A0A5K4EM09_SCHMA Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A5K4EM09, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 853 aa.

						>A0A5K4EM09_SCHMA|A0A5K4EM09
MSYGKRGGRWGMNFISGSGPQHSLSTHSVFKDEKSDVNKQSEDYKNTKPPNFIRTGGASVPPPPSLGSRNSRGYSDPNEVLINHSAFAGTQGGSTRAFANLGRKRVADEDDYFLEDDDTNNLEYQPAPGSPAATKRSDQADVQSDDSDDPLDQFMAGINEEVRTLHSGEKSVTKESNSKGKKSTKGDGKYHIHLHQNLQDKRGVRDDIEQEDEIESYLRFMEENPHLGLPGDDEEEVYEYDADGNIIGTEKKTIDPLPPIDHSMINYAPFAKNFYVEHVEISSLDEAGVDSLRSKLGLRVSGPSPLRPVCSFAHLGLDEPLMEAIRKAGYTQPTPIQAQAVPLILAGRDVIGIGKTGSGKTAAFLWPLIIHIMDQPELKLGDGPIGVICAPTRELALQIYSEAKKLAKVYNLTVVCAYGGGSLWEQQKACEAGCEILVCTPGRLIDIVKKKSTNLRRVTYLVFDEADKMFNLGFEPQVRSIANHVRPDRQTLLFSATFKRRLERLARDILLDPVRIIQGELGEANEDITQHVEIFDKIEQKWDWLTRNLVRLTTEGSVLIFVTRKVHSEEVAQKLKSRDLKVLLIHGDMHQSDRNTVIQAFKRQEAPILVATDVASRGLDIPSIHNVINYEVARDIDTHTHRIGRTGRAGAKGTAYTLFVAGKDPVDFAACLVQHLESGSQKVPQRLLDIALKCNWFANNRSSLNGRNEGCIRPSGGFEPRQPRARPGLGLSSDSSESDYYPRSGPAAAAAAGEGAELIRPGGLQADRFSAMKAAFSAQYNRRFVSAGVEASRYTHPEMLKSSNTTDRPQLADSFIVQSSNLEESQCPQQLQSSQVKPQNVQTDSKQKRSRWD
					

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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	34.5	Very low	41	Very low	244 Å²	244	167.3 Å²	167.3	100%	1.202	88%	0.883	S	S	*	*				0	94.4	0	-72.3	172.3	167.5	0	0	107.1
2	S	38.9	Very low	40.7	Very low	102 Å²	102	168.3 Å²	168.3	71%	0.713	88%	0.883	S	S	*	*				86.5	100.6	106.9	-177.2	0	0	0	0	115.3
3	Y	45	Very low	41	Very low	232 Å²	232	168.2 Å²	168.2	91%	0.91	88%	0.884	S	S	*	*			trans	44.7	143.7	137.4	-60.3	-83.9	0	0	0	120.5
4	G	45.7	Very low	40.6	Very low	73 Å²	73	170.9 Å²	170.9	75%	0.753	89%	0.886	S	S	*	*			cis	157.7	145.3	10.3	0	0	0	0	0	110
5	K	39.5	Very low	41	Very low	210 Å²	210	170.8 Å²	170.8	91%	0.913	89%	0.885	S	S	*	*			trans	-59	156.7	176.5	-72.8	174.6	172.4	176.3	0	114
6	R	48.8	Very low	40.8	Very low	252 Å²	252	167.4 Å²	167.4	95%	0.951	88%	0.88	S	S	*	*			trans	-159.7	124.1	142.4	-121.3	-178.1	-90	-171.3	-4.7	112.9
7	G	36.7	Very low	41.2	Very low	80 Å²	80	162.4 Å²	162.4	83%	0.825	88%	0.878	S	S	*	*			trans	-103.5	170.8	165.5	0	0	0	0	0	111.7
8	G	44.8	Very low	41.2	Very low	83 Å²	83	160.7 Å²	160.7	86%	0.856	88%	0.88	S	S	*	*			trans	-155.7	127.1	175	0	0	0	0	0	112.1
9	R	36	Very low	41.2	Very low	236 Å²	236	156.1 Å²	156.1	89%	0.891	87%	0.874	S	S	*	*			trans	-125.4	135.2	-179.9	-177.1	-174	-169.4	-160.3	4.7	107
10	W	42.9	Very low	41.3	Very low	257 Å²	257	154.1 Å²	154.1	97%	0.973	87%	0.868	S	S	*	*			trans	-145.6	138.7	164.8	-80.2	95.9	0	0	0	110.7
11	G	38.3	Very low	41.3	Very low	71 Å²	71	155.1 Å²	155.1	73%	0.732	87%	0.866	S	S	*	*			trans	-108.2	171.2	-169.5	0	0	0	0	0	116.3
12	M	37.8	Very low	41.5	Very low	179 Å²	179	152.5 Å²	152.5	88%	0.882	85%	0.85	S	S	*	*			trans	14.9	135	155.7	-67.6	164.3	107.8	0	0	121.4
13	N	43.5	Very low	41.4	Very low	168 Å²	168	152.2 Å²	152.2	90%	0.898	85%	0.848	S	S	*	*				-162.9	133.5	129.5	-90.6	-30	0	0	0	111.9
14	F	36.6	Very low	41.2	Very low	206 Å²	206	150 Å²	150	90%	0.904	85%	0.851	S	S	*	*			trans	-97.3	129.4	172.5	-107.2	-94.3	0	0	0	109.3
15	I	45.8	Very low	40.7	Very low	169 Å²	169	151.3 Å²	151.3	87%	0.867	85%	0.849	S	S	*	*			trans	-147.1	129.7	156.7	-65.2	-173.9	0	0	0	108.9
16	S	38.4	Very low	40.9	Very low	117 Å²	117	148.2 Å²	148.2	82%	0.818	85%	0.848	S	S	*	*			trans	-84.7	149	172.4	48.6	0	0	0	0	112
17	G	47.4	Very low	40.3	Very low	82 Å²	82	144.8 Å²	144.8	85%	0.845	84%	0.842	S	S	*	*			trans	-172.1	113.4	172.2	0	0	0	0	0	111.9
18	S	41.8	Very low	40.4	Very low	131 Å²	131	145.8 Å²	145.8	92%	0.916	84%	0.836	S	S	*	*			trans	-94.7	145.6	177.9	35	0	0	0	0	111.6
19	G	39.9	Very low	40.1	Very low	74 Å²	74	147 Å²	147	76%	0.763	83%	0.827	S	S	*	*			trans	150.2	147.6	160.3	0	0	0	0	0	115.7
20	P	44.6	Very low	40.2	Very low	116 Å²	116	144.6 Å²	144.6	75%	0.753	82%	0.823	S	S	*	*			trans	-129.2	175.3	-136.4	40.1	-23.1	0	0	0	117.3
21	Q	39.9	Very low	40	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.822	81%	0.812	S	S	*	*			trans	71.9	122.3	158.8	-49	-150.9	4.8	0	0	120
22	H	39.7	Very low	40	Very low	188 Å²	188	143.1 Å²	143.1	87%	0.87	81%	0.81	S	S	*	*				-169.7	142.2	117.4	-108.3	-81.1	0	0	0	112.3
23	S	37	Very low	40.2	Very low	96 Å²	96	143.6 Å²	143.6	67%	0.671	81%	0.81	S	S	*	*			trans	-60.1	149.1	-178.4	51.7	0	0	0	0	117.4
24	L	40.6	Very low	40	Very low	186 Å²	186	145.2 Å²	145.2	97%	0.974	81%	0.809	S	S	*	*			trans	-148.2	131.4	142.9	-89.4	172.6	0	0	0	110.5
25	S	33.8	Very low	40.2	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	80%	0.797	S	S	*	*			trans	-114.4	149.3	-172.1	54.7	0	0	0	0	112
26	T	44.4	Very low	39.9	Very low	146 Å²	146	138.9 Å²	138.9	90%	0.896	79%	0.794	S	S	*	*			trans	-139.9	123.9	157	43.1	0	0	0	0	112
27	H	36.9	Very low	40	Very low	180 Å²	180	140.1 Å²	140.1	83%	0.833	80%	0.796	S	S	*	*			trans	-56.1	164.9	169.5	-82	-105.2	0	0	0	112.7
28	S	37.6	Very low	39.4	Very low	100 Å²	100	142.9 Å²	142.9	70%	0.699	79%	0.792	S	S	*	*			cis	-173.6	139.2	41.8	70.2	0	0	0	0	114.3
29	V	38.6	Very low	39.2	Very low	109 Å²	109	145 Å²	145	66%	0.661	78%	0.784	S	S	*	*				75.9	116.5	128.9	-178.4	0	0	0	0	122.2
30	F	38.9	Very low	39.1	Very low	185 Å²	185	150.1 Å²	150.1	81%	0.811	79%	0.788	S	S	*	*				-175.6	103.3	113.4	-100.6	-79.6	0	0	0	108.5
31	K	38.7	Very low	38.9	Very low	167 Å²	167	149.4 Å²	149.4	73%	0.726	79%	0.786	S	S	*	*				54.8	141.1	105.2	-72.5	-166.2	165.9	-179.3	0	115.6
32	D	39	Very low	38.6	Very low	131 Å²	131	149.8 Å²	149.8	70%	0.701	79%	0.788	S	S	*	*			cis	-177.7	142.1	-9.5	-101.7	-32.5	0	0	0	105
33	E	41.5	Very low	38.6	Very low	189 Å²	189	147.7 Å²	147.7	88%	0.883	78%	0.783	S	S	*	*			trans	153.1	90.7	152.4	-91.2	-174.2	137.3	0	0	108.8
34	K	39.4	Very low	38.6	Very low	202 Å²	202	152.7 Å²	152.7	88%	0.878	79%	0.788	S	S	*	*				47.1	125.9	88.5	-74	-173.3	177.7	178.6	0	112.5
35	S	39.4	Very low	38.4	Very low	94 Å²	94	153.4 Å²	153.4	66%	0.657	78%	0.784	S	S	*	*			cis	-173.4	148.2	38.4	43.8	0	0	0	0	112.2
36	D	40.4	Very low	38.4	Very low	148 Å²	148	156.3 Å²	156.3	79%	0.791	79%	0.791	S	S	*	*			trans	56.6	127.1	144.2	-50.1	-30.7	0	0	0	119.1
37	V	41.3	Very low	38.1	Very low	143 Å²	143	156 Å²	156	87%	0.867	79%	0.789	S	S	*	*				-158.7	140.5	58.2	170.3	0	0	0	0	110.2
38	N	35	Very low	38.2	Very low	140 Å²	140	156.6 Å²	156.6	75%	0.749	79%	0.789	S	S	*	*			trans	-99.8	162.7	-177.2	-167.2	5.6	0	0	0	111.5
39	K	37.4	Very low	38.6	Very low	176 Å²	176	157.4 Å²	157.4	77%	0.765	79%	0.792	S	S	*	*			trans	100.1	105.8	156.5	-59	179.7	177.3	-178.6	0	119
40	Q	36.6	Very low	38.8	Very low	181 Å²	181	157.5 Å²	157.5	85%	0.846	80%	0.795	S	S	*	*				172.3	95.6	113.9	-90.9	171.8	8.3	0	0	107.7
41	S	39.8	Very low	38.7	Very low	101 Å²	101	155.8 Å²	155.8	71%	0.706	80%	0.795	S	S	*	*				51.4	98.2	97.9	63.9	0	0	0	0	113.5
42	E	34.4	Very low	38.6	Very low	184 Å²	184	156.9 Å²	156.9	86%	0.86	80%	0.8	S	S	*	*				66.9	102.5	111.8	-74.7	-162.9	156.7	0	0	114.2
43	D	39.6	Very low	38.3	Very low	143 Å²	143	157.1 Å²	157.1	77%	0.765	80%	0.8	S	S	*	*			trans	-172.7	146.8	139.1	-109.9	-19.3	0	0	0	113.2
44	Y	37	Very low	38.1	Very low	201 Å²	201	159 Å²	159	79%	0.788	80%	0.799	S	S	*	*			trans	79.3	85.9	169.4	-62.7	-77.3	0	0	0	120.5
45	K	35.9	Very low	38	Very low	202 Å²	202	155.2 Å²	155.2	88%	0.878	79%	0.792	S	S	*	*			trans	-54.4	145.6	131.2	-72.2	174.9	177.7	173.7	0	109.4
46	N	34.8	Very low	37.4	Very low	160 Å²	160	154.8 Å²	154.8	86%	0.856	80%	0.803	S	S	*	*			trans	101.3	76.1	165.5	-145.7	24.4	0	0	0	116.2
47	T	38.3	Very low	37.1	Very low	139 Å²	139	151.4 Å²	151.4	85%	0.853	80%	0.803	S	S	*	*			trans	-143.1	129.7	158.2	44.1	0	0	0	0	111.3
48	K	38.3	Very low	36.7	Very low	193 Å²	193	148.8 Å²	148.8	84%	0.839	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-59.5	155.6	173.5	-75.1	174.5	174.9	178.7	0	111.3
49	P	46.4	Very low	36.7	Very low	117 Å²	117	147.6 Å²	147.6	76%	0.76	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-61.7	144.6	173.9	28.3	-34.1	0	0	0	110.2	N51	P49-N51 PolarHBondContact O-N 3.09Å
50	P	43.2	Very low	37	Very low	111 Å²	111	145.8 Å²	145.8	72%	0.721	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.8	126.5	-177.6	29	-31.5	0	0	0	110.1	F52	P50-F52 PolarHBondContact O-N 3.12Å; P50-F52 VanDerWaalsContact O-N 3.09Å
51	N	36.5	Very low	37.3	Very low	150 Å²	150	142 Å²	142	80%	0.802	79%	0.794	S	S	*	*			trans	-60.2	107.3	160.4	-82.3	-24	0	0	0	108.3	P49 I53	P49-N51 PolarHBondContact O-N 3.09Å; N51-I53 HydrophobicContact CB-CG1 4.42Å; N51-I53 PolarHBondContact O-N 3.19Å
52	F	36.9	Very low	37.6	Very low	190 Å²	190	142.8 Å²	142.8	83%	0.833	80%	0.796	S	S	*	*			trans	-74.6	85.4	163.1	-117.1	-90.7	0	0	0	108.2	P50 R54	P50-F52 PolarHBondContact O-N 3.12Å; P50-F52 VanDerWaalsContact O-N 3.09Å; F52-R54 VanDerWaalsContact C-N 3.35Å; F52-R54 PolarHBondContact O-N 3.42Å; F52-R54 VanDerWaalsContact O-N 3.1Å
53	I	32.4	Very low	38.5	Very low	136 Å²	136	139.7 Å²	139.7	70%	0.697	79%	0.792	S	S	*	*			trans	-70.5	96.8	161.5	-64.8	174.5	0	0	0	105.9	N51 T55	N51-I53 HydrophobicContact CB-CG1 4.42Å; N51-I53 PolarHBondContact O-N 3.19Å; I53-T55 HydrophobicContact CG2-CG2 4.48Å; I53-T55 PolarHBondContact O-N 3.14Å
54	R	36.3	Very low	38.4	Very low	229 Å²	229	138.5 Å²	138.5	86%	0.864	79%	0.792	S	S	*	*			trans	-79.9	99.6	164.9	-134.5	-179.3	-174.4	-151.7	2.7	107.2	F52	F52-R54 VanDerWaalsContact C-N 3.35Å; F52-R54 PolarHBondContact O-N 3.42Å; F52-R54 VanDerWaalsContact O-N 3.1Å
55	T	37.1	Very low	38.3	Very low	121 Å²	121	134.7 Å²	134.7	74%	0.742	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-51.3	134.6	167.5	43.1	0	0	0	0	110.6	I53 G57	I53-T55 HydrophobicContact CG2-CG2 4.48Å; I53-T55 PolarHBondContact O-N 3.14Å; T55-G57 PolarHBondContact O-N 2.95Å
56	G	27.9	Very low	38.5	Very low	85 Å²	85	133.3 Å²	133.3	88%	0.876	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-50.7	125.3	-178.5	0	0	0	0	0	113.4
57	G	33.1	Very low	38.4	Very low	77 Å²	77	129 Å²	129	79%	0.794	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-95.6	116.6	164.6	0	0	0	0	0	108.5	T55	T55-G57 PolarHBondContact O-N 2.95Å
58	A	34.6	Very low	38.1	Very low	89 Å²	89	127.8 Å²	127.8	74%	0.736	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-55.7	140.2	-175.8	0	0	0	0	0	113.2	V60	A58-V60 PolarHBondContact O-N 3.43Å; A58-V60 VanDerWaalsContact O-N 3.11Å
59	S	33.6	Very low	37.8	Very low	114 Å²	114	129.7 Å²	129.7	80%	0.797	79%	0.789	S	S	*	*			trans	-49.5	111.4	162.7	52.2	0	0	0	0	110.3	P61	S59-P61 WeakPolarHBondContact O-CD 3.3Å
60	V	43.7	Very low	37.1	Very low	138 Å²	138	131.5 Å²	131.5	84%	0.836	79%	0.792	S	S	*	*			trans	-76.7	115	167.6	-179.1	0	0	0	0	107.1	A58	A58-V60 PolarHBondContact O-N 3.43Å; A58-V60 VanDerWaalsContact O-N 3.11Å
61	P	42.4	Very low	36.8	Very low	102 Å²	102	131.2 Å²	131.2	66%	0.662	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.4	150.2	175.5	31.9	-32.3	0	0	0	109.7	S59	S59-P61 WeakPolarHBondContact O-CD 3.3Å
62	P	47.9	Very low	36.5	Very low	117 Å²	117	136 Å²	136	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-64.5	150	171.4	28.9	-33	0	0	0	110.3
63	P	52.7	Low	36.3	Very low	120 Å²	120	130 Å²	130	78%	0.779	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.2	152.8	-177.5	27.1	-34.1	0	0	0	112.3
64	P	37.8	Very low	36.6	Very low	117 Å²	117	134.6 Å²	134.6	76%	0.76	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-75	130.2	-173.3	30.8	-32.7	0	0	0	111.3	L66	P64-L66 PolarHBondContact O-N 3.24Å
65	S	34.4	Very low	36.7	Very low	122 Å²	122	128.2 Å²	128.2	85%	0.853	79%	0.792	S	S	*	*			trans	-71.8	103.9	170.5	56.9	0	0	0	0	110.4
66	L	39.4	Very low	36.5	Very low	173 Å²	173	130.4 Å²	130.4	91%	0.906	80%	0.799	S	S	*	*			trans	-74.9	124.5	164.6	-97.6	150.6	0	0	0	109.4	P64	P64-L66 PolarHBondContact O-N 3.24Å
67	G	34	Very low	37	Very low	69 Å²	69	131.2 Å²	131.2	71%	0.711	79%	0.789	S	S	*	*			trans	-84.8	172.4	-168.1	0	0	0	0	0	116.8
68	S	31.2	Very low	37.2	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	79%	0.794	S	S	*	*			trans	75.3	100.4	148.7	-152.4	0	0	0	0	118.5
69	R	33	Very low	37.1	Very low	232 Å²	232	140.2 Å²	140.2	88%	0.875	80%	0.801	S	S	*	*				-175.1	120.7	108.1	-101.4	170.7	155	-176	-6.5	113.1
70	N	31.1	Very low	37.2	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	80%	0.801	S	S	*	*			trans	23.8	120.5	147.6	-68.6	-11.5	0	0	0	119.5
71	S	36.1	Very low	36.7	Very low	106 Å²	106	142.6 Å²	142.6	74%	0.741	80%	0.803	S	S	*	*				171	135.6	82.4	69.3	0	0	0	0	113.6
72	R	31.9	Very low	36.3	Very low	249 Å²	249	145 Å²	145	94%	0.94	81%	0.809	S	S	*	*			trans	57.9	110.7	143.4	-68.3	176.2	171	162.8	-2.8	120.7
73	G	31.3	Very low	35.7	Very low	64 Å²	64	145.8 Å²	145.8	66%	0.66	81%	0.807	S	S	*	*				127.7	117.6	116.1	0	0	0	0	0	118.3
74	Y	38.5	Very low	35	Very low	233 Å²	233	149.3 Å²	149.3	91%	0.914	81%	0.813	S	S	*	*			trans	76.5	139.6	160.1	-66.7	-92.1	0	0	0	118.2
75	S	38.8	Very low	34.7	Very low	95 Å²	95	149.3 Å²	149.3	66%	0.664	82%	0.815	S	S	*	*			cis	179.7	112.8	-37.9	43.4	0	0	0	0	103.8
76	D	33.5	Very low	34.8	Very low	168 Å²	168	147.7 Å²	147.7	90%	0.898	81%	0.809	S	S	*	*			trans	-79.9	138.2	168.1	-99.4	-36.7	0	0	0	110
77	P	38	Very low	34.6	Very low	102 Å²	102	149.1 Å²	149.1	66%	0.662	81%	0.809	S	S	*	*			trans	-123.4	106.7	159.3	31.5	-15.3	0	0	0	110.5
78	N	37.4	Very low	34.7	Very low	166 Å²	166	150.6 Å²	150.6	89%	0.888	81%	0.814	S	S	*	*			trans	174.1	72.8	131.2	-85.2	-21.6	0	0	0	111
79	E	32	Very low	34.9	Very low	189 Å²	189	148.4 Å²	148.4	88%	0.883	81%	0.81	S	S	*	*			trans	-132.8	158.8	150.5	-100.4	-166	158.3	0	0	107.6
80	V	35.8	Very low	34.9	Very low	132 Å²	132	143.7 Å²	143.7	80%	0.8	81%	0.807	S	S	*	*			trans	96.2	93.6	174.7	-164.1	0	0	0	0	115.4
81	L	34.3	Very low	35.2	Very low	169 Å²	169	145.6 Å²	145.6	89%	0.885	81%	0.811	S	S	*	*				-172.3	96.4	117.2	-99.6	147.3	0	0	0	111.1
82	I	32.8	Very low	35.1	Very low	152 Å²	152	144.5 Å²	144.5	78%	0.779	82%	0.816	S	S	*	*			trans	-115.1	122.5	155.7	-58.6	177.3	0	0	0	106.1
83	N	35	Very low	35.1	Very low	134 Å²	134	136.3 Å²	136.3	72%	0.717	81%	0.81	S	S	*	*			trans	153	114.7	140.6	-81.8	-28.2	0	0	0	110
84	H	39.4	Very low	35.2	Very low	195 Å²	195	138.9 Å²	138.9	90%	0.903	82%	0.818	S	S	*	*				-171	110.8	121.8	-94.9	-65.2	0	0	0	109.5
85	S	31.1	Very low	35.1	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	82%	0.817	S	S	*	*			trans	-75.6	141.2	169.6	50.2	0	0	0	0	112
86	A	37.1	Very low	34.8	Very low	89 Å²	89	142 Å²	142	74%	0.736	83%	0.829	S	S	*	*			trans	-178.9	129.1	140.2	0	0	0	0	0	113.1
87	F	34.9	Very low	34.8	Very low	202 Å²	202	138 Å²	138	89%	0.886	82%	0.82	S	S	*	*			trans	67	102	152.9	-83.6	-100.9	0	0	0	118.8
88	A	35.6	Very low	34.6	Very low	101 Å²	101	143.7 Å²	143.7	84%	0.835	84%	0.835	S	S	*	*				86.7	125.3	66.9	0	0	0	0	0	114.3
89	G	35.4	Very low	34.4	Very low	68 Å²	68	139.6 Å²	139.6	70%	0.701	82%	0.824	S	S	*	*			trans	130.8	72.8	151.7	0	0	0	0	0	119.2
90	T	33.7	Very low	34.4	Very low	132 Å²	132	137.8 Å²	137.8	81%	0.81	82%	0.821	S	S	*	*				42.6	141.6	128.9	53.4	0	0	0	0	124.4
91	Q	36.9	Very low	34.3	Very low	195 Å²	195	140.1 Å²	140.1	91%	0.911	83%	0.828	S	S	*	*			trans	84.6	129	162.7	-47.1	-164.3	14.9	0	0	114.8
92	G	33	Very low	34.1	Very low	83 Å²	83	135.7 Å²	135.7	86%	0.856	82%	0.823	S	S	*	*			cis	133.9	123.3	16.9	0	0	0	0	0	107.8
93	G	33.2	Very low	34.2	Very low	78 Å²	78	140.4 Å²	140.4	80%	0.804	83%	0.831	S	S	*	*			trans	104.6	101.4	160.5	0	0	0	0	0	118.1
94	S	32.3	Very low	34.1	Very low	118 Å²	118	143.8 Å²	143.8	83%	0.825	84%	0.839	S	S	*	*			trans	24.3	119.9	136.2	-143.1	0	0	0	0	119.3
95	T	36.9	Very low	33.8	Very low	146 Å²	146	146.1 Å²	146.1	90%	0.896	84%	0.84	S	S	*	*				-175.6	148.5	124.5	27.6	0	0	0	0	110.7
96	R	32.5	Very low	34.1	Very low	246 Å²	246	147.1 Å²	147.1	93%	0.928	84%	0.841	S	S	*	*			trans	-69.1	162.7	-173.5	-73.7	170.2	160.1	171.4	-7.7	113.8
97	A	32.9	Very low	34	Very low	85 Å²	85	147.1 Å²	147.1	70%	0.702	84%	0.84	S	S	*	*			trans	85.8	94.6	151.6	0	0	0	0	0	117.4
98	F	34.9	Very low	34.2	Very low	221 Å²	221	145.2 Å²	145.2	97%	0.969	84%	0.84	S	S	*	*			trans	-142.5	117.4	132.5	-88.7	-75.5	0	0	0	109.4
99	A	33.4	Very low	34.2	Very low	81 Å²	81	149.1 Å²	149.1	67%	0.669	84%	0.841	S	S	*	*			trans	-77.1	162.7	173.4	0	0	0	0	0	111.3
100	N	31.3	Very low	34.4	Very low	151 Å²	151	153.3 Å²	153.3	81%	0.807	85%	0.847	S	S	*	*			trans	74.1	82.8	154.9	-62.3	-11.9	0	0	0	119
101	L	33.8	Very low	34.6	Very low	181 Å²	181	154.7 Å²	154.7	95%	0.948	85%	0.849	S	S	*	*			trans	-151.7	102.8	140	-85	113.8	0	0	0	106.2
102	G	29.4	Very low	34.6	Very low	76 Å²	76	156 Å²	156	78%	0.784	85%	0.848	S	S	*	*				84.5	76.1	66.7	0	0	0	0	0	109.9
103	R	35.3	Very low	34.8	Very low	251 Å²	251	161.9 Å²	161.9	95%	0.947	85%	0.85	S	S	*	*			trans	-120.3	106.2	166.7	-93.5	-174.4	176.5	177.4	-0.4	110.8
104	K	33.9	Very low	35.3	Very low	205 Å²	205	166.7 Å²	166.7	89%	0.891	86%	0.856	S	S	*	*			trans	-31.8	129.8	168.2	-91.5	169	161.3	173.8	0	114
105	R	32.8	Very low	35.5	Very low	244 Å²	244	169.6 Å²	169.6	92%	0.921	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-62.2	137.7	161.9	-56.8	-179	-149.2	157.1	4.2	109.8
106	V	37.2	Very low	35.5	Very low	137 Å²	137	169.5 Å²	169.5	83%	0.83	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-83.6	121	159.4	176.3	0	0	0	0	105.5
107	A	35.5	Very low	35.8	Very low	88 Å²	88	164.8 Å²	164.8	73%	0.727	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-75.5	123.6	-179.3	0	0	0	0	0	109.8
108	D	39.4	Very low	36	Very low	163 Å²	163	167.6 Å²	167.6	87%	0.872	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-85.8	118.1	160.5	-85.1	-33.2	0	0	0	107.5	D110	D108-D110 PolarHBondContact O-N 3.36Å
109	E	34.9	Very low	36	Very low	183 Å²	183	162.8 Å²	162.8	86%	0.855	84%	0.836	S	S	*	*			trans	-81.4	100.1	169.3	-69.3	-175.3	154.1	0	0	108.2
110	D	38.6	Very low	36.3	Very low	156 Å²	156	166.2 Å²	166.2	83%	0.834	84%	0.843	S	S	*	*			trans	-165	57.1	162.7	-86.7	-33.1	0	0	0	109.6	D108	D108-D110 PolarHBondContact O-N 3.36Å
111	D	39.5	Very low	36.5	Very low	161 Å²	161	166.3 Å²	166.3	86%	0.861	84%	0.844	S	S	*	*			trans	-144.5	91	163.5	-96.1	-29.6	0	0	0	108.7
112	Y	35.8	Very low	37	Very low	223 Å²	223	166 Å²	166	88%	0.875	84%	0.842	S	S	*	*			trans	-140.9	102.2	169.2	-99	-92.8	0	0	0	106.4
113	F	38.1	Very low	37.6	Very low	205 Å²	205	170.7 Å²	170.7	90%	0.899	84%	0.844	S	S	*	*			trans	162.1	100.7	147.6	-90.6	-68.2	0	0	0	107.1
114	L	43.2	Very low	38.4	Very low	179 Å²	179	168.5 Å²	168.5	94%	0.937	84%	0.837	S	S	*	*			trans	160.7	79.4	140.8	-82.4	170.4	0	0	0	108.6
115	E	35.8	Very low	39.3	Very low	179 Å²	179	167.3 Å²	167.3	84%	0.836	84%	0.835	S	S	*	*			trans	-112.3	149.7	151.2	-81	-174.2	164.7	0	0	107.4
116	D	37.9	Very low	40.5	Very low	144 Å²	144	159.4 Å²	159.4	77%	0.77	81%	0.814	S	S	*	*			trans	90.6	93.7	172.4	-51.2	-25	0	0	0	117
117	D	38.3	Very low	40.8	Very low	148 Å²	148	156.3 Å²	156.3	79%	0.791	80%	0.804	S	S	*	*				-177	121.4	106.6	-87.5	-22.2	0	0	0	113
118	D	37.4	Very low	41.3	Very low	143 Å²	143	158.8 Å²	158.8	77%	0.765	81%	0.812	S	S	*	*			trans	71.4	99.6	140.1	-62.3	-25.9	0	0	0	123.9
119	T	34.8	Very low	42.1	Very low	120 Å²	120	155 Å²	155	74%	0.736	81%	0.812	S	S	*	*			trans	-10.2	129.3	137.6	40.3	0	0	0	0	118.9
120	N	38.7	Very low	42.8	Very low	154 Å²	154	149.7 Å²	149.7	82%	0.824	80%	0.795	S	S	*	*				-170.4	124.1	122.7	-96.4	-42	0	0	0	113.9
121	N	36.2	Very low	43	Very low	152 Å²	152	148.8 Å²	148.8	81%	0.813	80%	0.798	S	S	*	*			trans	16.4	120.8	152.4	-83.4	-14.6	0	0	0	119.1
122	L	43.3	Very low	43.2	Very low	175 Å²	175	145.5 Å²	145.5	92%	0.916	79%	0.793	S	S	*	*			trans	-160	165.7	132.8	-95.4	176.7	0	0	0	110.4
123	E	43.9	Very low	43.4	Very low	174 Å²	174	139.9 Å²	139.9	81%	0.813	79%	0.793	S	S	*	*			trans	-103	152.6	-134.1	-173.7	173.4	-176.2	0	0	114.9	Q125	E123-Q125 PolarHBondContact O-N 2.99Å
124	Y	52	Low	43.4	Very low	206 Å²	206	136.4 Å²	136.4	81%	0.808	79%	0.788	S	S	*	*			trans	-59.5	121.9	-176.1	177.3	-98.9	0	0	0	113.8	P126	Y124-P126 HydrophobicContact CE1-CB 4.03Å; Y124-P126 HydrophobicContact CE1-CG 4.42Å
125	Q	52.2	Low	43.2	Very low	180 Å²	180	136.8 Å²	136.8	84%	0.841	78%	0.782	S	S	*	*			trans	-114.6	119.7	167.8	-68.7	-174.3	5.9	0	0	110.7	E123	E123-Q125 PolarHBondContact O-N 2.99Å
126	P	57	Low	43.3	Very low	77 Å²	77	139 Å²	139	50%	0.5	78%	0.783	S	S	.	*	P	Polyproline II helix	trans	-76	147	-179.2	29.6	-31.9	0	0	0	112.2	Y124	Y124-P126 HydrophobicContact CE1-CB 4.03Å; Y124-P126 HydrophobicContact CE1-CG 4.42Å
127	A	45.3	Very low	43.2	Very low	73 Å²	73	136.6 Å²	136.6	60%	0.603	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-61.7	151.4	-176.3	0	0	0	0	0	113.8	G129 S130	A127-G129 PolarHBondContact O-N 2.92Å; A127-S130 PolarHBondContact O-OG 3.43Å
128	P	44.2	Very low	43.1	Very low	139 Å²	139	135.6 Å²	135.6	90%	0.903	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	123.4	175.9	-16.1	28.2	0	0	0	110.7
129	G	58	Low	43.2	Very low	85 Å²	85	137.6 Å²	137.6	88%	0.876	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	113.5	3.7	177	0	0	0	0	0	116.3	A127	A127-G129 PolarHBondContact O-N 2.92Å
130	S	49.1	Very low	43.3	Very low	71 Å²	71	135.5 Å²	135.5	50%	0.497	77%	0.772	S	S	.	*			trans	-85.9	135.1	175.7	55.6	0	0	0	0	112.8	A127 A132	A127-S130 PolarHBondContact O-OG 3.43Å; S130-A132 PolarHBondContact O-N 3.16Å
131	P	42.9	Very low	43.1	Very low	137 Å²	137	135.5 Å²	135.5	89%	0.89	77%	0.772	S	S	*	*	S	Bend	trans	-81.9	78.6	-171.1	31.5	-34.1	0	0	0	112.3
132	A	42.5	Very low	43	Very low	92 Å²	92	134 Å²	134	76%	0.76	77%	0.768	S	S	*	*			trans	-156.9	73.1	171.2	0	0	0	0	0	113.7	S130	S130-A132 PolarHBondContact O-N 3.16Å
133	A	40.1	Very low	42.7	Very low	105 Å²	105	133.7 Å²	133.7	87%	0.868	76%	0.762	S	S	*	*			trans	-179.6	118.6	145	0	0	0	0	0	110.2
134	T	39.3	Very low	42.2	Very low	132 Å²	132	130.4 Å²	130.4	81%	0.81	76%	0.758	S	S	*	*			trans	-121.9	140.1	-173.6	-18	0	0	0	0	110.4
135	K	39	Very low	41.6	Very low	186 Å²	186	128.2 Å²	128.2	81%	0.809	76%	0.76	S	S	*	*			trans	103	123.8	149.2	-63.6	-179.2	176.7	177.2	0	120.5
136	R	36.5	Very low	41.2	Very low	226 Å²	226	127.4 Å²	127.4	85%	0.853	76%	0.762	S	S	*	*			trans	116.8	97.7	144.1	-68.8	177.1	-178.5	-177.2	-0.2	113.3
137	S	35.8	Very low	40.7	Very low	93 Å²	93	129 Å²	129	65%	0.65	78%	0.775	S	S	*	*				70.3	127.8	79.2	84.9	0	0	0	0	110.8
138	D	37.3	Very low	41.1	Very low	128 Å²	128	131 Å²	131	68%	0.684	78%	0.775	S	S	*	*			cis	-168.6	159.2	42.7	-83	-61.4	0	0	0	112.4
139	Q	38.4	Very low	42.2	Very low	184 Å²	184	128.3 Å²	128.3	86%	0.86	75%	0.753	S	S	*	*			trans	70.5	136.8	148.9	-74.1	166.1	43.3	0	0	119.5
140	A	37.6	Very low	42.8	Very low	77 Å²	77	129.2 Å²	129.2	64%	0.636	74%	0.744	S	S	*	*			cis	-162.4	146.5	8.5	0	0	0	0	0	111.7
141	D	33.5	Very low	43.8	Very low	153 Å²	153	130.9 Å²	130.9	82%	0.818	75%	0.746	S	S	*	*			trans	65	133	138.5	-61.7	-22.8	0	0	0	125.3
142	V	35.5	Very low	45.3	Very low	120 Å²	120	129.6 Å²	129.6	73%	0.727	73%	0.732	S	S	*	*			trans	113.6	94.5	143.4	-164	0	0	0	0	117.8
143	Q	37.2	Very low	46.7	Very low	170 Å²	170	130.9 Å²	130.9	79%	0.794	72%	0.722	S	S	*	*			trans	45.4	107.2	131.2	-63.8	166.4	-10.4	0	0	118.2
144	S	33.4	Very low	48.3	Very low	105 Å²	105	132 Å²	132	73%	0.734	71%	0.708	S	S	*	*				54.9	98.9	85.5	78.4	0	0	0	0	114.6
145	D	39.6	Very low	50.1	Low	160 Å²	160	130.5 Å²	130.5	86%	0.856	69%	0.693	S	S	*	*				-165	132.6	129.2	-115.6	-15	0	0	0	109.5	S147	D145-S147 PolarHBondContact O-N 3.21Å
146	D	42.9	Very low	51.7	Low	163 Å²	163	124.4 Å²	124.4	87%	0.872	68%	0.678	S	S	*	*			trans	-57.7	124.5	170.6	-76	-47.1	0	0	0	109.6
147	S	46.3	Very low	53.6	Low	111 Å²	111	115.4 Å²	115.4	78%	0.776	66%	0.655	S	S	*	*			trans	-128.2	103.1	163.6	66.1	0	0	0	0	108	D145 D149	D145-S147 PolarHBondContact O-N 3.21Å; S147-D149 PolarHBondContact O-N 3.47Å
148	D	53.4	Low	55.3	Low	113 Å²	113	114.4 Å²	114.4	60%	0.604	64%	0.642	S	S	*	*			trans	-40.3	131.9	168.8	-60.6	-45.5	0	0	0	111.1	P150 Q153	D148-P150 WeakPolarHBondContact O-CD 3.38Å; D148-Q153 HydrophobicContact CB-CG 3.96Å; D148-Q153 PolarHBondContact OD2-NE2 3.42Å
149	D	67.1	Low	56.6	Low	83 Å²	83	113.2 Å²	113.2	44%	0.444	64%	0.635	S	S	.	*			trans	-57.9	123.9	171.4	-172.7	-18.8	0	0	0	108.5	S147 L151 D152 Q153	S147-D149 PolarHBondContact O-N 3.47Å; D149-L151 PolarHBondContact O-N 3Å; D149-L151 WeakPolarHBondContact OD1-CB 3.47Å; D149-L151 PolarHBondContact OD1-N 3.47Å; D149-D152 HydrophobicContact CB-CB 4.19Å; D149-D152 PolarHBondContact O-N 3.38Å; D149-Q153 PolarHBondContact O-N 2.99Å; D149-Q153 VanDerWaalsContact O-N 3.12Å
150	P	71.4	Confident	58.2	Low	104 Å²	104	111.3 Å²	111.3	68%	0.675	63%	0.626	S	S	*	*	H	α-helix	trans	-52.9	-26.4	174.5	-25.9	33.6	0	0	0	113.5	D148 F154	D148-P150 WeakPolarHBondContact O-CD 3.38Å; P150-F154 WeakPolarHBondContact O-CB 3.24Å; P150-F154 PolarHBondContact O-N 3.03Å
151	L	71.1	Confident	59.8	Low	106 Å²	106	113.9 Å²	113.9	56%	0.555	63%	0.625	S	S	*	*	H	α-helix	trans	-74.8	-38.3	176.4	-165.8	67.2	0	0	0	112	D149 F154 M155	D149-L151 PolarHBondContact O-N 3Å; D149-L151 WeakPolarHBondContact OD1-CB 3.47Å; D149-L151 PolarHBondContact OD1-N 3.47Å; L151-F154 PolarHBondContact O-N 2.98Å; L151-M155 HydrophobicContact CG-CG 4.48Å; L151-M155 WeakPolarHBondContact O-CB 3.49Å; L151-M155 WeakPolarHBondContact O-CG 3.46Å; L151-M155 PolarHBondContact O-N 3.22Å
152	D	73.2	Confident	61.5	Low	111 Å²	111	109.8 Å²	109.8	59%	0.594	61%	0.606	S	S	*	*	H	α-helix	trans	-70	-39.9	177.4	-80.1	-18	0	0	0	111.7	D149 F154 M155 A156	D149-D152 HydrophobicContact CB-CB 4.19Å; D149-D152 PolarHBondContact O-N 3.38Å; D152-F154 VanDerWaalsContact C-N 3.27Å; D152-F154 PolarHBondContact O-N 3.23Å; D152-M155 PolarHBondContact O-N 2.97Å; D152-A156 VanDerWaalsContact O-CB 3.3Å; D152-A156 WeakPolarHBondContact O-CB 3.38Å; D152-A156 PolarHBondContact O-N 3.39Å
153	Q	73.2	Confident	62.9	Low	118 Å²	118	113.5 Å²	113.5	55%	0.551	61%	0.607	S	S	*	*	H	α-helix	trans	-62	-35.9	170.9	-79.2	-173.8	1.5	0	0	112	D148 D149 G157	D148-Q153 HydrophobicContact CB-CG 3.96Å; D148-Q153 PolarHBondContact OD2-NE2 3.42Å; D149-Q153 PolarHBondContact O-N 2.99Å; D149-Q153 VanDerWaalsContact O-N 3.12Å; Q153-G157 PolarHBondContact O-N 3.45Å
154	F	72.7	Confident	64.3	Low	129 Å²	129	109.3 Å²	109.3	57%	0.566	59%	0.593	S	S	*	*	H	α-helix	trans	-71.9	-41.8	177.6	-177.3	-103.5	0	0	0	112.5	P150 L151 D152 G157 I158	P150-F154 WeakPolarHBondContact O-CB 3.24Å; P150-F154 PolarHBondContact O-N 3.03Å; L151-F154 PolarHBondContact O-N 2.98Å; D152-F154 VanDerWaalsContact C-N 3.27Å; D152-F154 PolarHBondContact O-N 3.23Å; F154-G157 PolarHBondContact O-N 3.07Å; F154-I158 HydrophobicContact CD1-CD1 4.16Å; F154-I158 HydrophobicContact CE1-CD1 3.5Å; F154-I158 HydrophobicContact CE1-CG1 4.47Å; F154-I158 HydrophobicContact CZ-CD1 3.71Å; F154-I158 HydrophobicContact CZ-CG1 4.47Å; F154-I158 PolarHBondContact O-N 3.4Å
155	M	76.6	Confident	65.4	Low	100 Å²	100	110.4 Å²	110.4	49%	0.493	59%	0.59	S	S	.	*	H	α-helix	trans	-69.5	-33.2	177.8	-69.8	-68.9	-71.4	0	0	112.2	L151 D152 N159	L151-M155 HydrophobicContact CG-CG 4.48Å; L151-M155 WeakPolarHBondContact O-CB 3.49Å; L151-M155 WeakPolarHBondContact O-CG 3.46Å; L151-M155 PolarHBondContact O-N 3.22Å; D152-M155 PolarHBondContact O-N 2.97Å; M155-N159 PolarHBondContact O-N 3.22Å
156	A	74.3	Confident	66.1	Low	59 Å²	59	110.1 Å²	110.1	49%	0.488	58%	0.583	S	S	.	*	H	α-helix	trans	-64.2	-42	172	0	0	0	0	0	111.8	D152 I158 N159 E160	D152-A156 VanDerWaalsContact O-CB 3.3Å; D152-A156 WeakPolarHBondContact O-CB 3.38Å; D152-A156 PolarHBondContact O-N 3.39Å; A156-I158 PolarHBondContact O-N 3.45Å; A156-N159 PolarHBondContact O-N 2.9Å; A156-E160 PolarHBondContact O-N 2.85Å; A156-E160 VanDerWaalsContact O-N 3.09Å
157	G	75.7	Confident	66.4	Low	37 Å²	37	106.8 Å²	106.8	38%	0.381	57%	0.572	S	S	.	*	H	α-helix	trans	-62.5	-40.9	177.7	0	0	0	0	0	113.6	Q153 F154 E160 E161	Q153-G157 PolarHBondContact O-N 3.45Å; F154-G157 PolarHBondContact O-N 3.07Å; G157-E160 PolarHBondContact O-N 3.34Å; G157-E161 PolarHBondContact O-N 3.46Å
158	I	72	Confident	66.4	Low	72 Å²	72	104.3 Å²	104.3	37%	0.369	56%	0.564	S	S	.	*	H	α-helix	trans	-67.5	-41.2	176.9	-68	-179.4	0	0	0	111.2	F154 A156 E160 E161 V162	F154-I158 HydrophobicContact CD1-CD1 4.16Å; F154-I158 HydrophobicContact CE1-CD1 3.5Å; F154-I158 HydrophobicContact CE1-CG1 4.47Å; F154-I158 HydrophobicContact CZ-CD1 3.71Å; F154-I158 HydrophobicContact CZ-CG1 4.47Å; F154-I158 PolarHBondContact O-N 3.4Å; A156-I158 PolarHBondContact O-N 3.45Å; I158-E160 PolarHBondContact O-N 2.87Å; I158-E161 PolarHBondContact O-N 3.12Å; I158-V162 HydrophobicContact CG2-CG2 4.3Å; I158-V162 WeakPolarHBondContact O-CG2 3.26Å; I158-V162 PolarHBondContact O-N 3.05Å
159	N	64.6	Low	65.9	Low	103 Å²	103	107.5 Å²	107.5	55%	0.551	58%	0.576	S	S	*	*	H	α-helix	trans	-65	-30.4	178	-82.4	-23.5	0	0	0	112.7	M155 A156 R163	M155-N159 PolarHBondContact O-N 3.22Å; A156-N159 PolarHBondContact O-N 2.9Å; N159-R163 WeakPolarHBondContact O-CG 3.35Å; N159-R163 PolarHBondContact O-N 2.93Å
160	E	72.2	Confident	64.3	Low	143 Å²	143	113.3 Å²	113.3	67%	0.668	60%	0.597	S	S	*	*	H	α-helix	trans	-75.2	-40.7	175.2	-149.7	159.6	-146.9	0	0	111.4	A156 G157 I158 V162 R163 T164	A156-E160 PolarHBondContact O-N 2.85Å; A156-E160 VanDerWaalsContact O-N 3.09Å; G157-E160 PolarHBondContact O-N 3.34Å; I158-E160 PolarHBondContact O-N 2.87Å; E160-V162 PolarHBondContact O-N 2.9Å; E160-R163 PolarHBondContact O-N 3.34Å; E160-T164 WeakPolarHBondContact O-CG2 3.37Å; E160-T164 PolarHBondContact O-N 2.98Å
161	E	70.3	Confident	62.5	Low	131 Å²	131	113.5 Å²	113.5	61%	0.612	60%	0.601	S	S	*	*	H	α-helix	trans	-64.5	-41.6	176.9	-152.6	170	-154.6	0	0	111.8	G157 I158 R163 T164 L165	G157-E161 PolarHBondContact O-N 3.46Å; I158-E161 PolarHBondContact O-N 3.12Å; E161-R163 PolarHBondContact O-N 2.97Å; E161-T164 PolarHBondContact O-N 3.43Å; E161-T164 PolarHBondContact O-OG1 2.93Å; E161-L165 WeakPolarHBondContact O-CG 3.37Å; E161-L165 PolarHBondContact O-N 3.36Å; E161-L165 VanDerWaalsContact O-N 3.09Å
162	V	68.9	Low	60.9	Low	68 Å²	68	115 Å²	115	41%	0.412	61%	0.614	S	S	.	*	H	α-helix	trans	-64.8	-36.8	175.3	174.1	0	0	0	0	112	I158 E160 L165 H166	I158-V162 HydrophobicContact CG2-CG2 4.3Å; I158-V162 WeakPolarHBondContact O-CG2 3.26Å; I158-V162 PolarHBondContact O-N 3.05Å; E160-V162 PolarHBondContact O-N 2.9Å; V162-L165 PolarHBondContact O-N 3.3Å; V162-H166 PolarHBondContact O-CD2 3.43Å; V162-H166 VanDerWaalsContact O-CD2 3.3Å; V162-H166 PolarHBondContact O-N 2.83Å
163	R	65.4	Low	59.1	Low	198 Å²	198	116.2 Å²	116.2	75%	0.747	63%	0.626	S	S	*	*	H	α-helix	trans	-67.8	-37.7	175	-80.2	179.6	177.3	174.2	2.4	112.4	N159 E160 E161 S167	N159-R163 WeakPolarHBondContact O-CG 3.35Å; N159-R163 PolarHBondContact O-N 2.93Å; E160-R163 PolarHBondContact O-N 3.34Å; E161-R163 PolarHBondContact O-N 2.97Å; R163-S167 WeakPolarHBondContact O-CB 3.33Å; R163-S167 PolarHBondContact O-N 3.26Å; R163-S167 PolarHBondContact O-OG 3.33Å
164	T	65.7	Low	57.2	Low	82 Å²	82	119.6 Å²	119.6	50%	0.503	64%	0.638	S	S	.	*	H	α-helix	trans	-66.8	-39.4	177.1	60.4	0	0	0	0	111.9	E160 E161 S167	E160-T164 WeakPolarHBondContact O-CG2 3.37Å; E160-T164 PolarHBondContact O-N 2.98Å; E161-T164 PolarHBondContact O-N 3.43Å; E161-T164 PolarHBondContact O-OG1 2.93Å; T164-S167 PolarHBondContact O-N 2.91Å; T164-S167 PolarHBondContact O-OG 3.44Å
165	L	57.2	Low	55.4	Low	127 Å²	127	122.1 Å²	122.1	67%	0.665	65%	0.652	S	S	*	*	H	α-helix	trans	-66.4	-38.4	177.9	-70.2	169.9	0	0	0	112.8	E161 V162 S167	E161-L165 WeakPolarHBondContact O-CG 3.37Å; E161-L165 PolarHBondContact O-N 3.36Å; E161-L165 VanDerWaalsContact O-N 3.09Å; V162-L165 PolarHBondContact O-N 3.3Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-S167 PolarHBondContact O-N 3.02Å
166	H	53.9	Low	53.6	Low	154 Å²	154	122.7 Å²	122.7	71%	0.713	67%	0.666	S	S	*	*	H	α-helix	trans	-78.5	-13.1	177.6	-76.4	-61.1	0	0	0	115	V162	V162-H166 PolarHBondContact O-CD2 3.43Å; V162-H166 VanDerWaalsContact O-CD2 3.3Å; V162-H166 PolarHBondContact O-N 2.83Å
167	S	50	Low	51.9	Low	93 Å²	93	127.4 Å²	127.4	65%	0.65	68%	0.683	S	S	*	*	H	α-helix	trans	-89.4	-11.2	177.4	68.8	0	0	0	0	114.2	R163 T164 L165	R163-S167 WeakPolarHBondContact O-CB 3.33Å; R163-S167 PolarHBondContact O-N 3.26Å; R163-S167 PolarHBondContact O-OG 3.33Å; T164-S167 PolarHBondContact O-N 2.91Å; T164-S167 PolarHBondContact O-OG 3.44Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-S167 PolarHBondContact O-N 3.02Å
168	G	46.3	Very low	50	Low	59 Å²	59	129.4 Å²	129.4	61%	0.608	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-13.5	-172.4	0	0	0	0	0	117.2
169	E	43.3	Very low	48.4	Very low	181 Å²	181	136 Å²	136	85%	0.846	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	14.3	-168	-72.8	-170.5	146.8	0	0	116
170	K	33.1	Very low	47	Very low	204 Å²	204	134.5 Å²	134.5	89%	0.887	73%	0.726	S	S	*	*			trans	-117.3	78.4	177.4	-75.1	-176.7	179.3	172.6	0	113.4
171	S	33	Very low	45.4	Very low	109 Å²	109	136.5 Å²	136.5	76%	0.762	73%	0.732	S	S	*	*			trans	-167.7	56.1	162.1	59.6	0	0	0	0	116.9
172	V	36.9	Very low	43.7	Very low	137 Å²	137	139.1 Å²	139.1	83%	0.83	74%	0.742	S	S	*	*			trans	-157.8	111.1	155.7	-164.8	0	0	0	0	104.8
173	T	35.1	Very low	42	Very low	136 Å²	136	140.4 Å²	140.4	83%	0.834	75%	0.753	S	S	*	*				-172	144.6	58.2	-16.3	0	0	0	0	107.6
174	K	33.5	Very low	40.7	Very low	189 Å²	189	137.7 Å²	137.7	82%	0.822	76%	0.759	S	S	*	*			trans	-95.8	163.9	-176.2	-117	175.6	-178	174.8	0	111
175	E	36.4	Very low	39.2	Very low	182 Å²	182	144 Å²	144	85%	0.85	78%	0.78	S	S	*	*			trans	85.1	127.2	162.8	-64.9	164.9	-161.5	0	0	115.9
176	S	38.3	Very low	38.1	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	78%	0.783	S	S	*	*			cis	-165.6	141.9	19.4	41.8	0	0	0	0	112.1
177	N	37.2	Very low	37.1	Very low	158 Å²	158	142.2 Å²	142.2	85%	0.845	79%	0.793	S	S	*	*			trans	8.3	152.6	145.1	-87	-19.1	0	0	0	120.8
178	S	37.5	Very low	36.4	Very low	79 Å²	79	141.1 Å²	141.1	55%	0.552	80%	0.796	S	S	*	*			cis	174	161.7	0.4	53.4	0	0	0	0	109.7
179	K	37.8	Very low	35.9	Very low	211 Å²	211	147.9 Å²	147.9	92%	0.917	81%	0.809	S	S	*	*			trans	78.1	135.5	162.3	-56.2	172.4	-177.7	174.1	0	116.7
180	G	35.3	Very low	35.5	Very low	71 Å²	71	150.3 Å²	150.3	73%	0.732	81%	0.812	S	S	*	*			cis	-177.9	132.6	1.3	0	0	0	0	0	106.7
181	K	38.1	Very low	35.5	Very low	186 Å²	186	147.9 Å²	147.9	81%	0.809	80%	0.804	S	S	*	*				90.2	108.9	93.3	-157.8	178.6	-166.9	177.5	0	114.5
182	K	34.3	Very low	35.9	Very low	186 Å²	186	150 Å²	150	81%	0.809	80%	0.804	S	S	*	*			trans	57.4	144.7	143.5	-66	-177.2	178.6	-172	0	117.3
183	S	33.8	Very low	35.9	Very low	94 Å²	94	150 Å²	150	66%	0.657	80%	0.795	S	S	*	*			cis	174.3	153.8	9.5	39.3	0	0	0	0	105.7
184	T	37.5	Very low	35.9	Very low	141 Å²	141	149.7 Å²	149.7	87%	0.865	79%	0.788	S	S	*	*			trans	140.1	138.9	136.2	55	0	0	0	0	115.1
185	K	35.1	Very low	36.1	Very low	215 Å²	215	148.1 Å²	148.1	94%	0.935	78%	0.783	S	S	*	*			trans	-53.5	156.1	179.5	-63.4	168.8	170.9	177.8	0	114.7
186	G	33.8	Very low	36.1	Very low	71 Å²	71	147.6 Å²	147.6	73%	0.732	78%	0.781	S	S	*	*			trans	165.3	103.8	159.4	0	0	0	0	0	113.8
187	D	33.7	Very low	36	Very low	173 Å²	173	149.5 Å²	149.5	93%	0.925	78%	0.782	S	S	*	*			trans	2.2	141.6	154	-53.7	-35.1	0	0	0	121.2
188	G	35.2	Very low	36.1	Very low	70 Å²	70	149.1 Å²	149.1	72%	0.722	78%	0.779	S	S	*	*			trans	117.1	123.8	136.4	0	0	0	0	0	117.9
189	K	35.6	Very low	36.2	Very low	201 Å²	201	153.6 Å²	153.6	87%	0.874	79%	0.792	S	S	*	*			trans	58.3	109.7	148.3	-74.7	176.9	173.1	175.8	0	118.7
190	Y	34.5	Very low	36.3	Very low	231 Å²	231	149.9 Å²	149.9	91%	0.906	78%	0.782	S	S	*	*			trans	-103.6	99.9	149.8	-75.7	-81	0	0	0	110.3
191	H	34	Very low	36.5	Very low	154 Å²	154	155.2 Å²	155.2	71%	0.713	79%	0.785	S	S	*	*			trans	-103	119	150.5	-119.1	-50.5	0	0	0	104.7
192	I	40.6	Very low	36.6	Very low	152 Å²	152	157.4 Å²	157.4	78%	0.779	79%	0.788	S	S	*	*			trans	-135	113.1	157.9	-63.2	-176.1	0	0	0	109.2
193	H	37.7	Very low	36.6	Very low	137 Å²	137	152.9 Å²	152.9	63%	0.634	79%	0.794	S	S	*	*			trans	-72.9	147.2	166.2	-86.2	-84.7	0	0	0	111.3
194	L	34.2	Very low	37	Very low	131 Å²	131	153.4 Å²	153.4	69%	0.686	79%	0.793	S	S	*	*			trans	59.2	134.6	135.7	-87.4	77.9	0	0	0	121.3
195	H	38.1	Very low	37.3	Very low	156 Å²	156	155.1 Å²	155.1	72%	0.722	78%	0.784	S	S	*	*			trans	95.5	111.1	132.4	-90.2	-118.6	0	0	0	119.7	N197	H195-N197 PolarHBondContact O-N 3.32Å
196	Q	34.9	Very low	38.2	Very low	171 Å²	171	150.6 Å²	150.6	80%	0.799	77%	0.769	S	S	*	*			trans	-29.1	121.2	139.5	-68.8	162.2	-20.7	0	0	112.6
197	N	37.8	Very low	39.4	Very low	152 Å²	152	152.3 Å²	152.3	81%	0.813	76%	0.762	S	S	*	*				-164.4	139.9	118.4	-98	-35.1	0	0	0	111.3	H195	H195-N197 PolarHBondContact O-N 3.32Å
198	L	39	Very low	40.5	Very low	149 Å²	149	150.1 Å²	150.1	78%	0.78	75%	0.749	S	S	*	*			trans	-57.1	143	-179.9	-68.2	72.5	0	0	0	111.6
199	Q	39.3	Very low	41.5	Very low	174 Å²	174	154.5 Å²	154.5	81%	0.813	75%	0.75	S	S	*	*				178.3	118.9	120.7	-95.3	163.5	18	0	0	111.1
200	D	39.5	Very low	42.3	Very low	133 Å²	133	152.3 Å²	152.3	71%	0.711	74%	0.744	S	S	*	*			trans	70.5	127	139.7	-67.9	-7.2	0	0	0	122.3
201	K	40.4	Very low	43.6	Very low	182 Å²	182	145.2 Å²	145.2	79%	0.791	72%	0.719	S	S	*	*			trans	90.6	86.5	147.9	-63	152	-175.9	175	0	117.5
202	R	39.7	Very low	45.4	Very low	233 Å²	233	142.2 Å²	142.2	88%	0.879	71%	0.708	S	S	*	*				167.2	122.8	101.1	-88	169.9	-177.8	-169.9	0.7	106.6	V204	R202-V204 PolarHBondContact O-N 3.46Å
203	G	35.3	Very low	46.9	Very low	91 Å²	91	142.6 Å²	142.6	94%	0.938	71%	0.706	S	S	*	*			trans	-61.3	102.6	-178.2	0	0	0	0	0	110.9
204	V	41.7	Very low	48.7	Very low	104 Å²	104	141.6 Å²	141.6	63%	0.63	70%	0.704	S	S	*	*			trans	-89.8	127.5	158.4	179.5	0	0	0	0	105.5	R202 D206	R202-V204 PolarHBondContact O-N 3.46Å; V204-D206 PolarHBondContact O-N 3.06Å
205	R	43.2	Very low	50.8	Low	178 Å²	178	140.2 Å²	140.2	67%	0.672	69%	0.694	S	S	*	*			trans	-74.4	98.6	172.8	-104.1	-170.5	174.3	168.1	-5.5	107.2	D207 I208	R205-D207 VanDerWaalsContact C-OD1 3.31Å; R205-D207 WeakPolarHBondContact CA-OD1 3.39Å; R205-D207 WeakPolarHBondContact CB-OD1 3.27Å; R205-D207 WeakPolarHBondContact CD-OD1 3.22Å; R205-D207 WeakPolarHBondContact CG-OD1 3.42Å; R205-D207 PolarHBondContact O-N 2.89Å; R205-D207 VanDerWaalsContact O-N 3.11Å; R205-I208 HydrophobicContact CB-CD1 3.9Å; R205-I208 HydrophobicContact CB-CG1 4.22Å; R205-I208 PolarHBondContact O-N 3.4Å
206	D	53.6	Low	52.7	Low	119 Å²	119	133.5 Å²	133.5	64%	0.636	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-5	176.2	-82.1	-10.7	0	0	0	112.9	V204 I208	V204-D206 PolarHBondContact O-N 3.06Å; D206-I208 VanDerWaalsContact C-N 3.33Å
207	D	58.4	Low	54.7	Low	107 Å²	107	130.3 Å²	130.3	57%	0.572	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-6	174.7	56.4	-44.7	0	0	0	114.1	R205	R205-D207 VanDerWaalsContact C-OD1 3.31Å; R205-D207 WeakPolarHBondContact CA-OD1 3.39Å; R205-D207 WeakPolarHBondContact CB-OD1 3.27Å; R205-D207 WeakPolarHBondContact CD-OD1 3.22Å; R205-D207 WeakPolarHBondContact CG-OD1 3.42Å; R205-D207 PolarHBondContact O-N 2.89Å; R205-D207 VanDerWaalsContact O-N 3.11Å
208	I	57.2	Low	56.7	Low	128 Å²	128	127.4 Å²	127.4	66%	0.656	63%	0.63	S	S	*	*	S	Bend	trans	-96.4	-16.5	-179.3	-61.9	173.2	0	0	0	112.4	R205 D206	R205-I208 HydrophobicContact CB-CD1 3.9Å; R205-I208 HydrophobicContact CB-CG1 4.22Å; R205-I208 PolarHBondContact O-N 3.4Å; D206-I208 VanDerWaalsContact C-N 3.33Å
209	E	56	Low	58.6	Low	161 Å²	161	125.9 Å²	125.9	75%	0.752	61%	0.614	S	S	*	*	S	Bend	trans	-99.1	0	-178.3	-64.3	-170.7	176.4	0	0	114.2	E211	E209-E211 PolarHBondContact O-N 3.03Å
210	Q	54	Low	60.3	Low	156 Å²	156	118.6 Å²	118.6	73%	0.729	58%	0.58	S	S	*	*	S	Bend	trans	-86.2	108.6	173.1	-72.8	178	27.4	0	0	109.3	D212	Q210-D212 PolarHBondContact O-N 3.17Å; Q210-D212 VanDerWaalsContact O-N 3.12Å
211	E	60.7	Low	62.1	Low	82 Å²	82	114.8 Å²	114.8	38%	0.383	56%	0.559	S	S	.	*			trans	-47.5	115.4	169.8	-151.1	173.8	-137.3	0	0	107.9	E209 E215 R219	E209-E211 PolarHBondContact O-N 3.03Å; E211-E215 WeakPolarHBondContact CA-OE2 3.45Å; E211-E215 HydrophobicContact CG-CB 3.75Å; E211-E215 HydrophobicContact CG-CG 3.49Å; E211-E215 VanDerWaalsContact CG-CG 3.49Å; E211-E215 WeakPolarHBondContact CG-OE2 3.45Å; E211-R219 WeakPolarHBondContact OE1-CD 3.36Å; E211-R219 IonicContact OE1-CZ 3.64Å; E211-R219 IonicContact OE1-NE 3.63Å; E211-R219 IonicContact OE1-NH1 2.67Å; E211-R219 PolarHBondContact OE1-NH1 3.4Å; E211-R219 IonicContact OE2-NH1 2.67Å
212	D	71.5	Confident	63.8	Low	91 Å²	91	113.6 Å²	113.6	49%	0.487	56%	0.556	S	S	.	*			trans	-68.4	163	-177.2	71.6	18.4	0	0	0	110.5	Q210 I214 E215 S216	Q210-D212 PolarHBondContact O-N 3.17Å; Q210-D212 VanDerWaalsContact O-N 3.12Å; D212-I214 PolarHBondContact O-N 2.86Å; D212-I214 WeakPolarHBondContact OD1-CB 3.39Å; D212-I214 PolarHBondContact OD1-N 3.38Å; D212-E215 PolarHBondContact O-N 3.42Å; D212-E215 VanDerWaalsContact O-N 3.09Å; D212-E215 VanDerWaalsContact OD1-CB 3.24Å; D212-E215 WeakPolarHBondContact OD1-CB 3.31Å; D212-E215 PolarHBondContact OD1-N 3.2Å; D212-S216 PolarHBondContact O-N 2.93Å
213	E	72.4	Confident	65.5	Low	160 Å²	160	108.1 Å²	108.1	75%	0.748	54%	0.54	S	S	*	.	H	α-helix	trans	-54.7	-33.7	-176	-73.2	-175.7	171.7	0	0	112	S216 Y217	E213-S216 PolarHBondContact O-OG 3.31Å; E213-Y217 VanDerWaalsContact O-CB 3.31Å; E213-Y217 WeakPolarHBondContact O-CB 3.42Å; E213-Y217 PolarHBondContact O-N 3.21Å
214	I	75.8	Confident	67	Low	115 Å²	115	105.3 Å²	105.3	59%	0.59	50%	0.503	S	S	*	.	H	α-helix	trans	-70.1	-47.9	179.6	-60.8	173.7	0	0	0	110.1	D212 S216 Y217 L218	D212-I214 PolarHBondContact O-N 2.86Å; D212-I214 WeakPolarHBondContact OD1-CB 3.39Å; D212-I214 PolarHBondContact OD1-N 3.38Å; I214-S216 VanDerWaalsContact C-N 3.34Å; I214-S216 PolarHBondContact O-N 3.22Å; I214-Y217 WeakPolarHBondContact O-CB 3.46Å; I214-Y217 PolarHBondContact O-N 3.35Å; I214-L218 HydrophobicContact CG2-CD1 3.88Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.41Å; I214-L218 VanDerWaalsContact O-CG 3.26Å; I214-L218 WeakPolarHBondContact O-CG 3.42Å; I214-L218 PolarHBondContact O-N 3.05Å
215	E	77.7	Confident	67.7	Low	103 Å²	103	103.5 Å²	103.5	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-41.9	177.4	-168.4	175.8	-159.4	0	0	110.8	E211 D212 Y217 L218 R219	E211-E215 WeakPolarHBondContact CA-OE2 3.45Å; E211-E215 HydrophobicContact CG-CB 3.75Å; E211-E215 HydrophobicContact CG-CG 3.49Å; E211-E215 VanDerWaalsContact CG-CG 3.49Å; E211-E215 WeakPolarHBondContact CG-OE2 3.45Å; D212-E215 PolarHBondContact O-N 3.42Å; D212-E215 VanDerWaalsContact O-N 3.09Å; D212-E215 VanDerWaalsContact OD1-CB 3.24Å; D212-E215 WeakPolarHBondContact OD1-CB 3.31Å; D212-E215 PolarHBondContact OD1-N 3.2Å; E215-Y217 VanDerWaalsContact C-N 3.32Å; E215-Y217 PolarHBondContact O-N 2.87Å; E215-L218 PolarHBondContact O-N 2.97Å; E215-R219 VanDerWaalsContact O-CB 3.28Å; E215-R219 WeakPolarHBondContact O-CB 3.48Å; E215-R219 PolarHBondContact O-N 3.07Å
216	S	77.9	Confident	68.4	Low	14 Å²	14	101.8 Å²	101.8	10%	0.098	49%	0.493	C	S	.	.	H	α-helix	trans	-67.6	-30.9	175.6	84.2	0	0	0	0	113.2	D212 E213 I214 F220	D212-S216 PolarHBondContact O-N 2.93Å; E213-S216 PolarHBondContact O-OG 3.31Å; I214-S216 VanDerWaalsContact C-N 3.34Å; I214-S216 PolarHBondContact O-N 3.22Å; S216-F220 VanDerWaalsContact O-CB 3.31Å; S216-F220 WeakPolarHBondContact O-CB 3.26Å; S216-F220 PolarHBondContact O-N 2.87Å; S216-F220 VanDerWaalsContact O-N 3.08Å
217	Y	77.9	Confident	68.3	Low	104 Å²	104	98 Å²	98	41%	0.408	47%	0.473	S	S	.	.	H	α-helix	trans	-72.2	-45.8	172.5	174.4	-103.3	0	0	0	111.1	E213 I214 E215 F220 M221 W424	E213-Y217 VanDerWaalsContact O-CB 3.31Å; E213-Y217 WeakPolarHBondContact O-CB 3.42Å; E213-Y217 PolarHBondContact O-N 3.21Å; I214-Y217 WeakPolarHBondContact O-CB 3.46Å; I214-Y217 PolarHBondContact O-N 3.35Å; E215-Y217 VanDerWaalsContact C-N 3.32Å; E215-Y217 PolarHBondContact O-N 2.87Å; Y217-F220 WeakPolarHBondContact O-CB 3.3Å; Y217-F220 PolarHBondContact O-N 3.25Å; Y217-M221 HydrophobicContact CD1-CG 4.33Å; Y217-M221 HydrophobicContact CD2-CG 4.44Å; Y217-M221 HydrophobicContact CE1-CG 3.91Å; Y217-M221 HydrophobicContact CE2-CG 4.03Å; Y217-M221 HydrophobicContact CE2-SD 4.11Å; Y217-M221 VanDerWaalsContact O-CG 3.31Å; Y217-M221 WeakPolarHBondContact O-CG 3.44Å; Y217-M221 PolarHBondContact O-N 3.43Å; Y217-W424 AromaticContact CD2-CD2 3.72Å; Y217-W424 HydrophobicContact CD2-CD2 3.72Å; Y217-W424 AromaticContact CD2-CE2 3.98Å; Y217-W424 AromaticContact CD2-CE3 3.91Å; Y217-W424 HydrophobicContact CD2-CE3 3.91Å; Y217-W424 HydrophobicContact CD2-CG 4.08Å; Y217-W424 HydrophobicContact CD2-CZ2 4.38Å; Y217-W424 HydrophobicContact CD2-CZ3 4.33Å
218	L	78.5	Confident	68	Low	92 Å²	92	96.6 Å²	96.6	48%	0.482	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-48.7	177.1	-73.7	169.7	0	0	0	110.9	I214 E215 F220 M221 E222	I214-L218 HydrophobicContact CG2-CD1 3.88Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.41Å; I214-L218 VanDerWaalsContact O-CG 3.26Å; I214-L218 WeakPolarHBondContact O-CG 3.42Å; I214-L218 PolarHBondContact O-N 3.05Å; E215-L218 PolarHBondContact O-N 2.97Å; L218-F220 VanDerWaalsContact C-N 3.29Å; L218-F220 PolarHBondContact O-N 2.88Å; L218-M221 CarbonylContact O-C 3.55Å; L218-M221 WeakPolarHBondContact O-CB 3.33Å; L218-M221 PolarHBondContact O-N 2.95Å; L218-M221 VanDerWaalsContact O-N 3.09Å; L218-E222 WeakPolarHBondContact O-CG 3.37Å; L218-E222 PolarHBondContact O-N 3.34Å
219	R	80.1	Confident	67.2	Low	116 Å²	116	95.4 Å²	95.4	44%	0.438	48%	0.479	S	S	.	.	H	α-helix	trans	-60.1	-39.9	174.8	-178	176.4	172.7	179.6	2	112.2	E211 E215 E222 E223	E211-R219 WeakPolarHBondContact OE1-CD 3.36Å; E211-R219 IonicContact OE1-CZ 3.64Å; E211-R219 IonicContact OE1-NE 3.63Å; E211-R219 IonicContact OE1-NH1 2.67Å; E211-R219 PolarHBondContact OE1-NH1 3.4Å; E211-R219 IonicContact OE2-NH1 2.67Å; E215-R219 VanDerWaalsContact O-CB 3.28Å; E215-R219 WeakPolarHBondContact O-CB 3.48Å; E215-R219 PolarHBondContact O-N 3.07Å; R219-E222 PolarHBondContact O-N 3.24Å; R219-E223 HydrophobicContact CG-CG 4.34Å; R219-E223 IonicContact CZ-OE1 3.78Å; R219-E223 IonicContact NE-OE1 3.89Å; R219-E223 PolarHBondContact NE-OE1 3.23Å; R219-E223 IonicContact NH2-OE1 3.28Å; R219-E223 WeakPolarHBondContact O-CB 3.24Å; R219-E223 WeakPolarHBondContact O-CG 3.43Å; R219-E223 PolarHBondContact O-N 2.72Å
220	F	74.2	Confident	66.4	Low	21 Å²	21	91.8 Å²	91.8	9%	0.092	47%	0.469	C	S	.	.	H	α-helix	trans	-62.4	-43.8	173.9	176.4	-95.2	0	0	0	112	S216 Y217 L218 E222 E223 N224 L227 L423 W424	S216-F220 VanDerWaalsContact O-CB 3.31Å; S216-F220 WeakPolarHBondContact O-CB 3.26Å; S216-F220 PolarHBondContact O-N 2.87Å; S216-F220 VanDerWaalsContact O-N 3.08Å; Y217-F220 WeakPolarHBondContact O-CB 3.3Å; Y217-F220 PolarHBondContact O-N 3.25Å; L218-F220 VanDerWaalsContact C-N 3.29Å; L218-F220 PolarHBondContact O-N 2.88Å; F220-E222 VanDerWaalsContact C-N 3.31Å; F220-E223 PolarHBondContact O-N 3.19Å; F220-N224 WeakPolarHBondContact CD2-ND2 3.25Å; F220-N224 HydrophobicContact CE1-CB 4.23Å; F220-N224 HydrophobicContact CE2-CB 4.45Å; F220-N224 VanDerWaalsContact CE2-ND2 3.27Å; F220-N224 WeakPolarHBondContact CE2-ND2 3.22Å; F220-N224 HydrophobicContact CZ-CB 4.21Å; F220-N224 WeakPolarHBondContact O-CA 3.45Å; F220-N224 WeakPolarHBondContact O-CB 3.3Å; F220-N224 PolarHBondContact O-N 2.91Å; F220-N224 PolarHBondContact O-ND2 2.96Å; F220-L227 HydrophobicContact CE1-CB 4.42Å; F220-L227 HydrophobicContact CE1-CD1 4.45Å; F220-L227 HydrophobicContact CE1-CD2 4.11Å; F220-L227 HydrophobicContact CZ-CD1 4Å; F220-L227 HydrophobicContact CZ-CD2 4.05Å; F220-L227 HydrophobicContact CZ-CG 4.49Å; F220-L423 HydrophobicContact CZ-CD2 4.38Å; F220-W424 HydrophobicContact CB-CG 4.4Å; F220-W424 HydrophobicContact CD1-CB 3.66Å; F220-W424 AromaticContact CD1-CD1 3.45Å; F220-W424 VanDerWaalsContact CD1-CD1 3.45Å; F220-W424 AromaticContact CD1-CG 3.82Å; F220-W424 HydrophobicContact CD1-CG 3.82Å; F220-W424 AromaticContact CD2-CD1 3.62Å; F220-W424 HydrophobicContact CE1-CB 3.54Å; F220-W424 HydrophobicContact CE1-CG 4.18Å; F220-W424 HydrophobicContact CG-CB 4.25Å; F220-W424 AromaticContact CG-CD1 3.17Å; F220-W424 HydrophobicContact CG-CG 4.01Å; F220-W424 AromaticContact CG-NE1 3.97Å; F220-W424 HydrophobicContact CZ-CB 4.01Å
221	M	77.2	Confident	65.7	Low	54 Å²	54	84.9 Å²	84.9	27%	0.266	44%	0.439	S	S	.	.	H	α-helix	trans	-64.1	-36.7	176.3	-68.2	-63.2	-63.8	0	0	111.4	Y217 L218 N224 P225	Y217-M221 HydrophobicContact CD1-CG 4.33Å; Y217-M221 HydrophobicContact CD2-CG 4.44Å; Y217-M221 HydrophobicContact CE1-CG 3.91Å; Y217-M221 HydrophobicContact CE2-CG 4.03Å; Y217-M221 HydrophobicContact CE2-SD 4.11Å; Y217-M221 VanDerWaalsContact O-CG 3.31Å; Y217-M221 WeakPolarHBondContact O-CG 3.44Å; Y217-M221 PolarHBondContact O-N 3.43Å; L218-M221 CarbonylContact O-C 3.55Å; L218-M221 WeakPolarHBondContact O-CB 3.33Å; L218-M221 PolarHBondContact O-N 2.95Å; L218-M221 VanDerWaalsContact O-N 3.09Å; M221-N224 CarbonylContact O-C 3.59Å; M221-N224 PolarHBondContact O-N 3.4Å; M221-P225 WeakPolarHBondContact O-CA 3.42Å; M221-P225 VanDerWaalsContact O-N 3.16Å
222	E	76.5	Confident	64.7	Low	156 Å²	156	88.8 Å²	88.8	73%	0.729	46%	0.463	S	S	*	.	H	α-helix	trans	-67.3	-43.7	174.1	-73.3	178	-179.4	0	0	112.8	L218 R219 F220 N224	L218-E222 WeakPolarHBondContact O-CG 3.37Å; L218-E222 PolarHBondContact O-N 3.34Å; R219-E222 PolarHBondContact O-N 3.24Å; F220-E222 VanDerWaalsContact C-N 3.31Å; E222-N224 PolarHBondContact O-N 2.85Å
