A0A3Q0KT28_SCHMA Loading...

DNA replication licensing factor MCM4

Acts as component of the MCM2-7 complex (MCM complex) which is the replicative helicase essential for 'once per cell cycle' DNA replication initiation and elongation in eukaryotic cells. The active ATPase sites in the MCM2-7 ring are formed through the interaction surfaces of two neighboring subunits such that a critical structure of a conserved arginine finger motif is provided in trans relative to the ATP-binding site of the Walker A box of the adjacent subunit. The six ATPase active sites, however, are likely to contribute differentially to the complex helicase activity.

AlphaFold DB , UniProt , Accession A0A3Q0KT28, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 898 aa.

						>A0A3Q0KT28_SCHMA|A0A3Q0KT28
MSSLSSRSSRRRHATNDEQLSGDLLSAGTTFERTGESSRTRGRTRHNRSGHTEPTSNAEPTSGLRTSEVEPGSPLSYSDMSSVATGVEDVLSSVRPGVNDEVAVRAVLSQSGPLVPATGVPGTTDGSTASGPQTVIWGTDVNIAQVMSRFKHFLLTYIPPDLTGQPNLTTGQPIDPQRPLYLQRMEDLAISGSTALDIDCEHLRSARPDLYTQLVTFPKEVIPACDAATHALFLDRFREVQLERSIQIRPFNCARSRDLRSLDPDDLDQLVTVSGLVIRLSPLIPEMMRAEFKCAICGAMTSVPCERGRIAEPEACIRCHSAHTAQLQHNRCLFVDKQMIKLQESPENMPASQTPHTVLMYAHEELVDKIQPGDRVIVTGIYRAIPLRMSNRQRTLKAVYKTYIDVLHFLREGDDRVQNDGIATDENTASEEAHILRQFTEERIEEFHTLARKPDLYERLAAGIAPTIYENEDIKKGILLQLFGGTRKDFTAKGRGDFRSEINILLCGDPGTSKSQLLQYVYRLTPRGQYTSGKGSSAVGLTAYITKDAETRQLTLQTGALVLADNGICCIDEFDKMSDSTRSVLHEVMEQQTLSIAKAGILCQLHARTSILAAANPIGSKWDPSKTIIDNIQLPHTLLSRFDLIFLILDPQDEVYDTRLARHLVGLYYRGTTPSQIESSQDIPTNSNNNTRGARRPRPGAVLLDMDSQTDDDPSFVNGKLLKDYIAYAKMKYFPKLTEEAGEYLVREYVEMRKLGSGRGQISAYPRQLESLVRLAEAHARLRLSNHVTADDCREARRLQREALKQAAIDPLTGTIDINILTTGISSSVRKRREEMAMAIWSLLEERPRVLTFVYSRVLEDLRARSERMITRENFEDGLNFLKNTNKIDWAGNTIRKR
					

Structure Viewer

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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	36.8	Very low	33	Very low	251 Å²	251	169.2 Å²	169.2	100%	1.236	89%	0.887	S	S	*	*				0	120.8	0	-62.9	174.4	172.2	0	0	106.1
2	S	33.9	Very low	32.8	Very low	127 Å²	127	174.8 Å²	174.8	89%	0.888	89%	0.888	S	S	*	*			cis	-138.6	145.9	2.4	43.7	0	0	0	0	110
3	S	31.4	Very low	32.8	Very low	113 Å²	113	175.6 Å²	175.6	79%	0.79	89%	0.885	S	S	*	*			trans	-102.5	134.2	-171.3	52.1	0	0	0	0	114
4	L	36.4	Very low	32.8	Very low	170 Å²	170	169.9 Å²	169.9	89%	0.89	88%	0.879	S	S	*	*			trans	-158.3	104.4	157.4	-83.5	171.7	0	0	0	106
5	S	33.7	Very low	33	Very low	105 Å²	105	167.1 Å²	167.1	73%	0.734	87%	0.873	S	S	*	*			cis	78.4	92.2	49.1	83.4	0	0	0	0	115.9
6	S	34.6	Very low	32.8	Very low	126 Å²	126	166.3 Å²	166.3	88%	0.881	87%	0.87	S	S	*	*			trans	-162.9	108	144.2	56.4	0	0	0	0	112.7
7	R	29.4	Very low	32.8	Very low	256 Å²	256	166.1 Å²	166.1	97%	0.966	87%	0.869	S	S	*	*			trans	-98.3	134.9	160.2	-89	178.3	165.4	177.4	-4.3	108.6
8	S	32.5	Very low	32.8	Very low	110 Å²	110	166.2 Å²	166.2	77%	0.769	87%	0.865	S	S	*	*			trans	-154.7	88.3	162.6	-179.1	0	0	0	0	107.5
9	S	33.4	Very low	32.6	Very low	102 Å²	102	167.6 Å²	167.6	71%	0.713	87%	0.867	S	S	*	*				76.8	102.8	82.8	70.2	0	0	0	0	114.7	R11	S9-R11 PolarHBondContact O-N 3.35Å
10	R	29.7	Very low	32.6	Very low	256 Å²	256	167.3 Å²	167.3	97%	0.966	87%	0.865	S	S	*	*			trans	-51	131.4	162.2	-69.2	171.8	168.9	167.1	-4.8	110.6
11	R	31.3	Very low	32.5	Very low	245 Å²	245	164.7 Å²	164.7	93%	0.925	86%	0.862	S	S	*	*			trans	-145	145.8	154.7	-110.3	-178.1	-177.5	-169.9	0.6	111.6	S9	S9-R11 PolarHBondContact O-N 3.35Å
12	R	30.3	Very low	32.4	Very low	237 Å²	237	156.2 Å²	156.2	89%	0.894	84%	0.839	S	S	*	*			trans	-76.2	142.9	-179.7	-59.3	167.4	175.7	165.9	-4.1	109.9
13	H	32.5	Very low	32.2	Very low	185 Å²	185	158 Å²	158	86%	0.856	84%	0.838	S	S	*	*			trans	-130.5	124.1	149.3	-91.5	-74.9	0	0	0	109.6
14	A	32.5	Very low	32.4	Very low	96 Å²	96	160 Å²	160	79%	0.793	84%	0.84	S	S	*	*			trans	-143.5	105.4	167.6	0	0	0	0	0	106
15	T	36.4	Very low	32.3	Very low	128 Å²	128	159.2 Å²	159.2	79%	0.785	84%	0.836	S	S	*	*			trans	-152.2	136.2	170.4	36.4	0	0	0	0	107.9
16	N	30	Very low	32	Very low	154 Å²	154	160.1 Å²	160.1	82%	0.824	84%	0.842	S	S	*	*			trans	-67.8	154.7	-171.5	-45.6	-46.9	0	0	0	113.3
17	D	32.7	Very low	32	Very low	162 Å²	162	159 Å²	159	87%	0.866	84%	0.84	S	S	*	*			trans	176.8	135.8	144.3	-86.4	-22.5	0	0	0	105.7
18	E	31.9	Very low	32	Very low	169 Å²	169	150.2 Å²	150.2	79%	0.79	83%	0.829	S	S	*	*			cis	-135.1	155.6	3.6	-62.6	175.5	104	0	0	110.9
19	Q	30.3	Very low	32.1	Very low	193 Å²	193	151.5 Å²	151.5	90%	0.902	83%	0.832	S	S	*	*			trans	-97.1	121.2	162.1	-72.9	178.1	-32.6	0	0	109.5
20	L	33	Very low	31.8	Very low	160 Å²	160	153 Å²	153	84%	0.838	84%	0.838	S	S	*	*			trans	-130.7	85.1	162.3	-92.8	167.3	0	0	0	110.1
21	S	30.7	Very low	31.9	Very low	113 Å²	113	150.3 Å²	150.3	79%	0.79	83%	0.833	S	S	*	*			trans	-73.2	139.9	161.3	38.2	0	0	0	0	110.1
22	G	33.9	Very low	31.8	Very low	73 Å²	73	146.4 Å²	146.4	75%	0.753	83%	0.826	S	S	*	*			trans	-156.6	72	-178.3	0	0	0	0	0	111.3	L24	G22-L24 PolarHBondContact O-N 3.24Å
23	D	30	Very low	31.6	Very low	164 Å²	164	147.1 Å²	147.1	88%	0.877	83%	0.828	S	S	*	*			trans	-59	123.2	169.4	-73.9	-51.6	0	0	0	110.5
24	L	35.6	Very low	31.6	Very low	156 Å²	156	144.7 Å²	144.7	82%	0.817	83%	0.827	S	S	*	*			trans	-144.1	112.6	160.1	-93.9	169.2	0	0	0	111.7	G22	G22-L24 PolarHBondContact O-N 3.24Å
25	L	33	Very low	31.4	Very low	154 Å²	154	143.7 Å²	143.7	81%	0.806	83%	0.825	S	S	*	*			trans	82.3	85.7	147.3	-55.8	172.5	0	0	0	119.6	A27	L25-A27 PolarHBondContact O-N 2.81Å
26	S	28.1	Very low	31.1	Very low	124 Å²	124	147.3 Å²	147.3	87%	0.867	83%	0.833	S	S	*	*			trans	-68.5	105.8	142.7	56.4	0	0	0	0	112.1
27	A	34.2	Very low	31	Very low	101 Å²	101	145.4 Å²	145.4	84%	0.835	83%	0.832	S	S	*	*			trans	-175.3	135.8	153.2	0	0	0	0	0	107.8	L25	L25-A27 PolarHBondContact O-N 2.81Å
28	G	30.2	Very low	30.9	Very low	72 Å²	72	143.2 Å²	143.2	74%	0.742	83%	0.83	S	S	*	*			cis	152.2	97.2	2.2	0	0	0	0	0	109.3
29	T	33.4	Very low	30.7	Very low	137 Å²	137	146.6 Å²	146.6	84%	0.84	84%	0.835	S	S	*	*			trans	-143.2	90.3	168.7	45.9	0	0	0	0	110.2
30	T	27.6	Very low	30.8	Very low	134 Å²	134	144.1 Å²	144.1	82%	0.822	83%	0.833	S	S	*	*			trans	-52.9	133.1	150.8	41	0	0	0	0	109.9
31	F	31.9	Very low	30.6	Very low	199 Å²	199	148.7 Å²	148.7	87%	0.873	84%	0.839	S	S	*	*			trans	-127.2	149.3	156.9	-127.4	-88.7	0	0	0	109.7
32	E	29.6	Very low	30.7	Very low	164 Å²	164	147 Å²	147	77%	0.766	84%	0.84	S	S	*	*			trans	-92.4	160.9	-140.5	-66.9	171.9	115.9	0	0	116.2	T34	E32-T34 PolarHBondContact O-N 3.41Å
33	R	27.2	Very low	30.6	Very low	252 Å²	252	154.3 Å²	154.3	95%	0.951	85%	0.845	S	S	*	*			trans	-75.8	106.3	165.1	-74.8	174.5	166.5	176.6	-3.8	110.8
34	T	31.8	Very low	30.7	Very low	134 Å²	134	152.1 Å²	152.1	82%	0.822	84%	0.837	S	S	*	*			trans	-147.4	124.8	146.9	51.1	0	0	0	0	106.4	E32	E32-T34 PolarHBondContact O-N 3.41Å
35	G	27.8	Very low	30.7	Very low	74 Å²	74	154.7 Å²	154.7	76%	0.763	84%	0.836	S	S	*	*			cis	119.8	88.8	17.7	0	0	0	0	0	108.4
36	E	31	Very low	30.8	Very low	205 Å²	205	154.6 Å²	154.6	96%	0.958	83%	0.831	S	S	*	*			trans	-156.1	139.2	158.3	-124.7	170.8	-154.8	0	0	112.6
37	S	26.3	Very low	30.9	Very low	113 Å²	113	154.7 Å²	154.7	79%	0.79	82%	0.822	S	S	*	*			trans	-136.2	118.4	-169.1	60.2	0	0	0	0	111.5
38	S	31.8	Very low	30.9	Very low	117 Å²	117	160.4 Å²	160.4	82%	0.818	82%	0.822	S	S	*	*			trans	-155.8	118.8	161.2	52.9	0	0	0	0	108.1
39	R	26.6	Very low	31	Very low	239 Å²	239	161.9 Å²	161.9	90%	0.902	82%	0.821	S	S	*	*				69	85.3	53.7	-73.5	-169.3	167.8	-176.4	0.6	115.5
40	T	34.1	Very low	30.9	Very low	141 Å²	141	158.7 Å²	158.7	87%	0.865	82%	0.815	S	S	*	*			trans	-161.2	89.6	145.3	24	0	0	0	0	108.8
41	R	27.9	Very low	31.1	Very low	257 Å²	257	160.5 Å²	160.5	97%	0.97	81%	0.814	S	S	*	*				55.5	106	85.3	-84.6	-169.4	167.8	-178.2	-1.9	116.8
42	G	32.6	Very low	31.1	Very low	77 Å²	77	156.9 Å²	156.9	79%	0.794	81%	0.808	S	S	*	*			trans	150.1	143.3	144.3	0	0	0	0	0	114.8
43	R	32.8	Very low	31.1	Very low	227 Å²	227	157.2 Å²	157.2	86%	0.857	81%	0.81	S	S	*	*			cis	-169	126.9	-15.2	-160.8	176.3	175.2	176.2	-2.6	110
44	T	31.9	Very low	31.5	Very low	117 Å²	117	151 Å²	151	72%	0.718	80%	0.802	S	S	*	*			trans	63.8	155.7	155.8	48.9	0	0	0	0	118.9
45	R	35.1	Very low	31.4	Very low	211 Å²	211	150.4 Å²	150.4	80%	0.796	80%	0.798	S	S	*	*			cis	-162.3	143.5	22.8	-141.8	157.8	-173.1	-169.6	1.7	113.2
46	H	34	Very low	31.6	Very low	151 Å²	151	152.3 Å²	152.3	70%	0.699	80%	0.8	S	S	*	*			trans	30.5	146.1	147.3	-65.3	-44.6	0	0	0	121.9
47	N	31.4	Very low	31.5	Very low	126 Å²	126	150.3 Å²	150.3	67%	0.674	80%	0.796	S	S	*	*			cis	-167	-177.2	6.4	-106.6	-8.4	0	0	0	108.1
48	R	34.3	Very low	31.8	Very low	221 Å²	221	149.9 Å²	149.9	83%	0.834	80%	0.799	S	S	*	*			cis	-155.1	-175.9	9.2	-139.2	178.8	-175.1	170.4	0.3	111.4
49	S	31.8	Very low	31.7	Very low	104 Å²	104	153 Å²	153	73%	0.727	80%	0.8	S	S	*	*			trans	-29.9	157	160.3	51.8	0	0	0	0	119.4
50	G	30.6	Very low	32.1	Very low	69 Å²	69	146.5 Å²	146.5	71%	0.711	79%	0.789	S	S	*	*			cis	171.8	161.3	4.8	0	0	0	0	0	107.6
51	H	33.1	Very low	31.8	Very low	172 Å²	172	145.9 Å²	145.9	80%	0.796	79%	0.786	S	S	*	*				-172.1	142.4	51.4	-125.6	-86.2	0	0	0	112.4
52	T	32.2	Very low	31.9	Very low	123 Å²	123	139.4 Å²	139.4	76%	0.755	78%	0.78	S	S	*	*			trans	43.5	119.6	146.4	46.2	0	0	0	0	124.8
53	E	28.7	Very low	31.6	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.804	78%	0.778	S	S	*	*			trans	-59.1	175.9	152.4	-112.4	174.2	-140.3	0	0	114.1
54	P	35.5	Very low	31.6	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	78%	0.781	S	S	*	*			cis	-148.9	-173.9	48.3	42.8	-20.3	0	0	0	119.4
55	T	29.8	Very low	31.3	Very low	121 Å²	121	142.4 Å²	142.4	74%	0.742	79%	0.789	S	S	*	*			trans	-72.3	149.7	-171.4	50	0	0	0	0	117.1
56	S	32.7	Very low	31	Very low	115 Å²	115	138.7 Å²	138.7	80%	0.804	79%	0.79	S	S	*	*			trans	-168.2	124.7	136.5	35.5	0	0	0	0	114.2
57	N	28.5	Very low	30.9	Very low	162 Å²	162	136.2 Å²	136.2	87%	0.866	79%	0.79	S	S	*	*			trans	6.7	121.7	153.4	-50.6	-16.7	0	0	0	120.7
58	A	32	Very low	30.9	Very low	104 Å²	104	136.6 Å²	136.6	86%	0.86	79%	0.787	S	S	*	*				166.2	124.5	113.6	0	0	0	0	0	112.4
59	E	29.5	Very low	30.9	Very low	182 Å²	182	129.8 Å²	129.8	85%	0.85	77%	0.77	S	S	*	*			trans	-86.9	-179.2	162.9	-63	-170.5	150.7	0	0	110.5
60	P	36	Very low	31.2	Very low	103 Å²	103	128.8 Å²	128.8	67%	0.669	75%	0.754	S	S	*	*			cis	-127.2	176.1	-18.6	16.7	7.5	0	0	0	112.6
61	T	28.3	Very low	31.5	Very low	129 Å²	129	128.6 Å²	128.6	79%	0.791	74%	0.741	S	S	*	*				161.9	147.8	125.9	39.5	0	0	0	0	113.9
62	S	28.3	Very low	31.6	Very low	121 Å²	121	121.1 Å²	121.1	85%	0.846	71%	0.71	S	S	*	*			trans	42.6	103.8	161.5	57.1	0	0	0	0	119.5
63	G	27.4	Very low	32	Very low	72 Å²	72	116.2 Å²	116.2	74%	0.742	68%	0.681	S	S	*	*			trans	-160.1	67.8	169.2	0	0	0	0	0	112.2	R65	G63-R65 PolarHBondContact O-N 3.09Å
64	L	32.2	Very low	32.7	Very low	179 Å²	179	111.8 Å²	111.8	94%	0.937	67%	0.667	S	S	*	*			trans	-62.1	122.4	176.3	-108.7	151.8	0	0	0	109.8	T66	L64-T66 PolarHBondContact O-N 3.03Å
65	R	25.9	Very low	33.2	Very low	232 Å²	232	107.8 Å²	107.8	88%	0.875	64%	0.639	S	S	*	*			trans	-67.6	121.1	-176	-64.6	172	175.9	172.4	-1.8	109.4	G63 S67	G63-R65 PolarHBondContact O-N 3.09Å; R65-S67 PolarHBondContact O-N 3.02Å
66	T	29	Very low	33.6	Very low	134 Å²	134	104.4 Å²	104.4	82%	0.822	62%	0.62	S	S	*	*			trans	-65.6	105.8	166.4	53.6	0	0	0	0	108.8	L64	L64-T66 PolarHBondContact O-N 3.03Å
67	S	30.7	Very low	34.1	Very low	99 Å²	99	103.1 Å²	103.1	69%	0.692	60%	0.598	S	S	*	*			trans	-61.9	160.5	168.9	42.4	0	0	0	0	111	R65 V69	R65-S67 PolarHBondContact O-N 3.02Å; S67-V69 PolarHBondContact O-N 3.16Å
68	E	32.5	Very low	34.3	Very low	133 Å²	133	97.1 Å²	97.1	62%	0.621	57%	0.569	S	S	*	*			trans	-70.2	100.1	-177.3	-68.2	168.2	159.9	0	0	109.9	E70 N391	E68-E70 VanDerWaalsContact C-N 3.27Å; E68-E70 PolarHBondContact O-N 2.8Å; E68-N391 PolarHBondContact OE1-ND2 3.32Å
69	V	34.7	Very low	34.4	Very low	79 Å²	79	96.5 Å²	96.5	48%	0.479	55%	0.551	S	S	.	*			trans	-69	89.2	166.8	179.5	0	0	0	0	108.3	S67 G308	S67-V69 PolarHBondContact O-N 3.16Å; V69-G308 WeakPolarHBondContact CG1-O 3.48Å
70	E	37.7	Very low	34.6	Very low	82 Å²	82	93.5 Å²	93.5	38%	0.383	54%	0.538	S	S	.	.			trans	-64.6	137	147.2	-66.4	-161.8	148.6	0	0	107.7	E68 G72 K337	E68-E70 VanDerWaalsContact C-N 3.27Å; E68-E70 PolarHBondContact O-N 2.8Å; E70-G72 PolarHBondContact O-N 3.4Å; E70-G72 VanDerWaalsContact O-N 3.11Å; E70-K337 IonicContact OE2-NZ 3.02Å; E70-K337 PolarHBondContact OE2-NZ 3.11Å
71	P	36.9	Very low	34.4	Very low	66 Å²	66	93 Å²	93	43%	0.429	54%	0.537	S	S	.	.			trans	-67.5	111.9	171.9	28	-31.6	0	0	0	108.4	I385	P71-I385 HydrophobicContact CG-CD1 4.47Å; P71-I385 HydrophobicContact CG-CG1 4.16Å
72	G	35.2	Very low	34.7	Very low	15 Å²	15	91.1 Å²	91.1	16%	0.155	53%	0.529	C	S	.	.			trans	-58.2	157.6	175.4	0	0	0	0	0	112.5	E70 P74 E286	E70-G72 PolarHBondContact O-N 3.4Å; E70-G72 VanDerWaalsContact O-N 3.11Å; G72-P74 WeakPolarHBondContact O-CD 3.45Å; G72-E286 WeakPolarHBondContact CA-OE1 3.39Å
73	S	40	Very low	34.9	Very low	20 Å²	20	90.4 Å²	90.4	14%	0.14	52%	0.519	C	S	.	.			trans	-67.2	124	-171.5	-161.4	0	0	0	0	110.8	L75 S76 E286 R383 D405	S73-L75 PolarHBondContact O-N 3Å; S73-S76 PolarHBondContact O-N 3.42Å; S73-E286 PolarHBondContact N-OE1 3.03Å; S73-R383 PolarHBondContact OG-NH2 3.4Å; S73-R383 VanDerWaalsContact OG-NH2 3.14Å; S73-D405 PolarHBondContact OG-OD2 2.98Å
74	P	43.1	Very low	35.1	Very low	78 Å²	78	91.3 Å²	91.3	51%	0.506	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	5.2	-175.5	30.3	-37.5	0	0	0	114.3	G72 R383	G72-P74 WeakPolarHBondContact O-CD 3.45Å; P74-R383 VanDerWaalsContact CD-NH1 3.28Å
75	L	47.2	Very low	35	Very low	38 Å²	38	88.8 Å²	88.8	20%	0.199	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	4.1	169.4	-68	171.3	0	0	0	112.6	S73 Y77 P223 I381 L407	S73-L75 PolarHBondContact O-N 3Å; L75-Y77 WeakPolarHBondContact O-CD2 3.42Å; L75-Y77 PolarHBondContact O-N 3.44Å; L75-P223 HydrophobicContact CD2-CG 3.71Å; L75-I381 HydrophobicContact CD1-CD1 4.37Å; L75-L407 HydrophobicContact CD1-CD2 4.02Å
76	S	38.5	Very low	35.1	Very low	49 Å²	49	80.9 Å²	80.9	34%	0.343	50%	0.503	S	S	.	.			trans	-62.3	118.5	167.5	174.1	0	0	0	0	110.8	S73 S78	S73-S76 PolarHBondContact O-N 3.42Å; S76-S78 PolarHBondContact O-N 3.06Å
77	Y	43.5	Very low	35.1	Very low	88 Å²	88	80.9 Å²	80.9	35%	0.345	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-66.9	19.8	-170.9	-86.8	-105.8	0	0	0	117	L75 D79 D226	L75-Y77 WeakPolarHBondContact O-CD2 3.42Å; L75-Y77 PolarHBondContact O-N 3.44Å; Y77-D79 VanDerWaalsContact C-N 3.3Å; Y77-D79 PolarHBondContact O-N 3.38Å; Y77-D226 HydrophobicContact CE1-CB 4.35Å; Y77-D226 WeakPolarHBondContact OH-CB 3.33Å; Y77-D226 PolarHBondContact OH-OD2 3.2Å
78	S	32.4	Very low	34.9	Very low	37 Å²	37	84.7 Å²	84.7	26%	0.259	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-62.9	-32.6	-176.1	43.8	0	0	0	0	114	S76 M80	S76-S78 PolarHBondContact O-N 3.06Å; S78-M80 PolarHBondContact O-N 3.01Å
79	D	34.4	Very low	34.7	Very low	90 Å²	90	86.4 Å²	86.4	48%	0.481	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-88.6	-9	-157.9	-64.9	17.1	0	0	0	113.9	Y77	Y77-D79 VanDerWaalsContact C-N 3.3Å; Y77-D79 PolarHBondContact O-N 3.38Å
80	M	33	Very low	34.3	Very low	120 Å²	120	89 Å²	89	59%	0.591	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-11.2	-174.2	-72.2	-74.4	93.6	0	0	115.7	S78 S82 V83	S78-M80 PolarHBondContact O-N 3.01Å; M80-S82 PolarHBondContact O-N 3.18Å; M80-V83 HydrophobicContact CE-CG2 4.31Å
81	S	32	Very low	33.9	Very low	91 Å²	91	92.7 Å²	92.7	64%	0.636	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-9.5	-178.1	62.6	0	0	0	0	114.7
82	S	33.1	Very low	33.6	Very low	91 Å²	91	94.7 Å²	94.7	64%	0.636	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-12.1	-177.3	54.4	0	0	0	0	114.8	M80	M80-S82 PolarHBondContact O-N 3.18Å
83	V	34.2	Very low	33.4	Very low	105 Å²	105	99.3 Å²	99.3	64%	0.636	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-20	-175.4	-177.8	0	0	0	0	112.4	M80	M80-V83 HydrophobicContact CE-CG2 4.31Å
84	A	31.7	Very low	33.1	Very low	91 Å²	91	104.4 Å²	104.4	75%	0.752	64%	0.635	S	S	*	*	S	Bend	trans	-82.8	-10.1	-172.7	0	0	0	0	0	115.6
85	T	30.3	Very low	32.5	Very low	127 Å²	127	112 Å²	112	78%	0.779	65%	0.654	S	S	*	*	S	Bend	trans	-105.1	47.3	179.6	58	0	0	0	0	111.5
86	G	26.4	Very low	31.7	Very low	65 Å²	65	116.4 Å²	116.4	67%	0.67	69%	0.685	S	S	*	*			trans	-110	10.5	-165.8	0	0	0	0	0	116.8
87	V	29.2	Very low	31.4	Very low	134 Å²	134	117.5 Å²	117.5	81%	0.812	70%	0.704	S	S	*	*	S	Bend	trans	-145.6	143.8	173.1	-156.6	0	0	0	0	108.8
88	E	26.3	Very low	31	Very low	180 Å²	180	119.3 Å²	119.3	84%	0.841	72%	0.724	S	S	*	*			trans	68.8	78.2	175.3	-47.2	-163.4	158.6	0	0	116.8
89	D	28.7	Very low	30.9	Very low	169 Å²	169	124.2 Å²	124.2	90%	0.904	75%	0.747	S	S	*	*				-155.1	102	129.7	-118.1	-21.5	0	0	0	111.3
90	V	26.6	Very low	30.9	Very low	132 Å²	132	127.6 Å²	127.6	80%	0.8	77%	0.765	S	S	*	*			trans	-113.3	99.4	176.9	173.6	0	0	0	0	107.7
91	L	29.4	Very low	30.7	Very low	161 Å²	161	131.2 Å²	131.2	84%	0.843	78%	0.78	S	S	*	*			trans	169	135.1	139.3	-92	152.7	0	0	0	114.4
92	S	30.2	Very low	30.9	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	79%	0.789	S	S	*	*			trans	94.4	134.9	146.6	82.3	0	0	0	0	122
93	S	31.7	Very low	30.9	Very low	111 Å²	111	133.5 Å²	133.5	78%	0.776	80%	0.796	S	S	*	*			trans	67.1	104.9	174.6	72.4	0	0	0	0	116.9
94	V	32.6	Very low	30.8	Very low	127 Å²	127	135 Å²	135	77%	0.77	81%	0.806	S	S	*	*			cis	82.4	81.3	49.8	-177.8	0	0	0	0	114.3
95	R	30.5	Very low	30.5	Very low	237 Å²	237	143.2 Å²	143.2	89%	0.894	82%	0.817	S	S	*	*				-179.8	149	110.7	-98.8	160.5	-173.2	-165.9	1.3	113.9
96	P	31.2	Very low	30.7	Very low	131 Å²	131	141.3 Å²	141.3	85%	0.851	81%	0.814	S	S	*	*			trans	-106.1	164.8	-173.5	40.3	-35.1	0	0	0	115.6
97	G	31.4	Very low	30.8	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	82%	0.823	S	S	*	*			trans	111.2	142.3	173.9	0	0	0	0	0	112.6
98	V	36.5	Very low	31	Very low	127 Å²	127	146.6 Å²	146.6	77%	0.77	83%	0.826	S	S	*	*			cis	-149.1	143.7	5.7	170.2	0	0	0	0	108.6
99	N	30.3	Very low	31.3	Very low	140 Å²	140	143.3 Å²	143.3	75%	0.749	82%	0.823	S	S	*	*			trans	19.1	119	161.8	-49.4	-7.8	0	0	0	120
100	D	34.1	Very low	31.4	Very low	161 Å²	161	144.5 Å²	144.5	86%	0.861	82%	0.823	S	S	*	*				-175.2	107.6	110.8	-92	-16.8	0	0	0	111
101	E	27.8	Very low	31.9	Very low	195 Å²	195	143.9 Å²	143.9	91%	0.911	83%	0.825	S	S	*	*			trans	-116.6	108.5	167.8	-79.5	-163.8	146.4	0	0	109.7
102	V	36.5	Very low	32.1	Very low	136 Å²	136	139.9 Å²	139.9	82%	0.824	82%	0.822	S	S	*	*			trans	-143.6	120.1	165.2	-178.8	0	0	0	0	110.3
103	A	34.1	Very low	32.3	Very low	95 Å²	95	140.5 Å²	140.5	79%	0.785	82%	0.824	S	S	*	*			trans	62.1	132.2	173.6	0	0	0	0	0	116
104	V	30.9	Very low	32.5	Very low	137 Å²	137	143.2 Å²	143.2	83%	0.83	83%	0.829	S	S	*	*			cis	-135.5	120.1	28.8	176.3	0	0	0	0	111
105	R	26.8	Very low	32.9	Very low	263 Å²	263	143 Å²	143	99%	0.992	83%	0.827	S	S	*	*			trans	-146.1	92.1	165.4	-126	179.1	-173.8	155.5	1.9	112
106	A	33.1	Very low	33	Very low	87 Å²	87	137.8 Å²	137.8	72%	0.719	83%	0.825	S	S	*	*			trans	-143.3	127.2	156.3	0	0	0	0	0	104.3
107	V	29.6	Very low	33.3	Very low	140 Å²	140	136.3 Å²	136.3	85%	0.848	82%	0.823	S	S	*	*			cis	-133.9	125.8	41.5	175.5	0	0	0	0	111.1
108	L	32.6	Very low	33.5	Very low	170 Å²	170	140 Å²	140	89%	0.89	83%	0.832	S	S	*	*			trans	-154.7	122.4	156.4	-107.9	157.3	0	0	0	107.6
109	S	33.1	Very low	33.4	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	83%	0.829	S	S	*	*			trans	-71.4	139.3	-169.7	45.8	0	0	0	0	112.9
110	Q	30.6	Very low	34	Very low	195 Å²	195	137.4 Å²	137.4	91%	0.911	84%	0.835	S	S	*	*			trans	-72.5	136.3	179.4	-62.1	169.8	-10.4	0	0	112.6
111	S	36.7	Very low	34.2	Very low	118 Å²	118	135.8 Å²	135.8	83%	0.825	83%	0.833	S	S	*	*			trans	-161.7	102.2	146.8	43	0	0	0	0	113.1
112	G	34.4	Very low	34.6	Very low	77 Å²	77	129.6 Å²	129.6	79%	0.794	82%	0.822	S	S	*	*			trans	72.9	111.9	147.5	0	0	0	0	0	119.7
113	P	33.9	Very low	34.6	Very low	122 Å²	122	129.3 Å²	129.3	79%	0.792	82%	0.82	S	S	*	*			trans	-95.7	139.1	170	35.5	-29.8	0	0	0	112.5
114	L	36.3	Very low	34.7	Very low	168 Å²	168	130.5 Å²	130.5	88%	0.88	82%	0.818	S	S	*	*			trans	-166.1	111.1	153.8	-103.5	136.2	0	0	0	113.1
115	V	40.6	Very low	34.9	Very low	121 Å²	121	131.3 Å²	131.3	73%	0.733	82%	0.818	S	S	*	*			trans	60.5	122.8	146.6	179.7	0	0	0	0	120.1
116	P	32.4	Very low	35.2	Very low	129 Å²	129	123 Å²	123	84%	0.838	81%	0.814	S	S	*	*			trans	-87.7	136.6	166.9	34.8	-30.6	0	0	0	112
117	A	37.9	Very low	35.4	Very low	99 Å²	99	123.7 Å²	123.7	82%	0.818	81%	0.813	S	S	*	*			trans	-129	124.3	169.2	0	0	0	0	0	110.6
118	T	34.8	Very low	35.7	Very low	151 Å²	151	123.5 Å²	123.5	93%	0.926	81%	0.813	S	S	*	*			trans	-74.4	135.5	177.2	46.3	0	0	0	0	112.1
119	G	36	Very low	35.8	Very low	70 Å²	70	120.7 Å²	120.7	72%	0.722	81%	0.814	S	S	*	*			trans	179.7	81.2	173.5	0	0	0	0	0	117
120	V	41.4	Very low	36.5	Very low	142 Å²	142	121 Å²	121	86%	0.861	82%	0.816	S	S	*	*			trans	46.4	132.9	140.1	-172.4	0	0	0	0	119.8
121	P	39.5	Very low	37.9	Very low	127 Å²	127	114 Å²	114	83%	0.825	80%	0.796	S	S	*	*			trans	-88.4	157.9	-163.7	36.8	-37.5	0	0	0	115.3
122	G	36	Very low	39.1	Very low	65 Å²	65	114.8 Å²	114.8	67%	0.67	80%	0.798	S	S	*	*			trans	-166.2	97.9	173.6	0	0	0	0	0	115
123	T	36.9	Very low	40.7	Very low	129 Å²	129	118.5 Å²	118.5	79%	0.791	80%	0.795	S	S	*	*			trans	56.4	135.7	146.3	55.2	0	0	0	0	122.2
124	T	35	Very low	42.9	Very low	121 Å²	121	117.8 Å²	117.8	74%	0.742	79%	0.789	S	S	*	*			trans	56.9	109.9	153	55.5	0	0	0	0	116.4
125	D	35.9	Very low	45.2	Very low	154 Å²	154	113.2 Å²	113.2	82%	0.824	77%	0.768	S	S	*	*				-154.3	149.7	73.3	-84.5	-33.4	0	0	0	114.5	S127	D125-S127 PolarHBondContact O-N 3.5Å
126	G	31.9	Very low	47.3	Very low	89 Å²	89	109.3 Å²	109.3	92%	0.918	74%	0.742	S	S	*	*			trans	-83.9	99.8	175.8	0	0	0	0	0	112.5
127	S	38.2	Very low	49.8	Very low	101 Å²	101	115.5 Å²	115.5	71%	0.706	75%	0.749	S	S	*	*			trans	-137.7	112.1	164.3	53.4	0	0	0	0	111.1	D125	D125-S127 PolarHBondContact O-N 3.5Å
128	T	34.6	Very low	51.8	Low	135 Å²	135	114 Å²	114	83%	0.828	74%	0.744	S	S	*	*			trans	8.4	109.7	165.1	48.3	0	0	0	0	117.8	S130	T128-S130 VanDerWaalsContact C-N 3.3Å; T128-S130 PolarHBondContact O-N 3.47Å
129	A	36.3	Very low	54.2	Low	112 Å²	112	108.2 Å²	108.2	93%	0.926	71%	0.708	S	S	*	*			trans	-67.3	80.1	173.1	0	0	0	0	0	112.7	G131	A129-G131 VanDerWaalsContact C-N 3.32Å; A129-G131 PolarHBondContact O-N 3.48Å
130	S	47.6	Very low	56.6	Low	116 Å²	116	110 Å²	110	81%	0.811	70%	0.701	S	S	*	*			trans	-87.4	69.7	168.8	-174.8	0	0	0	0	110.4	T128	T128-S130 VanDerWaalsContact C-N 3.3Å; T128-S130 PolarHBondContact O-N 3.47Å
131	G	58.7	Low	58.6	Low	47 Å²	47	103.3 Å²	103.3	49%	0.485	66%	0.66	S	S	.	*			trans	-64.3	153.2	167.6	0	0	0	0	0	111.4	A129 Q133	A129-G131 VanDerWaalsContact C-N 3.32Å; A129-G131 PolarHBondContact O-N 3.48Å; G131-Q133 PolarHBondContact O-N 3.13Å
132	P	63.4	Low	60.9	Low	135 Å²	135	98.5 Å²	98.5	88%	0.877	63%	0.627	S	S	*	*			trans	-61	113.5	178	25.5	-33.6	0	0	0	110.2	T134	P132-T134 PolarHBondContact O-N 3.44Å
133	Q	66.9	Low	63.4	Low	156 Å²	156	99 Å²	99	73%	0.729	61%	0.614	S	S	*	*			trans	-72.3	122	178.1	-68.8	-175.2	-11.1	0	0	109.9	G131	G131-Q133 PolarHBondContact O-N 3.13Å
134	T	81.6	Confident	65.8	Low	107 Å²	107	95.9 Å²	95.9	66%	0.656	60%	0.601	S	S	*	*			trans	-76.1	122.6	174.5	50.8	0	0	0	0	110.2	P132	P132-T134 PolarHBondContact O-N 3.44Å
135	V	83.9	Confident	68.4	Low	72 Å²	72	94 Å²	94	44%	0.436	58%	0.584	S	S	.	*			trans	-129.4	141.9	-179.9	178.2	0	0	0	0	108.8	T139	V135-T139 WeakPolarHBondContact CG1-O 3.46Å
136	I	84.7	Confident	70.9	Confident	39 Å²	39	86.8 Å²	86.8	20%	0.2	55%	0.546	C	S	.	.			trans	-72.6	128.9	177.9	-57.7	158.9	0	0	0	109.2	G138 T139 V141 I143 E220	I136-G138 PolarHBondContact O-N 2.92Å; I136-T139 WeakPolarHBondContact CB-OG1 3.47Å; I136-T139 PolarHBondContact O-N 2.86Å; I136-T139 PolarHBondContact O-OG1 3.32Å; I136-V141 PolarHBondContact N-O 3.3Å; I136-I143 HydrophobicContact CD1-CD1 3.91Å; I136-I143 HydrophobicContact CD1-CG1 3.73Å; I136-I143 HydrophobicContact CG1-CD1 4.07Å; I136-I143 HydrophobicContact CG1-CG1 4.19Å; I136-E220 HydrophobicContact CD1-CB 3.85Å; I136-E220 HydrophobicContact CD1-CG 4.03Å
137	W	83.7	Confident	73.7	Confident	259 Å²	259	85 Å²	85	98%	0.981	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	125.7	-179.3	-179.7	51.6	0	0	0	111.8
138	G	81.5	Confident	76.2	Confident	68 Å²	68	83.6 Å²	83.6	70%	0.701	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.3	-2.6	-174.8	0	0	0	0	0	114.7	I136	I136-G138 PolarHBondContact O-N 2.92Å
139	T	85.2	Confident	78.8	Confident	29 Å²	29	79.9 Å²	79.9	18%	0.178	48%	0.475	C	S	.	.	S	Bend	trans	-129.1	173.3	174.7	75.4	0	0	0	0	110.8	V135 I136 V141 F217 E220	V135-T139 WeakPolarHBondContact CG1-O 3.46Å; I136-T139 WeakPolarHBondContact CB-OG1 3.47Å; I136-T139 PolarHBondContact O-N 2.86Å; I136-T139 PolarHBondContact O-OG1 3.32Å; T139-V141 PolarHBondContact OG1-N 2.87Å; T139-F217 HydrophobicContact CG2-CD1 3.73Å; T139-F217 HydrophobicContact CG2-CD2 4.4Å; T139-F217 HydrophobicContact CG2-CE1 3.96Å; T139-F217 HydrophobicContact CG2-CG 3.98Å; T139-F217 HydrophobicContact CG2-CZ 4.38Å; T139-E220 HydrophobicContact CG2-CG 4.43Å
140	D	85.1	Confident	81.4	Confident	107 Å²	107	74.9 Å²	74.9	57%	0.572	43%	0.432	S	S	*	.			trans	-101.9	10.5	167	65.2	-17.1	0	0	0	112.5	F217	D140-F217 WeakPolarHBondContact OD1-CE2 3.25Å
141	V	84.1	Confident	83.5	Confident	2 Å²	2	72 Å²	72	1%	0.012	41%	0.405	C	S	.	.			trans	-90.4	128.8	-166.1	-177.5	0	0	0	0	112.3	I136 T139 V146 Q213 F217 V221	I136-V141 PolarHBondContact N-O 3.3Å; T139-V141 PolarHBondContact OG1-N 2.87Å; V141-V146 HydrophobicContact CG1-CG2 3.57Å; V141-Q213 HydrophobicContact CG2-CG 4.37Å; V141-F217 HydrophobicContact CG2-CB 4.45Å; V141-F217 HydrophobicContact CG2-CD2 3.7Å; V141-F217 HydrophobicContact CG2-CE2 4.38Å; V141-F217 HydrophobicContact CG2-CG 4.38Å; V141-V221 HydrophobicContact CG1-CG2 4.28Å
142	N	88.2	Confident	84.9	Confident	25 Å²	25	73.9 Å²	73.9	13%	0.134	40%	0.401	C	S	.	.			trans	-103	112.8	168.8	179.5	-22.4	0	0	0	110.2	A144 Q145 V146	N142-A144 PolarHBondContact O-N 3.28Å; N142-A144 PolarHBondContact OD1-N 2.87Å; N142-A144 VanDerWaalsContact OD1-N 3.14Å; N142-Q145 HydrophobicContact CB-CB 4.06Å; N142-Q145 WeakPolarHBondContact O-CB 3.41Å; N142-Q145 PolarHBondContact O-N 3.34Å; N142-Q145 VanDerWaalsContact O-N 3.11Å; N142-Q145 PolarHBondContact OD1-N 3.06Å; N142-V146 PolarHBondContact O-N 3.09Å
143	I	87.7	Confident	86.2	Confident	75 Å²	75	67.6 Å²	67.6	39%	0.385	36%	0.36	S	S	.	.	H	α-helix	trans	-54	-47.6	-175.7	-59	166.4	0	0	0	111.9	I136 Q145 V146 M147 A224	I136-I143 HydrophobicContact CD1-CD1 3.91Å; I136-I143 HydrophobicContact CD1-CG1 3.73Å; I136-I143 HydrophobicContact CG1-CD1 4.07Å; I136-I143 HydrophobicContact CG1-CG1 4.19Å; I143-Q145 VanDerWaalsContact C-N 3.28Å; I143-Q145 PolarHBondContact O-N 2.84Å; I143-V146 PolarHBondContact O-N 3.19Å; I143-M147 HydrophobicContact CG2-CG 4.25Å; I143-M147 HydrophobicContact CG2-SD 3.99Å; I143-M147 VanDerWaalsContact O-CG 3.31Å; I143-M147 WeakPolarHBondContact O-CG 3.48Å; I143-M147 PolarHBondContact O-N 3.08Å; I143-A224 HydrophobicContact CG2-CB 4.03Å
144	A	88.4	Confident	87.2	Confident	64 Å²	64	60.1 Å²	60.1	53%	0.529	33%	0.325	S	S	.	.	H	α-helix	trans	-65.9	-32.7	-177.2	0	0	0	0	0	112.3	N142 S148	N142-A144 PolarHBondContact O-N 3.28Å; N142-A144 PolarHBondContact OD1-N 2.87Å; N142-A144 VanDerWaalsContact OD1-N 3.14Å; A144-S148 WeakPolarHBondContact O-CB 3.48Å; A144-S148 PolarHBondContact O-N 3.16Å; A144-S148 VanDerWaalsContact O-N 3.11Å; A144-S148 PolarHBondContact O-OG 3.34Å
145	Q	89	Confident	87.3	Confident	82 Å²	82	58.4 Å²	58.4	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-72.2	-41.1	175.1	-162.9	-176.2	20	0	0	111.5	N142 I143 S148 R149	N142-Q145 HydrophobicContact CB-CB 4.06Å; N142-Q145 WeakPolarHBondContact O-CB 3.41Å; N142-Q145 PolarHBondContact O-N 3.34Å; N142-Q145 VanDerWaalsContact O-N 3.11Å; N142-Q145 PolarHBondContact OD1-N 3.06Å; I143-Q145 VanDerWaalsContact C-N 3.28Å; I143-Q145 PolarHBondContact O-N 2.84Å; Q145-S148 PolarHBondContact O-OG 3.29Å; Q145-S148 VanDerWaalsContact O-OG 3.12Å; Q145-R149 VanDerWaalsContact O-CB 3.23Å; Q145-R149 WeakPolarHBondContact O-CB 3.45Å; Q145-R149 WeakPolarHBondContact O-CD 3.32Å; Q145-R149 WeakPolarHBondContact O-CG 3.32Å; Q145-R149 PolarHBondContact O-N 3.13Å
146	V	89.3	Confident	87.4	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-59.8	-52.5	172.7	167.4	0	0	0	0	110.6	V141 N142 I143 S148 R149 F150 L210 V221 A224	V141-V146 HydrophobicContact CG1-CG2 3.57Å; N142-V146 PolarHBondContact O-N 3.09Å; I143-V146 PolarHBondContact O-N 3.19Å; V146-S148 PolarHBondContact O-N 3.19Å; V146-R149 PolarHBondContact O-N 3.14Å; V146-F150 VanDerWaalsContact O-CB 3.25Å; V146-F150 WeakPolarHBondContact O-CB 3.35Å; V146-F150 PolarHBondContact O-N 3.5Å; V146-L210 HydrophobicContact CG1-CD1 3.97Å; V146-L210 HydrophobicContact CG2-CD1 4.38Å; V146-V221 HydrophobicContact CG1-CG1 4.11Å; V146-A224 HydrophobicContact CG1-CB 3.97Å
147	M	90.7	Very high	87.3	Confident	53 Å²	53	57.4 Å²	57.4	26%	0.261	31%	0.306	S	S	.	.	H	α-helix	trans	-55.6	-49.1	179.7	-71.5	-179	80.6	0	0	112.2	I143 F150 K151 A224 A227 A228	I143-M147 HydrophobicContact CG2-CG 4.25Å; I143-M147 HydrophobicContact CG2-SD 3.99Å; I143-M147 VanDerWaalsContact O-CG 3.31Å; I143-M147 WeakPolarHBondContact O-CG 3.48Å; I143-M147 PolarHBondContact O-N 3.08Å; M147-F150 PolarHBondContact O-N 3.13Å; M147-K151 WeakPolarHBondContact O-CB 3.36Å; M147-K151 WeakPolarHBondContact O-CG 3.37Å; M147-K151 PolarHBondContact O-N 3.12Å; M147-A224 HydrophobicContact CG-CB 4.34Å; M147-A224 WeakPolarHBondContact CG-O 3.47Å; M147-A227 HydrophobicContact CE-CB 3.88Å; M147-A228 HydrophobicContact CB-CB 4.16Å; M147-A228 HydrophobicContact CE-CB 4.4Å; M147-A228 HydrophobicContact CG-CB 4.26Å
148	S	90.1	Very high	87	Confident	70 Å²	70	49.2 Å²	49.2	49%	0.49	28%	0.28	S	S	.	.	H	α-helix	trans	-67.9	-40.6	-179.6	53	0	0	0	0	112.9	A144 Q145 V146 F150 H152	A144-S148 WeakPolarHBondContact O-CB 3.48Å; A144-S148 PolarHBondContact O-N 3.16Å; A144-S148 VanDerWaalsContact O-N 3.11Å; A144-S148 PolarHBondContact O-OG 3.34Å; Q145-S148 PolarHBondContact O-OG 3.29Å; Q145-S148 VanDerWaalsContact O-OG 3.12Å; V146-S148 PolarHBondContact O-N 3.19Å; S148-F150 VanDerWaalsContact C-N 3.33Å; S148-F150 PolarHBondContact O-N 3.07Å; S148-H152 WeakPolarHBondContact O-CB 3.46Å; S148-H152 PolarHBondContact O-N 3.48Å; S148-H152 VanDerWaalsContact O-N 3.13Å
149	R	89.9	Confident	86.5	Confident	58 Å²	58	46.6 Å²	46.6	22%	0.219	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-40.9	174	-77.2	170.6	163.1	-163.9	-18.2	111.9	Q145 V146 F153 R207 D209 L210	Q145-R149 VanDerWaalsContact O-CB 3.23Å; Q145-R149 WeakPolarHBondContact O-CB 3.45Å; Q145-R149 WeakPolarHBondContact O-CD 3.32Å; Q145-R149 WeakPolarHBondContact O-CG 3.32Å; Q145-R149 PolarHBondContact O-N 3.13Å; V146-R149 PolarHBondContact O-N 3.14Å; R149-F153 PolarHBondContact O-N 3.4Å; R149-F153 VanDerWaalsContact O-N 3.12Å; R149-R207 PolarHBondContact O-NH1 3.2Å; R149-D209 IonicContact CZ-OD2 3.82Å; R149-D209 IonicContact NH1-OD2 3.16Å; R149-D209 IonicContact NH2-OD2 3.39Å; R149-D209 PolarHBondContact NH2-OD2 3.26Å; R149-L210 HydrophobicContact CB-CD2 4.35Å
150	F	90.8	Very high	85.4	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-75.2	-43.1	-179	-174.9	-107.2	0	0	0	112.4	V146 M147 S148 H152 F153 L154 I198 L203 L210 C225 A228 T229 I248	V146-F150 VanDerWaalsContact O-CB 3.25Å; V146-F150 WeakPolarHBondContact O-CB 3.35Å; V146-F150 PolarHBondContact O-N 3.5Å; M147-F150 PolarHBondContact O-N 3.13Å; S148-F150 VanDerWaalsContact C-N 3.33Å; S148-F150 PolarHBondContact O-N 3.07Å; F150-H152 VanDerWaalsContact C-N 3.26Å; F150-H152 PolarHBondContact O-N 3.37Å; F150-F153 HydrophobicContact CD2-CD1 4.03Å; F150-F153 AromaticContact CE2-CD1 3.95Å; F150-F153 HydrophobicContact CE2-CD1 3.95Å; F150-F153 HydrophobicContact CE2-CE1 4.26Å; F150-F153 WeakPolarHBondContact O-CB 3.4Å; F150-F153 PolarHBondContact O-N 2.84Å; F150-F153 VanDerWaalsContact O-N 3.1Å; F150-L154 HydrophobicContact CD1-CD1 3.98Å; F150-L154 HydrophobicContact CD1-CG 4.45Å; F150-L154 HydrophobicContact CE1-CD1 3.51Å; F150-L154 HydrophobicContact CE1-CD2 4.38Å; F150-L154 HydrophobicContact CE1-CG 4.05Å; F150-L154 HydrophobicContact CE2-CD2 4.47Å; F150-L154 HydrophobicContact CZ-CD1 3.97Å; F150-L154 HydrophobicContact CZ-CD2 3.98Å; F150-L154 HydrophobicContact CZ-CG 4.07Å; F150-L154 PolarHBondContact O-N 2.87Å; F150-I198 HydrophobicContact CE2-CD1 4.08Å; F150-I198 HydrophobicContact CZ-CD1 3.59Å; F150-L203 HydrophobicContact CD2-CD1 4.34Å; F150-L203 HydrophobicContact CE2-CD1 4.5Å; F150-L210 HydrophobicContact CB-CD2 3.98Å; F150-L210 HydrophobicContact CD2-CD2 4.09Å; F150-C225 HydrophobicContact CD1-CB 3.77Å; F150-C225 HydrophobicContact CD2-CB 4.39Å; F150-C225 HydrophobicContact CE1-CB 3.69Å; F150-C225 WeakPolarHBondContact CE1-O 3.22Å; F150-C225 HydrophobicContact CE2-CB 4.34Å; F150-C225 HydrophobicContact CG-CB 4.12Å; F150-C225 HydrophobicContact CZ-CB 4.01Å; F150-A228 HydrophobicContact CD1-CB 3.88Å; F150-T229 WeakPolarHBondContact CE1-OG1 3.28Å; F150-I248 HydrophobicContact CE1-CD1 3.53Å; F150-I248 HydrophobicContact CZ-CD1 3.54Å
151	K	90.3	Very high	84.2	Confident	55 Å²	55	51 Å²	51	24%	0.239	28%	0.279	C	S	.	.	H	α-helix	trans	-54.6	-43.8	171.6	-77.8	-161.4	173.2	-164.1	0	111.9	M147 L154 L155 A228 A231 L232 D235	M147-K151 WeakPolarHBondContact O-CB 3.36Å; M147-K151 WeakPolarHBondContact O-CG 3.37Å; M147-K151 PolarHBondContact O-N 3.12Å; K151-L154 PolarHBondContact O-N 2.8Å; K151-L155 WeakPolarHBondContact O-CG 3.42Å; K151-L155 PolarHBondContact O-N 3.11Å; K151-A228 WeakPolarHBondContact CE-O 3.37Å; K151-A228 HydrophobicContact CG-CB 3.82Å; K151-A231 VanDerWaalsContact NZ-CB 3.3Å; K151-L232 HydrophobicContact CB-CD1 3.86Å; K151-L232 HydrophobicContact CB-CG 4.33Å; K151-L232 HydrophobicContact CD-CD1 4.31Å; K151-L232 HydrophobicContact CD-CD2 4.11Å; K151-L232 HydrophobicContact CD-CG 3.89Å; K151-L232 HydrophobicContact CG-CD1 3.72Å; K151-L232 HydrophobicContact CG-CD2 4.38Å; K151-L232 HydrophobicContact CG-CG 3.84Å; K151-D235 IonicContact NZ-OD2 3.76Å
152	H	89.1	Confident	82.8	Confident	88 Å²	88	54.6 Å²	54.6	41%	0.407	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-43.8	176.8	178.6	106.2	0	0	0	111.8	S148 F150 L154 L155 T156 R207	S148-H152 WeakPolarHBondContact O-CB 3.46Å; S148-H152 PolarHBondContact O-N 3.48Å; S148-H152 VanDerWaalsContact O-N 3.13Å; F150-H152 VanDerWaalsContact C-N 3.26Å; F150-H152 PolarHBondContact O-N 3.37Å; H152-L154 PolarHBondContact O-N 3.33Å; H152-L155 PolarHBondContact O-N 3.5Å; H152-T156 WeakPolarHBondContact O-CG2 3.46Å; H152-T156 PolarHBondContact O-N 3.14Å; H152-T156 PolarHBondContact O-OG1 3.04Å; H152-R207 VanDerWaalsContact CD2-CZ 3.46Å; H152-R207 PolarHBondContact CD2-NH1 3.17Å; H152-R207 PolarHBondContact CD2-NH2 3.11Å; H152-R207 PolarHBondContact NE2-NH2 3Å; H152-R207 VanDerWaalsContact NE2-NH2 3.11Å
153	F	89.7	Confident	81	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.009	33%	0.33	C	S	.	.	H	α-helix	trans	-54.7	-48.1	175.4	163.3	-106.3	0	0	0	112.3	R149 F150 L155 T156 Y157 Y181 I198 H202 L203 A206	R149-F153 PolarHBondContact O-N 3.4Å; R149-F153 VanDerWaalsContact O-N 3.12Å; F150-F153 HydrophobicContact CD2-CD1 4.03Å; F150-F153 AromaticContact CE2-CD1 3.95Å; F150-F153 HydrophobicContact CE2-CD1 3.95Å; F150-F153 HydrophobicContact CE2-CE1 4.26Å; F150-F153 WeakPolarHBondContact O-CB 3.4Å; F150-F153 PolarHBondContact O-N 2.84Å; F150-F153 VanDerWaalsContact O-N 3.1Å; F153-L155 PolarHBondContact O-N 3.33Å; F153-T156 PolarHBondContact O-N 3.22Å; F153-Y157 HydrophobicContact CD2-CD2 4.27Å; F153-Y157 HydrophobicContact CD2-CG 4.4Å; F153-Y157 AromaticContact CE2-CD2 3.66Å; F153-Y157 HydrophobicContact CE2-CD2 3.66Å; F153-Y157 HydrophobicContact CE2-CE2 4.36Å; F153-Y157 AromaticContact CE2-CG 3.78Å; F153-Y157 HydrophobicContact CE2-CG 3.78Å; F153-Y157 HydrophobicContact CZ-CG 4.37Å; F153-Y157 VanDerWaalsContact O-CB 3.31Å; F153-Y157 WeakPolarHBondContact O-CB 3.31Å; F153-Y157 PolarHBondContact O-N 2.93Å; F153-Y181 HydrophobicContact CE1-CD2 4.17Å; F153-Y181 AromaticContact CE1-CE2 3.66Å; F153-Y181 HydrophobicContact CE1-CE2 3.66Å; F153-Y181 HydrophobicContact CE2-CE2 4.24Å; F153-Y181 HydrophobicContact CZ-CD2 4.25Å; F153-Y181 AromaticContact CZ-CE2 3.42Å; F153-Y181 HydrophobicContact CZ-CE2 3.42Å; F153-Y181 VanDerWaalsContact CZ-CE2 3.42Å; F153-Y181 AromaticContact CZ-CZ 3.92Å; F153-I198 HydrophobicContact CE1-CG2 4.43Å; F153-H202 WeakPolarHBondContact CE2-O 3.38Å; F153-H202 HydrophobicContact CZ-CB 4.18Å; F153-L203 HydrophobicContact CD1-CD1 3.82Å; F153-L203 HydrophobicContact CD2-CD1 4.41Å; F153-L203 HydrophobicContact CE1-CD1 3.75Å; F153-L203 HydrophobicContact CE2-CD1 4.34Å; F153-L203 HydrophobicContact CG-CD1 4.14Å; F153-L203 HydrophobicContact CZ-CB 4.31Å; F153-L203 HydrophobicContact CZ-CD1 4.01Å; F153-A206 HydrophobicContact CD2-CB 3.49Å; F153-A206 VanDerWaalsContact CD2-CB 3.49Å; F153-A206 HydrophobicContact CE2-CB 3.64Å
154	L	87.4	Confident	79.2	Confident	0 Å²	0	60 Å²	60	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.5	-27	177.6	-66.2	173.8	0	0	0	113.5	F150 K151 H152 Y181 I198 L232	F150-L154 HydrophobicContact CD1-CD1 3.98Å; F150-L154 HydrophobicContact CD1-CG 4.45Å; F150-L154 HydrophobicContact CE1-CD1 3.51Å; F150-L154 HydrophobicContact CE1-CD2 4.38Å; F150-L154 HydrophobicContact CE1-CG 4.05Å; F150-L154 HydrophobicContact CE2-CD2 4.47Å; F150-L154 HydrophobicContact CZ-CD1 3.97Å; F150-L154 HydrophobicContact CZ-CD2 3.98Å; F150-L154 HydrophobicContact CZ-CG 4.07Å; F150-L154 PolarHBondContact O-N 2.87Å; K151-L154 PolarHBondContact O-N 2.8Å; H152-L154 PolarHBondContact O-N 3.33Å; L154-Y181 HydrophobicContact CD2-CD1 4.15Å; L154-Y181 HydrophobicContact CD2-CD2 4.11Å; L154-Y181 HydrophobicContact CD2-CG 3.68Å; L154-I198 HydrophobicContact CD2-CD1 4.23Å; L154-L232 HydrophobicContact CB-CD1 4.09Å; L154-L232 HydrophobicContact CD1-CD1 3.71Å
155	L	85.5	Confident	77.4	Confident	70 Å²	70	58.3 Å²	58.3	37%	0.366	33%	0.333	S	S	.	.	H	α-helix	trans	-90.8	-26.2	179.3	-68.3	172.7	0	0	0	113.9	K151 H152 F153 P179 L232	K151-L155 WeakPolarHBondContact O-CG 3.42Å; K151-L155 PolarHBondContact O-N 3.11Å; H152-L155 PolarHBondContact O-N 3.5Å; F153-L155 PolarHBondContact O-N 3.33Å; L155-P179 WeakPolarHBondContact O-CB 3.44Å; L155-P179 WeakPolarHBondContact O-CG 3.44Å; L155-L232 HydrophobicContact CD1-CD2 4.21Å; L155-L232 HydrophobicContact CG-CD2 4.48Å
156	T	84.8	Confident	75.8	Confident	72 Å²	72	58.8 Å²	58.8	44%	0.442	34%	0.343	S	S	.	.	H	α-helix	trans	-103.5	-17.3	-175.1	59.3	0	0	0	0	114.6	H152 F153 I158	H152-T156 WeakPolarHBondContact O-CG2 3.46Å; H152-T156 PolarHBondContact O-N 3.14Å; H152-T156 PolarHBondContact O-OG1 3.04Å; F153-T156 PolarHBondContact O-N 3.22Å; T156-I158 PolarHBondContact O-N 3.15Å; T156-I158 VanDerWaalsContact O-N 3.17Å
157	Y	82	Confident	73.9	Confident	19 Å²	19	61.5 Å²	61.5	8%	0.075	36%	0.358	C	S	.	.			trans	-74.1	110.1	-171	-169.7	-100.2	0	0	0	113	F153 P159 P179 L180 Y181 H202 A206	F153-Y157 HydrophobicContact CD2-CD2 4.27Å; F153-Y157 HydrophobicContact CD2-CG 4.4Å; F153-Y157 AromaticContact CE2-CD2 3.66Å; F153-Y157 HydrophobicContact CE2-CD2 3.66Å; F153-Y157 HydrophobicContact CE2-CE2 4.36Å; F153-Y157 AromaticContact CE2-CG 3.78Å; F153-Y157 HydrophobicContact CE2-CG 3.78Å; F153-Y157 HydrophobicContact CZ-CG 4.37Å; F153-Y157 VanDerWaalsContact O-CB 3.31Å; F153-Y157 WeakPolarHBondContact O-CB 3.31Å; F153-Y157 PolarHBondContact O-N 2.93Å; Y157-P159 HydrophobicContact CE1-CB 4.1Å; Y157-P179 CarbonylContact O-C 3.54Å; Y157-P179 WeakPolarHBondContact O-CA 3.42Å; Y157-L180 PolarHBondContact O-N 3.16Å; Y157-L180 VanDerWaalsContact O-N 3.09Å; Y157-Y181 HydrophobicContact CD1-CD2 4.19Å; Y157-Y181 AromaticContact CD1-CE2 3.64Å; Y157-Y181 HydrophobicContact CD1-CE2 3.64Å; Y157-Y181 HydrophobicContact CE1-CE2 4.39Å; Y157-Y181 HydrophobicContact CG-CE2 4.09Å; Y157-H202 HydrophobicContact CD1-CB 4.35Å; Y157-H202 HydrophobicContact CE1-CB 3.68Å; Y157-H202 AromaticContact CE1-CD2 3.97Å; Y157-H202 AromaticContact CE1-CG 3.51Å; Y157-H202 AromaticContact CE1-ND1 3.69Å; Y157-H202 HydrophobicContact CE2-CB 4.07Å; Y157-H202 AromaticContact CZ-CD2 3.84Å; Y157-H202 AromaticContact CZ-CG 3.61Å; Y157-H202 PolarHBondContact OH-CD2 3.25Å; Y157-A206 HydrophobicContact CD2-CB 3.95Å; Y157-A206 HydrophobicContact CE2-CB 4.32Å
158	I	78.9	Confident	72.1	Confident	87 Å²	87	59.6 Å²	59.6	45%	0.446	35%	0.348	S	S	.	.			trans	-111.6	122.5	168.8	-59.1	173.1	0	0	0	106.4	T156 P176	T156-I158 PolarHBondContact O-N 3.15Å; T156-I158 VanDerWaalsContact O-N 3.17Å; I158-P176 VanDerWaalsContact CG2-O 3.25Å; I158-P176 WeakPolarHBondContact CG2-O 3.36Å
159	P	69.7	Low	70.1	Confident	13 Å²	13	58.8 Å²	58.8	8%	0.084	34%	0.341	C	S	.	.			trans	-70.1	142.2	179.4	29	-33.6	0	0	0	110.8	Y157	Y157-P159 HydrophobicContact CE1-CB 4.1Å
160	P	63.1	Low	67.8	Low	114 Å²	114	58.2 Å²	58.2	74%	0.74	34%	0.344	S	S	*	.	S	Bend	trans	-71.9	-34.6	175.7	28.7	-33.4	0	0	0	112.3
161	D	58.7	Low	65.9	Low	114 Å²	114	59.9 Å²	59.9	61%	0.61	36%	0.363	S	S	*	.			trans	-123.5	130.3	-178.8	-62.1	-53.6	0	0	0	110.3
162	L	56.6	Low	64.3	Low	78 Å²	78	63.5 Å²	63.5	41%	0.408	38%	0.38	S	S	.	.			trans	-89	-5.9	173.9	-74.3	109.6	0	0	0	113.3	G164 I174 P176	L162-G164 PolarHBondContact O-N 2.86Å; L162-I174 HydrophobicContact CD2-CB 3.88Å; L162-I174 HydrophobicContact CD2-CG2 3.86Å; L162-P176 HydrophobicContact CD1-CB 3.95Å
163	T	48.5	Very low	62.8	Low	131 Å²	131	64.4 Å²	64.4	80%	0.804	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	102.6	-175.2	49.5	0	0	0	0	111.9
164	G	50.4	Low	61.6	Low	81 Å²	81	65.3 Å²	65.3	84%	0.835	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.5	2.5	172.3	0	0	0	0	0	116	L162	L162-G164 PolarHBondContact O-N 2.86Å
165	Q	51.2	Low	60.5	Low	30 Å²	30	69 Å²	69	14%	0.14	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-77.7	139.8	166.7	-64.5	-172.8	6.2	0	0	110	N167 L180 H202	Q165-N167 PolarHBondContact O-N 3.11Å; Q165-L180 VanDerWaalsContact OE1-CD1 3.25Å; Q165-H202 PolarHBondContact NE2-CE1 3.09Å; Q165-H202 PolarHBondContact NE2-NE2 3.42Å; Q165-H202 VanDerWaalsContact NE2-NE2 3.18Å
166	P	54.3	Low	59.6	Low	91 Å²	91	69.4 Å²	69.4	59%	0.591	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-64	136.9	173.9	26.9	-34.1	0	0	0	110
167	N	50.7	Low	58.9	Low	59 Å²	59	74.2 Å²	74.2	32%	0.316	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-53.4	151.7	171.3	-65.2	-24.5	0	0	0	110.5	Q165 R437	Q165-N167 PolarHBondContact O-N 3.11Å; N167-R437 PolarHBondContact ND2-O 2.77Å; N167-R437 VanDerWaalsContact ND2-O 3.12Å
168	L	51.6	Low	58.6	Low	13 Å²	13	79.1 Å²	79.1	7%	0.068	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-55.7	140.6	168.8	-65.5	155.8	0	0	0	109	T170 G171 I174 Q183 R184 D187	L168-T170 PolarHBondContact O-N 2.98Å; L168-G171 WeakPolarHBondContact O-CA 3.37Å; L168-G171 PolarHBondContact O-N 2.85Å; L168-I174 HydrophobicContact CD1-CG1 3.92Å; L168-I174 HydrophobicContact CG-CG1 3.95Å; L168-Q183 HydrophobicContact CD1-CB 4.14Å; L168-Q183 HydrophobicContact CD2-CB 3.98Å; L168-R184 HydrophobicContact CD2-CG 4.22Å; L168-D187 HydrophobicContact CB-CB 4.49Å; L168-D187 HydrophobicContact CD2-CB 3.81Å
169	T	49.9	Very low	58.7	Low	54 Å²	54	76.1 Å²	76.1	33%	0.331	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.8	-173.6	66.3	0	0	0	0	112.9	G171 D187 R437	T169-G171 PolarHBondContact O-N 3.48Å; T169-D187 WeakPolarHBondContact CB-OD2 3.41Å; T169-D187 WeakPolarHBondContact CG2-OD2 3.35Å; T169-D187 VanDerWaalsContact N-CG 3.33Å; T169-D187 PolarHBondContact N-OD1 3.31Å; T169-D187 PolarHBondContact N-OD2 3.43Å; T169-D187 PolarHBondContact OG1-OD1 2.94Å; T169-D187 VanDerWaalsContact OG1-OD1 3.09Å; T169-D187 PolarHBondContact OG1-OD2 3.46Å; T169-R437 PolarHBondContact O-NH1 3.34Å
170	T	41.4	Very low	59.2	Low	45 Å²	45	75.5 Å²	75.5	28%	0.276	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.9	167.2	41.7	0	0	0	0	115.2	L168 Q172 D187 I190	L168-T170 PolarHBondContact O-N 2.98Å; T170-Q172 VanDerWaalsContact C-N 3.31Å; T170-Q172 PolarHBondContact O-N 3.4Å; T170-D187 VanDerWaalsContact CB-OD1 3.26Å; T170-D187 WeakPolarHBondContact CB-OD1 3.4Å; T170-D187 VanDerWaalsContact CG2-OD1 3.22Å; T170-D187 WeakPolarHBondContact CG2-OD1 3.33Å; T170-D187 PolarHBondContact N-OD1 3.11Å; T170-D187 PolarHBondContact OG1-OD1 3.43Å; T170-I190 HydrophobicContact CG2-CB 4Å; T170-I190 HydrophobicContact CG2-CD1 3.97Å; T170-I190 HydrophobicContact CG2-CG2 3.57Å
171	G	50.8	Low	60.2	Low	42 Å²	42	70 Å²	70	43%	0.433	41%	0.408	S	S	.	.			trans	75.4	12.5	176.6	0	0	0	0	0	115.2	L168 T169	L168-G171 WeakPolarHBondContact O-CA 3.37Å; L168-G171 PolarHBondContact O-N 2.85Å; T169-G171 PolarHBondContact O-N 3.48Å
172	Q	56.1	Low	61.5	Low	130 Å²	130	65.5 Å²	65.5	61%	0.607	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-78.4	140.7	169.9	-64.6	-174.2	6.3	0	0	110	T170	T170-Q172 VanDerWaalsContact C-N 3.31Å; T170-Q172 PolarHBondContact O-N 3.4Å
173	P	58.6	Low	62.7	Low	107 Å²	107	62.3 Å²	62.3	70%	0.695	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-62.7	140.1	172.3	27.8	-34.1	0	0	0	109.7	D175	P173-D175 PolarHBondContact O-N 2.89Å
174	I	62.6	Low	64.1	Low	22 Å²	22	57.6 Å²	57.6	11%	0.113	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-68.5	117.6	179	-63.9	168.8	0	0	0	108.4	L162 L168 P176 L180	L162-I174 HydrophobicContact CD2-CB 3.88Å; L162-I174 HydrophobicContact CD2-CG2 3.86Å; L168-I174 HydrophobicContact CD1-CG1 3.92Å; L168-I174 HydrophobicContact CG-CG1 3.95Å; I174-P176 WeakPolarHBondContact O-CD 3.43Å; I174-L180 HydrophobicContact CD1-CD1 4.11Å; I174-L180 HydrophobicContact CG2-CD1 4Å
175	D	65.6	Low	65.7	Low	76 Å²	76	53.8 Å²	53.8	41%	0.406	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-64.5	117	177.3	-95.6	-15.3	0	0	0	109.1	P173 Q177 R178 Q183	P173-D175 PolarHBondContact O-N 2.89Å; D175-Q177 PolarHBondContact O-N 2.81Å; D175-Q177 VanDerWaalsContact O-N 3.1Å; D175-R178 HydrophobicContact CB-CB 4Å; D175-R178 HydrophobicContact CB-CG 4Å; D175-R178 PolarHBondContact O-N 2.82Å; D175-R178 WeakPolarHBondContact OD2-CD 3.4Å; D175-R178 IonicContact OD2-CZ 3.81Å; D175-R178 IonicContact OD2-NE 2.74Å; D175-R178 PolarHBondContact OD2-NE 3.33Å; D175-R178 VanDerWaalsContact OD2-NE 3.16Å; D175-Q183 PolarHBondContact O-NE2 2.84Å
176	P	66.4	Low	67.2	Low	80 Å²	80	55.4 Å²	55.4	52%	0.519	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.5	-173.6	27.6	-36.2	0	0	0	113.7	I158 L162 I174	I158-P176 VanDerWaalsContact CG2-O 3.25Å; I158-P176 WeakPolarHBondContact CG2-O 3.36Å; L162-P176 HydrophobicContact CD1-CB 3.95Å; I174-P176 WeakPolarHBondContact O-CD 3.43Å
177	Q	69	Low	68.4	Low	173 Å²	173	51.7 Å²	51.7	81%	0.808	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-7.6	-179.5	-62.8	-175.4	-4	0	0	113.5	D175	D175-Q177 PolarHBondContact O-N 2.81Å; D175-Q177 VanDerWaalsContact O-N 3.1Å
178	R	76.9	Confident	69.9	Low	122 Å²	122	49.1 Å²	49.1	46%	0.46	26%	0.264	S	S	.	.	S	Bend	trans	-103.6	143.1	-179	-73	-175.8	-177.7	-152.1	0.7	110.5	D175 L180 Q183	D175-R178 HydrophobicContact CB-CB 4Å; D175-R178 HydrophobicContact CB-CG 4Å; D175-R178 PolarHBondContact O-N 2.82Å; D175-R178 WeakPolarHBondContact OD2-CD 3.4Å; D175-R178 IonicContact OD2-CZ 3.81Å; D175-R178 IonicContact OD2-NE 2.74Å; D175-R178 PolarHBondContact OD2-NE 3.33Å; D175-R178 VanDerWaalsContact OD2-NE 3.16Å; R178-L180 PolarHBondContact O-N 2.78Å; R178-Q183 HydrophobicContact CB-CG 4.15Å; R178-Q183 PolarHBondContact O-NE2 3.47Å
179	P	80.5	Confident	71.3	Confident	23 Å²	23	49.7 Å²	49.7	15%	0.149	27%	0.27	C	S	.	.			trans	-62	128.6	-179.7	24.3	-32.6	0	0	0	111.3	L155 Y157 Y181 L182 Q183	L155-P179 WeakPolarHBondContact O-CB 3.44Å; L155-P179 WeakPolarHBondContact O-CG 3.44Å; Y157-P179 CarbonylContact O-C 3.54Å; Y157-P179 WeakPolarHBondContact O-CA 3.42Å; P179-Y181 PolarHBondContact O-N 3.49Å; P179-L182 HydrophobicContact CB-CB 4.44Å; P179-L182 HydrophobicContact CG-CB 3.85Å; P179-L182 HydrophobicContact CG-CD1 3.85Å; P179-L182 WeakPolarHBondContact O-CB 3.43Å; P179-L182 PolarHBondContact O-N 2.83Å; P179-L182 VanDerWaalsContact O-N 3.13Å; P179-Q183 PolarHBondContact O-N 2.89Å
180	L	80.7	Confident	72.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56.8	-46.4	-169.2	174.5	68.8	0	0	0	112.6	Y157 Q165 I174 R178 L182 Q183 R184	Y157-L180 PolarHBondContact O-N 3.16Å; Y157-L180 VanDerWaalsContact O-N 3.09Å; Q165-L180 VanDerWaalsContact OE1-CD1 3.25Å; I174-L180 HydrophobicContact CD1-CD1 4.11Å; I174-L180 HydrophobicContact CG2-CD1 4Å; R178-L180 PolarHBondContact O-N 2.78Å; L180-L182 PolarHBondContact O-N 3.17Å; L180-Q183 PolarHBondContact O-N 2.85Å; L180-R184 PolarHBondContact O-N 2.83Å
181	Y	84.2	Confident	74.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69.2	-23.4	-176.1	-64	-72.3	0	0	0	113.2	F153 L154 Y157 P179 M185 I198 H202	F153-Y181 HydrophobicContact CE1-CD2 4.17Å; F153-Y181 AromaticContact CE1-CE2 3.66Å; F153-Y181 HydrophobicContact CE1-CE2 3.66Å; F153-Y181 HydrophobicContact CE2-CE2 4.24Å; F153-Y181 HydrophobicContact CZ-CD2 4.25Å; F153-Y181 AromaticContact CZ-CE2 3.42Å; F153-Y181 HydrophobicContact CZ-CE2 3.42Å; F153-Y181 VanDerWaalsContact CZ-CE2 3.42Å; F153-Y181 AromaticContact CZ-CZ 3.92Å; L154-Y181 HydrophobicContact CD2-CD1 4.15Å; L154-Y181 HydrophobicContact CD2-CD2 4.11Å; L154-Y181 HydrophobicContact CD2-CG 3.68Å; Y157-Y181 HydrophobicContact CD1-CD2 4.19Å; Y157-Y181 AromaticContact CD1-CE2 3.64Å; Y157-Y181 HydrophobicContact CD1-CE2 3.64Å; Y157-Y181 HydrophobicContact CE1-CE2 4.39Å; Y157-Y181 HydrophobicContact CG-CE2 4.09Å; P179-Y181 PolarHBondContact O-N 3.49Å; Y181-M185 VanDerWaalsContact O-CG 3.32Å; Y181-M185 WeakPolarHBondContact O-CG 3.48Å; Y181-M185 PolarHBondContact O-N 3.44Å; Y181-I198 HydrophobicContact CD1-CG1 4.27Å; Y181-I198 HydrophobicContact CE1-CB 4.18Å; Y181-I198 HydrophobicContact CE1-CD1 4.39Å; Y181-I198 HydrophobicContact CE1-CG1 3.82Å; Y181-I198 HydrophobicContact CE1-CG2 4.01Å; Y181-H202 AromaticContact CZ-ND1 3.82Å; Y181-H202 VanDerWaalsContact OH-CB 3.28Å; Y181-H202 WeakPolarHBondContact OH-CB 3.17Å; Y181-H202 PolarHBondContact OH-ND1 2.83Å
182	L	84.9	Confident	75.7	Confident	18 Å²	18	54.2 Å²	54.2	9%	0.094	30%	0.297	C	S	.	.	H	α-helix	trans	-70.4	-45.8	172.9	-171.5	163.2	0	0	0	110.4	P179 L180 R184 M185 E186 R236	P179-L182 HydrophobicContact CB-CB 4.44Å; P179-L182 HydrophobicContact CG-CB 3.85Å; P179-L182 HydrophobicContact CG-CD1 3.85Å; P179-L182 WeakPolarHBondContact O-CB 3.43Å; P179-L182 PolarHBondContact O-N 2.83Å; P179-L182 VanDerWaalsContact O-N 3.13Å; L180-L182 PolarHBondContact O-N 3.17Å; L182-R184 VanDerWaalsContact C-N 3.31Å; L182-R184 PolarHBondContact O-N 3.34Å; L182-M185 HydrophobicContact CB-CE 4.5Å; L182-M185 PolarHBondContact O-N 2.98Å; L182-M185 VanDerWaalsContact O-N 3.1Å; L182-E186 HydrophobicContact CD2-CG 4.28Å; L182-E186 VanDerWaalsContact CD2-OE1 3.22Å; L182-E186 WeakPolarHBondContact CD2-OE1 3.24Å; L182-E186 PolarHBondContact O-N 2.97Å; L182-R236 VanDerWaalsContact CD1-CZ 3.45Å
183	Q	82.2	Confident	76.9	Confident	11 Å²	11	50.3 Å²	50.3	5%	0.051	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-41.8	173.7	-57.8	-179.1	56.9	0	0	110.8	L168 D175 R178 P179 L180 M185 E186 D187	L168-Q183 HydrophobicContact CD1-CB 4.14Å; L168-Q183 HydrophobicContact CD2-CB 3.98Å; D175-Q183 PolarHBondContact O-NE2 2.84Å; R178-Q183 HydrophobicContact CB-CG 4.15Å; R178-Q183 PolarHBondContact O-NE2 3.47Å; P179-Q183 PolarHBondContact O-N 2.89Å; L180-Q183 PolarHBondContact O-N 2.85Å; Q183-M185 VanDerWaalsContact C-N 3.34Å; Q183-M185 PolarHBondContact O-N 3.21Å; Q183-E186 WeakPolarHBondContact O-CB 3.23Å; Q183-E186 PolarHBondContact O-N 3.29Å; Q183-D187 WeakPolarHBondContact O-CB 3.17Å; Q183-D187 PolarHBondContact O-N 3.48Å
184	R	79.3	Confident	78	Confident	32 Å²	32	46.3 Å²	46.3	12%	0.121	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-36.1	172.8	-70.9	-172.6	177	-167.8	-2	113	L168 L180 L182 D187 L188 L196 D197	L168-R184 HydrophobicContact CD2-CG 4.22Å; L180-R184 PolarHBondContact O-N 2.83Å; L182-R184 VanDerWaalsContact C-N 3.31Å; L182-R184 PolarHBondContact O-N 3.34Å; R184-D187 PolarHBondContact O-N 3.4Å; R184-L188 WeakPolarHBondContact O-CB 3.23Å; R184-L188 PolarHBondContact O-N 2.84Å; R184-L196 HydrophobicContact CB-CD1 3.95Å; R184-D197 PolarHBondContact NH1-O 3.12Å
185	M	83.3	Confident	79	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-70.3	-34.6	174.2	-76.1	-175.7	-62.9	0	0	112.8	Y181 L182 Q183 L188 A189 T229 F237	Y181-M185 VanDerWaalsContact O-CG 3.32Å; Y181-M185 WeakPolarHBondContact O-CG 3.48Å; Y181-M185 PolarHBondContact O-N 3.44Å; L182-M185 HydrophobicContact CB-CE 4.5Å; L182-M185 PolarHBondContact O-N 2.98Å; L182-M185 VanDerWaalsContact O-N 3.1Å; Q183-M185 VanDerWaalsContact C-N 3.34Å; Q183-M185 PolarHBondContact O-N 3.21Å; M185-L188 PolarHBondContact O-N 2.93Å; M185-A189 WeakPolarHBondContact O-CB 3.27Å; M185-A189 PolarHBondContact O-N 2.99Å; M185-T229 HydrophobicContact SD-CG2 4.37Å; M185-F237 HydrophobicContact CB-CE2 4.44Å
186	E	82.7	Confident	80.1	Confident	64 Å²	64	42.4 Å²	42.4	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-61.5	-45.7	170.2	-75.2	170	175.4	0	0	110.5	L182 Q183 A189 I190 F237	L182-E186 HydrophobicContact CD2-CG 4.28Å; L182-E186 VanDerWaalsContact CD2-OE1 3.22Å; L182-E186 WeakPolarHBondContact CD2-OE1 3.24Å; L182-E186 PolarHBondContact O-N 2.97Å; Q183-E186 WeakPolarHBondContact O-CB 3.23Å; Q183-E186 PolarHBondContact O-N 3.29Å; E186-A189 WeakPolarHBondContact O-CB 3.38Å; E186-A189 PolarHBondContact O-N 3.5Å; E186-I190 WeakPolarHBondContact O-CG1 3.35Å; E186-I190 PolarHBondContact O-N 3.31Å; E186-I190 VanDerWaalsContact O-N 3.12Å; E186-F237 HydrophobicContact CB-CZ 4.35Å; E186-F237 HydrophobicContact CG-CE1 4.3Å; E186-F237 HydrophobicContact CG-CZ 3.64Å
187	D	79.8	Confident	81	Confident	13 Å²	13	41.3 Å²	41.3	7%	0.07	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-35.1	176.6	-167.2	59.8	0	0	0	113.4	L168 T169 T170 Q183 R184 I190 S191	L168-D187 HydrophobicContact CB-CB 4.49Å; L168-D187 HydrophobicContact CD2-CB 3.81Å; T169-D187 WeakPolarHBondContact CB-OD2 3.41Å; T169-D187 WeakPolarHBondContact CG2-OD2 3.35Å; T169-D187 VanDerWaalsContact N-CG 3.33Å; T169-D187 PolarHBondContact N-OD1 3.31Å; T169-D187 PolarHBondContact N-OD2 3.43Å; T169-D187 PolarHBondContact OG1-OD1 2.94Å; T169-D187 VanDerWaalsContact OG1-OD1 3.09Å; T169-D187 PolarHBondContact OG1-OD2 3.46Å; T170-D187 VanDerWaalsContact CB-OD1 3.26Å; T170-D187 WeakPolarHBondContact CB-OD1 3.4Å; T170-D187 VanDerWaalsContact CG2-OD1 3.22Å; T170-D187 WeakPolarHBondContact CG2-OD1 3.33Å; T170-D187 PolarHBondContact N-OD1 3.11Å; T170-D187 PolarHBondContact OG1-OD1 3.43Å; Q183-D187 WeakPolarHBondContact O-CB 3.17Å; Q183-D187 PolarHBondContact O-N 3.48Å; R184-D187 PolarHBondContact O-N 3.4Å; D187-I190 PolarHBondContact O-N 3.22Å; D187-S191 VanDerWaalsContact O-CB 3.28Å; D187-S191 WeakPolarHBondContact O-CB 3.04Å; D187-S191 PolarHBondContact O-N 3.44Å; D187-S191 PolarHBondContact O-OG 2.91Å
188	L	80.8	Confident	81.8	Confident	6 Å²	6	33.3 Å²	33.3	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-40	173.4	-164.6	159.7	0	0	0	110.8	R184 M185 I190 S191 G192 S193 A195 L196 F233 I246	R184-L188 WeakPolarHBondContact O-CB 3.23Å; R184-L188 PolarHBondContact O-N 2.84Å; M185-L188 PolarHBondContact O-N 2.93Å; L188-I190 VanDerWaalsContact C-N 3.32Å; L188-I190 PolarHBondContact O-N 3.46Å; L188-S191 PolarHBondContact O-OG 3.25Å; L188-G192 PolarHBondContact O-N 3.45Å; L188-S193 WeakPolarHBondContact CD2-O 3.36Å; L188-A195 WeakPolarHBondContact CD1-O 3.09Å; L188-L196 HydrophobicContact CD1-CB 3.92Å; L188-L196 HydrophobicContact CD1-CD1 4.17Å; L188-F233 HydrophobicContact CD2-CE2 4.21Å; L188-I246 HydrophobicContact CD1-CG2 4.24Å; L188-I246 HydrophobicContact CD2-CD1 4.14Å; L188-I246 HydrophobicContact CD2-CG1 4.4Å
