A0A087YH20_POEFO Loading...

Calpain 15

AlphaFold DB , UniProt , Accession A0A087YH20, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,204 aa.

						>A0A087YH20_POEFO|A0A087YH20
MGSSASSLAAETESDHGFGSTSYPSTPPVGWLRNSHSSPVWGTTFITRQHQQPVPHRERSHSHSPGSMAAAVRSSEWSCGRCTFLNAGAAPRCSICEAPRQKPDLNQILRLSSTEEQRWACPRCTLNNPQGSGACSVCGFGPSSATNTPPTTTIAVTANGLPSAPAEPPTPAVTPTVLLEPNGQQPVKEDVLRRSESNGEVSGHEGQNPGWACARCTLHNTPVALSCSACGGPRKLSLPKIPPEALVVPEVRTPVVGFPVHPAPSAPLVIDLTDESNTPTPSDPQESPQVSSQGLSSPYPTFPSLQNNPVPRSRREVPPPGRPQNQGTNSPSPTSPSTAVVPPQPGPQRPAKPKHAQPQEPLYPSKRLSILEEEDPQHHPLTPANPTWKCPSCSLPNAVSSAKCEGCRSSRAGADLIDLVGCETVRFTPASPSSPDFSTWACSKCTLRNPTGTPKCSACGSSKLHGFQEQQTPLARCCPHCGSASCSCPPSSTPSGHKARKQARVFPSAAGASSGSSASTLSGLQEKAGQWSCPACTLLNDVKAKNCAACHTAQQYLTLRKVVKPLKRRESMHVEARRRNDEGEAKELWENIVSFCRENSVNFVDDSFPPGPRSVGFPEGDSVQQRIKKWLRPHEINCSNFKDRGVKWSVFRTPRPSDILQGLLGNCWFLSALAVLAERPELVERVMITRTICPEGAYQVRLCKDGTWTTVLVDDMLPCDDYGYLLFSQAQRKQLWVALIEKALAKLHGSYFALQAGRAIEGLATLTGAPCDSLMLQVSSTNPREEPIDTDLIWAKMLSSKEAGFLMGASCGGGNMKVDDAVYESLGLRPRHAYSILDVRDVQGYRLLRLRNPWGRFSWNGSWSDEWPDWPQHLRHELMAHGSSEGVFWMEYTDFIKYFDSVDICKIHSDWQEVRLQGCFPSKASGPVTVTALTVLERTALEFALFQEGSRRSDTADSHLLDLCIMVFRASFGSGNKLTLGRLLAHSKRAVKKFVGCDVMLEPGEYAVVCCAFNHWQMNVSGTGAPPTPISSPTSGAARRPSHDFPGYILAIYSSRQVMVEQVEATPTTLADAIILLTENKGERHEGREGMTCYYLTHGWAGLIVVVENRHPKYYLHVSCDCTDSFNVVSTRGSLKTIDSVPPLHRQVLVVLSQLEGNAGFSITHRLAHRKAAQASLGDWTPTKATHSPHLTPDIDGLHRPRPL
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.1	Very low	26.7	Very low	235 Å²	235	128.3 Å²	128.3	100%	1.158	84%	0.837	S	S	*	*				0	156.5	0	-64.4	-174.2	-174.2	0	0	109
2	G	24.8	Very low	26.9	Very low	60 Å²	60	129.3 Å²	129.3	62%	0.619	84%	0.839	S	S	*	*			trans	159.2	56.4	178.5	0	0	0	0	0	114	S4	G2-S4 PolarHBondContact O-N 2.98Å; G2-S4 VanDerWaalsContact O-N 3.16Å
3	S	23.2	Very low	26.8	Very low	129 Å²	129	134.8 Å²	134.8	90%	0.902	85%	0.847	S	S	*	*			trans	-75.5	100.7	177.3	-56.6	0	0	0	0	110.2	A5	S3-A5 PolarHBondContact O-N 2.98Å
4	S	29.7	Very low	26.8	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	85%	0.846	S	S	*	*			trans	-75.3	100.8	-179.6	-57.8	0	0	0	0	111.9	G2	G2-S4 PolarHBondContact O-N 2.98Å; G2-S4 VanDerWaalsContact O-N 3.16Å
5	A	23.3	Very low	26.6	Very low	94 Å²	94	135.3 Å²	135.3	78%	0.777	85%	0.846	S	S	*	*			trans	-104.5	113.7	159	0	0	0	0	0	108.3	S3	S3-A5 PolarHBondContact O-N 2.98Å
6	S	28.4	Very low	26.7	Very low	120 Å²	120	139.1 Å²	139.1	84%	0.839	85%	0.849	S	S	*	*			trans	-114.8	97.3	178.4	-65.1	0	0	0	0	109.6
7	S	25	Very low	26.6	Very low	115 Å²	115	134.5 Å²	134.5	80%	0.804	84%	0.836	S	S	*	*			trans	-70.2	133.4	169.6	-54.6	0	0	0	0	110.2
8	L	27.6	Very low	26.5	Very low	172 Å²	172	139.5 Å²	139.5	90%	0.901	85%	0.845	S	S	*	*			trans	-176.3	115.8	133.2	-101.8	166.9	0	0	0	110.1
9	A	27.5	Very low	26.5	Very low	101 Å²	101	135.9 Å²	135.9	84%	0.835	84%	0.839	S	S	*	*			trans	-140	133.4	159.2	0	0	0	0	0	105.9
10	A	28.3	Very low	26.4	Very low	97 Å²	97	135.1 Å²	135.1	80%	0.802	84%	0.839	S	S	*	*			trans	-84.4	132.8	-173	0	0	0	0	0	112.1
11	E	27.8	Very low	26.4	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	84%	0.842	S	S	*	*			trans	29.4	104.5	146.8	-61.4	179.1	175.9	0	0	119.6
12	T	28.5	Very low	26.3	Very low	140 Å²	140	129.1 Å²	129.1	86%	0.859	82%	0.819	S	S	*	*			trans	-145.1	124.1	133.1	50.8	0	0	0	0	108.6
13	E	25.7	Very low	26.3	Very low	202 Å²	202	136.3 Å²	136.3	94%	0.944	83%	0.829	S	S	*	*			trans	-79.8	142.9	174.9	-64.6	-176.2	124.5	0	0	112
14	S	27.4	Very low	26.7	Very low	118 Å²	118	136.1 Å²	136.1	83%	0.825	83%	0.825	S	S	*	*			trans	-157.7	111.4	159.1	65.6	0	0	0	0	110.6
15	D	23.6	Very low	26.6	Very low	158 Å²	158	135.9 Å²	135.9	85%	0.845	82%	0.823	S	S	*	*			trans	-90.5	115.9	-172.4	-150.1	-0.1	0	0	0	111.5
16	H	28.8	Very low	26.9	Very low	196 Å²	196	138.1 Å²	138.1	91%	0.907	83%	0.828	S	S	*	*			trans	-149.7	129.2	167.4	-82.6	-23.6	0	0	0	110.7
17	G	24	Very low	27.1	Very low	61 Å²	61	137.5 Å²	137.5	63%	0.629	82%	0.82	S	S	*	*			trans	-120.8	-165	-172.8	0	0	0	0	0	115.5
18	F	25.6	Very low	27.3	Very low	225 Å²	225	138.2 Å²	138.2	99%	0.987	82%	0.823	S	S	*	*			trans	70.8	140.4	-172.6	-54	-83.9	0	0	0	115
19	G	26.2	Very low	27.5	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	82%	0.818	S	S	*	*			cis	-167.4	167.3	-3.3	0	0	0	0	0	111.8
20	S	24.7	Very low	27.4	Very low	120 Å²	120	134.5 Å²	134.5	84%	0.839	81%	0.809	S	S	*	*			trans	-98.8	138.7	-172.5	59.2	0	0	0	0	114.3
21	T	26.5	Very low	27.4	Very low	148 Å²	148	141.6 Å²	141.6	91%	0.908	82%	0.815	S	S	*	*			trans	-129.6	164.3	161.9	49.7	0	0	0	0	109.8
22	S	24.8	Very low	27.3	Very low	97 Å²	97	139.8 Å²	139.8	68%	0.678	81%	0.811	S	S	*	*			trans	-143.8	157.9	-151.6	54.6	0	0	0	0	116.6
23	Y	26.6	Very low	27.2	Very low	211 Å²	211	144.4 Å²	144.4	83%	0.827	81%	0.813	S	S	*	*			trans	69.5	161.2	169.8	-68.3	-70.1	0	0	0	117.2
24	P	31.6	Very low	27.2	Very low	125 Å²	125	142.3 Å²	142.3	81%	0.812	81%	0.808	S	S	*	*			cis	-117.7	177.8	5.5	41.5	-29.6	0	0	0	115.8
25	S	26	Very low	27.1	Very low	94 Å²	94	141.4 Å²	141.4	66%	0.657	80%	0.802	S	S	*	*			trans	-152.4	126.5	-176.3	59.2	0	0	0	0	113.6
26	T	29.5	Very low	27.3	Very low	141 Å²	141	143.3 Å²	143.3	87%	0.865	81%	0.805	S	S	*	*			trans	-177.8	161.7	166.6	21.3	0	0	0	0	109.8
27	P	32.7	Very low	27.2	Very low	106 Å²	106	139.1 Å²	139.1	69%	0.688	80%	0.798	S	S	*	*				-132.9	162.6	-56.6	35.2	-17.3	0	0	0	113.6
28	P	30.4	Very low	27.3	Very low	131 Å²	131	141.4 Å²	141.4	85%	0.851	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-85.1	148.1	169.2	34	-33.2	0	0	0	112.8
29	V	31.3	Very low	28.2	Very low	132 Å²	132	136.5 Å²	136.5	80%	0.8	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-90.7	128.6	-179.7	179.4	0	0	0	0	111.4
30	G	26.1	Very low	28.2	Very low	63 Å²	63	139.4 Å²	139.4	65%	0.649	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-96.5	155	174.2	0	0	0	0	0	113.6
31	W	28.1	Very low	28.3	Very low	245 Å²	245	145.4 Å²	145.4	93%	0.928	80%	0.802	S	S	*	*			trans	-115	142.3	173.9	-80.9	72.8	0	0	0	111.2
32	L	26.2	Very low	28.2	Very low	152 Å²	152	142 Å²	142	80%	0.796	80%	0.797	S	S	*	*			trans	-85.3	151.6	-163.3	-70.5	81.1	0	0	0	114.2
33	R	25.6	Very low	28.2	Very low	237 Å²	237	143 Å²	143	89%	0.894	80%	0.799	S	S	*	*			trans	-97.8	146.1	149.9	-74.3	-176.3	170.4	-150.7	-2.6	109.1
34	N	25.2	Very low	28.2	Very low	157 Å²	157	138.9 Å²	138.9	84%	0.84	80%	0.796	S	S	*	*			trans	-127.3	133	166.1	-101.7	-10.8	0	0	0	109.7
35	S	26	Very low	27.9	Very low	100 Å²	100	141.4 Å²	141.4	70%	0.699	80%	0.795	S	S	*	*			trans	-163	96.3	177.8	57.4	0	0	0	0	113.3
