	29.3 Å²	29.3	17%	0.166	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-82.4	-14.2	173.2	65.1	0	0	0	0	113.7	L730 N794 I795	L730-T797 HydrophobicContact CB-CG2 4.17Å; L730-T797 HydrophobicContact CD2-CG2 3.77Å; N794-T797 PolarHBondContact O-N 2.98Å; N794-T797 PolarHBondContact O-OG1 3.21Å; I795-T797 VanDerWaalsContact C-N 3.28Å; I795-T797 PolarHBondContact O-N 2.88Å
798	C	82.9	Confident	85	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.02	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-75	133.4	175.5	-57.9	0	0	0	0	111.5	I795 C844 K891 L894	I795-C798 WeakPolarHBondContact O-CB 3.19Å; I795-C798 PolarHBondContact O-N 3.14Å; C798-C844 VanDerWaalsContact CA-SG 3.55Å; C798-C844 HydrophobicContact CB-CB 3.76Å; C798-C844 WeakPolarHBondContact CB-SG 3.24Å; C798-C844 WeakPolarHBondContact SG-CB 3.32Å; C798-C844 CovalentContact SG-SG 2.03Å; C798-C844 PolarHBondContact SG-SG 3.47Å; C798-K891 PolarHBondContact O-NZ 3.45Å; C798-L894 HydrophobicContact CB-CD1 3.99Å; C798-L894 HydrophobicContact CB-CD2 4.44Å
799	S	81.6	Confident	84.4	Confident	29 Å²	29	38.3 Å²	38.3	20%	0.203	21%	0.205	C	C	.	.			trans	-54	141.7	168.9	-173.8	0	0	0	0	111.6	L842	S799-L842 WeakPolarHBondContact CB-O 3.42Å; S799-L842 PolarHBondContact N-O 3.42Å
800	S	74.5	Confident	83.8	Confident	49 Å²	49	40.7 Å²	40.7	34%	0.343	22%	0.215	S	C	.	.			trans	-125.5	22.8	-179.6	43.3	0	0	0	0	113.7	K891 S893	S800-K891 PolarHBondContact OG-NZ 2.97Å; S800-K891 VanDerWaalsContact OG-NZ 3.1Å; S800-S893 PolarHBondContact O-OG 3.38Å
801	H	81.5	Confident	83.2	Confident	117 Å²	117	43.3 Å²	43.3	54%	0.542	23%	0.228	S	C	.	.			trans	-68.8	138.4	170.3	-70.5	-97	0	0	0	111.1	L803 N897	H801-L803 PolarHBondContact O-N 3.37Å; H801-N897 PolarHBondContact O-ND2 2.67Å
802	D	82.1	Confident	82.8	Confident	29 Å²	29	50.5 Å²	50.5	16%	0.155	27%	0.267	C	S	.	.			trans	-78.9	113.7	178.1	168.6	20.7	0	0	0	111.2	R804 S805 C806 R815	D802-R804 VanDerWaalsContact C-N 3.29Å; D802-R804 PolarHBondContact O-N 3.48Å; D802-R804 WeakPolarHBondContact OD1-CB 3.36Å; D802-R804 PolarHBondContact OD1-N 3.29Å; D802-S805 PolarHBondContact O-N 3.08Å; D802-S805 WeakPolarHBondContact OD2-CB 3.2Å; D802-S805 PolarHBondContact OD2-N 2.92Å; D802-S805 PolarHBondContact OD2-OG 3.49Å; D802-C806 PolarHBondContact O-N 3.34Å; D802-C806 VanDerWaalsContact O-N 3.14Å; D802-R815 IonicContact OD2-CZ 3.17Å; D802-R815 IonicContact OD2-NE 2.76Å; D802-R815 PolarHBondContact OD2-NE 3.4Å; D802-R815 IonicContact OD2-NH2 2.85Å; D802-R815 PolarHBondContact OD2-NH2 3.33Å
803	L	79.8	Confident	82.6	Confident	10 Å²	10	52.7 Å²	52.7	5%	0.052	28%	0.279	C	S	.	.	H	α-helix	trans	-65.8	-29.8	-179.3	-173.5	59.9	0	0	0	112.2	H801 C806 I807 Y828 A836 N897 L900 L901	H801-L803 PolarHBondContact O-N 3.37Å; L803-C806 WeakPolarHBondContact O-CB 3.33Å; L803-C806 PolarHBondContact O-N 3.36Å; L803-I807 HydrophobicContact CD1-CD1 4.31Å; L803-I807 HydrophobicContact CD1-CG1 4.28Å; L803-I807 HydrophobicContact CG-CD1 3.89Å; L803-I807 HydrophobicContact CG-CG1 4.33Å; L803-I807 VanDerWaalsContact O-CG1 3.32Å; L803-I807 WeakPolarHBondContact O-CG1 3.41Å; L803-I807 PolarHBondContact O-N 2.78Å; L803-Y828 HydrophobicContact CD1-CD2 3.96Å; L803-Y828 HydrophobicContact CD1-CE2 3.85Å; L803-A836 HydrophobicContact CD1-CB 3.91Å; L803-N897 HydrophobicContact CB-CB 4.34Å; L803-N897 WeakPolarHBondContact CB-OD1 3.31Å; L803-N897 PolarHBondContact N-OD1 3.48Å; L803-L900 HydrophobicContact CD2-CD2 4.3Å; L803-L900 HydrophobicContact CG-CD2 4.4Å; L803-L901 HydrophobicContact CD2-CD1 4.14Å; L803-L901 HydrophobicContact CD2-CD2 3.92Å; L803-L901 HydrophobicContact CD2-CG 3.93Å
804	R	81.7	Confident	82.3	Confident	76 Å²	76	54.3 Å²	54.3	29%	0.287	29%	0.292	S	S	.	.	H	α-helix	trans	-66.7	-40.2	175.1	-68.3	178	169.6	-99.2	-2.1	111.5	D802 C806 K808 R815 V818 L900	D802-R804 VanDerWaalsContact C-N 3.29Å; D802-R804 PolarHBondContact O-N 3.48Å; D802-R804 WeakPolarHBondContact OD1-CB 3.36Å; D802-R804 PolarHBondContact OD1-N 3.29Å; R804-C806 VanDerWaalsContact C-N 3.29Å; R804-K808 VanDerWaalsContact O-CB 3.27Å; R804-K808 WeakPolarHBondContact O-CB 3.45Å; R804-K808 PolarHBondContact O-N 2.87Å; R804-R815 HydrophobicContact CB-CG 4.5Å; R804-V818 HydrophobicContact CB-CG1 4.39Å; R804-V818 HydrophobicContact CG-CG1 4.35Å; R804-V818 PolarHBondContact NH1-O 2.9Å; R804-L900 HydrophobicContact CG-CD2 3.94Å
805	S	83.1	Confident	81.9	Confident	51 Å²	51	59.9 Å²	59.9	36%	0.357	31%	0.313	S	S	.	.	H	α-helix	trans	-69.1	-29.5	176	-66.8	0	0	0	0	112.6	D802 S809 R815	D802-S805 PolarHBondContact O-N 3.08Å; D802-S805 WeakPolarHBondContact OD2-CB 3.2Å; D802-S805 PolarHBondContact OD2-N 2.92Å; D802-S805 PolarHBondContact OD2-OG 3.49Å; S805-S809 PolarHBondContact O-N 3.01Å; S805-R815 PolarHBondContact OG-NE 3.13Å
806	C	82.7	Confident	81.2	Confident	19 Å²	19	66.2 Å²	66.2	13%	0.128	35%	0.347	C	S	.	.	H	α-helix	trans	-73.5	-51.5	175.6	174	0	0	0	0	112.6	D802 L803 R804 K808 S809 E810 C837	D802-C806 PolarHBondContact O-N 3.34Å; D802-C806 VanDerWaalsContact O-N 3.14Å; L803-C806 WeakPolarHBondContact O-CB 3.33Å; L803-C806 PolarHBondContact O-N 3.36Å; R804-C806 VanDerWaalsContact C-N 3.29Å; C806-K808 VanDerWaalsContact C-N 3.25Å; C806-K808 PolarHBondContact O-N 3.29Å; C806-S809 WeakPolarHBondContact O-CA 3.49Å; C806-S809 VanDerWaalsContact O-CB 3.31Å; C806-S809 WeakPolarHBondContact O-CB 3.32Å; C806-S809 PolarHBondContact O-N 2.84Å; C806-E810 PolarHBondContact O-N 2.88Å; C806-E810 VanDerWaalsContact O-N 3.12Å; C806-C837 HydrophobicContact CB-CB 3.96Å; C806-C837 WeakPolarHBondContact CB-SG 3.21Å; C806-C837 VanDerWaalsContact SG-CA 3.53Å; C806-C837 WeakPolarHBondContact SG-CB 3.5Å; C806-C837 CovalentContact SG-SG 2.03Å; C806-C837 PolarHBondContact SG-SG 3.47Å
807	I	81.4	Confident	80.6	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-58.1	-38.9	173.2	-66.5	166.6	0	0	0	111.1	L803 S809 E810 L811 V818 H822 A823 L826 Y828 L900	L803-I807 HydrophobicContact CD1-CD1 4.31Å; L803-I807 HydrophobicContact CD1-CG1 4.28Å; L803-I807 HydrophobicContact CG-CD1 3.89Å; L803-I807 HydrophobicContact CG-CG1 4.33Å; L803-I807 VanDerWaalsContact O-CG1 3.32Å; L803-I807 WeakPolarHBondContact O-CG1 3.41Å; L803-I807 PolarHBondContact O-N 2.78Å; I807-S809 VanDerWaalsContact C-N 3.25Å; I807-S809 PolarHBondContact O-N 2.76Å; I807-E810 PolarHBondContact O-N 2.66Å; I807-L811 HydrophobicContact CG2-CD1 3.87Å; I807-L811 HydrophobicContact CG2-CG 4.46Å; I807-L811 PolarHBondContact O-N 3.3Å; I807-V818 HydrophobicContact CB-CG1 3.85Å; I807-V818 HydrophobicContact CD1-CG1 4.14Å; I807-V818 HydrophobicContact CG2-CG1 3.62Å; I807-H822 HydrophobicContact CG2-CB 3.82Å; I807-A823 HydrophobicContact CD1-CB 3.96Å; I807-L826 HydrophobicContact CB-CD1 4.31Å; I807-L826 HydrophobicContact CG1-CD1 3.97Å; I807-L826 HydrophobicContact CG2-CD1 3.91Å; I807-Y828 HydrophobicContact CD1-CD2 4.22Å; I807-Y828 HydrophobicContact CD1-CE2 4.29Å; I807-Y828 HydrophobicContact CG1-CD2 4.15Å; I807-Y828 HydrophobicContact CG1-CE2 3.72Å; I807-L900 HydrophobicContact CD1-CD2 4.05Å
808	K	84.4	Confident	80.2	Confident	92 Å²	92	65.2 Å²	65.2	40%	0.4	35%	0.345	S	S	.	.	H	α-helix	trans	-54.6	-40.6	169.6	153.8	168.5	-176.3	-173.4	0	112.2	R804 C806 N812 I813 R815 V818	R804-K808 VanDerWaalsContact O-CB 3.27Å; R804-K808 WeakPolarHBondContact O-CB 3.45Å; R804-K808 PolarHBondContact O-N 2.87Å; C806-K808 VanDerWaalsContact C-N 3.25Å; C806-K808 PolarHBondContact O-N 3.29Å; K808-N812 WeakPolarHBondContact O-CA 3.41Å; K808-N812 PolarHBondContact O-N 3.43Å; K808-I813 VanDerWaalsContact CG-O 3.25Å; K808-I813 WeakPolarHBondContact CG-O 3.5Å; K808-I813 PolarHBondContact O-N 3.27Å; K808-R815 HydrophobicContact CD-CB 4.15Å; K808-V818 HydrophobicContact CB-CG2 4.34Å
809	S	81.6	Confident	79.9	Confident	98 Å²	98	68.9 Å²	68.9	69%	0.685	37%	0.365	S	S	*	.	H	α-helix	trans	-74.5	-31.1	-177.3	-163.5	0	0	0	0	113.2	S805 C806 I807	S805-S809 PolarHBondContact O-N 3.01Å; C806-S809 WeakPolarHBondContact O-CA 3.49Å; C806-S809 VanDerWaalsContact O-CB 3.31Å; C806-S809 WeakPolarHBondContact O-CB 3.32Å; C806-S809 PolarHBondContact O-N 2.84Å; I807-S809 VanDerWaalsContact C-N 3.25Å; I807-S809 PolarHBondContact O-N 2.76Å
810	E	80.5	Confident	79.6	Confident	110 Å²	110	67.8 Å²	67.8	51%	0.514	36%	0.357	S	S	.	.	H	α-helix	trans	-80.6	-42.6	177.3	-65.1	-163.2	149.8	0	0	112.6	C806 I807 Y828	C806-E810 PolarHBondContact O-N 2.88Å; C806-E810 VanDerWaalsContact O-N 3.12Å; I807-E810 PolarHBondContact O-N 2.66Å; E810-Y828 VanDerWaalsContact CD-OH 3.27Å; E810-Y828 PolarHBondContact OE1-OH 3.29Å; E810-Y828 PolarHBondContact OE2-OH 3.48Å
811	L	79.9	Confident	79.7	Confident	55 Å²	55	66.8 Å²	66.8	29%	0.288	35%	0.35	S	S	.	.	H	α-helix	trans	-91.3	-11.1	-178.2	-61.3	178.2	0	0	0	113.8	I807 I813 H822 L826	I807-L811 HydrophobicContact CG2-CD1 3.87Å; I807-L811 HydrophobicContact CG2-CG 4.46Å; I807-L811 PolarHBondContact O-N 3.3Å; L811-I813 HydrophobicContact CB-CD1 3.77Å; L811-I813 HydrophobicContact CB-CG1 4.02Å; L811-I813 HydrophobicContact CD1-CD1 4.29Å; L811-H822 HydrophobicContact CD1-CB 3.89Å; L811-L826 HydrophobicContact CD1-CD1 4.16Å; L811-L826 HydrophobicContact CD2-CD2 4.13Å; L811-L826 HydrophobicContact CG-CD1 4.2Å
812	N	81.8	Confident	79.6	Confident	152 Å²	152	63.3 Å²	63.3	81%	0.813	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	42.5	-178.2	-157.5	14.6	0	0	0	114.3	K808	K808-N812 WeakPolarHBondContact O-CA 3.41Å; K808-N812 PolarHBondContact O-N 3.43Å
813	I	82.8	Confident	79.4	Confident	55 Å²	55	61.9 Å²	61.9	28%	0.282	33%	0.326	S	S	.	.			trans	-109.6	158.3	-176	-62.6	173.6	0	0	0	110.7	K808 L811 L817	K808-I813 VanDerWaalsContact CG-O 3.25Å; K808-I813 WeakPolarHBondContact CG-O 3.5Å; K808-I813 PolarHBondContact O-N 3.27Å; L811-I813 HydrophobicContact CB-CD1 3.77Å; L811-I813 HydrophobicContact CB-CG1 4.02Å; L811-I813 HydrophobicContact CD1-CD1 4.29Å; I813-L817 HydrophobicContact CG2-CB 3.75Å; I813-L817 HydrophobicContact CG2-CD1 4.17Å
814	S	81.7	Confident	79.2	Confident	63 Å²	63	63.1 Å²	63.1	44%	0.441	33%	0.334	S	S	.	.			trans	-62.3	143.2	171.5	-167.4	0	0	0	0	112	D816 L817	S814-D816 PolarHBondContact O-N 3.08Å; S814-D816 VanDerWaalsContact O-N 3.17Å; S814-L817 PolarHBondContact O-N 3.32Å; S814-L817 VanDerWaalsContact O-N 3.09Å
815	R	77.5	Confident	78.9	Confident	117 Å²	117	64.7 Å²	64.7	44%	0.442	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-58.3	-34.6	-174.6	-168.5	-177.3	-173.6	-138.6	4.4	112.7	D802 R804 S805 K808 L817 V818	D802-R815 IonicContact OD2-CZ 3.17Å; D802-R815 IonicContact OD2-NE 2.76Å; D802-R815 PolarHBondContact OD2-NE 3.4Å; D802-R815 IonicContact OD2-NH2 2.85Å; D802-R815 PolarHBondContact OD2-NH2 3.33Å; R804-R815 HydrophobicContact CB-CG 4.5Å; S805-R815 PolarHBondContact OG-NE 3.13Å; K808-R815 HydrophobicContact CD-CB 4.15Å; R815-L817 VanDerWaalsContact C-N 3.27Å; R815-L817 PolarHBondContact O-N 3.35Å; R815-V818 WeakPolarHBondContact O-CB 3.42Å; R815-V818 PolarHBondContact O-N 2.93Å
816	D	73.8	Confident	78.5	Confident	135 Å²	135	64.5 Å²	64.5	72%	0.722	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-83.5	-3.7	-174.4	-41.8	-56.7	0	0	0	113	S814	S814-D816 PolarHBondContact O-N 3.08Å; S814-D816 VanDerWaalsContact O-N 3.17Å
817	L	73.8	Confident	78.1	Confident	107 Å²	107	69.2 Å²	69.2	56%	0.56	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-100.8	0.7	171.4	-63.9	170.8	0	0	0	112.3	I813 S814 R815 D819 H822	I813-L817 HydrophobicContact CG2-CB 3.75Å; I813-L817 HydrophobicContact CG2-CD1 4.17Å; S814-L817 PolarHBondContact O-N 3.32Å; S814-L817 VanDerWaalsContact O-N 3.09Å; R815-L817 VanDerWaalsContact C-N 3.27Å; R815-L817 PolarHBondContact O-N 3.35Å; L817-D819 PolarHBondContact O-N 2.94Å; L817-H822 PolarHBondContact O-CE1 3.01Å; L817-H822 PolarHBondContact O-ND1 3.09Å
818	V	75.4	Confident	77.8	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.006	37%	0.372	C	S	.	.			trans	-80.8	81	-178	-177.1	0	0	0	0	110.6	R804 I807 K808 R815	R804-V818 HydrophobicContact CB-CG1 4.39Å; R804-V818 HydrophobicContact CG-CG1 4.35Å; R804-V818 PolarHBondContact NH1-O 2.9Å; I807-V818 HydrophobicContact CB-CG1 3.85Å; I807-V818 HydrophobicContact CD1-CG1 4.14Å; I807-V818 HydrophobicContact CG2-CG1 3.62Å; K808-V818 HydrophobicContact CB-CG2 4.34Å; R815-V818 WeakPolarHBondContact O-CB 3.42Å; R815-V818 PolarHBondContact O-N 2.93Å
819	D	76.2	Confident	77.1	Confident	80 Å²	80	70 Å²	70	43%	0.428	37%	0.373	S	S	.	.			trans	-85.1	163.9	171.9	-67.6	-37.3	0	0	0	113.3	L817 C821 H822	L817-D819 PolarHBondContact O-N 2.94Å; D819-C821 PolarHBondContact O-N 2.88Å; D819-H822 PolarHBondContact N-ND1 3.43Å; D819-H822 VanDerWaalsContact N-ND1 3.2Å; D819-H822 WeakPolarHBondContact O-CB 3.38Å; D819-H822 PolarHBondContact O-N 3.4Å; D819-H822 PolarHBondContact O-ND1 3.34Å; D819-H822 VanDerWaalsContact O-ND1 3.07Å
820	A	76.6	Confident	76.7	Confident	5 Å²	5	65.6 Å²	65.6	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-52.3	-31.1	-175.7	0	0	0	0	0	114.6	H822 A823 V824 L900 M903 A904 L907	A820-H822 PolarHBondContact O-N 2.98Å; A820-A823 WeakPolarHBondContact O-CB 3.49Å; A820-A823 PolarHBondContact O-N 2.74Å; A820-V824 PolarHBondContact O-N 3.19Å; A820-V824 VanDerWaalsContact O-N 3.12Å; A820-L900 HydrophobicContact CB-CD1 4.17Å; A820-M903 HydrophobicContact CB-CB 3.92Å; A820-A904 HydrophobicContact CB-CB 4.38Å; A820-L907 HydrophobicContact CB-CD1 4.03Å
821	C	76.3	Confident	76.1	Confident	28 Å²	28	63.4 Å²	63.4	19%	0.189	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-20.7	176.2	-87.1	0	0	0	0	114.6	D819 L825 C919	D819-C821 PolarHBondContact O-N 2.88Å; C821-L825 VanDerWaalsContact O-CB 3.31Å; C821-L825 WeakPolarHBondContact O-CB 3.32Å; C821-L825 PolarHBondContact O-N 3.37Å; C821-C919 HydrophobicContact CB-CB 3.99Å; C821-C919 WeakPolarHBondContact CB-SG 3.39Å; C821-C919 WeakPolarHBondContact SG-CB 3.26Å; C821-C919 CovalentContact SG-SG 2.02Å; C821-C919 PolarHBondContact SG-SG 3.09Å
822	H	78.8	Confident	75.4	Confident	44 Å²	44	63 Å²	63	20%	0.204	34%	0.338	C	S	.	.	H	α-helix	trans	-73.1	-32.1	171.1	-57.6	97.2	0	0	0	111.8	I807 L811 L817 D819 A820 L825 L826	I807-H822 HydrophobicContact CG2-CB 3.82Å; L811-H822 HydrophobicContact CD1-CB 3.89Å; L817-H822 PolarHBondContact O-CE1 3.01Å; L817-H822 PolarHBondContact O-ND1 3.09Å; D819-H822 PolarHBondContact N-ND1 3.43Å; D819-H822 VanDerWaalsContact N-ND1 3.2Å; D819-H822 WeakPolarHBondContact O-CB 3.38Å; D819-H822 PolarHBondContact O-N 3.4Å; D819-H822 PolarHBondContact O-ND1 3.34Å; D819-H822 VanDerWaalsContact O-ND1 3.07Å; A820-H822 PolarHBondContact O-N 2.98Å; H822-L825 PolarHBondContact O-N 3.02Å; H822-L826 WeakPolarHBondContact O-CG 3.3Å; H822-L826 PolarHBondContact O-N 3.37Å
823	A	77.4	Confident	74.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-70.6	-39.3	172.3	0	0	0	0	0	111.6	I807 A820 L826 N827 Y828 A904	I807-A823 HydrophobicContact CD1-CB 3.96Å; A820-A823 WeakPolarHBondContact O-CB 3.49Å; A820-A823 PolarHBondContact O-N 2.74Å; A823-L826 PolarHBondContact O-N 3.43Å; A823-N827 PolarHBondContact O-N 3.35Å; A823-Y828 PolarHBondContact O-N 2.96Å; A823-A904 HydrophobicContact CB-CB 4.21Å
824	V	75.9	Confident	72.9	Confident	35 Å²	35	69.5 Å²	69.5	21%	0.212	36%	0.361	C	S	.	.	H	α-helix	trans	-62.3	-42.4	171.8	179.9	0	0	0	0	111.2	A820 L826 N827 A904 Y909	A820-V824 PolarHBondContact O-N 3.19Å; A820-V824 VanDerWaalsContact O-N 3.12Å; V824-L826 VanDerWaalsContact C-N 3.28Å; V824-L826 PolarHBondContact O-N 2.96Å; V824-N827 PolarHBondContact O-N 3.32Å; V824-A904 HydrophobicContact CG2-CB 3.72Å; V824-Y909 HydrophobicContact CG1-CD2 4.17Å; V824-Y909 HydrophobicContact CG1-CG 4.39Å
825	L	76	Confident	71.8	Confident	110 Å²	110	68.2 Å²	68.2	58%	0.576	36%	0.359	S	S	*	.	H	α-helix	trans	-61.5	-34.5	178.3	-176.6	64.7	0	0	0	112.9	C821 H822 N827	C821-L825 VanDerWaalsContact O-CB 3.31Å; C821-L825 WeakPolarHBondContact O-CB 3.32Å; C821-L825 PolarHBondContact O-N 3.37Å; H822-L825 PolarHBondContact O-N 3.02Å; L825-N827 VanDerWaalsContact C-N 3.32Å
826	L	74.6	Confident	70.8	Confident	46 Å²	46	64.3 Å²	64.3	24%	0.241	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3.5	175.2	-66.4	168.3	0	0	0	113.5	I807 L811 H822 A823 V824 Y828	I807-L826 HydrophobicContact CB-CD1 4.31Å; I807-L826 HydrophobicContact CG1-CD1 3.97Å; I807-L826 HydrophobicContact CG2-CD1 3.91Å; L811-L826 HydrophobicContact CD1-CD1 4.16Å; L811-L826 HydrophobicContact CD2-CD2 4.13Å; L811-L826 HydrophobicContact CG-CD1 4.2Å; H822-L826 WeakPolarHBondContact O-CG 3.3Å; H822-L826 PolarHBondContact O-N 3.37Å; A823-L826 PolarHBondContact O-N 3.43Å; V824-L826 VanDerWaalsContact C-N 3.28Å; V824-L826 PolarHBondContact O-N 2.96Å; L826-Y828 VanDerWaalsContact C-N 3.27Å; L826-Y828 HydrophobicContact CB-CD1 4.26Å; L826-Y828 HydrophobicContact CB-CD2 4.13Å; L826-Y828 HydrophobicContact CB-CE1 4.16Å; L826-Y828 HydrophobicContact CB-CE2 4.06Å; L826-Y828 HydrophobicContact CB-CG 4.25Å; L826-Y828 HydrophobicContact CD1-CD2 4.5Å; L826-Y828 HydrophobicContact CD1-CE2 3.88Å; L826-Y828 PolarHBondContact O-N 2.85Å
827	N	73.5	Confident	70.5	Confident	119 Å²	119	60.3 Å²	60.3	64%	0.636	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	35	-179.1	-169.8	38.8	0	0	0	113.9	A823 V824 L825 N829	A823-N827 PolarHBondContact O-N 3.35Å; V824-N827 PolarHBondContact O-N 3.32Å; L825-N827 VanDerWaalsContact C-N 3.32Å; N827-N829 PolarHBondContact O-N 3.43Å; N827-N829 PolarHBondContact O-ND2 3.14Å; N827-N829 PolarHBondContact OD1-ND2 2.88Å
828	Y	74.8	Confident	69.8	Low	33 Å²	33	59 Å²	59	13%	0.129	35%	0.345	C	S	.	.			trans	-82.1	106.7	175.2	-65.8	-21.7	0	0	0	111.1	L803 I807 E810 A823 L826 A836	L803-Y828 HydrophobicContact CD1-CD2 3.96Å; L803-Y828 HydrophobicContact CD1-CE2 3.85Å; I807-Y828 HydrophobicContact CD1-CD2 4.22Å; I807-Y828 HydrophobicContact CD1-CE2 4.29Å; I807-Y828 HydrophobicContact CG1-CD2 4.15Å; I807-Y828 HydrophobicContact CG1-CE2 3.72Å; E810-Y828 VanDerWaalsContact CD-OH 3.27Å; E810-Y828 PolarHBondContact OE1-OH 3.29Å; E810-Y828 PolarHBondContact OE2-OH 3.48Å; A823-Y828 PolarHBondContact O-N 2.96Å; L826-Y828 VanDerWaalsContact C-N 3.27Å; L826-Y828 HydrophobicContact CB-CD1 4.26Å; L826-Y828 HydrophobicContact CB-CD2 4.13Å; L826-Y828 HydrophobicContact CB-CE1 4.16Å; L826-Y828 HydrophobicContact CB-CE2 4.06Å; L826-Y828 HydrophobicContact CB-CG 4.25Å; L826-Y828 HydrophobicContact CD1-CD2 4.5Å; L826-Y828 HydrophobicContact CD1-CE2 3.88Å; L826-Y828 PolarHBondContact O-N 2.85Å; Y828-A836 HydrophobicContact CD1-CB 4.01Å; Y828-A836 HydrophobicContact CD2-CB 4.25Å; Y828-A836 HydrophobicContact CE1-CB 3.62Å; Y828-A836 HydrophobicContact CE2-CB 3.86Å; Y828-A836 HydrophobicContact CG-CB 4.31Å; Y828-A836 PolarHBondContact OH-O 2.88Å; Y828-A836 VanDerWaalsContact OH-O 3.13Å
829	N	70.9	Confident	69.2	Low	78 Å²	78	60.6 Å²	60.6	42%	0.417	36%	0.363	S	S	.	.			trans	-111.5	153.2	-176.3	-57.5	-41.5	0	0	0	111.2	N827 D831 A832	N827-N829 PolarHBondContact O-N 3.43Å; N827-N829 PolarHBondContact O-ND2 3.14Å; N827-N829 PolarHBondContact OD1-ND2 2.88Å; N829-D831 PolarHBondContact O-N 2.8Å; N829-D831 VanDerWaalsContact O-N 3.1Å; N829-A832 WeakPolarHBondContact O-CB 3.34Å; N829-A832 PolarHBondContact O-N 3.24Å
830	L	71.9	Confident	68.5	Low	5 Å²	5	65.5 Å²	65.5	3%	0.026	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-27.7	-177.4	-83.1	81.7	0	0	0	114.2	F321 S845 F846 L901 V902 N905	F321-L830 HydrophobicContact CD1-CB 4.34Å; F321-L830 HydrophobicContact CE1-CB 4.01Å; F321-L830 HydrophobicContact CE2-CD2 4.37Å; F321-L830 HydrophobicContact CZ-CB 4.3Å; F321-L830 HydrophobicContact CZ-CD2 4.18Å; L830-S845 WeakPolarHBondContact O-CB 3.31Å; L830-S845 PolarHBondContact O-OG 3.13Å; L830-F846 HydrophobicContact CD2-CD1 4.17Å; L830-F846 HydrophobicContact CD2-CE1 3.61Å; L830-F846 HydrophobicContact CD2-CZ 4.27Å; L830-L901 HydrophobicContact CD1-CB 3.91Å; L830-L901 WeakPolarHBondContact CD1-O 3.26Å; L830-L901 HydrophobicContact CG-CB 4.27Å; L830-V902 HydrophobicContact CD2-CG2 4.22Å; L830-N905 HydrophobicContact CD1-CB 3.73Å
831	D	68.2	Low	67.9	Low	63 Å²	63	67.3 Å²	67.3	34%	0.337	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	11.8	-175.1	-147.2	30.5	0	0	0	113.7	S320 F321 K324 N829 Q833	S320-D831 PolarHBondContact OG-OD2 3.2Å; F321-D831 HydrophobicContact CD1-CB 4.26Å; K324-D831 IonicContact NZ-OD1 2.62Å; K324-D831 PolarHBondContact NZ-OD1 3.1Å; N829-D831 PolarHBondContact O-N 2.8Å; N829-D831 VanDerWaalsContact O-N 3.1Å; D831-Q833 PolarHBondContact O-N 3.3Å
832	A	65.1	Low	67.8	Low	47 Å²	47	69.3 Å²	69.3	39%	0.388	41%	0.412	S	S	.	.			trans	-68.1	121.8	-178.5	0	0	0	0	0	112.4	N829	N829-A832 WeakPolarHBondContact O-CB 3.34Å; N829-A832 PolarHBondContact O-N 3.24Å
833	Q	55.8	Low	67.6	Low	183 Å²	183	70.3 Å²	70.3	86%	0.855	42%	0.418	S	S	*	.			trans	-81.3	-14	-178.2	-67.7	-175.3	-10.7	0	0	114.9	D831	D831-Q833 PolarHBondContact O-N 3.3Å
834	H	56.8	Low	67.8	Low	160 Å²	160	70.7 Å²	70.7	74%	0.741	42%	0.421	S	S	*	.	S	Bend	trans	-116	143	-178.1	-70.4	77.7	0	0	0	110.5	A836	H834-A836 PolarHBondContact O-N 3.45Å
835	G	57.9	Low	67.8	Low	37 Å²	37	70 Å²	70	38%	0.381	42%	0.418	S	S	.	.			trans	-64.9	117.7	-176.6	0	0	0	0	0	113.1	C837 G838	G835-C837 PolarHBondContact O-N 3.28Å; G835-G838 PolarHBondContact O-N 2.93Å
836	A	58	Low	68.2	Low	34 Å²	34	65 Å²	65	28%	0.281	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-25.3	168	0	0	0	0	0	113.9	L803 Y828 H834	L803-A836 HydrophobicContact CD1-CB 3.91Å; Y828-A836 HydrophobicContact CD1-CB 4.01Å; Y828-A836 HydrophobicContact CD2-CB 4.25Å; Y828-A836 HydrophobicContact CE1-CB 3.62Å; Y828-A836 HydrophobicContact CE2-CB 3.86Å; Y828-A836 HydrophobicContact CG-CB 4.31Å; Y828-A836 PolarHBondContact OH-O 2.88Å; Y828-A836 VanDerWaalsContact OH-O 3.13Å; H834-A836 PolarHBondContact O-N 3.45Å
837	C	67.1	Low	68.7	Low	51 Å²	51	62.9 Å²	62.9	35%	0.345	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	24.4	-171	-47.1	0	0	0	0	113.4	C806 G835 G839	C806-C837 HydrophobicContact CB-CB 3.96Å; C806-C837 WeakPolarHBondContact CB-SG 3.21Å; C806-C837 VanDerWaalsContact SG-CA 3.53Å; C806-C837 WeakPolarHBondContact SG-CB 3.5Å; C806-C837 CovalentContact SG-SG 2.03Å; C806-C837 PolarHBondContact SG-SG 3.47Å; G835-C837 PolarHBondContact O-N 3.28Å; C837-G839 PolarHBondContact O-N 3.02Å
838	G	58.9	Low	69.3	Low	79 Å²	79	57.9 Å²	57.9	81%	0.814	35%	0.353	S	S	*	.	S	Bend	trans	65	28	164	0	0	0	0	0	117.7	G835	G835-G838 PolarHBondContact O-N 2.93Å
839	G	61.8	Low	70.1	Confident	36 Å²	36	56.5 Å²	56.5	37%	0.371	35%	0.348	S	S	.	.			trans	-121.4	146.4	178.6	0	0	0	0	0	113.8	C837 A841	C837-G839 PolarHBondContact O-N 3.02Å; G839-A841 PolarHBondContact O-N 2.88Å
840	D	61.2	Low	71	Confident	182 Å²	182	53 Å²	53	97%	0.973	33%	0.329	S	S	*	.	S	Bend	trans	-70.4	9.7	-173.5	-59	-41.3	0	0	0	115.7
841	A	65.3	Low	71.9	Confident	43 Å²	43	53.3 Å²	53.3	36%	0.355	33%	0.331	S	S	.	.	S	Bend	trans	-92.6	137	-175.6	0	0	0	0	0	112.2	G839	G839-A841 PolarHBondContact O-N 2.88Å
842	L	73.8	Confident	73	Confident	71 Å²	71	50.9 Å²	50.9	37%	0.372	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-64.8	138.4	-175	-62.1	101.5	0	0	0	112.4	P726 S799	P726-L842 HydrophobicContact CB-CD2 3.75Å; P726-L842 HydrophobicContact CG-CB 3.95Å; P726-L842 HydrophobicContact CG-CD2 3.7Å; P726-L842 HydrophobicContact CG-CG 4.47Å; S799-L842 WeakPolarHBondContact CB-O 3.42Å; S799-L842 PolarHBondContact N-O 3.42Å
843	I	74.8	Confident	74.3	Confident	64 Å²	64	48.7 Å²	48.7	33%	0.328	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-86	137.2	176.4	-47.4	173.9	0	0	0	109.2	P726	P726-I843 WeakPolarHBondContact CG-O 3.45Å
844	C	81.4	Confident	76.1	Confident	9 Å²	9	40 Å²	40	6%	0.061	26%	0.26	C	S	.	.			trans	-118.8	85.7	177.3	-63.9	0	0	0	0	110.1	C798 F846 L894	C798-C844 VanDerWaalsContact CA-SG 3.55Å; C798-C844 HydrophobicContact CB-CB 3.76Å; C798-C844 WeakPolarHBondContact CB-SG 3.24Å; C798-C844 WeakPolarHBondContact SG-CB 3.32Å; C798-C844 CovalentContact SG-SG 2.03Å; C798-C844 PolarHBondContact SG-SG 3.47Å; C844-F846 PolarHBondContact O-N 3.2Å; C844-F846 VanDerWaalsContact O-N 3.11Å; C844-L894 HydrophobicContact CB-CD1 4.41Å
845	S	75.7	Confident	77.8	Confident	21 Å²	21	32.5 Å²	32.5	15%	0.147	23%	0.225	C	C	.	.	S	Bend	trans	-72.5	2.7	-167.9	-45.3	0	0	0	0	117.1	L830 Q898	L830-S845 WeakPolarHBondContact O-CB 3.31Å; L830-S845 PolarHBondContact O-OG 3.13Å; S845-Q898 PolarHBondContact O-NE2 3.33Å; S845-Q898 PolarHBondContact O-OE1 2.9Å
846	F	85.1	Confident	79.5	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.018	21%	0.207	C	C	.	.			trans	-145.5	63.7	177.6	-47	-84	0	0	0	111.3	F321 K324 Q325 I724 L830 C844 E848 Y849	F321-F846 HydrophobicContact CB-CZ 3.99Å; F321-F846 AromaticContact CD2-CE1 3.65Å; F321-F846 HydrophobicContact CD2-CE1 3.65Å; F321-F846 AromaticContact CD2-CZ 3.48Å; F321-F846 HydrophobicContact CD2-CZ 3.48Å; F321-F846 VanDerWaalsContact CD2-CZ 3.48Å; F321-F846 AromaticContact CE2-CE1 3.86Å; F321-F846 HydrophobicContact CE2-CE1 3.86Å; F321-F846 HydrophobicContact CE2-CZ 4.12Å; F321-F846 HydrophobicContact CG-CE1 4.39Å; F321-F846 AromaticContact CG-CZ 3.81Å; F321-F846 HydrophobicContact CG-CZ 3.81Å; K324-F846 HydrophobicContact CD-CE2 4.42Å; Q325-F846 HydrophobicContact CG-CD1 4.14Å; Q325-F846 HydrophobicContact CG-CE1 4.01Å; I724-F846 HydrophobicContact CD1-CB 4.44Å; I724-F846 HydrophobicContact CD1-CD2 4.24Å; I724-F846 HydrophobicContact CD1-CG 4.47Å; I724-F846 HydrophobicContact CG2-CB 3.88Å; I724-F846 HydrophobicContact CG2-CD2 4.28Å; L830-F846 HydrophobicContact CD2-CD1 4.17Å; L830-F846 HydrophobicContact CD2-CE1 3.61Å; L830-F846 HydrophobicContact CD2-CZ 4.27Å; C844-F846 PolarHBondContact O-N 3.2Å; C844-F846 VanDerWaalsContact O-N 3.11Å; F846-E848 PolarHBondContact O-N 3.03Å; F846-E848 VanDerWaalsContact O-N 3.12Å; F846-Y849 HydrophobicContact CB-CD2 3.66Å; F846-Y849 HydrophobicContact CB-CE2 3.98Å; F846-Y849 PolarHBondContact O-N 2.91Å
847	P	85.5	Confident	81.2	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.006	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.5	-175.5	30.5	-36.9	0	0	0	113.4	Y849 F850 L894 F895 Q898	P847-Y849 PolarHBondContact O-N 3.26Å; P847-F850 HydrophobicContact CB-CD2 4.27Å; P847-F850 WeakPolarHBondContact O-CB 3.48Å; P847-F850 PolarHBondContact O-N 3Å; P847-L894 HydrophobicContact CB-CD2 3.63Å; P847-L894 HydrophobicContact CB-CG 3.78Å; P847-L894 HydrophobicContact CG-CG 4.21Å; P847-F895 HydrophobicContact CB-CD1 4.1Å; P847-F895 HydrophobicContact CB-CE1 4.07Å; P847-F895 HydrophobicContact CG-CD1 4.02Å; P847-F895 HydrophobicContact CG-CE1 4.37Å; P847-Q898 HydrophobicContact CG-CB 3.77Å; P847-Q898 HydrophobicContact CG-CG 3.95Å
848	E	85.7	Confident	82.4	Confident	15 Å²	15	26.8 Å²	26.8	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-49.9	-33.8	171.4	-57.4	162.1	-107.2	0	0	113.1	S273 F846 F850 T851 C852 Q898 L927	S273-E848 WeakPolarHBondContact CB-OE2 3.42Å; S273-E848 PolarHBondContact OG-OE2 3.25Å; F846-E848 PolarHBondContact O-N 3.03Å; F846-E848 VanDerWaalsContact O-N 3.12Å; E848-F850 VanDerWaalsContact C-N 3.32Å; E848-F850 PolarHBondContact O-N 3.11Å; E848-T851 WeakPolarHBondContact O-CB 3.28Å; E848-T851 PolarHBondContact O-N 3.23Å; E848-C852 PolarHBondContact O-N 2.9Å; E848-C852 PolarHBondContact O-SG 3.27Å; E848-C852 VanDerWaalsContact O-SG 3.33Å; E848-Q898 HydrophobicContact CG-CG 4.44Å; E848-Q898 PolarHBondContact OE1-NE2 2.87Å; E848-L927 HydrophobicContact CG-CD1 4.43Å; E848-L927 HydrophobicContact CG-CD2 3.7Å
849	Y	90.4	Very high	84	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-74.9	-18.6	179.4	-70.5	-87.5	0	0	0	113.2	I276 Q325 N329 I720 I724 F846 P847 C852 C853	I276-Y849 HydrophobicContact CD1-CD1 4.47Å; I276-Y849 HydrophobicContact CD1-CE1 3.67Å; Q325-Y849 WeakPolarHBondContact CA-OH 3.41Å; Q325-Y849 WeakPolarHBondContact CB-OH 3.49Å; Q325-Y849 HydrophobicContact CG-CE2 4.28Å; Q325-Y849 PolarHBondContact O-OH 2.86Å; N329-Y849 WeakPolarHBondContact OD1-CE1 3.36Å; N329-Y849 PolarHBondContact OD1-OH 3.07Å; I720-Y849 HydrophobicContact CG2-CD1 4.24Å; I724-Y849 HydrophobicContact CD1-CD2 3.78Å; I724-Y849 HydrophobicContact CD1-CE2 3.84Å; I724-Y849 HydrophobicContact CD1-CG 4.17Å; I724-Y849 HydrophobicContact CG1-CD1 4.4Å; I724-Y849 HydrophobicContact CG1-CD2 4.03Å; I724-Y849 HydrophobicContact CG1-CG 3.96Å; I724-Y849 HydrophobicContact CG2-CD2 4.3Å; F846-Y849 HydrophobicContact CB-CD2 3.66Å; F846-Y849 HydrophobicContact CB-CE2 3.98Å; F846-Y849 PolarHBondContact O-N 2.91Å; P847-Y849 PolarHBondContact O-N 3.26Å; Y849-C852 PolarHBondContact O-N 3.47Å; Y849-C853 PolarHBondContact O-N 3.27Å; Y849-C853 PolarHBondContact O-SG 2.95Å; Y849-C853 VanDerWaalsContact O-SG 3.33Å
850	F	90.6	Very high	85.4	Confident	4 Å²	4	21.4 Å²	21.4	2%	0.018	12%	0.122	C	C	.	.	H	α-helix	trans	-66.6	-43.1	167.9	-65.3	-61.9	0	0	0	110.6	Q721 V725 N794 I795 P847 E848 C852 C853 V854	Q721-F850 HydrophobicContact CG-CE1 4.43Å; V725-F850 HydrophobicContact CG2-CE1 3.97Å; V725-F850 HydrophobicContact CG2-CZ 3.66Å; N794-F850 HydrophobicContact CB-CE1 4.26Å; I795-F850 HydrophobicContact CB-CE2 4.46Å; I795-F850 HydrophobicContact CD1-CD2 4.38Å; I795-F850 HydrophobicContact CG1-CD2 4.27Å; I795-F850 HydrophobicContact CG1-CE2 4.2Å; P847-F850 HydrophobicContact CB-CD2 4.27Å; P847-F850 WeakPolarHBondContact O-CB 3.48Å; P847-F850 PolarHBondContact O-N 3Å; E848-F850 VanDerWaalsContact C-N 3.32Å; E848-F850 PolarHBondContact O-N 3.11Å; F850-C852 VanDerWaalsContact C-N 3.27Å; F850-C852 PolarHBondContact O-N 3.35Å; F850-C853 PolarHBondContact O-N 3.05Å; F850-V854 WeakPolarHBondContact O-CG2 3.31Å; F850-V854 PolarHBondContact O-N 3.35Å
851	T	90.3	Very high	86.8	Confident	11 Å²	11	12.8 Å²	12.8	7%	0.067	8%	0.076	C	C	.	.	H	α-helix	trans	-57.1	-43.2	171.8	-46.9	0	0	0	0	110.7	E848 V854 L855 Y883 T931 I935	E848-T851 WeakPolarHBondContact O-CB 3.28Å; E848-T851 PolarHBondContact O-N 3.23Å; T851-V854 PolarHBondContact O-N 3.16Å; T851-L855 WeakPolarHBondContact O-CG 3.37Å; T851-L855 PolarHBondContact O-N 3.49Å; T851-Y883 PolarHBondContact OG1-OH 3.13Å; T851-Y883 VanDerWaalsContact OG1-OH 3.1Å; T851-T931 HydrophobicContact CG2-CG2 3.81Å; T851-I935 HydrophobicContact CG2-CD1 4.33Å
852	C	91.6	Very high	87.9	Confident	13 Å²	13	11 Å²	11	9%	0.088	6%	0.061	C	C	.	.	H	α-helix	trans	-63.3	-42.9	176.4	-60.7	0	0	0	0	112.6	V332 E848 Y849 F850 V854 L855 L856	V332-C852 HydrophobicContact CG2-CB 4.41Å; E848-C852 PolarHBondContact O-N 2.9Å; E848-C852 PolarHBondContact O-SG 3.27Å; E848-C852 VanDerWaalsContact O-SG 3.33Å; Y849-C852 PolarHBondContact O-N 3.47Å; F850-C852 VanDerWaalsContact C-N 3.27Å; F850-C852 PolarHBondContact O-N 3.35Å; C852-V854 VanDerWaalsContact C-N 3.34Å; C852-V854 PolarHBondContact O-N 3.06Å; C852-L855 PolarHBondContact O-N 3.48Å; C852-L856 WeakPolarHBondContact O-CG 3.34Å; C852-L856 PolarHBondContact O-N 2.9Å
853	C	93.4	Very high	88.6	Confident	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-62.9	-37.8	174.6	-73.4	0	0	0	0	112.4	I717 A791 Y849 F850 L856 S857	I717-C853 HydrophobicContact CG1-CB 4.3Å; I717-C853 HydrophobicContact CG2-CB 4.2Å; A791-C853 HydrophobicContact CB-CB 3.89Å; Y849-C853 PolarHBondContact O-N 3.27Å; Y849-C853 PolarHBondContact O-SG 2.95Å; Y849-C853 VanDerWaalsContact O-SG 3.33Å; F850-C853 PolarHBondContact O-N 3.05Å; C853-L856 PolarHBondContact O-N 3.46Å; C853-S857 PolarHBondContact O-N 3.49Å
854	V	93.5	Very high	89.3	Confident	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-66.9	-41.5	174.4	172.9	0	0	0	0	111	F788 A791 F850 T851 C852 L856 S857 L858 I879 Y883	F788-V854 HydrophobicContact CD2-CG1 4.48Å; F788-V854 HydrophobicContact CD2-CG2 4.41Å; F788-V854 HydrophobicContact CE2-CG1 4.16Å; F788-V854 HydrophobicContact CE2-CG2 4.08Å; A791-V854 HydrophobicContact CB-CG2 4.1Å; F850-V854 WeakPolarHBondContact O-CG2 3.31Å; F850-V854 PolarHBondContact O-N 3.35Å; T851-V854 PolarHBondContact O-N 3.16Å; C852-V854 VanDerWaalsContact C-N 3.34Å; C852-V854 PolarHBondContact O-N 3.06Å; V854-L856 VanDerWaalsContact C-N 3.32Å; V854-L856 PolarHBondContact O-N 2.91Å; V854-S857 PolarHBondContact O-N 3.12Å; V854-S857 VanDerWaalsContact O-N 3.07Å; V854-S857 PolarHBondContact O-OG 3.3Å; V854-L858 HydrophobicContact CG1-CD1 4.44Å; V854-L858 PolarHBondContact O-N 3.42Å; V854-I879 HydrophobicContact CG1-CG2 4.18Å; V854-Y883 HydrophobicContact CG1-CD1 4.42Å; V854-Y883 HydrophobicContact CG1-CG 4.29Å; V854-Y883 HydrophobicContact CG2-CD2 3.75Å; V854-Y883 HydrophobicContact CG2-CE2 3.91Å; V854-Y883 HydrophobicContact CG2-CG 4.16Å
855	L	92.8	Very high	89.4	Confident	4 Å²	4	5.3 Å²	5.3	2%	0.021	3%	0.031	C	C	.	.	H	α-helix	trans	-60.5	-37.9	171.9	-69.1	171.3	0	0	0	112.3	W277 T851 C852 L858 L859 V934 I935 F938	W277-L855 HydrophobicContact CB-CD1 4.13Å; T851-L855 WeakPolarHBondContact O-CG 3.37Å; T851-L855 PolarHBondContact O-N 3.49Å; C852-L855 PolarHBondContact O-N 3.48Å; L855-L858 HydrophobicContact CD2-CD1 4.46Å; L855-L858 PolarHBondContact O-N 3.25Å; L855-L859 WeakPolarHBondContact O-CG 3.48Å; L855-L859 PolarHBondContact O-N 2.93Å; L855-V934 HydrophobicContact CD1-CG1 4.38Å; L855-I935 HydrophobicContact CD2-CG1 4.41Å; L855-F938 HydrophobicContact CD2-CB 3.87Å; L855-F938 HydrophobicContact CD2-CD1 3.73Å; L855-F938 HydrophobicContact CD2-CD2 4.02Å; L855-F938 HydrophobicContact CD2-CE1 4.21Å; L855-F938 HydrophobicContact CD2-CE2 4.47Å; L855-F938 HydrophobicContact CD2-CG 3.62Å
856	L	93.5	Very high	89.7	Confident	1 Å²	1	6.3 Å²	6.3	1%	0.005	3%	0.033	C	C	.	.	H	α-helix	trans	-64.7	-37.5	171.5	-68.3	-179.6	0	0	0	112.3	V332 C335 V713 I717 I720 C852 C853 V854 L859 A860	V332-L856 HydrophobicContact CG1-CD2 4.49Å; V332-L856 HydrophobicContact CG2-CD1 4.38Å; C335-L856 HydrophobicContact CB-CD1 4.23Å; C335-L856 HydrophobicContact CB-CD2 3.98Å; V713-L856 HydrophobicContact CG1-CB 4.2Å; I717-L856 HydrophobicContact CD1-CB 4.17Å; I717-L856 HydrophobicContact CG1-CB 4.2Å; I717-L856 HydrophobicContact CG1-CD1 4.23Å; I720-L856 HydrophobicContact CD1-CD1 3.66Å; C852-L856 WeakPolarHBondContact O-CG 3.34Å; C852-L856 PolarHBondContact O-N 2.9Å; C853-L856 PolarHBondContact O-N 3.46Å; V854-L856 VanDerWaalsContact C-N 3.32Å; V854-L856 PolarHBondContact O-N 2.91Å; L856-L859 HydrophobicContact CD2-CD1 4.13Å; L856-L859 WeakPolarHBondContact O-CB 3.21Å; L856-L859 PolarHBondContact O-N 3.31Å; L856-A860 PolarHBondContact O-N 3.03Å; L856-A860 VanDerWaalsContact O-N 3.07Å