189	A	81.3	Confident	82.2	Confident	24 Å²	24	28.5 Å²	28.5	20%	0.198	18%	0.175	C	C	.	.	H	α-helix	trans	-65.8	-30.9	173.8	0	0	0	0	0	113.4	M185 E186 F233 F237	M185-A189 WeakPolarHBondContact O-CB 3.27Å; M185-A189 PolarHBondContact O-N 2.99Å; E186-A189 WeakPolarHBondContact O-CB 3.38Å; E186-A189 PolarHBondContact O-N 3.5Å; A189-F233 HydrophobicContact CB-CE2 3.81Å; A189-F233 HydrophobicContact CB-CZ 3.77Å; A189-F237 HydrophobicContact CB-CD1 4.22Å; A189-F237 HydrophobicContact CB-CD2 4.4Å; A189-F237 HydrophobicContact CB-CE1 4.3Å; A189-F237 HydrophobicContact CB-CE2 4.47Å; A189-F237 HydrophobicContact CB-CG 4.28Å; A189-F237 HydrophobicContact CB-CZ 4.43Å
190	I	82	Confident	82.4	Confident	119 Å²	119	27.4 Å²	27.4	61%	0.61	17%	0.168	S	C	*	.	H	α-helix	trans	-83.9	-41.8	178.6	-64.4	163.4	0	0	0	111.7	T170 E186 D187 L188 G192	T170-I190 HydrophobicContact CG2-CB 4Å; T170-I190 HydrophobicContact CG2-CD1 3.97Å; T170-I190 HydrophobicContact CG2-CG2 3.57Å; E186-I190 WeakPolarHBondContact O-CG1 3.35Å; E186-I190 PolarHBondContact O-N 3.31Å; E186-I190 VanDerWaalsContact O-N 3.12Å; D187-I190 PolarHBondContact O-N 3.22Å; L188-I190 VanDerWaalsContact C-N 3.32Å; L188-I190 PolarHBondContact O-N 3.46Å; I190-G192 VanDerWaalsContact C-N 3.31Å
191	S	75.1	Confident	82.5	Confident	60 Å²	60	30.9 Å²	30.9	42%	0.42	19%	0.185	S	C	.	.	H	α-helix	trans	-75.3	-20.5	179.6	62.5	0	0	0	0	113.1	D187 L188 S193	D187-S191 VanDerWaalsContact O-CB 3.28Å; D187-S191 WeakPolarHBondContact O-CB 3.04Å; D187-S191 PolarHBondContact O-N 3.44Å; D187-S191 PolarHBondContact O-OG 2.91Å; L188-S191 PolarHBondContact O-OG 3.25Å; S191-S193 PolarHBondContact O-N 3.1Å; S191-S193 PolarHBondContact OG-OG 2.95Å
192	G	77.9	Confident	82.6	Confident	57 Å²	57	32 Å²	32	59%	0.588	19%	0.189	S	C	*	.			trans	69.6	13.5	-177.6	0	0	0	0	0	113.6	L188 I190	L188-G192 PolarHBondContact O-N 3.45Å; I190-G192 VanDerWaalsContact C-N 3.31Å
193	S	80.2	Confident	82.7	Confident	49 Å²	49	31.3 Å²	31.3	34%	0.343	19%	0.186	S	C	.	.			trans	-68.8	158.8	171.5	67.6	0	0	0	0	110.4	L188 S191	L188-S193 WeakPolarHBondContact CD2-O 3.36Å; S191-S193 PolarHBondContact O-N 3.1Å; S191-S193 PolarHBondContact OG-OG 2.95Å
194	T	81.8	Confident	82.9	Confident	22 Å²	22	35.9 Å²	35.9	14%	0.135	20%	0.203	C	C	.	.			trans	-116	13.6	-178.3	28.3	0	0	0	0	113.3	R244 I246 Q247 E365	T194-R244 HydrophobicContact CG2-CB 4.13Å; T194-I246 WeakPolarHBondContact O-CA 3.39Å; T194-Q247 PolarHBondContact O-N 3.22Å; T194-E365 PolarHBondContact OG1-OE1 3.37Å
195	A	84.9	Confident	83.2	Confident	12 Å²	12	38 Å²	38	10%	0.099	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.8	-177.3	0	0	0	0	0	112.4	L188 Q247	L188-A195 WeakPolarHBondContact CD1-O 3.09Å; A195-Q247 CarbonylContact C-O 3.31Å; A195-Q247 WeakPolarHBondContact CA-O 3.22Å
196	L	87.2	Confident	83.2	Confident	4 Å²	4	40 Å²	40	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	105.8	175.5	-177.9	64	0	0	0	109.7	R184 L188 I198 T229 I246 Q247 I248 R249	R184-L196 HydrophobicContact CB-CD1 3.95Å; L188-L196 HydrophobicContact CD1-CB 3.92Å; L188-L196 HydrophobicContact CD1-CD1 4.17Å; L196-I198 HydrophobicContact CD2-CD1 4.03Å; L196-I198 HydrophobicContact CD2-CG1 4.33Å; L196-I198 HydrophobicContact CG-CD1 4.27Å; L196-I198 HydrophobicContact CG-CG1 4.03Å; L196-T229 HydrophobicContact CD2-CG2 3.87Å; L196-I246 HydrophobicContact CB-CG2 4.22Å; L196-Q247 PolarHBondContact N-O 3.32Å; L196-I248 WeakPolarHBondContact O-CA 3.14Å; L196-R249 PolarHBondContact O-N 3.29Å
197	D	86.5	Confident	83.3	Confident	57 Å²	57	40.5 Å²	40.5	31%	0.305	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	125.2	174.6	-62.3	-56.7	0	0	0	110.8	R184 R249 F251 H408	R184-D197 PolarHBondContact NH1-O 3.12Å; D197-R249 WeakPolarHBondContact OD1-CB 3.43Å; D197-R249 WeakPolarHBondContact OD1-CD 3.18Å; D197-F251 HydrophobicContact CB-CD1 4Å; D197-F251 HydrophobicContact CB-CE1 3.84Å; D197-H408 IonicContact OD1-CE1 3.19Å; D197-H408 PolarHBondContact OD1-CE1 3.43Å; D197-H408 VanDerWaalsContact OD1-CE1 3.27Å; D197-H408 IonicContact OD1-ND1 2.64Å; D197-H408 PolarHBondContact OD1-ND1 3.13Å
198	I	86.5	Confident	83.6	Confident	5 Å²	5	43.4 Å²	43.4	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.8	-176	-60.4	-169.1	0	0	0	109.9	F150 F153 L154 Y181 L196 I248 R249 P250 F251	F150-I198 HydrophobicContact CE2-CD1 4.08Å; F150-I198 HydrophobicContact CZ-CD1 3.59Å; F153-I198 HydrophobicContact CE1-CG2 4.43Å; L154-I198 HydrophobicContact CD2-CD1 4.23Å; Y181-I198 HydrophobicContact CD1-CG1 4.27Å; Y181-I198 HydrophobicContact CE1-CB 4.18Å; Y181-I198 HydrophobicContact CE1-CD1 4.39Å; Y181-I198 HydrophobicContact CE1-CG1 3.82Å; Y181-I198 HydrophobicContact CE1-CG2 4.01Å; L196-I198 HydrophobicContact CD2-CD1 4.03Å; L196-I198 HydrophobicContact CD2-CG1 4.33Å; L196-I198 HydrophobicContact CG-CD1 4.27Å; L196-I198 HydrophobicContact CG-CG1 4.03Å; I198-I248 HydrophobicContact CB-CG2 4.25Å; I198-I248 HydrophobicContact CD1-CD1 4.43Å; I198-I248 HydrophobicContact CD1-CG1 4.25Å; I198-I248 HydrophobicContact CD1-CG2 3.62Å; I198-I248 HydrophobicContact CG1-CG2 3.93Å; I198-R249 PolarHBondContact N-O 2.87Å; I198-P250 WeakPolarHBondContact O-CA 3.41Å; I198-F251 VanDerWaalsContact C-CD1 3.46Å; I198-F251 VanDerWaalsContact O-CD1 3.31Å; I198-F251 WeakPolarHBondContact O-CD1 3.45Å; I198-F251 PolarHBondContact O-N 3Å
199	D	84.7	Confident	84	Confident	21 Å²	21	47.3 Å²	47.3	11%	0.112	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.1	171.7	-161.6	-46.2	0	0	0	110.3	E201 H202 L203 F251 N252	D199-E201 VanDerWaalsContact C-N 3.29Å; D199-E201 PolarHBondContact O-N 2.83Å; D199-E201 WeakPolarHBondContact OD1-CB 3.08Å; D199-E201 PolarHBondContact OD1-N 2.92Å; D199-H202 HydrophobicContact CB-CB 4.45Å; D199-H202 WeakPolarHBondContact O-CB 3.46Å; D199-H202 PolarHBondContact O-N 3.27Å; D199-L203 PolarHBondContact O-N 3.07Å; D199-F251 HydrophobicContact CB-CD2 4.44Å; D199-F251 HydrophobicContact CB-CE1 4.19Å; D199-F251 HydrophobicContact CB-CE2 3.72Å; D199-F251 HydrophobicContact CB-CZ 3.58Å; D199-F251 VanDerWaalsContact N-CE1 3.33Å; D199-F251 WeakPolarHBondContact OD2-CE2 3.38Å; D199-N252 PolarHBondContact OD1-ND2 3.3Å; D199-N252 PolarHBondContact OD2-ND2 2.78Å
200	C	84.4	Confident	84.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-69.7	-22.4	177.5	-70.7	0	0	0	0	113.4	L203 R204 Y211 F251 C253	C200-L203 WeakPolarHBondContact O-CB 3.48Å; C200-L203 PolarHBondContact O-N 3.04Å; C200-R204 WeakPolarHBondContact O-CB 3.5Å; C200-R204 PolarHBondContact O-N 3.28Å; C200-Y211 HydrophobicContact CB-CD2 4.07Å; C200-Y211 HydrophobicContact CB-CE2 3.83Å; C200-F251 WeakPolarHBondContact CB-O 3.32Å; C200-F251 PolarHBondContact N-O 3.24Å; C200-F251 PolarHBondContact SG-O 3.23Å; C200-F251 VanDerWaalsContact SG-O 3.36Å; C200-C253 VanDerWaalsContact SG-SG 3.61Å
201	E	83.6	Confident	84.8	Confident	73 Å²	73	41.8 Å²	41.8	34%	0.341	25%	0.245	S	C	.	.	H	α-helix	trans	-73.8	-30.9	175.7	-165.1	60.9	-151	0	0	111.4	D199 L203 R204 S205	D199-E201 VanDerWaalsContact C-N 3.29Å; D199-E201 PolarHBondContact O-N 2.83Å; D199-E201 WeakPolarHBondContact OD1-CB 3.08Å; D199-E201 PolarHBondContact OD1-N 2.92Å; E201-L203 VanDerWaalsContact C-N 3.34Å; E201-R204 PolarHBondContact O-N 3.04Å; E201-R204 WeakPolarHBondContact OE1-CD 3.43Å; E201-R204 IonicContact OE1-CZ 3.27Å; E201-R204 IonicContact OE1-NH1 2.81Å; E201-R204 PolarHBondContact OE1-NH1 2.99Å; E201-R204 WeakPolarHBondContact OE2-CD 3.46Å; E201-R204 IonicContact OE2-CZ 3.93Å; E201-R204 IonicContact OE2-NE 3.69Å; E201-R204 IonicContact OE2-NH1 3.81Å; E201-R204 PolarHBondContact OE2-NH1 3.2Å; E201-S205 WeakPolarHBondContact O-CB 3.43Å; E201-S205 PolarHBondContact O-N 2.92Å; E201-S205 PolarHBondContact O-OG 3.29Å
202	H	86	Confident	85.5	Confident	22 Å²	22	42.7 Å²	42.7	10%	0.102	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-42.1	167.3	-63.1	173.4	0	0	0	111.3	F153 Y157 Q165 Y181 D199 S205 A206	F153-H202 WeakPolarHBondContact CE2-O 3.38Å; F153-H202 HydrophobicContact CZ-CB 4.18Å; Y157-H202 HydrophobicContact CD1-CB 4.35Å; Y157-H202 HydrophobicContact CE1-CB 3.68Å; Y157-H202 AromaticContact CE1-CD2 3.97Å; Y157-H202 AromaticContact CE1-CG 3.51Å; Y157-H202 AromaticContact CE1-ND1 3.69Å; Y157-H202 HydrophobicContact CE2-CB 4.07Å; Y157-H202 AromaticContact CZ-CD2 3.84Å; Y157-H202 AromaticContact CZ-CG 3.61Å; Y157-H202 PolarHBondContact OH-CD2 3.25Å; Q165-H202 PolarHBondContact NE2-CE1 3.09Å; Q165-H202 PolarHBondContact NE2-NE2 3.42Å; Q165-H202 VanDerWaalsContact NE2-NE2 3.18Å; Y181-H202 AromaticContact CZ-ND1 3.82Å; Y181-H202 VanDerWaalsContact OH-CB 3.28Å; Y181-H202 WeakPolarHBondContact OH-CB 3.17Å; Y181-H202 PolarHBondContact OH-ND1 2.83Å; D199-H202 HydrophobicContact CB-CB 4.45Å; D199-H202 WeakPolarHBondContact O-CB 3.46Å; D199-H202 PolarHBondContact O-N 3.27Å; H202-S205 WeakPolarHBondContact CA-OG 3.44Å; H202-S205 PolarHBondContact O-OG 3.1Å; H202-A206 WeakPolarHBondContact O-CB 3.5Å; H202-A206 PolarHBondContact O-N 3.31Å
203	L	86.3	Confident	86.1	Confident	4 Å²	4	41 Å²	41	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-42.6	176.5	-168.1	72.1	0	0	0	111.4	F150 F153 D199 C200 E201 A206 R207 L210 L214	F150-L203 HydrophobicContact CD2-CD1 4.34Å; F150-L203 HydrophobicContact CE2-CD1 4.5Å; F153-L203 HydrophobicContact CD1-CD1 3.82Å; F153-L203 HydrophobicContact CD2-CD1 4.41Å; F153-L203 HydrophobicContact CE1-CD1 3.75Å; F153-L203 HydrophobicContact CE2-CD1 4.34Å; F153-L203 HydrophobicContact CG-CD1 4.14Å; F153-L203 HydrophobicContact CZ-CB 4.31Å; F153-L203 HydrophobicContact CZ-CD1 4.01Å; D199-L203 PolarHBondContact O-N 3.07Å; C200-L203 WeakPolarHBondContact O-CB 3.48Å; C200-L203 PolarHBondContact O-N 3.04Å; E201-L203 VanDerWaalsContact C-N 3.34Å; L203-A206 PolarHBondContact O-N 3.1Å; L203-R207 CarbonylContact O-C 3.58Å; L203-R207 PolarHBondContact O-N 2.86Å; L203-L210 HydrophobicContact CD1-CD2 3.88Å; L203-L210 HydrophobicContact CD1-CG 4.16Å; L203-L210 HydrophobicContact CD2-CG 4.38Å; L203-L214 HydrophobicContact CD2-CB 4.41Å; L203-L214 HydrophobicContact CD2-CD2 3.53Å
204	R	86.5	Confident	86.6	Confident	108 Å²	108	39.3 Å²	39.3	41%	0.408	21%	0.212	S	C	.	.	H	α-helix	trans	-63.8	-45.2	179.1	-173.2	-172	179.8	-166	-1.7	112.7	C200 E201 Y211	C200-R204 WeakPolarHBondContact O-CB 3.5Å; C200-R204 PolarHBondContact O-N 3.28Å; E201-R204 PolarHBondContact O-N 3.04Å; E201-R204 WeakPolarHBondContact OE1-CD 3.43Å; E201-R204 IonicContact OE1-CZ 3.27Å; E201-R204 IonicContact OE1-NH1 2.81Å; E201-R204 PolarHBondContact OE1-NH1 2.99Å; E201-R204 WeakPolarHBondContact OE2-CD 3.46Å; E201-R204 IonicContact OE2-CZ 3.93Å; E201-R204 IonicContact OE2-NE 3.69Å; E201-R204 IonicContact OE2-NH1 3.81Å; E201-R204 PolarHBondContact OE2-NH1 3.2Å; R204-Y211 HydrophobicContact CB-CD1 4.17Å; R204-Y211 HydrophobicContact CB-CD2 4.13Å; R204-Y211 HydrophobicContact CB-CG 3.91Å; R204-Y211 HydrophobicContact CG-CD1 3.95Å; R204-Y211 HydrophobicContact CG-CE1 4.24Å; R204-Y211 HydrophobicContact CG-CG 4.2Å
205	S	85.2	Confident	87	Confident	77 Å²	77	38.7 Å²	38.7	54%	0.538	21%	0.209	S	C	.	.	H	α-helix	trans	-65.9	-37	178.1	51.5	0	0	0	0	112.5	E201 H202	E201-S205 WeakPolarHBondContact O-CB 3.43Å; E201-S205 PolarHBondContact O-N 2.92Å; E201-S205 PolarHBondContact O-OG 3.29Å; H202-S205 WeakPolarHBondContact CA-OG 3.44Å; H202-S205 PolarHBondContact O-OG 3.1Å
206	A	83.2	Confident	87.2	Confident	42 Å²	42	40.6 Å²	40.6	35%	0.347	22%	0.219	S	C	.	.	H	α-helix	trans	-80	-44.7	178	0	0	0	0	0	114	F153 Y157 H202 L203	F153-A206 HydrophobicContact CD2-CB 3.49Å; F153-A206 VanDerWaalsContact CD2-CB 3.49Å; F153-A206 HydrophobicContact CE2-CB 3.64Å; Y157-A206 HydrophobicContact CD2-CB 3.95Å; Y157-A206 HydrophobicContact CE2-CB 4.32Å; H202-A206 WeakPolarHBondContact O-CB 3.5Å; H202-A206 PolarHBondContact O-N 3.31Å; L203-A206 PolarHBondContact O-N 3.1Å
207	R	85.1	Confident	87.4	Confident	74 Å²	74	43.4 Å²	43.4	28%	0.279	23%	0.231	S	C	.	.			trans	-150.6	93.4	-175.5	-72.4	-163.2	164.9	134.7	8.4	112.4	R149 H152 L203 D209 L210 Y211	R149-R207 PolarHBondContact O-NH1 3.2Å; H152-R207 VanDerWaalsContact CD2-CZ 3.46Å; H152-R207 PolarHBondContact CD2-NH1 3.17Å; H152-R207 PolarHBondContact CD2-NH2 3.11Å; H152-R207 PolarHBondContact NE2-NH2 3Å; H152-R207 VanDerWaalsContact NE2-NH2 3.11Å; L203-R207 CarbonylContact O-C 3.58Å; L203-R207 PolarHBondContact O-N 2.86Å; R207-D209 VanDerWaalsContact C-N 3.3Å; R207-D209 PolarHBondContact O-N 3.33Å; R207-L210 HydrophobicContact CB-CB 4.27Å; R207-L210 PolarHBondContact O-N 3.33Å; R207-Y211 PolarHBondContact O-N 2.92Å
208	P	87	Confident	87.7	Confident	74 Å²	74	40.7 Å²	40.7	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-63.9	-30	-179.1	25.7	-34.9	0	0	0	113.8	L210 Y211 T212	P208-L210 PolarHBondContact O-N 3.47Å; P208-Y211 PolarHBondContact O-N 3.49Å; P208-T212 WeakPolarHBondContact O-CB 3.4Å; P208-T212 PolarHBondContact O-N 3.38Å; P208-T212 PolarHBondContact O-OG1 3.12Å
209	D	89.4	Confident	87.8	Confident	88 Å²	88	43 Å²	43	47%	0.471	23%	0.226	S	C	.	.	H	α-helix	trans	-54.8	-50.3	174.7	-60	6.8	0	0	0	111.7	R149 R207 T212 Q213	R149-D209 IonicContact CZ-OD2 3.82Å; R149-D209 IonicContact NH1-OD2 3.16Å; R149-D209 IonicContact NH2-OD2 3.39Å; R149-D209 PolarHBondContact NH2-OD2 3.26Å; R207-D209 VanDerWaalsContact C-N 3.3Å; R207-D209 PolarHBondContact O-N 3.33Å; D209-T212 PolarHBondContact O-N 3.02Å; D209-Q213 WeakPolarHBondContact O-CG 3.25Å; D209-Q213 PolarHBondContact O-N 2.79Å
210	L	89.3	Confident	88	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-73.2	-36	-174.4	179.8	57.1	0	0	0	110.9	V146 R149 F150 L203 R207 P208 Q213 L214 V221	V146-L210 HydrophobicContact CG1-CD1 3.97Å; V146-L210 HydrophobicContact CG2-CD1 4.38Å; R149-L210 HydrophobicContact CB-CD2 4.35Å; F150-L210 HydrophobicContact CB-CD2 3.98Å; F150-L210 HydrophobicContact CD2-CD2 4.09Å; L203-L210 HydrophobicContact CD1-CD2 3.88Å; L203-L210 HydrophobicContact CD1-CG 4.16Å; L203-L210 HydrophobicContact CD2-CG 4.38Å; R207-L210 HydrophobicContact CB-CB 4.27Å; R207-L210 PolarHBondContact O-N 3.33Å; P208-L210 PolarHBondContact O-N 3.47Å; L210-Q213 PolarHBondContact O-N 3.22Å; L210-L214 VanDerWaalsContact O-CB 3.29Å; L210-L214 WeakPolarHBondContact O-CB 3.47Å; L210-L214 PolarHBondContact O-N 2.97Å; L210-V221 HydrophobicContact CD1-CG1 4.34Å
211	Y	90.2	Very high	88.3	Confident	26 Å²	26	46.1 Å²	46.1	10%	0.102	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-44	169.3	170.3	-101.2	0	0	0	111.8	C200 R204 R207 P208 L214 V215 A254	C200-Y211 HydrophobicContact CB-CD2 4.07Å; C200-Y211 HydrophobicContact CB-CE2 3.83Å; R204-Y211 HydrophobicContact CB-CD1 4.17Å; R204-Y211 HydrophobicContact CB-CD2 4.13Å; R204-Y211 HydrophobicContact CB-CG 3.91Å; R204-Y211 HydrophobicContact CG-CD1 3.95Å; R204-Y211 HydrophobicContact CG-CE1 4.24Å; R204-Y211 HydrophobicContact CG-CG 4.2Å; R207-Y211 PolarHBondContact O-N 2.92Å; P208-Y211 PolarHBondContact O-N 3.49Å; Y211-L214 PolarHBondContact O-N 2.84Å; Y211-V215 HydrophobicContact CD2-CG2 4.26Å; Y211-V215 HydrophobicContact CE1-CG2 4.32Å; Y211-V215 HydrophobicContact CE2-CG2 3.8Å; Y211-V215 WeakPolarHBondContact O-CG2 3.2Å; Y211-V215 PolarHBondContact O-N 3.2Å; Y211-A254 PolarHBondContact OH-N 2.83Å
212	T	90.1	Very high	88.7	Confident	79 Å²	79	43 Å²	43	49%	0.485	23%	0.226	S	C	.	.	H	α-helix	trans	-62.5	-47.8	178.5	-53.5	0	0	0	0	110.9	P208 D209 L214 V215 T216	P208-T212 WeakPolarHBondContact O-CB 3.4Å; P208-T212 PolarHBondContact O-N 3.38Å; P208-T212 PolarHBondContact O-OG1 3.12Å; D209-T212 PolarHBondContact O-N 3.02Å; T212-L214 VanDerWaalsContact C-N 3.34Å; T212-L214 PolarHBondContact O-N 3.47Å; T212-V215 PolarHBondContact O-N 2.93Å; T212-T216 PolarHBondContact O-N 3.25Å; T212-T216 PolarHBondContact O-OG1 3.01Å
213	Q	90	Very high	88.9	Confident	22 Å²	22	43.9 Å²	43.9	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-61.8	-38.3	176.4	-70.9	179.5	-33	0	0	112.7	V141 D209 L210 T216 F217 V221	V141-Q213 HydrophobicContact CG2-CG 4.37Å; D209-Q213 WeakPolarHBondContact O-CG 3.25Å; D209-Q213 PolarHBondContact O-N 2.79Å; L210-Q213 PolarHBondContact O-N 3.22Å; Q213-T216 PolarHBondContact O-OG1 2.87Å; Q213-F217 PolarHBondContact O-N 3.28Å; Q213-V221 HydrophobicContact CB-CG2 4.32Å
214	L	90.7	Very high	89.1	Confident	13 Å²	13	44 Å²	44	7%	0.068	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-38.6	176.6	-179.4	66.3	0	0	0	112.3	L203 L210 Y211 T212 P218 V221 I222 P250 L270	L203-L214 HydrophobicContact CD2-CB 4.41Å; L203-L214 HydrophobicContact CD2-CD2 3.53Å; L210-L214 VanDerWaalsContact O-CB 3.29Å; L210-L214 WeakPolarHBondContact O-CB 3.47Å; L210-L214 PolarHBondContact O-N 2.97Å; Y211-L214 PolarHBondContact O-N 2.84Å; T212-L214 VanDerWaalsContact C-N 3.34Å; T212-L214 PolarHBondContact O-N 3.47Å; L214-P218 WeakPolarHBondContact O-CA 3.31Å; L214-P218 WeakPolarHBondContact O-CB 3.23Å; L214-P218 WeakPolarHBondContact O-CD 3.23Å; L214-V221 HydrophobicContact CB-CG1 4.08Å; L214-V221 HydrophobicContact CD1-CB 4.16Å; L214-V221 HydrophobicContact CD1-CG1 3.7Å; L214-I222 HydrophobicContact CD1-CG1 3.77Å; L214-P250 HydrophobicContact CD2-CB 4.23Å; L214-L270 HydrophobicContact CG-CD2 4.41Å
215	V	90.4	Very high	89.3	Confident	10 Å²	10	39.1 Å²	39.1	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-73.2	-39.4	179.3	172.3	0	0	0	0	111.8	Y211 T212 Q269 L270	Y211-V215 HydrophobicContact CD2-CG2 4.26Å; Y211-V215 HydrophobicContact CE1-CG2 4.32Å; Y211-V215 HydrophobicContact CE2-CG2 3.8Å; Y211-V215 WeakPolarHBondContact O-CG2 3.2Å; Y211-V215 PolarHBondContact O-N 3.2Å; T212-V215 PolarHBondContact O-N 2.93Å; V215-Q269 WeakPolarHBondContact O-CA 3.36Å; V215-Q269 WeakPolarHBondContact O-CB 3.44Å; V215-L270 PolarHBondContact O-N 3.41Å; V215-L270 VanDerWaalsContact O-N 3.09Å
216	T	89.7	Confident	89.6	Confident	51 Å²	51	35.8 Å²	35.8	31%	0.313	19%	0.194	S	C	.	.	H	α-helix	trans	-81.9	-34.7	-178.6	58.5	0	0	0	0	113.8	T212 Q213 P218	T212-T216 PolarHBondContact O-N 3.25Å; T212-T216 PolarHBondContact O-OG1 3.01Å; Q213-T216 PolarHBondContact O-OG1 2.87Å; T216-P218 VanDerWaalsContact C-CD 3.41Å
217	F	91.6	Very high	89.8	Confident	63 Å²	63	35.8 Å²	35.8	28%	0.276	19%	0.194	S	C	.	.			trans	-129.1	52.9	-175.5	-55.5	-61.1	0	0	0	112.9	T139 D140 V141 Q213 K219 E220 V221	T139-F217 HydrophobicContact CG2-CD1 3.73Å; T139-F217 HydrophobicContact CG2-CD2 4.4Å; T139-F217 HydrophobicContact CG2-CE1 3.96Å; T139-F217 HydrophobicContact CG2-CG 3.98Å; T139-F217 HydrophobicContact CG2-CZ 4.38Å; D140-F217 WeakPolarHBondContact OD1-CE2 3.25Å; V141-F217 HydrophobicContact CG2-CB 4.45Å; V141-F217 HydrophobicContact CG2-CD2 3.7Å; V141-F217 HydrophobicContact CG2-CE2 4.38Å; V141-F217 HydrophobicContact CG2-CG 4.38Å; Q213-F217 PolarHBondContact O-N 3.28Å; F217-K219 PolarHBondContact O-N 3.39Å; F217-K219 VanDerWaalsContact O-N 3.15Å; F217-E220 PolarHBondContact O-N 3.45Å; F217-V221 HydrophobicContact CB-CG2 4.37Å; F217-V221 WeakPolarHBondContact O-CG2 3.15Å; F217-V221 PolarHBondContact O-N 3.11Å; F217-V221 VanDerWaalsContact O-N 3.08Å
218	P	91.3	Very high	90.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.2	-34	-175.5	23.8	-34.5	0	0	0	112.9	L214 T216 E220 I222 D268 L270 I381	L214-P218 WeakPolarHBondContact O-CA 3.31Å; L214-P218 WeakPolarHBondContact O-CB 3.23Å; L214-P218 WeakPolarHBondContact O-CD 3.23Å; T216-P218 VanDerWaalsContact C-CD 3.41Å; P218-E220 VanDerWaalsContact C-N 3.31Å; P218-E220 PolarHBondContact O-N 2.86Å; P218-I222 HydrophobicContact CB-CD1 3.9Å; P218-I222 VanDerWaalsContact O-CB 3.28Å; P218-I222 WeakPolarHBondContact O-CB 3.43Å; P218-I222 WeakPolarHBondContact O-CD1 3.28Å; P218-I222 WeakPolarHBondContact O-CG1 3.42Å; P218-I222 PolarHBondContact O-N 2.92Å; P218-D268 VanDerWaalsContact CD-O 3.3Å; P218-D268 WeakPolarHBondContact CD-O 3.22Å; P218-D268 VanDerWaalsContact CG-O 3.23Å; P218-D268 WeakPolarHBondContact CG-O 3.33Å; P218-L270 HydrophobicContact CB-CB 4.39Å; P218-L270 HydrophobicContact CG-CB 4.38Å; P218-I381 HydrophobicContact CB-CD1 3.94Å; P218-I381 HydrophobicContact CB-CG1 4.09Å; P218-I381 HydrophobicContact CG-CD1 4Å; P218-I381 HydrophobicContact CG-CG1 3.95Å; P218-I381 HydrophobicContact CG-CG2 4.22Å
219	K	88.8	Confident	90.1	Very high	53 Å²	53	28.8 Å²	28.8	23%	0.23	16%	0.158	C	C	.	.	H	α-helix	trans	-60	-35.7	-178.9	-64	-179.9	-176.1	175.9	0	114.1	F217 P223 D268 I381	F217-K219 PolarHBondContact O-N 3.39Å; F217-K219 VanDerWaalsContact O-N 3.15Å; K219-P223 WeakPolarHBondContact O-CD 3.49Å; K219-P223 WeakPolarHBondContact O-CG 3.33Å; K219-D268 VanDerWaalsContact CE-CG 3.46Å; K219-D268 VanDerWaalsContact CE-OD1 3.23Å; K219-D268 WeakPolarHBondContact CE-OD1 3.23Å; K219-D268 IonicContact NZ-OD1 3.36Å; K219-D268 PolarHBondContact NZ-OD1 3.31Å; K219-D268 IonicContact NZ-OD2 2.73Å; K219-D268 PolarHBondContact NZ-OD2 2.61Å; K219-I381 HydrophobicContact CG-CD1 4.18Å
220	E	89.2	Confident	90.1	Very high	88 Å²	88	27.4 Å²	27.4	41%	0.411	15%	0.148	S	C	.	.	H	α-helix	trans	-96.2	-35.5	-178	-56.7	-60.5	151.6	0	0	111.3	I136 T139 F217 P218	I136-E220 HydrophobicContact CD1-CB 3.85Å; I136-E220 HydrophobicContact CD1-CG 4.03Å; T139-E220 HydrophobicContact CG2-CG 4.43Å; F217-E220 PolarHBondContact O-N 3.45Å; P218-E220 VanDerWaalsContact C-N 3.31Å; P218-E220 PolarHBondContact O-N 2.86Å
221	V	91.5	Very high	90	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-75.6	-37.8	-176.9	177.6	0	0	0	0	112	V141 V146 L210 Q213 L214 F217 A224 C225	V141-V221 HydrophobicContact CG1-CG2 4.28Å; V146-V221 HydrophobicContact CG1-CG1 4.11Å; L210-V221 HydrophobicContact CD1-CG1 4.34Å; Q213-V221 HydrophobicContact CB-CG2 4.32Å; L214-V221 HydrophobicContact CB-CG1 4.08Å; L214-V221 HydrophobicContact CD1-CB 4.16Å; L214-V221 HydrophobicContact CD1-CG1 3.7Å; F217-V221 HydrophobicContact CB-CG2 4.37Å; F217-V221 WeakPolarHBondContact O-CG2 3.15Å; F217-V221 PolarHBondContact O-N 3.11Å; F217-V221 VanDerWaalsContact O-N 3.08Å; V221-A224 PolarHBondContact O-N 2.82Å; V221-C225 WeakPolarHBondContact O-CB 3.26Å; V221-C225 PolarHBondContact O-N 3.27Å; V221-C225 PolarHBondContact O-SG 3.41Å
222	I	91.2	Very high	89.7	Confident	7 Å²	7	28.1 Å²	28.1	4%	0.036	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-52.7	-179.4	-67.5	166.8	0	0	0	111.4	L214 P218 A224 C225 D226 P250 L407	L214-I222 HydrophobicContact CD1-CG1 3.77Å; P218-I222 HydrophobicContact CB-CD1 3.9Å; P218-I222 VanDerWaalsContact O-CB 3.28Å; P218-I222 WeakPolarHBondContact O-CB 3.43Å; P218-I222 WeakPolarHBondContact O-CD1 3.28Å; P218-I222 WeakPolarHBondContact O-CG1 3.42Å; P218-I222 PolarHBondContact O-N 2.92Å; I222-A224 VanDerWaalsContact C-N 3.27Å; I222-A224 PolarHBondContact O-N 2.91Å; I222-C225 WeakPolarHBondContact O-CB 3.32Å; I222-C225 PolarHBondContact O-N 3.23Å; I222-D226 VanDerWaalsContact O-CG 3.22Å; I222-D226 PolarHBondContact O-N 2.83Å; I222-P250 HydrophobicContact CD1-CG 4.21Å; I222-L407 HydrophobicContact CD1-CD1 3.46Å; I222-L407 VanDerWaalsContact CD1-CD1 3.46Å; I222-L407 HydrophobicContact CD1-CD2 4.19Å; I222-L407 HydrophobicContact CD1-CG 4.48Å
223	P	90.4	Very high	89.5	Confident	40 Å²	40	24.4 Å²	24.4	26%	0.26	14%	0.135	S	C	.	.	H	α-helix	trans	-59.9	-33.4	176.5	-25.5	35.7	0	0	0	114	L75 K219 D226 A227	L75-P223 HydrophobicContact CD2-CG 3.71Å; K219-P223 WeakPolarHBondContact O-CD 3.49Å; K219-P223 WeakPolarHBondContact O-CG 3.33Å; P223-D226 PolarHBondContact O-N 3.27Å; P223-A227 WeakPolarHBondContact O-CB 3.18Å; P223-A227 PolarHBondContact O-N 2.84Å
224	A	90.8	Very high	89.2	Confident	7 Å²	7	27.5 Å²	27.5	6%	0.058	15%	0.152	C	C	.	.	H	α-helix	trans	-67	-41.8	175	0	0	0	0	0	111.8	I143 V146 M147 V221 I222 A228	I143-A224 HydrophobicContact CG2-CB 4.03Å; V146-A224 HydrophobicContact CG1-CB 3.97Å; M147-A224 HydrophobicContact CG-CB 4.34Å; M147-A224 WeakPolarHBondContact CG-O 3.47Å; V221-A224 PolarHBondContact O-N 2.82Å; I222-A224 VanDerWaalsContact C-N 3.27Å; I222-A224 PolarHBondContact O-N 2.91Å; A224-A228 WeakPolarHBondContact O-CB 3.39Å; A224-A228 PolarHBondContact O-N 2.79Å; A224-A228 VanDerWaalsContact O-N 3.13Å
225	C	90.1	Very high	88.9	Confident	6 Å²	6	31.4 Å²	31.4	4%	0.041	17%	0.173	C	C	.	.	H	α-helix	trans	-66.2	-41.7	173.6	-68.1	0	0	0	0	111.3	F150 V221 I222 A227 A228 T229 I248	F150-C225 HydrophobicContact CD1-CB 3.77Å; F150-C225 HydrophobicContact CD2-CB 4.39Å; F150-C225 HydrophobicContact CE1-CB 3.69Å; F150-C225 WeakPolarHBondContact CE1-O 3.22Å; F150-C225 HydrophobicContact CE2-CB 4.34Å; F150-C225 HydrophobicContact CG-CB 4.12Å; F150-C225 HydrophobicContact CZ-CB 4.01Å; V221-C225 WeakPolarHBondContact O-CB 3.26Å; V221-C225 PolarHBondContact O-N 3.27Å; V221-C225 PolarHBondContact O-SG 3.41Å; I222-C225 WeakPolarHBondContact O-CB 3.32Å; I222-C225 PolarHBondContact O-N 3.23Å; C225-A227 PolarHBondContact O-N 2.67Å; C225-A228 CarbonylContact O-C 3.6Å; C225-A228 WeakPolarHBondContact O-CA 3.18Å; C225-A228 WeakPolarHBondContact O-CB 3.28Å; C225-A228 PolarHBondContact O-N 3.09Å; C225-A228 VanDerWaalsContact O-N 3.08Å; C225-T229 PolarHBondContact O-N 3.21Å; C225-T229 PolarHBondContact O-OG1 2.75Å; C225-I248 HydrophobicContact CB-CD1 3.39Å; C225-I248 WeakPolarHBondContact O-CD1 3.45Å
226	D	90.7	Very high	88.4	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-48.4	178.1	-67.8	-22.7	0	0	0	111.3	Y77 I222 P223 A228 T229 H230 I248	Y77-D226 HydrophobicContact CE1-CB 4.35Å; Y77-D226 WeakPolarHBondContact OH-CB 3.33Å; Y77-D226 PolarHBondContact OH-OD2 3.2Å; I222-D226 VanDerWaalsContact O-CG 3.22Å; I222-D226 PolarHBondContact O-N 2.83Å; P223-D226 PolarHBondContact O-N 3.27Å; D226-A228 PolarHBondContact O-N 2.6Å; D226-T229 PolarHBondContact O-N 3.44Å; D226-H230 WeakPolarHBondContact O-CB 3.45Å; D226-H230 PolarHBondContact O-N 2.63Å; D226-I248 WeakPolarHBondContact OD1-CB 3.48Å; D226-I248 WeakPolarHBondContact OD1-CD1 3.22Å; D226-I248 WeakPolarHBondContact OD1-CG1 3.43Å; D226-I248 PolarHBondContact OD1-N 3.45Å
227	A	89	Confident	87.8	Confident	42 Å²	42	36.5 Å²	36.5	35%	0.347	19%	0.187	S	C	.	.	H	α-helix	trans	-60.2	-34.3	174.5	0	0	0	0	0	112.4	M147 P223 C225 A231	M147-A227 HydrophobicContact CE-CB 3.88Å; P223-A227 WeakPolarHBondContact O-CB 3.18Å; P223-A227 PolarHBondContact O-N 2.84Å; C225-A227 PolarHBondContact O-N 2.67Å; A227-A231 VanDerWaalsContact O-CB 3.32Å; A227-A231 WeakPolarHBondContact O-CB 3.42Å; A227-A231 PolarHBondContact O-N 2.98Å
228	A	89.9	Confident	86.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-70.9	-40.7	175.5	0	0	0	0	0	113	M147 F150 K151 A224 C225 D226 L232	M147-A228 HydrophobicContact CB-CB 4.16Å; M147-A228 HydrophobicContact CE-CB 4.4Å; M147-A228 HydrophobicContact CG-CB 4.26Å; F150-A228 HydrophobicContact CD1-CB 3.88Å; K151-A228 WeakPolarHBondContact CE-O 3.37Å; K151-A228 HydrophobicContact CG-CB 3.82Å; A224-A228 WeakPolarHBondContact O-CB 3.39Å; A224-A228 PolarHBondContact O-N 2.79Å; A224-A228 VanDerWaalsContact O-N 3.13Å; C225-A228 CarbonylContact O-C 3.6Å; C225-A228 WeakPolarHBondContact O-CA 3.18Å; C225-A228 WeakPolarHBondContact O-CB 3.28Å; C225-A228 PolarHBondContact O-N 3.09Å; C225-A228 VanDerWaalsContact O-N 3.08Å; D226-A228 PolarHBondContact O-N 2.6Å; A228-L232 PolarHBondContact O-N 3.22Å; A228-L232 VanDerWaalsContact O-N 3.14Å
229	T	88.6	Confident	85.9	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-49.8	172.1	-65.5	0	0	0	0	111	F150 M185 L196 C225 D226 A231 L232 F233 I246 I248	F150-T229 WeakPolarHBondContact CE1-OG1 3.28Å; M185-T229 HydrophobicContact SD-CG2 4.37Å; L196-T229 HydrophobicContact CD2-CG2 3.87Å; C225-T229 PolarHBondContact O-N 3.21Å; C225-T229 PolarHBondContact O-OG1 2.75Å; D226-T229 PolarHBondContact O-N 3.44Å; T229-A231 VanDerWaalsContact C-N 3.31Å; T229-A231 PolarHBondContact O-N 3.08Å; T229-L232 PolarHBondContact O-N 2.87Å; T229-L232 VanDerWaalsContact O-N 3.09Å; T229-F233 PolarHBondContact O-N 2.93Å; T229-I246 HydrophobicContact CG2-CB 4.27Å; T229-I246 HydrophobicContact CG2-CD1 4.29Å; T229-I246 HydrophobicContact CG2-CG2 3.82Å; T229-I248 WeakPolarHBondContact OG1-CD1 3.43Å
230	H	88	Confident	85	Confident	60 Å²	60	52.9 Å²	52.9	28%	0.278	26%	0.259	S	S	.	.	H	α-helix	trans	-57.9	-43.5	-179.7	-177.2	-163.2	0	0	0	111.4	D226 F233 L234	D226-H230 WeakPolarHBondContact O-CB 3.45Å; D226-H230 PolarHBondContact O-N 2.63Å; H230-F233 PolarHBondContact O-N 2.89Å; H230-L234 WeakPolarHBondContact O-CG 3.45Å; H230-L234 PolarHBondContact O-N 2.97Å
231	A	87.5	Confident	83.8	Confident	30 Å²	30	57.7 Å²	57.7	25%	0.248	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-42.3	175.1	0	0	0	0	0	112.8	K151 A227 T229 F233 L234 D235	K151-A231 VanDerWaalsContact NZ-CB 3.3Å; A227-A231 VanDerWaalsContact O-CB 3.32Å; A227-A231 WeakPolarHBondContact O-CB 3.42Å; A227-A231 PolarHBondContact O-N 2.98Å; T229-A231 VanDerWaalsContact C-N 3.31Å; T229-A231 PolarHBondContact O-N 3.08Å; A231-F233 VanDerWaalsContact C-N 3.3Å; A231-F233 PolarHBondContact O-N 3.32Å; A231-L234 PolarHBondContact O-N 3.29Å; A231-D235 WeakPolarHBondContact O-CB 3.44Å; A231-D235 PolarHBondContact O-N 2.99Å
232	L	85.1	Confident	82.6	Confident	12 Å²	12	59.9 Å²	59.9	6%	0.063	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-32.6	175.2	-79.4	171.8	0	0	0	113.2	K151 L154 L155 A228 T229 R236	K151-L232 HydrophobicContact CB-CD1 3.86Å; K151-L232 HydrophobicContact CB-CG 4.33Å; K151-L232 HydrophobicContact CD-CD1 4.31Å; K151-L232 HydrophobicContact CD-CD2 4.11Å; K151-L232 HydrophobicContact CD-CG 3.89Å; K151-L232 HydrophobicContact CG-CD1 3.72Å; K151-L232 HydrophobicContact CG-CD2 4.38Å; K151-L232 HydrophobicContact CG-CG 3.84Å; L154-L232 HydrophobicContact CB-CD1 4.09Å; L154-L232 HydrophobicContact CD1-CD1 3.71Å; L155-L232 HydrophobicContact CD1-CD2 4.21Å; L155-L232 HydrophobicContact CG-CD2 4.48Å; A228-L232 PolarHBondContact O-N 3.22Å; A228-L232 VanDerWaalsContact O-N 3.14Å; T229-L232 PolarHBondContact O-N 2.87Å; T229-L232 VanDerWaalsContact O-N 3.09Å; L232-R236 PolarHBondContact O-N 3.15Å
233	F	85.5	Confident	81.4	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-67.8	-48.9	175.7	-171	-85.6	0	0	0	110.9	L188 A189 T229 H230 A231 D235 R236 F237 V240 L242 I246	L188-F233 HydrophobicContact CD2-CE2 4.21Å; A189-F233 HydrophobicContact CB-CE2 3.81Å; A189-F233 HydrophobicContact CB-CZ 3.77Å; T229-F233 PolarHBondContact O-N 2.93Å; H230-F233 PolarHBondContact O-N 2.89Å; A231-F233 VanDerWaalsContact C-N 3.3Å; A231-F233 PolarHBondContact O-N 3.32Å; F233-D235 VanDerWaalsContact C-N 3.31Å; F233-D235 PolarHBondContact O-N 3.18Å; F233-R236 PolarHBondContact O-N 2.83Å; F233-R236 VanDerWaalsContact O-N 3.16Å; F233-F237 HydrophobicContact CD1-CB 4.27Å; F233-F237 HydrophobicContact CD1-CD2 4.36Å; F233-F237 AromaticContact CD2-CD2 3.72Å; F233-F237 HydrophobicContact CD2-CD2 3.72Å; F233-F237 HydrophobicContact CD2-CE2 4.23Å; F233-F237 HydrophobicContact CE1-CB 3.88Å; F233-F237 HydrophobicContact CE1-CD2 4.29Å; F233-F237 HydrophobicContact CE1-CG 4.45Å; F233-F237 AromaticContact CE2-CD2 3.66Å; F233-F237 HydrophobicContact CE2-CD2 3.66Å; F233-F237 HydrophobicContact CE2-CE2 4.19Å; F233-F237 HydrophobicContact CE2-CG 4.35Å; F233-F237 HydrophobicContact CG-CD2 4.08Å; F233-F237 HydrophobicContact CZ-CB 4.08Å; F233-F237 AromaticContact CZ-CD2 3.96Å; F233-F237 HydrophobicContact CZ-CD2 3.96Å; F233-F237 HydrophobicContact CZ-CG 4.23Å; F233-F237 PolarHBondContact O-N 3.28Å; F233-V240 HydrophobicContact CE1-CB 4.13Å; F233-V240 HydrophobicContact CE1-CG1 4.17Å; F233-V240 HydrophobicContact CZ-CB 4.35Å; F233-V240 HydrophobicContact CZ-CG1 4.19Å; F233-L242 HydrophobicContact CD1-CD1 3.57Å; F233-L242 HydrophobicContact CD1-CG 4.31Å; F233-L242 HydrophobicContact CE1-CD1 3.5Å; F233-L242 HydrophobicContact CE1-CD2 4.19Å; F233-L242 HydrophobicContact CE1-CG 3.79Å; F233-L242 HydrophobicContact CG-CD1 4.3Å; F233-L242 HydrophobicContact CZ-CD1 4.17Å; F233-L242 HydrophobicContact CZ-CD2 4.32Å; F233-L242 HydrophobicContact CZ-CG 4.41Å; F233-I246 HydrophobicContact CB-CD1 3.63Å; F233-I246 HydrophobicContact CD1-CD1 4.16Å; F233-I246 HydrophobicContact CD2-CD1 3.48Å; F233-I246 VanDerWaalsContact CD2-CD1 3.48Å; F233-I246 HydrophobicContact CE2-CD1 4.13Å; F233-I246 HydrophobicContact CG-CD1 3.48Å; F233-I246 VanDerWaalsContact CG-CD1 3.48Å
234	L	83.9	Confident	80.3	Confident	87 Å²	87	74.2 Å²	74.2	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-37.2	176.1	-69.3	173.6	0	0	0	112.8	H230 A231 R236 R238	H230-L234 WeakPolarHBondContact O-CG 3.45Å; H230-L234 PolarHBondContact O-N 2.97Å; A231-L234 PolarHBondContact O-N 3.29Å; L234-R236 PolarHBondContact O-N 3.47Å; L234-R238 WeakPolarHBondContact O-CG 3.28Å
235	D	84	Confident	79.7	Confident	96 Å²	96	75.4 Å²	75.4	51%	0.513	36%	0.358	S	S	.	.	H	α-helix	trans	-60.1	-33.9	176.7	-75.7	-31.6	0	0	0	112	K151 A231 F233	K151-D235 IonicContact NZ-OD2 3.76Å; A231-D235 WeakPolarHBondContact O-CB 3.44Å; A231-D235 PolarHBondContact O-N 2.99Å; F233-D235 VanDerWaalsContact C-N 3.31Å; F233-D235 PolarHBondContact O-N 3.18Å
236	R	79.4	Confident	79.4	Confident	120 Å²	120	75.1 Å²	75.1	45%	0.453	36%	0.356	S	S	.	.	H	α-helix	trans	-97.7	-46.3	-176.2	-71	-179.2	173	-93.3	-2.2	114.1	L182 L232 F233 L234	L182-R236 VanDerWaalsContact CD1-CZ 3.45Å; L232-R236 PolarHBondContact O-N 3.15Å; F233-R236 PolarHBondContact O-N 2.83Å; F233-R236 VanDerWaalsContact O-N 3.16Å; L234-R236 PolarHBondContact O-N 3.47Å
237	F	77.9	Confident	79.2	Confident	47 Å²	47	76.9 Å²	76.9	21%	0.206	36%	0.364	C	S	.	.			trans	-108.4	60.5	-171.4	-57.8	-72.5	0	0	0	112	M185 E186 A189 F233 E239 V240	M185-F237 HydrophobicContact CB-CE2 4.44Å; E186-F237 HydrophobicContact CB-CZ 4.35Å; E186-F237 HydrophobicContact CG-CE1 4.3Å; E186-F237 HydrophobicContact CG-CZ 3.64Å; A189-F237 HydrophobicContact CB-CD1 4.22Å; A189-F237 HydrophobicContact CB-CD2 4.4Å; A189-F237 HydrophobicContact CB-CE1 4.3Å; A189-F237 HydrophobicContact CB-CE2 4.47Å; A189-F237 HydrophobicContact CB-CG 4.28Å; A189-F237 HydrophobicContact CB-CZ 4.43Å; F233-F237 HydrophobicContact CD1-CB 4.27Å; F233-F237 HydrophobicContact CD1-CD2 4.36Å; F233-F237 AromaticContact CD2-CD2 3.72Å; F233-F237 HydrophobicContact CD2-CD2 3.72Å; F233-F237 HydrophobicContact CD2-CE2 4.23Å; F233-F237 HydrophobicContact CE1-CB 3.88Å; F233-F237 HydrophobicContact CE1-CD2 4.29Å; F233-F237 HydrophobicContact CE1-CG 4.45Å; F233-F237 AromaticContact CE2-CD2 3.66Å; F233-F237 HydrophobicContact CE2-CD2 3.66Å; F233-F237 HydrophobicContact CE2-CE2 4.19Å; F233-F237 HydrophobicContact CE2-CG 4.35Å; F233-F237 HydrophobicContact CG-CD2 4.08Å; F233-F237 HydrophobicContact CZ-CB 4.08Å; F233-F237 AromaticContact CZ-CD2 3.96Å; F233-F237 HydrophobicContact CZ-CD2 3.96Å; F233-F237 HydrophobicContact CZ-CG 4.23Å; F233-F237 PolarHBondContact O-N 3.28Å; F237-E239 PolarHBondContact O-N 3.28Å; F237-V240 HydrophobicContact CB-CB 4.32Å; F237-V240 HydrophobicContact CB-CG2 4.19Å; F237-V240 PolarHBondContact O-N 3.44Å; F237-V240 VanDerWaalsContact O-N 3.09Å
238	R	73	Confident	79.3	Confident	216 Å²	216	75.5 Å²	75.5	82%	0.815	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-16.7	178.4	-63.5	-177.4	-180	-162.5	-3.7	114.4	L234	L234-R238 WeakPolarHBondContact O-CG 3.28Å
239	E	70.4	Confident	79.2	Confident	194 Å²	194	76.1 Å²	76.1	91%	0.907	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-19.3	-179.9	-58.8	-173.1	171.9	0	0	113.2	F237	F237-E239 PolarHBondContact O-N 3.28Å
240	V	69.8	Low	79.2	Confident	51 Å²	51	76.3 Å²	76.3	31%	0.309	35%	0.354	S	S	.	.			trans	-96.3	108.7	-175.5	-177.7	0	0	0	0	110.2	F233 F237 L242	F233-V240 HydrophobicContact CE1-CB 4.13Å; F233-V240 HydrophobicContact CE1-CG1 4.17Å; F233-V240 HydrophobicContact CZ-CB 4.35Å; F233-V240 HydrophobicContact CZ-CG1 4.19Å; F237-V240 HydrophobicContact CB-CB 4.32Å; F237-V240 HydrophobicContact CB-CG2 4.19Å; F237-V240 PolarHBondContact O-N 3.44Å; F237-V240 VanDerWaalsContact O-N 3.09Å; V240-L242 HydrophobicContact CG1-CD2 4.14Å; V240-L242 HydrophobicContact CG1-CG 4.44Å; V240-L242 PolarHBondContact O-N 3.49Å
241	Q	64	Low	79.1	Confident	189 Å²	189	75 Å²	75	88%	0.883	35%	0.348	S	S	*	.			trans	-81.3	101	172.4	-68.1	-177.1	-14.6	0	0	109.8
242	L	64.6	Low	78.7	Confident	46 Å²	46	77.5 Å²	77.5	24%	0.241	36%	0.357	C	S	.	.			trans	-77.7	125.1	171.7	-65.6	175.7	0	0	0	110.5	F233 V240 R244 I246	F233-L242 HydrophobicContact CD1-CD1 3.57Å; F233-L242 HydrophobicContact CD1-CG 4.31Å; F233-L242 HydrophobicContact CE1-CD1 3.5Å; F233-L242 HydrophobicContact CE1-CD2 4.19Å; F233-L242 HydrophobicContact CE1-CG 3.79Å; F233-L242 HydrophobicContact CG-CD1 4.3Å; F233-L242 HydrophobicContact CZ-CD1 4.17Å; F233-L242 HydrophobicContact CZ-CD2 4.32Å; F233-L242 HydrophobicContact CZ-CG 4.41Å; V240-L242 HydrophobicContact CG1-CD2 4.14Å; V240-L242 HydrophobicContact CG1-CG 4.44Å; V240-L242 PolarHBondContact O-N 3.49Å; L242-R244 VanDerWaalsContact C-N 3.29Å; L242-R244 WeakPolarHBondContact CB-O 3.22Å; L242-I246 HydrophobicContact CD1-CD1 3.87Å; L242-I246 HydrophobicContact CD1-CG1 3.72Å
243	E	66.2	Low	78.2	Confident	198 Å²	198	77.1 Å²	77.1	93%	0.925	36%	0.355	S	S	*	.	S	Bend	trans	-76.5	-16.6	173.3	-62.9	-169	162.4	0	0	113
244	R	68.9	Low	77.4	Confident	150 Å²	150	79.7 Å²	79.7	57%	0.566	38%	0.377	S	S	*	.	S	Bend	trans	-135.2	150.9	-178.5	-58.9	-179.5	-178.9	-166.1	-1.3	110.5	T194 L242	T194-R244 HydrophobicContact CG2-CB 4.13Å; L242-R244 VanDerWaalsContact C-N 3.29Å; L242-R244 WeakPolarHBondContact CB-O 3.22Å
245	S	77.5	Confident	76.5	Confident	33 Å²	33	81.8 Å²	81.8	23%	0.231	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-66.5	142.7	172.6	46.9	0	0	0	0	111.4	Q247	S245-Q247 PolarHBondContact O-N 3.25Å
246	I	84.1	Confident	75.9	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-68.4	125.7	172.7	-56.9	175	0	0	0	109	L188 T194 L196 T229 F233 L242	L188-I246 HydrophobicContact CD1-CG2 4.24Å; L188-I246 HydrophobicContact CD2-CD1 4.14Å; L188-I246 HydrophobicContact CD2-CG1 4.4Å; T194-I246 WeakPolarHBondContact O-CA 3.39Å; L196-I246 HydrophobicContact CB-CG2 4.22Å; T229-I246 HydrophobicContact CG2-CB 4.27Å; T229-I246 HydrophobicContact CG2-CD1 4.29Å; T229-I246 HydrophobicContact CG2-CG2 3.82Å; F233-I246 HydrophobicContact CB-CD1 3.63Å; F233-I246 HydrophobicContact CD1-CD1 4.16Å; F233-I246 HydrophobicContact CD2-CD1 3.48Å; F233-I246 VanDerWaalsContact CD2-CD1 3.48Å; F233-I246 HydrophobicContact CE2-CD1 4.13Å; F233-I246 HydrophobicContact CG-CD1 3.48Å; F233-I246 VanDerWaalsContact CG-CD1 3.48Å; L242-I246 HydrophobicContact CD1-CD1 3.87Å; L242-I246 HydrophobicContact CD1-CG1 3.72Å
247	Q	86.4	Confident	75.9	Confident	43 Å²	43	78.8 Å²	78.8	20%	0.201	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	138	175.2	-63.7	175.6	-1.1	0	0	110.5	T194 A195 L196 S245 E364	T194-Q247 PolarHBondContact O-N 3.22Å; A195-Q247 CarbonylContact C-O 3.31Å; A195-Q247 WeakPolarHBondContact CA-O 3.22Å; L196-Q247 PolarHBondContact N-O 3.32Å; S245-Q247 PolarHBondContact O-N 3.25Å; Q247-E364 PolarHBondContact NE2-OE2 3.49Å
248	I	89.8	Confident	76.1	Confident	14 Å²	14	79.8 Å²	79.8	7%	0.072	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.9	172	-65	163.5	0	0	0	110.2	F150 L196 I198 C225 D226 T229 P250	F150-I248 HydrophobicContact CE1-CD1 3.53Å; F150-I248 HydrophobicContact CZ-CD1 3.54Å; L196-I248 WeakPolarHBondContact O-CA 3.14Å; I198-I248 HydrophobicContact CB-CG2 4.25Å; I198-I248 HydrophobicContact CD1-CD1 4.43Å; I198-I248 HydrophobicContact CD1-CG1 4.25Å; I198-I248 HydrophobicContact CD1-CG2 3.62Å; I198-I248 HydrophobicContact CG1-CG2 3.93Å; C225-I248 HydrophobicContact CB-CD1 3.39Å; C225-I248 WeakPolarHBondContact O-CD1 3.45Å; D226-I248 WeakPolarHBondContact OD1-CB 3.48Å; D226-I248 WeakPolarHBondContact OD1-CD1 3.22Å; D226-I248 WeakPolarHBondContact OD1-CG1 3.43Å; D226-I248 PolarHBondContact OD1-N 3.45Å; T229-I248 WeakPolarHBondContact OG1-CD1 3.43Å; I248-P250 WeakPolarHBondContact O-CD 3.48Å
249	R	88.2	Confident	76.6	Confident	13 Å²	13	70.1 Å²	70.1	5%	0.049	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	93.8	175.6	-71.9	-168.9	178.3	128.6	18.8	109.9	L196 D197 I198 F251 E365 L407 H408	L196-R249 PolarHBondContact O-N 3.29Å; D197-R249 WeakPolarHBondContact OD1-CB 3.43Å; D197-R249 WeakPolarHBondContact OD1-CD 3.18Å; I198-R249 PolarHBondContact N-O 2.87Å; R249-F251 PolarHBondContact O-N 3.27Å; R249-E365 IonicContact CZ-OE2 3.35Å; R249-E365 IonicContact NH1-OE2 2.65Å; R249-E365 PolarHBondContact NH1-OE2 3.24Å; R249-E365 VanDerWaalsContact NH1-OE2 3.08Å; R249-E365 IonicContact NH2-OE2 3.42Å; R249-E365 PolarHBondContact NH2-OE2 2.86Å; R249-L407 WeakPolarHBondContact CD-O 3.12Å; R249-L407 WeakPolarHBondContact CG-O 3.45Å; R249-H408 HydrophobicContact CB-CB 4.16Å
250	P	89.5	Confident	77.3	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.019	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	121.1	175.6	29	-31.6	0	0	0	110.1	I198 L214 I222 I248 L270 T379 L407	I198-P250 WeakPolarHBondContact O-CA 3.41Å; L214-P250 HydrophobicContact CD2-CB 4.23Å; I222-P250 HydrophobicContact CD1-CG 4.21Å; I248-P250 WeakPolarHBondContact O-CD 3.48Å; P250-L270 HydrophobicContact CB-CD2 4.29Å; P250-L270 HydrophobicContact CG-CD2 4.24Å; P250-T379 PolarHBondContact O-OG1 2.95Å; P250-L407 HydrophobicContact CG-CD1 4.04Å
251	F	85.5	Confident	78	Confident	34 Å²	34	64 Å²	64	15%	0.149	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	165.8	176.6	71.1	-92.5	0	0	0	112	D197 I198 D199 C200 R249 T379 H408	D197-F251 HydrophobicContact CB-CD1 4Å; D197-F251 HydrophobicContact CB-CE1 3.84Å; I198-F251 VanDerWaalsContact C-CD1 3.46Å; I198-F251 VanDerWaalsContact O-CD1 3.31Å; I198-F251 WeakPolarHBondContact O-CD1 3.45Å; I198-F251 PolarHBondContact O-N 3Å; D199-F251 HydrophobicContact CB-CD2 4.44Å; D199-F251 HydrophobicContact CB-CE1 4.19Å; D199-F251 HydrophobicContact CB-CE2 3.72Å; D199-F251 HydrophobicContact CB-CZ 3.58Å; D199-F251 VanDerWaalsContact N-CE1 3.33Å; D199-F251 WeakPolarHBondContact OD2-CE2 3.38Å; C200-F251 WeakPolarHBondContact CB-O 3.32Å; C200-F251 PolarHBondContact N-O 3.24Å; C200-F251 PolarHBondContact SG-O 3.23Å; C200-F251 VanDerWaalsContact SG-O 3.36Å; R249-F251 PolarHBondContact O-N 3.27Å; F251-T379 HydrophobicContact CB-CG2 4.2Å; F251-H408 HydrophobicContact CB-CB 4.41Å
252	N	78.3	Confident	79.1	Confident	82 Å²	82	56 Å²	56	44%	0.439	28%	0.28	S	S	.	.			trans	55.7	62	175.6	-172.3	34.7	0	0	0	115.4	D199	D199-N252 PolarHBondContact OD1-ND2 3.3Å; D199-N252 PolarHBondContact OD2-ND2 2.78Å
253	C	76	Confident	80.2	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.027	29%	0.287	C	S	.	.			trans	-79.8	136.8	166.9	-52.6	0	0	0	0	110.2	C200 R255 L270 T272	C200-C253 VanDerWaalsContact SG-SG 3.61Å; C253-R255 PolarHBondContact O-N 3.43Å; C253-L270 WeakPolarHBondContact SG-CD2 3.44Å; C253-T272 HydrophobicContact CB-CG2 3.86Å; C253-T272 PolarHBondContact O-OG1 3.15Å; C253-T272 VanDerWaalsContact O-OG1 3.1Å
254	A	67.4	Low	81.3	Confident	54 Å²	54	52.4 Å²	52.4	45%	0.446	27%	0.272	S	S	.	.	S	Bend	trans	-63.4	-6.5	-177.4	0	0	0	0	0	115.4	Y211	Y211-A254 PolarHBondContact OH-N 2.83Å
255	R	65.4	Low	82.3	Confident	130 Å²	130	51.4 Å²	51.4	49%	0.491	28%	0.279	S	S	.	.			trans	-98.1	66.5	172.7	-69.7	-174.6	176.3	177.9	-0.8	111	C253 R257 T272	C253-R255 PolarHBondContact O-N 3.43Å; R255-R257 PolarHBondContact O-N 2.99Å; R255-T272 PolarHBondContact O-OG1 3.17Å
256	S	72.1	Confident	82.8	Confident	99 Å²	99	50 Å²	50	69%	0.692	27%	0.269	S	S	*	.	B	Isolated β-bridge	trans	-66.4	121	164.5	55.5	0	0	0	0	109.7	T272	S256-T272 WeakPolarHBondContact CA-O 3.3Å; S256-T272 VanDerWaalsContact CA-OG1 3.23Å; S256-T272 WeakPolarHBondContact CA-OG1 3.23Å; S256-T272 PolarHBondContact N-OG1 3.24Å
257	R	79.5	Confident	83.2	Confident	54 Å²	54	53.5 Å²	53.5	20%	0.204	29%	0.287	C	S	.	.			trans	-117.4	139.9	178.8	-69.9	-175.6	176.4	-109.8	12.8	110.8	R255 S261 L262 D263 D266 V271 T272	R255-R257 PolarHBondContact O-N 2.99Å; R257-S261 PolarHBondContact NH1-O 3.32Å; R257-L262 HydrophobicContact CB-CD2 4.34Å; R257-D263 IonicContact CZ-OD2 2.69Å; R257-D263 IonicContact NH1-OD2 2.99Å; R257-D263 PolarHBondContact NH1-OD2 3.08Å; R257-D266 WeakPolarHBondContact CD-OD2 3.43Å; R257-D266 IonicContact CZ-OD1 3.74Å; R257-D266 IonicContact CZ-OD2 3.67Å; R257-D266 IonicContact NE-OD1 3.96Å; R257-D266 PolarHBondContact NE-OD1 2.99Å; R257-D266 VanDerWaalsContact NE-OD1 3.13Å; R257-D266 IonicContact NE-OD2 3.4Å; R257-D266 PolarHBondContact NE-OD2 2.73Å; R257-D266 IonicContact NH1-OD2 2.78Å; R257-D266 PolarHBondContact NH1-OD2 2.99Å; R257-D266 VanDerWaalsContact NH1-OD2 3.12Å; R257-D266 VanDerWaalsContact NH2-CG 3.28Å; R257-D266 IonicContact NH2-OD1 2.63Å; R257-D266 PolarHBondContact NH2-OD1 3.08Å; R257-D266 IonicContact NH2-OD2 3.69Å; R257-D266 PolarHBondContact NH2-OD2 2.94Å; R257-D266 VanDerWaalsContact NH2-OD2 3.16Å; R257-V271 HydrophobicContact CB-CG1 4.11Å; R257-V271 HydrophobicContact CG-CG1 4.34Å; R257-T272 PolarHBondContact N-O 2.93Å
258	D	82.3	Confident	83.3	Confident	69 Å²	69	54.7 Å²	54.7	37%	0.369	29%	0.294	S	S	.	.			trans	-70.9	151	166.8	-66.3	-50.7	0	0	0	110.3	R260 S261 N348	D258-R260 PolarHBondContact O-N 3.39Å; D258-R260 VanDerWaalsContact O-N 3.09Å; D258-S261 PolarHBondContact N-OG 2.8Å; D258-S261 VanDerWaalsContact N-OG 3.09Å; D258-S261 WeakPolarHBondContact O-CA 3.08Å; D258-S261 PolarHBondContact O-N 3.37Å; D258-S261 PolarHBondContact O-OG 2.81Å; D258-N348 PolarHBondContact OD1-ND2 3.09Å
259	L	83.5	Confident	83.4	Confident	13 Å²	13	55.7 Å²	55.7	7%	0.068	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-61.4	-24	-177.3	-69.3	70.6	0	0	0	112.5	V273 S274 E344 V358	L259-V273 HydrophobicContact CD1-CG1 3.25Å; L259-V273 HydrophobicContact CG-CG1 3.73Å; L259-S274 WeakPolarHBondContact CD1-O 3.41Å; L259-E344 HydrophobicContact CB-CG 3.67Å; L259-E344 HydrophobicContact CD1-CG 3.82Å; L259-E344 HydrophobicContact CD2-CG 3.96Å; L259-E344 HydrophobicContact CG-CG 4.01Å; L259-V358 HydrophobicContact CB-CG2 4.19Å; L259-V358 HydrophobicContact CD2-CB 3.86Å; L259-V358 HydrophobicContact CD2-CG2 3.67Å; L259-V358 HydrophobicContact CG-CB 4.5Å; L259-V358 HydrophobicContact CG-CG2 3.98Å
260	R	84.7	Confident	83.5	Confident	71 Å²	71	55.2 Å²	55.2	27%	0.268	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-73.1	-23.5	170.6	-82.5	164.4	-145.4	-75.6	-16.3	115.1	D258 E344 T354 H356	D258-R260 PolarHBondContact O-N 3.39Å; D258-R260 VanDerWaalsContact O-N 3.09Å; R260-E344 VanDerWaalsContact CG-OE1 3.26Å; R260-E344 WeakPolarHBondContact CG-OE1 3.48Å; R260-E344 IonicContact CZ-OE1 3.38Å; R260-E344 IonicContact CZ-OE2 3.65Å; R260-E344 VanDerWaalsContact CZ-OE2 3.22Å; R260-E344 PolarHBondContact N-OE1 3.21Å; R260-E344 IonicContact NE-OE1 2.78Å; R260-E344 PolarHBondContact NE-OE1 2.81Å; R260-E344 VanDerWaalsContact NE-OE1 3.16Å; R260-E344 IonicContact NE-OE2 3.42Å; R260-E344 PolarHBondContact NE-OE2 3.3Å; R260-E344 IonicContact NH2-OE2 3.11Å; R260-E344 PolarHBondContact NH2-OE2 2.88Å; R260-T354 PolarHBondContact NH2-O 3.41Å; R260-H356 PolarHBondContact NH1-CD2 2.92Å; R260-H356 PolarHBondContact NH1-CE1 3.17Å; R260-H356 PolarHBondContact NH1-NE2 2.91Å; R260-H356 PolarHBondContact NH2-CD2 3.06Å
261	S	85.2	Confident	83.6	Confident	45 Å²	45	55.2 Å²	55.2	32%	0.315	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-104	22	-175.3	62.1	0	0	0	0	113.5	R257 D258 D263	R257-S261 PolarHBondContact NH1-O 3.32Å; D258-S261 PolarHBondContact N-OG 2.8Å; D258-S261 VanDerWaalsContact N-OG 3.09Å; D258-S261 WeakPolarHBondContact O-CA 3.08Å; D258-S261 PolarHBondContact O-N 3.37Å; D258-S261 PolarHBondContact O-OG 2.81Å; S261-D263 PolarHBondContact O-N 3.23Å
262	L	85.6	Confident	83.9	Confident	22 Å²	22	54 Å²	54	12%	0.115	29%	0.292	C	S	.	.			trans	-79.7	100.1	171.5	-67.6	174.1	0	0	0	109.2	R257 V271 V273 V358 Y382	R257-L262 HydrophobicContact CB-CD2 4.34Å; L262-V271 HydrophobicContact CD2-CG1 3.89Å; L262-V273 HydrophobicContact CD2-CG2 4.36Å; L262-V358 HydrophobicContact CD1-CG2 4.21Å; L262-Y382 HydrophobicContact CB-CE1 4.31Å; L262-Y382 HydrophobicContact CD1-CE2 4.19Å
263	D	88.8	Confident	84.4	Confident	73 Å²	73	50.1 Å²	50.1	39%	0.39	27%	0.272	S	S	.	.			trans	-82.2	157.1	-177.6	-67.8	-52	0	0	0	111	R257 S261 D265 D266	R257-D263 IonicContact CZ-OD2 2.69Å; R257-D263 IonicContact NH1-OD2 2.99Å; R257-D263 PolarHBondContact NH1-OD2 3.08Å; S261-D263 PolarHBondContact O-N 3.23Å; D263-D265 HydrophobicContact CB-CB 4.45Å; D263-D265 PolarHBondContact O-N 3.03Å; D263-D266 PolarHBondContact N-OD2 3.14Å; D263-D266 VanDerWaalsContact N-OD2 3.12Å; D263-D266 PolarHBondContact O-N 3.39Å
264	P	89.8	Confident	85	Confident	94 Å²	94	51.2 Å²	51.2	61%	0.61	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-62.3	-20.6	170	27.6	-35.6	0	0	0	112.7	D266 L267	P264-D266 VanDerWaalsContact C-N 3.26Å; P264-D266 PolarHBondContact O-N 3.07Å; P264-L267 WeakPolarHBondContact O-CB 3.36Å; P264-L267 WeakPolarHBondContact O-CD1 3.23Å; P264-L267 VanDerWaalsContact O-CG 3.23Å; P264-L267 WeakPolarHBondContact O-CG 3.41Å; P264-L267 PolarHBondContact O-N 3.12Å
265	D	89.2	Confident	85.9	Confident	130 Å²	130	48.7 Å²	48.7	70%	0.695	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-70.4	-21.8	177.2	-65	-12.5	0	0	0	112.4	D263 L267 Q269	D263-D265 HydrophobicContact CB-CB 4.45Å; D263-D265 PolarHBondContact O-N 3.03Å; D265-L267 VanDerWaalsContact C-N 3.26Å; D265-L267 PolarHBondContact O-N 3.27Å; D265-Q269 PolarHBondContact O-NE2 2.91Å
266	D	88.2	Confident	86.9	Confident	4 Å²	4	45 Å²	45	2%	0.021	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-81.8	-0.4	176.9	-60.8	-53.3	0	0	0	113.7	R257 D263 P264 D268 Q269 V271 Y382	R257-D266 WeakPolarHBondContact CD-OD2 3.43Å; R257-D266 IonicContact CZ-OD1 3.74Å; R257-D266 IonicContact CZ-OD2 3.67Å; R257-D266 IonicContact NE-OD1 3.96Å; R257-D266 PolarHBondContact NE-OD1 2.99Å; R257-D266 VanDerWaalsContact NE-OD1 3.13Å; R257-D266 IonicContact NE-OD2 3.4Å; R257-D266 PolarHBondContact NE-OD2 2.73Å; R257-D266 IonicContact NH1-OD2 2.78Å; R257-D266 PolarHBondContact NH1-OD2 2.99Å; R257-D266 VanDerWaalsContact NH1-OD2 3.12Å; R257-D266 VanDerWaalsContact NH2-CG 3.28Å; R257-D266 IonicContact NH2-OD1 2.63Å; R257-D266 PolarHBondContact NH2-OD1 3.08Å; R257-D266 IonicContact NH2-OD2 3.69Å; R257-D266 PolarHBondContact NH2-OD2 2.94Å; R257-D266 VanDerWaalsContact NH2-OD2 3.16Å; D263-D266 PolarHBondContact N-OD2 3.14Å; D263-D266 VanDerWaalsContact N-OD2 3.12Å; D263-D266 PolarHBondContact O-N 3.39Å; P264-D266 VanDerWaalsContact C-N 3.26Å; P264-D266 PolarHBondContact O-N 3.07Å; D266-D268 PolarHBondContact O-N 2.81Å; D266-Q269 WeakPolarHBondContact O-CB 3.21Å; D266-Q269 PolarHBondContact O-N 2.69Å; D266-V271 HydrophobicContact CB-CG2 4.21Å; D266-Y382 HydrophobicContact CB-CD1 4.22Å
267	L	91.1	Very high	87.6	Confident	72 Å²	72	40.3 Å²	40.3	38%	0.377	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	131.6	177.5	-73.5	173.4	0	0	0	110.4	P264 D265 Q269 Y382 A384	P264-L267 WeakPolarHBondContact O-CB 3.36Å; P264-L267 WeakPolarHBondContact O-CD1 3.23Å; P264-L267 VanDerWaalsContact O-CG 3.23Å; P264-L267 WeakPolarHBondContact O-CG 3.41Å; P264-L267 PolarHBondContact O-N 3.12Å; D265-L267 VanDerWaalsContact C-N 3.26Å; D265-L267 PolarHBondContact O-N 3.27Å; L267-Q269 PolarHBondContact O-N 3.48Å; L267-Y382 HydrophobicContact CD2-CD1 3.84Å; L267-Y382 HydrophobicContact CD2-CE1 3.91Å; L267-Y382 HydrophobicContact CG-CD1 4.4Å; L267-Y382 HydrophobicContact CG-CE1 4.49Å; L267-A384 HydrophobicContact CD2-CB 3.85Å
268	D	90.4	Very high	87.7	Confident	68 Å²	68	40.6 Å²	40.6	36%	0.364	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	5.5	-174.2	-64.5	-22.5	0	0	0	116.4	P218 K219 D266 Y382	P218-D268 VanDerWaalsContact CD-O 3.3Å; P218-D268 WeakPolarHBondContact CD-O 3.22Å; P218-D268 VanDerWaalsContact CG-O 3.23Å; P218-D268 WeakPolarHBondContact CG-O 3.33Å; K219-D268 VanDerWaalsContact CE-CG 3.46Å; K219-D268 VanDerWaalsContact CE-OD1 3.23Å; K219-D268 WeakPolarHBondContact CE-OD1 3.23Å; K219-D268 IonicContact NZ-OD1 3.36Å; K219-D268 PolarHBondContact NZ-OD1 3.31Å; K219-D268 IonicContact NZ-OD2 2.73Å; K219-D268 PolarHBondContact NZ-OD2 2.61Å; D266-D268 PolarHBondContact O-N 2.81Å; D268-Y382 WeakPolarHBondContact CA-O 3.31Å; D268-Y382 PolarHBondContact N-O 2.92Å
269	Q	90.3	Very high	87.8	Confident	35 Å²	35	39.9 Å²	39.9	16%	0.164	21%	0.213	C	C	.	.	S	Bend	trans	-85.6	162.7	170.9	-59.4	-170.7	37.4	0	0	112.4	V215 D265 D266 L267 I381 Y382	V215-Q269 WeakPolarHBondContact O-CA 3.36Å; V215-Q269 WeakPolarHBondContact O-CB 3.44Å; D265-Q269 PolarHBondContact O-NE2 2.91Å; D266-Q269 WeakPolarHBondContact O-CB 3.21Å; D266-Q269 PolarHBondContact O-N 2.69Å; L267-Q269 PolarHBondContact O-N 3.48Å; Q269-I381 WeakPolarHBondContact O-CA 3.43Å; Q269-Y382 PolarHBondContact O-N 2.96Å
270	L	91.6	Very high	88	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	120.3	172.7	-173.3	59.5	0	0	0	110.4	L214 V215 P218 P250 C253 L407	L214-L270 HydrophobicContact CG-CD2 4.41Å; V215-L270 PolarHBondContact O-N 3.41Å; V215-L270 VanDerWaalsContact O-N 3.09Å; P218-L270 HydrophobicContact CB-CB 4.39Å; P218-L270 HydrophobicContact CG-CB 4.38Å; P250-L270 HydrophobicContact CB-CD2 4.29Å; P250-L270 HydrophobicContact CG-CD2 4.24Å; C253-L270 WeakPolarHBondContact SG-CD2 3.44Å; L270-L407 HydrophobicContact CD1-CD1 3.64Å
271	V	91.3	Very high	88	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.024	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.3	-177	-169.6	0	0	0	0	110.4	R257 L262 D266 V273 G380	R257-V271 HydrophobicContact CB-CG1 4.11Å; R257-V271 HydrophobicContact CG-CG1 4.34Å; L262-V271 HydrophobicContact CD2-CG1 3.89Å; D266-V271 HydrophobicContact CB-CG2 4.21Å; V271-V273 HydrophobicContact CG1-CG2 3.77Å; V271-G380 PolarHBondContact N-O 2.91Å; V271-G380 PolarHBondContact O-N 2.82Å; V271-G380 VanDerWaalsContact O-N 3.09Å
272	T	90.7	Very high	88.1	Confident	7 Å²	7	41.1 Å²	41.1	4%	0.043	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.5	170.2	53.5	0	0	0	0	110.3	C253 R255 S256 R257 V378 T379	C253-T272 HydrophobicContact CB-CG2 3.86Å; C253-T272 PolarHBondContact O-OG1 3.15Å; C253-T272 VanDerWaalsContact O-OG1 3.1Å; R255-T272 PolarHBondContact O-OG1 3.17Å; S256-T272 WeakPolarHBondContact CA-O 3.3Å; S256-T272 VanDerWaalsContact CA-OG1 3.23Å; S256-T272 WeakPolarHBondContact CA-OG1 3.23Å; S256-T272 PolarHBondContact N-OG1 3.24Å; R257-T272 PolarHBondContact N-O 2.93Å; T272-V378 WeakPolarHBondContact CA-O 3.37Å; T272-T379 HydrophobicContact CG2-CG2 3.5Å; T272-T379 VanDerWaalsContact CG2-CG2 3.5Å
273	V	89.6	Confident	88.3	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	127.4	-170.4	-178.7	0	0	0	0	109.4	L259 L262 V271 L342 V378 I404	L259-V273 HydrophobicContact CD1-CG1 3.25Å; L259-V273 HydrophobicContact CG-CG1 3.73Å; L262-V273 HydrophobicContact CD2-CG2 4.36Å; V271-V273 HydrophobicContact CG1-CG2 3.77Å; V273-L342 HydrophobicContact CG1-CD2 4.06Å; V273-V378 PolarHBondContact N-O 2.79Å; V273-V378 PolarHBondContact O-N 2.83Å; V273-I404 HydrophobicContact CB-CD1 4.4Å; V273-I404 HydrophobicContact CG2-CD1 3.8Å
274	S	88.2	Confident	88.4	Confident	28 Å²	28	43.9 Å²	43.9	20%	0.196	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	147.5	175.4	60.4	0	0	0	0	112.4	L259 V376 E412	L259-S274 WeakPolarHBondContact CD1-O 3.41Å; S274-V376 CarbonylContact C-O 3.57Å; S274-V376 WeakPolarHBondContact CA-O 3.5Å; S274-E412 WeakPolarHBondContact CB-OE1 3.23Å
275	G	86.6	Confident	88.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.1	179.5	178.3	0	0	0	0	0	115.5	Q343 R375 V376	G275-Q343 CarbonylContact C-O 3.56Å; G275-Q343 WeakPolarHBondContact CA-O 3.45Å; G275-R375 WeakPolarHBondContact O-CA 3.29Å; G275-V376 PolarHBondContact N-O 2.69Å; G275-V376 PolarHBondContact O-N 3.32Å
276	L	86.1	Confident	88.4	Confident	52 Å²	52	39.5 Å²	39.5	27%	0.272	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.6	176.5	-173.1	77.8	0	0	0	110.2	I278 Q343 G373 D374 R375	L276-I278 PolarHBondContact O-N 3.38Å; L276-Q343 PolarHBondContact N-O 3.25Å; L276-Q343 PolarHBondContact O-N 2.8Å; L276-G373 WeakPolarHBondContact CD1-O 3.33Å; L276-D374 WeakPolarHBondContact CA-O 3.39Å; L276-R375 HydrophobicContact CD1-CG 3.99Å