36	H	26.7	Very low	28	Very low	198 Å²	198	143.8 Å²	143.8	92%	0.917	80%	0.798	S	S	*	*			trans	-149.7	156.9	158.9	-77	-70.9	0	0	0	106.2
37	S	27.6	Very low	27.8	Very low	108 Å²	108	144 Å²	144	76%	0.755	80%	0.8	S	S	*	*			cis	-152.7	175.7	30.9	55.4	0	0	0	0	114.4
38	S	26.9	Very low	27.4	Very low	109 Å²	109	150.1 Å²	150.1	76%	0.762	81%	0.809	S	S	*	*			trans	-144.6	156.2	160.8	-54.1	0	0	0	0	107.9
39	P	43.7	Very low	27.2	Very low	121 Å²	121	153.2 Å²	153.2	79%	0.786	81%	0.812	S	S	*	*				-129.3	-154.9	100	16.6	7	0	0	0	109.8
40	V	26.3	Very low	26.9	Very low	132 Å²	132	154.2 Å²	154.2	80%	0.8	81%	0.808	S	S	*	*			cis	-145.3	168.3	13.8	-164.4	0	0	0	0	109.5
41	W	27	Very low	26.8	Very low	246 Å²	246	158.2 Å²	158.2	93%	0.932	81%	0.81	S	S	*	*			trans	-92.5	160.9	173.9	-82.1	31.2	0	0	0	113.9
42	G	24.3	Very low	26.7	Very low	78 Å²	78	154 Å²	154	80%	0.804	80%	0.8	S	S	*	*			trans	-173.7	126.1	163.1	0	0	0	0	0	112.8
43	T	25.2	Very low	27.2	Very low	118 Å²	118	151.8 Å²	151.8	72%	0.724	80%	0.795	S	S	*	*			trans	-122.1	142.9	-178.5	50	0	0	0	0	111.3
44	T	25.8	Very low	27.3	Very low	124 Å²	124	146.7 Å²	146.7	76%	0.761	79%	0.79	S	S	*	*				165.3	151.1	126.7	37	0	0	0	0	116.5
45	F	25.6	Very low	27.7	Very low	177 Å²	177	145.1 Å²	145.1	78%	0.776	79%	0.788	S	S	*	*			trans	34	112.7	152.2	-65.2	-66	0	0	0	125.5
46	I	27.3	Very low	27.7	Very low	144 Å²	144	149 Å²	149	74%	0.738	80%	0.795	S	S	*	*				27	128.6	120	-55.7	174.9	0	0	0	119.6
47	T	25	Very low	27.6	Very low	145 Å²	145	150.2 Å²	150.2	89%	0.89	79%	0.792	S	S	*	*			trans	-147.2	156.5	136.9	4.1	0	0	0	0	111.3
48	R	24.8	Very low	27.4	Very low	236 Å²	236	154.4 Å²	154.4	89%	0.891	80%	0.799	S	S	*	*			trans	-105.5	152.1	179.9	-74.5	172.9	163.5	174.4	-5.8	111
49	Q	25.9	Very low	27.3	Very low	195 Å²	195	160 Å²	160	91%	0.911	80%	0.803	S	S	*	*			trans	-154.8	158.5	135.4	-115.1	166.7	11.6	0	0	114
50	H	25.9	Very low	26.5	Very low	153 Å²	153	160 Å²	160	71%	0.708	81%	0.806	S	S	*	*			trans	-33.8	143.9	-173.7	-76.6	-30.4	0	0	0	119.9
51	Q	24.6	Very low	26.4	Very low	148 Å²	148	161.7 Å²	161.7	69%	0.692	81%	0.805	S	S	*	*				64.3	140.9	68.1	-67.9	-176.7	-20.6	0	0	112.6
52	Q	26.1	Very low	26.3	Very low	157 Å²	157	154.7 Å²	154.7	73%	0.734	79%	0.794	S	S	*	*			cis	-165	-170.7	4.8	-121.9	-172.4	10.2	0	0	107.8
53	P	34.8	Very low	26.4	Very low	104 Å²	104	159.3 Å²	159.3	68%	0.675	79%	0.794	S	S	*	*			cis	-126	-176.9	-38.9	37.7	-22.4	0	0	0	112.4
54	V	28.4	Very low	26.5	Very low	131 Å²	131	159.6 Å²	159.6	79%	0.794	80%	0.801	S	S	*	*			trans	-111.4	141.7	168.8	170.8	0	0	0	0	109.8
55	P	33.4	Very low	26.8	Very low	124 Å²	124	159.8 Å²	159.8	81%	0.805	80%	0.804	S	S	*	*			trans	-99.7	151.4	156.6	35.4	-29.6	0	0	0	112
56	H	25.8	Very low	26.8	Very low	182 Å²	182	154.6 Å²	154.6	84%	0.843	80%	0.801	S	S	*	*			trans	-99.7	141.9	-166.9	-117.2	-51.7	0	0	0	113.5
57	R	26	Very low	26.9	Very low	223 Å²	223	153.6 Å²	153.6	84%	0.842	81%	0.807	S	S	*	*			trans	55.9	115.4	130.7	-175	-165.5	-165.1	173.4	4.3	118.6
58	E	23.6	Very low	27.1	Very low	195 Å²	195	155.3 Å²	155.3	91%	0.911	81%	0.807	S	S	*	*			trans	-141.9	162.9	137.5	-136.3	165	-139.5	0	0	111.4
59	R	25	Very low	27.4	Very low	226 Å²	226	148.7 Å²	148.7	85%	0.853	80%	0.803	S	S	*	*			trans	-121	128.8	178.1	-88.7	-175.3	173.8	175.4	-3.4	109.2
60	S	24.8	Very low	27.6	Very low	121 Å²	121	144.1 Å²	144.1	85%	0.846	80%	0.798	S	S	*	*			trans	-135.8	152.3	161.2	53.5	0	0	0	0	109.7
61	H	25.6	Very low	27.8	Very low	169 Å²	169	142 Å²	142	78%	0.782	81%	0.807	S	S	*	*			trans	-100.6	171.1	-173.7	-80.6	-109.3	0	0	0	112
62	S	25	Very low	28.2	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	82%	0.815	S	S	*	*			trans	96.5	156.7	145.8	78.1	0	0	0	0	120.5
63	H	26.4	Very low	28.6	Very low	174 Å²	174	145.3 Å²	145.3	81%	0.806	82%	0.822	S	S	*	*			trans	69.7	95.3	169.5	-59.7	-62.4	0	0	0	120.4
64	S	27	Very low	29.5	Very low	124 Å²	124	146.5 Å²	146.5	87%	0.867	83%	0.833	S	S	*	*			trans	-82.2	140.1	155	-42.1	0	0	0	0	111.6
65	P	32.7	Very low	30.9	Very low	128 Å²	128	144 Å²	144	83%	0.831	82%	0.821	S	S	*	*			trans	-102.4	159.9	140.1	35.3	-28.6	0	0	0	109.4
66	G	25.7	Very low	32.9	Very low	68 Å²	68	143.3 Å²	143.3	70%	0.701	81%	0.807	S	S	*	*			cis	154.9	112	3	0	0	0	0	0	107.4
67	S	29.1	Very low	35.6	Very low	124 Å²	124	136 Å²	136	87%	0.867	77%	0.773	S	S	*	*			trans	-74	136.7	-169	-170.5	0	0	0	0	112.6
68	M	28.9	Very low	38	Very low	180 Å²	180	129.1 Å²	129.1	89%	0.887	76%	0.758	S	S	*	*			trans	-122.2	100.9	172	-78.4	-66.7	-71.1	0	0	110.1
69	A	29.9	Very low	40.7	Very low	98 Å²	98	120 Å²	120	81%	0.81	72%	0.716	S	S	*	*			trans	-87.2	130.9	168.9	0	0	0	0	0	110
70	A	30.3	Very low	42.6	Very low	99 Å²	99	113.1 Å²	113.1	82%	0.818	72%	0.715	S	S	*	*			trans	-106	144.2	174.2	0	0	0	0	0	110.8
71	A	31.2	Very low	44.4	Very low	108 Å²	108	117.4 Å²	117.4	89%	0.893	71%	0.713	S	S	*	*			trans	-76.9	143.6	-165.4	0	0	0	0	0	114.7
72	V	32.7	Very low	46.3	Very low	142 Å²	142	111.4 Å²	111.4	86%	0.861	69%	0.689	S	S	*	*			trans	-106.7	142.7	163.9	178.6	0	0	0	0	108.7
73	R	35.1	Very low	48.7	Very low	232 Å²	232	112.3 Å²	112.3	88%	0.875	69%	0.691	S	S	*	*			trans	-72.5	151	-172.9	-68.2	-179.4	175.7	178.7	-2.2	112.6	S75	R73-S75 VanDerWaalsContact C-N 3.34Å; R73-S75 PolarHBondContact O-N 3.24Å
74	S	53	Low	51	Low	130 Å²	130	108.4 Å²	108.4	91%	0.909	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	56.4	-162.6	60.4	0	0	0	0	115.1
75	S	58.7	Low	53.8	Low	79 Å²	79	107.4 Å²	107.4	55%	0.552	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	-9.1	179.3	56.8	0	0	0	0	115.3	R73 G88	R73-S75 VanDerWaalsContact C-N 3.34Å; R73-S75 PolarHBondContact O-N 3.24Å; S75-G88 VanDerWaalsContact O-CA 3.25Å; S75-G88 WeakPolarHBondContact O-CA 3.48Å; S75-G88 PolarHBondContact O-N 2.85Å
76	E	74.1	Confident	56.2	Low	109 Å²	109	101.4 Å²	101.4	51%	0.509	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-143.5	169	-175.8	-64.4	-173.6	169.4	0	0	112.3	L85 N86	E76-L85 HydrophobicContact CB-CD2 4.36Å; E76-N86 CarbonylContact C-O 3.46Å; E76-N86 WeakPolarHBondContact CA-O 3.4Å; E76-N86 WeakPolarHBondContact CB-O 3.43Å