857	S	93	Very high	89.7	Confident	0 Å²	0	7 Å²	7	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-67.8	-36.6	174.7	78.9	0	0	0	0	112.7	C853 V854 A860	C853-S857 PolarHBondContact O-N 3.49Å; V854-S857 PolarHBondContact O-N 3.12Å; V854-S857 VanDerWaalsContact O-N 3.07Å; V854-S857 PolarHBondContact O-OG 3.3Å; S857-A860 WeakPolarHBondContact O-CB 3.38Å; S857-A860 PolarHBondContact O-N 3.48Å
858	L	92.8	Very high	89.8	Confident	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-66.9	-36.5	171.8	-73.3	170.3	0	0	0	111.7	V854 L855 A860 C861 M876 I879 I935 F938 V939 L942	V854-L858 HydrophobicContact CG1-CD1 4.44Å; V854-L858 PolarHBondContact O-N 3.42Å; L855-L858 HydrophobicContact CD2-CD1 4.46Å; L855-L858 PolarHBondContact O-N 3.25Å; L858-A860 VanDerWaalsContact C-N 3.31Å; L858-A860 PolarHBondContact O-N 3.02Å; L858-C861 WeakPolarHBondContact O-CB 3.15Å; L858-C861 PolarHBondContact O-N 2.84Å; L858-M876 HydrophobicContact CD2-CB 3.94Å; L858-M876 HydrophobicContact CD2-CG 3.84Å; L858-I879 HydrophobicContact CD1-CG2 4.49Å; L858-I879 HydrophobicContact CD2-CB 4.07Å; L858-I879 HydrophobicContact CD2-CD1 4.28Å; L858-I879 HydrophobicContact CD2-CG2 3.6Å; L858-I879 HydrophobicContact CG-CG2 3.93Å; L858-I935 HydrophobicContact CD1-CG2 4.12Å; L858-F938 HydrophobicContact CB-CD1 4.43Å; L858-V939 HydrophobicContact CD1-CG2 4.11Å; L858-V939 HydrophobicContact CD2-CG2 4.31Å; L858-L942 HydrophobicContact CB-CD1 3.81Å; L858-L942 WeakPolarHBondContact O-CD1 3.47Å
859	L	91.9	Very high	89.9	Confident	2 Å²	2	8.3 Å²	8.3	1%	0.01	5%	0.048	C	C	.	.	H	α-helix	trans	-61.9	-35.6	170.9	-81.3	176.5	0	0	0	112.5	V280 H284 V339 L855 L856 C861 S862 F938 L942	V280-L859 HydrophobicContact CG1-CD1 3.74Å; H284-L859 HydrophobicContact CB-CD2 4.04Å; H284-L859 WeakPolarHBondContact ND1-CD2 3.22Å; V339-L859 HydrophobicContact CG1-CB 4.12Å; L855-L859 WeakPolarHBondContact O-CG 3.48Å; L855-L859 PolarHBondContact O-N 2.93Å; L856-L859 HydrophobicContact CD2-CD1 4.13Å; L856-L859 WeakPolarHBondContact O-CB 3.21Å; L856-L859 PolarHBondContact O-N 3.31Å; L859-C861 PolarHBondContact O-N 2.99Å; L859-S862 PolarHBondContact O-N 3.44Å; L859-S862 PolarHBondContact O-OG 2.96Å; L859-F938 HydrophobicContact CD1-CZ 4.22Å; L859-F938 HydrophobicContact CD2-CE1 3.96Å; L859-F938 HydrophobicContact CD2-CZ 3.79Å; L859-F938 HydrophobicContact CG-CE1 3.83Å; L859-F938 HydrophobicContact CG-CZ 3.79Å; L859-L942 HydrophobicContact CD2-CD2 4.39Å
860	A	91.4	Very high	89.8	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.3	-28.9	175.2	0	0	0	0	0	112.6	V713 L856 S857 L858 S862 V863	V713-A860 HydrophobicContact CG1-CB 4.41Å; V713-A860 HydrophobicContact CG2-CB 4.47Å; L856-A860 PolarHBondContact O-N 3.03Å; L856-A860 VanDerWaalsContact O-N 3.07Å; S857-A860 WeakPolarHBondContact O-CB 3.38Å; S857-A860 PolarHBondContact O-N 3.48Å; L858-A860 VanDerWaalsContact C-N 3.31Å; L858-A860 PolarHBondContact O-N 3.02Å; A860-S862 VanDerWaalsContact C-N 3.25Å; A860-S862 PolarHBondContact O-N 3.07Å; A860-V863 PolarHBondContact O-N 3.46Å
861	C	90.8	Very high	89.7	Confident	2 Å²	2	11.9 Å²	11.9	1%	0.014	7%	0.074	C	C	.	.	H	α-helix	trans	-61.9	-28.3	173.4	-56.2	0	0	0	0	113.4	I784 L858 L859 V863 K872 M876	I784-C861 HydrophobicContact CD1-CB 4.48Å; I784-C861 VanDerWaalsContact CG2-SG 3.59Å; L858-C861 WeakPolarHBondContact O-CB 3.15Å; L858-C861 PolarHBondContact O-N 2.84Å; L859-C861 PolarHBondContact O-N 2.99Å; C861-V863 VanDerWaalsContact C-N 3.31Å; C861-V863 PolarHBondContact O-N 2.83Å; C861-K872 WeakPolarHBondContact O-CE 3.21Å; C861-M876 HydrophobicContact CB-CG 4.36Å; C861-M876 HydrophobicContact CB-SD 4.39Å
862	S	88.1	Confident	89.8	Confident	6 Å²	6	11.8 Å²	11.8	4%	0.042	7%	0.072	C	C	.	.	H	α-helix	trans	-72.1	-26.9	-177.7	80.8	0	0	0	0	112.9	T343 L859 A860 F864	T343-S862 PolarHBondContact OG1-OG 3.2Å; L859-S862 PolarHBondContact O-N 3.44Å; L859-S862 PolarHBondContact O-OG 2.96Å; A860-S862 VanDerWaalsContact C-N 3.25Å; A860-S862 PolarHBondContact O-N 3.07Å; S862-F864 PolarHBondContact O-N 3.35Å
863	V	89.1	Confident	89.8	Confident	1 Å²	1	12.8 Å²	12.8	1%	0.006	8%	0.077	C	C	.	.	H	α-helix	trans	-69.5	-32.5	-174.4	-175.5	0	0	0	0	112.3	V339 C342 Y706 C709 A860 C861 L865	V339-V863 HydrophobicContact CG1-CG2 3.72Å; C342-V863 HydrophobicContact CB-CG1 4.46Å; Y706-V863 HydrophobicContact CD1-CG1 3.75Å; Y706-V863 VanDerWaalsContact CD1-O 3.23Å; Y706-V863 WeakPolarHBondContact CD1-O 3.29Å; Y706-V863 HydrophobicContact CG-CG1 4.26Å; C709-V863 HydrophobicContact CB-CG1 3.89Å; A860-V863 PolarHBondContact O-N 3.46Å; C861-V863 VanDerWaalsContact C-N 3.31Å; C861-V863 PolarHBondContact O-N 2.83Å; V863-L865 VanDerWaalsContact C-N 3.25Å; V863-L865 PolarHBondContact O-N 2.9Å
864	F	89.7	Confident	89.7	Confident	3 Å²	3	19.6 Å²	19.6	1%	0.013	11%	0.107	C	C	.	.			trans	-76.1	72.2	-179.3	-70.8	-89.9	0	0	0	111.5	F703 Y706 V707 A710 T783 I784 S862 Q866 V867 K872	F703-F864 HydrophobicContact CE2-CD1 4.26Å; F703-F864 AromaticContact CE2-CE1 3.99Å; F703-F864 HydrophobicContact CE2-CE1 3.99Å; Y706-F864 HydrophobicContact CD2-CD1 4.34Å; Y706-F864 HydrophobicContact CG-CD1 4.45Å; V707-F864 HydrophobicContact CG2-CE1 4.2Å; V707-F864 HydrophobicContact CG2-CZ 4.45Å; A710-F864 HydrophobicContact CB-CE2 4.09Å; A710-F864 HydrophobicContact CB-CZ 4.24Å; T783-F864 HydrophobicContact CG2-CZ 4.48Å; I784-F864 HydrophobicContact CD1-CD2 3.77Å; I784-F864 HydrophobicContact CD1-CE2 3.93Å; I784-F864 HydrophobicContact CG1-CD2 4.16Å; I784-F864 HydrophobicContact CG1-CE2 3.8Å; S862-F864 PolarHBondContact O-N 3.35Å; F864-Q866 VanDerWaalsContact C-N 3.27Å; F864-Q866 PolarHBondContact O-N 3.19Å; F864-Q866 VanDerWaalsContact O-N 3.12Å; F864-V867 HydrophobicContact CB-CB 4.44Å; F864-V867 HydrophobicContact CB-CG2 3.79Å; F864-V867 PolarHBondContact O-N 3.06Å; F864-K872 WeakPolarHBondContact O-CE 3.37Å; F864-K872 PolarHBondContact O-NZ 2.8Å
865	L	83.3	Confident	89.7	Confident	20 Å²	20	20.5 Å²	20.5	11%	0.105	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-39	-169.8	-61.3	-179.2	0	0	0	113.7	T343 P346 Y706 V863 K872 V949	T343-L865 HydrophobicContact CG2-CD2 4.12Å; P346-L865 HydrophobicContact CB-CD1 4Å; Y706-L865 HydrophobicContact CE1-CG 4.45Å; V863-L865 VanDerWaalsContact C-N 3.25Å; V863-L865 PolarHBondContact O-N 2.9Å; L865-K872 PolarHBondContact O-NZ 2.76Å; L865-V949 HydrophobicContact CB-CG1 4.12Å; L865-V949 HydrophobicContact CD2-CG1 3.96Å; L865-V949 HydrophobicContact CD2-CG2 4.39Å
866	Q	81.4	Confident	89.7	Confident	41 Å²	41	20.4 Å²	20.4	19%	0.192	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.8	-174.5	-58.2	-149.7	34.2	0	0	116.1	D700 R773 F864	D700-Q866 HydrophobicContact CB-CG 4.38Å; D700-Q866 VanDerWaalsContact CB-NE2 3.32Å; D700-Q866 VanDerWaalsContact CG-CD 3.42Å; D700-Q866 PolarHBondContact OD1-NE2 2.61Å; D700-Q866 WeakPolarHBondContact OD2-CG 3.22Å; R773-Q866 PolarHBondContact NE-O 3.17Å; R773-Q866 PolarHBondContact NH2-O 3.47Å; F864-Q866 VanDerWaalsContact C-N 3.27Å; F864-Q866 PolarHBondContact O-N 3.19Å; F864-Q866 VanDerWaalsContact O-N 3.12Å
867	V	84.8	Confident	89.8	Confident	19 Å²	19	24 Å²	24	12%	0.115	13%	0.129	C	C	.	.	S	Bend	trans	-71	134.8	173.9	-179	0	0	0	0	109	T777 F864 K872	T777-V867 HydrophobicContact CG2-CB 4.44Å; T777-V867 HydrophobicContact CG2-CG1 4.5Å; T777-V867 HydrophobicContact CG2-CG2 3.93Å; F864-V867 HydrophobicContact CB-CB 4.44Å; F864-V867 HydrophobicContact CB-CG2 3.79Å; F864-V867 PolarHBondContact O-N 3.06Å; V867-K872 HydrophobicContact CB-CG 4.41Å; V867-K872 HydrophobicContact CG1-CG 4.11Å; V867-K872 WeakPolarHBondContact O-CE 3.31Å; V867-K872 PolarHBondContact O-NZ 2.98Å
868	S	87.5	Confident	89.8	Confident	41 Å²	41	29 Å²	29	29%	0.287	15%	0.152	S	C	.	.			trans	-61.2	146.3	-175	62.4	0	0	0	0	112.8	I870 G871 K872	S868-I870 VanDerWaalsContact C-N 3.28Å; S868-I870 PolarHBondContact O-N 3.1Å; S868-G871 PolarHBondContact O-N 3.33Å; S868-G871 VanDerWaalsContact O-N 3.13Å; S868-G871 PolarHBondContact OG-N 2.87Å; S868-K872 PolarHBondContact O-N 3.41Å
869	S	88.1	Confident	89.8	Confident	2 Å²	2	29 Å²	29	1%	0.014	15%	0.152	C	C	.	.	H	α-helix	trans	-56.4	-41.3	179.2	54	0	0	0	0	112.2	L873 E950	S869-L873 WeakPolarHBondContact O-CB 3.34Å; S869-L873 PolarHBondContact O-N 3.26Å; S869-E950 VanDerWaalsContact CB-OE2 3.3Å; S869-E950 WeakPolarHBondContact CB-OE2 3.14Å; S869-E950 PolarHBondContact N-OE2 3.01Å; S869-E950 PolarHBondContact OG-OE2 2.92Å
870	I	88.6	Confident	89.8	Confident	56 Å²	56	29.7 Å²	29.7	29%	0.287	15%	0.154	S	C	.	.	H	α-helix	trans	-69.9	-36.8	176.4	-169.7	60.3	0	0	0	112.8	S868 L873 F874	S868-I870 VanDerWaalsContact C-N 3.28Å; S868-I870 PolarHBondContact O-N 3.1Å; I870-L873 HydrophobicContact CD1-CD2 4.28Å; I870-L873 PolarHBondContact O-N 3.5Å; I870-F874 HydrophobicContact CD1-CD2 4.37Å; I870-F874 HydrophobicContact CD1-CE2 3.9Å; I870-F874 HydrophobicContact CD1-CZ 4.38Å; I870-F874 HydrophobicContact CG1-CD2 4.12Å; I870-F874 HydrophobicContact CG1-CE2 3.72Å; I870-F874 WeakPolarHBondContact O-CD2 3.42Å; I870-F874 PolarHBondContact O-N 2.92Å; I870-F874 VanDerWaalsContact O-N 3.08Å
871	G	88.6	Confident	89.9	Confident	27 Å²	27	35.4 Å²	35.4	28%	0.278	19%	0.185	S	C	.	.	H	α-helix	trans	-67.1	-41	174.6	0	0	0	0	0	112.1	S868 F874 L875	S868-G871 PolarHBondContact O-N 3.33Å; S868-G871 VanDerWaalsContact O-N 3.13Å; S868-G871 PolarHBondContact OG-N 2.87Å; G871-F874 PolarHBondContact O-N 3.35Å; G871-L875 PolarHBondContact O-N 3.01Å; G871-L875 VanDerWaalsContact O-N 3.1Å
872	K	91.4	Very high	90	Very high	10 Å²	10	37.7 Å²	37.7	4%	0.043	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-44.7	170.1	-75.9	167.9	171.6	148.5	0	111.6	C861 F864 L865 V867 S868 L875 M876 A946	C861-K872 WeakPolarHBondContact O-CE 3.21Å; F864-K872 WeakPolarHBondContact O-CE 3.37Å; F864-K872 PolarHBondContact O-NZ 2.8Å; L865-K872 PolarHBondContact O-NZ 2.76Å; V867-K872 HydrophobicContact CB-CG 4.41Å; V867-K872 HydrophobicContact CG1-CG 4.11Å; V867-K872 WeakPolarHBondContact O-CE 3.31Å; V867-K872 PolarHBondContact O-NZ 2.98Å; S868-K872 PolarHBondContact O-N 3.41Å; K872-L875 PolarHBondContact O-N 2.96Å; K872-M876 HydrophobicContact CB-CE 4.38Å; K872-M876 WeakPolarHBondContact O-CB 3.11Å; K872-M876 VanDerWaalsContact O-CG 3.27Å; K872-M876 WeakPolarHBondContact O-CG 3.42Å; K872-M876 PolarHBondContact O-N 3.13Å; K872-A946 HydrophobicContact CB-CB 4.48Å; K872-A946 HydrophobicContact CD-CB 3.63Å
873	L	92.1	Very high	90.1	Very high	34 Å²	34	37.5 Å²	37.5	18%	0.178	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-48.6	178.9	-177.7	61.4	0	0	0	111.8	S869 I870 L875 M876 L877 Y943	S869-L873 WeakPolarHBondContact O-CB 3.34Å; S869-L873 PolarHBondContact O-N 3.26Å; I870-L873 HydrophobicContact CD1-CD2 4.28Å; I870-L873 PolarHBondContact O-N 3.5Å; L873-L875 VanDerWaalsContact C-N 3.33Å; L873-L875 PolarHBondContact O-N 2.98Å; L873-M876 PolarHBondContact O-N 3.2Å; L873-L877 HydrophobicContact CD1-CD1 3.89Å; L873-L877 HydrophobicContact CD1-CG 4Å; L873-L877 HydrophobicContact CG-CD1 3.84Å; L873-L877 HydrophobicContact CG-CG 4.36Å; L873-L877 WeakPolarHBondContact O-CB 3.43Å; L873-L877 VanDerWaalsContact O-CG 3.31Å; L873-L877 WeakPolarHBondContact O-CG 3.38Å; L873-L877 PolarHBondContact O-N 3.3Å; L873-Y943 HydrophobicContact CB-CD2 3.84Å; L873-Y943 HydrophobicContact CB-CE2 4.16Å; L873-Y943 HydrophobicContact CD1-CD2 4Å; L873-Y943 HydrophobicContact CD1-CG 4.04Å; L873-Y943 HydrophobicContact CD2-CD2 4.03Å; L873-Y943 HydrophobicContact CD2-CE2 3.86Å; L873-Y943 HydrophobicContact CG-CD2 4.17Å; L873-Y943 HydrophobicContact CG-CE2 4.44Å
874	F	92.5	Very high	90.2	Very high	143 Å²	143	38.6 Å²	38.6	63%	0.627	20%	0.2	S	C	*	.	H	α-helix	trans	-60.5	-40.3	176.4	-75.5	-59	0	0	0	112.7	I870 G871 F878	I870-F874 HydrophobicContact CD1-CD2 4.37Å; I870-F874 HydrophobicContact CD1-CE2 3.9Å; I870-F874 HydrophobicContact CD1-CZ 4.38Å; I870-F874 HydrophobicContact CG1-CD2 4.12Å; I870-F874 HydrophobicContact CG1-CE2 3.72Å; I870-F874 WeakPolarHBondContact O-CD2 3.42Å; I870-F874 PolarHBondContact O-N 2.92Å; I870-F874 VanDerWaalsContact O-N 3.08Å; G871-F874 PolarHBondContact O-N 3.35Å; F874-F878 WeakPolarHBondContact O-CB 3.26Å; F874-F878 PolarHBondContact O-N 3.35Å
875	L	92.1	Very high	90.2	Very high	18 Å²	18	43.5 Å²	43.5	9%	0.094	23%	0.226	C	C	.	.	H	α-helix	trans	-66.5	-43.1	177.2	-178.4	59.4	0	0	0	112.4	V781 I784 I785 G871 K872 L873 F878 I879	V781-L875 HydrophobicContact CG1-CD1 4.24Å; V781-L875 HydrophobicContact CG1-CD2 4.43Å; V781-L875 HydrophobicContact CG2-CD2 4.27Å; I784-L875 HydrophobicContact CB-CD2 4.11Å; I784-L875 HydrophobicContact CD1-CD2 3.71Å; I784-L875 HydrophobicContact CG2-CD2 3.83Å; I784-L875 HydrophobicContact CG2-CG 4.4Å; I785-L875 HydrophobicContact CD1-CD1 4.41Å; I785-L875 HydrophobicContact CG1-CD1 4.07Å; G871-L875 PolarHBondContact O-N 3.01Å; G871-L875 VanDerWaalsContact O-N 3.1Å; K872-L875 PolarHBondContact O-N 2.96Å; L873-L875 VanDerWaalsContact C-N 3.33Å; L873-L875 PolarHBondContact O-N 2.98Å; L875-F878 PolarHBondContact O-N 3.24Å; L875-I879 HydrophobicContact CD1-CD1 4.25Å; L875-I879 HydrophobicContact CG-CD1 4.12Å; L875-I879 VanDerWaalsContact O-CG1 3.31Å; L875-I879 WeakPolarHBondContact O-CG1 3.39Å; L875-I879 PolarHBondContact O-N 3.46Å
876	M	93.9	Very high	90.4	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-68.6	-41.6	179.1	-68	-176.8	-53.5	0	0	111.9	L858 C861 K872 L873 F878 I879 E880 V939 L942	L858-M876 HydrophobicContact CD2-CB 3.94Å; L858-M876 HydrophobicContact CD2-CG 3.84Å; C861-M876 HydrophobicContact CB-CG 4.36Å; C861-M876 HydrophobicContact CB-SD 4.39Å; K872-M876 HydrophobicContact CB-CE 4.38Å; K872-M876 WeakPolarHBondContact O-CB 3.11Å; K872-M876 VanDerWaalsContact O-CG 3.27Å; K872-M876 WeakPolarHBondContact O-CG 3.42Å; K872-M876 PolarHBondContact O-N 3.13Å; L873-M876 PolarHBondContact O-N 3.2Å; M876-F878 VanDerWaalsContact C-N 3.32Å; M876-F878 PolarHBondContact O-N 3.2Å; M876-I879 PolarHBondContact O-N 3.17Å; M876-E880 WeakPolarHBondContact O-CB 3.34Å; M876-E880 PolarHBondContact O-N 3.03Å; M876-V939 HydrophobicContact CB-CG1 3.93Å; M876-V939 HydrophobicContact CB-CG2 4.23Å; M876-V939 HydrophobicContact CE-CG1 4.43Å; M876-L942 HydrophobicContact CE-CB 4.07Å; M876-L942 HydrophobicContact SD-CB 3.56Å; M876-L942 VanDerWaalsContact SD-CB 3.56Å; M876-L942 HydrophobicContact SD-CD1 3.85Å; M876-L942 HydrophobicContact SD-CG 4.37Å
877	L	94.1	Very high	90.5	Very high	76 Å²	76	41.7 Å²	41.7	40%	0.398	22%	0.218	S	C	.	.	H	α-helix	trans	-65.1	-33.8	174.1	-70.5	173.1	0	0	0	112.3	L873 L881 V939	L873-L877 HydrophobicContact CD1-CD1 3.89Å; L873-L877 HydrophobicContact CD1-CG 4Å; L873-L877 HydrophobicContact CG-CD1 3.84Å; L873-L877 HydrophobicContact CG-CG 4.36Å; L873-L877 WeakPolarHBondContact O-CB 3.43Å; L873-L877 VanDerWaalsContact O-CG 3.31Å; L873-L877 WeakPolarHBondContact O-CG 3.38Å; L873-L877 PolarHBondContact O-N 3.3Å; L877-L881 WeakPolarHBondContact O-CB 3.43Å; L877-L881 PolarHBondContact O-N 3.04Å; L877-V939 HydrophobicContact CD2-CG1 4.3Å
878	F	93.9	Very high	90.3	Very high	106 Å²	106	46.1 Å²	46.1	47%	0.465	24%	0.237	S	C	.	.	H	α-helix	trans	-67.1	-43.5	173	174.8	-98.9	0	0	0	111.9	F874 L875 M876 L882	F874-F878 WeakPolarHBondContact O-CB 3.26Å; F874-F878 PolarHBondContact O-N 3.35Å; L875-F878 PolarHBondContact O-N 3.24Å; M876-F878 VanDerWaalsContact C-N 3.32Å; M876-F878 PolarHBondContact O-N 3.2Å; F878-L882 HydrophobicContact CE1-CD2 3.98Å; F878-L882 HydrophobicContact CE2-CD2 4.47Å; F878-L882 HydrophobicContact CZ-CD2 3.75Å; F878-L882 WeakPolarHBondContact O-CB 3.34Å; F878-L882 PolarHBondContact O-N 3.42Å
879	I	92.7	Very high	89.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-47.9	174.7	-74.7	167.5	0	0	0	110.9	I784 F788 V854 L858 L875 M876 Y883	I784-I879 HydrophobicContact CG2-CD1 4.02Å; F788-I879 HydrophobicContact CB-CD1 4.33Å; F788-I879 HydrophobicContact CB-CG1 4.32Å; F788-I879 HydrophobicContact CD1-CG1 3.82Å; F788-I879 HydrophobicContact CD2-CB 4.47Å; F788-I879 HydrophobicContact CD2-CG1 4.29Å; F788-I879 HydrophobicContact CD2-CG2 3.68Å; F788-I879 HydrophobicContact CE1-CB 4.46Å; F788-I879 HydrophobicContact CE1-CG1 4.17Å; F788-I879 HydrophobicContact CE2-CB 4.44Å; F788-I879 HydrophobicContact CE2-CG2 3.67Å; F788-I879 HydrophobicContact CG-CD1 4.39Å; F788-I879 HydrophobicContact CG-CG1 3.87Å; F788-I879 HydrophobicContact CG-CG2 4.15Å; F788-I879 HydrophobicContact CZ-CB 4.42Å; F788-I879 HydrophobicContact CZ-CG2 4.09Å; F788-I879 WeakPolarHBondContact CZ-O 3.49Å; V854-I879 HydrophobicContact CG1-CG2 4.18Å; L858-I879 HydrophobicContact CD1-CG2 4.49Å; L858-I879 HydrophobicContact CD2-CB 4.07Å; L858-I879 HydrophobicContact CD2-CD1 4.28Å; L858-I879 HydrophobicContact CD2-CG2 3.6Å; L858-I879 HydrophobicContact CG-CG2 3.93Å; L875-I879 HydrophobicContact CD1-CD1 4.25Å; L875-I879 HydrophobicContact CG-CD1 4.12Å; L875-I879 VanDerWaalsContact O-CG1 3.31Å; L875-I879 WeakPolarHBondContact O-CG1 3.39Å; L875-I879 PolarHBondContact O-N 3.46Å; M876-I879 PolarHBondContact O-N 3.17Å; I879-Y883 VanDerWaalsContact O-CB 3.31Å; I879-Y883 WeakPolarHBondContact O-CB 3.39Å; I879-Y883 PolarHBondContact O-N 3.13Å
880	E	92.6	Very high	89.5	Confident	15 Å²	15	52.5 Å²	52.5	7%	0.07	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-56	176.3	175.6	171.3	-157.4	0	0	111.5	M876 L882 Y883 L884 I935 T936 V939	M876-E880 WeakPolarHBondContact O-CB 3.34Å; M876-E880 PolarHBondContact O-N 3.03Å; E880-L882 PolarHBondContact O-N 2.88Å; E880-Y883 PolarHBondContact O-N 3.14Å; E880-L884 HydrophobicContact CG-CD1 3.96Å; E880-L884 WeakPolarHBondContact O-CB 3.31Å; E880-L884 VanDerWaalsContact O-CG 3.3Å; E880-L884 WeakPolarHBondContact O-CG 3.47Å; E880-L884 PolarHBondContact O-N 3.37Å; E880-I935 HydrophobicContact CB-CG2 3.98Å; E880-I935 HydrophobicContact CG-CG2 3.7Å; E880-T936 WeakPolarHBondContact OE1-CA 3.4Å; E880-T936 VanDerWaalsContact OE1-CB 3.3Å; E880-T936 WeakPolarHBondContact OE1-CB 3.36Å; E880-T936 PolarHBondContact OE1-N 3.5Å; E880-T936 PolarHBondContact OE1-OG1 2.91Å; E880-V939 HydrophobicContact CB-CG2 4.46Å
881	L	92.8	Very high	89.3	Confident	121 Å²	121	50.6 Å²	50.6	63%	0.634	27%	0.265	S	S	*	.	H	α-helix	trans	-60.9	-42.4	-177.9	-179.1	64	0	0	0	112.6	L877 L885	L877-L881 WeakPolarHBondContact O-CB 3.43Å; L877-L881 PolarHBondContact O-N 3.04Å; L881-L885 VanDerWaalsContact O-CB 3.27Å; L881-L885 WeakPolarHBondContact O-CB 3.33Å; L881-L885 PolarHBondContact O-N 3.38Å
882	L	92.3	Very high	89	Confident	50 Å²	50	51.3 Å²	51.3	26%	0.262	26%	0.264	S	S	.	.	H	α-helix	trans	-69.6	-38.9	-179.8	-179.4	50.6	0	0	0	111.6	F788 F878 E880 I886	F788-L882 HydrophobicContact CE1-CB 4.42Å; F788-L882 HydrophobicContact CE1-CD2 4.04Å; F788-L882 HydrophobicContact CE1-CG 4.3Å; F788-L882 HydrophobicContact CZ-CB 4.47Å; F878-L882 HydrophobicContact CE1-CD2 3.98Å; F878-L882 HydrophobicContact CE2-CD2 4.47Å; F878-L882 HydrophobicContact CZ-CD2 3.75Å; F878-L882 WeakPolarHBondContact O-CB 3.34Å; F878-L882 PolarHBondContact O-N 3.42Å; E880-L882 PolarHBondContact O-N 2.88Å; L882-I886 HydrophobicContact CD1-CD1 3.93Å; L882-I886 HydrophobicContact CD1-CG1 4.44Å; L882-I886 HydrophobicContact CG-CD1 4.29Å; L882-I886 WeakPolarHBondContact O-CD1 3.25Å; L882-I886 VanDerWaalsContact O-CG1 3.29Å; L882-I886 WeakPolarHBondContact O-CG1 3.34Å; L882-I886 PolarHBondContact O-N 3.5Å
883	Y	91.1	Very high	88.6	Confident	1 Å²	1	51.9 Å²	51.9	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-46.6	174	179.2	-110.4	0	0	0	111.9	F792 T851 V854 I879 E880 L885 I886 M887 T931 I935	F792-Y883 HydrophobicContact CB-CD2 4.41Å; T851-Y883 PolarHBondContact OG1-OH 3.13Å; T851-Y883 VanDerWaalsContact OG1-OH 3.1Å; V854-Y883 HydrophobicContact CG1-CD1 4.42Å; V854-Y883 HydrophobicContact CG1-CG 4.29Å; V854-Y883 HydrophobicContact CG2-CD2 3.75Å; V854-Y883 HydrophobicContact CG2-CE2 3.91Å; V854-Y883 HydrophobicContact CG2-CG 4.16Å; I879-Y883 VanDerWaalsContact O-CB 3.31Å; I879-Y883 WeakPolarHBondContact O-CB 3.39Å; I879-Y883 PolarHBondContact O-N 3.13Å; E880-Y883 PolarHBondContact O-N 3.14Å; Y883-L885 PolarHBondContact O-N 3.48Å; Y883-I886 PolarHBondContact O-N 3.09Å; Y883-I886 VanDerWaalsContact O-N 3.14Å; Y883-M887 HydrophobicContact CD1-CG 4.23Å; Y883-M887 HydrophobicContact CD2-CG 4.2Å; Y883-M887 HydrophobicContact CE1-CG 3.74Å; Y883-M887 HydrophobicContact CE2-CG 3.7Å; Y883-M887 HydrophobicContact CE2-SD 3.75Å; Y883-M887 HydrophobicContact CG-CG 4.45Å; Y883-M887 VanDerWaalsContact CZ-CG 3.44Å; Y883-M887 WeakPolarHBondContact O-CG 3.4Å; Y883-M887 PolarHBondContact O-N 3.47Å; Y883-T931 HydrophobicContact CE1-CG2 3.89Å; Y883-I935 HydrophobicContact CD1-CD1 3.49Å; Y883-I935 VanDerWaalsContact CD1-CD1 3.49Å; Y883-I935 HydrophobicContact CE1-CD1 3.59Å
884	L	90.2	Very high	88.2	Confident	24 Å²	24	50.8 Å²	50.8	13%	0.126	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-41	178.9	-67.9	-178.4	0	0	0	112.2	E880 I886 M887 E888 P932	E880-L884 HydrophobicContact CG-CD1 3.96Å; E880-L884 WeakPolarHBondContact O-CB 3.31Å; E880-L884 VanDerWaalsContact O-CG 3.3Å; E880-L884 WeakPolarHBondContact O-CG 3.47Å; E880-L884 PolarHBondContact O-N 3.37Å; L884-I886 PolarHBondContact O-N 2.91Å; L884-M887 PolarHBondContact O-N 2.89Å; L884-M887 VanDerWaalsContact O-N 3.17Å; L884-E888 WeakPolarHBondContact O-CB 3.13Å; L884-E888 WeakPolarHBondContact O-CG 3.48Å; L884-E888 PolarHBondContact O-N 3.27Å; L884-P932 HydrophobicContact CD1-CB 4.14Å; L884-P932 HydrophobicContact CD2-CB 4.02Å; L884-P932 HydrophobicContact CD2-CG 3.89Å
885	L	90.2	Very high	87.9	Confident	106 Å²	106	44.2 Å²	44.2	56%	0.555	23%	0.234	S	C	*	.	H	α-helix	trans	-59.3	-35.2	174.3	-175.7	65.9	0	0	0	112.7	L881 Y883 V889	L881-L885 VanDerWaalsContact O-CB 3.27Å; L881-L885 WeakPolarHBondContact O-CB 3.33Å; L881-L885 PolarHBondContact O-N 3.38Å; Y883-L885 PolarHBondContact O-N 3.48Å; L885-V889 HydrophobicContact CD1-CG2 4.22Å
886	I	87.2	Confident	87.5	Confident	18 Å²	18	45.3 Å²	45.3	9%	0.092	24%	0.24	C	C	.	.	H	α-helix	trans	-77.7	-33.3	177.7	-67.7	167.7	0	0	0	111.6	F792 I795 F796 L882 Y883 L884 P890	F792-I886 HydrophobicContact CD2-CD1 3.91Å; F792-I886 HydrophobicContact CE2-CD1 3.41Å; F792-I886 VanDerWaalsContact CE2-CD1 3.41Å; F792-I886 HydrophobicContact CZ-CD1 4.01Å; I795-I886 HydrophobicContact CG2-CG2 4.11Å; F796-I886 HydrophobicContact CE1-CG2 4.32Å; F796-I886 HydrophobicContact CZ-CD1 4.13Å; F796-I886 HydrophobicContact CZ-CG1 4.45Å; F796-I886 HydrophobicContact CZ-CG2 4.1Å; L882-I886 HydrophobicContact CD1-CD1 3.93Å; L882-I886 HydrophobicContact CD1-CG1 4.44Å; L882-I886 HydrophobicContact CG-CD1 4.29Å; L882-I886 WeakPolarHBondContact O-CD1 3.25Å; L882-I886 VanDerWaalsContact O-CG1 3.29Å; L882-I886 WeakPolarHBondContact O-CG1 3.34Å; L882-I886 PolarHBondContact O-N 3.5Å; Y883-I886 PolarHBondContact O-N 3.09Å; Y883-I886 VanDerWaalsContact O-N 3.14Å; L884-I886 PolarHBondContact O-N 2.91Å; I886-P890 VanDerWaalsContact O-CD 3.23Å; I886-P890 WeakPolarHBondContact O-CD 3.44Å; I886-P890 VanDerWaalsContact O-CG 3.25Å; I886-P890 WeakPolarHBondContact O-CG 3.14Å
887	M	83.4	Confident	87	Confident	6 Å²	6	46.4 Å²	46.4	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-77.3	-47.8	176.6	-66.4	-48.8	-44.6	0	0	112.9	I795 Y883 L884 V889 K891 V892 F895	I795-M887 HydrophobicContact CD1-CE 3.81Å; I795-M887 HydrophobicContact CD1-SD 3.27Å; I795-M887 WeakPolarHBondContact CD1-SD 3.38Å; Y883-M887 HydrophobicContact CD1-CG 4.23Å; Y883-M887 HydrophobicContact CD2-CG 4.2Å; Y883-M887 HydrophobicContact CE1-CG 3.74Å; Y883-M887 HydrophobicContact CE2-CG 3.7Å; Y883-M887 HydrophobicContact CE2-SD 3.75Å; Y883-M887 HydrophobicContact CG-CG 4.45Å; Y883-M887 VanDerWaalsContact CZ-CG 3.44Å; Y883-M887 WeakPolarHBondContact O-CG 3.4Å; Y883-M887 PolarHBondContact O-N 3.47Å; L884-M887 PolarHBondContact O-N 2.89Å; L884-M887 VanDerWaalsContact O-N 3.17Å; M887-V889 PolarHBondContact O-N 3.03Å; M887-K891 HydrophobicContact CE-CB 4.26Å; M887-K891 CarbonylContact O-C 3.53Å; M887-V892 VanDerWaalsContact O-CG2 3.3Å; M887-V892 WeakPolarHBondContact O-CG2 3.42Å; M887-V892 PolarHBondContact O-N 3.14Å; M887-F895 HydrophobicContact CB-CE2 4.45Å; M887-F895 HydrophobicContact CE-CD1 3.99Å; M887-F895 HydrophobicContact CE-CD2 4.04Å; M887-F895 HydrophobicContact CE-CE1 3.64Å; M887-F895 HydrophobicContact CE-CE2 3.7Å; M887-F895 HydrophobicContact CE-CG 4.2Å; M887-F895 HydrophobicContact CE-CZ 3.5Å; M887-F895 VanDerWaalsContact CE-CZ 3.5Å; M887-F895 HydrophobicContact CG-CE2 4.37Å; M887-F895 HydrophobicContact CG-CZ 4.39Å; M887-F895 HydrophobicContact SD-CZ 4.27Å
888	E	80.8	Confident	86.4	Confident	112 Å²	112	43 Å²	43	52%	0.523	23%	0.228	S	C	.	.	H	α-helix	trans	-79.3	-15	-170.5	-67.1	-170.1	171.8	0	0	114.5	L884 V892 P932	L884-E888 WeakPolarHBondContact O-CB 3.13Å; L884-E888 WeakPolarHBondContact O-CG 3.48Å; L884-E888 PolarHBondContact O-N 3.27Å; E888-V892 WeakPolarHBondContact O-CG2 3.31Å; E888-P932 WeakPolarHBondContact OE1-CG 3.49Å
889	V	79.6	Confident	85.9	Confident	108 Å²	108	38.8 Å²	38.8	66%	0.655	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-72.4	-179.7	-178.6	0	0	0	0	112.3	L885 M887	L885-V889 HydrophobicContact CD1-CG2 4.22Å; M887-V889 PolarHBondContact O-N 3.03Å
890	P	79.9	Confident	85.3	Confident	69 Å²	69	39.1 Å²	39.1	45%	0.448	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-14.8	-174.6	32.6	-37.8	0	0	0	115.9	I886	I886-P890 VanDerWaalsContact O-CD 3.23Å; I886-P890 WeakPolarHBondContact O-CD 3.44Å; I886-P890 VanDerWaalsContact O-CG 3.25Å; I886-P890 WeakPolarHBondContact O-CG 3.14Å
891	K	83.4	Confident	84.7	Confident	16 Å²	16	39.6 Å²	39.6	7%	0.07	22%	0.215	C	C	.	.			trans	-127.6	14.8	-168.8	-65	-63.1	-177	-177.7	0	116.1	I795 C798 S800 M887 S893 L894	I795-K891 HydrophobicContact CD1-CB 4.32Å; I795-K891 HydrophobicContact CD1-CG 4.35Å; I795-K891 HydrophobicContact CG1-CG 4.38Å; I795-K891 VanDerWaalsContact O-CE 3.29Å; I795-K891 WeakPolarHBondContact O-CE 3.39Å; C798-K891 PolarHBondContact O-NZ 3.45Å; S800-K891 PolarHBondContact OG-NZ 2.97Å; S800-K891 VanDerWaalsContact OG-NZ 3.1Å; M887-K891 HydrophobicContact CE-CB 4.26Å; M887-K891 CarbonylContact O-C 3.53Å; K891-S893 PolarHBondContact O-N 2.65Å; K891-L894 WeakPolarHBondContact O-CB 3.5Å; K891-L894 PolarHBondContact O-N 3.45Å
892	V	83.1	Confident	84.2	Confident	41 Å²	41	34.1 Å²	34.1	25%	0.248	19%	0.187	C	C	.	.	H	α-helix	trans	-54.1	-39.6	179	-176.2	0	0	0	0	112.9	M887 E888 L894 F895 D896 K928	M887-V892 VanDerWaalsContact O-CG2 3.3Å; M887-V892 WeakPolarHBondContact O-CG2 3.42Å; M887-V892 PolarHBondContact O-N 3.14Å; E888-V892 WeakPolarHBondContact O-CG2 3.31Å; V892-L894 PolarHBondContact O-N 3.38Å; V892-L894 VanDerWaalsContact O-N 3.13Å; V892-F895 PolarHBondContact O-N 2.82Å; V892-D896 PolarHBondContact O-N 2.82Å; V892-D896 VanDerWaalsContact O-N 3.08Å; V892-K928 HydrophobicContact CG1-CD 4Å
893	S	83.5	Confident	83.6	Confident	22 Å²	22	32.8 Å²	32.8	15%	0.154	18%	0.18	C	C	.	.	H	α-helix	trans	-56.3	-27.8	177.1	47.3	0	0	0	0	113	S800 K891 F895 N897	S800-S893 PolarHBondContact O-OG 3.38Å; K891-S893 PolarHBondContact O-N 2.65Å; S893-F895 PolarHBondContact O-N 3.29Å; S893-N897 WeakPolarHBondContact O-CB 3.3Å; S893-N897 PolarHBondContact O-N 3.18Å; S893-N897 PolarHBondContact O-ND2 3.35Å; S893-N897 PolarHBondContact O-OD1 3.4Å
894	L	83.6	Confident	82.9	Confident	11 Å²	11	33 Å²	33	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-64.6	-39	177.2	-159.6	73.2	0	0	0	111.9	I795 C798 C844 P847 K891 V892 Q898	I795-L894 HydrophobicContact CD1-CD2 3.84Å; I795-L894 HydrophobicContact CG1-CD2 3.7Å; C798-L894 HydrophobicContact CB-CD1 3.99Å; C798-L894 HydrophobicContact CB-CD2 4.44Å; C844-L894 HydrophobicContact CB-CD1 4.41Å; P847-L894 HydrophobicContact CB-CD2 3.63Å; P847-L894 HydrophobicContact CB-CG 3.78Å; P847-L894 HydrophobicContact CG-CG 4.21Å; K891-L894 WeakPolarHBondContact O-CB 3.5Å; K891-L894 PolarHBondContact O-N 3.45Å; V892-L894 PolarHBondContact O-N 3.38Å; V892-L894 VanDerWaalsContact O-N 3.13Å; L894-Q898 PolarHBondContact O-N 3Å
895	F	85.1	Confident	82.3	Confident	5 Å²	5	33.8 Å²	33.8	2%	0.022	19%	0.186	C	C	.	.	H	α-helix	trans	-78.4	-43.1	175	-73.7	-11.6	0	0	0	112.1	P847 M887 V892 S893 N897 Q898 D899 L927 K928 T931	P847-F895 HydrophobicContact CB-CD1 4.1Å; P847-F895 HydrophobicContact CB-CE1 4.07Å; P847-F895 HydrophobicContact CG-CD1 4.02Å; P847-F895 HydrophobicContact CG-CE1 4.37Å; M887-F895 HydrophobicContact CB-CE2 4.45Å; M887-F895 HydrophobicContact CE-CD1 3.99Å; M887-F895 HydrophobicContact CE-CD2 4.04Å; M887-F895 HydrophobicContact CE-CE1 3.64Å; M887-F895 HydrophobicContact CE-CE2 3.7Å; M887-F895 HydrophobicContact CE-CG 4.2Å; M887-F895 HydrophobicContact CE-CZ 3.5Å; M887-F895 VanDerWaalsContact CE-CZ 3.5Å; M887-F895 HydrophobicContact CG-CE2 4.37Å; M887-F895 HydrophobicContact CG-CZ 4.39Å; M887-F895 HydrophobicContact SD-CZ 4.27Å; V892-F895 PolarHBondContact O-N 2.82Å; S893-F895 PolarHBondContact O-N 3.29Å; F895-N897 VanDerWaalsContact C-N 3.28Å; F895-N897 PolarHBondContact O-N 3.48Å; F895-Q898 PolarHBondContact O-N 2.92Å; F895-D899 PolarHBondContact O-N 3.42Å; F895-L927 HydrophobicContact CB-CB 4.29Å; F895-L927 HydrophobicContact CD1-CD2 3.73Å; F895-L927 HydrophobicContact CD2-CB 4.39Å; F895-L927 HydrophobicContact CE1-CD2 3.76Å; F895-L927 HydrophobicContact CG-CB 4.24Å; F895-L927 HydrophobicContact CG-CD2 4.13Å; F895-L927 HydrophobicContact CZ-CD2 4.19Å; F895-K928 HydrophobicContact CD2-CB 4.2Å; F895-T931 HydrophobicContact CE2-CG2 4.1Å; F895-T931 HydrophobicContact CZ-CG2 4.23Å
896	D	83.4	Confident	81.6	Confident	41 Å²	41	30 Å²	30	22%	0.219	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-32	178.1	-81.5	-28.7	0	0	0	112.7	V892 L900 K928	V892-D896 PolarHBondContact O-N 2.82Å; V892-D896 VanDerWaalsContact O-N 3.08Å; D896-L900 WeakPolarHBondContact O-CB 3.39Å; D896-L900 PolarHBondContact O-N 2.87Å; D896-K928 WeakPolarHBondContact OD1-CE 3.46Å; D896-K928 IonicContact OD1-NZ 3.9Å; D896-K928 PolarHBondContact OD1-NZ 3.37Å; D896-K928 IonicContact OD2-NZ 2.73Å; D896-K928 PolarHBondContact OD2-NZ 3.47Å
897	N	83.8	Confident	81	Confident	27 Å²	27	31.2 Å²	31.2	14%	0.144	18%	0.177	C	C	.	.	H	α-helix	trans	-68.4	-42	170.5	-68.5	-6.8	0	0	0	111.3	H801 L803 S893 F895 L900 L901	H801-N897 PolarHBondContact O-ND2 2.67Å; L803-N897 HydrophobicContact CB-CB 4.34Å; L803-N897 WeakPolarHBondContact CB-OD1 3.31Å; L803-N897 PolarHBondContact N-OD1 3.48Å; S893-N897 WeakPolarHBondContact O-CB 3.3Å; S893-N897 PolarHBondContact O-N 3.18Å; S893-N897 PolarHBondContact O-ND2 3.35Å; S893-N897 PolarHBondContact O-OD1 3.4Å; F895-N897 VanDerWaalsContact C-N 3.28Å; F895-N897 PolarHBondContact O-N 3.48Å; N897-L900 PolarHBondContact O-N 3.35Å; N897-L901 WeakPolarHBondContact O-CB 3.44Å; N897-L901 WeakPolarHBondContact O-CG 3.46Å; N897-L901 PolarHBondContact O-N 3.3Å
898	Q	81.3	Confident	79.9	Confident	4 Å²	4	38 Å²	38	2%	0.019	21%	0.213	C	C	.	.	H	α-helix	trans	-66.3	-46.9	-178.4	-175.7	66.9	-4.5	0	0	112.2	S845 P847 E848 L894 F895 L900 L901 V902	S845-Q898 PolarHBondContact O-NE2 3.33Å; S845-Q898 PolarHBondContact O-OE1 2.9Å; P847-Q898 HydrophobicContact CG-CB 3.77Å; P847-Q898 HydrophobicContact CG-CG 3.95Å; E848-Q898 HydrophobicContact CG-CG 4.44Å; E848-Q898 PolarHBondContact OE1-NE2 2.87Å; L894-Q898 PolarHBondContact O-N 3Å; F895-Q898 PolarHBondContact O-N 2.92Å; Q898-L900 VanDerWaalsContact C-N 3.26Å; Q898-L900 PolarHBondContact O-N 3.45Å; Q898-L901 PolarHBondContact O-N 3.47Å; Q898-V902 HydrophobicContact CG-CG2 4.11Å; Q898-V902 WeakPolarHBondContact O-CB 3.42Å; Q898-V902 WeakPolarHBondContact O-CG2 3.4Å; Q898-V902 PolarHBondContact O-N 3.3Å
899	D	83.4	Confident	78.7	Confident	18 Å²	18	38.5 Å²	38.5	10%	0.096	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-36.5	178	-75	-37.4	0	0	0	111.2	F895 M903 K924 P926 L927	F895-D899 PolarHBondContact O-N 3.42Å; D899-M903 WeakPolarHBondContact O-CB 3.23Å; D899-M903 WeakPolarHBondContact O-CG 3.22Å; D899-M903 PolarHBondContact O-N 2.99Å; D899-M903 VanDerWaalsContact O-N 3.12Å; D899-K924 IonicContact OD1-NZ 3.43Å; D899-K924 PolarHBondContact OD1-NZ 3.07Å; D899-P926 WeakPolarHBondContact OD2-CA 3.39Å; D899-L927 WeakPolarHBondContact OD2-CB 3.01Å; D899-L927 PolarHBondContact OD2-N 3.22Å
900	L	81.2	Confident	77.3	Confident	7 Å²	7	39 Å²	39	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-43.3	174.3	-173.7	66.5	0	0	0	112.5	L803 R804 I807 A820 D896 N897 Q898 A904	L803-L900 HydrophobicContact CD2-CD2 4.3Å; L803-L900 HydrophobicContact CG-CD2 4.4Å; R804-L900 HydrophobicContact CG-CD2 3.94Å; I807-L900 HydrophobicContact CD1-CD2 4.05Å; A820-L900 HydrophobicContact CB-CD1 4.17Å; D896-L900 WeakPolarHBondContact O-CB 3.39Å; D896-L900 PolarHBondContact O-N 2.87Å; N897-L900 PolarHBondContact O-N 3.35Å; Q898-L900 VanDerWaalsContact C-N 3.26Å; Q898-L900 PolarHBondContact O-N 3.45Å; L900-A904 WeakPolarHBondContact O-CB 3.38Å; L900-A904 PolarHBondContact O-N 3.35Å
901	L	80.4	Confident	75.8	Confident	25 Å²	25	44.1 Å²	44.1	13%	0.131	23%	0.229	C	C	.	.	H	α-helix	trans	-74.4	-39.4	-178.4	-73	170.4	0	0	0	113	L803 L830 N897 Q898 A904 N905	L803-L901 HydrophobicContact CD2-CD1 4.14Å; L803-L901 HydrophobicContact CD2-CD2 3.92Å; L803-L901 HydrophobicContact CD2-CG 3.93Å; L830-L901 HydrophobicContact CD1-CB 3.91Å; L830-L901 WeakPolarHBondContact CD1-O 3.26Å; L830-L901 HydrophobicContact CG-CB 4.27Å; N897-L901 WeakPolarHBondContact O-CB 3.44Å; N897-L901 WeakPolarHBondContact O-CG 3.46Å; N897-L901 PolarHBondContact O-N 3.3Å; Q898-L901 PolarHBondContact O-N 3.47Å; L901-A904 WeakPolarHBondContact O-CB 3.34Å; L901-A904 PolarHBondContact O-N 3.47Å; L901-N905 PolarHBondContact O-N 3.37Å
902	V	81.1	Confident	74	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.036	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-41.6	175	171.3	0	0	0	0	110.4	P269 L830 Q898 A904 N905 A906	P269-V902 HydrophobicContact CG-CG1 4.12Å; L830-V902 HydrophobicContact CD2-CG2 4.22Å; Q898-V902 HydrophobicContact CG-CG2 4.11Å; Q898-V902 WeakPolarHBondContact O-CB 3.42Å; Q898-V902 WeakPolarHBondContact O-CG2 3.4Å; Q898-V902 PolarHBondContact O-N 3.3Å; V902-A904 VanDerWaalsContact C-N 3.31Å; V902-A904 PolarHBondContact O-N 3.47Å; V902-N905 PolarHBondContact O-N 2.95Å; V902-A906 PolarHBondContact O-N 3.46Å