223	E	75.5	Confident	63.3	Low	119 Å²	119	90.2 Å²	90.2	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-72.7	-18.7	176.3	-71.4	179.3	-174.1	0	0	112	R219 F220	R219-E223 HydrophobicContact CG-CG 4.34Å; R219-E223 IonicContact CZ-OE1 3.78Å; R219-E223 IonicContact NE-OE1 3.89Å; R219-E223 PolarHBondContact NE-OE1 3.23Å; R219-E223 IonicContact NH2-OE1 3.28Å; R219-E223 WeakPolarHBondContact O-CB 3.24Å; R219-E223 WeakPolarHBondContact O-CG 3.43Å; R219-E223 PolarHBondContact O-N 2.72Å; F220-E223 PolarHBondContact O-N 3.19Å
224	N	67	Low	61.8	Low	31 Å²	31	88.1 Å²	88.1	17%	0.166	46%	0.461	C	S	.	.			trans	-136.1	66.2	-175.9	-55.5	-93	0	0	0	111.4	F220 M221 E222 H226 L227 K450	F220-N224 WeakPolarHBondContact CD2-ND2 3.25Å; F220-N224 HydrophobicContact CE1-CB 4.23Å; F220-N224 HydrophobicContact CE2-CB 4.45Å; F220-N224 VanDerWaalsContact CE2-ND2 3.27Å; F220-N224 WeakPolarHBondContact CE2-ND2 3.22Å; F220-N224 HydrophobicContact CZ-CB 4.21Å; F220-N224 WeakPolarHBondContact O-CA 3.45Å; F220-N224 WeakPolarHBondContact O-CB 3.3Å; F220-N224 PolarHBondContact O-N 2.91Å; F220-N224 PolarHBondContact O-ND2 2.96Å; M221-N224 CarbonylContact O-C 3.59Å; M221-N224 PolarHBondContact O-N 3.4Å; E222-N224 PolarHBondContact O-N 2.85Å; N224-H226 PolarHBondContact O-N 3.04Å; N224-H226 VanDerWaalsContact O-N 3.14Å; N224-L227 HydrophobicContact CB-CB 3.73Å; N224-L227 HydrophobicContact CB-CD1 3.44Å; N224-L227 VanDerWaalsContact CB-CD1 3.44Å; N224-L227 HydrophobicContact CB-CG 4.18Å; N224-L227 WeakPolarHBondContact O-CB 3.5Å; N224-L227 PolarHBondContact O-N 3.45Å; N224-K450 PolarHBondContact OD1-NZ 3.42Å
225	P	56	Low	59.9	Low	67 Å²	67	90.1 Å²	90.1	44%	0.435	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.8	-174	22.2	-31.3	0	0	0	112.7	M221 L227 L229	M221-P225 WeakPolarHBondContact O-CA 3.42Å; M221-P225 VanDerWaalsContact O-N 3.16Å; P225-L227 PolarHBondContact O-N 3.26Å; P225-L229 WeakPolarHBondContact O-CD1 3.47Å
226	H	59.5	Low	58.2	Low	141 Å²	141	90.2 Å²	90.2	65%	0.653	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	17	-177.2	-55.6	-67.5	0	0	0	114.2	N224	N224-H226 PolarHBondContact O-N 3.04Å; N224-H226 VanDerWaalsContact O-N 3.14Å
227	L	51	Low	56.4	Low	39 Å²	39	94.2 Å²	94.2	20%	0.204	49%	0.492	C	S	.	.	S	Bend	trans	-113.8	97.5	-160.8	-127.7	149.5	0	0	0	112.2	F220 N224 P225 L423	F220-L227 HydrophobicContact CE1-CB 4.42Å; F220-L227 HydrophobicContact CE1-CD1 4.45Å; F220-L227 HydrophobicContact CE1-CD2 4.11Å; F220-L227 HydrophobicContact CZ-CD1 4Å; F220-L227 HydrophobicContact CZ-CD2 4.05Å; F220-L227 HydrophobicContact CZ-CG 4.49Å; N224-L227 HydrophobicContact CB-CB 3.73Å; N224-L227 HydrophobicContact CB-CD1 3.44Å; N224-L227 VanDerWaalsContact CB-CD1 3.44Å; N224-L227 HydrophobicContact CB-CG 4.18Å; N224-L227 WeakPolarHBondContact O-CB 3.5Å; N224-L227 PolarHBondContact O-N 3.45Å; P225-L227 PolarHBondContact O-N 3.26Å; L227-L423 HydrophobicContact CD1-CD2 3.59Å; L227-L423 HydrophobicContact CD2-CB 3.23Å; L227-L423 HydrophobicContact CD2-CD2 3.52Å; L227-L423 HydrophobicContact CD2-CG 3.99Å; L227-L423 HydrophobicContact CG-CD2 4.12Å
228	G	50.8	Low	55.2	Low	79 Å²	79	93.4 Å²	93.4	81%	0.814	49%	0.488	S	S	*	.	S	Bend	trans	93.2	-9	-177.4	0	0	0	0	0	114.2
229	L	41.9	Very low	54.1	Low	103 Å²	103	95.2 Å²	95.2	54%	0.539	50%	0.495	S	S	.	.	S	Bend	trans	-72.7	139.8	156.7	-68.6	173.5	0	0	0	107.9	P225 G231	P225-L229 WeakPolarHBondContact O-CD1 3.47Å; L229-G231 PolarHBondContact O-N 2.95Å; L229-G231 VanDerWaalsContact O-N 3.09Å
230	P	39.1	Very low	53.4	Low	85 Å²	85	96 Å²	96	55%	0.552	50%	0.498	S	S	*	.			trans	-52.7	123.6	151.3	27.7	-28.2	0	0	0	103.3	D232 E234	P230-D232 PolarHBondContact O-N 2.69Å; P230-E234 WeakPolarHBondContact CA-OE2 3.44Å; P230-E234 HydrophobicContact CB-CB 4.13Å
231	G	38.5	Very low	53.4	Low	10 Å²	10	97.6 Å²	97.6	10%	0.103	51%	0.508	C	S	.	.			trans	-45.9	146.6	178.2	0	0	0	0	0	108.5	L229 D233 E234 E235	L229-G231 PolarHBondContact O-N 2.95Å; L229-G231 VanDerWaalsContact O-N 3.09Å; G231-D233 PolarHBondContact O-N 3.05Å; G231-E234 VanDerWaalsContact C-N 3.3Å; G231-E234 CarbonylContact O-C 3.59Å; G231-E234 VanDerWaalsContact O-CA 3.28Å; G231-E234 WeakPolarHBondContact O-CA 3.4Å; G231-E234 PolarHBondContact O-N 3.27Å; G231-E235 PolarHBondContact O-N 3.45Å
232	D	39.3	Very low	53.2	Low	164 Å²	164	100.3 Å²	100.3	88%	0.877	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	1	149.7	-72.7	-35.5	0	0	0	110.2	P230	P230-D232 PolarHBondContact O-N 2.69Å
233	D	42	Very low	53	Low	121 Å²	121	99.4 Å²	99.4	65%	0.647	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	10.7	160.3	-47.3	-46.2	0	0	0	114.2	G231	G231-D233 PolarHBondContact O-N 3.05Å
234	E	41.8	Very low	52.3	Low	117 Å²	117	95.9 Å²	95.9	55%	0.547	54%	0.535	S	S	.	.			trans	-127.7	19	174.2	-62	-173	177.9	0	0	113	P230 G231 E236	P230-E234 WeakPolarHBondContact CA-OE2 3.44Å; P230-E234 HydrophobicContact CB-CB 4.13Å; G231-E234 VanDerWaalsContact C-N 3.3Å; G231-E234 CarbonylContact O-C 3.59Å; G231-E234 VanDerWaalsContact O-CA 3.28Å; G231-E234 WeakPolarHBondContact O-CA 3.4Å; G231-E234 PolarHBondContact O-N 3.27Å; E234-E236 PolarHBondContact O-N 3.31Å; E234-E236 VanDerWaalsContact O-N 3.14Å
235	E	36.5	Very low	52.2	Low	156 Å²	156	98.7 Å²	98.7	73%	0.729	55%	0.55	S	S	*	.	S	Bend		-60.8	104.2	122.2	-89.5	-172.1	170.9	0	0	102.9	G231 V237	G231-E235 PolarHBondContact O-N 3.45Å; E235-V237 HydrophobicContact CB-CG2 4.42Å; E235-V237 PolarHBondContact O-N 2.87Å
236	E	40.8	Very low	52.6	Low	105 Å²	105	100.1 Å²	100.1	49%	0.491	55%	0.553	S	S	.	*			trans	-57.3	92.1	158.9	-79.3	-175	153.4	0	0	103.9	E234 Y238	E234-E236 PolarHBondContact O-N 3.31Å; E234-E236 VanDerWaalsContact O-N 3.14Å; E236-Y238 HydrophobicContact CB-CD1 3.95Å; E236-Y238 HydrophobicContact CB-CD2 4.3Å; E236-Y238 HydrophobicContact CB-CE1 3.59Å; E236-Y238 HydrophobicContact CB-CE2 3.97Å; E236-Y238 HydrophobicContact CB-CG 4.32Å; E236-Y238 HydrophobicContact CG-CE1 4.22Å; E236-Y238 VanDerWaalsContact O-CD2 3.23Å; E236-Y238 WeakPolarHBondContact O-CD2 3.45Å; E236-Y238 PolarHBondContact O-N 2.93Å; E236-Y238 WeakPolarHBondContact OE2-CE1 3.4Å; E236-Y238 PolarHBondContact OE2-OH 2.85Å
237	V	40.9	Very low	52.6	Low	99 Å²	99	97.1 Å²	97.1	60%	0.6	54%	0.541	S	S	*	.			trans	-63.6	85.6	162.6	178.8	0	0	0	0	102.4	E235 E239	E235-V237 HydrophobicContact CB-CG2 4.42Å; E235-V237 PolarHBondContact O-N 2.87Å; V237-E239 VanDerWaalsContact C-N 3.33Å; V237-E239 PolarHBondContact O-N 3.25Å
238	Y	52.7	Low	52.4	Low	86 Å²	86	98.5 Å²	98.5	34%	0.337	57%	0.565	S	S	.	*			trans	-63.9	105.1	168.7	-61.4	-63.8	0	0	0	104.1	E236 Y240 I246	E236-Y238 HydrophobicContact CB-CD1 3.95Å; E236-Y238 HydrophobicContact CB-CD2 4.3Å; E236-Y238 HydrophobicContact CB-CE1 3.59Å; E236-Y238 HydrophobicContact CB-CE2 3.97Å; E236-Y238 HydrophobicContact CB-CG 4.32Å; E236-Y238 HydrophobicContact CG-CE1 4.22Å; E236-Y238 VanDerWaalsContact O-CD2 3.23Å; E236-Y238 WeakPolarHBondContact O-CD2 3.45Å; E236-Y238 PolarHBondContact O-N 2.93Å; E236-Y238 WeakPolarHBondContact OE2-CE1 3.4Å; E236-Y238 PolarHBondContact OE2-OH 2.85Å; Y238-Y240 VanDerWaalsContact CB-CE2 3.45Å; Y238-Y240 HydrophobicContact CD2-CE2 4.41Å; Y238-Y240 AromaticContact CD2-CZ 3.89Å; Y238-Y240 WeakPolarHBondContact CD2-OH 3.23Å; Y238-Y240 HydrophobicContact CG-CE1 4.42Å; Y238-Y240 HydrophobicContact CG-CE2 4.37Å; Y238-Y240 AromaticContact CG-CZ 3.91Å; Y238-Y240 WeakPolarHBondContact O-CD2 3.49Å; Y238-Y240 WeakPolarHBondContact O-CE2 3.43Å; Y238-Y240 PolarHBondContact O-N 3.43Å; Y238-Y240 VanDerWaalsContact O-N 3.15Å; Y238-I246 HydrophobicContact CD1-CB 4.18Å; Y238-I246 HydrophobicContact CD1-CD1 3.78Å; Y238-I246 HydrophobicContact CD1-CG1 3.66Å; Y238-I246 HydrophobicContact CD1-CG2 3.47Å; Y238-I246 VanDerWaalsContact CD1-CG2 3.47Å; Y238-I246 HydrophobicContact CE1-CD1 3.72Å; Y238-I246 HydrophobicContact CE1-CG1 4.15Å; Y238-I246 HydrophobicContact CE1-CG2 4.12Å; Y238-I246 HydrophobicContact CG-CD1 4.43Å; Y238-I246 HydrophobicContact CG-CG1 4.07Å; Y238-I246 HydrophobicContact CG-CG2 4.39Å
239	E	54.2	Low	52.1	Low	131 Å²	131	98.5 Å²	98.5	61%	0.612	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	115.2	156.9	-74.2	-170	166.4	0	0	105.5	V237 I247	V237-E239 VanDerWaalsContact C-N 3.33Å; V237-E239 PolarHBondContact O-N 3.25Å; E239-I247 HydrophobicContact CB-CB 4.03Å; E239-I247 HydrophobicContact CB-CD1 3.97Å; E239-I247 HydrophobicContact CB-CG1 4.43Å; E239-I247 VanDerWaalsContact O-CB 3.26Å; E239-I247 WeakPolarHBondContact O-CB 3.39Å; E239-I247 WeakPolarHBondContact O-CG1 3.39Å; E239-I247 PolarHBondContact O-N 2.91Å
240	Y	67.1	Low	52.2	Low	132 Å²	132	102.8 Å²	102.8	52%	0.518	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	135.3	172.3	-63.8	-80.8	0	0	0	107.7	Y238 G244 N245 I246	Y238-Y240 VanDerWaalsContact CB-CE2 3.45Å; Y238-Y240 HydrophobicContact CD2-CE2 4.41Å; Y238-Y240 AromaticContact CD2-CZ 3.89Å; Y238-Y240 WeakPolarHBondContact CD2-OH 3.23Å; Y238-Y240 HydrophobicContact CG-CE1 4.42Å; Y238-Y240 HydrophobicContact CG-CE2 4.37Å; Y238-Y240 AromaticContact CG-CZ 3.91Å; Y238-Y240 WeakPolarHBondContact O-CD2 3.49Å; Y238-Y240 WeakPolarHBondContact O-CE2 3.43Å; Y238-Y240 PolarHBondContact O-N 3.43Å; Y238-Y240 VanDerWaalsContact O-N 3.15Å; Y240-G244 VanDerWaalsContact CD1-O 3.3Å; Y240-G244 WeakPolarHBondContact CD1-O 3.47Å; Y240-N245 VanDerWaalsContact CA-O 3.27Å; Y240-N245 WeakPolarHBondContact CA-O 3.45Å; Y240-I246 HydrophobicContact CD1-CG1 4.43Å; Y240-I246 HydrophobicContact CE1-CG1 3.95Å
241	D	72.2	Confident	52.6	Low	54 Å²	54	107.9 Å²	107.9	29%	0.289	58%	0.58	S	S	.	*			trans	-63.9	174.4	162.4	65.3	13.5	0	0	0	110.1	D243 G244 N245 I247	D241-D243 PolarHBondContact O-N 3.26Å; D241-D243 VanDerWaalsContact OD1-C 3.28Å; D241-D243 WeakPolarHBondContact OD1-CA 3.28Å; D241-D243 WeakPolarHBondContact OD1-CB 3.46Å; D241-D243 PolarHBondContact OD1-N 3Å; D241-G244 PolarHBondContact O-N 3.38Å; D241-G244 PolarHBondContact OD1-N 3.36Å; D241-N245 PolarHBondContact N-O 3.21Å; D241-N245 WeakPolarHBondContact OD1-CB 3.45Å; D241-N245 PolarHBondContact OD1-N 2.92Å; D241-N245 PolarHBondContact OD1-ND2 3.4Å; D241-N245 WeakPolarHBondContact OD2-CB 3.49Å; D241-N245 PolarHBondContact OD2-ND2 3.25Å; D241-I247 HydrophobicContact CB-CD1 4.2Å; D241-I247 HydrophobicContact CB-CG1 4.26Å
242	A	73.4	Confident	53.3	Low	111 Å²	111	114.9 Å²	114.9	92%	0.917	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-16.3	177.8	0	0	0	0	0	113.3
243	D	72.3	Confident	54.4	Low	137 Å²	137	112.8 Å²	112.8	73%	0.733	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	0.7	-178.7	-58.1	-52.7	0	0	0	113	D241	D241-D243 PolarHBondContact O-N 3.26Å; D241-D243 VanDerWaalsContact OD1-C 3.28Å; D241-D243 WeakPolarHBondContact OD1-CA 3.28Å; D241-D243 WeakPolarHBondContact OD1-CB 3.46Å; D241-D243 PolarHBondContact OD1-N 3Å
244	G	61.7	Low	55.6	Low	45 Å²	45	109.7 Å²	109.7	46%	0.464	58%	0.584	S	S	.	*	S	Bend	trans	80.8	16.8	179.2	0	0	0	0	0	114.6	Y240 D241	Y240-G244 VanDerWaalsContact CD1-O 3.3Å; Y240-G244 WeakPolarHBondContact CD1-O 3.47Å; D241-G244 PolarHBondContact O-N 3.38Å; D241-G244 PolarHBondContact OD1-N 3.36Å
245	N	64.8	Low	57.2	Low	91 Å²	91	109.3 Å²	109.3	49%	0.487	59%	0.585	S	S	.	*			trans	-88.4	140.9	174.3	-49.7	-57.5	0	0	0	111	Y240 D241 I247	Y240-N245 VanDerWaalsContact CA-O 3.27Å; Y240-N245 WeakPolarHBondContact CA-O 3.45Å; D241-N245 PolarHBondContact N-O 3.21Å; D241-N245 WeakPolarHBondContact OD1-CB 3.45Å; D241-N245 PolarHBondContact OD1-N 2.92Å; D241-N245 PolarHBondContact OD1-ND2 3.4Å; D241-N245 WeakPolarHBondContact OD2-CB 3.49Å; D241-N245 PolarHBondContact OD2-ND2 3.25Å; N245-I247 PolarHBondContact O-N 3.44Å
246	I	64.1	Low	59.4	Low	97 Å²	97	105.4 Å²	105.4	50%	0.497	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.7	114.3	176.4	-61	163.3	0	0	0	109.6	Y238 Y240	Y238-I246 HydrophobicContact CD1-CB 4.18Å; Y238-I246 HydrophobicContact CD1-CD1 3.78Å; Y238-I246 HydrophobicContact CD1-CG1 3.66Å; Y238-I246 HydrophobicContact CD1-CG2 3.47Å; Y238-I246 VanDerWaalsContact CD1-CG2 3.47Å; Y238-I246 HydrophobicContact CE1-CD1 3.72Å; Y238-I246 HydrophobicContact CE1-CG1 4.15Å; Y238-I246 HydrophobicContact CE1-CG2 4.12Å; Y238-I246 HydrophobicContact CG-CD1 4.43Å; Y238-I246 HydrophobicContact CG-CG1 4.07Å; Y238-I246 HydrophobicContact CG-CG2 4.39Å; Y240-I246 HydrophobicContact CD1-CG1 4.43Å; Y240-I246 HydrophobicContact CE1-CG1 3.95Å
247	I	59	Low	61.6	Low	77 Å²	77	100.8 Å²	100.8	40%	0.395	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.1	124.7	166.2	-58.8	169.4	0	0	0	106.7	E239 D241 N245 T249	E239-I247 HydrophobicContact CB-CB 4.03Å; E239-I247 HydrophobicContact CB-CD1 3.97Å; E239-I247 HydrophobicContact CB-CG1 4.43Å; E239-I247 VanDerWaalsContact O-CB 3.26Å; E239-I247 WeakPolarHBondContact O-CB 3.39Å; E239-I247 WeakPolarHBondContact O-CG1 3.39Å; E239-I247 PolarHBondContact O-N 2.91Å; D241-I247 HydrophobicContact CB-CD1 4.2Å; D241-I247 HydrophobicContact CB-CG1 4.26Å; N245-I247 PolarHBondContact O-N 3.44Å; I247-T249 PolarHBondContact O-N 3.45Å; I247-T249 VanDerWaalsContact O-N 3.15Å
248	G	46.7	Very low	63.7	Low	69 Å²	69	100.3 Å²	100.3	71%	0.711	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-61.8	116.2	-171.9	0	0	0	0	0	112.8
249	T	45.2	Very low	65.3	Low	79 Å²	79	102.3 Å²	102.3	49%	0.485	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-66.7	142	171.7	48.1	0	0	0	0	111.1	I247 K251	I247-T249 PolarHBondContact O-N 3.45Å; I247-T249 VanDerWaalsContact O-N 3.15Å; T249-K251 PolarHBondContact O-N 2.93Å; T249-K251 VanDerWaalsContact O-N 3.16Å
250	E	43.5	Very low	66.9	Low	192 Å²	192	99.4 Å²	99.4	90%	0.897	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-58.5	117.2	180	-69.2	-172.2	160.6	0	0	110.6	K252	E250-K252 PolarHBondContact O-N 2.8Å
251	K	48.9	Very low	68.1	Low	192 Å²	192	96.9 Å²	96.9	84%	0.835	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-59.5	121.8	173.4	-70.8	176.2	-178.9	168.7	0	108.9	T249 T253	T249-K251 PolarHBondContact O-N 2.93Å; T249-K251 VanDerWaalsContact O-N 3.16Å; K251-T253 PolarHBondContact O-N 2.94Å
252	K	53.3	Low	69	Low	157 Å²	157	96.3 Å²	96.3	68%	0.683	55%	0.553	S	S	*	*			trans	-48.3	103.6	170.7	-74.7	178.2	179.7	168.6	0	109.7	E250 I254	E250-K252 PolarHBondContact O-N 2.8Å; K252-I254 PolarHBondContact O-N 2.84Å
253	T	61.2	Low	69.8	Low	121 Å²	121	95.9 Å²	95.9	74%	0.742	54%	0.544	S	S	*	.			trans	-73.1	108.5	175.5	49.2	0	0	0	0	107.9	K251 D255	K251-T253 PolarHBondContact O-N 2.94Å; T253-D255 PolarHBondContact O-N 3.37Å; T253-D255 VanDerWaalsContact O-N 3.07Å
254	I	67	Low	70.8	Confident	56 Å²	56	96.8 Å²	96.8	29%	0.287	55%	0.545	S	S	.	.			trans	-67.2	110.9	173.4	-59	174.6	0	0	0	107.4	K252 G442 I445	K252-I254 PolarHBondContact O-N 2.84Å; I254-G442 VanDerWaalsContact CD1-CA 3.49Å; I254-I445 HydrophobicContact CG2-CB 4.29Å; I254-I445 HydrophobicContact CG2-CG2 3.83Å
255	D	76	Confident	72.2	Confident	108 Å²	108	96.5 Å²	96.5	58%	0.578	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-57.3	137.1	177.4	-68.9	-34.8	0	0	0	109.8	T253 K449	T253-D255 PolarHBondContact O-N 3.37Å; T253-D255 VanDerWaalsContact O-N 3.07Å; D255-K449 VanDerWaalsContact O-CE 3.25Å; D255-K449 WeakPolarHBondContact O-CE 3.23Å; D255-K449 PolarHBondContact O-NZ 3.09Å
256	P	82.2	Confident	73.5	Confident	74 Å²	74	99.9 Å²	99.9	48%	0.481	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-59.7	157.2	173.9	26.1	-33.4	0	0	0	110.9	S480	P256-S480 WeakPolarHBondContact CB-OG 3.45Å
257	L	87.2	Confident	74.8	Confident	8 Å²	8	97.1 Å²	97.1	4%	0.042	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-62.3	143.6	170.5	-64.5	166.7	0	0	0	110.2	I445 V448 K449 S480 H484	L257-I445 HydrophobicContact CD1-CG1 4.2Å; L257-I445 HydrophobicContact CD2-CB 4.47Å; L257-I445 HydrophobicContact CD2-CG2 3.93Å; L257-I445 HydrophobicContact CG-CB 4.31Å; L257-I445 HydrophobicContact CG-CG1 4.04Å; L257-I445 HydrophobicContact CG-CG2 3.93Å; L257-V448 HydrophobicContact CD1-CB 4.35Å; L257-V448 HydrophobicContact CD1-CG1 4.05Å; L257-V448 HydrophobicContact CD2-CB 3.97Å; L257-V448 HydrophobicContact CD2-CG1 3.76Å; L257-K449 HydrophobicContact CD2-CG 3.59Å; L257-S480 WeakPolarHBondContact CB-OG 3.03Å; L257-S480 PolarHBondContact N-OG 3.19Å; L257-H484 WeakPolarHBondContact CB-CE1 3.32Å; L257-H484 WeakPolarHBondContact CB-NE2 3.29Å; L257-H484 HydrophobicContact CD1-CB 4.14Å; L257-H484 PolarHBondContact O-CE1 3.43Å; L257-H484 VanDerWaalsContact O-CE1 3.25Å
258	P	85.5	Confident	76.4	Confident	89 Å²	89	96.7 Å²	96.7	58%	0.578	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-67.1	131.6	-177.5	27.8	-34.6	0	0	0	111.2	I260 H484	P258-I260 PolarHBondContact O-N 2.82Å; P258-H484 PolarHBondContact O-CE1 3.11Å; P258-H484 PolarHBondContact O-NE2 2.94Å
259	P	85.6	Confident	78.6	Confident	129 Å²	129	99.3 Å²	99.3	84%	0.838	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-54.8	137.5	-173	24.6	-34.7	0	0	0	112.5
260	I	89	Confident	81	Confident	69 Å²	69	97.4 Å²	97.4	35%	0.354	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-102.7	133	178.6	-65.8	178	0	0	0	109	P258 H262 I265 H484	P258-I260 PolarHBondContact O-N 2.82Å; I260-H262 PolarHBondContact O-N 3.13Å; I260-I265 HydrophobicContact CG2-CD1 3.53Å; I260-H484 HydrophobicContact CD1-CB 4.48Å; I260-H484 WeakPolarHBondContact CD1-CD2 3.46Å
261	D	90.7	Very high	83.3	Confident	79 Å²	79	90 Å²	90	42%	0.422	50%	0.504	S	S	.	.			trans	-82.8	99.8	166.3	-172.3	-6.6	0	0	0	110	S263 M264	D261-S263 PolarHBondContact O-N 2.83Å; D261-S263 VanDerWaalsContact OD1-CB 3.3Å; D261-S263 WeakPolarHBondContact OD1-CB 3.4Å; D261-S263 PolarHBondContact OD1-N 3.12Å; D261-S263 PolarHBondContact OD1-OG 2.87Å; D261-S263 PolarHBondContact OD2-OG 2.82Å; D261-M264 HydrophobicContact CB-CE 4.09Å; D261-M264 HydrophobicContact CB-CG 4.26Å; D261-M264 PolarHBondContact O-N 3.27Å; D261-M264 WeakPolarHBondContact OD2-CE 3.34Å
262	H	91.7	Very high	85.3	Confident	42 Å²	42	83.6 Å²	83.6	19%	0.194	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-65.2	-21	179.3	-67.7	-71.3	0	0	0	113.5	I260 M264 I265 Y267 N483 V485 P487	I260-H262 PolarHBondContact O-N 3.13Å; H262-M264 PolarHBondContact O-N 2.68Å; H262-I265 PolarHBondContact O-N 3.26Å; H262-Y267 HydrophobicContact CB-CE2 4.34Å; H262-Y267 AromaticContact ND1-CE2 3.95Å; H262-Y267 AromaticContact ND1-CZ 3.75Å; H262-Y267 PolarHBondContact ND1-OH 3.13Å; H262-N483 PolarHBondContact NE2-O 3.41Å; H262-V485 PolarHBondContact CE1-O 3.47Å; H262-V485 VanDerWaalsContact CE1-O 3.24Å; H262-V485 PolarHBondContact NE2-O 2.83Å; H262-P487 HydrophobicContact CB-CG 4.5Å
263	S	91.3	Very high	87.3	Confident	103 Å²	103	81.3 Å²	81.3	72%	0.72	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-68.1	-23.9	179.5	73.8	0	0	0	0	112.6	D261 I265	D261-S263 PolarHBondContact O-N 2.83Å; D261-S263 VanDerWaalsContact OD1-CB 3.3Å; D261-S263 WeakPolarHBondContact OD1-CB 3.4Å; D261-S263 PolarHBondContact OD1-N 3.12Å; D261-S263 PolarHBondContact OD1-OG 2.87Å; D261-S263 PolarHBondContact OD2-OG 2.82Å; S263-I265 VanDerWaalsContact C-N 3.35Å
264	M	91.7	Very high	88.7	Confident	155 Å²	155	77.9 Å²	77.9	76%	0.764	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-85.9	-5.7	178	-55.9	-164.6	-158.1	0	0	113.4	D261 H262	D261-M264 HydrophobicContact CB-CE 4.09Å; D261-M264 HydrophobicContact CB-CG 4.26Å; D261-M264 PolarHBondContact O-N 3.27Å; D261-M264 WeakPolarHBondContact OD2-CE 3.34Å; H262-M264 PolarHBondContact O-N 2.68Å
265	I	91.6	Very high	89.9	Confident	39 Å²	39	76.4 Å²	76.4	20%	0.2	44%	0.437	C	S	.	.			trans	-107.1	116.6	-175.7	-57.3	175.4	0	0	0	109.3	I260 H262 S263 Y267	I260-I265 HydrophobicContact CG2-CD1 3.53Å; H262-I265 PolarHBondContact O-N 3.26Å; S263-I265 VanDerWaalsContact C-N 3.35Å; I265-Y267 HydrophobicContact CB-CD2 4.33Å; I265-Y267 HydrophobicContact CB-CE2 3.77Å; I265-Y267 HydrophobicContact CG2-CD1 4.03Å; I265-Y267 HydrophobicContact CG2-CD2 4.11Å; I265-Y267 HydrophobicContact CG2-CE1 3.68Å; I265-Y267 HydrophobicContact CG2-CE2 3.77Å; I265-Y267 HydrophobicContact CG2-CG 4.23Å; I265-Y267 WeakPolarHBondContact O-CD2 3.48Å; I265-Y267 PolarHBondContact O-N 3.2Å
266	N	92.1	Very high	90.7	Very high	163 Å²	163	77 Å²	77	87%	0.872	45%	0.445	S	S	*	.			trans	-80.3	97.7	172.3	-173.3	26.7	0	0	0	110.3
267	Y	92.3	Very high	91.2	Very high	38 Å²	38	76.9 Å²	76.9	15%	0.149	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-78.9	140.7	178.7	-68.1	-76.5	0	0	0	112.2	H262 I265 R456 R486	H262-Y267 HydrophobicContact CB-CE2 4.34Å; H262-Y267 AromaticContact ND1-CE2 3.95Å; H262-Y267 AromaticContact ND1-CZ 3.75Å; H262-Y267 PolarHBondContact ND1-OH 3.13Å; I265-Y267 HydrophobicContact CB-CD2 4.33Å; I265-Y267 HydrophobicContact CB-CE2 3.77Å; I265-Y267 HydrophobicContact CG2-CD1 4.03Å; I265-Y267 HydrophobicContact CG2-CD2 4.11Å; I265-Y267 HydrophobicContact CG2-CE1 3.68Å; I265-Y267 HydrophobicContact CG2-CE2 3.77Å; I265-Y267 HydrophobicContact CG2-CG 4.23Å; I265-Y267 WeakPolarHBondContact O-CD2 3.48Å; I265-Y267 PolarHBondContact O-N 3.2Å; Y267-R456 HydrophobicContact CE1-CB 4.5Å; Y267-R486 HydrophobicContact CD1-CB 3.93Å; Y267-R486 HydrophobicContact CD2-CB 4.23Å; Y267-R486 HydrophobicContact CE1-CB 3.65Å; Y267-R486 HydrophobicContact CE2-CB 3.96Å; Y267-R486 HydrophobicContact CG-CB 4.21Å
268	A	91.5	Very high	91.5	Very high	69 Å²	69	79.6 Å²	79.6	57%	0.57	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-65.3	141.1	171.1	0	0	0	0	0	110.6	R486	A268-R486 PolarHBondContact O-NH1 3Å; A268-R486 PolarHBondContact O-NH2 2.79Å
269	P	93.4	Very high	91.9	Very high	124 Å²	124	80.6 Å²	80.6	81%	0.805	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-63.8	151.9	170.8	29.7	-34.9	0	0	0	109.8
270	F	94.6	Very high	92.2	Very high	39 Å²	39	79.7 Å²	79.7	17%	0.171	44%	0.439	C	S	.	.			trans	-144.5	149.7	-177.8	80.2	-83.5	0	0	0	109.4	K272 H371 Q375 T459 D488	F270-K272 HydrophobicContact CE2-CB 4.01Å; F270-K272 HydrophobicContact CE2-CD 4.46Å; F270-K272 HydrophobicContact CE2-CG 3.83Å; F270-K272 HydrophobicContact CZ-CB 4.45Å; F270-K272 HydrophobicContact CZ-CD 4.27Å; F270-K272 HydrophobicContact CZ-CG 4.14Å; F270-H371 AromaticContact CD2-CE1 3.81Å; F270-H371 AromaticContact CE2-CE1 3.76Å; F270-Q375 VanDerWaalsContact CB-OE1 3.3Å; F270-T459 HydrophobicContact CB-CG2 4.09Å; F270-T459 HydrophobicContact CD1-CG2 3.76Å; F270-T459 HydrophobicContact CD2-CG2 3.55Å; F270-T459 HydrophobicContact CE1-CG2 3.99Å; F270-T459 HydrophobicContact CE2-CG2 3.81Å; F270-T459 HydrophobicContact CG-CG2 3.53Å; F270-T459 HydrophobicContact CZ-CG2 4.02Å; F270-D488 WeakPolarHBondContact CE1-OD2 3.34Å; F270-D488 VanDerWaalsContact CZ-O 3.27Å; F270-D488 WeakPolarHBondContact CZ-O 3.36Å
271	A	93.2	Very high	92.3	Very high	36 Å²	36	76.5 Å²	76.5	30%	0.298	42%	0.423	S	S	.	.			trans	-79.2	137.7	175.4	0	0	0	0	0	109.9	F274 D374 Q375	A271-F274 HydrophobicContact CB-CE1 3.63Å; A271-F274 HydrophobicContact CB-CZ 4.1Å; A271-F274 WeakPolarHBondContact O-CZ 3.4Å; A271-D374 WeakPolarHBondContact CB-OD2 3.33Å; A271-Q375 PolarHBondContact O-NE2 3.33Å
272	K	91.3	Very high	92.3	Very high	57 Å²	57	75.6 Å²	75.6	25%	0.248	42%	0.422	C	S	.	.			trans	-122.3	-29.4	-176.8	-152.3	-170.6	-171.2	-172.6	0	113.7	F270 G347 D349 R489	F270-K272 HydrophobicContact CE2-CB 4.01Å; F270-K272 HydrophobicContact CE2-CD 4.46Å; F270-K272 HydrophobicContact CE2-CG 3.83Å; F270-K272 HydrophobicContact CZ-CB 4.45Å; F270-K272 HydrophobicContact CZ-CD 4.27Å; F270-K272 HydrophobicContact CZ-CG 4.14Å; K272-G347 VanDerWaalsContact CD-O 3.22Å; K272-G347 WeakPolarHBondContact CD-O 3.46Å; K272-G347 WeakPolarHBondContact CE-O 3.47Å; K272-G347 PolarHBondContact NZ-O 3.27Å; K272-G347 WeakPolarHBondContact O-CA 3.4Å; K272-G347 PolarHBondContact O-N 3.04Å; K272-D349 IonicContact NZ-OD1 2.59Å; K272-R489 PolarHBondContact NZ-O 3.41Å
273	N	93.4	Very high	92.3	Very high	110 Å²	110	77.9 Å²	77.9	59%	0.588	44%	0.443	S	S	*	.			trans	-112.3	111.1	-175.1	-178.4	6.4	0	0	0	110.5	Y275 A346	N273-Y275 PolarHBondContact OD1-N 3.35Å; N273-A346 WeakPolarHBondContact OD1-CA 3.41Å
274	F	91	Very high	92.2	Very high	49 Å²	49	75.5 Å²	75.5	22%	0.215	42%	0.422	C	S	.	.			trans	-115.1	-6.1	-180	-42.2	-73.9	0	0	0	112.1	A271 V276 L345 I370 H371 D374	A271-F274 HydrophobicContact CB-CE1 3.63Å; A271-F274 HydrophobicContact CB-CZ 4.1Å; A271-F274 WeakPolarHBondContact O-CZ 3.4Å; F274-V276 PolarHBondContact O-N 3.37Å; F274-L345 PolarHBondContact N-O 3.45Å; F274-I370 HydrophobicContact CB-CG2 4.1Å; F274-I370 HydrophobicContact CD2-CG2 4.3Å; F274-I370 HydrophobicContact CG-CG2 4.11Å; F274-H371 HydrophobicContact CE2-CB 4.09Å; F274-H371 AromaticContact CE2-ND1 3.48Å; F274-H371 WeakPolarHBondContact CE2-ND1 3.29Å; F274-H371 AromaticContact CZ-ND1 3.78Å; F274-D374 HydrophobicContact CD1-CB 4.12Å; F274-D374 HydrophobicContact CE1-CB 3.47Å; F274-D374 VanDerWaalsContact CE1-CB 3.47Å; F274-D374 VanDerWaalsContact CE1-OD2 3.29Å; F274-D374 WeakPolarHBondContact CE1-OD2 3.41Å; F274-D374 HydrophobicContact CZ-CB 4.14Å
275	Y	93.3	Very high	92.2	Very high	24 Å²	24	73 Å²	73	9%	0.094	41%	0.411	C	S	.	.			trans	-78.7	121.9	-173.4	-176.8	-117.3	0	0	0	111	N273 E277 L306 P342 L345	N273-Y275 PolarHBondContact OD1-N 3.35Å; Y275-E277 HydrophobicContact CE1-CB 3.91Å; Y275-E277 HydrophobicContact CE1-CG 4.37Å; Y275-L306 HydrophobicContact CD1-CD1 3.78Å; Y275-L306 HydrophobicContact CE1-CD1 4.04Å; Y275-P342 HydrophobicContact CD1-CB 4.5Å; Y275-P342 HydrophobicContact CD2-CB 4.11Å; Y275-P342 HydrophobicContact CE1-CB 4.06Å; Y275-P342 HydrophobicContact CE2-CB 3.64Å; Y275-L345 HydrophobicContact CD2-CB 4.3Å; Y275-L345 HydrophobicContact CD2-CD1 4.34Å; Y275-L345 HydrophobicContact CG-CB 4.42Å; Y275-L345 PolarHBondContact N-O 3.33Å
276	V	93.1	Very high	92.1	Very high	122 Å²	122	76.6 Å²	76.6	74%	0.739	43%	0.427	S	S	*	.			trans	-112.2	116.6	167.6	-178.6	0	0	0	0	107.2	F274 H278	F274-V276 PolarHBondContact O-N 3.37Å; V276-H278 PolarHBondContact O-N 3.09Å
277	E	92.5	Very high	92.1	Very high	71 Å²	71	72 Å²	72	33%	0.332	41%	0.412	S	S	.	.			trans	-65.2	129.7	-177.2	-174	167.1	-140.9	0	0	111.4	Y275 I281 R307	Y275-E277 HydrophobicContact CE1-CB 3.91Å; Y275-E277 HydrophobicContact CE1-CG 4.37Å; E277-I281 HydrophobicContact CG-CB 4.22Å; E277-I281 HydrophobicContact CG-CG2 4.19Å; E277-I281 WeakPolarHBondContact OE1-CG2 3.39Å; E277-R307 WeakPolarHBondContact OE1-CD 3.32Å
278	H	93.4	Very high	92	Very high	64 Å²	64	71 Å²	71	30%	0.296	41%	0.414	S	S	.	.			trans	-68.4	144.1	178.7	-169.4	-97.9	0	0	0	111.5	V276 E280 I281 S282 H314	V276-H278 PolarHBondContact O-N 3.09Å; H278-E280 VanDerWaalsContact C-N 3.27Å; H278-E280 PolarHBondContact ND1-N 3.22Å; H278-E280 PolarHBondContact O-N 3.34Å; H278-I281 HydrophobicContact CB-CG1 4.41Å; H278-I281 PolarHBondContact O-N 3.18Å; H278-S282 PolarHBondContact O-N 3.49Å; H278-H314 HydrophobicContact CB-CB 3.95Å; H278-H314 AromaticContact CE1-CD2 4Å; H278-H314 AromaticContact CG-CD2 3.98Å; H278-H314 AromaticContact ND1-CD2 3.67Å
279	V	93.3	Very high	92	Very high	110 Å²	110	67.8 Å²	67.8	67%	0.667	39%	0.387	S	S	*	.	H	α-helix	trans	-53.8	-43.2	-175.7	-179.1	0	0	0	0	111.8	I281 S282 S283	V279-I281 VanDerWaalsContact C-N 3.32Å; V279-I281 PolarHBondContact O-N 3.32Å; V279-S282 WeakPolarHBondContact CA-OG 3.5Å; V279-S282 PolarHBondContact O-N 3.26Å; V279-S282 PolarHBondContact O-OG 3.19Å; V279-S283 WeakPolarHBondContact O-CB 3.18Å; V279-S283 PolarHBondContact O-N 2.65Å
280	E	90.8	Very high	91.9	Very high	111 Å²	111	66 Å²	66	52%	0.519	37%	0.371	S	S	.	.	H	α-helix	trans	-61.3	-38.1	178.2	-66	-178.5	-171.1	0	0	113	H278 S283 H314	H278-E280 VanDerWaalsContact C-N 3.27Å; H278-E280 PolarHBondContact ND1-N 3.22Å; H278-E280 PolarHBondContact O-N 3.34Å; E280-S283 PolarHBondContact O-N 2.98Å; E280-S283 PolarHBondContact O-OG 2.95Å; E280-H314 IonicContact OE2-CE1 3.12Å; E280-H314 IonicContact OE2-NE2 2.71Å; E280-H314 PolarHBondContact OE2-NE2 2.99Å
281	I	91.4	Very high	91.8	Very high	2 Å²	2	67.9 Å²	67.9	1%	0.01	39%	0.389	C	S	.	.	H	α-helix	trans	-75.4	-37	178.9	-58.3	-56.6	0	0	0	110.9	E277 H278 V279 S283 L284 R307 V309 H314	E277-I281 HydrophobicContact CG-CB 4.22Å; E277-I281 HydrophobicContact CG-CG2 4.19Å; E277-I281 WeakPolarHBondContact OE1-CG2 3.39Å; H278-I281 HydrophobicContact CB-CG1 4.41Å; H278-I281 PolarHBondContact O-N 3.18Å; V279-I281 VanDerWaalsContact C-N 3.32Å; V279-I281 PolarHBondContact O-N 3.32Å; I281-S283 PolarHBondContact O-N 3.24Å; I281-L284 HydrophobicContact CD1-CD1 4.15Å; I281-L284 PolarHBondContact O-N 3.41Å; I281-R307 HydrophobicContact CG2-CB 3.45Å; I281-R307 VanDerWaalsContact CG2-CB 3.45Å; I281-R307 HydrophobicContact CG2-CG 4.42Å; I281-R307 WeakPolarHBondContact O-CD 3.34Å; I281-R307 PolarHBondContact O-NH1 2.75Å; I281-V309 HydrophobicContact CG1-CG1 4.38Å; I281-H314 HydrophobicContact CG1-CB 4.24Å
282	S	90.7	Very high	91.7	Very high	59 Å²	59	67.4 Å²	67.4	41%	0.413	38%	0.381	S	S	.	.	H	α-helix	trans	-65	-28.8	173.5	75.3	0	0	0	0	112.7	H278 V279 L284 R307	H278-S282 PolarHBondContact O-N 3.49Å; V279-S282 WeakPolarHBondContact CA-OG 3.5Å; V279-S282 PolarHBondContact O-N 3.26Å; V279-S282 PolarHBondContact O-OG 3.19Å; S282-L284 VanDerWaalsContact C-N 3.33Å; S282-L284 PolarHBondContact O-N 2.91Å; S282-R307 VanDerWaalsContact C-NH1 3.32Å; S282-R307 PolarHBondContact O-NH1 3.06Å
283	S	91.4	Very high	91.8	Very high	91 Å²	91	66 Å²	66	64%	0.636	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-14.9	-179.8	74.7	0	0	0	0	114.5	V279 E280 I281	V279-S283 WeakPolarHBondContact O-CB 3.18Å; V279-S283 PolarHBondContact O-N 2.65Å; E280-S283 PolarHBondContact O-N 2.98Å; E280-S283 PolarHBondContact O-OG 2.95Å; I281-S283 PolarHBondContact O-N 3.24Å
284	L	90	Very high	91.6	Very high	53 Å²	53	65.2 Å²	65.2	28%	0.277	38%	0.377	S	S	.	.			trans	-68.4	137.4	177.2	-68.4	167.8	0	0	0	110.7	I281 S282 V289 L292 R307	I281-L284 HydrophobicContact CD1-CD1 4.15Å; I281-L284 PolarHBondContact O-N 3.41Å; S282-L284 VanDerWaalsContact C-N 3.33Å; S282-L284 PolarHBondContact O-N 2.91Å; L284-V289 HydrophobicContact CB-CG2 4.01Å; L284-L292 HydrophobicContact CD1-CD2 4.29Å; L284-R307 VanDerWaalsContact O-CZ 3.27Å; L284-R307 PolarHBondContact O-NH1 3.37Å; L284-R307 PolarHBondContact O-NH2 3Å
285	D	92.1	Very high	91.6	Very high	101 Å²	101	71.7 Å²	71.7	54%	0.54	41%	0.405	S	S	.	.			trans	-76.5	162.7	168.3	64.6	-25.2	0	0	0	110.8	A287 G288 V289	D285-A287 PolarHBondContact O-N 3.48Å; D285-G288 WeakPolarHBondContact O-CA 3.48Å; D285-G288 PolarHBondContact O-N 3.14Å; D285-G288 VanDerWaalsContact OD1-CA 3.23Å; D285-G288 WeakPolarHBondContact OD1-CA 3.38Å; D285-G288 PolarHBondContact OD1-N 2.95Å; D285-V289 WeakPolarHBondContact O-CG2 3.18Å; D285-V289 PolarHBondContact O-N 3.4Å
286	E	90.2	Very high	91.4	Very high	115 Å²	115	72.5 Å²	72.5	54%	0.537	41%	0.411	S	S	.	.	H	α-helix	trans	-60.2	-35	-179	-65.5	-58.9	134.6	0	0	112	V289 D290 R307	E286-V289 PolarHBondContact O-N 3.37Å; E286-D290 PolarHBondContact O-N 2.92Å; E286-R307 IonicContact OE1-CZ 2.76Å; E286-R307 IonicContact OE1-NE 3.4Å; E286-R307 IonicContact OE1-NH2 3.72Å; E286-R307 PolarHBondContact OE1-NH2 3.21Å
287	A	90.9	Very high	91.2	Very high	66 Å²	66	68.4 Å²	68.4	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-65.9	-39.2	174.2	0	0	0	0	0	112.3	D285 D290 S291	D285-A287 PolarHBondContact O-N 3.48Å; A287-D290 PolarHBondContact O-N 3.39Å; A287-S291 VanDerWaalsContact O-CB 3.28Å; A287-S291 WeakPolarHBondContact O-CB 3.45Å; A287-S291 PolarHBondContact O-N 3.28Å
288	G	90.3	Very high	91.1	Very high	19 Å²	19	65.6 Å²	65.6	20%	0.196	38%	0.381	C	S	.	.	H	α-helix	trans	-64	-39.3	172.8	0	0	0	0	0	112.7	D285 S291 L292	D285-G288 WeakPolarHBondContact O-CA 3.48Å; D285-G288 PolarHBondContact O-N 3.14Å; D285-G288 VanDerWaalsContact OD1-CA 3.23Å; D285-G288 WeakPolarHBondContact OD1-CA 3.38Å; D285-G288 PolarHBondContact OD1-N 2.95Å; G288-S291 PolarHBondContact O-N 2.89Å; G288-L292 WeakPolarHBondContact O-CB 3.35Å; G288-L292 PolarHBondContact O-N 2.61Å
289	V	92.1	Very high	91	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-63.6	-45.8	174.6	173.7	0	0	0	0	111.2	L284 D285 E286 L292 R293 R307	L284-V289 HydrophobicContact CB-CG2 4.01Å; D285-V289 WeakPolarHBondContact O-CG2 3.18Å; D285-V289 PolarHBondContact O-N 3.4Å; E286-V289 PolarHBondContact O-N 3.37Å; V289-L292 WeakPolarHBondContact O-CB 3.4Å; V289-L292 PolarHBondContact O-N 2.87Å; V289-R293 WeakPolarHBondContact O-CG 3.24Å; V289-R293 PolarHBondContact O-N 2.92Å; V289-R307 HydrophobicContact CG1-CG 4.36Å; V289-R307 HydrophobicContact CG2-CB 4.4Å; V289-R307 HydrophobicContact CG2-CG 3.88Å
290	D	91.3	Very high	91	Very high	86 Å²	86	65.5 Å²	65.5	46%	0.46	37%	0.37	S	S	.	.	H	α-helix	trans	-68.3	-36.8	178.8	-75.4	-18.3	0	0	0	112.4	E286 A287 L292 R293 S294	E286-D290 PolarHBondContact O-N 2.92Å; A287-D290 PolarHBondContact O-N 3.39Å; D290-L292 VanDerWaalsContact C-N 3.35Å; D290-R293 PolarHBondContact O-N 3.37Å; D290-R293 IonicContact OD1-NH1 3.91Å; D290-R293 PolarHBondContact OD1-NH1 3.05Å; D290-S294 WeakPolarHBondContact O-CB 3.47Å; D290-S294 PolarHBondContact O-N 2.83Å; D290-S294 PolarHBondContact O-OG 3.49Å
291	S	91.6	Very high	91.1	Very high	79 Å²	79	62.8 Å²	62.8	55%	0.552	36%	0.363	S	S	*	.	H	α-helix	trans	-61.6	-42.9	171.1	-177.3	0	0	0	0	111.4	A287 G288 S294 K295	A287-S291 VanDerWaalsContact O-CB 3.28Å; A287-S291 WeakPolarHBondContact O-CB 3.45Å; A287-S291 PolarHBondContact O-N 3.28Å; G288-S291 PolarHBondContact O-N 2.89Å; S291-S294 PolarHBondContact O-N 2.78Å; S291-K295 WeakPolarHBondContact O-CB 3.47Å; S291-K295 PolarHBondContact O-N 3.4Å
292	L	91.2	Very high	90.9	Very high	26 Å²	26	64.7 Å²	64.7	14%	0.136	38%	0.383	C	S	.	.	H	α-helix	trans	-64.9	-44.9	176.7	179.7	58.1	0	0	0	112	L284 G288 V289 D290 S294 K295 L296 P308 C310	L284-L292 HydrophobicContact CD1-CD2 4.29Å; G288-L292 WeakPolarHBondContact O-CB 3.35Å; G288-L292 PolarHBondContact O-N 2.61Å; V289-L292 WeakPolarHBondContact O-CB 3.4Å; V289-L292 PolarHBondContact O-N 2.87Å; D290-L292 VanDerWaalsContact C-N 3.35Å; L292-S294 VanDerWaalsContact C-N 3.32Å; L292-S294 PolarHBondContact O-N 2.54Å; L292-K295 PolarHBondContact O-N 3.35Å; L292-L296 HydrophobicContact CD1-CD1 4Å; L292-L296 HydrophobicContact CD1-CG 4.24Å; L292-L296 HydrophobicContact CG-CD1 4.13Å; L292-L296 WeakPolarHBondContact O-CB 3.44Å; L292-L296 VanDerWaalsContact O-CG 3.31Å; L292-L296 WeakPolarHBondContact O-CG 3.44Å; L292-L296 PolarHBondContact O-N 2.78Å; L292-P308 HydrophobicContact CD2-CG 3.8Å; L292-P308 HydrophobicContact CG-CG 4.01Å; L292-C310 WeakPolarHBondContact CD2-SG 3.29Å
293	R	93.5	Very high	90.7	Very high	28 Å²	28	64.8 Å²	64.8	11%	0.106	38%	0.382	C	S	.	.	H	α-helix	trans	-59.9	-43.4	173.8	-73.6	178.8	179.9	137.8	-0.1	111.4	V289 D290 L296 G297 L298 L306 P308	V289-R293 WeakPolarHBondContact O-CG 3.24Å; V289-R293 PolarHBondContact O-N 2.92Å; D290-R293 PolarHBondContact O-N 3.37Å; D290-R293 IonicContact OD1-NH1 3.91Å; D290-R293 PolarHBondContact OD1-NH1 3.05Å; R293-L296 CarbonylContact O-C 3.6Å; R293-L296 PolarHBondContact O-N 2.8Å; R293-G297 PolarHBondContact O-N 3.07Å; R293-L298 HydrophobicContact CB-CB 4.31Å; R293-L298 PolarHBondContact O-N 2.75Å; R293-L306 PolarHBondContact NH2-O 2.99Å; R293-L306 VanDerWaalsContact NH2-O 3.13Å; R293-P308 HydrophobicContact CG-CG 3.96Å
294	S	90	Very high	90.3	Very high	93 Å²	93	65 Å²	65	65%	0.65	38%	0.384	S	S	*	.	H	α-helix	trans	-62.3	-44.9	177.4	-59.2	0	0	0	0	111.6	D290 S291 L292 L296 G297	D290-S294 WeakPolarHBondContact O-CB 3.47Å; D290-S294 PolarHBondContact O-N 2.83Å; D290-S294 PolarHBondContact O-OG 3.49Å; S291-S294 PolarHBondContact O-N 2.78Å; L292-S294 VanDerWaalsContact C-N 3.32Å; L292-S294 PolarHBondContact O-N 2.54Å; S294-L296 VanDerWaalsContact C-N 3.28Å; S294-L296 PolarHBondContact O-N 3.14Å; S294-G297 PolarHBondContact O-N 3.41Å
295	K	90.5	Very high	90.1	Very high	185 Å²	185	64.9 Å²	64.9	80%	0.804	39%	0.386	S	S	*	.	H	α-helix	trans	-61.9	-35.3	176.4	-175.9	178.7	178.9	-178.2	0	112.6	S291 L292 G297	S291-K295 WeakPolarHBondContact O-CB 3.47Å; S291-K295 PolarHBondContact O-N 3.4Å; L292-K295 PolarHBondContact O-N 3.35Å; K295-G297 VanDerWaalsContact C-N 3.29Å
296	L	88.8	Confident	90.1	Very high	42 Å²	42	62.3 Å²	62.3	22%	0.22	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-3.5	177	-69	175.4	0	0	0	113.1	L292 R293 S294 L298 P308 P335 A338	L292-L296 HydrophobicContact CD1-CD1 4Å; L292-L296 HydrophobicContact CD1-CG 4.24Å; L292-L296 HydrophobicContact CG-CD1 4.13Å; L292-L296 WeakPolarHBondContact O-CB 3.44Å; L292-L296 VanDerWaalsContact O-CG 3.31Å; L292-L296 WeakPolarHBondContact O-CG 3.44Å; L292-L296 PolarHBondContact O-N 2.78Å; R293-L296 CarbonylContact O-C 3.6Å; R293-L296 PolarHBondContact O-N 2.8Å; S294-L296 VanDerWaalsContact C-N 3.28Å; S294-L296 PolarHBondContact O-N 3.14Å; L296-L298 VanDerWaalsContact C-N 3.33Å; L296-L298 HydrophobicContact CB-CD1 3.63Å; L296-L298 HydrophobicContact CB-CG 3.79Å; L296-L298 HydrophobicContact CD1-CD1 3.85Å; L296-L298 HydrophobicContact CG-CD1 4.41Å; L296-P308 HydrophobicContact CD1-CB 4.42Å; L296-P335 HydrophobicContact CB-CB 4.1Å; L296-P335 HydrophobicContact CD2-CB 4.34Å; L296-P335 HydrophobicContact CD2-CG 4.16Å; L296-P335 VanDerWaalsContact O-CB 3.3Å; L296-P335 WeakPolarHBondContact O-CB 3.5Å; L296-A338 HydrophobicContact CD1-CB 4.03Å
297	G	88.3	Confident	90.3	Very high	36 Å²	36	59 Å²	59	37%	0.371	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	35	-176.7	0	0	0	0	0	112.9	R293 S294 K295 Q518 G519	R293-G297 PolarHBondContact O-N 3.07Å; S294-G297 PolarHBondContact O-N 3.41Å; K295-G297 VanDerWaalsContact C-N 3.29Å; G297-Q518 WeakPolarHBondContact O-CA 3.42Å; G297-G519 PolarHBondContact O-N 3.28Å
298	L	91.9	Very high	90.4	Very high	11 Å²	11	56 Å²	56	6%	0.058	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	131	-175	-65.8	170.5	0	0	0	111.8	R293 L296 P335 Q339 I516 I517 Q518	R293-L298 HydrophobicContact CB-CB 4.31Å; R293-L298 PolarHBondContact O-N 2.75Å; L296-L298 VanDerWaalsContact C-N 3.33Å; L296-L298 HydrophobicContact CB-CD1 3.63Å; L296-L298 HydrophobicContact CB-CG 3.79Å; L296-L298 HydrophobicContact CD1-CD1 3.85Å; L296-L298 HydrophobicContact CG-CD1 4.41Å; L298-P335 WeakPolarHBondContact CD1-O 3.42Å; L298-P335 HydrophobicContact CD2-CB 4.17Å; L298-P335 HydrophobicContact CG-CB 4.37Å; L298-Q339 HydrophobicContact CD1-CB 3.81Å; L298-Q339 HydrophobicContact CD1-CG 4.46Å; L298-I516 HydrophobicContact CD2-CG2 4.02Å; L298-I517 CarbonylContact C-O 3.58Å; L298-I517 WeakPolarHBondContact CA-O 3.5Å; L298-Q518 HydrophobicContact CD2-CB 4.11Å; L298-Q518 HydrophobicContact CD2-CG 4.38Å
299	R	91.2	Very high	90.6	Very high	139 Å²	139	55 Å²	55	53%	0.525	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.4	164.4	-60	-177.4	-176.6	173.6	8.2	108.6	I517 E520	R299-I517 HydrophobicContact CB-CB 4.3Å; R299-I517 PolarHBondContact N-O 3.05Å; R299-I517 PolarHBondContact O-N 3.38Å; R299-E520 IonicContact CZ-OE1 3.75Å; R299-E520 IonicContact NH2-OE1 2.84Å; R299-E520 PolarHBondContact NH2-OE1 3.11Å
300	V	93.1	Very high	90.4	Very high	34 Å²	34	58 Å²	58	21%	0.206	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.6	-177.5	-171.3	0	0	0	0	109.3	P305 Q339 V514 R515	V300-P305 HydrophobicContact CG1-CB 3.58Å; V300-P305 HydrophobicContact CG1-CG 4.46Å; V300-Q339 HydrophobicContact CG2-CG 3.75Å; V300-V514 HydrophobicContact CG1-CG1 3.67Å; V300-R515 CarbonylContact C-O 3.58Å; V300-R515 WeakPolarHBondContact CA-O 3.45Å
301	S	91.8	Very high	90.4	Very high	54 Å²	54	56 Å²	56	38%	0.378	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	150.6	178.6	57.5	0	0	0	0	110.1	R515	S301-R515 PolarHBondContact N-O 3.16Å; S301-R515 PolarHBondContact O-N 3.27Å; S301-R515 WeakPolarHBondContact OG-CB 3.28Å
302	G	88.3	Confident	90.4	Very high	42 Å²	42	52.7 Å²	52.7	43%	0.433	31%	0.308	S	S	.	.	S	Bend	trans	124.8	174.4	-177	0	0	0	0	0	112
303	P	85.7	Confident	90.4	Very high	60 Å²	60	54.4 Å²	54.4	39%	0.39	33%	0.326	S	S	.	.	S	Bend	trans	-74.2	131.7	-175.6	22.6	-22.7	0	0	0	111.3	R348 D512	P303-R348 PolarHBondContact O-NH1 3.14Å; P303-R348 PolarHBondContact O-NH2 2.8Å; P303-D512 HydrophobicContact CG-CB 3.96Å
304	S	84.7	Confident	90.4	Very high	96 Å²	96	53.8 Å²	53.8	67%	0.671	32%	0.324	S	S	*	.	S	Bend	trans	46.4	65.4	174.3	-54.1	0	0	0	0	114	L306 R348	S304-L306 PolarHBondContact O-N 2.76Å; S304-R348 PolarHBondContact O-NH1 2.99Å
305	P	85.6	Confident	90.4	Very high	50 Å²	50	49.8 Å²	49.8	33%	0.325	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-70.7	129.3	178	29.9	-33.4	0	0	0	110.7	V300 V514	V300-P305 HydrophobicContact CG1-CB 3.58Å; V300-P305 HydrophobicContact CG1-CG 4.46Å; P305-V514 HydrophobicContact CB-CG1 4.19Å
306	L	91.7	Very high	90.3	Very high	47 Å²	47	44.3 Å²	44.3	25%	0.246	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-69.5	160.4	174.9	-62.1	-177.6	0	0	0	111.8	Y275 R293 S304 Q339 L343 A346	Y275-L306 HydrophobicContact CD1-CD1 3.78Å; Y275-L306 HydrophobicContact CE1-CD1 4.04Å; R293-L306 PolarHBondContact NH2-O 2.99Å; R293-L306 VanDerWaalsContact NH2-O 3.13Å; S304-L306 PolarHBondContact O-N 2.76Å; L306-Q339 PolarHBondContact O-NE2 3.31Å; L306-L343 HydrophobicContact CB-CD2 3.98Å; L306-L343 HydrophobicContact CB-CG 4.32Å; L306-L343 HydrophobicContact CD1-CD2 4.32Å; L306-L343 HydrophobicContact CG-CD2 3.93Å; L306-A346 HydrophobicContact CD1-CB 3.41Å; L306-A346 VanDerWaalsContact CD1-CB 3.41Å
307	R	93.4	Very high	90.4	Very high	47 Å²	47	43.2 Å²	43.2	18%	0.177	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-73.3	140.4	178.8	-61.1	-178.4	175.2	-176.4	-5.2	110.5	E277 I281 S282 L284 E286 V289	E277-R307 WeakPolarHBondContact OE1-CD 3.32Å; I281-R307 HydrophobicContact CG2-CB 3.45Å; I281-R307 VanDerWaalsContact CG2-CB 3.45Å; I281-R307 HydrophobicContact CG2-CG 4.42Å; I281-R307 WeakPolarHBondContact O-CD 3.34Å; I281-R307 PolarHBondContact O-NH1 2.75Å; S282-R307 VanDerWaalsContact C-NH1 3.32Å; S282-R307 PolarHBondContact O-NH1 3.06Å; L284-R307 VanDerWaalsContact O-CZ 3.27Å; L284-R307 PolarHBondContact O-NH1 3.37Å; L284-R307 PolarHBondContact O-NH2 3Å; E286-R307 IonicContact OE1-CZ 2.76Å; E286-R307 IonicContact OE1-NE 3.4Å; E286-R307 IonicContact OE1-NH2 3.72Å; E286-R307 PolarHBondContact OE1-NH2 3.21Å; V289-R307 HydrophobicContact CG1-CG 4.36Å; V289-R307 HydrophobicContact CG2-CB 4.4Å; V289-R307 HydrophobicContact CG2-CG 3.88Å
308	P	93.7	Very high	90.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-73.5	147.9	177.8	29.5	-31.5	0	0	0	111.2	L292 R293 L296 A338 Q339	L292-P308 HydrophobicContact CD2-CG 3.8Å; L292-P308 HydrophobicContact CG-CG 4.01Å; R293-P308 HydrophobicContact CG-CG 3.96Å; L296-P308 HydrophobicContact CD1-CB 4.42Å; P308-A338 CarbonylContact C-O 3.57Å; P308-A338 WeakPolarHBondContact CA-O 3.38Å; P308-Q339 HydrophobicContact CB-CB 4.36Å
309	V	93.6	Very high	90.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-92.8	148.4	174.9	-60.5	0	0	0	0	112.3	I281 H314 L315 A338 P342	I281-V309 HydrophobicContact CG1-CG1 4.38Å; V309-H314 HydrophobicContact CB-CB 3.86Å; V309-H314 HydrophobicContact CG1-CB 3.73Å; V309-L315 HydrophobicContact CB-CD2 4.4Å; V309-L315 HydrophobicContact CG1-CD2 3.96Å; V309-L315 HydrophobicContact CG2-CD1 4.46Å; V309-L315 HydrophobicContact CG2-CD2 3.65Å; V309-L315 HydrophobicContact CG2-CG 4.04Å; V309-A338 WeakPolarHBondContact CG2-O 3.48Å; V309-A338 PolarHBondContact N-O 2.87Å; V309-A338 WeakPolarHBondContact O-CB 3.3Å; V309-P342 HydrophobicContact CG1-CG 4.4Å
310	C	88.3	Confident	90.7	Very high	61 Å²	61	45.9 Å²	45.9	41%	0.412	30%	0.301	S	S	.	.	S	Bend	trans	-96.9	-17.6	175.5	-56	0	0	0	0	114.2	L292 H314	L292-C310 WeakPolarHBondContact CD2-SG 3.29Å; C310-H314 PolarHBondContact N-ND1 3.44Å
311	S	92	Very high	90.7	Very high	45 Å²	45	44.3 Å²	44.3	32%	0.315	29%	0.291	S	S	.	.	S	Bend	trans	-143.2	152.3	-172.3	178.2	0	0	0	0	110.5	A313 H314	S311-A313 PolarHBondContact O-N 3.09Å; S311-A313 PolarHBondContact OG-N 3.25Å; S311-H314 WeakPolarHBondContact O-CB 3.5Å; S311-H314 PolarHBondContact O-N 2.89Å
312	F	92.3	Very high	90.8	Very high	10 Å²	10	43.8 Å²	43.8	4%	0.044	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-61	-29.7	173.1	-63.8	-56.5	0	0	0	112.5	H314 L315 M322 I325 Y330 Q332 P333 W366	F312-H314 PolarHBondContact O-N 2.77Å; F312-L315 HydrophobicContact CD1-CD1 4.07Å; F312-L315 WeakPolarHBondContact O-CB 3.32Å; F312-L315 PolarHBondContact O-N 2.8Å; F312-L315 VanDerWaalsContact O-N 3.14Å; F312-M322 HydrophobicContact CB-CE 3.9Å; F312-M322 HydrophobicContact CB-SD 3.96Å; F312-I325 HydrophobicContact CD1-CG2 4.42Å; F312-I325 HydrophobicContact CD2-CG2 3.97Å; F312-I325 HydrophobicContact CE1-CG2 4.38Å; F312-I325 HydrophobicContact CE2-CG2 3.88Å; F312-I325 HydrophobicContact CG-CG2 4.24Å; F312-I325 HydrophobicContact CZ-CG2 4.1Å; F312-Y330 HydrophobicContact CZ-CG 4.49Å; F312-Q332 WeakPolarHBondContact CZ-O 3.44Å; F312-P333 HydrophobicContact CD1-CB 4.17Å; F312-P333 HydrophobicContact CE1-CB 3.7Å; F312-P333 HydrophobicContact CE1-CG 4.42Å; F312-P333 HydrophobicContact CZ-CB 4.22Å; F312-P333 VanDerWaalsContact CZ-N 3.31Å; F312-W366 HydrophobicContact CD1-CH2 4.22Å; F312-W366 HydrophobicContact CD1-CZ3 4.1Å; F312-W366 AromaticContact CE1-CH2 3.36Å; F312-W366 HydrophobicContact CE1-CH2 3.36Å; F312-W366 HydrophobicContact CE1-CZ2 4.42Å; F312-W366 AromaticContact CE1-CZ3 3.51Å; F312-W366 HydrophobicContact CE1-CZ3 3.51Å; F312-W366 AromaticContact CZ-CH2 3.88Å; F312-W366 HydrophobicContact CZ-CH2 3.88Å; F312-W366 HydrophobicContact CZ-CZ3 4.45Å
313	A	91	Very high	91	Very high	61 Å²	61	44.8 Å²	44.8	50%	0.504	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-61.5	-26.8	177.5	0	0	0	0	0	113.1	S311 L315	S311-A313 PolarHBondContact O-N 3.09Å; S311-A313 PolarHBondContact OG-N 3.25Å; A313-L315 PolarHBondContact O-N 2.9Å
314	H	91.8	Very high	91.3	Very high	16 Å²	16	42.9 Å²	42.9	7%	0.074	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-76	-11.2	-179.3	-55.2	168.3	0	0	0	113.3	H278 E280 I281 V309 C310 S311 F312 G316	H278-H314 HydrophobicContact CB-CB 3.95Å; H278-H314 AromaticContact CE1-CD2 4Å; H278-H314 AromaticContact CG-CD2 3.98Å; H278-H314 AromaticContact ND1-CD2 3.67Å; E280-H314 IonicContact OE2-CE1 3.12Å; E280-H314 IonicContact OE2-NE2 2.71Å; E280-H314 PolarHBondContact OE2-NE2 2.99Å; I281-H314 HydrophobicContact CG1-CB 4.24Å; V309-H314 HydrophobicContact CB-CB 3.86Å; V309-H314 HydrophobicContact CG1-CB 3.73Å; C310-H314 PolarHBondContact N-ND1 3.44Å; S311-H314 WeakPolarHBondContact O-CB 3.5Å; S311-H314 PolarHBondContact O-N 2.89Å; F312-H314 PolarHBondContact O-N 2.77Å; H314-G316 VanDerWaalsContact C-N 3.33Å
315	L	91.1	Very high	91.6	Very high	9 Å²	9	38.4 Å²	38.4	5%	0.047	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-84.6	-11.3	-177.1	-64	168.3	0	0	0	112.5	V309 F312 A313 L317 V341 L345	V309-L315 HydrophobicContact CB-CD2 4.4Å; V309-L315 HydrophobicContact CG1-CD2 3.96Å; V309-L315 HydrophobicContact CG2-CD1 4.46Å; V309-L315 HydrophobicContact CG2-CD2 3.65Å; V309-L315 HydrophobicContact CG2-CG 4.04Å; F312-L315 HydrophobicContact CD1-CD1 4.07Å; F312-L315 WeakPolarHBondContact O-CB 3.32Å; F312-L315 PolarHBondContact O-N 2.8Å; F312-L315 VanDerWaalsContact O-N 3.14Å; A313-L315 PolarHBondContact O-N 2.9Å; L315-L317 VanDerWaalsContact C-N 3.26Å; L315-L317 HydrophobicContact CB-CD1 4.28Å; L315-L317 HydrophobicContact CB-CD2 3.93Å; L315-L317 HydrophobicContact CB-CG 3.75Å; L315-L317 HydrophobicContact CD1-CD1 4.3Å; L315-L317 PolarHBondContact O-N 2.82Å; L315-V341 HydrophobicContact CD1-CB 4.42Å; L315-V341 HydrophobicContact CD1-CG1 3.93Å; L315-V341 HydrophobicContact CD2-CB 3.94Å; L315-V341 HydrophobicContact CD2-CG1 3.61Å; L315-V341 HydrophobicContact CG-CG1 4.3Å; L315-L345 HydrophobicContact CD2-CD1 4.47Å
316	G	87.8	Confident	91.8	Very high	69 Å²	69	41.9 Å²	41.9	71%	0.711	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	29.6	-179.3	0	0	0	0	0	113.6	H314	H314-G316 VanDerWaalsContact C-N 3.33Å
317	L	91.2	Very high	91.8	Very high	19 Å²	19	47.2 Å²	47.2	10%	0.099	26%	0.262	C	S	.	.			trans	-69.9	149	177.6	-50.1	180	0	0	0	110.3	L315 L321 M322 I325 L345 I370	L315-L317 VanDerWaalsContact C-N 3.26Å; L315-L317 HydrophobicContact CB-CD1 4.28Å; L315-L317 HydrophobicContact CB-CD2 3.93Å; L315-L317 HydrophobicContact CB-CG 3.75Å; L315-L317 HydrophobicContact CD1-CD1 4.3Å; L315-L317 PolarHBondContact O-N 2.82Å; L317-L321 HydrophobicContact CB-CD2 4.2Å; L317-L321 HydrophobicContact CB-CG 4.5Å; L317-L321 HydrophobicContact CD1-CD2 4.06Å; L317-L321 HydrophobicContact CD1-CG 4.23Å; L317-L321 HydrophobicContact CD2-CD2 3.99Å; L317-L321 HydrophobicContact CG-CD2 4.29Å; L317-M322 HydrophobicContact CB-CG 3.92Å; L317-M322 HydrophobicContact CB-SD 4.02Å; L317-M322 HydrophobicContact CD1-SD 4.04Å; L317-M322 HydrophobicContact CG-SD 4.42Å; L317-I325 HydrophobicContact CD1-CD1 3.45Å; L317-I325 VanDerWaalsContact CD1-CD1 3.45Å; L317-L345 HydrophobicContact CD2-CD1 4.44Å; L317-I370 HydrophobicContact CD2-CD1 3.35Å