77	W	82.2	Confident	59.1	Low	29 Å²	29	101.2 Å²	101.2	11%	0.11	61%	0.609	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-148	131.9	169.2	67.3	-78.8	0	0	0	112.3	C79 N86 A87 A90 C93 R100	W77-C79 HydrophobicContact CZ3-CB 4.27Å; W77-N86 HydrophobicContact CD2-CB 4.19Å; W77-N86 HydrophobicContact CG-CB 4.35Å; W77-N86 HydrophobicContact CZ2-CB 4.03Å; W77-N86 PolarHBondContact N-O 2.85Å; W77-N86 PolarHBondContact O-N 2.83Å; W77-N86 PolarHBondContact O-ND2 3.34Å; W77-A87 PolarHBondContact NE1-O 3.35Å; W77-A90 PolarHBondContact NE1-O 3.47Å; W77-C93 HydrophobicContact CH2-CB 4.05Å; W77-R100 VanDerWaalsContact CD1-NE 3.29Å; W77-R100 HydrophobicContact CD2-CB 4.2Å; W77-R100 HydrophobicContact CD2-CG 3.59Å; W77-R100 HydrophobicContact CE3-CB 4.31Å; W77-R100 HydrophobicContact CE3-CG 3.83Å; W77-R100 HydrophobicContact CG-CG 4.07Å; W77-R100 VanDerWaalsContact CG-NE 3.33Å; W77-R100 HydrophobicContact CH2-CB 3.73Å; W77-R100 HydrophobicContact CH2-CG 4.17Å; W77-R100 HydrophobicContact CZ2-CB 3.57Å; W77-R100 HydrophobicContact CZ2-CG 3.94Å; W77-R100 HydrophobicContact CZ3-CB 4.08Å; W77-R100 HydrophobicContact CZ3-CG 4.11Å
78	S	77.9	Confident	61.3	Low	77 Å²	77	96.4 Å²	96.4	54%	0.538	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.5	137.4	173.7	48.6	0	0	0	0	111.1	G80 T83 F84	S78-G80 PolarHBondContact O-N 3.4Å; S78-T83 WeakPolarHBondContact CB-O 3.25Å; S78-F84 WeakPolarHBondContact CA-O 3.27Å
79	C	78.9	Confident	63.5	Low	3 Å²	3	92.3 Å²	92.3	2%	0.02	57%	0.574	C	S	.	*			trans	-76	121.2	-179.6	-177.6	0	0	0	0	111.8	W77 R81 C82 T83 F84 C93	W77-C79 HydrophobicContact CZ3-CB 4.27Å; C79-R81 PolarHBondContact O-N 2.97Å; C79-R81 PolarHBondContact SG-N 2.7Å; C79-R81 VanDerWaalsContact SG-N 3.41Å; C79-C82 PolarHBondContact O-N 3Å; C79-T83 WeakPolarHBondContact O-CA 3.45Å; C79-T83 PolarHBondContact O-N 2.88Å; C79-F84 PolarHBondContact N-O 3.42Å; C79-C93 HydrophobicContact CB-CB 3.91Å; C79-C93 VanDerWaalsContact SG-CB 3.58Å
80	G	64.6	Low	65.7	Low	82 Å²	82	88.6 Å²	88.6	85%	0.845	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-9	175.5	0	0	0	0	0	116	S78	S78-G80 PolarHBondContact O-N 3.4Å
81	R	63.6	Low	67.9	Low	211 Å²	211	88.7 Å²	88.7	80%	0.796	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-28.1	175.8	-88.7	-173.3	165.2	-168.9	-2.5	115.4	C79 A98	C79-R81 PolarHBondContact O-N 2.97Å; C79-R81 PolarHBondContact SG-N 2.7Å; C79-R81 VanDerWaalsContact SG-N 3.41Å; R81-A98 HydrophobicContact CB-CB 4.01Å; R81-A98 HydrophobicContact CG-CB 4.22Å
82	C	65.9	Low	70.3	Confident	43 Å²	43	89.8 Å²	89.8	29%	0.291	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.2	17.8	-174.9	77.6	0	0	0	0	114.3	C79 F84 C96	C79-C82 PolarHBondContact O-N 3Å; C82-F84 PolarHBondContact O-N 3.45Å; C82-C96 HydrophobicContact CB-CB 4.21Å; C82-C96 PolarHBondContact SG-SG 2.89Å
83	T	73.9	Confident	72.7	Confident	118 Å²	118	83.2 Å²	83.2	72%	0.724	48%	0.477	S	S	*	.			trans	54.5	-19.7	179.8	60.4	0	0	0	0	118.4	S78 C79 L85	S78-T83 WeakPolarHBondContact CB-O 3.25Å; C79-T83 WeakPolarHBondContact O-CA 3.45Å; C79-T83 PolarHBondContact O-N 2.88Å; T83-L85 PolarHBondContact O-N 2.75Å
84	F	75.2	Confident	74.7	Confident	93 Å²	93	76.3 Å²	76.3	41%	0.408	46%	0.464	S	S	.	.			trans	-46.6	132.6	180	-175.4	-93.8	0	0	0	113.1	S78 C79 C82 N86 I95	S78-F84 WeakPolarHBondContact CA-O 3.27Å; C79-F84 PolarHBondContact N-O 3.42Å; C82-F84 PolarHBondContact O-N 3.45Å; F84-N86 WeakPolarHBondContact CD1-OD1 3.31Å; F84-N86 PolarHBondContact O-ND2 3.46Å; F84-I95 HydrophobicContact CB-CG1 4.15Å; F84-I95 HydrophobicContact CD1-CG1 3.65Å; F84-I95 HydrophobicContact CD2-CD1 4.29Å; F84-I95 HydrophobicContact CD2-CG1 3.54Å; F84-I95 HydrophobicContact CE1-CD1 4.48Å; F84-I95 HydrophobicContact CE1-CG1 3.83Å; F84-I95 HydrophobicContact CE2-CD1 4.03Å; F84-I95 HydrophobicContact CE2-CG1 3.72Å; F84-I95 HydrophobicContact CG-CB 4.35Å; F84-I95 HydrophobicContact CG-CG1 3.49Å; F84-I95 VanDerWaalsContact CG-CG1 3.49Å; F84-I95 HydrophobicContact CZ-CD1 4.13Å; F84-I95 HydrophobicContact CZ-CG1 3.87Å
85	L	86.1	Confident	75.6	Confident	102 Å²	102	75.5 Å²	75.5	53%	0.534	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	119.9	177.3	-77.1	162.1	0	0	0	110.5	E76 T83	E76-L85 HydrophobicContact CB-CD2 4.36Å; T83-L85 PolarHBondContact O-N 2.75Å
86	N	84.1	Confident	75.8	Confident	2 Å²	2	74 Å²	74	1%	0.011	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	148.5	-179	-49	-87.8	0	0	0	109.3	E76 W77 F84 A90 C93 S94	E76-N86 CarbonylContact C-O 3.46Å; E76-N86 WeakPolarHBondContact CA-O 3.4Å; E76-N86 WeakPolarHBondContact CB-O 3.43Å; W77-N86 HydrophobicContact CD2-CB 4.19Å; W77-N86 HydrophobicContact CG-CB 4.35Å; W77-N86 HydrophobicContact CZ2-CB 4.03Å; W77-N86 PolarHBondContact N-O 2.85Å; W77-N86 PolarHBondContact O-N 2.83Å; W77-N86 PolarHBondContact O-ND2 3.34Å; F84-N86 WeakPolarHBondContact CD1-OD1 3.31Å; F84-N86 PolarHBondContact O-ND2 3.46Å; N86-A90 HydrophobicContact CB-CB 4.38Å; N86-C93 WeakPolarHBondContact OD1-CA 3.31Å; N86-C93 PolarHBondContact OD1-SG 2.9Å; N86-S94 PolarHBondContact OD1-N 3.06Å
87	A	85.2	Confident	75.9	Confident	64 Å²	64	74.3 Å²	74.3	53%	0.529	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	142.2	173.5	0	0	0	0	0	111.5	W77 A89 A90	W77-A87 PolarHBondContact NE1-O 3.35Å; A87-A89 PolarHBondContact O-N 3.37Å; A87-A90 VanDerWaalsContact O-CB 3.31Å; A87-A90 WeakPolarHBondContact O-CB 3.21Å; A87-A90 PolarHBondContact O-N 2.85Å
88	G	75.7	Confident	75.4	Confident	23 Å²	23	73.2 Å²	73.2	24%	0.237	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-11.2	-171.2	0	0	0	0	0	115.9	S75 R100	S75-G88 VanDerWaalsContact O-CA 3.25Å; S75-G88 WeakPolarHBondContact O-CA 3.48Å; S75-G88 PolarHBondContact O-N 2.85Å; G88-R100 PolarHBondContact O-NH1 3.17Å; G88-R100 PolarHBondContact O-NH2 2.95Å
89	A	74.6	Confident	75.5	Confident	94 Å²	94	73.5 Å²	73.5	78%	0.777	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-12.1	172.9	0	0	0	0	0	113.9	A87 P91	A87-A89 PolarHBondContact O-N 3.37Å; A89-P91 WeakPolarHBondContact O-CD 3.16Å
90	A	77.1	Confident	75.6	Confident	20 Å²	20	78.5 Å²	78.5	17%	0.165	45%	0.454	C	S	.	.			trans	-70	122.2	-176.4	0	0	0	0	0	111.1	W77 N86 A87	W77-A90 PolarHBondContact NE1-O 3.47Å; N86-A90 HydrophobicContact CB-CB 4.38Å; A87-A90 VanDerWaalsContact O-CB 3.31Å; A87-A90 WeakPolarHBondContact O-CB 3.21Å; A87-A90 PolarHBondContact O-N 2.85Å
91	P	76.3	Confident	75.7	Confident	101 Å²	101	82.6 Å²	82.6	66%	0.656	45%	0.452	S	S	*	.	S	Bend	trans	-80.9	-16.6	-177.6	32.4	-36	0	0	0	113.3	A89 R100	A89-P91 WeakPolarHBondContact O-CD 3.16Å; P91-R100 PolarHBondContact O-N 2.85Å