903	M	79.1	Confident	72.3	Confident	21 Å²	21	53.7 Å²	53.7	10%	0.103	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-36.9	171.8	-72	-58.4	-57.1	0	0	112.2	P269 A820 D899 L907 V921 D922 K924	P269-M903 HydrophobicContact CB-SD 4.02Å; P269-M903 HydrophobicContact CG-SD 3.62Å; A820-M903 HydrophobicContact CB-CB 3.92Å; D899-M903 WeakPolarHBondContact O-CB 3.23Å; D899-M903 WeakPolarHBondContact O-CG 3.22Å; D899-M903 PolarHBondContact O-N 2.99Å; D899-M903 VanDerWaalsContact O-N 3.12Å; M903-L907 WeakPolarHBondContact O-CD1 3.47Å; M903-L907 WeakPolarHBondContact O-CG 3.48Å; M903-V921 HydrophobicContact CE-CG1 3.98Å; M903-D922 WeakPolarHBondContact CE-O 3.42Å; M903-K924 HydrophobicContact SD-CB 3.99Å
904	A	77.3	Confident	70.7	Confident	6 Å²	6	59.4 Å²	59.4	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-46.2	175.5	0	0	0	0	0	112.6	A820 A823 V824 L900 L901 V902 A906 L907	A820-A904 HydrophobicContact CB-CB 4.38Å; A823-A904 HydrophobicContact CB-CB 4.21Å; V824-A904 HydrophobicContact CG2-CB 3.72Å; L900-A904 WeakPolarHBondContact O-CB 3.38Å; L900-A904 PolarHBondContact O-N 3.35Å; L901-A904 WeakPolarHBondContact O-CB 3.34Å; L901-A904 PolarHBondContact O-N 3.47Å; V902-A904 VanDerWaalsContact C-N 3.31Å; V902-A904 PolarHBondContact O-N 3.47Å; A904-A906 PolarHBondContact O-N 2.9Å; A904-L907 PolarHBondContact O-N 3.21Å
905	N	78.2	Confident	69.1	Low	41 Å²	41	62.8 Å²	62.8	22%	0.219	34%	0.344	C	S	.	.	H	α-helix	trans	-69.1	-19.1	-179	-167.4	85.7	0	0	0	113.9	R270 D319 L830 L901 V902	R270-N905 PolarHBondContact NH2-ND2 2.94Å; R270-N905 PolarHBondContact NH2-O 2.83Å; D319-N905 PolarHBondContact OD1-ND2 3.13Å; L830-N905 HydrophobicContact CD1-CB 3.73Å; L901-N905 PolarHBondContact O-N 3.37Å; V902-N905 PolarHBondContact O-N 2.95Å
906	A	74.9	Confident	67.3	Low	27 Å²	27	68.4 Å²	68.4	22%	0.223	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.1	175.4	0	0	0	0	0	113.8	P269 V902 A904	P269-A906 HydrophobicContact CB-CB 3.56Å; V902-A906 PolarHBondContact O-N 3.46Å; A904-A906 PolarHBondContact O-N 2.9Å
907	L	74.8	Confident	65.8	Low	43 Å²	43	70 Å²	70	23%	0.225	39%	0.393	C	S	.	.			trans	-88.8	115.5	-175.4	-72.4	164.4	0	0	0	112.4	A820 M903 A904 Y909 L920	A820-L907 HydrophobicContact CB-CD1 4.03Å; M903-L907 WeakPolarHBondContact O-CD1 3.47Å; M903-L907 WeakPolarHBondContact O-CG 3.48Å; A904-L907 PolarHBondContact O-N 3.21Å; L907-Y909 PolarHBondContact O-N 2.77Å; L907-Y909 VanDerWaalsContact O-N 3.12Å; L907-L920 WeakPolarHBondContact CD2-O 3.36Å
908	N	60.3	Low	64.3	Low	148 Å²	148	80.5 Å²	80.5	79%	0.791	43%	0.43	S	S	*	.			trans	-73.6	100.1	171.1	-76.5	-27.6	0	0	0	110.8	T910	N908-T910 PolarHBondContact O-N 3.19Å
909	Y	55.9	Low	63.4	Low	123 Å²	123	82.9 Å²	82.9	48%	0.482	45%	0.447	S	S	.	.			trans	-71.5	92.2	177.8	-174.2	-97.1	0	0	0	112.4	V824 L907 K911	V824-Y909 HydrophobicContact CG1-CD2 4.17Å; V824-Y909 HydrophobicContact CG1-CG 4.39Å; L907-Y909 PolarHBondContact O-N 2.77Å; L907-Y909 VanDerWaalsContact O-N 3.12Å; Y909-K911 HydrophobicContact CD1-CG 4.32Å; Y909-K911 HydrophobicContact CE1-CG 3.65Å
910	T	50.3	Low	62.1	Low	117 Å²	117	89.3 Å²	89.3	72%	0.718	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-85.5	117.5	167.8	51.3	0	0	0	0	110.4	N908 P912	N908-T910 PolarHBondContact O-N 3.19Å; T910-P912 VanDerWaalsContact O-CD 3.27Å; T910-P912 WeakPolarHBondContact O-CD 3.31Å
911	K	46.8	Very low	61.1	Low	177 Å²	177	91.6 Å²	91.6	77%	0.77	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-63.1	119.4	172.4	-75.5	-177.5	176.4	-179.3	0	110.4	Y909	Y909-K911 HydrophobicContact CD1-CG 4.32Å; Y909-K911 HydrophobicContact CE1-CG 3.65Å
912	P	45.9	Very low	60	Low	62 Å²	62	94 Å²	94	40%	0.403	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-87.9	136.6	170.4	33.2	-27.6	0	0	0	110.1	T910 N914	T910-P912 VanDerWaalsContact O-CD 3.27Å; T910-P912 WeakPolarHBondContact O-CD 3.31Å; P912-N914 PolarHBondContact O-N 3.37Å
913	E	48.8	Very low	59.2	Low	197 Å²	197	99.4 Å²	99.4	92%	0.921	54%	0.536	S	S	*	.	S	Bend	trans	-70.2	-14.7	175.5	-63.4	-173.7	133	0	0	113.1
914	N	48.5	Very low	58.9	Low	142 Å²	142	100.4 Å²	100.4	76%	0.759	54%	0.54	S	S	*	.	S	Bend	trans	-123.2	79.4	-176.8	-77.2	-56.4	0	0	0	113.1	P912 T916	P912-N914 PolarHBondContact O-N 3.37Å; N914-T916 VanDerWaalsContact C-N 3.28Å; N914-T916 PolarHBondContact O-N 2.94Å
915	G	49.6	Very low	59.1	Low	82 Å²	82	101.4 Å²	101.4	85%	0.845	55%	0.545	S	S	*	.	S	Bend	trans	66.5	-25.1	143.2	0	0	0	0	0	121.4
916	T	49.2	Very low	59.3	Low	122 Å²	122	101.7 Å²	101.7	75%	0.748	55%	0.55	S	S	*	.			trans	-137.2	90.5	-174.9	51	0	0	0	0	111.7	N914 R918	N914-T916 VanDerWaalsContact C-N 3.28Å; N914-T916 PolarHBondContact O-N 2.94Å; T916-R918 PolarHBondContact O-N 3.37Å
917	S	51.1	Low	59.7	Low	76 Å²	76	100.6 Å²	100.6	53%	0.531	54%	0.54	S	S	.	.			trans	-70.1	111.7	168.9	52.1	0	0	0	0	110.5
918	R	52.6	Low	60.1	Low	247 Å²	247	102.3 Å²	102.3	93%	0.932	55%	0.546	S	S	*	.			trans	-94.5	110	174.8	-137	179.6	-171.5	171.9	2.4	109.6	T916	T916-R918 PolarHBondContact O-N 3.37Å
919	C	61.4	Low	61.4	Low	54 Å²	54	99.7 Å²	99.7	37%	0.365	53%	0.531	S	S	.	.			trans	-83.1	122.2	173.6	-62.2	0	0	0	0	110.2	C821	C821-C919 HydrophobicContact CB-CB 3.99Å; C821-C919 WeakPolarHBondContact CB-SG 3.39Å; C821-C919 WeakPolarHBondContact SG-CB 3.26Å; C821-C919 CovalentContact SG-SG 2.02Å; C821-C919 PolarHBondContact SG-SG 3.09Å
920	L	57.6	Low	62.8	Low	153 Å²	153	95.2 Å²	95.2	80%	0.801	52%	0.515	S	S	*	.			trans	-81.1	117.3	163.5	-89.8	159.8	0	0	0	107.6	L907	L907-L920 WeakPolarHBondContact CD2-O 3.36Å
921	V	58.8	Low	64.6	Low	55 Å²	55	89.8 Å²	89.8	33%	0.333	48%	0.481	S	S	.	.			trans	-107.9	112.4	176.4	-177.8	0	0	0	0	107.2	M903	M903-V921 HydrophobicContact CE-CG1 3.98Å
922	D	58.2	Low	66.7	Low	76 Å²	76	82.4 Å²	82.4	41%	0.406	45%	0.452	S	S	.	.			trans	-76.1	133.5	170.4	-73.5	-47.5	0	0	0	110	M903 K924	M903-D922 WeakPolarHBondContact CE-O 3.42Å; D922-K924 PolarHBondContact O-N 3Å
923	N	63.9	Low	68.8	Low	119 Å²	119	82 Å²	82	64%	0.636	45%	0.448	S	S	*	.			trans	-78	92.9	-178.4	-77	-16.9	0	0	0	111.2	G211	G211-N923 WeakPolarHBondContact CA-O 3.49Å
924	K	73.4	Confident	70.7	Confident	41 Å²	41	72.9 Å²	72.9	18%	0.178	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-67.8	140.6	164.4	-168.5	-167.3	176.7	-171	0	110.3	P269 E274 D899 M903 D922 P926	P269-K924 HydrophobicContact CG-CD 4.2Å; E274-K924 WeakPolarHBondContact OE1-CE 3.47Å; E274-K924 IonicContact OE1-NZ 2.72Å; E274-K924 PolarHBondContact OE1-NZ 2.94Å; D899-K924 IonicContact OD1-NZ 3.43Å; D899-K924 PolarHBondContact OD1-NZ 3.07Å; M903-K924 HydrophobicContact SD-CB 3.99Å; D922-K924 PolarHBondContact O-N 3Å; K924-P926 WeakPolarHBondContact O-CD 3.36Å
925	V	80.8	Confident	72.7	Confident	27 Å²	27	66.1 Å²	66.1	16%	0.164	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-67.5	124.9	169.9	-180	0	0	0	0	109.5	F207 S210	F207-V925 HydrophobicContact CB-CG2 4.22Å; F207-V925 HydrophobicContact CD1-CG1 4.07Å; F207-V925 HydrophobicContact CD1-CG2 4.42Å; F207-V925 HydrophobicContact CE1-CG1 4.4Å; F207-V925 WeakPolarHBondContact O-CG2 3.27Å; S210-V925 WeakPolarHBondContact OG-CG2 3.39Å
926	P	83.4	Confident	74.7	Confident	48 Å²	48	65.5 Å²	65.5	31%	0.312	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-60	138.2	-177.8	-27.1	35.6	0	0	0	113.6	D899 K924 K928 I929 M930	D899-P926 WeakPolarHBondContact OD2-CA 3.39Å; K924-P926 WeakPolarHBondContact O-CD 3.36Å; P926-K928 HydrophobicContact CB-CG 4.09Å; P926-K928 PolarHBondContact O-N 3.22Å; P926-K928 VanDerWaalsContact O-N 3.13Å; P926-I929 HydrophobicContact CG-CD1 4.44Å; P926-I929 PolarHBondContact O-N 3.46Å; P926-M930 PolarHBondContact O-N 3.32Å; P926-M930 VanDerWaalsContact O-N 3.13Å
927	L	82.6	Confident	76.7	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-29	-175.2	-143	83.6	0	0	0	112.6	E848 F895 D899 I929 M930 T931	E848-L927 HydrophobicContact CG-CD1 4.43Å; E848-L927 HydrophobicContact CG-CD2 3.7Å; F895-L927 HydrophobicContact CB-CB 4.29Å; F895-L927 HydrophobicContact CD1-CD2 3.73Å; F895-L927 HydrophobicContact CD2-CB 4.39Å; F895-L927 HydrophobicContact CE1-CD2 3.76Å; F895-L927 HydrophobicContact CG-CB 4.24Å; F895-L927 HydrophobicContact CG-CD2 4.13Å; F895-L927 HydrophobicContact CZ-CD2 4.19Å; D899-L927 WeakPolarHBondContact OD2-CB 3.01Å; D899-L927 PolarHBondContact OD2-N 3.22Å; L927-I929 VanDerWaalsContact C-N 3.27Å; L927-I929 PolarHBondContact O-N 3Å; L927-M930 HydrophobicContact CD1-CE 3.62Å; L927-M930 HydrophobicContact CG-CE 4.3Å; L927-M930 PolarHBondContact O-N 3.02Å; L927-T931 WeakPolarHBondContact O-CB 3.42Å; L927-T931 PolarHBondContact O-N 3.32Å; L927-T931 PolarHBondContact O-OG1 2.91Å
928	K	84.1	Confident	78.5	Confident	78 Å²	78	57.2 Å²	57.2	34%	0.339	30%	0.295	S	S	.	.	H	α-helix	trans	-67	-20.4	173.9	67.6	-168.4	178.2	-164.6	0	114.5	V892 F895 D896 P926 P932	V892-K928 HydrophobicContact CG1-CD 4Å; F895-K928 HydrophobicContact CD2-CB 4.2Å; D896-K928 WeakPolarHBondContact OD1-CE 3.46Å; D896-K928 IonicContact OD1-NZ 3.9Å; D896-K928 PolarHBondContact OD1-NZ 3.37Å; D896-K928 IonicContact OD2-NZ 2.73Å; D896-K928 PolarHBondContact OD2-NZ 3.47Å; P926-K928 HydrophobicContact CB-CG 4.09Å; P926-K928 PolarHBondContact O-N 3.22Å; P926-K928 VanDerWaalsContact O-N 3.13Å; K928-P932 WeakPolarHBondContact O-CD 3.26Å; K928-P932 WeakPolarHBondContact O-CG 3.41Å
929	I	86.4	Confident	80.4	Confident	94 Å²	94	45.6 Å²	45.6	48%	0.482	25%	0.251	S	S	.	.	H	α-helix	trans	-95	-37.9	173.1	-57.5	177.8	0	0	0	110.2	P926 L927 V933	P926-I929 HydrophobicContact CG-CD1 4.44Å; P926-I929 PolarHBondContact O-N 3.46Å; L927-I929 VanDerWaalsContact C-N 3.27Å; L927-I929 PolarHBondContact O-N 3Å; I929-V933 WeakPolarHBondContact O-CG2 3.24Å
930	M	86.3	Confident	81.8	Confident	29 Å²	29	46.4 Å²	46.4	14%	0.143	25%	0.252	C	S	.	.	H	α-helix	trans	-67.3	-42.8	178.3	-171.4	-176.9	73.7	0	0	112.4	F207 P926 L927 V933 V934	F207-M930 HydrophobicContact CE2-CG 4.12Å; F207-M930 HydrophobicContact CZ-CG 4.26Å; P926-M930 PolarHBondContact O-N 3.32Å; P926-M930 VanDerWaalsContact O-N 3.13Å; L927-M930 HydrophobicContact CD1-CE 3.62Å; L927-M930 HydrophobicContact CG-CE 4.3Å; L927-M930 PolarHBondContact O-N 3.02Å; M930-V933 PolarHBondContact O-N 3.18Å; M930-V934 HydrophobicContact CG-CG2 3.85Å; M930-V934 WeakPolarHBondContact O-CB 3.5Å; M930-V934 WeakPolarHBondContact O-CG2 3.41Å; M930-V934 PolarHBondContact O-N 3.13Å
931	T	87.8	Confident	83.3	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-49.1	-172	-65	0	0	0	0	113.7	T851 Y883 F895 L927 V933 V934 I935	T851-T931 HydrophobicContact CG2-CG2 3.81Å; Y883-T931 HydrophobicContact CE1-CG2 3.89Å; F895-T931 HydrophobicContact CE2-CG2 4.1Å; F895-T931 HydrophobicContact CZ-CG2 4.23Å; L927-T931 WeakPolarHBondContact O-CB 3.42Å; L927-T931 PolarHBondContact O-N 3.32Å; L927-T931 PolarHBondContact O-OG1 2.91Å; T931-V933 PolarHBondContact O-N 3.25Å; T931-V934 PolarHBondContact O-N 3.47Å; T931-I935 HydrophobicContact CG2-CD1 3.94Å; T931-I935 WeakPolarHBondContact O-CG1 3.43Å; T931-I935 PolarHBondContact O-N 3.11Å; T931-I935 VanDerWaalsContact O-N 3.12Å
932	P	90.6	Very high	84.8	Confident	22 Å²	22	37 Å²	37	14%	0.143	20%	0.201	C	C	.	.	H	α-helix	trans	-57.5	-51.1	175.3	-21.8	31.1	0	0	0	112.1	L884 E888 K928 V934 I935 T936	L884-P932 HydrophobicContact CD1-CB 4.14Å; L884-P932 HydrophobicContact CD2-CB 4.02Å; L884-P932 HydrophobicContact CD2-CG 3.89Å; E888-P932 WeakPolarHBondContact OE1-CG 3.49Å; K928-P932 WeakPolarHBondContact O-CD 3.26Å; K928-P932 WeakPolarHBondContact O-CG 3.41Å; P932-V934 VanDerWaalsContact C-N 3.34Å; P932-V934 PolarHBondContact O-N 2.95Å; P932-I935 PolarHBondContact O-N 3.34Å; P932-I935 VanDerWaalsContact O-N 3.13Å; P932-T936 PolarHBondContact O-N 3.12Å; P932-T936 PolarHBondContact O-OG1 3.13Å; P932-T936 VanDerWaalsContact O-OG1 3.06Å
933	V	90.2	Very high	86.3	Confident	53 Å²	53	34.6 Å²	34.6	32%	0.321	19%	0.186	S	C	.	.	H	α-helix	trans	-60.4	-42.1	-176.9	177.7	0	0	0	0	111.9	V203 F207 I929 M930 T931 V937	V203-V933 HydrophobicContact CG1-CG1 3.85Å; F207-V933 HydrophobicContact CE2-CG1 4.47Å; F207-V933 HydrophobicContact CZ-CB 3.98Å; F207-V933 HydrophobicContact CZ-CG1 3.81Å; F207-V933 HydrophobicContact CZ-CG2 4.44Å; I929-V933 WeakPolarHBondContact O-CG2 3.24Å; M930-V933 PolarHBondContact O-N 3.18Å; T931-V933 PolarHBondContact O-N 3.25Å; V933-V937 HydrophobicContact CG1-CG2 4.49Å; V933-V937 WeakPolarHBondContact O-CB 3.47Å; V933-V937 VanDerWaalsContact O-CG2 3.25Å; V933-V937 WeakPolarHBondContact O-CG2 3.2Å; V933-V937 PolarHBondContact O-N 3.41Å
934	V	88.6	Confident	87.4	Confident	5 Å²	5	30.4 Å²	30.4	3%	0.03	16%	0.164	C	C	.	.	H	α-helix	trans	-63.1	-43.2	176.9	167.6	0	0	0	0	111.3	W277 L855 M930 T931 P932 F938	W277-V934 HydrophobicContact CB-CG1 3.84Å; W277-V934 HydrophobicContact CD2-CB 4.42Å; W277-V934 HydrophobicContact CD2-CG1 3.75Å; W277-V934 HydrophobicContact CD2-CG2 3.7Å; W277-V934 HydrophobicContact CE3-CG1 3.82Å; W277-V934 HydrophobicContact CE3-CG2 4.04Å; W277-V934 HydrophobicContact CG-CG1 3.79Å; W277-V934 HydrophobicContact CG-CG2 4.17Å; W277-V934 HydrophobicContact CH2-CG2 4.26Å; W277-V934 HydrophobicContact CZ2-CG2 3.92Å; W277-V934 HydrophobicContact CZ3-CG2 4.31Å; L855-V934 HydrophobicContact CD1-CG1 4.38Å; M930-V934 HydrophobicContact CG-CG2 3.85Å; M930-V934 WeakPolarHBondContact O-CB 3.5Å; M930-V934 WeakPolarHBondContact O-CG2 3.41Å; M930-V934 PolarHBondContact O-N 3.13Å; T931-V934 PolarHBondContact O-N 3.47Å; P932-V934 VanDerWaalsContact C-N 3.34Å; P932-V934 PolarHBondContact O-N 2.95Å; V934-F938 WeakPolarHBondContact O-CB 3.33Å; V934-F938 PolarHBondContact O-N 3.43Å
935	I	91.3	Very high	88.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.9	-47.2	178.6	-65.9	171.9	0	0	0	110.7	T851 L855 L858 E880 Y883 T931 P932 V937 F938 V939	T851-I935 HydrophobicContact CG2-CD1 4.33Å; L855-I935 HydrophobicContact CD2-CG1 4.41Å; L858-I935 HydrophobicContact CD1-CG2 4.12Å; E880-I935 HydrophobicContact CB-CG2 3.98Å; E880-I935 HydrophobicContact CG-CG2 3.7Å; Y883-I935 HydrophobicContact CD1-CD1 3.49Å; Y883-I935 VanDerWaalsContact CD1-CD1 3.49Å; Y883-I935 HydrophobicContact CE1-CD1 3.59Å; T931-I935 HydrophobicContact CG2-CD1 3.94Å; T931-I935 WeakPolarHBondContact O-CG1 3.43Å; T931-I935 PolarHBondContact O-N 3.11Å; T931-I935 VanDerWaalsContact O-N 3.12Å; P932-I935 PolarHBondContact O-N 3.34Å; P932-I935 VanDerWaalsContact O-N 3.13Å; I935-V937 VanDerWaalsContact C-N 3.32Å; I935-V937 PolarHBondContact O-N 3.17Å; I935-F938 CarbonylContact O-C 3.3Å; I935-F938 WeakPolarHBondContact O-CA 3.47Å; I935-F938 WeakPolarHBondContact O-CB 3.4Å; I935-F938 PolarHBondContact O-N 2.89Å; I935-V939 HydrophobicContact CG2-CG2 4.16Å; I935-V939 WeakPolarHBondContact O-CG2 3.45Å; I935-V939 PolarHBondContact O-N 3.4Å
936	T	91.2	Very high	88.5	Confident	70 Å²	70	27.8 Å²	27.8	43%	0.429	15%	0.151	S	C	.	.	H	α-helix	trans	-60.3	-40.8	179.5	-50.6	0	0	0	0	112.1	E880 P932 F938 V939 L940	E880-T936 WeakPolarHBondContact OE1-CA 3.4Å; E880-T936 VanDerWaalsContact OE1-CB 3.3Å; E880-T936 WeakPolarHBondContact OE1-CB 3.36Å; E880-T936 PolarHBondContact OE1-N 3.5Å; E880-T936 PolarHBondContact OE1-OG1 2.91Å; P932-T936 PolarHBondContact O-N 3.12Å; P932-T936 PolarHBondContact O-OG1 3.13Å; P932-T936 VanDerWaalsContact O-OG1 3.06Å; T936-F938 VanDerWaalsContact C-N 3.32Å; T936-F938 PolarHBondContact O-N 3.01Å; T936-V939 PolarHBondContact O-N 3.35Å; T936-L940 WeakPolarHBondContact O-CB 3.45Å; T936-L940 PolarHBondContact O-N 3.28Å
937	V	89.9	Confident	88.6	Confident	18 Å²	18	27.4 Å²	27.4	11%	0.109	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-39.2	174	166.6	0	0	0	0	111.5	V200 V933 I935 A941	V200-V937 HydrophobicContact CG2-CG1 3.76Å; V933-V937 HydrophobicContact CG1-CG2 4.49Å; V933-V937 WeakPolarHBondContact O-CB 3.47Å; V933-V937 VanDerWaalsContact O-CG2 3.25Å; V933-V937 WeakPolarHBondContact O-CG2 3.2Å; V933-V937 PolarHBondContact O-N 3.41Å; I935-V937 VanDerWaalsContact C-N 3.32Å; I935-V937 PolarHBondContact O-N 3.17Å; V937-A941 PolarHBondContact O-N 3.43Å; V937-A941 VanDerWaalsContact O-N 3.08Å
938	F	90.2	Very high	88.6	Confident	5 Å²	5	27.7 Å²	27.7	2%	0.022	15%	0.146	C	C	.	.	H	α-helix	trans	-69.9	-42.8	178.2	-151.3	-96.7	0	0	0	112.1	V280 F281 L855 L858 L859 V934 I935 T936 A941 L942	V280-F938 HydrophobicContact CG1-CE2 4.26Å; V280-F938 HydrophobicContact CG1-CZ 4.12Å; F281-F938 HydrophobicContact CB-CD2 4.38Å; F281-F938 HydrophobicContact CB-CE2 4.09Å; F281-F938 HydrophobicContact CD2-CD2 4.09Å; F281-F938 HydrophobicContact CD2-CE2 4.29Å; L855-F938 HydrophobicContact CD2-CB 3.87Å; L855-F938 HydrophobicContact CD2-CD1 3.73Å; L855-F938 HydrophobicContact CD2-CD2 4.02Å; L855-F938 HydrophobicContact CD2-CE1 4.21Å; L855-F938 HydrophobicContact CD2-CE2 4.47Å; L855-F938 HydrophobicContact CD2-CG 3.62Å; L858-F938 HydrophobicContact CB-CD1 4.43Å; L859-F938 HydrophobicContact CD1-CZ 4.22Å; L859-F938 HydrophobicContact CD2-CE1 3.96Å; L859-F938 HydrophobicContact CD2-CZ 3.79Å; L859-F938 HydrophobicContact CG-CE1 3.83Å; L859-F938 HydrophobicContact CG-CZ 3.79Å; V934-F938 WeakPolarHBondContact O-CB 3.33Å; V934-F938 PolarHBondContact O-N 3.43Å; I935-F938 CarbonylContact O-C 3.3Å; I935-F938 WeakPolarHBondContact O-CA 3.47Å; I935-F938 WeakPolarHBondContact O-CB 3.4Å; I935-F938 PolarHBondContact O-N 2.89Å; T936-F938 VanDerWaalsContact C-N 3.32Å; T936-F938 PolarHBondContact O-N 3.01Å; F938-A941 PolarHBondContact O-N 2.88Å; F938-L942 HydrophobicContact CD1-CD1 3.59Å; F938-L942 HydrophobicContact CD1-CG 4.07Å; F938-L942 HydrophobicContact CE1-CD1 3.76Å; F938-L942 HydrophobicContact CE1-CG 4.19Å; F938-L942 WeakPolarHBondContact O-CB 3.4Å; F938-L942 WeakPolarHBondContact O-CG 3.23Å; F938-L942 PolarHBondContact O-N 3.39Å
939	V	92.8	Very high	88.7	Confident	4 Å²	4	25.1 Å²	25.1	2%	0.024	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-41.5	174.9	170.9	0	0	0	0	111.1	L858 M876 L877 E880 I935 T936 L942 Y943	L858-V939 HydrophobicContact CD1-CG2 4.11Å; L858-V939 HydrophobicContact CD2-CG2 4.31Å; M876-V939 HydrophobicContact CB-CG1 3.93Å; M876-V939 HydrophobicContact CB-CG2 4.23Å; M876-V939 HydrophobicContact CE-CG1 4.43Å; L877-V939 HydrophobicContact CD2-CG1 4.3Å; E880-V939 HydrophobicContact CB-CG2 4.46Å; I935-V939 HydrophobicContact CG2-CG2 4.16Å; I935-V939 WeakPolarHBondContact O-CG2 3.45Å; I935-V939 PolarHBondContact O-N 3.4Å; T936-V939 PolarHBondContact O-N 3.35Å; V939-L942 PolarHBondContact O-N 2.91Å; V939-Y943 VanDerWaalsContact O-CB 3.32Å; V939-Y943 WeakPolarHBondContact O-CB 3.38Å; V939-Y943 PolarHBondContact O-N 3.36Å
940	L	90.4	Very high	88.6	Confident	71 Å²	71	21 Å²	21	37%	0.372	12%	0.116	S	C	.	.	H	α-helix	trans	-60.5	-46.3	173.7	176.5	60.7	0	0	0	112	L199 T936 Y943 L944	L199-L940 HydrophobicContact CD2-CD2 3.75Å; T936-L940 WeakPolarHBondContact O-CB 3.45Å; T936-L940 PolarHBondContact O-N 3.28Å; L940-Y943 PolarHBondContact O-N 3.31Å; L940-L944 HydrophobicContact CD1-CD1 4.2Å; L940-L944 HydrophobicContact CD1-CG 4.39Å; L940-L944 HydrophobicContact CG-CD1 4.26Å; L940-L944 WeakPolarHBondContact O-CG 3.48Å; L940-L944 PolarHBondContact O-N 2.91Å
941	A	88.4	Confident	88.4	Confident	5 Å²	5	19.9 Å²	19.9	4%	0.041	11%	0.111	C	C	.	.	H	α-helix	trans	-65.4	-42.4	178.7	0	0	0	0	0	112.5	V196 F281 V937 F938 Y943 L944 H945	V196-A941 HydrophobicContact CG1-CB 4.2Å; F281-A941 HydrophobicContact CE2-CB 3.73Å; V937-A941 PolarHBondContact O-N 3.43Å; V937-A941 VanDerWaalsContact O-N 3.08Å; F938-A941 PolarHBondContact O-N 2.88Å; A941-Y943 VanDerWaalsContact C-N 3.33Å; A941-Y943 PolarHBondContact O-N 3.47Å; A941-L944 PolarHBondContact O-N 3.29Å; A941-H945 WeakPolarHBondContact O-CB 3.42Å; A941-H945 PolarHBondContact O-N 3Å
942	L	90.6	Very high	88.1	Confident	4 Å²	4	20.4 Å²	20.4	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-64.7	-35.6	174.9	-72.5	175	0	0	0	112.5	L858 L859 M876 F938 V939 A946	L858-L942 HydrophobicContact CB-CD1 3.81Å; L858-L942 WeakPolarHBondContact O-CD1 3.47Å; L859-L942 HydrophobicContact CD2-CD2 4.39Å; M876-L942 HydrophobicContact CE-CB 4.07Å; M876-L942 HydrophobicContact SD-CB 3.56Å; M876-L942 VanDerWaalsContact SD-CB 3.56Å; M876-L942 HydrophobicContact SD-CD1 3.85Å; M876-L942 HydrophobicContact SD-CG 4.37Å; F938-L942 HydrophobicContact CD1-CD1 3.59Å; F938-L942 HydrophobicContact CD1-CG 4.07Å; F938-L942 HydrophobicContact CE1-CD1 3.76Å; F938-L942 HydrophobicContact CE1-CG 4.19Å; F938-L942 WeakPolarHBondContact O-CB 3.4Å; F938-L942 WeakPolarHBondContact O-CG 3.23Å; F938-L942 PolarHBondContact O-N 3.39Å; V939-L942 PolarHBondContact O-N 2.91Å; L942-A946 VanDerWaalsContact O-CB 3.31Å; L942-A946 WeakPolarHBondContact O-CB 3.42Å; L942-A946 PolarHBondContact O-N 3.02Å
943	Y	90.4	Very high	87.7	Confident	27 Å²	27	21.1 Å²	21.1	11%	0.106	12%	0.122	C	C	.	.	H	α-helix	trans	-65.8	-46.2	174.1	171.4	-113.3	0	0	0	111.9	L873 V939 L940 A941 H945 A946 Q947	L873-Y943 HydrophobicContact CB-CD2 3.84Å; L873-Y943 HydrophobicContact CB-CE2 4.16Å; L873-Y943 HydrophobicContact CD1-CD2 4Å; L873-Y943 HydrophobicContact CD1-CG 4.04Å; L873-Y943 HydrophobicContact CD2-CD2 4.03Å; L873-Y943 HydrophobicContact CD2-CE2 3.86Å; L873-Y943 HydrophobicContact CG-CD2 4.17Å; L873-Y943 HydrophobicContact CG-CE2 4.44Å; V939-Y943 VanDerWaalsContact O-CB 3.32Å; V939-Y943 WeakPolarHBondContact O-CB 3.38Å; V939-Y943 PolarHBondContact O-N 3.36Å; L940-Y943 PolarHBondContact O-N 3.31Å; A941-Y943 VanDerWaalsContact C-N 3.33Å; A941-Y943 PolarHBondContact O-N 3.47Å; Y943-H945 VanDerWaalsContact C-N 3.34Å; Y943-H945 PolarHBondContact O-N 3.49Å; Y943-A946 WeakPolarHBondContact O-CB 3.48Å; Y943-A946 PolarHBondContact O-N 3.49Å; Y943-A946 VanDerWaalsContact O-N 3.14Å; Y943-Q947 WeakPolarHBondContact O-CB 3.44Å; Y943-Q947 PolarHBondContact O-N 3.34Å
944	L	87.3	Confident	87.4	Confident	31 Å²	31	19 Å²	19	16%	0.162	11%	0.108	C	C	.	.	H	α-helix	trans	-62.7	-40.1	176.8	-68.9	169	0	0	0	111.8	M192 V196 L940 A941 Q947 Q948	M192-L944 HydrophobicContact SD-CD2 4.09Å; V196-L944 HydrophobicContact CG2-CD1 3.49Å; V196-L944 VanDerWaalsContact CG2-CD1 3.49Å; L940-L944 HydrophobicContact CD1-CD1 4.2Å; L940-L944 HydrophobicContact CD1-CG 4.39Å; L940-L944 HydrophobicContact CG-CD1 4.26Å; L940-L944 WeakPolarHBondContact O-CG 3.48Å; L940-L944 PolarHBondContact O-N 2.91Å; A941-L944 PolarHBondContact O-N 3.29Å; L944-Q947 PolarHBondContact O-N 3.34Å; L944-Q948 PolarHBondContact O-N 3.04Å
945	H	87.1	Confident	87	Confident	8 Å²	8	19.3 Å²	19.3	4%	0.037	11%	0.109	C	C	.	.	H	α-helix	trans	-60.8	-47.3	170.2	168.3	-121.4	0	0	0	111.9	L289 A941 Y943 Q947 Q948 V949	L289-H945 HydrophobicContact CD2-CB 4.02Å; A941-H945 WeakPolarHBondContact O-CB 3.42Å; A941-H945 PolarHBondContact O-N 3Å; Y943-H945 VanDerWaalsContact C-N 3.34Å; Y943-H945 PolarHBondContact O-N 3.49Å; H945-Q947 VanDerWaalsContact C-N 3.3Å; H945-Q947 PolarHBondContact O-N 3.32Å; H945-Q948 PolarHBondContact O-N 2.87Å; H945-V949 VanDerWaalsContact NE2-CG2 3.33Å; H945-V949 WeakPolarHBondContact NE2-CG2 3.39Å; H945-V949 WeakPolarHBondContact O-CG2 3.35Å; H945-V949 PolarHBondContact O-N 3.27Å
946	A	88.7	Confident	86.3	Confident	4 Å²	4	20.3 Å²	20.3	3%	0.033	12%	0.115	C	C	.	.	H	α-helix	trans	-61.6	-36.8	177.9	0	0	0	0	0	112.9	K872 L942 Y943 V949 E950	K872-A946 HydrophobicContact CB-CB 4.48Å; K872-A946 HydrophobicContact CD-CB 3.63Å; L942-A946 VanDerWaalsContact O-CB 3.31Å; L942-A946 WeakPolarHBondContact O-CB 3.42Å; L942-A946 PolarHBondContact O-N 3.02Å; Y943-A946 WeakPolarHBondContact O-CB 3.48Å; Y943-A946 PolarHBondContact O-N 3.49Å; Y943-A946 VanDerWaalsContact O-N 3.14Å; A946-V949 PolarHBondContact O-N 2.92Å; A946-E950 PolarHBondContact O-N 2.9Å
947	Q	86.3	Confident	85.9	Confident	40 Å²	40	17.8 Å²	17.8	19%	0.187	10%	0.098	C	C	.	.	H	α-helix	trans	-66	-42.1	175.2	-166.5	-176.4	9.7	0	0	111.6	L684 Y943 L944 H945 S951	L684-Q947 HydrophobicContact CD1-CG 3.77Å; L684-Q947 WeakPolarHBondContact CD1-O 3.27Å; L684-Q947 HydrophobicContact CG-CG 4.43Å; Y943-Q947 WeakPolarHBondContact O-CB 3.44Å; Y943-Q947 PolarHBondContact O-N 3.34Å; L944-Q947 PolarHBondContact O-N 3.34Å; H945-Q947 VanDerWaalsContact C-N 3.3Å; H945-Q947 PolarHBondContact O-N 3.32Å; Q947-S951 VanDerWaalsContact O-CB 3.23Å; Q947-S951 WeakPolarHBondContact O-CB 3.46Å; Q947-S951 PolarHBondContact O-N 3.47Å
948	Q	83.3	Confident	85.5	Confident	10 Å²	10	17.8 Å²	17.8	5%	0.047	10%	0.097	C	C	.	.	H	α-helix	trans	-65.6	-42.8	174.6	178.6	61.6	7.6	0	0	111.9	M192 L944 H945 T952	M192-Q948 HydrophobicContact CE-CB 4.26Å; L944-Q948 PolarHBondContact O-N 3.04Å; H945-Q948 PolarHBondContact O-N 2.87Å; Q948-T952 WeakPolarHBondContact O-CB 3.21Å; Q948-T952 PolarHBondContact O-N 3.03Å; Q948-T952 PolarHBondContact O-OG1 3.12Å
949	V	84.8	Confident	84.7	Confident	25 Å²	25	18.9 Å²	18.9	15%	0.152	10%	0.101	C	C	.	.	H	α-helix	trans	-62.5	-52.3	177.2	169.3	0	0	0	0	111.5	L865 H945 A946 S951 T952 A953	L865-V949 HydrophobicContact CB-CG1 4.12Å; L865-V949 HydrophobicContact CD2-CG1 3.96Å; L865-V949 HydrophobicContact CD2-CG2 4.39Å; H945-V949 VanDerWaalsContact NE2-CG2 3.33Å; H945-V949 WeakPolarHBondContact NE2-CG2 3.39Å; H945-V949 WeakPolarHBondContact O-CG2 3.35Å; H945-V949 PolarHBondContact O-N 3.27Å; A946-V949 PolarHBondContact O-N 2.92Å; V949-S951 VanDerWaalsContact C-N 3.35Å; V949-S951 PolarHBondContact O-N 2.86Å; V949-T952 PolarHBondContact O-N 3.48Å; V949-A953 PolarHBondContact O-N 3.36Å
950	E	85.9	Confident	83.9	Confident	8 Å²	8	21.5 Å²	21.5	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-61.4	-44.2	179.5	176.4	171.1	-170.2	0	0	111.4	L684 S869 A946 T952 A953 R954	L684-E950 HydrophobicContact CB-CG 4.31Å; L684-E950 HydrophobicContact CD1-CB 3.94Å; L684-E950 HydrophobicContact CD1-CG 3.97Å; S869-E950 VanDerWaalsContact CB-OE2 3.3Å; S869-E950 WeakPolarHBondContact CB-OE2 3.14Å; S869-E950 PolarHBondContact N-OE2 3.01Å; S869-E950 PolarHBondContact OG-OE2 2.92Å; A946-E950 PolarHBondContact O-N 2.9Å; E950-T952 VanDerWaalsContact C-N 3.27Å; E950-T952 PolarHBondContact O-N 2.99Å; E950-A953 PolarHBondContact O-N 3.09Å; E950-R954 HydrophobicContact CG-CG 4.39Å; E950-R954 WeakPolarHBondContact O-CG 3.48Å; E950-R954 PolarHBondContact O-N 3.07Å; E950-R954 IonicContact OE1-CZ 2.66Å; E950-R954 VanDerWaalsContact OE1-CZ 3.27Å; E950-R954 IonicContact OE1-NE 3.81Å; E950-R954 PolarHBondContact OE1-NE 3.12Å; E950-R954 IonicContact OE1-NH2 3.88Å; E950-R954 PolarHBondContact OE1-NH2 3.15Å
951	S	81.7	Confident	83.5	Confident	5 Å²	5	18.9 Å²	18.9	4%	0.035	10%	0.099	C	C	.	.	H	α-helix	trans	-68	-26.2	-179.8	-173.8	0	0	0	0	113.3	R675 Q947 V949 L955	R675-S951 PolarHBondContact NE-OG 3.32Å; R675-S951 PolarHBondContact NH2-OG 3.27Å; Q947-S951 VanDerWaalsContact O-CB 3.23Å; Q947-S951 WeakPolarHBondContact O-CB 3.46Å; Q947-S951 PolarHBondContact O-N 3.47Å; V949-S951 VanDerWaalsContact C-N 3.35Å; V949-S951 PolarHBondContact O-N 2.86Å; S951-L955 PolarHBondContact O-N 2.92Å
952	T	80.4	Confident	82.9	Confident	14 Å²	14	21.3 Å²	21.3	9%	0.086	11%	0.109	C	C	.	.	H	α-helix	trans	-74.9	-47.1	173.4	-55.9	0	0	0	0	110.3	L185 Q948 V949 E950 R954 L955 D956	L185-T952 HydrophobicContact CD2-CG2 3.98Å; Q948-T952 WeakPolarHBondContact O-CB 3.21Å; Q948-T952 PolarHBondContact O-N 3.03Å; Q948-T952 PolarHBondContact O-OG1 3.12Å; V949-T952 PolarHBondContact O-N 3.48Å; E950-T952 VanDerWaalsContact C-N 3.27Å; E950-T952 PolarHBondContact O-N 2.99Å; T952-R954 VanDerWaalsContact C-N 3.26Å; T952-R954 PolarHBondContact O-N 2.92Å; T952-L955 PolarHBondContact O-N 3.47Å; T952-D956 PolarHBondContact O-N 3.35Å
953	A	81.7	Confident	81.9	Confident	37 Å²	37	22 Å²	22	31%	0.306	12%	0.116	S	C	.	.	H	α-helix	trans	-60.4	-33.7	177.9	0	0	0	0	0	113	V949 E950 F957	V949-A953 PolarHBondContact O-N 3.36Å; E950-A953 PolarHBondContact O-N 3.09Å; A953-F957 WeakPolarHBondContact O-CB 3.48Å; A953-F957 PolarHBondContact O-N 2.85Å
954	R	85	Confident	81.2	Confident	7 Å²	7	23.1 Å²	23.1	3%	0.026	13%	0.125	C	C	.	.	H	α-helix	trans	-71.7	-29.7	174.4	-73.8	175.7	177	-88.9	6.7	113.5	L684 F686 E692 Y695 E950 T952 L958	L684-R954 WeakPolarHBondContact O-CD 3.21Å; L684-R954 PolarHBondContact O-NE 3.38Å; L684-R954 PolarHBondContact O-NH1 2.96Å; F686-R954 HydrophobicContact CE1-CB 4.33Å; F686-R954 HydrophobicContact CE2-CB 4.47Å; F686-R954 HydrophobicContact CE2-CG 4.17Å; F686-R954 HydrophobicContact CZ-CB 3.8Å; F686-R954 HydrophobicContact CZ-CG 4Å; E692-R954 VanDerWaalsContact CD-NH1 3.32Å; E692-R954 IonicContact OE1-CZ 3.84Å; E692-R954 IonicContact OE1-NH1 3Å; E692-R954 PolarHBondContact OE1-NH1 3.45Å; E692-R954 VanDerWaalsContact OE1-NH1 3.12Å; E692-R954 IonicContact OE1-NH2 3.84Å; E692-R954 PolarHBondContact OE1-NH2 3.31Å; E692-R954 IonicContact OE2-CZ 3.72Å; E692-R954 IonicContact OE2-NH1 2.65Å; E692-R954 PolarHBondContact OE2-NH1 2.9Å; E692-R954 IonicContact OE2-NH2 2.82Å; Y695-R954 HydrophobicContact CD1-CG 4.43Å; Y695-R954 HydrophobicContact CE1-CG 3.68Å; Y695-R954 HydrophobicContact CE2-CG 4.35Å; E950-R954 HydrophobicContact CG-CG 4.39Å; E950-R954 WeakPolarHBondContact O-CG 3.48Å; E950-R954 PolarHBondContact O-N 3.07Å; E950-R954 IonicContact OE1-CZ 2.66Å; E950-R954 VanDerWaalsContact OE1-CZ 3.27Å; E950-R954 IonicContact OE1-NE 3.81Å; E950-R954 PolarHBondContact OE1-NE 3.12Å; E950-R954 IonicContact OE1-NH2 3.88Å; E950-R954 PolarHBondContact OE1-NH2 3.15Å; T952-R954 VanDerWaalsContact C-N 3.26Å; T952-R954 PolarHBondContact O-N 2.92Å; R954-L958 PolarHBondContact O-N 3.4Å; R954-L958 VanDerWaalsContact O-N 3.13Å
955	L	79.6	Confident	80.8	Confident	12 Å²	12	25.3 Å²	25.3	6%	0.063	14%	0.135	C	C	.	.	H	α-helix	trans	-74.9	-46.7	173.9	-173.4	72.8	0	0	0	111.1	L185 I671 S951 T952 F957 L958 W959	L185-L955 HydrophobicContact CD1-CD2 3.66Å; I671-L955 HydrophobicContact CG2-CD2 3.59Å; S951-L955 PolarHBondContact O-N 2.92Å; T952-L955 PolarHBondContact O-N 3.47Å; L955-F957 PolarHBondContact O-N 3.32Å; L955-L958 PolarHBondContact O-N 2.94Å; L955-L958 VanDerWaalsContact O-N 3.14Å; L955-W959 HydrophobicContact CD1-CZ2 3.98Å; L955-W959 HydrophobicContact CD2-CH2 3.82Å; L955-W959 HydrophobicContact CD2-CZ2 3.84Å; L955-W959 HydrophobicContact CD2-CZ3 4.27Å; L955-W959 HydrophobicContact CG-CD2 4.22Å; L955-W959 HydrophobicContact CG-CH2 4.29Å; L955-W959 HydrophobicContact CG-CZ2 3.97Å; L955-W959 PolarHBondContact O-N 2.96Å
956	D	77.6	Confident	79.9	Confident	21 Å²	21	26.9 Å²	26.9	11%	0.112	14%	0.142	C	C	.	.	H	α-helix	trans	-54.4	-42.9	172.4	-84.2	-6.1	0	0	0	110.6	A354 T952 K960	A354-D956 HydrophobicContact CB-CB 4.32Å; A354-D956 WeakPolarHBondContact CB-OD1 3.2Å; T952-D956 PolarHBondContact O-N 3.35Å; D956-K960 VanDerWaalsContact O-CB 3.28Å; D956-K960 WeakPolarHBondContact O-CB 3.43Å; D956-K960 PolarHBondContact O-N 3.35Å
957	F	81.8	Confident	79.1	Confident	17 Å²	17	31.1 Å²	31.1	8%	0.075	16%	0.16	C	C	.	.	H	α-helix	trans	-61.9	-46.9	175.3	176.4	-95.2	0	0	0	112.9	F686 K694 Y695 A953 L955 W959 K960 L961	F686-F957 HydrophobicContact CE2-CD1 4.01Å; F686-F957 HydrophobicContact CE2-CE1 4.35Å; F686-F957 AromaticContact CZ-CD1 3.83Å; F686-F957 HydrophobicContact CZ-CD1 3.83Å; F686-F957 HydrophobicContact CZ-CE1 4.47Å; K694-F957 HydrophobicContact CB-CE1 4.49Å; K694-F957 HydrophobicContact CB-CZ 3.74Å; Y695-F957 HydrophobicContact CD2-CB 4.01Å; Y695-F957 HydrophobicContact CD2-CD1 4.01Å; Y695-F957 AromaticContact CD2-CD2 3.76Å; Y695-F957 HydrophobicContact CD2-CD2 3.76Å; Y695-F957 HydrophobicContact CD2-CE1 4.5Å; Y695-F957 HydrophobicContact CD2-CE2 4.27Å; Y695-F957 AromaticContact CD2-CG 3.63Å; Y695-F957 HydrophobicContact CD2-CG 3.63Å; Y695-F957 HydrophobicContact CE2-CB 4.17Å; Y695-F957 HydrophobicContact CE2-CG 4.29Å; Y695-F957 HydrophobicContact CG-CD1 4.4Å; Y695-F957 HydrophobicContact CG-CG 4.44Å; A953-F957 WeakPolarHBondContact O-CB 3.48Å; A953-F957 PolarHBondContact O-N 2.85Å; L955-F957 PolarHBondContact O-N 3.32Å; F957-W959 VanDerWaalsContact C-N 3.35Å; F957-W959 PolarHBondContact O-N 2.91Å; F957-K960 PolarHBondContact O-N 3.46Å; F957-L961 HydrophobicContact CE1-CD2 4.42Å; F957-L961 WeakPolarHBondContact O-CB 3.31Å; F957-L961 PolarHBondContact O-N 3.44Å
958	L	81.6	Confident	78.7	Confident	18 Å²	18	34.4 Å²	34.4	9%	0.094	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-40.8	-180	-176.7	65.4	0	0	0	111.7	L674 H678 L691 R954 L955 L961 Q962	L674-L958 HydrophobicContact CD2-CD2 4.37Å; H678-L958 HydrophobicContact CB-CD2 4.05Å; L691-L958 HydrophobicContact CD1-CD1 4.49Å; R954-L958 PolarHBondContact O-N 3.4Å; R954-L958 VanDerWaalsContact O-N 3.13Å; L955-L958 PolarHBondContact O-N 2.94Å; L955-L958 VanDerWaalsContact O-N 3.14Å; L958-L961 PolarHBondContact O-N 3.4Å; L958-Q962 PolarHBondContact O-N 3.33Å
959	W	72.6	Confident	78.3	Confident	28 Å²	28	40.5 Å²	40.5	11%	0.106	20%	0.203	C	C	.	.	H	α-helix	trans	-73.1	-36.8	176.9	-68.6	-11.2	0	0	0	113.1	Y181 I671 L955 F957 L961 Q962 A963	Y181-W959 AromaticContact CE2-CH2 3.84Å; Y181-W959 HydrophobicContact CE2-CH2 3.84Å; Y181-W959 AromaticContact CE2-CZ3 3.55Å; Y181-W959 HydrophobicContact CE2-CZ3 3.55Å; Y181-W959 AromaticContact CZ-CZ3 3.82Å; Y181-W959 WeakPolarHBondContact OH-CZ3 3.41Å; I671-W959 HydrophobicContact CD1-CH2 4.16Å; I671-W959 HydrophobicContact CG1-CH2 3.99Å; I671-W959 HydrophobicContact CG1-CZ2 4.05Å; L955-W959 HydrophobicContact CD1-CZ2 3.98Å; L955-W959 HydrophobicContact CD2-CH2 3.82Å; L955-W959 HydrophobicContact CD2-CZ2 3.84Å; L955-W959 HydrophobicContact CD2-CZ3 4.27Å; L955-W959 HydrophobicContact CG-CD2 4.22Å; L955-W959 HydrophobicContact CG-CH2 4.29Å; L955-W959 HydrophobicContact CG-CZ2 3.97Å; L955-W959 PolarHBondContact O-N 2.96Å; F957-W959 VanDerWaalsContact C-N 3.35Å; F957-W959 PolarHBondContact O-N 2.91Å; W959-L961 VanDerWaalsContact C-N 3.28Å; W959-L961 PolarHBondContact O-N 2.98Å; W959-Q962 PolarHBondContact O-N 3.24Å; W959-A963 WeakPolarHBondContact O-CB 3.28Å; W959-A963 PolarHBondContact O-N 3.48Å