318	D	92.2	Very high	91.4	Very high	65 Å²	65	48 Å²	48	35%	0.348	28%	0.279	S	S	.	.			trans	-72.7	158.4	174.9	63.5	-28.3	0	0	0	112.1	P320 L321 M322 Y410	D318-P320 VanDerWaalsContact C-CD 3.44Å; D318-L321 PolarHBondContact O-N 2.84Å; D318-L321 WeakPolarHBondContact OD1-CB 3.43Å; D318-M322 WeakPolarHBondContact O-CG 3.41Å; D318-M322 PolarHBondContact O-N 3.08Å; D318-Y410 PolarHBondContact OD1-OH 2.79Å; D318-Y410 VanDerWaalsContact OD2-CE1 3.25Å; D318-Y410 WeakPolarHBondContact OD2-CE1 3.36Å; D318-Y410 PolarHBondContact OD2-OH 3.2Å
319	E	93.2	Very high	91.1	Very high	122 Å²	122	50.6 Å²	50.6	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-57.9	-39.6	-174.6	-168.4	59	-143	0	0	113.9	L321 M322 E323 R326	E319-L321 VanDerWaalsContact C-N 3.35Å; E319-L321 PolarHBondContact O-N 2.72Å; E319-M322 PolarHBondContact O-N 2.98Å; E319-E323 VanDerWaalsContact O-CB 3.29Å; E319-E323 WeakPolarHBondContact O-CB 3.25Å; E319-E323 PolarHBondContact O-N 3.14Å; E319-R326 IonicContact OE1-NH2 3.14Å; E319-R326 PolarHBondContact OE1-NH2 3.34Å
320	P	93.5	Very high	90.8	Very high	56 Å²	56	54.9 Å²	54.9	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-39	177.7	-20.2	31.5	0	0	0	113.4	D318 A324 V409	D318-P320 VanDerWaalsContact C-CD 3.44Å; P320-A324 PolarHBondContact O-N 2.83Å; P320-V409 HydrophobicContact CB-CG1 3.43Å; P320-V409 VanDerWaalsContact CB-CG1 3.43Å
321	L	92.5	Very high	90.7	Very high	1 Å²	1	58 Å²	58	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-71.1	-42.5	175.8	-174	54	0	0	0	111.3	L317 D318 E319 E323 A324 I325 W366 I370 L406 Y410	L317-L321 HydrophobicContact CB-CD2 4.2Å; L317-L321 HydrophobicContact CB-CG 4.5Å; L317-L321 HydrophobicContact CD1-CD2 4.06Å; L317-L321 HydrophobicContact CD1-CG 4.23Å; L317-L321 HydrophobicContact CD2-CD2 3.99Å; L317-L321 HydrophobicContact CG-CD2 4.29Å; D318-L321 PolarHBondContact O-N 2.84Å; D318-L321 WeakPolarHBondContact OD1-CB 3.43Å; E319-L321 VanDerWaalsContact C-N 3.35Å; E319-L321 PolarHBondContact O-N 2.72Å; L321-E323 VanDerWaalsContact C-N 3.31Å; L321-E323 PolarHBondContact O-N 2.9Å; L321-A324 WeakPolarHBondContact O-CB 3.42Å; L321-A324 PolarHBondContact O-N 3.06Å; L321-A324 VanDerWaalsContact O-N 3.16Å; L321-I325 HydrophobicContact CG-CD1 4.17Å; L321-I325 VanDerWaalsContact O-CG1 3.27Å; L321-I325 WeakPolarHBondContact O-CG1 3.45Å; L321-I325 PolarHBondContact O-N 2.9Å; L321-W366 HydrophobicContact CD1-CG 4.5Å; L321-W366 HydrophobicContact CD2-CB 4.23Å; L321-I370 HydrophobicContact CD2-CD1 4.1Å; L321-I370 HydrophobicContact CD2-CG1 4.29Å; L321-L406 HydrophobicContact CD1-CD2 4.12Å; L321-Y410 VanDerWaalsContact CB-OH 3.31Å; L321-Y410 WeakPolarHBondContact CB-OH 3.2Å; L321-Y410 PolarHBondContact N-OH 2.9Å; L321-Y410 VanDerWaalsContact N-OH 3.11Å
322	M	93	Very high	90.7	Very high	42 Å²	42	62.7 Å²	62.7	21%	0.207	36%	0.357	C	S	.	.	H	α-helix	trans	-60.1	-40.6	175	-74	-65.4	-69.7	0	0	112.2	F312 L317 D318 E319 I325 R326	F312-M322 HydrophobicContact CB-CE 3.9Å; F312-M322 HydrophobicContact CB-SD 3.96Å; L317-M322 HydrophobicContact CB-CG 3.92Å; L317-M322 HydrophobicContact CB-SD 4.02Å; L317-M322 HydrophobicContact CD1-SD 4.04Å; L317-M322 HydrophobicContact CG-SD 4.42Å; D318-M322 WeakPolarHBondContact O-CG 3.41Å; D318-M322 PolarHBondContact O-N 3.08Å; E319-M322 PolarHBondContact O-N 2.98Å; M322-I325 PolarHBondContact O-N 2.93Å; M322-R326 WeakPolarHBondContact O-CB 3.47Å; M322-R326 PolarHBondContact O-N 2.83Å
323	E	92.8	Very high	90.7	Very high	64 Å²	64	62.9 Å²	62.9	30%	0.299	36%	0.359	S	S	.	.	H	α-helix	trans	-62	-43.7	173.4	178.2	66.1	-135.2	0	0	111.5	E319 L321 R326 K327	E319-E323 VanDerWaalsContact O-CB 3.29Å; E319-E323 WeakPolarHBondContact O-CB 3.25Å; E319-E323 PolarHBondContact O-N 3.14Å; L321-E323 VanDerWaalsContact C-N 3.31Å; L321-E323 PolarHBondContact O-N 2.9Å; E323-R326 PolarHBondContact O-N 2.95Å; E323-R326 IonicContact OE1-NH1 2.9Å; E323-R326 PolarHBondContact OE1-NH1 3.29Å; E323-R326 IonicContact OE2-CZ 3.58Å; E323-R326 IonicContact OE2-NH1 3.95Å; E323-R326 PolarHBondContact OE2-NH1 3.28Å; E323-R326 IonicContact OE2-NH2 2.99Å; E323-K327 HydrophobicContact CG-CD 4.14Å; E323-K327 WeakPolarHBondContact O-CB 3.37Å; E323-K327 WeakPolarHBondContact O-CG 3.3Å; E323-K327 PolarHBondContact O-N 3.09Å; E323-K327 WeakPolarHBondContact OE1-CE 3.45Å; E323-K327 IonicContact OE1-NZ 3.76Å; E323-K327 PolarHBondContact OE1-NZ 3.25Å
324	A	91.3	Very high	90.7	Very high	19 Å²	19	61.8 Å²	61.8	16%	0.157	35%	0.346	C	S	.	.	H	α-helix	trans	-63.4	-41.4	176.7	0	0	0	0	0	112	P320 L321 K327 A328 L406	P320-A324 PolarHBondContact O-N 2.83Å; L321-A324 WeakPolarHBondContact O-CB 3.42Å; L321-A324 PolarHBondContact O-N 3.06Å; L321-A324 VanDerWaalsContact O-N 3.16Å; A324-K327 PolarHBondContact O-N 3.48Å; A324-A328 WeakPolarHBondContact O-CB 3.38Å; A324-A328 PolarHBondContact O-N 3.02Å; A324-L406 HydrophobicContact CB-CD2 3.92Å
325	I	91.3	Very high	90.7	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.015	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-45.1	175.3	-69.5	170.5	0	0	0	110.5	F312 L317 L321 M322 A328 G329 Y330 W366	F312-I325 HydrophobicContact CD1-CG2 4.42Å; F312-I325 HydrophobicContact CD2-CG2 3.97Å; F312-I325 HydrophobicContact CE1-CG2 4.38Å; F312-I325 HydrophobicContact CE2-CG2 3.88Å; F312-I325 HydrophobicContact CG-CG2 4.24Å; F312-I325 HydrophobicContact CZ-CG2 4.1Å; L317-I325 HydrophobicContact CD1-CD1 3.45Å; L317-I325 VanDerWaalsContact CD1-CD1 3.45Å; L321-I325 HydrophobicContact CG-CD1 4.17Å; L321-I325 VanDerWaalsContact O-CG1 3.27Å; L321-I325 WeakPolarHBondContact O-CG1 3.45Å; L321-I325 PolarHBondContact O-N 2.9Å; M322-I325 PolarHBondContact O-N 2.93Å; I325-A328 PolarHBondContact O-N 3.22Å; I325-G329 PolarHBondContact O-N 3.26Å; I325-Y330 HydrophobicContact CG2-CD2 4.16Å; I325-Y330 HydrophobicContact CG2-CG 4.36Å; I325-Y330 PolarHBondContact O-N 3.27Å; I325-W366 HydrophobicContact CD1-CD2 3.93Å; I325-W366 HydrophobicContact CD1-CE3 4.38Å; I325-W366 HydrophobicContact CD1-CG 4.3Å; I325-W366 HydrophobicContact CD1-CH2 4.48Å; I325-W366 HydrophobicContact CD1-CZ2 4.02Å; I325-W366 HydrophobicContact CG1-CD2 4.36Å; I325-W366 HydrophobicContact CG1-CZ2 3.79Å; I325-W366 HydrophobicContact CG2-CZ2 4.29Å
326	R	90.7	Very high	90.8	Very high	123 Å²	123	62.2 Å²	62.2	46%	0.464	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-42.9	178.4	-160	-174.1	-41	102.4	-1.2	112.1	E319 M322 E323 A328 G329	E319-R326 IonicContact OE1-NH2 3.14Å; E319-R326 PolarHBondContact OE1-NH2 3.34Å; M322-R326 WeakPolarHBondContact O-CB 3.47Å; M322-R326 PolarHBondContact O-N 2.83Å; E323-R326 PolarHBondContact O-N 2.95Å; E323-R326 IonicContact OE1-NH1 2.9Å; E323-R326 PolarHBondContact OE1-NH1 3.29Å; E323-R326 IonicContact OE2-CZ 3.58Å; E323-R326 IonicContact OE2-NH1 3.95Å; E323-R326 PolarHBondContact OE2-NH1 3.28Å; E323-R326 IonicContact OE2-NH2 2.99Å; R326-A328 VanDerWaalsContact C-N 3.27Å; R326-A328 PolarHBondContact O-N 3.43Å; R326-G329 PolarHBondContact O-N 3.29Å
327	K	90.5	Very high	91.2	Very high	158 Å²	158	59 Å²	59	69%	0.687	32%	0.318	S	S	*	.	H	α-helix	trans	-62.8	-31.9	175.6	-81.1	173.1	171.8	148.2	0	113	E323 A324 G329	E323-K327 HydrophobicContact CG-CD 4.14Å; E323-K327 WeakPolarHBondContact O-CB 3.37Å; E323-K327 WeakPolarHBondContact O-CG 3.3Å; E323-K327 PolarHBondContact O-N 3.09Å; E323-K327 WeakPolarHBondContact OE1-CE 3.45Å; E323-K327 IonicContact OE1-NZ 3.76Å; E323-K327 PolarHBondContact OE1-NZ 3.25Å; A324-K327 PolarHBondContact O-N 3.48Å; K327-G329 PolarHBondContact O-N 3.32Å
328	A	86.2	Confident	91.4	Very high	63 Å²	63	58.1 Å²	58.1	52%	0.521	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.9	173.5	0	0	0	0	0	113.3	A324 I325 R326 Y330	A324-A328 WeakPolarHBondContact O-CB 3.38Å; A324-A328 PolarHBondContact O-N 3.02Å; I325-A328 PolarHBondContact O-N 3.22Å; R326-A328 VanDerWaalsContact C-N 3.27Å; R326-A328 PolarHBondContact O-N 3.43Å; A328-Y330 HydrophobicContact CB-CD2 3.63Å; A328-Y330 HydrophobicContact CB-CE2 3.58Å
329	G	87.1	Confident	91.5	Very high	56 Å²	56	55 Å²	55	58%	0.577	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	12.1	177.1	0	0	0	0	0	114.5	I325 R326 K327 T331	I325-G329 PolarHBondContact O-N 3.26Å; R326-G329 PolarHBondContact O-N 3.29Å; K327-G329 PolarHBondContact O-N 3.32Å; G329-T331 PolarHBondContact O-N 3.3Å
330	Y	87.3	Confident	91.7	Very high	90 Å²	90	49.2 Å²	49.2	35%	0.353	27%	0.27	S	S	.	.			trans	-75.4	122.7	175.8	-64.2	-69	0	0	0	110.7	F312 I325 A328 W366	F312-Y330 HydrophobicContact CZ-CG 4.49Å; I325-Y330 HydrophobicContact CG2-CD2 4.16Å; I325-Y330 HydrophobicContact CG2-CG 4.36Å; I325-Y330 PolarHBondContact O-N 3.27Å; A328-Y330 HydrophobicContact CB-CD2 3.63Å; A328-Y330 HydrophobicContact CB-CE2 3.58Å; Y330-W366 HydrophobicContact CD2-CZ2 4.05Å; Y330-W366 HydrophobicContact CE2-CZ2 4.14Å
331	T	87.2	Confident	91.8	Very high	128 Å²	128	46.6 Å²	46.6	79%	0.785	25%	0.252	S	S	*	.			trans	-99.2	-37.2	178.7	53.9	0	0	0	0	112.7	G329	G329-T331 PolarHBondContact O-N 3.3Å
332	Q	90	Very high	92	Very high	142 Å²	142	46.5 Å²	46.5	66%	0.664	25%	0.252	S	S	*	.	S	Bend	trans	-143.2	152.7	178.5	-67.8	-174.8	4.2	0	0	110.7	F312	F312-Q332 WeakPolarHBondContact CZ-O 3.44Å
333	P	92.3	Very high	92.1	Very high	14 Å²	14	44.5 Å²	44.5	9%	0.091	24%	0.242	C	C	.	.			trans	-65.5	135.5	174.7	26.7	-33.3	0	0	0	110.5	F312 Q337 A338	F312-P333 HydrophobicContact CD1-CB 4.17Å; F312-P333 HydrophobicContact CE1-CB 3.7Å; F312-P333 HydrophobicContact CE1-CG 4.42Å; F312-P333 HydrophobicContact CZ-CB 4.22Å; F312-P333 VanDerWaalsContact CZ-N 3.31Å; P333-Q337 HydrophobicContact CB-CB 4.14Å; P333-A338 HydrophobicContact CB-CB 4.43Å
334	T	91.9	Very high	92.3	Very high	38 Å²	38	41.5 Å²	41.5	23%	0.233	23%	0.228	C	C	.	.			trans	-63.2	158.1	168.5	59.8	0	0	0	0	110.4	I336 Q337 A338 S358	T334-I336 VanDerWaalsContact C-N 3.27Å; T334-I336 PolarHBondContact O-N 2.96Å; T334-Q337 WeakPolarHBondContact O-CA 3.48Å; T334-Q337 WeakPolarHBondContact O-CB 3.3Å; T334-Q337 PolarHBondContact O-N 3.02Å; T334-Q337 WeakPolarHBondContact OG1-CB 3.26Å; T334-Q337 WeakPolarHBondContact OG1-CG 3.04Å; T334-Q337 PolarHBondContact OG1-N 3.18Å; T334-Q337 PolarHBondContact OG1-OE1 2.51Å; T334-A338 WeakPolarHBondContact O-CB 3.38Å; T334-A338 PolarHBondContact O-N 2.79Å; T334-S358 VanDerWaalsContact CB-O 3.24Å; T334-S358 WeakPolarHBondContact CB-O 3.23Å; T334-S358 WeakPolarHBondContact CG2-O 3.36Å; T334-S358 PolarHBondContact OG1-O 3.4Å
335	P	92.2	Very high	92.5	Very high	35 Å²	35	40.8 Å²	40.8	23%	0.227	22%	0.222	C	C	.	.	H	α-helix	trans	-53.2	-41	-179.3	-30.3	36.3	0	0	0	114.5	L296 L298 A338 Q339 Q518	L296-P335 HydrophobicContact CB-CB 4.1Å; L296-P335 HydrophobicContact CD2-CB 4.34Å; L296-P335 HydrophobicContact CD2-CG 4.16Å; L296-P335 VanDerWaalsContact O-CB 3.3Å; L296-P335 WeakPolarHBondContact O-CB 3.5Å; L298-P335 WeakPolarHBondContact CD1-O 3.42Å; L298-P335 HydrophobicContact CD2-CB 4.17Å; L298-P335 HydrophobicContact CG-CB 4.37Å; P335-A338 PolarHBondContact O-N 3.36Å; P335-Q339 PolarHBondContact O-N 3.49Å; P335-Q518 HydrophobicContact CB-CG 4.13Å
336	I	93.1	Very high	92.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.1	-39.2	177.3	-163.6	66.4	0	0	0	111.5	T334 A340 S358 K360 I516 Q518	T334-I336 VanDerWaalsContact C-N 3.27Å; T334-I336 PolarHBondContact O-N 2.96Å; I336-A340 WeakPolarHBondContact O-CB 3.48Å; I336-A340 PolarHBondContact O-N 3.46Å; I336-S358 WeakPolarHBondContact CG2-O 3.07Å; I336-K360 HydrophobicContact CG1-CG 4.36Å; I336-K360 HydrophobicContact CG2-CG 4.32Å; I336-I516 HydrophobicContact CD1-CB 4.26Å; I336-I516 HydrophobicContact CD1-CG2 3.78Å; I336-Q518 HydrophobicContact CD1-CB 4.48Å
337	Q	95.1	Very high	92.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-42.8	176.6	-71.1	161.3	-8.4	0	0	111.4	P333 T334 Q339 A340 V341 G359 A363 W366	P333-Q337 HydrophobicContact CB-CB 4.14Å; T334-Q337 WeakPolarHBondContact O-CA 3.48Å; T334-Q337 WeakPolarHBondContact O-CB 3.3Å; T334-Q337 PolarHBondContact O-N 3.02Å; T334-Q337 WeakPolarHBondContact OG1-CB 3.26Å; T334-Q337 WeakPolarHBondContact OG1-CG 3.04Å; T334-Q337 PolarHBondContact OG1-N 3.18Å; T334-Q337 PolarHBondContact OG1-OE1 2.51Å; Q337-Q339 PolarHBondContact O-N 2.98Å; Q337-Q339 VanDerWaalsContact O-N 3.16Å; Q337-A340 PolarHBondContact O-N 2.97Å; Q337-V341 HydrophobicContact CB-CG2 4.1Å; Q337-V341 WeakPolarHBondContact O-CB 3.35Å; Q337-V341 WeakPolarHBondContact O-CG2 3.16Å; Q337-V341 PolarHBondContact O-N 3Å; Q337-G359 PolarHBondContact NE2-O 3.25Å; Q337-A363 HydrophobicContact CG-CB 3.78Å; Q337-W366 HydrophobicContact CB-CZ3 4.46Å; Q337-W366 HydrophobicContact CG-CZ3 4.22Å
338	A	95.1	Very high	93.1	Very high	1 Å²	1	31 Å²	31	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-53.3	-36.5	179.5	0	0	0	0	0	112.9	L296 P308 V309 P333 T334 P335 P342	L296-A338 HydrophobicContact CD1-CB 4.03Å; P308-A338 CarbonylContact C-O 3.57Å; P308-A338 WeakPolarHBondContact CA-O 3.38Å; V309-A338 WeakPolarHBondContact CG2-O 3.48Å; V309-A338 PolarHBondContact N-O 2.87Å; V309-A338 WeakPolarHBondContact O-CB 3.3Å; P333-A338 HydrophobicContact CB-CB 4.43Å; T334-A338 WeakPolarHBondContact O-CB 3.38Å; T334-A338 PolarHBondContact O-N 2.79Å; P335-A338 PolarHBondContact O-N 3.36Å; A338-P342 WeakPolarHBondContact O-CD 3.14Å; A338-P342 WeakPolarHBondContact O-CG 2.98Å
339	Q	95.3	Very high	93.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-98.7	-37	-179.9	-174	61.9	83	0	0	113.4	L298 V300 L306 P308 P335 Q337 P342 L343 I516	L298-Q339 HydrophobicContact CD1-CB 3.81Å; L298-Q339 HydrophobicContact CD1-CG 4.46Å; V300-Q339 HydrophobicContact CG2-CG 3.75Å; L306-Q339 PolarHBondContact O-NE2 3.31Å; P308-Q339 HydrophobicContact CB-CB 4.36Å; P335-Q339 PolarHBondContact O-N 3.49Å; Q337-Q339 PolarHBondContact O-N 2.98Å; Q337-Q339 VanDerWaalsContact O-N 3.16Å; Q339-P342 WeakPolarHBondContact O-CG 3.45Å; Q339-L343 HydrophobicContact CG-CD1 4.34Å; Q339-L343 WeakPolarHBondContact O-CD1 3.48Å; Q339-I516 HydrophobicContact CB-CD1 4.37Å; Q339-I516 HydrophobicContact CB-CG2 4.12Å; Q339-I516 HydrophobicContact CG-CD1 3.94Å; Q339-I516 HydrophobicContact CG-CG1 4Å; Q339-I516 HydrophobicContact CG-CG2 3.86Å
340	A	96.4	Very high	94.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-77	-42.8	-174.9	0	0	0	0	0	112.8	I336 Q337 L343 I344 A363 I516	I336-A340 WeakPolarHBondContact O-CB 3.48Å; I336-A340 PolarHBondContact O-N 3.46Å; Q337-A340 PolarHBondContact O-N 2.97Å; A340-L343 WeakPolarHBondContact O-CB 3.4Å; A340-L343 PolarHBondContact O-N 3.13Å; A340-I344 HydrophobicContact CB-CD1 4.17Å; A340-I344 WeakPolarHBondContact O-CD1 3.34Å; A340-I344 WeakPolarHBondContact O-CG1 3.3Å; A340-I344 PolarHBondContact O-N 3.42Å; A340-A363 HydrophobicContact CB-CB 4.4Å; A340-I516 HydrophobicContact CB-CD1 3.69Å
341	V	96.4	Very high	94.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.7	-48.7	-176.7	-176.8	0	0	0	0	112.6	L315 Q337 L343 I344 L345 A363 W366 P367	L315-V341 HydrophobicContact CD1-CB 4.42Å; L315-V341 HydrophobicContact CD1-CG1 3.93Å; L315-V341 HydrophobicContact CD2-CB 3.94Å; L315-V341 HydrophobicContact CD2-CG1 3.61Å; L315-V341 HydrophobicContact CG-CG1 4.3Å; Q337-V341 HydrophobicContact CB-CG2 4.1Å; Q337-V341 WeakPolarHBondContact O-CB 3.35Å; Q337-V341 WeakPolarHBondContact O-CG2 3.16Å; Q337-V341 PolarHBondContact O-N 3Å; V341-L343 VanDerWaalsContact C-N 3.34Å; V341-L343 PolarHBondContact O-N 3.14Å; V341-I344 PolarHBondContact O-N 3.42Å; V341-L345 HydrophobicContact CG1-CD1 3.89Å; V341-L345 HydrophobicContact CG1-CG 4.27Å; V341-L345 WeakPolarHBondContact O-CB 3.45Å; V341-L345 WeakPolarHBondContact O-CG 3.49Å; V341-L345 PolarHBondContact O-N 3.24Å; V341-A363 HydrophobicContact CG2-CB 4.27Å; V341-W366 HydrophobicContact CG2-CE3 4.13Å; V341-W366 HydrophobicContact CG2-CZ3 4.44Å; V341-P367 HydrophobicContact CG1-CG 3.89Å
342	P	95.8	Very high	94.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.5	-37.3	177.6	24	-34.1	0	0	0	112.8	Y275 V309 A338 Q339 I344 A346	Y275-P342 HydrophobicContact CD1-CB 4.5Å; Y275-P342 HydrophobicContact CD2-CB 4.11Å; Y275-P342 HydrophobicContact CE1-CB 4.06Å; Y275-P342 HydrophobicContact CE2-CB 3.64Å; V309-P342 HydrophobicContact CG1-CG 4.4Å; A338-P342 WeakPolarHBondContact O-CD 3.14Å; A338-P342 WeakPolarHBondContact O-CG 2.98Å; Q339-P342 WeakPolarHBondContact O-CG 3.45Å; P342-I344 VanDerWaalsContact C-N 3.35Å; P342-I344 PolarHBondContact O-N 3.28Å; P342-A346 WeakPolarHBondContact O-CB 3.34Å; P342-A346 PolarHBondContact O-N 3.38Å
343	L	96	Very high	95	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.1	-41.2	175.2	-77.7	166.7	0	0	0	112.3	L306 Q339 A340 V341 A346 R348 V350 V514 I516	L306-L343 HydrophobicContact CB-CD2 3.98Å; L306-L343 HydrophobicContact CB-CG 4.32Å; L306-L343 HydrophobicContact CD1-CD2 4.32Å; L306-L343 HydrophobicContact CG-CD2 3.93Å; Q339-L343 HydrophobicContact CG-CD1 4.34Å; Q339-L343 WeakPolarHBondContact O-CD1 3.48Å; A340-L343 WeakPolarHBondContact O-CB 3.4Å; A340-L343 PolarHBondContact O-N 3.13Å; V341-L343 VanDerWaalsContact C-N 3.34Å; V341-L343 PolarHBondContact O-N 3.14Å; L343-A346 PolarHBondContact O-N 2.71Å; L343-R348 WeakPolarHBondContact O-CB 3.45Å; L343-R348 PolarHBondContact O-N 2.67Å; L343-V350 HydrophobicContact CB-CG2 3.85Å; L343-V514 HydrophobicContact CD1-CB 4.05Å; L343-V514 HydrophobicContact CD1-CG1 3.62Å; L343-V514 HydrophobicContact CD2-CB 4.15Å; L343-V514 HydrophobicContact CD2-CG1 4.17Å; L343-V514 HydrophobicContact CD2-CG2 3.93Å; L343-I516 HydrophobicContact CD1-CD1 3.63Å; L343-I516 HydrophobicContact CD1-CG1 4.03Å
344	I	96.9	Very high	94.7	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-71.2	-44.8	180	-64.1	164.1	0	0	0	110.5	A340 V341 P342 A346 G347 V350 A363 P367 Y460 Q490 L492 F494	A340-I344 HydrophobicContact CB-CD1 4.17Å; A340-I344 WeakPolarHBondContact O-CD1 3.34Å; A340-I344 WeakPolarHBondContact O-CG1 3.3Å; A340-I344 PolarHBondContact O-N 3.42Å; V341-I344 PolarHBondContact O-N 3.42Å; P342-I344 VanDerWaalsContact C-N 3.35Å; P342-I344 PolarHBondContact O-N 3.28Å; I344-A346 PolarHBondContact O-N 3.05Å; I344-G347 PolarHBondContact O-N 2.85Å; I344-V350 HydrophobicContact CG1-CG2 3.94Å; I344-A363 WeakPolarHBondContact CD1-O 3.45Å; I344-P367 HydrophobicContact CB-CB 4.03Å; I344-P367 HydrophobicContact CB-CG 3.92Å; I344-P367 HydrophobicContact CG2-CB 3.3Å; I344-P367 HydrophobicContact CG2-CG 3.66Å; I344-Y460 HydrophobicContact CG2-CE2 3.63Å; I344-Y460 WeakPolarHBondContact CG2-OH 3.47Å; I344-Q490 PolarHBondContact O-NE2 2.83Å; I344-L492 HydrophobicContact CD1-CD1 3.72Å; I344-L492 HydrophobicContact CG1-CD1 3.83Å; I344-L492 HydrophobicContact CG1-CD2 3.91Å; I344-L492 HydrophobicContact CG2-CD1 3.84Å; I344-L492 HydrophobicContact CG2-CD2 4.48Å; I344-F494 HydrophobicContact CD1-CZ 4.08Å
345	L	96.1	Very high	93.9	Very high	4 Å²	4	10 Å²	10	2%	0.021	5%	0.052	C	C	.	.	H	α-helix	trans	-60.2	-28.4	174.7	-72.2	172	0	0	0	112.3	F274 Y275 L315 L317 V341 G347 P367 I370	F274-L345 PolarHBondContact N-O 3.45Å; Y275-L345 HydrophobicContact CD2-CB 4.3Å; Y275-L345 HydrophobicContact CD2-CD1 4.34Å; Y275-L345 HydrophobicContact CG-CB 4.42Å; Y275-L345 PolarHBondContact N-O 3.33Å; L315-L345 HydrophobicContact CD2-CD1 4.47Å; L317-L345 HydrophobicContact CD2-CD1 4.44Å; V341-L345 HydrophobicContact CG1-CD1 3.89Å; V341-L345 HydrophobicContact CG1-CG 4.27Å; V341-L345 WeakPolarHBondContact O-CB 3.45Å; V341-L345 WeakPolarHBondContact O-CG 3.49Å; V341-L345 PolarHBondContact O-N 3.24Å; L345-G347 PolarHBondContact O-N 3.12Å; L345-P367 HydrophobicContact CD2-CB 3.84Å; L345-P367 HydrophobicContact CD2-CG 4.29Å; L345-P367 HydrophobicContact CG-CB 4.15Å; L345-P367 HydrophobicContact CG-CG 4.2Å; L345-I370 HydrophobicContact CD2-CB 4.18Å; L345-I370 HydrophobicContact CD2-CD1 3.68Å; L345-I370 HydrophobicContact CD2-CG2 4.15Å
346	A	95	Very high	93	Very high	17 Å²	17	9.7 Å²	9.7	14%	0.14	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-1.6	174.7	0	0	0	0	0	114.3	N273 L306 P342 L343 I344 R348	N273-A346 WeakPolarHBondContact OD1-CA 3.41Å; L306-A346 HydrophobicContact CD1-CB 3.41Å; L306-A346 VanDerWaalsContact CD1-CB 3.41Å; P342-A346 WeakPolarHBondContact O-CB 3.34Å; P342-A346 PolarHBondContact O-N 3.38Å; L343-A346 PolarHBondContact O-N 2.71Å; I344-A346 PolarHBondContact O-N 3.05Å; A346-R348 HydrophobicContact CB-CG 4.48Å
347	G	94.7	Very high	92	Very high	4 Å²	4	11.9 Å²	11.9	4%	0.041	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	17.6	177.7	0	0	0	0	0	114.9	K272 I344 L345	K272-G347 VanDerWaalsContact CD-O 3.22Å; K272-G347 WeakPolarHBondContact CD-O 3.46Å; K272-G347 WeakPolarHBondContact CE-O 3.47Å; K272-G347 PolarHBondContact NZ-O 3.27Å; K272-G347 WeakPolarHBondContact O-CA 3.4Å; K272-G347 PolarHBondContact O-N 3.04Å; I344-G347 PolarHBondContact O-N 2.85Å; L345-G347 PolarHBondContact O-N 3.12Å
348	R	95.4	Very high	91.4	Very high	57 Å²	57	12.1 Å²	12.1	22%	0.215	7%	0.073	C	C	.	.			trans	-87.4	148.3	179.1	-61.2	-66	-59.1	-73	-7.8	111	P303 S304 L343 A346 Q490 D512	P303-R348 PolarHBondContact O-NH1 3.14Å; P303-R348 PolarHBondContact O-NH2 2.8Å; S304-R348 PolarHBondContact O-NH1 2.99Å; L343-R348 WeakPolarHBondContact O-CB 3.45Å; L343-R348 PolarHBondContact O-N 2.67Å; A346-R348 HydrophobicContact CB-CG 4.48Å; R348-Q490 PolarHBondContact O-NE2 3.31Å; R348-D512 PolarHBondContact NH2-O 2.84Å
349	D	97.2	Very high	91	Very high	4 Å²	4	13 Å²	13	2%	0.021	8%	0.082	C	C	.	.			trans	-71.8	141	168.8	-75.2	14.6	0	0	0	109.3	K272 Q490 T491 L510 L511 P513 V514	K272-D349 IonicContact NZ-OD1 2.59Å; D349-Q490 WeakPolarHBondContact OD1-CA 3.2Å; D349-T491 VanDerWaalsContact CA-O 3.27Å; D349-T491 WeakPolarHBondContact CA-O 3.31Å; D349-T491 VanDerWaalsContact CB-O 3.3Å; D349-T491 WeakPolarHBondContact CB-O 3.35Å; D349-T491 PolarHBondContact OD1-N 2.83Å; D349-L510 HydrophobicContact CB-CB 4.42Å; D349-L510 HydrophobicContact CB-CD2 4.45Å; D349-L510 WeakPolarHBondContact OD2-CA 3.18Å; D349-L511 PolarHBondContact OD2-N 2.88Å; D349-P513 HydrophobicContact CB-CB 4.12Å; D349-P513 CarbonylContact O-C 3.54Å; D349-P513 VanDerWaalsContact O-CA 3.31Å; D349-P513 WeakPolarHBondContact O-CA 3.39Å; D349-V514 PolarHBondContact O-N 3.38Å
350	V	96.7	Very high	90.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.6	-173.3	177.4	0	0	0	0	111.1	L343 I344 T491 L492 L493 V514 I516	L343-V350 HydrophobicContact CB-CG2 3.85Å; I344-V350 HydrophobicContact CG1-CG2 3.94Å; V350-T491 PolarHBondContact N-O 3.42Å; V350-L492 HydrophobicContact CB-CD2 3.94Å; V350-L492 HydrophobicContact CG2-CD2 4.17Å; V350-L492 WeakPolarHBondContact O-CA 3.35Å; V350-L493 PolarHBondContact O-N 2.86Å; V350-V514 WeakPolarHBondContact CA-O 3.38Å; V350-I516 HydrophobicContact CG1-CD1 3.62Å; V350-I516 HydrophobicContact CG1-CG1 4.3Å
351	I	96.3	Very high	90.7	Very high	11 Å²	11	15.2 Å²	15.2	6%	0.056	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	102.9	164.7	-59.6	169	0	0	0	107.6	I353 L493 F498 A506 L510 P513 V514 R515 I516	I351-I353 HydrophobicContact CG2-CD1 3.85Å; I351-I353 HydrophobicContact CG2-CG1 4.09Å; I351-L493 CarbonylContact C-O 3.53Å; I351-L493 WeakPolarHBondContact CA-O 3.48Å; I351-L493 HydrophobicContact CG2-CD2 4.36Å; I351-F498 HydrophobicContact CD1-CE2 4.31Å; I351-F498 HydrophobicContact CD1-CZ 3.91Å; I351-F498 HydrophobicContact CG2-CD2 4Å; I351-F498 HydrophobicContact CG2-CE2 3.63Å; I351-F498 HydrophobicContact CG2-CZ 4.03Å; I351-A506 HydrophobicContact CD1-CB 3.94Å; I351-L510 HydrophobicContact CD1-CD1 3.68Å; I351-L510 HydrophobicContact CG1-CD1 3.35Å; I351-P513 HydrophobicContact CD1-CB 4.15Å; I351-P513 HydrophobicContact CD1-CG 4.07Å; I351-P513 HydrophobicContact CG1-CB 4.15Å; I351-V514 PolarHBondContact N-O 3.1Å; I351-R515 HydrophobicContact CB-CB 4.16Å; I351-R515 HydrophobicContact CB-CG 4.25Å; I351-R515 HydrophobicContact CG2-CG 4.2Å; I351-R515 CarbonylContact O-C 3.52Å; I351-R515 WeakPolarHBondContact O-CA 3.43Å; I351-I516 PolarHBondContact O-N 3.3Å
352	G	94.8	Very high	90.6	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	105.9	-179.4	0	0	0	0	0	112.3	L493 F494 S495	G352-L493 PolarHBondContact N-O 3.41Å; G352-F494 WeakPolarHBondContact O-CA 3.19Å; G352-S495 PolarHBondContact O-N 3.29Å
353	I	92.2	Very high	90.6	Very high	5 Å²	5	15.6 Å²	15.6	3%	0.026	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.1	177.1	-50.3	-55.9	0	0	0	109.4	I351 S495 F498 I516 I517 Q518 L521	I351-I353 HydrophobicContact CG2-CD1 3.85Å; I351-I353 HydrophobicContact CG2-CG1 4.09Å; I353-S495 WeakPolarHBondContact CA-O 3.11Å; I353-F498 HydrophobicContact CD1-CB 3.74Å; I353-F498 HydrophobicContact CD1-CD2 3.7Å; I353-F498 HydrophobicContact CD1-CG 3.96Å; I353-F498 HydrophobicContact CG1-CB 3.96Å; I353-F498 HydrophobicContact CG1-CD2 4.41Å; I353-F498 HydrophobicContact CG1-CG 4.27Å; I353-I516 PolarHBondContact N-O 3.08Å; I353-I517 HydrophobicContact CB-CG1 4.46Å; I353-I517 HydrophobicContact CB-CG2 4.48Å; I353-Q518 PolarHBondContact O-N 3.31Å; I353-L521 HydrophobicContact CG2-CD2 4.39Å
354	G	86.3	Confident	90.6	Very high	2 Å²	2	15.6 Å²	15.6	2%	0.021	10%	0.098	C	C	.	.			trans	-169.6	159.8	177	0	0	0	0	0	112.4	K360 S495 A496	G354-K360 PolarHBondContact O-NZ 3.02Å; G354-S495 PolarHBondContact N-O 3.12Å; G354-S495 VanDerWaalsContact N-O 3.14Å; G354-A496 WeakPolarHBondContact O-CA 2.92Å
355	K	75.5	Confident	90.6	Very high	68 Å²	68	15.8 Å²	15.8	30%	0.296	10%	0.099	S	C	.	.			trans	-57.4	158.4	-178.4	66.6	-175.9	-169.5	175.6	0	113.1	S358 N525 D527	K355-S358 VanDerWaalsContact O-CB 3.3Å; K355-S358 WeakPolarHBondContact O-CB 3.34Å; K355-S358 PolarHBondContact O-N 3.46Å; K355-S358 PolarHBondContact O-OG 3.17Å; K355-N525 HydrophobicContact CD-CB 4.04Å; K355-N525 WeakPolarHBondContact CD-OD1 3.31Å; K355-N525 WeakPolarHBondContact CE-OD1 3.47Å; K355-N525 PolarHBondContact NZ-OD1 2.9Å; K355-D527 IonicContact NZ-OD2 3.29Å; K355-D527 PolarHBondContact NZ-OD2 2.97Å
356	T	72.8	Confident	90.6	Very high	28 Å²	28	15.8 Å²	15.8	17%	0.172	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	140	171.5	52.3	0	0	0	0	110.1	S358	T356-S358 VanDerWaalsContact C-N 3.28Å; T356-S358 PolarHBondContact O-N 3.1Å
357	G	73	Confident	90.6	Very high	47 Å²	47	15.1 Å²	15.1	49%	0.485	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	7.4	-177.4	0	0	0	0	0	114.9	G359	G357-G359 PolarHBondContact O-N 3.49Å
358	S	81	Confident	90.7	Very high	5 Å²	5	14.9 Å²	14.9	4%	0.035	9%	0.091	C	C	.	.	S	Bend	trans	-75.7	0.6	175.9	68.9	0	0	0	0	114.9	T334 I336 K355 T356 K360	T334-S358 VanDerWaalsContact CB-O 3.24Å; T334-S358 WeakPolarHBondContact CB-O 3.23Å; T334-S358 WeakPolarHBondContact CG2-O 3.36Å; T334-S358 PolarHBondContact OG1-O 3.4Å; I336-S358 WeakPolarHBondContact CG2-O 3.07Å; K355-S358 VanDerWaalsContact O-CB 3.3Å; K355-S358 WeakPolarHBondContact O-CB 3.34Å; K355-S358 PolarHBondContact O-N 3.46Å; K355-S358 PolarHBondContact O-OG 3.17Å; T356-S358 VanDerWaalsContact C-N 3.28Å; T356-S358 PolarHBondContact O-N 3.1Å; S358-K360 WeakPolarHBondContact OG-CG 3.36Å
359	G	86.9	Confident	90.7	Very high	19 Å²	19	12.3 Å²	12.3	20%	0.196	8%	0.082	C	C	.	.	S	Bend	trans	92	15.6	178.2	0	0	0	0	0	115.7	Q337 G357 T361 A362 A363	Q337-G359 PolarHBondContact NE2-O 3.25Å; G357-G359 PolarHBondContact O-N 3.49Å; G359-T361 VanDerWaalsContact C-N 3.32Å; G359-T361 PolarHBondContact O-N 2.67Å; G359-A362 PolarHBondContact O-N 3.08Å; G359-A363 PolarHBondContact O-N 2.96Å
360	K	92.7	Very high	90.6	Very high	16 Å²	16	13.9 Å²	13.9	7%	0.07	9%	0.089	C	C	.	.	H	α-helix	trans	-53.4	-43.1	179.4	-64.1	-176.6	-63.2	-164	0	113.4	I336 G354 S358 A362 A363 F364 F494 S495	I336-K360 HydrophobicContact CG1-CG 4.36Å; I336-K360 HydrophobicContact CG2-CG 4.32Å; G354-K360 PolarHBondContact O-NZ 3.02Å; S358-K360 WeakPolarHBondContact OG-CG 3.36Å; K360-A362 PolarHBondContact O-N 3.37Å; K360-A363 VanDerWaalsContact O-CB 3.27Å; K360-A363 WeakPolarHBondContact O-CB 3.48Å; K360-A363 PolarHBondContact O-N 2.96Å; K360-F364 WeakPolarHBondContact O-CD1 3.47Å; K360-F364 WeakPolarHBondContact O-CE1 3.43Å; K360-F364 PolarHBondContact O-N 3Å; K360-F494 HydrophobicContact CB-CD1 3.96Å; K360-F494 HydrophobicContact CB-CE1 4.47Å; K360-F494 HydrophobicContact CB-CG 4.42Å; K360-F494 HydrophobicContact CD-CB 4.28Å; K360-F494 HydrophobicContact CD-CD1 3.96Å; K360-F494 HydrophobicContact CG-CD1 3.96Å; K360-S495 VanDerWaalsContact NZ-C 3.34Å; K360-S495 PolarHBondContact NZ-O 2.89Å; K360-S495 VanDerWaalsContact NZ-O 3.08Å
361	T	94	Very high	90.6	Very high	31 Å²	31	14 Å²	14	19%	0.19	9%	0.09	C	C	.	.	H	α-helix	trans	-57.1	-48.4	-178.7	-48.8	0	0	0	0	112.6	G359 A363 F364 L365 I399	G359-T361 VanDerWaalsContact C-N 3.32Å; G359-T361 PolarHBondContact O-N 2.67Å; T361-A363 VanDerWaalsContact C-N 3.31Å; T361-A363 PolarHBondContact O-N 2.91Å; T361-F364 VanDerWaalsContact CA-CE1 3.47Å; T361-F364 HydrophobicContact CG2-CE2 4.27Å; T361-F364 HydrophobicContact CG2-CZ 3.96Å; T361-F364 WeakPolarHBondContact O-CD2 3.47Å; T361-L365 HydrophobicContact CG2-CD1 3.79Å; T361-L365 HydrophobicContact CG2-CG 4.4Å; T361-L365 WeakPolarHBondContact O-CB 3.38Å; T361-L365 VanDerWaalsContact O-CG 3.27Å; T361-L365 WeakPolarHBondContact O-CG 3.32Å; T361-L365 PolarHBondContact O-N 2.92Å; T361-I399 HydrophobicContact CG2-CG1 4.09Å; T361-I399 HydrophobicContact CG2-CG2 4.5Å
362	A	93.6	Very high	90.6	Very high	9 Å²	9	13.8 Å²	13.8	7%	0.074	9%	0.089	C	C	.	.	H	α-helix	trans	-67.5	-31.7	176.4	0	0	0	0	0	112.6	G359 K360 F364 L365 W366	G359-A362 PolarHBondContact O-N 3.08Å; K360-A362 PolarHBondContact O-N 3.37Å; A362-F364 VanDerWaalsContact C-N 3.28Å; A362-F364 PolarHBondContact O-N 3.32Å; A362-L365 PolarHBondContact O-N 3.02Å; A362-W366 HydrophobicContact CB-CD2 4.28Å; A362-W366 HydrophobicContact CB-CH2 4.04Å; A362-W366 HydrophobicContact CB-CZ2 3.62Å; A362-W366 PolarHBondContact O-N 2.84Å; A362-W366 VanDerWaalsContact O-N 3.12Å
363	A	95.4	Very high	90.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-33.2	-179.7	0	0	0	0	0	113.3	Q337 A340 V341 I344 G359 K360 T361 P367	Q337-A363 HydrophobicContact CG-CB 3.78Å; A340-A363 HydrophobicContact CB-CB 4.4Å; V341-A363 HydrophobicContact CG2-CB 4.27Å; I344-A363 WeakPolarHBondContact CD1-O 3.45Å; G359-A363 PolarHBondContact O-N 2.96Å; K360-A363 VanDerWaalsContact O-CB 3.27Å; K360-A363 WeakPolarHBondContact O-CB 3.48Å; K360-A363 PolarHBondContact O-N 2.96Å; T361-A363 VanDerWaalsContact C-N 3.31Å; T361-A363 PolarHBondContact O-N 2.91Å; A363-P367 WeakPolarHBondContact O-CD 3.3Å; A363-P367 WeakPolarHBondContact O-CG 3.39Å
364	F	96.7	Very high	90.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-96.5	-26	173.9	61	-109.9	0	0	0	113.7	K360 T361 A362 L368 I388 I399 Y460 V462 D464 L492 F494	K360-F364 WeakPolarHBondContact O-CD1 3.47Å; K360-F364 WeakPolarHBondContact O-CE1 3.43Å; K360-F364 PolarHBondContact O-N 3Å; T361-F364 VanDerWaalsContact CA-CE1 3.47Å; T361-F364 HydrophobicContact CG2-CE2 4.27Å; T361-F364 HydrophobicContact CG2-CZ 3.96Å; T361-F364 WeakPolarHBondContact O-CD2 3.47Å; A362-F364 VanDerWaalsContact C-N 3.28Å; A362-F364 PolarHBondContact O-N 3.32Å; F364-L368 VanDerWaalsContact O-CB 3.24Å; F364-L368 WeakPolarHBondContact O-CB 3.28Å; F364-L368 PolarHBondContact O-N 2.85Å; F364-I388 HydrophobicContact CD2-CD1 4.23Å; F364-I388 HydrophobicContact CE2-CD1 3.91Å; F364-I388 HydrophobicContact CE2-CG1 4.36Å; F364-I388 HydrophobicContact CE2-CG2 4.13Å; F364-I388 HydrophobicContact CZ-CG2 4.35Å; F364-I399 HydrophobicContact CE2-CG2 4.27Å; F364-I399 HydrophobicContact CZ-CD1 4.39Å; F364-Y460 WeakPolarHBondContact CA-OH 3.49Å; F364-Y460 PolarHBondContact O-OH 3.19Å; F364-V462 HydrophobicContact CB-CG2 4.32Å; F364-V462 HydrophobicContact CD1-CG1 4.01Å; F364-V462 HydrophobicContact CD2-CG1 4.25Å; F364-V462 HydrophobicContact CD2-CG2 4.37Å; F364-V462 HydrophobicContact CE1-CG1 4.17Å; F364-V462 HydrophobicContact CE2-CG1 4.45Å; F364-V462 HydrophobicContact CG-CG1 4.03Å; F364-V462 HydrophobicContact CG-CG2 4.41Å; F364-V462 HydrophobicContact CZ-CG1 4.39Å; F364-D464 HydrophobicContact CE1-CB 4.34Å; F364-D464 HydrophobicContact CZ-CB 4.43Å; F364-L492 HydrophobicContact CB-CD1 3.95Å; F364-F494 HydrophobicContact CB-CE2 3.82Å; F364-F494 HydrophobicContact CB-CZ 4.39Å; F364-F494 AromaticContact CD1-CD2 3.61Å; F364-F494 HydrophobicContact CD1-CD2 3.61Å; F364-F494 AromaticContact CD1-CE2 3.61Å; F364-F494 HydrophobicContact CD1-CE2 3.61Å; F364-F494 HydrophobicContact CD1-CG 4.3Å; F364-F494 HydrophobicContact CD1-CZ 4.29Å; F364-F494 HydrophobicContact CE1-CD2 4.23Å; F364-F494 HydrophobicContact CG-CD2 4.49Å; F364-F494 HydrophobicContact CG-CE2 4.17Å
365	L	96.9	Very high	90.9	Very high	4 Å²	4	23.8 Å²	23.8	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-70.6	-41.5	179.1	-75.1	178.6	0	0	0	113.2	T361 A362 L368 I369 I388 E402 A403 L406	T361-L365 HydrophobicContact CG2-CD1 3.79Å; T361-L365 HydrophobicContact CG2-CG 4.4Å; T361-L365 WeakPolarHBondContact O-CB 3.38Å; T361-L365 VanDerWaalsContact O-CG 3.27Å; T361-L365 WeakPolarHBondContact O-CG 3.32Å; T361-L365 PolarHBondContact O-N 2.92Å; A362-L365 PolarHBondContact O-N 3.02Å; L365-L368 HydrophobicContact CD2-CD2 4.31Å; L365-L368 WeakPolarHBondContact O-CB 3.41Å; L365-L368 PolarHBondContact O-N 3.33Å; L365-I369 WeakPolarHBondContact O-CG1 3.23Å; L365-I369 PolarHBondContact O-N 2.85Å; L365-I388 HydrophobicContact CD2-CD1 3.67Å; L365-E402 HydrophobicContact CD1-CB 3.92Å; L365-A403 HydrophobicContact CD1-CB 4.35Å; L365-A403 HydrophobicContact CD2-CB 3.82Å; L365-L406 HydrophobicContact CB-CD1 3.88Å; L365-L406 HydrophobicContact CD1-CD1 4.31Å
366	W	95.1	Very high	91.8	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.015	15%	0.151	C	C	.	.	H	α-helix	trans	-63.6	-48.3	-178.3	-54.9	-34.6	0	0	0	112.7	F312 L321 I325 Y330 Q337 V341 A362 L368 I369 I370	F312-W366 HydrophobicContact CD1-CH2 4.22Å; F312-W366 HydrophobicContact CD1-CZ3 4.1Å; F312-W366 AromaticContact CE1-CH2 3.36Å; F312-W366 HydrophobicContact CE1-CH2 3.36Å; F312-W366 HydrophobicContact CE1-CZ2 4.42Å; F312-W366 AromaticContact CE1-CZ3 3.51Å; F312-W366 HydrophobicContact CE1-CZ3 3.51Å; F312-W366 AromaticContact CZ-CH2 3.88Å; F312-W366 HydrophobicContact CZ-CH2 3.88Å; F312-W366 HydrophobicContact CZ-CZ3 4.45Å; L321-W366 HydrophobicContact CD1-CG 4.5Å; L321-W366 HydrophobicContact CD2-CB 4.23Å; I325-W366 HydrophobicContact CD1-CD2 3.93Å; I325-W366 HydrophobicContact CD1-CE3 4.38Å; I325-W366 HydrophobicContact CD1-CG 4.3Å; I325-W366 HydrophobicContact CD1-CH2 4.48Å; I325-W366 HydrophobicContact CD1-CZ2 4.02Å; I325-W366 HydrophobicContact CG1-CD2 4.36Å; I325-W366 HydrophobicContact CG1-CZ2 3.79Å; I325-W366 HydrophobicContact CG2-CZ2 4.29Å; Y330-W366 HydrophobicContact CD2-CZ2 4.05Å; Y330-W366 HydrophobicContact CE2-CZ2 4.14Å; Q337-W366 HydrophobicContact CB-CZ3 4.46Å; Q337-W366 HydrophobicContact CG-CZ3 4.22Å; V341-W366 HydrophobicContact CG2-CE3 4.13Å; V341-W366 HydrophobicContact CG2-CZ3 4.44Å; A362-W366 HydrophobicContact CB-CD2 4.28Å; A362-W366 HydrophobicContact CB-CH2 4.04Å; A362-W366 HydrophobicContact CB-CZ2 3.62Å; A362-W366 PolarHBondContact O-N 2.84Å; A362-W366 VanDerWaalsContact O-N 3.12Å; W366-L368 VanDerWaalsContact C-N 3.28Å; W366-L368 PolarHBondContact O-N 3.21Å; W366-I369 PolarHBondContact O-N 3.36Å; W366-I370 PolarHBondContact O-N 2.96Å
367	P	96.1	Very high	92.8	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.019	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-31.7	174.4	-24.3	37.5	0	0	0	113.5	V341 I344 L345 A363 I369 I370 H371	V341-P367 HydrophobicContact CG1-CG 3.89Å; I344-P367 HydrophobicContact CB-CB 4.03Å; I344-P367 HydrophobicContact CB-CG 3.92Å; I344-P367 HydrophobicContact CG2-CB 3.3Å; I344-P367 HydrophobicContact CG2-CG 3.66Å; L345-P367 HydrophobicContact CD2-CB 3.84Å; L345-P367 HydrophobicContact CD2-CG 4.29Å; L345-P367 HydrophobicContact CG-CB 4.15Å; L345-P367 HydrophobicContact CG-CG 4.2Å; A363-P367 WeakPolarHBondContact O-CD 3.3Å; A363-P367 WeakPolarHBondContact O-CG 3.39Å; P367-I369 VanDerWaalsContact C-N 3.31Å; P367-I369 PolarHBondContact O-N 3.44Å; P367-I370 PolarHBondContact O-N 3.07Å; P367-H371 VanDerWaalsContact O-CB 3.28Å; P367-H371 WeakPolarHBondContact O-CB 3.38Å; P367-H371 PolarHBondContact O-N 3.23Å
368	L	96.9	Very high	93.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-40.8	177.6	172.4	60.4	0	0	0	111.7	F364 L365 W366 H371 I372 I388 I436 Y460	F364-L368 VanDerWaalsContact O-CB 3.24Å; F364-L368 WeakPolarHBondContact O-CB 3.28Å; F364-L368 PolarHBondContact O-N 2.85Å; L365-L368 HydrophobicContact CD2-CD2 4.31Å; L365-L368 WeakPolarHBondContact O-CB 3.41Å; L365-L368 PolarHBondContact O-N 3.33Å; W366-L368 VanDerWaalsContact C-N 3.28Å; W366-L368 PolarHBondContact O-N 3.21Å; L368-H371 PolarHBondContact O-N 3.49Å; L368-I372 HydrophobicContact CD1-CD1 3.65Å; L368-I372 HydrophobicContact CD1-CG1 3.99Å; L368-I372 HydrophobicContact CG-CD1 3.89Å; L368-I372 WeakPolarHBondContact O-CG1 3.16Å; L368-I372 PolarHBondContact O-N 3.36Å; L368-I388 HydrophobicContact CD2-CD1 3.86Å; L368-I388 HydrophobicContact CD2-CG1 4.43Å; L368-I436 HydrophobicContact CD2-CD1 4Å; L368-I436 HydrophobicContact CD2-CG1 4.08Å; L368-I436 HydrophobicContact CD2-CG2 4.05Å; L368-I436 HydrophobicContact CG-CD1 4.3Å; L368-I436 HydrophobicContact CG-CG1 4.44Å; L368-Y460 HydrophobicContact CB-CD1 4.29Å; L368-Y460 HydrophobicContact CB-CE1 3.88Å; L368-Y460 HydrophobicContact CD1-CD1 3.58Å; L368-Y460 HydrophobicContact CD1-CD2 4.43Å; L368-Y460 HydrophobicContact CD1-CE1 4.06Å; L368-Y460 HydrophobicContact CD1-CG 3.75Å; L368-Y460 HydrophobicContact CG-CD1 4.35Å; L368-Y460 HydrophobicContact CG-CE1 4.38Å
369	I	95.7	Very high	94.3	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-49.4	176.4	-62.8	-64.4	0	0	0	110.3	L365 W366 P367 H371 I372 M373 L406 A407 Y410 L412 I436	L365-I369 WeakPolarHBondContact O-CG1 3.23Å; L365-I369 PolarHBondContact O-N 2.85Å; W366-I369 PolarHBondContact O-N 3.36Å; P367-I369 VanDerWaalsContact C-N 3.31Å; P367-I369 PolarHBondContact O-N 3.44Å; I369-H371 VanDerWaalsContact C-N 3.31Å; I369-H371 PolarHBondContact O-N 2.98Å; I369-I372 PolarHBondContact O-N 3.16Å; I369-M373 HydrophobicContact CG2-CG 4.38Å; I369-M373 VanDerWaalsContact O-CG 3.27Å; I369-M373 WeakPolarHBondContact O-CG 3.37Å; I369-M373 PolarHBondContact O-N 3.17Å; I369-L406 HydrophobicContact CD1-CB 4.32Å; I369-L406 HydrophobicContact CG1-CB 4.28Å; I369-A407 HydrophobicContact CD1-CB 4.44Å; I369-Y410 HydrophobicContact CG2-CD1 4.42Å; I369-Y410 HydrophobicContact CG2-CD2 3.5Å; I369-Y410 VanDerWaalsContact CG2-CD2 3.5Å; I369-Y410 HydrophobicContact CG2-CE1 4.44Å; I369-Y410 HydrophobicContact CG2-CE2 3.55Å; I369-Y410 HydrophobicContact CG2-CG 3.97Å; I369-L412 HydrophobicContact CD1-CD1 3.92Å; I369-I436 HydrophobicContact CD1-CD1 3.99Å
370	I	95.1	Very high	94.4	Very high	36 Å²	36	45.6 Å²	45.6	19%	0.185	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-44	178	-68.1	167.7	0	0	0	110.9	F274 L317 L321 L345 W366 P367 I372 M373 D374	F274-I370 HydrophobicContact CB-CG2 4.1Å; F274-I370 HydrophobicContact CD2-CG2 4.3Å; F274-I370 HydrophobicContact CG-CG2 4.11Å; L317-I370 HydrophobicContact CD2-CD1 3.35Å; L321-I370 HydrophobicContact CD2-CD1 4.1Å; L321-I370 HydrophobicContact CD2-CG1 4.29Å; L345-I370 HydrophobicContact CD2-CB 4.18Å; L345-I370 HydrophobicContact CD2-CD1 3.68Å; L345-I370 HydrophobicContact CD2-CG2 4.15Å; W366-I370 PolarHBondContact O-N 2.96Å; P367-I370 PolarHBondContact O-N 3.07Å; I370-I372 VanDerWaalsContact C-N 3.33Å; I370-I372 PolarHBondContact O-N 3.09Å; I370-M373 PolarHBondContact O-N 3.19Å; I370-D374 PolarHBondContact O-N 2.92Å
371	H	96.1	Very high	94.3	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.009	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-47.1	178.1	-177.6	85.9	0	0	0	111.5	F270 F274 P367 L368 I369 Q375 T459 Y460	F270-H371 AromaticContact CD2-CE1 3.81Å; F270-H371 AromaticContact CE2-CE1 3.76Å; F274-H371 HydrophobicContact CE2-CB 4.09Å; F274-H371 AromaticContact CE2-ND1 3.48Å; F274-H371 WeakPolarHBondContact CE2-ND1 3.29Å; F274-H371 AromaticContact CZ-ND1 3.78Å; P367-H371 VanDerWaalsContact O-CB 3.28Å; P367-H371 WeakPolarHBondContact O-CB 3.38Å; P367-H371 PolarHBondContact O-N 3.23Å; L368-H371 PolarHBondContact O-N 3.49Å; I369-H371 VanDerWaalsContact C-N 3.31Å; I369-H371 PolarHBondContact O-N 2.98Å; H371-Q375 VanDerWaalsContact O-CG 3.27Å; H371-Q375 WeakPolarHBondContact O-CG 3.29Å; H371-Q375 PolarHBondContact O-NE2 3.12Å; H371-T459 PolarHBondContact NE2-OG1 3.4Å; H371-Y460 HydrophobicContact CB-CD2 4.27Å
372	I	96	Very high	94.3	Very high	7 Å²	7	47.9 Å²	47.9	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-43.3	179.3	-71.1	166.2	0	0	0	111.4	L368 I369 I370 D374 Q375 I385 L412 E435 I436	L368-I372 HydrophobicContact CD1-CD1 3.65Å; L368-I372 HydrophobicContact CD1-CG1 3.99Å; L368-I372 HydrophobicContact CG-CD1 3.89Å; L368-I372 WeakPolarHBondContact O-CG1 3.16Å; L368-I372 PolarHBondContact O-N 3.36Å; I369-I372 PolarHBondContact O-N 3.16Å; I370-I372 VanDerWaalsContact C-N 3.33Å; I370-I372 PolarHBondContact O-N 3.09Å; I372-D374 PolarHBondContact O-N 3.09Å; I372-Q375 WeakPolarHBondContact O-CB 3.19Å; I372-Q375 PolarHBondContact O-N 3.45Å; I372-I385 HydrophobicContact CG1-CB 4.1Å; I372-I385 HydrophobicContact CG1-CG2 3.82Å; I372-I385 HydrophobicContact CG2-CD1 4.22Å; I372-L412 HydrophobicContact CB-CD1 4.35Å; I372-L412 HydrophobicContact CG2-CD1 3.89Å; I372-L412 HydrophobicContact CG2-CD2 3.77Å; I372-L412 HydrophobicContact CG2-CG 4.47Å; I372-E435 HydrophobicContact CD1-CB 4.15Å; I372-E435 HydrophobicContact CG2-CB 3.98Å; I372-E435 HydrophobicContact CG2-CG 4.05Å; I372-I436 HydrophobicContact CD1-CD1 3.78Å; I372-I436 HydrophobicContact CD1-CG1 3.3Å
373	M	93.9	Very high	94.3	Very high	100 Å²	100	47.5 Å²	47.5	49%	0.493	25%	0.254	S	S	.	.	H	α-helix	trans	-63.9	-23.3	-177.3	-70.8	-57.9	-60.9	0	0	113.5	I369 I370 Y410 L412	I369-M373 HydrophobicContact CG2-CG 4.38Å; I369-M373 VanDerWaalsContact O-CG 3.27Å; I369-M373 WeakPolarHBondContact O-CG 3.37Å; I369-M373 PolarHBondContact O-N 3.17Å; I370-M373 PolarHBondContact O-N 3.19Å; M373-Y410 HydrophobicContact CE-CD1 3.89Å; M373-Y410 HydrophobicContact CG-CD1 3.87Å; M373-Y410 HydrophobicContact CG-CE1 4.38Å; M373-Y410 HydrophobicContact CG-CG 4.4Å; M373-Y410 HydrophobicContact SD-CD1 3.69Å; M373-Y410 HydrophobicContact SD-CG 4.08Å; M373-L412 HydrophobicContact SD-CD1 4.37Å; M373-L412 HydrophobicContact SD-CD2 4.16Å; M373-L412 HydrophobicContact SD-CG 4.49Å
374	D	93.5	Very high	94.4	Very high	96 Å²	96	47.5 Å²	47.5	51%	0.513	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-0.4	174.5	-153.1	66.1	0	0	0	113.3	A271 F274 I370 I372	A271-D374 WeakPolarHBondContact CB-OD2 3.33Å; F274-D374 HydrophobicContact CD1-CB 4.12Å; F274-D374 HydrophobicContact CE1-CB 3.47Å; F274-D374 VanDerWaalsContact CE1-CB 3.47Å; F274-D374 VanDerWaalsContact CE1-OD2 3.29Å; F274-D374 WeakPolarHBondContact CE1-OD2 3.41Å; F274-D374 HydrophobicContact CZ-CB 4.14Å; I370-D374 PolarHBondContact O-N 2.92Å; I372-D374 PolarHBondContact O-N 3.09Å
375	Q	93.1	Very high	94.4	Very high	21 Å²	21	47.6 Å²	47.6	10%	0.098	26%	0.255	C	S	.	.	S	Bend	trans	-92.8	155.7	173.1	-56	-38.1	-50.6	0	0	111.9	F270 A271 H371 I372 E377 I385	F270-Q375 VanDerWaalsContact CB-OE1 3.3Å; A271-Q375 PolarHBondContact O-NE2 3.33Å; H371-Q375 VanDerWaalsContact O-CG 3.27Å; H371-Q375 WeakPolarHBondContact O-CG 3.29Å; H371-Q375 PolarHBondContact O-NE2 3.12Å; I372-Q375 WeakPolarHBondContact O-CB 3.19Å; I372-Q375 PolarHBondContact O-N 3.45Å; Q375-E377 PolarHBondContact O-N 3.46Å; Q375-I385 HydrophobicContact CB-CD1 4.07Å; Q375-I385 HydrophobicContact CG-CG2 3.96Å
376	P	93.4	Very high	94.5	Very high	84 Å²	84	47.4 Å²	47.4	55%	0.545	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-56.8	141.3	169.9	-23.5	33.4	0	0	0	111.6	R457	P376-R457 PolarHBondContact O-NH1 3.45Å; P376-R457 PolarHBondContact O-NH2 3.03Å
377	E	93.2	Very high	94.6	Very high	177 Å²	177	47.3 Å²	47.3	83%	0.827	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-52.3	152.8	174.1	-65.3	179.3	173.5	0	0	111.7	Q375 R457	Q375-E377 PolarHBondContact O-N 3.46Å; E377-R457 PolarHBondContact O-NH1 3.46Å
378	L	92.9	Very high	94.7	Very high	36 Å²	36	47.1 Å²	47.1	19%	0.188	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-68.6	137.2	178.6	-65.7	-177.7	0	0	0	110.9	D382 I385 C434 E435	L378-D382 HydrophobicContact CB-CB 4.45Å; L378-D382 HydrophobicContact CD2-CB 3.95Å; L378-I385 HydrophobicContact CD2-CD1 3.89Å; L378-I385 HydrophobicContact CD2-CG1 3.96Å; L378-C434 VanDerWaalsContact CD1-C 3.41Å; L378-C434 WeakPolarHBondContact CD1-O 3.49Å; L378-E435 HydrophobicContact CD1-CB 4.38Å; L378-E435 HydrophobicContact CD1-CG 3.64Å; L378-E435 HydrophobicContact CG-CG 3.95Å
379	K	92.2	Very high	94.7	Very high	158 Å²	158	47.1 Å²	47.1	69%	0.687	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-98.4	160.9	168.8	-62.6	176.7	-176.1	175.5	0	109.8	G381 D382	K379-G381 PolarHBondContact O-N 2.66Å; K379-D382 PolarHBondContact N-OD2 2.67Å; K379-D382 VanDerWaalsContact O-CB 3.23Å; K379-D382 WeakPolarHBondContact O-CB 3.28Å; K379-D382 PolarHBondContact O-N 2.71Å
380	L	89.6	Confident	94.7	Very high	170 Å²	170	47 Å²	47	89%	0.89	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	126.7	173.8	-172.5	67.3	0	0	0	110.4
381	G	90.3	Very high	94.4	Very high	55 Å²	55	45.5 Å²	45.5	57%	0.567	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.8	-3.7	-176.4	0	0	0	0	0	115.4	K379 N454	K379-G381 PolarHBondContact O-N 2.66Å; G381-N454 PolarHBondContact O-ND2 3.17Å
382	D	93.6	Very high	94	Very high	41 Å²	41	46.3 Å²	46.3	22%	0.219	25%	0.249	C	C	.	.			trans	-68.6	142.5	170.1	-79.6	-14.5	0	0	0	111	L378 K379 R457	L378-D382 HydrophobicContact CB-CB 4.45Å; L378-D382 HydrophobicContact CD2-CB 3.95Å; K379-D382 PolarHBondContact N-OD2 2.67Å; K379-D382 VanDerWaalsContact O-CB 3.23Å; K379-D382 WeakPolarHBondContact O-CB 3.28Å; K379-D382 PolarHBondContact O-N 2.71Å; D382-R457 HydrophobicContact CB-CG 4.4Å; D382-R457 WeakPolarHBondContact OD2-CD 3.46Å; D382-R457 IonicContact OD2-CZ 2.7Å; D382-R457 IonicContact OD2-NE 3.96Å; D382-R457 IonicContact OD2-NH1 3.67Å; D382-R457 PolarHBondContact OD2-NH1 3.21Å
383	G	94.3	Very high	93.6	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.01	25%	0.254	C	S	.	.			trans	-83.8	-180	168.7	0	0	0	0	0	113	N454	G383-N454 WeakPolarHBondContact CA-O 3.34Å
384	P	97.2	Very high	93.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.			trans	-63.3	155.1	179.2	26.5	-34.9	0	0	0	113.9	V387 C434 L437 T453 R457 V458	P384-V387 HydrophobicContact CB-CG2 4.28Å; P384-V387 HydrophobicContact CG-CG2 3.79Å; P384-C434 WeakPolarHBondContact CA-O 3.33Å; P384-C434 WeakPolarHBondContact CB-O 3.49Å; P384-L437 HydrophobicContact CB-CB 4.01Å; P384-L437 HydrophobicContact CG-CB 4.01Å; P384-L437 HydrophobicContact CG-CD2 4.15Å; P384-T453 WeakPolarHBondContact CD-OG1 3.46Å; P384-R457 CarbonylContact O-C 3.26Å; P384-V458 HydrophobicContact CG-CG2 4.04Å; P384-V458 WeakPolarHBondContact O-CA 3.41Å; P384-V458 WeakPolarHBondContact O-CG2 3.46Å; P384-V458 PolarHBondContact O-N 2.99Å; P384-V458 VanDerWaalsContact O-N 3.12Å
385	I	97.5	Very high	92.9	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	22%	0.216	C	C	.	.	S	Bend	trans	-91.2	-39.9	173.4	-64.2	165.9	0	0	0	109.8	I372 Q375 L378 E435 V458 T459 Y460	I372-I385 HydrophobicContact CG1-CB 4.1Å; I372-I385 HydrophobicContact CG1-CG2 3.82Å; I372-I385 HydrophobicContact CG2-CD1 4.22Å; Q375-I385 HydrophobicContact CB-CD1 4.07Å; Q375-I385 HydrophobicContact CG-CG2 3.96Å; L378-I385 HydrophobicContact CD2-CD1 3.89Å; L378-I385 HydrophobicContact CD2-CG1 3.96Å; I385-E435 HydrophobicContact CD1-CG 4.48Å; I385-E435 PolarHBondContact N-O 2.89Å; I385-V458 WeakPolarHBondContact O-CA 3.43Å; I385-T459 WeakPolarHBondContact CG2-OG1 3.46Å; I385-T459 PolarHBondContact O-N 3Å; I385-Y460 PolarHBondContact O-N 3.46Å
386	G	97.8	Very high	92.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.2	176.9	0	0	0	0	0	112.8	E435 I436 L437 Y460	G386-E435 PolarHBondContact N-O 2.97Å; G386-I436 WeakPolarHBondContact O-CA 3.47Å; G386-L437 PolarHBondContact O-N 2.94Å; G386-Y460 WeakPolarHBondContact CA-O 3.48Å
387	V	98.2	Very high	92.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.5	173.1	175.6	0	0	0	0	109.8	P384 L437 L444 L455 V458 Y460 L461 V462	P384-V387 HydrophobicContact CB-CG2 4.28Å; P384-V387 HydrophobicContact CG-CG2 3.79Å; V387-L437 WeakPolarHBondContact CA-O 3.31Å; V387-L437 HydrophobicContact CG2-CB 4.4Å; V387-L444 HydrophobicContact CG1-CD2 3.95Å; V387-L455 HydrophobicContact CG2-CD2 4.36Å; V387-V458 HydrophobicContact CB-CG1 4.18Å; V387-V458 HydrophobicContact CG2-CB 4.41Å; V387-V458 HydrophobicContact CG2-CG1 3.88Å; V387-V458 HydrophobicContact CG2-CG2 3.57Å; V387-Y460 PolarHBondContact N-O 3.15Å; V387-L461 HydrophobicContact CB-CD1 3.89Å; V387-L461 HydrophobicContact CG1-CD1 3.92Å; V387-L461 WeakPolarHBondContact O-CA 3.39Å; V387-V462 PolarHBondContact O-N 3.31Å