92	R	82.2	Confident	75	Confident	131 Å²	131	81.7 Å²	81.7	49%	0.494	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-135.9	154.4	177.6	-60.2	-179.6	74.5	-157.4	-1.5	108.7	E97 A98	R92-E97 VanDerWaalsContact CZ-O 3.28Å; R92-E97 IonicContact CZ-OE2 3.12Å; R92-E97 PolarHBondContact NE-O 3.23Å; R92-E97 IonicContact NH1-OE2 2.86Å; R92-E97 PolarHBondContact NH1-OE2 2.8Å; R92-E97 PolarHBondContact NH2-O 3.12Å; R92-E97 IonicContact NH2-OE2 3.24Å; R92-E97 PolarHBondContact NH2-OE2 2.83Å; R92-A98 CarbonylContact C-O 3.57Å; R92-A98 VanDerWaalsContact CA-O 3.31Å; R92-A98 WeakPolarHBondContact CA-O 3.39Å
93	C	82.7	Confident	73.8	Confident	4 Å²	4	85.5 Å²	85.5	3%	0.027	48%	0.478	C	S	.	.			trans	-71.5	134.3	-179.3	172.7	0	0	0	0	112.1	W77 C79 N86 I95 E97 A98	W77-C93 HydrophobicContact CH2-CB 4.05Å; C79-C93 HydrophobicContact CB-CB 3.91Å; C79-C93 VanDerWaalsContact SG-CB 3.58Å; N86-C93 WeakPolarHBondContact OD1-CA 3.31Å; N86-C93 PolarHBondContact OD1-SG 2.9Å; C93-I95 PolarHBondContact O-N 2.87Å; C93-I95 VanDerWaalsContact O-N 3.11Å; C93-I95 PolarHBondContact SG-N 2.94Å; C93-E97 WeakPolarHBondContact O-CA 3.45Å; C93-E97 PolarHBondContact O-N 2.77Å; C93-A98 PolarHBondContact N-O 3.36Å
94	S	76.2	Confident	72	Confident	87 Å²	87	84.4 Å²	84.4	61%	0.608	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.2	-177.4	-49.5	0	0	0	0	115.1	N86	N86-S94 PolarHBondContact OD1-N 3.06Å
95	I	71.8	Confident	70.1	Confident	113 Å²	113	86.6 Å²	86.6	58%	0.579	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-38.4	-175.7	-60.4	-58.8	0	0	0	113.1	F84 C93	F84-I95 HydrophobicContact CB-CG1 4.15Å; F84-I95 HydrophobicContact CD1-CG1 3.65Å; F84-I95 HydrophobicContact CD2-CD1 4.29Å; F84-I95 HydrophobicContact CD2-CG1 3.54Å; F84-I95 HydrophobicContact CE1-CD1 4.48Å; F84-I95 HydrophobicContact CE1-CG1 3.83Å; F84-I95 HydrophobicContact CE2-CD1 4.03Å; F84-I95 HydrophobicContact CE2-CG1 3.72Å; F84-I95 HydrophobicContact CG-CB 4.35Å; F84-I95 HydrophobicContact CG-CG1 3.49Å; F84-I95 VanDerWaalsContact CG-CG1 3.49Å; F84-I95 HydrophobicContact CZ-CD1 4.13Å; F84-I95 HydrophobicContact CZ-CG1 3.87Å; C93-I95 PolarHBondContact O-N 2.87Å; C93-I95 VanDerWaalsContact O-N 3.11Å; C93-I95 PolarHBondContact SG-N 2.94Å
96	C	62.9	Low	67.7	Low	49 Å²	49	87 Å²	87	33%	0.331	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	5.5	-176.5	72.3	0	0	0	0	114.3	C82 A98	C82-C96 HydrophobicContact CB-CB 4.21Å; C82-C96 PolarHBondContact SG-SG 2.89Å; C96-A98 PolarHBondContact O-N 3.46Å; C96-A98 VanDerWaalsContact SG-CB 3.54Å
97	E	77.3	Confident	65.4	Low	114 Å²	114	94.3 Å²	94.3	53%	0.533	52%	0.519	S	S	.	.			trans	50.3	15.3	-175.2	-43.2	-170.9	178.3	0	0	116.9	R92 C93	R92-E97 VanDerWaalsContact CZ-O 3.28Å; R92-E97 IonicContact CZ-OE2 3.12Å; R92-E97 PolarHBondContact NE-O 3.23Å; R92-E97 IonicContact NH1-OE2 2.86Å; R92-E97 PolarHBondContact NH1-OE2 2.8Å; R92-E97 PolarHBondContact NH2-O 3.12Å; R92-E97 IonicContact NH2-OE2 3.24Å; R92-E97 PolarHBondContact NH2-OE2 2.83Å; C93-E97 WeakPolarHBondContact O-CA 3.45Å; C93-E97 PolarHBondContact O-N 2.77Å
98	A	71.6	Confident	63	Low	7 Å²	7	97.6 Å²	97.6	6%	0.058	53%	0.527	C	S	.	.			trans	-61.1	134	175.6	0	0	0	0	0	110.1	R81 R92 C93 C96	R81-A98 HydrophobicContact CB-CB 4.01Å; R81-A98 HydrophobicContact CG-CB 4.22Å; R92-A98 CarbonylContact C-O 3.57Å; R92-A98 VanDerWaalsContact CA-O 3.31Å; R92-A98 WeakPolarHBondContact CA-O 3.39Å; C93-A98 PolarHBondContact N-O 3.36Å; C96-A98 PolarHBondContact O-N 3.46Å; C96-A98 VanDerWaalsContact SG-CB 3.54Å
99	P	79.3	Confident	60.9	Low	82 Å²	82	103.8 Å²	103.8	53%	0.532	55%	0.553	S	S	.	*	B	Isolated β-bridge	trans	-64.8	149.5	179.7	28	-35	0	0	0	111.5	Q101	P99-Q101 PolarHBondContact O-N 2.86Å
100	R	81.6	Confident	58.9	Low	108 Å²	108	108.6 Å²	108.6	41%	0.408	55%	0.551	S	S	.	*			trans	-71.2	89.6	175.4	-172.8	179.8	-168.9	-165.4	11.2	110.7	W77 G88 P91 K102	W77-R100 VanDerWaalsContact CD1-NE 3.29Å; W77-R100 HydrophobicContact CD2-CB 4.2Å; W77-R100 HydrophobicContact CD2-CG 3.59Å; W77-R100 HydrophobicContact CE3-CB 4.31Å; W77-R100 HydrophobicContact CE3-CG 3.83Å; W77-R100 HydrophobicContact CG-CG 4.07Å; W77-R100 VanDerWaalsContact CG-NE 3.33Å; W77-R100 HydrophobicContact CH2-CB 3.73Å; W77-R100 HydrophobicContact CH2-CG 4.17Å; W77-R100 HydrophobicContact CZ2-CB 3.57Å; W77-R100 HydrophobicContact CZ2-CG 3.94Å; W77-R100 HydrophobicContact CZ3-CB 4.08Å; W77-R100 HydrophobicContact CZ3-CG 4.11Å; G88-R100 PolarHBondContact O-NH1 3.17Å; G88-R100 PolarHBondContact O-NH2 2.95Å; P91-R100 PolarHBondContact O-N 2.85Å; R100-K102 PolarHBondContact O-N 3.21Å
101	Q	67.3	Low	56.7	Low	168 Å²	168	115.9 Å²	115.9	79%	0.785	59%	0.587	S	S	*	*			trans	-65.8	126.5	169.5	-69.6	179.7	-32.1	0	0	109.8	P99	P99-Q101 PolarHBondContact O-N 2.86Å
102	K	48.9	Very low	54.7	Low	193 Å²	193	115.7 Å²	115.7	84%	0.839	59%	0.588	S	S	*	*			trans	-77.4	141.7	160	-69.6	-178.3	178.2	179.3	0	107.9	R100 D104	R100-K102 PolarHBondContact O-N 3.21Å; K102-D104 PolarHBondContact O-N 2.85Å
103	P	40.1	Very low	52.3	Low	123 Å²	123	114.6 Å²	114.6	80%	0.799	60%	0.601	S	S	*	*			trans	-71.9	107.7	172.8	29	-32.5	0	0	0	110
104	D	36.3	Very low	49.9	Very low	94 Å²	94	120.9 Å²	120.9	50%	0.503	64%	0.639	S	S	.	*			trans	-81.9	114.5	159.8	-176.6	-6.2	0	0	0	108.3	K102 N106 Q107	K102-D104 PolarHBondContact O-N 2.85Å; D104-N106 PolarHBondContact O-N 2.86Å; D104-N106 WeakPolarHBondContact OD1-CB 3.43Å; D104-N106 PolarHBondContact OD1-N 2.83Å; D104-N106 PolarHBondContact OD1-ND2 3.5Å; D104-Q107 PolarHBondContact O-N 2.84Å
105	L	34.8	Very low	48.3	Very low	139 Å²	139	125.9 Å²	125.9	73%	0.728	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-66.5	-19.7	-175.1	-151.3	69.4	0	0	0	112.5	Q107	L105-Q107 VanDerWaalsContact C-N 3.33Å; L105-Q107 PolarHBondContact O-N 3.23Å
106	N	36.8	Very low	47	Very low	110 Å²	110	127.2 Å²	127.2	59%	0.588	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-75.3	-18.5	-178.4	-62.2	-75.7	0	0	0	113.8	D104	D104-N106 PolarHBondContact O-N 2.86Å; D104-N106 WeakPolarHBondContact OD1-CB 3.43Å; D104-N106 PolarHBondContact OD1-N 2.83Å; D104-N106 PolarHBondContact OD1-ND2 3.5Å
107	Q	34.8	Very low	46.6	Very low	156 Å²	156	131.3 Å²	131.3	73%	0.729	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-85.3	-13.4	-174.7	-155.6	165.4	41.7	0	0	113.5	D104 L105	D104-Q107 PolarHBondContact O-N 2.84Å; L105-Q107 VanDerWaalsContact C-N 3.33Å; L105-Q107 PolarHBondContact O-N 3.23Å
108	I	34.9	Very low	46.6	Very low	134 Å²	134	132.7 Å²	132.7	69%	0.687	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-20.1	-178.8	-64	176.3	0	0	0	112.2
109	L	30.9	Very low	46.8	Very low	152 Å²	152	135.4 Å²	135.4	80%	0.796	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	18.6	-174.7	-70.5	173.7	0	0	0	115