277	V	86.6	Confident	88.3	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.6	173.5	176.2	0	0	0	0	110.4	L280 I340 L342 I370 G373 D374 V376	V277-L280 HydrophobicContact CG1-CD2 3.98Å; V277-I340 HydrophobicContact CG1-CG2 3.78Å; V277-I340 HydrophobicContact CG2-CG2 4.04Å; V277-L342 HydrophobicContact CG2-CD1 3.92Å; V277-I370 HydrophobicContact CB-CG2 4.14Å; V277-I370 HydrophobicContact CG1-CG2 4.49Å; V277-I370 HydrophobicContact CG2-CD1 4.46Å; V277-I370 HydrophobicContact CG2-CG2 3.65Å; V277-G373 PolarHBondContact O-N 3.47Å; V277-D374 PolarHBondContact N-O 3.21Å; V277-V376 HydrophobicContact CG2-CG2 3.78Å
278	I	82.7	Confident	88	Confident	60 Å²	60	40.5 Å²	40.5	31%	0.308	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-46.2	175.7	-55.3	178.3	0	0	0	110.6	L276 K341 Q343 T357	L276-I278 PolarHBondContact O-N 3.38Å; I278-K341 PolarHBondContact N-O 3.45Å; I278-Q343 HydrophobicContact CD1-CB 3.87Å; I278-Q343 HydrophobicContact CD1-CG 4.22Å; I278-Q343 HydrophobicContact CG1-CB 3.82Å; I278-T357 HydrophobicContact CD1-CG2 3.72Å
279	R	83.4	Confident	88	Confident	55 Å²	55	43.4 Å²	43.4	21%	0.208	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	151.9	-169.1	53.9	168.9	-118.8	-172.1	2.3	112.4	K341 D548 E550	R279-K341 HydrophobicContact CG-CB 3.88Å; R279-K341 HydrophobicContact CG-CD 4.33Å; R279-K341 HydrophobicContact CG-CG 4.31Å; R279-K341 VanDerWaalsContact NH2-CE 3.32Å; R279-K341 PolarHBondContact O-N 3.43Å; R279-D548 IonicContact CZ-OD1 3.21Å; R279-D548 IonicContact NH1-OD1 2.71Å; R279-D548 PolarHBondContact NH1-OD1 3.33Å; R279-E550 IonicContact CZ-OE2 2.87Å; R279-E550 VanDerWaalsContact NH2-CD 3.34Å; R279-E550 IonicContact NH2-OE1 2.85Å; R279-E550 PolarHBondContact NH2-OE1 3.39Å; R279-E550 IonicContact NH2-OE2 2.99Å; R279-E550 PolarHBondContact NH2-OE2 2.98Å
280	L	87.2	Confident	88	Confident	41 Å²	41	41.8 Å²	41.8	22%	0.215	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	149.9	172.3	-50.1	169.1	0	0	0	108.6	V277 M339 I340 I370	V277-L280 HydrophobicContact CG1-CD2 3.98Å; L280-M339 CarbonylContact C-O 3.58Å; L280-I340 HydrophobicContact CD2-CB 4.42Å; L280-I340 HydrophobicContact CD2-CD1 3.92Å; L280-I340 HydrophobicContact CD2-CG1 3.77Å; L280-I340 HydrophobicContact CD2-CG2 4.07Å; L280-I370 WeakPolarHBondContact CD1-O 3.02Å
281	S	86.1	Confident	88	Confident	15 Å²	15	44.3 Å²	44.3	11%	0.105	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-84.3	161.3	164.2	74.6	0	0	0	0	110.6	Q338 M339	S281-Q338 PolarHBondContact O-NE2 3.36Å; S281-M339 PolarHBondContact N-O 3.48Å; S281-M339 PolarHBondContact OG-N 2.91Å; S281-M339 PolarHBondContact OG-O 3.06Å
282	P	87.8	Confident	88	Confident	99 Å²	99	44.8 Å²	44.8	64%	0.643	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-58	164.2	155.8	29.5	-37	0	0	0	110.6
283	L	89.3	Confident	88.1	Confident	76 Å²	76	48.5 Å²	48.5	40%	0.398	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-67.2	135.3	179.7	-49.6	-168.9	0	0	0	110.9	Q338 V367	L283-Q338 HydrophobicContact CD2-CB 4.32Å; L283-Q338 HydrophobicContact CD2-CG 4.27Å; L283-V367 HydrophobicContact CD1-CG1 4.14Å; L283-V367 HydrophobicContact CD2-CG1 3.19Å; L283-V367 HydrophobicContact CG-CG1 4.29Å
284	I	89.9	Confident	88.1	Confident	77 Å²	77	48.7 Å²	48.7	40%	0.395	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	112.9	179.2	-54.4	177	0	0	0	107.3	E286 K337	I284-E286 PolarHBondContact O-N 3.26Å; I284-K337 WeakPolarHBondContact CA-O 3.43Å; I284-K337 WeakPolarHBondContact CB-O 3.26Å; I284-K337 PolarHBondContact N-O 3.36Å; I284-K337 WeakPolarHBondContact O-CB 3.35Å; I284-K337 PolarHBondContact O-N 3.19Å
285	P	91	Very high	88.1	Confident	80 Å²	80	50.1 Å²	50.1	52%	0.519	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.1	178.6	28.8	-33.2	0	0	0	111.2	F334	P285-F334 HydrophobicContact CB-CB 3.91Å; P285-F334 HydrophobicContact CB-CD1 3.92Å; P285-F334 HydrophobicContact CB-CG 4.05Å
286	E	87.7	Confident	88.3	Confident	51 Å²	51	55.9 Å²	55.9	24%	0.238	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.7	175.9	-169.5	167.6	126.7	0	0	110.2	G72 S73 I284 M288 F334 V335 K337	G72-E286 WeakPolarHBondContact CA-OE1 3.39Å; S73-E286 PolarHBondContact N-OE1 3.03Å; I284-E286 PolarHBondContact O-N 3.26Å; E286-M288 PolarHBondContact O-N 3.43Å; E286-F334 CarbonylContact O-C 3.5Å; E286-F334 VanDerWaalsContact O-CA 3.22Å; E286-F334 WeakPolarHBondContact O-CA 3.46Å; E286-V335 PolarHBondContact N-O 3.02Å; E286-V335 PolarHBondContact O-N 3.3Å; E286-K337 WeakPolarHBondContact OE2-CD 3.43Å; E286-K337 IonicContact OE2-NZ 3.74Å; E286-K337 PolarHBondContact OE2-NZ 3.04Å
287	M	86.4	Confident	88.4	Confident	46 Å²	46	55.8 Å²	55.8	23%	0.227	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.4	-172.9	-174	179.8	-66.6	0	0	112	A290 C305 I310 L327 C332 F334	M287-A290 HydrophobicContact SD-CB 3.95Å; M287-C305 WeakPolarHBondContact O-CB 3.39Å; M287-C305 PolarHBondContact O-SG 2.88Å; M287-I310 HydrophobicContact SD-CD1 3.82Å; M287-L327 HydrophobicContact CE-CD2 4.45Å; M287-C332 HydrophobicContact CE-CB 3.62Å; M287-C332 VanDerWaalsContact CE-SG 3.57Å; M287-C332 HydrophobicContact CG-CB 4.06Å; M287-C332 HydrophobicContact SD-CB 3.94Å; M287-F334 HydrophobicContact CB-CD1 3.99Å; M287-F334 HydrophobicContact CB-CE1 3.89Å; M287-F334 HydrophobicContact CE-CE1 3.64Å; M287-F334 HydrophobicContact CE-CZ 3.7Å; M287-F334 HydrophobicContact CG-CE1 4.23Å
288	M	85.4	Confident	88.4	Confident	51 Å²	51	57.4 Å²	57.4	25%	0.251	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-37.8	175.5	-170.7	-143	-73.1	0	0	112.9	E286 C305 L333 V335	E286-M288 PolarHBondContact O-N 3.43Å; M288-C305 WeakPolarHBondContact O-CB 3.47Å; M288-C305 PolarHBondContact O-N 3.45Å; M288-C305 PolarHBondContact O-SG 2.8Å; M288-L333 HydrophobicContact CB-CD2 3.94Å; M288-L333 HydrophobicContact CE-CD2 3.71Å; M288-L333 PolarHBondContact N-O 2.88Å; M288-L333 HydrophobicContact SD-CD2 3.9Å; M288-V335 HydrophobicContact CB-CG2 4.1Å; M288-V335 HydrophobicContact CE-CG2 3.59Å
289	R	90.2	Very high	88.5	Confident	130 Å²	130	54.7 Å²	54.7	49%	0.491	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	127.2	178.1	-63.5	-177.9	175.2	171.5	-1.3	111.2	C332 L333	R289-C332 CarbonylContact O-C 3.58Å; R289-C332 VanDerWaalsContact O-CA 3.23Å; R289-C332 WeakPolarHBondContact O-CA 3.1Å; R289-C332 VanDerWaalsContact O-CB 3.22Å; R289-C332 WeakPolarHBondContact O-CB 2.93Å; R289-L333 HydrophobicContact CB-CB 4.08Å; R289-L333 PolarHBondContact N-O 3.13Å; R289-L333 PolarHBondContact O-N 3.1Å
290	A	90.6	Very high	88.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	128.8	176.7	0	0	0	0	0	111	M287 F292 S302 V303 I310 L327	M287-A290 HydrophobicContact SD-CB 3.95Å; A290-F292 HydrophobicContact CB-CD2 4.49Å; A290-F292 HydrophobicContact CB-CE2 3.89Å; A290-F292 HydrophobicContact CB-CZ 4.38Å; A290-S302 CarbonylContact O-C 3.5Å; A290-S302 WeakPolarHBondContact O-CA 3.37Å; A290-V303 PolarHBondContact N-O 3.31Å; A290-V303 PolarHBondContact O-N 2.96Å; A290-I310 HydrophobicContact CB-CG2 3.66Å; A290-L327 HydrophobicContact CB-CD1 3.73Å
291	E	91.8	Very high	88.9	Confident	57 Å²	57	54.3 Å²	54.3	27%	0.266	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	118.2	169.2	-75.1	-156	174.8	0	0	111.3	M300 Q328 R331 C332	E291-M300 HydrophobicContact CB-CE 4.04Å; E291-M300 WeakPolarHBondContact OE2-CE 3.44Å; E291-Q328 PolarHBondContact O-N 3.49Å; E291-R331 HydrophobicContact CB-CB 4.23Å; E291-R331 HydrophobicContact CG-CB 4.23Å; E291-R331 WeakPolarHBondContact OE2-CB 3.37Å; E291-R331 VanDerWaalsContact OE2-CD 3.23Å; E291-R331 WeakPolarHBondContact OE2-CD 3.41Å; E291-C332 PolarHBondContact N-SG 2.67Å; E291-C332 VanDerWaalsContact N-SG 3.38Å
292	F	91.5	Very high	89	Confident	13 Å²	13	57.5 Å²	57.5	6%	0.057	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	140.1	172.8	-66.1	-84.4	0	0	0	111	A290 M300 T301 V303 I310 E312 P313 A325 L327	A290-F292 HydrophobicContact CB-CD2 4.49Å; A290-F292 HydrophobicContact CB-CE2 3.89Å; A290-F292 HydrophobicContact CB-CZ 4.38Å; F292-M300 CarbonylContact O-C 3.13Å; F292-M300 VanDerWaalsContact O-CA 3.27Å; F292-M300 WeakPolarHBondContact O-CA 3.48Å; F292-T301 PolarHBondContact N-O 3.34Å; F292-T301 PolarHBondContact O-N 3.27Å; F292-V303 HydrophobicContact CD2-CB 4.49Å; F292-V303 HydrophobicContact CD2-CG2 3.98Å; F292-V303 HydrophobicContact CE2-CB 4.2Å; F292-V303 HydrophobicContact CE2-CG2 4.04Å; F292-I310 HydrophobicContact CE2-CG2 4.05Å; F292-I310 HydrophobicContact CZ-CG2 3.78Å; F292-E312 HydrophobicContact CD1-CG 4.39Å; F292-E312 HydrophobicContact CE1-CB 4.28Å; F292-E312 HydrophobicContact CE1-CG 3.91Å; F292-E312 HydrophobicContact CZ-CB 4.25Å; F292-E312 HydrophobicContact CZ-CG 4.33Å; F292-P313 HydrophobicContact CB-CG 4.33Å; F292-P313 HydrophobicContact CD2-CG 4.21Å; F292-P313 HydrophobicContact CG-CG 4.23Å; F292-A325 HydrophobicContact CB-CB 4.19Å; F292-A325 HydrophobicContact CD1-CB 3.96Å; F292-A325 HydrophobicContact CG-CB 4.34Å; F292-L327 HydrophobicContact CD1-CB 4.26Å; F292-L327 HydrophobicContact CD1-CD1 4.4Å; F292-L327 HydrophobicContact CE1-CB 4.14Å; F292-L327 HydrophobicContact CE1-CD1 4.13Å; F292-L327 HydrophobicContact CZ-CD1 4.24Å
293	K	91.3	Very high	89.1	Confident	85 Å²	85	54.1 Å²	54.1	37%	0.37	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.8	172.1	-178.1	-178.1	175.5	-170.6	0	109.9	A295 A299 M300 Q326 Q328	K293-A295 PolarHBondContact O-N 3.07Å; K293-A299 CarbonylContact C-O 3.49Å; K293-A299 WeakPolarHBondContact CA-O 3.39Å; K293-M300 HydrophobicContact CB-CE 4.21Å; K293-M300 HydrophobicContact CB-SD 3.59Å; K293-M300 VanDerWaalsContact CB-SD 3.59Å; K293-M300 HydrophobicContact CD-SD 4.12Å; K293-M300 HydrophobicContact CG-SD 3.7Å; K293-Q326 PolarHBondContact N-O 2.91Å; K293-Q326 PolarHBondContact O-N 3.45Å; K293-Q328 HydrophobicContact CB-CG 3.54Å; K293-Q328 HydrophobicContact CD-CG 4.26Å
294	C	90.4	Very high	89.1	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.034	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.1	171.7	177.9	0	0	0	0	111.3	I296 C297 G298 A299 C316 C319 T324	C294-I296 VanDerWaalsContact C-N 3.31Å; C294-I296 PolarHBondContact O-N 2.89Å; C294-I296 PolarHBondContact SG-N 2.88Å; C294-I296 VanDerWaalsContact SG-N 3.43Å; C294-C297 VanDerWaalsContact SG-SG 3.65Å; C294-G298 VanDerWaalsContact O-CA 3.24Å; C294-G298 WeakPolarHBondContact O-CA 3.38Å; C294-G298 PolarHBondContact O-N 2.91Å; C294-A299 HydrophobicContact CB-CB 4.48Å; C294-A299 PolarHBondContact N-O 3.17Å; C294-C316 HydrophobicContact CB-CB 3.98Å; C294-C316 WeakPolarHBondContact CB-SG 3.47Å; C294-C319 VanDerWaalsContact SG-SG 3.62Å; C294-T324 CarbonylContact C-O 3.31Å; C294-T324 WeakPolarHBondContact CA-O 3.46Å; C294-T324 PolarHBondContact SG-OG1 3.39Å; C294-T324 VanDerWaalsContact SG-OG1 3.33Å
295	A	89.1	Confident	88.8	Confident	59 Å²	59	50.4 Å²	50.4	49%	0.488	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-30.1	178.2	0	0	0	0	0	114	K293 T324 Q326	K293-A295 PolarHBondContact O-N 3.07Å; A295-T324 PolarHBondContact N-O 3.18Å; A295-Q326 HydrophobicContact CB-CG 4.49Å
296	I	89.4	Confident	88.2	Confident	121 Å²	121	52.4 Å²	52.4	62%	0.621	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-55.4	-175.3	-56.9	-177	0	0	0	111.7	C294 T324	C294-I296 VanDerWaalsContact C-N 3.31Å; C294-I296 PolarHBondContact O-N 2.89Å; C294-I296 PolarHBondContact SG-N 2.88Å; C294-I296 VanDerWaalsContact SG-N 3.43Å; I296-T324 HydrophobicContact CD1-CG2 3.84Å; I296-T324 HydrophobicContact CG1-CG2 4.09Å
297	C	88.9	Confident	87.5	Confident	49 Å²	49	60 Å²	60	33%	0.331	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-5.3	-173.7	71.3	0	0	0	0	114.7	C294 A299 C316 C319	C294-C297 VanDerWaalsContact SG-SG 3.65Å; C297-A299 PolarHBondContact O-N 2.93Å; C297-A299 WeakPolarHBondContact SG-CB 3.29Å; C297-C316 PolarHBondContact SG-SG 3.39Å; C297-C319 HydrophobicContact CB-CB 4.3Å; C297-C319 PolarHBondContact SG-SG 2.87Å
298	G	86	Confident	86.7	Confident	35 Å²	35	58.9 Å²	58.9	36%	0.361	31%	0.314	S	S	.	.			trans	68.4	7.8	-178.3	0	0	0	0	0	115.5	C294 M300	C294-G298 VanDerWaalsContact O-CA 3.24Å; C294-G298 WeakPolarHBondContact O-CA 3.38Å; C294-G298 PolarHBondContact O-N 2.91Å; G298-M300 PolarHBondContact O-N 3.04Å
299	A	86.3	Confident	86.6	Confident	3 Å²	3	66.1 Å²	66.1	3%	0.025	34%	0.339	C	S	.	.			trans	-61.5	133.6	175.9	0	0	0	0	0	111.2	K293 C294 C297 R318	K293-A299 CarbonylContact C-O 3.49Å; K293-A299 WeakPolarHBondContact CA-O 3.39Å; C294-A299 HydrophobicContact CB-CB 4.48Å; C294-A299 PolarHBondContact N-O 3.17Å; C297-A299 PolarHBondContact O-N 2.93Å; C297-A299 WeakPolarHBondContact SG-CB 3.29Å; A299-R318 HydrophobicContact CB-CB 4.46Å; A299-R318 HydrophobicContact CB-CG 3.93Å
300	M	88.5	Confident	86.3	Confident	60 Å²	60	63.6 Å²	63.6	30%	0.296	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139.8	173.3	-57.8	-63.6	-56.2	0	0	109.9	E291 F292 K293 G298 Q328	E291-M300 HydrophobicContact CB-CE 4.04Å; E291-M300 WeakPolarHBondContact OE2-CE 3.44Å; F292-M300 CarbonylContact O-C 3.13Å; F292-M300 VanDerWaalsContact O-CA 3.27Å; F292-M300 WeakPolarHBondContact O-CA 3.48Å; K293-M300 HydrophobicContact CB-CE 4.21Å; K293-M300 HydrophobicContact CB-SD 3.59Å; K293-M300 VanDerWaalsContact CB-SD 3.59Å; K293-M300 HydrophobicContact CD-SD 4.12Å; K293-M300 HydrophobicContact CG-SD 3.7Å; G298-M300 PolarHBondContact O-N 3.04Å; M300-Q328 HydrophobicContact CE-CB 4.36Å; M300-Q328 HydrophobicContact CE-CG 4.1Å
301	T	89	Confident	86.1	Confident	28 Å²	28	66.7 Å²	66.7	17%	0.172	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	122.9	173.6	-58	0	0	0	0	108.8	F292 V303 I317	F292-T301 PolarHBondContact N-O 3.34Å; F292-T301 PolarHBondContact O-N 3.27Å; T301-V303 HydrophobicContact CG2-CG2 4.27Å; T301-I317 HydrophobicContact CG2-CD1 4Å
302	S	88.5	Confident	85.8	Confident	83 Å²	83	68.7 Å²	68.7	58%	0.58	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.1	174	55.9	0	0	0	0	111	A290	A290-S302 CarbonylContact O-C 3.5Å; A290-S302 WeakPolarHBondContact O-CA 3.37Å
303	V	89.6	Confident	85.4	Confident	28 Å²	28	69.6 Å²	69.6	17%	0.17	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130	176.6	-175.2	0	0	0	0	109.1	A290 F292 T301 A311	A290-V303 PolarHBondContact N-O 3.31Å; A290-V303 PolarHBondContact O-N 2.96Å; F292-V303 HydrophobicContact CD2-CB 4.49Å; F292-V303 HydrophobicContact CD2-CG2 3.98Å; F292-V303 HydrophobicContact CE2-CB 4.2Å; F292-V303 HydrophobicContact CE2-CG2 4.04Å; T301-V303 HydrophobicContact CG2-CG2 4.27Å; V303-A311 HydrophobicContact CG1-CB 4.49Å
304	P	88.8	Confident	85.1	Confident	55 Å²	55	73 Å²	73	36%	0.357	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	149.3	174	30.6	-34.6	0	0	0	111.7	E306	P304-E306 PolarHBondContact O-N 2.82Å
305	C	83.5	Confident	84.9	Confident	19 Å²	19	75 Å²	75	13%	0.128	41%	0.41	C	S	.	.			trans	-87.7	95.4	177.6	-60	0	0	0	0	111	M287 M288 R307	M287-C305 WeakPolarHBondContact O-CB 3.39Å; M287-C305 PolarHBondContact O-SG 2.88Å; M288-C305 WeakPolarHBondContact O-CB 3.47Å; M288-C305 PolarHBondContact O-N 3.45Å; M288-C305 PolarHBondContact O-SG 2.8Å; C305-R307 PolarHBondContact O-N 3.01Å
306	E	79.7	Confident	84.7	Confident	123 Å²	123	72.7 Å²	72.7	58%	0.575	39%	0.39	S	S	*	.	B	Isolated β-bridge	trans	-80.3	118.1	178.5	-69.7	178.5	-162.8	0	0	111.6	P304 G308 R309	P304-E306 PolarHBondContact O-N 2.82Å; E306-G308 PolarHBondContact O-N 3.18Å; E306-G308 VanDerWaalsContact O-N 3.11Å; E306-R309 PolarHBondContact N-O 2.9Å; E306-R309 PolarHBondContact O-N 3.08Å
307	R	73.7	Confident	84.5	Confident	209 Å²	209	72.5 Å²	72.5	79%	0.789	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	38.4	172.6	-56.2	179.8	-179.3	-164.8	-3.8	113.8	C305 R309	C305-R307 PolarHBondContact O-N 3.01Å; R307-R309 VanDerWaalsContact C-N 3.27Å; R307-R309 PolarHBondContact O-N 3.05Å
308	G	69.5	Low	84.2	Confident	23 Å²	23	78.7 Å²	78.7	24%	0.237	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	4.6	-177.9	0	0	0	0	0	115.3	V69 E306	V69-G308 WeakPolarHBondContact CG1-O 3.48Å; E306-G308 PolarHBondContact O-N 3.18Å; E306-G308 VanDerWaalsContact O-N 3.11Å
309	R	81.8	Confident	84.1	Confident	204 Å²	204	79.3 Å²	79.3	77%	0.77	40%	0.404	S	S	*	.	B	Isolated β-bridge	trans	-101	128.8	172.6	-62.7	-174.9	-175.7	179.8	3.7	109.7	E306 R307	E306-R309 PolarHBondContact N-O 2.9Å; E306-R309 PolarHBondContact O-N 3.08Å; R307-R309 VanDerWaalsContact C-N 3.27Å; R307-R309 PolarHBondContact O-N 3.05Å
310	I	85.3	Confident	84	Confident	77 Å²	77	86.3 Å²	86.3	40%	0.395	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-99.4	116.8	171.4	-49.5	-178.6	0	0	0	106.8	M287 A290 F292	M287-I310 HydrophobicContact SD-CD1 3.82Å; A290-I310 HydrophobicContact CB-CG2 3.66Å; F292-I310 HydrophobicContact CE2-CG2 4.05Å; F292-I310 HydrophobicContact CZ-CG2 3.78Å
311	A	85	Confident	83.8	Confident	64 Å²	64	84.7 Å²	84.7	53%	0.529	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-82.4	117.2	171.4	0	0	0	0	0	109.1	V303	V303-A311 HydrophobicContact CG1-CB 4.49Å
312	E	85.9	Confident	83.7	Confident	99 Å²	99	86.3 Å²	86.3	46%	0.463	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-76.6	132.1	170.8	-173.6	-177.8	146.7	0	0	109.2	F292 E314 A325	F292-E312 HydrophobicContact CD1-CG 4.39Å; F292-E312 HydrophobicContact CE1-CB 4.28Å; F292-E312 HydrophobicContact CE1-CG 3.91Å; F292-E312 HydrophobicContact CZ-CB 4.25Å; F292-E312 HydrophobicContact CZ-CG 4.33Å; E312-E314 PolarHBondContact O-N 3.22Å; E312-A325 HydrophobicContact CG-CB 4.02Å
313	P	83.6	Confident	83.5	Confident	33 Å²	33	89.4 Å²	89.4	21%	0.214	45%	0.452	C	S	.	.			trans	-69.5	114.5	175.1	27.7	-32.7	0	0	0	110.2	F292 A315 A325	F292-P313 HydrophobicContact CB-CG 4.33Å; F292-P313 HydrophobicContact CD2-CG 4.21Å; F292-P313 HydrophobicContact CG-CG 4.23Å; P313-A315 PolarHBondContact O-N 2.99Å; P313-A315 VanDerWaalsContact O-N 3.17Å; P313-A325 HydrophobicContact CG-CB 4.1Å
314	E	84.6	Confident	83.3	Confident	156 Å²	156	89.2 Å²	89.2	73%	0.729	45%	0.45	S	S	*	.	S	Bend	trans	-56.3	-36.2	-173.7	-63	-170	154.8	0	0	113.3	E312 A322 H323	E312-E314 PolarHBondContact O-N 3.22Å; E314-A322 CarbonylContact O-C 3.41Å; E314-A322 VanDerWaalsContact O-CA 3.23Å; E314-A322 WeakPolarHBondContact O-CA 3.28Å; E314-H323 PolarHBondContact O-N 2.96Å
315	A	86.3	Confident	83.2	Confident	47 Å²	47	87.6 Å²	87.6	39%	0.388	44%	0.442	S	S	.	.	B	Isolated β-bridge	trans	-129.4	148.7	177.6	0	0	0	0	0	111.9	P313	P313-A315 PolarHBondContact O-N 2.99Å; P313-A315 VanDerWaalsContact O-N 3.17Å
316	C	84.2	Confident	83.4	Confident	10 Å²	10	91.9 Å²	91.9	7%	0.068	46%	0.46	C	S	.	.			trans	-74.7	131.3	174.2	-179.7	0	0	0	0	112.1	C294 C297 R318 C319 H320 S321	C294-C316 HydrophobicContact CB-CB 3.98Å; C294-C316 WeakPolarHBondContact CB-SG 3.47Å; C297-C316 PolarHBondContact SG-SG 3.39Å; C316-R318 PolarHBondContact O-N 3.38Å; C316-C319 PolarHBondContact O-N 3.11Å; C316-H320 WeakPolarHBondContact O-CA 2.97Å; C316-H320 PolarHBondContact O-N 3.29Å; C316-S321 PolarHBondContact N-O 3.06Å
317	I	84.7	Confident	83.9	Confident	118 Å²	118	89.4 Å²	89.4	61%	0.605	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-30.1	179.2	-56.7	171.5	0	0	0	113.8	T301	T301-I317 HydrophobicContact CG2-CD1 4Å
318	R	82.8	Confident	84.7	Confident	178 Å²	178	82.4 Å²	82.4	67%	0.672	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-29.3	-174.1	-58	-169	-158.4	168.1	5.9	115.7	A299 C316	A299-R318 HydrophobicContact CB-CB 4.46Å; A299-R318 HydrophobicContact CB-CG 3.93Å; C316-R318 PolarHBondContact O-N 3.38Å
319	C	84.9	Confident	85.7	Confident	48 Å²	48	86.8 Å²	86.8	32%	0.324	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	2.6	-174.2	56.9	0	0	0	0	113.8	C294 C297 C316 S321	C294-C319 VanDerWaalsContact SG-SG 3.62Å; C297-C319 HydrophobicContact CB-CB 4.3Å; C297-C319 PolarHBondContact SG-SG 2.87Å; C316-C319 PolarHBondContact O-N 3.11Å; C319-S321 PolarHBondContact O-N 3.11Å; C319-S321 PolarHBondContact SG-OG 2.98Å
320	H	84.3	Confident	86.1	Confident	151 Å²	151	84 Å²	84	70%	0.699	44%	0.441	S	S	*	.			trans	51.4	15.5	177.5	-57.9	-78.7	0	0	0	115.5	C316 A322	C316-H320 WeakPolarHBondContact O-CA 2.97Å; C316-H320 PolarHBondContact O-N 3.29Å; H320-A322 PolarHBondContact O-N 3.14Å
321	S	84.8	Confident	86.3	Confident	25 Å²	25	87.8 Å²	87.8	18%	0.175	45%	0.45	C	S	.	.			trans	-76.2	114.3	179.4	51.6	0	0	0	0	110.6	C316 C319 T324	C316-S321 PolarHBondContact N-O 3.06Å; C319-S321 PolarHBondContact O-N 3.11Å; C319-S321 PolarHBondContact SG-OG 2.98Å; S321-T324 PolarHBondContact O-OG1 3.48Å; S321-T324 WeakPolarHBondContact OG-CG2 3.2Å; S321-T324 PolarHBondContact OG-OG1 2.36Å
322	A	86.8	Confident	86.5	Confident	62 Å²	62	85.2 Å²	85.2	51%	0.512	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-60.8	144.6	178.9	0	0	0	0	0	112.2	E314 H320 T324	E314-A322 CarbonylContact O-C 3.41Å; E314-A322 VanDerWaalsContact O-CA 3.23Å; E314-A322 WeakPolarHBondContact O-CA 3.28Å; H320-A322 PolarHBondContact O-N 3.14Å; A322-T324 PolarHBondContact O-N 3.4Å; A322-T324 VanDerWaalsContact O-N 3.16Å
323	H	82.7	Confident	86.7	Confident	149 Å²	149	84.1 Å²	84.1	69%	0.69	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	34.6	173.2	-47.8	-58.8	0	0	0	114.9	E314	E314-H323 PolarHBondContact O-N 2.96Å
324	T	86.2	Confident	87	Confident	23 Å²	23	86.6 Å²	86.6	14%	0.141	43%	0.433	C	S	.	.			trans	-102.6	4.4	177.8	55.4	0	0	0	0	113.8	C294 A295 I296 S321 A322	C294-T324 CarbonylContact C-O 3.31Å; C294-T324 WeakPolarHBondContact CA-O 3.46Å; C294-T324 PolarHBondContact SG-OG1 3.39Å; C294-T324 VanDerWaalsContact SG-OG1 3.33Å; A295-T324 PolarHBondContact N-O 3.18Å; I296-T324 HydrophobicContact CD1-CG2 3.84Å; I296-T324 HydrophobicContact CG1-CG2 4.09Å; S321-T324 PolarHBondContact O-OG1 3.48Å; S321-T324 WeakPolarHBondContact OG-CG2 3.2Å; S321-T324 PolarHBondContact OG-OG1 2.36Å; A322-T324 PolarHBondContact O-N 3.4Å; A322-T324 VanDerWaalsContact O-N 3.16Å
325	A	86	Confident	87.2	Confident	22 Å²	22	80.4 Å²	80.4	18%	0.182	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	122	-177.9	0	0	0	0	0	111.4	F292 E312 P313	F292-A325 HydrophobicContact CB-CB 4.19Å; F292-A325 HydrophobicContact CD1-CB 3.96Å; F292-A325 HydrophobicContact CG-CB 4.34Å; E312-A325 HydrophobicContact CG-CB 4.02Å; P313-A325 HydrophobicContact CG-CB 4.1Å
326	Q	89	Confident	87.4	Confident	108 Å²	108	81.9 Å²	81.9	51%	0.505	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.6	174.5	-65.7	-176.7	-12.8	0	0	109.9	K293 A295 Q328	K293-Q326 PolarHBondContact N-O 2.91Å; K293-Q326 PolarHBondContact O-N 3.45Å; A295-Q326 HydrophobicContact CB-CG 4.49Å; Q326-Q328 PolarHBondContact O-N 3.49Å
327	L	90.5	Very high	87.7	Confident	72 Å²	72	82 Å²	82	38%	0.377	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	121.3	175.7	-176	69.5	0	0	0	110.9	M287 A290 F292 H329	M287-L327 HydrophobicContact CE-CD2 4.45Å; A290-L327 HydrophobicContact CB-CD1 3.73Å; F292-L327 HydrophobicContact CD1-CB 4.26Å; F292-L327 HydrophobicContact CD1-CD1 4.4Å; F292-L327 HydrophobicContact CE1-CB 4.14Å; F292-L327 HydrophobicContact CE1-CD1 4.13Å; F292-L327 HydrophobicContact CZ-CD1 4.24Å; L327-H329 PolarHBondContact O-N 3.27Å
328	Q	90.3	Very high	88	Confident	61 Å²	61	76.5 Å²	76.5	29%	0.285	38%	0.378	S	S	.	.			trans	-96.1	78.7	175.2	-64.4	-60.9	-67.6	0	0	109.6	E291 K293 M300 Q326 N330 R331 C332	E291-Q328 PolarHBondContact O-N 3.49Å; K293-Q328 HydrophobicContact CB-CG 3.54Å; K293-Q328 HydrophobicContact CD-CG 4.26Å; M300-Q328 HydrophobicContact CE-CB 4.36Å; M300-Q328 HydrophobicContact CE-CG 4.1Å; Q326-Q328 PolarHBondContact O-N 3.49Å; Q328-N330 PolarHBondContact O-N 2.95Å; Q328-R331 PolarHBondContact O-N 3.26Å; Q328-C332 PolarHBondContact O-N 2.86Å; Q328-C332 PolarHBondContact O-SG 2.66Å
329	H	89.5	Confident	88.4	Confident	116 Å²	116	69.2 Å²	69.2	54%	0.537	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-49.7	-35.6	-174.8	63.3	83.6	0	0	0	114.2	L327 R331 C332 F334	L327-H329 PolarHBondContact O-N 3.27Å; H329-R331 PolarHBondContact O-N 2.92Å; H329-C332 PolarHBondContact O-N 2.87Å; H329-F334 VanDerWaalsContact O-CE2 3.28Å; H329-F334 WeakPolarHBondContact O-CE2 3.27Å; H329-F334 WeakPolarHBondContact O-CZ 3.45Å
330	N	90.9	Very high	88.7	Confident	144 Å²	144	67 Å²	67	77%	0.77	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-67.4	-12.9	179.3	-74.1	-16.6	0	0	0	115.2	Q328	Q328-N330 PolarHBondContact O-N 2.95Å
331	R	88.4	Confident	89	Confident	157 Å²	157	61.7 Å²	61.7	59%	0.592	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-113.4	-4.2	177.6	-62.5	-173.1	172.4	-174.1	-4.6	113.6	E291 Q328 H329	E291-R331 HydrophobicContact CB-CB 4.23Å; E291-R331 HydrophobicContact CG-CB 4.23Å; E291-R331 WeakPolarHBondContact OE2-CB 3.37Å; E291-R331 VanDerWaalsContact OE2-CD 3.23Å; E291-R331 WeakPolarHBondContact OE2-CD 3.41Å; Q328-R331 PolarHBondContact O-N 3.26Å; H329-R331 PolarHBondContact O-N 2.92Å
332	C	89.8	Confident	89.3	Confident	10 Å²	10	60.5 Å²	60.5	7%	0.068	30%	0.304	C	S	.	.	S	Bend	trans	-62.6	147.5	172.9	-61.8	0	0	0	0	110	M287 R289 E291 Q328 H329 F334	M287-C332 HydrophobicContact CE-CB 3.62Å; M287-C332 VanDerWaalsContact CE-SG 3.57Å; M287-C332 HydrophobicContact CG-CB 4.06Å; M287-C332 HydrophobicContact SD-CB 3.94Å; R289-C332 CarbonylContact O-C 3.58Å; R289-C332 VanDerWaalsContact O-CA 3.23Å; R289-C332 WeakPolarHBondContact O-CA 3.1Å; R289-C332 VanDerWaalsContact O-CB 3.22Å; R289-C332 WeakPolarHBondContact O-CB 2.93Å; E291-C332 PolarHBondContact N-SG 2.67Å; E291-C332 VanDerWaalsContact N-SG 3.38Å; Q328-C332 PolarHBondContact O-N 2.86Å; Q328-C332 PolarHBondContact O-SG 2.66Å; H329-C332 PolarHBondContact O-N 2.87Å; C332-F334 HydrophobicContact CB-CE2 3.8Å; C332-F334 HydrophobicContact CB-CZ 3.82Å; C332-F334 VanDerWaalsContact O-CD2 3.23Å; C332-F334 WeakPolarHBondContact O-CD2 3.28Å; C332-F334 WeakPolarHBondContact O-CE2 3.4Å
333	L	89.6	Confident	89.4	Confident	77 Å²	77	59.8 Å²	59.8	40%	0.403	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.7	173.7	-167	150.1	0	0	0	108.6	M288 R289	M288-L333 HydrophobicContact CB-CD2 3.94Å; M288-L333 HydrophobicContact CE-CD2 3.71Å; M288-L333 PolarHBondContact N-O 2.88Å; M288-L333 HydrophobicContact SD-CD2 3.9Å; R289-L333 HydrophobicContact CB-CB 4.08Å; R289-L333 PolarHBondContact N-O 3.13Å; R289-L333 PolarHBondContact O-N 3.1Å
334	F	90.1	Very high	89.6	Confident	84 Å²	84	53 Å²	53	37%	0.368	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	152.1	177.6	-59.6	-87	0	0	0	110.9	P285 E286 M287 H329 C332	P285-F334 HydrophobicContact CB-CB 3.91Å; P285-F334 HydrophobicContact CB-CD1 3.92Å; P285-F334 HydrophobicContact CB-CG 4.05Å; E286-F334 CarbonylContact O-C 3.5Å; E286-F334 VanDerWaalsContact O-CA 3.22Å; E286-F334 WeakPolarHBondContact O-CA 3.46Å; M287-F334 HydrophobicContact CB-CD1 3.99Å; M287-F334 HydrophobicContact CB-CE1 3.89Å; M287-F334 HydrophobicContact CE-CE1 3.64Å; M287-F334 HydrophobicContact CE-CZ 3.7Å; M287-F334 HydrophobicContact CG-CE1 4.23Å; H329-F334 VanDerWaalsContact O-CE2 3.28Å; H329-F334 WeakPolarHBondContact O-CE2 3.27Å; H329-F334 WeakPolarHBondContact O-CZ 3.45Å; C332-F334 HydrophobicContact CB-CE2 3.8Å; C332-F334 HydrophobicContact CB-CZ 3.82Å; C332-F334 VanDerWaalsContact O-CD2 3.23Å; C332-F334 WeakPolarHBondContact O-CD2 3.28Å; C332-F334 WeakPolarHBondContact O-CE2 3.4Å
335	V	88.9	Confident	89.4	Confident	26 Å²	26	52.1 Å²	52.1	16%	0.158	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.3	172.6	171.5	0	0	0	0	107.7	E286 M288 E364	E286-V335 PolarHBondContact N-O 3.02Å; E286-V335 PolarHBondContact O-N 3.3Å; M288-V335 HydrophobicContact CB-CG2 4.1Å; M288-V335 HydrophobicContact CE-CG2 3.59Å; V335-E364 HydrophobicContact CG1-CG 3.63Å
336	D	91	Very high	88.9	Confident	78 Å²	78	54.8 Å²	54.8	42%	0.417	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	126.5	178.8	-62.8	-53.8	0	0	0	111.1	E364 V367	D336-E364 PolarHBondContact O-N 2.95Å; D336-V367 HydrophobicContact CB-CG2 4.3Å
337	K	90	Very high	88.4	Confident	13 Å²	13	56.3 Å²	56.3	6%	0.057	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.2	175.2	171.7	173.8	165.6	-177.5	0	109.2	E70 I284 E286 Y361 A362	E70-K337 IonicContact OE2-NZ 3.02Å; E70-K337 PolarHBondContact OE2-NZ 3.11Å; I284-K337 WeakPolarHBondContact CA-O 3.43Å; I284-K337 WeakPolarHBondContact CB-O 3.26Å; I284-K337 PolarHBondContact N-O 3.36Å; I284-K337 WeakPolarHBondContact O-CB 3.35Å; I284-K337 PolarHBondContact O-N 3.19Å; E286-K337 WeakPolarHBondContact OE2-CD 3.43Å; E286-K337 IonicContact OE2-NZ 3.74Å; E286-K337 PolarHBondContact OE2-NZ 3.04Å; K337-Y361 HydrophobicContact CG-CD1 4.4Å; K337-A362 WeakPolarHBondContact CA-O 3.42Å
338	Q	90.5	Very high	87.7	Confident	3 Å²	3	56.5 Å²	56.5	1%	0.014	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	137.4	179.1	-169	176.6	37.5	0	0	110.8	S281 L283 Y361 A362 V367 D368	S281-Q338 PolarHBondContact O-NE2 3.36Å; L283-Q338 HydrophobicContact CD2-CB 4.32Å; L283-Q338 HydrophobicContact CD2-CG 4.27Å; Q338-Y361 VanDerWaalsContact O-CA 3.31Å; Q338-Y361 WeakPolarHBondContact O-CA 3.38Å; Q338-A362 PolarHBondContact N-O 2.75Å; Q338-A362 PolarHBondContact O-N 3.2Å; Q338-V367 HydrophobicContact CB-CG1 4.29Å; Q338-V367 HydrophobicContact CB-CG2 4.09Å; Q338-D368 PolarHBondContact NE2-OD1 3.42Å
339	M	91.5	Very high	87.2	Confident	25 Å²	25	56.5 Å²	56.5	12%	0.123	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.2	178	-177.8	177.6	56.3	0	0	110.8	L280 S281 L359 M360 Y361 E550	L280-M339 CarbonylContact C-O 3.58Å; S281-M339 PolarHBondContact N-O 3.48Å; S281-M339 PolarHBondContact OG-N 2.91Å; S281-M339 PolarHBondContact OG-O 3.06Å; M339-L359 HydrophobicContact CG-CD2 3.79Å; M339-L359 HydrophobicContact SD-CD2 3.66Å; M339-M360 WeakPolarHBondContact CA-O 3.44Å; M339-Y361 HydrophobicContact CB-CD1 3.86Å; M339-Y361 HydrophobicContact CB-CE1 3.71Å; M339-Y361 HydrophobicContact CG-CD1 4.09Å; M339-Y361 HydrophobicContact CG-CE1 3.65Å; M339-Y361 HydrophobicContact SD-CE1 4.02Å; M339-E550 WeakPolarHBondContact CE-OE2 3.05Å
340	I	91.6	Very high	86.9	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.6	-176.9	-56	-175.3	0	0	0	108.7	V277 L280 M360 A362 I370 F409	V277-I340 HydrophobicContact CG1-CG2 3.78Å; V277-I340 HydrophobicContact CG2-CG2 4.04Å; L280-I340 HydrophobicContact CD2-CB 4.42Å; L280-I340 HydrophobicContact CD2-CD1 3.92Å; L280-I340 HydrophobicContact CD2-CG1 3.77Å; L280-I340 HydrophobicContact CD2-CG2 4.07Å; I340-M360 HydrophobicContact CB-CB 4.37Å; I340-M360 PolarHBondContact N-O 2.78Å; I340-M360 PolarHBondContact O-N 3.46Å; I340-A362 HydrophobicContact CD1-CB 4.21Å; I340-I370 HydrophobicContact CD1-CD1 4.46Å; I340-F409 HydrophobicContact CD1-CE2 4.32Å; I340-F409 HydrophobicContact CD1-CZ 3.75Å
341	K	91.7	Very high	86.4	Confident	38 Å²	38	50.9 Å²	50.9	17%	0.165	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	113.7	168	-74.8	-170.1	-178.7	167.7	0	110.2	I278 R279 L359 E550	I278-K341 PolarHBondContact N-O 3.45Å; R279-K341 HydrophobicContact CG-CB 3.88Å; R279-K341 HydrophobicContact CG-CD 4.33Å; R279-K341 HydrophobicContact CG-CG 4.31Å; R279-K341 VanDerWaalsContact NH2-CE 3.32Å; R279-K341 PolarHBondContact O-N 3.43Å; K341-L359 HydrophobicContact CD-CD2 4.27Å; K341-L359 HydrophobicContact CG-CD2 3.64Å; K341-L359 HydrophobicContact CG-CG 4.45Å; K341-E550 WeakPolarHBondContact CE-OE1 3.35Å; K341-E550 IonicContact NZ-OE1 3.98Å; K341-E550 PolarHBondContact NZ-OE1 3.15Å
342	L	90.1	Very high	86.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	143.7	173.1	-166.3	74.1	0	0	0	109.7	V273 V277 T357 V358 M360 V376 V378	V273-L342 HydrophobicContact CG1-CD2 4.06Å; V277-L342 HydrophobicContact CG2-CD1 3.92Å; L342-T357 CarbonylContact O-C 3.58Å; L342-T357 WeakPolarHBondContact O-CA 3.32Å; L342-V358 PolarHBondContact N-O 2.92Å; L342-V358 PolarHBondContact O-N 3.09Å; L342-M360 HydrophobicContact CB-CG 4.26Å; L342-M360 HydrophobicContact CB-SD 3.74Å; L342-M360 HydrophobicContact CD2-CE 4.3Å; L342-M360 HydrophobicContact CD2-SD 3.81Å; L342-M360 HydrophobicContact CG-SD 4.25Å; L342-V376 HydrophobicContact CD1-CG2 3.56Å; L342-V378 HydrophobicContact CD2-CG2 4.23Å
343	Q	89.5	Confident	86	Confident	48 Å²	48	54.1 Å²	54.1	22%	0.224	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.2	174	-164.8	-173.9	-71.5	0	0	110	G275 L276 I278 S345 P355 T357	G275-Q343 CarbonylContact C-O 3.56Å; G275-Q343 WeakPolarHBondContact CA-O 3.45Å; L276-Q343 PolarHBondContact N-O 3.25Å; L276-Q343 PolarHBondContact O-N 2.8Å; I278-Q343 HydrophobicContact CD1-CB 3.87Å; I278-Q343 HydrophobicContact CD1-CG 4.22Å; I278-Q343 HydrophobicContact CG1-CB 3.82Å; Q343-S345 PolarHBondContact O-N 3.01Å; Q343-P355 HydrophobicContact CG-CB 3.61Å; Q343-P355 HydrophobicContact CG-CG 4.03Å; Q343-T357 HydrophobicContact CG-CG2 4.36Å
344	E	87.1	Confident	85.8	Confident	5 Å²	5	55.9 Å²	55.9	2%	0.023	32%	0.317	C	S	.	.			trans	-52.4	134.8	166.4	-69	175.8	147.8	0	0	112.1	L259 R260 P355 H356	L259-E344 HydrophobicContact CB-CG 3.67Å; L259-E344 HydrophobicContact CD1-CG 3.82Å; L259-E344 HydrophobicContact CD2-CG 3.96Å; L259-E344 HydrophobicContact CG-CG 4.01Å; R260-E344 VanDerWaalsContact CG-OE1 3.26Å; R260-E344 WeakPolarHBondContact CG-OE1 3.48Å; R260-E344 IonicContact CZ-OE1 3.38Å; R260-E344 IonicContact CZ-OE2 3.65Å; R260-E344 VanDerWaalsContact CZ-OE2 3.22Å; R260-E344 PolarHBondContact N-OE1 3.21Å; R260-E344 IonicContact NE-OE1 2.78Å; R260-E344 PolarHBondContact NE-OE1 2.81Å; R260-E344 VanDerWaalsContact NE-OE1 3.16Å; R260-E344 IonicContact NE-OE2 3.42Å; R260-E344 PolarHBondContact NE-OE2 3.3Å; R260-E344 IonicContact NH2-OE2 3.11Å; R260-E344 PolarHBondContact NH2-OE2 2.88Å; E344-P355 HydrophobicContact CB-CB 4.41Å; E344-H356 HydrophobicContact CG-CB 4.47Å; E344-H356 PolarHBondContact N-O 2.83Å; E344-H356 PolarHBondContact OE2-N 3.17Å
345	S	80.4	Confident	85.5	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.035	31%	0.312	C	S	.	.			trans	-61	139.7	168.5	-74	0	0	0	0	110.2	Q343 E347 N348	Q343-S345 PolarHBondContact O-N 3.01Å; S345-E347 PolarHBondContact O-N 3.32Å; S345-E347 VanDerWaalsContact O-N 3.08Å; S345-N348 PolarHBondContact O-N 3.25Å; S345-N348 VanDerWaalsContact O-N 3.15Å
346	P	76.3	Confident	85.5	Confident	78 Å²	78	56.8 Å²	56.8	51%	0.506	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-65.5	-17	-174.9	27.7	-36.1	0	0	0	113.5	M349	P346-M349 WeakPolarHBondContact O-CB 3.48Å
347	E	78.2	Confident	85.5	Confident	141 Å²	141	56.9 Å²	56.9	66%	0.659	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-74.5	-28.6	179.2	-68.4	162.9	-131.4	0	0	112	S345 R375	S345-E347 PolarHBondContact O-N 3.32Å; S345-E347 VanDerWaalsContact O-N 3.08Å; E347-R375 IonicContact OE1-CZ 3.95Å; E347-R375 IonicContact OE1-NH1 3.14Å; E347-R375 PolarHBondContact OE1-NH1 2.88Å; E347-R375 IonicContact OE1-NH2 3.91Å; E347-R375 PolarHBondContact OE1-NH2 2.9Å
348	N	77	Confident	85.5	Confident	75 Å²	75	57.2 Å²	57.2	40%	0.401	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-96	5	178.5	-59.7	19.9	0	0	0	112.1	D258 S345	D258-N348 PolarHBondContact OD1-ND2 3.09Å; S345-N348 PolarHBondContact O-N 3.25Å; S345-N348 VanDerWaalsContact O-N 3.15Å
349	M	78.6	Confident	85.7	Confident	61 Å²	61	58.4 Å²	58.4	30%	0.3	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-78.4	125.4	-175.4	-178.6	-176.1	-68.5	0	0	111.7	P346 A351 Q353 P355	P346-M349 WeakPolarHBondContact O-CB 3.48Å; M349-A351 PolarHBondContact O-N 2.76Å; M349-Q353 VanDerWaalsContact SD-O 3.4Å; M349-P355 HydrophobicContact CE-CB 3.58Å; M349-P355 HydrophobicContact CE-CG 3.78Å
350	P	82.8	Confident	85.7	Confident	49 Å²	49	57.2 Å²	57.2	32%	0.318	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-66.9	130.6	168.1	27.4	-32.2	0	0	0	110.1	S352 Q353	P350-S352 PolarHBondContact O-N 3.45Å; P350-Q353 HydrophobicContact CG-CB 4.18Å; P350-Q353 HydrophobicContact CG-CG 4.17Å; P350-Q353 PolarHBondContact O-N 2.86Å
351	A	82.3	Confident	85.9	Confident	93 Å²	93	57.7 Å²	57.7	77%	0.769	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	136	-174.8	0	0	0	0	0	112.6	M349 Q353	M349-A351 PolarHBondContact O-N 2.76Å; A351-Q353 PolarHBondContact O-N 3.25Å
352	S	82.2	Confident	85.9	Confident	132 Å²	132	55.9 Å²	55.9	92%	0.923	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	7.1	-180	-38.4	0	0	0	0	117.1	P350	P350-S352 PolarHBondContact O-N 3.45Å
353	Q	86.6	Confident	85.9	Confident	103 Å²	103	57.6 Å²	57.6	48%	0.481	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-100.2	150.9	171.5	-58.5	-170.2	7.3	0	0	111.7	M349 P350 A351	M349-Q353 VanDerWaalsContact SD-O 3.4Å; P350-Q353 HydrophobicContact CG-CB 4.18Å; P350-Q353 HydrophobicContact CG-CG 4.17Å; P350-Q353 PolarHBondContact O-N 2.86Å; A351-Q353 PolarHBondContact O-N 3.25Å
354	T	84.7	Confident	85.7	Confident	114 Å²	114	58.6 Å²	58.6	70%	0.699	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-78.6	140.3	171.9	49.6	0	0	0	0	109.8	R260 H356	R260-T354 PolarHBondContact NH2-O 3.41Å; T354-H356 PolarHBondContact O-N 2.74Å
355	P	85.5	Confident	85.6	Confident	42 Å²	42	60.7 Å²	60.7	27%	0.273	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-60.9	137.8	-178.3	21.7	-29.3	0	0	0	110.9	Q343 E344 M349	Q343-P355 HydrophobicContact CG-CB 3.61Å; Q343-P355 HydrophobicContact CG-CG 4.03Å; E344-P355 HydrophobicContact CB-CB 4.41Å; M349-P355 HydrophobicContact CE-CB 3.58Å; M349-P355 HydrophobicContact CE-CG 3.78Å
356	H	88.6	Confident	85.9	Confident	87 Å²	87	61 Å²	61	40%	0.403	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-78.9	148.8	173.1	-72.7	-174.4	0	0	0	110.6	R260 E344 T354	R260-H356 PolarHBondContact NH1-CD2 2.92Å; R260-H356 PolarHBondContact NH1-CE1 3.17Å; R260-H356 PolarHBondContact NH1-NE2 2.91Å; R260-H356 PolarHBondContact NH2-CD2 3.06Å; E344-H356 HydrophobicContact CG-CB 4.47Å; E344-H356 PolarHBondContact N-O 2.83Å; E344-H356 PolarHBondContact OE2-N 3.17Å; T354-H356 PolarHBondContact O-N 2.74Å
357	T	90.8	Very high	86.5	Confident	81 Å²	81	58.4 Å²	58.4	50%	0.497	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.9	177.2	63.5	0	0	0	0	110.4	I278 L342 Q343	I278-T357 HydrophobicContact CD1-CG2 3.72Å; L342-T357 CarbonylContact O-C 3.58Å; L342-T357 WeakPolarHBondContact O-CA 3.32Å; Q343-T357 HydrophobicContact CG-CG2 4.36Å
358	V	90.5	Very high	86.9	Confident	19 Å²	19	55.6 Å²	55.6	12%	0.115	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	144.9	174.9	167.5	0	0	0	0	109.7	L259 L262 L342 I404	L259-V358 HydrophobicContact CB-CG2 4.19Å; L259-V358 HydrophobicContact CD2-CB 3.86Å; L259-V358 HydrophobicContact CD2-CG2 3.67Å; L259-V358 HydrophobicContact CG-CB 4.5Å; L259-V358 HydrophobicContact CG-CG2 3.98Å; L262-V358 HydrophobicContact CD1-CG2 4.21Å; L342-V358 PolarHBondContact N-O 2.92Å; L342-V358 PolarHBondContact O-N 3.09Å; V358-I404 HydrophobicContact CG1-CD1 3.88Å; V358-I404 HydrophobicContact CG1-CG1 4.08Å
359	L	93.3	Very high	87.3	Confident	28 Å²	28	56.1 Å²	56.1	15%	0.147	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	136.4	173.5	-80.7	164	0	0	0	109.8	M339 K341 Y403 I404	M339-L359 HydrophobicContact CG-CD2 3.79Å; M339-L359 HydrophobicContact SD-CD2 3.66Å; K341-L359 HydrophobicContact CD-CD2 4.27Å; K341-L359 HydrophobicContact CG-CD2 3.64Å; K341-L359 HydrophobicContact CG-CG 4.45Å; L359-Y403 CarbonylContact O-C 3.55Å; L359-Y403 WeakPolarHBondContact O-CA 3.09Å; L359-Y403 WeakPolarHBondContact O-CB 3.46Å; L359-I404 PolarHBondContact O-N 3.18Å
360	M	93	Very high	87.6	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	149.8	177.5	-34	-169.4	86.6	0	0	109.8	M339 I340 L342 V378 I404 V406	M339-M360 WeakPolarHBondContact CA-O 3.44Å; I340-M360 HydrophobicContact CB-CB 4.37Å; I340-M360 PolarHBondContact N-O 2.78Å; I340-M360 PolarHBondContact O-N 3.46Å; L342-M360 HydrophobicContact CB-CG 4.26Å; L342-M360 HydrophobicContact CB-SD 3.74Å; L342-M360 HydrophobicContact CD2-CE 4.3Å; L342-M360 HydrophobicContact CD2-SD 3.81Å; L342-M360 HydrophobicContact CG-SD 4.25Å; M360-V378 HydrophobicContact CE-CB 3.64Å; M360-V378 HydrophobicContact CE-CG1 3.41Å; M360-V378 VanDerWaalsContact CE-CG1 3.41Å; M360-V378 HydrophobicContact CE-CG2 3.93Å; M360-V378 HydrophobicContact SD-CB 4.27Å; M360-V378 HydrophobicContact SD-CG1 4.1Å; M360-V378 HydrophobicContact SD-CG2 3.88Å; M360-I404 CarbonylContact C-O 3.55Å; M360-I404 WeakPolarHBondContact CA-O 3.4Å; M360-I404 HydrophobicContact CE-CB 3.61Å; M360-I404 HydrophobicContact CE-CD1 3.81Å; M360-I404 HydrophobicContact CE-CG1 4.26Å; M360-I404 HydrophobicContact CE-CG2 3.59Å; M360-V406 HydrophobicContact CB-CG2 3.92Å; M360-V406 HydrophobicContact CE-CG2 4.2Å
361	Y	94.1	Very high	87.6	Confident	11 Å²	11	55.7 Å²	55.7	4%	0.043	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.1	168.4	-61.6	-60.4	0	0	0	110.1	K337 Q338 M339 Y403 I404 V406	K337-Y361 HydrophobicContact CG-CD1 4.4Å; Q338-Y361 VanDerWaalsContact O-CA 3.31Å; Q338-Y361 WeakPolarHBondContact O-CA 3.38Å; M339-Y361 HydrophobicContact CB-CD1 3.86Å; M339-Y361 HydrophobicContact CB-CE1 3.71Å; M339-Y361 HydrophobicContact CG-CD1 4.09Å; M339-Y361 HydrophobicContact CG-CE1 3.65Å; M339-Y361 HydrophobicContact SD-CE1 4.02Å; Y361-Y403 AromaticContact CD2-CD2 3.32Å; Y361-Y403 HydrophobicContact CD2-CD2 3.32Å; Y361-Y403 AromaticContact CD2-CE2 3.6Å; Y361-Y403 HydrophobicContact CD2-CE2 3.6Å; Y361-Y403 HydrophobicContact CD2-CG 4.02Å; Y361-Y403 HydrophobicContact CE2-CD1 4.41Å; Y361-Y403 AromaticContact CE2-CD2 3.61Å; Y361-Y403 HydrophobicContact CE2-CD2 3.61Å; Y361-Y403 AromaticContact CE2-CE2 3.94Å; Y361-Y403 HydrophobicContact CE2-CE2 3.94Å; Y361-Y403 AromaticContact CE2-CG 3.85Å; Y361-Y403 HydrophobicContact CE2-CG 3.85Å; Y361-Y403 HydrophobicContact CG-CD2 4.48Å; Y361-I404 PolarHBondContact N-O 3.25Å; Y361-V406 WeakPolarHBondContact O-CG2 3.49Å; Y361-V406 PolarHBondContact O-N 3.1Å
362	A	92.3	Very high	87.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	144.5	168.6	0	0	0	0	0	109.2	K337 Q338 I340 L366 F409	K337-A362 WeakPolarHBondContact CA-O 3.42Å; Q338-A362 PolarHBondContact N-O 2.75Å; Q338-A362 PolarHBondContact O-N 3.2Å; I340-A362 HydrophobicContact CD1-CB 4.21Å; A362-L366 HydrophobicContact CB-CB 4Å; A362-F409 HydrophobicContact CB-CE2 3.93Å; A362-F409 HydrophobicContact CB-CZ 4.11Å
363	H	90.2	Very high	87.1	Confident	37 Å²	37	48.9 Å²	48.9	17%	0.171	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147	-178.1	-63.2	99	0	0	0	110.4	E365 L366 D405	H363-E365 PolarHBondContact O-N 2.76Å; H363-L366 WeakPolarHBondContact O-CB 3.39Å; H363-L366 PolarHBondContact O-N 3.45Å; H363-D405 IonicContact CE1-OD1 3.01Å; H363-D405 PolarHBondContact CE1-OD1 3.03Å; H363-D405 IonicContact ND1-OD1 3.08Å; H363-D405 PolarHBondContact ND1-OD1 3.01Å
364	E	85.7	Confident	86.8	Confident	69 Å²	69	46 Å²	46	32%	0.322	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	48.1	-118.4	173.1	-61.5	-175.3	161.9	0	0	113.5	Q247 V335 D336 L366 V367	Q247-E364 PolarHBondContact NE2-OE2 3.49Å; V335-E364 HydrophobicContact CG1-CG 3.63Å; D336-E364 PolarHBondContact O-N 2.95Å; E364-L366 PolarHBondContact O-N 2.52Å; E364-L366 VanDerWaalsContact O-N 3.08Å; E364-V367 VanDerWaalsContact O-CB 3.27Å; E364-V367 WeakPolarHBondContact O-CB 3.31Å; E364-V367 VanDerWaalsContact O-CG2 3.28Å; E364-V367 WeakPolarHBondContact O-CG2 3.33Å; E364-V367 PolarHBondContact O-N 2.93Å
365	E	84.7	Confident	86.7	Confident	48 Å²	48	44 Å²	44	22%	0.224	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-65.9	-8.6	-176.7	-60.9	178.1	-168.6	0	0	114.8	T194 R249 H363 K369	T194-E365 PolarHBondContact OG1-OE1 3.37Å; R249-E365 IonicContact CZ-OE2 3.35Å; R249-E365 IonicContact NH1-OE2 2.65Å; R249-E365 PolarHBondContact NH1-OE2 3.24Å; R249-E365 VanDerWaalsContact NH1-OE2 3.08Å; R249-E365 IonicContact NH2-OE2 3.42Å; R249-E365 PolarHBondContact NH2-OE2 2.86Å; H363-E365 PolarHBondContact O-N 2.76Å; E365-K369 WeakPolarHBondContact O-CD 3.17Å; E365-K369 WeakPolarHBondContact O-CE 3.4Å; E365-K369 PolarHBondContact O-NZ 3.08Å
366	L	87.1	Confident	86.8	Confident	13 Å²	13	42 Å²	42	7%	0.068	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-89.2	-8.1	178.1	-63.6	172.4	0	0	0	112.6	A362 H363 E364 K369 V406 L407 F409	A362-L366 HydrophobicContact CB-CB 4Å; H363-L366 WeakPolarHBondContact O-CB 3.39Å; H363-L366 PolarHBondContact O-N 3.45Å; E364-L366 PolarHBondContact O-N 2.52Å; E364-L366 VanDerWaalsContact O-N 3.08Å; L366-K369 HydrophobicContact CD2-CD 4.42Å; L366-V406 HydrophobicContact CD1-CG1 4.29Å; L366-V406 WeakPolarHBondContact CD1-O 3.48Å; L366-L407 WeakPolarHBondContact CD1-O 3.16Å; L366-F409 HydrophobicContact CB-CD2 4.3Å; L366-F409 HydrophobicContact CB-CE2 4.04Å; L366-F409 HydrophobicContact CD2-CD2 4.14Å
367	V	88.9	Confident	86.8	Confident	22 Å²	22	40.1 Å²	40.1	13%	0.133	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	140.3	174.9	172.3	0	0	0	0	111	L283 D336 Q338 E364 K369	L283-V367 HydrophobicContact CD1-CG1 4.14Å; L283-V367 HydrophobicContact CD2-CG1 3.19Å; L283-V367 HydrophobicContact CG-CG1 4.29Å; D336-V367 HydrophobicContact CB-CG2 4.3Å; Q338-V367 HydrophobicContact CB-CG1 4.29Å; Q338-V367 HydrophobicContact CB-CG2 4.09Å; E364-V367 VanDerWaalsContact O-CB 3.27Å; E364-V367 WeakPolarHBondContact O-CB 3.31Å; E364-V367 VanDerWaalsContact O-CG2 3.28Å; E364-V367 WeakPolarHBondContact O-CG2 3.33Å; E364-V367 PolarHBondContact O-N 2.93Å; V367-K369 PolarHBondContact O-N 2.93Å
368	D	86.8	Confident	86.8	Confident	82 Å²	82	36.3 Å²	36.3	44%	0.439	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	7.2	-179.3	-70.2	-36.6	0	0	0	116.5	Q338 I370	Q338-D368 PolarHBondContact NE2-OD1 3.42Å; D368-I370 PolarHBondContact O-N 2.86Å
369	K	84.7	Confident	86.9	Confident	86 Å²	86	35.4 Å²	35.4	37%	0.374	18%	0.182	S	C	.	.			trans	-68.6	-5.6	174.1	-84.1	-167.1	174.8	147.5	0	115.1	E365 L366 V367 R411	E365-K369 WeakPolarHBondContact O-CD 3.17Å; E365-K369 WeakPolarHBondContact O-CE 3.4Å; E365-K369 PolarHBondContact O-NZ 3.08Å; L366-K369 HydrophobicContact CD2-CD 4.42Å; V367-K369 PolarHBondContact O-N 2.93Å; K369-R411 PolarHBondContact O-NE 2.67Å; K369-R411 PolarHBondContact O-NH2 3.23Å
370	I	85	Confident	86.8	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.015	18%	0.175	C	C	.	.	S	Bend	trans	-130.7	146.2	176.4	-56.2	166.3	0	0	0	109.2	V277 L280 I340 D368 D374 V376 F409	V277-I370 HydrophobicContact CB-CG2 4.14Å; V277-I370 HydrophobicContact CG1-CG2 4.49Å; V277-I370 HydrophobicContact CG2-CD1 4.46Å; V277-I370 HydrophobicContact CG2-CG2 3.65Å; L280-I370 WeakPolarHBondContact CD1-O 3.02Å; I340-I370 HydrophobicContact CD1-CD1 4.46Å; D368-I370 PolarHBondContact O-N 2.86Å; I370-D374 HydrophobicContact CG2-CB 3.68Å; I370-V376 HydrophobicContact CD1-CB 4.41Å; I370-V376 HydrophobicContact CD1-CG1 3.9Å; I370-V376 HydrophobicContact CD1-CG2 4.23Å; I370-V376 HydrophobicContact CG1-CG1 4.08Å; I370-V376 HydrophobicContact CG2-CG1 3.92Å; I370-F409 HydrophobicContact CD1-CB 4.09Å; I370-F409 HydrophobicContact CD1-CD1 3.26Å; I370-F409 HydrophobicContact CD1-CD2 3.7Å; I370-F409 HydrophobicContact CD1-CE1 3.31Å; I370-F409 HydrophobicContact CD1-CE2 3.78Å; I370-F409 HydrophobicContact CD1-CG 3.44Å; I370-F409 VanDerWaalsContact CD1-CG 3.44Å; I370-F409 HydrophobicContact CD1-CZ 3.6Å; I370-F409 HydrophobicContact CG1-CB 4.42Å; I370-F409 HydrophobicContact CG1-CD1 4.38Å; I370-F409 HydrophobicContact CG1-CD2 4.16Å; I370-F409 HydrophobicContact CG1-CE2 4.46Å; I370-F409 HydrophobicContact CG1-CG 4.12Å
371	Q	82.3	Confident	86.8	Confident	99 Å²	99	34 Å²	34	46%	0.463	17%	0.174	S	C	.	.			trans	-107.6	153.5	173.5	-64.9	-59.1	-41.3	0	0	111.4	G373 D374	Q371-G373 PolarHBondContact O-N 2.94Å; Q371-D374 PolarHBondContact N-OD2 3.15Å; Q371-D374 WeakPolarHBondContact O-CB 3.41Å; Q371-D374 PolarHBondContact O-N 2.86Å
372	P	81.1	Confident	86.8	Confident	50 Å²	50	34.5 Å²	34.5	33%	0.325	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	131.1	175.8	27.4	-34.5	0	0	0	110.7
373	G	73.7	Confident	86.8	Confident	32 Å²	32	35.1 Å²	35.1	33%	0.33	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.8	-8.8	-173	0	0	0	0	0	114.7	L276 V277 Q371	L276-G373 WeakPolarHBondContact CD1-O 3.33Å; V277-G373 PolarHBondContact O-N 3.47Å; Q371-G373 PolarHBondContact O-N 2.94Å
374	D	80.2	Confident	86.8	Confident	43 Å²	43	35.1 Å²	35.1	23%	0.23	19%	0.185	C	C	.	.			trans	-72.3	142.2	175.5	-69.3	-17	0	0	0	111.6	L276 V277 I370 Q371 V376	L276-D374 WeakPolarHBondContact CA-O 3.39Å; V277-D374 PolarHBondContact N-O 3.21Å; I370-D374 HydrophobicContact CG2-CB 3.68Å; Q371-D374 PolarHBondContact N-OD2 3.15Å; Q371-D374 WeakPolarHBondContact O-CB 3.41Å; Q371-D374 PolarHBondContact O-N 2.86Å; D374-V376 HydrophobicContact CB-CG1 4.27Å
375	R	81.7	Confident	87	Confident	70 Å²	70	32.7 Å²	32.7	26%	0.264	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.5	166.7	-63.5	-175	-177.2	-152.7	1.4	109.3	G275 L276 E347 E412	G275-R375 WeakPolarHBondContact O-CA 3.29Å; L276-R375 HydrophobicContact CD1-CG 3.99Å; E347-R375 IonicContact OE1-CZ 3.95Å; E347-R375 IonicContact OE1-NH1 3.14Å; E347-R375 PolarHBondContact OE1-NH1 2.88Å; E347-R375 IonicContact OE1-NH2 3.91Å; E347-R375 PolarHBondContact OE1-NH2 2.9Å; R375-E412 HydrophobicContact CB-CB 4.04Å; R375-E412 PolarHBondContact O-N 3.43Å
376	V	87.7	Confident	87.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136.7	-175.4	-64.4	0	0	0	0	111.4	S274 G275 V277 L342 I370 D374 V378 L410 R411	S274-V376 CarbonylContact C-O 3.57Å; S274-V376 WeakPolarHBondContact CA-O 3.5Å; G275-V376 PolarHBondContact N-O 2.69Å; G275-V376 PolarHBondContact O-N 3.32Å; V277-V376 HydrophobicContact CG2-CG2 3.78Å; L342-V376 HydrophobicContact CD1-CG2 3.56Å; I370-V376 HydrophobicContact CD1-CB 4.41Å; I370-V376 HydrophobicContact CD1-CG1 3.9Å; I370-V376 HydrophobicContact CD1-CG2 4.23Å; I370-V376 HydrophobicContact CG1-CG1 4.08Å; I370-V376 HydrophobicContact CG2-CG1 3.92Å; D374-V376 HydrophobicContact CB-CG1 4.27Å; V376-V378 HydrophobicContact CB-CG2 4.24Å; V376-V378 HydrophobicContact CG2-CG2 3.66Å; V376-L410 CarbonylContact C-O 3.52Å; V376-L410 WeakPolarHBondContact CA-O 3.02Å; V376-R411 HydrophobicContact CG1-CG 4.17Å
377	I	89.4	Confident	87.4	Confident	48 Å²	48	35.1 Å²	35.1	25%	0.246	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.2	157.1	-67.2	155	0	0	0	106.3	L410 E412	I377-L410 HydrophobicContact CB-CB 4.27Å; I377-L410 HydrophobicContact CB-CD2 4.49Å; I377-L410 HydrophobicContact CD1-CD2 4.12Å; I377-L410 PolarHBondContact N-O 3.44Å; I377-L410 PolarHBondContact O-N 3.05Å; I377-L410 VanDerWaalsContact O-O 3.12Å; I377-E412 HydrophobicContact CD1-CG 3.59Å; I377-E412 HydrophobicContact CG1-CG 3.75Å; I377-E412 WeakPolarHBondContact CG1-OE1 3.46Å
378	V	91.2	Very high	87.3	Confident	1 Å²	1	39 Å²	39	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.3	-178.8	-168.2	0	0	0	0	108.7	T272 V273 L342 M360 V376 V406 F409	T272-V378 WeakPolarHBondContact CA-O 3.37Å; V273-V378 PolarHBondContact N-O 2.79Å; V273-V378 PolarHBondContact O-N 2.83Å; L342-V378 HydrophobicContact CD2-CG2 4.23Å; M360-V378 HydrophobicContact CE-CB 3.64Å; M360-V378 HydrophobicContact CE-CG1 3.41Å; M360-V378 VanDerWaalsContact CE-CG1 3.41Å; M360-V378 HydrophobicContact CE-CG2 3.93Å; M360-V378 HydrophobicContact SD-CB 4.27Å; M360-V378 HydrophobicContact SD-CG1 4.1Å; M360-V378 HydrophobicContact SD-CG2 3.88Å; V376-V378 HydrophobicContact CB-CG2 4.24Å; V376-V378 HydrophobicContact CG2-CG2 3.66Å; V378-V406 HydrophobicContact CG1-CB 4.16Å; V378-V406 HydrophobicContact CG1-CG1 3.55Å; V378-V406 HydrophobicContact CG1-CG2 3.58Å; V378-F409 HydrophobicContact CB-CD1 4.17Å; V378-F409 HydrophobicContact CB-CE1 4.32Å; V378-F409 HydrophobicContact CG1-CD1 3.59Å; V378-F409 HydrophobicContact CG1-CE1 3.5Å; V378-F409 HydrophobicContact CG2-CD1 3.81Å; V378-F409 HydrophobicContact CG2-CE1 3.91Å
379	T	91.4	Very high	87.1	Confident	1 Å²	1	41 Å²	41	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.4	169.5	82	0	0	0	0	109	P250 F251 T272 L407 H408	P250-T379 PolarHBondContact O-OG1 2.95Å; F251-T379 HydrophobicContact CB-CG2 4.2Å; T272-T379 HydrophobicContact CG2-CG2 3.5Å; T272-T379 VanDerWaalsContact CG2-CG2 3.5Å; T379-L407 PolarHBondContact O-N 2.99Å; T379-H408 PolarHBondContact N-O 3.43Å; T379-H408 PolarHBondContact O-N 3.18Å; T379-H408 WeakPolarHBondContact OG1-CB 3.39Å
380	G	92.2	Very high	87	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	170.8	-174.1	0	0	0	0	0	114	V271 D405	V271-G380 PolarHBondContact N-O 2.91Å; V271-G380 PolarHBondContact O-N 2.82Å; V271-G380 VanDerWaalsContact O-N 3.09Å; G380-D405 CarbonylContact C-O 3.57Å; G380-D405 WeakPolarHBondContact CA-O 3.42Å
381	I	93.1	Very high	86.8	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.1	-179.8	-52.4	176	0	0	0	108.2	L75 P218 K219 Q269 R383 D405 L407	L75-I381 HydrophobicContact CD1-CD1 4.37Å; P218-I381 HydrophobicContact CB-CD1 3.94Å; P218-I381 HydrophobicContact CB-CG1 4.09Å; P218-I381 HydrophobicContact CG-CD1 4Å; P218-I381 HydrophobicContact CG-CG1 3.95Å; P218-I381 HydrophobicContact CG-CG2 4.22Å; K219-I381 HydrophobicContact CG-CD1 4.18Å; Q269-I381 WeakPolarHBondContact O-CA 3.43Å; I381-R383 HydrophobicContact CG2-CG 4.14Å; I381-R383 PolarHBondContact O-N 3.25Å; I381-D405 PolarHBondContact N-O 3.23Å; I381-D405 PolarHBondContact O-N 3.43Å; I381-L407 HydrophobicContact CD1-CD1 4.4Å; I381-L407 HydrophobicContact CG1-CD1 4.02Å
382	Y	93.1	Very high	86.9	Confident	21 Å²	21	50.8 Å²	50.8	8%	0.082	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118	176.8	-173.1	-133.8	0	0	0	110.3	L262 D266 L267 D268 Q269 T402 I404	L262-Y382 HydrophobicContact CB-CE1 4.31Å; L262-Y382 HydrophobicContact CD1-CE2 4.19Å; D266-Y382 HydrophobicContact CB-CD1 4.22Å; L267-Y382 HydrophobicContact CD2-CD1 3.84Å; L267-Y382 HydrophobicContact CD2-CE1 3.91Å; L267-Y382 HydrophobicContact CG-CD1 4.4Å; L267-Y382 HydrophobicContact CG-CE1 4.49Å; D268-Y382 WeakPolarHBondContact CA-O 3.31Å; D268-Y382 PolarHBondContact N-O 2.92Å; Q269-Y382 PolarHBondContact O-N 2.96Å; Y382-T402 HydrophobicContact CE1-CG2 4.46Å; Y382-T402 HydrophobicContact CE2-CG2 4.2Å; Y382-T402 WeakPolarHBondContact OH-CB 3.25Å; Y382-T402 WeakPolarHBondContact OH-CG2 3.34Å; Y382-T402 PolarHBondContact OH-OG1 3.45Å; Y382-T402 VanDerWaalsContact OH-OG1 3.13Å; Y382-I404 HydrophobicContact CD2-CG1 3.91Å
383	R	91.8	Very high	87.2	Confident	13 Å²	13	53.7 Å²	53.7	5%	0.049	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	155.3	-171.9	-66.3	-175.8	-172.9	-109.8	11.4	112	S73 P74 I381 T402 Y403 D405	S73-R383 PolarHBondContact OG-NH2 3.4Å; S73-R383 VanDerWaalsContact OG-NH2 3.14Å; P74-R383 VanDerWaalsContact CD-NH1 3.28Å; I381-R383 HydrophobicContact CG2-CG 4.14Å; I381-R383 PolarHBondContact O-N 3.25Å; R383-T402 CarbonylContact O-C 3.58Å; R383-T402 VanDerWaalsContact O-CA 3.26Å; R383-T402 WeakPolarHBondContact O-CA 3.46Å; R383-Y403 HydrophobicContact CB-CD1 4.23Å; R383-Y403 HydrophobicContact CB-CD2 4.29Å; R383-Y403 HydrophobicContact CB-CE1 3.63Å; R383-Y403 HydrophobicContact CB-CE2 3.75Å; R383-Y403 VanDerWaalsContact CD-OH 3.26Å; R383-Y403 WeakPolarHBondContact CD-OH 3.4Å; R383-Y403 HydrophobicContact CG-CE2 4.3Å; R383-Y403 PolarHBondContact N-O 3.35Å; R383-Y403 PolarHBondContact O-N 2.97Å; R383-Y403 VanDerWaalsContact O-O 3.11Å; R383-D405 HydrophobicContact CG-CB 4.35Å; R383-D405 IonicContact CZ-OD2 3.16Å; R383-D405 VanDerWaalsContact NE-CB 3.33Å; R383-D405 IonicContact NE-OD2 3.22Å; R383-D405 PolarHBondContact NE-OD2 2.82Å; R383-D405 IonicContact NH2-OD2 3.7Å; R383-D405 PolarHBondContact NH2-OD2 2.81Å
384	A	91.7	Very high	87.8	Confident	36 Å²	36	64.1 Å²	64.1	30%	0.298	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.3	177.7	0	0	0	0	0	111.7	L267 Y400 T402	L267-A384 HydrophobicContact CD2-CB 3.85Å; A384-Y400 HydrophobicContact CB-CD1 4.11Å; A384-Y400 HydrophobicContact CB-CG 4.42Å; A384-T402 HydrophobicContact CB-CG2 4.23Å
385	I	90.2	Very high	88.3	Confident	18 Å²	18	65.1 Å²	65.1	9%	0.092	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.7	173.1	-85.6	163.8	0	0	0	110.1	P71 Y400 K401 Y403	P71-I385 HydrophobicContact CG-CD1 4.47Å; P71-I385 HydrophobicContact CG-CG1 4.16Å; I385-Y400 WeakPolarHBondContact O-CA 3.38Å; I385-K401 PolarHBondContact N-O 3.35Å; I385-K401 PolarHBondContact O-N 3.4Å; I385-Y403 HydrophobicContact CB-CE1 4.13Å; I385-Y403 HydrophobicContact CD1-CD1 4.26Å; I385-Y403 HydrophobicContact CD1-CE1 3.4Å; I385-Y403 HydrophobicContact CG1-CE1 3.6Å