960	K	77.6	Confident	77.5	Confident	59 Å²	59	40.6 Å²	40.6	26%	0.257	20%	0.202	S	C	.	.	H	α-helix	trans	-60.7	-41.1	171.8	-168.4	-178.8	-177.9	80.4	0	110.8	E357 D956 F957 A963 T964	E357-K960 IonicContact OE1-NZ 3.31Å; E357-K960 PolarHBondContact OE1-NZ 3.46Å; E357-K960 IonicContact OE2-NZ 2.67Å; E357-K960 PolarHBondContact OE2-NZ 3.47Å; D956-K960 VanDerWaalsContact O-CB 3.28Å; D956-K960 WeakPolarHBondContact O-CB 3.43Å; D956-K960 PolarHBondContact O-N 3.35Å; F957-K960 PolarHBondContact O-N 3.46Å; K960-A963 PolarHBondContact O-N 2.74Å; K960-T964 PolarHBondContact O-N 2.9Å; K960-T964 PolarHBondContact O-OG1 2.91Å; K960-T964 VanDerWaalsContact O-OG1 3.11Å
961	L	80.6	Confident	76.9	Confident	17 Å²	17	45.1 Å²	45.1	9%	0.089	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-50.8	176.6	-174.7	64.3	0	0	0	112	L691 K694 F957 L958 W959 A963 T964 E965	L691-L961 HydrophobicContact CD2-CD2 3.53Å; K694-L961 HydrophobicContact CD-CD1 4.02Å; K694-L961 HydrophobicContact CD-CD2 3.88Å; F957-L961 HydrophobicContact CE1-CD2 4.42Å; F957-L961 WeakPolarHBondContact O-CB 3.31Å; F957-L961 PolarHBondContact O-N 3.44Å; L958-L961 PolarHBondContact O-N 3.4Å; W959-L961 VanDerWaalsContact C-N 3.28Å; W959-L961 PolarHBondContact O-N 2.98Å; L961-A963 VanDerWaalsContact C-N 3.28Å; L961-A963 PolarHBondContact O-N 2.94Å; L961-T964 WeakPolarHBondContact CA-OG1 3.35Å; L961-T964 PolarHBondContact O-N 3.07Å; L961-T964 VanDerWaalsContact O-N 3.1Å; L961-T964 PolarHBondContact O-OG1 3.49Å; L961-E965 HydrophobicContact CD1-CG 4.34Å; L961-E965 WeakPolarHBondContact CD1-OE1 3.2Å; L961-E965 HydrophobicContact CG-CG 4.5Å; L961-E965 WeakPolarHBondContact CG-OE1 3.3Å; L961-E965 WeakPolarHBondContact O-CG 3.44Å; L961-E965 PolarHBondContact O-N 3.06Å
962	Q	77.8	Confident	76.6	Confident	56 Å²	56	51.9 Å²	51.9	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-57.7	-41.5	175	178.9	175.9	4.1	0	0	111.6	L958 W959 T964 E965 E966	L958-Q962 PolarHBondContact O-N 3.33Å; W959-Q962 PolarHBondContact O-N 3.24Å; Q962-T964 VanDerWaalsContact C-N 3.31Å; Q962-T964 PolarHBondContact O-N 3.41Å; Q962-E965 PolarHBondContact O-N 3.49Å; Q962-E966 HydrophobicContact CG-CG 4.26Å; Q962-E966 WeakPolarHBondContact CG-OE1 3.39Å; Q962-E966 PolarHBondContact NE2-OE1 3.2Å; Q962-E966 WeakPolarHBondContact O-CB 3.32Å; Q962-E966 WeakPolarHBondContact O-CG 3.22Å; Q962-E966 PolarHBondContact O-N 3.46Å
963	A	69.1	Low	76	Confident	19 Å²	19	54.5 Å²	54.5	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-69.1	-25.4	178.6	0	0	0	0	0	113.5	C361 W959 K960 L961 K967	C361-A963 HydrophobicContact CB-CB 3.9Å; C361-A963 PolarHBondContact SG-O 3.31Å; W959-A963 WeakPolarHBondContact O-CB 3.28Å; W959-A963 PolarHBondContact O-N 3.48Å; K960-A963 PolarHBondContact O-N 2.74Å; L961-A963 VanDerWaalsContact C-N 3.28Å; L961-A963 PolarHBondContact O-N 2.94Å; A963-K967 VanDerWaalsContact O-CB 3.24Å; A963-K967 WeakPolarHBondContact O-CB 3.41Å; A963-K967 PolarHBondContact O-N 2.9Å
964	T	74.6	Confident	75.4	Confident	49 Å²	49	55.4 Å²	55.4	30%	0.301	27%	0.265	S	S	.	.	H	α-helix	trans	-79.9	-41.3	169.6	45.1	0	0	0	0	112.4	K960 L961 Q962 K967 E968	K960-T964 PolarHBondContact O-N 2.9Å; K960-T964 PolarHBondContact O-OG1 2.91Å; K960-T964 VanDerWaalsContact O-OG1 3.11Å; L961-T964 WeakPolarHBondContact CA-OG1 3.35Å; L961-T964 PolarHBondContact O-N 3.07Å; L961-T964 VanDerWaalsContact O-N 3.1Å; L961-T964 PolarHBondContact O-OG1 3.49Å; Q962-T964 VanDerWaalsContact C-N 3.31Å; Q962-T964 PolarHBondContact O-N 3.41Å; T964-K967 WeakPolarHBondContact O-CB 3.38Å; T964-K967 PolarHBondContact O-N 2.93Å; T964-K967 VanDerWaalsContact O-N 3.12Å; T964-E968 WeakPolarHBondContact O-CG 3.46Å; T964-E968 PolarHBondContact O-N 3.18Å
965	E	79.1	Confident	74.8	Confident	78 Å²	78	57.1 Å²	57.1	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-67.4	-45.9	-179.7	-70.1	168.7	170.9	0	0	110.3	K694 L961 Q962 K967 E968 E969	K694-E965 IonicContact NZ-OE1 3.51Å; K694-E965 PolarHBondContact NZ-OE1 3.28Å; L961-E965 HydrophobicContact CD1-CG 4.34Å; L961-E965 WeakPolarHBondContact CD1-OE1 3.2Å; L961-E965 HydrophobicContact CG-CG 4.5Å; L961-E965 WeakPolarHBondContact CG-OE1 3.3Å; L961-E965 WeakPolarHBondContact O-CG 3.44Å; L961-E965 PolarHBondContact O-N 3.06Å; Q962-E965 PolarHBondContact O-N 3.49Å; E965-K967 PolarHBondContact O-N 3.44Å; E965-E968 PolarHBondContact O-N 2.96Å; E965-E969 WeakPolarHBondContact O-CG 3.47Å; E965-E969 PolarHBondContact O-N 3.26Å; E965-E969 VanDerWaalsContact O-N 3.09Å
966	E	68.4	Low	74.3	Confident	40 Å²	40	59 Å²	59	19%	0.187	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-22.7	170.9	-72.1	-173.8	-149.8	0	0	113.4	R365 R669 Q962 M970	R365-E966 WeakPolarHBondContact CD-OE2 3.42Å; R365-E966 IonicContact CZ-OE2 2.95Å; R365-E966 IonicContact NE-OE2 2.65Å; R365-E966 IonicContact NH1-OE1 3.37Å; R365-E966 IonicContact NH1-OE2 3.84Å; R365-E966 PolarHBondContact NH1-OE2 3.43Å; R669-E966 IonicContact NH2-OE1 3.12Å; Q962-E966 HydrophobicContact CG-CG 4.26Å; Q962-E966 WeakPolarHBondContact CG-OE1 3.39Å; Q962-E966 PolarHBondContact NE2-OE1 3.2Å; Q962-E966 WeakPolarHBondContact O-CB 3.32Å; Q962-E966 WeakPolarHBondContact O-CG 3.22Å; Q962-E966 PolarHBondContact O-N 3.46Å; E966-M970 WeakPolarHBondContact O-CB 3.3Å; E966-M970 PolarHBondContact O-N 3.02Å
967	K	72.2	Confident	73.9	Confident	94 Å²	94	59 Å²	59	41%	0.409	29%	0.288	S	S	.	.	H	α-helix	trans	-82.5	-41.3	176.4	175.8	-175	170.4	-67.6	0	111.7	A963 T964 E965 M970 E971	A963-K967 VanDerWaalsContact O-CB 3.24Å; A963-K967 WeakPolarHBondContact O-CB 3.41Å; A963-K967 PolarHBondContact O-N 2.9Å; T964-K967 WeakPolarHBondContact O-CB 3.38Å; T964-K967 PolarHBondContact O-N 2.93Å; T964-K967 VanDerWaalsContact O-N 3.12Å; E965-K967 PolarHBondContact O-N 3.44Å; K967-M970 PolarHBondContact O-N 2.8Å; K967-E971 VanDerWaalsContact CE-OE1 3.27Å; K967-E971 WeakPolarHBondContact CE-OE1 3.4Å; K967-E971 IonicContact NZ-OE1 3.73Å; K967-E971 PolarHBondContact NZ-OE1 3.03Å; K967-E971 IonicContact NZ-OE2 3.6Å; K967-E971 PolarHBondContact NZ-OE2 3.32Å; K967-E971 PolarHBondContact O-N 3.03Å
968	E	77.4	Confident	73.4	Confident	109 Å²	109	65 Å²	65	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-45.4	176.9	-74	175.3	-177.8	0	0	110.3	T964 E965 M970 E971 E972	T964-E968 WeakPolarHBondContact O-CG 3.46Å; T964-E968 PolarHBondContact O-N 3.18Å; E965-E968 PolarHBondContact O-N 2.96Å; E968-M970 PolarHBondContact O-N 2.93Å; E968-E971 PolarHBondContact O-N 3.41Å; E968-E972 PolarHBondContact O-N 3.38Å
969	E	75.6	Confident	73	Confident	137 Å²	137	73.1 Å²	73.1	64%	0.64	34%	0.339	S	S	*	.	H	α-helix	trans	-55	-39.1	170.8	-71.2	-178	166.6	0	0	112.5	E965 L973	E965-E969 WeakPolarHBondContact O-CG 3.47Å; E965-E969 PolarHBondContact O-N 3.26Å; E965-E969 VanDerWaalsContact O-N 3.09Å; E969-L973 WeakPolarHBondContact O-CB 3.46Å; E969-L973 PolarHBondContact O-N 3.47Å
970	M	67.1	Low	73	Confident	27 Å²	27	73 Å²	73	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-72.8	-37.4	179.7	-163	60.2	69.5	0	0	112.7	R365 S368 Q369 E966 K967 E968 L973 Q974	R365-M970 HydrophobicContact CB-CE 4.48Å; R365-M970 HydrophobicContact CG-CE 3.62Å; S368-M970 WeakPolarHBondContact CB-SD 3.39Å; S368-M970 WeakPolarHBondContact OG-CG 3.36Å; S368-M970 PolarHBondContact OG-SD 3.3Å; Q369-M970 HydrophobicContact CG-CE 4.23Å; E966-M970 WeakPolarHBondContact O-CB 3.3Å; E966-M970 PolarHBondContact O-N 3.02Å; K967-M970 PolarHBondContact O-N 2.8Å; E968-M970 PolarHBondContact O-N 2.93Å; M970-L973 PolarHBondContact O-N 3.28Å; M970-L973 HydrophobicContact SD-CD2 4.21Å; M970-Q974 WeakPolarHBondContact O-CG 3.46Å; M970-Q974 PolarHBondContact O-N 2.96Å
971	E	73.5	Confident	72.7	Confident	104 Å²	104	70.9 Å²	70.9	49%	0.486	33%	0.332	S	S	.	.	H	α-helix	trans	-68.8	-37.3	175	-75.2	178.5	167.6	0	0	111.5	K967 E968 A975	K967-E971 VanDerWaalsContact CE-OE1 3.27Å; K967-E971 WeakPolarHBondContact CE-OE1 3.4Å; K967-E971 IonicContact NZ-OE1 3.73Å; K967-E971 PolarHBondContact NZ-OE1 3.03Å; K967-E971 IonicContact NZ-OE2 3.6Å; K967-E971 PolarHBondContact NZ-OE2 3.32Å; K967-E971 PolarHBondContact O-N 3.03Å; E968-E971 PolarHBondContact O-N 3.41Å; E971-A975 WeakPolarHBondContact O-CB 3.41Å; E971-A975 PolarHBondContact O-N 3.17Å
972	E	75.6	Confident	72.4	Confident	147 Å²	147	73.2 Å²	73.2	69%	0.687	34%	0.343	S	S	*	.	H	α-helix	trans	-61.9	-47.1	169.5	-71.7	-162.1	165	0	0	111.9	E968 Q974 A975 Y976	E968-E972 PolarHBondContact O-N 3.38Å; E972-Q974 PolarHBondContact O-N 3.07Å; E972-A975 PolarHBondContact O-N 3.03Å; E972-Y976 WeakPolarHBondContact O-CB 3.46Å; E972-Y976 PolarHBondContact O-N 2.91Å
973	L	67.4	Low	72.4	Confident	69 Å²	69	71.9 Å²	71.9	36%	0.361	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-38.5	179.3	-177.1	60.1	0	0	0	112.4	N372 E969 M970 Y976 N977	N372-L973 WeakPolarHBondContact ND2-CD2 3.3Å; E969-L973 WeakPolarHBondContact O-CB 3.46Å; E969-L973 PolarHBondContact O-N 3.47Å; M970-L973 PolarHBondContact O-N 3.28Å; M970-L973 HydrophobicContact SD-CD2 4.21Å; L973-Y976 HydrophobicContact CD1-CD1 4.33Å; L973-N977 WeakPolarHBondContact O-CB 3.5Å; L973-N977 PolarHBondContact O-N 3.4Å; L973-N977 PolarHBondContact O-ND2 2.89Å
974	Q	69.6	Low	72.7	Confident	55 Å²	55	72.3 Å²	72.3	26%	0.257	34%	0.337	S	S	.	.	H	α-helix	trans	-65.1	-43.8	172.1	-76.1	-164.8	1.6	0	0	112.1	S368 M970 E972 Y976 N977 R978	S368-Q974 WeakPolarHBondContact OG-CG 3.49Å; S368-Q974 PolarHBondContact OG-NE2 3.43Å; M970-Q974 WeakPolarHBondContact O-CG 3.46Å; M970-Q974 PolarHBondContact O-N 2.96Å; E972-Q974 PolarHBondContact O-N 3.07Å; Q974-Y976 VanDerWaalsContact C-N 3.33Å; Q974-Y976 PolarHBondContact O-N 3.33Å; Q974-N977 PolarHBondContact O-N 2.94Å; Q974-R978 WeakPolarHBondContact O-CG 3.31Å; Q974-R978 PolarHBondContact O-N 3.13Å
975	A	71.3	Confident	72.8	Confident	43 Å²	43	70.3 Å²	70.3	36%	0.355	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-41.1	177.5	0	0	0	0	0	111.6	E971 E972 R978 R979	E971-A975 WeakPolarHBondContact O-CB 3.41Å; E971-A975 PolarHBondContact O-N 3.17Å; E972-A975 PolarHBondContact O-N 3.03Å; A975-R978 PolarHBondContact O-N 3.29Å; A975-R979 WeakPolarHBondContact O-CG 3.44Å; A975-R979 PolarHBondContact O-N 2.8Å; A975-R979 VanDerWaalsContact O-N 3.12Å
976	Y	70.8	Confident	72.9	Confident	53 Å²	53	66.6 Å²	66.6	21%	0.208	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-49.9	172.9	173.6	-105.1	0	0	0	112.2	I396 E972 L973 Q974 R978 R979 L980	I396-Y976 HydrophobicContact CG2-CE2 3.62Å; I396-Y976 WeakPolarHBondContact CG2-OH 3.26Å; E972-Y976 WeakPolarHBondContact O-CB 3.46Å; E972-Y976 PolarHBondContact O-N 2.91Å; L973-Y976 HydrophobicContact CD1-CD1 4.33Å; Q974-Y976 VanDerWaalsContact C-N 3.33Å; Q974-Y976 PolarHBondContact O-N 3.33Å; Y976-R978 VanDerWaalsContact C-N 3.3Å; Y976-R978 PolarHBondContact O-N 2.93Å; Y976-R979 WeakPolarHBondContact O-CB 3.15Å; Y976-R979 PolarHBondContact O-N 3.13Å; Y976-L980 PolarHBondContact O-N 3.09Å
977	N	68.4	Low	73.3	Confident	21 Å²	21	71 Å²	71	11%	0.112	33%	0.325	C	S	.	.	H	α-helix	trans	-64.5	-33.1	-180	-75.2	-21.1	0	0	0	113	N372 Q376 L973 Q974 L980 L981	N372-N977 PolarHBondContact OD1-ND2 2.75Å; Q376-N977 PolarHBondContact NE2-OD1 3.18Å; L973-N977 WeakPolarHBondContact O-CB 3.5Å; L973-N977 PolarHBondContact O-N 3.4Å; L973-N977 PolarHBondContact O-ND2 2.89Å; Q974-N977 PolarHBondContact O-N 2.94Å; N977-L980 PolarHBondContact O-N 2.78Å; N977-L981 PolarHBondContact O-N 2.86Å
978	R	71.6	Confident	73.5	Confident	143 Å²	143	70 Å²	70	54%	0.54	32%	0.324	S	S	.	.	H	α-helix	trans	-65.6	-40	170.9	-71.3	177.8	-174.7	-152.6	2.6	112.4	Q974 A975 Y976 L981 H982	Q974-R978 WeakPolarHBondContact O-CG 3.31Å; Q974-R978 PolarHBondContact O-N 3.13Å; A975-R978 PolarHBondContact O-N 3.29Å; Y976-R978 VanDerWaalsContact C-N 3.3Å; Y976-R978 PolarHBondContact O-N 2.93Å; R978-L981 PolarHBondContact O-N 3.37Å; R978-H982 WeakPolarHBondContact O-CB 3.47Å; R978-H982 PolarHBondContact O-CD2 2.7Å; R978-H982 VanDerWaalsContact O-CG 3.24Å; R978-H982 PolarHBondContact O-N 2.9Å
979	R	73	Confident	73.5	Confident	188 Å²	188	64.9 Å²	64.9	71%	0.709	30%	0.3	S	S	*	.	H	α-helix	trans	-60.4	-44.7	173.8	-68.7	170.2	-173.8	177.9	3.1	111.3	A975 Y976 H982 N983	A975-R979 WeakPolarHBondContact O-CG 3.44Å; A975-R979 PolarHBondContact O-N 2.8Å; A975-R979 VanDerWaalsContact O-N 3.12Å; Y976-R979 WeakPolarHBondContact O-CB 3.15Å; Y976-R979 PolarHBondContact O-N 3.13Å; R979-H982 PolarHBondContact O-N 2.87Å; R979-N983 PolarHBondContact O-N 3.27Å
980	L	71.9	Confident	73.4	Confident	24 Å²	24	58.3 Å²	58.3	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-44.7	177.9	-176.5	62.2	0	0	0	112.2	Q376 L380 W528 Y976 N977 N983	Q376-L980 HydrophobicContact CG-CD2 4.24Å; L380-L980 HydrophobicContact CD1-CD1 4.5Å; L380-L980 HydrophobicContact CD1-CD2 4.43Å; W528-L980 HydrophobicContact CE3-CD1 4.38Å; W528-L980 HydrophobicContact CZ3-CD1 3.85Å; Y976-L980 PolarHBondContact O-N 3.09Å; N977-L980 PolarHBondContact O-N 2.78Å; L980-N983 WeakPolarHBondContact O-CB 3.37Å; L980-N983 PolarHBondContact O-N 3.17Å; L980-N983 VanDerWaalsContact O-N 3.16Å
981	L	71.9	Confident	73.6	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-40.6	175.8	178.1	55.6	0	0	0	112.7	L379 N977 R978 N983 I984 L985 A990 L994	L379-L981 HydrophobicContact CD1-CD1 4.08Å; L379-L981 HydrophobicContact CD1-CD2 4.45Å; N977-L981 PolarHBondContact O-N 2.86Å; R978-L981 PolarHBondContact O-N 3.37Å; L981-N983 PolarHBondContact O-N 2.96Å; L981-I984 PolarHBondContact O-N 3.48Å; L981-L985 HydrophobicContact CD1-CD1 4.27Å; L981-L985 HydrophobicContact CD1-CG 4.47Å; L981-L985 PolarHBondContact O-N 2.86Å; L981-A990 HydrophobicContact CD2-CB 4.16Å; L981-A990 HydrophobicContact CG-CB 4.02Å; L981-L994 HydrophobicContact CD2-CD1 3.83Å; L981-L994 HydrophobicContact CD2-CD2 4.02Å; L981-L994 HydrophobicContact CD2-CG 3.88Å
982	H	75.1	Confident	73.5	Confident	66 Å²	66	56.8 Å²	56.8	31%	0.306	27%	0.267	S	S	.	.	H	α-helix	trans	-67.4	-17	174.8	-66.6	-36.1	0	0	0	113.5	R978 R979 I984 K987	R978-H982 WeakPolarHBondContact O-CB 3.47Å; R978-H982 PolarHBondContact O-CD2 2.7Å; R978-H982 VanDerWaalsContact O-CG 3.24Å; R978-H982 PolarHBondContact O-N 2.9Å; R979-H982 PolarHBondContact O-N 2.87Å; H982-I984 VanDerWaalsContact C-N 3.31Å; H982-K987 HydrophobicContact CB-CG 4.47Å
983	N	77	Confident	73	Confident	28 Å²	28	54.3 Å²	54.3	15%	0.15	25%	0.254	C	S	.	.	H	α-helix	trans	-76.3	-20.8	169.1	-157.6	9.4	0	0	0	112.6	L525 R526 K527 W528 R979 L980 L981	L525-N983 PolarHBondContact O-ND2 3.27Å; L525-N983 PolarHBondContact O-OD1 2.74Å; R526-N983 WeakPolarHBondContact CA-OD1 3.25Å; K527-N983 WeakPolarHBondContact CA-O 3.36Å; K527-N983 PolarHBondContact N-O 2.71Å; K527-N983 PolarHBondContact N-OD1 2.65Å; W528-N983 VanDerWaalsContact CD2-ND2 3.32Å; R979-N983 PolarHBondContact O-N 3.27Å; L980-N983 WeakPolarHBondContact O-CB 3.37Å; L980-N983 PolarHBondContact O-N 3.17Å; L980-N983 VanDerWaalsContact O-N 3.16Å; L981-N983 PolarHBondContact O-N 2.96Å
984	I	74.7	Confident	72.9	Confident	28 Å²	28	54.1 Å²	54.1	14%	0.144	25%	0.253	C	S	.	.	H	α-helix	trans	-91.9	-64.3	177.5	-62.2	164	0	0	0	109.9	V383 L981 H982	V383-I984 HydrophobicContact CG2-CD1 3.95Å; V383-I984 HydrophobicContact CG2-CG1 4.18Å; V383-I984 HydrophobicContact CG2-CG2 3.6Å; L981-I984 PolarHBondContact O-N 3.48Å; H982-I984 VanDerWaalsContact C-N 3.31Å
985	L	77	Confident	72.4	Confident	6 Å²	6	59 Å²	59	3%	0.031	28%	0.276	C	S	.	.	S	Bend	trans	-100.9	148.4	-175	-63.2	179.7	0	0	0	111.4	L981 V989 A990 F993	L981-L985 HydrophobicContact CD1-CD1 4.27Å; L981-L985 HydrophobicContact CD1-CG 4.47Å; L981-L985 PolarHBondContact O-N 2.86Å; L985-V989 HydrophobicContact CD1-CG1 4.44Å; L985-A990 HydrophobicContact CB-CB 4.16Å; L985-F993 HydrophobicContact CD1-CD2 3.89Å; L985-F993 HydrophobicContact CD1-CE2 4.32Å
986	P	81.8	Confident	71.2	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.006	28%	0.28	C	S	.	.			trans	-53.9	150.6	168	-20.9	31.1	0	0	0	111.2	D988 V989 A990 E1061 Y1137	P986-D988 PolarHBondContact O-N 3.24Å; P986-V989 HydrophobicContact CB-CB 4.29Å; P986-V989 HydrophobicContact CB-CG2 3.89Å; P986-V989 HydrophobicContact CG-CB 4.43Å; P986-V989 HydrophobicContact CG-CG2 3.95Å; P986-V989 PolarHBondContact O-N 3.48Å; P986-A990 WeakPolarHBondContact O-CB 3.47Å; P986-A990 PolarHBondContact O-N 3Å; P986-E1061 WeakPolarHBondContact CA-OE1 3.39Å; P986-E1061 HydrophobicContact CB-CG 4.49Å; P986-E1061 WeakPolarHBondContact CB-OE1 3.41Å; P986-E1061 HydrophobicContact CG-CG 4.23Å; P986-Y1137 HydrophobicContact CG-CD1 3.62Å; P986-Y1137 HydrophobicContact CG-CD2 4.11Å; P986-Y1137 HydrophobicContact CG-CE1 3.68Å; P986-Y1137 HydrophobicContact CG-CE2 4.16Å; P986-Y1137 HydrophobicContact CG-CG 3.84Å
987	K	77.1	Confident	70	Confident	133 Å²	133	70.1 Å²	70.1	58%	0.578	32%	0.317	S	S	*	.	H	α-helix	trans	-58.2	-44.1	-170.3	-70.1	176.7	179.7	171.4	0	113.5	H982 A990 A991	H982-K987 HydrophobicContact CB-CG 4.47Å; K987-A990 PolarHBondContact O-N 2.88Å; K987-A991 PolarHBondContact O-N 3.3Å
988	D	76.1	Confident	68.7	Low	73 Å²	73	77.2 Å²	77.2	39%	0.39	34%	0.342	S	S	.	.	H	α-helix	trans	-73.9	-32.3	-176.7	-61.9	-5	0	0	0	111	P986 A991 H992 S1079	P986-D988 PolarHBondContact O-N 3.24Å; D988-A991 PolarHBondContact O-N 3.42Å; D988-H992 PolarHBondContact O-N 3.39Å; D988-H992 VanDerWaalsContact O-N 3.09Å; D988-S1079 PolarHBondContact OD2-OG 3.14Å
989	V	76	Confident	67.5	Low	0 Å²	0	80.5 Å²	80.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-68.3	-45.2	171.5	-175.8	0	0	0	0	111	L985 P986 A991 H992 F993 Y1004 V1129 Y1137	L985-V989 HydrophobicContact CD1-CG1 4.44Å; P986-V989 HydrophobicContact CB-CB 4.29Å; P986-V989 HydrophobicContact CB-CG2 3.89Å; P986-V989 HydrophobicContact CG-CB 4.43Å; P986-V989 HydrophobicContact CG-CG2 3.95Å; P986-V989 PolarHBondContact O-N 3.48Å; V989-A991 VanDerWaalsContact C-N 3.27Å; V989-A991 PolarHBondContact O-N 2.92Å; V989-H992 WeakPolarHBondContact O-CB 3.32Å; V989-H992 PolarHBondContact O-N 3.38Å; V989-H992 VanDerWaalsContact O-N 3.12Å; V989-F993 HydrophobicContact CG1-CD2 4.12Å; V989-F993 HydrophobicContact CG1-CE2 3.87Å; V989-F993 VanDerWaalsContact O-CD2 3.31Å; V989-F993 WeakPolarHBondContact O-CD2 3.42Å; V989-F993 PolarHBondContact O-N 3.47Å; V989-Y1004 HydrophobicContact CG1-CD1 4.15Å; V989-Y1004 HydrophobicContact CG1-CE1 4.28Å; V989-Y1004 HydrophobicContact CG1-CG 4.33Å; V989-Y1004 HydrophobicContact CG2-CD1 4.43Å; V989-Y1004 HydrophobicContact CG2-CE1 3.76Å; V989-Y1004 HydrophobicContact CG2-CE2 4.45Å; V989-V1129 HydrophobicContact CG1-CG2 3.71Å; V989-Y1137 HydrophobicContact CG1-CD2 4.45Å; V989-Y1137 HydrophobicContact CG2-CD2 4Å; V989-Y1137 HydrophobicContact CG2-CE2 3.83Å
990	A	74.7	Confident	66.4	Low	0 Å²	0	79.2 Å²	79.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60.2	-38.3	174.7	0	0	0	0	0	111.5	L981 L985 P986 K987 F993 L994	L981-A990 HydrophobicContact CD2-CB 4.16Å; L981-A990 HydrophobicContact CG-CB 4.02Å; L985-A990 HydrophobicContact CB-CB 4.16Å; P986-A990 WeakPolarHBondContact O-CB 3.47Å; P986-A990 PolarHBondContact O-N 3Å; K987-A990 PolarHBondContact O-N 2.88Å; A990-F993 PolarHBondContact O-N 3.02Å; A990-L994 WeakPolarHBondContact O-CB 3.45Å; A990-L994 WeakPolarHBondContact O-CG 3.04Å; A990-L994 PolarHBondContact O-N 3.34Å
991	A	71.8	Confident	65.4	Low	29 Å²	29	84.3 Å²	84.3	24%	0.24	39%	0.389	C	S	.	.	H	α-helix	trans	-62.9	-40.6	173.7	0	0	0	0	0	112.2	K987 D988 V989 F993 L994 Q995	K987-A991 PolarHBondContact O-N 3.3Å; D988-A991 PolarHBondContact O-N 3.42Å; V989-A991 VanDerWaalsContact C-N 3.27Å; V989-A991 PolarHBondContact O-N 2.92Å; A991-F993 PolarHBondContact O-N 2.96Å; A991-L994 PolarHBondContact O-N 3.45Å; A991-Q995 VanDerWaalsContact O-CB 3.3Å; A991-Q995 WeakPolarHBondContact O-CB 3.43Å; A991-Q995 WeakPolarHBondContact O-CG 3.37Å; A991-Q995 PolarHBondContact O-N 2.93Å
992	H	70.5	Confident	64.8	Low	70 Å²	70	88.5 Å²	88.5	32%	0.324	41%	0.409	S	S	.	.	H	α-helix	trans	-57.3	-45.1	174.6	-175.6	-89	0	0	0	112.4	D988 V989 Y1004	D988-H992 PolarHBondContact O-N 3.39Å; D988-H992 VanDerWaalsContact O-N 3.09Å; V989-H992 WeakPolarHBondContact O-CB 3.32Å; V989-H992 PolarHBondContact O-N 3.38Å; V989-H992 VanDerWaalsContact O-N 3.12Å; H992-Y1004 HydrophobicContact CB-CD2 4.17Å; H992-Y1004 HydrophobicContact CB-CE2 4.4Å; H992-Y1004 AromaticContact CG-CD2 3.79Å; H992-Y1004 AromaticContact ND1-CD2 3.85Å
993	F	65.2	Low	64.5	Low	94 Å²	94	87.9 Å²	87.9	41%	0.412	41%	0.407	S	S	.	.	H	α-helix	trans	-73.7	-26.3	177.3	-73.1	-75.5	0	0	0	114.2	L985 V989 A990 A991 V1129	L985-F993 HydrophobicContact CD1-CD2 3.89Å; L985-F993 HydrophobicContact CD1-CE2 4.32Å; V989-F993 HydrophobicContact CG1-CD2 4.12Å; V989-F993 HydrophobicContact CG1-CE2 3.87Å; V989-F993 VanDerWaalsContact O-CD2 3.31Å; V989-F993 WeakPolarHBondContact O-CD2 3.42Å; V989-F993 PolarHBondContact O-N 3.47Å; A990-F993 PolarHBondContact O-N 3.02Å; A991-F993 PolarHBondContact O-N 2.96Å; F993-V1129 HydrophobicContact CE2-CB 4.31Å; F993-V1129 HydrophobicContact CE2-CG1 4.33Å; F993-V1129 HydrophobicContact CE2-CG2 4.05Å; F993-V1129 HydrophobicContact CZ-CB 4.24Å; F993-V1129 HydrophobicContact CZ-CG1 4.15Å; F993-V1129 HydrophobicContact CZ-CG2 4.48Å
994	L	65	Low	64.4	Low	66 Å²	66	87.9 Å²	87.9	35%	0.346	41%	0.406	S	S	.	.	H	α-helix	trans	-84.2	-25.9	177.9	-74.6	177.4	0	0	0	114.3	L981 A990 A991 R996	L981-L994 HydrophobicContact CD2-CD1 3.83Å; L981-L994 HydrophobicContact CD2-CD2 4.02Å; L981-L994 HydrophobicContact CD2-CG 3.88Å; A990-L994 WeakPolarHBondContact O-CB 3.45Å; A990-L994 WeakPolarHBondContact O-CG 3.04Å; A990-L994 PolarHBondContact O-N 3.34Å; A991-L994 PolarHBondContact O-N 3.45Å; L994-R996 VanDerWaalsContact C-N 3.32Å; L994-R996 PolarHBondContact O-N 3.17Å
995	Q	58.6	Low	64.7	Low	158 Å²	158	91.1 Å²	91.1	74%	0.738	42%	0.416	S	S	*	.	S	Bend	trans	-82.8	2.9	-170	-76.9	177.2	14.8	0	0	115.3	A991	A991-Q995 VanDerWaalsContact O-CB 3.3Å; A991-Q995 WeakPolarHBondContact O-CB 3.43Å; A991-Q995 WeakPolarHBondContact O-CG 3.37Å; A991-Q995 PolarHBondContact O-N 2.93Å
996	R	47.1	Very low	64.9	Low	118 Å²	118	92.2 Å²	92.2	45%	0.445	42%	0.422	S	S	.	.			trans	-143.3	120.9	-177.7	-80.9	-177.6	172.3	-173.9	7.6	113.3	L994 R998 E1002	L994-R996 VanDerWaalsContact C-N 3.32Å; L994-R996 PolarHBondContact O-N 3.17Å; R996-R998 HydrophobicContact CB-CB 4.06Å; R996-R998 HydrophobicContact CB-CG 4.31Å; R996-R998 HydrophobicContact CG-CB 4.48Å; R996-R998 HydrophobicContact CG-CG 4.39Å; R996-R998 PolarHBondContact O-N 2.97Å; R996-E1002 IonicContact CZ-OE2 2.83Å; R996-E1002 IonicContact NH1-OE1 2.93Å; R996-E1002 PolarHBondContact NH1-OE1 2.95Å; R996-E1002 IonicContact NH1-OE2 3.27Å; R996-E1002 PolarHBondContact NH1-OE2 3.17Å
997	E	45.3	Very low	65	Low	210 Å²	210	96 Å²	96	98%	0.981	45%	0.448	S	S	*	.			trans	-71.6	31.6	156.6	-61.4	-179.1	112.8	0	0	112.4
998	R	41	Very low	65.4	Low	170 Å²	170	90.1 Å²	90.1	64%	0.642	42%	0.423	S	S	*	.			trans	-100.5	144.1	-177.8	-69.8	-171	168.5	-175.2	-3	110.9	R996	R996-R998 HydrophobicContact CB-CB 4.06Å; R996-R998 HydrophobicContact CB-CG 4.31Å; R996-R998 HydrophobicContact CG-CB 4.48Å; R996-R998 HydrophobicContact CG-CG 4.39Å; R996-R998 PolarHBondContact O-N 2.97Å
999	R	46.2	Very low	65.8	Low	212 Å²	212	93.3 Å²	93.3	80%	0.8	44%	0.436	S	S	*	.			trans	-14.1	127.7	173.3	-61.4	-179.5	-177.1	171.6	-0.7	115.1	D1001	R999-D1001 PolarHBondContact O-N 3.46Å
1000	N	50	Low	66.3	Low	162 Å²	162	94.3 Å²	94.3	87%	0.866	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	16.7	-176.4	-54.2	-41.9	0	0	0	115.3
1001	D	51.9	Low	67.1	Low	130 Å²	130	94.3 Å²	94.3	70%	0.695	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-9.3	-165.3	-44.1	-49.1	0	0	0	112.8	R999 L1003	R999-D1001 PolarHBondContact O-N 3.46Å; D1001-L1003 PolarHBondContact O-N 2.94Å
1002	E	58.3	Low	68.2	Low	104 Å²	104	93 Å²	93	49%	0.486	43%	0.432	S	S	.	.			trans	-88.1	98.4	-176.9	-163.3	171.7	-153.8	0	0	110.3	R996	R996-E1002 IonicContact CZ-OE2 2.83Å; R996-E1002 IonicContact NH1-OE1 2.93Å; R996-E1002 PolarHBondContact NH1-OE1 2.95Å; R996-E1002 IonicContact NH1-OE2 3.27Å; R996-E1002 PolarHBondContact NH1-OE2 3.17Å
1003	L	69.4	Low	69.4	Low	53 Å²	53	89.7 Å²	89.7	28%	0.277	42%	0.417	S	S	.	.			trans	-69.9	139.9	-177.5	-64.8	174.1	0	0	0	112.5	M440 N443 D1001 Y1005	M440-L1003 HydrophobicContact CG-CD1 4.3Å; N443-L1003 HydrophobicContact CB-CD1 4.01Å; D1001-L1003 PolarHBondContact O-N 2.94Å; L1003-Y1005 WeakPolarHBondContact O-CD1 2.98Å
1004	Y	75.1	Confident	70.9	Confident	29 Å²	29	85.2 Å²	85.2	11%	0.114	40%	0.397	C	S	.	.			trans	-87	122.7	173.2	-179.1	-87.8	0	0	0	111.4	V989 H992 Q1006 G1128 V1129 Y1137	V989-Y1004 HydrophobicContact CG1-CD1 4.15Å; V989-Y1004 HydrophobicContact CG1-CE1 4.28Å; V989-Y1004 HydrophobicContact CG1-CG 4.33Å; V989-Y1004 HydrophobicContact CG2-CD1 4.43Å; V989-Y1004 HydrophobicContact CG2-CE1 3.76Å; V989-Y1004 HydrophobicContact CG2-CE2 4.45Å; H992-Y1004 HydrophobicContact CB-CD2 4.17Å; H992-Y1004 HydrophobicContact CB-CE2 4.4Å; H992-Y1004 AromaticContact CG-CD2 3.79Å; H992-Y1004 AromaticContact ND1-CD2 3.85Å; Y1004-Q1006 PolarHBondContact OH-OE1 2.8Å; Y1004-G1128 VanDerWaalsContact O-CA 3.24Å; Y1004-G1128 WeakPolarHBondContact O-CA 3.15Å; Y1004-V1129 HydrophobicContact CD1-CG2 4.05Å; Y1004-V1129 PolarHBondContact O-N 3.28Å; Y1004-Y1137 HydrophobicContact CE1-CE2 4.25Å
1005	Y	79.9	Confident	72.4	Confident	95 Å²	95	82.8 Å²	82.8	37%	0.373	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	150.1	173	62.8	-80.1	0	0	0	110.8	Q436 L1003 A1127	Q436-Y1005 HydrophobicContact CB-CD2 4.1Å; Q436-Y1005 HydrophobicContact CB-CE2 3.58Å; Q436-Y1005 HydrophobicContact CG-CE1 4.16Å; Q436-Y1005 HydrophobicContact CG-CE2 3.83Å; Q436-Y1005 PolarHBondContact OE1-OH 3.13Å; L1003-Y1005 WeakPolarHBondContact O-CD1 2.98Å; Y1005-A1127 CarbonylContact C-O 3.5Å; Y1005-A1127 WeakPolarHBondContact CA-O 3.37Å
1006	Q	82.8	Confident	74.1	Confident	30 Å²	30	75.4 Å²	75.4	14%	0.14	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	140.1	178.3	-167.8	-172.2	-3.8	0	0	109.4	Y1004 L1076 D1078 A1127	Y1004-Q1006 PolarHBondContact OH-OE1 2.8Å; Q1006-L1076 PolarHBondContact NE2-O 3.13Å; Q1006-L1076 VanDerWaalsContact NE2-O 3.1Å; Q1006-L1076 PolarHBondContact OE1-O 2.89Å; Q1006-D1078 PolarHBondContact NE2-OD2 3.14Å; Q1006-A1127 PolarHBondContact N-O 3.29Å; Q1006-A1127 PolarHBondContact O-N 2.94Å
1007	S	83.2	Confident	76.4	Confident	80 Å²	80	70.2 Å²	70.2	56%	0.559	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.8	173.5	-176.2	0	0	0	0	109.1
1008	C	85.9	Confident	78.7	Confident	9 Å²	9	60.7 Å²	60.7	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	114.3	-174	-53.7	0	0	0	0	109.5	V1011 L1076 P1124 V1125	C1008-V1011 HydrophobicContact CB-CG2 3.47Å; C1008-V1011 VanDerWaalsContact CB-CG2 3.47Å; C1008-L1076 HydrophobicContact CB-CD2 4.49Å; C1008-P1124 CarbonylContact O-C 3.55Å; C1008-P1124 VanDerWaalsContact O-CA 3.27Å; C1008-P1124 WeakPolarHBondContact O-CA 3.17Å; C1008-V1125 HydrophobicContact CB-CG2 3.98Å; C1008-V1125 PolarHBondContact N-O 3.48Å; C1008-V1125 PolarHBondContact O-N 2.87Å
1009	E	84	Confident	81	Confident	140 Å²	140	54.7 Å²	54.7	65%	0.654	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	-30.2	-167	-61.9	176.9	147.2	0	0	115.1	G1123 P1124	E1009-G1123 CarbonylContact O-C 3.58Å; E1009-P1124 WeakPolarHBondContact O-CA 3.15Å
1010	C	87.3	Confident	83	Confident	22 Å²	22	46.1 Å²	46.1	15%	0.149	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	70.6	-171	-166.6	0	0	0	0	111.3	Y1081 H1088	C1010-Y1081 HydrophobicContact CB-CE2 4.27Å; C1010-Y1081 VanDerWaalsContact CB-OH 3.3Å; C1010-Y1081 WeakPolarHBondContact CB-OH 3.43Å; C1010-H1088 PolarHBondContact O-NE2 3.15Å
1011	V	91.3	Very high	84.7	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	139.6	178.1	168.9	0	0	0	0	109.7	C1008 V1013 A1073 S1074 L1076 I1122 G1123 V1125	C1008-V1011 HydrophobicContact CB-CG2 3.47Å; C1008-V1011 VanDerWaalsContact CB-CG2 3.47Å; V1011-V1013 HydrophobicContact CG1-CG2 3.83Å; V1011-A1073 HydrophobicContact CG1-CB 3.98Å; V1011-S1074 WeakPolarHBondContact CA-O 3.43Å; V1011-S1074 WeakPolarHBondContact CG1-O 3.48Å; V1011-L1076 HydrophobicContact CG1-CD2 4.17Å; V1011-L1076 HydrophobicContact CG1-CG 4.39Å; V1011-L1076 HydrophobicContact CG2-CD2 3.84Å; V1011-L1076 HydrophobicContact CG2-CG 4.33Å; V1011-I1122 WeakPolarHBondContact O-CA 3.38Å; V1011-G1123 PolarHBondContact N-O 3.2Å; V1011-G1123 PolarHBondContact O-N 2.88Å; V1011-V1125 HydrophobicContact CB-CG1 4.44Å; V1011-V1125 HydrophobicContact CB-CG2 3.75Å; V1011-V1125 HydrophobicContact CG1-CG1 4.48Å; V1011-V1125 HydrophobicContact CG1-CG2 3.95Å; V1011-V1125 HydrophobicContact CG2-CG2 3.58Å
1012	A	93.6	Very high	86	Confident	2 Å²	2	37 Å²	37	2%	0.017	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	135.5	164.7	0	0	0	0	0	109.1	A1073 S1074 I1089 M1092 I1122	A1012-A1073 CarbonylContact O-C 3.53Å; A1012-A1073 WeakPolarHBondContact O-CA 3.36Å; A1012-A1073 VanDerWaalsContact O-CB 3.31Å; A1012-A1073 WeakPolarHBondContact O-CB 3.39Å; A1012-S1074 PolarHBondContact N-O 3.27Å; A1012-S1074 PolarHBondContact O-N 2.97Å; A1012-I1089 HydrophobicContact CB-CG1 4.39Å; A1012-I1089 HydrophobicContact CB-CG2 4.48Å; A1012-M1092 HydrophobicContact CB-CB 4.11Å; A1012-M1092 HydrophobicContact CB-CG 3.88Å; A1012-I1122 HydrophobicContact CB-CG2 3.84Å
1013	V	95.7	Very high	87.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.9	-179.4	-175	0	0	0	0	109.4	V1011 F1015 M1071 A1073 N1121 V1125 I1139 T1143 V1144 A1147	V1011-V1013 HydrophobicContact CG1-CG2 3.83Å; V1013-F1015 HydrophobicContact CG1-CD2 4.3Å; V1013-F1015 HydrophobicContact CG1-CE2 3.9Å; V1013-M1071 HydrophobicContact CG1-CE 4.39Å; V1013-A1073 HydrophobicContact CG2-CB 4.34Å; V1013-N1121 PolarHBondContact N-O 3.05Å; V1013-N1121 PolarHBondContact O-N 3.09Å; V1013-N1121 VanDerWaalsContact O-N 3.15Å; V1013-V1125 HydrophobicContact CG2-CG1 4.33Å; V1013-I1139 HydrophobicContact CG1-CD1 4.47Å; V1013-I1139 HydrophobicContact CG2-CD1 4.1Å; V1013-T1143 HydrophobicContact CG2-CG2 4.01Å; V1013-V1144 HydrophobicContact CG1-CG1 4.48Å; V1013-V1144 HydrophobicContact CG2-CG2 4.28Å; V1013-A1147 HydrophobicContact CB-CB 3.96Å; V1013-A1147 HydrophobicContact CG1-CB 3.91Å
1014	M	96.6	Very high	87.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.9	176.9	-173.1	177.8	75.1	0	0	111.9	A1016 Y1070 M1071 A1072 M1092 Y1095 A1096 M1099 I1118 G1119 L1120	M1014-A1016 HydrophobicContact CE-CB 4.06Å; M1014-A1016 HydrophobicContact SD-CB 4.45Å; M1014-Y1070 HydrophobicContact CE-CD1 4.39Å; M1014-M1071 WeakPolarHBondContact O-CA 3.39Å; M1014-A1072 HydrophobicContact CE-CB 4.4Å; M1014-A1072 PolarHBondContact N-O 3.08Å; M1014-A1072 PolarHBondContact O-N 2.69Å; M1014-M1092 HydrophobicContact CB-CE 3.53Å; M1014-M1092 HydrophobicContact CB-SD 3.69Å; M1014-M1092 HydrophobicContact CE-CE 3.79Å; M1014-M1092 HydrophobicContact CG-CE 4.12Å; M1014-M1092 HydrophobicContact SD-CE 3.53Å; M1014-M1092 VanDerWaalsContact SD-CE 3.53Å; M1014-Y1095 HydrophobicContact CE-CD1 3.78Å; M1014-Y1095 HydrophobicContact CE-CE1 3.62Å; M1014-Y1095 HydrophobicContact SD-CD1 4.47Å; M1014-A1096 HydrophobicContact SD-CB 3.76Å; M1014-M1099 HydrophobicContact CE-CE 4.42Å; M1014-M1099 HydrophobicContact CE-SD 3.5Å; M1014-M1099 WeakPolarHBondContact CE-SD 3.46Å; M1014-I1118 HydrophobicContact CG-CG2 3.49Å; M1014-I1118 VanDerWaalsContact CG-CG2 3.49Å; M1014-I1118 HydrophobicContact SD-CD1 4.32Å; M1014-I1118 HydrophobicContact SD-CG2 3.61Å; M1014-G1119 WeakPolarHBondContact CA-O 3.45Å; M1014-L1120 HydrophobicContact CB-CD2 3.52Å; M1014-L1120 HydrophobicContact CG-CD2 3.53Å; M1014-L1120 HydrophobicContact SD-CD2 4.06Å
1015	F	96.6	Very high	88.1	Confident	15 Å²	15	39.1 Å²	39.1	7%	0.066	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.9	159	-72.8	-99.8	0	0	0	108.3	V1013 I1066 T1069 M1071 I1118 G1119 V1144 A1147 D1151	V1013-F1015 HydrophobicContact CG1-CD2 4.3Å; V1013-F1015 HydrophobicContact CG1-CE2 3.9Å; F1015-I1066 HydrophobicContact CE1-CD1 4.42Å; F1015-T1069 HydrophobicContact CB-CG2 4.41Å; F1015-T1069 HydrophobicContact CD1-CG2 3.96Å; F1015-M1071 HydrophobicContact CD1-CB 4.42Å; F1015-M1071 HydrophobicContact CD1-CG 4.38Å; F1015-M1071 HydrophobicContact CE1-CB 4.29Å; F1015-M1071 HydrophobicContact CE1-CG 3.96Å; F1015-M1071 HydrophobicContact CE1-SD 3.84Å; F1015-M1071 HydrophobicContact CE2-CE 4.35Å; F1015-M1071 HydrophobicContact CE2-CG 4.34Å; F1015-M1071 HydrophobicContact CE2-SD 4.46Å; F1015-M1071 HydrophobicContact CZ-CE 3.91Å; F1015-M1071 HydrophobicContact CZ-CG 3.94Å; F1015-M1071 HydrophobicContact CZ-SD 3.65Å; F1015-I1118 CarbonylContact O-C 3.45Å; F1015-I1118 WeakPolarHBondContact O-CA 3.39Å; F1015-G1119 PolarHBondContact N-O 3.46Å; F1015-G1119 PolarHBondContact O-N 3.43Å; F1015-V1144 HydrophobicContact CE2-CG1 3.91Å; F1015-V1144 HydrophobicContact CZ-CG1 3.85Å; F1015-A1147 HydrophobicContact CD2-CB 3.79Å; F1015-A1147 HydrophobicContact CE2-CB 4.05Å; F1015-D1151 HydrophobicContact CB-CB 3.73Å
1016	A	96.2	Very high	88.2	Confident	3 Å²	3	38 Å²	38	3%	0.025	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	116.6	177.2	0	0	0	0	0	109.7	M1014 T1069 Y1070 M1099 M1116 K1117 I1118	M1014-A1016 HydrophobicContact CE-CB 4.06Å; M1014-A1016 HydrophobicContact SD-CB 4.45Å; A1016-T1069 CarbonylContact O-C 3.56Å; A1016-T1069 WeakPolarHBondContact O-CA 3.35Å; A1016-Y1070 PolarHBondContact N-O 2.95Å; A1016-Y1070 PolarHBondContact O-N 3.41Å; A1016-M1099 HydrophobicContact CB-CE 3.8Å; A1016-M1116 HydrophobicContact CB-SD 4.13Å; A1016-K1117 WeakPolarHBondContact CA-O 3.34Å; A1016-I1118 HydrophobicContact CB-CD1 4.16Å; A1016-I1118 HydrophobicContact CB-CG1 3.76Å; A1016-I1118 HydrophobicContact CB-CG2 4.47Å
1017	S	94.9	Very high	88	Confident	8 Å²	8	38 Å²	38	6%	0.056	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	131.9	-169.2	-64.6	0	0	0	0	112.2	S1019 T1069 M1116 K1117 D1151	S1017-S1019 PolarHBondContact O-N 3.28Å; S1017-T1069 WeakPolarHBondContact OG-CG2 3.47Å; S1017-T1069 PolarHBondContact OG-OG1 3.41Å; S1017-M1116 WeakPolarHBondContact O-CA 3.41Å; S1017-K1117 PolarHBondContact N-O 3.47Å; S1017-K1117 WeakPolarHBondContact O-CG 3.34Å; S1017-K1117 PolarHBondContact O-N 2.84Å; S1017-D1151 WeakPolarHBondContact CB-OD1 3.2Å; S1017-D1151 WeakPolarHBondContact CB-OD2 3.15Å; S1017-D1151 PolarHBondContact OG-OD1 3.4Å; S1017-D1151 PolarHBondContact OG-OD2 3.49Å