110	R	34	Very low	46.7	Very low	195 Å²	195	134.3 Å²	134.3	74%	0.736	68%	0.678	S	S	*	*			trans	-127.6	8.4	179.3	-75.2	-159.9	178.5	103.3	-3.8	116.6	S112	R110-S112 VanDerWaalsContact C-N 3.27Å; R110-S112 PolarHBondContact O-N 2.94Å
111	L	30.4	Very low	46.3	Very low	173 Å²	173	129.2 Å²	129.2	91%	0.906	66%	0.659	S	S	*	*			trans	-93	53.3	173.2	-69.8	178.1	0	0	0	112.6
112	S	33.5	Very low	46.3	Very low	98 Å²	98	126 Å²	126	69%	0.685	65%	0.652	S	S	*	*	S	Bend	trans	-149	123.8	159.6	53.6	0	0	0	0	110.2	R110	R110-S112 VanDerWaalsContact C-N 3.27Å; R110-S112 PolarHBondContact O-N 2.94Å
113	S	32.5	Very low	47.2	Very low	108 Å²	108	126.1 Å²	126.1	76%	0.755	65%	0.647	S	S	*	*	S	Bend	trans	75.1	151.8	-179.3	77	0	0	0	0	118.6
114	T	32.7	Very low	49.1	Very low	135 Å²	135	122.4 Å²	122.4	83%	0.828	62%	0.623	S	S	*	*			trans	61.6	120.9	179.9	61.3	0	0	0	0	118.3
115	E	41.8	Very low	50.8	Low	193 Å²	193	123.6 Å²	123.6	90%	0.902	64%	0.635	S	S	*	*			trans	-81.2	122.8	167.3	-63.8	174.4	106.4	0	0	110.9	Q117	E115-Q117 PolarHBondContact O-N 3.15Å
116	E	45.1	Very low	52.7	Low	141 Å²	141	120.1 Å²	120.1	66%	0.659	62%	0.616	S	S	*	*			trans	-77.2	116	168.2	-68.4	-178.5	158.2	0	0	110.2	R118	E116-R118 PolarHBondContact O-N 2.97Å; E116-R118 IonicContact OE2-CZ 2.75Å; E116-R118 IonicContact OE2-NE 2.81Å; E116-R118 IonicContact OE2-NH2 3.74Å; E116-R118 PolarHBondContact OE2-NH2 2.83Å
117	Q	53.7	Low	54.6	Low	134 Å²	134	119.5 Å²	119.5	63%	0.626	61%	0.613	S	S	*	*			trans	-66.9	133.5	174.4	-67.4	-174.1	-1.1	0	0	111.4	E115 Q130	E115-Q117 PolarHBondContact O-N 3.15Å; Q117-Q130 VanDerWaalsContact CB-CD 3.47Å; Q117-Q130 HydrophobicContact CB-CG 4.19Å; Q117-Q130 WeakPolarHBondContact O-CG 3.38Å; Q117-Q130 PolarHBondContact O-N 2.8Å
118	R	78.6	Confident	56.7	Low	144 Å²	144	112.3 Å²	112.3	54%	0.543	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.6	147.4	-178	-61.4	-174.1	179.8	-169.2	-2.2	110.4	E116 N127 N128	E116-R118 PolarHBondContact O-N 2.97Å; E116-R118 IonicContact OE2-CZ 2.75Å; E116-R118 IonicContact OE2-NE 2.81Å; E116-R118 IonicContact OE2-NH2 3.74Å; E116-R118 PolarHBondContact OE2-NH2 2.83Å; R118-N127 HydrophobicContact CB-CB 4.35Å; R118-N128 CarbonylContact C-O 3.56Å; R118-N128 VanDerWaalsContact CA-O 3.28Å; R118-N128 WeakPolarHBondContact CA-O 3.31Å; R118-N128 WeakPolarHBondContact CB-O 3.18Å
119	W	75.4	Confident	58.9	Low	64 Å²	64	109 Å²	109	24%	0.242	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	131.8	-179.2	68.8	-84.6	0	0	0	111.6	C121 N127 N128 P129 S132 C135 F140	W119-C121 HydrophobicContact CZ3-CB 4.19Å; W119-N127 WeakPolarHBondContact O-CA 3.26Å; W119-N128 HydrophobicContact CD2-CB 4.39Å; W119-N128 HydrophobicContact CZ2-CB 4.1Å; W119-N128 PolarHBondContact N-O 2.8Å; W119-N128 PolarHBondContact O-N 3.15Å; W119-P129 PolarHBondContact NE1-O 2.98Å; W119-S132 WeakPolarHBondContact CZ2-O 3.35Å; W119-S132 PolarHBondContact NE1-O 3.4Å; W119-C135 HydrophobicContact CH2-CB 4.13Å; W119-F140 HydrophobicContact CZ3-CD1 4.48Å
120	A	76.6	Confident	60.4	Low	59 Å²	59	107.4 Å²	107.4	49%	0.488	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.5	127.8	175.8	0	0	0	0	0	110.3	N127	A120-N127 WeakPolarHBondContact CA-OD1 3.27Å; A120-N127 VanDerWaalsContact CB-OD1 3.31Å; A120-N127 WeakPolarHBondContact CB-OD1 3.39Å
121	C	72.6	Confident	61.8	Low	1 Å²	1	102.2 Å²	102.2	1%	0.007	56%	0.562	C	S	.	*			trans	-68.5	124.3	175.7	178.6	0	0	0	0	111.2	W119 R123 C124 T125 L126 C135	W119-C121 HydrophobicContact CZ3-CB 4.19Å; C121-R123 PolarHBondContact O-N 2.72Å; C121-R123 VanDerWaalsContact O-N 3.13Å; C121-C124 PolarHBondContact O-N 2.84Å; C121-T125 VanDerWaalsContact O-CA 3.24Å; C121-T125 WeakPolarHBondContact O-CA 3.43Å; C121-T125 PolarHBondContact O-N 3.2Å; C121-L126 PolarHBondContact N-O 2.89Å; C121-C135 HydrophobicContact CB-CB 3.8Å; C121-C135 WeakPolarHBondContact CB-SG 3.37Å; C121-C135 VanDerWaalsContact SG-CB 3.58Å
122	P	68.5	Low	63.6	Low	99 Å²	99	95.7 Å²	95.7	64%	0.643	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.3	-177.4	27.9	-35.6	0	0	0	113.9	F140	P122-F140 HydrophobicContact CG-CD1 4.03Å; P122-F140 HydrophobicContact CG-CE1 3.43Å; P122-F140 VanDerWaalsContact CG-CE1 3.43Å; P122-F140 HydrophobicContact CG-CZ 3.89Å
123	R	67.9	Low	65.2	Low	197 Å²	197	94.1 Å²	94.1	74%	0.743	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-30.8	176.2	-83.3	-168.6	164.8	-169.5	-5.6	115.1	C121 F140	C121-R123 PolarHBondContact O-N 2.72Å; C121-R123 VanDerWaalsContact O-N 3.13Å; R123-F140 HydrophobicContact CG-CD2 4.16Å; R123-F140 HydrophobicContact CG-CG 4.45Å
124	C	79.3	Confident	67.4	Low	44 Å²	44	91.2 Å²	91.2	30%	0.297	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.1	10.7	-173.2	74.4	0	0	0	0	114.8	C121 L126 C138	C121-C124 PolarHBondContact O-N 2.84Å; C124-L126 PolarHBondContact O-N 3.04Å; C124-C138 HydrophobicContact CB-CB 4.48Å
125	T	72.7	Confident	69.7	Low	120 Å²	120	84.9 Å²	84.9	74%	0.736	47%	0.474	S	S	*	.			trans	53.2	14.5	177.7	61.2	0	0	0	0	116.6	C121	C121-T125 VanDerWaalsContact O-CA 3.24Å; C121-T125 WeakPolarHBondContact O-CA 3.43Å; C121-T125 PolarHBondContact O-N 3.2Å
126	L	73.6	Confident	71.3	Confident	65 Å²	65	80.6 Å²	80.6	34%	0.34	47%	0.465	S	S	.	.			trans	-73.4	130.5	175	-175.3	72.7	0	0	0	110.1	C121 C124 N128 S136 V137	C121-L126 PolarHBondContact N-O 2.89Å; C124-L126 PolarHBondContact O-N 3.04Å; L126-N128 PolarHBondContact O-N 3.09Å; L126-N128 PolarHBondContact O-ND2 2.91Å; L126-S136 WeakPolarHBondContact CD2-OG 3.15Å; L126-V137 HydrophobicContact CD2-CB 3.97Å; L126-V137 HydrophobicContact CD2-CG2 3.59Å
127	N	77.8	Confident	72.5	Confident	98 Å²	98	79.2 Å²	79.2	52%	0.524	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	109.6	173.8	-76.2	4.6	0	0	0	110.8	R118 W119 A120	R118-N127 HydrophobicContact CB-CB 4.35Å; W119-N127 WeakPolarHBondContact O-CA 3.26Å; A120-N127 WeakPolarHBondContact CA-OD1 3.27Å; A120-N127 VanDerWaalsContact CB-OD1 3.31Å; A120-N127 WeakPolarHBondContact CB-OD1 3.39Å
128	N	78.4	Confident	73.3	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.021	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	148.7	176.4	-50.6	-85.5	0	0	0	109.9	R118 W119 L126 C135 S136	R118-N128 CarbonylContact C-O 3.56Å; R118-N128 VanDerWaalsContact CA-O 3.28Å; R118-N128 WeakPolarHBondContact CA-O 3.31Å; R118-N128 WeakPolarHBondContact CB-O 3.18Å; W119-N128 HydrophobicContact CD2-CB 4.39Å; W119-N128 HydrophobicContact CZ2-CB 4.1Å; W119-N128 PolarHBondContact N-O 2.8Å; W119-N128 PolarHBondContact O-N 3.15Å; L126-N128 PolarHBondContact O-N 3.09Å; L126-N128 PolarHBondContact O-ND2 2.91Å; N128-C135 PolarHBondContact ND2-SG 3.34Å; N128-C135 WeakPolarHBondContact OD1-CA 3.36Å; N128-C135 PolarHBondContact OD1-SG 2.9Å; N128-S136 PolarHBondContact OD1-N 2.81Å