388	I	98.3	Very high	92.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	114.7	175.4	-57.1	159.7	0	0	0	108.8	F364 L365 L368 I399 I436 L437 V438 C439 V462	F364-I388 HydrophobicContact CD2-CD1 4.23Å; F364-I388 HydrophobicContact CE2-CD1 3.91Å; F364-I388 HydrophobicContact CE2-CG1 4.36Å; F364-I388 HydrophobicContact CE2-CG2 4.13Å; F364-I388 HydrophobicContact CZ-CG2 4.35Å; L365-I388 HydrophobicContact CD2-CD1 3.67Å; L368-I388 HydrophobicContact CD2-CD1 3.86Å; L368-I388 HydrophobicContact CD2-CG1 4.43Å; I388-I399 HydrophobicContact CD1-CG2 4.02Å; I388-I399 HydrophobicContact CG2-CD1 4.14Å; I388-I399 HydrophobicContact CG2-CG2 4.06Å; I388-I436 HydrophobicContact CD1-CG2 4.31Å; I388-L437 PolarHBondContact N-O 3.28Å; I388-V438 HydrophobicContact CB-CG2 4.46Å; I388-V438 HydrophobicContact CD1-CG2 4.24Å; I388-V438 CarbonylContact O-C 3.19Å; I388-V438 WeakPolarHBondContact O-CA 3.41Å; I388-C439 PolarHBondContact O-N 2.76Å; I388-V462 HydrophobicContact CB-CB 4.33Å; I388-V462 HydrophobicContact CG1-CB 4.02Å; I388-V462 HydrophobicContact CG1-CG2 4.09Å; I388-V462 HydrophobicContact CG2-CB 4.13Å; I388-V462 HydrophobicContact CG2-CG1 4.27Å
389	C	97.3	Very high	92.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.2	176	-67.8	0	0	0	0	110.3	C439 V462 F463 D464 M469	C389-C439 CarbonylContact C-O 3.54Å; C389-C439 WeakPolarHBondContact CA-O 3.15Å; C389-V462 PolarHBondContact N-O 3Å; C389-F463 HydrophobicContact CB-CD1 3.65Å; C389-F463 HydrophobicContact CB-CE1 3.94Å; C389-D464 PolarHBondContact O-N 3.4Å; C389-M469 HydrophobicContact CB-CE 4.1Å; C389-M469 WeakPolarHBondContact O-CE 3.14Å
390	A	94.5	Very high	92.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.			trans	-127.7	147.8	173.5	0	0	0	0	0	110.8	T392 L395 A396 I399 C439 T440 P441	A390-T392 VanDerWaalsContact C-N 3.3Å; A390-T392 PolarHBondContact O-N 3.09Å; A390-L395 HydrophobicContact CB-CB 4.28Å; A390-L395 HydrophobicContact CB-CD2 4.04Å; A390-L395 HydrophobicContact CB-CG 3.96Å; A390-A396 HydrophobicContact CB-CB 4.27Å; A390-I399 HydrophobicContact CB-CD1 4.12Å; A390-C439 PolarHBondContact N-O 3.09Å; A390-T440 WeakPolarHBondContact O-CA 3.23Å; A390-P441 WeakPolarHBondContact O-CD 3.31Å
391	P	89.9	Confident	93	Very high	5 Å²	5	19.1 Å²	19.1	3%	0.032	11%	0.111	C	C	.	.	S	Bend	trans	-67.6	-22	-176.8	23.9	-36.9	0	0	0	115.2	L395 D464 E465 K468 M469 L472 F474	P391-L395 HydrophobicContact CG-CD2 4.18Å; P391-D464 WeakPolarHBondContact CD-O 3.28Å; P391-E465 HydrophobicContact CG-CB 3.7Å; P391-K468 HydrophobicContact CB-CB 4.41Å; P391-K468 HydrophobicContact CB-CD 4.39Å; P391-K468 HydrophobicContact CB-CG 4.07Å; P391-K468 HydrophobicContact CG-CB 4.21Å; P391-K468 HydrophobicContact CG-CD 3.98Å; P391-K468 HydrophobicContact CG-CG 4.09Å; P391-M469 HydrophobicContact CB-CG 3.79Å; P391-M469 HydrophobicContact CG-CG 4.34Å; P391-L472 HydrophobicContact CB-CD1 3.91Å; P391-F474 WeakPolarHBondContact O-CE2 3.28Å
392	T	86.7	Confident	93.2	Very high	18 Å²	18	19.5 Å²	19.5	11%	0.11	10%	0.098	C	C	.	.	S	Bend	trans	-137.3	147.1	-170.6	50.4	0	0	0	0	111	A390 E394 L395 A396 L472 R617	A390-T392 VanDerWaalsContact C-N 3.3Å; A390-T392 PolarHBondContact O-N 3.09Å; T392-E394 VanDerWaalsContact C-N 3.26Å; T392-E394 PolarHBondContact O-N 3.19Å; T392-L395 PolarHBondContact O-N 3.49Å; T392-L395 WeakPolarHBondContact OG1-CB 3.23Å; T392-A396 PolarHBondContact O-N 2.83Å; T392-L472 HydrophobicContact CG2-CD1 4.42Å; T392-R617 HydrophobicContact CG2-CB 4.5Å
393	R	87.4	Confident	93.3	Very high	38 Å²	38	17.6 Å²	17.6	14%	0.143	9%	0.088	C	C	.	.	H	α-helix	trans	-52.7	-43.9	176.9	168.1	175.3	-179	162.8	4.8	112.2	A396 L397 Y418 G420	R393-A396 PolarHBondContact O-N 3.14Å; R393-L397 HydrophobicContact CG-CD1 4.01Å; R393-L397 WeakPolarHBondContact O-CB 3.36Å; R393-L397 WeakPolarHBondContact O-CG 3.26Å; R393-L397 PolarHBondContact O-N 3.15Å; R393-Y418 HydrophobicContact CB-CD2 4.23Å; R393-Y418 HydrophobicContact CB-CG 4.11Å; R393-Y418 HydrophobicContact CG-CD1 4.06Å; R393-Y418 HydrophobicContact CG-CD2 3.48Å; R393-Y418 VanDerWaalsContact CG-CD2 3.48Å; R393-Y418 HydrophobicContact CG-CE1 4.35Å; R393-Y418 HydrophobicContact CG-CE2 3.87Å; R393-Y418 HydrophobicContact CG-CG 3.59Å; R393-Y418 VanDerWaalsContact NH2-CE2 3.31Å; R393-Y418 PolarHBondContact NH2-OH 3.47Å; R393-G420 PolarHBondContact NH1-O 3.41Å
394	E	84.9	Confident	93.3	Very high	32 Å²	32	22.8 Å²	22.8	15%	0.15	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-43.1	-176.4	-64.9	77.8	-174.4	0	0	111.4	T392 L397 Q398 Q591 R594	T392-E394 VanDerWaalsContact C-N 3.26Å; T392-E394 PolarHBondContact O-N 3.19Å; E394-L397 PolarHBondContact O-N 2.78Å; E394-Q398 PolarHBondContact O-N 2.54Å; E394-Q591 PolarHBondContact OE1-NE2 2.9Å; E394-Q591 VanDerWaalsContact OE1-NE2 3.13Å; E394-R594 IonicContact OE1-CZ 3.12Å; E394-R594 IonicContact OE1-NH1 3.27Å; E394-R594 IonicContact OE1-NH2 3.83Å; E394-R594 PolarHBondContact OE1-NH2 2.94Å; E394-R594 VanDerWaalsContact OE1-NH2 3.14Å
395	L	87.9	Confident	93.1	Very high	10 Å²	10	28.7 Å²	28.7	5%	0.052	14%	0.136	C	C	.	.	H	α-helix	trans	-68.7	-40.4	175.7	-178.4	59.9	0	0	0	111.7	A390 P391 T392 L397 Q398 I399 E465	A390-L395 HydrophobicContact CB-CB 4.28Å; A390-L395 HydrophobicContact CB-CD2 4.04Å; A390-L395 HydrophobicContact CB-CG 3.96Å; P391-L395 HydrophobicContact CG-CD2 4.18Å; T392-L395 PolarHBondContact O-N 3.49Å; T392-L395 WeakPolarHBondContact OG1-CB 3.23Å; L395-L397 VanDerWaalsContact C-N 3.33Å; L395-L397 PolarHBondContact O-N 3.42Å; L395-Q398 WeakPolarHBondContact O-CB 3.45Å; L395-Q398 PolarHBondContact O-N 2.89Å; L395-I399 HydrophobicContact CD1-CD1 4.27Å; L395-I399 HydrophobicContact CD1-CG1 4.34Å; L395-I399 HydrophobicContact CG-CD1 4.07Å; L395-I399 WeakPolarHBondContact O-CG1 3.48Å; L395-I399 PolarHBondContact O-N 2.72Å; L395-E465 HydrophobicContact CD2-CB 4.17Å; L395-E465 HydrophobicContact CD2-CG 3.67Å; L395-E465 WeakPolarHBondContact CD2-OE2 3.27Å
396	A	91.6	Very high	92.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.7	-43.8	174.3	0	0	0	0	0	111.4	A390 T392 R393 Q398 I399 Y400 V438	A390-A396 HydrophobicContact CB-CB 4.27Å; T392-A396 PolarHBondContact O-N 2.83Å; R393-A396 PolarHBondContact O-N 3.14Å; A396-Q398 VanDerWaalsContact C-N 3.34Å; A396-Q398 PolarHBondContact O-N 3.25Å; A396-I399 PolarHBondContact O-N 3.44Å; A396-Y400 VanDerWaalsContact O-CB 3.23Å; A396-Y400 WeakPolarHBondContact O-CB 3.35Å; A396-Y400 PolarHBondContact O-N 3.1Å; A396-V438 HydrophobicContact CB-CG1 4.13Å; A396-V438 VanDerWaalsContact O-CG1 3.25Å; A396-V438 WeakPolarHBondContact O-CG1 3.4Å
397	L	90.7	Very high	92.7	Very high	51 Å²	51	29.5 Å²	29.5	27%	0.267	14%	0.14	S	C	.	.	H	α-helix	trans	-63.4	-37.5	175.3	-79.6	170.6	0	0	0	112.8	R393 E394 L395 S401 Y418	R393-L397 HydrophobicContact CG-CD1 4.01Å; R393-L397 WeakPolarHBondContact O-CB 3.36Å; R393-L397 WeakPolarHBondContact O-CG 3.26Å; R393-L397 PolarHBondContact O-N 3.15Å; E394-L397 PolarHBondContact O-N 2.78Å; L395-L397 VanDerWaalsContact C-N 3.33Å; L395-L397 PolarHBondContact O-N 3.42Å; L397-S401 WeakPolarHBondContact O-CB 3.46Å; L397-S401 PolarHBondContact O-N 3Å; L397-Y418 HydrophobicContact CD1-CE1 4.11Å; L397-Y418 HydrophobicContact CD2-CD1 4.44Å; L397-Y418 HydrophobicContact CD2-CE1 3.52Å; L397-Y418 HydrophobicContact CG-CD1 4.26Å; L397-Y418 HydrophobicContact CG-CE1 3.69Å
398	Q	89.9	Confident	92.4	Very high	46 Å²	46	37.3 Å²	37.3	22%	0.215	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-52.6	174.8	175.4	175.8	-12.1	0	0	111.1	E394 L395 A396 Y400 S401 E402 D620	E394-Q398 PolarHBondContact O-N 2.54Å; L395-Q398 WeakPolarHBondContact O-CB 3.45Å; L395-Q398 PolarHBondContact O-N 2.89Å; A396-Q398 VanDerWaalsContact C-N 3.34Å; A396-Q398 PolarHBondContact O-N 3.25Å; Q398-Y400 VanDerWaalsContact C-N 3.29Å; Q398-Y400 PolarHBondContact O-N 3.3Å; Q398-S401 PolarHBondContact O-N 3.24Å; Q398-S401 VanDerWaalsContact O-N 3.14Å; Q398-S401 PolarHBondContact O-OG 3.44Å; Q398-E402 PolarHBondContact O-N 3.29Å; Q398-E402 VanDerWaalsContact O-N 3.13Å; Q398-D620 PolarHBondContact NE2-OD2 3.38Å
399	I	95	Very high	92.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-42.6	178.1	-63.9	168.1	0	0	0	110.2	T361 F364 I388 A390 L395 A396 S401 E402 A403 V438 D464	T361-I399 HydrophobicContact CG2-CG1 4.09Å; T361-I399 HydrophobicContact CG2-CG2 4.5Å; F364-I399 HydrophobicContact CE2-CG2 4.27Å; F364-I399 HydrophobicContact CZ-CD1 4.39Å; I388-I399 HydrophobicContact CD1-CG2 4.02Å; I388-I399 HydrophobicContact CG2-CD1 4.14Å; I388-I399 HydrophobicContact CG2-CG2 4.06Å; A390-I399 HydrophobicContact CB-CD1 4.12Å; L395-I399 HydrophobicContact CD1-CD1 4.27Å; L395-I399 HydrophobicContact CD1-CG1 4.34Å; L395-I399 HydrophobicContact CG-CD1 4.07Å; L395-I399 WeakPolarHBondContact O-CG1 3.48Å; L395-I399 PolarHBondContact O-N 2.72Å; A396-I399 PolarHBondContact O-N 3.44Å; I399-S401 VanDerWaalsContact C-N 3.33Å; I399-S401 PolarHBondContact O-N 3.13Å; I399-E402 PolarHBondContact O-N 3.35Å; I399-A403 VanDerWaalsContact O-CB 3.28Å; I399-A403 WeakPolarHBondContact O-CB 3Å; I399-A403 PolarHBondContact O-N 2.94Å; I399-V438 HydrophobicContact CB-CG1 3.91Å; I399-V438 HydrophobicContact CG2-CG1 3.88Å; I399-V438 HydrophobicContact CG2-CG2 4.07Å; I399-D464 HydrophobicContact CD1-CB 4.31Å
400	Y	96.2	Very high	92	Very high	52 Å²	52	42.1 Å²	42.1	20%	0.204	20%	0.2	C	C	.	.	H	α-helix	trans	-55.4	-46.2	174.4	169.5	-102	0	0	0	112.1	A396 Q398 E402 A403 K404 V414 C416	A396-Y400 VanDerWaalsContact O-CB 3.23Å; A396-Y400 WeakPolarHBondContact O-CB 3.35Å; A396-Y400 PolarHBondContact O-N 3.1Å; Q398-Y400 VanDerWaalsContact C-N 3.29Å; Q398-Y400 PolarHBondContact O-N 3.3Å; Y400-E402 VanDerWaalsContact C-N 3.34Å; Y400-E402 PolarHBondContact O-N 3.14Å; Y400-A403 PolarHBondContact O-N 3.4Å; Y400-K404 HydrophobicContact CE1-CD 4.07Å; Y400-K404 VanDerWaalsContact O-CB 3.23Å; Y400-K404 WeakPolarHBondContact O-CB 3.42Å; Y400-K404 PolarHBondContact O-N 3.49Å; Y400-K404 PolarHBondContact OH-NZ 3.07Å; Y400-K404 VanDerWaalsContact OH-NZ 3.1Å; Y400-V414 HydrophobicContact CD2-CB 4.32Å; Y400-V414 HydrophobicContact CD2-CG1 3.63Å; Y400-V414 HydrophobicContact CE2-CB 4.1Å; Y400-V414 HydrophobicContact CE2-CG1 3.9Å; Y400-V414 WeakPolarHBondContact CE2-O 3.33Å; Y400-C416 HydrophobicContact CD1-CB 4.29Å; Y400-C416 HydrophobicContact CD2-CB 3.55Å; Y400-C416 HydrophobicContact CE2-CB 4.09Å; Y400-C416 HydrophobicContact CG-CB 3.66Å
401	S	94.6	Very high	91.9	Very high	49 Å²	49	49 Å²	49	34%	0.343	24%	0.237	S	C	.	.	H	α-helix	trans	-64.7	-37.9	-179.4	73.9	0	0	0	0	112.6	L397 Q398 I399 K405	L397-S401 WeakPolarHBondContact O-CB 3.46Å; L397-S401 PolarHBondContact O-N 3Å; Q398-S401 PolarHBondContact O-N 3.24Å; Q398-S401 VanDerWaalsContact O-N 3.14Å; Q398-S401 PolarHBondContact O-OG 3.44Å; I399-S401 VanDerWaalsContact C-N 3.33Å; I399-S401 PolarHBondContact O-N 3.13Å; S401-K405 WeakPolarHBondContact O-CG 3.46Å; S401-K405 PolarHBondContact O-N 3.21Å
402	E	93.2	Very high	92.2	Very high	64 Å²	64	50 Å²	50	30%	0.299	24%	0.242	S	C	.	.	H	α-helix	trans	-72.3	-44.7	175.6	-66.9	-53.4	142.2	0	0	111.8	L365 Q398 I399 Y400 K404 K405 L406	L365-E402 HydrophobicContact CD1-CB 3.92Å; Q398-E402 PolarHBondContact O-N 3.29Å; Q398-E402 VanDerWaalsContact O-N 3.13Å; I399-E402 PolarHBondContact O-N 3.35Å; Y400-E402 VanDerWaalsContact C-N 3.34Å; Y400-E402 PolarHBondContact O-N 3.14Å; E402-K404 VanDerWaalsContact C-N 3.31Å; E402-K404 PolarHBondContact O-N 3.41Å; E402-K405 VanDerWaalsContact CD-NZ 3.33Å; E402-K405 PolarHBondContact O-N 2.65Å; E402-K405 IonicContact OE1-NZ 2.65Å; E402-K405 PolarHBondContact OE1-NZ 3.18Å; E402-K405 IonicContact OE2-NZ 3.95Å; E402-K405 PolarHBondContact OE2-NZ 2.73Å; E402-L406 PolarHBondContact O-N 3.49Å
403	A	96.1	Very high	92.7	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-58.4	-43.7	175.6	0	0	0	0	0	111.3	L365 I399 Y400 K405 L406 A407 V414	L365-A403 HydrophobicContact CD1-CB 4.35Å; L365-A403 HydrophobicContact CD2-CB 3.82Å; I399-A403 VanDerWaalsContact O-CB 3.28Å; I399-A403 WeakPolarHBondContact O-CB 3Å; I399-A403 PolarHBondContact O-N 2.94Å; Y400-A403 PolarHBondContact O-N 3.4Å; A403-K405 VanDerWaalsContact C-N 3.33Å; A403-K405 PolarHBondContact O-N 3.45Å; A403-L406 PolarHBondContact O-N 3.25Å; A403-A407 WeakPolarHBondContact O-CB 3.48Å; A403-A407 PolarHBondContact O-N 2.88Å; A403-V414 HydrophobicContact CB-CG1 4.03Å
404	K	95	Very high	93.1	Very high	110 Å²	110	51.2 Å²	51.2	48%	0.478	25%	0.253	S	S	.	.	H	α-helix	trans	-62.2	-36.2	179.1	-170.8	174.6	-169.7	166.6	0	113	Y400 E402 K408	Y400-K404 HydrophobicContact CE1-CD 4.07Å; Y400-K404 VanDerWaalsContact O-CB 3.23Å; Y400-K404 WeakPolarHBondContact O-CB 3.42Å; Y400-K404 PolarHBondContact O-N 3.49Å; Y400-K404 PolarHBondContact OH-NZ 3.07Å; Y400-K404 VanDerWaalsContact OH-NZ 3.1Å; E402-K404 VanDerWaalsContact C-N 3.31Å; E402-K404 PolarHBondContact O-N 3.41Å; K404-K408 VanDerWaalsContact O-CB 3.3Å; K404-K408 WeakPolarHBondContact O-CB 3.43Å; K404-K408 PolarHBondContact O-N 3Å; K404-K408 VanDerWaalsContact O-N 3.08Å
405	K	92.7	Very high	93.7	Very high	123 Å²	123	50.2 Å²	50.2	54%	0.535	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-43.6	176.2	-69.5	168	-166.3	170.5	0	111.4	S401 E402 A403	S401-K405 WeakPolarHBondContact O-CG 3.46Å; S401-K405 PolarHBondContact O-N 3.21Å; E402-K405 VanDerWaalsContact CD-NZ 3.33Å; E402-K405 PolarHBondContact O-N 2.65Å; E402-K405 IonicContact OE1-NZ 2.65Å; E402-K405 PolarHBondContact OE1-NZ 3.18Å; E402-K405 IonicContact OE2-NZ 3.95Å; E402-K405 PolarHBondContact OE2-NZ 2.73Å; A403-K405 VanDerWaalsContact C-N 3.33Å; A403-K405 PolarHBondContact O-N 3.45Å
406	L	92.9	Very high	94.1	Very high	19 Å²	19	50.4 Å²	50.4	10%	0.099	25%	0.252	C	S	.	.	H	α-helix	trans	-72.8	-48.6	179.1	-62.7	173.6	0	0	0	111.4	L321 A324 L365 I369 E402 A403 K408 V409	L321-L406 HydrophobicContact CD1-CD2 4.12Å; A324-L406 HydrophobicContact CB-CD2 3.92Å; L365-L406 HydrophobicContact CB-CD1 3.88Å; L365-L406 HydrophobicContact CD1-CD1 4.31Å; I369-L406 HydrophobicContact CD1-CB 4.32Å; I369-L406 HydrophobicContact CG1-CB 4.28Å; E402-L406 PolarHBondContact O-N 3.49Å; A403-L406 PolarHBondContact O-N 3.25Å; L406-K408 VanDerWaalsContact C-N 3.28Å; L406-K408 PolarHBondContact O-N 3.46Å; L406-V409 WeakPolarHBondContact O-CB 3.47Å; L406-V409 PolarHBondContact O-N 3.28Å; L406-V409 VanDerWaalsContact O-N 3.13Å
407	A	93.6	Very high	94.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-34.9	-179.4	0	0	0	0	0	113.4	I369 A403 V409 Y410 N411 L412 V414	I369-A407 HydrophobicContact CD1-CB 4.44Å; A403-A407 WeakPolarHBondContact O-CB 3.48Å; A403-A407 PolarHBondContact O-N 2.88Å; A407-V409 PolarHBondContact O-N 2.69Å; A407-Y410 CarbonylContact O-C 3.54Å; A407-Y410 PolarHBondContact O-N 2.7Å; A407-N411 PolarHBondContact O-N 3.29Å; A407-N411 VanDerWaalsContact O-N 3.12Å; A407-L412 HydrophobicContact CB-CB 3.93Å; A407-L412 PolarHBondContact O-N 2.84Å; A407-V414 HydrophobicContact CB-CG2 3.33Å
408	K	92.7	Very high	94.3	Very high	166 Å²	166	49.6 Å²	49.6	72%	0.722	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-57.6	-30.8	177.4	-175.8	177.8	179.5	-177.7	0	112.9	K404 L406 Y410	K404-K408 VanDerWaalsContact O-CB 3.3Å; K404-K408 WeakPolarHBondContact O-CB 3.43Å; K404-K408 PolarHBondContact O-N 3Å; K404-K408 VanDerWaalsContact O-N 3.08Å; L406-K408 VanDerWaalsContact C-N 3.28Å; L406-K408 PolarHBondContact O-N 3.46Å; K408-Y410 PolarHBondContact O-N 3.41Å
409	V	92.6	Very high	94	Very high	70 Å²	70	49.2 Å²	49.2	42%	0.424	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-67.7	-27.3	178.9	-177.5	0	0	0	0	111.5	P320 L406 A407	P320-V409 HydrophobicContact CB-CG1 3.43Å; P320-V409 VanDerWaalsContact CB-CG1 3.43Å; L406-V409 WeakPolarHBondContact O-CB 3.47Å; L406-V409 PolarHBondContact O-N 3.28Å; L406-V409 VanDerWaalsContact O-N 3.13Å; A407-V409 PolarHBondContact O-N 2.69Å
410	Y	93.8	Very high	93.2	Very high	31 Å²	31	52.4 Å²	52.4	12%	0.122	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-109.6	7.9	-175.5	-65	-85.8	0	0	0	113.4	D318 L321 I369 M373 A407 K408 L412	D318-Y410 PolarHBondContact OD1-OH 2.79Å; D318-Y410 VanDerWaalsContact OD2-CE1 3.25Å; D318-Y410 WeakPolarHBondContact OD2-CE1 3.36Å; D318-Y410 PolarHBondContact OD2-OH 3.2Å; L321-Y410 VanDerWaalsContact CB-OH 3.31Å; L321-Y410 WeakPolarHBondContact CB-OH 3.2Å; L321-Y410 PolarHBondContact N-OH 2.9Å; L321-Y410 VanDerWaalsContact N-OH 3.11Å; I369-Y410 HydrophobicContact CG2-CD1 4.42Å; I369-Y410 HydrophobicContact CG2-CD2 3.5Å; I369-Y410 VanDerWaalsContact CG2-CD2 3.5Å; I369-Y410 HydrophobicContact CG2-CE1 4.44Å; I369-Y410 HydrophobicContact CG2-CE2 3.55Å; I369-Y410 HydrophobicContact CG2-CG 3.97Å; M373-Y410 HydrophobicContact CE-CD1 3.89Å; M373-Y410 HydrophobicContact CG-CD1 3.87Å; M373-Y410 HydrophobicContact CG-CE1 4.38Å; M373-Y410 HydrophobicContact CG-CG 4.4Å; M373-Y410 HydrophobicContact SD-CD1 3.69Å; M373-Y410 HydrophobicContact SD-CG 4.08Å; A407-Y410 CarbonylContact O-C 3.54Å; A407-Y410 PolarHBondContact O-N 2.7Å; K408-Y410 PolarHBondContact O-N 3.41Å; Y410-L412 PolarHBondContact O-N 3.45Å
411	N	93.6	Very high	92.3	Very high	145 Å²	145	50.8 Å²	50.8	78%	0.775	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	32.6	-173.3	-60.6	-32.2	0	0	0	114.1	A407	A407-N411 PolarHBondContact O-N 3.29Å; A407-N411 VanDerWaalsContact O-N 3.12Å
412	L	95.8	Very high	91.9	Very high	25 Å²	25	51 Å²	51	13%	0.131	29%	0.287	C	S	.	.			trans	-86.4	143.7	176.9	-57.5	175.4	0	0	0	111.1	I369 I372 M373 A407 Y410 E435	I369-L412 HydrophobicContact CD1-CD1 3.92Å; I372-L412 HydrophobicContact CB-CD1 4.35Å; I372-L412 HydrophobicContact CG2-CD1 3.89Å; I372-L412 HydrophobicContact CG2-CD2 3.77Å; I372-L412 HydrophobicContact CG2-CG 4.47Å; M373-L412 HydrophobicContact SD-CD1 4.37Å; M373-L412 HydrophobicContact SD-CD2 4.16Å; M373-L412 HydrophobicContact SD-CG 4.49Å; A407-L412 HydrophobicContact CB-CB 3.93Å; A407-L412 PolarHBondContact O-N 2.84Å; Y410-L412 PolarHBondContact O-N 3.45Å; L412-E435 HydrophobicContact CD2-CG 4.05Å
413	T	95.9	Very high	91.7	Very high	67 Å²	67	48.4 Å²	48.4	41%	0.411	28%	0.276	S	S	.	.			trans	-91	124.6	178.3	-55.7	0	0	0	0	110.3	V415 C434 E435 I436	T413-V415 HydrophobicContact CG2-CG2 4.42Å; T413-C434 HydrophobicContact CG2-CB 4.28Å; T413-E435 VanDerWaalsContact CA-OE2 3.31Å; T413-E435 WeakPolarHBondContact CA-OE2 3.41Å; T413-E435 WeakPolarHBondContact CB-OE2 3.47Å; T413-E435 PolarHBondContact N-OE2 3.38Å; T413-E435 PolarHBondContact O-N 3.05Å; T413-E435 VanDerWaalsContact O-N 3.08Å; T413-I436 PolarHBondContact O-N 2.91Å
414	V	97.1	Very high	91.4	Very high	14 Å²	14	50.5 Å²	50.5	9%	0.085	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.5	176.2	-168.2	0	0	0	0	108.4	Y400 A403 A407 I436 V438	Y400-V414 HydrophobicContact CD2-CB 4.32Å; Y400-V414 HydrophobicContact CD2-CG1 3.63Å; Y400-V414 HydrophobicContact CE2-CB 4.1Å; Y400-V414 HydrophobicContact CE2-CG1 3.9Å; Y400-V414 WeakPolarHBondContact CE2-O 3.33Å; A403-V414 HydrophobicContact CB-CG1 4.03Å; A407-V414 HydrophobicContact CB-CG2 3.33Å; V414-I436 WeakPolarHBondContact CA-O 3.31Å; V414-I436 HydrophobicContact CB-CB 4.46Å; V414-I436 HydrophobicContact CG1-CB 4.06Å; V414-I436 HydrophobicContact CG1-CG2 4Å; V414-I436 HydrophobicContact CG2-CB 4.19Å; V414-I436 HydrophobicContact CG2-CD1 4.23Å; V414-V438 HydrophobicContact CG1-CG2 4.31Å
415	V	96.5	Very high	91.3	Very high	11 Å²	11	51 Å²	51	7%	0.067	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	146	175.2	175.8	0	0	0	0	109.8	T413 A429 C434 I436 L437 V438	T413-V415 HydrophobicContact CG2-CG2 4.42Å; V415-A429 HydrophobicContact CG1-CB 4.01Å; V415-A429 HydrophobicContact CG2-CB 3.99Å; V415-C434 HydrophobicContact CB-CB 4.05Å; V415-C434 HydrophobicContact CG2-CB 3.52Å; V415-I436 PolarHBondContact N-O 3.33Å; V415-L437 HydrophobicContact CB-CD1 4.08Å; V415-L437 HydrophobicContact CG1-CD1 4Å; V415-V438 PolarHBondContact O-N 3.45Å
416	C	96.3	Very high	91.3	Very high	15 Å²	15	45.8 Å²	45.8	10%	0.101	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.7	174.8	-162.4	0	0	0	0	110.8	Y400 Y418 V438	Y400-C416 HydrophobicContact CD1-CB 4.29Å; Y400-C416 HydrophobicContact CD2-CB 3.55Å; Y400-C416 HydrophobicContact CE2-CB 4.09Å; Y400-C416 HydrophobicContact CG-CB 3.66Å; C416-Y418 HydrophobicContact CB-CE1 4.38Å; C416-Y418 VanDerWaalsContact SG-CD1 3.56Å; C416-V438 CarbonylContact C-O 3.59Å; C416-V438 WeakPolarHBondContact CA-O 3.48Å
417	A	95.2	Very high	91.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	111.2	-177.3	0	0	0	0	0	112	L437 V438 C439 T440 R443 I447	A417-L437 HydrophobicContact CB-CD1 3.98Å; A417-V438 PolarHBondContact N-O 3.14Å; A417-C439 HydrophobicContact CB-CB 4.02Å; A417-C439 CarbonylContact O-C 3.55Å; A417-C439 WeakPolarHBondContact O-CA 3.49Å; A417-C439 VanDerWaalsContact O-CB 3.28Å; A417-C439 WeakPolarHBondContact O-CB 3.4Å; A417-T440 PolarHBondContact O-N 2.7Å; A417-R443 HydrophobicContact CB-CG 3.97Å; A417-I447 HydrophobicContact CB-CD1 3.57Å
418	Y	92.6	Very high	91.2	Very high	33 Å²	33	49.2 Å²	49.2	13%	0.129	28%	0.279	C	S	.	.			trans	-144.7	160.8	-179.6	54.8	-105.2	0	0	0	112.7	R393 L397 C416 Q426 T440 R443	R393-Y418 HydrophobicContact CB-CD2 4.23Å; R393-Y418 HydrophobicContact CB-CG 4.11Å; R393-Y418 HydrophobicContact CG-CD1 4.06Å; R393-Y418 HydrophobicContact CG-CD2 3.48Å; R393-Y418 VanDerWaalsContact CG-CD2 3.48Å; R393-Y418 HydrophobicContact CG-CE1 4.35Å; R393-Y418 HydrophobicContact CG-CE2 3.87Å; R393-Y418 HydrophobicContact CG-CG 3.59Å; R393-Y418 VanDerWaalsContact NH2-CE2 3.31Å; R393-Y418 PolarHBondContact NH2-OH 3.47Å; L397-Y418 HydrophobicContact CD1-CE1 4.11Å; L397-Y418 HydrophobicContact CD2-CD1 4.44Å; L397-Y418 HydrophobicContact CD2-CE1 3.52Å; L397-Y418 HydrophobicContact CG-CD1 4.26Å; L397-Y418 HydrophobicContact CG-CE1 3.69Å; C416-Y418 HydrophobicContact CB-CE1 4.38Å; C416-Y418 VanDerWaalsContact SG-CD1 3.56Å; Y418-Q426 PolarHBondContact O-NE2 3.27Å; Y418-Q426 PolarHBondContact O-OE1 2.96Å; Y418-T440 WeakPolarHBondContact CA-OG1 3.36Å; Y418-R443 PolarHBondContact O-NH1 3Å
419	G	83.5	Confident	91.3	Very high	39 Å²	39	43.1 Å²	43.1	40%	0.402	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	148.3	174.6	0	0	0	0	0	114.6	G421	G419-G421 VanDerWaalsContact C-N 3.31Å; G419-G421 PolarHBondContact O-N 3.35Å
420	G	76.5	Confident	91.3	Very high	67 Å²	67	39.9 Å²	39.9	69%	0.691	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.6	10.5	179.9	0	0	0	0	0	115.1	R393	R393-G420 PolarHBondContact NH1-O 3.41Å
421	G	77.2	Confident	91.3	Very high	18 Å²	18	42.3 Å²	42.3	19%	0.186	25%	0.253	C	S	.	.	S	Bend	trans	-113.4	162.8	162.1	0	0	0	0	0	110.7	G419 L423 R443	G419-G421 VanDerWaalsContact C-N 3.31Å; G419-G421 PolarHBondContact O-N 3.35Å; G421-L423 PolarHBondContact O-N 3.05Å; G421-L423 VanDerWaalsContact O-N 3.14Å; G421-R443 PolarHBondContact O-NH1 3.17Å; G421-R443 PolarHBondContact O-NH2 3.42Å
422	S	87.8	Confident	91.2	Very high	52 Å²	52	39.4 Å²	39.4	36%	0.364	25%	0.249	S	C	.	.			trans	-45.8	112.9	171.2	46	0	0	0	0	110.9	W424 E425 Q426	S422-W424 VanDerWaalsContact C-N 3.35Å; S422-E425 PolarHBondContact OG-OE2 3.22Å; S422-Q426 VanDerWaalsContact O-CG 3.31Å; S422-Q426 WeakPolarHBondContact O-CG 3.38Å; S422-Q426 PolarHBondContact O-N 3.28Å
423	L	89.4	Confident	90.9	Very high	11 Å²	11	39 Å²	39	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-69.8	-37.6	176.2	-176.7	68.8	0	0	0	110.7	F220 L227 G421 E425 Q426 Q427 I447 K450	F220-L423 HydrophobicContact CZ-CD2 4.38Å; L227-L423 HydrophobicContact CD1-CD2 3.59Å; L227-L423 HydrophobicContact CD2-CB 3.23Å; L227-L423 HydrophobicContact CD2-CD2 3.52Å; L227-L423 HydrophobicContact CD2-CG 3.99Å; L227-L423 HydrophobicContact CG-CD2 4.12Å; G421-L423 PolarHBondContact O-N 3.05Å; G421-L423 VanDerWaalsContact O-N 3.14Å; L423-E425 PolarHBondContact O-N 2.96Å; L423-Q426 CarbonylContact O-C 3.59Å; L423-Q426 PolarHBondContact O-N 3.45Å; L423-Q427 HydrophobicContact CD1-CG 4.36Å; L423-Q427 HydrophobicContact CG-CG 4.09Å; L423-Q427 WeakPolarHBondContact O-CB 3.39Å; L423-Q427 WeakPolarHBondContact O-CG 3.26Å; L423-Q427 PolarHBondContact O-N 3.42Å; L423-I447 HydrophobicContact CD1-CD1 4.42Å; L423-I447 HydrophobicContact CD1-CG1 3.77Å; L423-K450 HydrophobicContact CD2-CD 3.97Å
424	W	89.7	Confident	90.9	Very high	44 Å²	44	35.8 Å²	35.8	17%	0.167	23%	0.231	C	C	.	.	H	α-helix	trans	-56	-50.1	-179.9	-176.3	74.9	0	0	0	112.3	Y217 F220 S422 Q426 Q427 K428	Y217-W424 AromaticContact CD2-CD2 3.72Å; Y217-W424 HydrophobicContact CD2-CD2 3.72Å; Y217-W424 AromaticContact CD2-CE2 3.98Å; Y217-W424 AromaticContact CD2-CE3 3.91Å; Y217-W424 HydrophobicContact CD2-CE3 3.91Å; Y217-W424 HydrophobicContact CD2-CG 4.08Å; Y217-W424 HydrophobicContact CD2-CZ2 4.38Å; Y217-W424 HydrophobicContact CD2-CZ3 4.33Å; F220-W424 HydrophobicContact CB-CG 4.4Å; F220-W424 HydrophobicContact CD1-CB 3.66Å; F220-W424 AromaticContact CD1-CD1 3.45Å; F220-W424 VanDerWaalsContact CD1-CD1 3.45Å; F220-W424 AromaticContact CD1-CG 3.82Å; F220-W424 HydrophobicContact CD1-CG 3.82Å; F220-W424 AromaticContact CD2-CD1 3.62Å; F220-W424 HydrophobicContact CE1-CB 3.54Å; F220-W424 HydrophobicContact CE1-CG 4.18Å; F220-W424 HydrophobicContact CG-CB 4.25Å; F220-W424 AromaticContact CG-CD1 3.17Å; F220-W424 HydrophobicContact CG-CG 4.01Å; F220-W424 AromaticContact CG-NE1 3.97Å; F220-W424 HydrophobicContact CZ-CB 4.01Å; S422-W424 VanDerWaalsContact C-N 3.35Å; W424-Q426 VanDerWaalsContact C-N 3.3Å; W424-Q426 PolarHBondContact O-N 3.22Å; W424-Q427 WeakPolarHBondContact O-CB 3.39Å; W424-Q427 PolarHBondContact O-N 3.18Å; W424-Q427 VanDerWaalsContact O-N 3.13Å; W424-K428 HydrophobicContact CD2-CG 4.03Å; W424-K428 HydrophobicContact CE3-CG 4.4Å; W424-K428 HydrophobicContact CH2-CG 4.27Å; W424-K428 HydrophobicContact CZ2-CD 4.31Å; W424-K428 HydrophobicContact CZ2-CG 3.89Å; W424-K428 WeakPolarHBondContact O-CG 3.47Å; W424-K428 PolarHBondContact O-N 3.25Å
425	E	91.6	Very high	90.9	Very high	121 Å²	121	36.6 Å²	36.6	57%	0.565	23%	0.234	S	C	*	.	H	α-helix	trans	-61.9	-40.4	178.7	-64.1	178.8	164.3	0	0	111.2	S422 L423 Q427 A429	S422-E425 PolarHBondContact OG-OE2 3.22Å; L423-E425 PolarHBondContact O-N 2.96Å; E425-Q427 VanDerWaalsContact C-N 3.35Å; E425-A429 VanDerWaalsContact O-CB 3.23Å; E425-A429 WeakPolarHBondContact O-CB 2.99Å; E425-A429 PolarHBondContact O-N 3.49Å
426	Q	92.8	Very high	91	Very high	13 Å²	13	36.1 Å²	36.1	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-36.1	176.7	-66.3	174.4	22.2	0	0	111.8	Y418 S422 L423 W424 C430 R443 I447	Y418-Q426 PolarHBondContact O-NE2 3.27Å; Y418-Q426 PolarHBondContact O-OE1 2.96Å; S422-Q426 VanDerWaalsContact O-CG 3.31Å; S422-Q426 WeakPolarHBondContact O-CG 3.38Å; S422-Q426 PolarHBondContact O-N 3.28Å; L423-Q426 CarbonylContact O-C 3.59Å; L423-Q426 PolarHBondContact O-N 3.45Å; W424-Q426 VanDerWaalsContact C-N 3.3Å; W424-Q426 PolarHBondContact O-N 3.22Å; Q426-C430 PolarHBondContact O-N 2.92Å; Q426-C430 VanDerWaalsContact O-N 3.1Å; Q426-C430 PolarHBondContact O-SG 3.33Å; Q426-R443 VanDerWaalsContact NE2-NH1 3.18Å; Q426-I447 HydrophobicContact CB-CD1 4.13Å
427	Q	93	Very high	91	Very high	11 Å²	11	35.4 Å²	35.4	5%	0.051	23%	0.226	C	C	.	.	H	α-helix	trans	-67.8	-51.6	175.7	-77.1	-179.9	-85.6	0	0	111.4	L423 W424 E425 A429 C430 E431 I447 S452	L423-Q427 HydrophobicContact CD1-CG 4.36Å; L423-Q427 HydrophobicContact CG-CG 4.09Å; L423-Q427 WeakPolarHBondContact O-CB 3.39Å; L423-Q427 WeakPolarHBondContact O-CG 3.26Å; L423-Q427 PolarHBondContact O-N 3.42Å; W424-Q427 WeakPolarHBondContact O-CB 3.39Å; W424-Q427 PolarHBondContact O-N 3.18Å; W424-Q427 VanDerWaalsContact O-N 3.13Å; E425-Q427 VanDerWaalsContact C-N 3.35Å; Q427-A429 VanDerWaalsContact C-N 3.27Å; Q427-A429 PolarHBondContact O-N 3.02Å; Q427-C430 PolarHBondContact O-N 2.95Å; Q427-E431 WeakPolarHBondContact O-CG 3.49Å; Q427-E431 PolarHBondContact O-N 3.42Å; Q427-I447 HydrophobicContact CG-CG1 4.32Å; Q427-I447 HydrophobicContact CG-CG2 4.48Å; Q427-S452 WeakPolarHBondContact CB-OG 3.35Å; Q427-S452 WeakPolarHBondContact CG-OG 3.26Å; Q427-S452 PolarHBondContact NE2-OG 3.16Å
428	K	92.7	Very high	91.2	Very high	80 Å²	80	35.4 Å²	35.4	35%	0.348	23%	0.226	S	C	.	.	H	α-helix	trans	-56.7	-42.2	175.9	-72.9	-67.2	-173.4	-178.4	0	111.7	W424 C430 E431 A432	W424-K428 HydrophobicContact CD2-CG 4.03Å; W424-K428 HydrophobicContact CE3-CG 4.4Å; W424-K428 HydrophobicContact CH2-CG 4.27Å; W424-K428 HydrophobicContact CZ2-CD 4.31Å; W424-K428 HydrophobicContact CZ2-CG 3.89Å; W424-K428 WeakPolarHBondContact O-CG 3.47Å; W424-K428 PolarHBondContact O-N 3.25Å; K428-C430 VanDerWaalsContact C-N 3.32Å; K428-C430 PolarHBondContact O-N 2.59Å; K428-E431 PolarHBondContact O-N 3.4Å; K428-A432 WeakPolarHBondContact O-CB 3.42Å; K428-A432 PolarHBondContact O-N 3.39Å
429	A	93.1	Very high	91.4	Very high	38 Å²	38	33.8 Å²	33.8	31%	0.314	22%	0.22	S	C	.	.	H	α-helix	trans	-63.6	-35.5	175.8	0	0	0	0	0	113	V415 E425 Q427	V415-A429 HydrophobicContact CG1-CB 4.01Å; V415-A429 HydrophobicContact CG2-CB 3.99Å; E425-A429 VanDerWaalsContact O-CB 3.23Å; E425-A429 WeakPolarHBondContact O-CB 2.99Å; E425-A429 PolarHBondContact O-N 3.49Å; Q427-A429 VanDerWaalsContact C-N 3.27Å; Q427-A429 PolarHBondContact O-N 3.02Å
430	C	93.7	Very high	91.9	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.014	21%	0.205	C	C	.	.	H	α-helix	trans	-75.3	-36.5	174.9	-65.7	0	0	0	0	112.6	Q426 Q427 K428 A432 G433 I447	Q426-C430 PolarHBondContact O-N 2.92Å; Q426-C430 VanDerWaalsContact O-N 3.1Å; Q426-C430 PolarHBondContact O-SG 3.33Å; Q427-C430 PolarHBondContact O-N 2.95Å; K428-C430 VanDerWaalsContact C-N 3.32Å; K428-C430 PolarHBondContact O-N 2.59Å; C430-A432 VanDerWaalsContact C-N 3.32Å; C430-G433 PolarHBondContact O-N 3.43Å; C430-G433 VanDerWaalsContact O-N 3.1Å; C430-I447 HydrophobicContact CB-CG2 4.33Å
431	E	92.7	Very high	92.7	Very high	83 Å²	83	29.4 Å²	29.4	39%	0.388	17%	0.172	S	C	.	.	H	α-helix	trans	-65.9	-34.5	177.9	-75.4	167.8	-165.6	0	0	112	Q427 K428 G433 S452	Q427-E431 WeakPolarHBondContact O-CG 3.49Å; Q427-E431 PolarHBondContact O-N 3.42Å; K428-E431 PolarHBondContact O-N 3.4Å; E431-G433 PolarHBondContact O-N 3.3Å; E431-S452 WeakPolarHBondContact CG-O 3.38Å; E431-S452 WeakPolarHBondContact OE1-CB 3.39Å; E431-S452 PolarHBondContact OE1-OG 3.38Å
432	A	92	Very high	93.5	Very high	84 Å²	84	28.8 Å²	28.8	69%	0.694	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.6	172.8	0	0	0	0	0	113.4	K428 C430	K428-A432 WeakPolarHBondContact O-CB 3.42Å; K428-A432 PolarHBondContact O-N 3.39Å; C430-A432 VanDerWaalsContact C-N 3.32Å
433	G	90.7	Very high	93.7	Very high	16 Å²	16	27.7 Å²	27.7	17%	0.165	15%	0.153	C	C	.	.			trans	98.7	135.7	-175.7	0	0	0	0	0	112	C430 E431	C430-G433 PolarHBondContact O-N 3.43Å; C430-G433 VanDerWaalsContact O-N 3.1Å; E431-G433 PolarHBondContact O-N 3.3Å
434	C	94.5	Very high	94.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.			trans	-146.4	132.7	174.6	62.6	0	0	0	0	110.1	L378 P384 T413 V415	L378-C434 VanDerWaalsContact CD1-C 3.41Å; L378-C434 WeakPolarHBondContact CD1-O 3.49Å; P384-C434 WeakPolarHBondContact CA-O 3.33Å; P384-C434 WeakPolarHBondContact CB-O 3.49Å; T413-C434 HydrophobicContact CG2-CB 4.28Å; V415-C434 HydrophobicContact CB-CB 4.05Å; V415-C434 HydrophobicContact CG2-CB 3.52Å
435	E	97.3	Very high	94.3	Very high	31 Å²	31	25 Å²	25	15%	0.145	14%	0.142	C	C	.	.	S	Bend	trans	-78.5	-36.2	177.1	-67	79.8	-177.2	0	0	111.3	I372 L378 I385 G386 L412 T413	I372-E435 HydrophobicContact CD1-CB 4.15Å; I372-E435 HydrophobicContact CG2-CB 3.98Å; I372-E435 HydrophobicContact CG2-CG 4.05Å; L378-E435 HydrophobicContact CD1-CB 4.38Å; L378-E435 HydrophobicContact CD1-CG 3.64Å; L378-E435 HydrophobicContact CG-CG 3.95Å; I385-E435 HydrophobicContact CD1-CG 4.48Å; I385-E435 PolarHBondContact N-O 2.89Å; G386-E435 PolarHBondContact N-O 2.97Å; L412-E435 HydrophobicContact CD2-CG 4.05Å; T413-E435 VanDerWaalsContact CA-OE2 3.31Å; T413-E435 WeakPolarHBondContact CA-OE2 3.41Å; T413-E435 WeakPolarHBondContact CB-OE2 3.47Å; T413-E435 PolarHBondContact N-OE2 3.38Å; T413-E435 PolarHBondContact O-N 3.05Å; T413-E435 VanDerWaalsContact O-N 3.08Å
436	I	98	Very high	94.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.9	-179.6	-55.9	174.3	0	0	0	110.3	L368 I369 I372 G386 I388 T413 V414 V415 V438	L368-I436 HydrophobicContact CD2-CD1 4Å; L368-I436 HydrophobicContact CD2-CG1 4.08Å; L368-I436 HydrophobicContact CD2-CG2 4.05Å; L368-I436 HydrophobicContact CG-CD1 4.3Å; L368-I436 HydrophobicContact CG-CG1 4.44Å; I369-I436 HydrophobicContact CD1-CD1 3.99Å; I372-I436 HydrophobicContact CD1-CD1 3.78Å; I372-I436 HydrophobicContact CD1-CG1 3.3Å; G386-I436 WeakPolarHBondContact O-CA 3.47Å; I388-I436 HydrophobicContact CD1-CG2 4.31Å; T413-I436 PolarHBondContact O-N 2.91Å; V414-I436 WeakPolarHBondContact CA-O 3.31Å; V414-I436 HydrophobicContact CB-CB 4.46Å; V414-I436 HydrophobicContact CG1-CB 4.06Å; V414-I436 HydrophobicContact CG1-CG2 4Å; V414-I436 HydrophobicContact CG2-CB 4.19Å; V414-I436 HydrophobicContact CG2-CD1 4.23Å; V415-I436 PolarHBondContact N-O 3.33Å; I436-V438 HydrophobicContact CG2-CG2 4.18Å
437	L	97.9	Very high	94.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115	172.8	-178.8	59.1	0	0	0	110.9	P384 G386 V387 I388 V415 A417 C439 L444	P384-L437 HydrophobicContact CB-CB 4.01Å; P384-L437 HydrophobicContact CG-CB 4.01Å; P384-L437 HydrophobicContact CG-CD2 4.15Å; G386-L437 PolarHBondContact O-N 2.94Å; V387-L437 WeakPolarHBondContact CA-O 3.31Å; V387-L437 HydrophobicContact CG2-CB 4.4Å; I388-L437 PolarHBondContact N-O 3.28Å; V415-L437 HydrophobicContact CB-CD1 4.08Å; V415-L437 HydrophobicContact CG1-CD1 4Å; A417-L437 HydrophobicContact CB-CD1 3.98Å; L437-C439 HydrophobicContact CG-CB 4.41Å; L437-L444 HydrophobicContact CD2-CD1 3.46Å; L437-L444 VanDerWaalsContact CD2-CD1 3.46Å
438	V	98.1	Very high	94.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	122.7	173.6	-173.8	0	0	0	0	109	I388 A396 I399 V414 V415 C416 A417 I436	I388-V438 HydrophobicContact CB-CG2 4.46Å; I388-V438 HydrophobicContact CD1-CG2 4.24Å; I388-V438 CarbonylContact O-C 3.19Å; I388-V438 WeakPolarHBondContact O-CA 3.41Å; A396-V438 HydrophobicContact CB-CG1 4.13Å; A396-V438 VanDerWaalsContact O-CG1 3.25Å; A396-V438 WeakPolarHBondContact O-CG1 3.4Å; I399-V438 HydrophobicContact CB-CG1 3.91Å; I399-V438 HydrophobicContact CG2-CG1 3.88Å; I399-V438 HydrophobicContact CG2-CG2 4.07Å; V414-V438 HydrophobicContact CG1-CG2 4.31Å; V415-V438 PolarHBondContact O-N 3.45Å; C416-V438 CarbonylContact C-O 3.59Å; C416-V438 WeakPolarHBondContact CA-O 3.48Å; A417-V438 PolarHBondContact N-O 3.14Å; I436-V438 HydrophobicContact CG2-CG2 4.18Å
439	C	96.9	Very high	94.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	162.9	-168.1	61.4	0	0	0	0	115.3	I388 C389 A390 A417 L437 L444	I388-C439 PolarHBondContact O-N 2.76Å; C389-C439 CarbonylContact C-O 3.54Å; C389-C439 WeakPolarHBondContact CA-O 3.15Å; A390-C439 PolarHBondContact N-O 3.09Å; A417-C439 HydrophobicContact CB-CB 4.02Å; A417-C439 CarbonylContact O-C 3.55Å; A417-C439 WeakPolarHBondContact O-CA 3.49Å; A417-C439 VanDerWaalsContact O-CB 3.28Å; A417-C439 WeakPolarHBondContact O-CB 3.4Å; L437-C439 HydrophobicContact CG-CB 4.41Å; C439-L444 HydrophobicContact CB-CB 4.23Å
440	T	94.5	Very high	94.2	Very high	14 Å²	14	23.2 Å²	23.2	9%	0.086	13%	0.129	C	C	.	.			trans	-90.4	140.8	160.1	58.7	0	0	0	0	109.6	A390 A417 Y418 G442 R443 L444	A390-T440 WeakPolarHBondContact O-CA 3.23Å; A417-T440 PolarHBondContact O-N 2.7Å; Y418-T440 WeakPolarHBondContact CA-OG1 3.36Å; T440-G442 PolarHBondContact O-N 3.38Å; T440-R443 PolarHBondContact O-N 3.12Å; T440-L444 PolarHBondContact O-N 3.07Å; T440-L444 VanDerWaalsContact O-N 3.16Å
441	P	94.1	Very high	94.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-50.3	-48.3	-173.8	-31	36	0	0	0	115	A390 R443 L444 I445 M469 F474 Q477 V478 I481	A390-P441 WeakPolarHBondContact O-CD 3.31Å; P441-R443 PolarHBondContact O-N 3.5Å; P441-L444 WeakPolarHBondContact O-CB 3.42Å; P441-L444 PolarHBondContact O-N 3.29Å; P441-I445 WeakPolarHBondContact O-CG1 3.23Å; P441-I445 PolarHBondContact O-N 3.11Å; P441-I445 VanDerWaalsContact O-N 3.12Å; P441-M469 HydrophobicContact CG-SD 4.12Å; P441-F474 HydrophobicContact CG-CB 4.38Å; P441-F474 HydrophobicContact CG-CG 4.4Å; P441-Q477 HydrophobicContact CB-CB 3.91Å; P441-V478 HydrophobicContact CG-CG2 4.31Å; P441-I481 HydrophobicContact CB-CD1 3.76Å
442	G	92.6	Very high	94	Very high	5 Å²	5	28.4 Å²	28.4	5%	0.052	15%	0.151	C	C	.	.	H	α-helix	trans	-58.9	-48.5	-179.2	0	0	0	0	0	113.4	I254 T440 L444 I445 D446 Q477	I254-G442 VanDerWaalsContact CD1-CA 3.49Å; T440-G442 PolarHBondContact O-N 3.38Å; G442-L444 VanDerWaalsContact C-N 3.32Å; G442-L444 PolarHBondContact O-N 3.2Å; G442-I445 WeakPolarHBondContact O-CB 3.19Å; G442-I445 PolarHBondContact O-N 2.79Å; G442-D446 PolarHBondContact O-N 3.45Å; G442-D446 VanDerWaalsContact O-N 3.1Å; G442-Q477 VanDerWaalsContact N-OE1 3.1Å
443	R	93.5	Very high	94.1	Very high	28 Å²	28	24.8 Å²	24.8	11%	0.106	12%	0.121	C	C	.	.	H	α-helix	trans	-65.1	-35.1	179.3	-178.8	58.3	64.1	100.3	-9.3	112.6	A417 Y418 G421 Q426 T440 P441 I445 D446 I447	A417-R443 HydrophobicContact CB-CG 3.97Å; Y418-R443 PolarHBondContact O-NH1 3Å; G421-R443 PolarHBondContact O-NH1 3.17Å; G421-R443 PolarHBondContact O-NH2 3.42Å; Q426-R443 VanDerWaalsContact NE2-NH1 3.18Å; T440-R443 PolarHBondContact O-N 3.12Å; P441-R443 PolarHBondContact O-N 3.5Å; R443-I445 VanDerWaalsContact C-N 3.33Å; R443-D446 PolarHBondContact O-N 2.83Å; R443-I447 HydrophobicContact CG-CD1 4.03Å; R443-I447 WeakPolarHBondContact O-CG1 3.25Å; R443-I447 PolarHBondContact O-N 3.29Å; R443-I447 VanDerWaalsContact O-N 3.12Å
444	L	95.8	Very high	94.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.9	-45.6	174.3	178.3	62.4	0	0	0	110.9	V387 L437 C439 T440 P441 G442 D446 I447 V448 L455 I481	V387-L444 HydrophobicContact CG1-CD2 3.95Å; L437-L444 HydrophobicContact CD2-CD1 3.46Å; L437-L444 VanDerWaalsContact CD2-CD1 3.46Å; C439-L444 HydrophobicContact CB-CB 4.23Å; T440-L444 PolarHBondContact O-N 3.07Å; T440-L444 VanDerWaalsContact O-N 3.16Å; P441-L444 WeakPolarHBondContact O-CB 3.42Å; P441-L444 PolarHBondContact O-N 3.29Å; G442-L444 VanDerWaalsContact C-N 3.32Å; G442-L444 PolarHBondContact O-N 3.2Å; L444-D446 VanDerWaalsContact C-N 3.31Å; L444-D446 PolarHBondContact O-N 3.09Å; L444-I447 PolarHBondContact O-N 3.07Å; L444-V448 HydrophobicContact CD1-CG2 4.1Å; L444-V448 HydrophobicContact CG-CG2 4.41Å; L444-V448 VanDerWaalsContact O-CG2 3.29Å; L444-V448 WeakPolarHBondContact O-CG2 3.34Å; L444-V448 PolarHBondContact O-N 3.2Å; L444-L455 HydrophobicContact CD1-CD2 4.32Å; L444-I481 HydrophobicContact CD2-CD1 3.92Å; L444-I481 HydrophobicContact CD2-CG1 4.01Å; L444-I481 HydrophobicContact CD2-CG2 3.78Å
445	I	94.3	Very high	94.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.1	-45.5	177.3	-69	173.2	0	0	0	110.5	I254 L257 P441 G442 R443 I447 V448 K449 Q477 I481	I254-I445 HydrophobicContact CG2-CB 4.29Å; I254-I445 HydrophobicContact CG2-CG2 3.83Å; L257-I445 HydrophobicContact CD1-CG1 4.2Å; L257-I445 HydrophobicContact CD2-CB 4.47Å; L257-I445 HydrophobicContact CD2-CG2 3.93Å; L257-I445 HydrophobicContact CG-CB 4.31Å; L257-I445 HydrophobicContact CG-CG1 4.04Å; L257-I445 HydrophobicContact CG-CG2 3.93Å; P441-I445 WeakPolarHBondContact O-CG1 3.23Å; P441-I445 PolarHBondContact O-N 3.11Å; P441-I445 VanDerWaalsContact O-N 3.12Å; G442-I445 WeakPolarHBondContact O-CB 3.19Å; G442-I445 PolarHBondContact O-N 2.79Å; R443-I445 VanDerWaalsContact C-N 3.33Å; I445-I447 PolarHBondContact O-N 2.73Å; I445-V448 PolarHBondContact O-N 2.97Å; I445-K449 HydrophobicContact CG2-CD 4.09Å; I445-K449 HydrophobicContact CG2-CG 4.3Å; I445-K449 WeakPolarHBondContact O-CB 3.39Å; I445-K449 WeakPolarHBondContact O-CG 3.37Å; I445-K449 PolarHBondContact O-N 2.58Å; I445-Q477 HydrophobicContact CD1-CB 3.66Å; I445-Q477 HydrophobicContact CD1-CG 3.8Å; I445-I481 HydrophobicContact CD1-CD1 4.47Å; I445-I481 HydrophobicContact CD1-CG1 4.39Å; I445-I481 HydrophobicContact CG1-CD1 4.27Å; I445-I481 HydrophobicContact CG1-CG1 4.02Å
446	D	92.8	Very high	94.2	Very high	53 Å²	53	32.7 Å²	32.7	28%	0.283	15%	0.149	S	C	.	.	H	α-helix	trans	-59.9	-47.6	179.3	-62.6	-27	0	0	0	112.5	G442 R443 L444 V448 K449 K450	G442-D446 PolarHBondContact O-N 3.45Å; G442-D446 VanDerWaalsContact O-N 3.1Å; R443-D446 PolarHBondContact O-N 2.83Å; L444-D446 VanDerWaalsContact C-N 3.31Å; L444-D446 PolarHBondContact O-N 3.09Å; D446-V448 VanDerWaalsContact C-N 3.34Å; D446-V448 PolarHBondContact O-N 3.37Å; D446-K449 PolarHBondContact O-N 3.14Å; D446-K450 WeakPolarHBondContact O-CG 3.28Å; D446-K450 PolarHBondContact O-N 3.27Å
447	I	93.7	Very high	94	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.3	-38.9	-179	-64.3	172.1	0	0	0	110.9	A417 L423 Q426 Q427 C430 R443 L444 I445 K451 S452 T453	A417-I447 HydrophobicContact CB-CD1 3.57Å; L423-I447 HydrophobicContact CD1-CD1 4.42Å; L423-I447 HydrophobicContact CD1-CG1 3.77Å; Q426-I447 HydrophobicContact CB-CD1 4.13Å; Q427-I447 HydrophobicContact CG-CG1 4.32Å; Q427-I447 HydrophobicContact CG-CG2 4.48Å; C430-I447 HydrophobicContact CB-CG2 4.33Å; R443-I447 HydrophobicContact CG-CD1 4.03Å; R443-I447 WeakPolarHBondContact O-CG1 3.25Å; R443-I447 PolarHBondContact O-N 3.29Å; R443-I447 VanDerWaalsContact O-N 3.12Å; L444-I447 PolarHBondContact O-N 3.07Å; I445-I447 PolarHBondContact O-N 2.73Å; I447-K451 PolarHBondContact O-N 2.87Å; I447-S452 PolarHBondContact O-N 2.79Å; I447-T453 HydrophobicContact CG2-CG2 3.75Å
448	V	94.4	Very high	94	Very high	22 Å²	22	34.9 Å²	34.9	13%	0.133	16%	0.157	C	C	.	.	H	α-helix	trans	-69	-42.1	176.6	175	0	0	0	0	111.2	L257 L444 I445 D446 K450 K451 T453 L455	L257-V448 HydrophobicContact CD1-CB 4.35Å; L257-V448 HydrophobicContact CD1-CG1 4.05Å; L257-V448 HydrophobicContact CD2-CB 3.97Å; L257-V448 HydrophobicContact CD2-CG1 3.76Å; L444-V448 HydrophobicContact CD1-CG2 4.1Å; L444-V448 HydrophobicContact CG-CG2 4.41Å; L444-V448 VanDerWaalsContact O-CG2 3.29Å; L444-V448 WeakPolarHBondContact O-CG2 3.34Å; L444-V448 PolarHBondContact O-N 3.2Å; I445-V448 PolarHBondContact O-N 2.97Å; D446-V448 VanDerWaalsContact C-N 3.34Å; D446-V448 PolarHBondContact O-N 3.37Å; V448-K450 VanDerWaalsContact C-N 3.28Å; V448-K450 PolarHBondContact O-N 3.49Å; V448-K451 PolarHBondContact O-N 3.19Å; V448-T453 HydrophobicContact CG2-CG2 3.8Å; V448-L455 HydrophobicContact CG2-CD1 4.38Å; V448-L455 HydrophobicContact CG2-CD2 4.15Å; V448-L455 HydrophobicContact CG2-CG 4.07Å
449	K	92.2	Very high	94	Very high	83 Å²	83	35.1 Å²	35.1	36%	0.361	16%	0.158	S	C	.	.	H	α-helix	trans	-59.7	-38.9	176.2	-78.5	-175.5	179.9	174.7	0	112.4	D255 L257 I445 D446 K451	D255-K449 VanDerWaalsContact O-CE 3.25Å; D255-K449 WeakPolarHBondContact O-CE 3.23Å; D255-K449 PolarHBondContact O-NZ 3.09Å; L257-K449 HydrophobicContact CD2-CG 3.59Å; I445-K449 HydrophobicContact CG2-CD 4.09Å; I445-K449 HydrophobicContact CG2-CG 4.3Å; I445-K449 WeakPolarHBondContact O-CB 3.39Å; I445-K449 WeakPolarHBondContact O-CG 3.37Å; I445-K449 PolarHBondContact O-N 2.58Å; D446-K449 PolarHBondContact O-N 3.14Å; K449-K451 PolarHBondContact O-N 3.23Å
450	K	89.5	Confident	94	Very high	67 Å²	67	35.1 Å²	35.1	29%	0.291	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-2.2	176.8	-69.1	-171.1	177.6	-154.2	0	114.3	N224 L423 D446 V448 S452	N224-K450 PolarHBondContact OD1-NZ 3.42Å; L423-K450 HydrophobicContact CD2-CD 3.97Å; D446-K450 WeakPolarHBondContact O-CG 3.28Å; D446-K450 PolarHBondContact O-N 3.27Å; V448-K450 VanDerWaalsContact C-N 3.28Å; V448-K450 PolarHBondContact O-N 3.49Å; K450-S452 PolarHBondContact O-N 3.02Å
451	K	91.4	Very high	94.2	Very high	186 Å²	186	34.4 Å²	34.4	81%	0.809	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	16.5	179	-51.3	177.2	-179.2	173.5	0	114.7	I447 V448 K449 T453	I447-K451 PolarHBondContact O-N 2.87Å; V448-K451 PolarHBondContact O-N 3.19Å; K449-K451 PolarHBondContact O-N 3.23Å; K451-T453 PolarHBondContact O-N 3.14Å
452	S	90.2	Very high	94.4	Very high	7 Å²	7	34.4 Å²	34.4	5%	0.049	15%	0.154	C	C	.	.	S	Bend	trans	-71.1	-19.8	171	-64.9	0	0	0	0	112.4	Q427 E431 I447 K450	Q427-S452 WeakPolarHBondContact CB-OG 3.35Å; Q427-S452 WeakPolarHBondContact CG-OG 3.26Å; Q427-S452 PolarHBondContact NE2-OG 3.16Å; E431-S452 WeakPolarHBondContact CG-O 3.38Å; E431-S452 WeakPolarHBondContact OE1-CB 3.39Å; E431-S452 PolarHBondContact OE1-OG 3.38Å; I447-S452 PolarHBondContact O-N 2.79Å; K450-S452 PolarHBondContact O-N 3.02Å
453	T	93.8	Very high	94.6	Very high	9 Å²	9	34.3 Å²	34.3	6%	0.055	15%	0.152	C	C	.	.			trans	-146.6	171	166.9	-158.2	0	0	0	0	110.8	P384 I447 V448 K451	P384-T453 WeakPolarHBondContact CD-OG1 3.46Å; I447-T453 HydrophobicContact CG2-CG2 3.75Å; V448-T453 HydrophobicContact CG2-CG2 3.8Å; K451-T453 PolarHBondContact O-N 3.14Å
454	N	94.1	Very high	94.7	Very high	49 Å²	49	33.1 Å²	33.1	26%	0.262	15%	0.148	S	C	.	.			trans	-139.1	160.8	175.3	66.5	83.8	0	0	0	110.2	G381 G383 R456	G381-N454 PolarHBondContact O-ND2 3.17Å; G383-N454 WeakPolarHBondContact CA-O 3.34Å; N454-R456 WeakPolarHBondContact OD1-CB 3.3Å; N454-R456 PolarHBondContact OD1-N 3.47Å
455	L	95.6	Very high	94.4	Very high	9 Å²	9	34.3 Å²	34.3	5%	0.047	15%	0.153	C	C	.	.	S	Bend	trans	-103.9	18.8	-176.9	-55.6	-178.3	0	0	0	113.3	V387 L444 V448 R457 V458 I481 H484 V485	V387-L455 HydrophobicContact CG2-CD2 4.36Å; L444-L455 HydrophobicContact CD1-CD2 4.32Å; V448-L455 HydrophobicContact CG2-CD1 4.38Å; V448-L455 HydrophobicContact CG2-CD2 4.15Å; V448-L455 HydrophobicContact CG2-CG 4.07Å; L455-R457 PolarHBondContact O-N 2.94Å; L455-V458 HydrophobicContact CB-CG2 4.06Å; L455-V458 HydrophobicContact CD2-CG2 3.92Å; L455-V458 PolarHBondContact O-N 3.18Å; L455-I481 HydrophobicContact CD1-CG2 4.37Å; L455-H484 HydrophobicContact CD1-CB 4.02Å; L455-V485 HydrophobicContact CB-CG2 4.07Å; L455-V485 HydrophobicContact CD1-CG2 3.99Å
456	R	94.2	Very high	94.3	Very high	155 Å²	155	34.4 Å²	34.4	59%	0.585	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-32.6	-173.7	-67.2	-178.9	171	-174.9	-3	113.2	Y267 N454	Y267-R456 HydrophobicContact CE1-CB 4.5Å; N454-R456 WeakPolarHBondContact OD1-CB 3.3Å; N454-R456 PolarHBondContact OD1-N 3.47Å
457	R	95.1	Very high	94	Very high	45 Å²	45	32.3 Å²	32.3	17%	0.17	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-3.6	179.1	-71.8	-148.2	64.9	-177.8	-8.4	114.1	P376 E377 D382 P384 L455 T459	P376-R457 PolarHBondContact O-NH1 3.45Å; P376-R457 PolarHBondContact O-NH2 3.03Å; E377-R457 PolarHBondContact O-NH1 3.46Å; D382-R457 HydrophobicContact CB-CG 4.4Å; D382-R457 WeakPolarHBondContact OD2-CD 3.46Å; D382-R457 IonicContact OD2-CZ 2.7Å; D382-R457 IonicContact OD2-NE 3.96Å; D382-R457 IonicContact OD2-NH1 3.67Å; D382-R457 PolarHBondContact OD2-NH1 3.21Å; P384-R457 CarbonylContact O-C 3.26Å; L455-R457 PolarHBondContact O-N 2.94Å; R457-T459 PolarHBondContact O-N 2.92Å; R457-T459 VanDerWaalsContact O-N 3.07Å
458	V	97.3	Very high	93.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.145	C	C	.	.			trans	-70.5	110.9	-177.9	-179.5	0	0	0	0	109.1	P384 I385 V387 L455 V485 R486	P384-V458 HydrophobicContact CG-CG2 4.04Å; P384-V458 WeakPolarHBondContact O-CA 3.41Å; P384-V458 WeakPolarHBondContact O-CG2 3.46Å; P384-V458 PolarHBondContact O-N 2.99Å; P384-V458 VanDerWaalsContact O-N 3.12Å; I385-V458 WeakPolarHBondContact O-CA 3.43Å; V387-V458 HydrophobicContact CB-CG1 4.18Å; V387-V458 HydrophobicContact CG2-CB 4.41Å; V387-V458 HydrophobicContact CG2-CG1 3.88Å; V387-V458 HydrophobicContact CG2-CG2 3.57Å; L455-V458 HydrophobicContact CB-CG2 4.06Å; L455-V458 HydrophobicContact CD2-CG2 3.92Å; L455-V458 PolarHBondContact O-N 3.18Å; V458-V485 HydrophobicContact CB-CG1 3.73Å; V458-V485 HydrophobicContact CB-CG2 4.25Å; V458-V485 HydrophobicContact CG1-CG1 3.76Å; V458-V485 HydrophobicContact CG1-CG2 4.11Å; V458-V485 WeakPolarHBondContact O-CG1 3.47Å; V458-R486 WeakPolarHBondContact O-CD 3.36Å; V458-R486 WeakPolarHBondContact O-CG 3.46Å
459	T	97.6	Very high	93.2	Very high	5 Å²	5	31.7 Å²	31.7	3%	0.031	14%	0.139	C	C	.	.			trans	-112.5	-11.5	178	46.4	0	0	0	0	112	F270 H371 I385 R457 Q490	F270-T459 HydrophobicContact CB-CG2 4.09Å; F270-T459 HydrophobicContact CD1-CG2 3.76Å; F270-T459 HydrophobicContact CD2-CG2 3.55Å; F270-T459 HydrophobicContact CE1-CG2 3.99Å; F270-T459 HydrophobicContact CE2-CG2 3.81Å; F270-T459 HydrophobicContact CG-CG2 3.53Å; F270-T459 HydrophobicContact CZ-CG2 4.02Å; H371-T459 PolarHBondContact NE2-OG1 3.4Å; I385-T459 WeakPolarHBondContact CG2-OG1 3.46Å; I385-T459 PolarHBondContact O-N 3Å; R457-T459 PolarHBondContact O-N 2.92Å; R457-T459 VanDerWaalsContact O-N 3.07Å; T459-Q490 PolarHBondContact O-N 3.45Å
460	Y	98.1	Very high	92.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	112.1	-179.7	-166.9	-78.3	0	0	0	109.8	I344 F364 L368 H371 I385 G386 V387 V462 Q490 L492	I344-Y460 HydrophobicContact CG2-CE2 3.63Å; I344-Y460 WeakPolarHBondContact CG2-OH 3.47Å; F364-Y460 WeakPolarHBondContact CA-OH 3.49Å; F364-Y460 PolarHBondContact O-OH 3.19Å; L368-Y460 HydrophobicContact CB-CD1 4.29Å; L368-Y460 HydrophobicContact CB-CE1 3.88Å; L368-Y460 HydrophobicContact CD1-CD1 3.58Å; L368-Y460 HydrophobicContact CD1-CD2 4.43Å; L368-Y460 HydrophobicContact CD1-CE1 4.06Å; L368-Y460 HydrophobicContact CD1-CG 3.75Å; L368-Y460 HydrophobicContact CG-CD1 4.35Å; L368-Y460 HydrophobicContact CG-CE1 4.38Å; H371-Y460 HydrophobicContact CB-CD2 4.27Å; I385-Y460 PolarHBondContact O-N 3.46Å; G386-Y460 WeakPolarHBondContact CA-O 3.48Å; V387-Y460 PolarHBondContact N-O 3.15Å; Y460-V462 HydrophobicContact CD1-CG2 3.77Å; Y460-V462 HydrophobicContact CE1-CG2 3.32Å; Y460-Q490 HydrophobicContact CD2-CB 4.49Å; Y460-L492 HydrophobicContact CE1-CD1 3.82Å; Y460-L492 HydrophobicContact CE2-CD1 4.09Å; Y460-L492 WeakPolarHBondContact OH-CD1 3.41Å