386	P	92.2	Very high	88.6	Confident	46 Å²	46	66.4 Å²	66.4	30%	0.299	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	132.7	175.1	28.7	-33.3	0	0	0	111.3	L396 Y400	P386-L396 HydrophobicContact CB-CD1 4.04Å; P386-L396 HydrophobicContact CB-CD2 4.33Å; P386-L396 HydrophobicContact CG-CD1 4.33Å; P386-Y400 HydrophobicContact CB-CD1 3.98Å; P386-Y400 HydrophobicContact CB-CE1 3.64Å; P386-Y400 HydrophobicContact CG-CE1 4.11Å
387	L	87	Confident	88.7	Confident	66 Å²	66	71 Å²	71	35%	0.346	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	139.6	174.1	-66.2	176.6	0	0	0	111.1	K397 K401	L387-K397 HydrophobicContact CB-CB 4.44Å; L387-K397 HydrophobicContact CB-CD 4.19Å; L387-K397 HydrophobicContact CB-CG 4.5Å; L387-K397 WeakPolarHBondContact O-CB 3.26Å; L387-K397 PolarHBondContact O-N 3.1Å; L387-K401 HydrophobicContact CD1-CB 4.11Å; L387-K401 HydrophobicContact CD2-CB 3.91Å; L387-K401 HydrophobicContact CD2-CD 4.15Å; L387-K401 HydrophobicContact CG-CB 3.92Å
388	R	86.3	Confident	88.7	Confident	104 Å²	104	73.4 Å²	73.4	39%	0.392	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	145.5	170.3	-64.2	-179.3	-174.3	168	3.7	110.6	L396	R388-L396 HydrophobicContact CG-CD2 4.01Å
389	M	83.2	Confident	88.7	Confident	125 Å²	125	78.6 Å²	78.6	62%	0.616	39%	0.394	S	S	*	.	S	Bend	trans	-76.7	-37	177.3	-171.5	163.9	68.1	0	0	112.5	T395 K397	M389-T395 PolarHBondContact N-O 3.35Å; M389-K397 HydrophobicContact CB-CG 4.04Å
390	S	83.3	Confident	88.7	Confident	59 Å²	59	84.7 Å²	84.7	41%	0.413	42%	0.417	S	S	.	.	S	Bend	trans	-148.1	137.1	172	174.7	0	0	0	0	108.2	R392 Q393	S390-R392 PolarHBondContact O-N 3.3Å; S390-Q393 PolarHBondContact O-N 2.95Å; S390-Q393 VanDerWaalsContact O-O 3.14Å
391	N	79.6	Confident	88.7	Confident	93 Å²	93	88 Å²	88	50%	0.497	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-13.9	-170.8	-149.1	10.3	0	0	0	114.2	E68	E68-N391 PolarHBondContact OE1-ND2 3.32Å
392	R	85.9	Confident	88.6	Confident	241 Å²	241	90.6 Å²	90.6	91%	0.909	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-18.5	175.8	-67.1	-176.3	176.6	-179.2	-1.8	114.1	S390	S390-R392 PolarHBondContact O-N 3.3Å
393	Q	86.7	Confident	88.7	Confident	110 Å²	110	90.6 Å²	90.6	51%	0.514	45%	0.447	S	S	.	.	S	Bend	trans	-112.6	146.9	-175.5	-70.1	-176.9	-17.7	0	0	110.4	S390 T395	S390-Q393 PolarHBondContact O-N 2.95Å; S390-Q393 VanDerWaalsContact O-O 3.14Å; Q393-T395 WeakPolarHBondContact CB-OG1 3.33Å; Q393-T395 PolarHBondContact O-N 2.98Å; Q393-T395 PolarHBondContact OE1-OG1 2.67Å
394	R	86.5	Confident	88.7	Confident	251 Å²	251	90 Å²	90	95%	0.947	45%	0.446	S	S	*	.			trans	-76.6	4.7	175.9	-63.3	-178	178.3	178.9	-1.3	113.2	L396	R394-L396 PolarHBondContact O-N 3.39Å
395	T	90.5	Very high	88.8	Confident	64 Å²	64	88.5 Å²	88.5	39%	0.393	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-75.7	119	-179.3	43.6	0	0	0	0	111.3	M389 Q393	M389-T395 PolarHBondContact N-O 3.35Å; Q393-T395 WeakPolarHBondContact CB-OG1 3.33Å; Q393-T395 PolarHBondContact O-N 2.98Å; Q393-T395 PolarHBondContact OE1-OG1 2.67Å
396	L	88.6	Confident	89	Confident	97 Å²	97	87.9 Å²	87.9	51%	0.508	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	152.1	176	-56.8	179.4	0	0	0	110.6	P386 R388 R394	P386-L396 HydrophobicContact CB-CD1 4.04Å; P386-L396 HydrophobicContact CB-CD2 4.33Å; P386-L396 HydrophobicContact CG-CD1 4.33Å; R388-L396 HydrophobicContact CG-CD2 4.01Å; R394-L396 PolarHBondContact O-N 3.39Å
397	K	88	Confident	88.9	Confident	98 Å²	98	86.5 Å²	86.5	43%	0.426	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	147.8	165.6	-62.6	-172.7	-177.9	-175.5	0	109.1	L387 M389 V399	L387-K397 HydrophobicContact CB-CB 4.44Å; L387-K397 HydrophobicContact CB-CD 4.19Å; L387-K397 HydrophobicContact CB-CG 4.5Å; L387-K397 WeakPolarHBondContact O-CB 3.26Å; L387-K397 PolarHBondContact O-N 3.1Å; M389-K397 HydrophobicContact CB-CG 4.04Å; K397-V399 VanDerWaalsContact C-N 3.25Å; K397-V399 PolarHBondContact O-N 3.13Å
398	A	89.6	Confident	89	Confident	98 Å²	98	84.3 Å²	84.3	81%	0.81	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	-23.5	173.5	0	0	0	0	0	113.2	Y400	A398-Y400 WeakPolarHBondContact O-CD2 3.24Å
399	V	90.9	Very high	89.1	Confident	110 Å²	110	80.5 Å²	80.5	67%	0.667	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	118	176.2	-176.8	0	0	0	0	109.6	K397	K397-V399 VanDerWaalsContact C-N 3.25Å; K397-V399 PolarHBondContact O-N 3.13Å
400	Y	92.3	Very high	89.2	Confident	128 Å²	128	77.9 Å²	77.9	50%	0.502	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	147.5	173.4	-71.8	-115	0	0	0	110.1	A384 I385 P386 A398	A384-Y400 HydrophobicContact CB-CD1 4.11Å; A384-Y400 HydrophobicContact CB-CG 4.42Å; I385-Y400 WeakPolarHBondContact O-CA 3.38Å; P386-Y400 HydrophobicContact CB-CD1 3.98Å; P386-Y400 HydrophobicContact CB-CE1 3.64Å; P386-Y400 HydrophobicContact CG-CE1 4.11Å; A398-Y400 WeakPolarHBondContact O-CD2 3.24Å
401	K	91.3	Very high	88.8	Confident	69 Å²	69	79 Å²	79	30%	0.3	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.2	170.1	178.5	-174.8	173.3	-163.4	0	108.1	I385 L387	I385-K401 PolarHBondContact N-O 3.35Å; I385-K401 PolarHBondContact O-N 3.4Å; L387-K401 HydrophobicContact CD1-CB 4.11Å; L387-K401 HydrophobicContact CD2-CB 3.91Å; L387-K401 HydrophobicContact CD2-CD 4.15Å; L387-K401 HydrophobicContact CG-CB 3.92Å
402	T	92.6	Very high	88	Confident	55 Å²	55	77.9 Å²	77.9	34%	0.337	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	153.8	176.8	59	0	0	0	0	112	Y382 R383 A384	Y382-T402 HydrophobicContact CE1-CG2 4.46Å; Y382-T402 HydrophobicContact CE2-CG2 4.2Å; Y382-T402 WeakPolarHBondContact OH-CB 3.25Å; Y382-T402 WeakPolarHBondContact OH-CG2 3.34Å; Y382-T402 PolarHBondContact OH-OG1 3.45Å; Y382-T402 VanDerWaalsContact OH-OG1 3.13Å; R383-T402 CarbonylContact O-C 3.58Å; R383-T402 VanDerWaalsContact O-CA 3.26Å; R383-T402 WeakPolarHBondContact O-CA 3.46Å; A384-T402 HydrophobicContact CB-CG2 4.23Å
403	Y	93.9	Very high	86.3	Confident	21 Å²	21	67.6 Å²	67.6	8%	0.082	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	163.7	176.5	65.3	-80	0	0	0	109.3	L359 Y361 R383 I385 D405	L359-Y403 CarbonylContact O-C 3.55Å; L359-Y403 WeakPolarHBondContact O-CA 3.09Å; L359-Y403 WeakPolarHBondContact O-CB 3.46Å; Y361-Y403 AromaticContact CD2-CD2 3.32Å; Y361-Y403 HydrophobicContact CD2-CD2 3.32Å; Y361-Y403 AromaticContact CD2-CE2 3.6Å; Y361-Y403 HydrophobicContact CD2-CE2 3.6Å; Y361-Y403 HydrophobicContact CD2-CG 4.02Å; Y361-Y403 HydrophobicContact CE2-CD1 4.41Å; Y361-Y403 AromaticContact CE2-CD2 3.61Å; Y361-Y403 HydrophobicContact CE2-CD2 3.61Å; Y361-Y403 AromaticContact CE2-CE2 3.94Å; Y361-Y403 HydrophobicContact CE2-CE2 3.94Å; Y361-Y403 AromaticContact CE2-CG 3.85Å; Y361-Y403 HydrophobicContact CE2-CG 3.85Å; Y361-Y403 HydrophobicContact CG-CD2 4.48Å; R383-Y403 HydrophobicContact CB-CD1 4.23Å; R383-Y403 HydrophobicContact CB-CD2 4.29Å; R383-Y403 HydrophobicContact CB-CE1 3.63Å; R383-Y403 HydrophobicContact CB-CE2 3.75Å; R383-Y403 VanDerWaalsContact CD-OH 3.26Å; R383-Y403 WeakPolarHBondContact CD-OH 3.4Å; R383-Y403 HydrophobicContact CG-CE2 4.3Å; R383-Y403 PolarHBondContact N-O 3.35Å; R383-Y403 PolarHBondContact O-N 2.97Å; R383-Y403 VanDerWaalsContact O-O 3.11Å; I385-Y403 HydrophobicContact CB-CE1 4.13Å; I385-Y403 HydrophobicContact CD1-CD1 4.26Å; I385-Y403 HydrophobicContact CD1-CE1 3.4Å; I385-Y403 HydrophobicContact CG1-CE1 3.6Å; Y403-D405 HydrophobicContact CE2-CB 4.36Å
404	I	93.2	Very high	84.5	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.1	174.1	-64	172.5	0	0	0	108.9	V273 V358 L359 M360 Y361 Y382	V273-I404 HydrophobicContact CB-CD1 4.4Å; V273-I404 HydrophobicContact CG2-CD1 3.8Å; V358-I404 HydrophobicContact CG1-CD1 3.88Å; V358-I404 HydrophobicContact CG1-CG1 4.08Å; L359-I404 PolarHBondContact O-N 3.18Å; M360-I404 CarbonylContact C-O 3.55Å; M360-I404 WeakPolarHBondContact CA-O 3.4Å; M360-I404 HydrophobicContact CE-CB 3.61Å; M360-I404 HydrophobicContact CE-CD1 3.81Å; M360-I404 HydrophobicContact CE-CG1 4.26Å; M360-I404 HydrophobicContact CE-CG2 3.59Å; Y361-I404 PolarHBondContact N-O 3.25Å; Y382-I404 HydrophobicContact CD2-CG1 3.91Å
405	D	93.7	Very high	82.6	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.016	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	114.6	171.8	-176.5	22.3	0	0	0	108.5	S73 H363 G380 I381 R383 Y403	S73-D405 PolarHBondContact OG-OD2 2.98Å; H363-D405 IonicContact CE1-OD1 3.01Å; H363-D405 PolarHBondContact CE1-OD1 3.03Å; H363-D405 IonicContact ND1-OD1 3.08Å; H363-D405 PolarHBondContact ND1-OD1 3.01Å; G380-D405 CarbonylContact C-O 3.57Å; G380-D405 WeakPolarHBondContact CA-O 3.42Å; I381-D405 PolarHBondContact N-O 3.23Å; I381-D405 PolarHBondContact O-N 3.43Å; R383-D405 HydrophobicContact CG-CB 4.35Å; R383-D405 IonicContact CZ-OD2 3.16Å; R383-D405 VanDerWaalsContact NE-CB 3.33Å; R383-D405 IonicContact NE-OD2 3.22Å; R383-D405 PolarHBondContact NE-OD2 2.82Å; R383-D405 IonicContact NH2-OD2 3.7Å; R383-D405 PolarHBondContact NH2-OD2 2.81Å; Y403-D405 HydrophobicContact CE2-CB 4.36Å
406	V	93	Very high	80.2	Confident	5 Å²	5	62 Å²	62	3%	0.03	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	134.9	-166.5	-177.3	0	0	0	0	111.9	M360 Y361 L366 V378 F409	M360-V406 HydrophobicContact CB-CG2 3.92Å; M360-V406 HydrophobicContact CE-CG2 4.2Å; Y361-V406 WeakPolarHBondContact O-CG2 3.49Å; Y361-V406 PolarHBondContact O-N 3.1Å; L366-V406 HydrophobicContact CD1-CG1 4.29Å; L366-V406 WeakPolarHBondContact CD1-O 3.48Å; V378-V406 HydrophobicContact CG1-CB 4.16Å; V378-V406 HydrophobicContact CG1-CG1 3.55Å; V378-V406 HydrophobicContact CG1-CG2 3.58Å; V406-F409 HydrophobicContact CB-CE1 4.16Å; V406-F409 HydrophobicContact CB-CE2 4.45Å; V406-F409 HydrophobicContact CB-CZ 3.92Å; V406-F409 HydrophobicContact CG1-CD1 3.78Å; V406-F409 HydrophobicContact CG1-CD2 4.16Å; V406-F409 HydrophobicContact CG1-CE1 3.53Å; V406-F409 HydrophobicContact CG1-CE2 3.89Å; V406-F409 HydrophobicContact CG1-CG 4.11Å; V406-F409 HydrophobicContact CG1-CZ 3.57Å; V406-F409 HydrophobicContact CG2-CE1 3.78Å; V406-F409 HydrophobicContact CG2-CZ 3.75Å
407	L	90.1	Very high	77.8	Confident	17 Å²	17	59.1 Å²	59.1	9%	0.089	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-37	172.9	-61.2	171.6	0	0	0	112.2	L75 I222 R249 P250 L270 L366 T379 I381	L75-L407 HydrophobicContact CD1-CD2 4.02Å; I222-L407 HydrophobicContact CD1-CD1 3.46Å; I222-L407 VanDerWaalsContact CD1-CD1 3.46Å; I222-L407 HydrophobicContact CD1-CD2 4.19Å; I222-L407 HydrophobicContact CD1-CG 4.48Å; R249-L407 WeakPolarHBondContact CD-O 3.12Å; R249-L407 WeakPolarHBondContact CG-O 3.45Å; P250-L407 HydrophobicContact CG-CD1 4.04Å; L270-L407 HydrophobicContact CD1-CD1 3.64Å; L366-L407 WeakPolarHBondContact CD1-O 3.16Å; T379-L407 PolarHBondContact O-N 2.99Å; I381-L407 HydrophobicContact CD1-CD1 4.4Å; I381-L407 HydrophobicContact CG1-CD1 4.02Å
408	H	89.6	Confident	75.2	Confident	21 Å²	21	57.3 Å²	57.3	10%	0.097	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	147.8	178.2	-179.2	98.7	0	0	0	111.7	D197 R249 F251 T379	D197-H408 IonicContact OD1-CE1 3.19Å; D197-H408 PolarHBondContact OD1-CE1 3.43Å; D197-H408 VanDerWaalsContact OD1-CE1 3.27Å; D197-H408 IonicContact OD1-ND1 2.64Å; D197-H408 PolarHBondContact OD1-ND1 3.13Å; R249-H408 HydrophobicContact CB-CB 4.16Å; F251-H408 HydrophobicContact CB-CB 4.41Å; T379-H408 PolarHBondContact N-O 3.43Å; T379-H408 PolarHBondContact O-N 3.18Å; T379-H408 WeakPolarHBondContact OG1-CB 3.39Å
409	F	88.6	Confident	72.7	Confident	24 Å²	24	55.2 Å²	55.2	11%	0.105	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	120.6	174	-68.7	-58.7	0	0	0	109.6	I340 A362 L366 I370 V378 V406	I340-F409 HydrophobicContact CD1-CE2 4.32Å; I340-F409 HydrophobicContact CD1-CZ 3.75Å; A362-F409 HydrophobicContact CB-CE2 3.93Å; A362-F409 HydrophobicContact CB-CZ 4.11Å; L366-F409 HydrophobicContact CB-CD2 4.3Å; L366-F409 HydrophobicContact CB-CE2 4.04Å; L366-F409 HydrophobicContact CD2-CD2 4.14Å; I370-F409 HydrophobicContact CD1-CB 4.09Å; I370-F409 HydrophobicContact CD1-CD1 3.26Å; I370-F409 HydrophobicContact CD1-CD2 3.7Å; I370-F409 HydrophobicContact CD1-CE1 3.31Å; I370-F409 HydrophobicContact CD1-CE2 3.78Å; I370-F409 HydrophobicContact CD1-CG 3.44Å; I370-F409 VanDerWaalsContact CD1-CG 3.44Å; I370-F409 HydrophobicContact CD1-CZ 3.6Å; I370-F409 HydrophobicContact CG1-CB 4.42Å; I370-F409 HydrophobicContact CG1-CD1 4.38Å; I370-F409 HydrophobicContact CG1-CD2 4.16Å; I370-F409 HydrophobicContact CG1-CE2 4.46Å; I370-F409 HydrophobicContact CG1-CG 4.12Å; V378-F409 HydrophobicContact CB-CD1 4.17Å; V378-F409 HydrophobicContact CB-CE1 4.32Å; V378-F409 HydrophobicContact CG1-CD1 3.59Å; V378-F409 HydrophobicContact CG1-CE1 3.5Å; V378-F409 HydrophobicContact CG2-CD1 3.81Å; V378-F409 HydrophobicContact CG2-CE1 3.91Å; V406-F409 HydrophobicContact CB-CE1 4.16Å; V406-F409 HydrophobicContact CB-CE2 4.45Å; V406-F409 HydrophobicContact CB-CZ 3.92Å; V406-F409 HydrophobicContact CG1-CD1 3.78Å; V406-F409 HydrophobicContact CG1-CD2 4.16Å; V406-F409 HydrophobicContact CG1-CE1 3.53Å; V406-F409 HydrophobicContact CG1-CE2 3.89Å; V406-F409 HydrophobicContact CG1-CG 4.11Å; V406-F409 HydrophobicContact CG1-CZ 3.57Å; V406-F409 HydrophobicContact CG2-CE1 3.78Å; V406-F409 HydrophobicContact CG2-CZ 3.75Å
410	L	84.5	Confident	70.1	Confident	70 Å²	70	54 Å²	54	37%	0.366	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	120.5	170.9	178.9	70.3	0	0	0	108.1	V376 I377	V376-L410 CarbonylContact C-O 3.52Å; V376-L410 WeakPolarHBondContact CA-O 3.02Å; I377-L410 HydrophobicContact CB-CB 4.27Å; I377-L410 HydrophobicContact CB-CD2 4.49Å; I377-L410 HydrophobicContact CD1-CD2 4.12Å; I377-L410 PolarHBondContact N-O 3.44Å; I377-L410 PolarHBondContact O-N 3.05Å; I377-L410 VanDerWaalsContact O-O 3.12Å
411	R	76.1	Confident	67.2	Low	82 Å²	82	51 Å²	51	31%	0.309	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	129.5	176.2	-61.6	167.6	172.3	-177.3	-3.2	109.1	K369 V376 G413 D414	K369-R411 PolarHBondContact O-NE 2.67Å; K369-R411 PolarHBondContact O-NH2 3.23Å; V376-R411 HydrophobicContact CG1-CG 4.17Å; R411-G413 PolarHBondContact O-N 2.91Å; R411-D414 WeakPolarHBondContact CD-OD1 3.4Å; R411-D414 PolarHBondContact O-N 3.03Å
412	E	61.3	Low	64.2	Low	70 Å²	70	55.2 Å²	55.2	33%	0.327	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	16.4	177.3	-85.4	-178	174.1	0	0	113.8	S274 R375 I377	S274-E412 WeakPolarHBondContact CB-OE1 3.23Å; R375-E412 HydrophobicContact CB-CB 4.04Å; R375-E412 PolarHBondContact O-N 3.43Å; I377-E412 HydrophobicContact CD1-CG 3.59Å; I377-E412 HydrophobicContact CG1-CG 3.75Å; I377-E412 WeakPolarHBondContact CG1-OE1 3.46Å
413	G	50.4	Low	61.2	Low	25 Å²	25	55.5 Å²	55.5	26%	0.258	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.3	12.1	-178.9	0	0	0	0	0	114.4	R411 D415 R416	R411-G413 PolarHBondContact O-N 2.91Å; G413-D415 VanDerWaalsContact C-N 3.28Å; G413-R416 CarbonylContact O-C 3.59Å; G413-R416 WeakPolarHBondContact O-CA 3.38Å; G413-R416 WeakPolarHBondContact O-CB 3.3Å; G413-R416 PolarHBondContact O-N 3.05Å
414	D	49.1	Very low	58.1	Low	53 Å²	53	60.3 Å²	60.3	28%	0.283	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-26.3	173	-74	-19.1	0	0	0	111.8	R411 R416 Q418	R411-D414 WeakPolarHBondContact CD-OD1 3.4Å; R411-D414 PolarHBondContact O-N 3.03Å; D414-R416 PolarHBondContact O-N 2.97Å; D414-R416 VanDerWaalsContact O-N 3.08Å; D414-Q418 WeakPolarHBondContact OD1-CG 3.23Å; D414-Q418 PolarHBondContact OD1-NE2 2.91Å; D414-Q418 PolarHBondContact OD2-NE2 3.41Å
415	D	46.1	Very low	55	Low	140 Å²	140	67.7 Å²	67.7	75%	0.749	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	3.6	159.3	-93.7	7.8	0	0	0	113.6	G413	G413-D415 VanDerWaalsContact C-N 3.28Å
416	R	40.4	Very low	52.2	Low	113 Å²	113	76.5 Å²	76.5	43%	0.426	42%	0.416	S	S	.	.	S	Bend	trans	-144.3	63.5	-168.6	-55.7	179.9	179.9	170.3	6.1	112.9	G413 D414 P526	G413-R416 CarbonylContact O-C 3.59Å; G413-R416 WeakPolarHBondContact O-CA 3.38Å; G413-R416 WeakPolarHBondContact O-CB 3.3Å; G413-R416 PolarHBondContact O-N 3.05Å; D414-R416 PolarHBondContact O-N 2.97Å; D414-R416 VanDerWaalsContact O-N 3.08Å; R416-P526 HydrophobicContact CB-CB 4.27Å; R416-P526 VanDerWaalsContact O-CB 3.28Å; R416-P526 WeakPolarHBondContact O-CB 3.35Å
417	V	39.3	Very low	49.2	Very low	37 Å²	37	81 Å²	81	22%	0.224	44%	0.44	C	S	.	.			trans	66.3	78.3	161.9	-162.3	0	0	0	0	113.2	N419 P526 A727 M731	V417-N419 HydrophobicContact CG1-CB 4.49Å; V417-N419 PolarHBondContact O-N 3.45Å; V417-P526 HydrophobicContact CB-CG 4.29Å; V417-A727 HydrophobicContact CB-CB 4.15Å; V417-A727 HydrophobicContact CG1-CB 3.66Å; V417-A727 HydrophobicContact CG2-CB 3.68Å; V417-M731 HydrophobicContact CG1-CE 4.22Å
418	Q	32.8	Very low	46.4	Very low	60 Å²	60	84.5 Å²	84.5	28%	0.28	46%	0.462	S	S	.	.			trans	-62.8	101.4	161.4	-72.9	-170.9	-15.8	0	0	109.5	D414 M731	D414-Q418 WeakPolarHBondContact OD1-CG 3.23Å; D414-Q418 PolarHBondContact OD1-NE2 2.91Å; D414-Q418 PolarHBondContact OD2-NE2 3.41Å; Q418-M731 VanDerWaalsContact O-CE 3.29Å; Q418-M731 WeakPolarHBondContact O-CE 3.46Å
419	N	36.7	Very low	43.7	Very low	54 Å²	54	87.5 Å²	87.5	29%	0.289	49%	0.49	S	S	.	.			trans	-124.6	123.9	168	-111.5	40.5	0	0	0	108.8	V417 M731	V417-N419 HydrophobicContact CG1-CB 4.49Å; V417-N419 PolarHBondContact O-N 3.45Å; N419-M731 WeakPolarHBondContact OD1-CE 3.48Å
420	D	36.7	Very low	41.2	Very low	86 Å²	86	89.2 Å²	89.2	46%	0.46	51%	0.505	S	S	.	.			trans	64.5	83.9	164.4	-52.7	-0.4	0	0	0	116.5	R487 N566	D420-R487 IonicContact OD2-NH1 3.65Å; D420-N566 PolarHBondContact OD2-ND2 2.72Å
421	G	30.8	Very low	38.8	Very low	64 Å²	64	90.4 Å²	90.4	66%	0.66	51%	0.509	S	S	*	.			trans	-95.6	115.3	147	0	0	0	0	0	109.1	A423	G421-A423 PolarHBondContact O-N 2.86Å; G421-A423 VanDerWaalsContact O-N 3.17Å
422	I	30.1	Very low	37.1	Very low	158 Å²	158	92.1 Å²	92.1	81%	0.81	52%	0.52	S	S	*	.			trans	-75.3	105.5	-179.4	-62	170.5	0	0	0	109.2
423	A	29.6	Very low	36.1	Very low	61 Å²	61	90.2 Å²	90.2	50%	0.504	52%	0.516	S	S	.	.			trans	-136.8	80.3	174.7	0	0	0	0	0	111.9	G421	G421-A423 PolarHBondContact O-N 2.86Å; G421-A423 VanDerWaalsContact O-N 3.17Å
424	T	28.3	Very low	35.7	Very low	122 Å²	122	93.1 Å²	93.1	75%	0.748	52%	0.523	S	S	*	.			trans	57.4	132.1	160.4	49.1	0	0	0	0	119
425	D	28.5	Very low	35.6	Very low	156 Å²	156	92.2 Å²	92.2	83%	0.834	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	151.8	179.3	-55.7	-67.6	0	0	0	114.7
426	E	33.4	Very low	35.8	Very low	189 Å²	189	88.5 Å²	88.5	88%	0.883	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	-17.7	175.2	-52.8	-157.5	150.5	0	0	119.1
427	N	30.5	Very low	36.2	Very low	100 Å²	100	88.2 Å²	88.2	54%	0.535	50%	0.497	S	S	.	.			trans	-98.1	2.2	-178	-79	-20	0	0	0	116.9	A429 S430	N427-A429 VanDerWaalsContact C-N 3.33Å; N427-A429 PolarHBondContact O-N 2.83Å; N427-A429 VanDerWaalsContact O-N 3.08Å; N427-S430 WeakPolarHBondContact O-CB 3.45Å; N427-S430 PolarHBondContact O-N 3.06Å; N427-S430 PolarHBondContact O-OG 3.42Å
428	T	32	Very low	36.9	Very low	90 Å²	90	91.6 Å²	91.6	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-56.2	-34.3	-160.9	-29.8	0	0	0	0	115.6	S430	T428-S430 VanDerWaalsContact C-N 3.25Å; T428-S430 PolarHBondContact O-N 3.12Å
429	A	32.4	Very low	38.3	Very low	83 Å²	83	89.9 Å²	89.9	69%	0.686	50%	0.502	S	S	*	.	H	α-helix	trans	-69.6	-20.3	-179.7	0	0	0	0	0	114	N427	N427-A429 VanDerWaalsContact C-N 3.33Å; N427-A429 PolarHBondContact O-N 2.83Å; N427-A429 VanDerWaalsContact O-N 3.08Å
430	S	36.3	Very low	39.7	Very low	60 Å²	60	89.4 Å²	89.4	42%	0.42	50%	0.501	S	S	.	.	H	α-helix	trans	-79.9	-40.3	-178	-26.2	0	0	0	0	111.5	N427 T428 A433 H434	N427-S430 WeakPolarHBondContact O-CB 3.45Å; N427-S430 PolarHBondContact O-N 3.06Å; N427-S430 PolarHBondContact O-OG 3.42Å; T428-S430 VanDerWaalsContact C-N 3.25Å; T428-S430 PolarHBondContact O-N 3.12Å; S430-A433 WeakPolarHBondContact O-CB 3.38Å; S430-A433 PolarHBondContact O-N 3.06Å; S430-H434 PolarHBondContact O-CD2 3.14Å; S430-H434 PolarHBondContact O-N 2.83Å
431	E	34.9	Very low	41.5	Very low	96 Å²	96	93.6 Å²	93.6	45%	0.449	52%	0.518	S	S	.	.	H	α-helix	trans	-77.3	-40.2	-172.6	-61.6	-176	155.9	0	0	111.6	A433 H434 I435	E431-A433 PolarHBondContact O-N 3.05Å; E431-H434 PolarHBondContact O-N 2.85Å; E431-H434 VanDerWaalsContact O-N 3.07Å; E431-I435 PolarHBondContact O-N 3.18Å; E431-I435 VanDerWaalsContact O-N 3.11Å
432	E	38.6	Very low	43.7	Very low	117 Å²	117	97.6 Å²	97.6	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-54.7	-40.5	169.1	-69.1	-177.4	172.1	0	0	111.3	L436	E432-L436 WeakPolarHBondContact O-CB 3.4Å; E432-L436 VanDerWaalsContact O-CG 3.28Å; E432-L436 WeakPolarHBondContact O-CG 3.43Å; E432-L436 PolarHBondContact O-N 3.06Å; E432-L436 VanDerWaalsContact O-N 3.14Å
433	A	40.6	Very low	45.8	Very low	30 Å²	30	95.4 Å²	95.4	25%	0.248	50%	0.501	C	S	.	.	H	α-helix	trans	-68.6	-39	176.3	0	0	0	0	0	112.4	S430 E431 R437	S430-A433 WeakPolarHBondContact O-CB 3.38Å; S430-A433 PolarHBondContact O-N 3.06Å; E431-A433 PolarHBondContact O-N 3.05Å; A433-R437 WeakPolarHBondContact O-CB 3.25Å; A433-R437 WeakPolarHBondContact O-CD 3.38Å; A433-R437 WeakPolarHBondContact O-CG 3.39Å; A433-R437 PolarHBondContact O-N 2.97Å
434	H	42.3	Very low	48.2	Very low	86 Å²	86	94.3 Å²	94.3	40%	0.398	49%	0.486	S	S	.	.	H	α-helix	trans	-62.8	-42.7	178.1	-97.5	-88.3	0	0	0	113	S430 E431 R437 Q438	S430-H434 PolarHBondContact O-CD2 3.14Å; S430-H434 PolarHBondContact O-N 2.83Å; E431-H434 PolarHBondContact O-N 2.85Å; E431-H434 VanDerWaalsContact O-N 3.07Å; H434-R437 PolarHBondContact O-N 2.84Å; H434-Q438 PolarHBondContact O-N 2.98Å
435	I	48	Very low	50.9	Low	35 Å²	35	94.9 Å²	94.9	18%	0.179	48%	0.48	C	S	.	.	H	α-helix	trans	-74.2	-37.7	-178.7	-55	159.1	0	0	0	110.5	E431 R437 Q438 M731	E431-I435 PolarHBondContact O-N 3.18Å; E431-I435 VanDerWaalsContact O-N 3.11Å; I435-R437 VanDerWaalsContact C-N 3.3Å; I435-R437 PolarHBondContact O-N 3.43Å; I435-Q438 PolarHBondContact O-N 2.95Å; I435-M731 HydrophobicContact CB-SD 4.49Å; I435-M731 HydrophobicContact CG2-CE 3.49Å; I435-M731 VanDerWaalsContact CG2-CE 3.49Å; I435-M731 HydrophobicContact CG2-SD 3.67Å
436	L	50.3	Low	53.5	Low	62 Å²	62	91.9 Å²	91.9	33%	0.325	46%	0.461	S	S	.	.	H	α-helix	trans	-65.2	-29.7	173.3	-71.2	172.5	0	0	0	113.2	E432 Q438 F439 Y728	E432-L436 WeakPolarHBondContact O-CB 3.4Å; E432-L436 VanDerWaalsContact O-CG 3.28Å; E432-L436 WeakPolarHBondContact O-CG 3.43Å; E432-L436 PolarHBondContact O-N 3.06Å; E432-L436 VanDerWaalsContact O-N 3.14Å; L436-Q438 VanDerWaalsContact C-N 3.33Å; L436-Q438 PolarHBondContact O-N 3.38Å; L436-F439 PolarHBondContact O-N 2.88Å; L436-Y728 HydrophobicContact CD2-CD2 4.14Å; L436-Y728 HydrophobicContact CD2-CE2 4.21Å
437	R	47.7	Very low	55.9	Low	106 Å²	106	82.9 Å²	82.9	40%	0.4	42%	0.419	S	S	.	.	H	α-helix	trans	-71.2	-19.5	175.2	-75.8	168.3	-159.2	173.6	10.1	114.4	N167 T169 A433 H434 I435 F439	N167-R437 PolarHBondContact ND2-O 2.77Å; N167-R437 VanDerWaalsContact ND2-O 3.12Å; T169-R437 PolarHBondContact O-NH1 3.34Å; A433-R437 WeakPolarHBondContact O-CB 3.25Å; A433-R437 WeakPolarHBondContact O-CD 3.38Å; A433-R437 WeakPolarHBondContact O-CG 3.39Å; A433-R437 PolarHBondContact O-N 2.97Å; H434-R437 PolarHBondContact O-N 2.84Å; I435-R437 VanDerWaalsContact C-N 3.3Å; I435-R437 PolarHBondContact O-N 3.43Å; R437-F439 VanDerWaalsContact C-N 3.32Å
438	Q	55.3	Low	58.6	Low	108 Å²	108	81.4 Å²	81.4	51%	0.505	41%	0.409	S	S	.	.	H	α-helix	trans	-73.3	-26.8	176.2	-71.3	-179.8	-7.3	0	0	112.2	H434 I435 L436 T440	H434-Q438 PolarHBondContact O-N 2.98Å; I435-Q438 PolarHBondContact O-N 2.95Å; L436-Q438 VanDerWaalsContact C-N 3.33Å; L436-Q438 PolarHBondContact O-N 3.38Å; Q438-T440 PolarHBondContact O-N 3.39Å
439	F	61.6	Low	61.2	Low	25 Å²	25	80.1 Å²	80.1	11%	0.11	40%	0.401	C	S	.	.	S	Bend	trans	-77.1	122.5	172.1	-60.7	-70.2	0	0	0	109.8	L436 R437 I444 F447 D724 A727	L436-F439 PolarHBondContact O-N 2.88Å; R437-F439 VanDerWaalsContact C-N 3.32Å; F439-I444 HydrophobicContact CB-CD1 4.14Å; F439-I444 HydrophobicContact CB-CG1 4.05Å; F439-F447 HydrophobicContact CD1-CE2 4.22Å; F439-F447 HydrophobicContact CD1-CZ 4.47Å; F439-D724 HydrophobicContact CE1-CB 3.91Å; F439-A727 HydrophobicContact CZ-CB 4.05Å
440	T	66.6	Low	63.7	Low	44 Å²	44	77.2 Å²	77.2	27%	0.27	37%	0.374	S	S	.	.			trans	-61.5	146.7	170.8	57.5	0	0	0	0	110	Q438 E442 R443 I444	Q438-T440 PolarHBondContact O-N 3.39Å; T440-E442 PolarHBondContact O-N 3.5Å; T440-R443 PolarHBondContact O-N 3.27Å; T440-R443 PolarHBondContact OG1-N 3.48Å; T440-I444 PolarHBondContact O-N 2.91Å; T440-I444 VanDerWaalsContact O-N 3.11Å
441	E	73.3	Confident	66	Low	174 Å²	174	75.4 Å²	75.4	81%	0.813	36%	0.362	S	S	*	.	H	α-helix	trans	-57.8	-33.1	177.4	-62.3	-170.2	154.1	0	0	111.3	I444 E445	E441-I444 WeakPolarHBondContact O-CB 3.45Å; E441-I444 PolarHBondContact O-N 3.2Å; E441-E445 PolarHBondContact O-N 2.95Å
442	E	76.8	Confident	68.5	Low	147 Å²	147	80.5 Å²	80.5	69%	0.687	38%	0.378	S	S	*	.	H	α-helix	trans	-57.1	-49.9	171.3	-59.9	175.9	161.1	0	0	112.7	T440 I444 E445 E446	T440-E442 PolarHBondContact O-N 3.5Å; E442-I444 VanDerWaalsContact C-N 3.27Å; E442-I444 PolarHBondContact O-N 2.96Å; E442-E445 PolarHBondContact O-N 3.13Å; E442-E445 VanDerWaalsContact O-N 3.13Å; E442-E446 PolarHBondContact O-N 3.27Å
443	R	74.5	Confident	70.7	Confident	113 Å²	113	79 Å²	79	43%	0.426	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-35.6	175.3	-79.2	-167.1	-166	171.2	18.1	111.8	T440 E445 E446 F447 D724	T440-R443 PolarHBondContact O-N 3.27Å; T440-R443 PolarHBondContact OG1-N 3.48Å; R443-E445 VanDerWaalsContact C-N 3.34Å; R443-E446 WeakPolarHBondContact O-CB 3.16Å; R443-E446 PolarHBondContact O-N 2.95Å; R443-F447 HydrophobicContact CB-CE2 4.24Å; R443-F447 HydrophobicContact CB-CZ 4.01Å; R443-F447 WeakPolarHBondContact O-CD1 3.44Å; R443-F447 VanDerWaalsContact O-CD2 3.25Å; R443-F447 WeakPolarHBondContact O-CD2 3.37Å; R443-F447 WeakPolarHBondContact O-CG 3.4Å; R443-F447 PolarHBondContact O-N 3.35Å; R443-D724 IonicContact CZ-OD2 2.86Å; R443-D724 IonicContact NE-OD2 3.24Å; R443-D724 IonicContact NH1-OD2 3.74Å; R443-D724 PolarHBondContact NH1-OD2 3.42Å
444	I	81	Confident	72.7	Confident	37 Å²	37	83.3 Å²	83.3	19%	0.19	39%	0.394	C	S	.	.	H	α-helix	trans	-65.3	-40.5	175.8	-65.8	171.3	0	0	0	110.3	F439 T440 E441 E442 F447 H448 Y728	F439-I444 HydrophobicContact CB-CD1 4.14Å; F439-I444 HydrophobicContact CB-CG1 4.05Å; T440-I444 PolarHBondContact O-N 2.91Å; T440-I444 VanDerWaalsContact O-N 3.11Å; E441-I444 WeakPolarHBondContact O-CB 3.45Å; E441-I444 PolarHBondContact O-N 3.2Å; E442-I444 VanDerWaalsContact C-N 3.27Å; E442-I444 PolarHBondContact O-N 2.96Å; I444-F447 PolarHBondContact O-N 2.83Å; I444-H448 WeakPolarHBondContact CG2-NE2 3.2Å; I444-H448 PolarHBondContact O-CD2 3.47Å; I444-H448 PolarHBondContact O-N 2.86Å; I444-Y728 HydrophobicContact CD1-CE2 4.32Å; I444-Y728 HydrophobicContact CG1-CE2 4.1Å; I444-Y728 HydrophobicContact CG2-CE2 4.37Å; I444-Y728 WeakPolarHBondContact CG2-OH 3.36Å
445	E	85	Confident	74.8	Confident	134 Å²	134	83.3 Å²	83.3	63%	0.626	40%	0.398	S	S	*	.	H	α-helix	trans	-64.7	-41.5	172.5	-174.5	164.1	-156.6	0	0	112.1	E441 E442 R443 F447 H448 T449	E441-E445 PolarHBondContact O-N 2.95Å; E442-E445 PolarHBondContact O-N 3.13Å; E442-E445 VanDerWaalsContact O-N 3.13Å; R443-E445 VanDerWaalsContact C-N 3.34Å; E445-F447 VanDerWaalsContact C-N 3.32Å; E445-F447 PolarHBondContact O-N 3.13Å; E445-H448 PolarHBondContact O-N 3.27Å; E445-H448 VanDerWaalsContact O-N 3.15Å; E445-T449 HydrophobicContact CG-CG2 4.27Å; E445-T449 WeakPolarHBondContact O-CG2 3.5Å; E445-T449 PolarHBondContact O-N 2.9Å; E445-T449 PolarHBondContact O-OG1 2.98Å
446	E	82.5	Confident	76.6	Confident	93 Å²	93	82 Å²	82	44%	0.435	39%	0.391	S	S	.	.	H	α-helix	trans	-55.9	-44.9	170.7	-71.3	-176.8	176.7	0	0	111.8	E442 R443 H448 T449 L450 L721	E442-E446 PolarHBondContact O-N 3.27Å; R443-E446 WeakPolarHBondContact O-CB 3.16Å; R443-E446 PolarHBondContact O-N 2.95Å; E446-H448 VanDerWaalsContact C-N 3.34Å; E446-H448 PolarHBondContact O-N 3.07Å; E446-T449 WeakPolarHBondContact CA-OG1 3.48Å; E446-T449 PolarHBondContact O-N 2.94Å; E446-T449 PolarHBondContact O-OG1 3Å; E446-L450 WeakPolarHBondContact O-CB 3.19Å; E446-L450 VanDerWaalsContact O-CG 3.3Å; E446-L450 WeakPolarHBondContact O-CG 3.43Å; E446-L450 PolarHBondContact O-N 3.2Å; E446-L721 WeakPolarHBondContact OE2-CD1 3.45Å
447	F	84.4	Confident	78.4	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-61.9	-40.7	176	-56.8	-26.8	0	0	0	112.1	F439 R443 I444 E445 A451 L721 D724 Y725 Y728	F439-F447 HydrophobicContact CD1-CE2 4.22Å; F439-F447 HydrophobicContact CD1-CZ 4.47Å; R443-F447 HydrophobicContact CB-CE2 4.24Å; R443-F447 HydrophobicContact CB-CZ 4.01Å; R443-F447 WeakPolarHBondContact O-CD1 3.44Å; R443-F447 VanDerWaalsContact O-CD2 3.25Å; R443-F447 WeakPolarHBondContact O-CD2 3.37Å; R443-F447 WeakPolarHBondContact O-CG 3.4Å; R443-F447 PolarHBondContact O-N 3.35Å; I444-F447 PolarHBondContact O-N 2.83Å; E445-F447 VanDerWaalsContact C-N 3.32Å; E445-F447 PolarHBondContact O-N 3.13Å; F447-A451 VanDerWaalsContact O-CB 3.24Å; F447-A451 WeakPolarHBondContact O-CB 3.45Å; F447-A451 PolarHBondContact O-N 3.46Å; F447-L721 HydrophobicContact CD1-CD1 4.39Å; F447-L721 HydrophobicContact CE1-CD1 3.74Å; F447-L721 HydrophobicContact CE1-CG 4.36Å; F447-D724 HydrophobicContact CE1-CB 4.07Å; F447-D724 HydrophobicContact CE2-CB 4.49Å; F447-D724 HydrophobicContact CZ-CB 3.54Å; F447-Y725 HydrophobicContact CB-CD2 3.78Å; F447-Y725 HydrophobicContact CB-CE2 4.02Å; F447-Y725 AromaticContact CD1-CD2 3.74Å; F447-Y725 HydrophobicContact CD1-CD2 3.74Å; F447-Y725 HydrophobicContact CD1-CG 4.48Å; F447-Y725 AromaticContact CG-CD2 3.88Å; F447-Y725 HydrophobicContact CG-CD2 3.88Å; F447-Y728 HydrophobicContact CB-CD1 4.39Å; F447-Y728 AromaticContact CD2-CD1 3.81Å; F447-Y728 HydrophobicContact CD2-CD1 3.81Å; F447-Y728 HydrophobicContact CD2-CD2 4.42Å; F447-Y728 HydrophobicContact CD2-CE1 4.34Å; F447-Y728 AromaticContact CD2-CG 3.85Å; F447-Y728 HydrophobicContact CD2-CG 3.85Å; F447-Y728 HydrophobicContact CE2-CG 4.25Å; F447-Y728 HydrophobicContact CG-CD1 4.46Å
448	H	86.7	Confident	80.3	Confident	69 Å²	69	80 Å²	80	32%	0.319	38%	0.383	S	S	.	.	H	α-helix	trans	-71.8	-35.2	177.4	-78.1	-67.4	0	0	0	113.2	I444 E445 E446 A451 R452 Y728 Y733	I444-H448 WeakPolarHBondContact CG2-NE2 3.2Å; I444-H448 PolarHBondContact O-CD2 3.47Å; I444-H448 PolarHBondContact O-N 2.86Å; E445-H448 PolarHBondContact O-N 3.27Å; E445-H448 VanDerWaalsContact O-N 3.15Å; E446-H448 VanDerWaalsContact C-N 3.34Å; E446-H448 PolarHBondContact O-N 3.07Å; H448-A451 PolarHBondContact O-N 3.5Å; H448-R452 WeakPolarHBondContact O-CG 3.49Å; H448-R452 PolarHBondContact O-N 2.92Å; H448-Y728 AromaticContact NE2-CE1 3.78Å; H448-Y728 AromaticContact NE2-CZ 3.44Å; H448-Y728 PolarHBondContact NE2-OH 3.09Å; H448-Y733 AromaticContact CE1-CZ 3.82Å; H448-Y733 PolarHBondContact CE1-OH 3.29Å
449	T	87.2	Confident	81.7	Confident	63 Å²	63	77.8 Å²	77.8	39%	0.387	37%	0.37	S	S	.	.	H	α-helix	trans	-71.5	-34	174.9	59.4	0	0	0	0	112.1	E445 E446	E445-T449 HydrophobicContact CG-CG2 4.27Å; E445-T449 WeakPolarHBondContact O-CG2 3.5Å; E445-T449 PolarHBondContact O-N 2.9Å; E445-T449 PolarHBondContact O-OG1 2.98Å; E446-T449 WeakPolarHBondContact CA-OG1 3.48Å; E446-T449 PolarHBondContact O-N 2.94Å; E446-T449 PolarHBondContact O-OG1 3Å
450	L	84.1	Confident	82.9	Confident	23 Å²	23	76.8 Å²	76.8	12%	0.12	37%	0.366	C	S	.	.	H	α-helix	trans	-65.6	-49.2	168.6	-72.6	171.8	0	0	0	111.2	E446 R452 K453 L456 L721	E446-L450 WeakPolarHBondContact O-CB 3.19Å; E446-L450 VanDerWaalsContact O-CG 3.3Å; E446-L450 WeakPolarHBondContact O-CG 3.43Å; E446-L450 PolarHBondContact O-N 3.2Å; L450-R452 PolarHBondContact O-N 2.98Å; L450-R452 VanDerWaalsContact O-N 3.13Å; L450-K453 HydrophobicContact CD2-CD 4.44Å; L450-K453 WeakPolarHBondContact O-CB 3.22Å; L450-K453 PolarHBondContact O-N 3.07Å; L450-L456 HydrophobicContact CB-CD1 4.29Å; L450-L721 HydrophobicContact CD1-CD2 3.78Å; L450-L721 HydrophobicContact CD1-CG 4.42Å
451	A	85.4	Confident	83.9	Confident	21 Å²	21	74.7 Å²	74.7	17%	0.174	35%	0.354	C	S	.	.	H	α-helix	trans	-58.3	-27.6	-178.1	0	0	0	0	0	114	F447 H448 L784	F447-A451 VanDerWaalsContact O-CB 3.24Å; F447-A451 WeakPolarHBondContact O-CB 3.45Å; F447-A451 PolarHBondContact O-N 3.46Å; H448-A451 PolarHBondContact O-N 3.5Å; A451-L784 HydrophobicContact CB-CB 4.46Å; A451-L784 HydrophobicContact CB-CD1 3.78Å; A451-L784 HydrophobicContact CB-CG 4.02Å
452	R	86.1	Confident	84.3	Confident	204 Å²	204	68.6 Å²	68.6	77%	0.77	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-15	176.3	-73.7	173.7	-173.5	174.7	5.9	114.6	H448 L450	H448-R452 WeakPolarHBondContact O-CG 3.49Å; H448-R452 PolarHBondContact O-N 2.92Å; L450-R452 PolarHBondContact O-N 2.98Å; L450-R452 VanDerWaalsContact O-N 3.13Å
453	K	86.3	Confident	84.4	Confident	85 Å²	85	62.2 Å²	62.2	37%	0.37	31%	0.307	S	S	.	.			trans	-76.9	127.2	-178.3	-66.1	173	-175.5	172.9	0	109.5	L450 D455 L456	L450-K453 HydrophobicContact CD2-CD 4.44Å; L450-K453 WeakPolarHBondContact O-CB 3.22Å; L450-K453 PolarHBondContact O-N 3.07Å; K453-D455 VanDerWaalsContact C-N 3.27Å; K453-D455 PolarHBondContact O-N 3.09Å; K453-L456 VanDerWaalsContact O-CB 3.24Å; K453-L456 WeakPolarHBondContact O-CB 3.36Å; K453-L456 PolarHBondContact O-N 3.03Å
454	P	81.5	Confident	84.7	Confident	120 Å²	120	57 Å²	57	78%	0.779	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-36.6	-179.2	24.3	-32.5	0	0	0	112	L456	P454-L456 PolarHBondContact O-N 3.12Å; P454-L456 VanDerWaalsContact O-N 3.14Å
455	D	86.4	Confident	84.5	Confident	87 Å²	87	55.3 Å²	55.3	47%	0.465	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	9.4	-177.9	-35.2	-32.5	0	0	0	113.3	K453 Y457 E458 R459	K453-D455 VanDerWaalsContact C-N 3.27Å; K453-D455 PolarHBondContact O-N 3.09Å; D455-Y457 VanDerWaalsContact C-N 3.27Å; D455-Y457 PolarHBondContact O-N 3.23Å; D455-E458 PolarHBondContact O-N 3.12Å; D455-R459 WeakPolarHBondContact O-CB 3.18Å; D455-R459 PolarHBondContact O-N 3.16Å
456	L	86.8	Confident	84.2	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-51.7	-45.6	-178.5	177.6	73	0	0	0	112	L450 K453 P454 E458 R459 L460 L782	L450-L456 HydrophobicContact CB-CD1 4.29Å; K453-L456 VanDerWaalsContact O-CB 3.24Å; K453-L456 WeakPolarHBondContact O-CB 3.36Å; K453-L456 PolarHBondContact O-N 3.03Å; P454-L456 PolarHBondContact O-N 3.12Å; P454-L456 VanDerWaalsContact O-N 3.14Å; L456-E458 VanDerWaalsContact C-N 3.32Å; L456-E458 PolarHBondContact O-N 2.9Å; L456-R459 PolarHBondContact O-N 3.31Å; L456-L460 HydrophobicContact CD1-CD1 3.7Å; L456-L460 HydrophobicContact CD1-CD2 4.27Å; L456-L460 HydrophobicContact CD1-CG 3.82Å; L456-L460 HydrophobicContact CD2-CD1 4.46Å; L456-L460 HydrophobicContact CG-CD1 3.79Å; L456-L460 HydrophobicContact CG-CG 4.16Å; L456-L460 WeakPolarHBondContact O-CB 3.4Å; L456-L460 VanDerWaalsContact O-CG 3.24Å; L456-L460 WeakPolarHBondContact O-CG 3.2Å; L456-L460 PolarHBondContact O-N 2.83Å; L456-L782 HydrophobicContact CD2-CD2 3.9Å; L456-L782 HydrophobicContact CG-CD2 4.32Å
457	Y	88.1	Confident	84.1	Confident	23 Å²	23	50.3 Å²	50.3	9%	0.09	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-42.5	-177.1	-175.6	-139.7	0	0	0	112	D455 A461 K476 L479 L782	D455-Y457 VanDerWaalsContact C-N 3.27Å; D455-Y457 PolarHBondContact O-N 3.23Å; Y457-A461 WeakPolarHBondContact O-CB 3.28Å; Y457-A461 PolarHBondContact O-N 3.35Å; Y457-K476 HydrophobicContact CD1-CD 4.38Å; Y457-K476 HydrophobicContact CD1-CG 4.38Å; Y457-K476 HydrophobicContact CD2-CG 4.49Å; Y457-K476 HydrophobicContact CE1-CB 4.29Å; Y457-K476 HydrophobicContact CE1-CD 3.94Å; Y457-K476 HydrophobicContact CE1-CG 3.91Å; Y457-K476 HydrophobicContact CE2-CB 4.03Å; Y457-K476 HydrophobicContact CE2-CG 4.03Å; Y457-L479 HydrophobicContact CD2-CD2 4.04Å; Y457-L479 HydrophobicContact CE2-CD2 4.35Å; Y457-L782 HydrophobicContact CD2-CD1 3.65Å; Y457-L782 HydrophobicContact CD2-CD2 4.38Å; Y457-L782 HydrophobicContact CE2-CD1 4.09Å
458	E	87.6	Confident	84.1	Confident	101 Å²	101	50.9 Å²	50.9	47%	0.472	27%	0.268	S	S	.	.	H	α-helix	trans	-76.7	-39	-179.4	-49.4	-156.2	127.2	0	0	111.3	D455 L456 A461 A462 K476	D455-E458 PolarHBondContact O-N 3.12Å; L456-E458 VanDerWaalsContact C-N 3.32Å; L456-E458 PolarHBondContact O-N 2.9Å; E458-A461 PolarHBondContact O-N 3.12Å; E458-A462 VanDerWaalsContact O-CB 3.3Å; E458-A462 WeakPolarHBondContact O-CB 3.33Å; E458-A462 PolarHBondContact O-N 3.48Å; E458-K476 IonicContact OE1-NZ 3.84Å; E458-K476 PolarHBondContact OE1-NZ 3.23Å
459	R	84.8	Confident	83.8	Confident	62 Å²	62	50.3 Å²	50.3	23%	0.234	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-44.5	177.1	-168.8	177.5	-62.8	-146.3	1.9	112.3	D455 L456 A462 G463 P714 V717	D455-R459 WeakPolarHBondContact O-CB 3.18Å; D455-R459 PolarHBondContact O-N 3.16Å; L456-R459 PolarHBondContact O-N 3.31Å; R459-A462 PolarHBondContact O-N 2.7Å; R459-G463 PolarHBondContact O-N 3.16Å; R459-P714 VanDerWaalsContact CD-O 3.25Å; R459-P714 WeakPolarHBondContact CD-O 3.39Å; R459-P714 PolarHBondContact NE-O 2.94Å; R459-P714 PolarHBondContact NH1-O 3.48Å; R459-V717 HydrophobicContact CG-CG2 3.94Å
460	L	86.6	Confident	83.1	Confident	4 Å²	4	51 Å²	51	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-38.2	174.7	-65.5	-178.9	0	0	0	111.4	L456 G463 I464 L479 V717 L722 Y725 L782	L456-L460 HydrophobicContact CD1-CD1 3.7Å; L456-L460 HydrophobicContact CD1-CD2 4.27Å; L456-L460 HydrophobicContact CD1-CG 3.82Å; L456-L460 HydrophobicContact CD2-CD1 4.46Å; L456-L460 HydrophobicContact CG-CD1 3.79Å; L456-L460 HydrophobicContact CG-CG 4.16Å; L456-L460 WeakPolarHBondContact O-CB 3.4Å; L456-L460 VanDerWaalsContact O-CG 3.24Å; L456-L460 WeakPolarHBondContact O-CG 3.2Å; L456-L460 PolarHBondContact O-N 2.83Å; L460-G463 PolarHBondContact O-N 2.9Å; L460-I464 PolarHBondContact O-N 3.27Å; L460-L479 HydrophobicContact CB-CD1 4.07Å; L460-L479 HydrophobicContact CB-CD2 3.62Å; L460-V717 HydrophobicContact CD2-CG1 4.18Å; L460-V717 HydrophobicContact CD2-CG2 4.3Å; L460-L722 HydrophobicContact CD2-CD1 3.96Å; L460-Y725 HydrophobicContact CD1-CD1 4.44Å; L460-Y725 HydrophobicContact CD1-CE1 4.11Å; L460-L782 HydrophobicContact CD1-CG 4.45Å
461	A	87.6	Confident	83	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-43.2	175.1	0	0	0	0	0	112	Y457 E458 G463 I464 K475 K476 L479	Y457-A461 WeakPolarHBondContact O-CB 3.28Å; Y457-A461 PolarHBondContact O-N 3.35Å; E458-A461 PolarHBondContact O-N 3.12Å; A461-G463 VanDerWaalsContact C-N 3.32Å; A461-G463 PolarHBondContact O-N 3.13Å; A461-I464 PolarHBondContact O-N 2.94Å; A461-K475 HydrophobicContact CB-CB 4.19Å; A461-K475 WeakPolarHBondContact O-CB 3.4Å; A461-K475 VanDerWaalsContact O-CD 3.29Å; A461-K475 WeakPolarHBondContact O-CD 3.34Å; A461-K476 HydrophobicContact CB-CG 3.63Å; A461-L479 HydrophobicContact CB-CD2 4.45Å
462	A	82.1	Confident	83	Confident	45 Å²	45	55.9 Å²	55.9	37%	0.372	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-36.3	175.7	0	0	0	0	0	112.5	E458 R459 I464	E458-A462 VanDerWaalsContact O-CB 3.3Å; E458-A462 WeakPolarHBondContact O-CB 3.33Å; E458-A462 PolarHBondContact O-N 3.48Å; R459-A462 PolarHBondContact O-N 2.7Å; A462-I464 PolarHBondContact O-N 3.33Å
463	G	78.5	Confident	83.2	Confident	14 Å²	14	48.5 Å²	48.5	14%	0.144	26%	0.258	C	S	.	.	H	α-helix	trans	-64.3	-23.8	173.5	0	0	0	0	0	114.2	R459 L460 A461 A465	R459-G463 PolarHBondContact O-N 3.16Å; L460-G463 PolarHBondContact O-N 2.9Å; A461-G463 VanDerWaalsContact C-N 3.32Å; A461-G463 PolarHBondContact O-N 3.13Å; G463-A465 PolarHBondContact O-N 3.43Å
464	I	80.4	Confident	83.4	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.242	C	C	.	.	S	Bend	trans	-75	120.4	171.2	-68.2	172.1	0	0	0	109.6	L460 A461 A462 K475 L479 L482 Y520 L722	L460-I464 PolarHBondContact O-N 3.27Å; A461-I464 PolarHBondContact O-N 2.94Å; A462-I464 PolarHBondContact O-N 3.33Å; I464-K475 WeakPolarHBondContact O-CD 3.49Å; I464-K475 WeakPolarHBondContact O-CE 3.39Å; I464-K475 PolarHBondContact O-NZ 2.73Å; I464-K475 VanDerWaalsContact O-NZ 3.1Å; I464-L479 HydrophobicContact CD1-CB 3.8Å; I464-L479 HydrophobicContact CD1-CD1 3.71Å; I464-L479 HydrophobicContact CD1-CG 4.3Å; I464-L482 HydrophobicContact CD1-CD1 3.77Å; I464-Y520 HydrophobicContact CG2-CD1 4.36Å; I464-Y520 HydrophobicContact CG2-CE1 4.23Å; I464-L722 HydrophobicContact CG1-CD2 4.28Å
465	A	77	Confident	83.9	Confident	2 Å²	2	39.8 Å²	39.8	2%	0.017	21%	0.208	C	C	.	.			trans	51	70.3	177.5	0	0	0	0	0	113	G463 T467 I468 K475 Y520	G463-A465 PolarHBondContact O-N 3.43Å; A465-T467 PolarHBondContact O-N 3.38Å; A465-T467 VanDerWaalsContact O-N 3.12Å; A465-I468 HydrophobicContact CB-CB 4.35Å; A465-I468 HydrophobicContact CB-CD1 3.92Å; A465-I468 HydrophobicContact CB-CG1 4.13Å; A465-I468 PolarHBondContact O-N 3.48Å; A465-K475 PolarHBondContact O-NZ 2.92Å; A465-Y520 HydrophobicContact CB-CD1 3.85Å; A465-Y520 HydrophobicContact CB-CD2 4.25Å; A465-Y520 HydrophobicContact CB-CE1 4.19Å; A465-Y520 HydrophobicContact CB-CG 3.89Å; A465-Y520 VanDerWaalsContact N-CZ 3.34Å
466	P	77.6	Confident	84.1	Confident	59 Å²	59	35.9 Å²	35.9	38%	0.383	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-17.8	178.1	26.9	-35.8	0	0	0	113.1	I468 H663	P466-I468 VanDerWaalsContact C-N 3.26Å; P466-I468 PolarHBondContact O-N 2.59Å; P466-H663 PolarHBondContact O-NE2 2.83Å
467	T	81.7	Confident	84.4	Confident	63 Å²	63	35.5 Å²	35.5	39%	0.387	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.7	173.2	54.9	0	0	0	0	113.8	A465 L667	A465-T467 PolarHBondContact O-N 3.38Å; A465-T467 VanDerWaalsContact O-N 3.12Å; T467-L667 HydrophobicContact CG2-CD1 4.37Å
468	I	84.2	Confident	84.6	Confident	13 Å²	13	34.4 Å²	34.4	7%	0.067	18%	0.181	C	C	.	.	S	Bend	trans	-97.3	117.9	-179.5	-61.3	179	0	0	0	108.7	A465 P466 K475 L517	A465-I468 HydrophobicContact CB-CB 4.35Å; A465-I468 HydrophobicContact CB-CD1 3.92Å; A465-I468 HydrophobicContact CB-CG1 4.13Å; A465-I468 PolarHBondContact O-N 3.48Å; P466-I468 VanDerWaalsContact C-N 3.26Å; P466-I468 PolarHBondContact O-N 2.59Å; I468-K475 PolarHBondContact O-NZ 2.98Å; I468-L517 HydrophobicContact CD1-CB 3.65Å; I468-L517 HydrophobicContact CD1-CD1 4.44Å; I468-L517 HydrophobicContact CD1-CG 4.33Å
469	Y	79.3	Confident	84.8	Confident	56 Å²	56	29.6 Å²	29.6	22%	0.22	16%	0.159	C	C	.	.			trans	-77	142.4	175	-168.7	-116.7	0	0	0	111.2	N471 Y656 R659 L660 H663	Y469-N471 PolarHBondContact O-ND2 2.71Å; Y469-Y656 HydrophobicContact CD1-CE2 4.12Å; Y469-Y656 HydrophobicContact CE1-CE2 4.45Å; Y469-R659 HydrophobicContact CE1-CB 3.59Å; Y469-R659 WeakPolarHBondContact OH-CD 3.46Å; Y469-L660 HydrophobicContact CD1-CB 4.32Å; Y469-H663 HydrophobicContact CD2-CB 4.05Å; Y469-H663 AromaticContact CD2-CG 3.89Å; Y469-H663 HydrophobicContact CG-CB 4.38Å
470	E	74.4	Confident	85.2	Confident	78 Å²	78	26.7 Å²	26.7	36%	0.364	15%	0.148	S	C	.	.	S	Bend	trans	48.4	-155.2	-178.4	-67.4	178.8	-173.8	0	0	112.9	Y656 R659	E470-Y656 HydrophobicContact CB-CE2 4.28Å; E470-Y656 VanDerWaalsContact OE2-CD2 3.31Å; E470-Y656 WeakPolarHBondContact OE2-CD2 3.39Å; E470-Y656 VanDerWaalsContact OE2-CE2 3.26Å; E470-Y656 WeakPolarHBondContact OE2-CE2 3.45Å; E470-R659 IonicContact OE1-NH1 3.71Å
471	N	80.5	Confident	85.5	Confident	51 Å²	51	26.8 Å²	26.8	27%	0.273	15%	0.148	S	C	.	.			trans	63	40.2	-174.6	-56.9	-79.6	0	0	0	115.7	Y469 D473 I474 K475	Y469-N471 PolarHBondContact O-ND2 2.71Å; N471-D473 PolarHBondContact O-N 2.6Å; N471-I474 HydrophobicContact CB-CB 4.46Å; N471-I474 HydrophobicContact CB-CD1 4.19Å; N471-I474 HydrophobicContact CB-CG1 4.38Å; N471-I474 PolarHBondContact O-N 2.96Å; N471-K475 PolarHBondContact O-N 2.79Å
472	E	85.6	Confident	85.6	Confident	96 Å²	96	27.1 Å²	27.1	45%	0.449	15%	0.149	S	C	.	.	H	α-helix	trans	-56.2	-42.7	-179.3	-68.7	-171.2	-168.2	0	0	114.3	I474 K475 K476	E472-I474 PolarHBondContact O-N 3.37Å; E472-K475 CarbonylContact O-C 3.54Å; E472-K475 WeakPolarHBondContact O-CB 3.49Å; E472-K475 PolarHBondContact O-N 2.9Å; E472-K475 VanDerWaalsContact O-N 3.09Å; E472-K476 HydrophobicContact CB-CD 4.35Å; E472-K476 WeakPolarHBondContact O-CB 3.43Å; E472-K476 VanDerWaalsContact O-CG 3.3Å; E472-K476 WeakPolarHBondContact O-CG 3.39Å; E472-K476 PolarHBondContact O-N 2.83Å; E472-K476 IonicContact OE2-NZ 2.83Å; E472-K476 PolarHBondContact OE2-NZ 3.26Å
473	D	89.6	Confident	85.9	Confident	48 Å²	48	25 Å²	25	26%	0.257	13%	0.132	S	C	.	.	H	α-helix	trans	-64.2	-29.4	-177.3	-63	-53.7	0	0	0	112.2	N471 G477 R798 L799	N471-D473 PolarHBondContact O-N 2.6Å; D473-G477 PolarHBondContact O-N 3.08Å; D473-R798 IonicContact OD1-CZ 2.67Å; D473-R798 IonicContact OD1-NH1 2.64Å; D473-R798 PolarHBondContact OD1-NH1 3.26Å; D473-R798 IonicContact OD1-NH2 3.13Å; D473-R798 PolarHBondContact OD1-NH2 3.39Å; D473-L799 HydrophobicContact CB-CD1 4.08Å; D473-L799 WeakPolarHBondContact O-CD1 3.27Å
474	I	91.1	Very high	86.3	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-71.1	-43.6	174.3	-53.6	-173.4	0	0	0	110.2	N471 E472 G477 I478 L506 L517 F646 I648	N471-I474 HydrophobicContact CB-CB 4.46Å; N471-I474 HydrophobicContact CB-CD1 4.19Å; N471-I474 HydrophobicContact CB-CG1 4.38Å; N471-I474 PolarHBondContact O-N 2.96Å; E472-I474 PolarHBondContact O-N 3.37Å; I474-G477 PolarHBondContact O-N 3Å; I474-I478 HydrophobicContact CG2-CD1 3.95Å; I474-I478 WeakPolarHBondContact O-CD1 3.28Å; I474-I478 VanDerWaalsContact O-CG1 3.31Å; I474-I478 WeakPolarHBondContact O-CG1 3.47Å; I474-I478 PolarHBondContact O-N 2.64Å; I474-L506 HydrophobicContact CG2-CD2 3.76Å; I474-L517 HydrophobicContact CG2-CD1 4.03Å; I474-F646 HydrophobicContact CD1-CB 4.09Å; I474-F646 HydrophobicContact CD1-CG 4.44Å; I474-F646 HydrophobicContact CG1-CB 4.12Å; I474-F646 HydrophobicContact CG1-CD1 3.92Å; I474-F646 HydrophobicContact CG1-CD2 4.46Å; I474-F646 HydrophobicContact CG1-CE1 4.43Å; I474-F646 HydrophobicContact CG1-CG 3.93Å; I474-F646 HydrophobicContact CG2-CD2 4.23Å; I474-F646 HydrophobicContact CG2-CG 4.47Å; I474-I648 HydrophobicContact CD1-CD1 3.81Å; I474-I648 HydrophobicContact CD1-CG1 3.37Å
475	K	91.4	Very high	86.3	Confident	17 Å²	17	24.9 Å²	24.9	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-42.2	174.8	-60.4	-178.9	-179.1	-158.1	0	111.5	A461 I464 A465 I468 N471 E472 I478 L479	A461-K475 HydrophobicContact CB-CB 4.19Å; A461-K475 WeakPolarHBondContact O-CB 3.4Å; A461-K475 VanDerWaalsContact O-CD 3.29Å; A461-K475 WeakPolarHBondContact O-CD 3.34Å; I464-K475 WeakPolarHBondContact O-CD 3.49Å; I464-K475 WeakPolarHBondContact O-CE 3.39Å; I464-K475 PolarHBondContact O-NZ 2.73Å; I464-K475 VanDerWaalsContact O-NZ 3.1Å; A465-K475 PolarHBondContact O-NZ 2.92Å; I468-K475 PolarHBondContact O-NZ 2.98Å; N471-K475 PolarHBondContact O-N 2.79Å; E472-K475 CarbonylContact O-C 3.54Å; E472-K475 WeakPolarHBondContact O-CB 3.49Å; E472-K475 PolarHBondContact O-N 2.9Å; E472-K475 VanDerWaalsContact O-N 3.09Å; K475-I478 PolarHBondContact O-N 2.68Å; K475-L479 WeakPolarHBondContact O-CB 3.27Å; K475-L479 PolarHBondContact O-N 3.42Å
476	K	91.8	Very high	86.7	Confident	6 Å²	6	25.2 Å²	25.2	3%	0.026	13%	0.133	C	C	.	.	H	α-helix	trans	-57.8	-43.6	172.1	-77.1	165.2	170.7	159.9	0	110.9	Y457 E458 A461 E472 L479 L480	Y457-K476 HydrophobicContact CD1-CD 4.38Å; Y457-K476 HydrophobicContact CD1-CG 4.38Å; Y457-K476 HydrophobicContact CD2-CG 4.49Å; Y457-K476 HydrophobicContact CE1-CB 4.29Å; Y457-K476 HydrophobicContact CE1-CD 3.94Å; Y457-K476 HydrophobicContact CE1-CG 3.91Å; Y457-K476 HydrophobicContact CE2-CB 4.03Å; Y457-K476 HydrophobicContact CE2-CG 4.03Å; E458-K476 IonicContact OE1-NZ 3.84Å; E458-K476 PolarHBondContact OE1-NZ 3.23Å; A461-K476 HydrophobicContact CB-CG 3.63Å; E472-K476 HydrophobicContact CB-CD 4.35Å; E472-K476 WeakPolarHBondContact O-CB 3.43Å; E472-K476 VanDerWaalsContact O-CG 3.3Å; E472-K476 WeakPolarHBondContact O-CG 3.39Å; E472-K476 PolarHBondContact O-N 2.83Å; E472-K476 IonicContact OE2-NZ 2.83Å; E472-K476 PolarHBondContact OE2-NZ 3.26Å; K476-L479 WeakPolarHBondContact O-CB 3.39Å; K476-L479 PolarHBondContact O-N 3.45Å; K476-L480 WeakPolarHBondContact O-CG 3.43Å; K476-L480 PolarHBondContact O-N 2.78Å
477	G	91.9	Very high	86.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-45	173.4	0	0	0	0	0	114.5	D473 I474 L479 L480 Q481 I504	D473-G477 PolarHBondContact O-N 3.08Å; I474-G477 PolarHBondContact O-N 3Å; G477-L479 VanDerWaalsContact C-N 3.31Å; G477-L479 PolarHBondContact O-N 2.99Å; G477-L480 PolarHBondContact O-N 2.83Å; G477-Q481 PolarHBondContact O-N 3.37Å; G477-I504 WeakPolarHBondContact O-CD1 3.28Å
478	I	92.4	Very high	86.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.2	-37.5	176.7	-67.2	156.1	0	0	0	111.2	I474 K475 L480 Q481 L482 L517 V521	I474-I478 HydrophobicContact CG2-CD1 3.95Å; I474-I478 WeakPolarHBondContact O-CD1 3.28Å; I474-I478 VanDerWaalsContact O-CG1 3.31Å; I474-I478 WeakPolarHBondContact O-CG1 3.47Å; I474-I478 PolarHBondContact O-N 2.64Å; K475-I478 PolarHBondContact O-N 2.68Å; I478-L480 VanDerWaalsContact C-N 3.34Å; I478-L480 PolarHBondContact O-N 3.49Å; I478-Q481 WeakPolarHBondContact O-CB 3.43Å; I478-Q481 PolarHBondContact O-N 2.94Å; I478-Q481 VanDerWaalsContact O-N 3.15Å; I478-L482 HydrophobicContact CG2-CD1 4.24Å; I478-L482 HydrophobicContact CG2-CG 4.49Å; I478-L482 WeakPolarHBondContact O-CG 3.4Å; I478-L482 PolarHBondContact O-N 2.83Å; I478-L517 HydrophobicContact CD1-CD1 3.67Å; I478-L517 HydrophobicContact CD1-CD2 3.51Å; I478-L517 HydrophobicContact CD1-CG 3.82Å; I478-V521 HydrophobicContact CG2-CG2 3.63Å
479	L	92.3	Very high	85.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.8	-45.3	174.2	-173.7	63.2	0	0	0	111.1	Y457 L460 A461 I464 K475 K476 G477 Q481 L482 F483 L782	Y457-L479 HydrophobicContact CD2-CD2 4.04Å; Y457-L479 HydrophobicContact CE2-CD2 4.35Å; L460-L479 HydrophobicContact CB-CD1 4.07Å; L460-L479 HydrophobicContact CB-CD2 3.62Å; A461-L479 HydrophobicContact CB-CD2 4.45Å; I464-L479 HydrophobicContact CD1-CB 3.8Å; I464-L479 HydrophobicContact CD1-CD1 3.71Å; I464-L479 HydrophobicContact CD1-CG 4.3Å; K475-L479 WeakPolarHBondContact O-CB 3.27Å; K475-L479 PolarHBondContact O-N 3.42Å; K476-L479 WeakPolarHBondContact O-CB 3.39Å; K476-L479 PolarHBondContact O-N 3.45Å; G477-L479 VanDerWaalsContact C-N 3.31Å; G477-L479 PolarHBondContact O-N 2.99Å; L479-Q481 VanDerWaalsContact C-N 3.34Å; L479-Q481 PolarHBondContact O-N 3.03Å; L479-L482 WeakPolarHBondContact O-CB 3.48Å; L479-L482 PolarHBondContact O-N 3.26Å; L479-F483 HydrophobicContact CD1-CD2 4.43Å; L479-F483 HydrophobicContact CD1-CE2 3.74Å; L479-F483 HydrophobicContact CG-CD2 4.39Å; L479-F483 HydrophobicContact CG-CE2 3.95Å; L479-F483 WeakPolarHBondContact O-CD2 3.49Å; L479-F483 PolarHBondContact O-N 3.4Å; L479-L782 HydrophobicContact CD2-CD1 3.53Å; L479-L782 HydrophobicContact CG-CD1 3.79Å
480	L	93.1	Very high	85.5	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-37.5	173.8	-63.9	176.7	0	0	0	112.5	K476 G477 I478 L482 F483 G484 I502 L775 A778 H779 L799	K476-L480 WeakPolarHBondContact O-CG 3.43Å; K476-L480 PolarHBondContact O-N 2.78Å; G477-L480 PolarHBondContact O-N 2.83Å; I478-L480 VanDerWaalsContact C-N 3.34Å; I478-L480 PolarHBondContact O-N 3.49Å; L480-L482 VanDerWaalsContact C-N 3.34Å; L480-L482 PolarHBondContact O-N 2.93Å; L480-F483 PolarHBondContact O-N 3.49Å; L480-G484 PolarHBondContact O-N 2.91Å; L480-I502 HydrophobicContact CB-CD1 4.38Å; L480-L775 HydrophobicContact CB-CD2 4.31Å; L480-L775 HydrophobicContact CD1-CD2 3.82Å; L480-A778 HydrophobicContact CB-CB 4.15Å; L480-A778 HydrophobicContact CD2-CB 4.04Å; L480-H779 HydrophobicContact CD2-CB 3.83Å; L480-L799 HydrophobicContact CD1-CD2 3.69Å
481	Q	92.9	Very high	85.3	Confident	6 Å²	6	33.6 Å²	33.6	3%	0.028	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-38.5	173.2	-176.5	177.2	3.5	0	0	112.3	G477 I478 L479 F483 G484 I504 I568 S610 I611	G477-Q481 PolarHBondContact O-N 3.37Å; I478-Q481 WeakPolarHBondContact O-CB 3.43Å; I478-Q481 PolarHBondContact O-N 2.94Å; I478-Q481 VanDerWaalsContact O-N 3.15Å; L479-Q481 VanDerWaalsContact C-N 3.34Å; L479-Q481 PolarHBondContact O-N 3.03Å; Q481-F483 PolarHBondContact O-N 3.45Å; Q481-G484 PolarHBondContact O-N 3Å; Q481-I504 HydrophobicContact CB-CD1 3.85Å; Q481-I504 HydrophobicContact CB-CG1 4.47Å; Q481-I568 HydrophobicContact CG-CD1 4.03Å; Q481-S610 PolarHBondContact NE2-OG 2.86Å; Q481-S610 VanDerWaalsContact NE2-OG 3.09Å; Q481-I611 PolarHBondContact NE2-O 2.8Å
482	L	90	Very high	84.9	Confident	7 Å²	7	36 Å²	36	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-37.6	177.8	-72.4	164	0	0	0	112.4	I464 I478 L479 L480 L524 T525 I568 I726 K730	I464-L482 HydrophobicContact CD1-CD1 3.77Å; I478-L482 HydrophobicContact CG2-CD1 4.24Å; I478-L482 HydrophobicContact CG2-CG 4.49Å; I478-L482 WeakPolarHBondContact O-CG 3.4Å; I478-L482 PolarHBondContact O-N 2.83Å; L479-L482 WeakPolarHBondContact O-CB 3.48Å; L479-L482 PolarHBondContact O-N 3.26Å; L480-L482 VanDerWaalsContact C-N 3.34Å; L480-L482 PolarHBondContact O-N 2.93Å; L482-L524 HydrophobicContact CD1-CD2 3.54Å; L482-L524 HydrophobicContact CD2-CD2 4.16Å; L482-T525 HydrophobicContact CD2-CG2 3.48Å; L482-T525 VanDerWaalsContact CD2-CG2 3.48Å; L482-I568 HydrophobicContact CD2-CD1 3.82Å; L482-I568 HydrophobicContact CG-CD1 4.44Å; L482-I726 HydrophobicContact CB-CD1 4.11Å; L482-I726 HydrophobicContact CD1-CD1 4.37Å; L482-K730 WeakPolarHBondContact O-CE 3.14Å; L482-K730 PolarHBondContact O-NZ 2.68Å
483	F	88.6	Confident	84.4	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-76.6	-45.3	173.7	-70.8	-73.7	0	0	0	113	L479 L480 Q481 Y725 I726 A729 K730 L782	L479-F483 HydrophobicContact CD1-CD2 4.43Å; L479-F483 HydrophobicContact CD1-CE2 3.74Å; L479-F483 HydrophobicContact CG-CD2 4.39Å; L479-F483 HydrophobicContact CG-CE2 3.95Å; L479-F483 WeakPolarHBondContact O-CD2 3.49Å; L479-F483 PolarHBondContact O-N 3.4Å; L480-F483 PolarHBondContact O-N 3.49Å; Q481-F483 PolarHBondContact O-N 3.45Å; F483-Y725 AromaticContact CE1-CD1 4Å; F483-Y725 HydrophobicContact CE1-CD1 4Å; F483-Y725 HydrophobicContact CE1-CE1 4.04Å; F483-Y725 AromaticContact CZ-CD1 3.77Å; F483-Y725 HydrophobicContact CZ-CD1 3.77Å; F483-Y725 AromaticContact CZ-CE1 3.73Å; F483-Y725 HydrophobicContact CZ-CE1 3.73Å; F483-I726 HydrophobicContact CD1-CG1 4.34Å; F483-I726 HydrophobicContact CD1-CG2 4.49Å; F483-I726 HydrophobicContact CE1-CB 4.31Å; F483-I726 HydrophobicContact CE1-CG1 3.84Å; F483-I726 HydrophobicContact CZ-CG1 3.92Å; F483-A729 HydrophobicContact CD1-CB 3.75Å; F483-A729 HydrophobicContact CE1-CB 3.57Å; F483-K730 WeakPolarHBondContact O-CE 3.47Å; F483-L782 HydrophobicContact CD2-CB 3.98Å; F483-L782 HydrophobicContact CD2-CD1 4.14Å; F483-L782 HydrophobicContact CD2-CG 4.32Å; F483-L782 HydrophobicContact CE2-CB 3.83Å; F483-L782 HydrophobicContact CE2-CD1 3.72Å; F483-L782 HydrophobicContact CE2-CG 3.74Å; F483-L782 HydrophobicContact CZ-CB 4.29Å; F483-L782 HydrophobicContact CZ-CG 4.23Å
484	G	85.6	Confident	83.4	Confident	9 Å²	9	40.7 Å²	40.7	9%	0.093	23%	0.234	C	C	.	.			trans	70	160.3	-178.5	0	0	0	0	0	115.1	L480 Q481 R781	L480-G484 PolarHBondContact O-N 2.91Å; Q481-G484 PolarHBondContact O-N 3Å; G484-R781 WeakPolarHBondContact O-CD 3.46Å; G484-R781 PolarHBondContact O-NH1 3.17Å
485	G	81.3	Confident	82.3	Confident	4 Å²	4	48.9 Å²	48.9	4%	0.041	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-75.1	169.7	177.2	0	0	0	0	0	113.5	S500 R781	G485-S500 VanDerWaalsContact CA-O 3.28Å; G485-S500 WeakPolarHBondContact CA-O 3.22Å; G485-S500 PolarHBondContact N-O 3.22Å; G485-R781 PolarHBondContact O-NH1 2.82Å
486	T	84.6	Confident	81.2	Confident	10 Å²	10	50.7 Å²	50.7	6%	0.061	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-75.6	143.8	-179.5	62.9	0	0	0	0	112	K488 S500 F734 P735 E777	T486-K488 WeakPolarHBondContact OG1-CE 3.12Å; T486-S500 WeakPolarHBondContact O-CB 3.01Å; T486-F734 HydrophobicContact CG2-CB 4.44Å; T486-P735 VanDerWaalsContact CG2-CD 3.45Å; T486-P735 HydrophobicContact CG2-CG 3.8Å; T486-E777 WeakPolarHBondContact CB-OE2 3.28Å; T486-E777 PolarHBondContact N-OE2 3.23Å; T486-E777 PolarHBondContact OG1-OE2 3.47Å