129	P	80.3	Confident	72.9	Confident	64 Å²	64	71.2 Å²	71.2	42%	0.416	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	143.9	169.6	-24.4	33	0	0	0	112.6	W119 S132	W119-P129 PolarHBondContact NE1-O 2.98Å; P129-S132 WeakPolarHBondContact CD-OG 3.43Å; P129-S132 WeakPolarHBondContact O-CB 3.5Å; P129-S132 PolarHBondContact O-N 2.99Å; P129-S132 PolarHBondContact O-OG 2.9Å
130	Q	62.9	Low	72.8	Confident	120 Å²	120	71.2 Å²	71.2	56%	0.561	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	144.3	160.4	-82.5	-177.2	-4.1	0	0	110	Q117 S132	Q117-Q130 VanDerWaalsContact CB-CD 3.47Å; Q117-Q130 HydrophobicContact CB-CG 4.19Å; Q117-Q130 WeakPolarHBondContact O-CG 3.38Å; Q117-Q130 PolarHBondContact O-N 2.8Å; Q130-S132 VanDerWaalsContact C-N 3.29Å
131	G	63.7	Low	72.5	Confident	85 Å²	85	69.5 Å²	69.5	88%	0.876	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-13.9	-168.5	0	0	0	0	0	114.8	G133	G131-G133 PolarHBondContact O-N 2.93Å
132	S	67.4	Low	71.6	Confident	37 Å²	37	74.1 Å²	74.1	26%	0.259	48%	0.475	S	S	.	.			trans	-72.6	97.5	170.7	-48.7	0	0	0	0	109.9	W119 P129 Q130 A134	W119-S132 WeakPolarHBondContact CZ2-O 3.35Å; W119-S132 PolarHBondContact NE1-O 3.4Å; P129-S132 WeakPolarHBondContact CD-OG 3.43Å; P129-S132 WeakPolarHBondContact O-CB 3.5Å; P129-S132 PolarHBondContact O-N 2.99Å; P129-S132 PolarHBondContact O-OG 2.9Å; Q130-S132 VanDerWaalsContact C-N 3.29Å; S132-A134 PolarHBondContact O-N 3.17Å; S132-A134 VanDerWaalsContact O-N 3.1Å
133	G	67.6	Low	70.3	Confident	65 Å²	65	75 Å²	75	67%	0.67	48%	0.484	S	S	*	.	S	Bend	trans	-62.2	-15.3	-177.8	0	0	0	0	0	115.2	G131 G141	G131-G133 PolarHBondContact O-N 2.93Å; G133-G141 WeakPolarHBondContact O-CA 3.47Å
134	A	78.8	Confident	68.8	Low	46 Å²	46	71.7 Å²	71.7	38%	0.38	49%	0.491	S	S	.	.	S	Bend	trans	-145.5	155.7	169.5	0	0	0	0	0	111.1	S132 F140	S132-A134 PolarHBondContact O-N 3.17Å; S132-A134 VanDerWaalsContact O-N 3.1Å; A134-F140 CarbonylContact C-O 3.55Å; A134-F140 WeakPolarHBondContact CA-O 3.47Å
135	C	80.4	Confident	66.4	Low	2 Å²	2	74 Å²	74	1%	0.014	51%	0.513	C	S	.	.			trans	-72	125.6	175.1	176	0	0	0	0	111.6	W119 C121 N128 V137 C138 G139 F140	W119-C135 HydrophobicContact CH2-CB 4.13Å; C121-C135 HydrophobicContact CB-CB 3.8Å; C121-C135 WeakPolarHBondContact CB-SG 3.37Å; C121-C135 VanDerWaalsContact SG-CB 3.58Å; N128-C135 PolarHBondContact ND2-SG 3.34Å; N128-C135 WeakPolarHBondContact OD1-CA 3.36Å; N128-C135 PolarHBondContact OD1-SG 2.9Å; C135-V137 VanDerWaalsContact C-N 3.26Å; C135-V137 PolarHBondContact O-N 2.89Å; C135-V137 VanDerWaalsContact O-N 3.11Å; C135-C138 PolarHBondContact O-N 3.27Å; C135-C138 VanDerWaalsContact SG-SG 3.68Å; C135-G139 WeakPolarHBondContact O-CA 3.35Å; C135-G139 PolarHBondContact O-N 2.9Å; C135-F140 HydrophobicContact CB-CB 4.44Å; C135-F140 PolarHBondContact N-O 2.8Å
136	S	76.8	Confident	64.5	Low	103 Å²	103	74.9 Å²	74.9	72%	0.72	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-20.8	-169.6	58.1	0	0	0	0	115.9	L126 N128	L126-S136 WeakPolarHBondContact CD2-OG 3.15Å; N128-S136 PolarHBondContact OD1-N 2.81Å
137	V	69.1	Low	62.4	Low	112 Å²	112	79.5 Å²	79.5	68%	0.679	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-26.1	-179.1	168	0	0	0	0	114.1	L126 C135	L126-V137 HydrophobicContact CD2-CB 3.97Å; L126-V137 HydrophobicContact CD2-CG2 3.59Å; C135-V137 VanDerWaalsContact C-N 3.26Å; C135-V137 PolarHBondContact O-N 2.89Å; C135-V137 VanDerWaalsContact O-N 3.11Å
138	C	71.1	Confident	60.2	Low	50 Å²	50	81.1 Å²	81.1	34%	0.338	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.8	5.3	-173.9	69.8	0	0	0	0	114.9	C124 C135 F140	C124-C138 HydrophobicContact CB-CB 4.48Å; C135-C138 PolarHBondContact O-N 3.27Å; C135-C138 VanDerWaalsContact SG-SG 3.68Å; C138-F140 PolarHBondContact O-N 3.37Å
139	G	69.6	Low	58.2	Low	60 Å²	60	86.8 Å²	86.8	62%	0.619	59%	0.594	S	S	*	*			trans	67	2.2	178.2	0	0	0	0	0	115.3	C135 G141	C135-G139 WeakPolarHBondContact O-CA 3.35Å; C135-G139 PolarHBondContact O-N 2.9Å; G139-G141 PolarHBondContact O-N 3.4Å
140	F	73.7	Confident	56.7	Low	65 Å²	65	89 Å²	89	29%	0.285	61%	0.609	S	S	.	*			trans	-69.7	104.3	-177.5	-178.2	-94.3	0	0	0	111	W119 P122 R123 A134 C135 C138	W119-F140 HydrophobicContact CZ3-CD1 4.48Å; P122-F140 HydrophobicContact CG-CD1 4.03Å; P122-F140 HydrophobicContact CG-CE1 3.43Å; P122-F140 VanDerWaalsContact CG-CE1 3.43Å; P122-F140 HydrophobicContact CG-CZ 3.89Å; R123-F140 HydrophobicContact CG-CD2 4.16Å; R123-F140 HydrophobicContact CG-CG 4.45Å; A134-F140 CarbonylContact C-O 3.55Å; A134-F140 WeakPolarHBondContact CA-O 3.47Å; C135-F140 HydrophobicContact CB-CB 4.44Å; C135-F140 PolarHBondContact N-O 2.8Å; C138-F140 PolarHBondContact O-N 3.37Å
141	G	70.5	Confident	55	Low	22 Å²	22	89.5 Å²	89.5	23%	0.227	62%	0.621	C	S	.	*			trans	-114.6	141.8	167.6	0	0	0	0	0	110.8	G133 G139 S143	G133-G141 WeakPolarHBondContact O-CA 3.47Å; G139-G141 PolarHBondContact O-N 3.4Å; G141-S143 PolarHBondContact O-N 3.21Å
142	P	53.7	Low	53.3	Low	98 Å²	98	91.2 Å²	91.2	64%	0.636	61%	0.614	S	S	*	*			trans	-73.7	105.3	177.4	29.6	-32.9	0	0	0	110.7	S144	P142-S144 PolarHBondContact O-N 2.84Å
143	S	40.5	Very low	51.4	Low	119 Å²	119	95.2 Å²	95.2	83%	0.832	64%	0.637	S	S	*	*			trans	-66.3	125.5	170.7	-57	0	0	0	0	110.5	G141 A145	G141-S143 PolarHBondContact O-N 3.21Å; S143-A145 PolarHBondContact O-N 3.46Å
144	S	37.4	Very low	49.6	Very low	126 Å²	126	100 Å²	100	88%	0.881	65%	0.645	S	S	*	*			trans	-77.1	109.2	-175.2	55.4	0	0	0	0	112.6	P142	P142-S144 PolarHBondContact O-N 2.84Å
145	A	29.2	Very low	47.2	Very low	93 Å²	93	101.9 Å²	101.9	77%	0.769	66%	0.661	S	S	*	*			trans	-148.9	90.9	166.7	0	0	0	0	0	110.7	S143	S143-A145 PolarHBondContact O-N 3.46Å
146	T	33.1	Very low	44.7	Very low	139 Å²	139	108.6 Å²	108.6	85%	0.853	70%	0.702	S	S	*	*			trans	-77.1	137.6	168.2	42.7	0	0	0	0	110.7
147	N	28.4	Very low	42.4	Very low	162 Å²	162	109.9 Å²	109.9	87%	0.866	71%	0.706	S	S	*	*			trans	-135.8	120.7	166.8	-93.9	-32.2	0	0	0	110.5
148	T	32	Very low	40.4	Very low	131 Å²	131	108.4 Å²	108.4	80%	0.804	71%	0.705	S	S	*	*			trans	-134.4	154.7	162.6	28.4	0	0	0	0	108.4