461	L	98.1	Very high	92.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.2	-175	-179.6	63.1	0	0	0	110.7	V387 F463 I481 A482 V485 Q490 T491 L492	V387-L461 HydrophobicContact CB-CD1 3.89Å; V387-L461 HydrophobicContact CG1-CD1 3.92Å; V387-L461 WeakPolarHBondContact O-CA 3.39Å; L461-F463 HydrophobicContact CD1-CE2 4.4Å; L461-F463 HydrophobicContact CD1-CZ 4.18Å; L461-F463 HydrophobicContact CD2-CE2 3.59Å; L461-F463 HydrophobicContact CD2-CZ 3.75Å; L461-F463 HydrophobicContact CG-CD2 4.48Å; L461-F463 HydrophobicContact CG-CE2 3.77Å; L461-F463 HydrophobicContact CG-CZ 4.01Å; L461-I481 HydrophobicContact CD1-CG2 4.49Å; L461-A482 HydrophobicContact CD2-CB 4.42Å; L461-V485 HydrophobicContact CD2-CG2 4.28Å; L461-Q490 PolarHBondContact N-O 2.84Å; L461-T491 HydrophobicContact CB-CG2 4.42Å; L461-T491 HydrophobicContact CD2-CG2 4.25Å; L461-T491 HydrophobicContact CG-CG2 4.37Å; L461-T491 CarbonylContact O-C 3.46Å; L461-T491 WeakPolarHBondContact O-CA 3.3Å; L461-L492 PolarHBondContact O-N 2.99Å
462	V	98.1	Very high	91.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.6	-179.8	-173.4	0	0	0	0	110.9	F364 V387 I388 C389 Y460 L492 F494	F364-V462 HydrophobicContact CB-CG2 4.32Å; F364-V462 HydrophobicContact CD1-CG1 4.01Å; F364-V462 HydrophobicContact CD2-CG1 4.25Å; F364-V462 HydrophobicContact CD2-CG2 4.37Å; F364-V462 HydrophobicContact CE1-CG1 4.17Å; F364-V462 HydrophobicContact CE2-CG1 4.45Å; F364-V462 HydrophobicContact CG-CG1 4.03Å; F364-V462 HydrophobicContact CG-CG2 4.41Å; F364-V462 HydrophobicContact CZ-CG1 4.39Å; V387-V462 PolarHBondContact O-N 3.31Å; I388-V462 HydrophobicContact CB-CB 4.33Å; I388-V462 HydrophobicContact CG1-CB 4.02Å; I388-V462 HydrophobicContact CG1-CG2 4.09Å; I388-V462 HydrophobicContact CG2-CB 4.13Å; I388-V462 HydrophobicContact CG2-CG1 4.27Å; C389-V462 PolarHBondContact N-O 3Å; Y460-V462 HydrophobicContact CD1-CG2 3.77Å; Y460-V462 HydrophobicContact CE1-CG2 3.32Å; V462-L492 CarbonylContact C-O 3.58Å; V462-L492 WeakPolarHBondContact CA-O 3.46Å; V462-L492 HydrophobicContact CG1-CB 4.46Å; V462-L492 HydrophobicContact CG2-CB 4.28Å; V462-L492 HydrophobicContact CG2-CD1 4.17Å; V462-L492 HydrophobicContact CG2-CG 4.46Å; V462-F494 HydrophobicContact CG1-CD2 4.18Å
463	F	97.1	Very high	91.5	Very high	2 Å²	2	26 Å²	26	1%	0.009	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	106	166	-62.8	-76	0	0	0	109.3	C389 L461 A466 M469 V478 A482 T491 L492 F494 I509	C389-F463 HydrophobicContact CB-CD1 3.65Å; C389-F463 HydrophobicContact CB-CE1 3.94Å; L461-F463 HydrophobicContact CD1-CE2 4.4Å; L461-F463 HydrophobicContact CD1-CZ 4.18Å; L461-F463 HydrophobicContact CD2-CE2 3.59Å; L461-F463 HydrophobicContact CD2-CZ 3.75Å; L461-F463 HydrophobicContact CG-CD2 4.48Å; L461-F463 HydrophobicContact CG-CE2 3.77Å; L461-F463 HydrophobicContact CG-CZ 4.01Å; F463-A466 HydrophobicContact CB-CB 4.42Å; F463-M469 HydrophobicContact CB-CE 3.92Å; F463-M469 HydrophobicContact CD1-CE 4.12Å; F463-M469 HydrophobicContact CD1-SD 4.18Å; F463-V478 HydrophobicContact CD1-CG1 3.84Å; F463-V478 HydrophobicContact CD1-CG2 4.14Å; F463-V478 HydrophobicContact CE1-CB 4.17Å; F463-V478 HydrophobicContact CE1-CG1 3.58Å; F463-V478 HydrophobicContact CE1-CG2 4.1Å; F463-V478 HydrophobicContact CE2-CG1 4.34Å; F463-V478 HydrophobicContact CG-CG1 4.34Å; F463-V478 HydrophobicContact CZ-CG1 3.84Å; F463-A482 HydrophobicContact CE2-CB 4.47Å; F463-A482 HydrophobicContact CZ-CB 4.3Å; F463-T491 HydrophobicContact CD2-CG2 4.21Å; F463-T491 HydrophobicContact CE2-CG2 4.09Å; F463-L492 PolarHBondContact N-O 3.39Å; F463-F494 PolarHBondContact O-N 2.85Å; F463-I509 HydrophobicContact CD2-CD1 3.88Å; F463-I509 HydrophobicContact CE2-CD1 3.79Å
464	D	95.3	Very high	91.2	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.021	14%	0.139	C	C	.	.	S	Bend	trans	-98.9	143.9	178.5	-164.9	16	0	0	0	111.6	F364 C389 P391 I399 A466 M469	F364-D464 HydrophobicContact CE1-CB 4.34Å; F364-D464 HydrophobicContact CZ-CB 4.43Å; C389-D464 PolarHBondContact O-N 3.4Å; P391-D464 WeakPolarHBondContact CD-O 3.28Å; I399-D464 HydrophobicContact CD1-CB 4.31Å; D464-A466 VanDerWaalsContact C-N 3.3Å; D464-A466 PolarHBondContact O-N 3.27Å; D464-M469 WeakPolarHBondContact O-CE 3.44Å
465	E	90.3	Very high	90.9	Very high	25 Å²	25	26.9 Å²	26.9	12%	0.117	13%	0.134	C	C	.	.	S	Bend	trans	49.5	48.5	-168.1	-64.3	-168.6	170.6	0	0	112.6	P391 L395 D467 K468 M469 F494	P391-E465 HydrophobicContact CG-CB 3.7Å; L395-E465 HydrophobicContact CD2-CB 4.17Å; L395-E465 HydrophobicContact CD2-CG 3.67Å; L395-E465 WeakPolarHBondContact CD2-OE2 3.27Å; E465-D467 VanDerWaalsContact C-N 3.31Å; E465-D467 PolarHBondContact O-N 3.46Å; E465-K468 HydrophobicContact CB-CB 4.22Å; E465-K468 WeakPolarHBondContact O-CB 3.5Å; E465-K468 PolarHBondContact O-N 2.82Å; E465-K468 VanDerWaalsContact OE2-CD 3.26Å; E465-K468 WeakPolarHBondContact OE2-CD 3.24Å; E465-K468 IonicContact OE2-NZ 3.74Å; E465-K468 PolarHBondContact OE2-NZ 3.18Å; E465-M469 PolarHBondContact O-N 3.4Å; E465-M469 VanDerWaalsContact O-N 3.1Å; E465-F494 PolarHBondContact N-O 3.43Å
466	A	90.8	Very high	90.7	Very high	2 Å²	2	30.3 Å²	30.3	2%	0.017	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-34.1	-174.2	0	0	0	0	0	113.6	F463 D464 K468 M469 F470 L493 F494 L502	F463-A466 HydrophobicContact CB-CB 4.42Å; D464-A466 VanDerWaalsContact C-N 3.3Å; D464-A466 PolarHBondContact O-N 3.27Å; A466-K468 VanDerWaalsContact C-N 3.29Å; A466-K468 PolarHBondContact O-N 3.13Å; A466-M469 WeakPolarHBondContact O-CB 3.12Å; A466-M469 PolarHBondContact O-N 3.28Å; A466-F470 WeakPolarHBondContact O-CD2 3.24Å; A466-F470 PolarHBondContact O-N 3.08Å; A466-L493 HydrophobicContact CB-CD1 4.31Å; A466-L493 HydrophobicContact CB-CD2 3.73Å; A466-L493 HydrophobicContact CB-CG 3.79Å; A466-F494 PolarHBondContact N-O 2.96Å; A466-F494 VanDerWaalsContact N-O 3.14Å; A466-L502 HydrophobicContact CB-CD1 3.76Å; A466-L502 HydrophobicContact CB-CD2 4.32Å
467	D	86.4	Confident	90.5	Very high	9 Å²	9	24 Å²	24	5%	0.048	14%	0.135	C	C	.	.	H	α-helix	trans	-58.5	-40.4	172	54	-7.6	0	0	0	112.8	E465 F470 N471 S495 T497 L502	E465-D467 VanDerWaalsContact C-N 3.31Å; E465-D467 PolarHBondContact O-N 3.46Å; D467-F470 WeakPolarHBondContact O-CB 3.35Å; D467-F470 PolarHBondContact O-N 2.8Å; D467-N471 PolarHBondContact O-N 3.33Å; D467-N471 VanDerWaalsContact O-N 3.11Å; D467-S495 VanDerWaalsContact CB-OG 3.27Å; D467-S495 WeakPolarHBondContact CB-OG 3.29Å; D467-S495 PolarHBondContact N-OG 2.76Å; D467-S495 PolarHBondContact OD1-OG 2.61Å; D467-S495 PolarHBondContact OD2-OG 3.44Å; D467-T497 WeakPolarHBondContact CB-OG1 3.44Å; D467-T497 WeakPolarHBondContact OD2-CB 3.27Å; D467-T497 PolarHBondContact OD2-N 3.08Å; D467-T497 PolarHBondContact OD2-OG1 3.01Å; D467-L502 HydrophobicContact CB-CD2 4.09Å
468	K	85	Confident	90.5	Very high	8 Å²	8	22 Å²	22	4%	0.035	13%	0.127	C	C	.	.	H	α-helix	trans	-73	-33.8	177.4	-176.3	172.7	153.7	-153.1	0	112.7	P391 E465 A466 F470 N471 L472	P391-K468 HydrophobicContact CB-CB 4.41Å; P391-K468 HydrophobicContact CB-CD 4.39Å; P391-K468 HydrophobicContact CB-CG 4.07Å; P391-K468 HydrophobicContact CG-CB 4.21Å; P391-K468 HydrophobicContact CG-CD 3.98Å; P391-K468 HydrophobicContact CG-CG 4.09Å; E465-K468 HydrophobicContact CB-CB 4.22Å; E465-K468 WeakPolarHBondContact O-CB 3.5Å; E465-K468 PolarHBondContact O-N 2.82Å; E465-K468 VanDerWaalsContact OE2-CD 3.26Å; E465-K468 WeakPolarHBondContact OE2-CD 3.24Å; E465-K468 IonicContact OE2-NZ 3.74Å; E465-K468 PolarHBondContact OE2-NZ 3.18Å; A466-K468 VanDerWaalsContact C-N 3.29Å; A466-K468 PolarHBondContact O-N 3.13Å; K468-F470 PolarHBondContact O-N 3.24Å; K468-N471 PolarHBondContact O-N 3.38Å; K468-L472 HydrophobicContact CG-CD1 4.27Å; K468-L472 WeakPolarHBondContact O-CG 3.49Å; K468-L472 PolarHBondContact O-N 3.23Å
469	M	86.5	Confident	90.2	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-56.2	-38.4	170.9	-67.2	-167.6	-141.8	0	0	111.1	C389 P391 P441 F463 D464 E465 A466 L472 G473 F474 V478	C389-M469 HydrophobicContact CB-CE 4.1Å; C389-M469 WeakPolarHBondContact O-CE 3.14Å; P391-M469 HydrophobicContact CB-CG 3.79Å; P391-M469 HydrophobicContact CG-CG 4.34Å; P441-M469 HydrophobicContact CG-SD 4.12Å; F463-M469 HydrophobicContact CB-CE 3.92Å; F463-M469 HydrophobicContact CD1-CE 4.12Å; F463-M469 HydrophobicContact CD1-SD 4.18Å; D464-M469 WeakPolarHBondContact O-CE 3.44Å; E465-M469 PolarHBondContact O-N 3.4Å; E465-M469 VanDerWaalsContact O-N 3.1Å; A466-M469 WeakPolarHBondContact O-CB 3.12Å; A466-M469 PolarHBondContact O-N 3.28Å; M469-L472 PolarHBondContact O-N 3.14Å; M469-G473 PolarHBondContact O-N 3.26Å; M469-F474 HydrophobicContact CB-CB 4.17Å; M469-F474 HydrophobicContact CB-CD2 4.43Å; M469-F474 WeakPolarHBondContact O-CB 3.49Å; M469-F474 PolarHBondContact O-N 3.14Å; M469-V478 HydrophobicContact CB-CG2 4.44Å; M469-V478 HydrophobicContact SD-CG2 3.6Å; M469-V478 VanDerWaalsContact SD-CG2 3.6Å
470	F	84.1	Confident	90.1	Very high	10 Å²	10	26.2 Å²	26.2	4%	0.044	14%	0.144	C	C	.	.	H	α-helix	trans	-69.6	-46.1	178.1	-85.2	-118	0	0	0	112.2	A466 D467 K468 L472 G473 E475 R501 L502 L505	A466-F470 WeakPolarHBondContact O-CD2 3.24Å; A466-F470 PolarHBondContact O-N 3.08Å; D467-F470 WeakPolarHBondContact O-CB 3.35Å; D467-F470 PolarHBondContact O-N 2.8Å; K468-F470 PolarHBondContact O-N 3.24Å; F470-L472 PolarHBondContact O-N 3.5Å; F470-L472 VanDerWaalsContact O-N 3.16Å; F470-G473 PolarHBondContact O-N 3.38Å; F470-E475 HydrophobicContact CD1-CB 4.13Å; F470-E475 HydrophobicContact CD1-CG 4.38Å; F470-E475 HydrophobicContact CE1-CB 3.83Å; F470-E475 HydrophobicContact CE1-CG 3.65Å; F470-E475 HydrophobicContact CE2-CB 4.22Å; F470-E475 HydrophobicContact CG-CB 4.44Å; F470-E475 HydrophobicContact CZ-CB 3.83Å; F470-E475 HydrophobicContact CZ-CG 3.69Å; F470-R501 HydrophobicContact CD1-CG 3.86Å; F470-R501 HydrophobicContact CE1-CG 4.11Å; F470-L502 HydrophobicContact CD2-CD1 4.06Å; F470-L502 HydrophobicContact CE2-CD1 3.94Å; F470-L502 HydrophobicContact CZ-CD1 4.38Å; F470-L505 HydrophobicContact CE1-CB 4.08Å; F470-L505 HydrophobicContact CE1-CD2 4.48Å; F470-L505 HydrophobicContact CE2-CB 4.28Å; F470-L505 HydrophobicContact CE2-CD2 3.22Å; F470-L505 HydrophobicContact CE2-CG 4.23Å; F470-L505 HydrophobicContact CZ-CB 3.41Å; F470-L505 VanDerWaalsContact CZ-CB 3.41Å; F470-L505 HydrophobicContact CZ-CD1 4.1Å; F470-L505 HydrophobicContact CZ-CD2 3.18Å; F470-L505 HydrophobicContact CZ-CG 3.68Å
471	N	80.2	Confident	89.9	Confident	99 Å²	99	26.2 Å²	26.2	53%	0.529	14%	0.144	S	C	.	.	H	α-helix	trans	-61.6	-23.3	177.3	-64.5	-16.9	0	0	0	112.3	D467 K468	D467-N471 PolarHBondContact O-N 3.33Å; D467-N471 VanDerWaalsContact O-N 3.11Å; K468-N471 PolarHBondContact O-N 3.38Å
472	L	80.7	Confident	89.8	Confident	69 Å²	69	26.2 Å²	26.2	36%	0.361	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-1.1	174.6	-69.3	175.6	0	0	0	113.9	P391 T392 K468 M469 F470 F474	P391-L472 HydrophobicContact CB-CD1 3.91Å; T392-L472 HydrophobicContact CG2-CD1 4.42Å; K468-L472 HydrophobicContact CG-CD1 4.27Å; K468-L472 WeakPolarHBondContact O-CG 3.49Å; K468-L472 PolarHBondContact O-N 3.23Å; M469-L472 PolarHBondContact O-N 3.14Å; F470-L472 PolarHBondContact O-N 3.5Å; F470-L472 VanDerWaalsContact O-N 3.16Å; L472-F474 HydrophobicContact CB-CD2 3.85Å; L472-F474 HydrophobicContact CB-CE2 3.88Å; L472-F474 HydrophobicContact CD1-CD2 4.34Å; L472-F474 HydrophobicContact CD1-CE2 3.87Å
473	G	82.5	Confident	89.5	Confident	44 Å²	44	30.1 Å²	30.1	45%	0.454	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	14.3	179.9	0	0	0	0	0	115	M469 F470 E475 P476	M469-G473 PolarHBondContact O-N 3.26Å; F470-G473 PolarHBondContact O-N 3.38Å; G473-E475 PolarHBondContact O-N 2.98Å; G473-P476 WeakPolarHBondContact O-CD 3.37Å
474	F	87.2	Confident	89.4	Confident	42 Å²	42	30.7 Å²	30.7	18%	0.184	17%	0.167	C	C	.	.			trans	-78	3.2	178.1	-64.8	-47.3	0	0	0	114.3	P391 P441 M469 L472 Q477 V478	P391-F474 WeakPolarHBondContact O-CE2 3.28Å; P441-F474 HydrophobicContact CG-CB 4.38Å; P441-F474 HydrophobicContact CG-CG 4.4Å; M469-F474 HydrophobicContact CB-CB 4.17Å; M469-F474 HydrophobicContact CB-CD2 4.43Å; M469-F474 WeakPolarHBondContact O-CB 3.49Å; M469-F474 PolarHBondContact O-N 3.14Å; L472-F474 HydrophobicContact CB-CD2 3.85Å; L472-F474 HydrophobicContact CB-CE2 3.88Å; L472-F474 HydrophobicContact CD1-CD2 4.34Å; L472-F474 HydrophobicContact CD1-CE2 3.87Å; F474-Q477 WeakPolarHBondContact O-CB 3.49Å; F474-Q477 PolarHBondContact O-N 3.09Å; F474-V478 HydrophobicContact CB-CG2 4.45Å; F474-V478 WeakPolarHBondContact O-CG2 3.24Å; F474-V478 PolarHBondContact O-N 3.32Å
475	E	88.8	Confident	89.4	Confident	36 Å²	36	30.5 Å²	30.5	17%	0.168	17%	0.167	C	C	.	.	H	α-helix	trans	-50.9	-49.1	179.9	169.3	176.1	-168.3	0	0	113.5	F470 G473 Q477 V478 R479 R501	F470-E475 HydrophobicContact CD1-CB 4.13Å; F470-E475 HydrophobicContact CD1-CG 4.38Å; F470-E475 HydrophobicContact CE1-CB 3.83Å; F470-E475 HydrophobicContact CE1-CG 3.65Å; F470-E475 HydrophobicContact CE2-CB 4.22Å; F470-E475 HydrophobicContact CG-CB 4.44Å; F470-E475 HydrophobicContact CZ-CB 3.83Å; F470-E475 HydrophobicContact CZ-CG 3.69Å; G473-E475 PolarHBondContact O-N 2.98Å; E475-Q477 VanDerWaalsContact C-N 3.3Å; E475-Q477 PolarHBondContact O-N 3.4Å; E475-V478 PolarHBondContact O-N 3.26Å; E475-R479 WeakPolarHBondContact O-CB 3.34Å; E475-R479 PolarHBondContact O-N 3.33Å; E475-R501 IonicContact OE2-CZ 3.28Å; E475-R501 VanDerWaalsContact OE2-CZ 3.29Å; E475-R501 IonicContact OE2-NE 3.25Å; E475-R501 PolarHBondContact OE2-NE 3.31Å; E475-R501 IonicContact OE2-NH2 2.69Å; E475-R501 PolarHBondContact OE2-NH2 3.43Å
476	P	90.3	Very high	89.6	Confident	81 Å²	81	29.9 Å²	29.9	53%	0.526	16%	0.163	S	C	.	.	H	α-helix	trans	-62.8	-36.5	177.7	-22.2	34.5	0	0	0	112.9	G473 S480	G473-P476 WeakPolarHBondContact O-CD 3.37Å; P476-S480 VanDerWaalsContact O-CB 3.26Å; P476-S480 WeakPolarHBondContact O-CB 3.09Å; P476-S480 PolarHBondContact O-N 2.97Å
477	Q	91.9	Very high	89.8	Confident	23 Å²	23	33.6 Å²	33.6	11%	0.107	19%	0.187	C	C	.	.	H	α-helix	trans	-70.2	-44.4	-179.6	-61.9	175	17.4	0	0	111	P441 G442 I445 F474 E475 R479 S480 I481	P441-Q477 HydrophobicContact CB-CB 3.91Å; G442-Q477 VanDerWaalsContact N-OE1 3.1Å; I445-Q477 HydrophobicContact CD1-CB 3.66Å; I445-Q477 HydrophobicContact CD1-CG 3.8Å; F474-Q477 WeakPolarHBondContact O-CB 3.49Å; F474-Q477 PolarHBondContact O-N 3.09Å; E475-Q477 VanDerWaalsContact C-N 3.3Å; E475-Q477 PolarHBondContact O-N 3.4Å; Q477-R479 PolarHBondContact O-N 3.21Å; Q477-S480 WeakPolarHBondContact O-CB 2.96Å; Q477-S480 PolarHBondContact O-N 2.93Å; Q477-I481 WeakPolarHBondContact O-CD1 3.31Å; Q477-I481 VanDerWaalsContact O-CG1 3.28Å; Q477-I481 WeakPolarHBondContact O-CG1 3.33Å; Q477-I481 PolarHBondContact O-N 2.95Å
478	V	93.3	Very high	90.2	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-47.1	175.1	166.1	0	0	0	0	110.9	P441 F463 M469 F474 E475 S480 I481 A482 L505	P441-V478 HydrophobicContact CG-CG2 4.31Å; F463-V478 HydrophobicContact CD1-CG1 3.84Å; F463-V478 HydrophobicContact CD1-CG2 4.14Å; F463-V478 HydrophobicContact CE1-CB 4.17Å; F463-V478 HydrophobicContact CE1-CG1 3.58Å; F463-V478 HydrophobicContact CE1-CG2 4.1Å; F463-V478 HydrophobicContact CE2-CG1 4.34Å; F463-V478 HydrophobicContact CG-CG1 4.34Å; F463-V478 HydrophobicContact CZ-CG1 3.84Å; M469-V478 HydrophobicContact CB-CG2 4.44Å; M469-V478 HydrophobicContact SD-CG2 3.6Å; M469-V478 VanDerWaalsContact SD-CG2 3.6Å; F474-V478 HydrophobicContact CB-CG2 4.45Å; F474-V478 WeakPolarHBondContact O-CG2 3.24Å; F474-V478 PolarHBondContact O-N 3.32Å; E475-V478 PolarHBondContact O-N 3.26Å; V478-S480 PolarHBondContact O-N 3.28Å; V478-I481 PolarHBondContact O-N 3.42Å; V478-A482 WeakPolarHBondContact O-CB 3.24Å; V478-A482 PolarHBondContact O-N 3.02Å; V478-L505 HydrophobicContact CG1-CD2 3.53Å
479	R	92.9	Very high	90.7	Very high	83 Å²	83	37 Å²	37	31%	0.313	20%	0.204	S	C	.	.	H	α-helix	trans	-61.7	-43.6	176	-174.2	-177.6	-66.2	-99.1	-4.3	111.5	E475 Q477 A482 N483 L505 D508	E475-R479 WeakPolarHBondContact O-CB 3.34Å; E475-R479 PolarHBondContact O-N 3.33Å; Q477-R479 PolarHBondContact O-N 3.21Å; R479-A482 PolarHBondContact O-N 3.15Å; R479-N483 WeakPolarHBondContact O-CB 3.27Å; R479-N483 VanDerWaalsContact O-CG 3.26Å; R479-N483 PolarHBondContact O-N 3.07Å; R479-L505 HydrophobicContact CB-CD1 4.25Å; R479-D508 IonicContact CZ-OD2 3.86Å; R479-D508 IonicContact NH1-OD2 2.94Å; R479-D508 PolarHBondContact NH1-OD2 3.3Å; R479-D508 IonicContact NH2-OD2 3.81Å; R479-D508 PolarHBondContact NH2-OD2 2.95Å
480	S	93.4	Very high	91.2	Very high	10 Å²	10	37 Å²	37	7%	0.07	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-46.2	178	-178.8	0	0	0	0	112.1	P256 L257 P476 Q477 V478 N483 H484	P256-S480 WeakPolarHBondContact CB-OG 3.45Å; L257-S480 WeakPolarHBondContact CB-OG 3.03Å; L257-S480 PolarHBondContact N-OG 3.19Å; P476-S480 VanDerWaalsContact O-CB 3.26Å; P476-S480 WeakPolarHBondContact O-CB 3.09Å; P476-S480 PolarHBondContact O-N 2.97Å; Q477-S480 WeakPolarHBondContact O-CB 2.96Å; Q477-S480 PolarHBondContact O-N 2.93Å; V478-S480 PolarHBondContact O-N 3.28Å; S480-N483 PolarHBondContact O-N 3.42Å; S480-H484 PolarHBondContact O-N 3.32Å; S480-H484 VanDerWaalsContact O-N 3.13Å; S480-H484 PolarHBondContact O-ND1 3.16Å
481	I	95.2	Very high	91.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-49.2	176.7	-67.5	157.9	0	0	0	110.6	P441 L444 I445 L455 L461 Q477 V478 N483 H484 V485	P441-I481 HydrophobicContact CB-CD1 3.76Å; L444-I481 HydrophobicContact CD2-CD1 3.92Å; L444-I481 HydrophobicContact CD2-CG1 4.01Å; L444-I481 HydrophobicContact CD2-CG2 3.78Å; I445-I481 HydrophobicContact CD1-CD1 4.47Å; I445-I481 HydrophobicContact CD1-CG1 4.39Å; I445-I481 HydrophobicContact CG1-CD1 4.27Å; I445-I481 HydrophobicContact CG1-CG1 4.02Å; L455-I481 HydrophobicContact CD1-CG2 4.37Å; L461-I481 HydrophobicContact CD1-CG2 4.49Å; Q477-I481 WeakPolarHBondContact O-CD1 3.31Å; Q477-I481 VanDerWaalsContact O-CG1 3.28Å; Q477-I481 WeakPolarHBondContact O-CG1 3.33Å; Q477-I481 PolarHBondContact O-N 2.95Å; V478-I481 PolarHBondContact O-N 3.42Å; I481-N483 VanDerWaalsContact C-N 3.28Å; I481-N483 PolarHBondContact O-N 3.12Å; I481-H484 WeakPolarHBondContact O-CB 3.15Å; I481-H484 PolarHBondContact O-N 3.37Å; I481-V485 WeakPolarHBondContact O-CG2 3.48Å; I481-V485 PolarHBondContact O-N 3.24Å
482	A	95	Very high	92.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.4	-39.3	179.6	0	0	0	0	0	112.3	L461 F463 V478 R479 H484 V485 R489 I509	L461-A482 HydrophobicContact CD2-CB 4.42Å; F463-A482 HydrophobicContact CE2-CB 4.47Å; F463-A482 HydrophobicContact CZ-CB 4.3Å; V478-A482 WeakPolarHBondContact O-CB 3.24Å; V478-A482 PolarHBondContact O-N 3.02Å; R479-A482 PolarHBondContact O-N 3.15Å; A482-H484 VanDerWaalsContact C-N 3.27Å; A482-H484 PolarHBondContact O-N 2.9Å; A482-V485 PolarHBondContact O-N 2.91Å; A482-R489 PolarHBondContact O-NH1 2.83Å; A482-R489 PolarHBondContact O-NH2 3.42Å; A482-I509 HydrophobicContact CB-CB 3.96Å; A482-I509 HydrophobicContact CB-CG2 3.7Å
483	N	93.4	Very high	93.5	Very high	82 Å²	82	28.5 Å²	28.5	44%	0.439	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-7.5	176.8	-70	-9.6	0	0	0	114.1	H262 R479 S480 I481	H262-N483 PolarHBondContact NE2-O 3.41Å; R479-N483 WeakPolarHBondContact O-CB 3.27Å; R479-N483 VanDerWaalsContact O-CG 3.26Å; R479-N483 PolarHBondContact O-N 3.07Å; S480-N483 PolarHBondContact O-N 3.42Å; I481-N483 VanDerWaalsContact C-N 3.28Å; I481-N483 PolarHBondContact O-N 3.12Å
484	H	94	Very high	94.1	Very high	13 Å²	13	26.4 Å²	26.4	6%	0.06	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-22	174	-88.8	60.8	0	0	0	113	L257 P258 I260 L455 S480 I481 A482	L257-H484 WeakPolarHBondContact CB-CE1 3.32Å; L257-H484 WeakPolarHBondContact CB-NE2 3.29Å; L257-H484 HydrophobicContact CD1-CB 4.14Å; L257-H484 PolarHBondContact O-CE1 3.43Å; L257-H484 VanDerWaalsContact O-CE1 3.25Å; P258-H484 PolarHBondContact O-CE1 3.11Å; P258-H484 PolarHBondContact O-NE2 2.94Å; I260-H484 HydrophobicContact CD1-CB 4.48Å; I260-H484 WeakPolarHBondContact CD1-CD2 3.46Å; L455-H484 HydrophobicContact CD1-CB 4.02Å; S480-H484 PolarHBondContact O-N 3.32Å; S480-H484 VanDerWaalsContact O-N 3.13Å; S480-H484 PolarHBondContact O-ND1 3.16Å; I481-H484 WeakPolarHBondContact O-CB 3.15Å; I481-H484 PolarHBondContact O-N 3.37Å; A482-H484 VanDerWaalsContact C-N 3.27Å; A482-H484 PolarHBondContact O-N 2.9Å
485	V	95.4	Very high	94.2	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.006	13%	0.129	C	C	.	.	S	Bend	trans	-83.3	146.6	176.4	-175.8	0	0	0	0	109.2	H262 L455 V458 L461 I481 A482 R489	H262-V485 PolarHBondContact CE1-O 3.47Å; H262-V485 VanDerWaalsContact CE1-O 3.24Å; H262-V485 PolarHBondContact NE2-O 2.83Å; L455-V485 HydrophobicContact CB-CG2 4.07Å; L455-V485 HydrophobicContact CD1-CG2 3.99Å; V458-V485 HydrophobicContact CB-CG1 3.73Å; V458-V485 HydrophobicContact CB-CG2 4.25Å; V458-V485 HydrophobicContact CG1-CG1 3.76Å; V458-V485 HydrophobicContact CG1-CG2 4.11Å; V458-V485 WeakPolarHBondContact O-CG1 3.47Å; L461-V485 HydrophobicContact CD2-CG2 4.28Å; I481-V485 WeakPolarHBondContact O-CG2 3.48Å; I481-V485 PolarHBondContact O-N 3.24Å; A482-V485 PolarHBondContact O-N 2.91Å; V485-R489 HydrophobicContact CG1-CB 4.08Å; V485-R489 VanDerWaalsContact CG1-CD 3.42Å; V485-R489 HydrophobicContact CG1-CG 4.31Å; V485-R489 PolarHBondContact O-NH1 3.39Å
486	R	95.3	Very high	94	Very high	12 Å²	12	24.3 Å²	24.3	5%	0.045	13%	0.134	C	C	.	.			trans	-45.9	142.4	173.8	66.5	-170.3	-67.9	169.1	-0.3	112.4	Y267 A268 V458 D488 R489	Y267-R486 HydrophobicContact CD1-CB 3.93Å; Y267-R486 HydrophobicContact CD2-CB 4.23Å; Y267-R486 HydrophobicContact CE1-CB 3.65Å; Y267-R486 HydrophobicContact CE2-CB 3.96Å; Y267-R486 HydrophobicContact CG-CB 4.21Å; A268-R486 PolarHBondContact O-NH1 3Å; A268-R486 PolarHBondContact O-NH2 2.79Å; V458-R486 WeakPolarHBondContact O-CD 3.36Å; V458-R486 WeakPolarHBondContact O-CG 3.46Å; R486-D488 WeakPolarHBondContact CB-OD1 3.37Å; R486-D488 WeakPolarHBondContact CG-OD1 3.46Å; R486-D488 IonicContact CZ-OD1 3.52Å; R486-D488 IonicContact CZ-OD2 3.37Å; R486-D488 IonicContact NE-OD1 2.71Å; R486-D488 PolarHBondContact NE-OD1 3.37Å; R486-D488 IonicContact NE-OD2 3.34Å; R486-D488 PolarHBondContact NE-OD2 3.07Å; R486-D488 IonicContact NH2-OD1 3.5Å; R486-D488 IonicContact NH2-OD2 2.67Å; R486-D488 PolarHBondContact NH2-OD2 3.33Å; R486-D488 PolarHBondContact O-N 3.11Å; R486-R489 HydrophobicContact CG-CB 4.22Å; R486-R489 WeakPolarHBondContact O-CB 3.28Å; R486-R489 WeakPolarHBondContact O-CD 3.49Å; R486-R489 VanDerWaalsContact O-CG 3.27Å; R486-R489 WeakPolarHBondContact O-CG 3.08Å; R486-R489 PolarHBondContact O-NH1 3.42Å
487	P	93.9	Very high	93.4	Very high	80 Å²	80	22 Å²	22	52%	0.519	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.7	-173.4	27.4	-35	0	0	0	114.1	H262 R489	H262-P487 HydrophobicContact CB-CG 4.5Å; P487-R489 VanDerWaalsContact C-N 3.27Å; P487-R489 PolarHBondContact O-N 3.32Å
488	D	94.7	Very high	93.1	Very high	67 Å²	67	22.3 Å²	22.3	36%	0.358	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	7.1	-179.2	61.1	-33.5	0	0	0	114	F270 R486	F270-D488 WeakPolarHBondContact CE1-OD2 3.34Å; F270-D488 VanDerWaalsContact CZ-O 3.27Å; F270-D488 WeakPolarHBondContact CZ-O 3.36Å; R486-D488 WeakPolarHBondContact CB-OD1 3.37Å; R486-D488 WeakPolarHBondContact CG-OD1 3.46Å; R486-D488 IonicContact CZ-OD1 3.52Å; R486-D488 IonicContact CZ-OD2 3.37Å; R486-D488 IonicContact NE-OD1 2.71Å; R486-D488 PolarHBondContact NE-OD1 3.37Å; R486-D488 IonicContact NE-OD2 3.34Å; R486-D488 PolarHBondContact NE-OD2 3.07Å; R486-D488 IonicContact NH2-OD1 3.5Å; R486-D488 IonicContact NH2-OD2 2.67Å; R486-D488 PolarHBondContact NH2-OD2 3.33Å; R486-D488 PolarHBondContact O-N 3.11Å
489	R	96.1	Very high	92.6	Very high	20 Å²	20	27 Å²	27	8%	0.075	14%	0.14	C	C	.	.	S	Bend	trans	-56.9	163.5	173.3	68.7	-176.8	178.1	-93	-0.4	112.6	K272 A482 V485 R486 P487 T491 I509	K272-R489 PolarHBondContact NZ-O 3.41Å; A482-R489 PolarHBondContact O-NH1 2.83Å; A482-R489 PolarHBondContact O-NH2 3.42Å; V485-R489 HydrophobicContact CG1-CB 4.08Å; V485-R489 VanDerWaalsContact CG1-CD 3.42Å; V485-R489 HydrophobicContact CG1-CG 4.31Å; V485-R489 PolarHBondContact O-NH1 3.39Å; R486-R489 HydrophobicContact CG-CB 4.22Å; R486-R489 WeakPolarHBondContact O-CB 3.28Å; R486-R489 WeakPolarHBondContact O-CD 3.49Å; R486-R489 VanDerWaalsContact O-CG 3.27Å; R486-R489 WeakPolarHBondContact O-CG 3.08Å; R486-R489 PolarHBondContact O-NH1 3.42Å; P487-R489 VanDerWaalsContact C-N 3.27Å; P487-R489 PolarHBondContact O-N 3.32Å; R489-T491 WeakPolarHBondContact CD-OG1 3.38Å; R489-T491 WeakPolarHBondContact CG-OG1 3.46Å; R489-T491 PolarHBondContact NE-OG1 3.38Å; R489-I509 PolarHBondContact NH2-O 3.2Å; R489-I509 VanDerWaalsContact NH2-O 3.13Å
490	Q	97.5	Very high	92.2	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	127.8	160.2	-168.9	175.1	13.6	0	0	109.5	I344 R348 D349 T459 Y460 L461 L492	I344-Q490 PolarHBondContact O-NE2 2.83Å; R348-Q490 PolarHBondContact O-NE2 3.31Å; D349-Q490 WeakPolarHBondContact OD1-CA 3.2Å; T459-Q490 PolarHBondContact O-N 3.45Å; Y460-Q490 HydrophobicContact CD2-CB 4.49Å; L461-Q490 PolarHBondContact N-O 2.84Å; Q490-L492 HydrophobicContact CG-CD2 4.03Å
491	T	97.7	Very high	91.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.3	177.6	-47.8	0	0	0	0	111.3	D349 V350 L461 F463 R489 L510	D349-T491 VanDerWaalsContact CA-O 3.27Å; D349-T491 WeakPolarHBondContact CA-O 3.31Å; D349-T491 VanDerWaalsContact CB-O 3.3Å; D349-T491 WeakPolarHBondContact CB-O 3.35Å; D349-T491 PolarHBondContact OD1-N 2.83Å; V350-T491 PolarHBondContact N-O 3.42Å; L461-T491 HydrophobicContact CB-CG2 4.42Å; L461-T491 HydrophobicContact CD2-CG2 4.25Å; L461-T491 HydrophobicContact CG-CG2 4.37Å; L461-T491 CarbonylContact O-C 3.46Å; L461-T491 WeakPolarHBondContact O-CA 3.3Å; F463-T491 HydrophobicContact CD2-CG2 4.21Å; F463-T491 HydrophobicContact CE2-CG2 4.09Å; R489-T491 WeakPolarHBondContact CD-OG1 3.38Å; R489-T491 WeakPolarHBondContact CG-OG1 3.46Å; R489-T491 PolarHBondContact NE-OG1 3.38Å; T491-L510 VanDerWaalsContact CB-CD2 3.42Å; T491-L510 HydrophobicContact CG2-CD2 3.36Å; T491-L510 WeakPolarHBondContact O-CD2 3.43Å
492	L	97.6	Very high	91.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.8	179.9	-46.9	-176.5	0	0	0	110.3	I344 V350 F364 Y460 L461 V462 F463 Q490 F494	I344-L492 HydrophobicContact CD1-CD1 3.72Å; I344-L492 HydrophobicContact CG1-CD1 3.83Å; I344-L492 HydrophobicContact CG1-CD2 3.91Å; I344-L492 HydrophobicContact CG2-CD1 3.84Å; I344-L492 HydrophobicContact CG2-CD2 4.48Å; V350-L492 HydrophobicContact CB-CD2 3.94Å; V350-L492 HydrophobicContact CG2-CD2 4.17Å; V350-L492 WeakPolarHBondContact O-CA 3.35Å; F364-L492 HydrophobicContact CB-CD1 3.95Å; Y460-L492 HydrophobicContact CE1-CD1 3.82Å; Y460-L492 HydrophobicContact CE2-CD1 4.09Å; Y460-L492 WeakPolarHBondContact OH-CD1 3.41Å; L461-L492 PolarHBondContact O-N 2.99Å; V462-L492 CarbonylContact C-O 3.58Å; V462-L492 WeakPolarHBondContact CA-O 3.46Å; V462-L492 HydrophobicContact CG1-CB 4.46Å; V462-L492 HydrophobicContact CG2-CB 4.28Å; V462-L492 HydrophobicContact CG2-CD1 4.17Å; V462-L492 HydrophobicContact CG2-CG 4.46Å; F463-L492 PolarHBondContact N-O 3.39Å; Q490-L492 HydrophobicContact CG-CD2 4.03Å; L492-F494 HydrophobicContact CB-CD2 4.33Å; L492-F494 HydrophobicContact CB-CE2 3.89Å; L492-F494 HydrophobicContact CD1-CE2 4.2Å
493	L	96.4	Very high	91.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	116.5	178.1	-169.8	160.3	0	0	0	109	V350 I351 G352 A466 L502 A506 I509 L510	V350-L493 PolarHBondContact O-N 2.86Å; I351-L493 CarbonylContact C-O 3.53Å; I351-L493 WeakPolarHBondContact CA-O 3.48Å; I351-L493 HydrophobicContact CG2-CD2 4.36Å; G352-L493 PolarHBondContact N-O 3.41Å; A466-L493 HydrophobicContact CB-CD1 4.31Å; A466-L493 HydrophobicContact CB-CD2 3.73Å; A466-L493 HydrophobicContact CB-CG 3.79Å; L493-L502 HydrophobicContact CD1-CD1 4.12Å; L493-L502 HydrophobicContact CD2-CD1 4.43Å; L493-L502 HydrophobicContact CD2-CD2 4.23Å; L493-L502 HydrophobicContact CD2-CG 4.48Å; L493-A506 HydrophobicContact CD1-CB 4.02Å; L493-I509 HydrophobicContact CD1-CD1 4.5Å; L493-L510 HydrophobicContact CB-CD1 4.4Å
494	F	95.1	Very high	91.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.7	176.4	-73.1	-83.3	0	0	0	111	I344 G352 K360 F364 V462 F463 E465 A466 L492	I344-F494 HydrophobicContact CD1-CZ 4.08Å; G352-F494 WeakPolarHBondContact O-CA 3.19Å; K360-F494 HydrophobicContact CB-CD1 3.96Å; K360-F494 HydrophobicContact CB-CE1 4.47Å; K360-F494 HydrophobicContact CB-CG 4.42Å; K360-F494 HydrophobicContact CD-CB 4.28Å; K360-F494 HydrophobicContact CD-CD1 3.96Å; K360-F494 HydrophobicContact CG-CD1 3.96Å; F364-F494 HydrophobicContact CB-CE2 3.82Å; F364-F494 HydrophobicContact CB-CZ 4.39Å; F364-F494 AromaticContact CD1-CD2 3.61Å; F364-F494 HydrophobicContact CD1-CD2 3.61Å; F364-F494 AromaticContact CD1-CE2 3.61Å; F364-F494 HydrophobicContact CD1-CE2 3.61Å; F364-F494 HydrophobicContact CD1-CG 4.3Å; F364-F494 HydrophobicContact CD1-CZ 4.29Å; F364-F494 HydrophobicContact CE1-CD2 4.23Å; F364-F494 HydrophobicContact CG-CD2 4.49Å; F364-F494 HydrophobicContact CG-CE2 4.17Å; V462-F494 HydrophobicContact CG1-CD2 4.18Å; F463-F494 PolarHBondContact O-N 2.85Å; E465-F494 PolarHBondContact N-O 3.43Å; A466-F494 PolarHBondContact N-O 2.96Å; A466-F494 VanDerWaalsContact N-O 3.14Å; L492-F494 HydrophobicContact CB-CD2 4.33Å; L492-F494 HydrophobicContact CB-CE2 3.89Å; L492-F494 HydrophobicContact CD1-CE2 4.2Å
495	S	90.8	Very high	90.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	159.9	-175.9	-170.3	0	0	0	0	111.6	G352 I353 G354 K360 D467 T497	G352-S495 PolarHBondContact O-N 3.29Å; I353-S495 WeakPolarHBondContact CA-O 3.11Å; G354-S495 PolarHBondContact N-O 3.12Å; G354-S495 VanDerWaalsContact N-O 3.14Å; K360-S495 VanDerWaalsContact NZ-C 3.34Å; K360-S495 PolarHBondContact NZ-O 2.89Å; K360-S495 VanDerWaalsContact NZ-O 3.08Å; D467-S495 VanDerWaalsContact CB-OG 3.27Å; D467-S495 WeakPolarHBondContact CB-OG 3.29Å; D467-S495 PolarHBondContact N-OG 2.76Å; D467-S495 PolarHBondContact OD1-OG 2.61Å; D467-S495 PolarHBondContact OD2-OG 3.44Å; S495-T497 VanDerWaalsContact CB-O 3.28Å; S495-T497 WeakPolarHBondContact CB-O 3.13Å; S495-T497 PolarHBondContact OG-N 2.65Å; S495-T497 PolarHBondContact OG-O 2.82Å
496	A	83	Confident	90.7	Very high	33 Å²	33	42.2 Å²	42.2	27%	0.273	19%	0.193	S	C	.	.	S	Bend	trans	-85.9	-36.3	168.8	0	0	0	0	0	110.7	G354	G354-A496 WeakPolarHBondContact O-CA 2.92Å
497	T	78.8	Confident	90.5	Very high	33 Å²	33	49.7 Å²	49.7	20%	0.202	22%	0.221	C	C	.	.			trans	-118.4	156.6	179	71.7	0	0	0	0	111.9	D467 S495 L502	D467-T497 WeakPolarHBondContact CB-OG1 3.44Å; D467-T497 WeakPolarHBondContact OD2-CB 3.27Å; D467-T497 PolarHBondContact OD2-N 3.08Å; D467-T497 PolarHBondContact OD2-OG1 3.01Å; S495-T497 VanDerWaalsContact CB-O 3.28Å; S495-T497 WeakPolarHBondContact CB-O 3.13Å; S495-T497 PolarHBondContact OG-N 2.65Å; S495-T497 PolarHBondContact OG-O 2.82Å; T497-L502 WeakPolarHBondContact O-CD2 3.27Å
498	F	86.2	Confident	90.4	Very high	29 Å²	29	50 Å²	50	13%	0.127	22%	0.219	C	C	.	.			trans	-133.8	65.4	177.9	-160.7	-113.7	0	0	0	111.3	I351 I353 L502 E503 A506	I351-F498 HydrophobicContact CD1-CE2 4.31Å; I351-F498 HydrophobicContact CD1-CZ 3.91Å; I351-F498 HydrophobicContact CG2-CD2 4Å; I351-F498 HydrophobicContact CG2-CE2 3.63Å; I351-F498 HydrophobicContact CG2-CZ 4.03Å; I353-F498 HydrophobicContact CD1-CB 3.74Å; I353-F498 HydrophobicContact CD1-CD2 3.7Å; I353-F498 HydrophobicContact CD1-CG 3.96Å; I353-F498 HydrophobicContact CG1-CB 3.96Å; I353-F498 HydrophobicContact CG1-CD2 4.41Å; I353-F498 HydrophobicContact CG1-CG 4.27Å; F498-L502 HydrophobicContact CD2-CD2 3.87Å; F498-L502 HydrophobicContact CD2-CG 4.07Å; F498-L502 HydrophobicContact CE2-CD2 4.38Å; F498-L502 HydrophobicContact CE2-CG 4.14Å; F498-E503 HydrophobicContact CD1-CB 4.44Å; F498-E503 HydrophobicContact CE1-CB 3.78Å; F498-E503 HydrophobicContact CE1-CG 3.76Å; F498-E503 HydrophobicContact CZ-CB 3.89Å; F498-E503 HydrophobicContact CZ-CG 4.03Å; F498-A506 HydrophobicContact CE2-CB 4.17Å; F498-A506 HydrophobicContact CZ-CB 4.08Å
499	K	82.8	Confident	90.3	Very high	101 Å²	101	47.1 Å²	47.1	44%	0.439	20%	0.203	S	C	.	.			trans	-70.1	158.3	178.4	-63	-176.2	-178.7	177.8	0	111	R501 L502 E503 D637	K499-R501 PolarHBondContact O-N 3Å; K499-L502 PolarHBondContact O-N 3.33Å; K499-E503 PolarHBondContact O-N 3.18Å; K499-D637 VanDerWaalsContact NZ-CG 3.26Å; K499-D637 IonicContact NZ-OD1 3.75Å; K499-D637 PolarHBondContact NZ-OD1 3.19Å; K499-D637 IonicContact NZ-OD2 3.46Å; K499-D637 PolarHBondContact NZ-OD2 3.2Å
500	R	84.3	Confident	90.2	Very high	175 Å²	175	46.9 Å²	46.9	66%	0.66	20%	0.203	S	C	*	.	H	α-helix	trans	-51.5	-33.8	-178.2	-170.3	177.1	70.2	134.3	-0.1	114.2	E503 R504	R500-E503 PolarHBondContact O-N 2.84Å; R500-R504 VanDerWaalsContact NH1-NH2 3.11Å; R500-R504 WeakPolarHBondContact O-CG 3.22Å; R500-R504 PolarHBondContact O-N 3.13Å
501	R	84.1	Confident	90	Very high	140 Å²	140	52.3 Å²	52.3	53%	0.528	23%	0.232	S	C	.	.	H	α-helix	trans	-66.3	-45.6	178.1	-168.1	-179.9	174.7	164.5	0.6	111.6	F470 E475 K499 E503 R504 L505	F470-R501 HydrophobicContact CD1-CG 3.86Å; F470-R501 HydrophobicContact CE1-CG 4.11Å; E475-R501 IonicContact OE2-CZ 3.28Å; E475-R501 VanDerWaalsContact OE2-CZ 3.29Å; E475-R501 IonicContact OE2-NE 3.25Å; E475-R501 PolarHBondContact OE2-NE 3.31Å; E475-R501 IonicContact OE2-NH2 2.69Å; E475-R501 PolarHBondContact OE2-NH2 3.43Å; K499-R501 PolarHBondContact O-N 3Å; R501-E503 VanDerWaalsContact C-N 3.34Å; R501-R504 PolarHBondContact O-N 2.8Å; R501-L505 PolarHBondContact O-N 3.13Å
502	L	88.6	Confident	89.7	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-66.5	-36.8	175.8	-177.4	60.3	0	0	0	111.8	A466 D467 F470 L493 T497 F498 K499 R504 L505 A506	A466-L502 HydrophobicContact CB-CD1 3.76Å; A466-L502 HydrophobicContact CB-CD2 4.32Å; D467-L502 HydrophobicContact CB-CD2 4.09Å; F470-L502 HydrophobicContact CD2-CD1 4.06Å; F470-L502 HydrophobicContact CE2-CD1 3.94Å; F470-L502 HydrophobicContact CZ-CD1 4.38Å; L493-L502 HydrophobicContact CD1-CD1 4.12Å; L493-L502 HydrophobicContact CD2-CD1 4.43Å; L493-L502 HydrophobicContact CD2-CD2 4.23Å; L493-L502 HydrophobicContact CD2-CG 4.48Å; T497-L502 WeakPolarHBondContact O-CD2 3.27Å; F498-L502 HydrophobicContact CD2-CD2 3.87Å; F498-L502 HydrophobicContact CD2-CG 4.07Å; F498-L502 HydrophobicContact CE2-CD2 4.38Å; F498-L502 HydrophobicContact CE2-CG 4.14Å; K499-L502 PolarHBondContact O-N 3.33Å; L502-R504 VanDerWaalsContact C-N 3.3Å; L502-R504 PolarHBondContact O-N 2.85Å; L502-L505 PolarHBondContact O-N 3.45Å; L502-A506 PolarHBondContact O-N 2.96Å
503	E	89.8	Confident	89.6	Confident	64 Å²	64	59 Å²	59	30%	0.299	27%	0.269	S	S	.	.	H	α-helix	trans	-59.5	-38.8	175.7	-175	-176.2	176.9	0	0	112.6	F498 K499 R500 R501 A506 R507	F498-E503 HydrophobicContact CD1-CB 4.44Å; F498-E503 HydrophobicContact CE1-CB 3.78Å; F498-E503 HydrophobicContact CE1-CG 3.76Å; F498-E503 HydrophobicContact CZ-CB 3.89Å; F498-E503 HydrophobicContact CZ-CG 4.03Å; K499-E503 PolarHBondContact O-N 3.18Å; R500-E503 PolarHBondContact O-N 2.84Å; R501-E503 VanDerWaalsContact C-N 3.34Å; E503-A506 PolarHBondContact O-N 3.23Å; E503-R507 WeakPolarHBondContact O-CG 3.48Å; E503-R507 PolarHBondContact O-N 2.84Å; E503-R507 IonicContact OE1-CZ 3.88Å; E503-R507 IonicContact OE1-NE 2.74Å; E503-R507 IonicContact OE1-NH2 3.15Å; E503-R507 PolarHBondContact OE1-NH2 3.02Å
504	R	90.4	Very high	89.6	Confident	123 Å²	123	59 Å²	59	46%	0.464	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-47.3	176.1	-70.5	174.5	-173.4	166.4	-5	111.8	R500 R501 L502 A506 R507 D508	R500-R504 VanDerWaalsContact NH1-NH2 3.11Å; R500-R504 WeakPolarHBondContact O-CG 3.22Å; R500-R504 PolarHBondContact O-N 3.13Å; R501-R504 PolarHBondContact O-N 2.8Å; L502-R504 VanDerWaalsContact C-N 3.3Å; L502-R504 PolarHBondContact O-N 2.85Å; R504-A506 VanDerWaalsContact C-N 3.32Å; R504-A506 PolarHBondContact O-N 3.16Å; R504-R507 PolarHBondContact O-N 3.1Å; R504-D508 PolarHBondContact O-N 2.91Å
505	L	88.9	Confident	89.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-44.3	176.1	-179.6	79.5	0	0	0	111.3	F470 V478 R479 R501 L502 R507 D508 I509	F470-L505 HydrophobicContact CE1-CB 4.08Å; F470-L505 HydrophobicContact CE1-CD2 4.48Å; F470-L505 HydrophobicContact CE2-CB 4.28Å; F470-L505 HydrophobicContact CE2-CD2 3.22Å; F470-L505 HydrophobicContact CE2-CG 4.23Å; F470-L505 HydrophobicContact CZ-CB 3.41Å; F470-L505 VanDerWaalsContact CZ-CB 3.41Å; F470-L505 HydrophobicContact CZ-CD1 4.1Å; F470-L505 HydrophobicContact CZ-CD2 3.18Å; F470-L505 HydrophobicContact CZ-CG 3.68Å; V478-L505 HydrophobicContact CG1-CD2 3.53Å; R479-L505 HydrophobicContact CB-CD1 4.25Å; R501-L505 PolarHBondContact O-N 3.13Å; L502-L505 PolarHBondContact O-N 3.45Å; L505-R507 PolarHBondContact O-N 3.2Å; L505-D508 WeakPolarHBondContact O-CA 3.42Å; L505-D508 WeakPolarHBondContact O-CB 3.27Å; L505-D508 PolarHBondContact O-N 2.86Å; L505-I509 HydrophobicContact CD1-CG2 3.89Å; L505-I509 HydrophobicContact CD2-CD1 4Å; L505-I509 HydrophobicContact CG-CD1 4.13Å; L505-I509 HydrophobicContact CG-CG1 4.47Å; L505-I509 HydrophobicContact CG-CG2 4.16Å; L505-I509 WeakPolarHBondContact O-CG1 3.49Å; L505-I509 PolarHBondContact O-N 3.08Å
506	A	92	Very high	89.8	Confident	3 Å²	3	61.8 Å²	61.8	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-56.2	-36.3	-179.9	0	0	0	0	0	111.8	I351 L493 F498 L502 E503 R504 D508 L510	I351-A506 HydrophobicContact CD1-CB 3.94Å; L493-A506 HydrophobicContact CD1-CB 4.02Å; F498-A506 HydrophobicContact CE2-CB 4.17Å; F498-A506 HydrophobicContact CZ-CB 4.08Å; L502-A506 PolarHBondContact O-N 2.96Å; E503-A506 PolarHBondContact O-N 3.23Å; R504-A506 VanDerWaalsContact C-N 3.32Å; R504-A506 PolarHBondContact O-N 3.16Å; A506-D508 VanDerWaalsContact C-N 3.32Å; A506-L510 HydrophobicContact CB-CD1 3.94Å; A506-L510 WeakPolarHBondContact O-CB 3.44Å; A506-L510 WeakPolarHBondContact O-CG 3.08Å; A506-L510 PolarHBondContact O-N 2.91Å
507	R	92.2	Very high	90.2	Very high	169 Å²	169	60.7 Å²	60.7	64%	0.638	27%	0.269	S	S	*	.	H	α-helix	trans	-69.3	-28.1	174.3	-66.3	176.6	-164.4	171.3	1.2	113.6	E503 R504 L505	E503-R507 WeakPolarHBondContact O-CG 3.48Å; E503-R507 PolarHBondContact O-N 2.84Å; E503-R507 IonicContact OE1-CZ 3.88Å; E503-R507 IonicContact OE1-NE 2.74Å; E503-R507 IonicContact OE1-NH2 3.15Å; E503-R507 PolarHBondContact OE1-NH2 3.02Å; R504-R507 PolarHBondContact O-N 3.1Å; L505-R507 PolarHBondContact O-N 3.2Å
508	D	91.4	Very high	90.7	Very high	87 Å²	87	60.9 Å²	60.9	47%	0.465	27%	0.267	S	S	.	.	H	α-helix	trans	-82.9	-30.8	-177.9	-63.3	-17.5	0	0	0	112.4	R479 R504 L505 A506	R479-D508 IonicContact CZ-OD2 3.86Å; R479-D508 IonicContact NH1-OD2 2.94Å; R479-D508 PolarHBondContact NH1-OD2 3.3Å; R479-D508 IonicContact NH2-OD2 3.81Å; R479-D508 PolarHBondContact NH2-OD2 2.95Å; R504-D508 PolarHBondContact O-N 2.91Å; L505-D508 WeakPolarHBondContact O-CA 3.42Å; L505-D508 WeakPolarHBondContact O-CB 3.27Å; L505-D508 PolarHBondContact O-N 2.86Å; A506-D508 VanDerWaalsContact C-N 3.32Å
509	I	93.4	Very high	90.3	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-107.2	-16.6	-171.5	71.6	173.9	0	0	0	115.2	F463 A482 R489 L493 L505	F463-I509 HydrophobicContact CD2-CD1 3.88Å; F463-I509 HydrophobicContact CE2-CD1 3.79Å; A482-I509 HydrophobicContact CB-CB 3.96Å; A482-I509 HydrophobicContact CB-CG2 3.7Å; R489-I509 PolarHBondContact NH2-O 3.2Å; R489-I509 VanDerWaalsContact NH2-O 3.13Å; L493-I509 HydrophobicContact CD1-CD1 4.5Å; L505-I509 HydrophobicContact CD1-CG2 3.89Å; L505-I509 HydrophobicContact CD2-CD1 4Å; L505-I509 HydrophobicContact CG-CD1 4.13Å; L505-I509 HydrophobicContact CG-CG1 4.47Å; L505-I509 HydrophobicContact CG-CG2 4.16Å; L505-I509 WeakPolarHBondContact O-CG1 3.49Å; L505-I509 PolarHBondContact O-N 3.08Å
510	L	94	Very high	89.5	Confident	16 Å²	16	60.8 Å²	60.8	8%	0.084	28%	0.276	C	S	.	.			trans	-108	148.9	-176.3	-53.8	175.2	0	0	0	111.2	D349 I351 T491 L493 A506 P513	D349-L510 HydrophobicContact CB-CB 4.42Å; D349-L510 HydrophobicContact CB-CD2 4.45Å; D349-L510 WeakPolarHBondContact OD2-CA 3.18Å; I351-L510 HydrophobicContact CD1-CD1 3.68Å; I351-L510 HydrophobicContact CG1-CD1 3.35Å; T491-L510 VanDerWaalsContact CB-CD2 3.42Å; T491-L510 HydrophobicContact CG2-CD2 3.36Å; T491-L510 WeakPolarHBondContact O-CD2 3.43Å; L493-L510 HydrophobicContact CB-CD1 4.4Å; A506-L510 HydrophobicContact CB-CD1 3.94Å; A506-L510 WeakPolarHBondContact O-CB 3.44Å; A506-L510 WeakPolarHBondContact O-CG 3.08Å; A506-L510 PolarHBondContact O-N 2.91Å; L510-P513 HydrophobicContact CB-CB 4.01Å; L510-P513 HydrophobicContact CB-CG 3.93Å; L510-P513 HydrophobicContact CD1-CB 3.83Å; L510-P513 HydrophobicContact CD1-CG 4.04Å
511	L	93.3	Very high	88.3	Confident	115 Å²	115	57.3 Å²	57.3	60%	0.602	27%	0.27	S	S	*	.	S	Bend	trans	-111.7	117.8	175.2	-175.4	69.4	0	0	0	110.8	D349	D349-L511 PolarHBondContact OD2-N 2.88Å
512	D	91.6	Very high	86.7	Confident	108 Å²	108	53.2 Å²	53.2	58%	0.578	27%	0.272	S	S	*	.	S	Bend	trans	43.3	54.1	-179.5	-67.9	-27	0	0	0	115	P303 R348	P303-D512 HydrophobicContact CG-CB 3.96Å; R348-D512 PolarHBondContact NH2-O 2.84Å
513	P	94.7	Very high	85.1	Confident	32 Å²	32	55.9 Å²	55.9	21%	0.208	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-71.9	146.9	-171.3	30.1	-36.1	0	0	0	112.8	D349 I351 L510	D349-P513 HydrophobicContact CB-CB 4.12Å; D349-P513 CarbonylContact O-C 3.54Å; D349-P513 VanDerWaalsContact O-CA 3.31Å; D349-P513 WeakPolarHBondContact O-CA 3.39Å; I351-P513 HydrophobicContact CD1-CB 4.15Å; I351-P513 HydrophobicContact CD1-CG 4.07Å; I351-P513 HydrophobicContact CG1-CB 4.15Å; L510-P513 HydrophobicContact CB-CB 4.01Å; L510-P513 HydrophobicContact CB-CG 3.93Å; L510-P513 HydrophobicContact CD1-CB 3.83Å; L510-P513 HydrophobicContact CD1-CG 4.04Å
514	V	95.6	Very high	83.4	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.4	166.3	-177.9	0	0	0	0	109	V300 P305 L343 D349 V350 I351	V300-V514 HydrophobicContact CG1-CG1 3.67Å; P305-V514 HydrophobicContact CB-CG1 4.19Å; L343-V514 HydrophobicContact CD1-CB 4.05Å; L343-V514 HydrophobicContact CD1-CG1 3.62Å; L343-V514 HydrophobicContact CD2-CB 4.15Å; L343-V514 HydrophobicContact CD2-CG1 4.17Å; L343-V514 HydrophobicContact CD2-CG2 3.93Å; D349-V514 PolarHBondContact O-N 3.38Å; V350-V514 WeakPolarHBondContact CA-O 3.38Å; I351-V514 PolarHBondContact N-O 3.1Å
515	R	95	Very high	82.2	Confident	59 Å²	59	47.7 Å²	47.7	22%	0.223	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.3	177.2	177.3	-176.4	-178.3	-148	2.1	110.4	V300 S301 I351 I517	V300-R515 CarbonylContact C-O 3.58Å; V300-R515 WeakPolarHBondContact CA-O 3.45Å; S301-R515 PolarHBondContact N-O 3.16Å; S301-R515 PolarHBondContact O-N 3.27Å; S301-R515 WeakPolarHBondContact OG-CB 3.28Å; I351-R515 HydrophobicContact CB-CB 4.16Å; I351-R515 HydrophobicContact CB-CG 4.25Å; I351-R515 HydrophobicContact CG2-CG 4.2Å; I351-R515 CarbonylContact O-C 3.52Å; I351-R515 WeakPolarHBondContact O-CA 3.43Å; R515-I517 HydrophobicContact CG-CG1 4.19Å
516	I	94.8	Very high	81.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.2	178.4	-49.2	164.5	0	0	0	107.3	L298 I336 Q339 A340 L343 V350 I351 I353	L298-I516 HydrophobicContact CD2-CG2 4.02Å; I336-I516 HydrophobicContact CD1-CB 4.26Å; I336-I516 HydrophobicContact CD1-CG2 3.78Å; Q339-I516 HydrophobicContact CB-CD1 4.37Å; Q339-I516 HydrophobicContact CB-CG2 4.12Å; Q339-I516 HydrophobicContact CG-CD1 3.94Å; Q339-I516 HydrophobicContact CG-CG1 4Å; Q339-I516 HydrophobicContact CG-CG2 3.86Å; A340-I516 HydrophobicContact CB-CD1 3.69Å; L343-I516 HydrophobicContact CD1-CD1 3.63Å; L343-I516 HydrophobicContact CD1-CG1 4.03Å; V350-I516 HydrophobicContact CG1-CD1 3.62Å; V350-I516 HydrophobicContact CG1-CG1 4.3Å; I351-I516 PolarHBondContact O-N 3.3Å; I353-I516 PolarHBondContact N-O 3.08Å
517	I	92.3	Very high	80.7	Confident	11 Å²	11	56.1 Å²	56.1	6%	0.056	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.3	176.1	-49.8	167.7	0	0	0	107	L298 R299 I353 R515 L521	L298-I517 CarbonylContact C-O 3.58Å; L298-I517 WeakPolarHBondContact CA-O 3.5Å; R299-I517 HydrophobicContact CB-CB 4.3Å; R299-I517 PolarHBondContact N-O 3.05Å; R299-I517 PolarHBondContact O-N 3.38Å; I353-I517 HydrophobicContact CB-CG1 4.46Å; I353-I517 HydrophobicContact CB-CG2 4.48Å; R515-I517 HydrophobicContact CG-CG1 4.19Å; I517-L521 HydrophobicContact CD1-CD1 4.25Å; I517-L521 HydrophobicContact CD1-CD2 4.21Å; I517-L521 HydrophobicContact CD1-CG 4.33Å; I517-L521 HydrophobicContact CG2-CD2 3.97Å; I517-L521 HydrophobicContact CG2-CG 4.16Å
518	Q	88.6	Confident	80.4	Confident	36 Å²	36	48.1 Å²	48.1	17%	0.168	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122	170.8	-176.4	-170.1	9.6	0	0	109.3	G297 L298 P335 I336 I353	G297-Q518 WeakPolarHBondContact O-CA 3.42Å; L298-Q518 HydrophobicContact CD2-CB 4.11Å; L298-Q518 HydrophobicContact CD2-CG 4.38Å; P335-Q518 HydrophobicContact CB-CG 4.13Å; I336-Q518 HydrophobicContact CD1-CB 4.48Å; I353-Q518 PolarHBondContact O-N 3.31Å
519	G	78.2	Confident	80.4	Confident	26 Å²	26	46.8 Å²	46.8	27%	0.268	26%	0.258	S	S	.	.	S	Bend	trans	80.2	-169.8	-174.4	0	0	0	0	0	113.1	G297	G297-G519 PolarHBondContact O-N 3.28Å
520	E	66.4	Low	80.3	Confident	103 Å²	103	47 Å²	47	48%	0.481	26%	0.258	S	S	.	.	S	Bend	trans	-84.5	151.3	168.7	-53.7	-157.8	133.1	0	0	112.2	R299 G522 E523	R299-E520 IonicContact CZ-OE1 3.75Å; R299-E520 IonicContact NH2-OE1 2.84Å; R299-E520 PolarHBondContact NH2-OE1 3.11Å; E520-G522 PolarHBondContact O-N 3.3Å; E520-E523 HydrophobicContact CB-CG 3.81Å; E520-E523 WeakPolarHBondContact CB-OE1 3.31Å; E520-E523 VanDerWaalsContact CG-OE1 3.24Å; E520-E523 WeakPolarHBondContact CG-OE1 3.25Å; E520-E523 PolarHBondContact N-OE2 3.29Å; E520-E523 PolarHBondContact O-N 3.26Å
521	L	59.3	Low	80.3	Confident	101 Å²	101	49.7 Å²	49.7	53%	0.529	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	105.8	-179.3	-72.2	161.2	0	0	0	109.7	I353 I517	I353-L521 HydrophobicContact CG2-CD2 4.39Å; I517-L521 HydrophobicContact CD1-CD1 4.25Å; I517-L521 HydrophobicContact CD1-CD2 4.21Å; I517-L521 HydrophobicContact CD1-CG 4.33Å; I517-L521 HydrophobicContact CG2-CD2 3.97Å; I517-L521 HydrophobicContact CG2-CG 4.16Å
522	G	50.8	Low	80.3	Confident	55 Å²	55	44.8 Å²	44.8	57%	0.567	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	103.1	5.1	176.5	0	0	0	0	0	115.3	E520	E520-G522 PolarHBondContact O-N 3.3Å
523	E	54.3	Low	80.5	Confident	60 Å²	60	43 Å²	43	28%	0.28	23%	0.234	S	C	.	.			trans	-65.8	136	174.7	-80	174.8	166.2	0	0	112.2	E520	E520-E523 HydrophobicContact CB-CG 3.81Å; E520-E523 WeakPolarHBondContact CB-OE1 3.31Å; E520-E523 VanDerWaalsContact CG-OE1 3.24Å; E520-E523 WeakPolarHBondContact CG-OE1 3.25Å; E520-E523 PolarHBondContact N-OE2 3.29Å; E520-E523 PolarHBondContact O-N 3.26Å
524	A	54.8	Low	80.5	Confident	4 Å²	4	42.5 Å²	42.5	3%	0.033	23%	0.229	C	C	.	.			trans	-64.6	151.8	165.9	0	0	0	0	0	109.9	E526 H675	A524-E526 PolarHBondContact O-N 2.72Å; A524-E526 VanDerWaalsContact O-N 3.07Å; A524-H675 VanDerWaalsContact CB-CE1 3.48Å; A524-H675 WeakPolarHBondContact CB-CE1 3.44Å; A524-H675 VanDerWaalsContact CB-NE2 3.33Å; A524-H675 WeakPolarHBondContact CB-NE2 3.48Å
525	N	64.8	Low	80.4	Confident	11 Å²	11	43.3 Å²	43.3	6%	0.059	23%	0.232	C	C	.	.			trans	-62.5	113.7	174.1	-179.1	2.2	0	0	0	110.3	K355 D527 I528 G647	K355-N525 HydrophobicContact CD-CB 4.04Å; K355-N525 WeakPolarHBondContact CD-OD1 3.31Å; K355-N525 WeakPolarHBondContact CE-OD1 3.47Å; K355-N525 PolarHBondContact NZ-OD1 2.9Å; N525-D527 PolarHBondContact O-N 3.05Å; N525-D527 VanDerWaalsContact O-N 3.12Å; N525-D527 WeakPolarHBondContact OD1-CB 3.27Å; N525-D527 PolarHBondContact OD1-N 3.26Å; N525-D527 PolarHBondContact OD1-OD2 3.43Å; N525-D527 VanDerWaalsContact OD1-OD2 3.09Å; N525-I528 HydrophobicContact CB-CD1 3.74Å; N525-I528 HydrophobicContact CB-CG1 3.98Å; N525-I528 WeakPolarHBondContact O-CB 3.2Å; N525-I528 PolarHBondContact O-N 3.14Å; N525-G647 PolarHBondContact ND2-O 3.23Å
526	E	70.5	Confident	80.3	Confident	131 Å²	131	44.7 Å²	44.7	61%	0.612	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-23.3	178.2	-62.5	-177.1	163.4	0	0	113.8	A524 I528	A524-E526 PolarHBondContact O-N 2.72Å; A524-E526 VanDerWaalsContact O-N 3.07Å; E526-I528 PolarHBondContact O-N 3.06Å; E526-I528 VanDerWaalsContact O-N 3.17Å
527	D	79.2	Confident	80.1	Confident	49 Å²	49	51.1 Å²	51.1	26%	0.262	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-7.5	176.4	-59	-50.5	0	0	0	112.3	K355 N525 K652 G653	K355-D527 IonicContact NZ-OD2 3.29Å; K355-D527 PolarHBondContact NZ-OD2 2.97Å; N525-D527 PolarHBondContact O-N 3.05Å; N525-D527 VanDerWaalsContact O-N 3.12Å; N525-D527 WeakPolarHBondContact OD1-CB 3.27Å; N525-D527 PolarHBondContact OD1-N 3.26Å; N525-D527 PolarHBondContact OD1-OD2 3.43Å; N525-D527 VanDerWaalsContact OD1-OD2 3.09Å; D527-K652 WeakPolarHBondContact O-CA 3.38Å; D527-G653 PolarHBondContact O-N 3.42Å