487	R	81.4	Confident	80.3	Confident	85 Å²	85	55 Å²	55	32%	0.321	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-77.5	133.6	165.7	-70	-175.1	172.4	165.6	2	108.2	D420 E501 N566	D420-R487 IonicContact OD2-NH1 3.65Å; R487-E501 IonicContact NH2-OE1 2.98Å; R487-E501 PolarHBondContact NH2-OE1 2.74Å; R487-N566 VanDerWaalsContact CZ-OD1 3.27Å; R487-N566 PolarHBondContact NH1-OD1 2.95Å; R487-N566 PolarHBondContact NH2-OD1 3.47Å
488	K	76.5	Confident	79.7	Confident	68 Å²	68	59.3 Å²	59.3	30%	0.296	33%	0.33	S	S	.	.			trans	-135.3	101.5	-176.3	-64.5	-174.5	-169.5	175.2	0	109.3	T486 F490 E777	T486-K488 WeakPolarHBondContact OG1-CE 3.12Å; K488-F490 HydrophobicContact CB-CD2 4.13Å; K488-F490 HydrophobicContact CB-CE2 3.61Å; K488-F490 HydrophobicContact CB-CZ 4.3Å; K488-F490 HydrophobicContact CD-CE2 4.24Å; K488-F490 HydrophobicContact CD-CZ 4.39Å; K488-F490 VanDerWaalsContact O-CD2 3.27Å; K488-F490 WeakPolarHBondContact O-CD2 3.25Å; K488-F490 PolarHBondContact O-N 2.69Å; K488-E777 VanDerWaalsContact CE-OE1 3.22Å; K488-E777 WeakPolarHBondContact CE-OE1 3.49Å; K488-E777 IonicContact NZ-OE1 3.06Å; K488-E777 PolarHBondContact NZ-OE1 3.02Å
489	D	69	Low	79.5	Confident	114 Å²	114	60 Å²	60	61%	0.61	33%	0.333	S	S	*	.			trans	-85.7	102.8	-173.8	-56.4	-11.7	0	0	0	108.5	T491	D489-T491 HydrophobicContact CB-CG2 4.49Å; D489-T491 PolarHBondContact O-N 3.29Å
490	F	71	Confident	79.2	Confident	75 Å²	75	60.4 Å²	60.4	33%	0.329	34%	0.336	S	S	.	.			trans	-91	22.8	178.6	-72	-79.3	0	0	0	112.8	K488 A492 K493 G494 R495 F498	K488-F490 HydrophobicContact CB-CD2 4.13Å; K488-F490 HydrophobicContact CB-CE2 3.61Å; K488-F490 HydrophobicContact CB-CZ 4.3Å; K488-F490 HydrophobicContact CD-CE2 4.24Å; K488-F490 HydrophobicContact CD-CZ 4.39Å; K488-F490 VanDerWaalsContact O-CD2 3.27Å; K488-F490 WeakPolarHBondContact O-CD2 3.25Å; K488-F490 PolarHBondContact O-N 2.69Å; F490-A492 PolarHBondContact O-N 3.26Å; F490-K493 HydrophobicContact CD1-CD 4.48Å; F490-K493 WeakPolarHBondContact O-CA 3.41Å; F490-K493 PolarHBondContact O-N 3.25Å; F490-G494 PolarHBondContact O-N 2.82Å; F490-R495 CarbonylContact C-O 3.6Å; F490-R495 VanDerWaalsContact C-O 3.31Å; F490-R495 HydrophobicContact CB-CB 4.35Å; F490-F498 AromaticContact CD2-CD2 3.54Å; F490-F498 HydrophobicContact CD2-CD2 3.54Å; F490-F498 AromaticContact CD2-CE2 3.82Å; F490-F498 HydrophobicContact CD2-CE2 3.82Å; F490-F498 AromaticContact CE2-CD2 3.99Å; F490-F498 HydrophobicContact CE2-CD2 3.99Å; F490-F498 HydrophobicContact CE2-CE2 4.29Å; F490-F498 HydrophobicContact CG-CD2 4.47Å; F490-F498 HydrophobicContact CG-CE2 4.42Å
491	T	71.1	Confident	79	Confident	103 Å²	103	61.1 Å²	61.1	63%	0.632	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-49.7	-41.8	178.2	53.9	0	0	0	0	112.1	D489 K493 G494	D489-T491 HydrophobicContact CB-CG2 4.49Å; D489-T491 PolarHBondContact O-N 3.29Å; T491-K493 PolarHBondContact O-N 2.94Å; T491-G494 PolarHBondContact O-N 2.74Å
492	A	72.4	Confident	79	Confident	102 Å²	102	60.9 Å²	60.9	84%	0.843	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-59.5	-14	174.9	0	0	0	0	0	115.4	F490	F490-A492 PolarHBondContact O-N 3.26Å
493	K	74.7	Confident	79.2	Confident	169 Å²	169	60.6 Å²	60.6	74%	0.735	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-113.3	8.5	176	-66.1	-173.8	179	178.8	0	113.3	F490 T491 R495	F490-K493 HydrophobicContact CD1-CD 4.48Å; F490-K493 WeakPolarHBondContact O-CA 3.41Å; F490-K493 PolarHBondContact O-N 3.25Å; T491-K493 PolarHBondContact O-N 2.94Å; K493-R495 PolarHBondContact O-N 3.41Å; K493-R495 VanDerWaalsContact O-N 3.12Å
494	G	67.6	Low	79.5	Confident	73 Å²	73	60.6 Å²	60.6	75%	0.753	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	14.8	-178.8	0	0	0	0	0	114.5	F490 T491	F490-G494 PolarHBondContact O-N 2.82Å; T491-G494 PolarHBondContact O-N 2.74Å
495	R	68.3	Low	79.8	Confident	176 Å²	176	60.1 Å²	60.1	66%	0.664	33%	0.332	S	S	*	.			trans	-97.4	131.6	167.5	-82.9	-174.2	167.3	152.9	-1	108	F490 K493 F498	F490-R495 CarbonylContact C-O 3.6Å; F490-R495 VanDerWaalsContact C-O 3.31Å; F490-R495 HydrophobicContact CB-CB 4.35Å; K493-R495 PolarHBondContact O-N 3.41Å; K493-R495 VanDerWaalsContact O-N 3.12Å; R495-F498 HydrophobicContact CB-CE2 4.41Å
496	G	68.4	Low	80.3	Confident	56 Å²	56	60 Å²	60	58%	0.577	33%	0.33	S	S	*	.			trans	-66.4	177.1	176.9	0	0	0	0	0	113	F498	G496-F498 PolarHBondContact O-N 2.81Å
497	D	72.4	Confident	80.5	Confident	96 Å²	96	59.6 Å²	59.6	51%	0.513	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-59.2	129.8	-172.7	-54.4	-7.4	0	0	0	111.4	R608	D497-R608 IonicContact OD2-NH2 3.22Å
498	F	81	Confident	80.8	Confident	90 Å²	90	55.6 Å²	55.6	40%	0.395	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-84.8	127.2	171.8	-80.8	-100	0	0	0	109.5	F490 R495 G496 S500	F490-F498 AromaticContact CD2-CD2 3.54Å; F490-F498 HydrophobicContact CD2-CD2 3.54Å; F490-F498 AromaticContact CD2-CE2 3.82Å; F490-F498 HydrophobicContact CD2-CE2 3.82Å; F490-F498 AromaticContact CE2-CD2 3.99Å; F490-F498 HydrophobicContact CE2-CD2 3.99Å; F490-F498 HydrophobicContact CE2-CE2 4.29Å; F490-F498 HydrophobicContact CG-CD2 4.47Å; F490-F498 HydrophobicContact CG-CE2 4.42Å; R495-F498 HydrophobicContact CB-CE2 4.41Å; G496-F498 PolarHBondContact O-N 2.81Å; F498-S500 PolarHBondContact O-N 3.14Å
499	R	87.3	Confident	81.3	Confident	16 Å²	16	53.1 Å²	53.1	6%	0.06	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-51.2	124.4	172.8	169.1	173.3	164.1	-132.1	-26.7	111.1	E501 N503 M589 Q592 R641 D643 R774	R499-E501 PolarHBondContact NE-O 2.8Å; R499-E501 PolarHBondContact NH2-O 3.34Å; R499-N503 PolarHBondContact NH1-ND2 3.02Å; R499-N503 PolarHBondContact NH2-ND2 3.38Å; R499-M589 WeakPolarHBondContact CD-O 3.39Å; R499-M589 PolarHBondContact NE-O 3.4Å; R499-M589 PolarHBondContact NH1-O 2.83Å; R499-Q592 HydrophobicContact CB-CG 4.27Å; R499-Q592 HydrophobicContact CG-CG 4.1Å; R499-R641 PolarHBondContact NH1-O 2.72Å; R499-D643 IonicContact CZ-OD2 3.99Å; R499-D643 IonicContact NH2-OD2 2.79Å; R499-D643 PolarHBondContact NH2-OD2 2.95Å; R499-R774 PolarHBondContact O-NE 2.92Å; R499-R774 PolarHBondContact O-NH2 3.27Å; R499-R774 VanDerWaalsContact O-NH2 3.12Å
500	S	85.6	Confident	82.2	Confident	7 Å²	7	51.1 Å²	51.1	5%	0.049	30%	0.296	C	S	.	.			trans	-103.1	-20	-179.8	65	0	0	0	0	114	G485 T486 F498	G485-S500 VanDerWaalsContact CA-O 3.28Å; G485-S500 WeakPolarHBondContact CA-O 3.22Å; G485-S500 PolarHBondContact N-O 3.22Å; T486-S500 WeakPolarHBondContact O-CB 3.01Å; F498-S500 PolarHBondContact O-N 3.14Å
501	E	90.3	Very high	82.8	Confident	17 Å²	17	51.5 Å²	51.5	8%	0.079	32%	0.321	C	S	.	.			trans	-82.3	145.5	-175.7	-75.5	136.5	-132.3	0	0	113.2	R487 R499 Q592 R608 T609 S610	R487-E501 IonicContact NH2-OE1 2.98Å; R487-E501 PolarHBondContact NH2-OE1 2.74Å; R499-E501 PolarHBondContact NE-O 2.8Å; R499-E501 PolarHBondContact NH2-O 3.34Å; E501-Q592 PolarHBondContact OE1-NE2 3.07Å; E501-Q592 PolarHBondContact OE2-NE2 2.85Å; E501-R608 VanDerWaalsContact OE2-O 3.13Å; E501-T609 WeakPolarHBondContact OE2-CA 3.5Å; E501-T609 PolarHBondContact OE2-N 2.89Å; E501-S610 PolarHBondContact OE2-N 3.07Å
502	I	92.7	Very high	83.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	30%	0.298	C	S	.	.			trans	-96.1	127.7	-178.1	-61	161.6	0	0	0	108.5	L480 I504 S610 D643 R774 L775 A778	L480-I502 HydrophobicContact CB-CD1 4.38Å; I502-I504 HydrophobicContact CG2-CD1 4.47Å; I502-I504 HydrophobicContact CG2-CG1 4.1Å; I502-S610 WeakPolarHBondContact O-CB 3.38Å; I502-D643 HydrophobicContact CG2-CB 4.12Å; I502-R774 HydrophobicContact CG1-CB 4.05Å; I502-L775 HydrophobicContact CD1-CD2 3.95Å; I502-L775 HydrophobicContact CG2-CD2 4.17Å; I502-A778 HydrophobicContact CD1-CB 3.81Å
503	N	94.2	Very high	84.1	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	28%	0.275	C	S	.	.			trans	-106	129.7	177.2	-72.1	-15.4	0	0	0	110.2	R499 M589 I611 F642 D643 L644	R499-N503 PolarHBondContact NH1-ND2 3.02Å; R499-N503 PolarHBondContact NH2-ND2 3.38Å; N503-M589 HydrophobicContact CB-CE 4.05Å; N503-M589 WeakPolarHBondContact ND2-CE 3.42Å; N503-I611 WeakPolarHBondContact CA-O 3.49Å; N503-I611 PolarHBondContact OD1-N 3.39Å; N503-F642 HydrophobicContact CB-CD1 3.94Å; N503-F642 HydrophobicContact CB-CE1 4.49Å; N503-D643 PolarHBondContact N-OD2 2.9Å; N503-D643 PolarHBondContact O-N 3.14Å; N503-L644 PolarHBondContact O-N 3.24Å
504	I	93.7	Very high	84.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.2	-174.8	-57.3	-170.1	0	0	0	110.3	G477 Q481 I502 L506 I611 L612 A613 L644 F646	G477-I504 WeakPolarHBondContact O-CD1 3.28Å; Q481-I504 HydrophobicContact CB-CD1 3.85Å; Q481-I504 HydrophobicContact CB-CG1 4.47Å; I502-I504 HydrophobicContact CG2-CD1 4.47Å; I502-I504 HydrophobicContact CG2-CG1 4.1Å; I504-L506 HydrophobicContact CG2-CD2 4.01Å; I504-I611 PolarHBondContact N-O 2.87Å; I504-L612 HydrophobicContact CB-CD1 3.76Å; I504-L612 HydrophobicContact CG2-CD1 3.85Å; I504-A613 PolarHBondContact O-N 2.89Å; I504-L644 WeakPolarHBondContact CA-O 3.44Å; I504-L644 HydrophobicContact CD1-CD1 4.12Å; I504-L644 HydrophobicContact CG1-CB 4.29Å; I504-L644 HydrophobicContact CG1-CD1 4.45Å; I504-F646 HydrophobicContact CD1-CE2 4.44Å; I504-F646 HydrophobicContact CG2-CD2 3.74Å; I504-F646 HydrophobicContact CG2-CE2 3.87Å
505	L	92.7	Very high	85.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.9	173	-179.9	63.6	0	0	0	110.1	A613 A615 L634 L639 F642 L644 I645 F646	L505-A613 CarbonylContact C-O 3.57Å; L505-A613 HydrophobicContact CD1-CB 3.71Å; L505-A615 HydrophobicContact CD1-CB 4.08Å; L505-L634 HydrophobicContact CD2-CD1 4.2Å; L505-L639 HydrophobicContact CD2-CD2 4.01Å; L505-F642 HydrophobicContact CB-CB 4.38Å; L505-F642 HydrophobicContact CB-CD1 3.8Å; L505-F642 HydrophobicContact CB-CD2 4.19Å; L505-F642 HydrophobicContact CB-CE1 4.06Å; L505-F642 HydrophobicContact CB-CE2 4.42Å; L505-F642 HydrophobicContact CB-CG 3.87Å; L505-F642 HydrophobicContact CB-CZ 4.36Å; L505-F642 HydrophobicContact CD1-CZ 4.34Å; L505-F642 HydrophobicContact CD2-CD2 4.1Å; L505-F642 HydrophobicContact CD2-CE2 4.14Å; L505-L644 PolarHBondContact N-O 3.45Å; L505-I645 HydrophobicContact CB-CG1 4.32Å; L505-I645 HydrophobicContact CB-CG2 4.46Å; L505-I645 HydrophobicContact CD2-CG1 4.48Å; L505-I645 HydrophobicContact CD2-CG2 4.19Å; L505-I645 HydrophobicContact CG-CG2 4.45Å; L505-I645 CarbonylContact O-C 3.59Å; L505-I645 WeakPolarHBondContact O-CA 3.47Å; L505-F646 PolarHBondContact O-N 2.99Å
506	L	92.1	Very high	86.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	103.6	175.6	-54.4	-178.4	0	0	0	109.3	I474 I504 K514 L517 L612 A613 A614 A615 F646 I648	I474-L506 HydrophobicContact CG2-CD2 3.76Å; I504-L506 HydrophobicContact CG2-CD2 4.01Å; L506-K514 HydrophobicContact CB-CD 4.11Å; L506-K514 HydrophobicContact CB-CG 4.46Å; L506-L517 HydrophobicContact CD1-CD1 4.18Å; L506-L517 HydrophobicContact CD1-CD2 3.67Å; L506-L517 HydrophobicContact CD1-CG 4.49Å; L506-L612 HydrophobicContact CD1-CD1 4.33Å; L506-L612 HydrophobicContact CG-CD1 4.32Å; L506-A613 PolarHBondContact N-O 3.2Å; L506-A614 WeakPolarHBondContact O-CA 3.27Å; L506-A615 PolarHBondContact O-N 3.27Å; L506-F646 HydrophobicContact CD2-CB 4Å; L506-F646 HydrophobicContact CD2-CD2 3.83Å; L506-F646 HydrophobicContact CD2-CG 4.36Å; L506-I648 HydrophobicContact CB-CD1 4.35Å
507	C	88.9	Confident	87.9	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.014	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	155.1	173.9	-71	0	0	0	0	110.1	A615 I632 F646 L647 I648	C507-A615 WeakPolarHBondContact CA-O 3.37Å; C507-I632 HydrophobicContact CB-CD1 4.08Å; C507-F646 PolarHBondContact N-O 2.77Å; C507-L647 HydrophobicContact CB-CD2 3.69Å; C507-I648 PolarHBondContact O-N 2.74Å
508	G	86.6	Confident	88.9	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.7	-179.7	179.7	0	0	0	0	0	114.9	K514 P617 I648	G508-K514 VanDerWaalsContact C-NZ 3.27Å; G508-K514 PolarHBondContact O-NZ 2.86Å; G508-P617 WeakPolarHBondContact O-CD 3.14Å; G508-I648 CarbonylContact C-O 3.54Å; G508-I648 WeakPolarHBondContact CA-O 3.43Å
509	D	87.7	Confident	89.3	Confident	17 Å²	17	24 Å²	24	9%	0.091	15%	0.154	C	C	.	.			trans	-74.6	150.7	-176.5	-66.6	-38.4	0	0	0	112.9	T512 K621 W622 I648 D650	D509-T512 HydrophobicContact CB-CG2 4.42Å; D509-T512 WeakPolarHBondContact O-CB 3.49Å; D509-T512 WeakPolarHBondContact O-CG2 3.42Å; D509-T512 PolarHBondContact O-N 2.84Å; D509-T512 PolarHBondContact O-OG1 3.09Å; D509-K621 VanDerWaalsContact OD1-CA 3.27Å; D509-K621 WeakPolarHBondContact OD1-CA 3.5Å; D509-W622 PolarHBondContact OD1-N 2.8Å; D509-I648 PolarHBondContact N-O 3.09Å; D509-D650 HydrophobicContact CB-CB 4.25Å
510	P	87.9	Confident	89.4	Confident	72 Å²	72	26.1 Å²	26.1	47%	0.468	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	140.4	174.3	30.3	-34.3	0	0	0	110.5	S620	P510-S620 WeakPolarHBondContact CD-O 3.25Å; P510-S620 WeakPolarHBondContact CG-O 3.18Å
511	G	83.8	Confident	89.6	Confident	82 Å²	82	25.9 Å²	25.9	85%	0.845	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	101	-28.4	-171.7	0	0	0	0	0	112.5	S513	G511-S513 PolarHBondContact O-N 2.75Å
512	T	84	Confident	89.5	Confident	23 Å²	23	28.5 Å²	28.5	14%	0.141	17%	0.17	C	C	.	.	S	Bend	trans	-62.6	135.3	161.6	71.9	0	0	0	0	108.9	D509 K514 I648 D650	D509-T512 HydrophobicContact CB-CG2 4.42Å; D509-T512 WeakPolarHBondContact O-CB 3.49Å; D509-T512 WeakPolarHBondContact O-CG2 3.42Å; D509-T512 PolarHBondContact O-N 2.84Å; D509-T512 PolarHBondContact O-OG1 3.09Å; T512-K514 PolarHBondContact O-N 3.28Å; T512-K514 VanDerWaalsContact OG1-CE 3.24Å; T512-K514 WeakPolarHBondContact OG1-CE 3.4Å; T512-I648 HydrophobicContact CG2-CG2 3.77Å; T512-D650 HydrophobicContact CG2-CB 4.04Å
513	S	86	Confident	89.1	Confident	52 Å²	52	36.7 Å²	36.7	36%	0.364	20%	0.201	S	C	.	.	S	Bend	trans	-75.1	29.8	-157.7	55.1	0	0	0	0	116.4	G511 S515 Q516 L517	G511-S513 PolarHBondContact O-N 2.75Å; S513-S515 PolarHBondContact O-N 3.11Å; S513-Q516 WeakPolarHBondContact O-CB 3.01Å; S513-Q516 PolarHBondContact O-N 2.86Å; S513-Q516 VanDerWaalsContact O-N 3.16Å; S513-L517 PolarHBondContact O-N 2.85Å
514	K	89.2	Confident	88.6	Confident	6 Å²	6	37.1 Å²	37.1	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-54.2	-51.6	-175.9	-58	-174.7	-135.1	143	0	114	L506 G508 T512 Q516 L517 L518 A614 A615 N616 I648	L506-K514 HydrophobicContact CB-CD 4.11Å; L506-K514 HydrophobicContact CB-CG 4.46Å; G508-K514 VanDerWaalsContact C-NZ 3.27Å; G508-K514 PolarHBondContact O-NZ 2.86Å; T512-K514 PolarHBondContact O-N 3.28Å; T512-K514 VanDerWaalsContact OG1-CE 3.24Å; T512-K514 WeakPolarHBondContact OG1-CE 3.4Å; K514-Q516 VanDerWaalsContact C-N 3.25Å; K514-Q516 PolarHBondContact O-N 3.09Å; K514-L517 WeakPolarHBondContact O-CB 2.92Å; K514-L517 PolarHBondContact O-N 2.86Å; K514-L517 VanDerWaalsContact O-N 3.11Å; K514-L518 WeakPolarHBondContact O-CG 3.2Å; K514-L518 PolarHBondContact O-N 3.4Å; K514-A614 HydrophobicContact CB-CB 4.12Å; K514-A614 HydrophobicContact CD-CB 4.3Å; K514-A615 PolarHBondContact NZ-O 3Å; K514-N616 PolarHBondContact NZ-OD1 3.02Å; K514-I648 HydrophobicContact CD-CD1 4.05Å; K514-I648 HydrophobicContact CG-CD1 3.6Å
515	S	89.6	Confident	87.9	Confident	44 Å²	44	37.8 Å²	37.8	31%	0.308	21%	0.208	S	C	.	.	H	α-helix	trans	-64	-33.9	-178.6	-50.1	0	0	0	0	111.5	S513 L518 Q519 D572	S513-S515 PolarHBondContact O-N 3.11Å; S515-L518 PolarHBondContact O-N 3.43Å; S515-Q519 VanDerWaalsContact O-CG 3.29Å; S515-Q519 WeakPolarHBondContact O-CG 3.2Å; S515-Q519 PolarHBondContact O-N 3.05Å; S515-D572 VanDerWaalsContact CB-OD2 3.25Å; S515-D572 WeakPolarHBondContact CB-OD2 3.33Å; S515-D572 PolarHBondContact OG-OD1 3.44Å; S515-D572 PolarHBondContact OG-OD2 2.87Å
516	Q	89.5	Confident	86.9	Confident	87 Å²	87	41.3 Å²	41.3	41%	0.407	23%	0.23	S	C	.	.	H	α-helix	trans	-67.3	-39.2	174.2	-172.5	61.2	39.9	0	0	111.7	S513 K514 Q519 Y520	S513-Q516 WeakPolarHBondContact O-CB 3.01Å; S513-Q516 PolarHBondContact O-N 2.86Å; S513-Q516 VanDerWaalsContact O-N 3.16Å; K514-Q516 VanDerWaalsContact C-N 3.25Å; K514-Q516 PolarHBondContact O-N 3.09Å; Q516-Q519 PolarHBondContact O-N 2.82Å; Q516-Y520 PolarHBondContact O-N 2.99Å
517	L	91.2	Very high	86.2	Confident	13 Å²	13	45.5 Å²	45.5	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-46.5	173.7	179.1	164.2	0	0	0	111.2	I468 I474 I478 L506 S513 K514 Q519 Y520 V521 L612	I468-L517 HydrophobicContact CD1-CB 3.65Å; I468-L517 HydrophobicContact CD1-CD1 4.44Å; I468-L517 HydrophobicContact CD1-CG 4.33Å; I474-L517 HydrophobicContact CG2-CD1 4.03Å; I478-L517 HydrophobicContact CD1-CD1 3.67Å; I478-L517 HydrophobicContact CD1-CD2 3.51Å; I478-L517 HydrophobicContact CD1-CG 3.82Å; L506-L517 HydrophobicContact CD1-CD1 4.18Å; L506-L517 HydrophobicContact CD1-CD2 3.67Å; L506-L517 HydrophobicContact CD1-CG 4.49Å; S513-L517 PolarHBondContact O-N 2.85Å; K514-L517 WeakPolarHBondContact O-CB 2.92Å; K514-L517 PolarHBondContact O-N 2.86Å; K514-L517 VanDerWaalsContact O-N 3.11Å; L517-Q519 VanDerWaalsContact C-N 3.33Å; L517-Q519 PolarHBondContact O-N 3.28Å; L517-Y520 PolarHBondContact O-N 3.1Å; L517-Y520 VanDerWaalsContact O-N 3.15Å; L517-V521 HydrophobicContact CD2-CG2 4.25Å; L517-V521 WeakPolarHBondContact O-CG2 3.22Å; L517-V521 PolarHBondContact O-N 2.8Å; L517-L612 HydrophobicContact CD2-CD2 4.21Å
518	L	92.7	Very high	85.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.5	-45.7	174.5	-68.3	-172.2	0	0	0	111.9	K514 S515 Y520 V521 Y522 Y530 C570 D572 L612 A614	K514-L518 WeakPolarHBondContact O-CG 3.2Å; K514-L518 PolarHBondContact O-N 3.4Å; S515-L518 PolarHBondContact O-N 3.43Å; L518-Y520 VanDerWaalsContact C-N 3.32Å; L518-Y520 PolarHBondContact O-N 2.8Å; L518-V521 PolarHBondContact O-N 3.01Å; L518-Y522 WeakPolarHBondContact O-CB 3.41Å; L518-Y522 PolarHBondContact O-N 2.64Å; L518-Y530 HydrophobicContact CB-CD2 4.43Å; L518-Y530 HydrophobicContact CB-CE2 3.98Å; L518-Y530 HydrophobicContact CD1-CE2 4.46Å; L518-C570 HydrophobicContact CB-CB 4.25Å; L518-C570 HydrophobicContact CD2-CB 4.31Å; L518-C570 PolarHBondContact O-SG 3.2Å; L518-D572 HydrophobicContact CD1-CB 3.84Å; L518-L612 HydrophobicContact CD2-CB 4.34Å; L518-L612 HydrophobicContact CD2-CD1 4.5Å; L518-L612 HydrophobicContact CD2-CD2 3.62Å; L518-L612 HydrophobicContact CD2-CG 3.48Å; L518-L612 VanDerWaalsContact CD2-CG 3.48Å; L518-A614 HydrophobicContact CD1-CB 3.72Å; L518-A614 HydrophobicContact CG-CB 4.33Å
519	Q	90.1	Very high	86	Confident	64 Å²	64	48.3 Å²	48.3	30%	0.299	26%	0.261	S	S	.	.	H	α-helix	trans	-65	-34.6	177.9	-72.5	175.5	22.2	0	0	112.6	S515 Q516 L517 R523 Y530	S515-Q519 VanDerWaalsContact O-CG 3.29Å; S515-Q519 WeakPolarHBondContact O-CG 3.2Å; S515-Q519 PolarHBondContact O-N 3.05Å; Q516-Q519 PolarHBondContact O-N 2.82Å; L517-Q519 VanDerWaalsContact C-N 3.33Å; L517-Q519 PolarHBondContact O-N 3.28Å; Q519-R523 WeakPolarHBondContact O-CG 3.42Å; Q519-R523 PolarHBondContact O-N 3.48Å; Q519-Y530 HydrophobicContact CG-CD2 4.29Å; Q519-Y530 HydrophobicContact CG-CE2 3.83Å
520	Y	88.6	Confident	86.2	Confident	60 Å²	60	51.1 Å²	51.1	24%	0.235	27%	0.271	C	S	.	.	H	α-helix	trans	-67.5	-46.5	175	-172.1	-87.9	0	0	0	111.6	I464 A465 Q516 L517 L518 Y522 R523 L524	I464-Y520 HydrophobicContact CG2-CD1 4.36Å; I464-Y520 HydrophobicContact CG2-CE1 4.23Å; A465-Y520 HydrophobicContact CB-CD1 3.85Å; A465-Y520 HydrophobicContact CB-CD2 4.25Å; A465-Y520 HydrophobicContact CB-CE1 4.19Å; A465-Y520 HydrophobicContact CB-CG 3.89Å; A465-Y520 VanDerWaalsContact N-CZ 3.34Å; Q516-Y520 PolarHBondContact O-N 2.99Å; L517-Y520 PolarHBondContact O-N 3.1Å; L517-Y520 VanDerWaalsContact O-N 3.15Å; L518-Y520 VanDerWaalsContact C-N 3.32Å; L518-Y520 PolarHBondContact O-N 2.8Å; Y520-Y522 VanDerWaalsContact C-N 3.32Å; Y520-Y522 PolarHBondContact O-N 2.88Å; Y520-R523 PolarHBondContact O-N 3.48Å; Y520-R523 VanDerWaalsContact O-N 3.14Å; Y520-L524 PolarHBondContact O-N 3.1Å
521	V	90	Very high	86.3	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-39.4	176.6	175.6	0	0	0	0	111.6	I478 L517 L518 R523 L524 T525 I568 L612	I478-V521 HydrophobicContact CG2-CG2 3.63Å; L517-V521 HydrophobicContact CD2-CG2 4.25Å; L517-V521 WeakPolarHBondContact O-CG2 3.22Å; L517-V521 PolarHBondContact O-N 2.8Å; L518-V521 PolarHBondContact O-N 3.01Å; V521-R523 VanDerWaalsContact C-N 3.33Å; V521-R523 PolarHBondContact O-N 3.04Å; V521-L524 PolarHBondContact O-N 3.44Å; V521-T525 HydrophobicContact CG1-CG2 4.18Å; V521-T525 WeakPolarHBondContact O-CG2 3.47Å; V521-T525 PolarHBondContact O-N 3.12Å; V521-T525 PolarHBondContact O-OG1 2.75Å; V521-I568 HydrophobicContact CG1-CD1 3.92Å; V521-I568 HydrophobicContact CG1-CG2 4.21Å; V521-L612 HydrophobicContact CB-CD2 4.03Å; V521-L612 HydrophobicContact CG1-CD2 3.93Å; V521-L612 HydrophobicContact CG2-CD2 3.96Å
522	Y	89.1	Confident	86.6	Confident	72 Å²	72	46.5 Å²	46.5	28%	0.282	23%	0.227	S	C	.	.	H	α-helix	trans	-58.5	-39	173.4	167.5	-105.4	0	0	0	112.9	L518 Y520 T525 G528	L518-Y522 WeakPolarHBondContact O-CB 3.41Å; L518-Y522 PolarHBondContact O-N 2.64Å; Y520-Y522 VanDerWaalsContact C-N 3.32Å; Y520-Y522 PolarHBondContact O-N 2.88Å; Y522-T525 PolarHBondContact O-OG1 2.72Å; Y522-G528 VanDerWaalsContact CE2-O 3.3Å; Y522-G528 WeakPolarHBondContact CE2-O 3.19Å
523	R	84.3	Confident	86.4	Confident	173 Å²	173	45.6 Å²	45.6	65%	0.653	22%	0.222	S	C	*	.	H	α-helix	trans	-77.3	-27.5	176.2	-67.1	175.1	-173.8	-176.8	2.7	113.6	Q519 Y520 V521 K723	Q519-R523 WeakPolarHBondContact O-CG 3.42Å; Q519-R523 PolarHBondContact O-N 3.48Å; Y520-R523 PolarHBondContact O-N 3.48Å; Y520-R523 VanDerWaalsContact O-N 3.14Å; V521-R523 VanDerWaalsContact C-N 3.33Å; V521-R523 PolarHBondContact O-N 3.04Å; R523-K723 PolarHBondContact O-NZ 2.87Å
524	L	82.5	Confident	86.3	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-74.4	-42	178.5	-171.1	70	0	0	0	111	L482 Y520 V521 L722 K723	L482-L524 HydrophobicContact CD1-CD2 3.54Å; L482-L524 HydrophobicContact CD2-CD2 4.16Å; Y520-L524 PolarHBondContact O-N 3.1Å; V521-L524 PolarHBondContact O-N 3.44Å; L524-L722 HydrophobicContact CD1-CD2 4.09Å; L524-L722 HydrophobicContact CD2-CD2 4.16Å; L524-K723 HydrophobicContact CD1-CG 4.2Å; L524-K723 WeakPolarHBondContact O-CE 3.5Å; L524-K723 PolarHBondContact O-NZ 3.49Å
525	T	79.7	Confident	85.8	Confident	14 Å²	14	52.5 Å²	52.5	9%	0.086	27%	0.265	C	S	.	.	S	Bend	trans	-78	139.6	-175.7	51.3	0	0	0	0	112.6	L482 V521 Y522 G528 I568	L482-T525 HydrophobicContact CD2-CG2 3.48Å; L482-T525 VanDerWaalsContact CD2-CG2 3.48Å; V521-T525 HydrophobicContact CG1-CG2 4.18Å; V521-T525 WeakPolarHBondContact O-CG2 3.47Å; V521-T525 PolarHBondContact O-N 3.12Å; V521-T525 PolarHBondContact O-OG1 2.75Å; Y522-T525 PolarHBondContact O-OG1 2.72Å; T525-G528 VanDerWaalsContact OG1-CA 3.25Å; T525-G528 WeakPolarHBondContact OG1-CA 3.04Å; T525-I568 HydrophobicContact CG2-CB 4.15Å; T525-I568 HydrophobicContact CG2-CD1 3.65Å; T525-I568 HydrophobicContact CG2-CG1 3.63Å
526	P	71.4	Confident	85.1	Confident	73 Å²	73	51.3 Å²	51.3	47%	0.474	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-36.1	-179	28.1	-33.9	0	0	0	112.6	R416 V417	R416-P526 HydrophobicContact CB-CB 4.27Å; R416-P526 VanDerWaalsContact O-CB 3.28Å; R416-P526 WeakPolarHBondContact O-CB 3.35Å; V417-P526 HydrophobicContact CB-CG 4.29Å
527	R	77.6	Confident	84.7	Confident	89 Å²	89	50.3 Å²	50.3	34%	0.336	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	43.1	176.5	-57.5	-177	77.3	173.7	0.5	111.1	D565	R527-D565 WeakPolarHBondContact CD-O 3.4Å; R527-D565 PolarHBondContact NE-O 2.83Å
528	G	83.1	Confident	84.3	Confident	8 Å²	8	50.7 Å²	50.7	8%	0.082	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	143.7	173.3	0	0	0	0	0	111.3	Y522 T525 I568	Y522-G528 VanDerWaalsContact CE2-O 3.3Å; Y522-G528 WeakPolarHBondContact CE2-O 3.19Å; T525-G528 VanDerWaalsContact OG1-CA 3.25Å; T525-G528 WeakPolarHBondContact OG1-CA 3.04Å; G528-I568 WeakPolarHBondContact CA-O 3.43Å
529	Q	88.7	Confident	83.8	Confident	53 Å²	53	54 Å²	54	25%	0.248	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.8	166	-69.3	-64.3	-16.7	0	0	110.1	L563 A564 I568 C570	Q529-L563 HydrophobicContact CG-CB 4.4Å; Q529-A564 HydrophobicContact CB-CB 4.06Å; Q529-A564 HydrophobicContact CG-CB 3.72Å; Q529-I568 PolarHBondContact N-O 3.15Å; Q529-C570 WeakPolarHBondContact O-CB 3.42Å; Q529-C570 PolarHBondContact O-N 3.19Å
530	Y	91.5	Very high	83.5	Confident	77 Å²	77	52.6 Å²	52.6	30%	0.302	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.1	177.8	-175.6	-90.7	0	0	0	110.5	L518 Q519 C570 D572	L518-Y530 HydrophobicContact CB-CD2 4.43Å; L518-Y530 HydrophobicContact CB-CE2 3.98Å; L518-Y530 HydrophobicContact CD1-CE2 4.46Å; Q519-Y530 HydrophobicContact CG-CD2 4.29Å; Q519-Y530 HydrophobicContact CG-CE2 3.83Å; Y530-C570 HydrophobicContact CD2-CB 4.04Å; Y530-D572 PolarHBondContact OH-OD2 3.01Å
531	T	89.8	Confident	83.3	Confident	13 Å²	13	49.8 Å²	49.8	8%	0.08	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.6	-176.2	61.8	0	0	0	0	110.9	S536 L541 A560 C570 I571 D572	T531-S536 WeakPolarHBondContact CB-OG 3.24Å; T531-L541 HydrophobicContact CG2-CD2 4.04Å; T531-A560 HydrophobicContact CG2-CB 3.67Å; T531-C570 PolarHBondContact N-O 3.48Å; T531-C570 PolarHBondContact OG1-O 2.75Å; T531-I571 WeakPolarHBondContact O-CA 3.07Å; T531-D572 PolarHBondContact O-N 3.21Å
532	S	89.3	Confident	83	Confident	44 Å²	44	50.1 Å²	50.1	31%	0.308	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.7	172.1	168.2	0	0	0	0	109.6	K534 G535 S536	S532-K534 PolarHBondContact O-N 2.95Å; S532-G535 PolarHBondContact O-N 2.91Å; S532-G535 VanDerWaalsContact O-N 3.1Å; S532-S536 VanDerWaalsContact O-CB 3.24Å; S532-S536 WeakPolarHBondContact O-CB 3.24Å; S532-S536 PolarHBondContact O-N 2.87Å; S532-S536 PolarHBondContact O-OG 3.43Å
533	G	81	Confident	82.7	Confident	4 Å²	4	46.8 Å²	46.8	4%	0.041	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.7	-176.6	0	0	0	0	0	114.6	D572 M577	G533-D572 PolarHBondContact N-O 2.82Å; G533-M577 WeakPolarHBondContact O-CG 3.28Å
534	K	83.7	Confident	82.7	Confident	134 Å²	134	42.7 Å²	42.7	58%	0.583	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-38.9	172.9	-73.4	-176.6	-177.3	146.7	0	113.6	S532 S536 E573 K576	S532-K534 PolarHBondContact O-N 2.95Å; K534-S536 VanDerWaalsContact C-N 3.32Å; K534-E573 VanDerWaalsContact CD-OE2 3.27Å; K534-E573 WeakPolarHBondContact CD-OE2 3.46Å; K534-E573 WeakPolarHBondContact CE-OE2 3.48Å; K534-E573 IonicContact NZ-OE1 2.75Å; K534-E573 IonicContact NZ-OE2 2.81Å; K534-E573 PolarHBondContact NZ-OE2 2.88Å; K534-K576 HydrophobicContact CD-CB 4.31Å; K534-K576 HydrophobicContact CG-CB 3.67Å; K534-K576 HydrophobicContact CG-CG 4.49Å
535	G	78.8	Confident	82.9	Confident	69 Å²	69	44.3 Å²	44.3	71%	0.711	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-23	-179.5	0	0	0	0	0	113.2	S532 S537	S532-G535 PolarHBondContact O-N 2.91Å; S532-G535 VanDerWaalsContact O-N 3.1Å; G535-S537 PolarHBondContact O-N 2.74Å
536	S	75.1	Confident	83.3	Confident	19 Å²	19	45.5 Å²	45.5	13%	0.133	27%	0.266	C	S	.	.			trans	-99.4	92.9	-170.8	-47.7	0	0	0	0	111.2	T531 S532 K534	T531-S536 WeakPolarHBondContact CB-OG 3.24Å; S532-S536 VanDerWaalsContact O-CB 3.24Å; S532-S536 WeakPolarHBondContact O-CB 3.24Å; S532-S536 PolarHBondContact O-N 2.87Å; S532-S536 PolarHBondContact O-OG 3.43Å; K534-S536 VanDerWaalsContact C-N 3.32Å
537	S	81.2	Confident	83.9	Confident	66 Å²	66	48.9 Å²	48.9	46%	0.462	27%	0.273	S	S	.	.			trans	-63.5	155.2	166	71.5	0	0	0	0	110.8	G535 V539 G540 L541	G535-S537 PolarHBondContact O-N 2.74Å; S537-V539 PolarHBondContact O-N 3.06Å; S537-G540 WeakPolarHBondContact O-CA 3.35Å; S537-G540 PolarHBondContact O-N 3.4Å; S537-G540 PolarHBondContact OG-N 3.01Å; S537-L541 PolarHBondContact O-N 3.4Å; S537-L541 VanDerWaalsContact O-N 3.12Å
538	A	82.3	Confident	83.9	Confident	21 Å²	21	45.6 Å²	45.6	17%	0.174	26%	0.262	C	S	.	.	H	α-helix	trans	-49.3	-34.5	173	0	0	0	0	0	112.7	T542 T581 V584	A538-T542 WeakPolarHBondContact O-CB 3.33Å; A538-T542 VanDerWaalsContact O-CG2 3.29Å; A538-T542 WeakPolarHBondContact O-CG2 3.38Å; A538-T542 PolarHBondContact O-N 3.48Å; A538-T542 VanDerWaalsContact O-N 3.09Å; A538-T542 PolarHBondContact O-OG1 2.99Å; A538-T581 PolarHBondContact N-OG1 3.15Å; A538-T581 VanDerWaalsContact N-OG1 3.11Å; A538-V584 HydrophobicContact CB-CG2 4.33Å
539	V	82.1	Confident	83.8	Confident	69 Å²	69	49.4 Å²	49.4	42%	0.418	29%	0.293	S	S	.	.	H	α-helix	trans	-68.3	-33.8	178.5	179.7	0	0	0	0	112.3	S537 Y544	S537-V539 PolarHBondContact O-N 3.06Å; V539-Y544 HydrophobicContact CG1-CG 4.31Å
540	G	83	Confident	83.2	Confident	34 Å²	34	51.3 Å²	51.3	35%	0.351	30%	0.302	S	S	.	.	H	α-helix	trans	-81.2	-27	176.5	0	0	0	0	0	114.3	S537 G559 A560	S537-G540 WeakPolarHBondContact O-CA 3.35Å; S537-G540 PolarHBondContact O-N 3.4Å; S537-G540 PolarHBondContact OG-N 3.01Å; G540-G559 CarbonylContact O-C 3.59Å; G540-G559 WeakPolarHBondContact O-CA 3.38Å; G540-A560 PolarHBondContact O-N 3.43Å
541	L	84.1	Confident	82.4	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-78	-36	172.9	-67.4	-171.5	0	0	0	113	T531 S537 G559 A560 L561 T581	T531-L541 HydrophobicContact CG2-CD2 4.04Å; S537-L541 PolarHBondContact O-N 3.4Å; S537-L541 VanDerWaalsContact O-N 3.12Å; L541-G559 CarbonylContact O-C 3.57Å; L541-A560 HydrophobicContact CD2-CB 4.15Å; L541-A560 PolarHBondContact O-N 2.96Å; L541-L561 HydrophobicContact CB-CD1 3.99Å; L541-L561 HydrophobicContact CB-CG 4.26Å; L541-L561 VanDerWaalsContact O-CB 3.32Å; L541-L561 WeakPolarHBondContact O-CB 3.22Å; L541-L561 PolarHBondContact O-N 3.32Å; L541-T581 HydrophobicContact CD1-CG2 3.48Å; L541-T581 VanDerWaalsContact CD1-CG2 3.48Å; L541-T581 HydrophobicContact CG-CG2 4.37Å
542	T	83.9	Confident	81.9	Confident	8 Å²	8	59.2 Å²	59.2	5%	0.049	34%	0.337	C	S	.	.	S	Bend	trans	-87.6	-101	-170.9	53	0	0	0	0	113.1	A538 G559 V584 L594	A538-T542 WeakPolarHBondContact O-CB 3.33Å; A538-T542 VanDerWaalsContact O-CG2 3.29Å; A538-T542 WeakPolarHBondContact O-CG2 3.38Å; A538-T542 PolarHBondContact O-N 3.48Å; A538-T542 VanDerWaalsContact O-N 3.09Å; A538-T542 PolarHBondContact O-OG1 2.99Å; T542-G559 WeakPolarHBondContact O-CA 3.04Å; T542-G559 PolarHBondContact O-N 2.99Å; T542-V584 HydrophobicContact CG2-CB 4.17Å; T542-V584 HydrophobicContact CG2-CG1 3.22Å; T542-V584 HydrophobicContact CG2-CG2 3.87Å; T542-L594 HydrophobicContact CG2-CD1 3.6Å; T542-L594 HydrophobicContact CG2-CD2 4.07Å; T542-L594 HydrophobicContact CG2-CG 4.46Å
543	A	82.8	Confident	81.5	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.008	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	154.6	165.3	0	0	0	0	0	107.3	L556 Q557 I596 L605	A543-L556 HydrophobicContact CB-CD1 4.27Å; A543-L556 HydrophobicContact CB-CD2 3.71Å; A543-L556 HydrophobicContact CB-CG 3.94Å; A543-Q557 CarbonylContact C-O 3.43Å; A543-Q557 WeakPolarHBondContact CA-O 3.4Å; A543-Q557 VanDerWaalsContact CB-O 3.25Å; A543-Q557 WeakPolarHBondContact CB-O 3.01Å; A543-I596 HydrophobicContact CB-CD1 3.44Å; A543-I596 VanDerWaalsContact CB-CD1 3.44Å; A543-L605 HydrophobicContact CB-CD1 3.97Å
544	Y	86.1	Confident	81.7	Confident	88 Å²	88	67.5 Å²	67.5	35%	0.345	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	143.5	-176	68.2	-77.4	0	0	0	110.7	V539 T546 Q557	V539-Y544 HydrophobicContact CG1-CG 4.31Å; Y544-T546 HydrophobicContact CD2-CG2 3.55Å; Y544-T546 HydrophobicContact CE2-CG2 3.37Å; Y544-Q557 HydrophobicContact CD1-CB 3.98Å; Y544-Q557 WeakPolarHBondContact CD1-O 3.12Å; Y544-Q557 HydrophobicContact CD2-CB 4.49Å; Y544-Q557 HydrophobicContact CE1-CB 3.54Å; Y544-Q557 HydrophobicContact CE2-CB 4.12Å; Y544-Q557 VanDerWaalsContact CE2-OE1 3.23Å; Y544-Q557 HydrophobicContact CG-CB 4.41Å; Y544-Q557 PolarHBondContact N-O 3.34Å; Y544-Q557 PolarHBondContact O-N 3.48Å; Y544-Q557 PolarHBondContact OH-OE1 2.94Å; Y544-Q557 VanDerWaalsContact OH-OE1 3.09Å
545	I	86.6	Confident	81.6	Confident	45 Å²	45	63.4 Å²	63.4	23%	0.231	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.8	-178.9	-60.1	-179.9	0	0	0	107.7	L554 T555 K598 A599 I601	I545-L554 HydrophobicContact CG2-CB 3.91Å; I545-L554 HydrophobicContact CG2-CD2 4.2Å; I545-L554 HydrophobicContact CG2-CG 4.47Å; I545-T555 WeakPolarHBondContact CA-O 3.37Å; I545-K598 HydrophobicContact CD1-CB 3.51Å; I545-K598 WeakPolarHBondContact CD1-O 3.3Å; I545-A599 HydrophobicContact CD1-CB 3.98Å; I545-I601 HydrophobicContact CD1-CB 4.27Å; I545-I601 HydrophobicContact CD1-CD1 4.05Å; I545-I601 HydrophobicContact CD1-CG1 4.36Å; I545-I601 HydrophobicContact CG1-CD1 4.42Å; I545-I601 HydrophobicContact CG2-CD1 4.49Å
546	T	86.4	Confident	81.7	Confident	39 Å²	39	62.6 Å²	62.6	24%	0.239	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	156.3	169.5	50.9	0	0	0	0	110.3	Y544 L554 T555 Q557	Y544-T546 HydrophobicContact CD2-CG2 3.55Å; Y544-T546 HydrophobicContact CE2-CG2 3.37Å; T546-L554 CarbonylContact O-C 3.54Å; T546-L554 WeakPolarHBondContact O-CA 3.47Å; T546-T555 PolarHBondContact N-O 2.92Å; T546-T555 PolarHBondContact O-N 3.16Å; T546-T555 VanDerWaalsContact O-O 3.11Å; T546-T555 PolarHBondContact O-OG1 3.38Å; T546-T555 PolarHBondContact OG1-OG1 3.29Å; T546-Q557 VanDerWaalsContact OG1-CD 3.3Å; T546-Q557 PolarHBondContact OG1-OE1 2.96Å
547	K	84.7	Confident	82	Confident	144 Å²	144	64 Å²	64	63%	0.626	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	110.5	167.6	-170.5	175.6	-173.5	173.8	0	107.5	R552 Q553 L554	K547-R552 WeakPolarHBondContact CE-O 3.34Å; K547-Q553 WeakPolarHBondContact CA-O 3.46Å; K547-L554 HydrophobicContact CB-CD2 4.03Å; K547-L554 HydrophobicContact CG-CD2 4.33Å
548	D	78.3	Confident	82	Confident	19 Å²	19	63.1 Å²	63.1	10%	0.102	33%	0.333	C	S	.	.			trans	-63.4	137.6	176.2	169.2	52.3	0	0	0	110	R279 E550 T551 R552 Q553 T555	R279-D548 IonicContact CZ-OD1 3.21Å; R279-D548 IonicContact NH1-OD1 2.71Å; R279-D548 PolarHBondContact NH1-OD1 3.33Å; D548-E550 VanDerWaalsContact C-N 3.34Å; D548-E550 PolarHBondContact OD2-N 3.03Å; D548-T551 WeakPolarHBondContact CB-OG1 3.11Å; D548-T551 WeakPolarHBondContact OD2-CB 3.5Å; D548-T551 WeakPolarHBondContact OD2-CG2 3.25Å; D548-T551 PolarHBondContact OD2-N 3.09Å; D548-T551 PolarHBondContact OD2-OG1 3.45Å; D548-R552 WeakPolarHBondContact O-CA 3.45Å; D548-R552 PolarHBondContact O-N 3.1Å; D548-Q553 PolarHBondContact N-O 3.15Å; D548-T555 HydrophobicContact CB-CG2 3.85Å
549	A	80.5	Confident	82.1	Confident	88 Å²	88	62.3 Å²	62.3	73%	0.727	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-26.9	-173.2	0	0	0	0	0	112.7
550	E	75.4	Confident	82.3	Confident	94 Å²	94	59.8 Å²	59.8	44%	0.439	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-56.4	-173.6	-70	154.8	-153.1	0	0	110.8	R279 M339 K341 D548 R552	R279-E550 IonicContact CZ-OE2 2.87Å; R279-E550 VanDerWaalsContact NH2-CD 3.34Å; R279-E550 IonicContact NH2-OE1 2.85Å; R279-E550 PolarHBondContact NH2-OE1 3.39Å; R279-E550 IonicContact NH2-OE2 2.99Å; R279-E550 PolarHBondContact NH2-OE2 2.98Å; M339-E550 WeakPolarHBondContact CE-OE2 3.05Å; K341-E550 WeakPolarHBondContact CE-OE1 3.35Å; K341-E550 IonicContact NZ-OE1 3.98Å; K341-E550 PolarHBondContact NZ-OE1 3.15Å; D548-E550 VanDerWaalsContact C-N 3.34Å; D548-E550 PolarHBondContact OD2-N 3.03Å; E550-R552 VanDerWaalsContact C-N 3.33Å
551	T	75	Confident	82.5	Confident	64 Å²	64	58.1 Å²	58.1	39%	0.393	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-22.5	176.3	60.6	0	0	0	0	113.3	D548 Q553	D548-T551 WeakPolarHBondContact CB-OG1 3.11Å; D548-T551 WeakPolarHBondContact OD2-CB 3.5Å; D548-T551 WeakPolarHBondContact OD2-CG2 3.25Å; D548-T551 PolarHBondContact OD2-N 3.09Å; D548-T551 PolarHBondContact OD2-OG1 3.45Å; T551-Q553 PolarHBondContact O-N 3.41Å; T551-Q553 VanDerWaalsContact O-N 3.16Å; T551-Q553 PolarHBondContact OG1-N 3.25Å
552	R	79.6	Confident	82.6	Confident	192 Å²	192	59.1 Å²	59.1	73%	0.725	30%	0.303	S	S	*	.			trans	59.6	11.6	-168.5	-56	179.2	176.7	179.2	-0.3	114.4	K547 D548 E550	K547-R552 WeakPolarHBondContact CE-O 3.34Å; D548-R552 WeakPolarHBondContact O-CA 3.45Å; D548-R552 PolarHBondContact O-N 3.1Å; E550-R552 VanDerWaalsContact C-N 3.33Å
553	Q	81.3	Confident	82.6	Confident	130 Å²	130	61.1 Å²	61.1	61%	0.607	31%	0.313	S	S	*	.	S	Bend	trans	-85.5	161.1	177.6	-65.1	178.2	0.4	0	0	110.6	K547 D548 T551 T555	K547-Q553 WeakPolarHBondContact CA-O 3.46Å; D548-Q553 PolarHBondContact N-O 3.15Å; T551-Q553 PolarHBondContact O-N 3.41Å; T551-Q553 VanDerWaalsContact O-N 3.16Å; T551-Q553 PolarHBondContact OG1-N 3.25Å; Q553-T555 PolarHBondContact O-N 3.16Å
554	L	84.2	Confident	82.8	Confident	91 Å²	91	61 Å²	61	48%	0.476	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	111.9	170.9	-65.9	178	0	0	0	108.2	I545 T546 K547 A599	I545-L554 HydrophobicContact CG2-CB 3.91Å; I545-L554 HydrophobicContact CG2-CD2 4.2Å; I545-L554 HydrophobicContact CG2-CG 4.47Å; T546-L554 CarbonylContact O-C 3.54Å; T546-L554 WeakPolarHBondContact O-CA 3.47Å; K547-L554 HydrophobicContact CB-CD2 4.03Å; K547-L554 HydrophobicContact CG-CD2 4.33Å; L554-A599 HydrophobicContact CD1-CB 3.97Å
555	T	81.4	Confident	82.7	Confident	48 Å²	48	58.2 Å²	58.2	29%	0.294	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.5	179.7	50.8	0	0	0	0	109.8	I545 T546 D548 Q553	I545-T555 WeakPolarHBondContact CA-O 3.37Å; T546-T555 PolarHBondContact N-O 2.92Å; T546-T555 PolarHBondContact O-N 3.16Å; T546-T555 VanDerWaalsContact O-O 3.11Å; T546-T555 PolarHBondContact O-OG1 3.38Å; T546-T555 PolarHBondContact OG1-OG1 3.29Å; D548-T555 HydrophobicContact CB-CG2 3.85Å; Q553-T555 PolarHBondContact O-N 3.16Å
556	L	81.5	Confident	82.6	Confident	52 Å²	52	57.5 Å²	57.5	27%	0.272	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	128.3	170.6	-177.4	149.1	0	0	0	109.1	A543 T558 I596 I601 C603 L605	A543-L556 HydrophobicContact CB-CD1 4.27Å; A543-L556 HydrophobicContact CB-CD2 3.71Å; A543-L556 HydrophobicContact CB-CG 3.94Å; L556-T558 HydrophobicContact CD2-CG2 4.35Å; L556-I596 HydrophobicContact CD1-CD1 4.33Å; L556-I601 HydrophobicContact CD1-CG2 4.4Å; L556-C603 WeakPolarHBondContact CD1-SG 3.17Å; L556-L605 HydrophobicContact CD1-CD1 4.38Å; L556-L605 HydrophobicContact CD2-CD1 3.99Å
557	Q	81.1	Confident	82.6	Confident	50 Å²	50	56.1 Å²	56.1	23%	0.234	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.7	173.4	-64.7	-168.8	-80.7	0	0	109.3	A543 Y544 T546	A543-Q557 CarbonylContact C-O 3.43Å; A543-Q557 WeakPolarHBondContact CA-O 3.4Å; A543-Q557 VanDerWaalsContact CB-O 3.25Å; A543-Q557 WeakPolarHBondContact CB-O 3.01Å; Y544-Q557 HydrophobicContact CD1-CB 3.98Å; Y544-Q557 WeakPolarHBondContact CD1-O 3.12Å; Y544-Q557 HydrophobicContact CD2-CB 4.49Å; Y544-Q557 HydrophobicContact CE1-CB 3.54Å; Y544-Q557 HydrophobicContact CE2-CB 4.12Å; Y544-Q557 VanDerWaalsContact CE2-OE1 3.23Å; Y544-Q557 HydrophobicContact CG-CB 4.41Å; Y544-Q557 PolarHBondContact N-O 3.34Å; Y544-Q557 PolarHBondContact O-N 3.48Å; Y544-Q557 PolarHBondContact OH-OE1 2.94Å; Y544-Q557 VanDerWaalsContact OH-OE1 3.09Å; T546-Q557 VanDerWaalsContact OG1-CD 3.3Å; T546-Q557 PolarHBondContact OG1-OE1 2.96Å
558	T	82.4	Confident	83	Confident	46 Å²	46	49.5 Å²	49.5	28%	0.282	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	137.4	-177	46.3	0	0	0	0	112	L556 V562	L556-T558 HydrophobicContact CD2-CG2 4.35Å; T558-V562 HydrophobicContact CG2-CB 4.06Å; T558-V562 HydrophobicContact CG2-CG1 3.59Å
559	G	83.8	Confident	83.7	Confident	4 Å²	4	48.6 Å²	48.6	4%	0.041	26%	0.26	C	S	.	.			trans	-90	-178.6	172.7	0	0	0	0	0	112.8	G540 L541 T542 L561 V562 L563	G540-G559 CarbonylContact O-C 3.59Å; G540-G559 WeakPolarHBondContact O-CA 3.38Å; L541-G559 CarbonylContact O-C 3.57Å; T542-G559 WeakPolarHBondContact O-CA 3.04Å; T542-G559 PolarHBondContact O-N 2.99Å; G559-L561 VanDerWaalsContact C-N 3.29Å; G559-L561 PolarHBondContact O-N 2.89Å; G559-V562 PolarHBondContact O-N 3.4Å; G559-V562 VanDerWaalsContact O-N 3.15Å; G559-L563 WeakPolarHBondContact O-CG 3.3Å; G559-L563 PolarHBondContact O-N 3.47Å; G559-L563 VanDerWaalsContact O-N 3.1Å
560	A	85.8	Confident	84.3	Confident	16 Å²	16	44.4 Å²	44.4	13%	0.132	23%	0.225	C	C	.	.	H	α-helix	trans	-58.8	-32.4	-170.8	0	0	0	0	0	114.7	T531 G540 L541 A564	T531-A560 HydrophobicContact CG2-CB 3.67Å; G540-A560 PolarHBondContact O-N 3.43Å; L541-A560 HydrophobicContact CD2-CB 4.15Å; L541-A560 PolarHBondContact O-N 2.96Å; A560-A564 WeakPolarHBondContact O-CB 3.37Å; A560-A564 PolarHBondContact O-N 3.02Å
561	L	87.3	Confident	85.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-71.1	-43.6	177.5	-66.1	168.4	0	0	0	111.3	L541 G559 L563 A564 C569 L585 V588 T609	L541-L561 HydrophobicContact CB-CD1 3.99Å; L541-L561 HydrophobicContact CB-CG 4.26Å; L541-L561 VanDerWaalsContact O-CB 3.32Å; L541-L561 WeakPolarHBondContact O-CB 3.22Å; L541-L561 PolarHBondContact O-N 3.32Å; G559-L561 VanDerWaalsContact C-N 3.29Å; G559-L561 PolarHBondContact O-N 2.89Å; L561-L563 VanDerWaalsContact C-N 3.29Å; L561-L563 PolarHBondContact O-N 3.5Å; L561-A564 PolarHBondContact O-N 3.5Å; L561-A564 VanDerWaalsContact O-N 3.09Å; L561-C569 HydrophobicContact CD2-CB 3.97Å; L561-L585 HydrophobicContact CD1-CD2 3.91Å; L561-V588 HydrophobicContact CD1-CG2 4.27Å; L561-T609 WeakPolarHBondContact O-CG2 3.31Å
562	V	87.2	Confident	86	Confident	22 Å²	22	37.9 Å²	37.9	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-69.7	-30.7	-179.8	-174.5	0	0	0	0	111.2	T558 G559 A564 L594 L605	T558-V562 HydrophobicContact CG2-CB 4.06Å; T558-V562 HydrophobicContact CG2-CG1 3.59Å; G559-V562 PolarHBondContact O-N 3.4Å; G559-V562 VanDerWaalsContact O-N 3.15Å; V562-A564 VanDerWaalsContact C-N 3.28Å; V562-A564 PolarHBondContact O-N 3.09Å; V562-L594 HydrophobicContact CG2-CD2 3.82Å; V562-L605 HydrophobicContact CG2-CB 4.3Å; V562-L605 HydrophobicContact CG2-CD1 4.01Å
563	L	84.2	Confident	86.5	Confident	50 Å²	50	30.8 Å²	30.8	26%	0.262	17%	0.166	S	C	.	.	H	α-helix	trans	-70.5	-20.8	172.2	-67	173.1	0	0	0	113.7	Q529 G559 L561	Q529-L563 HydrophobicContact CG-CB 4.4Å; G559-L563 WeakPolarHBondContact O-CG 3.3Å; G559-L563 PolarHBondContact O-N 3.47Å; G559-L563 VanDerWaalsContact O-N 3.1Å; L561-L563 VanDerWaalsContact C-N 3.29Å; L561-L563 PolarHBondContact O-N 3.5Å
564	A	85.7	Confident	86.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	15	-179.9	0	0	0	0	0	113.6	Q529 A560 L561 V562 G567 C569 T609	Q529-A564 HydrophobicContact CB-CB 4.06Å; Q529-A564 HydrophobicContact CG-CB 3.72Å; A560-A564 WeakPolarHBondContact O-CB 3.37Å; A560-A564 PolarHBondContact O-N 3.02Å; L561-A564 PolarHBondContact O-N 3.5Å; L561-A564 VanDerWaalsContact O-N 3.09Å; V562-A564 VanDerWaalsContact C-N 3.28Å; V562-A564 PolarHBondContact O-N 3.09Å; A564-G567 VanDerWaalsContact O-CA 3.23Å; A564-G567 WeakPolarHBondContact O-CA 3.48Å; A564-G567 PolarHBondContact O-N 3.02Å; A564-C569 HydrophobicContact CB-CB 4.32Å; A564-T609 HydrophobicContact CB-CG2 3.96Å; A564-T609 WeakPolarHBondContact O-CG2 3.29Å
565	D	85.2	Confident	87.1	Confident	28 Å²	28	22.2 Å²	22.2	15%	0.15	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	138.4	-178.4	-162.9	47.4	0	0	0	112.2	R527 G567 R608	R527-D565 WeakPolarHBondContact CD-O 3.4Å; R527-D565 PolarHBondContact NE-O 2.83Å; D565-G567 PolarHBondContact O-N 2.65Å; D565-G567 VanDerWaalsContact O-N 3.08Å; D565-R608 WeakPolarHBondContact OD1-CA 3.24Å; D565-R608 VanDerWaalsContact OD1-CB 3.3Å; D565-R608 WeakPolarHBondContact OD1-CB 3.14Å; D565-R608 PolarHBondContact OD1-N 3.45Å
566	N	83.2	Confident	87.3	Confident	31 Å²	31	24 Å²	24	17%	0.166	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	5.4	-166.6	-66.1	-26.4	0	0	0	116	D420 R487 R608	D420-N566 PolarHBondContact OD2-ND2 2.72Å; R487-N566 VanDerWaalsContact CZ-OD1 3.27Å; R487-N566 PolarHBondContact NH1-OD1 2.95Å; R487-N566 PolarHBondContact NH2-OD1 3.47Å; N566-R608 VanDerWaalsContact CA-O 3.27Å; N566-R608 WeakPolarHBondContact CA-O 3.26Å; N566-R608 PolarHBondContact N-O 3.35Å
567	G	87.5	Confident	87.5	Confident	9 Å²	9	21.8 Å²	21.8	9%	0.093	12%	0.117	C	C	.	.	S	Bend	trans	-111.2	-152.9	-172.2	0	0	0	0	0	115.1	A564 D565 S610	A564-G567 VanDerWaalsContact O-CA 3.23Å; A564-G567 WeakPolarHBondContact O-CA 3.48Å; A564-G567 PolarHBondContact O-N 3.02Å; D565-G567 PolarHBondContact O-N 2.65Å; D565-G567 VanDerWaalsContact O-N 3.08Å; G567-S610 PolarHBondContact O-N 2.98Å; G567-S610 VanDerWaalsContact O-N 3.15Å; G567-S610 PolarHBondContact O-OG 3.24Å
568	I	92.1	Very high	87.9	Confident	6 Å²	6	22.3 Å²	22.3	3%	0.031	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.8	177.7	-50	-158.7	0	0	0	109.5	Q481 L482 V521 T525 G528 Q529 S610 L612	Q481-I568 HydrophobicContact CG-CD1 4.03Å; L482-I568 HydrophobicContact CD2-CD1 3.82Å; L482-I568 HydrophobicContact CG-CD1 4.44Å; V521-I568 HydrophobicContact CG1-CD1 3.92Å; V521-I568 HydrophobicContact CG1-CG2 4.21Å; T525-I568 HydrophobicContact CG2-CB 4.15Å; T525-I568 HydrophobicContact CG2-CD1 3.65Å; T525-I568 HydrophobicContact CG2-CG1 3.63Å; G528-I568 WeakPolarHBondContact CA-O 3.43Å; Q529-I568 PolarHBondContact N-O 3.15Å; I568-S610 WeakPolarHBondContact CA-O 3.29Å; I568-S610 WeakPolarHBondContact CG1-OG 3.33Å; I568-L612 HydrophobicContact CG2-CB 3.84Å
569	C	92.6	Very high	88.1	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	110.5	168.5	-172.6	0	0	0	0	109.4	L561 A564 S610 L612	L561-C569 HydrophobicContact CD2-CB 3.97Å; A564-C569 HydrophobicContact CB-CB 4.32Å; C569-S610 PolarHBondContact N-O 3.29Å; C569-L612 PolarHBondContact O-N 3.23Å
570	C	94.6	Very high	88.2	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122	173	-66.7	0	0	0	0	109.6	L518 Q529 Y530 T531 L612	L518-C570 HydrophobicContact CB-CB 4.25Å; L518-C570 HydrophobicContact CD2-CB 4.31Å; L518-C570 PolarHBondContact O-SG 3.2Å; Q529-C570 WeakPolarHBondContact O-CB 3.42Å; Q529-C570 PolarHBondContact O-N 3.19Å; Y530-C570 HydrophobicContact CD2-CB 4.04Å; T531-C570 PolarHBondContact N-O 3.48Å; T531-C570 PolarHBondContact OG1-O 2.75Å; C570-L612 WeakPolarHBondContact CA-O 3.35Å
571	I	93	Very high	88.2	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	110.1	178.4	-49.8	178.8	0	0	0	109.3	T531 F574 M577 L585 I611 L612 A613 A614	T531-I571 WeakPolarHBondContact O-CA 3.07Å; I571-F574 HydrophobicContact CB-CD2 4.24Å; I571-F574 HydrophobicContact CD1-CD2 4.36Å; I571-F574 HydrophobicContact CD1-CE2 4.26Å; I571-F574 HydrophobicContact CG2-CD2 3.93Å; I571-M577 HydrophobicContact CG2-SD 4.16Å; I571-L585 HydrophobicContact CD1-CD1 4.44Å; I571-I611 HydrophobicContact CD1-CG2 3.85Å; I571-I611 HydrophobicContact CG1-CG2 4.37Å; I571-L612 PolarHBondContact N-O 3.46Å; I571-A613 CarbonylContact O-C 3.59Å; I571-A613 WeakPolarHBondContact O-CA 3.33Å; I571-A614 PolarHBondContact O-N 2.81Å
572	D	93	Very high	88.1	Confident	19 Å²	19	29.8 Å²	29.8	10%	0.102	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	160	170.4	-159.9	1.2	0	0	0	111.4	S515 L518 Y530 T531 G533 F574	S515-D572 VanDerWaalsContact CB-OD2 3.25Å; S515-D572 WeakPolarHBondContact CB-OD2 3.33Å; S515-D572 PolarHBondContact OG-OD1 3.44Å; S515-D572 PolarHBondContact OG-OD2 2.87Å; L518-D572 HydrophobicContact CD1-CB 3.84Å; Y530-D572 PolarHBondContact OH-OD2 3.01Å; T531-D572 PolarHBondContact O-N 3.21Å; G533-D572 PolarHBondContact N-O 2.82Å; D572-F574 VanDerWaalsContact C-N 3.29Å; D572-F574 PolarHBondContact O-N 3.46Å
573	E	90.2	Very high	88	Confident	44 Å²	44	32.3 Å²	32.3	21%	0.206	18%	0.183	C	C	.	.			trans	51.6	41.8	-177	-64	-153.8	132.4	0	0	113.8	K534 D575 K576 A614	K534-E573 VanDerWaalsContact CD-OE2 3.27Å; K534-E573 WeakPolarHBondContact CD-OE2 3.46Å; K534-E573 WeakPolarHBondContact CE-OE2 3.48Å; K534-E573 IonicContact NZ-OE1 2.75Å; K534-E573 IonicContact NZ-OE2 2.81Å; K534-E573 PolarHBondContact NZ-OE2 2.88Å; E573-D575 PolarHBondContact O-N 3.17Å; E573-D575 VanDerWaalsContact O-N 3.16Å; E573-K576 HydrophobicContact CB-CB 4.42Å; E573-K576 HydrophobicContact CB-CD 3.76Å; E573-K576 VanDerWaalsContact CD-CD 3.48Å; E573-K576 HydrophobicContact CG-CD 3.97Å; E573-K576 PolarHBondContact O-N 3.06Å; E573-K576 WeakPolarHBondContact OE1-CD 3.47Å; E573-K576 IonicContact OE1-NZ 2.68Å; E573-K576 PolarHBondContact OE1-NZ 3.22Å; E573-A614 PolarHBondContact N-O 3.49Å
574	F	89.5	Confident	88.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-57.7	-31.7	-176.9	-167.9	-77.7	0	0	0	112.9	I571 D572 K576 M577 L585 A613 A614 A615 L634 L638 F642	I571-F574 HydrophobicContact CB-CD2 4.24Å; I571-F574 HydrophobicContact CD1-CD2 4.36Å; I571-F574 HydrophobicContact CD1-CE2 4.26Å; I571-F574 HydrophobicContact CG2-CD2 3.93Å; D572-F574 VanDerWaalsContact C-N 3.29Å; D572-F574 PolarHBondContact O-N 3.46Å; F574-K576 PolarHBondContact O-N 2.99Å; F574-M577 HydrophobicContact CD1-CE 3.86Å; F574-M577 HydrophobicContact CD2-CE 3.38Å; F574-M577 HydrophobicContact CE1-CE 3.7Å; F574-M577 HydrophobicContact CE2-CE 3.26Å; F574-M577 HydrophobicContact CG-CE 3.68Å; F574-M577 HydrophobicContact CZ-CE 3.4Å; F574-M577 PolarHBondContact O-N 3Å; F574-L585 HydrophobicContact CE2-CD1 3.74Å; F574-L585 HydrophobicContact CZ-CD1 3.84Å; F574-A613 HydrophobicContact CB-CB 4.34Å; F574-A613 HydrophobicContact CD2-CB 3.46Å; F574-A613 VanDerWaalsContact CD2-CB 3.46Å; F574-A613 HydrophobicContact CE2-CB 4.01Å; F574-A613 HydrophobicContact CG-CB 4.05Å; F574-A614 WeakPolarHBondContact CB-O 3.41Å; F574-A614 PolarHBondContact N-O 2.84Å; F574-A615 HydrophobicContact CB-CB 4.27Å; F574-L634 HydrophobicContact CD1-CD1 4.01Å; F574-L634 HydrophobicContact CD1-CD2 4.12Å; F574-L634 HydrophobicContact CE1-CD1 4Å; F574-L634 HydrophobicContact CE1-CD2 3.87Å; F574-L638 HydrophobicContact CE1-CD2 3.41Å; F574-L638 VanDerWaalsContact CE1-CD2 3.41Å; F574-L638 HydrophobicContact CZ-CD2 3.6Å; F574-F642 HydrophobicContact CE2-CZ 4.22Å; F574-F642 HydrophobicContact CZ-CZ 4.14Å
575	D	87.7	Confident	88.4	Confident	41 Å²	41	31.3 Å²	31.3	22%	0.219	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-60.4	-27	174.5	58.8	-71.8	0	0	0	113.4	E573 R582 N616	E573-D575 PolarHBondContact O-N 3.17Å; E573-D575 VanDerWaalsContact O-N 3.16Å; D575-R582 PolarHBondContact O-NH2 3.01Å; D575-N616 PolarHBondContact OD1-N 3.34Å
576	K	86	Confident	88.5	Confident	85 Å²	85	32.2 Å²	32.2	37%	0.37	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-96	2.7	-175.4	-70.1	132.6	174	176.3	0	114.7	K534 E573 F574	K534-K576 HydrophobicContact CD-CB 4.31Å; K534-K576 HydrophobicContact CG-CB 3.67Å; K534-K576 HydrophobicContact CG-CG 4.49Å; E573-K576 HydrophobicContact CB-CB 4.42Å; E573-K576 HydrophobicContact CB-CD 3.76Å; E573-K576 VanDerWaalsContact CD-CD 3.48Å; E573-K576 HydrophobicContact CG-CD 3.97Å; E573-K576 PolarHBondContact O-N 3.06Å; E573-K576 WeakPolarHBondContact OE1-CD 3.47Å; E573-K576 IonicContact OE1-NZ 2.68Å; E573-K576 PolarHBondContact OE1-NZ 3.22Å; F574-K576 PolarHBondContact O-N 2.99Å
577	M	86.3	Confident	88.8	Confident	6 Å²	6	32.9 Å²	32.9	3%	0.03	18%	0.184	C	C	.	.	S	Bend	trans	-68.6	146.3	174.4	-70.4	-164.9	-59.6	0	0	112.8	G533 I571 F574 T581 R582 L585	G533-M577 WeakPolarHBondContact O-CG 3.28Å; I571-M577 HydrophobicContact CG2-SD 4.16Å; F574-M577 HydrophobicContact CD1-CE 3.86Å; F574-M577 HydrophobicContact CD2-CE 3.38Å; F574-M577 HydrophobicContact CE1-CE 3.7Å; F574-M577 HydrophobicContact CE2-CE 3.26Å; F574-M577 HydrophobicContact CG-CE 3.68Å; F574-M577 HydrophobicContact CZ-CE 3.4Å; F574-M577 PolarHBondContact O-N 3Å; M577-T581 HydrophobicContact SD-CG2 3.99Å; M577-R582 HydrophobicContact CB-CG 4.26Å; M577-R582 HydrophobicContact CE-CG 4.3Å; M577-R582 PolarHBondContact O-NE 2.64Å; M577-R582 PolarHBondContact O-NH2 3.16Å; M577-L585 HydrophobicContact CE-CD1 3.72Å; M577-L585 HydrophobicContact SD-CD1 4.49Å
578	S	88.2	Confident	89	Confident	61 Å²	61	32.5 Å²	32.5	43%	0.427	18%	0.18	S	C	.	.			trans	-70.9	148.7	170.8	60	0	0	0	0	112.4	S580 T581 R582	S578-S580 PolarHBondContact O-N 3.42Å; S578-S580 PolarHBondContact OG-OG 3.14Å; S578-T581 WeakPolarHBondContact O-CA 3.35Å; S578-T581 WeakPolarHBondContact O-CB 3.4Å; S578-T581 PolarHBondContact O-N 3.23Å; S578-T581 PolarHBondContact OG-OG1 3.08Å; S578-T581 VanDerWaalsContact OG-OG1 3.11Å; S578-R582 PolarHBondContact O-N 3.02Å; S578-R582 VanDerWaalsContact O-N 3.1Å
579	D	87.2	Confident	88.9	Confident	111 Å²	111	32.3 Å²	32.3	59%	0.594	18%	0.179	S	C	*	.	H	α-helix	trans	-61.6	-29	-178.3	-63	-45.2	0	0	0	113.7	T581 R582 S583	D579-T581 VanDerWaalsContact C-N 3.3Å; D579-T581 PolarHBondContact O-N 3.19Å; D579-R582 PolarHBondContact O-N 3.49Å; D579-R582 IonicContact OD1-CZ 3.24Å; D579-R582 IonicContact OD1-NE 2.89Å; D579-R582 IonicContact OD1-NH1 3.48Å; D579-R582 PolarHBondContact OD1-NH1 3.4Å; D579-S583 PolarHBondContact O-N 3.25Å
580	S	85.5	Confident	88.4	Confident	77 Å²	77	35.6 Å²	35.6	54%	0.538	20%	0.195	S	C	.	.	H	α-helix	trans	-58.1	-39.7	170.4	52.3	0	0	0	0	113.1	S578	S578-S580 PolarHBondContact O-N 3.42Å; S578-S580 PolarHBondContact OG-OG 3.14Å
581	T	86.4	Confident	88.1	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-75.6	-38.5	177.4	-54.6	0	0	0	0	110.5	A538 L541 M577 S578 D579 S583 V584	A538-T581 PolarHBondContact N-OG1 3.15Å; A538-T581 VanDerWaalsContact N-OG1 3.11Å; L541-T581 HydrophobicContact CD1-CG2 3.48Å; L541-T581 VanDerWaalsContact CD1-CG2 3.48Å; L541-T581 HydrophobicContact CG-CG2 4.37Å; M577-T581 HydrophobicContact SD-CG2 3.99Å; S578-T581 WeakPolarHBondContact O-CA 3.35Å; S578-T581 WeakPolarHBondContact O-CB 3.4Å; S578-T581 PolarHBondContact O-N 3.23Å; S578-T581 PolarHBondContact OG-OG1 3.08Å; S578-T581 VanDerWaalsContact OG-OG1 3.11Å; D579-T581 VanDerWaalsContact C-N 3.3Å; D579-T581 PolarHBondContact O-N 3.19Å; T581-S583 VanDerWaalsContact C-N 3.31Å; T581-S583 PolarHBondContact O-N 2.72Å; T581-V584 WeakPolarHBondContact O-CB 3.23Å; T581-V584 PolarHBondContact O-N 3.45Å
582	R	85	Confident	87.8	Confident	34 Å²	34	42.3 Å²	42.3	13%	0.128	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-35.5	175.2	-63.6	173.9	-178.9	161.5	-7.3	112.7	D575 M577 S578 D579 V584 L585 H586	D575-R582 PolarHBondContact O-NH2 3.01Å; M577-R582 HydrophobicContact CB-CG 4.26Å; M577-R582 HydrophobicContact CE-CG 4.3Å; M577-R582 PolarHBondContact O-NE 2.64Å; M577-R582 PolarHBondContact O-NH2 3.16Å; S578-R582 PolarHBondContact O-N 3.02Å; S578-R582 VanDerWaalsContact O-N 3.1Å; D579-R582 PolarHBondContact O-N 3.49Å; D579-R582 IonicContact OD1-CZ 3.24Å; D579-R582 IonicContact OD1-NE 2.89Å; D579-R582 IonicContact OD1-NH1 3.48Å; D579-R582 PolarHBondContact OD1-NH1 3.4Å; R582-V584 PolarHBondContact O-N 3.49Å; R582-L585 PolarHBondContact O-N 2.8Å; R582-H586 PolarHBondContact O-N 3.33Å
583	S	85.5	Confident	87.6	Confident	75 Å²	75	42.3 Å²	42.3	52%	0.524	23%	0.227	S	C	.	.	H	α-helix	trans	-59	-44.1	177.1	-169.9	0	0	0	0	112.2	D579 T581 L585 H586	D579-S583 PolarHBondContact O-N 3.25Å; T581-S583 VanDerWaalsContact C-N 3.31Å; T581-S583 PolarHBondContact O-N 2.72Å; S583-L585 VanDerWaalsContact C-N 3.29Å; S583-L585 PolarHBondContact O-N 3.38Å; S583-H586 VanDerWaalsContact O-CB 3.28Å; S583-H586 WeakPolarHBondContact O-CB 3.46Å; S583-H586 PolarHBondContact O-N 3.1Å; S583-H586 VanDerWaalsContact O-N 3.1Å
584	V	88.3	Confident	87.5	Confident	28 Å²	28	40.4 Å²	40.4	17%	0.17	22%	0.218	C	C	.	.	H	α-helix	trans	-56.5	-43.1	175.2	172.3	0	0	0	0	111.7	A538 T542 T581 R582 H586 E587 V588 L594	A538-V584 HydrophobicContact CB-CG2 4.33Å; T542-V584 HydrophobicContact CG2-CB 4.17Å; T542-V584 HydrophobicContact CG2-CG1 3.22Å; T542-V584 HydrophobicContact CG2-CG2 3.87Å; T581-V584 WeakPolarHBondContact O-CB 3.23Å; T581-V584 PolarHBondContact O-N 3.45Å; R582-V584 PolarHBondContact O-N 3.49Å; V584-H586 PolarHBondContact O-N 3.41Å; V584-E587 WeakPolarHBondContact O-CB 3.36Å; V584-E587 PolarHBondContact O-N 2.99Å; V584-V588 HydrophobicContact CG1-CG2 4.35Å; V584-V588 PolarHBondContact O-N 3.17Å; V584-L594 HydrophobicContact CG1-CD1 3.98Å
585	L	88.8	Confident	87.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-21.5	-178.1	-60.6	178.5	0	0	0	112.4	L561 I571 F574 M577 R582 S583 E587 M589 I611	L561-L585 HydrophobicContact CD1-CD2 3.91Å; I571-L585 HydrophobicContact CD1-CD1 4.44Å; F574-L585 HydrophobicContact CE2-CD1 3.74Å; F574-L585 HydrophobicContact CZ-CD1 3.84Å; M577-L585 HydrophobicContact CE-CD1 3.72Å; M577-L585 HydrophobicContact SD-CD1 4.49Å; R582-L585 PolarHBondContact O-N 2.8Å; S583-L585 VanDerWaalsContact C-N 3.29Å; S583-L585 PolarHBondContact O-N 3.38Å; L585-E587 VanDerWaalsContact C-N 3.28Å; L585-E587 PolarHBondContact O-N 3.47Å; L585-M589 HydrophobicContact CB-SD 4.27Å; L585-M589 WeakPolarHBondContact O-CB 3.43Å; L585-M589 WeakPolarHBondContact O-CG 3.47Å; L585-M589 PolarHBondContact O-N 3.37Å; L585-I611 HydrophobicContact CD2-CD1 4.05Å