149	P	37	Very low	38.5	Very low	123 Å²	123	114 Å²	114	80%	0.799	73%	0.732	S	S	*	*			trans	-73	167.8	-161.2	27.3	-34.9	0	0	0	115.5
150	P	48.4	Very low	36.5	Very low	112 Å²	112	114.6 Å²	114.6	73%	0.727	74%	0.738	S	S	*	*			trans	-102.3	178	-148.3	39.6	-38.8	0	0	0	116.9
151	T	27.2	Very low	34.2	Very low	130 Å²	130	119.7 Å²	119.7	80%	0.798	77%	0.767	S	S	*	*			trans	71.8	141.6	170.4	13.3	0	0	0	0	114.9
152	T	28.1	Very low	33	Very low	120 Å²	120	124.1 Å²	124.1	74%	0.736	79%	0.792	S	S	*	*			cis	-140.9	146.7	22.8	35.6	0	0	0	0	115.9
153	T	27.9	Very low	31.7	Very low	121 Å²	121	124.4 Å²	124.4	74%	0.742	80%	0.796	S	S	*	*			trans	29	119.3	136.9	-26.4	0	0	0	0	121.6
154	I	28.7	Very low	31.1	Very low	165 Å²	165	123.1 Å²	123.1	85%	0.846	79%	0.793	S	S	*	*				-179.6	155	111.2	-91.6	168.6	0	0	0	109.3
155	A	28.5	Very low	31.6	Very low	87 Å²	87	123.2 Å²	123.2	72%	0.719	79%	0.79	S	S	*	*			trans	-98.7	165.5	-172	0	0	0	0	0	114.2
156	V	28.3	Very low	31.6	Very low	142 Å²	142	123 Å²	123	86%	0.861	79%	0.789	S	S	*	*			trans	-171	160.5	132.8	139.4	0	0	0	0	111
157	T	27.2	Very low	31.5	Very low	131 Å²	131	125.2 Å²	125.2	80%	0.804	79%	0.79	S	S	*	*			trans	-67.6	172.2	-177.5	58.1	0	0	0	0	114.1
158	A	28.5	Very low	33.1	Very low	80 Å²	80	122.7 Å²	122.7	66%	0.661	78%	0.782	S	S	*	*			cis	-159.5	167.8	18.9	0	0	0	0	0	114.2
159	N	30.6	Very low	34.3	Very low	168 Å²	168	122 Å²	122	90%	0.898	78%	0.78	S	S	*	*			trans	13.9	145.2	143	-50.4	-13.2	0	0	0	121.5
160	G	27.3	Very low	34.1	Very low	73 Å²	73	122.4 Å²	122.4	75%	0.753	78%	0.78	S	S	*	*			cis	173.8	-172	2.4	0	0	0	0	0	117.2
161	L	26.4	Very low	34.5	Very low	171 Å²	171	123 Å²	123	90%	0.895	78%	0.784	S	S	*	*			trans	-79	-172.4	-179.3	-97	63.1	0	0	0	114.3
162	P	44.1	Very low	34.7	Very low	116 Å²	116	120.9 Å²	120.9	75%	0.753	78%	0.78	S	S	*	*			cis	-119.9	-149.8	-2.3	26.2	0.1	0	0	0	112.3
163	S	26	Very low	34.8	Very low	103 Å²	103	121.5 Å²	121.5	72%	0.72	78%	0.783	S	S	*	*			cis	-154.6	170.5	10.4	-43.7	0	0	0	0	109.1
164	A	28.4	Very low	35	Very low	93 Å²	93	121.5 Å²	121.5	77%	0.769	78%	0.783	S	S	*	*			cis	80.3	146.3	16.5	0	0	0	0	0	117
165	P	49.2	Very low	36.2	Very low	127 Å²	127	119.5 Å²	119.5	83%	0.825	78%	0.781	S	S	*	*			cis	-143.5	-173.7	-4.1	42.7	-22.9	0	0	0	118.7
166	A	28.1	Very low	36.5	Very low	90 Å²	90	120.4 Å²	120.4	74%	0.744	78%	0.778	S	S	*	*			trans	92.6	96.1	144	0	0	0	0	0	124.6
167	E	31.6	Very low	36.7	Very low	185 Å²	185	119.9 Å²	119.9	86%	0.864	78%	0.775	S	S	*	*				37.9	161.3	115.2	-79.1	-162.8	142.3	0	0	126.2
168	P	62.5	Low	36.9	Very low	108 Å²	108	120.8 Å²	120.8	70%	0.701	77%	0.774	S	S	*	*			cis	-119.7	-112.9	-15.1	35.6	-15.1	0	0	0	110.7
169	P	56.9	Low	36.8	Very low	117 Å²	117	123.9 Å²	123.9	76%	0.76	78%	0.778	S	S	*	*			cis	-115	-150.9	-9.7	44.7	-29.5	0	0	0	114.1
170	T	31.4	Very low	36.9	Very low	132 Å²	132	124 Å²	124	81%	0.81	77%	0.773	S	S	*	*			trans	-150.1	-170.8	-170.8	52.4	0	0	0	0	111.3
171	P	56.8	Low	38.3	Very low	123 Å²	123	124.8 Å²	124.8	80%	0.799	77%	0.765	S	S	*	*			cis	-122.9	-158.5	-7.1	45.7	-29.7	0	0	0	111.7
172	A	32.7	Very low	38.4	Very low	87 Å²	87	124.4 Å²	124.4	72%	0.719	76%	0.764	S	S	*	*			cis	-149.7	-163.1	2.9	0	0	0	0	0	107.8
173	V	30	Very low	37.6	Very low	133 Å²	133	122.1 Å²	122.1	81%	0.806	76%	0.762	S	S	*	*			cis	-150.9	160.9	8.3	-168.7	0	0	0	0	107.9
174	T	31.3	Very low	37.7	Very low	120 Å²	120	127.1 Å²	127.1	74%	0.736	77%	0.774	S	S	*	*			trans	-149.3	160.9	173.5	1.2	0	0	0	0	111.9
175	P	53.9	Low	37.5	Very low	123 Å²	123	131.4 Å²	131.4	80%	0.799	78%	0.778	S	S	*	*				-149.4	-175.2	93.2	35.5	-15.6	0	0	0	116.2
176	T	34.4	Very low	37.3	Very low	107 Å²	107	129.8 Å²	129.8	66%	0.656	77%	0.767	S	S	*	*				-177.5	111.4	-53.2	-85.3	0	0	0	0	111.5
177	V	34.1	Very low	37.2	Very low	131 Å²	131	131.7 Å²	131.7	79%	0.794	77%	0.769	S	S	*	*			trans	66.5	164.2	143.3	175.2	0	0	0	0	117.2
178	L	30.5	Very low	37	Very low	150 Å²	150	131.2 Å²	131.2	79%	0.785	76%	0.764	S	S	*	*			cis	-122.2	-138.8	5.4	-129	159.7	0	0	0	108.9
179	L	26.8	Very low	35.3	Very low	145 Å²	145	133.1 Å²	133.1	76%	0.759	76%	0.764	S	S	*	*			cis	-153.4	172.8	1.7	-134.8	-175.2	0	0	0	110.5
180	E	32.7	Very low	34	Very low	169 Å²	169	134.3 Å²	134.3	79%	0.79	76%	0.764	S	S	*	*			trans	-137.4	-145.6	176.9	-54.8	-173.2	107.4	0	0	109.5
181	P	56.1	Low	33.8	Very low	91 Å²	91	133.2 Å²	133.2	59%	0.591	76%	0.757	S	S	*	*			cis	-138.9	-168	-22.6	32	-8.1	0	0	0	115.8
182	N	30	Very low	32.4	Very low	163 Å²	163	134.2 Å²	134.2	87%	0.872	76%	0.755	S	S	*	*			trans	80.7	146.5	157.9	-62.6	-30.4	0	0	0	120.5
183	G	27.3	Very low	32.1	Very low	68 Å²	68	140.6 Å²	140.6	70%	0.701	76%	0.76	S	S	*	*			cis	166	-175	-10	0	0	0	0	0	116.5
184	Q	27.6	Very low	32	Very low	208 Å²	208	145.5 Å²	145.5	97%	0.972	76%	0.764	S	S	*	*			trans	86.1	172.1	162.5	-60.8	-173.6	-11	0	0	121.5
185	Q	23.8	Very low	31.7	Very low	183 Å²	183	144.1 Å²	144.1	86%	0.855	76%	0.76	S	S	*	*			trans	-154.3	-165.2	-147.1	-130.5	-172.5	1.6	0	0	108.5
186	P	44.1	Very low	30.8	Very low	93 Å²	93	147.1 Å²	147.1	60%	0.604	76%	0.763	S	S	*	*			cis	-139.3	-165.8	-18.9	27.4	-0.7	0	0	0	115
187	V	27.2	Very low	30.4	Very low	129 Å²	129	147.9 Å²	147.9	78%	0.782	77%	0.772	S	S	*	*			trans	63.6	154.9	157.4	-89.5	0	0	0	0	121.2
188	K	26.6	Very low	30.3	Very low	175 Å²	175	150 Å²	150	76%	0.761	78%	0.779	S	S	*	*			cis	-147.1	-179	2.9	-152.9	151.5	177.2	-178.6	0	113.9
189	E	28.4	Very low	30.1	Very low	148 Å²	148	146.7 Å²	146.7	69%	0.692	78%	0.781	S	S	*	*			trans	-62.2	177.6	175.9	-55.1	130.3	129.6	0	0	114.2
190	D	27.6	Very low	30.2	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	79%	0.786	S	S	*	*			cis	-168.6	176.8	25.2	-149.3	-10.3	0	0	0	116
191	V	27.9	Very low	30.1	Very low	108 Å²	108	146.9 Å²	146.9	66%	0.655	79%	0.787	S	S	*	*			trans	72.1	109.6	148	162.3	0	0	0	0	124.2
192	L	27.3	Very low	28.6	Very low	145 Å²	145	148.5 Å²	148.5	76%	0.759	80%	0.801	S	S	*	*			trans	44.4	131.5	134.4	-60.4	167.6	0	0	0	126.9
193	R	27	Very low	28.6	Very low	220 Å²	220	144.1 Å²	144.1	83%	0.83	79%	0.794	S	S	*	*			trans	81.2	107.5	132.8	-81.3	-175.9	175.3	-162.6	0.7	124
194	R	26.7	Very low	28.6	Very low	237 Å²	237	149.3 Å²	149.3	89%	0.894	80%	0.8	S	S	*	*				66.5	139.4	124.6	-109.6	-170.5	-171.4	-174.4	1.8	123.2
195	S	26.1	Very low	28.8	Very low	91 Å²	91	147.2 Å²	147.2	64%	0.636	79%	0.79	S	S	*	*			trans	85	97.5	151.2	-68	0	0	0	0	120.9
196	E	34.7	Very low	29.1	Very low	186 Å²	186	142.1 Å²	142.1	87%	0.869	79%	0.787	S	S	*	*				33.4	117.4	129.2	-61.7	170.4	119.1	0	0	121.1