1018	I	94	Very high	87.7	Confident	10 Å²	10	39.1 Å²	39.1	5%	0.051	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	103.4	172.5	-45.5	178.4	0	0	0	109.1	N1020 F1021 L1041 I1044 S1068 M1103 F1114	I1018-N1020 PolarHBondContact O-N 2.74Å; I1018-F1021 HydrophobicContact CB-CB 4.05Å; I1018-F1021 HydrophobicContact CG2-CB 3.95Å; I1018-F1021 PolarHBondContact O-N 3.22Å; I1018-L1041 HydrophobicContact CD1-CD1 4.01Å; I1018-I1044 HydrophobicContact CD1-CD1 4.38Å; I1018-I1044 HydrophobicContact CD1-CG2 3.91Å; I1018-S1068 PolarHBondContact N-O 3.47Å; I1018-S1068 VanDerWaalsContact N-O 3.1Å; I1018-M1103 HydrophobicContact CD1-CE 3.87Å; I1018-M1103 HydrophobicContact CG1-CE 3.83Å; I1018-F1114 HydrophobicContact CG2-CB 3.9Å; I1018-F1114 HydrophobicContact CG2-CD1 3.93Å; I1018-F1114 HydrophobicContact CG2-CG 4.25Å
1019	S	88	Confident	86.9	Confident	44 Å²	44	47.2 Å²	47.2	31%	0.308	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-38.5	-164.7	-50.1	0	0	0	0	114.4	S1017 K1115 K1117	S1017-S1019 PolarHBondContact O-N 3.28Å; S1019-K1115 WeakPolarHBondContact CB-O 3.16Å; S1019-K1115 PolarHBondContact N-O 2.98Å; S1019-K1115 PolarHBondContact OG-O 3.16Å; S1019-K1117 WeakPolarHBondContact OG-CG 3.48Å
1020	N	88.1	Confident	86	Confident	32 Å²	32	45.6 Å²	45.6	17%	0.171	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	13	-175.9	62.1	-29.3	0	0	0	113.4	I1018 S1022 E1023 F1024 N1113 F1114 K1115	I1018-N1020 PolarHBondContact O-N 2.74Å; N1020-S1022 PolarHBondContact O-N 2.92Å; N1020-E1023 HydrophobicContact CB-CB 4.49Å; N1020-E1023 HydrophobicContact CB-CG 4.44Å; N1020-E1023 WeakPolarHBondContact CB-OE2 3.34Å; N1020-E1023 WeakPolarHBondContact O-CB 3.41Å; N1020-E1023 PolarHBondContact O-N 3.47Å; N1020-F1024 PolarHBondContact O-N 3.39Å; N1020-N1113 PolarHBondContact ND2-O 3.46Å; N1020-F1114 WeakPolarHBondContact OD1-CA 3.49Å; N1020-K1115 PolarHBondContact OD1-N 3.48Å
1021	F	86.7	Confident	85.3	Confident	13 Å²	13	46.5 Å²	46.5	6%	0.057	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-30.9	176.5	-171.2	-91.7	0	0	0	112.1	I1018 E1023 F1024 Y1025 C1037 L1041 F1114	I1018-F1021 HydrophobicContact CB-CB 4.05Å; I1018-F1021 HydrophobicContact CG2-CB 3.95Å; I1018-F1021 PolarHBondContact O-N 3.22Å; F1021-E1023 PolarHBondContact O-N 3.07Å; F1021-F1024 HydrophobicContact CD2-CD1 4.12Å; F1021-F1024 AromaticContact CE2-CD1 3.81Å; F1021-F1024 HydrophobicContact CE2-CD1 3.81Å; F1021-F1024 HydrophobicContact CE2-CE1 4.15Å; F1021-F1024 HydrophobicContact CZ-CD1 4.35Å; F1021-F1024 PolarHBondContact O-N 3.47Å; F1021-Y1025 HydrophobicContact CE1-CD2 4.19Å; F1021-Y1025 HydrophobicContact CE1-CG 4.37Å; F1021-Y1025 VanDerWaalsContact O-CB 3.31Å; F1021-Y1025 WeakPolarHBondContact O-CB 3.4Å; F1021-Y1025 PolarHBondContact O-N 2.89Å; F1021-C1037 HydrophobicContact CZ-CB 4.37Å; F1021-L1041 HydrophobicContact CD2-CD1 4.36Å; F1021-L1041 HydrophobicContact CE1-CD2 3.98Å; F1021-L1041 HydrophobicContact CE2-CB 3.85Å; F1021-L1041 HydrophobicContact CE2-CD1 4.1Å; F1021-L1041 HydrophobicContact CE2-CD2 4.43Å; F1021-L1041 HydrophobicContact CE2-CG 4.34Å; F1021-L1041 HydrophobicContact CZ-CB 3.74Å; F1021-L1041 HydrophobicContact CZ-CD1 4.36Å; F1021-L1041 HydrophobicContact CZ-CD2 3.86Å; F1021-L1041 HydrophobicContact CZ-CG 4.2Å; F1021-F1114 HydrophobicContact CD2-CE1 4.04Å
1022	S	79.4	Confident	84.6	Confident	89 Å²	89	51.2 Å²	51.2	62%	0.622	29%	0.285	S	S	*	.	H	α-helix	trans	-69.9	-15	173.2	54.9	0	0	0	0	114.7	N1020	N1020-S1022 PolarHBondContact O-N 2.92Å
1023	E	81.1	Confident	84	Confident	153 Å²	153	54.6 Å²	54.6	72%	0.715	30%	0.301	S	S	*	.	H	α-helix	trans	-89.5	-29.4	173.1	-57.7	177.6	162.8	0	0	110.7	N1020 F1021	N1020-E1023 HydrophobicContact CB-CB 4.49Å; N1020-E1023 HydrophobicContact CB-CG 4.44Å; N1020-E1023 WeakPolarHBondContact CB-OE2 3.34Å; N1020-E1023 WeakPolarHBondContact O-CB 3.41Å; N1020-E1023 PolarHBondContact O-N 3.47Å; F1021-E1023 PolarHBondContact O-N 3.07Å
1024	F	82.3	Confident	83.2	Confident	57 Å²	57	54.6 Å²	54.6	25%	0.25	30%	0.301	C	S	.	.	H	α-helix	trans	-79.2	-30.6	173.3	173.5	-101.5	0	0	0	113.4	N1020 F1021 V1026 C1037 L1040 N1112 F1114	N1020-F1024 PolarHBondContact O-N 3.39Å; F1021-F1024 HydrophobicContact CD2-CD1 4.12Å; F1021-F1024 AromaticContact CE2-CD1 3.81Å; F1021-F1024 HydrophobicContact CE2-CD1 3.81Å; F1021-F1024 HydrophobicContact CE2-CE1 4.15Å; F1021-F1024 HydrophobicContact CZ-CD1 4.35Å; F1021-F1024 PolarHBondContact O-N 3.47Å; F1024-V1026 PolarHBondContact O-N 2.9Å; F1024-C1037 HydrophobicContact CD1-CB 4.18Å; F1024-C1037 HydrophobicContact CE1-CB 3.69Å; F1024-C1037 WeakPolarHBondContact CE1-SG 3.5Å; F1024-L1040 HydrophobicContact CE1-CD2 3.97Å; F1024-L1040 HydrophobicContact CE2-CD2 4.38Å; F1024-L1040 HydrophobicContact CZ-CD2 3.57Å; F1024-N1112 WeakPolarHBondContact CE2-OD1 3.36Å; F1024-F1114 HydrophobicContact CB-CE1 3.87Å; F1024-F1114 AromaticContact CD1-CE1 3.72Å; F1024-F1114 HydrophobicContact CD1-CE1 3.72Å; F1024-F1114 AromaticContact CD1-CZ 3.78Å; F1024-F1114 HydrophobicContact CD1-CZ 3.78Å; F1024-F1114 HydrophobicContact CD2-CE1 4.11Å; F1024-F1114 AromaticContact CD2-CZ 3.97Å; F1024-F1114 HydrophobicContact CD2-CZ 3.97Å; F1024-F1114 HydrophobicContact CE1-CE1 4.28Å; F1024-F1114 AromaticContact CE1-CZ 3.86Å; F1024-F1114 HydrophobicContact CE1-CZ 3.86Å; F1024-F1114 HydrophobicContact CE2-CZ 4.06Å; F1024-F1114 AromaticContact CG-CE1 3.63Å; F1024-F1114 HydrophobicContact CG-CE1 3.63Å; F1024-F1114 AromaticContact CG-CZ 3.84Å; F1024-F1114 HydrophobicContact CG-CZ 3.84Å; F1024-F1114 HydrophobicContact CZ-CZ 4.02Å
1025	Y	83.5	Confident	82.7	Confident	20 Å²	20	56 Å²	56	8%	0.078	31%	0.309	C	S	.	.			trans	-75.7	89.3	-177.3	-175.6	-106.8	0	0	0	112	H519 F1021 E1027 C1037 L1038	H519-Y1025 PolarHBondContact ND1-OH 3.37Å; F1021-Y1025 HydrophobicContact CE1-CD2 4.19Å; F1021-Y1025 HydrophobicContact CE1-CG 4.37Å; F1021-Y1025 VanDerWaalsContact O-CB 3.31Å; F1021-Y1025 WeakPolarHBondContact O-CB 3.4Å; F1021-Y1025 PolarHBondContact O-N 2.89Å; Y1025-E1027 HydrophobicContact CD1-CG 4.44Å; Y1025-E1027 HydrophobicContact CE1-CG 3.68Å; Y1025-E1027 WeakPolarHBondContact CE1-OE1 3.35Å; Y1025-C1037 HydrophobicContact CD2-CB 3.73Å; Y1025-C1037 HydrophobicContact CE2-CB 4.31Å; Y1025-L1038 HydrophobicContact CE2-CD2 4.08Å; Y1025-L1038 HydrophobicContact CE2-CG 4.05Å
1026	V	80.4	Confident	82.1	Confident	70 Å²	70	58.5 Å²	58.5	42%	0.424	32%	0.321	S	S	.	.			trans	-109.7	118.8	178	-153.4	0	0	0	0	111.5	F1024 L1028 N1031	F1024-V1026 PolarHBondContact O-N 2.9Å; V1026-L1028 VanDerWaalsContact C-N 3.27Å; V1026-L1028 HydrophobicContact CB-CD1 4.45Å; V1026-L1028 HydrophobicContact CB-CG 4.4Å; V1026-L1028 HydrophobicContact CG1-CD1 3.97Å; V1026-L1028 HydrophobicContact CG1-CG 3.77Å; V1026-L1028 PolarHBondContact O-N 3.39Å; V1026-N1031 PolarHBondContact O-ND2 3.42Å
1027	E	78.7	Confident	81.7	Confident	32 Å²	32	58.5 Å²	58.5	15%	0.15	32%	0.321	C	S	.	.			trans	-80	66.3	179.6	-60.3	176.4	-171.1	0	0	111.1	R517 S534 N535 Y1025 E1033	R517-E1027 IonicContact CZ-OE2 2.8Å; R517-E1027 IonicContact NE-OE2 3.65Å; R517-E1027 PolarHBondContact NE-OE2 2.69Å; R517-E1027 IonicContact NH2-OE2 2.73Å; R517-E1027 PolarHBondContact NH2-OE2 2.97Å; S534-E1027 PolarHBondContact OG-OE1 3.05Å; N535-E1027 PolarHBondContact N-OE1 2.96Å; N535-E1027 VanDerWaalsContact ND2-CD 3.34Å; N535-E1027 PolarHBondContact ND2-OE1 3.31Å; Y1025-E1027 HydrophobicContact CD1-CG 4.44Å; Y1025-E1027 HydrophobicContact CE1-CG 3.68Å; Y1025-E1027 WeakPolarHBondContact CE1-OE1 3.35Å; E1027-E1033 WeakPolarHBondContact CA-O 3.31Å; E1027-E1033 WeakPolarHBondContact CB-O 3.27Å
1028	L	78.3	Confident	81.4	Confident	103 Å²	103	58.1 Å²	58.1	54%	0.539	32%	0.318	S	S	.	.			trans	-102.1	148.6	177.5	-69.1	172.9	0	0	0	112.2	V1026 A1030 N1031 E1033	V1026-L1028 VanDerWaalsContact C-N 3.27Å; V1026-L1028 HydrophobicContact CB-CD1 4.45Å; V1026-L1028 HydrophobicContact CB-CG 4.4Å; V1026-L1028 HydrophobicContact CG1-CD1 3.97Å; V1026-L1028 HydrophobicContact CG1-CG 3.77Å; V1026-L1028 PolarHBondContact O-N 3.39Å; L1028-A1030 VanDerWaalsContact C-N 3.3Å; L1028-A1030 PolarHBondContact O-N 3.49Å; L1028-N1031 HydrophobicContact CB-CB 4.23Å; L1028-N1031 CarbonylContact O-C 3.59Å; L1028-N1031 WeakPolarHBondContact O-CA 3.3Å; L1028-N1031 WeakPolarHBondContact O-CB 3.44Å; L1028-N1031 PolarHBondContact O-N 3.21Å; L1028-E1033 WeakPolarHBondContact O-CA 3.47Å; L1028-E1033 PolarHBondContact O-N 3.3Å
1029	E	68.8	Low	81.2	Confident	178 Å²	178	61.2 Å²	61.2	83%	0.832	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-54.4	-44.2	174.5	-65	-179.7	172.5	0	0	112.2	N1031 N1032	E1029-N1031 PolarHBondContact O-N 3.34Å; E1029-N1032 PolarHBondContact O-N 3.44Å; E1029-N1032 VanDerWaalsContact O-N 3.13Å
1030	A	65.5	Low	81.2	Confident	107 Å²	107	61.3 Å²	61.3	88%	0.884	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-64.5	-7	176.8	0	0	0	0	0	114.6	L1028	L1028-A1030 VanDerWaalsContact C-N 3.3Å; L1028-A1030 PolarHBondContact O-N 3.49Å
1031	N	71.3	Confident	81.4	Confident	40 Å²	40	59.8 Å²	59.8	21%	0.214	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-118.4	21.5	-178.7	-163.4	42.7	0	0	0	111.4	V1026 L1028 E1029 E1033 G1034 E1036 C1037	V1026-N1031 PolarHBondContact O-ND2 3.42Å; L1028-N1031 HydrophobicContact CB-CB 4.23Å; L1028-N1031 CarbonylContact O-C 3.59Å; L1028-N1031 WeakPolarHBondContact O-CA 3.3Å; L1028-N1031 WeakPolarHBondContact O-CB 3.44Å; L1028-N1031 PolarHBondContact O-N 3.21Å; E1029-N1031 PolarHBondContact O-N 3.34Å; N1031-E1033 VanDerWaalsContact C-N 3.28Å; N1031-E1033 PolarHBondContact O-N 3.35Å; N1031-G1034 PolarHBondContact O-N 2.83Å; N1031-E1036 WeakPolarHBondContact OD1-CB 3.31Å; N1031-C1037 PolarHBondContact ND2-SG 2.77Å
1032	N	78.3	Confident	81.6	Confident	100 Å²	100	59.5 Å²	59.5	54%	0.535	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	47.9	48.5	-170.2	-66.3	-35.7	0	0	0	112.1	E1029 G1034 V1035 E1036	E1029-N1032 PolarHBondContact O-N 3.44Å; E1029-N1032 VanDerWaalsContact O-N 3.13Å; N1032-G1034 PolarHBondContact O-N 3.42Å; N1032-V1035 HydrophobicContact CB-CB 4.14Å; N1032-V1035 WeakPolarHBondContact O-CB 3.33Å; N1032-V1035 WeakPolarHBondContact O-CG2 3.46Å; N1032-V1035 PolarHBondContact O-N 2.99Å; N1032-E1036 HydrophobicContact CB-CG 4.22Å; N1032-E1036 PolarHBondContact ND2-OE1 3Å
1033	E	79.3	Confident	82.1	Confident	72 Å²	72	56.8 Å²	56.8	34%	0.336	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	55.3	17.7	-176.8	-59.1	-172.5	96.3	0	0	114.9	K412 H519 E1027 L1028 N1031	K412-E1033 VanDerWaalsContact CD-OE2 3.24Å; K412-E1033 WeakPolarHBondContact CD-OE2 3.32Å; K412-E1033 WeakPolarHBondContact CE-OE1 3.33Å; K412-E1033 VanDerWaalsContact CE-OE2 3.23Å; K412-E1033 WeakPolarHBondContact CE-OE2 3.41Å; K412-E1033 IonicContact NZ-OE1 2.73Å; K412-E1033 PolarHBondContact NZ-OE1 3.16Å; K412-E1033 IonicContact NZ-OE2 3.19Å; K412-E1033 PolarHBondContact NZ-OE2 3.02Å; H519-E1033 PolarHBondContact CE1-O 3.05Å; H519-E1033 VanDerWaalsContact CE1-O 3.23Å; E1027-E1033 WeakPolarHBondContact CA-O 3.31Å; E1027-E1033 WeakPolarHBondContact CB-O 3.27Å; L1028-E1033 WeakPolarHBondContact O-CA 3.47Å; L1028-E1033 PolarHBondContact O-N 3.3Å; N1031-E1033 VanDerWaalsContact C-N 3.28Å; N1031-E1033 PolarHBondContact O-N 3.35Å
1034	G	80.3	Confident	82.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	108.4	-2.6	-179.4	0	0	0	0	0	114.7	N1031 N1032 E1036 C1037 L1038	N1031-G1034 PolarHBondContact O-N 2.83Å; N1032-G1034 PolarHBondContact O-N 3.42Å; G1034-E1036 VanDerWaalsContact C-N 3.28Å; G1034-E1036 PolarHBondContact O-N 2.81Å; G1034-C1037 WeakPolarHBondContact O-CB 3.38Å; G1034-C1037 PolarHBondContact O-N 2.54Å; G1034-L1038 PolarHBondContact O-N 3.25Å
1035	V	85.3	Confident	83.1	Confident	30 Å²	30	47.3 Å²	47.3	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-34.4	177.6	173.8	0	0	0	0	112	I408 N1032 C1037 L1038 R1039	I408-V1035 HydrophobicContact CD1-CG1 4Å; N1032-V1035 HydrophobicContact CB-CB 4.14Å; N1032-V1035 WeakPolarHBondContact O-CB 3.33Å; N1032-V1035 WeakPolarHBondContact O-CG2 3.46Å; N1032-V1035 PolarHBondContact O-N 2.99Å; V1035-C1037 PolarHBondContact O-N 3.26Å; V1035-L1038 PolarHBondContact O-N 2.67Å; V1035-L1038 VanDerWaalsContact O-N 3.14Å; V1035-R1039 PolarHBondContact O-N 3.32Å
1036	E	84.9	Confident	83.5	Confident	68 Å²	68	46.3 Å²	46.3	32%	0.318	25%	0.247	S	C	.	.	H	α-helix	trans	-64.1	-39.6	176.8	-57.6	-55.3	115.1	0	0	112.1	N1031 N1032 G1034 L1038 R1039 L1040	N1031-E1036 WeakPolarHBondContact OD1-CB 3.31Å; N1032-E1036 HydrophobicContact CB-CG 4.22Å; N1032-E1036 PolarHBondContact ND2-OE1 3Å; G1034-E1036 VanDerWaalsContact C-N 3.28Å; G1034-E1036 PolarHBondContact O-N 2.81Å; E1036-L1038 VanDerWaalsContact C-N 3.28Å; E1036-L1038 PolarHBondContact O-N 3.2Å; E1036-R1039 WeakPolarHBondContact O-CB 3.43Å; E1036-R1039 PolarHBondContact O-N 3.26Å; E1036-R1039 VanDerWaalsContact O-N 3.16Å; E1036-R1039 IonicContact OE1-CZ 2.78Å; E1036-R1039 IonicContact OE1-NH1 2.7Å; E1036-R1039 PolarHBondContact OE1-NH1 3.02Å; E1036-R1039 IonicContact OE1-NH2 3.16Å; E1036-R1039 IonicContact OE2-CZ 3.28Å; E1036-R1039 IonicContact OE2-NH1 2.69Å; E1036-R1039 PolarHBondContact OE2-NH1 2.77Å; E1036-L1040 PolarHBondContact O-N 2.71Å
1037	C	87.9	Confident	84.1	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.014	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-35.4	173.4	-67.3	0	0	0	0	112	F1021 F1024 Y1025 N1031 G1034 V1035 L1040 L1041	F1021-C1037 HydrophobicContact CZ-CB 4.37Å; F1024-C1037 HydrophobicContact CD1-CB 4.18Å; F1024-C1037 HydrophobicContact CE1-CB 3.69Å; F1024-C1037 WeakPolarHBondContact CE1-SG 3.5Å; Y1025-C1037 HydrophobicContact CD2-CB 3.73Å; Y1025-C1037 HydrophobicContact CE2-CB 4.31Å; N1031-C1037 PolarHBondContact ND2-SG 2.77Å; G1034-C1037 WeakPolarHBondContact O-CB 3.38Å; G1034-C1037 PolarHBondContact O-N 2.54Å; V1035-C1037 PolarHBondContact O-N 3.26Å; C1037-L1040 PolarHBondContact O-N 2.89Å; C1037-L1041 WeakPolarHBondContact O-CB 3.41Å; C1037-L1041 PolarHBondContact O-N 3.33Å
1038	L	88.4	Confident	84.8	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-73.3	-28.8	175.3	-62.1	176.8	0	0	0	112.2	I410 H519 W533 Y1025 G1034 V1035 E1036 L1041 N1042	I410-L1038 HydrophobicContact CD1-CB 3.64Å; I410-L1038 HydrophobicContact CD1-CD1 3.97Å; I410-L1038 HydrophobicContact CD1-CG 4.46Å; H519-L1038 HydrophobicContact CB-CD1 3.79Å; W533-L1038 HydrophobicContact CB-CD1 4.05Å; W533-L1038 HydrophobicContact CB-CD2 3.87Å; W533-L1038 HydrophobicContact CD2-CD2 4.33Å; W533-L1038 HydrophobicContact CE3-CD1 4.48Å; W533-L1038 HydrophobicContact CG-CD1 4.41Å; W533-L1038 HydrophobicContact CG-CD2 3.81Å; Y1025-L1038 HydrophobicContact CE2-CD2 4.08Å; Y1025-L1038 HydrophobicContact CE2-CG 4.05Å; G1034-L1038 PolarHBondContact O-N 3.25Å; V1035-L1038 PolarHBondContact O-N 2.67Å; V1035-L1038 VanDerWaalsContact O-N 3.14Å; E1036-L1038 VanDerWaalsContact C-N 3.28Å; E1036-L1038 PolarHBondContact O-N 3.2Å; L1038-L1041 HydrophobicContact CD2-CD2 4.34Å; L1038-L1041 PolarHBondContact O-N 3.47Å; L1038-N1042 PolarHBondContact O-N 2.96Å
1039	R	88.6	Confident	85.5	Confident	75 Å²	75	38.8 Å²	38.8	28%	0.283	21%	0.206	S	C	.	.	H	α-helix	trans	-66.7	-44.1	168.9	-166.8	178.6	-66.6	98.6	1	111.5	I408 V1035 E1036 L1041 N1042 E1043	I408-R1039 HydrophobicContact CD1-CB 3.84Å; I408-R1039 HydrophobicContact CD1-CG 4.19Å; I408-R1039 HydrophobicContact CG1-CG 4.5Å; I408-R1039 HydrophobicContact CG2-CG 4.46Å; V1035-R1039 PolarHBondContact O-N 3.32Å; E1036-R1039 WeakPolarHBondContact O-CB 3.43Å; E1036-R1039 PolarHBondContact O-N 3.26Å; E1036-R1039 VanDerWaalsContact O-N 3.16Å; E1036-R1039 IonicContact OE1-CZ 2.78Å; E1036-R1039 IonicContact OE1-NH1 2.7Å; E1036-R1039 PolarHBondContact OE1-NH1 3.02Å; E1036-R1039 IonicContact OE1-NH2 3.16Å; E1036-R1039 IonicContact OE2-CZ 3.28Å; E1036-R1039 IonicContact OE2-NH1 2.69Å; E1036-R1039 PolarHBondContact OE2-NH1 2.77Å; R1039-L1041 VanDerWaalsContact C-N 3.32Å; R1039-L1041 PolarHBondContact O-N 3.37Å; R1039-N1042 WeakPolarHBondContact O-CA 3.35Å; R1039-N1042 WeakPolarHBondContact O-CB 3.29Å; R1039-N1042 PolarHBondContact O-N 3.02Å; R1039-N1042 VanDerWaalsContact O-N 3.07Å; R1039-E1043 PolarHBondContact O-N 3.12Å; R1039-E1043 VanDerWaalsContact O-N 3.16Å
1040	L	89.2	Confident	86.7	Confident	45 Å²	45	35.6 Å²	35.6	24%	0.236	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-39.6	174.9	-174.1	58.4	0	0	0	111.7	F1024 E1036 C1037 N1042 E1043 I1044 F1114	F1024-L1040 HydrophobicContact CE1-CD2 3.97Å; F1024-L1040 HydrophobicContact CE2-CD2 4.38Å; F1024-L1040 HydrophobicContact CZ-CD2 3.57Å; E1036-L1040 PolarHBondContact O-N 2.71Å; C1037-L1040 PolarHBondContact O-N 2.89Å; L1040-N1042 VanDerWaalsContact C-N 3.28Å; L1040-N1042 PolarHBondContact O-N 3.34Å; L1040-E1043 PolarHBondContact O-N 3.12Å; L1040-I1044 HydrophobicContact CG-CD1 4.24Å; L1040-I1044 VanDerWaalsContact O-CG1 3.26Å; L1040-I1044 WeakPolarHBondContact O-CG1 3.27Å; L1040-I1044 PolarHBondContact O-N 3.33Å; L1040-I1044 VanDerWaalsContact O-N 3.1Å; L1040-F1114 HydrophobicContact CD2-CE2 3.81Å; L1040-F1114 HydrophobicContact CD2-CZ 3.81Å; L1040-F1114 HydrophobicContact CG-CE2 4.49Å
1041	L	90.6	Very high	88	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-33.4	172	-174.9	61.8	0	0	0	112.6	L523 I1018 F1021 C1037 L1038 R1039 I1045	L523-L1041 HydrophobicContact CD1-CD2 4.14Å; L523-L1041 HydrophobicContact CD1-CG 4.4Å; I1018-L1041 HydrophobicContact CD1-CD1 4.01Å; F1021-L1041 HydrophobicContact CD2-CD1 4.36Å; F1021-L1041 HydrophobicContact CE1-CD2 3.98Å; F1021-L1041 HydrophobicContact CE2-CB 3.85Å; F1021-L1041 HydrophobicContact CE2-CD1 4.1Å; F1021-L1041 HydrophobicContact CE2-CD2 4.43Å; F1021-L1041 HydrophobicContact CE2-CG 4.34Å; F1021-L1041 HydrophobicContact CZ-CB 3.74Å; F1021-L1041 HydrophobicContact CZ-CD1 4.36Å; F1021-L1041 HydrophobicContact CZ-CD2 3.86Å; F1021-L1041 HydrophobicContact CZ-CG 4.2Å; C1037-L1041 WeakPolarHBondContact O-CB 3.41Å; C1037-L1041 PolarHBondContact O-N 3.33Å; L1038-L1041 HydrophobicContact CD2-CD2 4.34Å; L1038-L1041 PolarHBondContact O-N 3.47Å; R1039-L1041 VanDerWaalsContact C-N 3.32Å; R1039-L1041 PolarHBondContact O-N 3.37Å; L1041-I1045 HydrophobicContact CD1-CD1 4.12Å; L1041-I1045 HydrophobicContact CD1-CG1 4.43Å; L1041-I1045 HydrophobicContact CG-CD1 3.87Å; L1041-I1045 WeakPolarHBondContact O-CD1 3.43Å; L1041-I1045 VanDerWaalsContact O-CG1 3.26Å; L1041-I1045 WeakPolarHBondContact O-CG1 3.46Å; L1041-I1045 PolarHBondContact O-N 3.21Å
1042	N	90.9	Very high	89.1	Confident	6 Å²	6	29.1 Å²	29.1	3%	0.032	14%	0.142	C	C	.	.	H	α-helix	trans	-61.1	-50.1	174.7	-172.5	70	0	0	0	111.7	I408 L523 G524 L1038 R1039 L1040 I1045 A1046	I408-N1042 HydrophobicContact CG2-CB 3.51Å; I408-N1042 VanDerWaalsContact CG2-CG 3.41Å; L523-N1042 WeakPolarHBondContact CA-OD1 3.32Å; L523-N1042 HydrophobicContact CD2-CB 3.97Å; G524-N1042 PolarHBondContact N-OD1 3.17Å; L1038-N1042 PolarHBondContact O-N 2.96Å; R1039-N1042 WeakPolarHBondContact O-CA 3.35Å; R1039-N1042 WeakPolarHBondContact O-CB 3.29Å; R1039-N1042 PolarHBondContact O-N 3.02Å; R1039-N1042 VanDerWaalsContact O-N 3.07Å; L1040-N1042 VanDerWaalsContact C-N 3.28Å; L1040-N1042 PolarHBondContact O-N 3.34Å; N1042-I1045 CarbonylContact O-C 3.51Å; N1042-I1045 PolarHBondContact O-N 3.27Å; N1042-I1045 VanDerWaalsContact O-N 3.16Å; N1042-A1046 WeakPolarHBondContact O-CB 3.2Å; N1042-A1046 PolarHBondContact O-N 3.19Å
1043	E	90.1	Very high	89.6	Confident	32 Å²	32	27.2 Å²	27.2	15%	0.15	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-39	-179.6	-52.8	-44.4	127	0	0	111.2	F405 H406 R1039 L1040 I1045 A1046 D1047	F405-E1043 HydrophobicContact CD1-CG 4.34Å; H406-E1043 IonicContact CE1-OE2 3.65Å; H406-E1043 IonicContact CG-OE2 3.06Å; H406-E1043 PolarHBondContact N-OE1 3.33Å; H406-E1043 IonicContact ND1-OE2 3.65Å; H406-E1043 PolarHBondContact ND1-OE2 2.88Å; R1039-E1043 PolarHBondContact O-N 3.12Å; R1039-E1043 VanDerWaalsContact O-N 3.16Å; L1040-E1043 PolarHBondContact O-N 3.12Å; E1043-I1045 VanDerWaalsContact C-N 3.26Å; E1043-I1045 PolarHBondContact O-N 3.47Å; E1043-A1046 WeakPolarHBondContact O-CA 3.41Å; E1043-A1046 WeakPolarHBondContact O-CB 3.36Å; E1043-A1046 PolarHBondContact O-N 2.96Å; E1043-D1047 PolarHBondContact O-N 3.37Å
1044	I	92.3	Very high	90.2	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.015	13%	0.134	C	C	.	.	H	α-helix	trans	-57.9	-39.3	172.4	-64	166.2	0	0	0	111.6	I1018 L1040 F1048 M1103 I1106 F1114	I1018-I1044 HydrophobicContact CD1-CD1 4.38Å; I1018-I1044 HydrophobicContact CD1-CG2 3.91Å; L1040-I1044 HydrophobicContact CG-CD1 4.24Å; L1040-I1044 VanDerWaalsContact O-CG1 3.26Å; L1040-I1044 WeakPolarHBondContact O-CG1 3.27Å; L1040-I1044 PolarHBondContact O-N 3.33Å; L1040-I1044 VanDerWaalsContact O-N 3.1Å; I1044-F1048 HydrophobicContact CG2-CD2 4.29Å; I1044-F1048 HydrophobicContact CG2-CE2 3.58Å; I1044-F1048 HydrophobicContact CG2-CZ 3.75Å; I1044-F1048 WeakPolarHBondContact O-CD2 3.37Å; I1044-F1048 WeakPolarHBondContact O-CG 3.35Å; I1044-F1048 PolarHBondContact O-N 3.18Å; I1044-M1103 HydrophobicContact CG2-CE 4.19Å; I1044-I1106 HydrophobicContact CD1-CG2 4.46Å; I1044-I1106 HydrophobicContact CG1-CD1 4.24Å; I1044-I1106 HydrophobicContact CG1-CG2 4.08Å; I1044-I1106 HydrophobicContact CG2-CD1 4.32Å; I1044-F1114 HydrophobicContact CD1-CD2 4.26Å; I1044-F1114 HydrophobicContact CD1-CE2 4.18Å
1045	I	92.9	Very high	90.5	Very high	8 Å²	8	32.9 Å²	32.9	4%	0.041	17%	0.166	C	C	.	.	H	α-helix	trans	-75.4	-30.8	176.3	-66.8	165	0	0	0	111.4	L523 L1041 N1042 E1043 F1048 D1049 T1065	L523-I1045 HydrophobicContact CB-CD1 4.42Å; L523-I1045 HydrophobicContact CD1-CD1 4.4Å; L1041-I1045 HydrophobicContact CD1-CD1 4.12Å; L1041-I1045 HydrophobicContact CD1-CG1 4.43Å; L1041-I1045 HydrophobicContact CG-CD1 3.87Å; L1041-I1045 WeakPolarHBondContact O-CD1 3.43Å; L1041-I1045 VanDerWaalsContact O-CG1 3.26Å; L1041-I1045 WeakPolarHBondContact O-CG1 3.46Å; L1041-I1045 PolarHBondContact O-N 3.21Å; N1042-I1045 CarbonylContact O-C 3.51Å; N1042-I1045 PolarHBondContact O-N 3.27Å; N1042-I1045 VanDerWaalsContact O-N 3.16Å; E1043-I1045 VanDerWaalsContact C-N 3.26Å; E1043-I1045 PolarHBondContact O-N 3.47Å; I1045-F1048 PolarHBondContact O-N 3.39Å; I1045-D1049 WeakPolarHBondContact O-CB 3.33Å; I1045-D1049 VanDerWaalsContact O-CG 3.24Å; I1045-D1049 PolarHBondContact O-N 3.02Å; I1045-T1065 HydrophobicContact CD1-CG2 4.11Å; I1045-T1065 HydrophobicContact CG1-CG2 4.41Å; I1045-T1065 HydrophobicContact CG2-CG2 4.06Å
1046	A	91.2	Very high	90.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.1	-48	175.2	0	0	0	0	0	111.2	L525 N1042 E1043 F1048 D1049 E1050	L525-A1046 HydrophobicContact CD1-CB 3.99Å; L525-A1046 HydrophobicContact CD2-CB 4.39Å; L525-A1046 HydrophobicContact CG-CB 3.9Å; N1042-A1046 WeakPolarHBondContact O-CB 3.2Å; N1042-A1046 PolarHBondContact O-N 3.19Å; E1043-A1046 WeakPolarHBondContact O-CA 3.41Å; E1043-A1046 WeakPolarHBondContact O-CB 3.36Å; E1043-A1046 PolarHBondContact O-N 2.96Å; A1046-F1048 VanDerWaalsContact C-N 3.27Å; A1046-F1048 PolarHBondContact O-N 3.43Å; A1046-D1049 CarbonylContact O-C 3.58Å; A1046-D1049 WeakPolarHBondContact O-CA 3.49Å; A1046-D1049 WeakPolarHBondContact O-CB 3.2Å; A1046-D1049 PolarHBondContact O-N 3.21Å; A1046-E1050 PolarHBondContact O-N 3.46Å
1047	D	92.8	Very high	90.9	Very high	40 Å²	40	34.2 Å²	34.2	21%	0.214	17%	0.171	C	C	.	.	H	α-helix	trans	-52	-45.4	172.7	-77.8	17.3	0	0	0	111.7	E1043 E1050 I1051 Q1102 I1106	E1043-D1047 PolarHBondContact O-N 3.37Å; D1047-E1050 PolarHBondContact O-N 3.11Å; D1047-I1051 VanDerWaalsContact O-CG1 3.29Å; D1047-I1051 WeakPolarHBondContact O-CG1 3.28Å; D1047-I1051 PolarHBondContact O-N 3.24Å; D1047-Q1102 HydrophobicContact CB-CG 4.06Å; D1047-Q1102 PolarHBondContact OD2-NE2 3.24Å; D1047-I1106 HydrophobicContact CB-CD1 4.46Å; D1047-I1106 WeakPolarHBondContact OD2-CD1 3.03Å; D1047-I1106 WeakPolarHBondContact OD2-CG1 3.28Å
1048	F	94.9	Very high	90.8	Very high	5 Å²	5	42.8 Å²	42.8	2%	0.022	20%	0.203	C	C	.	.	H	α-helix	trans	-68.6	-33.8	177.2	-59.5	-23.5	0	0	0	112.8	I1044 I1045 A1046 I1052 Y1070 Y1095 M1099 Q1102 M1103 M1116	I1044-F1048 HydrophobicContact CG2-CD2 4.29Å; I1044-F1048 HydrophobicContact CG2-CE2 3.58Å; I1044-F1048 HydrophobicContact CG2-CZ 3.75Å; I1044-F1048 WeakPolarHBondContact O-CD2 3.37Å; I1044-F1048 WeakPolarHBondContact O-CG 3.35Å; I1044-F1048 PolarHBondContact O-N 3.18Å; I1045-F1048 PolarHBondContact O-N 3.39Å; A1046-F1048 VanDerWaalsContact C-N 3.27Å; A1046-F1048 PolarHBondContact O-N 3.43Å; F1048-I1052 WeakPolarHBondContact O-CB 3.36Å; F1048-I1052 WeakPolarHBondContact O-CG2 3.24Å; F1048-I1052 PolarHBondContact O-N 2.99Å; F1048-Y1070 HydrophobicContact CB-CD2 4.28Å; F1048-Y1070 HydrophobicContact CB-CE2 3.9Å; F1048-Y1070 HydrophobicContact CD2-CD2 4.21Å; F1048-Y1095 PolarHBondContact O-OH 3.46Å; F1048-M1099 HydrophobicContact CB-CE 4.42Å; F1048-M1099 HydrophobicContact CD1-CB 4.44Å; F1048-M1099 HydrophobicContact CD1-CE 3.91Å; F1048-M1099 HydrophobicContact CD1-CG 4Å; F1048-M1099 HydrophobicContact CD2-CE 3.52Å; F1048-M1099 HydrophobicContact CE1-CB 4.16Å; F1048-M1099 HydrophobicContact CE1-CE 3.95Å; F1048-M1099 HydrophobicContact CE1-CG 4.22Å; F1048-M1099 HydrophobicContact CE2-CE 3.56Å; F1048-M1099 HydrophobicContact CG-CE 3.7Å; F1048-M1099 HydrophobicContact CZ-CE 3.78Å; F1048-Q1102 HydrophobicContact CE1-CB 4.37Å; F1048-Q1102 HydrophobicContact CE1-CG 4.41Å; F1048-M1103 HydrophobicContact CZ-CE 3.91Å; F1048-M1116 HydrophobicContact CZ-SD 4.13Å
1049	D	92.9	Very high	90.8	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-71	-30.9	174.2	-78.1	-17.9	0	0	0	112.8	L525 R526 I1045 A1046 S1053 K1062 Y1070	L525-D1049 HydrophobicContact CB-CB 4.09Å; L525-D1049 PolarHBondContact N-OD2 2.87Å; R526-D1049 HydrophobicContact CB-CB 4.28Å; R526-D1049 WeakPolarHBondContact CD-O 3.4Å; R526-D1049 HydrophobicContact CG-CB 3.99Å; R526-D1049 PolarHBondContact N-OD2 2.82Å; I1045-D1049 WeakPolarHBondContact O-CB 3.33Å; I1045-D1049 VanDerWaalsContact O-CG 3.24Å; I1045-D1049 PolarHBondContact O-N 3.02Å; A1046-D1049 CarbonylContact O-C 3.58Å; A1046-D1049 WeakPolarHBondContact O-CA 3.49Å; A1046-D1049 WeakPolarHBondContact O-CB 3.2Å; A1046-D1049 PolarHBondContact O-N 3.21Å; D1049-S1053 PolarHBondContact O-N 3.44Å; D1049-S1053 PolarHBondContact O-OG 2.86Å; D1049-K1062 WeakPolarHBondContact OD1-CD 3.46Å; D1049-K1062 VanDerWaalsContact OD1-CE 3.29Å; D1049-K1062 WeakPolarHBondContact OD1-CE 3.49Å; D1049-K1062 IonicContact OD1-NZ 3.95Å; D1049-K1062 PolarHBondContact OD1-NZ 3.1Å; D1049-K1062 IonicContact OD2-NZ 3.73Å; D1049-K1062 PolarHBondContact OD2-NZ 3.18Å; D1049-Y1070 PolarHBondContact OD1-OH 2.76Å
1050	E	92.4	Very high	90.9	Very high	112 Å²	112	41.8 Å²	41.8	52%	0.523	20%	0.201	S	C	.	.	H	α-helix	trans	-71.5	-49.3	172.2	-72.1	-168.7	-174.8	0	0	111.1	L525 A1046 D1047 I1052 S1053 E1054	L525-E1050 HydrophobicContact CD1-CG 4.22Å; A1046-E1050 PolarHBondContact O-N 3.46Å; D1047-E1050 PolarHBondContact O-N 3.11Å; E1050-I1052 VanDerWaalsContact C-N 3.34Å; E1050-I1052 PolarHBondContact O-N 3.06Å; E1050-S1053 WeakPolarHBondContact O-CA 3.36Å; E1050-S1053 VanDerWaalsContact O-CB 3.23Å; E1050-S1053 WeakPolarHBondContact O-CB 3.3Å; E1050-S1053 PolarHBondContact O-N 2.87Å; E1050-E1054 PolarHBondContact O-N 3.29Å
1051	I	94.6	Very high	91	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.041	20%	0.198	C	C	.	.	H	α-helix	trans	-58.3	-46.2	177.7	-63.3	163.2	0	0	0	110.2	D1047 S1053 E1054 F1057 Y1095 R1098 Q1102	D1047-I1051 VanDerWaalsContact O-CG1 3.29Å; D1047-I1051 WeakPolarHBondContact O-CG1 3.28Å; D1047-I1051 PolarHBondContact O-N 3.24Å; I1051-S1053 PolarHBondContact O-N 3.3Å; I1051-E1054 WeakPolarHBondContact O-CB 3.36Å; I1051-E1054 WeakPolarHBondContact O-CG 3.32Å; I1051-E1054 PolarHBondContact O-N 2.76Å; I1051-F1057 HydrophobicContact CG2-CD2 3.91Å; I1051-F1057 HydrophobicContact CG2-CE2 3.7Å; I1051-F1057 VanDerWaalsContact O-CD2 3.28Å; I1051-F1057 WeakPolarHBondContact O-CD2 3.12Å; I1051-Y1095 HydrophobicContact CB-CE2 4.09Å; I1051-Y1095 HydrophobicContact CG2-CD2 3.79Å; I1051-Y1095 HydrophobicContact CG2-CE2 3.69Å; I1051-R1098 HydrophobicContact CD1-CG 4.39Å; I1051-R1098 HydrophobicContact CG2-CB 4.45Å; I1051-R1098 HydrophobicContact CG2-CG 3.72Å; I1051-Q1102 HydrophobicContact CD1-CB 3.83Å; I1051-Q1102 HydrophobicContact CD1-CG 3.77Å
1052	I	92.5	Very high	91.1	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.015	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	0.4	177.4	-147.2	176.9	0	0	0	113.5	R526 F1048 E1050 L1060 K1062 Y1070 A1072 Y1095	R526-I1052 PolarHBondContact NH1-O 2.88Å; F1048-I1052 WeakPolarHBondContact O-CB 3.36Å; F1048-I1052 WeakPolarHBondContact O-CG2 3.24Å; F1048-I1052 PolarHBondContact O-N 2.99Å; E1050-I1052 VanDerWaalsContact C-N 3.34Å; E1050-I1052 PolarHBondContact O-N 3.06Å; I1052-L1060 HydrophobicContact CD1-CB 4Å; I1052-L1060 HydrophobicContact CG1-CB 3.91Å; I1052-K1062 HydrophobicContact CD1-CB 4.35Å; I1052-Y1070 HydrophobicContact CD1-CE1 4.42Å; I1052-A1072 HydrophobicContact CD1-CB 4.19Å; I1052-Y1095 HydrophobicContact CB-CE2 3.63Å; I1052-Y1095 HydrophobicContact CD1-CE1 4.12Å; I1052-Y1095 HydrophobicContact CD1-CE2 4.46Å; I1052-Y1095 HydrophobicContact CG1-CD2 4.47Å; I1052-Y1095 HydrophobicContact CG1-CE1 4.4Å; I1052-Y1095 HydrophobicContact CG1-CE2 3.93Å
1053	S	89.4	Confident	91	Very high	60 Å²	60	41.4 Å²	41.4	42%	0.42	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-11.8	171.6	-59.9	0	0	0	0	113.7	R526 D1049 E1050 I1051	R526-S1053 WeakPolarHBondContact CD-OG 3.45Å; R526-S1053 PolarHBondContact NE-OG 3.38Å; R526-S1053 PolarHBondContact NH1-OG 3.25Å; R526-S1053 VanDerWaalsContact NH1-OG 3.13Å; R526-S1053 PolarHBondContact NH2-OG 2.85Å; D1049-S1053 PolarHBondContact O-N 3.44Å; D1049-S1053 PolarHBondContact O-OG 2.86Å; E1050-S1053 WeakPolarHBondContact O-CA 3.36Å; E1050-S1053 VanDerWaalsContact O-CB 3.23Å; E1050-S1053 WeakPolarHBondContact O-CB 3.3Å; E1050-S1053 PolarHBondContact O-N 2.87Å; I1051-S1053 PolarHBondContact O-N 3.3Å
1054	E	91.8	Very high	91	Very high	63 Å²	63	40.1 Å²	40.1	29%	0.294	19%	0.192	S	C	.	.	S	Bend	trans	-61.8	143.3	174.1	-60.5	173.2	-167.4	0	0	111.4	E1050 I1051 Q1056 F1057 R1058	E1050-E1054 PolarHBondContact O-N 3.29Å; I1051-E1054 WeakPolarHBondContact O-CB 3.36Å; I1051-E1054 WeakPolarHBondContact O-CG 3.32Å; I1051-E1054 PolarHBondContact O-N 2.76Å; E1054-Q1056 HydrophobicContact CB-CG 4.18Å; E1054-Q1056 PolarHBondContact O-N 3.07Å; E1054-Q1056 VanDerWaalsContact O-N 3.13Å; E1054-Q1056 PolarHBondContact OE2-NE2 3.35Å; E1054-F1057 HydrophobicContact CB-CD2 4.09Å; E1054-F1057 PolarHBondContact O-N 2.97Å; E1054-F1057 WeakPolarHBondContact OE2-CE2 3.17Å; E1054-R1058 PolarHBondContact O-N 2.92Å
1055	D	86.4	Confident	90.9	Very high	127 Å²	127	40.7 Å²	40.7	68%	0.679	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-59.1	-29.6	-176.5	-92.6	-52.8	0	0	0	113.6	F1057 R1058	D1055-F1057 PolarHBondContact O-N 3.1Å; D1055-R1058 VanDerWaalsContact O-CB 3.23Å; D1055-R1058 WeakPolarHBondContact O-CB 3.33Å; D1055-R1058 PolarHBondContact O-N 2.98Å
1056	Q	87.6	Confident	90.6	Very high	122 Å²	122	42.8 Å²	42.8	57%	0.57	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-65.5	-26.5	175.5	63.8	176.4	-13.5	0	0	113.3	E1054	E1054-Q1056 HydrophobicContact CB-CG 4.18Å; E1054-Q1056 PolarHBondContact O-N 3.07Å; E1054-Q1056 VanDerWaalsContact O-N 3.13Å; E1054-Q1056 PolarHBondContact OE2-NE2 3.35Å
1057	F	91.1	Very high	90.3	Very high	5 Å²	5	44.2 Å²	44.2	2%	0.022	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-99.6	7.8	-179.9	-62.6	-52.4	0	0	0	113.1	I1051 E1054 D1055 Q1059 L1060 A1091 D1094 Y1095 R1098	I1051-F1057 HydrophobicContact CG2-CD2 3.91Å; I1051-F1057 HydrophobicContact CG2-CE2 3.7Å; I1051-F1057 VanDerWaalsContact O-CD2 3.28Å; I1051-F1057 WeakPolarHBondContact O-CD2 3.12Å; E1054-F1057 HydrophobicContact CB-CD2 4.09Å; E1054-F1057 PolarHBondContact O-N 2.97Å; E1054-F1057 WeakPolarHBondContact OE2-CE2 3.17Å; D1055-F1057 PolarHBondContact O-N 3.1Å; F1057-Q1059 PolarHBondContact O-N 3.43Å; F1057-L1060 HydrophobicContact CB-CD1 3.8Å; F1057-L1060 HydrophobicContact CD1-CD1 3.68Å; F1057-L1060 HydrophobicContact CG-CD1 4.1Å; F1057-L1060 VanDerWaalsContact O-CB 3.29Å; F1057-L1060 WeakPolarHBondContact O-CB 3.41Å; F1057-L1060 PolarHBondContact O-N 3.29Å; F1057-A1091 HydrophobicContact CD1-CB 4.46Å; F1057-D1094 HydrophobicContact CE1-CB 4.01Å; F1057-D1094 HydrophobicContact CZ-CB 4.49Å; F1057-Y1095 HydrophobicContact CD1-CD2 4.25Å; F1057-Y1095 HydrophobicContact CD1-CG 4.44Å; F1057-Y1095 HydrophobicContact CD2-CD2 4.12Å; F1057-Y1095 HydrophobicContact CE1-CD2 4.46Å; F1057-Y1095 HydrophobicContact CE2-CD2 4.32Å; F1057-Y1095 HydrophobicContact CG-CD2 4.09Å; F1057-Y1095 HydrophobicContact CZ-CD2 4.49Å; F1057-R1098 HydrophobicContact CE2-CG 4.41Å; F1057-R1098 HydrophobicContact CZ-CB 4.34Å
1058	R	86.8	Confident	90.1	Very high	182 Å²	182	44 Å²	44	69%	0.687	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-14.5	-179.4	179.9	173.4	164.4	-178.4	-6.8	115.9	E1054 D1055 L1060	E1054-R1058 PolarHBondContact O-N 2.92Å; D1055-R1058 VanDerWaalsContact O-CB 3.23Å; D1055-R1058 WeakPolarHBondContact O-CB 3.33Å; D1055-R1058 PolarHBondContact O-N 2.98Å; R1058-L1060 VanDerWaalsContact C-N 3.32Å
1059	Q	87.4	Confident	90	Very high	45 Å²	45	45.2 Å²	45.2	21%	0.21	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3.6	172.8	-62.9	-178.8	-69	0	0	113.8	F1057 S1074 T1080 S1087 H1088	F1057-Q1059 PolarHBondContact O-N 3.43Å; Q1059-S1074 WeakPolarHBondContact O-CA 3.28Å; Q1059-S1074 WeakPolarHBondContact O-CB 3.46Å; Q1059-T1080 PolarHBondContact NE2-O 3.24Å; Q1059-S1087 PolarHBondContact NE2-OG 3.37Å; Q1059-S1087 VanDerWaalsContact NE2-OG 3.1Å; Q1059-H1088 HydrophobicContact CB-CB 4.14Å