586	H	88.7	Confident	87.3	Confident	48 Å²	48	42.3 Å²	42.3	22%	0.222	23%	0.234	C	C	.	.	H	α-helix	trans	-65.9	-29.5	173.2	-66.1	-19.5	0	0	0	113.8	R582 S583 V584 E590 R641	R582-H586 PolarHBondContact O-N 3.33Å; S583-H586 VanDerWaalsContact O-CB 3.28Å; S583-H586 WeakPolarHBondContact O-CB 3.46Å; S583-H586 PolarHBondContact O-N 3.1Å; S583-H586 VanDerWaalsContact O-N 3.1Å; V584-H586 PolarHBondContact O-N 3.41Å; H586-E590 WeakPolarHBondContact O-CB 3.25Å; H586-R641 PolarHBondContact ND1-NH1 3.05Å; H586-R641 PolarHBondContact O-NH2 2.78Å
587	E	89.6	Confident	87.4	Confident	44 Å²	44	41.9 Å²	41.9	21%	0.206	25%	0.246	C	C	.	.	H	α-helix	trans	-78.9	-56.5	176.5	-163.9	-176.2	165	0	0	109.2	V584 L585 M589 E590 Q591 S595	V584-E587 WeakPolarHBondContact O-CB 3.36Å; V584-E587 PolarHBondContact O-N 2.99Å; L585-E587 VanDerWaalsContact C-N 3.28Å; L585-E587 PolarHBondContact O-N 3.47Å; E587-M589 PolarHBondContact O-N 3.49Å; E587-E590 PolarHBondContact O-N 3.25Å; E587-E590 VanDerWaalsContact O-N 3.13Å; E587-Q591 PolarHBondContact O-N 2.65Å; E587-S595 VanDerWaalsContact OE1-CB 3.24Å; E587-S595 WeakPolarHBondContact OE1-CB 3.26Å; E587-S595 PolarHBondContact OE1-N 3.36Å; E587-S595 PolarHBondContact OE1-OG 3.13Å
588	V	90	Very high	87.3	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-43.5	-177.3	-179.8	0	0	0	0	112.3	L561 V584 E590 Q592 L594 A607	L561-V588 HydrophobicContact CD1-CG2 4.27Å; V584-V588 HydrophobicContact CG1-CG2 4.35Å; V584-V588 PolarHBondContact O-N 3.17Å; V588-E590 VanDerWaalsContact C-N 3.28Å; V588-E590 PolarHBondContact O-N 3.26Å; V588-Q592 VanDerWaalsContact O-CA 3.26Å; V588-Q592 WeakPolarHBondContact O-CA 3.36Å; V588-Q592 PolarHBondContact O-N 3.49Å; V588-L594 HydrophobicContact CG2-CB 4.38Å; V588-L594 HydrophobicContact CG2-CD1 4.34Å; V588-A607 HydrophobicContact CG1-CB 3.99Å
589	M	89.9	Confident	87.1	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-72.5	-15.7	-179.8	-66.6	177.3	78.3	0	0	114.6	R499 N503 L585 E587 I611 L638 R641 F642	R499-M589 WeakPolarHBondContact CD-O 3.39Å; R499-M589 PolarHBondContact NE-O 3.4Å; R499-M589 PolarHBondContact NH1-O 2.83Å; N503-M589 HydrophobicContact CB-CE 4.05Å; N503-M589 WeakPolarHBondContact ND2-CE 3.42Å; L585-M589 HydrophobicContact CB-SD 4.27Å; L585-M589 WeakPolarHBondContact O-CB 3.43Å; L585-M589 WeakPolarHBondContact O-CG 3.47Å; L585-M589 PolarHBondContact O-N 3.37Å; E587-M589 PolarHBondContact O-N 3.49Å; M589-I611 HydrophobicContact CG-CD1 3.56Å; M589-I611 HydrophobicContact SD-CD1 4.21Å; M589-L638 HydrophobicContact SD-CD1 4Å; M589-R641 HydrophobicContact CB-CB 4.3Å; M589-R641 HydrophobicContact CE-CB 3.84Å; M589-R641 HydrophobicContact SD-CB 4.43Å; M589-F642 HydrophobicContact CE-CD1 3.7Å; M589-F642 HydrophobicContact CE-CD2 4.01Å; M589-F642 HydrophobicContact CE-CE1 3.55Å; M589-F642 HydrophobicContact CE-CE2 3.88Å; M589-F642 HydrophobicContact CE-CG 3.93Å; M589-F642 HydrophobicContact CE-CZ 3.65Å; M589-F642 HydrophobicContact SD-CZ 4.33Å
590	E	83.9	Confident	86.8	Confident	69 Å²	69	45.4 Å²	45.4	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-104.1	-49.6	-178.6	-162	76.2	-168.8	0	0	111.7	H586 E587 V588 R641 R767	H586-E590 WeakPolarHBondContact O-CB 3.25Å; E587-E590 PolarHBondContact O-N 3.25Å; E587-E590 VanDerWaalsContact O-N 3.13Å; V588-E590 VanDerWaalsContact C-N 3.28Å; V588-E590 PolarHBondContact O-N 3.26Å; E590-R641 WeakPolarHBondContact OE2-CD 3.2Å; E590-R641 WeakPolarHBondContact OE2-CG 3.3Å; E590-R641 IonicContact OE2-CZ 2.83Å; E590-R641 IonicContact OE2-NE 3.21Å; E590-R641 PolarHBondContact OE2-NE 3.49Å; E590-R641 IonicContact OE2-NH2 3.64Å; E590-R767 IonicContact OE1-CZ 3.16Å; E590-R767 VanDerWaalsContact OE1-CZ 3.3Å; E590-R767 IonicContact OE1-NE 2.73Å; E590-R767 PolarHBondContact OE1-NE 3.45Å; E590-R767 VanDerWaalsContact OE1-NE 3.1Å; E590-R767 IonicContact OE1-NH2 3.85Å; E590-R767 PolarHBondContact OE1-NH2 3.3Å; E590-R767 IonicContact OE2-CZ 3.12Å; E590-R767 VanDerWaalsContact OE2-CZ 3.25Å; E590-R767 IonicContact OE2-NE 2.81Å; E590-R767 PolarHBondContact OE2-NE 3.1Å; E590-R767 IonicContact OE2-NH2 3.03Å; E590-R767 PolarHBondContact OE2-NH2 2.96Å
591	Q	86.4	Confident	86.7	Confident	124 Å²	124	44 Å²	44	58%	0.579	27%	0.27	S	S	*	.	H	α-helix	trans	-101.5	-13.4	-171.2	-65.1	175.3	-19.5	0	0	112.9	E587 T593	E587-Q591 PolarHBondContact O-N 2.65Å; Q591-T593 PolarHBondContact O-N 3.03Å; Q591-T593 VanDerWaalsContact O-N 3.1Å
592	Q	88	Confident	86.8	Confident	17 Å²	17	50.9 Å²	50.9	8%	0.079	31%	0.307	C	S	.	.	S	Bend	trans	54.4	24.1	-172.6	-62.1	179.1	-58.2	0	0	113.9	R499 E501 V588 A607 R608	R499-Q592 HydrophobicContact CB-CG 4.27Å; R499-Q592 HydrophobicContact CG-CG 4.1Å; E501-Q592 PolarHBondContact OE1-NE2 3.07Å; E501-Q592 PolarHBondContact OE2-NE2 2.85Å; V588-Q592 VanDerWaalsContact O-CA 3.26Å; V588-Q592 WeakPolarHBondContact O-CA 3.36Å; V588-Q592 PolarHBondContact O-N 3.49Å; Q592-A607 CarbonylContact O-C 3.48Å; Q592-A607 VanDerWaalsContact O-C 3.31Å; Q592-A607 PolarHBondContact O-N 2.9Å; Q592-R608 HydrophobicContact CB-CG 4.16Å
593	T	89.3	Confident	86.8	Confident	19 Å²	19	51.1 Å²	51.1	12%	0.117	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	161.5	173.7	65.6	0	0	0	0	110.7	Q591 Q604 L605	Q591-T593 PolarHBondContact O-N 3.03Å; Q591-T593 VanDerWaalsContact O-N 3.1Å; T593-Q604 HydrophobicContact CG2-CG 4.38Å; T593-Q604 PolarHBondContact OG1-NE2 3.42Å; T593-L605 CarbonylContact C-O 3.38Å; T593-L605 WeakPolarHBondContact CA-O 3.41Å
594	L	88.2	Confident	86.9	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	105.1	-178.7	174.1	67.4	0	0	0	108.8	T542 V562 V584 V588 I596 L605	T542-L594 HydrophobicContact CG2-CD1 3.6Å; T542-L594 HydrophobicContact CG2-CD2 4.07Å; T542-L594 HydrophobicContact CG2-CG 4.46Å; V562-L594 HydrophobicContact CG2-CD2 3.82Å; V584-L594 HydrophobicContact CG1-CD1 3.98Å; V588-L594 HydrophobicContact CG2-CB 4.38Å; V588-L594 HydrophobicContact CG2-CD1 4.34Å; L594-I596 HydrophobicContact CD2-CD1 4.03Å; L594-I596 HydrophobicContact CD2-CG1 4.45Å; L594-I596 HydrophobicContact CG-CD1 4.2Å; L594-I596 HydrophobicContact CG-CG1 4.07Å; L594-L605 HydrophobicContact CB-CB 4.42Å; L594-L605 PolarHBondContact N-O 2.95Å; L594-L605 PolarHBondContact O-N 2.95Å
595	S	87	Confident	86.8	Confident	71 Å²	71	53.9 Å²	53.9	50%	0.497	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	128.8	175.6	61.4	0	0	0	0	111.2	E587	E587-S595 VanDerWaalsContact OE1-CB 3.24Å; E587-S595 WeakPolarHBondContact OE1-CB 3.26Å; E587-S595 PolarHBondContact OE1-N 3.36Å; E587-S595 PolarHBondContact OE1-OG 3.13Å
596	I	86.2	Confident	86.6	Confident	11 Å²	11	58.2 Å²	58.2	6%	0.056	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	115.1	179.6	-56.7	-174.6	0	0	0	109.1	A543 L556 L594 K598 L602 C603 L605	A543-I596 HydrophobicContact CB-CD1 3.44Å; A543-I596 VanDerWaalsContact CB-CD1 3.44Å; L556-I596 HydrophobicContact CD1-CD1 4.33Å; L594-I596 HydrophobicContact CD2-CD1 4.03Å; L594-I596 HydrophobicContact CD2-CG1 4.45Å; L594-I596 HydrophobicContact CG-CD1 4.2Å; L594-I596 HydrophobicContact CG-CG1 4.07Å; I596-K598 HydrophobicContact CG2-CB 4.42Å; I596-K598 HydrophobicContact CG2-CD 4.37Å; I596-K598 HydrophobicContact CG2-CG 4.41Å; I596-L602 WeakPolarHBondContact O-CA 3.34Å; I596-C603 PolarHBondContact N-O 3.27Å; I596-C603 PolarHBondContact O-N 3.25Å; I596-L605 HydrophobicContact CD1-CD1 3.79Å
597	A	87.2	Confident	86.4	Confident	75 Å²	75	56 Å²	56	62%	0.62	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	87.7	174.8	0	0	0	0	0	109.8	L602	A597-L602 HydrophobicContact CB-CD2 3.51Å
598	K	84.1	Confident	86.2	Confident	99 Å²	99	56.8 Å²	56.8	43%	0.43	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	139.5	-178	-71.9	176.9	-175.9	164.7	0	111.2	I545 I596 G600 I601	I545-K598 HydrophobicContact CD1-CB 3.51Å; I545-K598 WeakPolarHBondContact CD1-O 3.3Å; I596-K598 HydrophobicContact CG2-CB 4.42Å; I596-K598 HydrophobicContact CG2-CD 4.37Å; I596-K598 HydrophobicContact CG2-CG 4.41Å; K598-G600 PolarHBondContact O-N 2.77Å; K598-G600 VanDerWaalsContact O-N 3.07Å; K598-I601 PolarHBondContact N-O 3.02Å; K598-I601 PolarHBondContact O-N 3.24Å
599	A	83.1	Confident	86.2	Confident	73 Å²	73	56.9 Å²	56.9	60%	0.603	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	32.9	172.8	0	0	0	0	0	116	I545 L554 I601	I545-A599 HydrophobicContact CD1-CB 3.98Å; L554-A599 HydrophobicContact CD1-CB 3.97Å; A599-I601 VanDerWaalsContact C-N 3.3Å; A599-I601 PolarHBondContact O-N 3.48Å
600	G	82	Confident	86.3	Confident	81 Å²	81	57 Å²	57	84%	0.835	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-8.7	-177.8	0	0	0	0	0	114.9	K598	K598-G600 PolarHBondContact O-N 2.77Å; K598-G600 VanDerWaalsContact O-N 3.07Å
601	I	82.8	Confident	86.8	Confident	46 Å²	46	53.8 Å²	53.8	24%	0.236	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	116	170.1	-53.7	-178.8	0	0	0	107.8	I545 L556 K598 A599 C603	I545-I601 HydrophobicContact CD1-CB 4.27Å; I545-I601 HydrophobicContact CD1-CD1 4.05Å; I545-I601 HydrophobicContact CD1-CG1 4.36Å; I545-I601 HydrophobicContact CG1-CD1 4.42Å; I545-I601 HydrophobicContact CG2-CD1 4.49Å; L556-I601 HydrophobicContact CD1-CG2 4.4Å; K598-I601 PolarHBondContact N-O 3.02Å; K598-I601 PolarHBondContact O-N 3.24Å; A599-I601 VanDerWaalsContact C-N 3.3Å; A599-I601 PolarHBondContact O-N 3.48Å; I601-C603 HydrophobicContact CG2-CB 4.33Å
602	L	89.8	Confident	87.2	Confident	147 Å²	147	47.9 Å²	47.9	77%	0.77	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	106.4	170.1	-68.2	167.9	0	0	0	106.7	I596 A597	I596-L602 WeakPolarHBondContact O-CA 3.34Å; A597-L602 HydrophobicContact CB-CD2 3.51Å
603	C	85	Confident	87.5	Confident	38 Å²	38	47.1 Å²	47.1	26%	0.257	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.2	179.7	62.3	0	0	0	0	110.9	L556 I596 I601	L556-C603 WeakPolarHBondContact CD1-SG 3.17Å; I596-C603 PolarHBondContact N-O 3.27Å; I596-C603 PolarHBondContact O-N 3.25Å; I601-C603 HydrophobicContact CG2-CB 4.33Å
604	Q	86.8	Confident	87.7	Confident	125 Å²	125	46.2 Å²	46.2	58%	0.584	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.7	168.4	-173.8	172.5	1.5	0	0	106.5	T593	T593-Q604 HydrophobicContact CG2-CG 4.38Å; T593-Q604 PolarHBondContact OG1-NE2 3.42Å
605	L	85.7	Confident	87.8	Confident	36 Å²	36	46 Å²	46	19%	0.188	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	141	176.2	-59.6	175.7	0	0	0	108.5	A543 L556 V562 T593 L594 I596	A543-L605 HydrophobicContact CB-CD1 3.97Å; L556-L605 HydrophobicContact CD1-CD1 4.38Å; L556-L605 HydrophobicContact CD2-CD1 3.99Å; V562-L605 HydrophobicContact CG2-CB 4.3Å; V562-L605 HydrophobicContact CG2-CD1 4.01Å; T593-L605 CarbonylContact C-O 3.38Å; T593-L605 WeakPolarHBondContact CA-O 3.41Å; L594-L605 HydrophobicContact CB-CB 4.42Å; L594-L605 PolarHBondContact N-O 2.95Å; L594-L605 PolarHBondContact O-N 2.95Å; I596-L605 HydrophobicContact CD1-CD1 3.79Å
606	H	84	Confident	88	Confident	92 Å²	92	44 Å²	44	43%	0.426	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	138.8	169.3	-59.4	162.6	0	0	0	108.9
607	A	84.9	Confident	88.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.26	C	S	.	.			trans	-143	64.4	-179.8	0	0	0	0	0	107.7	V588 Q592 T609	V588-A607 HydrophobicContact CG1-CB 3.99Å; Q592-A607 CarbonylContact O-C 3.48Å; Q592-A607 VanDerWaalsContact O-C 3.31Å; Q592-A607 PolarHBondContact O-N 2.9Å; A607-T609 PolarHBondContact O-N 3.2Å
608	R	86.8	Confident	88.1	Confident	61 Å²	61	44 Å²	44	23%	0.23	25%	0.249	C	C	.	.			trans	-79.6	64.9	179.2	-58.9	167	169.8	177.3	-7.9	108.3	D497 E501 D565 N566 Q592	D497-R608 IonicContact OD2-NH2 3.22Å; E501-R608 VanDerWaalsContact OE2-O 3.13Å; D565-R608 WeakPolarHBondContact OD1-CA 3.24Å; D565-R608 VanDerWaalsContact OD1-CB 3.3Å; D565-R608 WeakPolarHBondContact OD1-CB 3.14Å; D565-R608 PolarHBondContact OD1-N 3.45Å; N566-R608 VanDerWaalsContact CA-O 3.27Å; N566-R608 WeakPolarHBondContact CA-O 3.26Å; N566-R608 PolarHBondContact N-O 3.35Å; Q592-R608 HydrophobicContact CB-CG 4.16Å
609	T	89.7	Confident	88	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.031	26%	0.264	C	S	.	.			trans	-110	130.8	-177.5	71.2	0	0	0	0	111.5	E501 L561 A564 A607	E501-T609 WeakPolarHBondContact OE2-CA 3.5Å; E501-T609 PolarHBondContact OE2-N 2.89Å; L561-T609 WeakPolarHBondContact O-CG2 3.31Å; A564-T609 HydrophobicContact CB-CG2 3.96Å; A564-T609 WeakPolarHBondContact O-CG2 3.29Å; A607-T609 PolarHBondContact O-N 3.2Å
610	S	91.7	Very high	88	Confident	5 Å²	5	43.2 Å²	43.2	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	136.4	162.4	73	0	0	0	0	110	Q481 E501 I502 G567 I568 C569	Q481-S610 PolarHBondContact NE2-OG 2.86Å; Q481-S610 VanDerWaalsContact NE2-OG 3.09Å; E501-S610 PolarHBondContact OE2-N 3.07Å; I502-S610 WeakPolarHBondContact O-CB 3.38Å; G567-S610 PolarHBondContact O-N 2.98Å; G567-S610 VanDerWaalsContact O-N 3.15Å; G567-S610 PolarHBondContact O-OG 3.24Å; I568-S610 WeakPolarHBondContact CA-O 3.29Å; I568-S610 WeakPolarHBondContact CG1-OG 3.33Å; C569-S610 PolarHBondContact N-O 3.29Å
611	I	94	Very high	88.2	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.5	179.4	-56.4	-170.3	0	0	0	109.3	Q481 N503 I504 I571 L585 M589 A613 F642	Q481-I611 PolarHBondContact NE2-O 2.8Å; N503-I611 WeakPolarHBondContact CA-O 3.49Å; N503-I611 PolarHBondContact OD1-N 3.39Å; I504-I611 PolarHBondContact N-O 2.87Å; I571-I611 HydrophobicContact CD1-CG2 3.85Å; I571-I611 HydrophobicContact CG1-CG2 4.37Å; L585-I611 HydrophobicContact CD2-CD1 4.05Å; M589-I611 HydrophobicContact CG-CD1 3.56Å; M589-I611 HydrophobicContact SD-CD1 4.21Å; I611-A613 HydrophobicContact CG2-CB 4.33Å; I611-F642 HydrophobicContact CG2-CE1 4.48Å
612	L	94.7	Very high	88.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	104.1	168.4	-178.3	63.2	0	0	0	108.4	I504 L506 L517 L518 V521 I568 C569 C570 I571	I504-L612 HydrophobicContact CB-CD1 3.76Å; I504-L612 HydrophobicContact CG2-CD1 3.85Å; L506-L612 HydrophobicContact CD1-CD1 4.33Å; L506-L612 HydrophobicContact CG-CD1 4.32Å; L517-L612 HydrophobicContact CD2-CD2 4.21Å; L518-L612 HydrophobicContact CD2-CB 4.34Å; L518-L612 HydrophobicContact CD2-CD1 4.5Å; L518-L612 HydrophobicContact CD2-CD2 3.62Å; L518-L612 HydrophobicContact CD2-CG 3.48Å; L518-L612 VanDerWaalsContact CD2-CG 3.48Å; V521-L612 HydrophobicContact CB-CD2 4.03Å; V521-L612 HydrophobicContact CG1-CD2 3.93Å; V521-L612 HydrophobicContact CG2-CD2 3.96Å; I568-L612 HydrophobicContact CG2-CB 3.84Å; C569-L612 PolarHBondContact O-N 3.23Å; C570-L612 WeakPolarHBondContact CA-O 3.35Å; I571-L612 PolarHBondContact N-O 3.46Å
613	A	93.6	Very high	87.8	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.6	-175.2	0	0	0	0	0	111.8	I504 L505 L506 I571 F574 I611 F642	I504-A613 PolarHBondContact O-N 2.89Å; L505-A613 CarbonylContact C-O 3.57Å; L505-A613 HydrophobicContact CD1-CB 3.71Å; L506-A613 PolarHBondContact N-O 3.2Å; I571-A613 CarbonylContact O-C 3.59Å; I571-A613 WeakPolarHBondContact O-CA 3.33Å; F574-A613 HydrophobicContact CB-CB 4.34Å; F574-A613 HydrophobicContact CD2-CB 3.46Å; F574-A613 VanDerWaalsContact CD2-CB 3.46Å; F574-A613 HydrophobicContact CE2-CB 4.01Å; F574-A613 HydrophobicContact CG-CB 4.05Å; I611-A613 HydrophobicContact CG2-CB 4.33Å; A613-F642 HydrophobicContact CB-CE1 4.16Å; A613-F642 HydrophobicContact CB-CZ 4.23Å
614	A	93.5	Very high	87.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.6	166.1	0	0	0	0	0	110.8	L506 K514 L518 I571 E573 F574	L506-A614 WeakPolarHBondContact O-CA 3.27Å; K514-A614 HydrophobicContact CB-CB 4.12Å; K514-A614 HydrophobicContact CD-CB 4.3Å; L518-A614 HydrophobicContact CD1-CB 3.72Å; L518-A614 HydrophobicContact CG-CB 4.33Å; I571-A614 PolarHBondContact O-N 2.81Å; E573-A614 PolarHBondContact N-O 3.49Å; F574-A614 WeakPolarHBondContact CB-O 3.41Å; F574-A614 PolarHBondContact N-O 2.84Å
615	A	91.4	Very high	86.7	Confident	1 Å²	1	40 Å²	40	1%	0.008	23%	0.234	C	C	.	.			trans	-129	152.1	177	0	0	0	0	0	110.7	L505 L506 C507 K514 F574	L505-A615 HydrophobicContact CD1-CB 4.08Å; L506-A615 PolarHBondContact O-N 3.27Å; C507-A615 WeakPolarHBondContact CA-O 3.37Å; K514-A615 PolarHBondContact NZ-O 3Å; F574-A615 HydrophobicContact CB-CB 4.27Å
616	N	90	Very high	86.2	Confident	29 Å²	29	42.4 Å²	42.4	16%	0.155	24%	0.242	C	C	.	.			trans	-113.5	149.3	175.6	-55	-63.8	0	0	0	109.8	K514 D575	K514-N616 PolarHBondContact NZ-OD1 3.02Å; D575-N616 PolarHBondContact OD1-N 3.34Å
617	P	89.1	Confident	85.6	Confident	7 Å²	7	40.9 Å²	40.9	5%	0.045	24%	0.24	C	C	.	.			trans	-68.3	153.4	176.6	29.6	-36.1	0	0	0	111.1	G508 G619 S620 W622 N631	G508-P617 WeakPolarHBondContact O-CD 3.14Å; P617-G619 PolarHBondContact O-N 3.05Å; P617-S620 PolarHBondContact O-N 3.33Å; P617-S620 VanDerWaalsContact O-N 3.13Å; P617-W622 HydrophobicContact CB-CE3 4.1Å; P617-N631 WeakPolarHBondContact CA-O 3.21Å
618	I	86.5	Confident	85	Confident	78 Å²	78	42.3 Å²	42.3	40%	0.4	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	128	172.8	-160.8	170.6	0	0	0	110	N631	I618-N631 PolarHBondContact N-O 3.19Å
619	G	83.9	Confident	84.5	Confident	72 Å²	72	41.1 Å²	41.1	74%	0.742	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.6	8.7	-177.1	0	0	0	0	0	115.8	P617 K621	P617-G619 PolarHBondContact O-N 3.05Å; G619-K621 PolarHBondContact O-N 3.3Å; G619-K621 VanDerWaalsContact O-N 3.13Å
620	S	83.1	Confident	84	Confident	83 Å²	83	45.3 Å²	45.3	58%	0.58	27%	0.267	S	S	*	.	S	Bend	trans	65.5	7.5	174.4	-52.6	0	0	0	0	116.2	P510 P617	P510-S620 WeakPolarHBondContact CD-O 3.25Å; P510-S620 WeakPolarHBondContact CG-O 3.18Å; P617-S620 PolarHBondContact O-N 3.33Å; P617-S620 VanDerWaalsContact O-N 3.13Å
621	K	84.7	Confident	83.6	Confident	116 Å²	116	45.1 Å²	45.1	50%	0.504	27%	0.266	S	S	.	.	S	Bend	trans	-141.8	142.3	169.7	-173.9	169.5	-175.9	169.6	0	109.7	D509 G619 D623	D509-K621 VanDerWaalsContact OD1-CA 3.27Å; D509-K621 WeakPolarHBondContact OD1-CA 3.5Å; G619-K621 PolarHBondContact O-N 3.3Å; G619-K621 VanDerWaalsContact O-N 3.13Å; K621-D623 PolarHBondContact O-N 2.86Å
622	W	81.9	Confident	82.8	Confident	32 Å²	32	45.4 Å²	45.4	12%	0.121	27%	0.267	C	S	.	.			trans	-69.1	111.9	173.8	-171.6	-94.1	0	0	0	111.3	D509 P617 P624 I628 N631 I632 L647 L649	D509-W622 PolarHBondContact OD1-N 2.8Å; P617-W622 HydrophobicContact CB-CE3 4.1Å; W622-P624 VanDerWaalsContact O-CD 3.27Å; W622-P624 WeakPolarHBondContact O-CD 3.2Å; W622-I628 HydrophobicContact CH2-CB 4.23Å; W622-I628 HydrophobicContact CH2-CG1 4.14Å; W622-I628 HydrophobicContact CH2-CG2 4.21Å; W622-I628 HydrophobicContact CZ2-CG1 4.14Å; W622-N631 HydrophobicContact CE3-CB 4.15Å; W622-N631 HydrophobicContact CH2-CB 3.96Å; W622-N631 HydrophobicContact CZ3-CB 3.74Å; W622-I632 HydrophobicContact CH2-CD1 4.42Å; W622-I632 HydrophobicContact CZ3-CD1 4.28Å; W622-I632 HydrophobicContact CZ3-CG1 4.14Å; W622-L647 HydrophobicContact CE3-CD2 4.43Å; W622-L647 HydrophobicContact CH2-CD1 4.5Å; W622-L647 HydrophobicContact CH2-CD2 3.61Å; W622-L647 HydrophobicContact CZ2-CD2 4.33Å; W622-L647 HydrophobicContact CZ3-CD2 3.67Å; W622-L649 HydrophobicContact CB-CD2 3.81Å; W622-L649 HydrophobicContact CD2-CD2 3.8Å; W622-L649 HydrophobicContact CE3-CD2 4.49Å; W622-L649 HydrophobicContact CG-CD2 3.44Å; W622-L649 VanDerWaalsContact CG-CD2 3.44Å
623	D	81.8	Confident	82.2	Confident	58 Å²	58	51.9 Å²	51.9	31%	0.31	30%	0.298	S	S	.	.			trans	-82.4	110.5	171.1	-80.8	-27.9	0	0	0	109.8	K621 S625 K626 N631	K621-D623 PolarHBondContact O-N 2.86Å; D623-S625 PolarHBondContact O-N 2.74Å; D623-K626 HydrophobicContact CB-CB 4.43Å; D623-K626 HydrophobicContact CB-CD 3.94Å; D623-K626 HydrophobicContact CB-CG 4.26Å; D623-K626 PolarHBondContact O-N 3Å; D623-K626 WeakPolarHBondContact OD2-CE 3.4Å; D623-K626 IonicContact OD2-NZ 3.68Å; D623-K626 PolarHBondContact OD2-NZ 2.94Å; D623-N631 PolarHBondContact O-ND2 3Å
624	P	75.9	Confident	81.5	Confident	57 Å²	57	52.2 Å²	52.2	37%	0.37	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-5	-179.1	32.1	-37.3	0	0	0	113.5	W622 I816 I818	W622-P624 VanDerWaalsContact O-CD 3.27Å; W622-P624 WeakPolarHBondContact O-CD 3.2Å; P624-I816 WeakPolarHBondContact O-CD1 3.44Å; P624-I818 HydrophobicContact CG-CD1 4.31Å
625	S	74.7	Confident	80.9	Confident	108 Å²	108	55 Å²	55	76%	0.755	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-14.7	176.9	55.8	0	0	0	0	113.8	D623	D623-S625 PolarHBondContact O-N 2.74Å
626	K	74.2	Confident	80.4	Confident	85 Å²	85	59.6 Å²	59.6	37%	0.37	34%	0.338	S	S	.	.	S	Bend	trans	-102.1	158.4	-179.4	-71.3	173.5	-174.8	158.2	0	110.7	D623 D630 N631	D623-K626 HydrophobicContact CB-CB 4.43Å; D623-K626 HydrophobicContact CB-CD 3.94Å; D623-K626 HydrophobicContact CB-CG 4.26Å; D623-K626 PolarHBondContact O-N 3Å; D623-K626 WeakPolarHBondContact OD2-CE 3.4Å; D623-K626 IonicContact OD2-NZ 3.68Å; D623-K626 PolarHBondContact OD2-NZ 2.94Å; K626-D630 HydrophobicContact CB-CB 4.46Å; K626-N631 WeakPolarHBondContact CB-OD1 3.4Å; K626-N631 VanDerWaalsContact CD-OD1 3.25Å; K626-N631 WeakPolarHBondContact CD-OD1 3.45Å
627	T	72	Confident	80.2	Confident	61 Å²	61	61.8 Å²	61.8	37%	0.374	35%	0.353	S	S	.	.			trans	-75.1	157.2	173.8	80.2	0	0	0	0	111	I629 D630 N631	T627-I629 PolarHBondContact O-N 2.63Å; T627-D630 WeakPolarHBondContact CB-OD2 3.46Å; T627-D630 WeakPolarHBondContact CG2-OD2 3.33Å; T627-D630 PolarHBondContact N-OD2 3.25Å; T627-D630 PolarHBondContact O-N 2.59Å; T627-D630 VanDerWaalsContact O-N 3.11Å; T627-D630 PolarHBondContact OG1-N 2.85Å; T627-D630 PolarHBondContact OG1-OD2 2.77Å; T627-N631 PolarHBondContact O-N 3.07Å
628	I	71.9	Confident	80	Confident	30 Å²	30	61.5 Å²	61.5	15%	0.154	35%	0.351	C	S	.	.	H	α-helix	trans	-53.1	-38.1	176.2	-58.2	133.8	0	0	0	111.7	W622 I632 A807	W622-I628 HydrophobicContact CH2-CB 4.23Å; W622-I628 HydrophobicContact CH2-CG1 4.14Å; W622-I628 HydrophobicContact CH2-CG2 4.21Å; W622-I628 HydrophobicContact CZ2-CG1 4.14Å; I628-I632 HydrophobicContact CG2-CD1 3.61Å; I628-I632 WeakPolarHBondContact O-CB 3.28Å; I628-I632 WeakPolarHBondContact O-CD1 3.32Å; I628-I632 VanDerWaalsContact O-CG1 3.32Å; I628-I632 WeakPolarHBondContact O-CG1 3.46Å; I628-I632 PolarHBondContact O-N 2.87Å; I628-I632 VanDerWaalsContact O-N 3.14Å; I628-A807 HydrophobicContact CD1-CB 3.4Å; I628-A807 VanDerWaalsContact CD1-CB 3.4Å; I628-A807 HydrophobicContact CG1-CB 3.88Å
629	I	76.8	Confident	79.9	Confident	36 Å²	36	58.7 Å²	58.7	19%	0.185	34%	0.337	C	S	.	.	H	α-helix	trans	-67.7	-44.6	-178.3	-60.3	136.9	0	0	0	110	T627 Q633 I762	T627-I629 PolarHBondContact O-N 2.63Å; I629-Q633 PolarHBondContact O-N 3.42Å; I629-Q633 VanDerWaalsContact O-N 3.07Å; I629-I762 HydrophobicContact CD1-CG1 4.47Å
630	D	79.7	Confident	79.9	Confident	93 Å²	93	56.8 Å²	56.8	50%	0.497	31%	0.312	S	S	.	.	H	α-helix	trans	-69.4	-36.6	178.4	-53.9	-48.2	0	0	0	112	K626 T627	K626-D630 HydrophobicContact CB-CB 4.46Å; T627-D630 WeakPolarHBondContact CB-OD2 3.46Å; T627-D630 WeakPolarHBondContact CG2-OD2 3.33Å; T627-D630 PolarHBondContact N-OD2 3.25Å; T627-D630 PolarHBondContact O-N 2.59Å; T627-D630 VanDerWaalsContact O-N 3.11Å; T627-D630 PolarHBondContact OG1-N 2.85Å; T627-D630 PolarHBondContact OG1-OD2 2.77Å
631	N	81.6	Confident	80.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.5	-31.9	179	-83.6	-12.5	0	0	0	113.5	P617 I618 W622 D623 K626 T627	P617-N631 WeakPolarHBondContact CA-O 3.21Å; I618-N631 PolarHBondContact N-O 3.19Å; W622-N631 HydrophobicContact CE3-CB 4.15Å; W622-N631 HydrophobicContact CH2-CB 3.96Å; W622-N631 HydrophobicContact CZ3-CB 3.74Å; D623-N631 PolarHBondContact O-ND2 3Å; K626-N631 WeakPolarHBondContact CB-OD1 3.4Å; K626-N631 VanDerWaalsContact CD-OD1 3.25Å; K626-N631 WeakPolarHBondContact CD-OD1 3.45Å; T627-N631 PolarHBondContact O-N 3.07Å
632	I	77.7	Confident	80.5	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.036	27%	0.269	C	S	.	.	H	α-helix	trans	-99.4	-19	-173.5	-63.6	167.3	0	0	0	112.1	C507 W622 I628 L634 L647	C507-I632 HydrophobicContact CB-CD1 4.08Å; W622-I632 HydrophobicContact CH2-CD1 4.42Å; W622-I632 HydrophobicContact CZ3-CD1 4.28Å; W622-I632 HydrophobicContact CZ3-CG1 4.14Å; I628-I632 HydrophobicContact CG2-CD1 3.61Å; I628-I632 WeakPolarHBondContact O-CB 3.28Å; I628-I632 WeakPolarHBondContact O-CD1 3.32Å; I628-I632 VanDerWaalsContact O-CG1 3.32Å; I628-I632 WeakPolarHBondContact O-CG1 3.46Å; I628-I632 PolarHBondContact O-N 2.87Å; I628-I632 VanDerWaalsContact O-N 3.14Å; I632-L634 HydrophobicContact CG2-CB 4.05Å; I632-L634 HydrophobicContact CG2-CD1 3.6Å; I632-L634 HydrophobicContact CG2-CG 3.72Å; I632-L634 PolarHBondContact O-N 2.93Å; I632-L634 VanDerWaalsContact O-N 3.15Å; I632-L647 HydrophobicContact CD1-CD2 4.43Å
633	Q	81.9	Confident	80.9	Confident	137 Å²	137	48.5 Å²	48.5	64%	0.64	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	33.4	179.6	-154.5	-168.2	-26.3	0	0	114.2	I629	I629-Q633 PolarHBondContact O-N 3.42Å; I629-Q633 VanDerWaalsContact O-N 3.07Å
634	L	79.7	Confident	81.3	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	25%	0.252	C	S	.	.			trans	-105.9	137.8	175.7	-72.1	177.9	0	0	0	111.5	L505 F574 I632 L638 L639	L505-L634 HydrophobicContact CD2-CD1 4.2Å; F574-L634 HydrophobicContact CD1-CD1 4.01Å; F574-L634 HydrophobicContact CD1-CD2 4.12Å; F574-L634 HydrophobicContact CE1-CD1 4Å; F574-L634 HydrophobicContact CE1-CD2 3.87Å; I632-L634 HydrophobicContact CG2-CB 4.05Å; I632-L634 HydrophobicContact CG2-CD1 3.6Å; I632-L634 HydrophobicContact CG2-CG 3.72Å; I632-L634 PolarHBondContact O-N 2.93Å; I632-L634 VanDerWaalsContact O-N 3.15Å; L634-L638 HydrophobicContact CD1-CD2 4.13Å; L634-L638 HydrophobicContact CD2-CD2 3.96Å; L634-L638 HydrophobicContact CG-CD2 4.44Å; L634-L639 HydrophobicContact CB-CD1 4.38Å; L634-L639 HydrophobicContact CB-CD2 3.99Å; L634-L639 HydrophobicContact CB-CG 4.01Å; L634-L639 HydrophobicContact CD1-CD2 4.13Å
635	P	81.6	Confident	81.9	Confident	59 Å²	59	45.1 Å²	45.1	38%	0.383	24%	0.244	S	C	.	.			trans	-58.9	141	175.5	-25.2	34.6	0	0	0	112.9	T637 L638 L639	P635-T637 PolarHBondContact O-N 2.69Å; P635-T637 VanDerWaalsContact O-N 3.11Å; P635-L638 WeakPolarHBondContact O-CB 3.4Å; P635-L638 PolarHBondContact O-N 2.97Å; P635-L639 PolarHBondContact O-N 3.09Å; P635-L639 VanDerWaalsContact O-N 3.1Å
636	H	79.9	Confident	82.7	Confident	97 Å²	97	40 Å²	40	45%	0.449	21%	0.209	S	C	.	.	H	α-helix	trans	-54.6	-31	175.3	-66.6	-84	0	0	0	113.6	L638 L639 S640	H636-L638 PolarHBondContact O-N 3.25Å; H636-L639 PolarHBondContact O-N 3.1Å; H636-S640 VanDerWaalsContact O-CB 3.28Å; H636-S640 WeakPolarHBondContact O-CB 3.18Å; H636-S640 PolarHBondContact O-N 3.32Å; H636-S640 PolarHBondContact O-OG 3.5Å
637	T	85.2	Confident	83.2	Confident	76 Å²	76	36.1 Å²	36.1	47%	0.466	19%	0.191	S	C	.	.	H	α-helix	trans	-64	-26.4	175.6	54	0	0	0	0	113	P635 S640 R641	P635-T637 PolarHBondContact O-N 2.69Å; P635-T637 VanDerWaalsContact O-N 3.11Å; T637-S640 PolarHBondContact O-OG 2.9Å; T637-R641 WeakPolarHBondContact O-CG 3.12Å; T637-R641 PolarHBondContact O-NH1 2.82Å
638	L	86.5	Confident	83.9	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-88.3	-48.7	174.1	-166.5	82.7	0	0	0	111.1	F574 M589 L634 P635 H636 S640 R641 F642	F574-L638 HydrophobicContact CE1-CD2 3.41Å; F574-L638 VanDerWaalsContact CE1-CD2 3.41Å; F574-L638 HydrophobicContact CZ-CD2 3.6Å; M589-L638 HydrophobicContact SD-CD1 4Å; L634-L638 HydrophobicContact CD1-CD2 4.13Å; L634-L638 HydrophobicContact CD2-CD2 3.96Å; L634-L638 HydrophobicContact CG-CD2 4.44Å; P635-L638 WeakPolarHBondContact O-CB 3.4Å; P635-L638 PolarHBondContact O-N 2.97Å; H636-L638 PolarHBondContact O-N 3.25Å; L638-S640 PolarHBondContact O-N 3.07Å; L638-R641 WeakPolarHBondContact O-CB 3.49Å; L638-R641 PolarHBondContact O-N 2.94Å; L638-F642 HydrophobicContact CD2-CE2 4Å; L638-F642 HydrophobicContact CG-CE2 3.96Å; L638-F642 WeakPolarHBondContact O-CD2 3.41Å
639	L	83.9	Confident	84.4	Confident	19 Å²	19	35.2 Å²	35.2	10%	0.099	18%	0.184	C	C	.	.	H	α-helix	trans	-56	-37.9	-179.6	-68.7	174.2	0	0	0	111.6	L505 L634 P635 H636 R641 F642 I645	L505-L639 HydrophobicContact CD2-CD2 4.01Å; L634-L639 HydrophobicContact CB-CD1 4.38Å; L634-L639 HydrophobicContact CB-CD2 3.99Å; L634-L639 HydrophobicContact CB-CG 4.01Å; L634-L639 HydrophobicContact CD1-CD2 4.13Å; P635-L639 PolarHBondContact O-N 3.09Å; P635-L639 VanDerWaalsContact O-N 3.1Å; H636-L639 PolarHBondContact O-N 3.1Å; L639-R641 PolarHBondContact O-N 2.8Å; L639-F642 PolarHBondContact O-N 2.94Å; L639-I645 HydrophobicContact CB-CD1 4.49Å; L639-I645 HydrophobicContact CD2-CD1 4.2Å
640	S	84.3	Confident	84.7	Confident	32 Å²	32	37 Å²	37	22%	0.224	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-5.9	175.7	59.4	0	0	0	0	115.5	H636 T637 L638 R767	H636-S640 VanDerWaalsContact O-CB 3.28Å; H636-S640 WeakPolarHBondContact O-CB 3.18Å; H636-S640 PolarHBondContact O-N 3.32Å; H636-S640 PolarHBondContact O-OG 3.5Å; T637-S640 PolarHBondContact O-OG 2.9Å; L638-S640 PolarHBondContact O-N 3.07Å; S640-R767 WeakPolarHBondContact O-CD 3.42Å; S640-R767 PolarHBondContact O-NH1 3.15Å; S640-R767 PolarHBondContact OG-NH1 3.37Å
641	R	89.6	Confident	84.7	Confident	37 Å²	37	34.9 Å²	34.9	14%	0.14	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-13.2	177.3	-70.1	-178.5	169.3	116.7	-24	114.1	R499 H586 M589 E590 T637 L638 L639	R499-R641 PolarHBondContact NH1-O 2.72Å; H586-R641 PolarHBondContact ND1-NH1 3.05Å; H586-R641 PolarHBondContact O-NH2 2.78Å; M589-R641 HydrophobicContact CB-CB 4.3Å; M589-R641 HydrophobicContact CE-CB 3.84Å; M589-R641 HydrophobicContact SD-CB 4.43Å; E590-R641 WeakPolarHBondContact OE2-CD 3.2Å; E590-R641 WeakPolarHBondContact OE2-CG 3.3Å; E590-R641 IonicContact OE2-CZ 2.83Å; E590-R641 IonicContact OE2-NE 3.21Å; E590-R641 PolarHBondContact OE2-NE 3.49Å; E590-R641 IonicContact OE2-NH2 3.64Å; T637-R641 WeakPolarHBondContact O-CG 3.12Å; T637-R641 PolarHBondContact O-NH1 2.82Å; L638-R641 WeakPolarHBondContact O-CB 3.49Å; L638-R641 PolarHBondContact O-N 2.94Å; L639-R641 PolarHBondContact O-N 2.8Å
642	F	89.7	Confident	84.6	Confident	10 Å²	10	41.9 Å²	41.9	4%	0.044	22%	0.218	C	C	.	.			trans	-80.2	134.2	165.2	-67.1	-76.9	0	0	0	108.6	N503 L505 F574 M589 I611 A613 L638 L639 I645	N503-F642 HydrophobicContact CB-CD1 3.94Å; N503-F642 HydrophobicContact CB-CE1 4.49Å; L505-F642 HydrophobicContact CB-CB 4.38Å; L505-F642 HydrophobicContact CB-CD1 3.8Å; L505-F642 HydrophobicContact CB-CD2 4.19Å; L505-F642 HydrophobicContact CB-CE1 4.06Å; L505-F642 HydrophobicContact CB-CE2 4.42Å; L505-F642 HydrophobicContact CB-CG 3.87Å; L505-F642 HydrophobicContact CB-CZ 4.36Å; L505-F642 HydrophobicContact CD1-CZ 4.34Å; L505-F642 HydrophobicContact CD2-CD2 4.1Å; L505-F642 HydrophobicContact CD2-CE2 4.14Å; F574-F642 HydrophobicContact CE2-CZ 4.22Å; F574-F642 HydrophobicContact CZ-CZ 4.14Å; M589-F642 HydrophobicContact CE-CD1 3.7Å; M589-F642 HydrophobicContact CE-CD2 4.01Å; M589-F642 HydrophobicContact CE-CE1 3.55Å; M589-F642 HydrophobicContact CE-CE2 3.88Å; M589-F642 HydrophobicContact CE-CG 3.93Å; M589-F642 HydrophobicContact CE-CZ 3.65Å; M589-F642 HydrophobicContact SD-CZ 4.33Å; I611-F642 HydrophobicContact CG2-CE1 4.48Å; A613-F642 HydrophobicContact CB-CE1 4.16Å; A613-F642 HydrophobicContact CB-CZ 4.23Å; L638-F642 HydrophobicContact CD2-CE2 4Å; L638-F642 HydrophobicContact CG-CE2 3.96Å; L638-F642 WeakPolarHBondContact O-CD2 3.41Å; L639-F642 PolarHBondContact O-N 2.94Å; F642-I645 HydrophobicContact CB-CG1 4.05Å
643	D	90.4	Very high	84.9	Confident	10 Å²	10	45.8 Å²	45.8	5%	0.053	24%	0.239	C	C	.	.	S	Bend	trans	-84.5	-32.4	-179.2	-56	-80.5	0	0	0	111	R499 I502 N503 S771 R774	R499-D643 IonicContact CZ-OD2 3.99Å; R499-D643 IonicContact NH2-OD2 2.79Å; R499-D643 PolarHBondContact NH2-OD2 2.95Å; I502-D643 HydrophobicContact CG2-CB 4.12Å; N503-D643 PolarHBondContact N-OD2 2.9Å; N503-D643 PolarHBondContact O-N 3.14Å; D643-S771 WeakPolarHBondContact OD1-CA 3.39Å; D643-S771 WeakPolarHBondContact OD1-CB 3.44Å; D643-S771 PolarHBondContact OD1-OG 3.31Å; D643-R774 IonicContact OD1-NH1 3.97Å; D643-R774 PolarHBondContact OD1-NH1 2.93Å
644	L	90	Very high	85.3	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.8	175.2	-63.6	174.1	0	0	0	110.3	N503 I504 L505 F646 L775 L799 Q800	N503-L644 PolarHBondContact O-N 3.24Å; I504-L644 WeakPolarHBondContact CA-O 3.44Å; I504-L644 HydrophobicContact CD1-CD1 4.12Å; I504-L644 HydrophobicContact CG1-CB 4.29Å; I504-L644 HydrophobicContact CG1-CD1 4.45Å; L505-L644 PolarHBondContact N-O 3.45Å; L644-F646 HydrophobicContact CB-CE2 4.03Å; L644-F646 HydrophobicContact CB-CZ 4.36Å; L644-F646 HydrophobicContact CD1-CE2 4.06Å; L644-F646 HydrophobicContact CD1-CZ 3.96Å; L644-L775 HydrophobicContact CD1-CD1 4.47Å; L644-L775 HydrophobicContact CD1-CD2 3.82Å; L644-L775 HydrophobicContact CD2-CD1 3.91Å; L644-L775 HydrophobicContact CG-CD1 4.19Å; L644-L775 HydrophobicContact CG-CD2 4.32Å; L644-L799 HydrophobicContact CD1-CD2 3.72Å; L644-L799 HydrophobicContact CD1-CG 4.34Å; L644-L799 HydrophobicContact CD2-CD2 4.42Å; L644-L799 HydrophobicContact CD2-CG 4.37Å; L644-Q800 HydrophobicContact CD2-CB 4.4Å
645	I	89.6	Confident	85.8	Confident	41 Å²	41	51.3 Å²	51.3	21%	0.21	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	103.4	175.1	-56.3	173.2	0	0	0	106.9	L505 L639 F642 A803	L505-I645 HydrophobicContact CB-CG1 4.32Å; L505-I645 HydrophobicContact CB-CG2 4.46Å; L505-I645 HydrophobicContact CD2-CG1 4.48Å; L505-I645 HydrophobicContact CD2-CG2 4.19Å; L505-I645 HydrophobicContact CG-CG2 4.45Å; L505-I645 CarbonylContact O-C 3.59Å; L505-I645 WeakPolarHBondContact O-CA 3.47Å; L639-I645 HydrophobicContact CB-CD1 4.49Å; L639-I645 HydrophobicContact CD2-CD1 4.2Å; F642-I645 HydrophobicContact CB-CG1 4.05Å; I645-A803 WeakPolarHBondContact O-CB 3.4Å
646	F	89.8	Confident	86	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.009	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.2	178.4	-66.2	-71.5	0	0	0	110.6	I474 I504 L505 L506 C507 L644 L799 A803	I474-F646 HydrophobicContact CD1-CB 4.09Å; I474-F646 HydrophobicContact CD1-CG 4.44Å; I474-F646 HydrophobicContact CG1-CB 4.12Å; I474-F646 HydrophobicContact CG1-CD1 3.92Å; I474-F646 HydrophobicContact CG1-CD2 4.46Å; I474-F646 HydrophobicContact CG1-CE1 4.43Å; I474-F646 HydrophobicContact CG1-CG 3.93Å; I474-F646 HydrophobicContact CG2-CD2 4.23Å; I474-F646 HydrophobicContact CG2-CG 4.47Å; I504-F646 HydrophobicContact CD1-CE2 4.44Å; I504-F646 HydrophobicContact CG2-CD2 3.74Å; I504-F646 HydrophobicContact CG2-CE2 3.87Å; L505-F646 PolarHBondContact O-N 2.99Å; L506-F646 HydrophobicContact CD2-CB 4Å; L506-F646 HydrophobicContact CD2-CD2 3.83Å; L506-F646 HydrophobicContact CD2-CG 4.36Å; C507-F646 PolarHBondContact N-O 2.77Å; L644-F646 HydrophobicContact CB-CE2 4.03Å; L644-F646 HydrophobicContact CB-CZ 4.36Å; L644-F646 HydrophobicContact CD1-CE2 4.06Å; L644-F646 HydrophobicContact CD1-CZ 3.96Å; F646-L799 HydrophobicContact CE1-CD1 4.11Å; F646-L799 HydrophobicContact CZ-CD1 4.06Å; F646-L799 HydrophobicContact CZ-CG 4.33Å; F646-A803 HydrophobicContact CD1-CB 4.04Å; F646-A803 HydrophobicContact CE1-CB 4.12Å
647	L	85.6	Confident	86.4	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	95.2	-179.2	-76.7	166.1	0	0	0	109.9	C507 W622 I632 L649 Q806 A807	C507-L647 HydrophobicContact CB-CD2 3.69Å; W622-L647 HydrophobicContact CE3-CD2 4.43Å; W622-L647 HydrophobicContact CH2-CD1 4.5Å; W622-L647 HydrophobicContact CH2-CD2 3.61Å; W622-L647 HydrophobicContact CZ2-CD2 4.33Å; W622-L647 HydrophobicContact CZ3-CD2 3.67Å; I632-L647 HydrophobicContact CD1-CD2 4.43Å; L647-L649 PolarHBondContact O-N 3.27Å; L647-L649 VanDerWaalsContact O-N 3.15Å; L647-Q806 HydrophobicContact CB-CB 3.86Å; L647-Q806 PolarHBondContact O-OE1 3.27Å; L647-Q806 VanDerWaalsContact O-OE1 3.13Å; L647-A807 VanDerWaalsContact CD1-CA 3.47Å; L647-A807 HydrophobicContact CD1-CB 3.38Å
648	I	86.2	Confident	86.8	Confident	15 Å²	15	48.9 Å²	48.9	8%	0.077	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	87.5	179.2	-49.8	159.9	0	0	0	108.3	I474 L506 C507 G508 D509 T512 K514	I474-I648 HydrophobicContact CD1-CD1 3.81Å; I474-I648 HydrophobicContact CD1-CG1 3.37Å; L506-I648 HydrophobicContact CB-CD1 4.35Å; C507-I648 PolarHBondContact O-N 2.74Å; G508-I648 CarbonylContact C-O 3.54Å; G508-I648 WeakPolarHBondContact CA-O 3.43Å; D509-I648 PolarHBondContact N-O 3.09Å; T512-I648 HydrophobicContact CG2-CG2 3.77Å; K514-I648 HydrophobicContact CD-CD1 4.05Å; K514-I648 HydrophobicContact CG-CD1 3.6Å
649	L	83	Confident	86.8	Confident	58 Å²	58	54.5 Å²	54.5	30%	0.304	28%	0.276	S	S	.	.			trans	-77.3	145.3	168.2	-55.4	-179.6	0	0	0	108.8	W622 L647 P651	W622-L649 HydrophobicContact CB-CD2 3.81Å; W622-L649 HydrophobicContact CD2-CD2 3.8Å; W622-L649 HydrophobicContact CE3-CD2 4.49Å; W622-L649 HydrophobicContact CG-CD2 3.44Å; W622-L649 VanDerWaalsContact CG-CD2 3.44Å; L647-L649 PolarHBondContact O-N 3.27Å; L647-L649 VanDerWaalsContact O-N 3.15Å; L649-P651 WeakPolarHBondContact O-CD 3.47Å
650	D	83.4	Confident	87	Confident	73 Å²	73	55.9 Å²	55.9	39%	0.39	28%	0.283	S	S	.	.			trans	-92.5	101.7	175	-171.7	39.3	0	0	0	109.8	D509 T512 Q652	D509-D650 HydrophobicContact CB-CB 4.25Å; T512-D650 HydrophobicContact CG2-CB 4.04Å; D650-Q652 PolarHBondContact O-N 3.26Å
651	P	78.2	Confident	87.2	Confident	48 Å²	48	56.8 Å²	56.8	31%	0.312	29%	0.293	S	S	.	.			trans	-73.1	119.7	175.6	30.9	-33	0	0	0	109.2	L649 D653 Y656	L649-P651 WeakPolarHBondContact O-CD 3.47Å; P651-D653 HydrophobicContact CB-CB 4.5Å; P651-D653 PolarHBondContact O-N 2.99Å; P651-Y656 HydrophobicContact CG-CD1 4.19Å; P651-Y656 HydrophobicContact CG-CE1 4.46Å; P651-Y656 HydrophobicContact CG-CG 4.48Å
652	Q	81.1	Confident	87.3	Confident	147 Å²	147	63.7 Å²	63.7	69%	0.687	32%	0.319	S	S	*	.			trans	-78.9	55.1	178.4	-58.7	-169	-25.2	0	0	111	D650	D650-Q652 PolarHBondContact O-N 3.26Å
653	D	83.9	Confident	87	Confident	90 Å²	90	66 Å²	66	48%	0.481	33%	0.329	S	S	.	.			trans	-105.9	113.5	-172.5	-73.9	-21.6	0	0	0	111.1	P651 V655 Y656 D657	P651-D653 HydrophobicContact CB-CB 4.5Å; P651-D653 PolarHBondContact O-N 2.99Å; D653-V655 PolarHBondContact O-N 3.15Å; D653-Y656 WeakPolarHBondContact O-CB 3.46Å; D653-Y656 PolarHBondContact O-N 2.98Å; D653-D657 PolarHBondContact O-N 3.47Å
654	E	90	Very high	86.7	Confident	165 Å²	165	68.9 Å²	68.9	77%	0.771	34%	0.344	S	S	*	.	H	α-helix	trans	-53	-30.4	-179.3	-61.3	-176.6	171.6	0	0	113.6	T658	E654-T658 WeakPolarHBondContact O-CB 3.33Å; E654-T658 PolarHBondContact O-N 3.4Å; E654-T658 PolarHBondContact O-OG1 3.39Å
655	V	90.4	Very high	86.7	Confident	94 Å²	94	73.6 Å²	73.6	57%	0.57	37%	0.373	S	S	*	.	H	α-helix	trans	-71	-41	178.8	-179.3	0	0	0	0	111.5	D653 R659	D653-V655 PolarHBondContact O-N 3.15Å; V655-R659 WeakPolarHBondContact O-CD 3.32Å; V655-R659 VanDerWaalsContact O-CG 3.28Å; V655-R659 WeakPolarHBondContact O-CG 3.3Å; V655-R659 PolarHBondContact O-N 2.86Å
656	Y	85.5	Confident	86.5	Confident	42 Å²	42	73.2 Å²	73.2	17%	0.165	38%	0.379	C	S	.	.	H	α-helix	trans	-68.6	-49.3	176.5	175.1	-103.7	0	0	0	109.8	Y469 E470 P651 D653 T658 R659 L660	Y469-Y656 HydrophobicContact CD1-CE2 4.12Å; Y469-Y656 HydrophobicContact CE1-CE2 4.45Å; E470-Y656 HydrophobicContact CB-CE2 4.28Å; E470-Y656 VanDerWaalsContact OE2-CD2 3.31Å; E470-Y656 WeakPolarHBondContact OE2-CD2 3.39Å; E470-Y656 VanDerWaalsContact OE2-CE2 3.26Å; E470-Y656 WeakPolarHBondContact OE2-CE2 3.45Å; P651-Y656 HydrophobicContact CG-CD1 4.19Å; P651-Y656 HydrophobicContact CG-CE1 4.46Å; P651-Y656 HydrophobicContact CG-CG 4.48Å; D653-Y656 WeakPolarHBondContact O-CB 3.46Å; D653-Y656 PolarHBondContact O-N 2.98Å; Y656-T658 VanDerWaalsContact C-N 3.31Å; Y656-T658 PolarHBondContact O-N 2.96Å; Y656-R659 WeakPolarHBondContact O-CB 3.47Å; Y656-R659 PolarHBondContact O-N 2.86Å; Y656-L660 HydrophobicContact CE1-CD2 4.24Å; Y656-L660 WeakPolarHBondContact O-CB 3.48Å; Y656-L660 PolarHBondContact O-N 3.12Å
657	D	88.8	Confident	86.1	Confident	77 Å²	77	75.8 Å²	75.8	41%	0.412	39%	0.393	S	S	.	.	H	α-helix	trans	-56	-44.1	176.7	-73.8	-16.5	0	0	0	112.4	D653 R659 L660 A661	D653-D657 PolarHBondContact O-N 3.47Å; D657-R659 VanDerWaalsContact C-N 3.31Å; D657-R659 PolarHBondContact O-N 2.94Å; D657-L660 PolarHBondContact O-N 3.44Å; D657-A661 WeakPolarHBondContact O-CB 3.31Å; D657-A661 PolarHBondContact O-N 2.86Å
658	T	91.8	Very high	85.9	Confident	61 Å²	61	84.2 Å²	84.2	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-63.3	-36.2	178	-63.1	0	0	0	0	112.1	E654 Y656 R662	E654-T658 WeakPolarHBondContact O-CB 3.33Å; E654-T658 PolarHBondContact O-N 3.4Å; E654-T658 PolarHBondContact O-OG1 3.39Å; Y656-T658 VanDerWaalsContact C-N 3.31Å; Y656-T658 PolarHBondContact O-N 2.96Å; T658-R662 VanDerWaalsContact O-CG 3.28Å; T658-R662 WeakPolarHBondContact O-CG 3.4Å; T658-R662 PolarHBondContact O-N 2.85Å
659	R	88.3	Confident	85.9	Confident	120 Å²	120	92 Å²	92	45%	0.453	46%	0.456	S	S	.	.	H	α-helix	trans	-73.9	-46.6	177	-70.4	167.8	179	-165.8	3.8	111.3	Y469 E470 V655 Y656 D657 A661 R662 H663	Y469-R659 HydrophobicContact CE1-CB 3.59Å; Y469-R659 WeakPolarHBondContact OH-CD 3.46Å; E470-R659 IonicContact OE1-NH1 3.71Å; V655-R659 WeakPolarHBondContact O-CD 3.32Å; V655-R659 VanDerWaalsContact O-CG 3.28Å; V655-R659 WeakPolarHBondContact O-CG 3.3Å; V655-R659 PolarHBondContact O-N 2.86Å; Y656-R659 WeakPolarHBondContact O-CB 3.47Å; Y656-R659 PolarHBondContact O-N 2.86Å; D657-R659 VanDerWaalsContact C-N 3.31Å; D657-R659 PolarHBondContact O-N 2.94Å; R659-A661 VanDerWaalsContact C-N 3.34Å; R659-A661 PolarHBondContact O-N 3.1Å; R659-R662 PolarHBondContact O-N 3.41Å; R659-H663 PolarHBondContact O-N 3.41Å
660	L	87.1	Confident	85.4	Confident	47 Å²	47	97.6 Å²	97.6	25%	0.246	47%	0.473	C	S	.	.	H	α-helix	trans	-56.3	-47.5	175.4	177.2	64.3	0	0	0	111.2	Y469 Y656 D657 R662 H663 L664	Y469-L660 HydrophobicContact CD1-CB 4.32Å; Y656-L660 HydrophobicContact CE1-CD2 4.24Å; Y656-L660 WeakPolarHBondContact O-CB 3.48Å; Y656-L660 PolarHBondContact O-N 3.12Å; D657-L660 PolarHBondContact O-N 3.44Å; L660-R662 PolarHBondContact O-N 2.95Å; L660-H663 PolarHBondContact O-N 2.99Å; L660-L664 HydrophobicContact CD1-CD1 4.08Å; L660-L664 HydrophobicContact CD1-CG 4.24Å; L660-L664 HydrophobicContact CG-CD1 4.08Å; L660-L664 WeakPolarHBondContact O-CG 3.46Å; L660-L664 PolarHBondContact O-N 2.98Å
661	A	89.4	Confident	84.4	Confident	52 Å²	52	97.4 Å²	97.4	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-61.4	-43.4	177.3	0	0	0	0	0	112.2	D657 R659 V665	D657-A661 WeakPolarHBondContact O-CB 3.31Å; D657-A661 PolarHBondContact O-N 2.86Å; R659-A661 VanDerWaalsContact C-N 3.34Å; R659-A661 PolarHBondContact O-N 3.1Å; A661-V665 WeakPolarHBondContact O-CB 3.36Å; A661-V665 VanDerWaalsContact O-CG2 3.27Å; A661-V665 WeakPolarHBondContact O-CG2 3.46Å; A661-V665 PolarHBondContact O-N 3.46Å
662	R	90.7	Very high	83.3	Confident	181 Å²	181	100.4 Å²	100.4	68%	0.683	51%	0.505	S	S	*	.	H	α-helix	trans	-62.5	-41.6	174.4	-75.6	173.4	-173.6	147.8	5.3	112.2	T658 R659 L660 G666	T658-R662 VanDerWaalsContact O-CG 3.28Å; T658-R662 WeakPolarHBondContact O-CG 3.4Å; T658-R662 PolarHBondContact O-N 2.85Å; R659-R662 PolarHBondContact O-N 3.41Å; L660-R662 PolarHBondContact O-N 2.95Å; R662-G666 PolarHBondContact O-N 3.37Å
663	H	83.7	Confident	81	Confident	58 Å²	58	97.7 Å²	97.7	27%	0.269	50%	0.499	S	S	.	.	H	α-helix	trans	-61.7	-51.9	177.1	-172.5	64.3	0	0	0	111.3	P466 Y469 R659 L660 V665 G666 L667	P466-H663 PolarHBondContact O-NE2 2.83Å; Y469-H663 HydrophobicContact CD2-CB 4.05Å; Y469-H663 AromaticContact CD2-CG 3.89Å; Y469-H663 HydrophobicContact CG-CB 4.38Å; R659-H663 PolarHBondContact O-N 3.41Å; L660-H663 PolarHBondContact O-N 2.99Å; H663-V665 PolarHBondContact O-N 3.41Å; H663-G666 PolarHBondContact O-N 3.38Å; H663-L667 WeakPolarHBondContact O-CG 3.45Å; H663-L667 PolarHBondContact O-N 3.44Å
664	L	84.3	Confident	78.6	Confident	71 Å²	71	97 Å²	97	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-61	-46.8	179.7	-67.6	174.4	0	0	0	112	L660 G666 L667 Y668	L660-L664 HydrophobicContact CD1-CD1 4.08Å; L660-L664 HydrophobicContact CD1-CG 4.24Å; L660-L664 HydrophobicContact CG-CD1 4.08Å; L660-L664 WeakPolarHBondContact O-CG 3.46Å; L660-L664 PolarHBondContact O-N 2.98Å; L664-G666 VanDerWaalsContact C-N 3.32Å; L664-G666 PolarHBondContact O-N 2.95Å; L664-L667 PolarHBondContact O-N 3.24Å; L664-Y668 WeakPolarHBondContact O-CD2 3.29Å; L664-Y668 PolarHBondContact O-N 2.76Å; L664-Y668 VanDerWaalsContact O-N 3.14Å
665	V	89.1	Confident	76	Confident	101 Å²	101	95.3 Å²	95.3	61%	0.612	51%	0.506	S	S	*	.	H	α-helix	trans	-63	-38.8	176.3	172.7	0	0	0	0	111.4	A661 H663 L667 Y668 Y669	A661-V665 WeakPolarHBondContact O-CB 3.36Å; A661-V665 VanDerWaalsContact O-CG2 3.27Å; A661-V665 WeakPolarHBondContact O-CG2 3.46Å; A661-V665 PolarHBondContact O-N 3.46Å; H663-V665 PolarHBondContact O-N 3.41Å; V665-L667 VanDerWaalsContact C-N 3.35Å; V665-L667 PolarHBondContact O-N 3.08Å; V665-Y668 PolarHBondContact O-N 3.41Å; V665-Y669 WeakPolarHBondContact O-CB 3.41Å; V665-Y669 PolarHBondContact O-N 2.91Å
666	G	86.7	Confident	73.3	Confident	33 Å²	33	98.6 Å²	98.6	34%	0.34	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-39.4	175	0	0	0	0	0	113.3	R662 H663 L664 Y669 R670	R662-G666 PolarHBondContact O-N 3.37Å; H663-G666 PolarHBondContact O-N 3.38Å; L664-G666 VanDerWaalsContact C-N 3.32Å; L664-G666 PolarHBondContact O-N 2.95Å; G666-Y669 PolarHBondContact O-N 2.73Å; G666-R670 PolarHBondContact O-N 2.78Å
667	L	80.1	Confident	70.8	Confident	56 Å²	56	102.4 Å²	102.4	29%	0.293	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-45	174.7	-68.6	169	0	0	0	112	T467 H663 L664 V665 Y669 R670 G671	T467-L667 HydrophobicContact CG2-CD1 4.37Å; H663-L667 WeakPolarHBondContact O-CG 3.45Å; H663-L667 PolarHBondContact O-N 3.44Å; L664-L667 PolarHBondContact O-N 3.24Å; V665-L667 VanDerWaalsContact C-N 3.35Å; V665-L667 PolarHBondContact O-N 3.08Å; L667-Y669 VanDerWaalsContact C-N 3.31Å; L667-Y669 PolarHBondContact O-N 3.04Å; L667-R670 PolarHBondContact O-N 3.39Å; L667-G671 PolarHBondContact O-N 3Å
668	Y	82.8	Confident	68.1	Low	179 Å²	179	108.2 Å²	108.2	70%	0.702	56%	0.562	S	S	*	*	H	α-helix	trans	-64.2	-36.2	175.4	-77	-71.1	0	0	0	112.4	L664 V665 G671 T672	L664-Y668 WeakPolarHBondContact O-CD2 3.29Å; L664-Y668 PolarHBondContact O-N 2.76Å; L664-Y668 VanDerWaalsContact O-N 3.14Å; V665-Y668 PolarHBondContact O-N 3.41Å; Y668-G671 PolarHBondContact O-N 3.2Å; Y668-T672 PolarHBondContact O-N 3.05Å; Y668-T672 PolarHBondContact O-OG1 3.03Å
669	Y	85.2	Confident	65.2	Low	179 Å²	179	110.7 Å²	110.7	70%	0.702	58%	0.581	S	S	*	*	H	α-helix	trans	-65	-49.1	176.3	-164.4	-98.1	0	0	0	111.5	V665 G666 L667 G671 T672 T673	V665-Y669 WeakPolarHBondContact O-CB 3.41Å; V665-Y669 PolarHBondContact O-N 2.91Å; G666-Y669 PolarHBondContact O-N 2.73Å; L667-Y669 VanDerWaalsContact C-N 3.31Å; L667-Y669 PolarHBondContact O-N 3.04Å; Y669-G671 VanDerWaalsContact C-N 3.31Å; Y669-G671 PolarHBondContact O-N 3.4Å; Y669-T672 PolarHBondContact O-N 3.02Å; Y669-T672 VanDerWaalsContact O-N 3.08Å; Y669-T673 PolarHBondContact O-N 3.36Å
670	R	73.7	Confident	62.5	Low	176 Å²	176	109.8 Å²	109.8	66%	0.664	59%	0.593	S	S	*	*	H	α-helix	trans	-61.8	-35.3	173.6	-71.6	-174.9	179.1	-165.1	-2	112.6	G666 L667 T672 T673 D713	G666-R670 PolarHBondContact O-N 2.78Å; L667-R670 PolarHBondContact O-N 3.39Å; R670-T672 PolarHBondContact O-N 3.1Å; R670-T673 PolarHBondContact O-N 3.44Å; R670-T673 PolarHBondContact O-OG1 3.05Å; R670-D713 IonicContact NH1-OD2 3.97Å
671	G	62.6	Low	59.7	Low	69 Å²	69	116.4 Å²	116.4	71%	0.711	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-11.8	174.9	0	0	0	0	0	114.7	L667 Y668 Y669	L667-G671 PolarHBondContact O-N 3Å; Y668-G671 PolarHBondContact O-N 3.2Å; Y669-G671 VanDerWaalsContact C-N 3.31Å; Y669-G671 PolarHBondContact O-N 3.4Å
672	T	53.2	Low	56.9	Low	110 Å²	110	121.6 Å²	121.6	68%	0.675	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-17.5	179.8	-47.9	0	0	0	0	112.5	Y668 Y669 R670 P674	Y668-T672 PolarHBondContact O-N 3.05Å; Y668-T672 PolarHBondContact O-OG1 3.03Å; Y669-T672 PolarHBondContact O-N 3.02Å; Y669-T672 VanDerWaalsContact O-N 3.08Å; R670-T672 PolarHBondContact O-N 3.1Å; T672-P674 WeakPolarHBondContact O-CD 3.35Å
673	T	33.5	Very low	54.4	Low	90 Å²	90	120.9 Å²	120.9	55%	0.552	65%	0.652	S	S	*	*	S	Bend	trans	-73.2	116.1	171.6	44.2	0	0	0	0	109.6	Y669 R670 S675	Y669-T673 PolarHBondContact O-N 3.36Å; R670-T673 PolarHBondContact O-N 3.44Å; R670-T673 PolarHBondContact O-OG1 3.05Å; T673-S675 PolarHBondContact O-N 3.41Å
674	P	32.8	Very low	52.1	Low	76 Å²	76	123.4 Å²	123.4	49%	0.494	67%	0.673	S	S	.	*			trans	-82.7	109.7	-166.4	31.8	-34.9	0	0	0	112.2	T672 Q676 I677	T672-P674 WeakPolarHBondContact O-CD 3.35Å; P674-Q676 HydrophobicContact CB-CB 4.33Å; P674-Q676 PolarHBondContact O-N 3.3Å; P674-I677 HydrophobicContact CB-CG1 4.45Å; P674-I677 HydrophobicContact CG-CD1 3.61Å; P674-I677 HydrophobicContact CG-CG1 3.96Å
675	S	35.5	Very low	49.5	Very low	129 Å²	129	126 Å²	126	90%	0.902	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	46.8	158.1	61	0	0	0	0	111.4	T673	T673-S675 PolarHBondContact O-N 3.41Å
676	Q	34.5	Very low	47	Very low	164 Å²	164	128.2 Å²	128.2	77%	0.766	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	8.3	-176	-70	-168.2	-11.2	0	0	113.3	P674	P674-Q676 HydrophobicContact CB-CB 4.33Å; P674-Q676 PolarHBondContact O-N 3.3Å
677	I	33.7	Very low	44.5	Very low	121 Å²	121	130.9 Å²	130.9	62%	0.621	71%	0.714	S	S	*	*			trans	-92.5	-12.1	-175.3	-68.9	-178.2	0	0	0	113.5	P674 S679	P674-I677 HydrophobicContact CB-CG1 4.45Å; P674-I677 HydrophobicContact CG-CD1 3.61Å; P674-I677 HydrophobicContact CG-CG1 3.96Å; I677-S679 VanDerWaalsContact C-N 3.29Å; I677-S679 PolarHBondContact O-N 2.95Å
678	E	31.1	Very low	42.4	Very low	200 Å²	200	134.6 Å²	134.6	94%	0.935	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	6	-173.9	-62.7	-165.8	141.5	0	0	115.6
679	S	31.5	Very low	40.1	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	28.5	179	69.3	0	0	0	0	114.6	I677	I677-S679 VanDerWaalsContact C-N 3.29Å; I677-S679 PolarHBondContact O-N 2.95Å
680	S	31	Very low	37.7	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	74%	0.736	S	S	*	*			trans	-151.8	72	171.5	63.5	0	0	0	0	113
681	Q	27.9	Very low	35.9	Very low	186 Å²	186	127.2 Å²	127.2	87%	0.869	74%	0.736	S	S	*	*			trans	-90	111.1	155.1	-68.3	-174.6	15.6	0	0	108.5
682	D	30.9	Very low	34.4	Very low	162 Å²	162	135.7 Å²	135.7	87%	0.866	75%	0.747	S	S	*	*			trans	-171.3	150.2	150.1	-103.6	-28.9	0	0	0	111.5
683	I	39.4	Very low	33.3	Very low	166 Å²	166	134.4 Å²	134.4	85%	0.851	76%	0.755	S	S	*	*			trans	104.5	109.3	179	-57.6	161.4	0	0	0	114.2
684	P	34.1	Very low	33.3	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	77%	0.77	S	S	*	*			trans	-104.9	161.3	-167.1	40.5	-37.5	0	0	0	116.2
685	T	30.3	Very low	33.4	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	79%	0.791	S	S	*	*			trans	39.8	118.6	152	46.4	0	0	0	0	120.7
686	N	35.7	Very low	33.2	Very low	147 Å²	147	148.6 Å²	148.6	79%	0.786	79%	0.791	S	S	*	*				-163.9	127.7	105.7	-130.5	-26.8	0	0	0	116.2
687	S	34.7	Very low	33.1	Very low	90 Å²	90	146.5 Å²	146.5	63%	0.629	79%	0.792	S	S	*	*			trans	40	134.9	137.9	-62	0	0	0	0	125
688	N	37.4	Very low	33.1	Very low	133 Å²	133	151.5 Å²	151.5	71%	0.711	80%	0.803	S	S	*	*			trans	88.6	91.8	137.4	-71.2	-23.4	0	0	0	121.4
689	N	33.6	Very low	33	Very low	133 Å²	133	148.3 Å²	148.3	71%	0.711	80%	0.8	S	S	*	*				60.3	126.3	108.2	-76.9	-20.3	0	0	0	121.3
690	N	34.1	Very low	33	Very low	137 Å²	137	146.4 Å²	146.4	73%	0.733	80%	0.797	S	S	*	*			trans	106.7	122.1	133.6	-77.8	-23.2	0	0	0	121
691	T	37	Very low	32.9	Very low	110 Å²	110	146.4 Å²	146.4	68%	0.675	80%	0.804	S	S	*	*			trans	89.3	100.7	139.9	50.1	0	0	0	0	121.7
692	R	29.5	Very low	33.1	Very low	247 Å²	247	143.6 Å²	143.6	93%	0.932	80%	0.799	S	S	*	*				59.1	95.8	121.7	-65.1	176.9	173.6	176.8	-2.7	117.7
693	G	31	Very low	32.9	Very low	82 Å²	82	142.3 Å²	142.3	85%	0.845	79%	0.791	S	S	*	*			trans	-140.3	83.7	162.3	0	0	0	0	0	112.2
694	A	32.8	Very low	32.5	Very low	105 Å²	105	141.5 Å²	141.5	87%	0.868	79%	0.788	S	S	*	*			trans	-79.1	120.3	-175.7	0	0	0	0	0	112.9
695	R	35.9	Very low	32.2	Very low	248 Å²	248	142 Å²	142	94%	0.936	79%	0.785	S	S	*	*			trans	-147.6	111.1	162.5	-97.7	-178.4	173.5	-179	-2.5	111.5
696	R	31.2	Very low	32.3	Very low	241 Å²	241	142.9 Å²	142.9	91%	0.909	78%	0.782	S	S	*	*			trans	-79.3	152.7	159.4	-77.6	-177.2	170.7	-171.4	-3.3	108.7
697	P	33.2	Very low	32	Very low	120 Å²	120	141.1 Å²	141.1	78%	0.779	77%	0.772	S	S	*	*				-143.1	-167.3	63.5	39.8	-18.6	0	0	0	112.8
698	R	33.7	Very low	31.9	Very low	226 Å²	226	142.9 Å²	142.9	85%	0.853	78%	0.784	S	S	*	*			cis	-134.6	164.9	5.2	-79.4	-176.5	175.6	169.8	-0.5	109.9
699	P	28.9	Very low	31.4	Very low	133 Å²	133	143.9 Å²	143.9	86%	0.864	79%	0.785	S	S	*	*			trans	-73.9	144.5	169.9	32.4	-34.8	0	0	0	111.3
700	G	29.9	Very low	31.3	Very low	72 Å²	72	142.6 Å²	142.6	74%	0.742	78%	0.782	S	S	*	*			trans	156	-16.1	-179.8	0	0	0	0	0	115.3	V702	G700-V702 PolarHBondContact O-N 3.12Å
701	A	29.5	Very low	31.2	Very low	100 Å²	100	144.1 Å²	144.1	83%	0.826	79%	0.79	S	S	*	*			trans	-72.5	113.3	168.5	0	0	0	0	0	109.5	L703	A701-L703 PolarHBondContact O-N 3.02Å; A701-L703 VanDerWaalsContact O-N 3.14Å
702	V	31.2	Very low	31	Very low	127 Å²	127	145.6 Å²	145.6	77%	0.77	79%	0.794	S	S	*	*			trans	-70.8	105.1	164.1	-178.8	0	0	0	0	106.6	G700 L704	G700-V702 PolarHBondContact O-N 3.12Å; V702-L704 VanDerWaalsContact C-N 3.34Å; V702-L704 HydrophobicContact CG1-CG 4.13Å; V702-L704 PolarHBondContact O-N 3.13Å
703	L	27.6	Very low	31.4	Very low	135 Å²	135	137.4 Å²	137.4	71%	0.707	77%	0.769	S	S	*	*			trans	-70.4	91.2	171.1	-170.9	81.4	0	0	0	107.9	A701 D705	A701-L703 PolarHBondContact O-N 3.02Å; A701-L703 VanDerWaalsContact O-N 3.14Å; L703-D705 WeakPolarHBondContact CD2-OD2 3.39Å; L703-D705 WeakPolarHBondContact CG-OD1 3.47Å; L703-D705 PolarHBondContact O-N 3.12Å
704	L	31.7	Very low	32	Very low	150 Å²	150	137.5 Å²	137.5	79%	0.785	76%	0.755	S	S	*	*			trans	-88.3	85	161.5	-76.4	176.1	0	0	0	107.8	V702 M706	V702-L704 VanDerWaalsContact C-N 3.34Å; V702-L704 HydrophobicContact CG1-CG 4.13Å; V702-L704 PolarHBondContact O-N 3.13Å; L704-M706 PolarHBondContact O-N 2.88Å; L704-M706 VanDerWaalsContact O-N 3.1Å
705	D	27	Very low	32.9	Very low	121 Å²	121	135.6 Å²	135.6	65%	0.647	74%	0.735	S	S	*	*			trans	-68	95.2	161.9	-65.3	-33.4	0	0	0	107.9	L703	L703-D705 WeakPolarHBondContact CD2-OD2 3.39Å; L703-D705 WeakPolarHBondContact CG-OD1 3.47Å; L703-D705 PolarHBondContact O-N 3.12Å
706	M	33.5	Very low	33.7	Very low	144 Å²	144	130.8 Å²	130.8	71%	0.709	72%	0.721	S	S	*	*			trans	-138	89	165.5	-74.3	-87.1	63.7	0	0	109.6	L704	L704-M706 PolarHBondContact O-N 2.88Å; L704-M706 VanDerWaalsContact O-N 3.1Å
707	D	29.1	Very low	35	Very low	109 Å²	109	120.3 Å²	120.3	58%	0.583	68%	0.683	S	S	*	*			trans	48.6	120.8	143.6	-54.2	-23.8	0	0	0	120.7	Q709	D707-Q709 PolarHBondContact O-N 3.23Å
708	S	31.3	Very low	36.6	Very low	127 Å²	127	119.2 Å²	119.2	89%	0.888	67%	0.671	S	S	*	*	S	Bend	trans	-70.7	64.3	162.6	54.2	0	0	0	0	111.6
709	Q	28.3	Very low	38.3	Very low	155 Å²	155	110.1 Å²	110.1	72%	0.724	65%	0.648	S	S	*	*			trans	-144.1	66.3	175.6	-69.3	-173.7	-3.2	0	0	109.5	D707	D707-Q709 PolarHBondContact O-N 3.23Å
710	T	30.9	Very low	40.5	Very low	105 Å²	105	111.4 Å²	111.4	64%	0.644	64%	0.64	S	S	*	*			trans	-131.3	27.9	-176.5	59.9	0	0	0	0	114.8	D712	T710-D712 VanDerWaalsContact C-N 3.32Å
711	D	33.2	Very low	42.8	Very low	170 Å²	170	109.6 Å²	109.6	91%	0.909	61%	0.613	S	S	*	*	S	Bend	trans	-85.3	-13.1	154.1	-65.3	-44.7	0	0	0	111.2
712	D	32.8	Very low	45.3	Very low	141 Å²	141	105.1 Å²	105.1	75%	0.754	58%	0.575	S	S	*	*			trans	-102.3	41.1	178.3	-76.8	-53.5	0	0	0	113.1	T710 P714	T710-D712 VanDerWaalsContact C-N 3.32Å; D712-P714 WeakPolarHBondContact O-CD 3.42Å
713	D	37.9	Very low	47.6	Very low	74 Å²	74	100.5 Å²	100.5	40%	0.396	54%	0.544	S	S	.	.			trans	-69.2	103.2	160.9	-105.7	-19.3	0	0	0	106.8	R670 S715 F716	R670-D713 IonicContact NH1-OD2 3.97Å; D713-S715 PolarHBondContact O-N 3.17Å; D713-F716 PolarHBondContact O-N 3.19Å; D713-F716 VanDerWaalsContact O-N 3.11Å