528	I	85.9	Confident	79.9	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	115.1	178.7	-52.5	175.2	0	0	0	109.4	N525 E526 Q530 I643 T646 G653 A655	N525-I528 HydrophobicContact CB-CD1 3.74Å; N525-I528 HydrophobicContact CB-CG1 3.98Å; N525-I528 WeakPolarHBondContact O-CB 3.2Å; N525-I528 PolarHBondContact O-N 3.14Å; E526-I528 PolarHBondContact O-N 3.06Å; E526-I528 VanDerWaalsContact O-N 3.17Å; I528-Q530 HydrophobicContact CG2-CG 4.07Å; I528-I643 HydrophobicContact CD1-CB 4.45Å; I528-I643 HydrophobicContact CD1-CG1 4.26Å; I528-I643 WeakPolarHBondContact CD1-O 3.46Å; I528-I643 HydrophobicContact CG2-CB 4.48Å; I528-T646 HydrophobicContact CG1-CG2 4.38Å; I528-T646 HydrophobicContact CG2-CG2 4.09Å; I528-G653 CarbonylContact C-O 3.58Å; I528-G653 WeakPolarHBondContact CA-O 3.34Å; I528-A655 HydrophobicContact CG2-CB 3.73Å
529	T	90.5	Very high	80	Confident	60 Å²	60	59.9 Å²	59.9	37%	0.368	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.6	168.4	-55.8	0	0	0	0	109.1	G653 T654 A655	T529-G653 PolarHBondContact N-O 3.38Å; T529-T654 WeakPolarHBondContact O-CA 3.43Å; T529-A655 PolarHBondContact O-N 3.3Å
530	Q	92.1	Very high	80.7	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.037	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126	-175.5	-61	-174.9	55.2	0	0	111.5	I528 I643 A655 L676 Q681	I528-Q530 HydrophobicContact CG2-CG 4.07Å; Q530-I643 HydrophobicContact CG-CD1 4.33Å; Q530-A655 WeakPolarHBondContact CA-O 3.4Å; Q530-L676 HydrophobicContact CB-CD2 3.62Å; Q530-L676 HydrophobicContact CG-CD2 4.37Å; Q530-Q681 HydrophobicContact CB-CG 4.16Å; Q530-Q681 HydrophobicContact CG-CG 4.38Å
531	H	93.7	Very high	81.9	Confident	73 Å²	73	57.5 Å²	57.5	34%	0.338	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.7	174.7	-64.4	-67.8	0	0	0	110	A655 Y656 T657	H531-A655 PolarHBondContact N-O 2.83Å; H531-Y656 HydrophobicContact CB-CD1 3.51Å; H531-Y656 HydrophobicContact CB-CE1 3.62Å; H531-Y656 HydrophobicContact CB-CG 4.4Å; H531-Y656 AromaticContact CD2-CE1 3.47Å; H531-Y656 VanDerWaalsContact CD2-CE1 3.47Å; H531-Y656 WeakPolarHBondContact CD2-CE1 3.4Å; H531-Y656 AromaticContact CD2-CZ 3.68Å; H531-Y656 AromaticContact CG-CE1 3.71Å; H531-Y656 CarbonylContact O-C 3.52Å; H531-Y656 WeakPolarHBondContact O-CA 3.43Å; H531-T657 PolarHBondContact O-N 3.5Å
532	V	94.4	Very high	83.5	Confident	12 Å²	12	54.8 Å²	54.8	7%	0.073	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.5	172.9	-175.7	0	0	0	0	108.9	I534 T657 F659 L672 L676 P684 L687	V532-I534 HydrophobicContact CG1-CG1 4.39Å; V532-T657 WeakPolarHBondContact CA-O 3.31Å; V532-F659 HydrophobicContact CG1-CB 4.16Å; V532-L672 HydrophobicContact CG1-CD2 4.21Å; V532-L672 HydrophobicContact CG2-CD2 3.92Å; V532-L672 HydrophobicContact CG2-CG 4.46Å; V532-L676 HydrophobicContact CG2-CD1 3.78Å; V532-P684 HydrophobicContact CB-CG 4.08Å; V532-P684 VanDerWaalsContact O-CG 3.3Å; V532-P684 WeakPolarHBondContact O-CG 3.19Å; V532-L687 HydrophobicContact CB-CD2 4.31Å; V532-L687 HydrophobicContact CG1-CD1 4.18Å; V532-L687 HydrophobicContact CG1-CD2 4.07Å; V532-L687 HydrophobicContact CG2-CD2 4.3Å
533	E	94.9	Very high	85.5	Confident	72 Å²	72	56 Å²	56	34%	0.336	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.6	179.6	-65.5	-71.6	-179	0	0	108.6	F535 W544 T657 L658 F659	E533-F535 HydrophobicContact CB-CE2 3.56Å; E533-F535 HydrophobicContact CB-CZ 3.68Å; E533-F535 WeakPolarHBondContact O-CE2 3.32Å; E533-W544 HydrophobicContact CG-CZ2 4.07Å; E533-T657 PolarHBondContact N-O 2.86Å; E533-L658 HydrophobicContact CB-CD2 3.99Å; E533-L658 HydrophobicContact CG-CD2 4.36Å; E533-F659 PolarHBondContact O-N 3.32Å
534	I	93.8	Very high	87.5	Confident	21 Å²	21	53.8 Å²	53.8	11%	0.108	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.6	-175.6	-64.8	167.3	0	0	0	109.7	V532 F659 A661 P684 R686 L687 I690	V532-I534 HydrophobicContact CG1-CG1 4.39Å; I534-F659 CarbonylContact C-O 3.58Å; I534-F659 WeakPolarHBondContact CA-O 3.49Å; I534-F659 HydrophobicContact CG1-CB 4.26Å; I534-F659 HydrophobicContact CG1-CD1 4.5Å; I534-A661 HydrophobicContact CG2-CB 4.32Å; I534-P684 HydrophobicContact CD1-CB 4.42Å; I534-R686 HydrophobicContact CB-CB 4.43Å; I534-R686 HydrophobicContact CD1-CB 3.53Å; I534-R686 HydrophobicContact CG2-CB 4.42Å; I534-L687 HydrophobicContact CD1-CB 3.57Å; I534-L687 HydrophobicContact CD1-CD1 4.08Å; I534-L687 HydrophobicContact CD1-CG 4.42Å; I534-I690 HydrophobicContact CD1-CD1 4.39Å; I534-I690 HydrophobicContact CG2-CD1 4.06Å
535	F	94.2	Very high	89.3	Confident	16 Å²	16	53.6 Å²	53.6	7%	0.07	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	148.1	179.9	-56.7	-78.9	0	0	0	110.4	E533 Q540 K541 W544 L658 F659 V660 A661	E533-F535 HydrophobicContact CB-CE2 3.56Å; E533-F535 HydrophobicContact CB-CZ 3.68Å; E533-F535 WeakPolarHBondContact O-CE2 3.32Å; F535-Q540 HydrophobicContact CB-CB 4.25Å; F535-Q540 HydrophobicContact CD1-CB 3.52Å; F535-Q540 HydrophobicContact CE1-CB 4.27Å; F535-Q540 HydrophobicContact CG-CB 4.19Å; F535-K541 HydrophobicContact CD2-CG 3.82Å; F535-K541 HydrophobicContact CE2-CG 4.27Å; F535-K541 HydrophobicContact CG-CG 4.22Å; F535-W544 HydrophobicContact CE1-CB 3.79Å; F535-W544 HydrophobicContact CE1-CG 4.12Å; F535-W544 HydrophobicContact CZ-CB 3.59Å; F535-W544 AromaticContact CZ-CD1 3.7Å; F535-W544 HydrophobicContact CZ-CD2 4.29Å; F535-W544 AromaticContact CZ-CG 3.58Å; F535-W544 HydrophobicContact CZ-CG 3.58Å; F535-L658 HydrophobicContact CD2-CB 4.29Å; F535-L658 HydrophobicContact CE2-CB 3.8Å; F535-L658 HydrophobicContact CE2-CD2 3.8Å; F535-L658 HydrophobicContact CE2-CG 4.24Å; F535-L658 HydrophobicContact CZ-CD2 4.22Å; F535-F659 PolarHBondContact N-O 3.06Å; F535-V660 CarbonylContact O-C 3.58Å; F535-V660 WeakPolarHBondContact O-CA 3.2Å; F535-A661 PolarHBondContact O-N 3.4Å
536	D	92.4	Very high	90.6	Very high	88 Å²	88	54.1 Å²	54.1	47%	0.471	26%	0.264	S	S	.	.	S	Bend	trans	-90.6	-28.8	174.9	-64.1	-60.7	0	0	0	111.3	R686	D536-R686 IonicContact OD1-CZ 2.69Å; D536-R686 IonicContact OD1-NH1 3.21Å; D536-R686 IonicContact OD1-NH2 3.68Å; D536-R686 PolarHBondContact OD1-NH2 3.13Å; D536-R686 IonicContact OD2-CZ 3.84Å; D536-R686 IonicContact OD2-NH1 3.94Å; D536-R686 PolarHBondContact OD2-NH1 2.93Å; D536-R686 VanDerWaalsContact OD2-NH1 3.12Å; D536-R686 IonicContact OD2-NH2 2.76Å; D536-R686 PolarHBondContact OD2-NH2 3.14Å
537	K	90.9	Very high	91.6	Very high	136 Å²	136	56.1 Å²	56.1	59%	0.591	27%	0.266	S	S	*	.	S	Bend	trans	-124.6	145.9	179.4	-62.8	-176.4	-179.9	-176.5	0	110.7	E539 Q540	K537-E539 VanDerWaalsContact C-N 3.3Å; K537-E539 PolarHBondContact O-N 3.46Å; K537-Q540 HydrophobicContact CB-CG 4.26Å; K537-Q540 WeakPolarHBondContact O-CB 3.49Å; K537-Q540 PolarHBondContact O-N 3.2Å
538	I	89.3	Confident	92.3	Very high	81 Å²	81	55.2 Å²	55.2	42%	0.415	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-39.1	-179.5	-58.9	167.4	0	0	0	111.4	Q540 K541 V660 K663	I538-Q540 PolarHBondContact O-N 3.12Å; I538-K541 VanDerWaalsContact O-CB 3.24Å; I538-K541 WeakPolarHBondContact O-CB 3.44Å; I538-K541 PolarHBondContact O-N 3.05Å; I538-V660 HydrophobicContact CG1-CG1 4.28Å; I538-V660 HydrophobicContact CG1-CG2 4.38Å; I538-K663 HydrophobicContact CD1-CD 3.68Å; I538-K663 HydrophobicContact CG1-CD 3.93Å
539	E	90.2	Very high	92.6	Very high	150 Å²	150	55.2 Å²	55.2	70%	0.701	26%	0.261	S	S	*	.	H	α-helix	trans	-58	-33.4	-178.1	-65	170.7	-179.4	0	0	112.8	K537 K541 W542 D543	K537-E539 VanDerWaalsContact C-N 3.3Å; K537-E539 PolarHBondContact O-N 3.46Å; E539-K541 PolarHBondContact O-N 3.44Å; E539-K541 VanDerWaalsContact O-N 3.17Å; E539-W542 WeakPolarHBondContact O-CB 3.36Å; E539-W542 PolarHBondContact O-N 3.04Å; E539-D543 PolarHBondContact O-N 3.35Å
540	Q	91.8	Very high	92.6	Very high	72 Å²	72	56.9 Å²	56.9	34%	0.336	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-24.6	179.3	-62.7	173.6	-15.9	0	0	112.5	F535 K537 I538 W542 D543 W544	F535-Q540 HydrophobicContact CB-CB 4.25Å; F535-Q540 HydrophobicContact CD1-CB 3.52Å; F535-Q540 HydrophobicContact CE1-CB 4.27Å; F535-Q540 HydrophobicContact CG-CB 4.19Å; K537-Q540 HydrophobicContact CB-CG 4.26Å; K537-Q540 WeakPolarHBondContact O-CB 3.49Å; K537-Q540 PolarHBondContact O-N 3.2Å; I538-Q540 PolarHBondContact O-N 3.12Å; Q540-W542 VanDerWaalsContact C-N 3.33Å; Q540-D543 PolarHBondContact O-N 2.96Å; Q540-W544 WeakPolarHBondContact O-CB 3.06Å; Q540-W544 PolarHBondContact O-N 2.99Å
541	K	92.8	Very high	92.6	Very high	7 Å²	7	61.3 Å²	61.3	3%	0.03	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-41.9	174.4	-67.3	-175.6	145.8	-176.5	0	111.4	F535 I538 E539 W544 L545 Y630 L658 V660 D664	F535-K541 HydrophobicContact CD2-CG 3.82Å; F535-K541 HydrophobicContact CE2-CG 4.27Å; F535-K541 HydrophobicContact CG-CG 4.22Å; I538-K541 VanDerWaalsContact O-CB 3.24Å; I538-K541 WeakPolarHBondContact O-CB 3.44Å; I538-K541 PolarHBondContact O-N 3.05Å; E539-K541 PolarHBondContact O-N 3.44Å; E539-K541 VanDerWaalsContact O-N 3.17Å; K541-W544 PolarHBondContact O-N 3.08Å; K541-L545 WeakPolarHBondContact O-CB 3.39Å; K541-L545 PolarHBondContact O-N 3.14Å; K541-Y630 HydrophobicContact CB-CE2 3.89Å; K541-Y630 WeakPolarHBondContact CE-O 3.26Å; K541-Y630 PolarHBondContact NZ-O 3.12Å; K541-L658 HydrophobicContact CB-CD1 4.2Å; K541-L658 HydrophobicContact CD-CB 4.21Å; K541-L658 VanDerWaalsContact CE-C 3.48Å; K541-L658 WeakPolarHBondContact CE-O 3.5Å; K541-L658 HydrophobicContact CG-CB 4.2Å; K541-L658 HydrophobicContact CG-CD1 4.46Å; K541-L658 PolarHBondContact NZ-O 2.82Å; K541-V660 HydrophobicContact CD-CG2 3.58Å; K541-V660 HydrophobicContact CG-CG2 4.15Å; K541-D664 IonicContact NZ-OD2 3.2Å
542	W	93	Very high	92.6	Very high	43 Å²	43	57.8 Å²	57.8	16%	0.163	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-43.9	179.4	179.8	-102.9	0	0	0	111.3	E539 Q540 W544 L545 T546 K574 L575	E539-W542 WeakPolarHBondContact O-CB 3.36Å; E539-W542 PolarHBondContact O-N 3.04Å; Q540-W542 VanDerWaalsContact C-N 3.33Å; W542-W544 VanDerWaalsContact C-N 3.33Å; W542-W544 PolarHBondContact O-N 2.8Å; W542-L545 HydrophobicContact CE3-CD2 4.39Å; W542-L545 HydrophobicContact CZ3-CD2 4.25Å; W542-L545 PolarHBondContact O-N 2.63Å; W542-T546 HydrophobicContact CD2-CG2 4.17Å; W542-T546 HydrophobicContact CH2-CG2 4.24Å; W542-T546 HydrophobicContact CZ2-CG2 3.71Å; W542-T546 WeakPolarHBondContact O-CG2 3.49Å; W542-T546 PolarHBondContact O-N 2.66Å; W542-T546 PolarHBondContact O-OG1 2.62Å; W542-K574 HydrophobicContact CH2-CB 3.21Å; W542-K574 HydrophobicContact CH2-CD 4.25Å; W542-K574 HydrophobicContact CH2-CG 4.32Å; W542-K574 HydrophobicContact CZ2-CB 3.68Å; W542-K574 HydrophobicContact CZ3-CB 3.85Å; W542-K574 HydrophobicContact CZ3-CD 4.24Å; W542-L575 HydrophobicContact CH2-CD2 3.91Å; W542-L575 HydrophobicContact CH2-CG 4.12Å; W542-L575 HydrophobicContact CZ3-CD2 4.34Å; W542-L575 HydrophobicContact CZ3-CG 4.44Å
543	D	92.8	Very high	92.3	Very high	81 Å²	81	59 Å²	59	43%	0.433	28%	0.278	S	S	.	.	H	α-helix	trans	-65.2	-37.6	176.9	-67.2	-22.4	0	0	0	112	E539 Q540 T546 R547	E539-D543 PolarHBondContact O-N 3.35Å; Q540-D543 PolarHBondContact O-N 2.96Å; D543-T546 PolarHBondContact O-OG1 2.79Å; D543-R547 WeakPolarHBondContact O-CB 3.49Å; D543-R547 VanDerWaalsContact O-CG 3.26Å; D543-R547 WeakPolarHBondContact O-CG 3.11Å; D543-R547 PolarHBondContact O-N 3.12Å; D543-R547 PolarHBondContact O-NE 3.3Å
544	W	95.2	Very high	92.1	Very high	14 Å²	14	61.2 Å²	61.2	5%	0.053	30%	0.297	C	S	.	.	H	α-helix	trans	-66.3	-46.6	174.2	-177.8	98.5	0	0	0	111.4	E533 F535 Q540 K541 W542 T546 R547 N548 L552 I628 Y656 L658	E533-W544 HydrophobicContact CG-CZ2 4.07Å; F535-W544 HydrophobicContact CE1-CB 3.79Å; F535-W544 HydrophobicContact CE1-CG 4.12Å; F535-W544 HydrophobicContact CZ-CB 3.59Å; F535-W544 AromaticContact CZ-CD1 3.7Å; F535-W544 HydrophobicContact CZ-CD2 4.29Å; F535-W544 AromaticContact CZ-CG 3.58Å; F535-W544 HydrophobicContact CZ-CG 3.58Å; Q540-W544 WeakPolarHBondContact O-CB 3.06Å; Q540-W544 PolarHBondContact O-N 2.99Å; K541-W544 PolarHBondContact O-N 3.08Å; W542-W544 VanDerWaalsContact C-N 3.33Å; W542-W544 PolarHBondContact O-N 2.8Å; W544-T546 PolarHBondContact O-N 3.11Å; W544-R547 PolarHBondContact O-N 3.26Å; W544-N548 VanDerWaalsContact CE2-ND2 3.28Å; W544-N548 HydrophobicContact CH2-CB 4.34Å; W544-N548 HydrophobicContact CZ2-CB 4.38Å; W544-N548 HydrophobicContact CZ3-CB 4.47Å; W544-N548 PolarHBondContact NE1-ND2 3.21Å; W544-N548 WeakPolarHBondContact O-CB 3.5Å; W544-N548 PolarHBondContact O-N 3.34Å; W544-N548 VanDerWaalsContact O-N 3.07Å; W544-N548 PolarHBondContact O-ND2 3.17Å; W544-L552 HydrophobicContact CH2-CD1 4.46Å; W544-I628 HydrophobicContact CZ3-CD1 4.48Å; W544-I628 HydrophobicContact CZ3-CG2 4.12Å; W544-Y656 AromaticContact CH2-CD1 3.61Å; W544-Y656 HydrophobicContact CH2-CD1 3.61Å; W544-Y656 HydrophobicContact CH2-CD2 4.18Å; W544-Y656 HydrophobicContact CH2-CE1 4.34Å; W544-Y656 AromaticContact CH2-CG 3.52Å; W544-Y656 HydrophobicContact CH2-CG 3.52Å; W544-Y656 AromaticContact CZ2-CD1 3.46Å; W544-Y656 HydrophobicContact CZ2-CD1 3.46Å; W544-Y656 VanDerWaalsContact CZ2-CD1 3.46Å; W544-Y656 AromaticContact CZ2-CE1 3.97Å; W544-Y656 HydrophobicContact CZ2-CE1 3.97Å; W544-Y656 AromaticContact CZ2-CG 3.91Å; W544-Y656 HydrophobicContact CZ2-CG 3.91Å; W544-L658 HydrophobicContact CD2-CD2 3.76Å; W544-L658 HydrophobicContact CE3-CD1 3.71Å; W544-L658 HydrophobicContact CE3-CD2 3.43Å; W544-L658 VanDerWaalsContact CE3-CD2 3.43Å; W544-L658 HydrophobicContact CE3-CG 4.19Å; W544-L658 HydrophobicContact CH2-CD2 3.94Å; W544-L658 HydrophobicContact CZ2-CD2 4.18Å; W544-L658 HydrophobicContact CZ3-CD1 4.09Å; W544-L658 HydrophobicContact CZ3-CD2 3.55Å; W544-L658 HydrophobicContact CZ3-CG 4.32Å
545	L	93.6	Very high	91.7	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-53.8	-179	179.1	65.7	0	0	0	109.6	K541 W542 R547 N548 L549 I560 L575 I628 Y630	K541-L545 WeakPolarHBondContact O-CB 3.39Å; K541-L545 PolarHBondContact O-N 3.14Å; W542-L545 HydrophobicContact CE3-CD2 4.39Å; W542-L545 HydrophobicContact CZ3-CD2 4.25Å; W542-L545 PolarHBondContact O-N 2.63Å; L545-R547 PolarHBondContact O-N 3.31Å; L545-N548 PolarHBondContact O-N 3.03Å; L545-L549 HydrophobicContact CD1-CD1 4.44Å; L545-L549 VanDerWaalsContact O-CB 3.25Å; L545-L549 WeakPolarHBondContact O-CB 3.31Å; L545-L549 PolarHBondContact O-N 3.09Å; L545-I560 HydrophobicContact CD1-CD1 4.06Å; L545-I560 HydrophobicContact CD2-CD1 4.47Å; L545-L575 HydrophobicContact CD2-CD2 4.41Å; L545-I628 HydrophobicContact CD1-CD1 3.73Å; L545-I628 HydrophobicContact CD1-CG2 4.26Å; L545-Y630 HydrophobicContact CB-CE2 4.27Å; L545-Y630 HydrophobicContact CD2-CD2 3.93Å; L545-Y630 HydrophobicContact CD2-CE2 3.88Å
546	T	91.5	Very high	91.4	Very high	22 Å²	22	64.3 Å²	64.3	14%	0.135	32%	0.317	C	S	.	.	H	α-helix	trans	-66.8	-34.8	-174.6	55.7	0	0	0	0	113.8	W542 D543 W544 R578	W542-T546 HydrophobicContact CD2-CG2 4.17Å; W542-T546 HydrophobicContact CH2-CG2 4.24Å; W542-T546 HydrophobicContact CZ2-CG2 3.71Å; W542-T546 WeakPolarHBondContact O-CG2 3.49Å; W542-T546 PolarHBondContact O-N 2.66Å; W542-T546 PolarHBondContact O-OG1 2.62Å; D543-T546 PolarHBondContact O-OG1 2.79Å; W544-T546 PolarHBondContact O-N 3.11Å; T546-R578 PolarHBondContact OG1-NH1 3.1Å
547	R	92.4	Very high	91.4	Very high	172 Å²	172	60.4 Å²	60.4	65%	0.649	30%	0.296	S	S	*	.	H	α-helix	trans	-68.2	-36.8	174.2	-76.2	-179.2	-68.9	141.8	-5.7	113	D543 W544 L545	D543-R547 WeakPolarHBondContact O-CB 3.49Å; D543-R547 VanDerWaalsContact O-CG 3.26Å; D543-R547 WeakPolarHBondContact O-CG 3.11Å; D543-R547 PolarHBondContact O-N 3.12Å; D543-R547 PolarHBondContact O-NE 3.3Å; W544-R547 PolarHBondContact O-N 3.26Å; L545-R547 PolarHBondContact O-N 3.31Å
548	N	93.4	Very high	91.5	Very high	31 Å²	31	53.9 Å²	53.9	17%	0.166	27%	0.268	C	S	.	.	H	α-helix	trans	-88.2	-24.2	-176.7	-75.5	-79.9	0	0	0	113.4	W544 L545 V550 R551 L552	W544-N548 VanDerWaalsContact CE2-ND2 3.28Å; W544-N548 HydrophobicContact CH2-CB 4.34Å; W544-N548 HydrophobicContact CZ2-CB 4.38Å; W544-N548 HydrophobicContact CZ3-CB 4.47Å; W544-N548 PolarHBondContact NE1-ND2 3.21Å; W544-N548 WeakPolarHBondContact O-CB 3.5Å; W544-N548 PolarHBondContact O-N 3.34Å; W544-N548 VanDerWaalsContact O-N 3.07Å; W544-N548 PolarHBondContact O-ND2 3.17Å; L545-N548 PolarHBondContact O-N 3.03Å; N548-V550 VanDerWaalsContact C-N 3.31Å; N548-V550 PolarHBondContact O-N 3.01Å; N548-R551 WeakPolarHBondContact O-CB 3.3Å; N548-R551 PolarHBondContact O-N 2.91Å; N548-L552 HydrophobicContact CB-CD1 4.07Å; N548-L552 HydrophobicContact CB-CG 4.4Å; N548-L552 WeakPolarHBondContact O-CG 3.44Å; N548-L552 PolarHBondContact O-N 3Å
549	L	92	Very high	91.8	Very high	1 Å²	1	50 Å²	50	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-58.2	-41.3	-169	-163.7	56.2	0	0	0	113	L545 R551 L552 T553 V558 I560 L575 L580 I608	L545-L549 HydrophobicContact CD1-CD1 4.44Å; L545-L549 VanDerWaalsContact O-CB 3.25Å; L545-L549 WeakPolarHBondContact O-CB 3.31Å; L545-L549 PolarHBondContact O-N 3.09Å; L549-R551 VanDerWaalsContact C-N 3.35Å; L549-R551 PolarHBondContact O-N 3.2Å; L549-L552 PolarHBondContact O-N 3Å; L549-T553 HydrophobicContact CD1-CG2 4.45Å; L549-T553 HydrophobicContact CG-CG2 4.46Å; L549-T553 WeakPolarHBondContact O-CG2 3.42Å; L549-T553 PolarHBondContact O-N 2.87Å; L549-T553 PolarHBondContact O-OG1 2.86Å; L549-V558 HydrophobicContact CD1-CG1 4.13Å; L549-I560 HydrophobicContact CD1-CD1 4.31Å; L549-L575 HydrophobicContact CD2-CD1 4.47Å; L549-L575 HydrophobicContact CD2-CD2 3.52Å; L549-L580 HydrophobicContact CD2-CD1 3.53Å; L549-L580 HydrophobicContact CG-CD1 4.45Å; L549-I608 HydrophobicContact CD1-CD1 4.07Å; L549-I608 HydrophobicContact CD1-CG1 4.19Å; L549-I608 HydrophobicContact CD2-CD1 3.79Å; L549-I608 HydrophobicContact CG-CD1 3.89Å
550	V	89.9	Confident	92.1	Very high	94 Å²	94	42.9 Å²	42.9	57%	0.57	22%	0.215	S	C	*	.	H	α-helix	trans	-60.9	-42.3	178.3	-178.9	0	0	0	0	111.9	N548 T553 T554	N548-V550 VanDerWaalsContact C-N 3.31Å; N548-V550 PolarHBondContact O-N 3.01Å; V550-T553 PolarHBondContact O-OG1 3.37Å; V550-T554 PolarHBondContact O-N 3.42Å; V550-T554 PolarHBondContact O-OG1 3.14Å
551	R	92.9	Very high	92.2	Very high	101 Å²	101	39.5 Å²	39.5	38%	0.381	20%	0.199	S	C	.	.	H	α-helix	trans	-63.9	-49.4	174.8	-179.6	-177.7	67.3	89.5	-4.9	110.3	N548 L549 T553 T554 E555 Y656	N548-R551 WeakPolarHBondContact O-CB 3.3Å; N548-R551 PolarHBondContact O-N 2.91Å; L549-R551 VanDerWaalsContact C-N 3.35Å; L549-R551 PolarHBondContact O-N 3.2Å; R551-T553 VanDerWaalsContact C-N 3.33Å; R551-T553 PolarHBondContact O-N 3.18Å; R551-T554 WeakPolarHBondContact O-CB 3.39Å; R551-T554 PolarHBondContact O-N 3.19Å; R551-E555 IonicContact CZ-OE1 3.88Å; R551-E555 IonicContact NH1-OE1 3.47Å; R551-E555 PolarHBondContact NH1-OE1 3.31Å; R551-E555 IonicContact NH1-OE2 2.61Å; R551-E555 PolarHBondContact O-N 3.21Å; R551-Y656 PolarHBondContact NH2-OH 3.16Å
552	L	92.5	Very high	92.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-35.7	-176.4	-63	175.4	0	0	0	112.6	W544 N548 L549 T554 E555 G556 V558 N626 I628 Y656	W544-L552 HydrophobicContact CH2-CD1 4.46Å; N548-L552 HydrophobicContact CB-CD1 4.07Å; N548-L552 HydrophobicContact CB-CG 4.4Å; N548-L552 WeakPolarHBondContact O-CG 3.44Å; N548-L552 PolarHBondContact O-N 3Å; L549-L552 PolarHBondContact O-N 3Å; L552-T554 VanDerWaalsContact C-N 3.26Å; L552-T554 PolarHBondContact O-N 3.45Å; L552-E555 PolarHBondContact O-N 3.18Å; L552-G556 PolarHBondContact O-N 3.46Å; L552-G556 VanDerWaalsContact O-O 3.08Å; L552-V558 HydrophobicContact CB-CG2 3.86Å; L552-N626 HydrophobicContact CB-CB 4.48Å; L552-N626 PolarHBondContact O-ND2 2.97Å; L552-I628 HydrophobicContact CD1-CD1 3.52Å; L552-I628 HydrophobicContact CD1-CG1 4.22Å; L552-Y656 HydrophobicContact CD1-CD2 4.38Å; L552-Y656 HydrophobicContact CD1-CE2 4.38Å; L552-Y656 HydrophobicContact CD2-CD2 4.23Å; L552-Y656 HydrophobicContact CD2-CE2 3.49Å; L552-Y656 VanDerWaalsContact CD2-CE2 3.49Å
553	T	90.1	Very high	92.2	Very high	38 Å²	38	38.7 Å²	38.7	23%	0.233	20%	0.199	C	C	.	.	H	α-helix	trans	-71.6	-20.4	175.3	51.6	0	0	0	0	113.4	L549 V550 R551 G556 V558 P607 I608	L549-T553 HydrophobicContact CD1-CG2 4.45Å; L549-T553 HydrophobicContact CG-CG2 4.46Å; L549-T553 WeakPolarHBondContact O-CG2 3.42Å; L549-T553 PolarHBondContact O-N 2.87Å; L549-T553 PolarHBondContact O-OG1 2.86Å; V550-T553 PolarHBondContact O-OG1 3.37Å; R551-T553 VanDerWaalsContact C-N 3.33Å; R551-T553 PolarHBondContact O-N 3.18Å; T553-G556 WeakPolarHBondContact CA-O 3.1Å; T553-V558 HydrophobicContact CG2-CG2 3.87Å; T553-P607 HydrophobicContact CG2-CB 4.14Å; T553-P607 HydrophobicContact CG2-CG 4.17Å; T553-I608 HydrophobicContact CG2-CD1 3.88Å; T553-I608 HydrophobicContact CG2-CG1 3.65Å
554	T	88.7	Confident	91.9	Very high	117 Å²	117	43.6 Å²	43.6	72%	0.718	21%	0.212	S	C	*	.	H	α-helix	trans	-78.6	-32.9	174.7	-53.8	0	0	0	0	111.1	V550 R551 L552	V550-T554 PolarHBondContact O-N 3.42Å; V550-T554 PolarHBondContact O-OG1 3.14Å; R551-T554 WeakPolarHBondContact O-CB 3.39Å; R551-T554 PolarHBondContact O-N 3.19Å; L552-T554 VanDerWaalsContact C-N 3.26Å; L552-T554 PolarHBondContact O-N 3.45Å
555	E	86.1	Confident	91.6	Very high	82 Å²	82	47.5 Å²	47.5	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-74.8	-30.8	176.4	-67.1	166.9	-173.8	0	0	112.4	R551 L552 N626	R551-E555 IonicContact CZ-OE1 3.88Å; R551-E555 IonicContact NH1-OE1 3.47Å; R551-E555 PolarHBondContact NH1-OE1 3.31Å; R551-E555 IonicContact NH1-OE2 2.61Å; R551-E555 PolarHBondContact O-N 3.21Å; L552-E555 PolarHBondContact O-N 3.18Å; E555-N626 PolarHBondContact OE2-ND2 3.24Å
556	G	87.6	Confident	91.5	Very high	21 Å²	21	51.2 Å²	51.2	22%	0.216	25%	0.251	C	S	.	.	S	Bend	trans	165.9	-166.7	175.5	0	0	0	0	0	113.5	L552 T553	L552-G556 PolarHBondContact O-N 3.46Å; L552-G556 VanDerWaalsContact O-O 3.08Å; T553-G556 WeakPolarHBondContact CA-O 3.1Å
557	S	92.4	Very high	91.5	Very high	5 Å²	5	51.8 Å²	51.8	4%	0.035	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	141.4	177.3	-51.7	0	0	0	0	111	P607 S623 H625 N626	S557-P607 CarbonylContact C-O 3.54Å; S557-P607 WeakPolarHBondContact CA-O 3.33Å; S557-S623 VanDerWaalsContact CB-O 3.29Å; S557-S623 WeakPolarHBondContact CB-O 3.12Å; S557-S623 PolarHBondContact N-O 3.43Å; S557-S623 PolarHBondContact OG-O 2.85Å; S557-H625 PolarHBondContact O-N 2.85Å; S557-H625 VanDerWaalsContact O-N 3.11Å; S557-N626 PolarHBondContact O-N 3.45Å; S557-N626 VanDerWaalsContact O-N 3.13Å
558	V	94.6	Very high	91.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.1	-174.8	-175.2	0	0	0	0	109.9	L549 L552 T553 I560 P607 I608 L609 N626 I628	L549-V558 HydrophobicContact CD1-CG1 4.13Å; L552-V558 HydrophobicContact CB-CG2 3.86Å; T553-V558 HydrophobicContact CG2-CG2 3.87Å; V558-I560 HydrophobicContact CG1-CG1 3.97Å; V558-P607 PolarHBondContact N-O 2.84Å; V558-I608 HydrophobicContact CB-CG1 4.39Å; V558-I608 WeakPolarHBondContact O-CA 3.5Å; V558-L609 PolarHBondContact O-N 3.37Å; V558-N626 CarbonylContact C-O 3.09Å; V558-N626 WeakPolarHBondContact CA-O 3.43Å; V558-N626 HydrophobicContact CG1-CB 4.45Å; V558-N626 HydrophobicContact CG2-CB 4.06Å; V558-I628 HydrophobicContact CG1-CD1 3.55Å; V558-I628 HydrophobicContact CG1-CG1 3.96Å
559	L	94.7	Very high	91.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.5	171.3	178.1	60.4	0	0	0	110	F561 L609 A611 I624 N626 V627 I628 R645	L559-F561 HydrophobicContact CD2-CD2 4.42Å; L559-F561 HydrophobicContact CD2-CE2 3.53Å; L559-F561 HydrophobicContact CD2-CZ 3.68Å; L559-F561 HydrophobicContact CG-CD2 4.31Å; L559-F561 HydrophobicContact CG-CE2 3.89Å; L559-F561 HydrophobicContact CG-CZ 4.26Å; L559-L609 CarbonylContact C-O 3.6Å; L559-L609 WeakPolarHBondContact CA-O 3.46Å; L559-L609 HydrophobicContact CD1-CB 4.03Å; L559-L609 HydrophobicContact CD1-CD2 3.9Å; L559-L609 HydrophobicContact CD1-CG 3.85Å; L559-L609 WeakPolarHBondContact CD1-O 3.33Å; L559-A611 HydrophobicContact CD1-CB 3.81Å; L559-I624 HydrophobicContact CB-CD1 4.22Å; L559-I624 HydrophobicContact CB-CG2 4.05Å; L559-I624 HydrophobicContact CD2-CD1 3.91Å; L559-N626 PolarHBondContact N-O 3.49Å; L559-V627 CarbonylContact O-C 3.58Å; L559-V627 WeakPolarHBondContact O-CA 3.38Å; L559-I628 PolarHBondContact O-N 2.85Å; L559-R645 HydrophobicContact CD2-CB 3.77Å; L559-R645 HydrophobicContact CD2-CG 3.74Å
560	I	95.6	Very high	91.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.4	-179.1	-54	176.5	0	0	0	109.4	L545 L549 V558 L575 I608 L609 V610 A611 I628	L545-I560 HydrophobicContact CD1-CD1 4.06Å; L545-I560 HydrophobicContact CD2-CD1 4.47Å; L549-I560 HydrophobicContact CD1-CD1 4.31Å; V558-I560 HydrophobicContact CG1-CG1 3.97Å; I560-L575 HydrophobicContact CD1-CD1 3.94Å; I560-I608 HydrophobicContact CD1-CG2 3.69Å; I560-I608 HydrophobicContact CG1-CG2 4.28Å; I560-L609 PolarHBondContact N-O 3.33Å; I560-V610 HydrophobicContact CB-CG2 4.29Å; I560-V610 HydrophobicContact CD1-CG2 4.39Å; I560-V610 CarbonylContact O-C 3.51Å; I560-V610 WeakPolarHBondContact O-CA 3.28Å; I560-A611 PolarHBondContact O-N 2.88Å; I560-I628 CarbonylContact C-O 3.58Å; I560-I628 WeakPolarHBondContact CA-O 3.21Å; I560-I628 HydrophobicContact CG1-CB 4.33Å; I560-I628 HydrophobicContact CG1-CD1 4.29Å
561	F	95.7	Very high	91.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.3	179.2	-84.3	-69.5	0	0	0	113	L559 A611 S616 V627 I628 Y630 E631 R642 R645	L559-F561 HydrophobicContact CD2-CD2 4.42Å; L559-F561 HydrophobicContact CD2-CE2 3.53Å; L559-F561 HydrophobicContact CD2-CZ 3.68Å; L559-F561 HydrophobicContact CG-CD2 4.31Å; L559-F561 HydrophobicContact CG-CE2 3.89Å; L559-F561 HydrophobicContact CG-CZ 4.26Å; F561-A611 WeakPolarHBondContact CA-O 3.48Å; F561-S616 WeakPolarHBondContact CE1-OG 3.25Å; F561-V627 HydrophobicContact CD2-CG1 3.75Å; F561-V627 HydrophobicContact CE2-CG1 3.89Å; F561-I628 PolarHBondContact N-O 3.05Å; F561-Y630 WeakPolarHBondContact O-CB 3.48Å; F561-Y630 PolarHBondContact O-N 3.03Å; F561-E631 PolarHBondContact O-N 3.05Å; F561-R642 HydrophobicContact CD1-CG 3.93Å; F561-R642 HydrophobicContact CD2-CB 3.74Å; F561-R642 HydrophobicContact CD2-CG 3.81Å; F561-R642 HydrophobicContact CE1-CG 3.9Å; F561-R642 HydrophobicContact CE2-CB 3.61Å; F561-R642 HydrophobicContact CE2-CG 3.8Å; F561-R642 HydrophobicContact CG-CB 4.31Å; F561-R642 HydrophobicContact CG-CG 3.88Å; F561-R642 HydrophobicContact CZ-CB 4.08Å; F561-R642 HydrophobicContact CZ-CG 3.84Å; F561-R645 HydrophobicContact CE2-CG 4.04Å; F561-R645 HydrophobicContact CZ-CG 3.95Å
562	V	94	Very high	91.9	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	143.9	174.4	-172.7	0	0	0	0	108.9	H567 V571 V610 A611 T612 Y630 E631	V562-H567 HydrophobicContact CG1-CB 3.67Å; V562-V571 HydrophobicContact CG2-CG2 4.4Å; V562-V610 HydrophobicContact CG2-CG1 4.05Å; V562-A611 PolarHBondContact N-O 2.88Å; V562-T612 WeakPolarHBondContact O-CA 3.39Å; V562-Y630 HydrophobicContact CG2-CD1 4.38Å; V562-E631 HydrophobicContact CG1-CG 4.48Å; V562-E631 WeakPolarHBondContact CG1-OE2 3.35Å
563	T	89.9	Confident	92	Very high	33 Å²	33	46.2 Å²	46.2	20%	0.202	23%	0.231	C	C	.	.	S	Bend	trans	-80.3	-41	-175.1	63.4	0	0	0	0	112.8	E631 V632	T563-E631 WeakPolarHBondContact CA-OE2 3.47Å; T563-E631 VanDerWaalsContact CB-OE2 3.29Å; T563-E631 WeakPolarHBondContact CB-OE2 3.14Å; T563-E631 HydrophobicContact CG2-CB 3.87Å; T563-E631 PolarHBondContact N-OE2 2.86Å; T563-E631 PolarHBondContact OG1-OE2 3.32Å; T563-V632 VanDerWaalsContact CG2-O 3.31Å; T563-V632 WeakPolarHBondContact CG2-O 3.37Å
564	R	87.9	Confident	92.2	Very high	185 Å²	185	49 Å²	49	70%	0.698	24%	0.24	S	C	*	.	S	Bend	trans	-101.4	144.6	-175.2	-61.9	-177.8	-177	-171.7	-1.9	111.4	H567 S568	R564-H567 HydrophobicContact CB-CB 4.28Å; R564-H567 PolarHBondContact O-N 3.26Å; R564-S568 PolarHBondContact O-N 2.86Å
565	K	89	Confident	92.4	Very high	95 Å²	95	43.4 Å²	43.4	41%	0.413	21%	0.206	S	C	.	.	H	α-helix	trans	-60	-49.3	177.8	74.5	-178.7	-172.2	-179.4	0	112.3	H567 S568 E569 D588	K565-H567 VanDerWaalsContact C-N 3.27Å; K565-H567 PolarHBondContact O-N 2.98Å; K565-S568 WeakPolarHBondContact O-CA 3.43Å; K565-S568 WeakPolarHBondContact O-CB 3.4Å; K565-S568 PolarHBondContact O-N 3.46Å; K565-S568 PolarHBondContact O-OG 3.02Å; K565-E569 PolarHBondContact O-N 3.42Å; K565-D588 WeakPolarHBondContact CD-OD2 3.32Å; K565-D588 WeakPolarHBondContact CE-OD2 3.24Å; K565-D588 IonicContact NZ-OD2 3.07Å; K565-D588 PolarHBondContact NZ-OD2 3.06Å
566	V	91.6	Very high	92.8	Very high	78 Å²	78	44.8 Å²	44.8	47%	0.473	21%	0.211	S	C	.	.	H	α-helix	trans	-57.9	-45	-177.8	-177.6	0	0	0	0	110.1	S568 E569 E570	V566-S568 VanDerWaalsContact C-N 3.33Å; V566-S568 PolarHBondContact O-N 3.23Å; V566-E569 WeakPolarHBondContact O-CB 3.49Å; V566-E569 PolarHBondContact O-N 3.35Å; V566-E570 WeakPolarHBondContact O-CG 3.41Å; V566-E570 PolarHBondContact O-N 3.45Å
567	H	91.5	Very high	93	Very high	35 Å²	35	48.3 Å²	48.3	16%	0.162	23%	0.232	C	C	.	.	H	α-helix	trans	-69.8	-31.2	178.9	-166.5	-168.6	0	0	0	112.5	V562 R564 K565 E569 E570 V571 Y630 E631	V562-H567 HydrophobicContact CG1-CB 3.67Å; R564-H567 HydrophobicContact CB-CB 4.28Å; R564-H567 PolarHBondContact O-N 3.26Å; K565-H567 VanDerWaalsContact C-N 3.27Å; K565-H567 PolarHBondContact O-N 2.98Å; H567-E569 VanDerWaalsContact C-N 3.35Å; H567-E570 IonicContact CD2-OE2 2.79Å; H567-E570 PolarHBondContact O-N 2.9Å; H567-V571 WeakPolarHBondContact O-CB 3.29Å; H567-V571 VanDerWaalsContact O-CG2 3.23Å; H567-V571 WeakPolarHBondContact O-CG2 3.45Å; H567-V571 PolarHBondContact O-N 3.22Å; H567-Y630 AromaticContact CE1-CE1 3.56Å; H567-Y630 AromaticContact NE2-CE1 3.57Å; H567-E631 IonicContact CE1-OE1 3.84Å; H567-E631 PolarHBondContact CE1-OE1 3.32Å; H567-E631 IonicContact CG-OE1 3.6Å; H567-E631 VanDerWaalsContact ND1-CD 3.31Å; H567-E631 IonicContact ND1-OE1 2.72Å; H567-E631 PolarHBondContact ND1-OE1 3.37Å; H567-E631 IonicContact ND1-OE2 3.75Å
568	S	92.2	Very high	93	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-39	174	74.8	0	0	0	0	112.1	R564 K565 V566 A572	R564-S568 PolarHBondContact O-N 2.86Å; K565-S568 WeakPolarHBondContact O-CA 3.43Å; K565-S568 WeakPolarHBondContact O-CB 3.4Å; K565-S568 PolarHBondContact O-N 3.46Å; K565-S568 PolarHBondContact O-OG 3.02Å; V566-S568 VanDerWaalsContact C-N 3.33Å; V566-S568 PolarHBondContact O-N 3.23Å; S568-A572 VanDerWaalsContact O-CB 3.31Å; S568-A572 WeakPolarHBondContact O-CB 3.46Å; S568-A572 PolarHBondContact O-N 3.11Å
569	E	93.6	Very high	92.7	Very high	68 Å²	68	61.5 Å²	61.5	32%	0.318	29%	0.293	S	S	.	.	H	α-helix	trans	-65.7	-47.6	173.3	-72.1	170.1	-164.1	0	0	111.3	K565 V566 H567 V571 A572 Q573 L584 H586	K565-E569 PolarHBondContact O-N 3.42Å; V566-E569 WeakPolarHBondContact O-CB 3.49Å; V566-E569 PolarHBondContact O-N 3.35Å; H567-E569 VanDerWaalsContact C-N 3.35Å; E569-V571 PolarHBondContact O-N 2.99Å; E569-A572 PolarHBondContact O-N 2.65Å; E569-Q573 WeakPolarHBondContact O-CB 3.41Å; E569-Q573 VanDerWaalsContact O-CG 3.27Å; E569-Q573 WeakPolarHBondContact O-CG 3.38Å; E569-Q573 PolarHBondContact O-N 3.46Å; E569-L584 HydrophobicContact CB-CD2 4.4Å; E569-L584 HydrophobicContact CG-CD2 3.74Å; E569-H586 IonicContact OE1-CE1 3.68Å; E569-H586 IonicContact OE1-NE2 2.58Å
570	E	94.2	Very high	92.5	Very high	79 Å²	79	64 Å²	64	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-57.5	-46.9	176.4	-73.5	177.3	-153.7	0	0	112.2	V566 H567 Q573 K574	V566-E570 WeakPolarHBondContact O-CG 3.41Å; V566-E570 PolarHBondContact O-N 3.45Å; H567-E570 IonicContact CD2-OE2 2.79Å; H567-E570 PolarHBondContact O-N 2.9Å; E570-Q573 PolarHBondContact O-N 3.06Å; E570-K574 WeakPolarHBondContact O-CB 3.35Å; E570-K574 VanDerWaalsContact O-CG 3.24Å; E570-K574 WeakPolarHBondContact O-CG 3.43Å; E570-K574 PolarHBondContact O-N 3.3Å; E570-K574 IonicContact OE2-NZ 3.98Å
571	V	93.7	Very high	92.3	Very high	1 Å²	1	71 Å²	71	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-45	178.5	170	0	0	0	0	110.2	V562 H567 E569 K574 L575 V610 Y630	V562-V571 HydrophobicContact CG2-CG2 4.4Å; H567-V571 WeakPolarHBondContact O-CB 3.29Å; H567-V571 VanDerWaalsContact O-CG2 3.23Å; H567-V571 WeakPolarHBondContact O-CG2 3.45Å; H567-V571 PolarHBondContact O-N 3.22Å; E569-V571 PolarHBondContact O-N 2.99Å; V571-K574 PolarHBondContact O-N 3.35Å; V571-L575 HydrophobicContact CG1-CD1 4Å; V571-L575 HydrophobicContact CG1-CG 4.48Å; V571-L575 VanDerWaalsContact O-CG 3.26Å; V571-L575 WeakPolarHBondContact O-CG 3.47Å; V571-L575 PolarHBondContact O-N 3.01Å; V571-V610 HydrophobicContact CG1-CG1 4.46Å; V571-V610 HydrophobicContact CG1-CG2 4.32Å; V571-Y630 HydrophobicContact CG2-CD1 4.14Å; V571-Y630 HydrophobicContact CG2-CE1 3.85Å
572	A	94.3	Very high	92.3	Very high	2 Å²	2	71.4 Å²	71.4	2%	0.017	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-43	178.1	0	0	0	0	0	112.3	S568 E569 L575 K576 V582 L584 V610	S568-A572 VanDerWaalsContact O-CB 3.31Å; S568-A572 WeakPolarHBondContact O-CB 3.46Å; S568-A572 PolarHBondContact O-N 3.11Å; E569-A572 PolarHBondContact O-N 2.65Å; A572-L575 PolarHBondContact O-N 2.81Å; A572-K576 WeakPolarHBondContact O-CB 3.4Å; A572-K576 VanDerWaalsContact O-CG 3.3Å; A572-K576 WeakPolarHBondContact O-CG 3.17Å; A572-K576 PolarHBondContact O-N 3.34Å; A572-V582 HydrophobicContact CB-CG1 4.36Å; A572-L584 HydrophobicContact CB-CB 4.12Å; A572-L584 HydrophobicContact CB-CD1 4.11Å; A572-L584 HydrophobicContact CB-CD2 4.2Å; A572-L584 HydrophobicContact CB-CG 4.37Å; A572-V610 HydrophobicContact CB-CB 4.48Å; A572-V610 HydrophobicContact CB-CG2 4.34Å
573	Q	94.6	Very high	92.3	Very high	131 Å²	131	73.1 Å²	73.1	61%	0.612	35%	0.348	S	S	*	.	H	α-helix	trans	-63.6	-45.4	176.8	-73.5	176.6	7.4	0	0	111.7	E569 E570 L575 K576 S577	E569-Q573 WeakPolarHBondContact O-CB 3.41Å; E569-Q573 VanDerWaalsContact O-CG 3.27Å; E569-Q573 WeakPolarHBondContact O-CG 3.38Å; E569-Q573 PolarHBondContact O-N 3.46Å; E570-Q573 PolarHBondContact O-N 3.06Å; Q573-L575 VanDerWaalsContact C-N 3.27Å; Q573-L575 PolarHBondContact O-N 3.07Å; Q573-K576 PolarHBondContact O-N 3.22Å; Q573-S577 PolarHBondContact O-N 3.48Å
574	K	94.2	Very high	92.5	Very high	97 Å²	97	72.8 Å²	72.8	42%	0.422	35%	0.345	S	S	.	.	H	α-helix	trans	-65.2	-28.7	177.2	-70.9	171.7	178.6	165	0	113.2	W542 E570 V571 S577	W542-K574 HydrophobicContact CH2-CB 3.21Å; W542-K574 HydrophobicContact CH2-CD 4.25Å; W542-K574 HydrophobicContact CH2-CG 4.32Å; W542-K574 HydrophobicContact CZ2-CB 3.68Å; W542-K574 HydrophobicContact CZ3-CB 3.85Å; W542-K574 HydrophobicContact CZ3-CD 4.24Å; E570-K574 WeakPolarHBondContact O-CB 3.35Å; E570-K574 VanDerWaalsContact O-CG 3.24Å; E570-K574 WeakPolarHBondContact O-CG 3.43Å; E570-K574 PolarHBondContact O-N 3.3Å; E570-K574 IonicContact OE2-NZ 3.98Å; V571-K574 PolarHBondContact O-N 3.35Å; K574-S577 PolarHBondContact O-OG 3.12Å
575	L	93.9	Very high	92.7	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-77.3	-40.3	173.5	-69.2	172.8	0	0	0	111.5	W542 L545 L549 I560 V571 A572 Q573 S577 R578 L580 V582 I608 V610	W542-L575 HydrophobicContact CH2-CD2 3.91Å; W542-L575 HydrophobicContact CH2-CG 4.12Å; W542-L575 HydrophobicContact CZ3-CD2 4.34Å; W542-L575 HydrophobicContact CZ3-CG 4.44Å; L545-L575 HydrophobicContact CD2-CD2 4.41Å; L549-L575 HydrophobicContact CD2-CD1 4.47Å; L549-L575 HydrophobicContact CD2-CD2 3.52Å; I560-L575 HydrophobicContact CD1-CD1 3.94Å; V571-L575 HydrophobicContact CG1-CD1 4Å; V571-L575 HydrophobicContact CG1-CG 4.48Å; V571-L575 VanDerWaalsContact O-CG 3.26Å; V571-L575 WeakPolarHBondContact O-CG 3.47Å; V571-L575 PolarHBondContact O-N 3.01Å; A572-L575 PolarHBondContact O-N 2.81Å; Q573-L575 VanDerWaalsContact C-N 3.27Å; Q573-L575 PolarHBondContact O-N 3.07Å; L575-S577 VanDerWaalsContact C-N 3.31Å; L575-S577 PolarHBondContact O-N 3.35Å; L575-R578 PolarHBondContact O-N 3.43Å; L575-R578 VanDerWaalsContact O-N 3.12Å; L575-L580 HydrophobicContact CD2-CD1 4.05Å; L575-L580 WeakPolarHBondContact O-CB 3.14Å; L575-L580 PolarHBondContact O-N 3.12Å; L575-V582 HydrophobicContact CB-CB 4.5Å; L575-V582 HydrophobicContact CB-CG2 3.61Å; L575-V582 HydrophobicContact CD1-CG1 4.39Å; L575-V582 HydrophobicContact CD1-CG2 4.16Å; L575-I608 HydrophobicContact CD1-CG2 4.46Å; L575-V610 HydrophobicContact CD1-CG2 4.17Å
576	K	93.5	Very high	92.7	Very high	111 Å²	111	60.4 Å²	60.4	48%	0.483	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-37	175.1	-75.6	176.4	-179.3	-178.6	0	112.3	A572 Q573 R578 D579 V582	A572-K576 WeakPolarHBondContact O-CB 3.4Å; A572-K576 VanDerWaalsContact O-CG 3.3Å; A572-K576 WeakPolarHBondContact O-CG 3.17Å; A572-K576 PolarHBondContact O-N 3.34Å; Q573-K576 PolarHBondContact O-N 3.22Å; K576-R578 PolarHBondContact O-N 3.35Å; K576-D579 PolarHBondContact O-N 2.87Å; K576-D579 VanDerWaalsContact O-N 3.09Å; K576-V582 VanDerWaalsContact CE-O 3.22Å; K576-V582 WeakPolarHBondContact CE-O 3.39Å; K576-V582 HydrophobicContact CG-CB 4.31Å
577	S	92.9	Very high	92.2	Very high	94 Å²	94	58.4 Å²	58.4	66%	0.657	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.8	176.5	66.7	0	0	0	0	114.4	Q573 K574 L575	Q573-S577 PolarHBondContact O-N 3.48Å; K574-S577 PolarHBondContact O-OG 3.12Å; L575-S577 VanDerWaalsContact C-N 3.31Å; L575-S577 PolarHBondContact O-N 3.35Å
578	R	90.7	Very high	91.8	Very high	124 Å²	124	61.4 Å²	61.4	47%	0.468	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	20.8	171.5	-65.8	-171.4	171.6	-152.4	3.1	112.8	T546 L575 K576 L580	T546-R578 PolarHBondContact OG1-NH1 3.1Å; L575-R578 PolarHBondContact O-N 3.43Å; L575-R578 VanDerWaalsContact O-N 3.12Å; K576-R578 PolarHBondContact O-N 3.35Å; R578-L580 HydrophobicContact CB-CG 4.48Å; R578-L580 PolarHBondContact O-N 3.17Å
579	D	89	Confident	91.5	Very high	158 Å²	158	63.4 Å²	63.4	85%	0.845	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	26.6	-178.8	-62	-44.7	0	0	0	114.6	K576	K576-D579 PolarHBondContact O-N 2.87Å; K576-D579 VanDerWaalsContact O-N 3.09Å
580	L	89.8	Confident	91	Very high	53 Å²	53	66.8 Å²	66.8	28%	0.277	33%	0.334	S	S	.	.			trans	-90.4	136.1	174.2	-61.4	173.8	0	0	0	110.7	L549 L575 R578 V582 I608	L549-L580 HydrophobicContact CD2-CD1 3.53Å; L549-L580 HydrophobicContact CG-CD1 4.45Å; L575-L580 HydrophobicContact CD2-CD1 4.05Å; L575-L580 WeakPolarHBondContact O-CB 3.14Å; L575-L580 PolarHBondContact O-N 3.12Å; R578-L580 HydrophobicContact CB-CG 4.48Å; R578-L580 PolarHBondContact O-N 3.17Å; L580-V582 HydrophobicContact CB-CG2 4.05Å; L580-V582 PolarHBondContact O-N 3.39Å; L580-V582 VanDerWaalsContact O-N 3.16Å; L580-I608 HydrophobicContact CB-CD1 4.27Å; L580-I608 HydrophobicContact CD1-CD1 4.42Å
581	K	92.6	Very high	90.1	Very high	146 Å²	146	65 Å²	65	64%	0.635	33%	0.326	S	S	*	.			trans	-73.6	106.5	172.6	-66	-175.3	-178	-177.4	0	109.6	E605 A606	K581-E605 WeakPolarHBondContact CD-O 3.46Å; K581-A606 HydrophobicContact CB-CB 3.98Å
582	V	94.4	Very high	89.7	Confident	10 Å²	10	68.5 Å²	68.5	6%	0.061	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.9	-177.1	-177.4	0	0	0	0	111	A572 L575 K576 L580 I608 V610	A572-V582 HydrophobicContact CB-CG1 4.36Å; L575-V582 HydrophobicContact CB-CB 4.5Å; L575-V582 HydrophobicContact CB-CG2 3.61Å; L575-V582 HydrophobicContact CD1-CG1 4.39Å; L575-V582 HydrophobicContact CD1-CG2 4.16Å; K576-V582 VanDerWaalsContact CE-O 3.22Å; K576-V582 WeakPolarHBondContact CE-O 3.39Å; K576-V582 HydrophobicContact CG-CB 4.31Å; L580-V582 HydrophobicContact CB-CG2 4.05Å; L580-V582 PolarHBondContact O-N 3.39Å; L580-V582 VanDerWaalsContact O-N 3.16Å; V582-I608 HydrophobicContact CG1-CB 4.5Å; V582-I608 HydrophobicContact CG1-CG2 4.07Å; V582-I608 HydrophobicContact CG2-CB 4.04Å; V582-I608 HydrophobicContact CG2-CD1 4.01Å; V582-I608 HydrophobicContact CG2-CG2 4.09Å; V582-V610 HydrophobicContact CG1-CG2 3.73Å
583	L	94.7	Very high	89.4	Confident	35 Å²	35	72 Å²	72	18%	0.183	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	151.8	168.7	-68	170.9	0	0	0	110.2	V597 A600 F601 A606 I608 L609 V610	L583-V597 HydrophobicContact CB-CG1 3.9Å; L583-V597 HydrophobicContact CD1-CG1 4.38Å; L583-V597 HydrophobicContact CD2-CG1 4.47Å; L583-V597 HydrophobicContact CG-CG1 4.47Å; L583-A600 HydrophobicContact CD1-CB 3.9Å; L583-F601 HydrophobicContact CD1-CB 3.76Å; L583-F601 HydrophobicContact CD1-CD2 4.38Å; L583-A606 HydrophobicContact CD1-CB 3.82Å; L583-A606 HydrophobicContact CG-CB 3.66Å; L583-I608 PolarHBondContact N-O 3.47Å; L583-L609 HydrophobicContact CB-CD1 3.77Å; L583-L609 WeakPolarHBondContact O-CA 3.34Å; L583-V610 PolarHBondContact O-N 3.1Å
584	L	94.2	Very high	89	Confident	27 Å²	27	66.8 Å²	66.8	14%	0.141	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	137.5	-179.1	174.5	64.9	0	0	0	109.2	E569 A572 M589 V610	E569-L584 HydrophobicContact CB-CD2 4.4Å; E569-L584 HydrophobicContact CG-CD2 3.74Å; A572-L584 HydrophobicContact CB-CB 4.12Å; A572-L584 HydrophobicContact CB-CD1 4.11Å; A572-L584 HydrophobicContact CB-CD2 4.2Å; A572-L584 HydrophobicContact CB-CG 4.37Å; L584-M589 VanDerWaalsContact O-SD 3.41Å; L584-V610 CarbonylContact C-O 3.49Å; L584-V610 WeakPolarHBondContact CA-O 3.37Å; L584-V610 HydrophobicContact CD1-CB 4.04Å; L584-V610 HydrophobicContact CD1-CG1 4.03Å
585	I	91.3	Very high	88.5	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	122.7	172.4	-160	-176.4	0	0	0	111.4	M589 R594 V597 I598 L609 V610 A611 T612 A615	I585-M589 HydrophobicContact CG1-SD 4.38Å; I585-R594 HydrophobicContact CD1-CB 4.04Å; I585-R594 HydrophobicContact CD1-CG 4.17Å; I585-R594 HydrophobicContact CG1-CB 4.28Å; I585-R594 HydrophobicContact CG1-CG 3.92Å; I585-V597 HydrophobicContact CB-CG1 4.42Å; I585-I598 HydrophobicContact CD1-CD1 3.83Å; I585-I598 HydrophobicContact CD1-CG1 3.82Å; I585-L609 HydrophobicContact CB-CD1 4.3Å; I585-L609 HydrophobicContact CG2-CD1 3.94Å; I585-L609 HydrophobicContact CG2-CD2 4.41Å; I585-L609 HydrophobicContact CG2-CG 4.31Å; I585-V610 PolarHBondContact N-O 3.27Å; I585-A611 HydrophobicContact CG2-CB 3.5Å; I585-A611 VanDerWaalsContact CG2-CB 3.5Å; I585-A611 WeakPolarHBondContact O-CA 3.48Å; I585-T612 PolarHBondContact O-N 2.86Å; I585-A615 HydrophobicContact CB-CB 4.32Å; I585-A615 HydrophobicContact CD1-CB 4.29Å; I585-A615 HydrophobicContact CG1-CB 3.93Å; I585-A615 HydrophobicContact CG2-CB 3.97Å; I585-A615 WeakPolarHBondContact O-CB 3.27Å
586	H	89.5	Confident	88.3	Confident	20 Å²	20	69.5 Å²	69.5	9%	0.093	37%	0.365	C	S	.	.			trans	-138.5	177.3	175.2	57.2	79.3	0	0	0	111.4	E569 D588 M589 T612	E569-H586 IonicContact OE1-CE1 3.68Å; E569-H586 IonicContact OE1-NE2 2.58Å; H586-D588 PolarHBondContact ND1-N 3.42Å; H586-M589 VanDerWaalsContact CE1-CG 3.48Å; H586-M589 WeakPolarHBondContact CE1-CG 3.02Å; H586-T612 HydrophobicContact CB-CG2 3.99Å
587	G	81.1	Confident	88.2	Confident	35 Å²	35	65.2 Å²	65.2	36%	0.361	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-38	-173.4	0	0	0	0	0	113.9	M589	G587-M589 PolarHBondContact O-N 3.27Å
588	D	84.4	Confident	88	Confident	99 Å²	99	61.5 Å²	61.5	53%	0.529	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-6.7	-176.5	-53.1	23.7	0	0	0	114	K565 H586	K565-D588 WeakPolarHBondContact CD-OD2 3.32Å; K565-D588 WeakPolarHBondContact CE-OD2 3.24Å; K565-D588 IonicContact NZ-OD2 3.07Å; K565-D588 PolarHBondContact NZ-OD2 3.06Å; H586-D588 PolarHBondContact ND1-N 3.42Å
589	M	84.5	Confident	87.8	Confident	42 Å²	42	60.2 Å²	60.2	21%	0.207	32%	0.321	C	S	.	.	S	Bend	trans	-74.3	138.7	175.3	-66.5	-174.6	69.2	0	0	110.7	L584 I585 H586 G587 D593 R594 V597	L584-M589 VanDerWaalsContact O-SD 3.41Å; I585-M589 HydrophobicContact CG1-SD 4.38Å; H586-M589 VanDerWaalsContact CE1-CG 3.48Å; H586-M589 WeakPolarHBondContact CE1-CG 3.02Å; G587-M589 PolarHBondContact O-N 3.27Å; M589-D593 HydrophobicContact CE-CB 3.88Å; M589-R594 HydrophobicContact CB-CG 3.6Å; M589-R594 WeakPolarHBondContact O-CD 3.47Å; M589-V597 HydrophobicContact CE-CG2 4Å
590	H	83.7	Confident	87.9	Confident	138 Å²	138	53.1 Å²	53.1	64%	0.639	28%	0.284	S	S	*	.			trans	-57	143.3	170.5	-65.6	-63.7	0	0	0	110.9	S592 D593 R594	H590-S592 PolarHBondContact O-N 2.88Å; H590-D593 IonicContact CD2-OD2 3.7Å; H590-D593 WeakPolarHBondContact O-CB 3.49Å; H590-D593 PolarHBondContact O-N 2.78Å; H590-R594 PolarHBondContact O-N 2.88Å
591	Q	75.2	Confident	88	Confident	43 Å²	43	50.6 Å²	50.6	20%	0.201	27%	0.271	C	S	.	.	H	α-helix	trans	-60.6	-32	-175.8	-169.5	71.8	28.1	0	0	112.7	E394 D593 R594 N595	E394-Q591 PolarHBondContact OE1-NE2 2.9Å; E394-Q591 VanDerWaalsContact OE1-NE2 3.13Å; Q591-D593 VanDerWaalsContact C-N 3.32Å; Q591-R594 PolarHBondContact O-N 2.91Å; Q591-N595 WeakPolarHBondContact O-CB 3.17Å; Q591-N595 PolarHBondContact O-N 2.85Å; Q591-N595 PolarHBondContact O-ND2 2.99Å
592	S	85.3	Confident	87.7	Confident	74 Å²	74	48.2 Å²	48.2	52%	0.517	26%	0.26	S	S	.	.	H	α-helix	trans	-58.3	-44.3	172.7	48.9	0	0	0	0	111.8	H590 N595 T596	H590-S592 PolarHBondContact O-N 2.88Å; S592-N595 PolarHBondContact O-N 2.81Å; S592-T596 PolarHBondContact O-N 3.26Å; S592-T596 PolarHBondContact O-OG1 3.33Å
593	D	88.5	Confident	87.4	Confident	74 Å²	74	56.2 Å²	56.2	40%	0.396	29%	0.29	S	S	.	.	H	α-helix	trans	-73.6	-41.1	-177.5	-57.1	-15.9	0	0	0	110	M589 H590 Q591 N595 T596 V597	M589-D593 HydrophobicContact CE-CB 3.88Å; H590-D593 IonicContact CD2-OD2 3.7Å; H590-D593 WeakPolarHBondContact O-CB 3.49Å; H590-D593 PolarHBondContact O-N 2.78Å; Q591-D593 VanDerWaalsContact C-N 3.32Å; D593-N595 VanDerWaalsContact C-N 3.32Å; D593-N595 PolarHBondContact O-N 2.87Å; D593-T596 WeakPolarHBondContact O-CB 3.37Å; D593-T596 PolarHBondContact O-N 3.41Å; D593-T596 VanDerWaalsContact O-N 3.14Å; D593-V597 WeakPolarHBondContact O-CG2 3.46Å; D593-V597 PolarHBondContact O-N 3.19Å
594	R	85.6	Confident	87	Confident	22 Å²	22	60.7 Å²	60.7	8%	0.083	31%	0.309	C	S	.	.	H	α-helix	trans	-55	-47.6	171.3	-69.6	-178.3	62.2	-154.9	-8.9	111.2	E394 I585 M589 H590 Q591 T596 V597 I598 A615	E394-R594 IonicContact OE1-CZ 3.12Å; E394-R594 IonicContact OE1-NH1 3.27Å; E394-R594 IonicContact OE1-NH2 3.83Å; E394-R594 PolarHBondContact OE1-NH2 2.94Å; E394-R594 VanDerWaalsContact OE1-NH2 3.14Å; I585-R594 HydrophobicContact CD1-CB 4.04Å; I585-R594 HydrophobicContact CD1-CG 4.17Å; I585-R594 HydrophobicContact CG1-CB 4.28Å; I585-R594 HydrophobicContact CG1-CG 3.92Å; M589-R594 HydrophobicContact CB-CG 3.6Å; M589-R594 WeakPolarHBondContact O-CD 3.47Å; H590-R594 PolarHBondContact O-N 2.88Å; Q591-R594 PolarHBondContact O-N 2.91Å; R594-T596 VanDerWaalsContact C-N 3.34Å; R594-T596 PolarHBondContact O-N 2.99Å; R594-V597 PolarHBondContact O-N 2.97Å; R594-I598 WeakPolarHBondContact O-CB 3.2Å; R594-I598 WeakPolarHBondContact O-CD1 3.34Å; R594-I598 WeakPolarHBondContact O-CG1 3.36Å; R594-I598 PolarHBondContact O-N 3.04Å; R594-A615 PolarHBondContact NH2-O 2.94Å
595	N	84.3	Confident	86.8	Confident	60 Å²	60	64.5 Å²	64.5	32%	0.321	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-41.4	177.8	-72	-21.8	0	0	0	111.6	Q591 S592 D593 I598 Q599	Q591-N595 WeakPolarHBondContact O-CB 3.17Å; Q591-N595 PolarHBondContact O-N 2.85Å; Q591-N595 PolarHBondContact O-ND2 2.99Å; S592-N595 PolarHBondContact O-N 2.81Å; D593-N595 VanDerWaalsContact C-N 3.32Å; D593-N595 PolarHBondContact O-N 2.87Å; N595-I598 PolarHBondContact O-N 2.87Å; N595-Q599 WeakPolarHBondContact O-CB 3.17Å; N595-Q599 VanDerWaalsContact O-CG 3.24Å; N595-Q599 WeakPolarHBondContact O-CG 3.41Å; N595-Q599 PolarHBondContact O-N 2.83Å
596	T	89.6	Confident	86.8	Confident	94 Å²	94	64.8 Å²	64.8	58%	0.577	33%	0.329	S	S	*	.	H	α-helix	trans	-62	-46.3	177.3	-58	0	0	0	0	111.2	S592 D593 R594 Q599 A600	S592-T596 PolarHBondContact O-N 3.26Å; S592-T596 PolarHBondContact O-OG1 3.33Å; D593-T596 WeakPolarHBondContact O-CB 3.37Å; D593-T596 PolarHBondContact O-N 3.41Å; D593-T596 VanDerWaalsContact O-N 3.14Å; R594-T596 VanDerWaalsContact C-N 3.34Å; R594-T596 PolarHBondContact O-N 2.99Å; T596-Q599 PolarHBondContact O-N 3.43Å; T596-A600 WeakPolarHBondContact O-CB 3.38Å; T596-A600 PolarHBondContact O-N 2.8Å
597	V	91	Very high	87	Confident	22 Å²	22	66 Å²	66	13%	0.133	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-44.7	175.9	169.2	0	0	0	0	111.8	L583 I585 M589 D593 R594 Q599 A600 F601 L609	L583-V597 HydrophobicContact CB-CG1 3.9Å; L583-V597 HydrophobicContact CD1-CG1 4.38Å; L583-V597 HydrophobicContact CD2-CG1 4.47Å; L583-V597 HydrophobicContact CG-CG1 4.47Å; I585-V597 HydrophobicContact CB-CG1 4.42Å; M589-V597 HydrophobicContact CE-CG2 4Å; D593-V597 WeakPolarHBondContact O-CG2 3.46Å; D593-V597 PolarHBondContact O-N 3.19Å; R594-V597 PolarHBondContact O-N 2.97Å; V597-Q599 VanDerWaalsContact C-N 3.3Å; V597-Q599 PolarHBondContact O-N 3.37Å; V597-A600 PolarHBondContact O-N 3.06Å; V597-F601 WeakPolarHBondContact O-CB 3.36Å; V597-F601 PolarHBondContact O-N 3.21Å; V597-L609 HydrophobicContact CG1-CD1 3.94Å