1060	L	91.1	Very high	90.1	Very high	9 Å²	9	45.5 Å²	45.5	5%	0.047	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.1	-179.7	-71.6	146.9	0	0	0	111.6	I1052 F1057 R1058 A1091 M1092 Y1095	I1052-L1060 HydrophobicContact CD1-CB 4Å; I1052-L1060 HydrophobicContact CG1-CB 3.91Å; F1057-L1060 HydrophobicContact CB-CD1 3.8Å; F1057-L1060 HydrophobicContact CD1-CD1 3.68Å; F1057-L1060 HydrophobicContact CG-CD1 4.1Å; F1057-L1060 VanDerWaalsContact O-CB 3.29Å; F1057-L1060 WeakPolarHBondContact O-CB 3.41Å; F1057-L1060 PolarHBondContact O-N 3.29Å; R1058-L1060 VanDerWaalsContact C-N 3.32Å; L1060-A1091 HydrophobicContact CD1-CB 4.29Å; L1060-M1092 HydrophobicContact CD2-CB 4.07Å; L1060-M1092 HydrophobicContact CD2-CE 3.45Å; L1060-M1092 VanDerWaalsContact CD2-CE 3.45Å; L1060-M1092 HydrophobicContact CD2-CG 4.34Å; L1060-M1092 HydrophobicContact CD2-SD 3.4Å; L1060-M1092 WeakPolarHBondContact CD2-SD 3.36Å; L1060-Y1095 HydrophobicContact CD1-CD1 4.45Å; L1060-Y1095 HydrophobicContact CD1-CG 4.03Å
1061	E	90.9	Very high	90.2	Very high	33 Å²	33	40.4 Å²	40.4	15%	0.154	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.3	173.9	-167.1	79.5	-157.2	0	0	108.9	K527 P986 I1063 A1072 A1073 L1076	K527-E1061 WeakPolarHBondContact CE-OE1 3.43Å; K527-E1061 IonicContact NZ-OE1 2.59Å; K527-E1061 PolarHBondContact NZ-OE1 3.45Å; P986-E1061 WeakPolarHBondContact CA-OE1 3.39Å; P986-E1061 HydrophobicContact CB-CG 4.49Å; P986-E1061 WeakPolarHBondContact CB-OE1 3.41Å; P986-E1061 HydrophobicContact CG-CG 4.23Å; E1061-I1063 PolarHBondContact O-N 3.07Å; E1061-A1072 WeakPolarHBondContact O-CA 3.23Å; E1061-A1073 PolarHBondContact N-O 2.96Å; E1061-A1073 PolarHBondContact O-N 3.37Å; E1061-L1076 HydrophobicContact CB-CD1 4.45Å
1062	K	92.5	Very high	90.2	Very high	7 Å²	7	40 Å²	40	3%	0.03	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	127.3	166.3	-179.4	-177.5	-172.5	-179.9	0	108.3	R526 K527 D1049 I1052 Y1070	R526-K1062 HydrophobicContact CB-CD 4.19Å; R526-K1062 WeakPolarHBondContact O-CE 3.34Å; R526-K1062 PolarHBondContact O-NZ 3.43Å; K527-K1062 HydrophobicContact CB-CD 4.12Å; K527-K1062 HydrophobicContact CB-CG 4.41Å; K527-K1062 WeakPolarHBondContact CE-O 3.43Å; K527-K1062 HydrophobicContact CG-CB 4.01Å; K527-K1062 HydrophobicContact CG-CD 4.02Å; K527-K1062 HydrophobicContact CG-CG 4.03Å; K527-K1062 WeakPolarHBondContact CG-O 3.39Å; D1049-K1062 WeakPolarHBondContact OD1-CD 3.46Å; D1049-K1062 VanDerWaalsContact OD1-CE 3.29Å; D1049-K1062 WeakPolarHBondContact OD1-CE 3.49Å; D1049-K1062 IonicContact OD1-NZ 3.95Å; D1049-K1062 PolarHBondContact OD1-NZ 3.1Å; D1049-K1062 IonicContact OD2-NZ 3.73Å; D1049-K1062 PolarHBondContact OD2-NZ 3.18Å; I1052-K1062 HydrophobicContact CD1-CB 4.35Å; K1062-Y1070 HydrophobicContact CD-CE2 3.94Å; K1062-Y1070 HydrophobicContact CG-CE1 4.49Å; K1062-Y1070 HydrophobicContact CG-CE2 4.29Å
1063	I	90.4	Very high	90.3	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-56.1	179	-51.9	-56.9	0	0	0	109.8	Q529 E1061 M1071 A1073 L1076 Y1137 I1139	Q529-I1063 PolarHBondContact NE2-O 2.65Å; E1061-I1063 PolarHBondContact O-N 3.07Å; I1063-M1071 HydrophobicContact CB-CE 4.3Å; I1063-M1071 HydrophobicContact CB-CG 4.2Å; I1063-M1071 HydrophobicContact CB-SD 4.21Å; I1063-M1071 HydrophobicContact CG1-CE 4.34Å; I1063-M1071 HydrophobicContact CG2-CE 4.1Å; I1063-M1071 HydrophobicContact CG2-SD 4.17Å; I1063-M1071 PolarHBondContact N-O 3.35Å; I1063-A1073 HydrophobicContact CD1-CB 4.29Å; I1063-A1073 HydrophobicContact CG1-CB 4.24Å; I1063-L1076 HydrophobicContact CD1-CD1 3.79Å; I1063-Y1137 HydrophobicContact CD1-CE1 4.15Å; I1063-I1139 HydrophobicContact CD1-CD1 4.39Å; I1063-I1139 HydrophobicContact CD1-CG2 4.46Å; I1063-I1139 HydrophobicContact CG1-CD1 4.2Å; I1063-I1139 HydrophobicContact CG1-CG1 4.45Å; I1063-I1139 HydrophobicContact CG2-CG1 4.46Å
1064	K	89.2	Confident	90.4	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.022	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	159.4	-179.3	58.4	-175.7	72.4	169.3	0	111	I463 L464 I1066 M1071 D1138	I463-K1064 PolarHBondContact O-NZ 3.46Å; L464-K1064 HydrophobicContact CD2-CD 4.2Å; K1064-I1066 HydrophobicContact CD-CD1 3.97Å; K1064-I1066 HydrophobicContact CD-CG1 3.95Å; K1064-I1066 HydrophobicContact CG-CD1 4.27Å; K1064-I1066 HydrophobicContact CG-CG1 4Å; K1064-M1071 HydrophobicContact CD-SD 4.21Å; K1064-M1071 HydrophobicContact CG-CB 4.19Å; K1064-M1071 HydrophobicContact CG-SD 3.9Å; K1064-M1071 PolarHBondContact N-O 3.24Å; K1064-M1071 WeakPolarHBondContact O-CB 3.31Å; K1064-M1071 PolarHBondContact O-N 3.43Å; K1064-D1138 WeakPolarHBondContact CE-OD1 3.33Å; K1064-D1138 IonicContact NZ-OD1 3.68Å; K1064-D1138 PolarHBondContact NZ-OD1 2.72Å; K1064-D1138 IonicContact NZ-OD2 2.64Å; K1064-D1138 PolarHBondContact NZ-OD2 2.57Å
1065	T	89.5	Confident	90.2	Very high	15 Å²	15	34.2 Å²	34.2	9%	0.092	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	155.3	155.7	47.4	0	0	0	0	109.3	K462 I1045 T1069 Y1070	K462-T1065 WeakPolarHBondContact CE-O 3.25Å; K462-T1065 PolarHBondContact NZ-O 3.28Å; I1045-T1065 HydrophobicContact CD1-CG2 4.11Å; I1045-T1065 HydrophobicContact CG1-CG2 4.41Å; I1045-T1065 HydrophobicContact CG2-CG2 4.06Å; T1065-T1069 CarbonylContact C-O 3.55Å; T1065-T1069 VanDerWaalsContact CA-O 3.31Å; T1065-T1069 WeakPolarHBondContact CA-O 3.39Å; T1065-Y1070 HydrophobicContact CG2-CD2 3.97Å
1066	I	87	Confident	90.2	Very high	52 Å²	52	28.3 Å²	28.3	27%	0.267	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	96.5	176.6	-48.1	172.2	0	0	0	107.3	L464 F1015 K1064 S1068 T1069	L464-I1066 HydrophobicContact CD1-CG2 4.31Å; L464-I1066 HydrophobicContact CD2-CD1 4.05Å; L464-I1066 HydrophobicContact CD2-CG1 4.03Å; L464-I1066 HydrophobicContact CD2-CG2 4.17Å; F1015-I1066 HydrophobicContact CE1-CD1 4.42Å; K1064-I1066 HydrophobicContact CD-CD1 3.97Å; K1064-I1066 HydrophobicContact CD-CG1 3.95Å; K1064-I1066 HydrophobicContact CG-CD1 4.27Å; K1064-I1066 HydrophobicContact CG-CG1 4Å; I1066-S1068 PolarHBondContact O-N 2.99Å; I1066-T1069 PolarHBondContact N-O 3.37Å; I1066-T1069 VanDerWaalsContact O-CB 3.26Å; I1066-T1069 WeakPolarHBondContact O-CB 3.5Å; I1066-T1069 PolarHBondContact O-N 3.01Å; I1066-T1069 PolarHBondContact O-OG1 3.13Å
1067	G	85.4	Confident	89.7	Confident	31 Å²	31	23.4 Å²	23.4	32%	0.32	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	-121.1	-169.5	0	0	0	0	0	111.3	T1069	G1067-T1069 VanDerWaalsContact C-N 3.34Å
1068	S	88.9	Confident	88.6	Confident	36 Å²	36	28.5 Å²	28.5	25%	0.252	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	19.8	173.2	55.8	0	0	0	0	114.7	I1018 I1066	I1018-S1068 PolarHBondContact N-O 3.47Å; I1018-S1068 VanDerWaalsContact N-O 3.1Å; I1066-S1068 PolarHBondContact O-N 2.99Å
1069	T	92.3	Very high	87.6	Confident	30 Å²	30	24 Å²	24	18%	0.184	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.3	176	-47.7	0	0	0	0	110.9	F1015 A1016 S1017 T1065 I1066 G1067	F1015-T1069 HydrophobicContact CB-CG2 4.41Å; F1015-T1069 HydrophobicContact CD1-CG2 3.96Å; A1016-T1069 CarbonylContact O-C 3.56Å; A1016-T1069 WeakPolarHBondContact O-CA 3.35Å; S1017-T1069 WeakPolarHBondContact OG-CG2 3.47Å; S1017-T1069 PolarHBondContact OG-OG1 3.41Å; T1065-T1069 CarbonylContact C-O 3.55Å; T1065-T1069 VanDerWaalsContact CA-O 3.31Å; T1065-T1069 WeakPolarHBondContact CA-O 3.39Å; I1066-T1069 PolarHBondContact N-O 3.37Å; I1066-T1069 VanDerWaalsContact O-CB 3.26Å; I1066-T1069 WeakPolarHBondContact O-CB 3.5Å; I1066-T1069 PolarHBondContact O-N 3.01Å; I1066-T1069 PolarHBondContact O-OG1 3.13Å; G1067-T1069 VanDerWaalsContact C-N 3.34Å
1070	Y	94.7	Very high	86.6	Confident	6 Å²	6	23.3 Å²	23.3	2%	0.024	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.3	173.5	-168.1	-86.8	0	0	0	109.9	M1014 A1016 F1048 D1049 I1052 K1062 T1065 A1072 Y1095 M1099	M1014-Y1070 HydrophobicContact CE-CD1 4.39Å; A1016-Y1070 PolarHBondContact N-O 2.95Å; A1016-Y1070 PolarHBondContact O-N 3.41Å; F1048-Y1070 HydrophobicContact CB-CD2 4.28Å; F1048-Y1070 HydrophobicContact CB-CE2 3.9Å; F1048-Y1070 HydrophobicContact CD2-CD2 4.21Å; D1049-Y1070 PolarHBondContact OD1-OH 2.76Å; I1052-Y1070 HydrophobicContact CD1-CE1 4.42Å; K1062-Y1070 HydrophobicContact CD-CE2 3.94Å; K1062-Y1070 HydrophobicContact CG-CE1 4.49Å; K1062-Y1070 HydrophobicContact CG-CE2 4.29Å; T1065-Y1070 HydrophobicContact CG2-CD2 3.97Å; Y1070-A1072 HydrophobicContact CD1-CB 4.47Å; Y1070-A1072 HydrophobicContact CE1-CB 4.09Å; Y1070-Y1095 HydrophobicContact CE1-CE1 4.08Å; Y1070-Y1095 VanDerWaalsContact CE1-OH 3.25Å; Y1070-Y1095 WeakPolarHBondContact CE1-OH 3.45Å; Y1070-Y1095 PolarHBondContact OH-OH 2.78Å; Y1070-M1099 HydrophobicContact CD1-CE 4.27Å; Y1070-M1099 HydrophobicContact CG-CE 4.4Å
1071	M	94.6	Very high	85.6	Confident	6 Å²	6	24.8 Å²	24.8	3%	0.03	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122	-179.3	-176.6	-172.1	170.8	0	0	111	V1013 M1014 F1015 I1063 K1064 I1139 V1144	V1013-M1071 HydrophobicContact CG1-CE 4.39Å; M1014-M1071 WeakPolarHBondContact O-CA 3.39Å; F1015-M1071 HydrophobicContact CD1-CB 4.42Å; F1015-M1071 HydrophobicContact CD1-CG 4.38Å; F1015-M1071 HydrophobicContact CE1-CB 4.29Å; F1015-M1071 HydrophobicContact CE1-CG 3.96Å; F1015-M1071 HydrophobicContact CE1-SD 3.84Å; F1015-M1071 HydrophobicContact CE2-CE 4.35Å; F1015-M1071 HydrophobicContact CE2-CG 4.34Å; F1015-M1071 HydrophobicContact CE2-SD 4.46Å; F1015-M1071 HydrophobicContact CZ-CE 3.91Å; F1015-M1071 HydrophobicContact CZ-CG 3.94Å; F1015-M1071 HydrophobicContact CZ-SD 3.65Å; I1063-M1071 HydrophobicContact CB-CE 4.3Å; I1063-M1071 HydrophobicContact CB-CG 4.2Å; I1063-M1071 HydrophobicContact CB-SD 4.21Å; I1063-M1071 HydrophobicContact CG1-CE 4.34Å; I1063-M1071 HydrophobicContact CG2-CE 4.1Å; I1063-M1071 HydrophobicContact CG2-SD 4.17Å; I1063-M1071 PolarHBondContact N-O 3.35Å; K1064-M1071 HydrophobicContact CD-SD 4.21Å; K1064-M1071 HydrophobicContact CG-CB 4.19Å; K1064-M1071 HydrophobicContact CG-SD 3.9Å; K1064-M1071 PolarHBondContact N-O 3.24Å; K1064-M1071 WeakPolarHBondContact O-CB 3.31Å; K1064-M1071 PolarHBondContact O-N 3.43Å; M1071-I1139 HydrophobicContact CE-CD1 3.86Å; M1071-I1139 HydrophobicContact CE-CG1 3.64Å; M1071-V1144 HydrophobicContact CE-CG1 3.74Å
1072	A	94.9	Very high	84.6	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	158.6	177.4	0	0	0	0	0	111	M1014 I1052 E1061 Y1070 M1092	M1014-A1072 HydrophobicContact CE-CB 4.4Å; M1014-A1072 PolarHBondContact N-O 3.08Å; M1014-A1072 PolarHBondContact O-N 2.69Å; I1052-A1072 HydrophobicContact CD1-CB 4.19Å; E1061-A1072 WeakPolarHBondContact O-CA 3.23Å; Y1070-A1072 HydrophobicContact CD1-CB 4.47Å; Y1070-A1072 HydrophobicContact CE1-CB 4.09Å; A1072-M1092 HydrophobicContact CB-CE 4.48Å
1073	A	94.2	Very high	83.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	160.4	175	0	0	0	0	0	111.6	V1011 A1012 V1013 E1061 I1063 L1076 I1139	V1011-A1073 HydrophobicContact CG1-CB 3.98Å; A1012-A1073 CarbonylContact O-C 3.53Å; A1012-A1073 WeakPolarHBondContact O-CA 3.36Å; A1012-A1073 VanDerWaalsContact O-CB 3.31Å; A1012-A1073 WeakPolarHBondContact O-CB 3.39Å; V1013-A1073 HydrophobicContact CG2-CB 4.34Å; E1061-A1073 PolarHBondContact N-O 2.96Å; E1061-A1073 PolarHBondContact O-N 3.37Å; I1063-A1073 HydrophobicContact CD1-CB 4.29Å; I1063-A1073 HydrophobicContact CG1-CB 4.24Å; A1073-L1076 HydrophobicContact CB-CD1 3.9Å; A1073-I1139 HydrophobicContact CB-CD1 3.74Å
1074	S	92.6	Very high	82.2	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	153.9	178.3	74.6	0	0	0	0	112.2	V1011 A1012 Q1059 H1088	V1011-S1074 WeakPolarHBondContact CA-O 3.43Å; V1011-S1074 WeakPolarHBondContact CG1-O 3.48Å; A1012-S1074 PolarHBondContact N-O 3.27Å; A1012-S1074 PolarHBondContact O-N 2.97Å; Q1059-S1074 WeakPolarHBondContact O-CA 3.28Å; Q1059-S1074 WeakPolarHBondContact O-CB 3.46Å; S1074-H1088 WeakPolarHBondContact CB-O 3.35Å; S1074-H1088 PolarHBondContact O-CD2 3.05Å; S1074-H1088 VanDerWaalsContact OG-C 3.29Å; S1074-H1088 PolarHBondContact OG-CD2 3.42Å; S1074-H1088 PolarHBondContact OG-O 3.31Å
1075	G	87.9	Confident	81.1	Confident	3 Å²	3	37.5 Å²	37.5	3%	0.031	23%	0.23	C	C	.	.	S	Bend	trans	83.3	19.8	-176.8	0	0	0	0	0	114.9	H1088	G1075-H1088 VanDerWaalsContact CA-CD2 3.49Å; G1075-H1088 WeakPolarHBondContact CA-CD2 3.37Å
1076	L	85.8	Confident	80.7	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.016	24%	0.244	C	C	.	.			trans	-80.8	-43	177.7	-68.7	166.8	0	0	0	112.6	Q1006 C1008 V1011 E1061 I1063 A1073 V1125 A1127 I1139	Q1006-L1076 PolarHBondContact NE2-O 3.13Å; Q1006-L1076 VanDerWaalsContact NE2-O 3.1Å; Q1006-L1076 PolarHBondContact OE1-O 2.89Å; C1008-L1076 HydrophobicContact CB-CD2 4.49Å; V1011-L1076 HydrophobicContact CG1-CD2 4.17Å; V1011-L1076 HydrophobicContact CG1-CG 4.39Å; V1011-L1076 HydrophobicContact CG2-CD2 3.84Å; V1011-L1076 HydrophobicContact CG2-CG 4.33Å; E1061-L1076 HydrophobicContact CB-CD1 4.45Å; I1063-L1076 HydrophobicContact CD1-CD1 3.79Å; A1073-L1076 HydrophobicContact CB-CD1 3.9Å; L1076-V1125 HydrophobicContact CD2-CG2 4Å; L1076-A1127 HydrophobicContact CD2-CB 4.18Å; L1076-I1139 HydrophobicContact CD1-CG2 4.18Å; L1076-I1139 HydrophobicContact CD2-CG2 3.82Å
1077	N	75.6	Confident	80.6	Confident	19 Å²	19	40.1 Å²	40.1	10%	0.102	24%	0.238	C	C	.	.	S	Bend	trans	-87.3	122.7	-179.4	-51.2	-45.6	0	0	0	110.2	S1079 T1080 Y1081	N1077-S1079 WeakPolarHBondContact CB-OG 3.27Å; N1077-S1079 PolarHBondContact O-N 3.49Å; N1077-S1079 VanDerWaalsContact O-N 3.11Å; N1077-T1080 HydrophobicContact CB-CG2 4.4Å; N1077-T1080 PolarHBondContact O-N 3.25Å; N1077-T1080 PolarHBondContact O-OG1 3.07Å; N1077-Y1081 PolarHBondContact O-N 3.04Å; N1077-Y1081 VanDerWaalsContact O-N 3.1Å
1078	D	68.4	Low	80.8	Confident	112 Å²	112	38.6 Å²	38.6	60%	0.599	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.6	176.8	-75.3	-44	0	0	0	112.6	Q1006 T1080	Q1006-D1078 PolarHBondContact NE2-OD2 3.14Å; D1078-T1080 PolarHBondContact O-N 3.23Å
1079	S	65.9	Low	80.9	Confident	86 Å²	86	37 Å²	37	60%	0.601	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.5	174.1	58.6	0	0	0	0	114.5	D988 N1077	D988-S1079 PolarHBondContact OD2-OG 3.14Å; N1077-S1079 WeakPolarHBondContact CB-OG 3.27Å; N1077-S1079 PolarHBondContact O-N 3.49Å; N1077-S1079 VanDerWaalsContact O-N 3.11Å
1080	T	66.8	Low	80.8	Confident	31 Å²	31	39.9 Å²	39.9	19%	0.19	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123	-8.7	-177.6	63.6	0	0	0	0	113.9	Q1059 N1077 D1078 D1082	Q1059-T1080 PolarHBondContact NE2-O 3.24Å; N1077-T1080 HydrophobicContact CB-CG2 4.4Å; N1077-T1080 PolarHBondContact O-N 3.25Å; N1077-T1080 PolarHBondContact O-OG1 3.07Å; D1078-T1080 PolarHBondContact O-N 3.23Å; T1080-D1082 PolarHBondContact O-N 2.8Å
1081	Y	69.8	Low	80.7	Confident	41 Å²	41	39.8 Å²	39.8	16%	0.161	22%	0.219	C	C	.	.			trans	-86	103.2	-170.2	174.7	-143.7	0	0	0	112.3	C1010 N1077 K1083 H1088	C1010-Y1081 HydrophobicContact CB-CE2 4.27Å; C1010-Y1081 VanDerWaalsContact CB-OH 3.3Å; C1010-Y1081 WeakPolarHBondContact CB-OH 3.43Å; N1077-Y1081 PolarHBondContact O-N 3.04Å; N1077-Y1081 VanDerWaalsContact O-N 3.1Å; Y1081-K1083 HydrophobicContact CD1-CG 3.87Å; Y1081-K1083 HydrophobicContact CE1-CD 4.14Å; Y1081-K1083 HydrophobicContact CE1-CG 3.52Å; Y1081-K1083 HydrophobicContact CE2-CG 4.32Å; Y1081-K1083 HydrophobicContact CG-CG 4.41Å; Y1081-K1083 PolarHBondContact O-N 2.77Å; Y1081-K1083 VanDerWaalsContact O-N 3.16Å; Y1081-H1088 AromaticContact CD2-CE1 3.66Å; Y1081-H1088 AromaticContact CD2-NE2 4Å; Y1081-H1088 AromaticContact CE2-CE1 3.55Å; Y1081-H1088 AromaticContact CE2-NE2 3.92Å
1082	D	70.8	Confident	80.7	Confident	50 Å²	50	39.6 Å²	39.6	27%	0.267	22%	0.218	S	C	.	.			trans	-80.5	90.7	176.1	173.4	17.4	0	0	0	111.6	T1080 A1084 G1085 R1086 S1087	T1080-D1082 PolarHBondContact O-N 2.8Å; D1082-A1084 PolarHBondContact O-N 2.96Å; D1082-A1084 PolarHBondContact OD1-N 2.93Å; D1082-G1085 VanDerWaalsContact CG-N 3.34Å; D1082-G1085 PolarHBondContact OD1-N 3.45Å; D1082-G1085 WeakPolarHBondContact OD2-CA 3.24Å; D1082-G1085 PolarHBondContact OD2-N 2.99Å; D1082-R1086 WeakPolarHBondContact O-CA 3.25Å; D1082-R1086 PolarHBondContact O-N 2.77Å; D1082-R1086 VanDerWaalsContact O-N 3.11Å; D1082-R1086 PolarHBondContact OD2-N 3.47Å; D1082-S1087 WeakPolarHBondContact CB-OG 3.47Å; D1082-S1087 WeakPolarHBondContact OD2-CB 3.49Å; D1082-S1087 PolarHBondContact OD2-N 3.25Å; D1082-S1087 VanDerWaalsContact OD2-N 3.1Å; D1082-S1087 PolarHBondContact OD2-OG 3.14Å
1083	K	65.9	Low	80.7	Confident	143 Å²	143	39.7 Å²	39.7	62%	0.622	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.5	179.6	-68.9	-175.2	-179.8	-169.2	0	114.4	Y1081	Y1081-K1083 HydrophobicContact CD1-CG 3.87Å; Y1081-K1083 HydrophobicContact CE1-CD 4.14Å; Y1081-K1083 HydrophobicContact CE1-CG 3.52Å; Y1081-K1083 HydrophobicContact CE2-CG 4.32Å; Y1081-K1083 HydrophobicContact CG-CG 4.41Å; Y1081-K1083 PolarHBondContact O-N 2.77Å; Y1081-K1083 VanDerWaalsContact O-N 3.16Å
1084	A	65.9	Low	80.7	Confident	95 Å²	95	41.2 Å²	41.2	79%	0.785	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-52.1	-172.9	0	0	0	0	0	112.6	D1082	D1082-A1084 PolarHBondContact O-N 2.96Å; D1082-A1084 PolarHBondContact OD1-N 2.93Å
1085	G	66.7	Low	80.8	Confident	28 Å²	28	41.2 Å²	41.2	29%	0.289	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-6.3	-176.9	0	0	0	0	0	115	D1082 S1087 Y1172	D1082-G1085 VanDerWaalsContact CG-N 3.34Å; D1082-G1085 PolarHBondContact OD1-N 3.45Å; D1082-G1085 WeakPolarHBondContact OD2-CA 3.24Å; D1082-G1085 PolarHBondContact OD2-N 2.99Å; G1085-S1087 PolarHBondContact O-N 3.36Å; G1085-Y1172 PolarHBondContact O-OH 3.19Å
1086	R	80.1	Confident	81.2	Confident	103 Å²	103	41 Å²	41	39%	0.389	23%	0.225	S	C	.	.			trans	47.5	31.1	179.5	-56.7	-176.9	178.5	-171	-0.6	114.3	D1082 H1088 I1089	D1082-R1086 WeakPolarHBondContact O-CA 3.25Å; D1082-R1086 PolarHBondContact O-N 2.77Å; D1082-R1086 VanDerWaalsContact O-N 3.11Å; D1082-R1086 PolarHBondContact OD2-N 3.47Å; R1086-H1088 PolarHBondContact O-N 3.48Å; R1086-H1088 VanDerWaalsContact O-N 3.08Å; R1086-I1089 HydrophobicContact CB-CD1 3.97Å; R1086-I1089 HydrophobicContact CB-CG1 4.27Å; R1086-I1089 HydrophobicContact CG-CD1 4.39Å; R1086-I1089 WeakPolarHBondContact O-CB 3.06Å; R1086-I1089 PolarHBondContact O-N 3.21Å
1087	S	86.3	Confident	81.6	Confident	18 Å²	18	42.5 Å²	42.5	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-55.5	-29.2	-173.3	42.2	0	0	0	0	114.6	Q1059 D1082 G1085 I1089 R1090 A1091	Q1059-S1087 PolarHBondContact NE2-OG 3.37Å; Q1059-S1087 VanDerWaalsContact NE2-OG 3.1Å; D1082-S1087 WeakPolarHBondContact CB-OG 3.47Å; D1082-S1087 WeakPolarHBondContact OD2-CB 3.49Å; D1082-S1087 PolarHBondContact OD2-N 3.25Å; D1082-S1087 VanDerWaalsContact OD2-N 3.1Å; D1082-S1087 PolarHBondContact OD2-OG 3.14Å; G1085-S1087 PolarHBondContact O-N 3.36Å; S1087-I1089 VanDerWaalsContact C-N 3.31Å; S1087-I1089 PolarHBondContact O-N 3.48Å; S1087-R1090 WeakPolarHBondContact O-CB 3.45Å; S1087-R1090 PolarHBondContact O-N 3Å; S1087-A1091 PolarHBondContact O-N 2.67Å
1088	H	89.3	Confident	82.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-29.3	176.4	66.3	-69.3	0	0	0	113.8	C1010 Q1059 S1074 G1075 Y1081 R1086 M1092	C1010-H1088 PolarHBondContact O-NE2 3.15Å; Q1059-H1088 HydrophobicContact CB-CB 4.14Å; S1074-H1088 WeakPolarHBondContact CB-O 3.35Å; S1074-H1088 PolarHBondContact O-CD2 3.05Å; S1074-H1088 VanDerWaalsContact OG-C 3.29Å; S1074-H1088 PolarHBondContact OG-CD2 3.42Å; S1074-H1088 PolarHBondContact OG-O 3.31Å; G1075-H1088 VanDerWaalsContact CA-CD2 3.49Å; G1075-H1088 WeakPolarHBondContact CA-CD2 3.37Å; Y1081-H1088 AromaticContact CD2-CE1 3.66Å; Y1081-H1088 AromaticContact CD2-NE2 4Å; Y1081-H1088 AromaticContact CE2-CE1 3.55Å; Y1081-H1088 AromaticContact CE2-NE2 3.92Å; R1086-H1088 PolarHBondContact O-N 3.48Å; R1086-H1088 VanDerWaalsContact O-N 3.08Å; H1088-M1092 WeakPolarHBondContact O-CB 3.23Å; H1088-M1092 PolarHBondContact O-N 2.85Å; H1088-M1092 VanDerWaalsContact O-N 3.16Å
1089	I	91.2	Very high	83.8	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-73.9	-37	176.2	-51.6	-177.2	0	0	0	109.9	A1012 R1086 S1087 M1092 A1093 I1122 L1165 V1168	A1012-I1089 HydrophobicContact CB-CG1 4.39Å; A1012-I1089 HydrophobicContact CB-CG2 4.48Å; R1086-I1089 HydrophobicContact CB-CD1 3.97Å; R1086-I1089 HydrophobicContact CB-CG1 4.27Å; R1086-I1089 HydrophobicContact CG-CD1 4.39Å; R1086-I1089 WeakPolarHBondContact O-CB 3.06Å; R1086-I1089 PolarHBondContact O-N 3.21Å; S1087-I1089 VanDerWaalsContact C-N 3.31Å; S1087-I1089 PolarHBondContact O-N 3.48Å; I1089-M1092 PolarHBondContact O-N 3Å; I1089-A1093 PolarHBondContact O-N 3.5Å; I1089-A1093 VanDerWaalsContact O-N 3.16Å; I1089-I1122 HydrophobicContact CD1-CG2 4.14Å; I1089-I1122 HydrophobicContact CG2-CG2 4.03Å; I1089-L1165 HydrophobicContact CG2-CD1 3.53Å; I1089-V1168 HydrophobicContact CD1-CG1 4.21Å; I1089-V1168 HydrophobicContact CG2-CG1 4.22Å
1090	R	90.3	Very high	85.1	Confident	89 Å²	89	38.4 Å²	38.4	34%	0.336	20%	0.195	S	C	.	.	H	α-helix	trans	-61.4	-55.1	173.8	-162.7	-158.9	-38.2	98.4	3.5	110.6	S1087 M1092 A1093 D1094 Y1174	S1087-R1090 WeakPolarHBondContact O-CB 3.45Å; S1087-R1090 PolarHBondContact O-N 3Å; R1090-M1092 PolarHBondContact O-N 3.19Å; R1090-M1092 VanDerWaalsContact O-N 3.13Å; R1090-A1093 WeakPolarHBondContact O-CA 3.3Å; R1090-A1093 WeakPolarHBondContact O-CB 3.25Å; R1090-A1093 PolarHBondContact O-N 3.29Å; R1090-D1094 WeakPolarHBondContact CG-OD2 3.41Å; R1090-D1094 VanDerWaalsContact O-CG 3.28Å; R1090-D1094 PolarHBondContact O-N 3.42Å; R1090-Y1174 HydrophobicContact CG-CE2 4.01Å; R1090-Y1174 WeakPolarHBondContact CG-OH 3.43Å
1091	A	91.9	Very high	86.4	Confident	4 Å²	4	40.5 Å²	40.5	3%	0.033	21%	0.205	C	C	.	.	H	α-helix	trans	-54.9	-35	177.5	0	0	0	0	0	112.6	F1057 L1060 S1087 Y1095	F1057-A1091 HydrophobicContact CD1-CB 4.46Å; L1060-A1091 HydrophobicContact CD1-CB 4.29Å; S1087-A1091 PolarHBondContact O-N 2.67Å; A1091-Y1095 WeakPolarHBondContact O-CB 3.45Å; A1091-Y1095 PolarHBondContact O-N 3.47Å
1092	M	94.3	Very high	87.6	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-66.7	-39.2	174.9	-176.7	79.7	-85.7	0	0	113	A1012 M1014 L1060 A1072 H1088 I1089 R1090 Y1095 A1096 L1120	A1012-M1092 HydrophobicContact CB-CB 4.11Å; A1012-M1092 HydrophobicContact CB-CG 3.88Å; M1014-M1092 HydrophobicContact CB-CE 3.53Å; M1014-M1092 HydrophobicContact CB-SD 3.69Å; M1014-M1092 HydrophobicContact CE-CE 3.79Å; M1014-M1092 HydrophobicContact CG-CE 4.12Å; M1014-M1092 HydrophobicContact SD-CE 3.53Å; M1014-M1092 VanDerWaalsContact SD-CE 3.53Å; L1060-M1092 HydrophobicContact CD2-CB 4.07Å; L1060-M1092 HydrophobicContact CD2-CE 3.45Å; L1060-M1092 VanDerWaalsContact CD2-CE 3.45Å; L1060-M1092 HydrophobicContact CD2-CG 4.34Å; L1060-M1092 HydrophobicContact CD2-SD 3.4Å; L1060-M1092 WeakPolarHBondContact CD2-SD 3.36Å; A1072-M1092 HydrophobicContact CB-CE 4.48Å; H1088-M1092 WeakPolarHBondContact O-CB 3.23Å; H1088-M1092 PolarHBondContact O-N 2.85Å; H1088-M1092 VanDerWaalsContact O-N 3.16Å; I1089-M1092 PolarHBondContact O-N 3Å; R1090-M1092 PolarHBondContact O-N 3.19Å; R1090-M1092 VanDerWaalsContact O-N 3.13Å; M1092-Y1095 HydrophobicContact CE-CD1 3.71Å; M1092-A1096 WeakPolarHBondContact O-CB 3.44Å; M1092-A1096 PolarHBondContact O-N 2.68Å; M1092-A1096 VanDerWaalsContact O-N 3.12Å; M1092-L1120 HydrophobicContact CG-CD2 3.89Å
1093	A	94.4	Very high	88.7	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-70.8	-41.9	175.4	0	0	0	0	0	111.8	I1089 R1090 A1096 M1097 L1169 Y1174 L1195	I1089-A1093 PolarHBondContact O-N 3.5Å; I1089-A1093 VanDerWaalsContact O-N 3.16Å; R1090-A1093 WeakPolarHBondContact O-CA 3.3Å; R1090-A1093 WeakPolarHBondContact O-CB 3.25Å; R1090-A1093 PolarHBondContact O-N 3.29Å; A1093-A1096 WeakPolarHBondContact O-CB 3.43Å; A1093-A1096 PolarHBondContact O-N 3.25Å; A1093-M1097 WeakPolarHBondContact O-CG 3.49Å; A1093-M1097 PolarHBondContact O-N 3.21Å; A1093-L1169 HydrophobicContact CB-CD1 4.22Å; A1093-L1169 HydrophobicContact CB-CD2 3.79Å; A1093-Y1174 HydrophobicContact CB-CE1 4.26Å; A1093-L1195 HydrophobicContact CB-CD2 3.99Å
1094	D	94.1	Very high	89.9	Confident	33 Å²	33	36.4 Å²	36.4	18%	0.176	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-43.1	177.2	-59.5	-30.9	0	0	0	111.1	F1057 R1090 A1096 M1097 R1098 Y1174	F1057-D1094 HydrophobicContact CE1-CB 4.01Å; F1057-D1094 HydrophobicContact CZ-CB 4.49Å; R1090-D1094 WeakPolarHBondContact CG-OD2 3.41Å; R1090-D1094 VanDerWaalsContact O-CG 3.28Å; R1090-D1094 PolarHBondContact O-N 3.42Å; D1094-A1096 PolarHBondContact O-N 3.04Å; D1094-M1097 PolarHBondContact O-N 2.9Å; D1094-R1098 WeakPolarHBondContact O-CB 3.34Å; D1094-R1098 PolarHBondContact O-N 3.45Å; D1094-Y1174 VanDerWaalsContact CG-OH 3.27Å; D1094-Y1174 WeakPolarHBondContact OD1-CE1 3.31Å; D1094-Y1174 PolarHBondContact OD1-OH 3.1Å; D1094-Y1174 PolarHBondContact OD2-OH 2.93Å
1095	Y	95.8	Very high	91.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-41.2	173.9	-177.9	-109.8	0	0	0	112.1	M1014 F1048 I1051 I1052 F1057 L1060 Y1070 A1091 M1092 M1097 R1098 M1099	M1014-Y1095 HydrophobicContact CE-CD1 3.78Å; M1014-Y1095 HydrophobicContact CE-CE1 3.62Å; M1014-Y1095 HydrophobicContact SD-CD1 4.47Å; F1048-Y1095 PolarHBondContact O-OH 3.46Å; I1051-Y1095 HydrophobicContact CB-CE2 4.09Å; I1051-Y1095 HydrophobicContact CG2-CD2 3.79Å; I1051-Y1095 HydrophobicContact CG2-CE2 3.69Å; I1052-Y1095 HydrophobicContact CB-CE2 3.63Å; I1052-Y1095 HydrophobicContact CD1-CE1 4.12Å; I1052-Y1095 HydrophobicContact CD1-CE2 4.46Å; I1052-Y1095 HydrophobicContact CG1-CD2 4.47Å; I1052-Y1095 HydrophobicContact CG1-CE1 4.4Å; I1052-Y1095 HydrophobicContact CG1-CE2 3.93Å; F1057-Y1095 HydrophobicContact CD1-CD2 4.25Å; F1057-Y1095 HydrophobicContact CD1-CG 4.44Å; F1057-Y1095 HydrophobicContact CD2-CD2 4.12Å; F1057-Y1095 HydrophobicContact CE1-CD2 4.46Å; F1057-Y1095 HydrophobicContact CE2-CD2 4.32Å; F1057-Y1095 HydrophobicContact CG-CD2 4.09Å; F1057-Y1095 HydrophobicContact CZ-CD2 4.49Å; L1060-Y1095 HydrophobicContact CD1-CD1 4.45Å; L1060-Y1095 HydrophobicContact CD1-CG 4.03Å; Y1070-Y1095 HydrophobicContact CE1-CE1 4.08Å; Y1070-Y1095 VanDerWaalsContact CE1-OH 3.25Å; Y1070-Y1095 WeakPolarHBondContact CE1-OH 3.45Å; Y1070-Y1095 PolarHBondContact OH-OH 2.78Å; A1091-Y1095 WeakPolarHBondContact O-CB 3.45Å; A1091-Y1095 PolarHBondContact O-N 3.47Å; M1092-Y1095 HydrophobicContact CE-CD1 3.71Å; Y1095-M1097 PolarHBondContact O-N 3.23Å; Y1095-R1098 PolarHBondContact O-N 3.18Å; Y1095-M1099 HydrophobicContact CD1-CG 4.4Å; Y1095-M1099 HydrophobicContact CD1-SD 3.88Å; Y1095-M1099 HydrophobicContact CE1-CG 4.05Å; Y1095-M1099 HydrophobicContact CE1-SD 3.26Å; Y1095-M1099 WeakPolarHBondContact CE1-SD 3.41Å; Y1095-M1099 HydrophobicContact CE2-CG 4.19Å; Y1095-M1099 HydrophobicContact CE2-SD 4.4Å; Y1095-M1099 VanDerWaalsContact CZ-SD 3.55Å; Y1095-M1099 WeakPolarHBondContact O-CG 3.34Å; Y1095-M1099 PolarHBondContact O-N 3.28Å
1096	A	95.9	Very high	92.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-39.6	176.3	0	0	0	0	0	112.6	M1014 M1092 A1093 D1094 M1100 I1118 L1120 I1159	M1014-A1096 HydrophobicContact SD-CB 3.76Å; M1092-A1096 WeakPolarHBondContact O-CB 3.44Å; M1092-A1096 PolarHBondContact O-N 2.68Å; M1092-A1096 VanDerWaalsContact O-N 3.12Å; A1093-A1096 WeakPolarHBondContact O-CB 3.43Å; A1093-A1096 PolarHBondContact O-N 3.25Å; D1094-A1096 PolarHBondContact O-N 3.04Å; A1096-M1100 WeakPolarHBondContact O-CG 3.46Å; A1096-M1100 PolarHBondContact O-N 3.31Å; A1096-I1118 HydrophobicContact CB-CD1 3.93Å; A1096-I1118 HydrophobicContact CB-CG2 4.22Å; A1096-I1118 VanDerWaalsContact O-CD1 3.26Å; A1096-I1118 WeakPolarHBondContact O-CD1 3.39Å; A1096-L1120 HydrophobicContact CB-CD1 4.18Å; A1096-I1159 HydrophobicContact CB-CD1 4.02Å; A1096-I1159 HydrophobicContact CB-CG2 4.47Å
1097	M	94	Very high	92.9	Very high	33 Å²	33	33 Å²	33	16%	0.163	15%	0.148	C	C	.	.	H	α-helix	trans	-68.2	-43.5	172.7	-65.4	-174.2	-58.4	0	0	111.4	A1093 D1094 Y1095 M1099 M1100 D1101 I1159 Y1174 L1195 G1198	A1093-M1097 WeakPolarHBondContact O-CG 3.49Å; A1093-M1097 PolarHBondContact O-N 3.21Å; D1094-M1097 PolarHBondContact O-N 2.9Å; Y1095-M1097 PolarHBondContact O-N 3.23Å; M1097-M1099 VanDerWaalsContact C-N 3.34Å; M1097-M1099 PolarHBondContact O-N 3.49Å; M1097-M1100 WeakPolarHBondContact O-CA 3.49Å; M1097-M1100 WeakPolarHBondContact O-CB 3.37Å; M1097-M1100 PolarHBondContact O-N 2.02Å; M1097-D1101 PolarHBondContact O-N 2.93Å; M1097-I1159 HydrophobicContact CG-CD1 3.8Å; M1097-Y1174 HydrophobicContact CE-CD1 4.36Å; M1097-Y1174 HydrophobicContact CE-CE1 3.79Å; M1097-L1195 HydrophobicContact CG-CD2 4.22Å; M1097-L1195 HydrophobicContact SD-CD2 4.33Å; M1097-L1195 HydrophobicContact SD-CG 4.47Å; M1097-G1198 PolarHBondContact SD-N 3.4Å
1098	R	94.8	Very high	93.1	Very high	108 Å²	108	38.7 Å²	38.7	41%	0.408	17%	0.173	S	C	.	.	H	α-helix	trans	-60.9	-39.9	179	-170	63.8	177.8	144	7.2	112.4	I1051 F1057 D1094 Y1095 D1101 Q1102	I1051-R1098 HydrophobicContact CD1-CG 4.39Å; I1051-R1098 HydrophobicContact CG2-CB 4.45Å; I1051-R1098 HydrophobicContact CG2-CG 3.72Å; F1057-R1098 HydrophobicContact CE2-CG 4.41Å; F1057-R1098 HydrophobicContact CZ-CB 4.34Å; D1094-R1098 WeakPolarHBondContact O-CB 3.34Å; D1094-R1098 PolarHBondContact O-N 3.45Å; Y1095-R1098 PolarHBondContact O-N 3.18Å; R1098-D1101 PolarHBondContact O-N 3.17Å; R1098-Q1102 PolarHBondContact O-N 3.03Å
1099	M	95.2	Very high	93	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-37	172.1	-70.3	-179.4	64	0	0	112.6	M1014 A1016 F1048 Y1070 Y1095 M1097 D1101 Q1102 M1103 M1116	M1014-M1099 HydrophobicContact CE-CE 4.42Å; M1014-M1099 HydrophobicContact CE-SD 3.5Å; M1014-M1099 WeakPolarHBondContact CE-SD 3.46Å; A1016-M1099 HydrophobicContact CB-CE 3.8Å; F1048-M1099 HydrophobicContact CB-CE 4.42Å; F1048-M1099 HydrophobicContact CD1-CB 4.44Å; F1048-M1099 HydrophobicContact CD1-CE 3.91Å; F1048-M1099 HydrophobicContact CD1-CG 4Å; F1048-M1099 HydrophobicContact CD2-CE 3.52Å; F1048-M1099 HydrophobicContact CE1-CB 4.16Å; F1048-M1099 HydrophobicContact CE1-CE 3.95Å; F1048-M1099 HydrophobicContact CE1-CG 4.22Å; F1048-M1099 HydrophobicContact CE2-CE 3.56Å; F1048-M1099 HydrophobicContact CG-CE 3.7Å; F1048-M1099 HydrophobicContact CZ-CE 3.78Å; Y1070-M1099 HydrophobicContact CD1-CE 4.27Å; Y1070-M1099 HydrophobicContact CG-CE 4.4Å; Y1095-M1099 HydrophobicContact CD1-CG 4.4Å; Y1095-M1099 HydrophobicContact CD1-SD 3.88Å; Y1095-M1099 HydrophobicContact CE1-CG 4.05Å; Y1095-M1099 HydrophobicContact CE1-SD 3.26Å; Y1095-M1099 WeakPolarHBondContact CE1-SD 3.41Å; Y1095-M1099 HydrophobicContact CE2-CG 4.19Å; Y1095-M1099 HydrophobicContact CE2-SD 4.4Å; Y1095-M1099 VanDerWaalsContact CZ-SD 3.55Å; Y1095-M1099 WeakPolarHBondContact O-CG 3.34Å; Y1095-M1099 PolarHBondContact O-N 3.28Å; M1097-M1099 VanDerWaalsContact C-N 3.34Å; M1097-M1099 PolarHBondContact O-N 3.49Å; M1099-D1101 VanDerWaalsContact C-N 3.32Å; M1099-Q1102 PolarHBondContact O-N 2.85Å; M1099-M1103 PolarHBondContact O-N 3.2Å; M1099-M1116 VanDerWaalsContact C-CE 3.44Å; M1099-M1116 HydrophobicContact CB-CE 3.82Å; M1099-M1116 HydrophobicContact CE-SD 4.01Å; M1099-M1116 WeakPolarHBondContact O-CE 3.46Å
1100	M	93.8	Very high	92.6	Very high	23 Å²	23	45.2 Å²	45.2	11%	0.113	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-36.9	175.8	-77.9	-70.7	-156.3	0	0	111.9	A1096 M1097 K1104 M1116 I1118 R1158 I1159	A1096-M1100 WeakPolarHBondContact O-CG 3.46Å; A1096-M1100 PolarHBondContact O-N 3.31Å; M1097-M1100 WeakPolarHBondContact O-CA 3.49Å; M1097-M1100 WeakPolarHBondContact O-CB 3.37Å; M1097-M1100 PolarHBondContact O-N 2.02Å; M1100-K1104 WeakPolarHBondContact O-CG 3.29Å; M1100-K1104 PolarHBondContact O-N 3.05Å; M1100-M1116 HydrophobicContact CB-CE 4.36Å; M1100-M1116 HydrophobicContact CG-CE 3.89Å; M1100-M1116 HydrophobicContact SD-CB 4.26Å; M1100-M1116 HydrophobicContact SD-CE 3.63Å; M1100-I1118 HydrophobicContact CE-CD1 4.38Å; M1100-I1118 HydrophobicContact CE-CG1 4.06Å; M1100-I1118 HydrophobicContact CG-CD1 4.06Å; M1100-R1158 VanDerWaalsContact CE-C 3.42Å; M1100-R1158 VanDerWaalsContact CE-O 3.29Å; M1100-R1158 WeakPolarHBondContact CE-O 3.37Å; M1100-I1159 HydrophobicContact CE-CG1 3.81Å; M1100-I1159 HydrophobicContact CG-CD1 4.14Å; M1100-I1159 HydrophobicContact CG-CG1 4.05Å
1101	D	93.8	Very high	92.3	Very high	75 Å²	75	50.2 Å²	50.2	40%	0.401	23%	0.231	S	C	.	.	H	α-helix	trans	-73.7	-39	174.4	-70.1	-29.1	0	0	0	112.4	M1097 R1098 M1099 M1103 K1104 Y1105	M1097-D1101 PolarHBondContact O-N 2.93Å; R1098-D1101 PolarHBondContact O-N 3.17Å; M1099-D1101 VanDerWaalsContact C-N 3.32Å; D1101-M1103 VanDerWaalsContact C-N 3.27Å; D1101-M1103 PolarHBondContact O-N 3.36Å; D1101-K1104 WeakPolarHBondContact O-CB 3.44Å; D1101-K1104 PolarHBondContact O-N 2.95Å; D1101-K1104 VanDerWaalsContact O-N 3.09Å; D1101-K1104 WeakPolarHBondContact OD1-CE 3.45Å; D1101-K1104 IonicContact OD1-NZ 3.75Å; D1101-K1104 PolarHBondContact OD1-NZ 3.17Å; D1101-Y1105 PolarHBondContact O-N 3.3Å
1102	Q	94.9	Very high	92	Very high	29 Å²	29	52.5 Å²	52.5	14%	0.136	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-38	173.1	-167.9	64.7	16.8	0	0	111.6	D1047 F1048 I1051 R1098 M1099 K1104 Y1105 I1106	D1047-Q1102 HydrophobicContact CB-CG 4.06Å; D1047-Q1102 PolarHBondContact OD2-NE2 3.24Å; F1048-Q1102 HydrophobicContact CE1-CB 4.37Å; F1048-Q1102 HydrophobicContact CE1-CG 4.41Å; I1051-Q1102 HydrophobicContact CD1-CB 3.83Å; I1051-Q1102 HydrophobicContact CD1-CG 3.77Å; R1098-Q1102 PolarHBondContact O-N 3.03Å; M1099-Q1102 PolarHBondContact O-N 2.85Å; Q1102-K1104 VanDerWaalsContact C-N 3.31Å; Q1102-K1104 PolarHBondContact O-N 2.91Å; Q1102-Y1105 WeakPolarHBondContact O-CB 3.24Å; Q1102-Y1105 PolarHBondContact O-N 2.95Å; Q1102-I1106 HydrophobicContact CG-CD1 3.94Å; Q1102-I1106 HydrophobicContact CG-CG1 4.43Å; Q1102-I1106 WeakPolarHBondContact O-CB 3.49Å; Q1102-I1106 WeakPolarHBondContact O-CD1 3.46Å; Q1102-I1106 VanDerWaalsContact O-CG1 3.26Å; Q1102-I1106 WeakPolarHBondContact O-CG1 3.5Å; Q1102-I1106 PolarHBondContact O-N 3.2Å