714	P	42.8	Very low	50.1	Low	85 Å²	85	94.7 Å²	94.7	55%	0.552	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-3.3	-164.9	30.7	-36.8	0	0	0	113.6	R459 D712	R459-P714 VanDerWaalsContact CD-O 3.25Å; R459-P714 WeakPolarHBondContact CD-O 3.39Å; R459-P714 PolarHBondContact NE-O 2.94Å; R459-P714 PolarHBondContact NH1-O 3.48Å; D712-P714 WeakPolarHBondContact O-CD 3.42Å
715	S	51.2	Low	52.6	Low	64 Å²	64	87.7 Å²	87.7	45%	0.448	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.2	177.5	49.9	0	0	0	0	114.1	D713 V717	D713-S715 PolarHBondContact O-N 3.17Å; S715-V717 PolarHBondContact O-N 2.62Å; S715-V717 VanDerWaalsContact O-N 3.09Å
716	F	52.2	Low	55.4	Low	147 Å²	147	82.6 Å²	82.6	65%	0.645	45%	0.45	S	S	*	.			trans	-83.6	87.9	-176.7	-160.3	-97.8	0	0	0	112.7	D713 N718	D713-F716 PolarHBondContact O-N 3.19Å; D713-F716 VanDerWaalsContact O-N 3.11Å; F716-N718 WeakPolarHBondContact CE1-OD1 3.39Å
717	V	59.1	Low	57.7	Low	21 Å²	21	75.8 Å²	75.8	13%	0.127	42%	0.417	C	S	.	.			trans	-80.6	118.1	168	-179.5	0	0	0	0	109.1	R459 L460 S715 G719 L722	R459-V717 HydrophobicContact CG-CG2 3.94Å; L460-V717 HydrophobicContact CD2-CG1 4.18Å; L460-V717 HydrophobicContact CD2-CG2 4.3Å; S715-V717 PolarHBondContact O-N 2.62Å; S715-V717 VanDerWaalsContact O-N 3.09Å; V717-G719 PolarHBondContact O-N 3.09Å; V717-L722 HydrophobicContact CG1-CB 4.31Å
718	N	67.8	Low	60.4	Low	97 Å²	97	70.7 Å²	70.7	52%	0.519	39%	0.389	S	S	.	.			trans	-54	126.1	176.7	-84.7	-34	0	0	0	111.5	F716 K720 L721 L722	F716-N718 WeakPolarHBondContact CE1-OD1 3.39Å; N718-K720 PolarHBondContact O-N 3.03Å; N718-L721 HydrophobicContact CB-CB 4.04Å; N718-L721 WeakPolarHBondContact O-CB 3.4Å; N718-L721 PolarHBondContact O-N 3.21Å; N718-L722 PolarHBondContact O-N 3.42Å
719	G	69	Low	63	Low	35 Å²	35	64.7 Å²	64.7	36%	0.361	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-18.7	-177.7	0	0	0	0	0	114.8	V717 K723	V717-G719 PolarHBondContact O-N 3.09Å; G719-K723 WeakPolarHBondContact O-CG 3.34Å
720	K	73.9	Confident	65.7	Low	161 Å²	161	60.2 Å²	60.2	70%	0.7	33%	0.325	S	S	*	.	H	α-helix	trans	-72.2	-54.4	167.7	-66.6	-171.9	177.5	-169.7	0	110.9	N718 L722 K723 D724	N718-K720 PolarHBondContact O-N 3.03Å; K720-L722 PolarHBondContact O-N 2.71Å; K720-K723 WeakPolarHBondContact O-CA 3.5Å; K720-K723 WeakPolarHBondContact O-CB 3.4Å; K720-K723 PolarHBondContact O-N 3.11Å; K720-D724 PolarHBondContact O-N 3.13Å; K720-D724 VanDerWaalsContact O-N 3.09Å
721	L	79.2	Confident	68	Low	34 Å²	34	56.9 Å²	56.9	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-54.7	-38.5	178.3	-166.3	72.5	0	0	0	112.5	E446 F447 L450 N718 D724 Y725	E446-L721 WeakPolarHBondContact OE2-CD1 3.45Å; F447-L721 HydrophobicContact CD1-CD1 4.39Å; F447-L721 HydrophobicContact CE1-CD1 3.74Å; F447-L721 HydrophobicContact CE1-CG 4.36Å; L450-L721 HydrophobicContact CD1-CD2 3.78Å; L450-L721 HydrophobicContact CD1-CG 4.42Å; N718-L721 HydrophobicContact CB-CB 4.04Å; N718-L721 WeakPolarHBondContact O-CB 3.4Å; N718-L721 PolarHBondContact O-N 3.21Å; L721-D724 PolarHBondContact O-N 2.91Å; L721-Y725 VanDerWaalsContact O-CB 3.28Å; L721-Y725 WeakPolarHBondContact O-CB 3.43Å; L721-Y725 PolarHBondContact O-N 3.12Å
722	L	81.5	Confident	70.4	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-41.3	173.7	178	62.8	0	0	0	112.7	L460 I464 L524 V717 N718 K720 I726	L460-L722 HydrophobicContact CD2-CD1 3.96Å; I464-L722 HydrophobicContact CG1-CD2 4.28Å; L524-L722 HydrophobicContact CD1-CD2 4.09Å; L524-L722 HydrophobicContact CD2-CD2 4.16Å; V717-L722 HydrophobicContact CG1-CB 4.31Å; N718-L722 PolarHBondContact O-N 3.42Å; K720-L722 PolarHBondContact O-N 2.71Å; L722-I726 HydrophobicContact CD1-CD1 3.96Å; L722-I726 HydrophobicContact CD1-CG1 4.39Å; L722-I726 HydrophobicContact CG-CD1 3.95Å; L722-I726 WeakPolarHBondContact O-CD1 3.14Å; L722-I726 VanDerWaalsContact O-CG1 3.22Å; L722-I726 WeakPolarHBondContact O-CG1 3.15Å; L722-I726 PolarHBondContact O-N 3.36Å
723	K	78.8	Confident	73	Confident	30 Å²	30	47 Å²	47	13%	0.13	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-45.4	178.2	-70.4	177.6	-172.2	-136.2	0	110.9	R523 L524 G719 K720 Y725 I726 A727	R523-K723 PolarHBondContact O-NZ 2.87Å; L524-K723 HydrophobicContact CD1-CG 4.2Å; L524-K723 WeakPolarHBondContact O-CE 3.5Å; L524-K723 PolarHBondContact O-NZ 3.49Å; G719-K723 WeakPolarHBondContact O-CG 3.34Å; K720-K723 WeakPolarHBondContact O-CA 3.5Å; K720-K723 WeakPolarHBondContact O-CB 3.4Å; K720-K723 PolarHBondContact O-N 3.11Å; K723-Y725 PolarHBondContact O-N 2.87Å; K723-I726 PolarHBondContact O-N 2.99Å; K723-A727 PolarHBondContact O-N 3.37Å
724	D	80.3	Confident	75.3	Confident	13 Å²	13	48.3 Å²	48.3	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-63.3	-42.2	178.6	-58.2	-4.2	0	0	0	111.3	F439 R443 F447 K720 L721 I726 A727 Y728	F439-D724 HydrophobicContact CE1-CB 3.91Å; R443-D724 IonicContact CZ-OD2 2.86Å; R443-D724 IonicContact NE-OD2 3.24Å; R443-D724 IonicContact NH1-OD2 3.74Å; R443-D724 PolarHBondContact NH1-OD2 3.42Å; F447-D724 HydrophobicContact CE1-CB 4.07Å; F447-D724 HydrophobicContact CE2-CB 4.49Å; F447-D724 HydrophobicContact CZ-CB 3.54Å; K720-D724 PolarHBondContact O-N 3.13Å; K720-D724 VanDerWaalsContact O-N 3.09Å; L721-D724 PolarHBondContact O-N 2.91Å; D724-I726 PolarHBondContact O-N 3.06Å; D724-A727 WeakPolarHBondContact O-CB 3.48Å; D724-A727 PolarHBondContact O-N 3.47Å; D724-Y728 WeakPolarHBondContact O-CB 3.29Å; D724-Y728 PolarHBondContact O-N 2.99Å
725	Y	85.7	Confident	77.6	Confident	3 Å²	3	44.4 Å²	44.4	1%	0.012	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-42.4	175.4	-172.9	-96.6	0	0	0	112.1	F447 L460 F483 L721 K723 A729 L782 L784	F447-Y725 HydrophobicContact CB-CD2 3.78Å; F447-Y725 HydrophobicContact CB-CE2 4.02Å; F447-Y725 AromaticContact CD1-CD2 3.74Å; F447-Y725 HydrophobicContact CD1-CD2 3.74Å; F447-Y725 HydrophobicContact CD1-CG 4.48Å; F447-Y725 AromaticContact CG-CD2 3.88Å; F447-Y725 HydrophobicContact CG-CD2 3.88Å; L460-Y725 HydrophobicContact CD1-CD1 4.44Å; L460-Y725 HydrophobicContact CD1-CE1 4.11Å; F483-Y725 AromaticContact CE1-CD1 4Å; F483-Y725 HydrophobicContact CE1-CD1 4Å; F483-Y725 HydrophobicContact CE1-CE1 4.04Å; F483-Y725 AromaticContact CZ-CD1 3.77Å; F483-Y725 HydrophobicContact CZ-CD1 3.77Å; F483-Y725 AromaticContact CZ-CE1 3.73Å; F483-Y725 HydrophobicContact CZ-CE1 3.73Å; L721-Y725 VanDerWaalsContact O-CB 3.28Å; L721-Y725 WeakPolarHBondContact O-CB 3.43Å; L721-Y725 PolarHBondContact O-N 3.12Å; K723-Y725 PolarHBondContact O-N 2.87Å; Y725-A729 VanDerWaalsContact O-CB 3.22Å; Y725-A729 WeakPolarHBondContact O-CB 3.4Å; Y725-A729 PolarHBondContact O-N 3.45Å; Y725-L782 PolarHBondContact OH-O 2.89Å; Y725-L784 HydrophobicContact CE2-CD1 4.01Å; Y725-L784 HydrophobicContact CE2-CD2 4.31Å; Y725-L784 HydrophobicContact CE2-CG 4.26Å; Y725-L784 WeakPolarHBondContact OH-CG 3.31Å
726	I	85.3	Confident	79.5	Confident	14 Å²	14	48.6 Å²	48.6	7%	0.072	23%	0.232	C	C	.	.	H	α-helix	trans	-64.8	-39.3	175.3	-67.9	160.4	0	0	0	111.2	L482 F483 L722 K723 D724 K730	L482-I726 HydrophobicContact CB-CD1 4.11Å; L482-I726 HydrophobicContact CD1-CD1 4.37Å; F483-I726 HydrophobicContact CD1-CG1 4.34Å; F483-I726 HydrophobicContact CD1-CG2 4.49Å; F483-I726 HydrophobicContact CE1-CB 4.31Å; F483-I726 HydrophobicContact CE1-CG1 3.84Å; F483-I726 HydrophobicContact CZ-CG1 3.92Å; L722-I726 HydrophobicContact CD1-CD1 3.96Å; L722-I726 HydrophobicContact CD1-CG1 4.39Å; L722-I726 HydrophobicContact CG-CD1 3.95Å; L722-I726 WeakPolarHBondContact O-CD1 3.14Å; L722-I726 VanDerWaalsContact O-CG1 3.22Å; L722-I726 WeakPolarHBondContact O-CG1 3.15Å; L722-I726 PolarHBondContact O-N 3.36Å; K723-I726 PolarHBondContact O-N 2.99Å; D724-I726 PolarHBondContact O-N 3.06Å; I726-K730 HydrophobicContact CG2-CD 4.28Å; I726-K730 WeakPolarHBondContact O-CB 3.35Å; I726-K730 WeakPolarHBondContact O-CG 3.5Å; I726-K730 PolarHBondContact O-N 2.97Å
727	A	81.4	Confident	81.2	Confident	2 Å²	2	45 Å²	45	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-55.6	175.7	0	0	0	0	0	111.6	V417 F439 K723 D724 A729 K730 M731	V417-A727 HydrophobicContact CB-CB 4.15Å; V417-A727 HydrophobicContact CG1-CB 3.66Å; V417-A727 HydrophobicContact CG2-CB 3.68Å; F439-A727 HydrophobicContact CZ-CB 4.05Å; K723-A727 PolarHBondContact O-N 3.37Å; D724-A727 WeakPolarHBondContact O-CB 3.48Å; D724-A727 PolarHBondContact O-N 3.47Å; A727-A729 VanDerWaalsContact C-N 3.31Å; A727-A729 PolarHBondContact O-N 2.96Å; A727-K730 PolarHBondContact O-N 2.94Å; A727-K730 VanDerWaalsContact O-N 3.14Å; A727-M731 HydrophobicContact CB-CE 4.47Å; A727-M731 WeakPolarHBondContact O-CG 3.38Å; A727-M731 PolarHBondContact O-N 2.96Å
728	Y	84.9	Confident	82.9	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-56.9	-44	179.2	-177.8	-108.5	0	0	0	112	L436 I444 F447 H448 D724 K732 Y733 L784	L436-Y728 HydrophobicContact CD2-CD2 4.14Å; L436-Y728 HydrophobicContact CD2-CE2 4.21Å; I444-Y728 HydrophobicContact CD1-CE2 4.32Å; I444-Y728 HydrophobicContact CG1-CE2 4.1Å; I444-Y728 HydrophobicContact CG2-CE2 4.37Å; I444-Y728 WeakPolarHBondContact CG2-OH 3.36Å; F447-Y728 HydrophobicContact CB-CD1 4.39Å; F447-Y728 AromaticContact CD2-CD1 3.81Å; F447-Y728 HydrophobicContact CD2-CD1 3.81Å; F447-Y728 HydrophobicContact CD2-CD2 4.42Å; F447-Y728 HydrophobicContact CD2-CE1 4.34Å; F447-Y728 AromaticContact CD2-CG 3.85Å; F447-Y728 HydrophobicContact CD2-CG 3.85Å; F447-Y728 HydrophobicContact CE2-CG 4.25Å; F447-Y728 HydrophobicContact CG-CD1 4.46Å; H448-Y728 AromaticContact NE2-CE1 3.78Å; H448-Y728 AromaticContact NE2-CZ 3.44Å; H448-Y728 PolarHBondContact NE2-OH 3.09Å; D724-Y728 WeakPolarHBondContact O-CB 3.29Å; D724-Y728 PolarHBondContact O-N 2.99Å; Y728-K732 HydrophobicContact CE1-CD 4.36Å; Y728-K732 HydrophobicContact CE2-CD 3.85Å; Y728-K732 WeakPolarHBondContact O-CB 3.24Å; Y728-K732 PolarHBondContact O-N 2.78Å; Y728-K732 VanDerWaalsContact O-N 3.1Å; Y728-K732 PolarHBondContact OH-NZ 2.86Å; Y728-Y733 HydrophobicContact CD1-CE2 4.29Å; Y728-Y733 AromaticContact CE1-CE2 3.88Å; Y728-Y733 HydrophobicContact CE1-CE2 3.88Å; Y728-L784 HydrophobicContact CD1-CD1 4.32Å; Y728-L784 HydrophobicContact CD1-CD2 4.45Å; Y728-L784 HydrophobicContact CE1-CD1 4.07Å
729	A	86.9	Confident	84	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-42.5	177.1	0	0	0	0	0	112.7	F483 Y725 A727 Y733 L784	F483-A729 HydrophobicContact CD1-CB 3.75Å; F483-A729 HydrophobicContact CE1-CB 3.57Å; Y725-A729 VanDerWaalsContact O-CB 3.22Å; Y725-A729 WeakPolarHBondContact O-CB 3.4Å; Y725-A729 PolarHBondContact O-N 3.45Å; A727-A729 VanDerWaalsContact C-N 3.31Å; A727-A729 PolarHBondContact O-N 2.96Å; A729-Y733 PolarHBondContact O-N 3.04Å; A729-L784 HydrophobicContact CB-CD2 3.75Å
730	K	83.8	Confident	85.2	Confident	61 Å²	61	54.6 Å²	54.6	27%	0.265	25%	0.253	S	S	.	.	H	α-helix	trans	-67	-41.6	179.6	-83.4	-178.6	173.7	175.4	0	113.4	L482 F483 I726 A727	L482-K730 WeakPolarHBondContact O-CE 3.14Å; L482-K730 PolarHBondContact O-NZ 2.68Å; F483-K730 WeakPolarHBondContact O-CE 3.47Å; I726-K730 HydrophobicContact CG2-CD 4.28Å; I726-K730 WeakPolarHBondContact O-CB 3.35Å; I726-K730 WeakPolarHBondContact O-CG 3.5Å; I726-K730 PolarHBondContact O-N 2.97Å; A727-K730 PolarHBondContact O-N 2.94Å; A727-K730 VanDerWaalsContact O-N 3.14Å
731	M	80.6	Confident	86	Confident	35 Å²	35	47 Å²	47	17%	0.172	22%	0.22	C	C	.	.	H	α-helix	trans	-74.8	-43.5	-176.3	-67.6	164.3	-179.3	0	0	112.1	V417 Q418 N419 I435 A727 F734	V417-M731 HydrophobicContact CG1-CE 4.22Å; Q418-M731 VanDerWaalsContact O-CE 3.29Å; Q418-M731 WeakPolarHBondContact O-CE 3.46Å; N419-M731 WeakPolarHBondContact OD1-CE 3.48Å; I435-M731 HydrophobicContact CB-SD 4.49Å; I435-M731 HydrophobicContact CG2-CE 3.49Å; I435-M731 VanDerWaalsContact CG2-CE 3.49Å; I435-M731 HydrophobicContact CG2-SD 3.67Å; A727-M731 HydrophobicContact CB-CE 4.47Å; A727-M731 WeakPolarHBondContact O-CG 3.38Å; A727-M731 PolarHBondContact O-N 2.96Å; M731-F734 WeakPolarHBondContact O-CE2 3.32Å; M731-F734 WeakPolarHBondContact O-CZ 3.42Å
732	K	83.5	Confident	86.6	Confident	94 Å²	94	46.3 Å²	46.3	41%	0.409	22%	0.221	S	C	.	.	H	α-helix	trans	-93.6	-28	-168.9	-172.7	172.1	178.9	175.3	0	114.7	Y728	Y728-K732 HydrophobicContact CE1-CD 4.36Å; Y728-K732 HydrophobicContact CE2-CD 3.85Å; Y728-K732 WeakPolarHBondContact O-CB 3.24Å; Y728-K732 PolarHBondContact O-N 2.78Å; Y728-K732 VanDerWaalsContact O-N 3.1Å; Y728-K732 PolarHBondContact OH-NZ 2.86Å
733	Y	86.8	Confident	87.2	Confident	10 Å²	10	50.7 Å²	50.7	4%	0.039	24%	0.242	C	C	.	.			trans	-112.3	115.6	-168.7	-62.6	-88.3	0	0	0	112.7	H448 Y728 A729 P735 R781 L784 N786	H448-Y733 AromaticContact CE1-CZ 3.82Å; H448-Y733 PolarHBondContact CE1-OH 3.29Å; Y728-Y733 HydrophobicContact CD1-CE2 4.29Å; Y728-Y733 AromaticContact CE1-CE2 3.88Å; Y728-Y733 HydrophobicContact CE1-CE2 3.88Å; A729-Y733 PolarHBondContact O-N 3.04Å; Y733-P735 WeakPolarHBondContact O-CD 3.48Å; Y733-R781 PolarHBondContact O-NE 3.16Å; Y733-R781 PolarHBondContact O-NH2 2.97Å; Y733-L784 HydrophobicContact CD1-CB 4.36Å; Y733-L784 WeakPolarHBondContact CD1-O 3.42Å; Y733-L784 HydrophobicContact CD2-CB 4.3Å; Y733-L784 HydrophobicContact CD2-CD2 3.84Å; Y733-L784 HydrophobicContact CE1-CB 3.97Å; Y733-L784 WeakPolarHBondContact CE1-O 3.2Å; Y733-L784 HydrophobicContact CE2-CB 3.88Å; Y733-L784 HydrophobicContact CE2-CD1 4.28Å; Y733-L784 HydrophobicContact CE2-CD2 3.74Å; Y733-L784 HydrophobicContact CE2-CG 4.17Å; Y733-N786 WeakPolarHBondContact CD1-OD1 3.28Å
734	F	87.3	Confident	87.9	Confident	102 Å²	102	51.6 Å²	51.6	45%	0.447	25%	0.245	S	C	.	.			trans	-120.2	78.8	176.1	-59	-79.9	0	0	0	109.5	T486 M731 K736	T486-F734 HydrophobicContact CG2-CB 4.44Å; M731-F734 WeakPolarHBondContact O-CE2 3.32Å; M731-F734 WeakPolarHBondContact O-CZ 3.42Å; F734-K736 PolarHBondContact O-N 2.86Å
735	P	91.2	Very high	88.4	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.019	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-59.3	132.5	-175.1	21	-34.2	0	0	0	113.3	T486 Y733 E777 A780 R781 N786 V788	T486-P735 VanDerWaalsContact CG2-CD 3.45Å; T486-P735 HydrophobicContact CG2-CG 3.8Å; Y733-P735 WeakPolarHBondContact O-CD 3.48Å; P735-E777 HydrophobicContact CG-CB 4.18Å; P735-E777 HydrophobicContact CG-CG 4.41Å; P735-E777 WeakPolarHBondContact CG-O 3.33Å; P735-A780 HydrophobicContact CB-CB 3.68Å; P735-A780 HydrophobicContact CG-CB 3.96Å; P735-R781 HydrophobicContact CG-CG 3.86Å; P735-N786 WeakPolarHBondContact CA-O 3.49Å; P735-V788 HydrophobicContact CB-CG2 3.9Å
736	K	89.9	Confident	88.8	Confident	152 Å²	152	55.1 Å²	55.1	66%	0.661	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	141.4	172.8	-64.4	179.2	-177	175.1	0	110	F734 N786 H787 V788	F734-K736 PolarHBondContact O-N 2.86Å; K736-N786 PolarHBondContact N-O 2.99Å; K736-H787 WeakPolarHBondContact O-CA 3.49Å; K736-V788 PolarHBondContact O-N 2.92Å
737	L	89.2	Confident	89	Confident	71 Å²	71	61.3 Å²	61.3	37%	0.372	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130	177.9	-170	67.3	0	0	0	110	A741 L745 V788	L737-A741 HydrophobicContact CD1-CB 3.61Å; L737-A741 HydrophobicContact CG-CB 4.38Å; L737-L745 HydrophobicContact CD1-CD1 4.04Å; L737-L745 HydrophobicContact CD2-CD1 4.47Å; L737-V788 HydrophobicContact CD1-CB 4.06Å; L737-V788 HydrophobicContact CD1-CG1 4.06Å; L737-V788 HydrophobicContact CD1-CG2 4.47Å
738	T	93.3	Very high	89.3	Confident	44 Å²	44	62 Å²	62	27%	0.27	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-81.5	158.6	171.3	57.6	0	0	0	0	111	E740 A741 G742 H787 V788	T738-E740 VanDerWaalsContact C-N 3.35Å; T738-E740 PolarHBondContact O-N 2.91Å; T738-A741 PolarHBondContact O-N 3.32Å; T738-A741 VanDerWaalsContact OG1-CB 3.25Å; T738-A741 WeakPolarHBondContact OG1-CB 3.39Å; T738-A741 PolarHBondContact OG1-N 2.86Å; T738-G742 PolarHBondContact O-N 3.24Å; T738-H787 HydrophobicContact CG2-CB 4.09Å; T738-V788 WeakPolarHBondContact CB-O 3.35Å; T738-V788 VanDerWaalsContact CG2-O 3.25Å; T738-V788 WeakPolarHBondContact CG2-O 3.29Å; T738-V788 PolarHBondContact OG1-O 2.98Å
739	E	91.8	Very high	89.4	Confident	164 Å²	164	63.3 Å²	63.3	77%	0.766	30%	0.297	S	S	*	.	H	α-helix	trans	-61.3	-42.8	178	-171.8	165.6	-158.4	0	0	111.7	A741 G742 E743	E739-A741 PolarHBondContact O-N 3.26Å; E739-G742 WeakPolarHBondContact O-CA 3.35Å; E739-G742 PolarHBondContact O-N 3.39Å; E739-G742 VanDerWaalsContact O-N 3.13Å; E739-E743 PolarHBondContact O-N 2.79Å
740	E	93	Very high	89.5	Confident	147 Å²	147	66.5 Å²	66.5	69%	0.687	32%	0.316	S	S	*	.	H	α-helix	trans	-57.8	-45.5	175.2	-60.2	-176.3	169.3	0	0	112.8	T738 E743 Y744	T738-E740 VanDerWaalsContact C-N 3.35Å; T738-E740 PolarHBondContact O-N 2.91Å; E740-E743 PolarHBondContact O-N 3.11Å; E740-Y744 PolarHBondContact O-N 3.03Å
741	A	92.4	Very high	89.5	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65.3	-39.5	175.9	0	0	0	0	0	111.5	L737 T738 E739 Y744 L745 V788	L737-A741 HydrophobicContact CD1-CB 3.61Å; L737-A741 HydrophobicContact CG-CB 4.38Å; T738-A741 PolarHBondContact O-N 3.32Å; T738-A741 VanDerWaalsContact OG1-CB 3.25Å; T738-A741 WeakPolarHBondContact OG1-CB 3.39Å; T738-A741 PolarHBondContact OG1-N 2.86Å; E739-A741 PolarHBondContact O-N 3.26Å; A741-Y744 PolarHBondContact O-N 3.44Å; A741-L745 WeakPolarHBondContact O-CB 3.29Å; A741-L745 VanDerWaalsContact O-CG 3.29Å; A741-L745 WeakPolarHBondContact O-CG 3.36Å; A741-L745 PolarHBondContact O-N 3.33Å; A741-V788 HydrophobicContact CB-CG1 4.35Å
742	G	91.8	Very high	89.5	Confident	20 Å²	20	67.2 Å²	67.2	21%	0.206	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-48.9	174.4	0	0	0	0	0	112.8	T738 E739 Y744 L745 V746	T738-G742 PolarHBondContact O-N 3.24Å; E739-G742 WeakPolarHBondContact O-CA 3.35Å; E739-G742 PolarHBondContact O-N 3.39Å; E739-G742 VanDerWaalsContact O-N 3.13Å; G742-Y744 PolarHBondContact O-N 3.2Å; G742-L745 PolarHBondContact O-N 2.89Å; G742-V746 WeakPolarHBondContact O-CG2 3.45Å; G742-V746 PolarHBondContact O-N 3.44Å; G742-V746 VanDerWaalsContact O-N 3.1Å
743	E	93.2	Very high	89.4	Confident	97 Å²	97	69.9 Å²	69.9	45%	0.453	33%	0.328	S	S	.	.	H	α-helix	trans	-61.1	-44.5	175.8	-73.2	-162.7	-174	0	0	112.4	E739 E740 L745 V746 R747	E739-E743 PolarHBondContact O-N 2.79Å; E740-E743 PolarHBondContact O-N 3.11Å; E743-L745 PolarHBondContact O-N 2.98Å; E743-V746 PolarHBondContact O-N 3.34Å; E743-R747 VanDerWaalsContact O-CG 3.31Å; E743-R747 WeakPolarHBondContact O-CG 3.38Å; E743-R747 PolarHBondContact O-N 3.33Å; E743-R747 IonicContact OE2-CZ 3.1Å; E743-R747 IonicContact OE2-NE 3.39Å; E743-R747 IonicContact OE2-NH2 2.67Å; E743-R747 PolarHBondContact OE2-NH2 3.43Å
744	Y	92.9	Very high	89.2	Confident	50 Å²	50	76.4 Å²	76.4	20%	0.196	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-44.8	179.9	179.1	-103.6	0	0	0	111.8	E740 A741 G742 V746 R747 E748 C793 R794	E740-Y744 PolarHBondContact O-N 3.03Å; A741-Y744 PolarHBondContact O-N 3.44Å; G742-Y744 PolarHBondContact O-N 3.2Å; Y744-V746 VanDerWaalsContact C-N 3.34Å; Y744-V746 PolarHBondContact O-N 3.26Å; Y744-R747 PolarHBondContact O-N 2.88Å; Y744-E748 HydrophobicContact CD1-CG 4.44Å; Y744-E748 HydrophobicContact CD2-CG 4.5Å; Y744-E748 HydrophobicContact CE1-CG 3.82Å; Y744-E748 HydrophobicContact CE2-CG 3.83Å; Y744-E748 VanDerWaalsContact CZ-CG 3.44Å; Y744-E748 PolarHBondContact O-N 3.5Å; Y744-E748 WeakPolarHBondContact OH-CG 3.39Å; Y744-E748 PolarHBondContact OH-OE1 3.23Å; Y744-C793 HydrophobicContact CD1-CB 3.56Å; Y744-C793 HydrophobicContact CE1-CB 3.94Å; Y744-R794 HydrophobicContact CE1-CG 3.74Å; Y744-R794 HydrophobicContact CE2-CG 4.32Å
745	L	92.3	Very high	88.5	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-60.9	-39.3	175.5	-73.1	173	0	0	0	112.8	L737 A741 G742 E743 Y749 L769 L772 V773 C793	L737-L745 HydrophobicContact CD1-CD1 4.04Å; L737-L745 HydrophobicContact CD2-CD1 4.47Å; A741-L745 WeakPolarHBondContact O-CB 3.29Å; A741-L745 VanDerWaalsContact O-CG 3.29Å; A741-L745 WeakPolarHBondContact O-CG 3.36Å; A741-L745 PolarHBondContact O-N 3.33Å; G742-L745 PolarHBondContact O-N 2.89Å; E743-L745 PolarHBondContact O-N 2.98Å; L745-Y749 VanDerWaalsContact O-CB 3.29Å; L745-Y749 WeakPolarHBondContact O-CB 3.46Å; L745-Y749 PolarHBondContact O-N 3.46Å; L745-L769 HydrophobicContact CB-CD1 4.02Å; L745-L772 HydrophobicContact CD2-CB 3.86Å; L745-L772 HydrophobicContact CD2-CD1 4.46Å; L745-V773 HydrophobicContact CD1-CG2 3.84Å; L745-C793 HydrophobicContact CD2-CB 3.92Å; L745-C793 HydrophobicContact CG-CB 4.13Å
746	V	92.4	Very high	87.4	Confident	86 Å²	86	76.5 Å²	76.5	52%	0.521	36%	0.363	S	S	.	.	H	α-helix	trans	-64.8	-44.2	176.1	170.3	0	0	0	0	111.3	G742 E743 Y744 Y749 V750	G742-V746 WeakPolarHBondContact O-CG2 3.45Å; G742-V746 PolarHBondContact O-N 3.44Å; G742-V746 VanDerWaalsContact O-N 3.1Å; E743-V746 PolarHBondContact O-N 3.34Å; Y744-V746 VanDerWaalsContact C-N 3.34Å; Y744-V746 PolarHBondContact O-N 3.26Å; V746-Y749 PolarHBondContact O-N 3.02Å; V746-V750 WeakPolarHBondContact O-CG2 3.2Å; V746-V750 PolarHBondContact O-N 3.35Å
747	R	91.3	Very high	86.4	Confident	144 Å²	144	73.9 Å²	73.9	54%	0.543	36%	0.364	S	S	.	.	H	α-helix	trans	-61	-50.5	177.4	-64.7	170.8	-157.5	-177.3	7.6	111.1	E743 Y744 Y749 V750 E751	E743-R747 VanDerWaalsContact O-CG 3.31Å; E743-R747 WeakPolarHBondContact O-CG 3.38Å; E743-R747 PolarHBondContact O-N 3.33Å; E743-R747 IonicContact OE2-CZ 3.1Å; E743-R747 IonicContact OE2-NE 3.39Å; E743-R747 IonicContact OE2-NH2 2.67Å; E743-R747 PolarHBondContact OE2-NH2 3.43Å; Y744-R747 PolarHBondContact O-N 2.88Å; R747-Y749 VanDerWaalsContact C-N 3.33Å; R747-Y749 PolarHBondContact O-N 3.49Å; R747-V750 PolarHBondContact O-N 3.16Å; R747-E751 PolarHBondContact O-N 3.19Å
748	E	86.7	Confident	85.1	Confident	17 Å²	17	71.9 Å²	71.9	8%	0.079	36%	0.36	C	S	.	.	H	α-helix	trans	-62.4	-36.3	178.3	-79.2	-73.5	172.5	0	0	113.1	Y744 E751 M752 R797 R801	Y744-E748 HydrophobicContact CD1-CG 4.44Å; Y744-E748 HydrophobicContact CD2-CG 4.5Å; Y744-E748 HydrophobicContact CE1-CG 3.82Å; Y744-E748 HydrophobicContact CE2-CG 3.83Å; Y744-E748 VanDerWaalsContact CZ-CG 3.44Å; Y744-E748 PolarHBondContact O-N 3.5Å; Y744-E748 WeakPolarHBondContact OH-CG 3.39Å; Y744-E748 PolarHBondContact OH-OE1 3.23Å; E748-E751 PolarHBondContact O-N 3.25Å; E748-M752 WeakPolarHBondContact O-CB 3.44Å; E748-M752 PolarHBondContact O-N 2.89Å; E748-R797 HydrophobicContact CG-CG 4.21Å; E748-R797 PolarHBondContact O-NH2 2.9Å; E748-R797 IonicContact OE2-CZ 3.67Å; E748-R797 IonicContact OE2-NE 2.98Å; E748-R797 PolarHBondContact OE2-NE 3.42Å; E748-R797 IonicContact OE2-NH2 2.59Å; E748-R797 PolarHBondContact OE2-NH2 3.44Å; E748-R801 IonicContact OE1-NH2 3.74Å; E748-R801 IonicContact OE2-NH2 3.69Å; E748-R801 PolarHBondContact OE2-NH2 3.28Å; E748-R801 VanDerWaalsContact OE2-NH2 3.11Å
749	Y	88.1	Confident	83.4	Confident	29 Å²	29	82.2 Å²	82.2	11%	0.114	39%	0.394	C	S	.	.	H	α-helix	trans	-65.4	-42.1	174.6	174.9	-102.7	0	0	0	112.2	L745 V746 R747 M752 R753 L769	L745-Y749 VanDerWaalsContact O-CB 3.29Å; L745-Y749 WeakPolarHBondContact O-CB 3.46Å; L745-Y749 PolarHBondContact O-N 3.46Å; V746-Y749 PolarHBondContact O-N 3.02Å; R747-Y749 VanDerWaalsContact C-N 3.33Å; R747-Y749 PolarHBondContact O-N 3.49Å; Y749-M752 HydrophobicContact CD2-CE 3.74Å; Y749-M752 HydrophobicContact CE2-CE 4.33Å; Y749-M752 WeakPolarHBondContact O-CB 3.47Å; Y749-M752 PolarHBondContact O-N 2.76Å; Y749-R753 PolarHBondContact O-N 2.7Å; Y749-L769 HydrophobicContact CD2-CB 3.95Å; Y749-L769 HydrophobicContact CE2-CB 4.4Å; Y749-L769 HydrophobicContact CG-CB 4.38Å
750	V	88.6	Confident	81.7	Confident	66 Å²	66	77.6 Å²	77.6	40%	0.4	39%	0.39	S	S	.	.	H	α-helix	trans	-63.4	-41.2	174.9	169.8	0	0	0	0	111.1	V746 R747 R753 K754	V746-V750 WeakPolarHBondContact O-CG2 3.2Å; V746-V750 PolarHBondContact O-N 3.35Å; R747-V750 PolarHBondContact O-N 3.16Å; V750-R753 PolarHBondContact O-N 2.97Å; V750-K754 HydrophobicContact CG1-CD 4.48Å; V750-K754 WeakPolarHBondContact O-CG 3.4Å; V750-K754 PolarHBondContact O-N 2.9Å
751	E	83.8	Confident	80.2	Confident	97 Å²	97	73.6 Å²	73.6	45%	0.453	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-44.1	174.5	-71.5	-175.1	-172.1	0	0	112.5	R747 E748 R753 K754 L755	R747-E751 PolarHBondContact O-N 3.19Å; E748-E751 PolarHBondContact O-N 3.25Å; E751-R753 PolarHBondContact O-N 3.48Å; E751-K754 WeakPolarHBondContact O-CB 3.28Å; E751-K754 PolarHBondContact O-N 3.44Å; E751-K754 VanDerWaalsContact O-N 3.15Å; E751-L755 WeakPolarHBondContact O-CG 3.48Å; E751-L755 PolarHBondContact O-N 3.33Å
752	M	79.7	Confident	78.7	Confident	15 Å²	15	76.7 Å²	76.7	7%	0.074	39%	0.388	C	S	.	.	H	α-helix	trans	-56.4	-40	174.9	-167.2	166.5	51.3	0	0	112	E748 Y749 L755 G756 A764 Q768 R797	E748-M752 WeakPolarHBondContact O-CB 3.44Å; E748-M752 PolarHBondContact O-N 2.89Å; Y749-M752 HydrophobicContact CD2-CE 3.74Å; Y749-M752 HydrophobicContact CE2-CE 4.33Å; Y749-M752 WeakPolarHBondContact O-CB 3.47Å; Y749-M752 PolarHBondContact O-N 2.76Å; M752-L755 PolarHBondContact O-N 2.93Å; M752-G756 PolarHBondContact O-N 3.2Å; M752-A764 HydrophobicContact CB-CB 4.32Å; M752-A764 HydrophobicContact CE-CB 4.36Å; M752-A764 HydrophobicContact CG-CB 3.78Å; M752-Q768 HydrophobicContact CE-CB 3.62Å; M752-Q768 HydrophobicContact CE-CG 4.49Å; M752-Q768 VanDerWaalsContact CE-OE1 3.3Å; M752-Q768 HydrophobicContact SD-CB 4.4Å; M752-Q768 PolarHBondContact SD-OE1 3.43Å; M752-R797 PolarHBondContact SD-NH1 3.22Å
753	R	81.6	Confident	77.5	Confident	150 Å²	150	78.4 Å²	78.4	57%	0.566	40%	0.397	S	S	*	.	H	α-helix	trans	-72.8	-32.5	178.7	-163.6	170.7	-178.2	174.1	-1.7	113.2	Y749 V750 E751 S757 A764	Y749-R753 PolarHBondContact O-N 2.7Å; V750-R753 PolarHBondContact O-N 2.97Å; E751-R753 PolarHBondContact O-N 3.48Å; R753-S757 PolarHBondContact O-OG 2.97Å; R753-S757 VanDerWaalsContact O-OG 3.14Å; R753-A764 HydrophobicContact CB-CB 4.24Å
754	K	82.5	Confident	76.5	Confident	147 Å²	147	74.4 Å²	74.4	64%	0.639	38%	0.38	S	S	*	.	H	α-helix	trans	-64.7	-46.8	170.1	-70.8	169.7	-178.3	173.8	0	111.1	V750 E751 S757	V750-K754 HydrophobicContact CG1-CD 4.48Å; V750-K754 WeakPolarHBondContact O-CG 3.4Å; V750-K754 PolarHBondContact O-N 2.9Å; E751-K754 WeakPolarHBondContact O-CB 3.28Å; E751-K754 PolarHBondContact O-N 3.44Å; E751-K754 VanDerWaalsContact O-N 3.15Å; K754-S757 WeakPolarHBondContact O-CB 3.47Å; K754-S757 PolarHBondContact O-N 3.47Å; K754-S757 PolarHBondContact O-OG 3.14Å
755	L	73.1	Confident	76	Confident	99 Å²	99	76.9 Å²	76.9	52%	0.518	39%	0.389	S	S	.	.	H	α-helix	trans	-60.3	-48.6	177.2	-74.7	156.2	0	0	0	111.7	E751 M752 S757 Q761	E751-L755 WeakPolarHBondContact O-CG 3.48Å; E751-L755 PolarHBondContact O-N 3.33Å; M752-L755 PolarHBondContact O-N 2.93Å; L755-S757 PolarHBondContact O-N 3.25Å; L755-Q761 PolarHBondContact O-OE1 3.14Å
756	G	67.7	Low	75.6	Confident	8 Å²	8	80.7 Å²	80.7	8%	0.082	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	15.8	-179.1	0	0	0	0	0	116.4	M752 S763	M752-G756 PolarHBondContact O-N 3.2Å; G756-S763 PolarHBondContact O-OG 3.28Å; G756-S763 VanDerWaalsContact O-OG 3.05Å
757	S	68.5	Low	75.3	Confident	97 Å²	97	79 Å²	79	68%	0.678	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.9	173.7	-62.2	0	0	0	0	113.3	R753 K754 L755	R753-S757 PolarHBondContact O-OG 2.97Å; R753-S757 VanDerWaalsContact O-OG 3.14Å; K754-S757 WeakPolarHBondContact O-CB 3.47Å; K754-S757 PolarHBondContact O-N 3.47Å; K754-S757 PolarHBondContact O-OG 3.14Å; L755-S757 PolarHBondContact O-N 3.25Å
758	G	62.8	Low	75.1	Confident	29 Å²	29	73.8 Å²	73.8	30%	0.299	38%	0.381	S	S	.	.	S	Bend	trans	-69.1	137.3	176.1	0	0	0	0	0	113.5	G760 Q761	G758-G760 PolarHBondContact O-N 3.29Å; G758-Q761 PolarHBondContact O-N 3.37Å
759	R	56.3	Low	75.3	Confident	261 Å²	261	75.4 Å²	75.4	99%	0.985	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	122.5	177.8	-173.5	177.5	-179.3	172.4	-0.1	110.3
760	G	56	Low	75.3	Confident	66 Å²	66	77.5 Å²	77.5	68%	0.68	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	1.1	-179.4	0	0	0	0	0	115.1	G758	G758-G760 PolarHBondContact O-N 3.29Å
761	Q	61.5	Low	75.4	Confident	64 Å²	64	74.5 Å²	74.5	30%	0.299	38%	0.383	S	S	.	.	S	Bend	trans	-92	157.2	175	-60.6	-176.3	-14.5	0	0	111.3	L755 G758 S763 I809	L755-Q761 PolarHBondContact O-OE1 3.14Å; G758-Q761 PolarHBondContact O-N 3.37Å; Q761-S763 PolarHBondContact O-N 2.81Å; Q761-I809 HydrophobicContact CG-CD1 3.75Å
762	I	62.9	Low	75.8	Confident	65 Å²	65	69.9 Å²	69.9	33%	0.333	36%	0.361	S	S	.	.			trans	-70.4	103	176.2	-57.5	172	0	0	0	108.4	I629	I629-I762 HydrophobicContact CD1-CG1 4.47Å
763	S	65.9	Low	76.3	Confident	56 Å²	56	70.8 Å²	70.8	39%	0.392	37%	0.367	S	S	.	.			trans	-63.5	144.3	177.4	-63	0	0	0	0	112.3	G756 Q761 Y765	G756-S763 PolarHBondContact O-OG 3.28Å; G756-S763 VanDerWaalsContact O-OG 3.05Å; Q761-S763 PolarHBondContact O-N 2.81Å; S763-Y765 WeakPolarHBondContact O-CD2 3.36Å; S763-Y765 WeakPolarHBondContact O-CE2 3.28Å; S763-Y765 PolarHBondContact O-N 3.34Å
764	A	72.3	Confident	76.9	Confident	12 Å²	12	64.3 Å²	64.3	10%	0.099	34%	0.343	C	S	.	.			trans	-77.2	113.8	-175	0	0	0	0	0	112.5	M752 R753	M752-A764 HydrophobicContact CB-CB 4.32Å; M752-A764 HydrophobicContact CE-CB 4.36Å; M752-A764 HydrophobicContact CG-CB 3.78Å; R753-A764 HydrophobicContact CB-CB 4.24Å
765	Y	81.3	Confident	77.4	Confident	102 Å²	102	57.3 Å²	57.3	40%	0.4	31%	0.312	S	S	.	.			trans	-90.6	150.6	177.8	-60	-71.7	0	0	0	111.8	S763 R767 Q768	S763-Y765 WeakPolarHBondContact O-CD2 3.36Å; S763-Y765 WeakPolarHBondContact O-CE2 3.28Å; S763-Y765 PolarHBondContact O-N 3.34Å; Y765-R767 PolarHBondContact O-N 3.1Å; Y765-R767 VanDerWaalsContact O-N 3.12Å; Y765-Q768 WeakPolarHBondContact O-CB 3.5Å; Y765-Q768 PolarHBondContact O-N 3.46Å
766	P	85.1	Confident	78.4	Confident	85 Å²	85	52.7 Å²	52.7	55%	0.552	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-33.3	175.9	-27.8	35.7	0	0	0	114.4	Q768 L769	P766-Q768 PolarHBondContact O-N 3.41Å; P766-Q768 VanDerWaalsContact O-N 3.12Å; P766-L769 WeakPolarHBondContact O-CB 3.5Å; P766-L769 PolarHBondContact O-N 3.34Å
767	R	86.2	Confident	79.6	Confident	50 Å²	50	52.5 Å²	52.5	19%	0.189	29%	0.285	C	S	.	.	H	α-helix	trans	-56.7	-28.4	177.4	-160.2	-175.6	-68.2	123.8	-3.8	113.2	E590 S640 Y765 L769 E770 S771	E590-R767 IonicContact OE1-CZ 3.16Å; E590-R767 VanDerWaalsContact OE1-CZ 3.3Å; E590-R767 IonicContact OE1-NE 2.73Å; E590-R767 PolarHBondContact OE1-NE 3.45Å; E590-R767 VanDerWaalsContact OE1-NE 3.1Å; E590-R767 IonicContact OE1-NH2 3.85Å; E590-R767 PolarHBondContact OE1-NH2 3.3Å; E590-R767 IonicContact OE2-CZ 3.12Å; E590-R767 VanDerWaalsContact OE2-CZ 3.25Å; E590-R767 IonicContact OE2-NE 2.81Å; E590-R767 PolarHBondContact OE2-NE 3.1Å; E590-R767 IonicContact OE2-NH2 3.03Å; E590-R767 PolarHBondContact OE2-NH2 2.96Å; S640-R767 WeakPolarHBondContact O-CD 3.42Å; S640-R767 PolarHBondContact O-NH1 3.15Å; S640-R767 PolarHBondContact OG-NH1 3.37Å; Y765-R767 PolarHBondContact O-N 3.1Å; Y765-R767 VanDerWaalsContact O-N 3.12Å; R767-L769 PolarHBondContact O-N 2.78Å; R767-E770 WeakPolarHBondContact O-CB 3.5Å; R767-E770 PolarHBondContact O-N 3.21Å; R767-E770 VanDerWaalsContact O-N 3.07Å; R767-S771 PolarHBondContact O-N 3.35Å; R767-S771 PolarHBondContact O-OG 3.06Å; R767-S771 VanDerWaalsContact O-OG 3.13Å
768	Q	86.7	Confident	80.7	Confident	34 Å²	34	47.9 Å²	47.9	16%	0.159	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-24.4	176.4	-65.8	174.2	-30	0	0	113.3	M752 Y765 P766 L772	M752-Q768 HydrophobicContact CE-CB 3.62Å; M752-Q768 HydrophobicContact CE-CG 4.49Å; M752-Q768 VanDerWaalsContact CE-OE1 3.3Å; M752-Q768 HydrophobicContact SD-CB 4.4Å; M752-Q768 PolarHBondContact SD-OE1 3.43Å; Y765-Q768 WeakPolarHBondContact O-CB 3.5Å; Y765-Q768 PolarHBondContact O-N 3.46Å; P766-Q768 PolarHBondContact O-N 3.41Å; P766-Q768 VanDerWaalsContact O-N 3.12Å; Q768-L772 WeakPolarHBondContact O-CG 3.21Å; Q768-L772 PolarHBondContact O-N 3.47Å; Q768-L772 VanDerWaalsContact O-N 3.07Å
769	L	90.5	Very high	82.1	Confident	52 Å²	52	47.2 Å²	47.2	27%	0.272	24%	0.242	S	C	.	.	H	α-helix	trans	-70.8	-40.7	171	179.2	61.4	0	0	0	110.5	L745 Y749 P766 R767 S771 L772 V773	L745-L769 HydrophobicContact CB-CD1 4.02Å; Y749-L769 HydrophobicContact CD2-CB 3.95Å; Y749-L769 HydrophobicContact CE2-CB 4.4Å; Y749-L769 HydrophobicContact CG-CB 4.38Å; P766-L769 WeakPolarHBondContact O-CB 3.5Å; P766-L769 PolarHBondContact O-N 3.34Å; R767-L769 PolarHBondContact O-N 2.78Å; L769-S771 VanDerWaalsContact C-N 3.34Å; L769-L772 PolarHBondContact O-N 3.41Å; L769-V773 WeakPolarHBondContact O-CG2 3.29Å; L769-V773 PolarHBondContact O-N 2.98Å
770	E	88.5	Confident	83.9	Confident	72 Å²	72	34.8 Å²	34.8	34%	0.336	20%	0.195	S	C	.	.	H	α-helix	trans	-62.1	-42.8	172.8	-54.4	176.3	-170.1	0	0	111.3	R767 L772 V773 R774	R767-E770 WeakPolarHBondContact O-CB 3.5Å; R767-E770 PolarHBondContact O-N 3.21Å; R767-E770 VanDerWaalsContact O-N 3.07Å; E770-L772 VanDerWaalsContact C-N 3.35Å; E770-L772 PolarHBondContact O-N 2.88Å; E770-V773 PolarHBondContact O-N 3.23Å; E770-R774 WeakPolarHBondContact O-CG 3.43Å; E770-R774 PolarHBondContact O-N 2.89Å; E770-R774 IonicContact OE2-CZ 3.25Å; E770-R774 IonicContact OE2-NH1 2.69Å; E770-R774 IonicContact OE2-NH2 3.61Å; E770-R774 PolarHBondContact OE2-NH2 3.41Å
771	S	89.8	Confident	85.5	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.028	17%	0.165	C	C	.	.	H	α-helix	trans	-56.2	-46.2	173.7	-56.1	0	0	0	0	112.1	D643 R767 L769 R774 L775	D643-S771 WeakPolarHBondContact OD1-CA 3.39Å; D643-S771 WeakPolarHBondContact OD1-CB 3.44Å; D643-S771 PolarHBondContact OD1-OG 3.31Å; R767-S771 PolarHBondContact O-N 3.35Å; R767-S771 PolarHBondContact O-OG 3.06Å; R767-S771 VanDerWaalsContact O-OG 3.13Å; L769-S771 VanDerWaalsContact C-N 3.34Å; S771-R774 PolarHBondContact O-N 3.29Å; S771-L775 WeakPolarHBondContact O-CB 3.48Å; S771-L775 VanDerWaalsContact O-CG 3.28Å; S771-L775 WeakPolarHBondContact O-CG 3.39Å; S771-L775 PolarHBondContact O-N 3.11Å
772	L	92	Very high	86.9	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-38.8	176.5	-76.5	169.4	0	0	0	112.4	L745 Q768 L769 E770 L775 A776 A796 R797 Q800	L745-L772 HydrophobicContact CD2-CB 3.86Å; L745-L772 HydrophobicContact CD2-CD1 4.46Å; Q768-L772 WeakPolarHBondContact O-CG 3.21Å; Q768-L772 PolarHBondContact O-N 3.47Å; Q768-L772 VanDerWaalsContact O-N 3.07Å; L769-L772 PolarHBondContact O-N 3.41Å; E770-L772 VanDerWaalsContact C-N 3.35Å; E770-L772 PolarHBondContact O-N 2.88Å; L772-L775 PolarHBondContact O-N 3.11Å; L772-A776 WeakPolarHBondContact O-CB 3.4Å; L772-A776 PolarHBondContact O-N 3.37Å; L772-A796 HydrophobicContact CD2-CB 4.39Å; L772-R797 HydrophobicContact CD2-CB 4.35Å; L772-Q800 HydrophobicContact CD2-CB 4.28Å
773	V	92.2	Very high	88.2	Confident	33 Å²	33	30.5 Å²	30.5	20%	0.2	15%	0.152	C	C	.	.	H	α-helix	trans	-63.8	-47.6	174.7	171	0	0	0	0	110.9	L745 L769 E770 L775 A776 E777	L745-V773 HydrophobicContact CD1-CG2 3.84Å; L769-V773 WeakPolarHBondContact O-CG2 3.29Å; L769-V773 PolarHBondContact O-N 2.98Å; E770-V773 PolarHBondContact O-N 3.23Å; V773-L775 VanDerWaalsContact C-N 3.33Å; V773-L775 PolarHBondContact O-N 3.47Å; V773-A776 PolarHBondContact O-N 3.42Å; V773-E777 WeakPolarHBondContact CG1-OE1 3.48Å; V773-E777 WeakPolarHBondContact O-CB 3.18Å; V773-E777 WeakPolarHBondContact O-CG 3.41Å; V773-E777 PolarHBondContact O-N 2.92Å
774	R	92.3	Very high	89.3	Confident	15 Å²	15	28.6 Å²	28.6	6%	0.057	14%	0.137	C	C	.	.	H	α-helix	trans	-57.6	-44.1	176.4	-69.1	170.3	-171.8	123.2	14.5	111.9	R499 I502 D643 E770 S771 A778	R499-R774 PolarHBondContact O-NE 2.92Å; R499-R774 PolarHBondContact O-NH2 3.27Å; R499-R774 VanDerWaalsContact O-NH2 3.12Å; I502-R774 HydrophobicContact CG1-CB 4.05Å; D643-R774 IonicContact OD1-NH1 3.97Å; D643-R774 PolarHBondContact OD1-NH1 2.93Å; E770-R774 WeakPolarHBondContact O-CG 3.43Å; E770-R774 PolarHBondContact O-N 2.89Å; E770-R774 IonicContact OE2-CZ 3.25Å; E770-R774 IonicContact OE2-NH1 2.69Å; E770-R774 IonicContact OE2-NH2 3.61Å; E770-R774 PolarHBondContact OE2-NH2 3.41Å; S771-R774 PolarHBondContact O-N 3.29Å; R774-A778 WeakPolarHBondContact O-CB 3.16Å; R774-A778 PolarHBondContact O-N 3.1Å
775	L	93.3	Very high	90.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.2	-43.6	178.9	-72.8	165.5	0	0	0	112.4	L480 I502 L644 S771 L772 V773 E777 A778 H779 A796	L480-L775 HydrophobicContact CB-CD2 4.31Å; L480-L775 HydrophobicContact CD1-CD2 3.82Å; I502-L775 HydrophobicContact CD1-CD2 3.95Å; I502-L775 HydrophobicContact CG2-CD2 4.17Å; L644-L775 HydrophobicContact CD1-CD1 4.47Å; L644-L775 HydrophobicContact CD1-CD2 3.82Å; L644-L775 HydrophobicContact CD2-CD1 3.91Å; L644-L775 HydrophobicContact CG-CD1 4.19Å; L644-L775 HydrophobicContact CG-CD2 4.32Å; S771-L775 WeakPolarHBondContact O-CB 3.48Å; S771-L775 VanDerWaalsContact O-CG 3.28Å; S771-L775 WeakPolarHBondContact O-CG 3.39Å; S771-L775 PolarHBondContact O-N 3.11Å; L772-L775 PolarHBondContact O-N 3.11Å; V773-L775 VanDerWaalsContact C-N 3.33Å; V773-L775 PolarHBondContact O-N 3.47Å; L775-E777 VanDerWaalsContact C-N 3.35Å; L775-A778 PolarHBondContact O-N 3.32Å; L775-H779 PolarHBondContact O-N 3.2Å; L775-A796 HydrophobicContact CB-CB 3.71Å
776	A	93.8	Very high	90.6	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-37	177.7	0	0	0	0	0	112.1	L772 V773 H779 A780 V788 D792 A796	L772-A776 WeakPolarHBondContact O-CB 3.4Å; L772-A776 PolarHBondContact O-N 3.37Å; V773-A776 PolarHBondContact O-N 3.42Å; A776-H779 PolarHBondContact O-N 2.77Å; A776-A780 WeakPolarHBondContact O-CB 3.25Å; A776-A780 PolarHBondContact O-N 2.91Å; A776-V788 HydrophobicContact CB-CG1 3.8Å; A776-D792 HydrophobicContact CB-CB 4.32Å; A776-A796 HydrophobicContact CB-CB 4.37Å
777	E	92.9	Very high	91	Very high	5 Å²	5	30 Å²	30	2%	0.023	14%	0.143	C	C	.	.	H	α-helix	trans	-66.5	-41.6	172.2	-74.6	173.6	-159.9	0	0	112.9	T486 K488 P735 V773 L775 H779 A780 R781 V788	T486-E777 WeakPolarHBondContact CB-OE2 3.28Å; T486-E777 PolarHBondContact N-OE2 3.23Å; T486-E777 PolarHBondContact OG1-OE2 3.47Å; K488-E777 VanDerWaalsContact CE-OE1 3.22Å; K488-E777 WeakPolarHBondContact CE-OE1 3.49Å; K488-E777 IonicContact NZ-OE1 3.06Å; K488-E777 PolarHBondContact NZ-OE1 3.02Å; P735-E777 HydrophobicContact CG-CB 4.18Å; P735-E777 HydrophobicContact CG-CG 4.41Å; P735-E777 WeakPolarHBondContact CG-O 3.33Å; V773-E777 WeakPolarHBondContact CG1-OE1 3.48Å; V773-E777 WeakPolarHBondContact O-CB 3.18Å; V773-E777 WeakPolarHBondContact O-CG 3.41Å; V773-E777 PolarHBondContact O-N 2.92Å; L775-E777 VanDerWaalsContact C-N 3.35Å; E777-H779 VanDerWaalsContact C-N 3.29Å; E777-H779 PolarHBondContact O-N 3.18Å; E777-A780 PolarHBondContact O-N 3.1Å; E777-R781 PolarHBondContact O-N 3.48Å; E777-V788 HydrophobicContact CG-CG2 4.06Å
778	A	92.3	Very high	91.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.4	-36.3	175.1	0	0	0	0	0	111.9	L480 I502 R774 L775 R781 L782	L480-A778 HydrophobicContact CB-CB 4.15Å; L480-A778 HydrophobicContact CD2-CB 4.04Å; I502-A778 HydrophobicContact CD1-CB 3.81Å; R774-A778 WeakPolarHBondContact O-CB 3.16Å; R774-A778 PolarHBondContact O-N 3.1Å; L775-A778 PolarHBondContact O-N 3.32Å; A778-R781 WeakPolarHBondContact O-CB 3.18Å; A778-R781 PolarHBondContact O-N 3.18Å; A778-L782 PolarHBondContact O-N 2.94Å
779	H	93.1	Very high	91.6	Very high	15 Å²	15	28.2 Å²	28.2	7%	0.069	14%	0.14	C	C	.	.	H	α-helix	trans	-72.5	-38.6	176.1	-169.4	-96	0	0	0	112.4	L480 L775 A776 E777 R781 L782 R783 D792	L480-H779 HydrophobicContact CD2-CB 3.83Å; L775-H779 PolarHBondContact O-N 3.2Å; A776-H779 PolarHBondContact O-N 2.77Å; E777-H779 VanDerWaalsContact C-N 3.29Å; E777-H779 PolarHBondContact O-N 3.18Å; H779-R781 VanDerWaalsContact C-N 3.35Å; H779-R781 PolarHBondContact O-N 3.17Å; H779-L782 WeakPolarHBondContact O-CB 3.26Å; H779-L782 PolarHBondContact O-N 3.1Å; H779-R783 PolarHBondContact O-N 2.88Å; H779-D792 HydrophobicContact CB-CB 4.39Å; H779-D792 IonicContact CE1-OD1 3.75Å; H779-D792 IonicContact CG-OD1 2.78Å; H779-D792 IonicContact ND1-OD1 3.99Å; H779-D792 PolarHBondContact ND1-OD1 3.03Å
780	A	92.4	Very high	91.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-42	171.3	0	0	0	0	0	111.8	P735 A776 E777 L782 R783 L784 S785 V788	P735-A780 HydrophobicContact CB-CB 3.68Å; P735-A780 HydrophobicContact CG-CB 3.96Å; A776-A780 WeakPolarHBondContact O-CB 3.25Å; A776-A780 PolarHBondContact O-N 2.91Å; E777-A780 PolarHBondContact O-N 3.1Å; A780-L782 PolarHBondContact O-N 3.41Å; A780-R783 PolarHBondContact O-N 3.17Å; A780-L784 PolarHBondContact O-N 2.78Å; A780-S785 WeakPolarHBondContact CA-OG 3.47Å; A780-S785 WeakPolarHBondContact CB-OG 3.49Å; A780-S785 PolarHBondContact O-N 3.46Å; A780-S785 PolarHBondContact O-OG 3.39Å; A780-S785 VanDerWaalsContact O-OG 3.06Å; A780-V788 HydrophobicContact CB-CG2 4.04Å
781	R	91.2	Very high	91.9	Very high	14 Å²	14	27 Å²	27	5%	0.053	14%	0.139	C	C	.	.	H	α-helix	trans	-59.5	-43	171.9	-85.2	175.9	159.2	178.1	-6.1	113.4	G484 G485 Y733 P735 E777 A778 H779 R783 L784	G484-R781 WeakPolarHBondContact O-CD 3.46Å; G484-R781 PolarHBondContact O-NH1 3.17Å; G485-R781 PolarHBondContact O-NH1 2.82Å; Y733-R781 PolarHBondContact O-NE 3.16Å; Y733-R781 PolarHBondContact O-NH2 2.97Å; P735-R781 HydrophobicContact CG-CG 3.86Å; E777-R781 PolarHBondContact O-N 3.48Å; A778-R781 WeakPolarHBondContact O-CB 3.18Å; A778-R781 PolarHBondContact O-N 3.18Å; H779-R781 VanDerWaalsContact C-N 3.35Å; H779-R781 PolarHBondContact O-N 3.17Å; R781-R783 PolarHBondContact O-N 3.1Å; R781-L784 PolarHBondContact O-N 3.45Å
782	L	91	Very high	92	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-57.2	-36.4	178.3	178.8	155.5	0	0	0	112.1	L456 Y457 L460 L479 F483 Y725 A778 H779 A780 L784	L456-L782 HydrophobicContact CD2-CD2 3.9Å; L456-L782 HydrophobicContact CG-CD2 4.32Å; Y457-L782 HydrophobicContact CD2-CD1 3.65Å; Y457-L782 HydrophobicContact CD2-CD2 4.38Å; Y457-L782 HydrophobicContact CE2-CD1 4.09Å; L460-L782 HydrophobicContact CD1-CG 4.45Å; L479-L782 HydrophobicContact CD2-CD1 3.53Å; L479-L782 HydrophobicContact CG-CD1 3.79Å; F483-L782 HydrophobicContact CD2-CB 3.98Å; F483-L782 HydrophobicContact CD2-CD1 4.14Å; F483-L782 HydrophobicContact CD2-CG 4.32Å; F483-L782 HydrophobicContact CE2-CB 3.83Å; F483-L782 HydrophobicContact CE2-CD1 3.72Å; F483-L782 HydrophobicContact CE2-CG 3.74Å; F483-L782 HydrophobicContact CZ-CB 4.29Å; F483-L782 HydrophobicContact CZ-CG 4.23Å; Y725-L782 PolarHBondContact OH-O 2.89Å; A778-L782 PolarHBondContact O-N 2.94Å; H779-L782 WeakPolarHBondContact O-CB 3.26Å; H779-L782 PolarHBondContact O-N 3.1Å; A780-L782 PolarHBondContact O-N 3.41Å; L782-L784 VanDerWaalsContact C-N 3.29Å; L782-L784 PolarHBondContact O-N 2.82Å
783	R	89.5	Confident	92.1	Very high	90 Å²	90	26.8 Å²	26.8	34%	0.34	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	6.3	176.7	-58.5	-167.8	-63	157.5	4.4	114	H779 A780 R781 S785 T789 D792	H779-R783 PolarHBondContact O-N 2.88Å; A780-R783 PolarHBondContact O-N 3.17Å; R781-R783 PolarHBondContact O-N 3.1Å; R783-S785 VanDerWaalsContact C-N 3.26Å; R783-S785 PolarHBondContact O-N 2.87Å; R783-T789 PolarHBondContact NH2-OG1 3.47Å; R783-D792 IonicContact CZ-OD1 3.3Å; R783-D792 IonicContact CZ-OD2 2.86Å; R783-D792 IonicContact NE-OD1 2.73Å; R783-D792 PolarHBondContact NE-OD1 3.2Å; R783-D792 IonicContact NH2-OD1 2.91Å; R783-D792 PolarHBondContact NH2-OD1 3.45Å; R783-D792 IonicContact NH2-OD2 3.25Å; R783-D792 PolarHBondContact NH2-OD2 3.19Å
784	L	89.9	Confident	92.1	Very high	16 Å²	16	31.9 Å²	31.9	8%	0.084	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	40	-172.4	-53.2	-172.6	0	0	0	112.9	A451 Y725 Y728 A729 Y733 A780 R781 L782	A451-L784 HydrophobicContact CB-CB 4.46Å; A451-L784 HydrophobicContact CB-CD1 3.78Å; A451-L784 HydrophobicContact CB-CG 4.02Å; Y725-L784 HydrophobicContact CE2-CD1 4.01Å; Y725-L784 HydrophobicContact CE2-CD2 4.31Å; Y725-L784 HydrophobicContact CE2-CG 4.26Å; Y725-L784 WeakPolarHBondContact OH-CG 3.31Å; Y728-L784 HydrophobicContact CD1-CD1 4.32Å; Y728-L784 HydrophobicContact CD1-CD2 4.45Å; Y728-L784 HydrophobicContact CE1-CD1 4.07Å; A729-L784 HydrophobicContact CB-CD2 3.75Å; Y733-L784 HydrophobicContact CD1-CB 4.36Å; Y733-L784 WeakPolarHBondContact CD1-O 3.42Å; Y733-L784 HydrophobicContact CD2-CB 4.3Å; Y733-L784 HydrophobicContact CD2-CD2 3.84Å; Y733-L784 HydrophobicContact CE1-CB 3.97Å; Y733-L784 WeakPolarHBondContact CE1-O 3.2Å; Y733-L784 HydrophobicContact CE2-CB 3.88Å; Y733-L784 HydrophobicContact CE2-CD1 4.28Å; Y733-L784 HydrophobicContact CE2-CD2 3.74Å; Y733-L784 HydrophobicContact CE2-CG 4.17Å; A780-L784 PolarHBondContact O-N 2.78Å; R781-L784 PolarHBondContact O-N 3.45Å; L782-L784 VanDerWaalsContact C-N 3.29Å; L782-L784 PolarHBondContact O-N 2.82Å
785	S	89.5	Confident	92.1	Very high	28 Å²	28	34.1 Å²	34.1	20%	0.196	17%	0.165	C	C	.	.			trans	-102.6	139.3	179.3	75.7	0	0	0	0	112.7	A780 R783 H787	A780-S785 WeakPolarHBondContact CA-OG 3.47Å; A780-S785 WeakPolarHBondContact CB-OG 3.49Å; A780-S785 PolarHBondContact O-N 3.46Å; A780-S785 PolarHBondContact O-OG 3.39Å; A780-S785 VanDerWaalsContact O-OG 3.06Å; R783-S785 VanDerWaalsContact C-N 3.26Å; R783-S785 PolarHBondContact O-N 2.87Å; S785-H787 VanDerWaalsContact C-N 3.31Å; S785-H787 PolarHBondContact OG-O 2.88Å; S785-H787 VanDerWaalsContact OG-O 3.12Å
786	N	89.8	Confident	92	Very high	83 Å²	83	34.1 Å²	34.1	44%	0.444	17%	0.165	S	C	.	.	S	Bend	trans	-85.1	-1.5	176.1	-74.9	-33.3	0	0	0	113.8	Y733 P735 K736	Y733-N786 WeakPolarHBondContact CD1-OD1 3.28Å; P735-N786 WeakPolarHBondContact CA-O 3.49Å; K736-N786 PolarHBondContact N-O 2.99Å
787	H	93.4	Very high	91.8	Very high	116 Å²	116	34.6 Å²	34.6	54%	0.537	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	133.1	-177.7	-57.3	102.3	0	0	0	109.5	K736 T738 S785	K736-H787 WeakPolarHBondContact O-CA 3.49Å; T738-H787 HydrophobicContact CG2-CB 4.09Å; S785-H787 VanDerWaalsContact C-N 3.31Å; S785-H787 PolarHBondContact OG-O 2.88Å; S785-H787 VanDerWaalsContact OG-O 3.12Å
788	V	93.5	Very high	91.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	123.2	173.6	-174.5	0	0	0	0	108.6	P735 K736 L737 T738 A741 A776 E777 A780 D792	P735-V788 HydrophobicContact CB-CG2 3.9Å; K736-V788 PolarHBondContact O-N 2.92Å; L737-V788 HydrophobicContact CD1-CB 4.06Å; L737-V788 HydrophobicContact CD1-CG1 4.06Å; L737-V788 HydrophobicContact CD1-CG2 4.47Å; T738-V788 WeakPolarHBondContact CB-O 3.35Å; T738-V788 VanDerWaalsContact CG2-O 3.25Å; T738-V788 WeakPolarHBondContact CG2-O 3.29Å; T738-V788 PolarHBondContact OG1-O 2.98Å; A741-V788 HydrophobicContact CB-CG1 4.35Å; A776-V788 HydrophobicContact CB-CG1 3.8Å; E777-V788 HydrophobicContact CG-CG2 4.06Å; A780-V788 HydrophobicContact CB-CG2 4.04Å; V788-D792 HydrophobicContact CG1-CB 3.89Å
789	T	92.5	Very high	91.6	Very high	47 Å²	47	37.5 Å²	37.5	29%	0.288	18%	0.178	S	C	.	.			trans	-93	162.3	175.1	73.9	0	0	0	0	111	R783 D791 D792 C793	R783-T789 PolarHBondContact NH2-OG1 3.47Å; T789-D791 PolarHBondContact O-N 2.81Å; T789-D791 VanDerWaalsContact O-N 3.16Å; T789-D791 PolarHBondContact OG1-N 3.13Å; T789-D792 PolarHBondContact N-OD2 3.33Å; T789-D792 WeakPolarHBondContact O-CB 3.43Å; T789-D792 PolarHBondContact O-N 3.24Å; T789-D792 VanDerWaalsContact O-N 3.16Å; T789-D792 PolarHBondContact OG1-OD2 3.42Å; T789-C793 PolarHBondContact O-N 3.19Å
790	A	92.8	Very high	91.3	Very high	25 Å²	25	37.1 Å²	37.1	21%	0.207	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-26.6	174.4	0	0	0	0	0	112.6	C793 R794	A790-C793 WeakPolarHBondContact O-CB 3.39Å; A790-C793 PolarHBondContact O-N 2.78Å; A790-R794 WeakPolarHBondContact O-CG 3.28Å; A790-R794 PolarHBondContact O-N 2.65Å
791	D	91.9	Very high	90.8	Very high	73 Å²	73	41.6 Å²	41.6	39%	0.39	19%	0.193	S	C	.	.	H	α-helix	trans	-66.5	-40.4	176.6	-56.9	-28.3	0	0	0	112.6	T789 C793 R794 E795	T789-D791 PolarHBondContact O-N 2.81Å; T789-D791 VanDerWaalsContact O-N 3.16Å; T789-D791 PolarHBondContact OG1-N 3.13Å; D791-C793 PolarHBondContact O-N 3.03Å; D791-R794 WeakPolarHBondContact O-CB 3.44Å; D791-R794 PolarHBondContact O-N 3.49Å; D791-R794 VanDerWaalsContact O-N 3.1Å; D791-R794 IonicContact OD1-CZ 2.66Å; D791-R794 IonicContact OD1-NE 2.86Å; D791-R794 PolarHBondContact OD1-NE 3.11Å; D791-R794 IonicContact OD1-NH2 3.81Å; D791-R794 PolarHBondContact OD1-NH2 3.27Å; D791-E795 PolarHBondContact O-N 2.73Å
792	D	93.3	Very high	90.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.8	-40.4	174	-59	-53.6	0	0	0	110.6	A776 H779 R783 V788 T789 A796	A776-D792 HydrophobicContact CB-CB 4.32Å; H779-D792 HydrophobicContact CB-CB 4.39Å; H779-D792 IonicContact CE1-OD1 3.75Å; H779-D792 IonicContact CG-OD1 2.78Å; H779-D792 IonicContact ND1-OD1 3.99Å; H779-D792 PolarHBondContact ND1-OD1 3.03Å; R783-D792 IonicContact CZ-OD1 3.3Å; R783-D792 IonicContact CZ-OD2 2.86Å; R783-D792 IonicContact NE-OD1 2.73Å; R783-D792 PolarHBondContact NE-OD1 3.2Å; R783-D792 IonicContact NH2-OD1 2.91Å; R783-D792 PolarHBondContact NH2-OD1 3.45Å; R783-D792 IonicContact NH2-OD2 3.25Å; R783-D792 PolarHBondContact NH2-OD2 3.19Å; V788-D792 HydrophobicContact CG1-CB 3.89Å; T789-D792 PolarHBondContact N-OD2 3.33Å; T789-D792 WeakPolarHBondContact O-CB 3.43Å; T789-D792 PolarHBondContact O-N 3.24Å; T789-D792 VanDerWaalsContact O-N 3.16Å; T789-D792 PolarHBondContact OG1-OD2 3.42Å; D792-A796 VanDerWaalsContact O-CB 3.28Å; D792-A796 WeakPolarHBondContact O-CB 3.27Å; D792-A796 PolarHBondContact O-N 3.29Å
793	C	93.1	Very high	89.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-70.4	-34.6	176.4	-58.2	0	0	0	0	112.6	Y744 L745 T789 A790 D791 R797	Y744-C793 HydrophobicContact CD1-CB 3.56Å; Y744-C793 HydrophobicContact CE1-CB 3.94Å; L745-C793 HydrophobicContact CD2-CB 3.92Å; L745-C793 HydrophobicContact CG-CB 4.13Å; T789-C793 PolarHBondContact O-N 3.19Å; A790-C793 WeakPolarHBondContact O-CB 3.39Å; A790-C793 PolarHBondContact O-N 2.78Å; D791-C793 PolarHBondContact O-N 3.03Å; C793-R797 WeakPolarHBondContact O-CB 3.32Å; C793-R797 PolarHBondContact O-N 3.15Å
794	R	93.1	Very high	88.6	Confident	140 Å²	140	42.8 Å²	42.8	53%	0.528	21%	0.205	S	C	.	.	H	α-helix	trans	-64.2	-44.6	173.9	-74.8	-165.4	-78.7	-170	-0.5	111.5	Y744 A790 D791 R797 R798	Y744-R794 HydrophobicContact CE1-CG 3.74Å; Y744-R794 HydrophobicContact CE2-CG 4.32Å; A790-R794 WeakPolarHBondContact O-CG 3.28Å; A790-R794 PolarHBondContact O-N 2.65Å; D791-R794 WeakPolarHBondContact O-CB 3.44Å; D791-R794 PolarHBondContact O-N 3.49Å; D791-R794 VanDerWaalsContact O-N 3.1Å; D791-R794 IonicContact OD1-CZ 2.66Å; D791-R794 IonicContact OD1-NE 2.86Å; D791-R794 PolarHBondContact OD1-NE 3.11Å; D791-R794 IonicContact OD1-NH2 3.81Å; D791-R794 PolarHBondContact OD1-NH2 3.27Å; R794-R797 CarbonylContact O-C 3.58Å; R794-R797 PolarHBondContact O-N 2.86Å; R794-R798 PolarHBondContact O-N 2.84Å
795	E	90.7	Very high	87.3	Confident	62 Å²	62	48.5 Å²	48.5	29%	0.29	23%	0.23	S	C	.	.	H	α-helix	trans	-70.9	-42.5	177.6	-74.4	-53	122	0	0	112.9	D791 R797 R798 L799	D791-E795 PolarHBondContact O-N 2.73Å; E795-R797 PolarHBondContact O-N 2.85Å; E795-R798 WeakPolarHBondContact O-CB 3.38Å; E795-R798 PolarHBondContact O-N 3.49Å; E795-R798 VanDerWaalsContact O-N 3.14Å; E795-R798 IonicContact OE1-NE 2.86Å; E795-R798 IonicContact OE2-CZ 3.36Å; E795-R798 IonicContact OE2-NE 2.76Å; E795-R798 PolarHBondContact OE2-NE 2.87Å; E795-R798 IonicContact OE2-NH2 3.02Å; E795-L799 WeakPolarHBondContact O-CB 3.05Å; E795-L799 PolarHBondContact O-N 2.81Å
796	A	91.7	Very high	85.6	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-56.3	-38	171.2	0	0	0	0	0	111.7	L772 L775 A776 D792 Q800	L772-A796 HydrophobicContact CD2-CB 4.39Å; L775-A796 HydrophobicContact CB-CB 3.71Å; A776-A796 HydrophobicContact CB-CB 4.37Å; D792-A796 VanDerWaalsContact O-CB 3.28Å; D792-A796 WeakPolarHBondContact O-CB 3.27Å; D792-A796 PolarHBondContact O-N 3.29Å; A796-Q800 WeakPolarHBondContact O-CB 3.46Å; A796-Q800 PolarHBondContact O-N 3.17Å
797	R	89.9	Confident	83.7	Confident	11 Å²	11	47.5 Å²	47.5	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-73.9	-36.8	176.5	-174.8	55.8	166.6	160.3	-0.2	113.2	E748 M752 L772 C793 R794 E795 R801	E748-R797 HydrophobicContact CG-CG 4.21Å; E748-R797 PolarHBondContact O-NH2 2.9Å; E748-R797 IonicContact OE2-CZ 3.67Å; E748-R797 IonicContact OE2-NE 2.98Å; E748-R797 PolarHBondContact OE2-NE 3.42Å; E748-R797 IonicContact OE2-NH2 2.59Å; E748-R797 PolarHBondContact OE2-NH2 3.44Å; M752-R797 PolarHBondContact SD-NH1 3.22Å; L772-R797 HydrophobicContact CD2-CB 4.35Å; C793-R797 WeakPolarHBondContact O-CB 3.32Å; C793-R797 PolarHBondContact O-N 3.15Å; R794-R797 CarbonylContact O-C 3.58Å; R794-R797 PolarHBondContact O-N 2.86Å; E795-R797 PolarHBondContact O-N 2.85Å; R797-R801 WeakPolarHBondContact O-CB 3.48Å; R797-R801 PolarHBondContact O-N 3.22Å
798	R	90.6	Very high	81.7	Confident	66 Å²	66	43.7 Å²	43.7	25%	0.249	21%	0.21	C	C	.	.	H	α-helix	trans	-57	-54.6	171.8	-175.2	-173.4	73.5	84.5	3.5	109.6	D473 R794 E795 Q800 R801 E802	D473-R798 IonicContact OD1-CZ 2.67Å; D473-R798 IonicContact OD1-NH1 2.64Å; D473-R798 PolarHBondContact OD1-NH1 3.26Å; D473-R798 IonicContact OD1-NH2 3.13Å; D473-R798 PolarHBondContact OD1-NH2 3.39Å; R794-R798 PolarHBondContact O-N 2.84Å; E795-R798 WeakPolarHBondContact O-CB 3.38Å; E795-R798 PolarHBondContact O-N 3.49Å; E795-R798 VanDerWaalsContact O-N 3.14Å; E795-R798 IonicContact OE1-NE 2.86Å; E795-R798 IonicContact OE2-CZ 3.36Å; E795-R798 IonicContact OE2-NE 2.76Å; E795-R798 PolarHBondContact OE2-NE 2.87Å; E795-R798 IonicContact OE2-NH2 3.02Å; R798-Q800 PolarHBondContact O-N 3.24Å; R798-R801 CarbonylContact O-C 3.54Å; R798-R801 WeakPolarHBondContact O-CA 3.36Å; R798-R801 WeakPolarHBondContact O-CB 3.29Å; R798-R801 PolarHBondContact O-N 3.21Å; R798-E802 WeakPolarHBondContact CG-OE1 3.48Å; R798-E802 IonicContact CZ-OE1 3.08Å; R798-E802 IonicContact CZ-OE2 3.95Å; R798-E802 IonicContact NE-OE1 3.75Å; R798-E802 IonicContact NE-OE2 3.31Å; R798-E802 IonicContact NH1-OE1 3.63Å; R798-E802 PolarHBondContact NH1-OE1 3.43Å; R798-E802 IonicContact NH1-OE2 2.72Å; R798-E802 PolarHBondContact NH1-OE2 2.94Å; R798-E802 IonicContact NH2-OE2 2.67Å; R798-E802 PolarHBondContact O-N 3.03Å
799	L	89.7	Confident	79.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-47.8	-178.5	-171.5	71.8	0	0	0	112.8	D473 L480 L644 F646 E795 R801 E802 A803	D473-L799 HydrophobicContact CB-CD1 4.08Å; D473-L799 WeakPolarHBondContact O-CD1 3.27Å; L480-L799 HydrophobicContact CD1-CD2 3.69Å; L644-L799 HydrophobicContact CD1-CD2 3.72Å; L644-L799 HydrophobicContact CD1-CG 4.34Å; L644-L799 HydrophobicContact CD2-CD2 4.42Å; L644-L799 HydrophobicContact CD2-CG 4.37Å; F646-L799 HydrophobicContact CE1-CD1 4.11Å; F646-L799 HydrophobicContact CZ-CD1 4.06Å; F646-L799 HydrophobicContact CZ-CG 4.33Å; E795-L799 WeakPolarHBondContact O-CB 3.05Å; E795-L799 PolarHBondContact O-N 2.81Å; L799-R801 VanDerWaalsContact C-N 3.27Å; L799-R801 PolarHBondContact O-N 3.38Å; L799-E802 PolarHBondContact O-N 2.84Å; L799-A803 WeakPolarHBondContact O-CB 3.46Å; L799-A803 PolarHBondContact O-N 3.48Å
800	Q	86.9	Confident	77.8	Confident	7 Å²	7	46.3 Å²	46.3	3%	0.033	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-38.6	175.2	-173.8	-170.1	59.7	0	0	111.6	L644 L772 A796 R798 L804	L644-Q800 HydrophobicContact CD2-CB 4.4Å; L772-Q800 HydrophobicContact CD2-CB 4.28Å; A796-Q800 WeakPolarHBondContact O-CB 3.46Å; A796-Q800 PolarHBondContact O-N 3.17Å; R798-Q800 PolarHBondContact O-N 3.24Å; Q800-L804 HydrophobicContact CG-CD1 4.28Å; Q800-L804 PolarHBondContact O-N 2.96Å
801	R	82.9	Confident	75.7	Confident	94 Å²	94	49.5 Å²	49.5	36%	0.355	24%	0.24	S	C	.	.	H	α-helix	trans	-72.3	-33.5	179.9	-171	-177.4	-68.6	170.9	-1.6	111.8	E748 R797 R798 L799 L804 K805	E748-R801 IonicContact OE1-NH2 3.74Å; E748-R801 IonicContact OE2-NH2 3.69Å; E748-R801 PolarHBondContact OE2-NH2 3.28Å; E748-R801 VanDerWaalsContact OE2-NH2 3.11Å; R797-R801 WeakPolarHBondContact O-CB 3.48Å; R797-R801 PolarHBondContact O-N 3.22Å; R798-R801 CarbonylContact O-C 3.54Å; R798-R801 WeakPolarHBondContact O-CA 3.36Å; R798-R801 WeakPolarHBondContact O-CB 3.29Å; R798-R801 PolarHBondContact O-N 3.21Å; L799-R801 VanDerWaalsContact C-N 3.27Å; L799-R801 PolarHBondContact O-N 3.38Å; R801-L804 CarbonylContact O-C 3.59Å; R801-L804 PolarHBondContact O-N 3.05Å; R801-K805 HydrophobicContact CG-CD 4.07Å; R801-K805 HydrophobicContact CG-CG 4.27Å; R801-K805 WeakPolarHBondContact O-CB 3.26Å; R801-K805 WeakPolarHBondContact O-CG 2.97Å; R801-K805 PolarHBondContact O-N 3.11Å