598	I	87.6	Confident	87.6	Confident	15 Å²	15	64.3 Å²	64.3	8%	0.077	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-41.6	177.3	-68.7	161.8	0	0	0	110.5	I585 R594 N595 F601 K602 L619 I621	I585-I598 HydrophobicContact CD1-CD1 3.83Å; I585-I598 HydrophobicContact CD1-CG1 3.82Å; R594-I598 WeakPolarHBondContact O-CB 3.2Å; R594-I598 WeakPolarHBondContact O-CD1 3.34Å; R594-I598 WeakPolarHBondContact O-CG1 3.36Å; R594-I598 PolarHBondContact O-N 3.04Å; N595-I598 PolarHBondContact O-N 2.87Å; I598-F601 PolarHBondContact O-N 3.3Å; I598-K602 HydrophobicContact CG2-CD 4.24Å; I598-K602 WeakPolarHBondContact O-CB 3.47Å; I598-K602 WeakPolarHBondContact O-CG 3.5Å; I598-K602 PolarHBondContact O-N 3.46Å; I598-L619 HydrophobicContact CD1-CD2 3.46Å; I598-L619 VanDerWaalsContact CD1-CD2 3.46Å; I598-L619 HydrophobicContact CG1-CD2 3.74Å; I598-L619 HydrophobicContact CG2-CD2 4.43Å; I598-I621 HydrophobicContact CG2-CD1 4.23Å
599	Q	87.7	Confident	88.1	Confident	98 Å²	98	59.6 Å²	59.6	46%	0.458	30%	0.296	S	S	.	.	H	α-helix	trans	-67.2	-42.1	177.3	-70.1	-67.1	-8.5	0	0	112	N595 T596 V597 F601 K602 R603	N595-Q599 WeakPolarHBondContact O-CB 3.17Å; N595-Q599 VanDerWaalsContact O-CG 3.24Å; N595-Q599 WeakPolarHBondContact O-CG 3.41Å; N595-Q599 PolarHBondContact O-N 2.83Å; T596-Q599 PolarHBondContact O-N 3.43Å; V597-Q599 VanDerWaalsContact C-N 3.3Å; V597-Q599 PolarHBondContact O-N 3.37Å; Q599-F601 VanDerWaalsContact C-N 3.32Å; Q599-F601 PolarHBondContact O-N 2.84Å; Q599-K602 PolarHBondContact O-N 3.39Å; Q599-R603 WeakPolarHBondContact O-CB 3.34Å; Q599-R603 VanDerWaalsContact O-CG 3.28Å; Q599-R603 WeakPolarHBondContact O-CG 3.47Å; Q599-R603 PolarHBondContact O-N 2.82Å
600	A	91.4	Very high	88.6	Confident	9 Å²	9	57.6 Å²	57.6	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-60.4	-41.7	175.1	0	0	0	0	0	111.7	L583 T596 V597 R603 Q604 E605	L583-A600 HydrophobicContact CD1-CB 3.9Å; T596-A600 WeakPolarHBondContact O-CB 3.38Å; T596-A600 PolarHBondContact O-N 2.8Å; V597-A600 PolarHBondContact O-N 3.06Å; A600-R603 PolarHBondContact O-N 2.82Å; A600-Q604 PolarHBondContact O-N 3.44Å; A600-E605 HydrophobicContact CB-CB 4.41Å; A600-E605 WeakPolarHBondContact CB-OE2 3.45Å; A600-E605 WeakPolarHBondContact O-CB 3.4Å; A600-E605 PolarHBondContact O-N 2.89Å
601	F	90.9	Very high	89.1	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-40.3	175.6	-171.4	-112.7	0	0	0	112.3	L583 V597 I598 Q599 R603 Q604 A606 L609 I621 I624	L583-F601 HydrophobicContact CD1-CB 3.76Å; L583-F601 HydrophobicContact CD1-CD2 4.38Å; V597-F601 WeakPolarHBondContact O-CB 3.36Å; V597-F601 PolarHBondContact O-N 3.21Å; I598-F601 PolarHBondContact O-N 3.3Å; Q599-F601 VanDerWaalsContact C-N 3.32Å; Q599-F601 PolarHBondContact O-N 2.84Å; F601-R603 VanDerWaalsContact C-N 3.28Å; F601-R603 PolarHBondContact O-N 2.81Å; F601-Q604 PolarHBondContact O-N 3.24Å; F601-A606 VanDerWaalsContact CD2-O 3.3Å; F601-A606 WeakPolarHBondContact CD2-O 3.36Å; F601-L609 HydrophobicContact CD1-CB 4.27Å; F601-L609 HydrophobicContact CD1-CD2 3.81Å; F601-L609 HydrophobicContact CD2-CB 3.69Å; F601-L609 HydrophobicContact CE1-CB 4.12Å; F601-L609 HydrophobicContact CE1-CD2 4.05Å; F601-L609 HydrophobicContact CE2-CB 3.52Å; F601-L609 HydrophobicContact CG-CB 4.05Å; F601-L609 HydrophobicContact CG-CD2 4.06Å; F601-L609 HydrophobicContact CZ-CB 3.74Å; F601-I621 HydrophobicContact CD1-CD1 3.61Å; F601-I621 HydrophobicContact CD1-CG2 3.96Å; F601-I621 HydrophobicContact CE1-CD1 4.1Å; F601-I621 HydrophobicContact CE1-CG2 3.98Å; F601-I624 HydrophobicContact CE1-CD1 4.09Å; F601-I624 HydrophobicContact CE1-CG1 3.72Å; F601-I624 HydrophobicContact CZ-CG1 4.18Å
602	K	86.8	Confident	89.9	Confident	96 Å²	96	49.4 Å²	49.4	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-35.7	173.6	-79	-179.1	176.1	-169.2	0	112.6	I598 Q599 Q604 D620 I621	I598-K602 HydrophobicContact CG2-CD 4.24Å; I598-K602 WeakPolarHBondContact O-CB 3.47Å; I598-K602 WeakPolarHBondContact O-CG 3.5Å; I598-K602 PolarHBondContact O-N 3.46Å; Q599-K602 PolarHBondContact O-N 3.39Å; K602-Q604 PolarHBondContact O-N 3.41Å; K602-D620 WeakPolarHBondContact CE-O 3.47Å; K602-I621 HydrophobicContact CG-CD1 4.44Å; K602-I621 HydrophobicContact CG-CG1 4.31Å; K602-I621 HydrophobicContact CG-CG2 4.1Å
603	R	88.2	Confident	89.9	Confident	178 Å²	178	46.6 Å²	46.6	67%	0.672	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	0	174.3	-68.8	172.9	-176.3	-166.1	0.4	113.5	Q599 A600 F601 E605	Q599-R603 WeakPolarHBondContact O-CB 3.34Å; Q599-R603 VanDerWaalsContact O-CG 3.28Å; Q599-R603 WeakPolarHBondContact O-CG 3.47Å; Q599-R603 PolarHBondContact O-N 2.82Å; A600-R603 PolarHBondContact O-N 2.82Å; F601-R603 VanDerWaalsContact C-N 3.28Å; F601-R603 PolarHBondContact O-N 2.81Å; R603-E605 HydrophobicContact CB-CG 4.07Å; R603-E605 WeakPolarHBondContact CD-OE1 3.46Å; R603-E605 PolarHBondContact O-N 3.19Å
604	Q	86.5	Confident	89.3	Confident	128 Å²	128	47.9 Å²	47.9	60%	0.598	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	29.4	-177.7	-57.5	-179.1	-19.9	0	0	113.7	A600 F601 K602 A606	A600-Q604 PolarHBondContact O-N 3.44Å; F601-Q604 PolarHBondContact O-N 3.24Å; K602-Q604 PolarHBondContact O-N 3.41Å; Q604-A606 PolarHBondContact O-N 2.9Å
605	E	90.2	Very high	88.6	Confident	107 Å²	107	46.9 Å²	46.9	50%	0.5	23%	0.234	S	C	.	.	S	Bend	trans	-63.6	-31.2	175.4	-66.8	176	-160.1	0	0	111.5	K581 A600 R603	K581-E605 WeakPolarHBondContact CD-O 3.46Å; A600-E605 HydrophobicContact CB-CB 4.41Å; A600-E605 WeakPolarHBondContact CB-OE2 3.45Å; A600-E605 WeakPolarHBondContact O-CB 3.4Å; A600-E605 PolarHBondContact O-N 2.89Å; R603-E605 HydrophobicContact CB-CG 4.07Å; R603-E605 WeakPolarHBondContact CD-OE1 3.46Å; R603-E605 PolarHBondContact O-N 3.19Å
606	A	91.8	Very high	88	Confident	6 Å²	6	44.2 Å²	44.2	5%	0.05	22%	0.221	C	C	.	.			trans	-132.7	133.5	169.8	0	0	0	0	0	109.8	K581 L583 F601 Q604 I608	K581-A606 HydrophobicContact CB-CB 3.98Å; L583-A606 HydrophobicContact CD1-CB 3.82Å; L583-A606 HydrophobicContact CG-CB 3.66Å; F601-A606 VanDerWaalsContact CD2-O 3.3Å; F601-A606 WeakPolarHBondContact CD2-O 3.36Å; Q604-A606 PolarHBondContact O-N 2.9Å; A606-I608 VanDerWaalsContact C-N 3.28Å; A606-I608 PolarHBondContact O-N 2.83Å
607	P	92.9	Very high	86.9	Confident	45 Å²	45	43.2 Å²	43.2	29%	0.292	21%	0.206	S	C	.	.	S	Bend	trans	-77.1	-13	179.3	30.9	-34.2	0	0	0	113.2	T553 S557 V558	T553-P607 HydrophobicContact CG2-CB 4.14Å; T553-P607 HydrophobicContact CG2-CG 4.17Å; S557-P607 CarbonylContact C-O 3.54Å; S557-P607 WeakPolarHBondContact CA-O 3.33Å; V558-P607 PolarHBondContact N-O 2.84Å
608	I	94.7	Very high	85.4	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.1	-174	-57.6	155	0	0	0	110.1	L549 T553 V558 I560 L575 L580 V582 L583 A606	L549-I608 HydrophobicContact CD1-CD1 4.07Å; L549-I608 HydrophobicContact CD1-CG1 4.19Å; L549-I608 HydrophobicContact CD2-CD1 3.79Å; L549-I608 HydrophobicContact CG-CD1 3.89Å; T553-I608 HydrophobicContact CG2-CD1 3.88Å; T553-I608 HydrophobicContact CG2-CG1 3.65Å; V558-I608 HydrophobicContact CB-CG1 4.39Å; V558-I608 WeakPolarHBondContact O-CA 3.5Å; I560-I608 HydrophobicContact CD1-CG2 3.69Å; I560-I608 HydrophobicContact CG1-CG2 4.28Å; L575-I608 HydrophobicContact CD1-CG2 4.46Å; L580-I608 HydrophobicContact CB-CD1 4.27Å; L580-I608 HydrophobicContact CD1-CD1 4.42Å; V582-I608 HydrophobicContact CG1-CB 4.5Å; V582-I608 HydrophobicContact CG1-CG2 4.07Å; V582-I608 HydrophobicContact CG2-CB 4.04Å; V582-I608 HydrophobicContact CG2-CD1 4.01Å; V582-I608 HydrophobicContact CG2-CG2 4.09Å; L583-I608 PolarHBondContact N-O 3.47Å; A606-I608 VanDerWaalsContact C-N 3.28Å; A606-I608 PolarHBondContact O-N 2.83Å
609	L	94.6	Very high	84.5	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.4	171.1	178.9	61.6	0	0	0	109.6	V558 L559 I560 L583 I585 V597 F601 L619	V558-L609 PolarHBondContact O-N 3.37Å; L559-L609 CarbonylContact C-O 3.6Å; L559-L609 WeakPolarHBondContact CA-O 3.46Å; L559-L609 HydrophobicContact CD1-CB 4.03Å; L559-L609 HydrophobicContact CD1-CD2 3.9Å; L559-L609 HydrophobicContact CD1-CG 3.85Å; L559-L609 WeakPolarHBondContact CD1-O 3.33Å; I560-L609 PolarHBondContact N-O 3.33Å; L583-L609 HydrophobicContact CB-CD1 3.77Å; L583-L609 WeakPolarHBondContact O-CA 3.34Å; I585-L609 HydrophobicContact CB-CD1 4.3Å; I585-L609 HydrophobicContact CG2-CD1 3.94Å; I585-L609 HydrophobicContact CG2-CD2 4.41Å; I585-L609 HydrophobicContact CG2-CG 4.31Å; V597-L609 HydrophobicContact CG1-CD1 3.94Å; F601-L609 HydrophobicContact CD1-CB 4.27Å; F601-L609 HydrophobicContact CD1-CD2 3.81Å; F601-L609 HydrophobicContact CD2-CB 3.69Å; F601-L609 HydrophobicContact CE1-CB 4.12Å; F601-L609 HydrophobicContact CE1-CD2 4.05Å; F601-L609 HydrophobicContact CE2-CB 3.52Å; F601-L609 HydrophobicContact CG-CB 4.05Å; F601-L609 HydrophobicContact CG-CD2 4.06Å; F601-L609 HydrophobicContact CZ-CB 3.74Å; L609-L619 HydrophobicContact CD2-CD1 4.43Å
610	V	95.3	Very high	83.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.9	170.3	-177.9	0	0	0	0	108.2	I560 V562 V571 A572 L575 V582 L583 L584 I585	I560-V610 HydrophobicContact CB-CG2 4.29Å; I560-V610 HydrophobicContact CD1-CG2 4.39Å; I560-V610 CarbonylContact O-C 3.51Å; I560-V610 WeakPolarHBondContact O-CA 3.28Å; V562-V610 HydrophobicContact CG2-CG1 4.05Å; V571-V610 HydrophobicContact CG1-CG1 4.46Å; V571-V610 HydrophobicContact CG1-CG2 4.32Å; A572-V610 HydrophobicContact CB-CB 4.48Å; A572-V610 HydrophobicContact CB-CG2 4.34Å; L575-V610 HydrophobicContact CD1-CG2 4.17Å; V582-V610 HydrophobicContact CG1-CG2 3.73Å; L583-V610 PolarHBondContact O-N 3.1Å; L584-V610 CarbonylContact C-O 3.49Å; L584-V610 WeakPolarHBondContact CA-O 3.37Å; L584-V610 HydrophobicContact CD1-CB 4.04Å; L584-V610 HydrophobicContact CD1-CG1 4.03Å; I585-V610 PolarHBondContact N-O 3.27Å
611	A	93.4	Very high	82.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147	-174.8	0	0	0	0	0	113	L559 I560 F561 V562 I585	L559-A611 HydrophobicContact CD1-CB 3.81Å; I560-A611 PolarHBondContact O-N 2.88Å; F561-A611 WeakPolarHBondContact CA-O 3.48Å; V562-A611 PolarHBondContact N-O 2.88Å; I585-A611 HydrophobicContact CG2-CB 3.5Å; I585-A611 VanDerWaalsContact CG2-CB 3.5Å; I585-A611 WeakPolarHBondContact O-CA 3.48Å
612	T	92	Very high	82	Confident	9 Å²	9	44.2 Å²	44.2	6%	0.055	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	163.7	163.7	65.8	0	0	0	0	111.9	V562 I585 H586 V614 A615 S616	V562-T612 WeakPolarHBondContact O-CA 3.39Å; I585-T612 PolarHBondContact O-N 2.86Å; H586-T612 HydrophobicContact CB-CG2 3.99Å; T612-V614 VanDerWaalsContact C-N 3.3Å; T612-V614 PolarHBondContact O-N 2.9Å; T612-A615 PolarHBondContact O-N 3.26Å; T612-S616 WeakPolarHBondContact O-CB 3.45Å; T612-S616 PolarHBondContact O-N 3.42Å; T612-S616 PolarHBondContact O-OG 3.47Å
613	D	85.3	Confident	81.8	Confident	15 Å²	15	41.2 Å²	41.2	8%	0.08	21%	0.212	C	C	.	.	H	α-helix	trans	-54.3	-46.8	178.7	-77.9	-43.2	0	0	0	112.5	A615 S616 R617 T638 R642	D613-A615 VanDerWaalsContact C-N 3.33Å; D613-A615 PolarHBondContact O-N 3.33Å; D613-S616 PolarHBondContact O-N 2.71Å; D613-S616 PolarHBondContact O-OG 2.9Å; D613-R617 WeakPolarHBondContact O-CG 3.23Å; D613-R617 PolarHBondContact O-N 3.33Å; D613-T638 WeakPolarHBondContact OD1-CG2 3.34Å; D613-R642 IonicContact OD1-CZ 3.23Å; D613-R642 VanDerWaalsContact OD1-CZ 3.28Å; D613-R642 IonicContact OD1-NE 3.73Å; D613-R642 PolarHBondContact OD1-NE 3.44Å; D613-R642 IonicContact OD1-NH2 3.69Å; D613-R642 PolarHBondContact OD1-NH2 2.96Å; D613-R642 VanDerWaalsContact OD1-NH2 3.12Å; D613-R642 IonicContact OD2-CZ 2.86Å; D613-R642 IonicContact OD2-NE 3.9Å; D613-R642 IonicContact OD2-NH2 2.68Å; D613-R642 PolarHBondContact OD2-NH2 3.22Å
614	V	75.1	Confident	81.8	Confident	101 Å²	101	33.1 Å²	33.1	61%	0.612	18%	0.182	S	C	*	.	H	α-helix	trans	-59.6	-45.9	-178.4	-179.6	0	0	0	0	110.5	T612 S616	T612-V614 VanDerWaalsContact C-N 3.3Å; T612-V614 PolarHBondContact O-N 2.9Å; V614-S616 VanDerWaalsContact C-N 3.32Å; V614-S616 PolarHBondContact O-N 2.76Å
615	A	72.2	Confident	82	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-73.1	-24.9	-177	0	0	0	0	0	113.8	I585 R594 T612 D613	I585-A615 HydrophobicContact CB-CB 4.32Å; I585-A615 HydrophobicContact CD1-CB 4.29Å; I585-A615 HydrophobicContact CG1-CB 3.93Å; I585-A615 HydrophobicContact CG2-CB 3.97Å; I585-A615 WeakPolarHBondContact O-CB 3.27Å; R594-A615 PolarHBondContact NH2-O 2.94Å; T612-A615 PolarHBondContact O-N 3.26Å; D613-A615 VanDerWaalsContact C-N 3.33Å; D613-A615 PolarHBondContact O-N 3.33Å
616	S	70.1	Confident	82.2	Confident	5 Å²	5	24.7 Å²	24.7	4%	0.035	14%	0.142	C	C	.	.	H	α-helix	trans	-86.8	-17.9	-174.9	75.4	0	0	0	0	115.8	F561 T612 D613 V614 G618 L619	F561-S616 WeakPolarHBondContact CE1-OG 3.25Å; T612-S616 WeakPolarHBondContact O-CB 3.45Å; T612-S616 PolarHBondContact O-N 3.42Å; T612-S616 PolarHBondContact O-OG 3.47Å; D613-S616 PolarHBondContact O-N 2.71Å; D613-S616 PolarHBondContact O-OG 2.9Å; V614-S616 VanDerWaalsContact C-N 3.32Å; V614-S616 PolarHBondContact O-N 2.76Å; S616-G618 PolarHBondContact O-N 2.9Å; S616-L619 WeakPolarHBondContact O-CB 3.12Å; S616-L619 WeakPolarHBondContact O-CG 3.47Å; S616-L619 PolarHBondContact O-N 2.94Å; S616-L619 VanDerWaalsContact O-N 3.08Å
617	R	67.1	Low	82.3	Confident	72 Å²	72	24.4 Å²	24.4	27%	0.272	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	128.9	-176	-80.2	174.1	176.5	-162.1	0.3	108.9	T392 D613 L619	T392-R617 HydrophobicContact CG2-CB 4.5Å; D613-R617 WeakPolarHBondContact O-CG 3.23Å; D613-R617 PolarHBondContact O-N 3.33Å; R617-L619 VanDerWaalsContact C-N 3.25Å; R617-L619 PolarHBondContact O-N 3.44Å
618	G	59.8	Low	82.5	Confident	7 Å²	7	22.3 Å²	22.3	7%	0.072	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	2.8	-178.6	0	0	0	0	0	114.8	S616 D620	S616-G618 PolarHBondContact O-N 2.9Å; G618-D620 PolarHBondContact O-N 3.22Å; G618-D620 VanDerWaalsContact O-N 3.14Å
619	L	69.2	Low	82.5	Confident	6 Å²	6	22.2 Å²	22.2	3%	0.031	13%	0.126	C	C	.	.			trans	-66.5	115.8	169.7	-66.8	-176	0	0	0	109.7	I598 L609 S616 R617 R645 R648	I598-L619 HydrophobicContact CD1-CD2 3.46Å; I598-L619 VanDerWaalsContact CD1-CD2 3.46Å; I598-L619 HydrophobicContact CG1-CD2 3.74Å; I598-L619 HydrophobicContact CG2-CD2 4.43Å; L609-L619 HydrophobicContact CD2-CD1 4.43Å; S616-L619 WeakPolarHBondContact O-CB 3.12Å; S616-L619 WeakPolarHBondContact O-CG 3.47Å; S616-L619 PolarHBondContact O-N 2.94Å; S616-L619 VanDerWaalsContact O-N 3.08Å; R617-L619 VanDerWaalsContact C-N 3.25Å; R617-L619 PolarHBondContact O-N 3.44Å; L619-R645 PolarHBondContact O-NH1 3.33Å; L619-R648 PolarHBondContact O-NH1 3.02Å; L619-R648 PolarHBondContact O-NH2 3.36Å
620	D	68.9	Low	82.6	Confident	44 Å²	44	22.9 Å²	22.9	24%	0.235	13%	0.128	C	C	.	.			trans	-113.7	103.1	167	-171	24.9	0	0	0	110.5	Q398 K602 G618 R648	Q398-D620 PolarHBondContact NE2-OD2 3.38Å; K602-D620 WeakPolarHBondContact CE-O 3.47Å; G618-D620 PolarHBondContact O-N 3.22Å; G618-D620 VanDerWaalsContact O-N 3.14Å; D620-R648 VanDerWaalsContact CA-NH1 3.26Å; D620-R648 VanDerWaalsContact CB-NH1 3.3Å; D620-R648 WeakPolarHBondContact OD1-CD 3.49Å; D620-R648 IonicContact OD1-CZ 3.69Å; D620-R648 IonicContact OD1-NE 3.57Å; D620-R648 IonicContact OD1-NH1 3.89Å; D620-R648 PolarHBondContact OD1-NH1 3.36Å
621	I	77.1	Confident	82.5	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.133	C	C	.	.			trans	-133.6	96.8	-175.4	-52.7	-175	0	0	0	106.4	I598 F601 K602 S623 I624	I598-I621 HydrophobicContact CG2-CD1 4.23Å; F601-I621 HydrophobicContact CD1-CD1 3.61Å; F601-I621 HydrophobicContact CD1-CG2 3.96Å; F601-I621 HydrophobicContact CE1-CD1 4.1Å; F601-I621 HydrophobicContact CE1-CG2 3.98Å; K602-I621 HydrophobicContact CG-CD1 4.44Å; K602-I621 HydrophobicContact CG-CG1 4.31Å; K602-I621 HydrophobicContact CG-CG2 4.1Å; I621-S623 VanDerWaalsContact CG2-OG 3.25Å; I621-S623 WeakPolarHBondContact CG2-OG 3.47Å; I621-S623 PolarHBondContact O-N 2.68Å; I621-S623 VanDerWaalsContact O-N 3.09Å; I621-I624 HydrophobicContact CB-CD1 3.8Å; I621-I624 HydrophobicContact CB-CG1 4.01Å; I621-I624 HydrophobicContact CG2-CD1 4.35Å; I621-I624 HydrophobicContact CG2-CG1 4.07Å; I621-I624 PolarHBondContact O-N 3.22Å
622	P	71.2	Confident	82.5	Confident	107 Å²	107	24.5 Å²	24.5	70%	0.695	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.1	-175.9	-25.2	34	0	0	0	114.3	I624	P622-I624 VanDerWaalsContact C-N 3.28Å; P622-I624 PolarHBondContact O-N 3.01Å
623	S	81.8	Confident	82.4	Confident	34 Å²	34	24.3 Å²	24.3	24%	0.238	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.7	-179.7	58.9	0	0	0	0	114.5	S557 I621 H625	S557-S623 VanDerWaalsContact CB-O 3.29Å; S557-S623 WeakPolarHBondContact CB-O 3.12Å; S557-S623 PolarHBondContact N-O 3.43Å; S557-S623 PolarHBondContact OG-O 2.85Å; I621-S623 VanDerWaalsContact CG2-OG 3.25Å; I621-S623 WeakPolarHBondContact CG2-OG 3.47Å; I621-S623 PolarHBondContact O-N 2.68Å; I621-S623 VanDerWaalsContact O-N 3.09Å; S623-H625 PolarHBondContact O-N 2.94Å
624	I	88.6	Confident	82.5	Confident	8 Å²	8	33.3 Å²	33.3	4%	0.041	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	111.1	177.8	-60.8	171.4	0	0	0	108.8	L559 F601 I621 P622 V627 R645 T646	L559-I624 HydrophobicContact CB-CD1 4.22Å; L559-I624 HydrophobicContact CB-CG2 4.05Å; L559-I624 HydrophobicContact CD2-CD1 3.91Å; F601-I624 HydrophobicContact CE1-CD1 4.09Å; F601-I624 HydrophobicContact CE1-CG1 3.72Å; F601-I624 HydrophobicContact CZ-CG1 4.18Å; I621-I624 HydrophobicContact CB-CD1 3.8Å; I621-I624 HydrophobicContact CB-CG1 4.01Å; I621-I624 HydrophobicContact CG2-CD1 4.35Å; I621-I624 HydrophobicContact CG2-CG1 4.07Å; I621-I624 PolarHBondContact O-N 3.22Å; P622-I624 VanDerWaalsContact C-N 3.28Å; P622-I624 PolarHBondContact O-N 3.01Å; I624-V627 HydrophobicContact CG2-CG2 3.9Å; I624-R645 HydrophobicContact CD1-CB 4.38Å; I624-T646 PolarHBondContact O-OG1 2.82Å; I624-T646 VanDerWaalsContact O-OG1 3.08Å
625	H	91.1	Very high	83.1	Confident	58 Å²	58	31.8 Å²	31.8	27%	0.269	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-41	172.8	-169.4	68.5	0	0	0	111	S557 S623 T646 K652 G653 T654	S557-H625 PolarHBondContact O-N 2.85Å; S557-H625 VanDerWaalsContact O-N 3.11Å; S623-H625 PolarHBondContact O-N 2.94Å; H625-T646 WeakPolarHBondContact O-CB 3.43Å; H625-T646 PolarHBondContact O-OG1 2.93Å; H625-K652 PolarHBondContact CE1-O 3.41Å; H625-K652 PolarHBondContact ND1-O 2.9Å; H625-K652 VanDerWaalsContact ND1-O 3.13Å; H625-G653 WeakPolarHBondContact O-CA 3.43Å; H625-T654 PolarHBondContact O-N 3.04Å
626	N	93.9	Very high	83.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.8	-171.1	-75.9	-48.6	0	0	0	111	L552 E555 S557 V558 L559 T654	L552-N626 HydrophobicContact CB-CB 4.48Å; L552-N626 PolarHBondContact O-ND2 2.97Å; E555-N626 PolarHBondContact OE2-ND2 3.24Å; S557-N626 PolarHBondContact O-N 3.45Å; S557-N626 VanDerWaalsContact O-N 3.13Å; V558-N626 CarbonylContact C-O 3.09Å; V558-N626 WeakPolarHBondContact CA-O 3.43Å; V558-N626 HydrophobicContact CG1-CB 4.45Å; V558-N626 HydrophobicContact CG2-CB 4.06Å; L559-N626 PolarHBondContact N-O 3.49Å; N626-T654 WeakPolarHBondContact CA-O 3.23Å; N626-T654 WeakPolarHBondContact OD1-CB 3.33Å
627	V	94.3	Very high	84.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.8	171.5	176.4	0	0	0	0	109	L559 F561 I624 R645 T646 T654 A655 Y656	L559-V627 CarbonylContact O-C 3.58Å; L559-V627 WeakPolarHBondContact O-CA 3.38Å; F561-V627 HydrophobicContact CD2-CG1 3.75Å; F561-V627 HydrophobicContact CE2-CG1 3.89Å; I624-V627 HydrophobicContact CG2-CG2 3.9Å; V627-R645 HydrophobicContact CG2-CB 4.01Å; V627-T646 HydrophobicContact CB-CG2 4.35Å; V627-T646 HydrophobicContact CG2-CG2 3.75Å; V627-T654 PolarHBondContact N-O 2.91Å; V627-A655 HydrophobicContact CB-CB 4.47Å; V627-A655 CarbonylContact O-C 3.58Å; V627-A655 VanDerWaalsContact O-CA 3.3Å; V627-A655 WeakPolarHBondContact O-CA 3.28Å; V627-Y656 PolarHBondContact O-N 3.5Å
628	I	96.3	Very high	85	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	110.7	177.9	-52.6	178	0	0	0	108.8	W544 L545 L552 V558 L559 I560 F561 Y630 Y656 L658	W544-I628 HydrophobicContact CZ3-CD1 4.48Å; W544-I628 HydrophobicContact CZ3-CG2 4.12Å; L545-I628 HydrophobicContact CD1-CD1 3.73Å; L545-I628 HydrophobicContact CD1-CG2 4.26Å; L552-I628 HydrophobicContact CD1-CD1 3.52Å; L552-I628 HydrophobicContact CD1-CG1 4.22Å; V558-I628 HydrophobicContact CG1-CD1 3.55Å; V558-I628 HydrophobicContact CG1-CG1 3.96Å; L559-I628 PolarHBondContact O-N 2.85Å; I560-I628 CarbonylContact C-O 3.58Å; I560-I628 WeakPolarHBondContact CA-O 3.21Å; I560-I628 HydrophobicContact CG1-CB 4.33Å; I560-I628 HydrophobicContact CG1-CD1 4.29Å; F561-I628 PolarHBondContact N-O 3.05Å; I628-Y630 PolarHBondContact O-N 2.91Å; I628-Y630 VanDerWaalsContact O-N 3.14Å; I628-Y656 CarbonylContact C-O 3.56Å; I628-Y656 WeakPolarHBondContact CA-O 3.45Å; I628-L658 HydrophobicContact CG2-CD1 4.41Å; I628-L658 HydrophobicContact CG2-CG 4.46Å
629	N	95.8	Very high	86.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	89.6	165.9	-59.8	-50.7	0	0	0	108.4	E631 R642 Y656 T657 L658	N629-E631 VanDerWaalsContact C-N 3.26Å; N629-R642 WeakPolarHBondContact OD1-CB 3.49Å; N629-R642 WeakPolarHBondContact OD1-CD 3.28Å; N629-Y656 PolarHBondContact N-O 3.18Å; N629-T657 HydrophobicContact CB-CG2 4.09Å; N629-T657 PolarHBondContact ND2-OG1 2.75Å; N629-L658 PolarHBondContact O-N 3.37Å
630	Y	95.8	Very high	87.1	Confident	14 Å²	14	33.7 Å²	33.7	6%	0.055	17%	0.172	C	C	.	.	S	Bend	trans	-65.6	-36.8	177.7	-172.9	-105.7	0	0	0	111.1	K541 L545 F561 V562 H567 V571 I628 L658	K541-Y630 HydrophobicContact CB-CE2 3.89Å; K541-Y630 WeakPolarHBondContact CE-O 3.26Å; K541-Y630 PolarHBondContact NZ-O 3.12Å; L545-Y630 HydrophobicContact CB-CE2 4.27Å; L545-Y630 HydrophobicContact CD2-CD2 3.93Å; L545-Y630 HydrophobicContact CD2-CE2 3.88Å; F561-Y630 WeakPolarHBondContact O-CB 3.48Å; F561-Y630 PolarHBondContact O-N 3.03Å; V562-Y630 HydrophobicContact CG2-CD1 4.38Å; H567-Y630 AromaticContact CE1-CE1 3.56Å; H567-Y630 AromaticContact NE2-CE1 3.57Å; V571-Y630 HydrophobicContact CG2-CD1 4.14Å; V571-Y630 HydrophobicContact CG2-CE1 3.85Å; I628-Y630 PolarHBondContact O-N 2.91Å; I628-Y630 VanDerWaalsContact O-N 3.14Å; Y630-L658 HydrophobicContact CD2-CD1 3.77Å; Y630-L658 HydrophobicContact CE2-CD1 4.29Å
631	E	93.4	Very high	87.6	Confident	23 Å²	23	33.2 Å²	33.2	11%	0.107	17%	0.169	C	C	.	.	S	Bend	trans	-115.1	143.4	166	-65	-174.5	145.2	0	0	110.1	F561 V562 T563 H567 N629 R642	F561-E631 PolarHBondContact O-N 3.05Å; V562-E631 HydrophobicContact CG1-CG 4.48Å; V562-E631 WeakPolarHBondContact CG1-OE2 3.35Å; T563-E631 WeakPolarHBondContact CA-OE2 3.47Å; T563-E631 VanDerWaalsContact CB-OE2 3.29Å; T563-E631 WeakPolarHBondContact CB-OE2 3.14Å; T563-E631 HydrophobicContact CG2-CB 3.87Å; T563-E631 PolarHBondContact N-OE2 2.86Å; T563-E631 PolarHBondContact OG1-OE2 3.32Å; H567-E631 IonicContact CE1-OE1 3.84Å; H567-E631 PolarHBondContact CE1-OE1 3.32Å; H567-E631 IonicContact CG-OE1 3.6Å; H567-E631 VanDerWaalsContact ND1-CD 3.31Å; H567-E631 IonicContact ND1-OE1 2.72Å; H567-E631 PolarHBondContact ND1-OE1 3.37Å; H567-E631 IonicContact ND1-OE2 3.75Å; N629-E631 VanDerWaalsContact C-N 3.26Å; E631-R642 PolarHBondContact O-NH1 2.97Å
632	V	93.1	Very high	88.1	Confident	11 Å²	11	33.3 Å²	33.3	7%	0.067	17%	0.169	C	C	.	.			trans	-59.9	151	174.8	-64.8	0	0	0	0	110.6	T563 T657 F659 D664 F668	T563-V632 VanDerWaalsContact CG2-O 3.31Å; T563-V632 WeakPolarHBondContact CG2-O 3.37Å; V632-T657 HydrophobicContact CG1-CG2 4.34Å; V632-F659 HydrophobicContact CG1-CD2 3.8Å; V632-F659 HydrophobicContact CG1-CE2 4.44Å; V632-D664 HydrophobicContact CG1-CB 4.28Å; V632-D664 WeakPolarHBondContact CG1-OD2 3.36Å; V632-D664 HydrophobicContact CG2-CB 3.92Å; V632-D664 WeakPolarHBondContact CG2-OD1 3.47Å; V632-F668 HydrophobicContact CB-CD1 4.09Å; V632-F668 HydrophobicContact CB-CE1 3.8Å; V632-F668 HydrophobicContact CB-CZ 4.31Å; V632-F668 HydrophobicContact CG1-CD1 4.24Å; V632-F668 HydrophobicContact CG1-CE1 3.94Å
633	A	90.8	Very high	89	Confident	5 Å²	5	28.3 Å²	28.3	4%	0.041	14%	0.137	C	C	.	.			trans	-73.4	162.5	175.2	0	0	0	0	0	110.3	D635 T638 H639 F668	A633-D635 VanDerWaalsContact C-N 3.3Å; A633-D635 WeakPolarHBondContact CB-O 3.43Å; A633-D635 PolarHBondContact O-N 3.42Å; A633-T638 HydrophobicContact CB-CG2 4.05Å; A633-H639 HydrophobicContact CB-CB 3.87Å; A633-F668 HydrophobicContact CB-CE2 4.25Å; A633-F668 HydrophobicContact CB-CZ 4.41Å; A633-F668 WeakPolarHBondContact O-CE2 3.47Å
634	R	87.5	Confident	89	Confident	203 Å²	203	26.8 Å²	26.8	77%	0.766	13%	0.126	S	C	*	.	S	Bend	trans	-66.3	-35.2	177.7	-59.4	-178	-174.6	-171.3	-0.6	112.2
635	D	86	Confident	88.8	Confident	69 Å²	69	26.8 Å²	26.8	37%	0.369	13%	0.126	S	C	.	.	S	Bend	trans	-144.2	168	179.5	59.1	27.5	0	0	0	111	A633 D637 T638 H639	A633-D635 VanDerWaalsContact C-N 3.3Å; A633-D635 WeakPolarHBondContact CB-O 3.43Å; A633-D635 PolarHBondContact O-N 3.42Å; D635-D637 VanDerWaalsContact C-N 3.3Å; D635-D637 PolarHBondContact O-N 3.33Å; D635-T638 PolarHBondContact O-N 2.98Å; D635-T638 WeakPolarHBondContact OD1-CA 3.44Å; D635-T638 WeakPolarHBondContact OD1-CB 3.34Å; D635-T638 PolarHBondContact OD1-N 3.07Å; D635-T638 PolarHBondContact OD1-OG1 2.96Å; D635-H639 PolarHBondContact O-N 3.44Å; D635-H639 VanDerWaalsContact O-N 3.07Å
636	I	86.3	Confident	88.7	Confident	37 Å²	37	24.1 Å²	24.1	19%	0.19	11%	0.114	C	C	.	.	H	α-helix	trans	-69.9	-27.6	-177.8	-164.6	61.2	0	0	0	112.7	H639 T640 C671 L672 H675	I636-H639 HydrophobicContact CD1-CB 4.26Å; I636-H639 WeakPolarHBondContact O-CB 3.48Å; I636-H639 PolarHBondContact O-N 3.37Å; I636-T640 WeakPolarHBondContact O-CB 3.48Å; I636-T640 PolarHBondContact O-N 3.39Å; I636-T640 PolarHBondContact O-OG1 3.35Å; I636-C671 HydrophobicContact CB-CB 4.13Å; I636-C671 HydrophobicContact CG1-CB 4.38Å; I636-L672 HydrophobicContact CD1-CB 4.45Å; I636-L672 HydrophobicContact CD1-CD1 4.17Å; I636-H675 HydrophobicContact CD1-CB 3.77Å; I636-H675 HydrophobicContact CG1-CB 4.06Å
637	D	80.3	Confident	88	Confident	33 Å²	33	24.3 Å²	24.3	18%	0.176	12%	0.116	C	C	.	.	H	α-helix	trans	-67.5	-46.4	177.1	-60.9	-66.6	0	0	0	110.4	K499 D635 H639 T640 H641	K499-D637 VanDerWaalsContact NZ-CG 3.26Å; K499-D637 IonicContact NZ-OD1 3.75Å; K499-D637 PolarHBondContact NZ-OD1 3.19Å; K499-D637 IonicContact NZ-OD2 3.46Å; K499-D637 PolarHBondContact NZ-OD2 3.2Å; D635-D637 VanDerWaalsContact C-N 3.3Å; D635-D637 PolarHBondContact O-N 3.33Å; D637-H639 VanDerWaalsContact C-N 3.32Å; D637-H639 PolarHBondContact O-N 3.28Å; D637-T640 WeakPolarHBondContact O-CB 3.43Å; D637-T640 PolarHBondContact O-N 3.29Å; D637-H641 PolarHBondContact O-N 3.5Å; D637-H641 PolarHBondContact O-ND1 2.76Å
638	T	84.4	Confident	87	Confident	14 Å²	14	26 Å²	26	9%	0.086	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-41.4	174.6	-58.5	0	0	0	0	110.4	D613 A633 D635 T640 H641 R642	D613-T638 WeakPolarHBondContact OD1-CG2 3.34Å; A633-T638 HydrophobicContact CB-CG2 4.05Å; D635-T638 PolarHBondContact O-N 2.98Å; D635-T638 WeakPolarHBondContact OD1-CA 3.44Å; D635-T638 WeakPolarHBondContact OD1-CB 3.34Å; D635-T638 PolarHBondContact OD1-N 3.07Å; D635-T638 PolarHBondContact OD1-OG1 2.96Å; T638-T640 PolarHBondContact O-N 2.81Å; T638-H641 PolarHBondContact O-N 2.87Å; T638-R642 HydrophobicContact CG2-CG 4.48Å; T638-R642 WeakPolarHBondContact O-CG 3.48Å; T638-R642 PolarHBondContact O-N 3.05Å
639	H	88.2	Confident	85.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-55.6	-49.5	172.8	179.9	83.5	0	0	0	112.1	A633 D635 I636 D637 H641 R642 I643 T657 F668 L672	A633-H639 HydrophobicContact CB-CB 3.87Å; D635-H639 PolarHBondContact O-N 3.44Å; D635-H639 VanDerWaalsContact O-N 3.07Å; I636-H639 HydrophobicContact CD1-CB 4.26Å; I636-H639 WeakPolarHBondContact O-CB 3.48Å; I636-H639 PolarHBondContact O-N 3.37Å; D637-H639 VanDerWaalsContact C-N 3.32Å; D637-H639 PolarHBondContact O-N 3.28Å; H639-H641 VanDerWaalsContact C-N 3.27Å; H639-H641 PolarHBondContact O-N 3.5Å; H639-R642 WeakPolarHBondContact O-CB 3.27Å; H639-R642 PolarHBondContact O-N 3.5Å; H639-R642 VanDerWaalsContact O-N 3.1Å; H639-I643 PolarHBondContact O-N 3.25Å; H639-T657 PolarHBondContact CE1-OG1 3.4Å; H639-T657 VanDerWaalsContact CE1-OG1 3.25Å; H639-F668 HydrophobicContact CB-CE2 4.2Å; H639-F668 HydrophobicContact CB-CZ 4.01Å; H639-F668 AromaticContact ND1-CZ 3.93Å; H639-L672 WeakPolarHBondContact NE2-CD1 3.4Å
640	T	83.7	Confident	84.2	Confident	46 Å²	46	33.4 Å²	33.4	28%	0.282	19%	0.189	S	C	.	.	H	α-helix	trans	-57.7	-40.7	177.4	-54.8	0	0	0	0	111.2	I636 D637 T638 I643 G644 H675	I636-T640 WeakPolarHBondContact O-CB 3.48Å; I636-T640 PolarHBondContact O-N 3.39Å; I636-T640 PolarHBondContact O-OG1 3.35Å; D637-T640 WeakPolarHBondContact O-CB 3.43Å; D637-T640 PolarHBondContact O-N 3.29Å; T638-T640 PolarHBondContact O-N 2.81Å; T640-I643 VanDerWaalsContact O-CG1 3.28Å; T640-I643 WeakPolarHBondContact O-CG1 3.3Å; T640-G644 PolarHBondContact O-N 3.28Å; T640-H675 PolarHBondContact OG1-CE1 3.22Å
641	H	80.3	Confident	83.5	Confident	35 Å²	35	35.4 Å²	35.4	16%	0.162	21%	0.208	C	C	.	.	H	α-helix	trans	-69.4	-34	176.5	-67.5	126.5	0	0	0	114.3	D637 T638 H639 R645	D637-H641 PolarHBondContact O-N 3.5Å; D637-H641 PolarHBondContact O-ND1 2.76Å; T638-H641 PolarHBondContact O-N 2.87Å; H639-H641 VanDerWaalsContact C-N 3.27Å; H639-H641 PolarHBondContact O-N 3.5Å; H641-R645 PolarHBondContact O-NE 3.18Å; H641-R645 PolarHBondContact O-NH2 2.68Å
642	R	88	Confident	83.1	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-52.4	176	-73.4	-175.9	-176.2	-174.5	0.7	110.3	F561 D613 N629 E631 T638 H639 G644 R645	F561-R642 HydrophobicContact CD1-CG 3.93Å; F561-R642 HydrophobicContact CD2-CB 3.74Å; F561-R642 HydrophobicContact CD2-CG 3.81Å; F561-R642 HydrophobicContact CE1-CG 3.9Å; F561-R642 HydrophobicContact CE2-CB 3.61Å; F561-R642 HydrophobicContact CE2-CG 3.8Å; F561-R642 HydrophobicContact CG-CB 4.31Å; F561-R642 HydrophobicContact CG-CG 3.88Å; F561-R642 HydrophobicContact CZ-CB 4.08Å; F561-R642 HydrophobicContact CZ-CG 3.84Å; D613-R642 IonicContact OD1-CZ 3.23Å; D613-R642 VanDerWaalsContact OD1-CZ 3.28Å; D613-R642 IonicContact OD1-NE 3.73Å; D613-R642 PolarHBondContact OD1-NE 3.44Å; D613-R642 IonicContact OD1-NH2 3.69Å; D613-R642 PolarHBondContact OD1-NH2 2.96Å; D613-R642 VanDerWaalsContact OD1-NH2 3.12Å; D613-R642 IonicContact OD2-CZ 2.86Å; D613-R642 IonicContact OD2-NE 3.9Å; D613-R642 IonicContact OD2-NH2 2.68Å; D613-R642 PolarHBondContact OD2-NH2 3.22Å; N629-R642 WeakPolarHBondContact OD1-CB 3.49Å; N629-R642 WeakPolarHBondContact OD1-CD 3.28Å; E631-R642 PolarHBondContact O-NH1 2.97Å; T638-R642 HydrophobicContact CG2-CG 4.48Å; T638-R642 WeakPolarHBondContact O-CG 3.48Å; T638-R642 PolarHBondContact O-N 3.05Å; H639-R642 WeakPolarHBondContact O-CB 3.27Å; H639-R642 PolarHBondContact O-N 3.5Å; H639-R642 VanDerWaalsContact O-N 3.1Å; R642-G644 VanDerWaalsContact C-N 3.27Å; R642-G644 PolarHBondContact O-N 3.41Å; R642-R645 WeakPolarHBondContact O-CB 3.27Å; R642-R645 VanDerWaalsContact O-CG 3.23Å; R642-R645 WeakPolarHBondContact O-CG 3.2Å; R642-R645 PolarHBondContact O-N 2.86Å; R642-R645 VanDerWaalsContact O-N 3.08Å
643	I	88.8	Confident	82.9	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-35.7	179.3	68.1	176.8	0	0	0	110.9	I528 Q530 H639 T640 R645 T646 A655	I528-I643 HydrophobicContact CD1-CB 4.45Å; I528-I643 HydrophobicContact CD1-CG1 4.26Å; I528-I643 WeakPolarHBondContact CD1-O 3.46Å; I528-I643 HydrophobicContact CG2-CB 4.48Å; Q530-I643 HydrophobicContact CG-CD1 4.33Å; H639-I643 PolarHBondContact O-N 3.25Å; T640-I643 VanDerWaalsContact O-CG1 3.28Å; T640-I643 WeakPolarHBondContact O-CG1 3.3Å; I643-R645 PolarHBondContact O-N 3.32Å; I643-T646 VanDerWaalsContact O-CG2 3.3Å; I643-T646 WeakPolarHBondContact O-CG2 3.48Å; I643-T646 PolarHBondContact O-N 2.85Å; I643-A655 HydrophobicContact CB-CB 3.8Å; I643-A655 HydrophobicContact CG2-CB 3.59Å
644	G	82.4	Confident	83	Confident	2 Å²	2	42 Å²	42	2%	0.021	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	4.2	173.4	0	0	0	0	0	115.6	T640 R642 T646 R648	T640-G644 PolarHBondContact O-N 3.28Å; R642-G644 VanDerWaalsContact C-N 3.27Å; R642-G644 PolarHBondContact O-N 3.41Å; G644-T646 VanDerWaalsContact C-N 3.28Å; G644-T646 CarbonylContact C-O 3.54Å; G644-R648 PolarHBondContact O-NE 2.9Å; G644-R648 PolarHBondContact O-NH2 3Å
645	R	85.4	Confident	83.4	Confident	9 Å²	9	32.3 Å²	32.3	3%	0.034	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-21.6	164.8	-60.2	-58.4	121.9	-176	2.7	112.5	L559 F561 L619 I624 V627 H641 R642 I643 R648	L559-R645 HydrophobicContact CD2-CB 3.77Å; L559-R645 HydrophobicContact CD2-CG 3.74Å; F561-R645 HydrophobicContact CE2-CG 4.04Å; F561-R645 HydrophobicContact CZ-CG 3.95Å; L619-R645 PolarHBondContact O-NH1 3.33Å; I624-R645 HydrophobicContact CD1-CB 4.38Å; V627-R645 HydrophobicContact CG2-CB 4.01Å; H641-R645 PolarHBondContact O-NE 3.18Å; H641-R645 PolarHBondContact O-NH2 2.68Å; R642-R645 WeakPolarHBondContact O-CB 3.27Å; R642-R645 VanDerWaalsContact O-CG 3.23Å; R642-R645 WeakPolarHBondContact O-CG 3.2Å; R642-R645 PolarHBondContact O-N 2.86Å; R642-R645 VanDerWaalsContact O-N 3.08Å; I643-R645 PolarHBondContact O-N 3.32Å; R645-R648 VanDerWaalsContact CZ-NH2 3.29Å
646	T	87.1	Confident	83.8	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.012	19%	0.186	C	C	.	.	S	Bend	trans	-107.9	176.9	168.4	-168.7	0	0	0	0	111	I528 I624 H625 V627 I643 G644 G653	I528-T646 HydrophobicContact CG1-CG2 4.38Å; I528-T646 HydrophobicContact CG2-CG2 4.09Å; I624-T646 PolarHBondContact O-OG1 2.82Å; I624-T646 VanDerWaalsContact O-OG1 3.08Å; H625-T646 WeakPolarHBondContact O-CB 3.43Å; H625-T646 PolarHBondContact O-OG1 2.93Å; V627-T646 HydrophobicContact CB-CG2 4.35Å; V627-T646 HydrophobicContact CG2-CG2 3.75Å; I643-T646 VanDerWaalsContact O-CG2 3.3Å; I643-T646 WeakPolarHBondContact O-CG2 3.48Å; I643-T646 PolarHBondContact O-N 2.85Å; G644-T646 VanDerWaalsContact C-N 3.28Å; G644-T646 CarbonylContact C-O 3.54Å; T646-G653 WeakPolarHBondContact OG1-CA 3.37Å
647	G	79.8	Confident	84.3	Confident	4 Å²	4	28.2 Å²	28.2	4%	0.041	18%	0.177	C	C	.	.	S	Bend	trans	74.5	30.4	176.9	0	0	0	0	0	114.6	N525 A651	N525-G647 PolarHBondContact ND2-O 3.23Å; G647-A651 CarbonylContact C-O 3.58Å; G647-A651 VanDerWaalsContact C-O 3.26Å; G647-A651 WeakPolarHBondContact CA-O 3.31Å
648	R	73.7	Confident	85	Confident	35 Å²	35	26.6 Å²	26.6	13%	0.132	17%	0.169	C	C	.	.			trans	-96	147.3	-171.8	-63.2	-174.5	176.1	-152	-1	112.2	L619 D620 G644 R645 G650 A651	L619-R648 PolarHBondContact O-NH1 3.02Å; L619-R648 PolarHBondContact O-NH2 3.36Å; D620-R648 VanDerWaalsContact CA-NH1 3.26Å; D620-R648 VanDerWaalsContact CB-NH1 3.3Å; D620-R648 WeakPolarHBondContact OD1-CD 3.49Å; D620-R648 IonicContact OD1-CZ 3.69Å; D620-R648 IonicContact OD1-NE 3.57Å; D620-R648 IonicContact OD1-NH1 3.89Å; D620-R648 PolarHBondContact OD1-NH1 3.36Å; G644-R648 PolarHBondContact O-NE 2.9Å; G644-R648 PolarHBondContact O-NH2 3Å; R645-R648 VanDerWaalsContact CZ-NH2 3.29Å; R648-G650 PolarHBondContact O-N 2.92Å; R648-G650 VanDerWaalsContact O-N 3.16Å; R648-A651 VanDerWaalsContact O-CB 3.3Å; R648-A651 WeakPolarHBondContact O-CB 3.35Å; R648-A651 PolarHBondContact O-N 3.4Å
649	A	66.1	Low	85.6	Confident	98 Å²	98	26 Å²	26	81%	0.81	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	34.2	174.1	0	0	0	0	0	114.9	A651	A649-A651 VanDerWaalsContact C-N 3.28Å; A649-A651 PolarHBondContact O-N 3.09Å
650	G	68	Low	85.8	Confident	58 Å²	58	26.1 Å²	26.1	60%	0.598	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.2	-3.7	-178.5	0	0	0	0	0	114.9	R648	R648-G650 PolarHBondContact O-N 2.92Å; R648-G650 VanDerWaalsContact O-N 3.16Å
651	A	79.5	Confident	86.1	Confident	55 Å²	55	25.2 Å²	25.2	46%	0.455	16%	0.163	S	C	.	.			trans	-70.1	138.3	167.7	0	0	0	0	0	109.6	G647 R648 A649	G647-A651 CarbonylContact C-O 3.58Å; G647-A651 VanDerWaalsContact C-O 3.26Å; G647-A651 WeakPolarHBondContact CA-O 3.31Å; R648-A651 VanDerWaalsContact O-CB 3.3Å; R648-A651 WeakPolarHBondContact O-CB 3.35Å; R648-A651 PolarHBondContact O-N 3.4Å; A649-A651 VanDerWaalsContact C-N 3.28Å; A649-A651 PolarHBondContact O-N 3.09Å
652	K	86.1	Confident	86.4	Confident	157 Å²	157	27.8 Å²	27.8	68%	0.683	20%	0.199	S	C	*	.			trans	-77.1	145.9	172.5	-64.9	-172.1	177.6	-172.7	0	110.5	D527 H625	D527-K652 WeakPolarHBondContact O-CA 3.38Å; H625-K652 PolarHBondContact CE1-O 3.41Å; H625-K652 PolarHBondContact ND1-O 2.9Å; H625-K652 VanDerWaalsContact ND1-O 3.13Å
653	G	89.2	Confident	86.4	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	157.5	178.6	0	0	0	0	0	112.6	D527 I528 T529 H625 T646	D527-G653 PolarHBondContact O-N 3.42Å; I528-G653 CarbonylContact C-O 3.58Å; I528-G653 WeakPolarHBondContact CA-O 3.34Å; T529-G653 PolarHBondContact N-O 3.38Å; H625-G653 WeakPolarHBondContact O-CA 3.43Å; T646-G653 WeakPolarHBondContact OG1-CA 3.37Å
654	T	93.1	Very high	86.5	Confident	19 Å²	19	34 Å²	34	12%	0.117	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132	172.7	-46.6	0	0	0	0	110	T529 H625 N626 V627 Y656	T529-T654 WeakPolarHBondContact O-CA 3.43Å; H625-T654 PolarHBondContact O-N 3.04Å; N626-T654 WeakPolarHBondContact CA-O 3.23Å; N626-T654 WeakPolarHBondContact OD1-CB 3.33Å; V627-T654 PolarHBondContact N-O 2.91Å; T654-Y656 HydrophobicContact CG2-CD2 4.07Å; T654-Y656 HydrophobicContact CG2-CE2 3.4Å; T654-Y656 VanDerWaalsContact CG2-CE2 3.4Å
655	A	94.3	Very high	86.9	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.008	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.3	176	0	0	0	0	0	110.6	I528 T529 Q530 H531 V627 I643	I528-A655 HydrophobicContact CG2-CB 3.73Å; T529-A655 PolarHBondContact O-N 3.3Å; Q530-A655 WeakPolarHBondContact CA-O 3.4Å; H531-A655 PolarHBondContact N-O 2.83Å; V627-A655 HydrophobicContact CB-CB 4.47Å; V627-A655 CarbonylContact O-C 3.58Å; V627-A655 VanDerWaalsContact O-CA 3.3Å; V627-A655 WeakPolarHBondContact O-CA 3.28Å; I643-A655 HydrophobicContact CB-CB 3.8Å; I643-A655 HydrophobicContact CG2-CB 3.59Å
656	Y	96.1	Very high	87.1	Confident	16 Å²	16	39.7 Å²	39.7	6%	0.063	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.3	174.8	-68.9	-85.1	0	0	0	110	H531 W544 R551 L552 V627 I628 N629 T654	H531-Y656 HydrophobicContact CB-CD1 3.51Å; H531-Y656 HydrophobicContact CB-CE1 3.62Å; H531-Y656 HydrophobicContact CB-CG 4.4Å; H531-Y656 AromaticContact CD2-CE1 3.47Å; H531-Y656 VanDerWaalsContact CD2-CE1 3.47Å; H531-Y656 WeakPolarHBondContact CD2-CE1 3.4Å; H531-Y656 AromaticContact CD2-CZ 3.68Å; H531-Y656 AromaticContact CG-CE1 3.71Å; H531-Y656 CarbonylContact O-C 3.52Å; H531-Y656 WeakPolarHBondContact O-CA 3.43Å; W544-Y656 AromaticContact CH2-CD1 3.61Å; W544-Y656 HydrophobicContact CH2-CD1 3.61Å; W544-Y656 HydrophobicContact CH2-CD2 4.18Å; W544-Y656 HydrophobicContact CH2-CE1 4.34Å; W544-Y656 AromaticContact CH2-CG 3.52Å; W544-Y656 HydrophobicContact CH2-CG 3.52Å; W544-Y656 AromaticContact CZ2-CD1 3.46Å; W544-Y656 HydrophobicContact CZ2-CD1 3.46Å; W544-Y656 VanDerWaalsContact CZ2-CD1 3.46Å; W544-Y656 AromaticContact CZ2-CE1 3.97Å; W544-Y656 HydrophobicContact CZ2-CE1 3.97Å; W544-Y656 AromaticContact CZ2-CG 3.91Å; W544-Y656 HydrophobicContact CZ2-CG 3.91Å; R551-Y656 PolarHBondContact NH2-OH 3.16Å; L552-Y656 HydrophobicContact CD1-CD2 4.38Å; L552-Y656 HydrophobicContact CD1-CE2 4.38Å; L552-Y656 HydrophobicContact CD2-CD2 4.23Å; L552-Y656 HydrophobicContact CD2-CE2 3.49Å; L552-Y656 VanDerWaalsContact CD2-CE2 3.49Å; V627-Y656 PolarHBondContact O-N 3.5Å; I628-Y656 CarbonylContact C-O 3.56Å; I628-Y656 WeakPolarHBondContact CA-O 3.45Å; N629-Y656 PolarHBondContact N-O 3.18Å; T654-Y656 HydrophobicContact CG2-CD2 4.07Å; T654-Y656 HydrophobicContact CG2-CE2 3.4Å; T654-Y656 VanDerWaalsContact CG2-CE2 3.4Å
657	T	96	Very high	87.2	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.1	175.8	-58.7	0	0	0	0	110.2	H531 V532 E533 N629 V632 H639	H531-T657 PolarHBondContact O-N 3.5Å; V532-T657 WeakPolarHBondContact CA-O 3.31Å; E533-T657 PolarHBondContact N-O 2.86Å; N629-T657 HydrophobicContact CB-CG2 4.09Å; N629-T657 PolarHBondContact ND2-OG1 2.75Å; V632-T657 HydrophobicContact CG1-CG2 4.34Å; H639-T657 PolarHBondContact CE1-OG1 3.4Å; H639-T657 VanDerWaalsContact CE1-OG1 3.25Å
658	L	95.8	Very high	87.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	106.7	-178.5	-47.7	-172.2	0	0	0	108.2	E533 F535 K541 W544 I628 N629 Y630	E533-L658 HydrophobicContact CB-CD2 3.99Å; E533-L658 HydrophobicContact CG-CD2 4.36Å; F535-L658 HydrophobicContact CD2-CB 4.29Å; F535-L658 HydrophobicContact CE2-CB 3.8Å; F535-L658 HydrophobicContact CE2-CD2 3.8Å; F535-L658 HydrophobicContact CE2-CG 4.24Å; F535-L658 HydrophobicContact CZ-CD2 4.22Å; K541-L658 HydrophobicContact CB-CD1 4.2Å; K541-L658 HydrophobicContact CD-CB 4.21Å; K541-L658 VanDerWaalsContact CE-C 3.48Å; K541-L658 WeakPolarHBondContact CE-O 3.5Å; K541-L658 HydrophobicContact CG-CB 4.2Å; K541-L658 HydrophobicContact CG-CD1 4.46Å; K541-L658 PolarHBondContact NZ-O 2.82Å; W544-L658 HydrophobicContact CD2-CD2 3.76Å; W544-L658 HydrophobicContact CE3-CD1 3.71Å; W544-L658 HydrophobicContact CE3-CD2 3.43Å; W544-L658 VanDerWaalsContact CE3-CD2 3.43Å; W544-L658 HydrophobicContact CE3-CG 4.19Å; W544-L658 HydrophobicContact CH2-CD2 3.94Å; W544-L658 HydrophobicContact CZ2-CD2 4.18Å; W544-L658 HydrophobicContact CZ3-CD1 4.09Å; W544-L658 HydrophobicContact CZ3-CD2 3.55Å; W544-L658 HydrophobicContact CZ3-CG 4.32Å; I628-L658 HydrophobicContact CG2-CD1 4.41Å; I628-L658 HydrophobicContact CG2-CG 4.46Å; N629-L658 PolarHBondContact O-N 3.37Å; Y630-L658 HydrophobicContact CD2-CD1 3.77Å; Y630-L658 HydrophobicContact CE2-CD1 4.29Å
659	F	95.4	Very high	88.7	Confident	0 Å²	0	43 Å²	43	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.9	-178.6	-169.9	-80	0	0	0	109.6	V532 E533 I534 F535 V632 D664 F668 A669 L687 I690	V532-F659 HydrophobicContact CG1-CB 4.16Å; E533-F659 PolarHBondContact O-N 3.32Å; I534-F659 CarbonylContact C-O 3.58Å; I534-F659 WeakPolarHBondContact CA-O 3.49Å; I534-F659 HydrophobicContact CG1-CB 4.26Å; I534-F659 HydrophobicContact CG1-CD1 4.5Å; F535-F659 PolarHBondContact N-O 3.06Å; V632-F659 HydrophobicContact CG1-CD2 3.8Å; V632-F659 HydrophobicContact CG1-CE2 4.44Å; F659-D664 WeakPolarHBondContact CA-OD2 3.17Å; F659-D664 HydrophobicContact CD1-CB 4.44Å; F659-D664 HydrophobicContact CD2-CB 4.06Å; F659-D664 HydrophobicContact CE1-CB 4.05Å; F659-D664 HydrophobicContact CE2-CB 3.65Å; F659-D664 HydrophobicContact CG-CB 4.43Å; F659-D664 HydrophobicContact CZ-CB 3.63Å; F659-F668 HydrophobicContact CE2-CD1 4.22Å; F659-A669 HydrophobicContact CE2-CB 3.92Å; F659-A669 HydrophobicContact CZ-CB 3.82Å; F659-L687 HydrophobicContact CD2-CD1 4.38Å; F659-L687 HydrophobicContact CG-CD1 4.41Å; F659-I690 HydrophobicContact CD1-CD1 4.23Å; F659-I690 HydrophobicContact CE1-CD1 3.88Å; F659-I690 HydrophobicContact CE1-CG2 4.2Å; F659-I690 HydrophobicContact CZ-CG2 4.26Å
660	V	94.1	Very high	89.8	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	115.7	172.6	-170.4	0	0	0	0	109.7	F535 I538 K541 G662 K663 D664	F535-V660 CarbonylContact O-C 3.58Å; F535-V660 WeakPolarHBondContact O-CA 3.2Å; I538-V660 HydrophobicContact CG1-CG1 4.28Å; I538-V660 HydrophobicContact CG1-CG2 4.38Å; K541-V660 HydrophobicContact CD-CG2 3.58Å; K541-V660 HydrophobicContact CG-CG2 4.15Å; V660-G662 PolarHBondContact O-N 3.13Å; V660-K663 HydrophobicContact CB-CB 4.09Å; V660-K663 HydrophobicContact CG1-CB 4.09Å; V660-K663 PolarHBondContact O-N 3.49Å; V660-D664 PolarHBondContact N-OD2 2.95Å; V660-D664 PolarHBondContact O-N 2.97Å
661	A	89.7	Confident	90.8	Very high	26 Å²	26	37.6 Å²	37.6	22%	0.215	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	129.7	172.7	0	0	0	0	0	110.5	I534 F535 K663 I690	I534-A661 HydrophobicContact CG2-CB 4.32Å; F535-A661 PolarHBondContact O-N 3.4Å; A661-K663 VanDerWaalsContact C-N 3.32Å; A661-K663 PolarHBondContact O-N 3.19Å; A661-I690 HydrophobicContact CB-CD1 3.85Å
662	G	85.8	Confident	91.4	Very high	89 Å²	89	35 Å²	35	92%	0.918	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.7	-20.4	178.4	0	0	0	0	0	115.5	V660	V660-G662 PolarHBondContact O-N 3.13Å
663	K	89	Confident	91.6	Very high	116 Å²	116	27.5 Å²	27.5	50%	0.504	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-46	171.7	-171.7	-165.8	-174.7	-177.8	0	111.9	I538 V660 A661	I538-K663 HydrophobicContact CD1-CD 3.68Å; I538-K663 HydrophobicContact CG1-CD 3.93Å; V660-K663 HydrophobicContact CB-CB 4.09Å; V660-K663 HydrophobicContact CG1-CB 4.09Å; V660-K663 PolarHBondContact O-N 3.49Å; A661-K663 VanDerWaalsContact C-N 3.32Å; A661-K663 PolarHBondContact O-N 3.19Å
664	D	90.9	Very high	91.5	Very high	19 Å²	19	31.7 Å²	31.7	10%	0.102	19%	0.194	C	C	.	.	S	Bend	trans	-81.4	145.6	-174.6	-66.5	-26	0	0	0	110.7	K541 V632 F659 V660 V666	K541-D664 IonicContact NZ-OD2 3.2Å; V632-D664 HydrophobicContact CG1-CB 4.28Å; V632-D664 WeakPolarHBondContact CG1-OD2 3.36Å; V632-D664 HydrophobicContact CG2-CB 3.92Å; V632-D664 WeakPolarHBondContact CG2-OD1 3.47Å; F659-D664 WeakPolarHBondContact CA-OD2 3.17Å; F659-D664 HydrophobicContact CD1-CB 4.44Å; F659-D664 HydrophobicContact CD2-CB 4.06Å; F659-D664 HydrophobicContact CE1-CB 4.05Å; F659-D664 HydrophobicContact CE2-CB 3.65Å; F659-D664 HydrophobicContact CG-CB 4.43Å; F659-D664 HydrophobicContact CZ-CB 3.63Å; V660-D664 PolarHBondContact N-OD2 2.95Å; V660-D664 PolarHBondContact O-N 2.97Å; D664-V666 PolarHBondContact O-N 3.27Å
665	P	90.1	Very high	91.1	Very high	75 Å²	75	31.4 Å²	31.4	49%	0.487	19%	0.191	S	C	.	.			trans	-62.2	134.4	-172.5	-23.3	33.4	0	0	0	113.4	D667 F668 A669	P665-D667 VanDerWaalsContact C-N 3.29Å; P665-D667 PolarHBondContact O-N 3.46Å; P665-F668 HydrophobicContact CB-CB 4.16Å; P665-F668 WeakPolarHBondContact O-CB 3.19Å; P665-F668 PolarHBondContact O-N 2.7Å; P665-F668 VanDerWaalsContact O-N 3.17Å; P665-A669 PolarHBondContact O-N 2.93Å
666	V	90.1	Very high	90.8	Very high	56 Å²	56	31.4 Å²	31.4	34%	0.339	19%	0.191	S	C	.	.	H	α-helix	trans	-64.5	-35.8	178.5	-170.1	0	0	0	0	111.4	D664 F668 A669 A670 I690 K693 C694	D664-V666 PolarHBondContact O-N 3.27Å; V666-F668 VanDerWaalsContact C-N 3.29Å; V666-F668 PolarHBondContact O-N 2.82Å; V666-A669 WeakPolarHBondContact O-CB 3.47Å; V666-A669 PolarHBondContact O-N 3.47Å; V666-A669 VanDerWaalsContact O-N 3.14Å; V666-A670 PolarHBondContact O-N 2.93Å; V666-I690 HydrophobicContact CG1-CG2 4.31Å; V666-I690 WeakPolarHBondContact CG1-O 3.06Å; V666-K693 HydrophobicContact CG1-CB 3.94Å; V666-C694 HydrophobicContact CG1-CB 3.97Å
667	D	89.3	Confident	90.3	Very high	97 Å²	97	34.9 Å²	34.9	52%	0.519	21%	0.208	S	C	.	.	H	α-helix	trans	-62.8	-36.7	176	-65.9	-23.6	0	0	0	112	P665 A670 C671 C694	P665-D667 VanDerWaalsContact C-N 3.29Å; P665-D667 PolarHBondContact O-N 3.46Å; D667-A670 PolarHBondContact O-N 3.36Å; D667-C671 PolarHBondContact O-N 3.31Å; D667-C671 PolarHBondContact O-SG 2.97Å; D667-C671 VanDerWaalsContact O-SG 3.41Å; D667-C694 PolarHBondContact OD1-SG 2.86Å
668	F	91.2	Very high	89.4	Confident	12 Å²	12	37.2 Å²	37.2	5%	0.053	22%	0.224	C	C	.	.	H	α-helix	trans	-65.9	-39.9	174.5	-176.8	-93.8	0	0	0	111.1	V632 A633 H639 F659 P665 V666 A670 C671 L672	V632-F668 HydrophobicContact CB-CD1 4.09Å; V632-F668 HydrophobicContact CB-CE1 3.8Å; V632-F668 HydrophobicContact CB-CZ 4.31Å; V632-F668 HydrophobicContact CG1-CD1 4.24Å; V632-F668 HydrophobicContact CG1-CE1 3.94Å; A633-F668 HydrophobicContact CB-CE2 4.25Å; A633-F668 HydrophobicContact CB-CZ 4.41Å; A633-F668 WeakPolarHBondContact O-CE2 3.47Å; H639-F668 HydrophobicContact CB-CE2 4.2Å; H639-F668 HydrophobicContact CB-CZ 4.01Å; H639-F668 AromaticContact ND1-CZ 3.93Å; F659-F668 HydrophobicContact CE2-CD1 4.22Å; P665-F668 HydrophobicContact CB-CB 4.16Å; P665-F668 WeakPolarHBondContact O-CB 3.19Å; P665-F668 PolarHBondContact O-N 2.7Å; P665-F668 VanDerWaalsContact O-N 3.17Å; V666-F668 VanDerWaalsContact C-N 3.29Å; V666-F668 PolarHBondContact O-N 2.82Å; F668-A670 VanDerWaalsContact C-N 3.35Å; F668-A670 PolarHBondContact O-N 3.35Å; F668-C671 PolarHBondContact O-N 3.04Å; F668-L672 HydrophobicContact CE1-CB 4.41Å; F668-L672 HydrophobicContact CE1-CD2 4.03Å; F668-L672 VanDerWaalsContact O-CB 3.23Å; F668-L672 WeakPolarHBondContact O-CB 3.34Å; F668-L672 PolarHBondContact O-N 3.26Å
669	A	92.3	Very high	88.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-42.6	174.7	0	0	0	0	0	112	F659 P665 V666 L672 V673 L687 I690	F659-A669 HydrophobicContact CE2-CB 3.92Å; F659-A669 HydrophobicContact CZ-CB 3.82Å; P665-A669 PolarHBondContact O-N 2.93Å; V666-A669 WeakPolarHBondContact O-CB 3.47Å; V666-A669 PolarHBondContact O-N 3.47Å; V666-A669 VanDerWaalsContact O-N 3.14Å; A669-L672 PolarHBondContact O-N 3.32Å; A669-V673 WeakPolarHBondContact O-CG2 3.4Å; A669-V673 PolarHBondContact O-N 3.37Å; A669-L687 HydrophobicContact CB-CD1 4.04Å; A669-I690 HydrophobicContact CB-CB 4.46Å; A669-I690 HydrophobicContact CB-CG2 3.82Å
670	A	90.4	Very high	87.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-48.6	175.6	0	0	0	0	0	112.8	V666 D667 F668 L672 V673 Q674 A691 C694 W696 F697	V666-A670 PolarHBondContact O-N 2.93Å; D667-A670 PolarHBondContact O-N 3.36Å; F668-A670 VanDerWaalsContact C-N 3.35Å; F668-A670 PolarHBondContact O-N 3.35Å; A670-L672 VanDerWaalsContact C-N 3.31Å; A670-L672 PolarHBondContact O-N 2.96Å; A670-V673 PolarHBondContact O-N 2.88Å; A670-Q674 PolarHBondContact O-N 3.41Å; A670-A691 HydrophobicContact CB-CB 4.32Å; A670-C694 HydrophobicContact CB-CB 3.95Å; A670-W696 HydrophobicContact CB-CH2 4.41Å; A670-W696 HydrophobicContact CB-CZ2 3.67Å; A670-F697 HydrophobicContact CB-CB 3.67Å; A670-F697 HydrophobicContact CB-CD2 3.84Å; A670-F697 HydrophobicContact CB-CG 3.8Å