1103	M	93.4	Very high	91.8	Very high	5 Å²	5	57 Å²	57	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-34.4	174.9	-170.7	61.1	77.5	0	0	112.8	I1018 I1044 F1048 M1099 D1101 N1107 F1114 M1116	I1018-M1103 HydrophobicContact CD1-CE 3.87Å; I1018-M1103 HydrophobicContact CG1-CE 3.83Å; I1044-M1103 HydrophobicContact CG2-CE 4.19Å; F1048-M1103 HydrophobicContact CZ-CE 3.91Å; M1099-M1103 PolarHBondContact O-N 3.2Å; D1101-M1103 VanDerWaalsContact C-N 3.27Å; D1101-M1103 PolarHBondContact O-N 3.36Å; M1103-N1107 WeakPolarHBondContact O-CB 3.17Å; M1103-N1107 PolarHBondContact O-N 3.41Å; M1103-N1107 PolarHBondContact O-ND2 2.79Å; M1103-F1114 HydrophobicContact CE-CB 4.46Å; M1103-F1114 HydrophobicContact CG-CB 4.47Å; M1103-F1114 HydrophobicContact SD-CB 3.56Å; M1103-F1114 VanDerWaalsContact SD-CB 3.56Å; M1103-F1114 HydrophobicContact SD-CG 4.47Å; M1103-M1116 HydrophobicContact CB-CE 4.28Å; M1103-M1116 HydrophobicContact CE-CB 3.97Å; M1103-M1116 HydrophobicContact CE-CG 4.45Å; M1103-M1116 HydrophobicContact CE-SD 4.14Å; M1103-M1116 HydrophobicContact CG-CB 4.12Å
1104	K	92.1	Very high	91.7	Very high	114 Å²	114	57.3 Å²	57.3	50%	0.496	27%	0.268	S	S	.	.	H	α-helix	trans	-66.1	-47.2	173.1	-61.2	165	-163	165.7	0	110.6	M1100 D1101 Q1102 I1106 N1107 E1108	M1100-K1104 WeakPolarHBondContact O-CG 3.29Å; M1100-K1104 PolarHBondContact O-N 3.05Å; D1101-K1104 WeakPolarHBondContact O-CB 3.44Å; D1101-K1104 PolarHBondContact O-N 2.95Å; D1101-K1104 VanDerWaalsContact O-N 3.09Å; D1101-K1104 WeakPolarHBondContact OD1-CE 3.45Å; D1101-K1104 IonicContact OD1-NZ 3.75Å; D1101-K1104 PolarHBondContact OD1-NZ 3.17Å; Q1102-K1104 VanDerWaalsContact C-N 3.31Å; Q1102-K1104 PolarHBondContact O-N 2.91Å; K1104-I1106 PolarHBondContact O-N 3.11Å; K1104-N1107 WeakPolarHBondContact O-CB 3.04Å; K1104-N1107 PolarHBondContact O-N 3.38Å; K1104-N1107 VanDerWaalsContact O-N 3.16Å; K1104-E1108 WeakPolarHBondContact O-CG 3.33Å; K1104-E1108 PolarHBondContact O-N 3.36Å
1105	Y	92.8	Very high	91.6	Very high	117 Å²	117	58.6 Å²	58.6	46%	0.459	27%	0.272	S	S	.	.	H	α-helix	trans	-57	-47.3	176.6	177.9	-96.9	0	0	0	112	D1101 Q1102 N1107 E1108 H1109	D1101-Y1105 PolarHBondContact O-N 3.3Å; Q1102-Y1105 WeakPolarHBondContact O-CB 3.24Å; Q1102-Y1105 PolarHBondContact O-N 2.95Å; Y1105-N1107 PolarHBondContact O-N 3.31Å; Y1105-E1108 PolarHBondContact O-N 3.32Å; Y1105-H1109 AromaticContact CD2-CE1 3.45Å; Y1105-H1109 VanDerWaalsContact CD2-CE1 3.45Å; Y1105-H1109 WeakPolarHBondContact CD2-CE1 3.43Å; Y1105-H1109 AromaticContact CD2-ND1 3.61Å; Y1105-H1109 AromaticContact CE2-CE1 3.07Å; Y1105-H1109 WeakPolarHBondContact CE2-CE1 3.45Å; Y1105-H1109 AromaticContact CE2-ND1 3.46Å; Y1105-H1109 WeakPolarHBondContact CE2-ND1 3Å; Y1105-H1109 AromaticContact CE2-NE2 3.52Å; Y1105-H1109 AromaticContact CZ-CD2 3.99Å; Y1105-H1109 AromaticContact CZ-CE1 3.66Å; Y1105-H1109 AromaticContact CZ-CG 3.97Å; Y1105-H1109 AromaticContact CZ-ND1 3.73Å; Y1105-H1109 AromaticContact CZ-NE2 3.8Å; Y1105-H1109 PolarHBondContact O-N 3.07Å; Y1105-H1109 PolarHBondContact O-ND1 2.91Å
1106	I	91.2	Very high	91.5	Very high	13 Å²	13	58.8 Å²	58.8	7%	0.067	27%	0.273	C	S	.	.	H	α-helix	trans	-59	-44.7	175.1	-69.6	161	0	0	0	111.1	I1044 D1047 Q1102 K1104 H1109 S1110	I1044-I1106 HydrophobicContact CD1-CG2 4.46Å; I1044-I1106 HydrophobicContact CG1-CD1 4.24Å; I1044-I1106 HydrophobicContact CG1-CG2 4.08Å; I1044-I1106 HydrophobicContact CG2-CD1 4.32Å; D1047-I1106 HydrophobicContact CB-CD1 4.46Å; D1047-I1106 WeakPolarHBondContact OD2-CD1 3.03Å; D1047-I1106 WeakPolarHBondContact OD2-CG1 3.28Å; Q1102-I1106 HydrophobicContact CG-CD1 3.94Å; Q1102-I1106 HydrophobicContact CG-CG1 4.43Å; Q1102-I1106 WeakPolarHBondContact O-CB 3.49Å; Q1102-I1106 WeakPolarHBondContact O-CD1 3.46Å; Q1102-I1106 VanDerWaalsContact O-CG1 3.26Å; Q1102-I1106 WeakPolarHBondContact O-CG1 3.5Å; Q1102-I1106 PolarHBondContact O-N 3.2Å; K1104-I1106 PolarHBondContact O-N 3.11Å; I1106-H1109 PolarHBondContact O-N 2.99Å; I1106-S1110 VanDerWaalsContact O-CB 3.23Å; I1106-S1110 WeakPolarHBondContact O-CB 3.38Å; I1106-S1110 PolarHBondContact O-N 3Å; I1106-S1110 PolarHBondContact O-OG 3.41Å
1107	N	91.9	Very high	91.5	Very high	26 Å²	26	60.2 Å²	60.2	14%	0.139	28%	0.279	C	S	.	.	H	α-helix	trans	-61.5	-44.7	178.1	-77.3	-24	0	0	0	112.2	M1103 K1104 Y1105 H1109 F1111 N1112 F1114	M1103-N1107 WeakPolarHBondContact O-CB 3.17Å; M1103-N1107 PolarHBondContact O-N 3.41Å; M1103-N1107 PolarHBondContact O-ND2 2.79Å; K1104-N1107 WeakPolarHBondContact O-CB 3.04Å; K1104-N1107 PolarHBondContact O-N 3.38Å; K1104-N1107 VanDerWaalsContact O-N 3.16Å; Y1105-N1107 PolarHBondContact O-N 3.31Å; N1107-H1109 VanDerWaalsContact C-N 3.35Å; N1107-H1109 PolarHBondContact O-N 2.81Å; N1107-F1111 PolarHBondContact O-N 2.9Å; N1107-F1111 VanDerWaalsContact O-N 3.13Å; N1107-N1112 WeakPolarHBondContact CA-O 3.43Å; N1107-N1112 VanDerWaalsContact CB-O 3.27Å; N1107-N1112 WeakPolarHBondContact CB-O 3.45Å; N1107-N1112 PolarHBondContact O-N 3.43Å; N1107-N1112 PolarHBondContact OD1-O 3.32Å; N1107-F1114 PolarHBondContact ND2-N 2.83Å; N1107-F1114 PolarHBondContact ND2-O 2.9Å; N1107-F1114 WeakPolarHBondContact OD1-CB 3.47Å; N1107-F1114 WeakPolarHBondContact OD1-CD2 3.32Å; N1107-F1114 PolarHBondContact OD1-N 3.33Å
1108	E	90.4	Very high	91.6	Very high	136 Å²	136	58.7 Å²	58.7	64%	0.636	27%	0.272	S	S	*	.	H	α-helix	trans	-60.6	-40.3	176.6	-71.7	172.7	-178.1	0	0	112.6	K1104 Y1105	K1104-E1108 WeakPolarHBondContact O-CG 3.33Å; K1104-E1108 PolarHBondContact O-N 3.36Å; Y1105-E1108 PolarHBondContact O-N 3.32Å
1109	H	86.1	Confident	91.7	Very high	108 Å²	108	53.5 Å²	53.5	50%	0.5	25%	0.252	S	S	.	.	H	α-helix	trans	-91	-23.4	-173.7	-67.5	71.3	0	0	0	113.9	Y1105 I1106 N1107	Y1105-H1109 AromaticContact CD2-CE1 3.45Å; Y1105-H1109 VanDerWaalsContact CD2-CE1 3.45Å; Y1105-H1109 WeakPolarHBondContact CD2-CE1 3.43Å; Y1105-H1109 AromaticContact CD2-ND1 3.61Å; Y1105-H1109 AromaticContact CE2-CE1 3.07Å; Y1105-H1109 WeakPolarHBondContact CE2-CE1 3.45Å; Y1105-H1109 AromaticContact CE2-ND1 3.46Å; Y1105-H1109 WeakPolarHBondContact CE2-ND1 3Å; Y1105-H1109 AromaticContact CE2-NE2 3.52Å; Y1105-H1109 AromaticContact CZ-CD2 3.99Å; Y1105-H1109 AromaticContact CZ-CE1 3.66Å; Y1105-H1109 AromaticContact CZ-CG 3.97Å; Y1105-H1109 AromaticContact CZ-ND1 3.73Å; Y1105-H1109 AromaticContact CZ-NE2 3.8Å; Y1105-H1109 PolarHBondContact O-N 3.07Å; Y1105-H1109 PolarHBondContact O-ND1 2.91Å; I1106-H1109 PolarHBondContact O-N 2.99Å; N1107-H1109 VanDerWaalsContact C-N 3.35Å; N1107-H1109 PolarHBondContact O-N 2.81Å
1110	S	83.2	Confident	91.8	Very high	33 Å²	33	53.7 Å²	53.7	23%	0.231	25%	0.253	C	S	.	.	H	α-helix	trans	-97.4	-1.5	176.8	68.7	0	0	0	0	114	I1106 N1112	I1106-S1110 VanDerWaalsContact O-CB 3.23Å; I1106-S1110 WeakPolarHBondContact O-CB 3.38Å; I1106-S1110 PolarHBondContact O-N 3Å; I1106-S1110 PolarHBondContact O-OG 3.41Å; S1110-N1112 PolarHBondContact O-N 3.33Å; S1110-N1112 PolarHBondContact O-ND2 3.18Å
1111	F	83.7	Confident	91.9	Very high	194 Å²	194	52.9 Å²	52.9	85%	0.851	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	27.4	-173.5	-56.9	-84.4	0	0	0	114.4	N1107	N1107-F1111 PolarHBondContact O-N 2.9Å; N1107-F1111 VanDerWaalsContact O-N 3.13Å
1112	N	86.3	Confident	91.9	Very high	52 Å²	52	50.3 Å²	50.3	28%	0.278	24%	0.235	S	C	.	.			trans	-107.4	176	177.1	-77.8	-83.2	0	0	0	112	F1024 N1107 S1110 F1114	F1024-N1112 WeakPolarHBondContact CE2-OD1 3.36Å; N1107-N1112 WeakPolarHBondContact CA-O 3.43Å; N1107-N1112 VanDerWaalsContact CB-O 3.27Å; N1107-N1112 WeakPolarHBondContact CB-O 3.45Å; N1107-N1112 PolarHBondContact O-N 3.43Å; N1107-N1112 PolarHBondContact OD1-O 3.32Å; S1110-N1112 PolarHBondContact O-N 3.33Å; S1110-N1112 PolarHBondContact O-ND2 3.18Å; N1112-F1114 HydrophobicContact CB-CD2 3.75Å; N1112-F1114 HydrophobicContact CB-CE2 3.41Å; N1112-F1114 VanDerWaalsContact CB-CE2 3.41Å; N1112-F1114 HydrophobicContact CB-CZ 4Å
1113	N	90.1	Very high	91.6	Very high	98 Å²	98	49.6 Å²	49.6	52%	0.524	24%	0.236	S	C	.	.			trans	-136.7	61.1	177.9	-170.3	-6	0	0	0	110.2	N1020	N1020-N1113 PolarHBondContact ND2-O 3.46Å
1114	F	92.8	Very high	91.4	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.026	26%	0.26	C	S	.	.			trans	-70.8	123.8	175	-65.3	-63.1	0	0	0	110.6	I1018 N1020 F1021 F1024 L1040 I1044 M1103 N1107 N1112	I1018-F1114 HydrophobicContact CG2-CB 3.9Å; I1018-F1114 HydrophobicContact CG2-CD1 3.93Å; I1018-F1114 HydrophobicContact CG2-CG 4.25Å; N1020-F1114 WeakPolarHBondContact OD1-CA 3.49Å; F1021-F1114 HydrophobicContact CD2-CE1 4.04Å; F1024-F1114 HydrophobicContact CB-CE1 3.87Å; F1024-F1114 AromaticContact CD1-CE1 3.72Å; F1024-F1114 HydrophobicContact CD1-CE1 3.72Å; F1024-F1114 AromaticContact CD1-CZ 3.78Å; F1024-F1114 HydrophobicContact CD1-CZ 3.78Å; F1024-F1114 HydrophobicContact CD2-CE1 4.11Å; F1024-F1114 AromaticContact CD2-CZ 3.97Å; F1024-F1114 HydrophobicContact CD2-CZ 3.97Å; F1024-F1114 HydrophobicContact CE1-CE1 4.28Å; F1024-F1114 AromaticContact CE1-CZ 3.86Å; F1024-F1114 HydrophobicContact CE1-CZ 3.86Å; F1024-F1114 HydrophobicContact CE2-CZ 4.06Å; F1024-F1114 AromaticContact CG-CE1 3.63Å; F1024-F1114 HydrophobicContact CG-CE1 3.63Å; F1024-F1114 AromaticContact CG-CZ 3.84Å; F1024-F1114 HydrophobicContact CG-CZ 3.84Å; F1024-F1114 HydrophobicContact CZ-CZ 4.02Å; L1040-F1114 HydrophobicContact CD2-CE2 3.81Å; L1040-F1114 HydrophobicContact CD2-CZ 3.81Å; L1040-F1114 HydrophobicContact CG-CE2 4.49Å; I1044-F1114 HydrophobicContact CD1-CD2 4.26Å; I1044-F1114 HydrophobicContact CD1-CE2 4.18Å; M1103-F1114 HydrophobicContact CE-CB 4.46Å; M1103-F1114 HydrophobicContact CG-CB 4.47Å; M1103-F1114 HydrophobicContact SD-CB 3.56Å; M1103-F1114 VanDerWaalsContact SD-CB 3.56Å; M1103-F1114 HydrophobicContact SD-CG 4.47Å; N1107-F1114 PolarHBondContact ND2-N 2.83Å; N1107-F1114 PolarHBondContact ND2-O 2.9Å; N1107-F1114 WeakPolarHBondContact OD1-CB 3.47Å; N1107-F1114 WeakPolarHBondContact OD1-CD2 3.32Å; N1107-F1114 PolarHBondContact OD1-N 3.33Å; N1112-F1114 HydrophobicContact CB-CD2 3.75Å; N1112-F1114 HydrophobicContact CB-CE2 3.41Å; N1112-F1114 VanDerWaalsContact CB-CE2 3.41Å; N1112-F1114 HydrophobicContact CB-CZ 4Å
1115	K	92.3	Very high	91.2	Very high	61 Å²	61	48.1 Å²	48.1	27%	0.265	24%	0.238	S	C	.	.			trans	-105.5	93	-177.6	-66.3	-175.1	175.7	-74.1	0	110.7	S1019 N1020 P1156 E1157	S1019-K1115 WeakPolarHBondContact CB-O 3.16Å; S1019-K1115 PolarHBondContact N-O 2.98Å; S1019-K1115 PolarHBondContact OG-O 3.16Å; N1020-K1115 PolarHBondContact OD1-N 3.48Å; K1115-P1156 HydrophobicContact CB-CB 4.11Å; K1115-P1156 HydrophobicContact CD-CB 4.45Å; K1115-E1157 HydrophobicContact CB-CG 4.43Å; K1115-E1157 HydrophobicContact CG-CG 4.34Å; K1115-E1157 IonicContact NZ-OE1 3.16Å; K1115-E1157 PolarHBondContact NZ-OE1 3Å; K1115-E1157 IonicContact NZ-OE2 3.99Å; K1115-E1157 PolarHBondContact NZ-OE2 3.39Å
1116	M	93.2	Very high	90.8	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	148.2	173.4	-166.6	171	58.6	0	0	111.3	A1016 S1017 F1048 M1099 M1100 M1103 I1118 E1157	A1016-M1116 HydrophobicContact CB-SD 4.13Å; S1017-M1116 WeakPolarHBondContact O-CA 3.41Å; F1048-M1116 HydrophobicContact CZ-SD 4.13Å; M1099-M1116 VanDerWaalsContact C-CE 3.44Å; M1099-M1116 HydrophobicContact CB-CE 3.82Å; M1099-M1116 HydrophobicContact CE-SD 4.01Å; M1099-M1116 WeakPolarHBondContact O-CE 3.46Å; M1100-M1116 HydrophobicContact CB-CE 4.36Å; M1100-M1116 HydrophobicContact CG-CE 3.89Å; M1100-M1116 HydrophobicContact SD-CB 4.26Å; M1100-M1116 HydrophobicContact SD-CE 3.63Å; M1103-M1116 HydrophobicContact CB-CE 4.28Å; M1103-M1116 HydrophobicContact CE-CB 3.97Å; M1103-M1116 HydrophobicContact CE-CG 4.45Å; M1103-M1116 HydrophobicContact CE-SD 4.14Å; M1103-M1116 HydrophobicContact CG-CB 4.12Å; M1116-I1118 HydrophobicContact CE-CD1 3.86Å; M1116-I1118 HydrophobicContact CE-CG1 4.25Å; M1116-I1118 HydrophobicContact CG-CG1 4.36Å; M1116-I1118 HydrophobicContact SD-CD1 4.45Å; M1116-I1118 HydrophobicContact SD-CG1 4.44Å; M1116-E1157 WeakPolarHBondContact O-CA 3.27Å; M1116-E1157 PolarHBondContact O-N 3.31Å
1117	K	95	Very high	90.6	Very high	31 Å²	31	42.8 Å²	42.8	14%	0.135	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155.2	165.6	52.6	170.8	-171.5	164.4	0	108.1	A1016 S1017 S1019 D1151	A1016-K1117 WeakPolarHBondContact CA-O 3.34Å; S1017-K1117 PolarHBondContact N-O 3.47Å; S1017-K1117 WeakPolarHBondContact O-CG 3.34Å; S1017-K1117 PolarHBondContact O-N 2.84Å; S1019-K1117 WeakPolarHBondContact OG-CG 3.48Å; K1117-D1151 WeakPolarHBondContact CD-O 3.45Å; K1117-D1151 WeakPolarHBondContact CE-O 3.02Å; K1117-D1151 VanDerWaalsContact CE-OD1 3.32Å; K1117-D1151 WeakPolarHBondContact CE-OD1 3.47Å; K1117-D1151 WeakPolarHBondContact CG-OD1 3.44Å; K1117-D1151 PolarHBondContact NZ-O 2.91Å; K1117-D1151 IonicContact NZ-OD1 2.73Å; K1117-D1151 IonicContact NZ-OD2 2.82Å
1118	I	97.1	Very high	90.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.1	-179.6	-57.4	-176.4	0	0	0	110	M1014 F1015 A1016 A1096 M1100 M1116 L1120 R1158 I1159 Q1160	M1014-I1118 HydrophobicContact CG-CG2 3.49Å; M1014-I1118 VanDerWaalsContact CG-CG2 3.49Å; M1014-I1118 HydrophobicContact SD-CD1 4.32Å; M1014-I1118 HydrophobicContact SD-CG2 3.61Å; F1015-I1118 CarbonylContact O-C 3.45Å; F1015-I1118 WeakPolarHBondContact O-CA 3.39Å; A1016-I1118 HydrophobicContact CB-CD1 4.16Å; A1016-I1118 HydrophobicContact CB-CG1 3.76Å; A1016-I1118 HydrophobicContact CB-CG2 4.47Å; A1096-I1118 HydrophobicContact CB-CD1 3.93Å; A1096-I1118 HydrophobicContact CB-CG2 4.22Å; A1096-I1118 VanDerWaalsContact O-CD1 3.26Å; A1096-I1118 WeakPolarHBondContact O-CD1 3.39Å; M1100-I1118 HydrophobicContact CE-CD1 4.38Å; M1100-I1118 HydrophobicContact CE-CG1 4.06Å; M1100-I1118 HydrophobicContact CG-CD1 4.06Å; M1116-I1118 HydrophobicContact CE-CD1 3.86Å; M1116-I1118 HydrophobicContact CE-CG1 4.25Å; M1116-I1118 HydrophobicContact CG-CG1 4.36Å; M1116-I1118 HydrophobicContact SD-CD1 4.45Å; M1116-I1118 HydrophobicContact SD-CG1 4.44Å; I1118-L1120 HydrophobicContact CG2-CD2 4.36Å; I1118-L1120 HydrophobicContact CG2-CG 4.21Å; I1118-R1158 PolarHBondContact N-O 2.87Å; I1118-I1159 HydrophobicContact CB-CB 4.44Å; I1118-I1159 HydrophobicContact CB-CG1 4.19Å; I1118-I1159 HydrophobicContact CB-CG2 4.18Å; I1118-I1159 HydrophobicContact CD1-CG1 4.31Å; I1118-I1159 HydrophobicContact CG2-CG2 4.18Å; I1118-I1159 CarbonylContact O-C 3.58Å; I1118-I1159 WeakPolarHBondContact O-CA 3.43Å; I1118-Q1160 PolarHBondContact O-N 3.34Å
1119	G	96.9	Very high	89.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.6	168.2	0	0	0	0	0	111.7	M1014 F1015	M1014-G1119 WeakPolarHBondContact CA-O 3.45Å; F1015-G1119 PolarHBondContact N-O 3.46Å; F1015-G1119 PolarHBondContact O-N 3.43Å
1120	L	96.8	Very high	89.4	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.9	175.8	-63.1	171.5	0	0	0	111.5	M1014 M1092 A1096 I1118 I1159 Q1160 V1161 L1165	M1014-L1120 HydrophobicContact CB-CD2 3.52Å; M1014-L1120 HydrophobicContact CG-CD2 3.53Å; M1014-L1120 HydrophobicContact SD-CD2 4.06Å; M1092-L1120 HydrophobicContact CG-CD2 3.89Å; A1096-L1120 HydrophobicContact CB-CD1 4.18Å; I1118-L1120 HydrophobicContact CG2-CD2 4.36Å; I1118-L1120 HydrophobicContact CG2-CG 4.21Å; L1120-I1159 HydrophobicContact CD1-CG2 3.66Å; L1120-I1159 HydrophobicContact CG-CG2 4.14Å; L1120-Q1160 PolarHBondContact N-O 2.73Å; L1120-V1161 HydrophobicContact CB-CG1 4.15Å; L1120-V1161 HydrophobicContact CD1-CG1 4.11Å; L1120-L1165 HydrophobicContact CB-CD2 3.41Å; L1120-L1165 VanDerWaalsContact CB-CD2 3.41Å; L1120-L1165 HydrophobicContact CD1-CD2 4.31Å; L1120-L1165 HydrophobicContact CG-CD2 4.47Å
1121	N	95.4	Very high	88.7	Confident	7 Å²	7	29 Å²	29	4%	0.037	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	160.1	167.9	-177.1	51.1	0	0	0	111.3	V1013 T1143 V1146 A1147 T1162	V1013-N1121 PolarHBondContact N-O 3.05Å; V1013-N1121 PolarHBondContact O-N 3.09Å; V1013-N1121 VanDerWaalsContact O-N 3.15Å; N1121-T1143 PolarHBondContact ND2-O 3.19Å; N1121-V1146 HydrophobicContact CB-CG1 4.09Å; N1121-A1147 HydrophobicContact CB-CB 3.92Å; N1121-T1162 HydrophobicContact CB-CG2 4.1Å; N1121-T1162 WeakPolarHBondContact OD1-CB 3.49Å; N1121-T1162 WeakPolarHBondContact OD1-CG2 3.35Å; N1121-T1162 PolarHBondContact OD1-OG1 2.85Å
1122	I	93.4	Very high	87.5	Confident	20 Å²	20	24.1 Å²	24.1	10%	0.103	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	156.5	174.3	57.3	172.9	0	0	0	111.9	V1011 A1012 I1089 T1143 D1164 L1165 V1168	V1011-I1122 WeakPolarHBondContact O-CA 3.38Å; A1012-I1122 HydrophobicContact CB-CG2 3.84Å; I1089-I1122 HydrophobicContact CD1-CG2 4.14Å; I1089-I1122 HydrophobicContact CG2-CG2 4.03Å; I1122-T1143 VanDerWaalsContact C-CG2 3.49Å; I1122-D1164 HydrophobicContact CD1-CB 4.46Å; I1122-D1164 HydrophobicContact CG1-CB 4.35Å; I1122-L1165 HydrophobicContact CD1-CB 4.36Å; I1122-L1165 HydrophobicContact CD1-CD1 4.46Å; I1122-L1165 HydrophobicContact CG1-CB 4.15Å; I1122-L1165 HydrophobicContact CG2-CD1 3.82Å; I1122-V1168 HydrophobicContact CD1-CB 4.46Å; I1122-V1168 HydrophobicContact CD1-CG2 3.7Å
1123	G	90.3	Very high	86.1	Confident	15 Å²	15	31.4 Å²	31.4	16%	0.155	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.2	-169.8	174.6	0	0	0	0	0	113.4	E1009 V1011 T1143	E1009-G1123 CarbonylContact O-C 3.58Å; V1011-G1123 PolarHBondContact N-O 3.2Å; V1011-G1123 PolarHBondContact O-N 2.88Å; G1123-T1143 VanDerWaalsContact C-OG1 3.26Å; G1123-T1143 WeakPolarHBondContact CA-OG1 3.26Å
1124	P	87.9	Confident	85	Confident	83 Å²	83	29.2 Å²	29.2	54%	0.539	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	146.8	179.3	30	-34.9	0	0	0	112.4	C1008 E1009 T1143	C1008-P1124 CarbonylContact O-C 3.55Å; C1008-P1124 VanDerWaalsContact O-CA 3.27Å; C1008-P1124 WeakPolarHBondContact O-CA 3.17Å; E1009-P1124 WeakPolarHBondContact O-CA 3.15Å; P1124-T1143 WeakPolarHBondContact O-CB 3.06Å; P1124-T1143 PolarHBondContact O-OG1 3.06Å
1125	V	87.7	Confident	84	Confident	5 Å²	5	30.2 Å²	30.2	3%	0.03	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	160.1	171.2	-61	0	0	0	0	110.7	C1008 V1011 V1013 L1076 W1140 T1143 V1144	C1008-V1125 HydrophobicContact CB-CG2 3.98Å; C1008-V1125 PolarHBondContact N-O 3.48Å; C1008-V1125 PolarHBondContact O-N 2.87Å; V1011-V1125 HydrophobicContact CB-CG1 4.44Å; V1011-V1125 HydrophobicContact CB-CG2 3.75Å; V1011-V1125 HydrophobicContact CG1-CG1 4.48Å; V1011-V1125 HydrophobicContact CG1-CG2 3.95Å; V1011-V1125 HydrophobicContact CG2-CG2 3.58Å; V1013-V1125 HydrophobicContact CG2-CG1 4.33Å; L1076-V1125 HydrophobicContact CD2-CG2 4Å; V1125-W1140 WeakPolarHBondContact CA-O 3.35Å; V1125-W1140 WeakPolarHBondContact CB-O 3.31Å; V1125-T1143 HydrophobicContact CG1-CG2 4.13Å; V1125-V1144 HydrophobicContact CG1-CG2 3.83Å
1126	V	86	Confident	83.2	Confident	18 Å²	18	28.5 Å²	28.5	11%	0.109	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.4	165.8	-178.4	0	0	0	0	107.8	A435 V439 I1139 W1140	A435-V1126 HydrophobicContact CB-CB 4.36Å; A435-V1126 HydrophobicContact CB-CG1 3.86Å; A435-V1126 HydrophobicContact CB-CG2 3.56Å; V439-V1126 HydrophobicContact CG2-CG1 3.76Å; V1126-I1139 CarbonylContact O-C 3.46Å; V1126-I1139 WeakPolarHBondContact O-CA 3.27Å; V1126-W1140 PolarHBondContact N-O 2.93Å; V1126-W1140 PolarHBondContact O-N 3.36Å
1127	A	86.8	Confident	82.8	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	150.1	170.7	0	0	0	0	0	109.9	Y1005 Q1006 L1076 Y1137 I1139	Y1005-A1127 CarbonylContact C-O 3.5Å; Y1005-A1127 WeakPolarHBondContact CA-O 3.37Å; Q1006-A1127 PolarHBondContact N-O 3.29Å; Q1006-A1127 PolarHBondContact O-N 2.94Å; L1076-A1127 HydrophobicContact CD2-CB 4.18Å; A1127-Y1137 HydrophobicContact CB-CE2 4.18Å; A1127-I1139 HydrophobicContact CB-CG2 3.94Å
1128	G	84.3	Confident	82.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174	175	178.7	0	0	0	0	0	113.8	Y1004 Y1137 D1138	Y1004-G1128 VanDerWaalsContact O-CA 3.24Å; Y1004-G1128 WeakPolarHBondContact O-CA 3.15Å; G1128-Y1137 WeakPolarHBondContact O-CA 3.38Å; G1128-D1138 PolarHBondContact N-O 3.31Å; G1128-D1138 PolarHBondContact O-N 3.19Å; G1128-D1138 VanDerWaalsContact O-N 3.1Å
1129	V	81	Confident	82	Confident	7 Å²	7	27.9 Å²	27.9	4%	0.042	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.7	173.7	178.2	0	0	0	0	109.7	V989 F993 Y1004 P1135 Q1136 Y1137	V989-V1129 HydrophobicContact CG1-CG2 3.71Å; F993-V1129 HydrophobicContact CE2-CB 4.31Å; F993-V1129 HydrophobicContact CE2-CG1 4.33Å; F993-V1129 HydrophobicContact CE2-CG2 4.05Å; F993-V1129 HydrophobicContact CZ-CB 4.24Å; F993-V1129 HydrophobicContact CZ-CG1 4.15Å; F993-V1129 HydrophobicContact CZ-CG2 4.48Å; Y1004-V1129 HydrophobicContact CD1-CG2 4.05Å; Y1004-V1129 PolarHBondContact O-N 3.28Å; V1129-P1135 HydrophobicContact CG1-CB 3.51Å; V1129-Q1136 WeakPolarHBondContact CA-O 3.24Å; V1129-Y1137 HydrophobicContact CG2-CD2 3.98Å
1130	I	77.9	Confident	81.5	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.015	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	142.6	179.7	-70.6	-172.8	0	0	0	110.8	L442 F446 I463 P1135 Q1136 W1140	L442-I1130 HydrophobicContact CB-CD1 3.88Å; L442-I1130 HydrophobicContact CD1-CD1 4.45Å; F446-I1130 HydrophobicContact CB-CG2 4.09Å; F446-I1130 HydrophobicContact CD2-CD1 3.98Å; F446-I1130 HydrophobicContact CD2-CG2 3.9Å; F446-I1130 HydrophobicContact CE2-CD1 4.22Å; F446-I1130 HydrophobicContact CG-CG2 4.45Å; I463-I1130 HydrophobicContact CD1-CG2 4.06Å; I1130-P1135 WeakPolarHBondContact O-CA 3.22Å; I1130-Q1136 PolarHBondContact N-O 3.41Å; I1130-Q1136 PolarHBondContact O-N 3.08Å; I1130-W1140 HydrophobicContact CD1-CH2 3.49Å; I1130-W1140 VanDerWaalsContact CD1-CH2 3.49Å; I1130-W1140 HydrophobicContact CD1-CZ2 3.36Å; I1130-W1140 HydrophobicContact CD1-CZ3 4.43Å; I1130-W1140 HydrophobicContact CG1-CH2 3.72Å; I1130-W1140 HydrophobicContact CG1-CZ2 4.07Å
1131	G	67.9	Low	80.7	Confident	4 Å²	4	29.3 Å²	29.3	4%	0.041	17%	0.166	C	C	.	.			trans	97	96.7	166.6	0	0	0	0	0	114.2	N443 R1133 K1134 P1135	N443-G1131 PolarHBondContact OD1-N 2.92Å; G1131-R1133 PolarHBondContact O-N 3.3Å; G1131-K1134 CarbonylContact O-C 3.56Å; G1131-K1134 PolarHBondContact O-N 2.97Å; G1131-P1135 WeakPolarHBondContact O-CA 3.33Å; G1131-P1135 VanDerWaalsContact O-N 3.11Å
1132	A	58.5	Low	80.1	Confident	91 Å²	91	33 Å²	33	75%	0.752	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.7	-175.6	0	0	0	0	0	115.8
1133	R	55.8	Low	80	Confident	204 Å²	204	32.2 Å²	32.2	77%	0.77	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-14.6	176	-67.9	-175.6	176	-159.8	-2.8	114.4	S382 G1131	S382-R1133 VanDerWaalsContact CB-O 3.29Å; S382-R1133 WeakPolarHBondContact CB-O 3.14Å; G1131-R1133 PolarHBondContact O-N 3.3Å
1134	K	68.3	Low	79.9	Confident	52 Å²	52	32.1 Å²	32.1	23%	0.226	18%	0.178	C	C	.	.	S	Bend	trans	-148.9	71.5	-173.9	-73.5	-146.9	167.7	-168.7	0	108.6	S382 R460 G1131 Q1136	S382-K1134 VanDerWaalsContact O-CD 3.25Å; S382-K1134 WeakPolarHBondContact O-CD 3.34Å; S382-K1134 WeakPolarHBondContact O-CG 3.32Å; R460-K1134 PolarHBondContact NH2-O 3.02Å; G1131-K1134 CarbonylContact O-C 3.56Å; G1131-K1134 PolarHBondContact O-N 2.97Å; K1134-Q1136 PolarHBondContact O-N 3.17Å
1135	P	70.8	Confident	79.9	Confident	28 Å²	28	30.8 Å²	30.8	18%	0.182	17%	0.167	C	C	.	.			trans	-66.7	115.1	-172.4	26.1	-33.7	0	0	0	110.6	V1129 I1130 G1131	V1129-P1135 HydrophobicContact CG1-CB 3.51Å; I1130-P1135 WeakPolarHBondContact O-CA 3.22Å; G1131-P1135 WeakPolarHBondContact O-CA 3.33Å; G1131-P1135 VanDerWaalsContact O-N 3.11Å
1136	Q	76.5	Confident	80	Confident	24 Å²	24	30.9 Å²	30.9	11%	0.112	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.3	175.4	-174.8	161.9	17.9	0	0	109.6	V1129 I1130 K1134	V1129-Q1136 WeakPolarHBondContact CA-O 3.24Å; I1130-Q1136 PolarHBondContact N-O 3.41Å; I1130-Q1136 PolarHBondContact O-N 3.08Å; K1134-Q1136 PolarHBondContact O-N 3.17Å
1137	Y	84.6	Confident	80.3	Confident	14 Å²	14	30 Å²	30	6%	0.055	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	132.3	168.4	-179.4	-98	0	0	0	109.7	P986 V989 Y1004 I1063 A1127 G1128 V1129	P986-Y1137 HydrophobicContact CG-CD1 3.62Å; P986-Y1137 HydrophobicContact CG-CD2 4.11Å; P986-Y1137 HydrophobicContact CG-CE1 3.68Å; P986-Y1137 HydrophobicContact CG-CE2 4.16Å; P986-Y1137 HydrophobicContact CG-CG 3.84Å; V989-Y1137 HydrophobicContact CG1-CD2 4.45Å; V989-Y1137 HydrophobicContact CG2-CD2 4Å; V989-Y1137 HydrophobicContact CG2-CE2 3.83Å; Y1004-Y1137 HydrophobicContact CE1-CE2 4.25Å; I1063-Y1137 HydrophobicContact CD1-CE1 4.15Å; A1127-Y1137 HydrophobicContact CB-CE2 4.18Å; G1128-Y1137 WeakPolarHBondContact O-CA 3.38Å; V1129-Y1137 HydrophobicContact CG2-CD2 3.98Å
1138	D	86.9	Confident	80.5	Confident	5 Å²	5	31.8 Å²	31.8	3%	0.027	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	170.8	-178.1	-158.4	12.9	0	0	0	111.2	K1064 G1128 W1140	K1064-D1138 WeakPolarHBondContact CE-OD1 3.33Å; K1064-D1138 IonicContact NZ-OD1 3.68Å; K1064-D1138 PolarHBondContact NZ-OD1 2.72Å; K1064-D1138 IonicContact NZ-OD2 2.64Å; K1064-D1138 PolarHBondContact NZ-OD2 2.57Å; G1128-D1138 PolarHBondContact N-O 3.31Å; G1128-D1138 PolarHBondContact O-N 3.19Å; G1128-D1138 VanDerWaalsContact O-N 3.1Å; D1138-W1140 HydrophobicContact CB-CH2 3.67Å; D1138-W1140 HydrophobicContact CB-CZ2 3.66Å; D1138-W1140 HydrophobicContact CB-CZ3 4.35Å; D1138-W1140 WeakPolarHBondContact O-CZ3 3.41Å
1139	I	88.3	Confident	80.8	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.015	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136	179.2	62.1	171.9	0	0	0	112.2	V1013 I1063 M1071 A1073 L1076 V1126 A1127 V1144	V1013-I1139 HydrophobicContact CG1-CD1 4.47Å; V1013-I1139 HydrophobicContact CG2-CD1 4.1Å; I1063-I1139 HydrophobicContact CD1-CD1 4.39Å; I1063-I1139 HydrophobicContact CD1-CG2 4.46Å; I1063-I1139 HydrophobicContact CG1-CD1 4.2Å; I1063-I1139 HydrophobicContact CG1-CG1 4.45Å; I1063-I1139 HydrophobicContact CG2-CG1 4.46Å; M1071-I1139 HydrophobicContact CE-CD1 3.86Å; M1071-I1139 HydrophobicContact CE-CG1 3.64Å; A1073-I1139 HydrophobicContact CB-CD1 3.74Å; L1076-I1139 HydrophobicContact CD1-CG2 4.18Å; L1076-I1139 HydrophobicContact CD2-CG2 3.82Å; V1126-I1139 CarbonylContact O-C 3.46Å; V1126-I1139 WeakPolarHBondContact O-CA 3.27Å; A1127-I1139 HydrophobicContact CB-CG2 3.94Å; I1139-V1144 HydrophobicContact CD1-CG2 4.02Å; I1139-V1144 HydrophobicContact CG1-CG2 3.96Å
1140	W	85.4	Confident	81.4	Confident	9 Å²	9	36 Å²	36	3%	0.034	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	153.7	-179.5	-57.8	-90.5	0	0	0	112	G465 V1125 V1126 I1130 D1138	G465-W1140 PolarHBondContact O-NE1 2.69Å; V1125-W1140 WeakPolarHBondContact CA-O 3.35Å; V1125-W1140 WeakPolarHBondContact CB-O 3.31Å; V1126-W1140 PolarHBondContact N-O 2.93Å; V1126-W1140 PolarHBondContact O-N 3.36Å; I1130-W1140 HydrophobicContact CD1-CH2 3.49Å; I1130-W1140 VanDerWaalsContact CD1-CH2 3.49Å; I1130-W1140 HydrophobicContact CD1-CZ2 3.36Å; I1130-W1140 HydrophobicContact CD1-CZ3 4.43Å; I1130-W1140 HydrophobicContact CG1-CH2 3.72Å; I1130-W1140 HydrophobicContact CG1-CZ2 4.07Å; D1138-W1140 HydrophobicContact CB-CH2 3.67Å; D1138-W1140 HydrophobicContact CB-CZ2 3.66Å; D1138-W1140 HydrophobicContact CB-CZ3 4.35Å; D1138-W1140 WeakPolarHBondContact O-CZ3 3.41Å
1141	G	81.9	Confident	82.2	Confident	24 Å²	24	36.5 Å²	36.5	25%	0.247	19%	0.192	C	C	.	.	S	Bend	trans	141.9	168.1	169.5	0	0	0	0	0	113.2	T1143 V1144 N1145	G1141-T1143 PolarHBondContact O-N 2.89Å; G1141-T1143 VanDerWaalsContact O-N 3.13Å; G1141-V1144 PolarHBondContact O-N 2.95Å; G1141-V1144 VanDerWaalsContact O-N 3.13Å; G1141-N1145 PolarHBondContact O-N 3.12Å
1142	N	82.8	Confident	83.1	Confident	85 Å²	85	39 Å²	39	46%	0.455	21%	0.209	S	C	.	.	H	α-helix	trans	-53.6	-34.6	178	174.7	84.3	0	0	0	112.8	V1144 N1145 V1146 K1187	N1142-V1144 PolarHBondContact O-N 2.76Å; N1142-N1145 PolarHBondContact O-N 3.41Å; N1142-V1146 WeakPolarHBondContact O-CG2 3.47Å; N1142-V1146 PolarHBondContact O-N 3.13Å; N1142-K1187 WeakPolarHBondContact OD1-CE 3.47Å; N1142-K1187 PolarHBondContact OD1-NZ 2.73Å
1143	T	89.6	Confident	84.7	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.018	19%	0.185	C	C	.	.	H	α-helix	trans	-59.2	-44.3	179	-56	0	0	0	0	112.7	V1013 N1121 I1122 G1123 P1124 V1125 G1141 V1146 A1147	V1013-T1143 HydrophobicContact CG2-CG2 4.01Å; N1121-T1143 PolarHBondContact ND2-O 3.19Å; I1122-T1143 VanDerWaalsContact C-CG2 3.49Å; G1123-T1143 VanDerWaalsContact C-OG1 3.26Å; G1123-T1143 WeakPolarHBondContact CA-OG1 3.26Å; P1124-T1143 WeakPolarHBondContact O-CB 3.06Å; P1124-T1143 PolarHBondContact O-OG1 3.06Å; V1125-T1143 HydrophobicContact CG1-CG2 4.13Å; G1141-T1143 PolarHBondContact O-N 2.89Å; G1141-T1143 VanDerWaalsContact O-N 3.13Å; T1143-V1146 PolarHBondContact O-N 3.38Å; T1143-A1147 PolarHBondContact O-N 3.13Å
1144	V	89.6	Confident	86.3	Confident	12 Å²	12	27.4 Å²	27.4	7%	0.073	15%	0.154	C	C	.	.	H	α-helix	trans	-65.4	-45.8	177.5	-176.2	0	0	0	0	110	V1013 F1015 M1071 V1125 I1139 G1141 N1142 V1146 A1147 S1148	V1013-V1144 HydrophobicContact CG1-CG1 4.48Å; V1013-V1144 HydrophobicContact CG2-CG2 4.28Å; F1015-V1144 HydrophobicContact CE2-CG1 3.91Å; F1015-V1144 HydrophobicContact CZ-CG1 3.85Å; M1071-V1144 HydrophobicContact CE-CG1 3.74Å; V1125-V1144 HydrophobicContact CG1-CG2 3.83Å; I1139-V1144 HydrophobicContact CD1-CG2 4.02Å; I1139-V1144 HydrophobicContact CG1-CG2 3.96Å; G1141-V1144 PolarHBondContact O-N 2.95Å; G1141-V1144 VanDerWaalsContact O-N 3.13Å; N1142-V1144 PolarHBondContact O-N 2.76Å; V1144-V1146 VanDerWaalsContact C-N 3.35Å; V1144-V1146 PolarHBondContact O-N 3.38Å; V1144-A1147 PolarHBondContact O-N 3.29Å; V1144-S1148 PolarHBondContact O-N 3.49Å
1145	N	86.9	Confident	87.4	Confident	56 Å²	56	27.9 Å²	27.9	30%	0.299	16%	0.161	S	C	.	.	H	α-helix	trans	-62.2	-41	178.8	-71	-4.9	0	0	0	111.7	G1141 N1142 R1149	G1141-N1145 PolarHBondContact O-N 3.12Å; N1142-N1145 PolarHBondContact O-N 3.41Å; N1145-R1149 VanDerWaalsContact O-CG 3.24Å; N1145-R1149 WeakPolarHBondContact O-CG 3.43Å; N1145-R1149 PolarHBondContact O-N 3.12Å
1146	V	89.4	Confident	88.5	Confident	6 Å²	6	29.1 Å²	29.1	4%	0.036	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-41.5	175.5	172.7	0	0	0	0	111.5	N1121 N1142 T1143 V1144 S1148 R1149 M1150 T1162 K1187 M1190	N1121-V1146 HydrophobicContact CB-CG1 4.09Å; N1142-V1146 WeakPolarHBondContact O-CG2 3.47Å; N1142-V1146 PolarHBondContact O-N 3.13Å; T1143-V1146 PolarHBondContact O-N 3.38Å; V1144-V1146 VanDerWaalsContact C-N 3.35Å; V1144-V1146 PolarHBondContact O-N 3.38Å; V1146-S1148 PolarHBondContact O-N 2.94Å; V1146-R1149 PolarHBondContact O-N 3.04Å; V1146-R1149 VanDerWaalsContact O-N 3.13Å; V1146-M1150 WeakPolarHBondContact O-CG 3.44Å; V1146-M1150 PolarHBondContact O-N 2.82Å; V1146-T1162 HydrophobicContact CG1-CG2 3.66Å; V1146-K1187 HydrophobicContact CG2-CG 4.44Å; V1146-M1190 HydrophobicContact CG1-CE 4.1Å
1147	A	93.2	Very high	89.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.2	-47.4	174.8	0	0	0	0	0	112	V1013 F1015 N1121 T1143 V1144 R1149 M1150 D1151	V1013-A1147 HydrophobicContact CB-CB 3.96Å; V1013-A1147 HydrophobicContact CG1-CB 3.91Å; F1015-A1147 HydrophobicContact CD2-CB 3.79Å; F1015-A1147 HydrophobicContact CE2-CB 4.05Å; N1121-A1147 HydrophobicContact CB-CB 3.92Å; T1143-A1147 PolarHBondContact O-N 3.13Å; V1144-A1147 PolarHBondContact O-N 3.29Å; A1147-R1149 VanDerWaalsContact C-N 3.26Å; A1147-R1149 PolarHBondContact O-N 3.25Å; A1147-M1150 WeakPolarHBondContact O-CB 3.24Å; A1147-M1150 PolarHBondContact O-N 2.93Å; A1147-M1150 VanDerWaalsContact O-N 3.14Å; A1147-D1151 PolarHBondContact O-N 3.44Å
1148	S	90.9	Very high	89.8	Confident	37 Å²	37	36.9 Å²	36.9	26%	0.259	20%	0.202	S	C	.	.	H	α-helix	trans	-59.6	-36.2	174.3	177.7	0	0	0	0	112	V1144 V1146 D1151 S1152	V1144-S1148 PolarHBondContact O-N 3.49Å; V1146-S1148 PolarHBondContact O-N 2.94Å; S1148-D1151 PolarHBondContact O-N 2.95Å; S1148-S1152 WeakPolarHBondContact O-CB 3.22Å; S1148-S1152 PolarHBondContact O-N 3.42Å
1149	R	89.8	Confident	90.3	Very high	96 Å²	96	37 Å²	37	36%	0.362	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-39.9	174.5	-66.2	-66.6	166.2	-134.4	-12.6	112.5	N1145 V1146 A1147 D1151 S1152 T1153 V1184	N1145-R1149 VanDerWaalsContact O-CG 3.24Å; N1145-R1149 WeakPolarHBondContact O-CG 3.43Å; N1145-R1149 PolarHBondContact O-N 3.12Å; V1146-R1149 PolarHBondContact O-N 3.04Å; V1146-R1149 VanDerWaalsContact O-N 3.13Å; A1147-R1149 VanDerWaalsContact C-N 3.26Å; A1147-R1149 PolarHBondContact O-N 3.25Å; R1149-D1151 VanDerWaalsContact C-N 3.32Å; R1149-D1151 PolarHBondContact O-N 3.42Å; R1149-S1152 WeakPolarHBondContact CA-OG 3.28Å; R1149-S1152 PolarHBondContact O-N 3.21Å; R1149-S1152 VanDerWaalsContact O-N 3.16Å; R1149-S1152 PolarHBondContact O-OG 3.32Å; R1149-T1153 PolarHBondContact O-N 3.38Å; R1149-T1153 PolarHBondContact O-OG1 2.71Å; R1149-V1184 HydrophobicContact CB-CG1 3.86Å; R1149-V1184 HydrophobicContact CG-CG1 4.03Å
1150	M	94.5	Very high	90.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.5	-43.8	173.1	-64.8	-59.6	91.4	0	0	111.1	V1146 A1147 T1153 G1154 Q1160 T1162 V1184 T1192	V1146-M1150 WeakPolarHBondContact O-CG 3.44Å; V1146-M1150 PolarHBondContact O-N 2.82Å; A1147-M1150 WeakPolarHBondContact O-CB 3.24Å; A1147-M1150 PolarHBondContact O-N 2.93Å; A1147-M1150 VanDerWaalsContact O-N 3.14Å; M1150-T1153 PolarHBondContact O-OG1 3.06Å; M1150-G1154 WeakPolarHBondContact O-CA 3.36Å; M1150-G1154 PolarHBondContact O-N 2.89Å; M1150-Q1160 HydrophobicContact CB-CG 4.19Å; M1150-Q1160 PolarHBondContact O-OE1 3.46Å; M1150-Q1160 HydrophobicContact SD-CG 3.93Å; M1150-Q1160 PolarHBondContact SD-NE2 2.03Å; M1150-T1162 HydrophobicContact CG-CG2 3.87Å; M1150-T1162 HydrophobicContact SD-CG2 3.75Å; M1150-V1184 HydrophobicContact CE-CG2 3.71Å; M1150-T1192 HydrophobicContact CE-CG2 4.12Å; M1150-T1192 HydrophobicContact SD-CG2 3.78Å
1151	D	93.9	Very high	91.2	Very high	13 Å²	13	36.5 Å²	36.5	7%	0.07	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-48.1	172.5	174.9	69	0	0	0	111.6	F1015 S1017 K1117 A1147 S1148 R1149 T1153 G1154	F1015-D1151 HydrophobicContact CB-CB 3.73Å; S1017-D1151 WeakPolarHBondContact CB-OD1 3.2Å; S1017-D1151 WeakPolarHBondContact CB-OD2 3.15Å; S1017-D1151 PolarHBondContact OG-OD1 3.4Å; S1017-D1151 PolarHBondContact OG-OD2 3.49Å; K1117-D1151 WeakPolarHBondContact CD-O 3.45Å; K1117-D1151 WeakPolarHBondContact CE-O 3.02Å; K1117-D1151 VanDerWaalsContact CE-OD1 3.32Å; K1117-D1151 WeakPolarHBondContact CE-OD1 3.47Å; K1117-D1151 WeakPolarHBondContact CG-OD1 3.44Å; K1117-D1151 PolarHBondContact NZ-O 2.91Å; K1117-D1151 IonicContact NZ-OD1 2.73Å; K1117-D1151 IonicContact NZ-OD2 2.82Å; A1147-D1151 PolarHBondContact O-N 3.44Å; S1148-D1151 PolarHBondContact O-N 2.95Å; R1149-D1151 VanDerWaalsContact C-N 3.32Å; R1149-D1151 PolarHBondContact O-N 3.42Å; D1151-T1153 PolarHBondContact O-N 3.02Å; D1151-T1153 VanDerWaalsContact O-N 3.16Å; D1151-G1154 WeakPolarHBondContact O-CA 3.02Å; D1151-G1154 PolarHBondContact O-N 2.96Å