802	E	79.7	Confident	73.3	Confident	48 Å²	48	52.2 Å²	52.2	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-70.6	-46.3	175.8	-77.8	155.2	176.7	0	0	112.1	R798 L799 L804 K805 Q806	R798-E802 WeakPolarHBondContact CG-OE1 3.48Å; R798-E802 IonicContact CZ-OE1 3.08Å; R798-E802 IonicContact CZ-OE2 3.95Å; R798-E802 IonicContact NE-OE1 3.75Å; R798-E802 IonicContact NE-OE2 3.31Å; R798-E802 IonicContact NH1-OE1 3.63Å; R798-E802 PolarHBondContact NH1-OE1 3.43Å; R798-E802 IonicContact NH1-OE2 2.72Å; R798-E802 PolarHBondContact NH1-OE2 2.94Å; R798-E802 IonicContact NH2-OE2 2.67Å; R798-E802 PolarHBondContact O-N 3.03Å; L799-E802 PolarHBondContact O-N 2.84Å; E802-L804 PolarHBondContact O-N 3.05Å; E802-K805 PolarHBondContact O-N 3.1Å; E802-Q806 PolarHBondContact O-N 3.14Å; E802-Q806 VanDerWaalsContact O-N 3.1Å
803	A	76.1	Confident	71.2	Confident	5 Å²	5	55.4 Å²	55.4	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-50.9	-41.4	170.3	0	0	0	0	0	112	I645 F646 L799	I645-A803 WeakPolarHBondContact O-CB 3.4Å; F646-A803 HydrophobicContact CD1-CB 4.04Å; F646-A803 HydrophobicContact CE1-CB 4.12Å; L799-A803 WeakPolarHBondContact O-CB 3.46Å; L799-A803 PolarHBondContact O-N 3.48Å
804	L	70.5	Confident	69.2	Low	76 Å²	76	57.7 Å²	57.7	40%	0.398	30%	0.297	S	S	.	.	H	α-helix	trans	-81.3	-22.5	174.7	-76	163.8	0	0	0	115.1	Q800 R801 E802 A807	Q800-L804 HydrophobicContact CG-CD1 4.28Å; Q800-L804 PolarHBondContact O-N 2.96Å; R801-L804 CarbonylContact O-C 3.59Å; R801-L804 PolarHBondContact O-N 3.05Å; E802-L804 PolarHBondContact O-N 3.05Å; L804-A807 WeakPolarHBondContact O-CB 3.24Å; L804-A807 PolarHBondContact O-N 3.49Å
805	K	61.7	Low	67.3	Low	137 Å²	137	54.3 Å²	54.3	60%	0.596	29%	0.292	S	S	*	.	H	α-helix	trans	-81.6	-33.9	-176.9	-91.5	173.7	170.1	-175.6	0	113	R801 E802 A807 A808	R801-K805 HydrophobicContact CG-CD 4.07Å; R801-K805 HydrophobicContact CG-CG 4.27Å; R801-K805 WeakPolarHBondContact O-CB 3.26Å; R801-K805 WeakPolarHBondContact O-CG 2.97Å; R801-K805 PolarHBondContact O-N 3.11Å; E802-K805 PolarHBondContact O-N 3.1Å; K805-A807 PolarHBondContact O-N 2.72Å; K805-A807 VanDerWaalsContact O-N 3.12Å; K805-A808 PolarHBondContact O-N 2.98Å
806	Q	54.1	Low	65.5	Low	78 Å²	78	54.9 Å²	54.9	36%	0.364	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.5	168.1	-70	175.8	-31.3	0	0	111.3	L647 E802 A808	L647-Q806 HydrophobicContact CB-CB 3.86Å; L647-Q806 PolarHBondContact O-OE1 3.27Å; L647-Q806 VanDerWaalsContact O-OE1 3.13Å; E802-Q806 PolarHBondContact O-N 3.14Å; E802-Q806 VanDerWaalsContact O-N 3.1Å; Q806-A808 PolarHBondContact O-N 3.19Å
807	A	50.5	Low	63.5	Low	11 Å²	11	56.6 Å²	56.6	9%	0.091	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	10.1	172.8	0	0	0	0	0	115	I628 L647 L804 K805	I628-A807 HydrophobicContact CD1-CB 3.4Å; I628-A807 VanDerWaalsContact CD1-CB 3.4Å; I628-A807 HydrophobicContact CG1-CB 3.88Å; L647-A807 VanDerWaalsContact CD1-CA 3.47Å; L647-A807 HydrophobicContact CD1-CB 3.38Å; L804-A807 WeakPolarHBondContact O-CB 3.24Å; L804-A807 PolarHBondContact O-N 3.49Å; K805-A807 PolarHBondContact O-N 2.72Å; K805-A807 VanDerWaalsContact O-N 3.12Å
808	A	51.5	Low	61.7	Low	36 Å²	36	60.6 Å²	60.6	30%	0.298	33%	0.326	S	S	.	.			trans	58.9	74.6	159.6	0	0	0	0	0	116.4	K805 Q806 I816	K805-A808 PolarHBondContact O-N 2.98Å; Q806-A808 PolarHBondContact O-N 3.19Å; A808-I816 HydrophobicContact CB-CD1 4.49Å; A808-I816 HydrophobicContact CB-CG1 3.95Å; A808-I816 HydrophobicContact CB-CG2 4.1Å; A808-I816 WeakPolarHBondContact O-CG1 3.42Å
809	I	54.4	Low	59.8	Low	75 Å²	75	62.3 Å²	62.3	39%	0.385	34%	0.341	S	S	.	.			trans	-141.1	120.6	160.3	-52	-178.1	0	0	0	109.3	Q761	Q761-I809 HydrophobicContact CG-CD1 3.75Å
810	D	49.3	Very low	58.1	Low	27 Å²	27	65.5 Å²	65.5	14%	0.144	36%	0.357	C	S	.	.			trans	-72.4	121.5	169.8	-154.6	20	0	0	0	108.1	L812 T813 G814 S828	D810-L812 PolarHBondContact O-N 2.78Å; D810-T813 PolarHBondContact O-N 3.24Å; D810-T813 VanDerWaalsContact O-N 3.13Å; D810-G814 PolarHBondContact O-N 3.26Å; D810-S828 PolarHBondContact OD1-OG 2.69Å; D810-S828 VanDerWaalsContact OD2-CB 3.24Å; D810-S828 WeakPolarHBondContact OD2-CB 3.19Å; D810-S828 PolarHBondContact OD2-OG 2.89Å
811	P	48.1	Very low	56.3	Low	93 Å²	93	71.6 Å²	71.6	60%	0.604	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	7.8	-161.8	26.6	-36.5	0	0	0	115.5
812	L	42.5	Very low	54.5	Low	129 Å²	129	72.1 Å²	72.1	68%	0.675	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	-21.8	179	-64.6	171.1	0	0	0	113.4	D810	D810-L812 PolarHBondContact O-N 2.78Å
813	T	48.8	Very low	53.3	Low	67 Å²	67	73.8 Å²	73.8	41%	0.411	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-25	-175	63	0	0	0	0	113.6	D810 T815	D810-T813 PolarHBondContact O-N 3.24Å; D810-T813 VanDerWaalsContact O-N 3.13Å; T813-T815 PolarHBondContact O-N 3.37Å; T813-T815 PolarHBondContact OG1-N 3.42Å; T813-T815 PolarHBondContact OG1-OG1 3.29Å
814	G	51.5	Low	52.3	Low	49 Å²	49	76.7 Å²	76.7	51%	0.505	45%	0.447	S	S	.	.			trans	71.6	6.7	-175.4	0	0	0	0	0	114.3	D810	D810-G814 PolarHBondContact O-N 3.26Å
815	T	52.6	Low	52	Low	69 Å²	69	76.4 Å²	76.4	42%	0.423	45%	0.445	S	S	.	.	S	Bend	trans	-107	146.8	-177.9	54.6	0	0	0	0	112.3	T813 D817	T813-T815 PolarHBondContact O-N 3.37Å; T813-T815 PolarHBondContact OG1-N 3.42Å; T813-T815 PolarHBondContact OG1-OG1 3.29Å; T815-D817 PolarHBondContact O-N 3.16Å; T815-D817 PolarHBondContact OG1-OD1 2.96Å
816	I	52.4	Low	52.1	Low	73 Å²	73	70.4 Å²	70.4	37%	0.374	42%	0.421	S	S	.	.			trans	-81.8	88.4	167.9	-62.7	163.9	0	0	0	107.5	P624 A808 I818	P624-I816 WeakPolarHBondContact O-CD1 3.44Å; A808-I816 HydrophobicContact CB-CD1 4.49Å; A808-I816 HydrophobicContact CB-CG1 3.95Å; A808-I816 HydrophobicContact CB-CG2 4.1Å; A808-I816 WeakPolarHBondContact O-CG1 3.42Å; I816-I818 HydrophobicContact CG2-CG1 4.29Å; I816-I818 PolarHBondContact O-N 2.94Å
817	D	50	Low	52.6	Low	38 Å²	38	68.9 Å²	68.9	20%	0.203	42%	0.419	C	S	.	.			trans	-77.3	90.5	174.4	-80.1	23.6	0	0	0	109.3	T815 N819 I820 S827	T815-D817 PolarHBondContact O-N 3.16Å; T815-D817 PolarHBondContact OG1-OD1 2.96Å; D817-N819 PolarHBondContact O-N 3.12Å; D817-I820 HydrophobicContact CB-CD1 4.16Å; D817-I820 HydrophobicContact CB-CG1 4.18Å; D817-I820 WeakPolarHBondContact O-CB 3.46Å; D817-I820 VanDerWaalsContact O-CG1 3.32Å; D817-I820 WeakPolarHBondContact O-CG1 3.25Å; D817-I820 PolarHBondContact O-N 3.18Å; D817-S827 WeakPolarHBondContact OD2-CB 3.29Å; D817-S827 PolarHBondContact OD2-OG 3.25Å
818	I	53.1	Low	53.3	Low	94 Å²	94	69 Å²	69	48%	0.482	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-28.6	178.2	-63.9	169.6	0	0	0	112.3	P624 I816 I820 L821	P624-I818 HydrophobicContact CG-CD1 4.31Å; I816-I818 HydrophobicContact CG2-CG1 4.29Å; I816-I818 PolarHBondContact O-N 2.94Å; I818-I820 PolarHBondContact O-N 2.81Å; I818-I820 VanDerWaalsContact O-N 3.1Å; I818-L821 PolarHBondContact O-N 3.35Å
819	N	49.7	Very low	54.1	Low	102 Å²	102	70.1 Å²	70.1	55%	0.545	42%	0.422	S	S	.	.	H	α-helix	trans	-58.7	-19	175.4	-65.5	-28.3	0	0	0	114.4	D817 L821 T823	D817-N819 PolarHBondContact O-N 3.12Å; N819-L821 VanDerWaalsContact C-N 3.28Å; N819-L821 PolarHBondContact O-N 2.81Å; N819-T823 WeakPolarHBondContact O-CB 3.49Å; N819-T823 PolarHBondContact O-N 2.67Å; N819-T823 PolarHBondContact O-OG1 3.31Å
820	I	54.6	Low	54.9	Low	67 Å²	67	74 Å²	74	34%	0.344	43%	0.432	S	S	.	.	H	α-helix	trans	-61.3	-39.6	173.9	-66.1	176.6	0	0	0	110.6	D817 I818 G824	D817-I820 HydrophobicContact CB-CD1 4.16Å; D817-I820 HydrophobicContact CB-CG1 4.18Å; D817-I820 WeakPolarHBondContact O-CB 3.46Å; D817-I820 VanDerWaalsContact O-CG1 3.32Å; D817-I820 WeakPolarHBondContact O-CG1 3.25Å; D817-I820 PolarHBondContact O-N 3.18Å; I818-I820 PolarHBondContact O-N 2.81Å; I818-I820 VanDerWaalsContact O-N 3.1Å; I820-G824 WeakPolarHBondContact O-CA 3.21Å; I820-G824 PolarHBondContact O-N 2.69Å
821	L	48.1	Very low	56.3	Low	135 Å²	135	79 Å²	79	71%	0.707	45%	0.452	S	S	*	.	H	α-helix	trans	-76.6	-41.5	-178.9	-71.8	157.6	0	0	0	112	I818 N819	I818-L821 PolarHBondContact O-N 3.35Å; N819-L821 VanDerWaalsContact C-N 3.28Å; N819-L821 PolarHBondContact O-N 2.81Å
822	T	45.6	Very low	57.6	Low	106 Å²	106	79.9 Å²	79.9	65%	0.65	44%	0.443	S	S	*	.	H	α-helix	trans	-87.2	-18.9	-175.5	50.9	0	0	0	0	115
823	T	53.4	Low	59.3	Low	83 Å²	83	76 Å²	76	51%	0.509	42%	0.42	S	S	.	.	H	α-helix	trans	-121.9	-4.9	-178	72.5	0	0	0	0	114.4	N819 I825	N819-T823 WeakPolarHBondContact O-CB 3.49Å; N819-T823 PolarHBondContact O-N 2.67Å; N819-T823 PolarHBondContact O-OG1 3.31Å; T823-I825 PolarHBondContact O-N 3.22Å; T823-I825 PolarHBondContact OG1-O 2.71Å
824	G	56.8	Low	60.9	Low	66 Å²	66	75.4 Å²	75.4	68%	0.68	41%	0.412	S	S	*	.	S	Bend	trans	65.9	-0.9	178.7	0	0	0	0	0	115.6	I820	I820-G824 WeakPolarHBondContact O-CA 3.21Å; I820-G824 PolarHBondContact O-N 2.69Å
825	I	64.3	Low	62.4	Low	70 Å²	70	78.2 Å²	78.2	36%	0.359	41%	0.412	S	S	.	.	S	Bend	trans	-132.6	111.7	-174.5	-54.8	175.5	0	0	0	108.1	T823 V829 R830	T823-I825 PolarHBondContact O-N 3.22Å; T823-I825 PolarHBondContact OG1-O 2.71Å; I825-V829 HydrophobicContact CG2-CB 4.24Å; I825-V829 HydrophobicContact CG2-CG1 3.96Å; I825-R830 HydrophobicContact CG2-CB 4.09Å
826	S	61.8	Low	63.8	Low	11 Å²	11	76.2 Å²	76.2	8%	0.077	40%	0.398	C	S	.	.			trans	-65.2	156.9	177	71.7	0	0	0	0	112	S828 V829 R830	S826-S828 PolarHBondContact O-N 3.15Å; S826-S828 PolarHBondContact OG-OG 3.41Å; S826-V829 PolarHBondContact O-N 3.14Å; S826-V829 VanDerWaalsContact O-N 3.15Å; S826-V829 WeakPolarHBondContact OG-CB 3.19Å; S826-V829 VanDerWaalsContact OG-CG2 3.26Å; S826-V829 WeakPolarHBondContact OG-CG2 3.14Å; S826-V829 PolarHBondContact OG-N 3.11Å; S826-R830 WeakPolarHBondContact O-CB 3.41Å; S826-R830 PolarHBondContact O-N 3.28Å
827	S	66.2	Low	65.4	Low	46 Å²	46	73 Å²	73	32%	0.322	38%	0.382	S	S	.	.	H	α-helix	trans	-57.6	-32.8	172.5	62.8	0	0	0	0	111.7	D817 K831	D817-S827 WeakPolarHBondContact OD2-CB 3.29Å; D817-S827 PolarHBondContact OD2-OG 3.25Å; S827-K831 WeakPolarHBondContact O-CB 3.49Å; S827-K831 WeakPolarHBondContact O-CG 3.35Å; S827-K831 PolarHBondContact O-N 3.4Å
828	S	64.2	Low	67.1	Low	14 Å²	14	77.4 Å²	77.4	10%	0.098	40%	0.403	C	S	.	.	H	α-helix	trans	-73	-39.4	174.2	60.6	0	0	0	0	113.7	D810 S826 K831 R832	D810-S828 PolarHBondContact OD1-OG 2.69Å; D810-S828 VanDerWaalsContact OD2-CB 3.24Å; D810-S828 WeakPolarHBondContact OD2-CB 3.19Å; D810-S828 PolarHBondContact OD2-OG 2.89Å; S826-S828 PolarHBondContact O-N 3.15Å; S826-S828 PolarHBondContact OG-OG 3.41Å; S828-K831 PolarHBondContact O-N 2.64Å; S828-R832 WeakPolarHBondContact O-CG 3.34Å; S828-R832 PolarHBondContact O-N 3.27Å
829	V	67.9	Low	68.6	Low	59 Å²	59	74.9 Å²	74.9	36%	0.358	40%	0.397	S	S	.	.	H	α-helix	trans	-69.7	-39.7	174	169.6	0	0	0	0	110.6	I825 S826 R832 R833	I825-V829 HydrophobicContact CG2-CB 4.24Å; I825-V829 HydrophobicContact CG2-CG1 3.96Å; S826-V829 PolarHBondContact O-N 3.14Å; S826-V829 VanDerWaalsContact O-N 3.15Å; S826-V829 WeakPolarHBondContact OG-CB 3.19Å; S826-V829 VanDerWaalsContact OG-CG2 3.26Å; S826-V829 WeakPolarHBondContact OG-CG2 3.14Å; S826-V829 PolarHBondContact OG-N 3.11Å; V829-R832 PolarHBondContact O-N 3.25Å; V829-R833 VanDerWaalsContact O-CB 3.28Å; V829-R833 WeakPolarHBondContact O-CB 3.08Å; V829-R833 PolarHBondContact O-N 3.08Å
830	R	72.7	Confident	70.3	Confident	157 Å²	157	70 Å²	70	59%	0.592	37%	0.371	S	S	*	.	H	α-helix	trans	-59.4	-47.8	172.9	-177.6	173.8	176.9	163.7	1.7	111.4	I825 S826 R833 E834	I825-R830 HydrophobicContact CG2-CB 4.09Å; S826-R830 WeakPolarHBondContact O-CB 3.41Å; S826-R830 PolarHBondContact O-N 3.28Å; R830-R833 PolarHBondContact O-N 2.83Å; R830-E834 WeakPolarHBondContact CG-OE1 3.39Å; R830-E834 IonicContact CZ-OE1 3.06Å; R830-E834 IonicContact NE-OE1 2.66Å; R830-E834 PolarHBondContact NE-OE1 3.42Å; R830-E834 IonicContact NH2-OE1 3.98Å; R830-E834 WeakPolarHBondContact O-CB 3.49Å; R830-E834 WeakPolarHBondContact O-CG 3.33Å; R830-E834 PolarHBondContact O-N 3.23Å
831	K	78.3	Confident	71.8	Confident	131 Å²	131	69 Å²	69	57%	0.57	36%	0.363	S	S	*	.	H	α-helix	trans	-59.3	-47	173	-78.2	176.6	178.8	178.7	0	112.3	S827 S828 R833 E834 E835	S827-K831 WeakPolarHBondContact O-CB 3.49Å; S827-K831 WeakPolarHBondContact O-CG 3.35Å; S827-K831 PolarHBondContact O-N 3.4Å; S828-K831 PolarHBondContact O-N 2.64Å; K831-R833 VanDerWaalsContact C-N 3.3Å; K831-R833 PolarHBondContact O-N 3.46Å; K831-E834 CarbonylContact O-C 3.5Å; K831-E834 PolarHBondContact O-N 3.17Å; K831-E835 WeakPolarHBondContact O-CB 3.21Å; K831-E835 VanDerWaalsContact O-CG 3.28Å; K831-E835 WeakPolarHBondContact O-CG 3.22Å; K831-E835 PolarHBondContact O-N 2.86Å
832	R	75.2	Confident	73.6	Confident	111 Å²	111	65.4 Å²	65.4	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-60.3	-38	175.8	-75.4	178	-168.3	168.1	7.2	112.8	S828 V829 E835 M836	S828-R832 WeakPolarHBondContact O-CG 3.34Å; S828-R832 PolarHBondContact O-N 3.27Å; V829-R832 PolarHBondContact O-N 3.25Å; R832-E835 PolarHBondContact O-N 3.37Å; R832-M836 VanDerWaalsContact O-CB 3.29Å; R832-M836 WeakPolarHBondContact O-CB 3.4Å; R832-M836 WeakPolarHBondContact O-CG 3.42Å; R832-M836 PolarHBondContact O-N 3.24Å
833	R	77.2	Confident	75.4	Confident	48 Å²	48	60.9 Å²	60.9	18%	0.181	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-40.5	177.1	-171.3	177.1	-170.7	174.7	7.9	111.2	V829 R830 K831 A837 D877 F881	V829-R833 VanDerWaalsContact O-CB 3.28Å; V829-R833 WeakPolarHBondContact O-CB 3.08Å; V829-R833 PolarHBondContact O-N 3.08Å; R830-R833 PolarHBondContact O-N 2.83Å; K831-R833 VanDerWaalsContact C-N 3.3Å; K831-R833 PolarHBondContact O-N 3.46Å; R833-A837 WeakPolarHBondContact O-CB 3.24Å; R833-A837 PolarHBondContact O-N 3.48Å; R833-D877 HydrophobicContact CG-CB 4.5Å; R833-D877 IonicContact CZ-OD1 3.58Å; R833-D877 PolarHBondContact NE-O 2.95Å; R833-D877 PolarHBondContact NH2-O 3.18Å; R833-D877 VanDerWaalsContact NH2-O 3.14Å; R833-D877 IonicContact NH2-OD1 3.98Å; R833-F881 HydrophobicContact CG-CB 4.03Å; R833-F881 HydrophobicContact CG-CD2 4.23Å; R833-F881 HydrophobicContact CG-CG 4.31Å
834	E	82.4	Confident	76.8	Confident	54 Å²	54	57 Å²	57	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-66.6	-46.2	173	-71.5	168.2	-167	0	0	111.1	R830 K831 A837 M838 F881	R830-E834 WeakPolarHBondContact CG-OE1 3.39Å; R830-E834 IonicContact CZ-OE1 3.06Å; R830-E834 IonicContact NE-OE1 2.66Å; R830-E834 PolarHBondContact NE-OE1 3.42Å; R830-E834 IonicContact NH2-OE1 3.98Å; R830-E834 WeakPolarHBondContact O-CB 3.49Å; R830-E834 WeakPolarHBondContact O-CG 3.33Å; R830-E834 PolarHBondContact O-N 3.23Å; K831-E834 CarbonylContact O-C 3.5Å; K831-E834 PolarHBondContact O-N 3.17Å; E834-A837 PolarHBondContact O-N 3.14Å; E834-M838 HydrophobicContact CB-CE 4.47Å; E834-M838 VanDerWaalsContact O-CG 3.3Å; E834-M838 WeakPolarHBondContact O-CG 3.12Å; E834-M838 PolarHBondContact O-N 2.87Å; E834-F881 HydrophobicContact CG-CE1 4.25Å; E834-F881 HydrophobicContact CG-CE2 4.19Å; E834-F881 HydrophobicContact CG-CZ 3.76Å
835	E	84.7	Confident	78	Confident	109 Å²	109	59 Å²	59	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-58.4	-46.6	174	-74.2	166.5	-165.8	0	0	112.2	K831 R832 M838 A839	K831-E835 WeakPolarHBondContact O-CB 3.21Å; K831-E835 VanDerWaalsContact O-CG 3.28Å; K831-E835 WeakPolarHBondContact O-CG 3.22Å; K831-E835 PolarHBondContact O-N 2.86Å; R832-E835 PolarHBondContact O-N 3.37Å; E835-M838 PolarHBondContact O-N 2.96Å; E835-A839 PolarHBondContact O-N 2.89Å
836	M	82	Confident	79	Confident	27 Å²	27	60.6 Å²	60.6	13%	0.133	29%	0.294	C	S	.	.	H	α-helix	trans	-69	-38.4	177.2	-77.7	-166.9	60.4	0	0	112.4	R832 M838 A839 I840 L862 I870 N874 F875	R832-M836 VanDerWaalsContact O-CB 3.29Å; R832-M836 WeakPolarHBondContact O-CB 3.4Å; R832-M836 WeakPolarHBondContact O-CG 3.42Å; R832-M836 PolarHBondContact O-N 3.24Å; M836-M838 VanDerWaalsContact C-N 3.29Å; M836-M838 PolarHBondContact O-N 2.94Å; M836-A839 PolarHBondContact O-N 2.86Å; M836-I840 WeakPolarHBondContact O-CB 2.9Å; M836-I840 WeakPolarHBondContact O-CD1 3.33Å; M836-I840 WeakPolarHBondContact O-CG1 3.4Å; M836-I840 PolarHBondContact O-N 3.31Å; M836-L862 HydrophobicContact CE-CD2 4.18Å; M836-I870 HydrophobicContact CE-CD1 4.48Å; M836-I870 HydrophobicContact CE-CG2 3.59Å; M836-I870 HydrophobicContact SD-CG2 4.47Å; M836-N874 VanDerWaalsContact CE-C 3.49Å; M836-N874 HydrophobicContact CE-CB 3.98Å; M836-N874 VanDerWaalsContact CE-O 3.29Å; M836-N874 WeakPolarHBondContact CE-O 3.5Å; M836-N874 HydrophobicContact SD-CB 3.67Å; M836-F875 HydrophobicContact CE-CB 4.33Å
837	A	85.7	Confident	79.9	Confident	4 Å²	4	65.1 Å²	65.1	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-39.5	171.6	0	0	0	0	0	111.4	R833 E834 W841 F881 L882	R833-A837 WeakPolarHBondContact O-CB 3.24Å; R833-A837 PolarHBondContact O-N 3.48Å; E834-A837 PolarHBondContact O-N 3.14Å; A837-W841 WeakPolarHBondContact O-CB 3.28Å; A837-W841 PolarHBondContact O-N 3.04Å; A837-F881 HydrophobicContact CB-CB 4.32Å; A837-F881 HydrophobicContact CB-CD1 3.57Å; A837-F881 HydrophobicContact CB-CE1 4.31Å; A837-F881 HydrophobicContact CB-CG 4.29Å; A837-L882 HydrophobicContact CB-CD1 4.33Å; A837-L882 HydrophobicContact CB-CD2 4Å; A837-L882 HydrophobicContact CB-CG 3.87Å
838	M	85	Confident	80.1	Confident	131 Å²	131	67.8 Å²	67.8	65%	0.645	33%	0.326	S	S	*	.	H	α-helix	trans	-66.6	-41.9	173.4	-69.1	-180	-151.8	0	0	112.4	E834 E835 M836 W841 S842	E834-M838 HydrophobicContact CB-CE 4.47Å; E834-M838 VanDerWaalsContact O-CG 3.3Å; E834-M838 WeakPolarHBondContact O-CG 3.12Å; E834-M838 PolarHBondContact O-N 2.87Å; E835-M838 PolarHBondContact O-N 2.96Å; M836-M838 VanDerWaalsContact C-N 3.29Å; M836-M838 PolarHBondContact O-N 2.94Å; M838-W841 PolarHBondContact O-N 2.93Å; M838-S842 WeakPolarHBondContact O-CB 3.37Å; M838-S842 PolarHBondContact O-N 2.68Å
839	A	85.7	Confident	80.6	Confident	42 Å²	42	78.8 Å²	78.8	35%	0.347	37%	0.365	S	S	.	.	H	α-helix	trans	-64.6	-44.5	177.7	0	0	0	0	0	112.6	E835 M836 S842 L843 L862	E835-A839 PolarHBondContact O-N 2.89Å; M836-A839 PolarHBondContact O-N 2.86Å; A839-S842 PolarHBondContact O-N 2.8Å; A839-L843 PolarHBondContact O-N 2.98Å; A839-L843 VanDerWaalsContact O-N 3.12Å; A839-L862 HydrophobicContact CB-CD1 4.18Å
840	I	85.3	Confident	81.1	Confident	0 Å²	0	79 Å²	79	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-64.2	-42.8	174.4	-64.9	165.4	0	0	0	110.2	M836 L843 L844 L862 F875 L879 L882	M836-I840 WeakPolarHBondContact O-CB 2.9Å; M836-I840 WeakPolarHBondContact O-CD1 3.33Å; M836-I840 WeakPolarHBondContact O-CG1 3.4Å; M836-I840 PolarHBondContact O-N 3.31Å; I840-L843 PolarHBondContact O-N 2.97Å; I840-L844 HydrophobicContact CG2-CD1 3.86Å; I840-L844 WeakPolarHBondContact O-CD1 3.28Å; I840-L844 VanDerWaalsContact O-CG 3.25Å; I840-L844 WeakPolarHBondContact O-CG 3.36Å; I840-L844 PolarHBondContact O-N 3.28Å; I840-L844 VanDerWaalsContact O-N 3.14Å; I840-L862 HydrophobicContact CG1-CD1 4.19Å; I840-L862 HydrophobicContact CG1-CD2 4.49Å; I840-F875 HydrophobicContact CD1-CD2 3.61Å; I840-F875 HydrophobicContact CD1-CE2 3.74Å; I840-F875 HydrophobicContact CG1-CD2 4.11Å; I840-F875 HydrophobicContact CG1-CE2 3.9Å; I840-L879 HydrophobicContact CG2-CD2 4.08Å; I840-L882 HydrophobicContact CB-CD1 3.85Å; I840-L882 HydrophobicContact CG2-CD1 3.62Å
841	W	86.1	Confident	81.3	Confident	46 Å²	46	76.5 Å²	76.5	17%	0.174	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-43.1	177.2	-176.9	-99.8	0	0	0	112.3	A837 M838 L843 L844 E845 L882 K887 I888 K897	A837-W841 WeakPolarHBondContact O-CB 3.28Å; A837-W841 PolarHBondContact O-N 3.04Å; M838-W841 PolarHBondContact O-N 2.93Å; W841-L843 PolarHBondContact O-N 3.41Å; W841-L844 CarbonylContact O-C 3.56Å; W841-L844 PolarHBondContact O-N 3.18Å; W841-L844 VanDerWaalsContact O-N 3.11Å; W841-E845 PolarHBondContact NE1-OE2 3.36Å; W841-E845 WeakPolarHBondContact O-CB 3.43Å; W841-E845 PolarHBondContact O-N 3.15Å; W841-L882 HydrophobicContact CB-CD2 4.22Å; W841-L882 HydrophobicContact CE3-CD2 4.44Å; W841-K887 HydrophobicContact CD2-CD 4.05Å; W841-K887 HydrophobicContact CE3-CB 4.05Å; W841-K887 HydrophobicContact CE3-CD 3.9Å; W841-K887 HydrophobicContact CE3-CG 4.48Å; W841-K887 HydrophobicContact CH2-CB 4.27Å; W841-K887 HydrophobicContact CH2-CD 4.36Å; W841-K887 HydrophobicContact CH2-CG 4.43Å; W841-K887 HydrophobicContact CZ3-CB 3.66Å; W841-K887 HydrophobicContact CZ3-CD 4.07Å; W841-K887 HydrophobicContact CZ3-CG 4.2Å; W841-I888 HydrophobicContact CE3-CD1 4.49Å; W841-I888 HydrophobicContact CE3-CG1 4.46Å; W841-I888 HydrophobicContact CZ3-CG1 4.28Å; W841-K897 HydrophobicContact CH2-CD 4.46Å; W841-K897 VanDerWaalsContact CH2-CE 3.41Å; W841-K897 HydrophobicContact CH2-CG 4.26Å; W841-K897 HydrophobicContact CZ3-CG 4.17Å
842	S	85	Confident	81.5	Confident	58 Å²	58	74.7 Å²	74.7	41%	0.406	36%	0.364	S	S	.	.	H	α-helix	trans	-58.3	-46.6	175.7	-175.6	0	0	0	0	112.2	M838 A839 L844 E845 E846	M838-S842 WeakPolarHBondContact O-CB 3.37Å; M838-S842 PolarHBondContact O-N 2.68Å; A839-S842 PolarHBondContact O-N 2.8Å; S842-L844 VanDerWaalsContact C-N 3.26Å; S842-L844 PolarHBondContact O-N 3.19Å; S842-E845 PolarHBondContact O-N 3.07Å; S842-E846 PolarHBondContact O-N 3.11Å
843	L	83.1	Confident	81.8	Confident	11 Å²	11	70.1 Å²	70.1	6%	0.058	35%	0.347	C	S	.	.	H	α-helix	trans	-58.3	-35.1	174	-81.7	169.3	0	0	0	113.5	A839 I840 W841 E845 D861 L862 R865	A839-L843 PolarHBondContact O-N 2.98Å; A839-L843 VanDerWaalsContact O-N 3.12Å; I840-L843 PolarHBondContact O-N 2.97Å; W841-L843 PolarHBondContact O-N 3.41Å; L843-E845 VanDerWaalsContact C-N 3.34Å; L843-D861 HydrophobicContact CD2-CB 4.41Å; L843-L862 HydrophobicContact CD1-CB 3.95Å; L843-L862 HydrophobicContact CD1-CD1 3.56Å; L843-L862 HydrophobicContact CD1-CG 4.38Å; L843-R865 VanDerWaalsContact CD2-CZ 3.45Å
844	L	83	Confident	82.2	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-82.8	-10.7	177.3	-64.1	166.7	0	0	0	112.9	I840 W841 S842 F853 I888 I895 K897	I840-L844 HydrophobicContact CG2-CD1 3.86Å; I840-L844 WeakPolarHBondContact O-CD1 3.28Å; I840-L844 VanDerWaalsContact O-CG 3.25Å; I840-L844 WeakPolarHBondContact O-CG 3.36Å; I840-L844 PolarHBondContact O-N 3.28Å; I840-L844 VanDerWaalsContact O-N 3.14Å; W841-L844 CarbonylContact O-C 3.56Å; W841-L844 PolarHBondContact O-N 3.18Å; W841-L844 VanDerWaalsContact O-N 3.11Å; S842-L844 VanDerWaalsContact C-N 3.26Å; S842-L844 PolarHBondContact O-N 3.19Å; L844-F853 HydrophobicContact CD2-CB 4.23Å; L844-F853 HydrophobicContact CD2-CD1 3.99Å; L844-F853 HydrophobicContact CD2-CD2 3.26Å; L844-F853 HydrophobicContact CD2-CE1 4.15Å; L844-F853 HydrophobicContact CD2-CE2 3.44Å; L844-F853 VanDerWaalsContact CD2-CE2 3.44Å; L844-F853 HydrophobicContact CD2-CG 3.55Å; L844-F853 HydrophobicContact CD2-CZ 3.89Å; L844-I888 HydrophobicContact CD1-CD1 3.27Å; L844-I888 HydrophobicContact CD1-CG1 4.29Å; L844-I895 HydrophobicContact CD1-CG2 4.46Å; L844-K897 PolarHBondContact O-NZ 2.95Å
845	E	83.6	Confident	82.3	Confident	110 Å²	110	69.4 Å²	69.4	51%	0.514	35%	0.35	S	S	.	.	H	α-helix	trans	-94.9	-34.1	178.6	-167.5	148.6	-148.3	0	0	112.1	W841 S842 L843 R847 P848	W841-E845 PolarHBondContact NE1-OE2 3.36Å; W841-E845 WeakPolarHBondContact O-CB 3.43Å; W841-E845 PolarHBondContact O-N 3.15Å; S842-E845 PolarHBondContact O-N 3.07Å; L843-E845 VanDerWaalsContact C-N 3.34Å; E845-R847 PolarHBondContact O-N 2.8Å; E845-R847 VanDerWaalsContact O-N 3.12Å; E845-P848 WeakPolarHBondContact O-CD 3.32Å
846	E	83.6	Confident	82.3	Confident	103 Å²	103	66.8 Å²	66.8	48%	0.481	34%	0.343	S	S	.	.	S	Bend	trans	-58.4	-21.8	171.1	-73.4	178.1	-164.7	0	0	114.5	S842 P848 R865	S842-E846 PolarHBondContact O-N 3.11Å; E846-P848 WeakPolarHBondContact O-CD 3.4Å; E846-R865 VanDerWaalsContact CD-NH1 3.33Å; E846-R865 IonicContact OE1-CZ 3.92Å; E846-R865 IonicContact OE1-NH1 3.02Å; E846-R865 PolarHBondContact OE1-NH1 3.15Å; E846-R865 IonicContact OE1-NH2 3.14Å; E846-R865 IonicContact OE2-CZ 3.42Å; E846-R865 IonicContact OE2-NH1 2.74Å; E846-R865 PolarHBondContact OE2-NH1 3.23Å; E846-R865 IonicContact OE2-NH2 2.83Å; E846-R865 PolarHBondContact OE2-NH2 2.74Å
847	R	81.5	Confident	82.4	Confident	105 Å²	105	73.5 Å²	73.5	40%	0.396	37%	0.367	S	S	.	.			trans	-115.4	63.5	-177.6	-64.8	-179.8	-179.3	155.7	4	112	E845 R849 V850 F853 D861	E845-R847 PolarHBondContact O-N 2.8Å; E845-R847 VanDerWaalsContact O-N 3.12Å; R847-R849 PolarHBondContact O-N 3.13Å; R847-R849 VanDerWaalsContact O-N 3.08Å; R847-V850 PolarHBondContact O-N 3.26Å; R847-F853 HydrophobicContact CB-CE1 3.99Å; R847-F853 HydrophobicContact CB-CZ 4.07Å; R847-D861 IonicContact CZ-OD2 3.22Å; R847-D861 IonicContact NH1-OD2 3.93Å; R847-D861 PolarHBondContact NH1-OD2 2.8Å; R847-D861 IonicContact NH2-OD1 3.64Å; R847-D861 IonicContact NH2-OD2 2.71Å; R847-D861 PolarHBondContact NH2-OD2 3.26Å
848	P	70.7	Confident	82.3	Confident	103 Å²	103	73.6 Å²	73.6	67%	0.669	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.2	-169.7	28.4	-37.1	0	0	0	115	E845 E846	E845-P848 WeakPolarHBondContact O-CD 3.32Å; E846-P848 WeakPolarHBondContact O-CD 3.4Å
849	R	75.1	Confident	82.3	Confident	244 Å²	244	68.3 Å²	68.3	92%	0.921	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.4	-179.8	-65.8	-176.3	-179.7	170.9	0.8	114.2	R847	R847-R849 PolarHBondContact O-N 3.13Å; R847-R849 VanDerWaalsContact O-N 3.08Å
850	V	77.4	Confident	82.2	Confident	64 Å²	64	72.1 Å²	72.1	39%	0.388	35%	0.352	S	S	.	.			trans	-117.6	118.6	-175.1	180	0	0	0	0	108.9	R847 T852 F853	R847-V850 PolarHBondContact O-N 3.26Å; V850-T852 WeakPolarHBondContact CG1-O 3.27Å; V850-F853 HydrophobicContact CB-CE1 4.14Å; V850-F853 HydrophobicContact CB-CZ 3.93Å; V850-F853 HydrophobicContact CG1-CD1 4.33Å; V850-F853 HydrophobicContact CG1-CE1 4.03Å; V850-F853 HydrophobicContact CG1-CE2 4.32Å; V850-F853 HydrophobicContact CG1-CZ 4.03Å; V850-F853 WeakPolarHBondContact O-CE2 3.43Å; V850-F853 WeakPolarHBondContact O-CZ 3.19Å
851	L	77.4	Confident	82.2	Confident	105 Å²	105	74.4 Å²	74.4	55%	0.55	36%	0.364	S	S	.	.	S	Bend	trans	-90.7	-16.8	178.2	-69.1	170.8	0	0	0	113	R896 K897	L851-R896 CarbonylContact O-C 3.58Å; L851-R896 WeakPolarHBondContact O-CA 3.08Å; L851-K897 PolarHBondContact O-N 3.14Å
852	T	81.6	Confident	82	Confident	92 Å²	92	72.7 Å²	72.7	56%	0.564	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	121.8	-174.7	45	0	0	0	0	111.4	V850 R896	V850-T852 WeakPolarHBondContact CG1-O 3.27Å; T852-R896 HydrophobicContact CG2-CB 4.4Å; T852-R896 HydrophobicContact CG2-CG 4.21Å
853	F	82.4	Confident	82	Confident	16 Å²	16	75.8 Å²	75.8	7%	0.07	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	150.9	-178	-60.6	-93.8	0	0	0	110.7	L844 R847 V850 V858 T894 I895	L844-F853 HydrophobicContact CD2-CB 4.23Å; L844-F853 HydrophobicContact CD2-CD1 3.99Å; L844-F853 HydrophobicContact CD2-CD2 3.26Å; L844-F853 HydrophobicContact CD2-CE1 4.15Å; L844-F853 HydrophobicContact CD2-CE2 3.44Å; L844-F853 VanDerWaalsContact CD2-CE2 3.44Å; L844-F853 HydrophobicContact CD2-CG 3.55Å; L844-F853 HydrophobicContact CD2-CZ 3.89Å; R847-F853 HydrophobicContact CB-CE1 3.99Å; R847-F853 HydrophobicContact CB-CZ 4.07Å; V850-F853 HydrophobicContact CB-CE1 4.14Å; V850-F853 HydrophobicContact CB-CZ 3.93Å; V850-F853 HydrophobicContact CG1-CD1 4.33Å; V850-F853 HydrophobicContact CG1-CE1 4.03Å; V850-F853 HydrophobicContact CG1-CE2 4.32Å; V850-F853 HydrophobicContact CG1-CZ 4.03Å; V850-F853 WeakPolarHBondContact O-CE2 3.43Å; V850-F853 WeakPolarHBondContact O-CZ 3.19Å; F853-V858 HydrophobicContact CB-CG2 3.8Å; F853-V858 HydrophobicContact CG-CG2 4.45Å; F853-T894 WeakPolarHBondContact O-CA 3.47Å; F853-I895 HydrophobicContact CB-CB 4.32Å; F853-I895 PolarHBondContact N-O 2.93Å; F853-I895 PolarHBondContact O-N 2.79Å
854	V	84.9	Confident	82	Confident	63 Å²	63	79.5 Å²	79.5	38%	0.382	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129.8	175.6	-177.6	0	0	0	0	108.9	S856 R857 V858	V854-S856 VanDerWaalsContact C-N 3.34Å; V854-S856 PolarHBondContact O-N 2.76Å; V854-R857 HydrophobicContact CB-CG 4.44Å; V854-R857 PolarHBondContact O-N 3.34Å; V854-V858 PolarHBondContact O-N 3.43Å
855	Y	85.5	Confident	81.8	Confident	24 Å²	24	86.2 Å²	86.2	9%	0.094	42%	0.419	C	S	.	.	H	α-helix	trans	-48.7	-49.9	-177.1	174.8	-80.1	0	0	0	113.1	R857 V858 L859 R872 F875 E876 L879 W890 N893	Y855-R857 PolarHBondContact O-N 3.12Å; Y855-V858 PolarHBondContact O-N 3.27Å; Y855-L859 PolarHBondContact O-N 2.88Å; Y855-R872 WeakPolarHBondContact OH-CG 3.43Å; Y855-R872 PolarHBondContact OH-NE 2.89Å; Y855-F875 AromaticContact CD2-CE1 3.85Å; Y855-F875 HydrophobicContact CD2-CE1 3.85Å; Y855-F875 HydrophobicContact CE1-CE1 4.41Å; Y855-F875 AromaticContact CE2-CD1 3.85Å; Y855-F875 HydrophobicContact CE2-CD1 3.85Å; Y855-F875 AromaticContact CE2-CE1 3.64Å; Y855-F875 HydrophobicContact CE2-CE1 3.64Å; Y855-F875 HydrophobicContact CG-CE1 4.36Å; Y855-F875 AromaticContact CZ-CD1 3.9Å; Y855-F875 AromaticContact CZ-CE1 3.94Å; Y855-E876 HydrophobicContact CE2-CG 4.14Å; Y855-E876 PolarHBondContact OH-OE1 2.84Å; Y855-L879 HydrophobicContact CD2-CD1 4.16Å; Y855-L879 HydrophobicContact CE2-CD1 4.13Å; Y855-W890 AromaticContact CD2-NE1 3.98Å; Y855-W890 HydrophobicContact CE2-CZ2 4.45Å; Y855-N893 WeakPolarHBondContact CB-O 3.5Å; Y855-N893 PolarHBondContact N-O 2.88Å
856	S	84.7	Confident	81.3	Confident	54 Å²	54	82.7 Å²	82.7	38%	0.378	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-42.5	-177.2	52.5	0	0	0	0	112.8	V854 V858 L859 E860	V854-S856 VanDerWaalsContact C-N 3.34Å; V854-S856 PolarHBondContact O-N 2.76Å; S856-V858 PolarHBondContact O-N 2.56Å; S856-L859 WeakPolarHBondContact O-CB 3.42Å; S856-L859 PolarHBondContact O-N 3.49Å; S856-E860 WeakPolarHBondContact O-CB 3.17Å; S856-E860 WeakPolarHBondContact O-CG 3.18Å; S856-E860 PolarHBondContact O-N 3.13Å
857	R	84	Confident	80.7	Confident	168 Å²	168	87.8 Å²	87.8	63%	0.634	43%	0.43	S	S	*	.	H	α-helix	trans	-65.3	-38	178.9	-67.5	-174.9	179	174.1	-0.1	112.4	V854 Y855 E860 D861	V854-R857 HydrophobicContact CB-CG 4.44Å; V854-R857 PolarHBondContact O-N 3.34Å; Y855-R857 PolarHBondContact O-N 3.12Å; R857-E860 PolarHBondContact O-N 2.81Å; R857-D861 VanDerWaalsContact O-CB 3.28Å; R857-D861 WeakPolarHBondContact O-CB 3.4Å; R857-D861 VanDerWaalsContact O-CG 3.3Å; R857-D861 PolarHBondContact O-N 3.36Å
858	V	83.7	Confident	80	Confident	5 Å²	5	92.1 Å²	92.1	3%	0.03	45%	0.446	C	S	.	.	H	α-helix	trans	-69.3	-38.7	176.2	-177.8	0	0	0	0	110.7	F853 V854 Y855 S856 L862 F875 I895	F853-V858 HydrophobicContact CB-CG2 3.8Å; F853-V858 HydrophobicContact CG-CG2 4.45Å; V854-V858 PolarHBondContact O-N 3.43Å; Y855-V858 PolarHBondContact O-N 3.27Å; S856-V858 PolarHBondContact O-N 2.56Å; V858-L862 WeakPolarHBondContact O-CB 3.43Å; V858-L862 PolarHBondContact O-N 3.28Å; V858-F875 HydrophobicContact CB-CZ 4.07Å; V858-F875 HydrophobicContact CG1-CE2 3.92Å; V858-F875 HydrophobicContact CG1-CZ 3.78Å; V858-I895 HydrophobicContact CB-CD1 4.29Å; V858-I895 HydrophobicContact CG2-CD1 4.21Å
859	L	83.9	Confident	79.9	Confident	21 Å²	21	96.4 Å²	96.4	11%	0.11	46%	0.46	C	S	.	.	H	α-helix	trans	-63.1	-43	174.3	-172.5	94.8	0	0	0	112	Y855 S856 R863 F875	Y855-L859 PolarHBondContact O-N 2.88Å; S856-L859 WeakPolarHBondContact O-CB 3.42Å; S856-L859 PolarHBondContact O-N 3.49Å; L859-R863 WeakPolarHBondContact O-CB 3.41Å; L859-R863 VanDerWaalsContact O-CG 3.29Å; L859-R863 WeakPolarHBondContact O-CG 3.48Å; L859-R863 PolarHBondContact O-N 2.9Å; L859-F875 HydrophobicContact CB-CE1 4.24Å; L859-F875 HydrophobicContact CB-CZ 4.45Å; L859-F875 HydrophobicContact CD1-CB 3.91Å; L859-F875 HydrophobicContact CD1-CD1 3.48Å; L859-F875 VanDerWaalsContact CD1-CD1 3.48Å; L859-F875 HydrophobicContact CD1-CD2 4.37Å; L859-F875 HydrophobicContact CD1-CE1 4.01Å; L859-F875 HydrophobicContact CD1-CG 3.67Å
860	E	84.4	Confident	79.9	Confident	121 Å²	121	85.9 Å²	85.9	57%	0.565	42%	0.422	S	S	*	.	H	α-helix	trans	-67.7	-48.7	177.2	-74.5	164.9	-169.5	0	0	112	S856 R857 L862 R863 A864	S856-E860 WeakPolarHBondContact O-CB 3.17Å; S856-E860 WeakPolarHBondContact O-CG 3.18Å; S856-E860 PolarHBondContact O-N 3.13Å; R857-E860 PolarHBondContact O-N 2.81Å; E860-L862 VanDerWaalsContact C-N 3.26Å; E860-L862 PolarHBondContact O-N 3.28Å; E860-R863 PolarHBondContact O-N 3.48Å; E860-A864 WeakPolarHBondContact O-CB 3.48Å; E860-A864 PolarHBondContact O-N 2.77Å
861	D	83.9	Confident	79.8	Confident	48 Å²	48	85.9 Å²	85.9	26%	0.257	42%	0.422	S	S	.	.	H	α-helix	trans	-57.5	-39.4	175.5	-79.9	-18.7	0	0	0	111.4	L843 R847 R857 R865	L843-D861 HydrophobicContact CD2-CB 4.41Å; R847-D861 IonicContact CZ-OD2 3.22Å; R847-D861 IonicContact NH1-OD2 3.93Å; R847-D861 PolarHBondContact NH1-OD2 2.8Å; R847-D861 IonicContact NH2-OD1 3.64Å; R847-D861 IonicContact NH2-OD2 2.71Å; R847-D861 PolarHBondContact NH2-OD2 3.26Å; R857-D861 VanDerWaalsContact O-CB 3.28Å; R857-D861 WeakPolarHBondContact O-CB 3.4Å; R857-D861 VanDerWaalsContact O-CG 3.3Å; R857-D861 PolarHBondContact O-N 3.36Å; D861-R865 WeakPolarHBondContact O-CG 3.4Å; D861-R865 PolarHBondContact O-N 3.49Å
862	L	83.1	Confident	79.9	Confident	10 Å²	10	88.3 Å²	88.3	5%	0.052	42%	0.424	C	S	.	.	H	α-helix	trans	-68.4	-47.8	177	-171	85.9	0	0	0	111.6	M836 A839 I840 L843 V858 E860 A864 R865 S866 I870 F875	M836-L862 HydrophobicContact CE-CD2 4.18Å; A839-L862 HydrophobicContact CB-CD1 4.18Å; I840-L862 HydrophobicContact CG1-CD1 4.19Å; I840-L862 HydrophobicContact CG1-CD2 4.49Å; L843-L862 HydrophobicContact CD1-CB 3.95Å; L843-L862 HydrophobicContact CD1-CD1 3.56Å; L843-L862 HydrophobicContact CD1-CG 4.38Å; V858-L862 WeakPolarHBondContact O-CB 3.43Å; V858-L862 PolarHBondContact O-N 3.28Å; E860-L862 VanDerWaalsContact C-N 3.26Å; E860-L862 PolarHBondContact O-N 3.28Å; L862-A864 VanDerWaalsContact C-N 3.29Å; L862-A864 PolarHBondContact O-N 3.21Å; L862-R865 PolarHBondContact O-N 2.83Å; L862-S866 PolarHBondContact O-N 3.12Å; L862-S866 VanDerWaalsContact O-N 3.16Å; L862-S866 PolarHBondContact O-OG 2.99Å; L862-I870 HydrophobicContact CD2-CD1 3.53Å; L862-I870 HydrophobicContact CD2-CG2 4.14Å; L862-I870 HydrophobicContact CG-CD1 3.7Å; L862-F875 HydrophobicContact CD2-CD2 3.66Å; L862-F875 HydrophobicContact CD2-CE2 4.09Å
863	R	84.4	Confident	79.9	Confident	124 Å²	124	90.7 Å²	90.7	47%	0.468	43%	0.428	S	S	.	.	H	α-helix	trans	-61	-35.6	177.1	-79.8	174.5	170.6	-179	-2.6	112.8	L859 E860 R865 I870	L859-R863 WeakPolarHBondContact O-CB 3.41Å; L859-R863 VanDerWaalsContact O-CG 3.29Å; L859-R863 WeakPolarHBondContact O-CG 3.48Å; L859-R863 PolarHBondContact O-N 2.9Å; E860-R863 PolarHBondContact O-N 3.48Å; R863-R865 VanDerWaalsContact C-N 3.3Å; R863-R865 PolarHBondContact O-N 2.87Å; R863-I870 PolarHBondContact NE-O 2.86Å; R863-I870 PolarHBondContact NH2-O 3.35Å
864	A	82.7	Confident	79.7	Confident	89 Å²	89	93 Å²	93	74%	0.736	44%	0.442	S	S	*	.	H	α-helix	trans	-70.1	-25.1	178	0	0	0	0	0	113.4	E860 L862	E860-A864 WeakPolarHBondContact O-CB 3.48Å; E860-A864 PolarHBondContact O-N 2.77Å; L862-A864 VanDerWaalsContact C-N 3.29Å; L862-A864 PolarHBondContact O-N 3.21Å
865	R	79.9	Confident	79.7	Confident	141 Å²	141	90 Å²	90	53%	0.532	42%	0.424	S	S	.	.	H	α-helix	trans	-92.2	-21	178.5	-70.9	-175.3	-176.4	-161.9	1.5	114.3	L843 E846 D861 L862 R863	L843-R865 VanDerWaalsContact CD2-CZ 3.45Å; E846-R865 VanDerWaalsContact CD-NH1 3.33Å; E846-R865 IonicContact OE1-CZ 3.92Å; E846-R865 IonicContact OE1-NH1 3.02Å; E846-R865 PolarHBondContact OE1-NH1 3.15Å; E846-R865 IonicContact OE1-NH2 3.14Å; E846-R865 IonicContact OE2-CZ 3.42Å; E846-R865 IonicContact OE2-NH1 2.74Å; E846-R865 PolarHBondContact OE2-NH1 3.23Å; E846-R865 IonicContact OE2-NH2 2.83Å; E846-R865 PolarHBondContact OE2-NH2 2.74Å; D861-R865 WeakPolarHBondContact O-CG 3.4Å; D861-R865 PolarHBondContact O-N 3.49Å; L862-R865 PolarHBondContact O-N 2.83Å; R863-R865 VanDerWaalsContact C-N 3.3Å; R863-R865 PolarHBondContact O-N 2.87Å
866	S	72.8	Confident	79.7	Confident	37 Å²	37	90.9 Å²	90.9	26%	0.259	43%	0.429	S	S	.	.			trans	-99.5	122.4	-176	62.1	0	0	0	0	112.3	L862 R868 I870	L862-S866 PolarHBondContact O-N 3.12Å; L862-S866 VanDerWaalsContact O-N 3.16Å; L862-S866 PolarHBondContact O-OG 2.99Å; S866-R868 PolarHBondContact O-N 3.05Å; S866-R868 VanDerWaalsContact O-N 3.1Å; S866-R868 PolarHBondContact OG-O 2.96Å; S866-I870 VanDerWaalsContact OG-CD1 3.29Å; S866-I870 WeakPolarHBondContact OG-CD1 3.46Å
867	E	71.1	Confident	79.6	Confident	209 Å²	209	91.3 Å²	91.3	98%	0.977	43%	0.427	S	S	*	.	S	Bend	trans	-62.9	-14.1	170.9	-62.2	-179.3	160.2	0	0	113.7
868	R	67.1	Low	79.7	Confident	196 Å²	196	83.3 Å²	83.3	74%	0.74	40%	0.396	S	S	*	.	S	Bend	trans	-98.3	139.9	179.4	-64.9	-179.4	179.3	166.2	0.9	110.7	S866 I870	S866-R868 PolarHBondContact O-N 3.05Å; S866-R868 VanDerWaalsContact O-N 3.1Å; S866-R868 PolarHBondContact OG-O 2.96Å; R868-I870 PolarHBondContact O-N 3.48Å
869	M	68.8	Low	79.8	Confident	193 Å²	193	83.1 Å²	83.1	95%	0.951	40%	0.395	S	S	*	.			trans	-65.1	114.7	172.6	-67.9	-173.6	178.6	0	0	110.9
870	I	73.4	Confident	79.9	Confident	23 Å²	23	84.6 Å²	84.6	12%	0.118	40%	0.403	C	S	.	.			trans	-92.5	114.1	176.7	-61	178.9	0	0	0	109.6	M836 L862 R863 S866 R868 F875	M836-I870 HydrophobicContact CE-CD1 4.48Å; M836-I870 HydrophobicContact CE-CG2 3.59Å; M836-I870 HydrophobicContact SD-CG2 4.47Å; L862-I870 HydrophobicContact CD2-CD1 3.53Å; L862-I870 HydrophobicContact CD2-CG2 4.14Å; L862-I870 HydrophobicContact CG-CD1 3.7Å; R863-I870 PolarHBondContact NE-O 2.86Å; R863-I870 PolarHBondContact NH2-O 3.35Å; S866-I870 VanDerWaalsContact OG-CD1 3.29Å; S866-I870 WeakPolarHBondContact OG-CD1 3.46Å; R868-I870 PolarHBondContact O-N 3.48Å; I870-F875 HydrophobicContact CG2-CB 4.44Å
871	T	76	Confident	79.9	Confident	65 Å²	65	81.7 Å²	81.7	40%	0.399	39%	0.389	S	S	.	.			trans	-67.9	156.5	171.3	61.6	0	0	0	0	110.7	E873 N874 F875	T871-E873 VanDerWaalsContact C-N 3.33Å; T871-E873 PolarHBondContact O-N 2.91Å; T871-N874 PolarHBondContact OG1-N 2.88Å; T871-N874 PolarHBondContact OG1-ND2 2.93Å; T871-N874 PolarHBondContact OG1-OD1 3.43Å; T871-F875 PolarHBondContact O-N 3Å
872	R	80.2	Confident	80	Confident	156 Å²	156	79.6 Å²	79.6	59%	0.589	38%	0.377	S	S	*	.	H	α-helix	trans	-62.2	-42.3	179.1	-176.1	179.2	168.2	171.5	-3.6	111.9	Y855 F875 E876	Y855-R872 WeakPolarHBondContact OH-CG 3.43Å; Y855-R872 PolarHBondContact OH-NE 2.89Å; R872-F875 WeakPolarHBondContact O-CB 3.41Å; R872-F875 PolarHBondContact O-N 3.19Å; R872-E876 IonicContact CZ-OE1 3.39Å; R872-E876 IonicContact NE-OE1 2.69Å; R872-E876 PolarHBondContact NE-OE1 3.03Å; R872-E876 IonicContact NH2-OE1 3.63Å; R872-E876 PolarHBondContact NH2-OE1 3.4Å; R872-E876 PolarHBondContact O-N 3.45Å
873	E	80	Confident	80.2	Confident	141 Å²	141	83.2 Å²	83.2	66%	0.659	39%	0.393	S	S	*	.	H	α-helix	trans	-57.3	-50.3	178.8	-66.3	157.6	-175.4	0	0	111.7	T871 F875 E876 D877	T871-E873 VanDerWaalsContact C-N 3.33Å; T871-E873 PolarHBondContact O-N 2.91Å; E873-F875 PolarHBondContact O-N 3.46Å; E873-E876 PolarHBondContact O-N 3.32Å; E873-E876 VanDerWaalsContact O-N 3.11Å; E873-D877 PolarHBondContact O-N 2.89Å
874	N	79.8	Confident	80.2	Confident	66 Å²	66	83.1 Å²	83.1	35%	0.353	40%	0.402	S	S	.	.	H	α-helix	trans	-58.7	-34.5	179	-67.8	-5.3	0	0	0	112.5	M836 T871 G878	M836-N874 VanDerWaalsContact CE-C 3.49Å; M836-N874 HydrophobicContact CE-CB 3.98Å; M836-N874 VanDerWaalsContact CE-O 3.29Å; M836-N874 WeakPolarHBondContact CE-O 3.5Å; M836-N874 HydrophobicContact SD-CB 3.67Å; T871-N874 PolarHBondContact OG1-N 2.88Å; T871-N874 PolarHBondContact OG1-ND2 2.93Å; T871-N874 PolarHBondContact OG1-OD1 3.43Å; N874-G878 PolarHBondContact O-N 3.3Å
875	F	84.5	Confident	80.4	Confident	0 Å²	0	82 Å²	82	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-71.8	-43.9	176.3	179.5	-111.8	0	0	0	112.1	M836 I840 Y855 V858 L859 L862 I870 T871 R872 E873 D877 G878 L879 I895	M836-F875 HydrophobicContact CE-CB 4.33Å; I840-F875 HydrophobicContact CD1-CD2 3.61Å; I840-F875 HydrophobicContact CD1-CE2 3.74Å; I840-F875 HydrophobicContact CG1-CD2 4.11Å; I840-F875 HydrophobicContact CG1-CE2 3.9Å; Y855-F875 AromaticContact CD2-CE1 3.85Å; Y855-F875 HydrophobicContact CD2-CE1 3.85Å; Y855-F875 HydrophobicContact CE1-CE1 4.41Å; Y855-F875 AromaticContact CE2-CD1 3.85Å; Y855-F875 HydrophobicContact CE2-CD1 3.85Å; Y855-F875 AromaticContact CE2-CE1 3.64Å; Y855-F875 HydrophobicContact CE2-CE1 3.64Å; Y855-F875 HydrophobicContact CG-CE1 4.36Å; Y855-F875 AromaticContact CZ-CD1 3.9Å; Y855-F875 AromaticContact CZ-CE1 3.94Å; V858-F875 HydrophobicContact CB-CZ 4.07Å; V858-F875 HydrophobicContact CG1-CE2 3.92Å; V858-F875 HydrophobicContact CG1-CZ 3.78Å; L859-F875 HydrophobicContact CB-CE1 4.24Å; L859-F875 HydrophobicContact CB-CZ 4.45Å; L859-F875 HydrophobicContact CD1-CB 3.91Å; L859-F875 HydrophobicContact CD1-CD1 3.48Å; L859-F875 VanDerWaalsContact CD1-CD1 3.48Å; L859-F875 HydrophobicContact CD1-CD2 4.37Å; L859-F875 HydrophobicContact CD1-CE1 4.01Å; L859-F875 HydrophobicContact CD1-CG 3.67Å; L862-F875 HydrophobicContact CD2-CD2 3.66Å; L862-F875 HydrophobicContact CD2-CE2 4.09Å; I870-F875 HydrophobicContact CG2-CB 4.44Å; T871-F875 PolarHBondContact O-N 3Å; R872-F875 WeakPolarHBondContact O-CB 3.41Å; R872-F875 PolarHBondContact O-N 3.19Å; E873-F875 PolarHBondContact O-N 3.46Å; F875-D877 VanDerWaalsContact C-N 3.31Å; F875-D877 PolarHBondContact O-N 3.07Å; F875-G878 PolarHBondContact O-N 2.83Å; F875-L879 HydrophobicContact CD1-CD1 3.99Å; F875-L879 HydrophobicContact CE1-CD1 3.57Å; F875-L879 HydrophobicContact CE1-CG 4.34Å; F875-L879 HydrophobicContact CZ-CD1 3.93Å; F875-L879 HydrophobicContact CZ-CG 4.32Å; F875-L879 WeakPolarHBondContact O-CG 3.18Å; F875-L879 PolarHBondContact O-N 3.18Å; F875-I895 HydrophobicContact CZ-CD1 4.34Å
876	E	85.6	Confident	80.4	Confident	42 Å²	42	80.4 Å²	80.4	20%	0.196	39%	0.388	C	S	.	.	H	α-helix	trans	-65.3	-34.7	175.9	-70.3	178.2	-176.2	0	0	111.6	Y855 R872 E873 L879 N880 W890	Y855-E876 HydrophobicContact CE2-CG 4.14Å; Y855-E876 PolarHBondContact OH-OE1 2.84Å; R872-E876 IonicContact CZ-OE1 3.39Å; R872-E876 IonicContact NE-OE1 2.69Å; R872-E876 PolarHBondContact NE-OE1 3.03Å; R872-E876 IonicContact NH2-OE1 3.63Å; R872-E876 PolarHBondContact NH2-OE1 3.4Å; R872-E876 PolarHBondContact O-N 3.45Å; E873-E876 PolarHBondContact O-N 3.32Å; E873-E876 VanDerWaalsContact O-N 3.11Å; E876-L879 PolarHBondContact O-N 3.06Å; E876-N880 WeakPolarHBondContact O-CB 3.19Å; E876-N880 PolarHBondContact O-N 2.93Å; E876-N880 PolarHBondContact O-ND2 3.37Å; E876-W890 HydrophobicContact CG-CH2 4.25Å
877	D	82.9	Confident	80.9	Confident	63 Å²	63	82.7 Å²	82.7	34%	0.337	39%	0.393	S	S	.	.	H	α-helix	trans	-64.9	-40.4	172.2	-93.1	-25	0	0	0	113.5	R833 E873 F875 N880 F881	R833-D877 HydrophobicContact CG-CB 4.5Å; R833-D877 IonicContact CZ-OD1 3.58Å; R833-D877 PolarHBondContact NE-O 2.95Å; R833-D877 PolarHBondContact NH2-O 3.18Å; R833-D877 VanDerWaalsContact NH2-O 3.14Å; R833-D877 IonicContact NH2-OD1 3.98Å; E873-D877 PolarHBondContact O-N 2.89Å; F875-D877 VanDerWaalsContact C-N 3.31Å; F875-D877 PolarHBondContact O-N 3.07Å; D877-N880 PolarHBondContact O-N 3.33Å; D877-F881 PolarHBondContact O-N 3.38Å
878	G	85.2	Confident	81.5	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.9	-43.1	172.6	0	0	0	0	0	112.3	N874 F875 F881 L882	N874-G878 PolarHBondContact O-N 3.3Å; F875-G878 PolarHBondContact O-N 2.83Å; G878-F881 WeakPolarHBondContact O-CB 3.35Å; G878-F881 PolarHBondContact O-N 2.89Å; G878-L882 WeakPolarHBondContact O-CG 3.27Å; G878-L882 PolarHBondContact O-N 3.29Å
879	L	86.6	Confident	82.3	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-43	173.7	-71.9	176.1	0	0	0	112.2	I840 Y855 F875 E876 F881 L882 K883 W890 I895	I840-L879 HydrophobicContact CG2-CD2 4.08Å; Y855-L879 HydrophobicContact CD2-CD1 4.16Å; Y855-L879 HydrophobicContact CE2-CD1 4.13Å; F875-L879 HydrophobicContact CD1-CD1 3.99Å; F875-L879 HydrophobicContact CE1-CD1 3.57Å; F875-L879 HydrophobicContact CE1-CG 4.34Å; F875-L879 HydrophobicContact CZ-CD1 3.93Å; F875-L879 HydrophobicContact CZ-CG 4.32Å; F875-L879 WeakPolarHBondContact O-CG 3.18Å; F875-L879 PolarHBondContact O-N 3.18Å; E876-L879 PolarHBondContact O-N 3.06Å; L879-F881 VanDerWaalsContact C-N 3.29Å; L879-F881 PolarHBondContact O-N 3.33Å; L879-L882 PolarHBondContact O-N 3.32Å; L879-K883 WeakPolarHBondContact O-CB 3.25Å; L879-K883 PolarHBondContact O-N 2.95Å; L879-W890 HydrophobicContact CB-CE3 4.41Å; L879-W890 HydrophobicContact CD1-CD2 4.37Å; L879-W890 HydrophobicContact CD1-CG 4.43Å; L879-I895 HydrophobicContact CD1-CD1 4.04Å; L879-I895 HydrophobicContact CD2-CD1 3.94Å; L879-I895 HydrophobicContact CD2-CG1 4.4Å; L879-I895 HydrophobicContact CD2-CG2 4.39Å
880	N	85.2	Confident	82.8	Confident	52 Å²	52	59.4 Å²	59.4	28%	0.278	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-35.7	175.1	-80.1	-33.8	0	0	0	112.1	E876 D877 N884 W890	E876-N880 WeakPolarHBondContact O-CB 3.19Å; E876-N880 PolarHBondContact O-N 2.93Å; E876-N880 PolarHBondContact O-ND2 3.37Å; D877-N880 PolarHBondContact O-N 3.33Å; N880-N884 WeakPolarHBondContact O-CB 3.3Å; N880-N884 PolarHBondContact O-N 3.06Å; N880-N884 PolarHBondContact O-OD1 3.4Å; N880-W890 WeakPolarHBondContact OD1-CZ3 3.44Å
881	F	85.3	Confident	83.1	Confident	60 Å²	60	61.6 Å²	61.6	26%	0.263	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-47.9	173	-168.5	-94.7	0	0	0	111.3	R833 E834 A837 D877 G878 L879 K883 N884 T885	R833-F881 HydrophobicContact CG-CB 4.03Å; R833-F881 HydrophobicContact CG-CD2 4.23Å; R833-F881 HydrophobicContact CG-CG 4.31Å; E834-F881 HydrophobicContact CG-CE1 4.25Å; E834-F881 HydrophobicContact CG-CE2 4.19Å; E834-F881 HydrophobicContact CG-CZ 3.76Å; A837-F881 HydrophobicContact CB-CB 4.32Å; A837-F881 HydrophobicContact CB-CD1 3.57Å; A837-F881 HydrophobicContact CB-CE1 4.31Å; A837-F881 HydrophobicContact CB-CG 4.29Å; D877-F881 PolarHBondContact O-N 3.38Å; G878-F881 WeakPolarHBondContact O-CB 3.35Å; G878-F881 PolarHBondContact O-N 2.89Å; L879-F881 VanDerWaalsContact C-N 3.29Å; L879-F881 PolarHBondContact O-N 3.33Å; F881-K883 VanDerWaalsContact C-N 3.3Å; F881-K883 PolarHBondContact O-N 2.81Å; F881-N884 PolarHBondContact O-N 2.75Å; F881-T885 HydrophobicContact CD1-CG2 4.24Å; F881-T885 HydrophobicContact CE1-CG2 3.99Å; F881-T885 HydrophobicContact CZ-CG2 4.47Å; F881-T885 WeakPolarHBondContact O-CG2 3.48Å; F881-T885 PolarHBondContact O-N 2.6Å; F881-T885 PolarHBondContact O-OG1 3.49Å
882	L	85.3	Confident	83.2	Confident	4 Å²	4	61 Å²	61	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-37.5	178.4	-69.8	167	0	0	0	112.3	A837 I840 W841 G878 L879 T885 N886 K887 I888	A837-L882 HydrophobicContact CB-CD1 4.33Å; A837-L882 HydrophobicContact CB-CD2 4Å; A837-L882 HydrophobicContact CB-CG 3.87Å; I840-L882 HydrophobicContact CB-CD1 3.85Å; I840-L882 HydrophobicContact CG2-CD1 3.62Å; W841-L882 HydrophobicContact CB-CD2 4.22Å; W841-L882 HydrophobicContact CE3-CD2 4.44Å; G878-L882 WeakPolarHBondContact O-CG 3.27Å; G878-L882 PolarHBondContact O-N 3.29Å; L879-L882 PolarHBondContact O-N 3.32Å; L882-T885 WeakPolarHBondContact CA-OG1 3.37Å; L882-T885 CarbonylContact O-C 3.59Å; L882-T885 PolarHBondContact O-N 3.39Å; L882-T885 PolarHBondContact O-OG1 2.91Å; L882-N886 PolarHBondContact O-N 3.34Å; L882-K887 HydrophobicContact CD2-CB 4.44Å; L882-K887 HydrophobicContact CD2-CD 3.96Å; L882-K887 PolarHBondContact O-N 2.77Å; L882-I888 HydrophobicContact CB-CB 4.3Å; L882-I888 HydrophobicContact CB-CD1 3.76Å; L882-I888 HydrophobicContact CB-CG1 4.11Å; L882-I888 HydrophobicContact CD1-CD1 3.59Å; L882-I888 HydrophobicContact CG-CD1 4.19Å
883	K	86.7	Confident	83.3	Confident	86 Å²	86	59.6 Å²	59.6	37%	0.374	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-47.6	171.7	-174.7	174.8	-179.9	170.8	0	112.1	L879 F881 T885 N886 I888 W890	L879-K883 WeakPolarHBondContact O-CB 3.25Å; L879-K883 PolarHBondContact O-N 2.95Å; F881-K883 VanDerWaalsContact C-N 3.3Å; F881-K883 PolarHBondContact O-N 2.81Å; K883-T885 VanDerWaalsContact C-N 3.25Å; K883-T885 PolarHBondContact O-N 2.98Å; K883-N886 WeakPolarHBondContact O-CA 3.5Å; K883-N886 PolarHBondContact O-N 3.23Å; K883-I888 WeakPolarHBondContact CA-O 3.36Å; K883-W890 PolarHBondContact NZ-O 3.05Å
884	N	85.3	Confident	83.4	Confident	123 Å²	123	56.8 Å²	56.8	66%	0.658	32%	0.315	S	S	*	.	H	α-helix	trans	-63.4	-30.8	176.1	-70.5	-5.1	0	0	0	112.5	N880 F881 N886	N880-N884 WeakPolarHBondContact O-CB 3.3Å; N880-N884 PolarHBondContact O-N 3.06Å; N880-N884 PolarHBondContact O-OD1 3.4Å; F881-N884 PolarHBondContact O-N 2.75Å; N884-N886 PolarHBondContact O-N 3.18Å
885	T	86	Confident	83.7	Confident	64 Å²	64	53.6 Å²	53.6	39%	0.393	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	8	171.3	64.1	0	0	0	0	114.5	F881 L882 K883 K887	F881-T885 HydrophobicContact CD1-CG2 4.24Å; F881-T885 HydrophobicContact CE1-CG2 3.99Å; F881-T885 HydrophobicContact CZ-CG2 4.47Å; F881-T885 WeakPolarHBondContact O-CG2 3.48Å; F881-T885 PolarHBondContact O-N 2.6Å; F881-T885 PolarHBondContact O-OG1 3.49Å; L882-T885 WeakPolarHBondContact CA-OG1 3.37Å; L882-T885 CarbonylContact O-C 3.59Å; L882-T885 PolarHBondContact O-N 3.39Å; L882-T885 PolarHBondContact O-OG1 2.91Å; K883-T885 VanDerWaalsContact C-N 3.25Å; K883-T885 PolarHBondContact O-N 2.98Å; T885-K887 PolarHBondContact O-N 3.24Å; T885-K887 VanDerWaalsContact O-N 3.12Å
886	N	80.9	Confident	83.5	Confident	108 Å²	108	60.7 Å²	60.7	58%	0.578	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	17.5	-177.6	-72.1	-57.3	0	0	0	115.7	L882 K883 N884 R898	L882-N886 PolarHBondContact O-N 3.34Å; K883-N886 WeakPolarHBondContact O-CA 3.5Å; K883-N886 PolarHBondContact O-N 3.23Å; N884-N886 PolarHBondContact O-N 3.18Å; N886-R898 WeakPolarHBondContact O-CD 3.35Å
887	K	82.5	Confident	83.4	Confident	86 Å²	86	60.1 Å²	60.1	37%	0.374	32%	0.322	S	S	.	.	S	Bend	trans	-80.2	-25.2	179.8	-74.4	-172.2	174.7	-168.4	0	113.7	W841 L882 T885 R898	W841-K887 HydrophobicContact CD2-CD 4.05Å; W841-K887 HydrophobicContact CE3-CB 4.05Å; W841-K887 HydrophobicContact CE3-CD 3.9Å; W841-K887 HydrophobicContact CE3-CG 4.48Å; W841-K887 HydrophobicContact CH2-CB 4.27Å; W841-K887 HydrophobicContact CH2-CD 4.36Å; W841-K887 HydrophobicContact CH2-CG 4.43Å; W841-K887 HydrophobicContact CZ3-CB 3.66Å; W841-K887 HydrophobicContact CZ3-CD 4.07Å; W841-K887 HydrophobicContact CZ3-CG 4.2Å; L882-K887 HydrophobicContact CD2-CB 4.44Å; L882-K887 HydrophobicContact CD2-CD 3.96Å; L882-K887 PolarHBondContact O-N 2.77Å; T885-K887 PolarHBondContact O-N 3.24Å; T885-K887 VanDerWaalsContact O-N 3.12Å; K887-R898 PolarHBondContact O-N 2.85Å
888	I	85.1	Confident	83	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	136.2	-170.7	-63	-177.5	0	0	0	109.6	W841 L844 L882 K883 I895 R896	W841-I888 HydrophobicContact CE3-CD1 4.49Å; W841-I888 HydrophobicContact CE3-CG1 4.46Å; W841-I888 HydrophobicContact CZ3-CG1 4.28Å; L844-I888 HydrophobicContact CD1-CD1 3.27Å; L844-I888 HydrophobicContact CD1-CG1 4.29Å; L882-I888 HydrophobicContact CB-CB 4.3Å; L882-I888 HydrophobicContact CB-CD1 3.76Å; L882-I888 HydrophobicContact CB-CG1 4.11Å; L882-I888 HydrophobicContact CD1-CD1 3.59Å; L882-I888 HydrophobicContact CG-CD1 4.19Å; K883-I888 WeakPolarHBondContact CA-O 3.36Å; I888-I895 HydrophobicContact CD1-CG2 4.42Å; I888-I895 HydrophobicContact CG2-CG2 3.55Å; I888-R896 CarbonylContact C-O 3.57Å; I888-R896 WeakPolarHBondContact CA-O 3.34Å
889	D	83.6	Confident	82.9	Confident	59 Å²	59	68.8 Å²	68.8	32%	0.316	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	118.9	160.1	-77.1	-45.2	0	0	0	109.6	R896 R898	D889-R896 HydrophobicContact CB-CB 4.33Å; D889-R896 PolarHBondContact N-O 2.66Å; D889-R896 PolarHBondContact O-N 3.06Å; D889-R898 IonicContact OD1-CZ 2.69Å; D889-R898 IonicContact OD1-NE 4Å; D889-R898 IonicContact OD1-NH2 2.72Å; D889-R898 PolarHBondContact OD1-NH2 3.38Å; D889-R898 IonicContact OD2-CZ 3.54Å; D889-R898 VanDerWaalsContact OD2-CZ 3.24Å; D889-R898 IonicContact OD2-NE 2.64Å; D889-R898 PolarHBondContact OD2-NE 3.12Å; D889-R898 IonicContact OD2-NH2 3.74Å; D889-R898 PolarHBondContact OD2-NH2 2.66Å
890	W	78.5	Confident	82.7	Confident	49 Å²	49	72.4 Å²	72.4	19%	0.186	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.8	173.9	168	51.3	0	0	0	110.5	Y855 E876 L879 N880 K883 G892	Y855-W890 AromaticContact CD2-NE1 3.98Å; Y855-W890 HydrophobicContact CE2-CZ2 4.45Å; E876-W890 HydrophobicContact CG-CH2 4.25Å; L879-W890 HydrophobicContact CB-CE3 4.41Å; L879-W890 HydrophobicContact CD1-CD2 4.37Å; L879-W890 HydrophobicContact CD1-CG 4.43Å; N880-W890 WeakPolarHBondContact OD1-CZ3 3.44Å; K883-W890 PolarHBondContact NZ-O 3.05Å; W890-G892 PolarHBondContact NE1-O 2.65Å
891	A	79	Confident	82.5	Confident	68 Å²	68	73.6 Å²	73.6	56%	0.562	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	118.1	175.1	0	0	0	0	0	110.3	N893 T894	A891-N893 PolarHBondContact O-N 2.92Å; A891-T894 PolarHBondContact N-O 2.99Å; A891-T894 PolarHBondContact O-N 3.1Å; A891-T894 VanDerWaalsContact O-N 3.15Å; A891-T894 PolarHBondContact O-OG1 3.13Å
892	G	78.4	Confident	82.4	Confident	54 Å²	54	74.4 Å²	74.4	56%	0.557	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	-123.3	-179.7	0	0	0	0	0	112.6	W890	W890-G892 PolarHBondContact NE1-O 2.65Å
893	N	83.1	Confident	82.2	Confident	126 Å²	126	78.8 Å²	78.8	67%	0.674	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	1.5	-177.2	-69.8	-9.2	0	0	0	114.4	Y855 A891	Y855-N893 WeakPolarHBondContact CB-O 3.5Å; Y855-N893 PolarHBondContact N-O 2.88Å; A891-N893 PolarHBondContact O-N 2.92Å
894	T	82.6	Confident	81.9	Confident	81 Å²	81	78.3 Å²	78.3	50%	0.497	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.2	-177.5	54	0	0	0	0	112.8	F853 A891	F853-T894 WeakPolarHBondContact O-CA 3.47Å; A891-T894 PolarHBondContact N-O 2.99Å; A891-T894 PolarHBondContact O-N 3.1Å; A891-T894 VanDerWaalsContact O-N 3.15Å; A891-T894 PolarHBondContact O-OG1 3.13Å
895	I	85.1	Confident	81.6	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.5	179	-61.3	169.6	0	0	0	106.3	L844 F853 V858 F875 L879 I888	L844-I895 HydrophobicContact CD1-CG2 4.46Å; F853-I895 HydrophobicContact CB-CB 4.32Å; F853-I895 PolarHBondContact N-O 2.93Å; F853-I895 PolarHBondContact O-N 2.79Å; V858-I895 HydrophobicContact CB-CD1 4.29Å; V858-I895 HydrophobicContact CG2-CD1 4.21Å; F875-I895 HydrophobicContact CZ-CD1 4.34Å; L879-I895 HydrophobicContact CD1-CD1 4.04Å; L879-I895 HydrophobicContact CD2-CD1 3.94Å; L879-I895 HydrophobicContact CD2-CG1 4.4Å; L879-I895 HydrophobicContact CD2-CG2 4.39Å; I888-I895 HydrophobicContact CD1-CG2 4.42Å; I888-I895 HydrophobicContact CG2-CG2 3.55Å
896	R	81.6	Confident	81.3	Confident	149 Å²	149	75.9 Å²	75.9	56%	0.562	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.9	178.5	-176	178.7	-179.3	177.6	0.7	109.8	L851 T852 I888 D889	L851-R896 CarbonylContact O-C 3.58Å; L851-R896 WeakPolarHBondContact O-CA 3.08Å; T852-R896 HydrophobicContact CG2-CB 4.4Å; T852-R896 HydrophobicContact CG2-CG 4.21Å; I888-R896 CarbonylContact C-O 3.57Å; I888-R896 WeakPolarHBondContact CA-O 3.34Å; D889-R896 HydrophobicContact CB-CB 4.33Å; D889-R896 PolarHBondContact N-O 2.66Å; D889-R896 PolarHBondContact O-N 3.06Å
897	K	81.8	Confident	81.3	Confident	30 Å²	30	73.3 Å²	73.3	13%	0.13	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	135.6	170.7	-166.7	176.9	-174.7	177.6	0	109	W841 L844 L851	W841-K897 HydrophobicContact CH2-CD 4.46Å; W841-K897 VanDerWaalsContact CH2-CE 3.41Å; W841-K897 HydrophobicContact CH2-CG 4.26Å; W841-K897 HydrophobicContact CZ3-CG 4.17Å; L844-K897 PolarHBondContact O-NZ 2.95Å; L851-K897 PolarHBondContact O-N 3.14Å
898	R	74.8	Confident	81.2	Confident	176 Å²	176	72.1 Å²	72.1	66%	0.664	38%	0.378	S	S	*	.			trans	-90.6	0	169.3	-75.5	-167.9	177.7	173.7	6.7	111.3	N886 K887 D889	N886-R898 WeakPolarHBondContact O-CD 3.35Å; K887-R898 PolarHBondContact O-N 2.85Å; D889-R898 IonicContact OD1-CZ 2.69Å; D889-R898 IonicContact OD1-NE 4Å; D889-R898 IonicContact OD1-NH2 2.72Å; D889-R898 PolarHBondContact OD1-NH2 3.38Å; D889-R898 IonicContact OD2-CZ 3.54Å; D889-R898 VanDerWaalsContact OD2-CZ 3.24Å; D889-R898 IonicContact OD2-NE 2.64Å; D889-R898 PolarHBondContact OD2-NE 3.12Å; D889-R898 IonicContact OD2-NH2 3.74Å; D889-R898 PolarHBondContact OD2-NH2 2.66Å

Retrieved 898 of 898 residues in 1255.3 ms (Link to these results)

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