671	C	89.4	Confident	87.1	Confident	43 Å²	43	44.2 Å²	44.2	29%	0.291	27%	0.27	S	S	.	.	H	α-helix	trans	-61.5	-39.6	174.9	-69.7	0	0	0	0	112.1	I636 D667 F668 Q674 H675	I636-C671 HydrophobicContact CB-CB 4.13Å; I636-C671 HydrophobicContact CG1-CB 4.38Å; D667-C671 PolarHBondContact O-N 3.31Å; D667-C671 PolarHBondContact O-SG 2.97Å; D667-C671 VanDerWaalsContact O-SG 3.41Å; F668-C671 PolarHBondContact O-N 3.04Å; C671-Q674 PolarHBondContact O-N 2.96Å; C671-H675 WeakPolarHBondContact O-CB 3.27Å; C671-H675 PolarHBondContact O-N 3.27Å
672	L	91	Very high	86.9	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.4	-40.5	179.7	-177.1	60.7	0	0	0	112.1	V532 I636 H639 F668 A669 A670 H675 L676 L687	V532-L672 HydrophobicContact CG1-CD2 4.21Å; V532-L672 HydrophobicContact CG2-CD2 3.92Å; V532-L672 HydrophobicContact CG2-CG 4.46Å; I636-L672 HydrophobicContact CD1-CB 4.45Å; I636-L672 HydrophobicContact CD1-CD1 4.17Å; H639-L672 WeakPolarHBondContact NE2-CD1 3.4Å; F668-L672 HydrophobicContact CE1-CB 4.41Å; F668-L672 HydrophobicContact CE1-CD2 4.03Å; F668-L672 VanDerWaalsContact O-CB 3.23Å; F668-L672 WeakPolarHBondContact O-CB 3.34Å; F668-L672 PolarHBondContact O-N 3.26Å; A669-L672 PolarHBondContact O-N 3.32Å; A670-L672 VanDerWaalsContact C-N 3.31Å; A670-L672 PolarHBondContact O-N 2.96Å; L672-H675 WeakPolarHBondContact O-CB 3.47Å; L672-H675 PolarHBondContact O-N 2.86Å; L672-L676 HydrophobicContact CD1-CG 4.4Å; L672-L676 HydrophobicContact CG-CD1 4.28Å; L672-L676 WeakPolarHBondContact O-CG 3.46Å; L672-L676 PolarHBondContact O-N 3.41Å; L672-L687 HydrophobicContact CD2-CD1 4.48Å; L672-L687 HydrophobicContact CD2-CD2 4.06Å; L672-L687 HydrophobicContact CG-CD2 4.16Å
673	V	91	Very high	87.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-48.9	174	170.9	0	0	0	0	110.3	A669 A670 H675 L676 E677 V683 L687 L688 A691 F697	A669-V673 WeakPolarHBondContact O-CG2 3.4Å; A669-V673 PolarHBondContact O-N 3.37Å; A670-V673 PolarHBondContact O-N 2.88Å; V673-H675 VanDerWaalsContact C-N 3.27Å; V673-H675 PolarHBondContact O-N 3.13Å; V673-L676 PolarHBondContact O-N 3.01Å; V673-E677 HydrophobicContact CG1-CG 4.36Å; V673-E677 WeakPolarHBondContact O-CG 3.44Å; V673-E677 PolarHBondContact O-N 2.74Å; V673-V683 HydrophobicContact CG1-CG1 4.12Å; V673-V683 HydrophobicContact CG2-CG1 4.05Å; V673-L687 HydrophobicContact CG2-CB 4.35Å; V673-L687 HydrophobicContact CG2-CD2 3.77Å; V673-L687 HydrophobicContact CG2-CG 3.69Å; V673-L688 HydrophobicContact CG1-CD1 4.27Å; V673-A691 HydrophobicContact CB-CB 4.35Å; V673-A691 HydrophobicContact CG2-CB 3.74Å; V673-F697 HydrophobicContact CB-CE2 4.31Å; V673-F697 HydrophobicContact CB-CZ 4.02Å; V673-F697 HydrophobicContact CG1-CE1 4.49Å; V673-F697 HydrophobicContact CG1-CE2 4.18Å; V673-F697 HydrophobicContact CG1-CZ 3.58Å
674	Q	85.9	Confident	87.3	Confident	90 Å²	90	45.2 Å²	45.2	42%	0.421	25%	0.25	S	C	.	.	H	α-helix	trans	-58.3	-41.9	177.5	-173	176.5	1.6	0	0	111.6	A670 C671 E677 S678	A670-Q674 PolarHBondContact O-N 3.41Å; C671-Q674 PolarHBondContact O-N 2.96Å; Q674-E677 PolarHBondContact O-N 3.4Å; Q674-S678 PolarHBondContact O-N 3.39Å; Q674-S678 PolarHBondContact O-OG 3.25Å; Q674-S678 VanDerWaalsContact O-OG 3.11Å
675	H	85.1	Confident	87.3	Confident	13 Å²	13	50.7 Å²	50.7	6%	0.06	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-42.1	177.7	-175.5	73.6	0	0	0	113.3	A524 I636 T640 C671 L672 V673 S678 G679	A524-H675 VanDerWaalsContact CB-CE1 3.48Å; A524-H675 WeakPolarHBondContact CB-CE1 3.44Å; A524-H675 VanDerWaalsContact CB-NE2 3.33Å; A524-H675 WeakPolarHBondContact CB-NE2 3.48Å; I636-H675 HydrophobicContact CD1-CB 3.77Å; I636-H675 HydrophobicContact CG1-CB 4.06Å; T640-H675 PolarHBondContact OG1-CE1 3.22Å; C671-H675 WeakPolarHBondContact O-CB 3.27Å; C671-H675 PolarHBondContact O-N 3.27Å; L672-H675 WeakPolarHBondContact O-CB 3.47Å; L672-H675 PolarHBondContact O-N 2.86Å; V673-H675 VanDerWaalsContact C-N 3.27Å; V673-H675 PolarHBondContact O-N 3.13Å; H675-S678 PolarHBondContact O-N 3.47Å; H675-G679 PolarHBondContact O-N 3.24Å; H675-G679 VanDerWaalsContact O-N 3.12Å
676	L	87.7	Confident	87.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-67.4	-39.7	176.8	-71.2	171.6	0	0	0	112	Q530 V532 L672 V673 G679 S680 Q681 V683 L687	Q530-L676 HydrophobicContact CB-CD2 3.62Å; Q530-L676 HydrophobicContact CG-CD2 4.37Å; V532-L676 HydrophobicContact CG2-CD1 3.78Å; L672-L676 HydrophobicContact CD1-CG 4.4Å; L672-L676 HydrophobicContact CG-CD1 4.28Å; L672-L676 WeakPolarHBondContact O-CG 3.46Å; L672-L676 PolarHBondContact O-N 3.41Å; V673-L676 PolarHBondContact O-N 3.01Å; L676-G679 CarbonylContact O-C 3.5Å; L676-G679 PolarHBondContact O-N 3.03Å; L676-S680 PolarHBondContact O-N 2.93Å; L676-Q681 HydrophobicContact CB-CB 4.26Å; L676-Q681 HydrophobicContact CD2-CB 3.83Å; L676-Q681 HydrophobicContact CD2-CG 4.25Å; L676-Q681 PolarHBondContact O-N 2.98Å; L676-V683 HydrophobicContact CB-CG2 3.82Å; L676-V683 HydrophobicContact CD1-CG2 4.39Å; L676-L687 HydrophobicContact CD1-CD2 3.88Å
677	E	86	Confident	87.5	Confident	88 Å²	88	49.8 Å²	49.8	41%	0.411	26%	0.256	S	S	.	.	H	α-helix	trans	-64.8	-41.8	176.4	-70.8	-174.8	141.9	0	0	111.6	V673 Q674 G679 S680 V683 R701	V673-E677 HydrophobicContact CG1-CG 4.36Å; V673-E677 WeakPolarHBondContact O-CG 3.44Å; V673-E677 PolarHBondContact O-N 2.74Å; Q674-E677 PolarHBondContact O-N 3.4Å; E677-G679 VanDerWaalsContact C-N 3.26Å; E677-G679 PolarHBondContact O-N 3.47Å; E677-S680 PolarHBondContact O-N 2.84Å; E677-V683 HydrophobicContact CG-CG2 3.79Å; E677-R701 IonicContact OE1-CZ 3.6Å; E677-R701 IonicContact OE1-NH1 3.78Å; E677-R701 IonicContact OE1-NH2 2.68Å; E677-R701 PolarHBondContact OE1-NH2 3.07Å; E677-R701 IonicContact OE2-CZ 2.78Å; E677-R701 IonicContact OE2-NH2 2.91Å; E677-R701 PolarHBondContact OE2-NH2 3.24Å
678	S	76.5	Confident	87.6	Confident	52 Å²	52	46.6 Å²	46.6	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-35.6	172.6	-64.6	0	0	0	0	112.4	Q674 H675 S680	Q674-S678 PolarHBondContact O-N 3.39Å; Q674-S678 PolarHBondContact O-OG 3.25Å; Q674-S678 VanDerWaalsContact O-OG 3.11Å; H675-S678 PolarHBondContact O-N 3.47Å; S678-S680 VanDerWaalsContact C-N 3.28Å; S678-S680 PolarHBondContact O-N 3.46Å
679	G	72.6	Confident	87.6	Confident	4 Å²	4	50.2 Å²	50.2	4%	0.041	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	10.1	177.4	0	0	0	0	0	115.4	H675 L676 E677 Q681	H675-G679 PolarHBondContact O-N 3.24Å; H675-G679 VanDerWaalsContact O-N 3.12Å; L676-G679 CarbonylContact O-C 3.5Å; L676-G679 PolarHBondContact O-N 3.03Å; E677-G679 VanDerWaalsContact C-N 3.26Å; E677-G679 PolarHBondContact O-N 3.47Å; G679-Q681 WeakPolarHBondContact O-CG 3.36Å; G679-Q681 PolarHBondContact O-N 3.22Å; G679-Q681 VanDerWaalsContact O-N 3.09Å; G679-Q681 PolarHBondContact O-NE2 2.74Å; G679-Q681 VanDerWaalsContact O-NE2 3.09Å
680	S	79.7	Confident	87.6	Confident	108 Å²	108	51 Å²	51	76%	0.755	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	31.8	-172.7	-63.1	0	0	0	0	113.8	L676 E677 S678	L676-S680 PolarHBondContact O-N 2.93Å; E677-S680 PolarHBondContact O-N 2.84Å; S678-S680 VanDerWaalsContact C-N 3.28Å; S678-S680 PolarHBondContact O-N 3.46Å
681	Q	84.8	Confident	87.5	Confident	40 Å²	40	51 Å²	51	19%	0.187	26%	0.263	C	S	.	.			trans	-89.5	155.5	-179.2	-60.8	-62.9	-55.1	0	0	111.2	Q530 L676 G679 V683	Q530-Q681 HydrophobicContact CB-CG 4.16Å; Q530-Q681 HydrophobicContact CG-CG 4.38Å; L676-Q681 HydrophobicContact CB-CB 4.26Å; L676-Q681 HydrophobicContact CD2-CB 3.83Å; L676-Q681 HydrophobicContact CD2-CG 4.25Å; L676-Q681 PolarHBondContact O-N 2.98Å; G679-Q681 WeakPolarHBondContact O-CG 3.36Å; G679-Q681 PolarHBondContact O-N 3.22Å; G679-Q681 VanDerWaalsContact O-N 3.09Å; G679-Q681 PolarHBondContact O-NE2 2.74Å; G679-Q681 VanDerWaalsContact O-NE2 3.09Å; Q681-V683 PolarHBondContact O-N 2.88Å
682	K	87.3	Confident	87.6	Confident	189 Å²	189	52.5 Å²	52.5	82%	0.822	27%	0.267	S	S	*	.			trans	-72.1	111.9	177.2	-175.1	179.9	179.3	-179.3	0	110.4	P684	K682-P684 WeakPolarHBondContact O-CD 3.27Å
683	V	89.9	Confident	87.5	Confident	27 Å²	27	60.2 Å²	60.2	16%	0.164	30%	0.301	C	S	.	.			trans	-80	124.8	174.1	-176.5	0	0	0	0	110.3	V673 L676 E677 Q681 L688	V673-V683 HydrophobicContact CG1-CG1 4.12Å; V673-V683 HydrophobicContact CG2-CG1 4.05Å; L676-V683 HydrophobicContact CB-CG2 3.82Å; L676-V683 HydrophobicContact CD1-CG2 4.39Å; E677-V683 HydrophobicContact CG-CG2 3.79Å; Q681-V683 PolarHBondContact O-N 2.88Å; V683-L688 HydrophobicContact CG1-CB 4.49Å
684	P	91.8	Very high	87.3	Confident	35 Å²	35	60.5 Å²	60.5	23%	0.227	30%	0.302	C	S	.	.			trans	-65.7	134.6	171	-18.5	30.9	0	0	0	111.2	V532 I534 K682 R686 L687 L688	V532-P684 HydrophobicContact CB-CG 4.08Å; V532-P684 VanDerWaalsContact O-CG 3.3Å; V532-P684 WeakPolarHBondContact O-CG 3.19Å; I534-P684 HydrophobicContact CD1-CB 4.42Å; K682-P684 WeakPolarHBondContact O-CD 3.27Å; P684-R686 VanDerWaalsContact C-N 3.27Å; P684-R686 PolarHBondContact O-N 3.42Å; P684-L687 HydrophobicContact CB-CB 4.3Å; P684-L687 WeakPolarHBondContact O-CA 2.88Å; P684-L687 VanDerWaalsContact O-CB 3.29Å; P684-L687 WeakPolarHBondContact O-CB 3.45Å; P684-L687 PolarHBondContact O-N 2.93Å; P684-L688 PolarHBondContact O-N 2.88Å
685	Q	91.4	Very high	87.2	Confident	134 Å²	134	62.1 Å²	62.1	63%	0.626	31%	0.314	S	S	*	.	H	α-helix	trans	-57.5	-41	179.6	-66.7	-62	-15.2	0	0	112.2	L687 L688 D689	Q685-L687 PolarHBondContact O-N 3.2Å; Q685-L687 VanDerWaalsContact O-N 3.14Å; Q685-L688 WeakPolarHBondContact O-CB 3.41Å; Q685-L688 PolarHBondContact O-N 2.7Å; Q685-D689 VanDerWaalsContact O-CG 3.25Å; Q685-D689 PolarHBondContact O-N 2.78Å
686	R	92.5	Very high	87.2	Confident	113 Å²	113	66.5 Å²	66.5	43%	0.426	33%	0.33	S	S	.	.	H	α-helix	trans	-57.5	-30.7	174.7	-65.5	-167	70.8	-177.6	4.1	113	I534 D536 P684 I690	I534-R686 HydrophobicContact CB-CB 4.43Å; I534-R686 HydrophobicContact CD1-CB 3.53Å; I534-R686 HydrophobicContact CG2-CB 4.42Å; D536-R686 IonicContact OD1-CZ 2.69Å; D536-R686 IonicContact OD1-NH1 3.21Å; D536-R686 IonicContact OD1-NH2 3.68Å; D536-R686 PolarHBondContact OD1-NH2 3.13Å; D536-R686 IonicContact OD2-CZ 3.84Å; D536-R686 IonicContact OD2-NH1 3.94Å; D536-R686 PolarHBondContact OD2-NH1 2.93Å; D536-R686 VanDerWaalsContact OD2-NH1 3.12Å; D536-R686 IonicContact OD2-NH2 2.76Å; D536-R686 PolarHBondContact OD2-NH2 3.14Å; P684-R686 VanDerWaalsContact C-N 3.27Å; P684-R686 PolarHBondContact O-N 3.42Å; R686-I690 WeakPolarHBondContact O-CD1 3.5Å; R686-I690 VanDerWaalsContact O-CG1 3.26Å; R686-I690 WeakPolarHBondContact O-CG1 3.22Å; R686-I690 PolarHBondContact O-N 3.46Å
687	L	92.4	Very high	87.1	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-73.6	-43.1	178.3	-168.8	64.1	0	0	0	110.1	V532 I534 F659 A669 L672 V673 L676 P684 Q685 D689 I690 A691	V532-L687 HydrophobicContact CB-CD2 4.31Å; V532-L687 HydrophobicContact CG1-CD1 4.18Å; V532-L687 HydrophobicContact CG1-CD2 4.07Å; V532-L687 HydrophobicContact CG2-CD2 4.3Å; I534-L687 HydrophobicContact CD1-CB 3.57Å; I534-L687 HydrophobicContact CD1-CD1 4.08Å; I534-L687 HydrophobicContact CD1-CG 4.42Å; F659-L687 HydrophobicContact CD2-CD1 4.38Å; F659-L687 HydrophobicContact CG-CD1 4.41Å; A669-L687 HydrophobicContact CB-CD1 4.04Å; L672-L687 HydrophobicContact CD2-CD1 4.48Å; L672-L687 HydrophobicContact CD2-CD2 4.06Å; L672-L687 HydrophobicContact CG-CD2 4.16Å; V673-L687 HydrophobicContact CG2-CB 4.35Å; V673-L687 HydrophobicContact CG2-CD2 3.77Å; V673-L687 HydrophobicContact CG2-CG 3.69Å; L676-L687 HydrophobicContact CD1-CD2 3.88Å; P684-L687 HydrophobicContact CB-CB 4.3Å; P684-L687 WeakPolarHBondContact O-CA 2.88Å; P684-L687 VanDerWaalsContact O-CB 3.29Å; P684-L687 WeakPolarHBondContact O-CB 3.45Å; P684-L687 PolarHBondContact O-N 2.93Å; Q685-L687 PolarHBondContact O-N 3.2Å; Q685-L687 VanDerWaalsContact O-N 3.14Å; L687-D689 VanDerWaalsContact C-N 3.32Å; L687-D689 PolarHBondContact O-N 3.05Å; L687-I690 PolarHBondContact O-N 3.2Å; L687-A691 WeakPolarHBondContact O-CB 3.18Å; L687-A691 PolarHBondContact O-N 3.21Å
688	L	91.2	Very high	87	Confident	29 Å²	29	64 Å²	64	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-43.3	175.9	-168.8	114.5	0	0	0	110.9	V673 V683 P684 Q685 I690 A691 L692	V673-L688 HydrophobicContact CG1-CD1 4.27Å; V683-L688 HydrophobicContact CG1-CB 4.49Å; P684-L688 PolarHBondContact O-N 2.88Å; Q685-L688 WeakPolarHBondContact O-CB 3.41Å; Q685-L688 PolarHBondContact O-N 2.7Å; L688-I690 VanDerWaalsContact C-N 3.28Å; L688-I690 PolarHBondContact O-N 3.23Å; L688-A691 PolarHBondContact O-N 3.05Å; L688-L692 HydrophobicContact CD2-CD1 3.85Å; L688-L692 HydrophobicContact CG-CD1 4.36Å; L688-L692 WeakPolarHBondContact O-CB 3.29Å; L688-L692 VanDerWaalsContact O-CG 3.28Å; L688-L692 WeakPolarHBondContact O-CG 3.04Å; L688-L692 PolarHBondContact O-N 3.32Å
689	D	91.4	Very high	87.2	Confident	88 Å²	88	65.8 Å²	65.8	47%	0.471	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-36.8	176.6	-62.9	-27.8	0	0	0	112.4	Q685 L687	Q685-D689 VanDerWaalsContact O-CG 3.25Å; Q685-D689 PolarHBondContact O-N 2.78Å; L687-D689 VanDerWaalsContact C-N 3.32Å; L687-D689 PolarHBondContact O-N 3.05Å
690	I	90.8	Very high	87.5	Confident	18 Å²	18	70 Å²	70	9%	0.092	35%	0.35	C	S	.	.	H	α-helix	trans	-71.5	-46.6	174.8	-64.7	164.4	0	0	0	109.7	I534 F659 A661 V666 A669 R686 L687 L688 L692 K693	I534-I690 HydrophobicContact CD1-CD1 4.39Å; I534-I690 HydrophobicContact CG2-CD1 4.06Å; F659-I690 HydrophobicContact CD1-CD1 4.23Å; F659-I690 HydrophobicContact CE1-CD1 3.88Å; F659-I690 HydrophobicContact CE1-CG2 4.2Å; F659-I690 HydrophobicContact CZ-CG2 4.26Å; A661-I690 HydrophobicContact CB-CD1 3.85Å; V666-I690 HydrophobicContact CG1-CG2 4.31Å; V666-I690 WeakPolarHBondContact CG1-O 3.06Å; A669-I690 HydrophobicContact CB-CB 4.46Å; A669-I690 HydrophobicContact CB-CG2 3.82Å; R686-I690 WeakPolarHBondContact O-CD1 3.5Å; R686-I690 VanDerWaalsContact O-CG1 3.26Å; R686-I690 WeakPolarHBondContact O-CG1 3.22Å; R686-I690 PolarHBondContact O-N 3.46Å; L687-I690 PolarHBondContact O-N 3.2Å; L688-I690 VanDerWaalsContact C-N 3.28Å; L688-I690 PolarHBondContact O-N 3.23Å; I690-L692 VanDerWaalsContact C-N 3.28Å; I690-L692 PolarHBondContact O-N 3.07Å; I690-K693 VanDerWaalsContact O-CB 3.29Å; I690-K693 WeakPolarHBondContact O-CB 3.42Å; I690-K693 PolarHBondContact O-N 2.81Å
691	A	90.1	Very high	87.5	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.9	-35.9	178.7	0	0	0	0	0	112.8	A670 V673 L687 L688 K693 C694 F697	A670-A691 HydrophobicContact CB-CB 4.32Å; V673-A691 HydrophobicContact CB-CB 4.35Å; V673-A691 HydrophobicContact CG2-CB 3.74Å; L687-A691 WeakPolarHBondContact O-CB 3.18Å; L687-A691 PolarHBondContact O-N 3.21Å; L688-A691 PolarHBondContact O-N 3.05Å; A691-K693 PolarHBondContact O-N 2.89Å; A691-C694 WeakPolarHBondContact O-CB 3.38Å; A691-C694 PolarHBondContact O-N 3.23Å; A691-F697 HydrophobicContact CB-CD1 3.86Å; A691-F697 HydrophobicContact CB-CE1 3.76Å; A691-F697 HydrophobicContact CB-CG 4.47Å; A691-F697 HydrophobicContact CB-CZ 4.29Å; A691-F697 WeakPolarHBondContact O-CD1 3.37Å
692	L	90	Very high	86.7	Confident	74 Å²	74	70.2 Å²	70.2	39%	0.387	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.1	175.7	-74.6	170.9	0	0	0	113.6	L688 I690 C694 F697 R701	L688-L692 HydrophobicContact CD2-CD1 3.85Å; L688-L692 HydrophobicContact CG-CD1 4.36Å; L688-L692 WeakPolarHBondContact O-CB 3.29Å; L688-L692 VanDerWaalsContact O-CG 3.28Å; L688-L692 WeakPolarHBondContact O-CG 3.04Å; L688-L692 PolarHBondContact O-N 3.32Å; I690-L692 VanDerWaalsContact C-N 3.28Å; I690-L692 PolarHBondContact O-N 3.07Å; L692-C694 PolarHBondContact O-N 3.18Å; L692-F697 HydrophobicContact CD2-CD1 4.35Å; L692-F697 HydrophobicContact CD2-CE1 4.34Å; L692-R701 HydrophobicContact CD2-CG 4.45Å
693	K	88.8	Confident	85.4	Confident	162 Å²	162	64.9 Å²	64.9	70%	0.704	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-14.9	170.7	-59.5	177.1	-177.6	-178.3	0	112.3	V666 I690 A691	V666-K693 HydrophobicContact CG1-CB 3.94Å; I690-K693 VanDerWaalsContact O-CB 3.29Å; I690-K693 WeakPolarHBondContact O-CB 3.42Å; I690-K693 PolarHBondContact O-N 2.81Å; A691-K693 PolarHBondContact O-N 2.89Å
694	C	86.9	Confident	83.8	Confident	5 Å²	5	70 Å²	70	3%	0.034	36%	0.357	C	S	.	.	S	Bend	trans	-81.2	124.7	174.9	-176.8	0	0	0	0	110.8	V666 D667 A670 A691 L692 W696 F697 A698	V666-C694 HydrophobicContact CG1-CB 3.97Å; D667-C694 PolarHBondContact OD1-SG 2.86Å; A670-C694 HydrophobicContact CB-CB 3.95Å; A691-C694 WeakPolarHBondContact O-CB 3.38Å; A691-C694 PolarHBondContact O-N 3.23Å; L692-C694 PolarHBondContact O-N 3.18Å; C694-W696 PolarHBondContact O-N 3.17Å; C694-W696 PolarHBondContact SG-NE1 3.1Å; C694-F697 HydrophobicContact CB-CB 4.1Å; C694-F697 PolarHBondContact O-N 2.82Å; C694-A698 WeakPolarHBondContact O-CB 3.47Å; C694-A698 PolarHBondContact O-N 3.39Å
695	N	83.9	Confident	81.7	Confident	124 Å²	124	75.3 Å²	75.3	66%	0.663	38%	0.383	S	S	*	.	H	α-helix	trans	-61.5	-42.9	-171.8	-165	40.2	0	0	0	113.2	F697 N699	N695-F697 PolarHBondContact O-N 3.01Å; N695-N699 WeakPolarHBondContact O-CB 3.28Å; N695-N699 PolarHBondContact O-N 2.98Å; N695-N699 VanDerWaalsContact O-N 3.14Å; N695-N699 PolarHBondContact O-ND2 3.44Å; N695-N699 VanDerWaalsContact O-ND2 3.09Å
696	W	86.2	Confident	79.6	Confident	105 Å²	105	72.1 Å²	72.1	40%	0.398	39%	0.386	S	S	.	.	H	α-helix	trans	-69.5	-35	-179.2	75.5	-98.2	0	0	0	112.2	A670 C694 N700	A670-W696 HydrophobicContact CB-CH2 4.41Å; A670-W696 HydrophobicContact CB-CZ2 3.67Å; C694-W696 PolarHBondContact O-N 3.17Å; C694-W696 PolarHBondContact SG-NE1 3.1Å; W696-N700 PolarHBondContact O-N 2.99Å; W696-N700 VanDerWaalsContact O-N 3.15Å
697	F	85.6	Confident	77.2	Confident	6 Å²	6	77.4 Å²	77.4	3%	0.026	41%	0.406	C	S	.	.	H	α-helix	trans	-72	-44.2	179.1	-172.3	-97.7	0	0	0	111.9	A670 V673 A691 L692 C694 N695 N699 N700 R701	A670-F697 HydrophobicContact CB-CB 3.67Å; A670-F697 HydrophobicContact CB-CD2 3.84Å; A670-F697 HydrophobicContact CB-CG 3.8Å; V673-F697 HydrophobicContact CB-CE2 4.31Å; V673-F697 HydrophobicContact CB-CZ 4.02Å; V673-F697 HydrophobicContact CG1-CE1 4.49Å; V673-F697 HydrophobicContact CG1-CE2 4.18Å; V673-F697 HydrophobicContact CG1-CZ 3.58Å; A691-F697 HydrophobicContact CB-CD1 3.86Å; A691-F697 HydrophobicContact CB-CE1 3.76Å; A691-F697 HydrophobicContact CB-CG 4.47Å; A691-F697 HydrophobicContact CB-CZ 4.29Å; A691-F697 WeakPolarHBondContact O-CD1 3.37Å; L692-F697 HydrophobicContact CD2-CD1 4.35Å; L692-F697 HydrophobicContact CD2-CE1 4.34Å; C694-F697 HydrophobicContact CB-CB 4.1Å; C694-F697 PolarHBondContact O-N 2.82Å; N695-F697 PolarHBondContact O-N 3.01Å; F697-N699 VanDerWaalsContact C-N 3.32Å; F697-N699 PolarHBondContact O-N 3.31Å; F697-N700 PolarHBondContact O-N 3.21Å; F697-R701 HydrophobicContact CD1-CG 4.29Å; F697-R701 HydrophobicContact CE1-CG 3.92Å; F697-R701 HydrophobicContact CZ-CG 4.22Å; F697-R701 PolarHBondContact O-N 3.25Å
698	A	82.9	Confident	74.6	Confident	30 Å²	30	84.8 Å²	84.8	25%	0.248	45%	0.446	C	S	.	.	H	α-helix	trans	-59.7	-41.5	175.6	0	0	0	0	0	112.1	C694 R701 S702	C694-A698 WeakPolarHBondContact O-CB 3.47Å; C694-A698 PolarHBondContact O-N 3.39Å; A698-R701 PolarHBondContact O-N 2.94Å; A698-S702 WeakPolarHBondContact O-CB 3.48Å; A698-S702 PolarHBondContact O-N 3.44Å; A698-S702 PolarHBondContact O-OG 3.41Å; A698-S702 VanDerWaalsContact O-OG 3.12Å
699	N	81	Confident	72.2	Confident	90 Å²	90	91.6 Å²	91.6	48%	0.481	48%	0.477	S	S	.	.	H	α-helix	trans	-65.8	-38.5	176.8	-71.4	-23	0	0	0	112.6	N695 F697 S702 S703	N695-N699 WeakPolarHBondContact O-CB 3.28Å; N695-N699 PolarHBondContact O-N 2.98Å; N695-N699 VanDerWaalsContact O-N 3.14Å; N695-N699 PolarHBondContact O-ND2 3.44Å; N695-N699 VanDerWaalsContact O-ND2 3.09Å; F697-N699 VanDerWaalsContact C-N 3.32Å; F697-N699 PolarHBondContact O-N 3.31Å; N699-S702 PolarHBondContact O-OG 2.81Å; N699-S702 VanDerWaalsContact O-OG 3.09Å; N699-S703 PolarHBondContact O-N 3.04Å
700	N	78.9	Confident	69.4	Low	92 Å²	92	91.6 Å²	91.6	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-69.1	-37.8	177.9	-160.7	31.2	0	0	0	111.8	W696 F697	W696-N700 PolarHBondContact O-N 2.99Å; W696-N700 VanDerWaalsContact O-N 3.15Å; F697-N700 PolarHBondContact O-N 3.21Å
701	R	79.4	Confident	66.7	Low	79 Å²	79	95.8 Å²	95.8	30%	0.298	53%	0.527	S	S	.	.	H	α-helix	trans	-69.4	-43.3	176.2	-78.2	-82.7	-174.8	149.6	2.2	113	E677 L692 F697 A698 S703 L704 N705	E677-R701 IonicContact OE1-CZ 3.6Å; E677-R701 IonicContact OE1-NH1 3.78Å; E677-R701 IonicContact OE1-NH2 2.68Å; E677-R701 PolarHBondContact OE1-NH2 3.07Å; E677-R701 IonicContact OE2-CZ 2.78Å; E677-R701 IonicContact OE2-NH2 2.91Å; E677-R701 PolarHBondContact OE2-NH2 3.24Å; L692-R701 HydrophobicContact CD2-CG 4.45Å; F697-R701 HydrophobicContact CD1-CG 4.29Å; F697-R701 HydrophobicContact CE1-CG 3.92Å; F697-R701 HydrophobicContact CZ-CG 4.22Å; F697-R701 PolarHBondContact O-N 3.25Å; A698-R701 PolarHBondContact O-N 2.94Å; R701-S703 VanDerWaalsContact C-N 3.29Å; R701-S703 PolarHBondContact O-N 3.22Å; R701-L704 PolarHBondContact O-N 3.15Å; R701-L704 VanDerWaalsContact O-N 3.11Å; R701-N705 PolarHBondContact O-N 3.27Å
702	S	67.9	Low	64.1	Low	74 Å²	74	103.5 Å²	103.5	52%	0.517	57%	0.567	S	S	.	*	H	α-helix	trans	-66.1	-32.7	179.1	61	0	0	0	0	112.2	A698 N699 L704 N705 G706	A698-S702 WeakPolarHBondContact O-CB 3.48Å; A698-S702 PolarHBondContact O-N 3.44Å; A698-S702 PolarHBondContact O-OG 3.41Å; A698-S702 VanDerWaalsContact O-OG 3.12Å; N699-S702 PolarHBondContact O-OG 2.81Å; N699-S702 VanDerWaalsContact O-OG 3.09Å; S702-L704 VanDerWaalsContact C-N 3.26Å; S702-L704 PolarHBondContact O-N 2.67Å; S702-N705 PolarHBondContact O-N 2.9Å; S702-G706 PolarHBondContact O-N 2.92Å
703	S	60.3	Low	61.7	Low	78 Å²	78	111.2 Å²	111.2	55%	0.545	59%	0.591	S	S	.	*	H	α-helix	trans	-66.6	-23.8	172.9	-172.5	0	0	0	0	113.7	N699 R701	N699-S703 PolarHBondContact O-N 3.04Å; R701-S703 VanDerWaalsContact C-N 3.29Å; R701-S703 PolarHBondContact O-N 3.22Å
704	L	55.5	Low	59.3	Low	134 Å²	134	109.3 Å²	109.3	70%	0.702	60%	0.595	S	S	*	*	H	α-helix	trans	-80.1	-37.3	177.6	-123.3	86.5	0	0	0	112.1	R701 S702	R701-L704 PolarHBondContact O-N 3.15Å; R701-L704 VanDerWaalsContact O-N 3.11Å; S702-L704 VanDerWaalsContact C-N 3.26Å; S702-L704 PolarHBondContact O-N 2.67Å
705	N	48.8	Very low	56.8	Low	146 Å²	146	115.4 Å²	115.4	78%	0.781	64%	0.638	S	S	*	*	H	α-helix	trans	-79.7	-16.2	177.9	-83.9	19.9	0	0	0	113.6	R701 S702 R707	R701-N705 PolarHBondContact O-N 3.27Å; S702-N705 PolarHBondContact O-N 2.9Å; N705-R707 VanDerWaalsContact C-N 3.31Å; N705-R707 PolarHBondContact O-N 3.34Å
706	G	46.2	Very low	54.6	Low	67 Å²	67	112.9 Å²	112.9	69%	0.691	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	2.4	-177.9	0	0	0	0	0	116.5	S702	S702-G706 PolarHBondContact O-N 2.92Å
707	R	43.3	Very low	52	Low	224 Å²	224	111.5 Å²	111.5	85%	0.845	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	2.3	-174.8	-87.9	-176.4	169.8	175.3	-1.7	115.9	N705	N705-R707 VanDerWaalsContact C-N 3.31Å; N705-R707 PolarHBondContact O-N 3.34Å
708	N	38.4	Very low	49.8	Very low	155 Å²	155	121.2 Å²	121.2	83%	0.829	70%	0.702	S	S	*	*	S	Bend	trans	-136.3	15.5	-172.6	-133.1	13.1	0	0	0	117.8
709	E	39	Very low	47.7	Very low	172 Å²	172	128.5 Å²	128.5	80%	0.804	73%	0.731	S	S	*	*			trans	-129.6	99.8	168	-76.2	-166.1	151.7	0	0	111.4	C711	E709-C711 VanDerWaalsContact C-N 3.28Å; E709-C711 PolarHBondContact O-N 2.71Å
710	G	33.9	Very low	45.7	Very low	89 Å²	89	129.9 Å²	129.9	92%	0.918	75%	0.745	S	S	*	*			trans	-64.2	95.1	152.4	0	0	0	0	0	108
711	C	34.1	Very low	43.6	Very low	105 Å²	105	137.5 Å²	137.5	71%	0.709	77%	0.767	S	S	*	*			trans	-134.4	127	169	-125.7	0	0	0	0	111.6	E709 R713	E709-C711 VanDerWaalsContact C-N 3.28Å; E709-C711 PolarHBondContact O-N 2.71Å; C711-R713 PolarHBondContact O-N 2.98Å
712	I	34.3	Very low	41.7	Very low	163 Å²	163	142.1 Å²	142.1	84%	0.836	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-56.7	118.8	-176.8	-65.1	168.3	0	0	0	109.1
713	R	40	Very low	40.4	Very low	235 Å²	235	144.5 Å²	144.5	89%	0.887	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.1	128.3	168.5	-73	-174.1	174.4	-167	-2.1	109.2	C711	C711-R713 PolarHBondContact O-N 2.98Å
714	P	38.8	Very low	39.4	Very low	123 Å²	123	153 Å²	153	80%	0.799	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-71.6	138	170.9	30.1	-30.2	0	0	0	109.5	G716	P714-G716 PolarHBondContact O-N 3.39Å
715	S	34.6	Very low	38.4	Very low	132 Å²	132	151.1 Å²	151.1	92%	0.923	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-52.8	118.1	177.1	-166.2	0	0	0	0	111.5
716	G	36.8	Very low	38.3	Very low	71 Å²	71	155.7 Å²	155.7	73%	0.732	84%	0.836	S	S	*	*			trans	-148.3	110.1	174.1	0	0	0	0	0	108.5	P714	P714-G716 PolarHBondContact O-N 3.39Å
717	G	33	Very low	38	Very low	77 Å²	77	158.5 Å²	158.5	79%	0.794	84%	0.842	S	S	*	*			trans	-59.8	132.1	-160.1	0	0	0	0	0	115.9
718	F	38.1	Very low	37.8	Very low	210 Å²	210	151.1 Å²	151.1	92%	0.921	84%	0.836	S	S	*	*			trans	-150.4	121.9	147.4	-138.5	-99.6	0	0	0	108
719	E	39.5	Very low	38.1	Very low	183 Å²	183	152.5 Å²	152.5	86%	0.855	84%	0.842	S	S	*	*			trans	-55.1	133.4	-172.8	-69.6	176.7	107.3	0	0	113.1	R721	E719-R721 PolarHBondContact O-N 2.86Å
720	P	38.3	Very low	38.2	Very low	119 Å²	119	147.9 Å²	147.9	77%	0.773	84%	0.84	S	S	*	*			trans	-81.7	114.4	167.1	30.5	-27.1	0	0	0	109.6	Q722	P720-Q722 PolarHBondContact O-N 3.41Å; P720-Q722 VanDerWaalsContact O-N 3.17Å
721	R	36.5	Very low	38.5	Very low	252 Å²	252	151.4 Å²	151.4	95%	0.951	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-58.7	116.6	166.1	-87.5	-178.3	164.6	154.5	-2.7	109.7	E719	E719-R721 PolarHBondContact O-N 2.86Å
722	Q	39.1	Very low	38.6	Very low	176 Å²	176	150.5 Å²	150.5	82%	0.822	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-61	146.3	178	-64.6	-178.7	-2.8	0	0	112.6	P720 R724	P720-Q722 PolarHBondContact O-N 3.41Å; P720-Q722 VanDerWaalsContact O-N 3.17Å; Q722-R724 PolarHBondContact O-N 3.4Å
723	P	40.8	Very low	38.7	Very low	124 Å²	124	148 Å²	148	81%	0.805	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-71.6	124.3	164.6	5.1	10.5	0	0	0	109	A725	P723-A725 PolarHBondContact O-N 3.32Å; P723-A725 VanDerWaalsContact O-N 3.17Å
724	R	38.5	Very low	38.6	Very low	255 Å²	255	143.5 Å²	143.5	96%	0.962	82%	0.823	S	S	*	*			trans	-59.8	115.3	172.9	-80.4	180	168.1	144.2	-3.3	110.4	Q722	Q722-R724 PolarHBondContact O-N 3.4Å
725	A	34.6	Very low	38.5	Very low	95 Å²	95	142 Å²	142	79%	0.785	82%	0.815	S	S	*	*			trans	-94.7	144.3	157.7	0	0	0	0	0	110.3	P723	P723-A725 PolarHBondContact O-N 3.32Å; P723-A725 VanDerWaalsContact O-N 3.17Å
726	R	46.2	Very low	38.5	Very low	242 Å²	242	139.9 Å²	139.9	91%	0.913	80%	0.801	S	S	*	*			trans	-158.3	148.9	164.7	-103.4	-168.2	-179.1	-171.4	-0	107.9
727	P	40.3	Very low	38.3	Very low	127 Å²	127	145.2 Å²	145.2	83%	0.825	81%	0.806	S	S	*	*				-137.3	160.3	-62.5	29.3	-9.4	0	0	0	113.5
728	G	39.5	Very low	38.4	Very low	69 Å²	69	145.7 Å²	145.7	71%	0.711	80%	0.798	S	S	*	*			trans	140.2	121.8	145.1	0	0	0	0	0	119.3
729	L	44.6	Very low	38.2	Very low	184 Å²	184	142.5 Å²	142.5	96%	0.963	79%	0.79	S	S	*	*			trans	77	100.4	158.9	-59.8	151	0	0	0	115.4
730	G	40.1	Very low	38.2	Very low	74 Å²	74	144.6 Å²	144.6	76%	0.763	79%	0.792	S	S	*	*				91.9	125.3	50.8	0	0	0	0	0	108.5
731	L	40	Very low	38.1	Very low	163 Å²	163	149.1 Å²	149.1	85%	0.853	80%	0.795	S	S	*	*			cis	-168.4	145.3	18.3	-152	81.2	0	0	0	109
732	S	37.8	Very low	39	Very low	87 Å²	87	142.5 Å²	142.5	61%	0.608	79%	0.785	S	S	*	*			trans	48.6	113.9	143.4	52	0	0	0	0	121.5
733	S	35.8	Very low	39	Very low	110 Å²	110	145.2 Å²	145.2	77%	0.769	79%	0.788	S	S	*	*				68.6	134.7	90.4	80.4	0	0	0	0	113
734	D	38.3	Very low	38.9	Very low	140 Å²	140	144.4 Å²	144.4	75%	0.749	79%	0.785	S	S	*	*			cis	-174.3	161.5	42.5	-161.4	12.2	0	0	0	109.7
735	S	35.9	Very low	38.9	Very low	91 Å²	91	135.8 Å²	135.8	64%	0.636	78%	0.775	S	S	*	*			trans	37.5	149.8	147.5	54.9	0	0	0	0	121.9
736	S	33.8	Very low	39.6	Very low	89 Å²	89	137.4 Å²	137.4	62%	0.622	78%	0.778	S	S	*	*			cis	175.4	150.9	-0.5	42.5	0	0	0	0	106.9
737	E	33.6	Very low	39.2	Very low	182 Å²	182	130.4 Å²	130.4	85%	0.85	77%	0.771	S	S	*	*			trans	60.8	151.9	154	-79.3	167.7	116	0	0	119.3
738	S	35.8	Very low	39	Very low	88 Å²	88	128.9 Å²	128.9	62%	0.615	77%	0.77	S	S	*	*			cis	-173.1	159.9	-4.4	48.8	0	0	0	0	107.9
739	D	34.3	Very low	38.9	Very low	143 Å²	143	130.6 Å²	130.6	77%	0.765	78%	0.777	S	S	*	*			trans	62.9	127.9	151.3	-56.3	-28.5	0	0	0	122.8
740	Y	38.4	Very low	38.5	Very low	226 Å²	226	126.4 Å²	126.4	89%	0.886	77%	0.769	S	S	*	*				173.4	148.3	92.7	-149.4	-101.1	0	0	0	112.5
741	Y	37.4	Very low	38.3	Very low	215 Å²	215	127.8 Å²	127.8	84%	0.843	77%	0.773	S	S	*	*			trans	-94.4	-177.1	-170	-96.7	-63	0	0	0	113.4
742	P	55.3	Low	38.4	Very low	113 Å²	113	125.2 Å²	125.2	73%	0.734	78%	0.776	S	S	*	*			trans	-113.2	179	-141	44	-33.2	0	0	0	114.9
743	R	38.3	Very low	38.3	Very low	233 Å²	233	124.8 Å²	124.8	88%	0.879	79%	0.785	S	S	*	*			trans	-170.2	141	146.9	-136.4	-177.1	171.4	-172.6	-3.8	117.5
744	S	39.3	Very low	38.2	Very low	107 Å²	107	129.4 Å²	129.4	75%	0.748	80%	0.795	S	S	*	*			trans	78	127	138.3	51.6	0	0	0	0	123.3
745	G	37.5	Very low	37.9	Very low	74 Å²	74	126.4 Å²	126.4	76%	0.763	80%	0.797	S	S	*	*			trans	-72.1	-143.8	179	0	0	0	0	0	116.8
746	P	49.9	Very low	37.5	Very low	128 Å²	128	127.1 Å²	127.1	83%	0.831	81%	0.808	S	S	*	*			cis	-141.6	174.5	14.9	41.7	-21.6	0	0	0	118.3
747	A	36.7	Very low	37.3	Very low	95 Å²	95	132.1 Å²	132.1	79%	0.785	82%	0.821	S	S	*	*			trans	71.3	133.9	140	0	0	0	0	0	126
748	A	37.1	Very low	37.2	Very low	96 Å²	96	131.2 Å²	131.2	79%	0.793	82%	0.822	S	S	*	*			trans	85.5	102.7	147.3	0	0	0	0	0	119.4
749	A	37.3	Very low	37	Very low	104 Å²	104	135 Å²	135	86%	0.86	83%	0.833	S	S	*	*				102.8	135.8	99	0	0	0	0	0	110.4
750	A	36.1	Very low	36.9	Very low	96 Å²	96	139.1 Å²	139.1	79%	0.793	84%	0.838	S	S	*	*			cis	-163.2	164.7	10.1	0	0	0	0	0	110.3
751	A	36.4	Very low	36.7	Very low	103 Å²	103	134.8 Å²	134.8	85%	0.851	84%	0.837	S	S	*	*			trans	90.1	126.3	146.7	0	0	0	0	0	122
752	A	40.7	Very low	36.3	Very low	110 Å²	110	128.2 Å²	128.2	91%	0.909	84%	0.835	S	S	*	*			trans	76.3	123.4	168.4	0	0	0	0	0	116.7
753	G	36.8	Very low	35.2	Very low	78 Å²	78	126.4 Å²	126.4	80%	0.804	84%	0.837	S	S	*	*			cis	162.8	128.7	7.6	0	0	0	0	0	106.5
754	E	32.6	Very low	35.3	Very low	207 Å²	207	123.1 Å²	123.1	97%	0.967	84%	0.836	S	S	*	*			trans	-71.7	158.8	-161.5	-65.1	168	124.3	0	0	116.2
755	G	32.5	Very low	35.7	Very low	77 Å²	77	126.7 Å²	126.7	79%	0.794	84%	0.841	S	S	*	*			trans	155.9	76.8	159.4	0	0	0	0	0	113.9
756	A	28.8	Very low	36	Very low	105 Å²	105	127.4 Å²	127.4	87%	0.868	84%	0.84	S	S	*	*			trans	-69.7	125.8	179.6	0	0	0	0	0	112.7
757	E	29.3	Very low	36.3	Very low	195 Å²	195	127.3 Å²	127.3	91%	0.911	83%	0.832	S	S	*	*			trans	-116.1	132.2	161.5	-94.2	-151.2	138.6	0	0	111.5
758	L	31.9	Very low	37.2	Very low	163 Å²	163	132.4 Å²	132.4	85%	0.853	83%	0.831	S	S	*	*			trans	-62.6	133.3	176.4	-94.1	79.2	0	0	0	112	R760	L758-R760 PolarHBondContact O-N 3.04Å
759	I	30.4	Very low	38.2	Very low	167 Å²	167	136 Å²	136	86%	0.856	83%	0.829	S	S	*	*			trans	-69.8	117.2	167.3	-62.8	169.5	0	0	0	109.2
760	R	31.6	Very low	39.7	Very low	230 Å²	230	134.7 Å²	134.7	87%	0.868	81%	0.814	S	S	*	*			trans	-107.3	133.2	165.7	-75.4	-174	173.6	-148.3	-0.1	110	L758 G762	L758-R760 PolarHBondContact O-N 3.04Å; R760-G762 PolarHBondContact O-N 3.45Å
761	P	34.9	Very low	41.2	Very low	134 Å²	134	133 Å²	133	87%	0.87	80%	0.8	S	S	*	*			trans	-86.7	106.1	172.2	32.6	-26.8	0	0	0	109.5
762	G	29.6	Very low	42.6	Very low	78 Å²	78	134 Å²	134	80%	0.804	79%	0.788	S	S	*	*			trans	-114.9	116.9	169.3	0	0	0	0	0	110	R760	R760-G762 PolarHBondContact O-N 3.45Å
763	G	32	Very low	43.9	Very low	75 Å²	75	136.5 Å²	136.5	77%	0.773	78%	0.779	S	S	*	*			trans	163.2	54.1	175	0	0	0	0	0	115.4
764	L	40.8	Very low	45.5	Very low	164 Å²	164	135.6 Å²	135.6	86%	0.859	76%	0.764	S	S	*	*			trans	-111.3	6.8	179.3	-86	164.9	0	0	0	114.7
765	Q	46.4	Very low	47.2	Very low	182 Å²	182	128.6 Å²	128.6	85%	0.85	74%	0.741	S	S	*	*	S	Bend	trans	-99.1	-16.5	-175.5	-74.2	-172.1	-16.2	0	0	115.1
766	A	44.7	Very low	49	Very low	89 Å²	89	131.9 Å²	131.9	74%	0.736	73%	0.734	S	S	*	*	S	Bend	trans	-80.1	-23.6	-178	0	0	0	0	0	114.1
767	D	55.9	Low	50.9	Low	125 Å²	125	129.8 Å²	129.8	67%	0.668	71%	0.713	S	S	*	*	H	α-helix	trans	-82.8	-18.9	-176.3	-96.2	-21.8	0	0	0	114.5	A771	D767-A771 VanDerWaalsContact O-CB 3.31Å; D767-A771 WeakPolarHBondContact O-CB 3.28Å; D767-A771 PolarHBondContact O-N 3.49Å
768	R	55.3	Low	52.8	Low	203 Å²	203	123.2 Å²	123.2	77%	0.766	69%	0.692	S	S	*	*	H	α-helix	trans	-72.2	-35.3	-176.4	-138.7	176.3	-174.9	-177.3	1.5	112.2	M772	R768-M772 VanDerWaalsContact O-CB 3.26Å; R768-M772 WeakPolarHBondContact O-CB 3.36Å; R768-M772 PolarHBondContact O-N 3.48Å; R768-M772 VanDerWaalsContact O-N 3.1Å
769	F	58.8	Low	54.5	Low	170 Å²	170	120.8 Å²	120.8	75%	0.746	68%	0.676	S	S	*	*	H	α-helix	trans	-74.2	-37.6	177.6	-121.7	-87.1	0	0	0	111.9	M772 K773	F769-M772 PolarHBondContact O-N 2.93Å; F769-K773 VanDerWaalsContact O-CB 3.31Å; F769-K773 WeakPolarHBondContact O-CB 3.26Å; F769-K773 PolarHBondContact O-N 2.94Å
770	S	67.6	Low	55.9	Low	77 Å²	77	119.3 Å²	119.3	54%	0.538	66%	0.661	S	S	.	*	H	α-helix	trans	-68.5	-43.6	177.2	-161.4	0	0	0	0	111.6	M772 K773 A774	S770-M772 PolarHBondContact O-N 2.93Å; S770-K773 PolarHBondContact O-N 3.48Å; S770-A774 WeakPolarHBondContact O-CB 3.34Å; S770-A774 PolarHBondContact O-N 3.48Å
771	A	67.5	Low	57.2	Low	62 Å²	62	113.6 Å²	113.6	51%	0.512	65%	0.648	S	S	.	*	H	α-helix	trans	-64.7	-37.8	174.7	0	0	0	0	0	112.7	D767 A774 A775	D767-A771 VanDerWaalsContact O-CB 3.31Å; D767-A771 WeakPolarHBondContact O-CB 3.28Å; D767-A771 PolarHBondContact O-N 3.49Å; A771-A774 PolarHBondContact O-N 2.96Å; A771-A775 WeakPolarHBondContact O-CB 3.3Å; A771-A775 PolarHBondContact O-N 3.1Å
772	M	66.1	Low	58.3	Low	122 Å²	122	118.1 Å²	118.1	60%	0.601	65%	0.648	S	S	*	*	H	α-helix	trans	-70.2	-38	177.2	-158.1	-179	-58	0	0	111.8	R768 F769 S770 F776	R768-M772 VanDerWaalsContact O-CB 3.26Å; R768-M772 WeakPolarHBondContact O-CB 3.36Å; R768-M772 PolarHBondContact O-N 3.48Å; R768-M772 VanDerWaalsContact O-N 3.1Å; F769-M772 PolarHBondContact O-N 2.93Å; S770-M772 PolarHBondContact O-N 2.93Å; M772-F776 VanDerWaalsContact O-CB 3.28Å; M772-F776 WeakPolarHBondContact O-CB 3.43Å; M772-F776 PolarHBondContact O-N 3.48Å
773	K	68	Low	59.1	Low	163 Å²	163	123.6 Å²	123.6	71%	0.709	64%	0.644	S	S	*	*	H	α-helix	trans	-68	-37.8	174.3	-166	174.1	-176.5	177.2	0	112.1	F769 S770 S777	F769-K773 VanDerWaalsContact O-CB 3.31Å; F769-K773 WeakPolarHBondContact O-CB 3.26Å; F769-K773 PolarHBondContact O-N 2.94Å; S770-K773 PolarHBondContact O-N 3.48Å; K773-S777 VanDerWaalsContact O-CB 3.24Å; K773-S777 WeakPolarHBondContact O-CB 3.24Å; K773-S777 PolarHBondContact O-N 3.17Å
774	A	70.3	Confident	59.2	Low	60 Å²	60	127 Å²	127	50%	0.496	64%	0.638	S	S	.	*	H	α-helix	trans	-68	-42.2	174.7	0	0	0	0	0	112.3	S770 A771 S777 A778	S770-A774 WeakPolarHBondContact O-CB 3.34Å; S770-A774 PolarHBondContact O-N 3.48Å; A771-A774 PolarHBondContact O-N 2.96Å; A774-S777 PolarHBondContact O-N 3.35Å; A774-A778 WeakPolarHBondContact O-CB 3.31Å; A774-A778 PolarHBondContact O-N 2.95Å
775	A	69.2	Low	59.4	Low	59 Å²	59	125.3 Å²	125.3	49%	0.488	63%	0.634	S	S	.	*	H	α-helix	trans	-65.5	-40.3	175.2	0	0	0	0	0	112	A771 A778 Q779	A771-A775 WeakPolarHBondContact O-CB 3.3Å; A771-A775 PolarHBondContact O-N 3.1Å; A775-A778 PolarHBondContact O-N 3.22Å; A775-Q779 WeakPolarHBondContact O-CB 3.38Å; A775-Q779 PolarHBondContact O-N 3.34Å
776	F	69.5	Low	58.9	Low	146 Å²	146	121.9 Å²	121.9	64%	0.64	63%	0.63	S	S	*	*	H	α-helix	trans	-68.4	-40.8	177.2	-156.2	-92.8	0	0	0	111.9	M772 Q779 Y780	M772-F776 VanDerWaalsContact O-CB 3.28Å; M772-F776 WeakPolarHBondContact O-CB 3.43Å; M772-F776 PolarHBondContact O-N 3.48Å; F776-Q779 PolarHBondContact O-N 3.34Å; F776-Y780 VanDerWaalsContact O-CB 3.28Å; F776-Y780 WeakPolarHBondContact O-CB 3.05Å; F776-Y780 PolarHBondContact O-N 3.22Å
777	S	68.3	Low	58.4	Low	61 Å²	61	123 Å²	123	43%	0.427	64%	0.64	S	S	.	*	H	α-helix	trans	-62.6	-43.7	174	-179.7	0	0	0	0	112.3	K773 A774 Q779 Y780 N781	K773-S777 VanDerWaalsContact O-CB 3.24Å; K773-S777 WeakPolarHBondContact O-CB 3.24Å; K773-S777 PolarHBondContact O-N 3.17Å; A774-S777 PolarHBondContact O-N 3.35Å; S777-Q779 VanDerWaalsContact C-N 3.3Å; S777-Q779 PolarHBondContact O-N 2.98Å; S777-Y780 PolarHBondContact O-N 2.62Å; S777-N781 WeakPolarHBondContact O-CB 3.31Å; S777-N781 PolarHBondContact O-N 3.37Å
778	A	69.8	Low	57.3	Low	58 Å²	58	119.7 Å²	119.7	48%	0.479	63%	0.634	S	S	.	*	H	α-helix	trans	-66.2	-31.4	176.8	0	0	0	0	0	113	A774 A775 R782	A774-A778 WeakPolarHBondContact O-CB 3.31Å; A774-A778 PolarHBondContact O-N 2.95Å; A775-A778 PolarHBondContact O-N 3.22Å; A778-R782 WeakPolarHBondContact O-CG 3.33Å; A778-R782 PolarHBondContact O-N 2.92Å
779	Q	68	Low	56.3	Low	111 Å²	111	116.9 Å²	116.9	52%	0.519	64%	0.64	S	S	.	*	H	α-helix	trans	-80.9	-34.4	177.6	-151.4	174.1	16.3	0	0	112.1	A775 F776 S777 R782 R783	A775-Q779 WeakPolarHBondContact O-CB 3.38Å; A775-Q779 PolarHBondContact O-N 3.34Å; F776-Q779 PolarHBondContact O-N 3.34Å; S777-Q779 VanDerWaalsContact C-N 3.3Å; S777-Q779 PolarHBondContact O-N 2.98Å; Q779-R782 PolarHBondContact O-N 3.29Å; Q779-R783 PolarHBondContact O-N 3.11Å
780	Y	59.3	Low	55.1	Low	136 Å²	136	116.8 Å²	116.8	53%	0.533	64%	0.642	S	S	.	*	H	α-helix	trans	-67	-45.6	174.6	-166.2	-92.8	0	0	0	111.4	F776 S777 R782 R783 F784	F776-Y780 VanDerWaalsContact O-CB 3.28Å; F776-Y780 WeakPolarHBondContact O-CB 3.05Å; F776-Y780 PolarHBondContact O-N 3.22Å; S777-Y780 PolarHBondContact O-N 2.62Å; Y780-R782 PolarHBondContact O-N 3.18Å; Y780-R783 PolarHBondContact O-N 2.95Å; Y780-R783 VanDerWaalsContact O-N 3.15Å; Y780-F784 HydrophobicContact CD2-CD2 4.31Å; Y780-F784 HydrophobicContact CE2-CD2 4.12Å; Y780-F784 HydrophobicContact CE2-CE2 4.46Å; Y780-F784 PolarHBondContact O-N 3.01Å
781	N	59.8	Low	53.4	Low	111 Å²	111	118.4 Å²	118.4	59%	0.594	66%	0.66	S	S	*	*	H	α-helix	trans	-68.2	-15.1	176.4	-73.8	-11.6	0	0	0	114	S777	S777-N781 WeakPolarHBondContact O-CB 3.31Å; S777-N781 PolarHBondContact O-N 3.37Å
782	R	58	Low	51.8	Low	229 Å²	229	119.8 Å²	119.8	86%	0.864	67%	0.666	S	S	*	*	H	α-helix	trans	-91.8	-19	173.2	-85.4	-173.5	169.6	-175.7	-1.8	114.1	A778 Q779 Y780	A778-R782 WeakPolarHBondContact O-CG 3.33Å; A778-R782 PolarHBondContact O-N 2.92Å; Q779-R782 PolarHBondContact O-N 3.29Å; Y780-R782 PolarHBondContact O-N 3.18Å
783	R	46.1	Very low	50.3	Low	192 Å²	192	123.8 Å²	123.8	73%	0.725	67%	0.674	S	S	*	*	H	α-helix	trans	-109.8	-15.6	-175.2	-101	175.9	166	136.1	-2.4	114.5	Q779 Y780	Q779-R783 PolarHBondContact O-N 3.11Å; Y780-R783 PolarHBondContact O-N 2.95Å; Y780-R783 VanDerWaalsContact O-N 3.15Å
784	F	35	Very low	48.8	Very low	146 Å²	146	127.1 Å²	127.1	64%	0.64	68%	0.684	S	S	*	*			trans	-126.7	96.2	177.5	-77.3	-85.3	0	0	0	110.1	Y780	Y780-F784 HydrophobicContact CD2-CD2 4.31Å; Y780-F784 HydrophobicContact CE2-CD2 4.12Å; Y780-F784 HydrophobicContact CE2-CE2 4.46Å; Y780-F784 PolarHBondContact O-N 3.01Å
785	V	44.5	Very low	47	Very low	130 Å²	130	130.7 Å²	130.7	79%	0.788	70%	0.699	S	S	*	*			trans	-105.7	127.3	161.2	178.8	0	0	0	0	106.9	A787	V785-A787 PolarHBondContact O-N 3.42Å
786	S	36.3	Very low	45.5	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	72%	0.718	S	S	*	*			trans	-58.9	126.3	177.7	-175.8	0	0	0	0	110.7	G788	S786-G788 VanDerWaalsContact C-N 3.29Å; S786-G788 PolarHBondContact O-N 3.39Å
787	A	33.7	Very low	43.7	Very low	113 Å²	113	134.9 Å²	134.9	93%	0.934	72%	0.72	S	S	*	*			trans	-72.7	85	169.8	0	0	0	0	0	109.3	V785	V785-A787 PolarHBondContact O-N 3.42Å
788	G	31.5	Very low	42.1	Very low	54 Å²	54	140.7 Å²	140.7	56%	0.557	74%	0.74	S	S	*	*	S	Bend	trans	-152.6	104	176.5	0	0	0	0	0	110.7	S786	S786-G788 VanDerWaalsContact C-N 3.29Å; S786-G788 PolarHBondContact O-N 3.39Å
789	V	35.7	Very low	40.4	Very low	144 Å²	144	146.6 Å²	146.6	87%	0.873	76%	0.76	S	S	*	*	S	Bend	trans	54.4	73.2	164.7	-163.6	0	0	0	0	115.2
790	E	32.7	Very low	38.6	Very low	169 Å²	169	149.7 Å²	149.7	79%	0.79	78%	0.779	S	S	*	*			trans	-177.3	58.7	149.6	-105.5	176.3	-176.4	0	0	111.5
791	A	31.7	Very low	37.6	Very low	111 Å²	111	152.9 Å²	152.9	92%	0.917	80%	0.796	S	S	*	*			trans	-98.2	65.5	169.5	0	0	0	0	0	110
792	S	34.1	Very low	36.3	Very low	91 Å²	91	152.7 Å²	152.7	64%	0.636	80%	0.803	S	S	*	*			trans	-165.7	73.5	173.4	64.6	0	0	0	0	111.5
793	R	35.1	Very low	35.3	Very low	205 Å²	205	147.1 Å²	147.1	77%	0.774	80%	0.799	S	S	*	*	S	Bend	trans	-177.2	135	162.8	-102.9	169.6	-97.3	-165.6	3.8	105.3
794	Y	36.1	Very low	34.6	Very low	234 Å²	234	145 Å²	145	92%	0.918	80%	0.803	S	S	*	*			trans	88.4	45.6	-168.9	-48	-74.4	0	0	0	116.7
795	T	32.5	Very low	34.6	Very low	134 Å²	134	144.3 Å²	144.3	82%	0.822	81%	0.81	S	S	*	*			trans	-125.8	114.5	142.6	43.8	0	0	0	0	106.4
796	H	38	Very low	34	Very low	188 Å²	188	143.8 Å²	143.8	87%	0.87	81%	0.807	S	S	*	*			trans	-103	118	171.1	-133.6	-72	0	0	0	108.1
797	P	31.7	Very low	34	Very low	105 Å²	105	146.1 Å²	146.1	68%	0.682	81%	0.811	S	S	*	*			trans	-95	131.1	179.7	34.6	-27.3	0	0	0	109.4
798	E	35.4	Very low	34	Very low	184 Å²	184	150.5 Å²	150.5	86%	0.86	80%	0.804	S	S	*	*			trans	-164.1	139.8	151.8	-119.4	173.7	178.5	0	0	110
799	M	34.6	Very low	34.3	Very low	182 Å²	182	153.4 Å²	153.4	90%	0.897	81%	0.813	S	S	*	*			trans	92.8	54	170.2	-48.9	-161.5	66.1	0	0	118.7
800	L	29.5	Very low	34.4	Very low	175 Å²	175	153.8 Å²	153.8	92%	0.916	81%	0.805	S	S	*	*			trans	-113.2	105.8	141.8	-92.3	158.7	0	0	0	108.4
801	K	37.9	Very low	34.6	Very low	203 Å²	203	153.7 Å²	153.7	88%	0.883	81%	0.809	S	S	*	*			trans	-138.5	110.8	156.5	-86.9	-170.9	179.8	176.7	0	110
802	S	32.6	Very low	34.9	Very low	107 Å²	107	152.2 Å²	152.2	75%	0.748	80%	0.797	S	S	*	*			trans	-23	137.7	152.3	53.9	0	0	0	0	117
803	S	36.7	Very low	35.2	Very low	113 Å²	113	155.8 Å²	155.8	79%	0.79	81%	0.809	S	S	*	*				169.5	130	106.8	56.8	0	0	0	0	112.6
804	N	31	Very low	35	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	80%	0.804	S	S	*	*			trans	-10.8	136.6	158.3	-60	-21.8	0	0	0	118.3
805	T	35.8	Very low	35	Very low	131 Å²	131	148.3 Å²	148.3	80%	0.804	80%	0.799	S	S	*	*				165.9	128.8	104.9	43.6	0	0	0	0	111.8
806	T	32.5	Very low	35.2	Very low	118 Å²	118	149 Å²	149	72%	0.724	80%	0.796	S	S	*	*			trans	11.6	120.1	141.6	-11	0	0	0	0	119.2
807	D	36	Very low	34.8	Very low	160 Å²	160	145.8 Å²	145.8	86%	0.856	79%	0.79	S	S	*	*				168.1	139.4	109.3	-96.5	-30.4	0	0	0	113
808	R	33.8	Very low	34.9	Very low	204 Å²	204	149.1 Å²	149.1	77%	0.77	80%	0.796	S	S	*	*			trans	-92.5	160	173.9	-139.7	-176.2	172.2	-166.9	-1.7	108.6
809	P	38	Very low	34.8	Very low	116 Å²	116	145.1 Å²	145.1	75%	0.753	79%	0.788	S	S	*	*				-152	144.2	81.3	31.6	-8.8	0	0	0	115.1
810	Q	36.6	Very low	34.9	Very low	152 Å²	152	141.2 Å²	141.2	71%	0.71	78%	0.779	S	S	*	*				61.4	128.2	101.1	-59.4	-167	-1.3	0	0	119.1
811	L	37.9	Very low	35	Very low	166 Å²	166	140 Å²	140	87%	0.869	77%	0.774	S	S	*	*			trans	179.3	105.5	135.6	-91.9	160.5	0	0	0	106.9
812	A	37.6	Very low	35	Very low	81 Å²	81	137.5 Å²	137.5	67%	0.669	77%	0.769	S	S	*	*				60	119.7	89.1	0	0	0	0	0	112.4
813	D	39.7	Very low	35.2	Very low	166 Å²	166	139.9 Å²	139.9	89%	0.888	77%	0.768	S	S	*	*				-150.7	155.6	65.4	-81.5	-35	0	0	0	115.2
814	S	31.6	Very low	35	Very low	95 Å²	95	143 Å²	143	66%	0.664	77%	0.771	S	S	*	*			trans	-139.7	-176.5	171.5	52.7	0	0	0	0	108.5
815	F	35.9	Very low	35.3	Very low	187 Å²	187	142.1 Å²	142.1	82%	0.82	78%	0.776	S	S	*	*			trans	101.7	133.6	179.2	-72.3	-110.3	0	0	0	113
816	I	36	Very low	35.1	Very low	147 Å²	147	144.5 Å²	144.5	75%	0.754	78%	0.778	S	S	*	*			cis	-161.5	157.7	18.1	-112	157.1	0	0	0	110.7
817	V	30.8	Very low	35.2	Very low	121 Å²	121	144.6 Å²	144.6	73%	0.733	78%	0.782	S	S	*	*			trans	-93.2	150	173.6	-174.9	0	0	0	0	110.9
818	Q	32.9	Very low	35.3	Very low	175 Å²	175	141.9 Å²	141.9	82%	0.818	77%	0.773	S	S	*	*			trans	135.5	121	136.8	-76.7	-172.2	-23.7	0	0	117.6
819	S	33.5	Very low	35.3	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	78%	0.775	S	S	*	*				86.1	128.2	128.4	-57.4	0	0	0	0	123.4
820	S	36.6	Very low	35.2	Very low	101 Å²	101	144.2 Å²	144.2	71%	0.706	78%	0.783	S	S	*	*			trans	88.7	111.6	135.3	57.4	0	0	0	0	122.7
821	N	32.5	Very low	35.1	Very low	150 Å²	150	144.1 Å²	144.1	80%	0.802	79%	0.786	S	S	*	*				79	149.9	123.3	-67	-12.6	0	0	0	123.1
822	L	37.8	Very low	35.2	Very low	150 Å²	150	145.5 Å²	145.5	79%	0.785	79%	0.788	S	S	*	*			trans	92.4	133.1	163.8	-55.6	154.6	0	0	0	114
823	E	36.3	Very low	34.9	Very low	156 Å²	156	146.9 Å²	146.9	73%	0.729	79%	0.793	S	S	*	*			cis	-165.2	128.2	2.6	-100.9	159.5	157.9	0	0	104.4
824	E	32.1	Very low	34.9	Very low	179 Å²	179	144.9 Å²	144.9	84%	0.836	79%	0.792	S	S	*	*				60	111.7	92.9	-129.4	177.6	-158.2	0	0	116.3
825	S	37.4	Very low	34.9	Very low	130 Å²	130	149.1 Å²	149.1	91%	0.909	80%	0.801	S	S	*	*			trans	-170.7	102.5	143.2	-82	0	0	0	0	111.2
826	Q	32.7	Very low	35	Very low	181 Å²	181	145.9 Å²	145.9	85%	0.846	80%	0.797	S	S	*	*			trans	-87.8	155.7	161.2	-69.8	177.4	-6.7	0	0	110.1
827	C	34.5	Very low	35	Very low	120 Å²	120	147.6 Å²	147.6	81%	0.811	80%	0.799	S	S	*	*				161.3	162.1	124.1	-99.4	0	0	0	0	114.2
828	P	37.9	Very low	35.2	Very low	102 Å²	102	147.8 Å²	147.8	66%	0.662	80%	0.803	S	S	*	*				-137.2	-168.3	-124.8	42.5	-21.6	0	0	0	116.1
829	Q	33.1	Very low	35.7	Very low	175 Å²	175	148.7 Å²	148.7	82%	0.818	81%	0.807	S	S	*	*			trans	65.5	123.3	156.5	-67.5	179.3	2.5	0	0	120
830	Q	36.9	Very low	35.9	Very low	195 Å²	195	151 Å²	151	91%	0.911	81%	0.811	S	S	*	*				-164.8	139.2	125.6	-109.7	173.9	9.6	0	0	113.5
831	L	34.1	Very low	36	Very low	149 Å²	149	151.3 Å²	151.3	78%	0.78	81%	0.809	S	S	*	*			trans	-64	154	176.3	-68.2	86.4	0	0	0	112.6
832	Q	39.2	Very low	36.2	Very low	195 Å²	195	153 Å²	153	91%	0.911	81%	0.812	S	S	*	*				-162.3	124.1	127	-107.2	167	51	0	0	112.4
833	S	31.8	Very low	36.2	Very low	111 Å²	111	151.8 Å²	151.8	78%	0.776	81%	0.811	S	S	*	*			trans	-79.6	141.8	168.9	50.4	0	0	0	0	111.6
834	S	39.1	Very low	36.3	Very low	124 Å²	124	152.4 Å²	152.4	87%	0.867	82%	0.819	S	S	*	*			trans	-156.1	124.5	149.6	42.4	0	0	0	0	111.6
835	Q	33	Very low	36.6	Very low	183 Å²	183	148.7 Å²	148.7	86%	0.855	81%	0.813	S	S	*	*			trans	-73.4	-176.3	176.2	-71	179.5	-27.6	0	0	112.2
836	V	37.8	Very low	36.6	Very low	119 Å²	119	152.7 Å²	152.7	72%	0.721	81%	0.814	S	S	*	*			trans	101.2	114.1	160.2	-170.6	0	0	0	0	111.1
837	K	36.2	Very low	37	Very low	184 Å²	184	152.1 Å²	152.1	80%	0.8	81%	0.811	S	S	*	*			cis	-170.5	145.3	41.1	-126.1	156.7	-162.1	-179.8	0	109.1
838	P	33.6	Very low	37.2	Very low	125 Å²	125	156.8 Å²	156.8	81%	0.812	82%	0.818	S	S	*	*			trans	-97.2	144.6	164.3	34.5	-26.1	0	0	0	111.2
839	Q	44.3	Very low	37.1	Very low	193 Å²	193	162.3 Å²	162.3	90%	0.902	83%	0.825	S	S	*	*			trans	-118.9	103.9	167.9	-84.2	-172.7	-23.2	0	0	111
840	N	36.6	Very low	37.2	Very low	149 Å²	149	159.5 Å²	159.5	80%	0.797	83%	0.825	S	S	*	*			trans	-29.2	146	139.1	-131.5	3	0	0	0	111.2
841	V	39.7	Very low	36.9	Very low	108 Å²	108	161 Å²	161	66%	0.655	82%	0.822	S	S	*	*			cis	-173.2	134.8	48.2	-170.4	0	0	0	0	103.6
842	Q	37.5	Very low	36.8	Very low	185 Å²	185	165.6 Å²	165.6	86%	0.864	83%	0.829	S	S	*	*				-176.9	135.3	96.4	-95.3	178.6	-10.5	0	0	111.1
843	T	36.2	Very low	36.8	Very low	125 Å²	125	167.5 Å²	167.5	77%	0.767	85%	0.846	S	S	*	*			trans	-74.9	138.4	-177.1	48.1	0	0	0	0	112.2
844	D	38.5	Very low	37	Very low	168 Å²	168	170.3 Å²	170.3	90%	0.898	85%	0.849	S	S	*	*			trans	-150	116.7	135.4	-115.3	-21.8	0	0	0	111.4
845	S	37.9	Very low	36.9	Very low	101 Å²	101	172.7 Å²	172.7	71%	0.706	85%	0.848	S	S	*	*			trans	-96.5	124.8	-174.3	51.6	0	0	0	0	110.7
846	K	39.3	Very low	37.1	Very low	215 Å²	215	172.2 Å²	172.2	94%	0.935	85%	0.848	S	S	*	*			trans	-135.1	96.8	151.7	-83.1	-171.8	178.9	170.8	0	110.8
847	Q	39.2	Very low	37.1	Very low	169 Å²	169	175.3 Å²	175.3	79%	0.79	86%	0.855	S	S	*	*			trans	-60.1	136.6	160	-73.6	174.5	-30.5	0	0	110.3
848	K	39.3	Very low	37.2	Very low	217 Å²	217	174.8 Å²	174.8	94%	0.943	86%	0.859	S	S	*	*			trans	-130.1	115.5	142	-95.7	-171.2	176.9	-178.1	0	109.3
849	R	36.9	Very low	37.4	Very low	219 Å²	219	178.1 Å²	178.1	83%	0.826	86%	0.862	S	S	*	*			trans	-64.2	143.3	176.6	-73.9	168.1	151.9	177.6	-8.8	111.2
850	S	34	Very low	36.9	Very low	115 Å²	115	177 Å²	177	80%	0.804	86%	0.859	S	S	*	*			trans	-62	137	148.1	60.3	0	0	0	0	109
851	R	31.2	Very low	36.9	Very low	228 Å²	228	179.2 Å²	179.2	86%	0.86	86%	0.864	S	S	*	*			trans	-127.7	123.8	168.9	-170.1	173.7	178.6	135.4	-0.7	106.3	D853	R851-D853 PolarHBondContact O-N 3.18Å; R851-D853 VanDerWaalsContact O-N 3.14Å
852	W	32.3	Very low	36.7	Very low	244 Å²	244	185.1 Å²	185.1	92%	0.924	88%	0.881	S	S	*	*			trans	-48.6	112.5	169.6	-67.4	75.2	0	0	0	110
853	D	37.8	Very low	36.6	Very low	235 Å²	235	185.1 Å²	185.1	100%	1.257	88%	0.883	S	S	*	*			trans	-160.5	0	144.5	-90.2	-34.8	0	0	0	107.7	R851	R851-D853 PolarHBondContact O-N 3.18Å; R851-D853 VanDerWaalsContact O-N 3.14Å

Retrieved 853 of 853 residues in 212.6 ms (Link to these results)

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