1152	S	88.3	Confident	91.8	Very high	58 Å²	58	35.4 Å²	35.4	41%	0.406	19%	0.189	S	C	.	.	H	α-helix	trans	-59.1	-32.8	-177.6	76.1	0	0	0	0	113.1	S1148 R1149	S1148-S1152 WeakPolarHBondContact O-CB 3.22Å; S1148-S1152 PolarHBondContact O-N 3.42Å; R1149-S1152 WeakPolarHBondContact CA-OG 3.28Å; R1149-S1152 PolarHBondContact O-N 3.21Å; R1149-S1152 VanDerWaalsContact O-N 3.16Å; R1149-S1152 PolarHBondContact O-OG 3.32Å
1153	T	90.5	Very high	92.3	Very high	38 Å²	38	32.2 Å²	32.2	23%	0.233	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	0.8	174.1	62.8	0	0	0	0	113.9	R1149 M1150 D1151 Q1160 R1179 V1182	R1149-T1153 PolarHBondContact O-N 3.38Å; R1149-T1153 PolarHBondContact O-OG1 2.71Å; M1150-T1153 PolarHBondContact O-OG1 3.06Å; D1151-T1153 PolarHBondContact O-N 3.02Å; D1151-T1153 VanDerWaalsContact O-N 3.16Å; T1153-Q1160 PolarHBondContact O-OE1 3.06Å; T1153-Q1160 PolarHBondContact OG1-NE2 3.28Å; T1153-Q1160 VanDerWaalsContact OG1-NE2 3.1Å; T1153-Q1160 PolarHBondContact OG1-OE1 3.46Å; T1153-R1179 VanDerWaalsContact O-CZ 3.29Å; T1153-R1179 PolarHBondContact O-NH1 3.3Å; T1153-R1179 PolarHBondContact O-NH2 3.03Å; T1153-V1182 HydrophobicContact CG2-CG1 3.89Å
1154	G	89.7	Confident	92.3	Very high	12 Å²	12	36.3 Å²	36.3	12%	0.124	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-61.2	140.1	-176.6	0	0	0	0	0	112.6	M1150 D1151 Q1160	M1150-G1154 WeakPolarHBondContact O-CA 3.36Å; M1150-G1154 PolarHBondContact O-N 2.89Å; D1151-G1154 WeakPolarHBondContact O-CA 3.02Å; D1151-G1154 PolarHBondContact O-N 2.96Å; G1154-Q1160 VanDerWaalsContact CA-OE1 3.3Å
1155	V	92.7	Very high	92.5	Very high	62 Å²	62	36 Å²	36	38%	0.376	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-82.5	136.3	167.7	176.8	0	0	0	0	107.7	R1158 F1194	V1155-R1158 HydrophobicContact CG1-CG 4.49Å; V1155-R1158 PolarHBondContact O-N 2.88Å; V1155-F1194 HydrophobicContact CB-CE1 4.15Å; V1155-F1194 HydrophobicContact CB-CZ 4Å; V1155-F1194 HydrophobicContact CG2-CE1 4.29Å; V1155-F1194 HydrophobicContact CG2-CZ 3.78Å
1156	P	93.2	Very high	92.8	Very high	55 Å²	55	36.4 Å²	36.4	36%	0.357	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	147	173.4	-27.2	35.7	0	0	0	112.8	K1115 R1158	K1115-P1156 HydrophobicContact CB-CB 4.11Å; K1115-P1156 HydrophobicContact CD-CB 4.45Å; P1156-R1158 PolarHBondContact O-N 3.47Å; P1156-R1158 VanDerWaalsContact O-N 3.15Å
1157	E	92.9	Very high	92.8	Very high	110 Å²	110	42.3 Å²	42.3	51%	0.514	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	16.9	179	-60.8	154.5	113.3	0	0	114.2	K1115 M1116	K1115-E1157 HydrophobicContact CB-CG 4.43Å; K1115-E1157 HydrophobicContact CG-CG 4.34Å; K1115-E1157 IonicContact NZ-OE1 3.16Å; K1115-E1157 PolarHBondContact NZ-OE1 3Å; K1115-E1157 IonicContact NZ-OE2 3.99Å; K1115-E1157 PolarHBondContact NZ-OE2 3.39Å; M1116-E1157 WeakPolarHBondContact O-CA 3.27Å; M1116-E1157 PolarHBondContact O-N 3.31Å
1158	R	94.9	Very high	92.7	Very high	90 Å²	90	42.9 Å²	42.9	34%	0.34	22%	0.223	S	C	.	.			trans	-129	151.9	174.4	-62.4	-61	-162.8	111	3.4	112.4	M1100 I1118 V1155 P1156 E1177 F1194	M1100-R1158 VanDerWaalsContact CE-C 3.42Å; M1100-R1158 VanDerWaalsContact CE-O 3.29Å; M1100-R1158 WeakPolarHBondContact CE-O 3.37Å; I1118-R1158 PolarHBondContact N-O 2.87Å; V1155-R1158 HydrophobicContact CG1-CG 4.49Å; V1155-R1158 PolarHBondContact O-N 2.88Å; P1156-R1158 PolarHBondContact O-N 3.47Å; P1156-R1158 VanDerWaalsContact O-N 3.15Å; R1158-E1177 IonicContact CZ-OE2 2.93Å; R1158-E1177 IonicContact NH1-OE2 3.62Å; R1158-E1177 PolarHBondContact NH1-OE2 3.41Å; R1158-E1177 IonicContact NH2-OE2 2.76Å; R1158-E1177 PolarHBondContact NH2-OE2 3.21Å; R1158-F1194 HydrophobicContact CB-CD1 3.63Å; R1158-F1194 HydrophobicContact CB-CE1 3.73Å; R1158-F1194 HydrophobicContact CB-CG 4.33Å; R1158-F1194 HydrophobicContact CG-CD1 4.26Å; R1158-F1194 HydrophobicContact CG-CE1 4.25Å
1159	I	97	Very high	92.7	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.041	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	113.1	173.3	-55.6	172.4	0	0	0	107.6	A1096 M1097 M1100 I1118 L1120 V1161 F1194 L1195	A1096-I1159 HydrophobicContact CB-CD1 4.02Å; A1096-I1159 HydrophobicContact CB-CG2 4.47Å; M1097-I1159 HydrophobicContact CG-CD1 3.8Å; M1100-I1159 HydrophobicContact CE-CG1 3.81Å; M1100-I1159 HydrophobicContact CG-CD1 4.14Å; M1100-I1159 HydrophobicContact CG-CG1 4.05Å; I1118-I1159 HydrophobicContact CB-CB 4.44Å; I1118-I1159 HydrophobicContact CB-CG1 4.19Å; I1118-I1159 HydrophobicContact CB-CG2 4.18Å; I1118-I1159 HydrophobicContact CD1-CG1 4.31Å; I1118-I1159 HydrophobicContact CG2-CG2 4.18Å; I1118-I1159 CarbonylContact O-C 3.58Å; I1118-I1159 WeakPolarHBondContact O-CA 3.43Å; L1120-I1159 HydrophobicContact CD1-CG2 3.66Å; L1120-I1159 HydrophobicContact CG-CG2 4.14Å; I1159-V1161 HydrophobicContact CG2-CG1 4.41Å; I1159-F1194 CarbonylContact O-C 3.6Å; I1159-F1194 VanDerWaalsContact O-CA 3.24Å; I1159-F1194 WeakPolarHBondContact O-CA 3.02Å; I1159-L1195 HydrophobicContact CB-CB 4.11Å; I1159-L1195 HydrophobicContact CD1-CD2 4.29Å; I1159-L1195 HydrophobicContact CG2-CB 4.09Å; I1159-L1195 HydrophobicContact CG2-CD2 4.29Å; I1159-L1195 PolarHBondContact O-N 2.81Å
1160	Q	96.8	Very high	92.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.9	178.7	179.3	177.3	-17.2	0	0	111.1	I1118 L1120 M1150 T1153 G1154 Y1193 F1194	I1118-Q1160 PolarHBondContact O-N 3.34Å; L1120-Q1160 PolarHBondContact N-O 2.73Å; M1150-Q1160 HydrophobicContact CB-CG 4.19Å; M1150-Q1160 PolarHBondContact O-OE1 3.46Å; M1150-Q1160 HydrophobicContact SD-CG 3.93Å; M1150-Q1160 PolarHBondContact SD-NE2 2.03Å; T1153-Q1160 PolarHBondContact O-OE1 3.06Å; T1153-Q1160 PolarHBondContact OG1-NE2 3.28Å; T1153-Q1160 VanDerWaalsContact OG1-NE2 3.1Å; T1153-Q1160 PolarHBondContact OG1-OE1 3.46Å; G1154-Q1160 VanDerWaalsContact CA-OE1 3.3Å; Q1160-Y1193 WeakPolarHBondContact CA-O 2.9Å; Q1160-F1194 HydrophobicContact CB-CD1 4.4Å; Q1160-F1194 HydrophobicContact CB-CE1 4.46Å
1161	V	96.3	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	154.5	178.6	-46	0	0	0	0	112.1	L1120 I1159 L1165 L1176 Y1193 L1195	L1120-V1161 HydrophobicContact CB-CG1 4.15Å; L1120-V1161 HydrophobicContact CD1-CG1 4.11Å; I1159-V1161 HydrophobicContact CG2-CG1 4.41Å; V1161-L1165 HydrophobicContact CB-CB 4.36Å; V1161-L1165 HydrophobicContact CB-CD2 3.96Å; V1161-L1165 HydrophobicContact CB-CG 4.18Å; V1161-L1165 HydrophobicContact CG1-CD2 4.05Å; V1161-L1165 HydrophobicContact CG1-CG 4.5Å; V1161-L1176 HydrophobicContact CG2-CD2 3.57Å; V1161-Y1193 PolarHBondContact N-O 2.83Å; V1161-Y1193 PolarHBondContact O-N 2.96Å; V1161-L1195 HydrophobicContact CG1-CB 4.09Å
1162	T	94.9	Very high	92.1	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	160.7	172	52.9	0	0	0	0	112.5	N1121 V1146 M1150 D1164 L1165 Y1166 M1190	N1121-T1162 HydrophobicContact CB-CG2 4.1Å; N1121-T1162 WeakPolarHBondContact OD1-CB 3.49Å; N1121-T1162 WeakPolarHBondContact OD1-CG2 3.35Å; N1121-T1162 PolarHBondContact OD1-OG1 2.85Å; V1146-T1162 HydrophobicContact CG1-CG2 3.66Å; M1150-T1162 HydrophobicContact CG-CG2 3.87Å; M1150-T1162 HydrophobicContact SD-CG2 3.75Å; T1162-D1164 VanDerWaalsContact C-N 3.27Å; T1162-D1164 PolarHBondContact O-N 2.95Å; T1162-L1165 PolarHBondContact O-N 3.44Å; T1162-Y1166 PolarHBondContact O-N 3.18Å; T1162-M1190 HydrophobicContact CG2-CE 4.22Å
1163	A	92.8	Very high	92.1	Very high	18 Å²	18	48.1 Å²	48.1	15%	0.149	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-35.3	177.3	0	0	0	0	0	113.7	Y1166 Q1167 M1191 Y1193	A1163-Y1166 WeakPolarHBondContact O-CB 3.46Å; A1163-Y1166 PolarHBondContact O-N 3.39Å; A1163-Q1167 WeakPolarHBondContact O-CG 3.34Å; A1163-Q1167 PolarHBondContact O-N 2.73Å; A1163-Q1167 VanDerWaalsContact O-N 3.13Å; A1163-M1191 HydrophobicContact CB-CB 4.38Å; A1163-Y1193 HydrophobicContact CB-CE2 3.98Å
1164	D	91.1	Very high	92.3	Very high	90 Å²	90	46.6 Å²	46.6	48%	0.481	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-40.7	178.3	-52.7	-41.4	0	0	0	111.3	I1122 T1162 Q1167 V1168	I1122-D1164 HydrophobicContact CD1-CB 4.46Å; I1122-D1164 HydrophobicContact CG1-CB 4.35Å; T1162-D1164 VanDerWaalsContact C-N 3.27Å; T1162-D1164 PolarHBondContact O-N 2.95Å; D1164-Q1167 PolarHBondContact O-N 2.76Å; D1164-V1168 PolarHBondContact O-N 3.24Å
1165	L	92.4	Very high	92.4	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-70.5	-35.5	174.5	-179.8	53	0	0	0	112	I1089 L1120 I1122 V1161 T1162 Q1167 V1168 L1169	I1089-L1165 HydrophobicContact CG2-CD1 3.53Å; L1120-L1165 HydrophobicContact CB-CD2 3.41Å; L1120-L1165 VanDerWaalsContact CB-CD2 3.41Å; L1120-L1165 HydrophobicContact CD1-CD2 4.31Å; L1120-L1165 HydrophobicContact CG-CD2 4.47Å; I1122-L1165 HydrophobicContact CD1-CB 4.36Å; I1122-L1165 HydrophobicContact CD1-CD1 4.46Å; I1122-L1165 HydrophobicContact CG1-CB 4.15Å; I1122-L1165 HydrophobicContact CG2-CD1 3.82Å; V1161-L1165 HydrophobicContact CB-CB 4.36Å; V1161-L1165 HydrophobicContact CB-CD2 3.96Å; V1161-L1165 HydrophobicContact CB-CG 4.18Å; V1161-L1165 HydrophobicContact CG1-CD2 4.05Å; V1161-L1165 HydrophobicContact CG1-CG 4.5Å; T1162-L1165 PolarHBondContact O-N 3.44Å; L1165-Q1167 VanDerWaalsContact C-N 3.34Å; L1165-Q1167 PolarHBondContact O-N 3.14Å; L1165-V1168 PolarHBondContact O-N 3.1Å; L1165-L1169 HydrophobicContact CD1-CD1 3.84Å; L1165-L1169 HydrophobicContact CD1-CD2 4.29Å; L1165-L1169 HydrophobicContact CD1-CG 3.72Å; L1165-L1169 HydrophobicContact CD2-CD1 4.41Å; L1165-L1169 HydrophobicContact CG-CD1 3.83Å; L1165-L1169 HydrophobicContact CG-CG 4.17Å; L1165-L1169 WeakPolarHBondContact O-CG 3.32Å; L1165-L1169 PolarHBondContact O-N 3Å
1166	Y	92.9	Very high	92.5	Very high	64 Å²	64	48 Å²	48	25%	0.251	26%	0.255	S	S	.	.	H	α-helix	trans	-55.9	-46.3	171.7	162	-91.7	0	0	0	111.7	T1162 A1163 V1168 L1169 N1170 L1176 Y1193	T1162-Y1166 PolarHBondContact O-N 3.18Å; A1163-Y1166 WeakPolarHBondContact O-CB 3.46Å; A1163-Y1166 PolarHBondContact O-N 3.39Å; Y1166-V1168 VanDerWaalsContact C-N 3.28Å; Y1166-V1168 PolarHBondContact O-N 3.45Å; Y1166-L1169 PolarHBondContact O-N 3.46Å; Y1166-N1170 HydrophobicContact CE2-CB 4.32Å; Y1166-N1170 WeakPolarHBondContact O-CB 3.38Å; Y1166-N1170 PolarHBondContact O-N 2.62Å; Y1166-L1176 HydrophobicContact CD2-CB 3.69Å; Y1166-L1176 HydrophobicContact CD2-CD1 3.97Å; Y1166-L1176 HydrophobicContact CD2-CD2 4.15Å; Y1166-L1176 HydrophobicContact CD2-CG 4.14Å; Y1166-L1176 HydrophobicContact CE2-CB 3.97Å; Y1166-L1176 HydrophobicContact CE2-CD1 4.37Å; Y1166-Y1193 HydrophobicContact CD1-CE1 4.09Å; Y1166-Y1193 HydrophobicContact CD1-CE2 4.09Å; Y1166-Y1193 AromaticContact CD1-CZ 3.84Å; Y1166-Y1193 AromaticContact CD2-CD1 3.47Å; Y1166-Y1193 HydrophobicContact CD2-CD1 3.47Å; Y1166-Y1193 VanDerWaalsContact CD2-CD1 3.47Å; Y1166-Y1193 HydrophobicContact CD2-CD2 4.26Å; Y1166-Y1193 AromaticContact CD2-CE1 3.69Å; Y1166-Y1193 HydrophobicContact CD2-CE1 3.69Å; Y1166-Y1193 HydrophobicContact CD2-CE2 4.47Å; Y1166-Y1193 AromaticContact CD2-CG 3.8Å; Y1166-Y1193 HydrophobicContact CD2-CG 3.8Å; Y1166-Y1193 HydrophobicContact CE1-CE1 4.17Å; Y1166-Y1193 AromaticContact CE2-CD1 3.84Å; Y1166-Y1193 HydrophobicContact CE2-CD1 3.84Å; Y1166-Y1193 AromaticContact CE2-CE1 3.76Å; Y1166-Y1193 HydrophobicContact CE2-CE1 3.76Å; Y1166-Y1193 AromaticContact CG-CD1 3.9Å; Y1166-Y1193 HydrophobicContact CG-CD1 3.9Å; Y1166-Y1193 AromaticContact CG-CD2 3.9Å; Y1166-Y1193 HydrophobicContact CG-CD2 3.9Å; Y1166-Y1193 AromaticContact CG-CE1 3.87Å; Y1166-Y1193 HydrophobicContact CG-CE1 3.87Å; Y1166-Y1193 AromaticContact CG-CE2 3.91Å; Y1166-Y1193 HydrophobicContact CG-CE2 3.91Å; Y1166-Y1193 AromaticContact CG-CG 3.93Å; Y1166-Y1193 HydrophobicContact CG-CG 3.93Å; Y1166-Y1193 AromaticContact CG-CZ 3.88Å
1167	Q	90.4	Very high	92.5	Very high	129 Å²	129	49.6 Å²	49.6	60%	0.603	26%	0.257	S	S	*	.	H	α-helix	trans	-58.8	-40.3	178.3	-69	175.6	29.4	0	0	112.1	A1163 D1164 L1165 S1171	A1163-Q1167 WeakPolarHBondContact O-CG 3.34Å; A1163-Q1167 PolarHBondContact O-N 2.73Å; A1163-Q1167 VanDerWaalsContact O-N 3.13Å; D1164-Q1167 PolarHBondContact O-N 2.76Å; L1165-Q1167 VanDerWaalsContact C-N 3.34Å; L1165-Q1167 PolarHBondContact O-N 3.14Å; Q1167-S1171 PolarHBondContact O-N 3.25Å
1168	V	90.2	Very high	92.6	Very high	13 Å²	13	50.2 Å²	50.2	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-68.7	-54	177.8	179.5	0	0	0	0	110.9	I1089 I1122 D1164 L1165 Y1166 N1170 S1171 Y1172	I1089-V1168 HydrophobicContact CD1-CG1 4.21Å; I1089-V1168 HydrophobicContact CG2-CG1 4.22Å; I1122-V1168 HydrophobicContact CD1-CB 4.46Å; I1122-V1168 HydrophobicContact CD1-CG2 3.7Å; D1164-V1168 PolarHBondContact O-N 3.24Å; L1165-V1168 PolarHBondContact O-N 3.1Å; Y1166-V1168 VanDerWaalsContact C-N 3.28Å; Y1166-V1168 PolarHBondContact O-N 3.45Å; V1168-N1170 PolarHBondContact O-N 3.36Å; V1168-S1171 WeakPolarHBondContact O-CB 3.47Å; V1168-S1171 PolarHBondContact O-N 3.36Å; V1168-S1171 PolarHBondContact O-OG 3.01Å; V1168-Y1172 HydrophobicContact CG1-CD2 4.43Å; V1168-Y1172 HydrophobicContact CG1-CE2 3.83Å; V1168-Y1172 WeakPolarHBondContact O-CD2 3.29Å
1169	L	91.6	Very high	92.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.1	-36.8	-176.6	-66.1	177.3	0	0	0	112.7	A1093 L1165 Y1166 S1171 Y1172 S1173 Y1174 L1176 L1195	A1093-L1169 HydrophobicContact CB-CD1 4.22Å; A1093-L1169 HydrophobicContact CB-CD2 3.79Å; L1165-L1169 HydrophobicContact CD1-CD1 3.84Å; L1165-L1169 HydrophobicContact CD1-CD2 4.29Å; L1165-L1169 HydrophobicContact CD1-CG 3.72Å; L1165-L1169 HydrophobicContact CD2-CD1 4.41Å; L1165-L1169 HydrophobicContact CG-CD1 3.83Å; L1165-L1169 HydrophobicContact CG-CG 4.17Å; L1165-L1169 WeakPolarHBondContact O-CG 3.32Å; L1165-L1169 PolarHBondContact O-N 3Å; Y1166-L1169 PolarHBondContact O-N 3.46Å; L1169-S1171 PolarHBondContact O-N 3.49Å; L1169-Y1172 CarbonylContact O-C 3.58Å; L1169-Y1172 PolarHBondContact O-N 3.34Å; L1169-S1173 PolarHBondContact O-N 3.38Å; L1169-Y1174 HydrophobicContact CB-CD2 4.18Å; L1169-Y1174 HydrophobicContact CB-CG 4.22Å; L1169-Y1174 HydrophobicContact CD2-CD2 4.07Å; L1169-Y1174 HydrophobicContact CD2-CE2 4.22Å; L1169-Y1174 HydrophobicContact CD2-CG 4.41Å; L1169-Y1174 WeakPolarHBondContact O-CD2 3.35Å; L1169-Y1174 PolarHBondContact O-N 3.19Å; L1169-L1176 HydrophobicContact CB-CD1 3.91Å; L1169-L1176 HydrophobicContact CB-CD2 4.49Å; L1169-L1176 HydrophobicContact CD1-CD2 4.28Å; L1169-L1195 HydrophobicContact CD1-CD1 4.36Å; L1169-L1195 HydrophobicContact CD1-CD2 4.4Å
1170	N	89.9	Confident	92.3	Very high	83 Å²	83	49.7 Å²	49.7	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-61.4	-28.4	174.2	-174	87.1	0	0	0	112.3	Y1166 V1168 Y1172 S1173 L1176	Y1166-N1170 HydrophobicContact CE2-CB 4.32Å; Y1166-N1170 WeakPolarHBondContact O-CB 3.38Å; Y1166-N1170 PolarHBondContact O-N 2.62Å; V1168-N1170 PolarHBondContact O-N 3.36Å; N1170-Y1172 VanDerWaalsContact C-N 3.26Å; N1170-Y1172 PolarHBondContact O-N 3.02Å; N1170-S1173 PolarHBondContact O-N 3.19Å; N1170-L1176 HydrophobicContact CB-CD1 4.43Å
1171	S	88.4	Confident	92	Very high	82 Å²	82	53.2 Å²	53.2	57%	0.573	28%	0.279	S	S	*	.	H	α-helix	trans	-72.5	-15.5	174.6	77.5	0	0	0	0	114.4	Q1167 V1168 L1169	Q1167-S1171 PolarHBondContact O-N 3.25Å; V1168-S1171 WeakPolarHBondContact O-CB 3.47Å; V1168-S1171 PolarHBondContact O-N 3.36Å; V1168-S1171 PolarHBondContact O-OG 3.01Å; L1169-S1171 PolarHBondContact O-N 3.49Å
1172	Y	86.5	Confident	91.8	Very high	66 Å²	66	54.1 Å²	54.1	26%	0.259	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	19.1	172.7	-56.9	-83	0	0	0	112.7	G1085 V1168 L1169 N1170 Y1174 P1199	G1085-Y1172 PolarHBondContact O-OH 3.19Å; V1168-Y1172 HydrophobicContact CG1-CD2 4.43Å; V1168-Y1172 HydrophobicContact CG1-CE2 3.83Å; V1168-Y1172 WeakPolarHBondContact O-CD2 3.29Å; L1169-Y1172 CarbonylContact O-C 3.58Å; L1169-Y1172 PolarHBondContact O-N 3.34Å; N1170-Y1172 VanDerWaalsContact C-N 3.26Å; N1170-Y1172 PolarHBondContact O-N 3.02Å; Y1172-Y1174 VanDerWaalsContact C-N 3.31Å; Y1172-Y1174 PolarHBondContact O-N 3.38Å; Y1172-P1199 WeakPolarHBondContact O-CB 3.41Å
1173	S	89.6	Confident	91.4	Very high	82 Å²	82	59.2 Å²	59.2	57%	0.573	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	27.3	177	-52.7	0	0	0	0	115.9	L1169 N1170	L1169-S1173 PolarHBondContact O-N 3.38Å; N1170-S1173 PolarHBondContact O-N 3.19Å
1174	Y	93.1	Very high	90.9	Very high	7 Å²	7	58.6 Å²	58.6	3%	0.027	31%	0.31	C	S	.	.			trans	-68.9	148	166	-73.6	-97	0	0	0	110.7	R1090 A1093 D1094 M1097 L1169 Y1172 L1195 P1199	R1090-Y1174 HydrophobicContact CG-CE2 4.01Å; R1090-Y1174 WeakPolarHBondContact CG-OH 3.43Å; A1093-Y1174 HydrophobicContact CB-CE1 4.26Å; D1094-Y1174 VanDerWaalsContact CG-OH 3.27Å; D1094-Y1174 WeakPolarHBondContact OD1-CE1 3.31Å; D1094-Y1174 PolarHBondContact OD1-OH 3.1Å; D1094-Y1174 PolarHBondContact OD2-OH 2.93Å; M1097-Y1174 HydrophobicContact CE-CD1 4.36Å; M1097-Y1174 HydrophobicContact CE-CE1 3.79Å; L1169-Y1174 HydrophobicContact CB-CD2 4.18Å; L1169-Y1174 HydrophobicContact CB-CG 4.22Å; L1169-Y1174 HydrophobicContact CD2-CD2 4.07Å; L1169-Y1174 HydrophobicContact CD2-CE2 4.22Å; L1169-Y1174 HydrophobicContact CD2-CG 4.41Å; L1169-Y1174 WeakPolarHBondContact O-CD2 3.35Å; L1169-Y1174 PolarHBondContact O-N 3.19Å; Y1172-Y1174 VanDerWaalsContact C-N 3.31Å; Y1172-Y1174 PolarHBondContact O-N 3.38Å; Y1174-L1195 HydrophobicContact CD1-CD1 3.84Å; Y1174-L1195 HydrophobicContact CG-CD1 4.26Å; Y1174-P1199 VanDerWaalsContact CE1-CD 3.48Å; Y1174-P1199 HydrophobicContact CE2-CG 4.21Å; Y1174-P1199 VanDerWaalsContact CZ-CD 3.48Å
1175	T	92.9	Very high	90	Very high	76 Å²	76	62.3 Å²	62.3	47%	0.466	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.6	174	-52	0	0	0	0	109.6	T1196 A1197	T1175-T1196 WeakPolarHBondContact CG2-OG1 3.15Å; T1175-T1196 PolarHBondContact O-N 3.48Å; T1175-T1196 PolarHBondContact O-OG1 3.27Å; T1175-T1196 VanDerWaalsContact O-OG1 3.11Å; T1175-A1197 PolarHBondContact N-O 2.89Å; T1175-A1197 PolarHBondContact O-N 3.21Å
1176	L	93.7	Very high	88.9	Confident	28 Å²	28	65.7 Å²	65.7	15%	0.147	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.8	177.7	-60.7	110.7	0	0	0	111.6	V1161 Y1166 L1169 N1170 F1194 L1195	V1161-L1176 HydrophobicContact CG2-CD2 3.57Å; Y1166-L1176 HydrophobicContact CD2-CB 3.69Å; Y1166-L1176 HydrophobicContact CD2-CD1 3.97Å; Y1166-L1176 HydrophobicContact CD2-CD2 4.15Å; Y1166-L1176 HydrophobicContact CD2-CG 4.14Å; Y1166-L1176 HydrophobicContact CE2-CB 3.97Å; Y1166-L1176 HydrophobicContact CE2-CD1 4.37Å; L1169-L1176 HydrophobicContact CB-CD1 3.91Å; L1169-L1176 HydrophobicContact CB-CD2 4.49Å; L1169-L1176 HydrophobicContact CD1-CD2 4.28Å; N1170-L1176 HydrophobicContact CB-CD1 4.43Å; L1176-F1194 CarbonylContact C-O 3.59Å; L1176-F1194 VanDerWaalsContact CA-O 3.22Å; L1176-F1194 WeakPolarHBondContact CA-O 3.45Å; L1176-L1195 HydrophobicContact CD2-CB 4.21Å; L1176-L1195 HydrophobicContact CD2-CD1 4.1Å; L1176-L1195 HydrophobicContact CG-CD1 4.02Å
1177	E	94.8	Very high	88.1	Confident	88 Å²	88	67.7 Å²	67.7	41%	0.411	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.1	-179.6	-178.4	-178.7	-174	0	0	109.5	R1158 R1179 Y1193 F1194 T1196	R1158-E1177 IonicContact CZ-OE2 2.93Å; R1158-E1177 IonicContact NH1-OE2 3.62Å; R1158-E1177 PolarHBondContact NH1-OE2 3.41Å; R1158-E1177 IonicContact NH2-OE2 2.76Å; R1158-E1177 PolarHBondContact NH2-OE2 3.21Å; E1177-R1179 PolarHBondContact O-N 3.21Å; E1177-Y1193 CarbonylContact O-C 3.53Å; E1177-Y1193 VanDerWaalsContact O-CA 3.23Å; E1177-Y1193 WeakPolarHBondContact O-CA 3.31Å; E1177-Y1193 WeakPolarHBondContact O-CB 3.39Å; E1177-F1194 HydrophobicContact CB-CB 4.4Å; E1177-F1194 PolarHBondContact N-O 2.94Å; E1177-F1194 PolarHBondContact O-N 2.03Å; E1177-T1196 HydrophobicContact CB-CG2 3.94Å
1178	Y	94.8	Very high	87.8	Confident	122 Å²	122	63.6 Å²	63.6	48%	0.478	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	117.6	176.5	176.5	-117.1	0	0	0	110.5	G1180 M1191 T1192 Y1193	Y1178-G1180 VanDerWaalsContact CZ-CA 3.41Å; Y1178-M1191 HydrophobicContact CE2-CB 4.43Å; Y1178-T1192 WeakPolarHBondContact CD2-O 3.36Å; Y1178-Y1193 HydrophobicContact CD2-CD1 4.07Å; Y1178-Y1193 AromaticContact CD2-CE1 3.69Å; Y1178-Y1193 HydrophobicContact CD2-CE1 3.69Å; Y1178-Y1193 HydrophobicContact CD2-CE2 4.36Å; Y1178-Y1193 AromaticContact CD2-CZ 3.84Å; Y1178-Y1193 HydrophobicContact CG-CE1 4.29Å
1179	R	92.5	Very high	87.8	Confident	74 Å²	74	70.1 Å²	70.1	28%	0.279	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-36.9	-179.9	173.3	-179	173.4	157.1	-5.7	112	T1153 E1177 T1192 F1194	T1153-R1179 VanDerWaalsContact O-CZ 3.29Å; T1153-R1179 PolarHBondContact O-NH1 3.3Å; T1153-R1179 PolarHBondContact O-NH2 3.03Å; E1177-R1179 PolarHBondContact O-N 3.21Å; R1179-T1192 WeakPolarHBondContact CB-O 3.45Å; R1179-T1192 WeakPolarHBondContact CD-OG1 3.31Å; R1179-T1192 PolarHBondContact N-O 3.45Å; R1179-F1194 HydrophobicContact CB-CD2 3.92Å; R1179-F1194 HydrophobicContact CB-CE2 3.77Å; R1179-F1194 HydrophobicContact CB-CG 4.48Å; R1179-F1194 HydrophobicContact CB-CZ 4.22Å; R1179-F1194 VanDerWaalsContact CD-CZ 3.44Å; R1179-F1194 HydrophobicContact CG-CD2 4.3Å; R1179-F1194 HydrophobicContact CG-CE1 4.47Å; R1179-F1194 HydrophobicContact CG-CE2 3.64Å; R1179-F1194 HydrophobicContact CG-CZ 3.74Å
1180	G	92.3	Very high	87.7	Confident	14 Å²	14	72 Å²	72	14%	0.144	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	121.4	-174	-168.8	0	0	0	0	0	113.6	Y1178 T1192	Y1178-G1180 VanDerWaalsContact CZ-CA 3.41Å; G1180-T1192 PolarHBondContact N-O 3.13Å; G1180-T1192 PolarHBondContact O-N 2.84Å; G1180-T1192 PolarHBondContact O-OG1 3.12Å
1181	V	90.8	Very high	87.8	Confident	74 Å²	74	73 Å²	73	45%	0.448	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	132	173.6	178.4	0	0	0	0	109.5	E1189 M1190 M1191	V1181-E1189 HydrophobicContact CG1-CB 3.51Å; V1181-E1189 HydrophobicContact CG1-CG 3.7Å; V1181-M1190 CarbonylContact C-O 3.6Å; V1181-M1190 WeakPolarHBondContact CA-O 3.27Å; V1181-M1191 HydrophobicContact CG2-CG 4.21Å
1182	V	91.4	Very high	88.1	Confident	20 Å²	20	69 Å²	69	12%	0.121	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.6	177.7	177.2	0	0	0	0	109.1	T1153 V1184 M1190 T1192	T1153-V1182 HydrophobicContact CG2-CG1 3.89Å; V1182-V1184 PolarHBondContact O-N 3.34Å; V1182-M1190 PolarHBondContact N-O 3.35Å; V1182-M1190 PolarHBondContact O-N 3.34Å; V1182-T1192 HydrophobicContact CB-CG2 4.17Å; V1182-T1192 HydrophobicContact CG2-CG2 4.19Å; V1182-T1192 WeakPolarHBondContact CG2-OG1 3.48Å
1183	T	87	Confident	88.6	Confident	107 Å²	107	67.6 Å²	67.6	66%	0.656	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	115.5	176.6	42.4	0	0	0	0	111.1	G1188 E1189	T1183-G1188 CarbonylContact C-O 3.53Å; T1183-G1188 WeakPolarHBondContact CA-O 3.25Å; T1183-E1189 HydrophobicContact CG2-CG 3.84Å
1184	V	82.9	Confident	88.9	Confident	6 Å²	6	64.6 Å²	64.6	4%	0.036	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.7	-175.8	175	0	0	0	0	109.9	R1149 M1150 V1182 G1186 K1187 G1188 M1190	R1149-V1184 HydrophobicContact CB-CG1 3.86Å; R1149-V1184 HydrophobicContact CG-CG1 4.03Å; M1150-V1184 HydrophobicContact CE-CG2 3.71Å; V1182-V1184 PolarHBondContact O-N 3.34Å; V1184-G1186 PolarHBondContact O-N 3.44Å; V1184-G1186 VanDerWaalsContact O-N 3.13Å; V1184-K1187 HydrophobicContact CB-CB 4.14Å; V1184-K1187 HydrophobicContact CG1-CB 4.06Å; V1184-K1187 HydrophobicContact CG1-CG 4.26Å; V1184-K1187 PolarHBondContact O-N 3Å; V1184-G1188 PolarHBondContact N-O 3.03Å; V1184-G1188 PolarHBondContact O-N 3.49Å; V1184-M1190 HydrophobicContact CB-CG 4.28Å; V1184-M1190 HydrophobicContact CB-SD 3.92Å; V1184-M1190 HydrophobicContact CG1-SD 4.02Å; V1184-M1190 HydrophobicContact CG2-CB 4.15Å; V1184-M1190 HydrophobicContact CG2-CG 4.15Å; V1184-M1190 HydrophobicContact CG2-SD 3.86Å
1185	K	72.1	Confident	89	Confident	167 Å²	167	64.6 Å²	64.6	73%	0.726	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	117.7	178.3	-174.6	-178.3	179.9	-175.8	0	110.2
1186	G	69	Low	88.9	Confident	78 Å²	78	64 Å²	64	80%	0.804	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	0.3	-178.2	0	0	0	0	0	115.8	V1184	V1184-G1186 PolarHBondContact O-N 3.44Å; V1184-G1186 VanDerWaalsContact O-N 3.13Å
1187	K	76.9	Confident	88.7	Confident	106 Å²	106	64.6 Å²	64.6	46%	0.461	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-20.2	172.8	-70.2	-64.6	-175.9	-172.9	0	114.5	N1142 V1146 V1184 M1190	N1142-K1187 WeakPolarHBondContact OD1-CE 3.47Å; N1142-K1187 PolarHBondContact OD1-NZ 2.73Å; V1146-K1187 HydrophobicContact CG2-CG 4.44Å; V1184-K1187 HydrophobicContact CB-CB 4.14Å; V1184-K1187 HydrophobicContact CG1-CB 4.06Å; V1184-K1187 HydrophobicContact CG1-CG 4.26Å; V1184-K1187 PolarHBondContact O-N 3Å; K1187-M1190 HydrophobicContact CB-CG 4.03Å; K1187-M1190 HydrophobicContact CB-SD 3.67Å; K1187-M1190 HydrophobicContact CG-SD 3.84Å
1188	G	84.2	Confident	88.2	Confident	42 Å²	42	61.3 Å²	61.3	43%	0.433	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	82	-137.1	-172.2	0	0	0	0	0	110.2	T1183 V1184	T1183-G1188 CarbonylContact C-O 3.53Å; T1183-G1188 WeakPolarHBondContact CA-O 3.25Å; V1184-G1188 PolarHBondContact N-O 3.03Å; V1184-G1188 PolarHBondContact O-N 3.49Å
1189	E	89.1	Confident	87.6	Confident	151 Å²	151	56.9 Å²	56.9	71%	0.706	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	129.3	179.6	-80	-179	-170.7	0	0	112	V1181 T1183	V1181-E1189 HydrophobicContact CG1-CB 3.51Å; V1181-E1189 HydrophobicContact CG1-CG 3.7Å; T1183-E1189 HydrophobicContact CG2-CG 3.84Å
1190	M	89.6	Confident	86	Confident	39 Å²	39	59.7 Å²	59.7	19%	0.192	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	135.2	177.2	-69.3	-172.3	66.2	0	0	111.2	V1146 T1162 V1181 V1182 V1184 K1187	V1146-M1190 HydrophobicContact CG1-CE 4.1Å; T1162-M1190 HydrophobicContact CG2-CE 4.22Å; V1181-M1190 CarbonylContact C-O 3.6Å; V1181-M1190 WeakPolarHBondContact CA-O 3.27Å; V1182-M1190 PolarHBondContact N-O 3.35Å; V1182-M1190 PolarHBondContact O-N 3.34Å; V1184-M1190 HydrophobicContact CB-CG 4.28Å; V1184-M1190 HydrophobicContact CB-SD 3.92Å; V1184-M1190 HydrophobicContact CG1-SD 4.02Å; V1184-M1190 HydrophobicContact CG2-CB 4.15Å; V1184-M1190 HydrophobicContact CG2-CG 4.15Å; V1184-M1190 HydrophobicContact CG2-SD 3.86Å; K1187-M1190 HydrophobicContact CB-CG 4.03Å; K1187-M1190 HydrophobicContact CB-SD 3.67Å; K1187-M1190 HydrophobicContact CG-SD 3.84Å
1191	M	92.8	Very high	84.5	Confident	103 Å²	103	62.9 Å²	62.9	51%	0.507	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	135.5	169.3	-67.7	-173.5	-64.6	0	0	110.6	A1163 Y1178 V1181	A1163-M1191 HydrophobicContact CB-CB 4.38Å; Y1178-M1191 HydrophobicContact CE2-CB 4.43Å; V1181-M1191 HydrophobicContact CG2-CG 4.21Å
1192	T	94.9	Very high	82.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	155.4	-175	60.8	0	0	0	0	111.8	M1150 Y1178 R1179 G1180 V1182	M1150-T1192 HydrophobicContact CE-CG2 4.12Å; M1150-T1192 HydrophobicContact SD-CG2 3.78Å; Y1178-T1192 WeakPolarHBondContact CD2-O 3.36Å; R1179-T1192 WeakPolarHBondContact CB-O 3.45Å; R1179-T1192 WeakPolarHBondContact CD-OG1 3.31Å; R1179-T1192 PolarHBondContact N-O 3.45Å; G1180-T1192 PolarHBondContact N-O 3.13Å; G1180-T1192 PolarHBondContact O-N 2.84Å; G1180-T1192 PolarHBondContact O-OG1 3.12Å; V1182-T1192 HydrophobicContact CB-CG2 4.17Å; V1182-T1192 HydrophobicContact CG2-CG2 4.19Å; V1182-T1192 WeakPolarHBondContact CG2-OG1 3.48Å
1193	Y	96.4	Very high	82.1	Confident	35 Å²	35	67.4 Å²	67.4	14%	0.137	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	159.6	-178.3	-60.8	-102.3	0	0	0	109.8	Q1160 V1161 A1163 Y1166 E1177 Y1178	Q1160-Y1193 WeakPolarHBondContact CA-O 2.9Å; V1161-Y1193 PolarHBondContact N-O 2.83Å; V1161-Y1193 PolarHBondContact O-N 2.96Å; A1163-Y1193 HydrophobicContact CB-CE2 3.98Å; Y1166-Y1193 HydrophobicContact CD1-CE1 4.09Å; Y1166-Y1193 HydrophobicContact CD1-CE2 4.09Å; Y1166-Y1193 AromaticContact CD1-CZ 3.84Å; Y1166-Y1193 AromaticContact CD2-CD1 3.47Å; Y1166-Y1193 HydrophobicContact CD2-CD1 3.47Å; Y1166-Y1193 VanDerWaalsContact CD2-CD1 3.47Å; Y1166-Y1193 HydrophobicContact CD2-CD2 4.26Å; Y1166-Y1193 AromaticContact CD2-CE1 3.69Å; Y1166-Y1193 HydrophobicContact CD2-CE1 3.69Å; Y1166-Y1193 HydrophobicContact CD2-CE2 4.47Å; Y1166-Y1193 AromaticContact CD2-CG 3.8Å; Y1166-Y1193 HydrophobicContact CD2-CG 3.8Å; Y1166-Y1193 HydrophobicContact CE1-CE1 4.17Å; Y1166-Y1193 AromaticContact CE2-CD1 3.84Å; Y1166-Y1193 HydrophobicContact CE2-CD1 3.84Å; Y1166-Y1193 AromaticContact CE2-CE1 3.76Å; Y1166-Y1193 HydrophobicContact CE2-CE1 3.76Å; Y1166-Y1193 AromaticContact CG-CD1 3.9Å; Y1166-Y1193 HydrophobicContact CG-CD1 3.9Å; Y1166-Y1193 AromaticContact CG-CD2 3.9Å; Y1166-Y1193 HydrophobicContact CG-CD2 3.9Å; Y1166-Y1193 AromaticContact CG-CE1 3.87Å; Y1166-Y1193 HydrophobicContact CG-CE1 3.87Å; Y1166-Y1193 AromaticContact CG-CE2 3.91Å; Y1166-Y1193 HydrophobicContact CG-CE2 3.91Å; Y1166-Y1193 AromaticContact CG-CG 3.93Å; Y1166-Y1193 HydrophobicContact CG-CG 3.93Å; Y1166-Y1193 AromaticContact CG-CZ 3.88Å; E1177-Y1193 CarbonylContact O-C 3.53Å; E1177-Y1193 VanDerWaalsContact O-CA 3.23Å; E1177-Y1193 WeakPolarHBondContact O-CA 3.31Å; E1177-Y1193 WeakPolarHBondContact O-CB 3.39Å; Y1178-Y1193 HydrophobicContact CD2-CD1 4.07Å; Y1178-Y1193 AromaticContact CD2-CE1 3.69Å; Y1178-Y1193 HydrophobicContact CD2-CE1 3.69Å; Y1178-Y1193 HydrophobicContact CD2-CE2 4.36Å; Y1178-Y1193 AromaticContact CD2-CZ 3.84Å; Y1178-Y1193 HydrophobicContact CG-CE1 4.29Å
1194	F	96.6	Very high	81.8	Confident	20 Å²	20	65.3 Å²	65.3	9%	0.088	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	134.1	163.9	-64.3	-61.6	0	0	0	109.8	V1155 R1158 I1159 Q1160 L1176 E1177 R1179 T1196	V1155-F1194 HydrophobicContact CB-CE1 4.15Å; V1155-F1194 HydrophobicContact CB-CZ 4Å; V1155-F1194 HydrophobicContact CG2-CE1 4.29Å; V1155-F1194 HydrophobicContact CG2-CZ 3.78Å; R1158-F1194 HydrophobicContact CB-CD1 3.63Å; R1158-F1194 HydrophobicContact CB-CE1 3.73Å; R1158-F1194 HydrophobicContact CB-CG 4.33Å; R1158-F1194 HydrophobicContact CG-CD1 4.26Å; R1158-F1194 HydrophobicContact CG-CE1 4.25Å; I1159-F1194 CarbonylContact O-C 3.6Å; I1159-F1194 VanDerWaalsContact O-CA 3.24Å; I1159-F1194 WeakPolarHBondContact O-CA 3.02Å; Q1160-F1194 HydrophobicContact CB-CD1 4.4Å; Q1160-F1194 HydrophobicContact CB-CE1 4.46Å; L1176-F1194 CarbonylContact C-O 3.59Å; L1176-F1194 VanDerWaalsContact CA-O 3.22Å; L1176-F1194 WeakPolarHBondContact CA-O 3.45Å; E1177-F1194 HydrophobicContact CB-CB 4.4Å; E1177-F1194 PolarHBondContact N-O 2.94Å; E1177-F1194 PolarHBondContact O-N 2.03Å; R1179-F1194 HydrophobicContact CB-CD2 3.92Å; R1179-F1194 HydrophobicContact CB-CE2 3.77Å; R1179-F1194 HydrophobicContact CB-CG 4.48Å; R1179-F1194 HydrophobicContact CB-CZ 4.22Å; R1179-F1194 VanDerWaalsContact CD-CZ 3.44Å; R1179-F1194 HydrophobicContact CG-CD2 4.3Å; R1179-F1194 HydrophobicContact CG-CE1 4.47Å; R1179-F1194 HydrophobicContact CG-CE2 3.64Å; R1179-F1194 HydrophobicContact CG-CZ 3.74Å; F1194-T1196 HydrophobicContact CB-CG2 4.31Å
1195	L	95	Very high	81.7	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.9	164.2	176.2	64.7	0	0	0	108.2	A1093 M1097 I1159 V1161 L1169 Y1174 L1176	A1093-L1195 HydrophobicContact CB-CD2 3.99Å; M1097-L1195 HydrophobicContact CG-CD2 4.22Å; M1097-L1195 HydrophobicContact SD-CD2 4.33Å; M1097-L1195 HydrophobicContact SD-CG 4.47Å; I1159-L1195 HydrophobicContact CB-CB 4.11Å; I1159-L1195 HydrophobicContact CD1-CD2 4.29Å; I1159-L1195 HydrophobicContact CG2-CB 4.09Å; I1159-L1195 HydrophobicContact CG2-CD2 4.29Å; I1159-L1195 PolarHBondContact O-N 2.81Å; V1161-L1195 HydrophobicContact CG1-CB 4.09Å; L1169-L1195 HydrophobicContact CD1-CD1 4.36Å; L1169-L1195 HydrophobicContact CD1-CD2 4.4Å; Y1174-L1195 HydrophobicContact CD1-CD1 3.84Å; Y1174-L1195 HydrophobicContact CG-CD1 4.26Å; L1176-L1195 HydrophobicContact CD2-CB 4.21Å; L1176-L1195 HydrophobicContact CD2-CD1 4.1Å; L1176-L1195 HydrophobicContact CG-CD1 4.02Å
1196	T	90.2	Very high	82.3	Confident	64 Å²	64	62.8 Å²	62.8	39%	0.393	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	-28.9	-172.4	57.9	0	0	0	0	114.7	T1175 E1177 F1194	T1175-T1196 WeakPolarHBondContact CG2-OG1 3.15Å; T1175-T1196 PolarHBondContact O-N 3.48Å; T1175-T1196 PolarHBondContact O-OG1 3.27Å; T1175-T1196 VanDerWaalsContact O-OG1 3.11Å; E1177-T1196 HydrophobicContact CB-CG2 3.94Å; F1194-T1196 HydrophobicContact CB-CG2 4.31Å
1197	A	88.8	Confident	83.1	Confident	40 Å²	40	61.9 Å²	61.9	33%	0.331	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	152.9	173.4	0	0	0	0	0	112.9	T1175	T1175-A1197 PolarHBondContact N-O 2.89Å; T1175-A1197 PolarHBondContact O-N 3.21Å
1198	G	85.6	Confident	83.5	Confident	20 Å²	20	58.9 Å²	58.9	21%	0.206	38%	0.384	C	S	.	.			trans	-69.8	170.2	169.1	0	0	0	0	0	113.6	M1097	M1097-G1198 PolarHBondContact SD-N 3.4Å
1199	P	82.1	Confident	83.5	Confident	28 Å²	28	60.1 Å²	60.1	18%	0.182	38%	0.381	C	S	.	.			trans	-66.7	153	171	29.5	-34.7	0	0	0	111.2	Y1172 Y1174 G1201 S1202	Y1172-P1199 WeakPolarHBondContact O-CB 3.41Å; Y1174-P1199 VanDerWaalsContact CE1-CD 3.48Å; Y1174-P1199 HydrophobicContact CE2-CG 4.21Å; Y1174-P1199 VanDerWaalsContact CZ-CD 3.48Å; P1199-G1201 PolarHBondContact O-N 3.27Å; P1199-S1202 PolarHBondContact O-N 3.2Å; P1199-S1202 VanDerWaalsContact O-N 3.16Å; P1199-S1202 PolarHBondContact O-OG 2.98Å; P1199-S1202 VanDerWaalsContact O-OG 3.08Å
1200	P	59.5	Low	83.1	Confident	133 Å²	133	53.2 Å²	53.2	86%	0.864	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	105	-176.9	26.1	-34.4	0	0	0	111.6
1201	G	59.3	Low	82.5	Confident	82 Å²	82	54.3 Å²	54.3	85%	0.845	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.2	7.8	-179.5	0	0	0	0	0	115.8	P1199	P1199-G1201 PolarHBondContact O-N 3.27Å
1202	S	49.3	Very low	81.6	Confident	121 Å²	121	49.9 Å²	49.9	85%	0.846	36%	0.357	S	S	*	.			trans	-75.7	0	160.6	62.2	0	0	0	0	111.5	P1199	P1199-S1202 PolarHBondContact O-N 3.2Å; P1199-S1202 VanDerWaalsContact O-N 3.16Å; P1199-S1202 PolarHBondContact O-OG 2.98Å; P1199-S1202 VanDerWaalsContact O-OG 3.08Å

Retrieved 1,202 of 1,202 residues in 2514.1 ms (Link to these results)

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