197	S	26.8	Very low	28.8	Very low	122 Å²	122	146.8 Å²	146.8	85%	0.853	80%	0.8	S	S	*	*			trans	-165.5	161.6	135.4	36.2	0	0	0	0	110.6
198	N	30.9	Very low	29.4	Very low	176 Å²	176	146.8 Å²	146.8	94%	0.941	80%	0.796	S	S	*	*			trans	-91	145.1	-177	-66.9	-40.3	0	0	0	112
199	G	27.6	Very low	30.7	Very low	80 Å²	80	143.1 Å²	143.1	83%	0.825	79%	0.79	S	S	*	*			trans	-164.5	127.8	176.7	0	0	0	0	0	113.5
200	E	27.1	Very low	32.5	Very low	186 Å²	186	137.9 Å²	137.9	87%	0.869	78%	0.776	S	S	*	*			trans	-60.4	147.3	-160.9	-69.2	-179.9	103.3	0	0	121.2
201	V	31.6	Very low	35.2	Very low	132 Å²	132	132.2 Å²	132.2	80%	0.8	74%	0.743	S	S	*	*			trans	52.6	112.2	131.6	-175.4	0	0	0	0	120.9
202	S	25.4	Very low	37.7	Very low	126 Å²	126	129.6 Å²	129.6	88%	0.881	73%	0.733	S	S	*	*				-160.8	159.6	122.7	47.9	0	0	0	0	109.5
203	G	28.2	Very low	39.8	Very low	71 Å²	71	122.8 Å²	122.8	73%	0.732	70%	0.698	S	S	*	*			trans	-140.1	160.1	-171.4	0	0	0	0	0	114.6
204	H	28.9	Very low	41.9	Very low	177 Å²	177	116.8 Å²	116.8	82%	0.819	70%	0.695	S	S	*	*			trans	-143.9	166.9	167.4	-113.5	-77.5	0	0	0	111.3
205	E	30.6	Very low	43.9	Very low	164 Å²	164	113.9 Å²	113.9	77%	0.766	69%	0.685	S	S	*	*			trans	-64.4	140.7	-156.4	-62	120.9	115.4	0	0	116.2	Q207	E205-Q207 PolarHBondContact O-N 2.83Å
206	G	30.1	Very low	46.3	Very low	76 Å²	76	112 Å²	112	78%	0.784	67%	0.67	S	S	*	*			trans	-79.1	114.9	-175.1	0	0	0	0	0	114.4	N208	G206-N208 PolarHBondContact O-N 2.89Å
207	Q	37.3	Very low	48.2	Very low	190 Å²	190	108.4 Å²	108.4	89%	0.888	66%	0.662	S	S	*	*			trans	-71	117.5	155.3	-65.3	-174.5	8.6	0	0	108.8	E205 P209	E205-Q207 PolarHBondContact O-N 2.83Å; Q207-P209 VanDerWaalsContact O-CD 3.31Å; Q207-P209 WeakPolarHBondContact O-CD 3.35Å
208	N	39.8	Very low	50.5	Low	130 Å²	130	106 Å²	106	70%	0.695	64%	0.639	S	S	*	*			trans	-88.2	107.6	-172.3	-152.1	-14.7	0	0	0	110.1	G206 G210 P222	G206-N208 PolarHBondContact O-N 2.89Å; N208-G210 PolarHBondContact O-N 3.48Å; N208-P222 HydrophobicContact CB-CG 4.43Å
209	P	55.4	Low	52.8	Low	98 Å²	98	104.3 Å²	104.3	64%	0.636	63%	0.625	S	S	*	*			trans	-73.8	117.2	-164.3	28.4	-34.5	0	0	0	112.5	Q207	Q207-P209 VanDerWaalsContact O-CD 3.31Å; Q207-P209 WeakPolarHBondContact O-CD 3.35Å
210	G	65.3	Low	55.2	Low	38 Å²	38	100.9 Å²	100.9	39%	0.392	59%	0.588	S	S	.	*			trans	-65.3	163.7	164.9	0	0	0	0	0	112.3	N208 N220	N208-G210 PolarHBondContact O-N 3.48Å; G210-N220 CarbonylContact C-O 3.42Å; G210-N220 WeakPolarHBondContact CA-O 3.47Å
211	W	83.7	Confident	57.7	Low	23 Å²	23	96 Å²	96	9%	0.087	57%	0.571	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-115	128.4	-177.3	63.7	-84.7	0	0	0	112.4	C213 H219 N220 T221 A224 C227 G232 R234	W211-C213 HydrophobicContact CZ3-CB 3.93Å; W211-H219 WeakPolarHBondContact O-CA 3.43Å; W211-N220 HydrophobicContact CD2-CB 4.09Å; W211-N220 HydrophobicContact CG-CB 4.42Å; W211-N220 HydrophobicContact CZ2-CB 3.87Å; W211-N220 PolarHBondContact N-O 3.42Å; W211-N220 PolarHBondContact O-N 3.04Å; W211-N220 PolarHBondContact O-ND2 2.73Å; W211-T221 PolarHBondContact NE1-O 3.1Å; W211-A224 HydrophobicContact CZ2-CB 4.36Å; W211-A224 PolarHBondContact NE1-O 3.44Å; W211-C227 HydrophobicContact CH2-CB 4.04Å; W211-G232 WeakPolarHBondContact CH2-O 3.1Å; W211-R234 HydrophobicContact CD2-CB 4.11Å; W211-R234 HydrophobicContact CD2-CG 3.64Å; W211-R234 HydrophobicContact CE3-CB 4.21Å; W211-R234 HydrophobicContact CE3-CG 3.98Å; W211-R234 HydrophobicContact CG-CG 3.92Å; W211-R234 HydrophobicContact CH2-CB 3.94Å; W211-R234 HydrophobicContact CZ2-CB 3.83Å; W211-R234 HydrophobicContact CZ2-CG 4.25Å; W211-R234 HydrophobicContact CZ3-CB 4.13Å; W211-R234 HydrophobicContact CZ3-CG 4.41Å
212	A	80.2	Confident	59.5	Low	53 Å²	53	91.7 Å²	91.7	44%	0.438	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	129.9	172.8	0	0	0	0	0	110.6	A214 L218	A212-A214 PolarHBondContact O-N 3.18Å; A212-L218 WeakPolarHBondContact CA-O 3.43Å
213	C	71.6	Confident	61.4	Low	2 Å²	2	91.6 Å²	91.6	1%	0.014	54%	0.539	C	S	.	.			trans	-74.6	121.7	178.4	-178.1	0	0	0	0	111.7	W211 R215 C216 T217 L218 C227 C230	W211-C213 HydrophobicContact CZ3-CB 3.93Å; C213-R215 PolarHBondContact O-N 2.84Å; C213-R215 PolarHBondContact SG-N 3.45Å; C213-C216 PolarHBondContact O-N 3.41Å; C213-C216 VanDerWaalsContact O-N 3.15Å; C213-T217 VanDerWaalsContact O-CA 3.3Å; C213-T217 WeakPolarHBondContact O-CA 3.28Å; C213-T217 PolarHBondContact O-N 2.82Å; C213-L218 PolarHBondContact N-O 2.82Å; C213-C227 HydrophobicContact CB-CB 3.66Å; C213-C227 VanDerWaalsContact CB-SG 3.56Å; C213-C227 WeakPolarHBondContact SG-CB 3.35Å; C213-C230 VanDerWaalsContact SG-SG 3.67Å
214	A	71.5	Confident	63.1	Low	95 Å²	95	89.3 Å²	89.3	79%	0.785	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-10.6	177.6	0	0	0	0	0	115.3	A212	A212-A214 PolarHBondContact O-N 3.18Å
215	R	69.3	Low	65.1	Low	176 Å²	176	87.6 Å²	87.6	66%	0.664	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-22.8	177.8	-54.7	-173.7	80	173.7	8.6	114.8	C213	C213-R215 PolarHBondContact O-N 2.84Å; C213-R215 PolarHBondContact SG-N 3.45Å
216	C	76.1	Confident	67.2	Low	50 Å²	50	82.9 Å²	82.9	34%	0.338	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.8	11.7	-172.7	64.8	0	0	0	0	115.1	C213 L218 C227 C230	C213-C216 PolarHBondContact O-N 3.41Å; C213-C216 VanDerWaalsContact O-N 3.15Å; C216-L218 PolarHBondContact O-N 3.24Å; C216-C227 PolarHBondContact SG-SG 2.97Å; C216-C230 HydrophobicContact CB-CB 4.29Å; C216-C230 PolarHBondContact SG-SG 2.82Å
217	T	74.1	Confident	69.5	Low	112 Å²	112	79.4 Å²	79.4	69%	0.687	46%	0.458	S	S	*	.			trans	54.5	-5.2	178.2	64.2	0	0	0	0	118.3	C213 H219	C213-T217 VanDerWaalsContact O-CA 3.3Å; C213-T217 WeakPolarHBondContact O-CA 3.28Å; C213-T217 PolarHBondContact O-N 2.82Å; T217-H219 PolarHBondContact O-N 3.04Å; T217-H219 PolarHBondContact O-ND1 3.31Å; T217-H219 VanDerWaalsContact O-ND1 3.12Å
218	L	76.3	Confident	70.6	Confident	71 Å²	71	75.3 Å²	75.3	37%	0.372	45%	0.451	S	S	.	.			trans	-54	132.4	172.1	-176	69.1	0	0	0	110.8	A212 C213 C216 N220 S228 A229	A212-L218 WeakPolarHBondContact CA-O 3.43Å; C213-L218 PolarHBondContact N-O 2.82Å; C216-L218 PolarHBondContact O-N 3.24Å; L218-N220 PolarHBondContact O-ND2 3.25Å; L218-S228 WeakPolarHBondContact CD2-OG 3.13Å; L218-A229 HydrophobicContact CD2-CB 3.61Å
219	H	78.4	Confident	71.4	Confident	140 Å²	140	72.9 Å²	72.9	65%	0.648	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	124.2	175.1	-72.5	51.5	0	0	0	110.2	W211 T217	W211-H219 WeakPolarHBondContact O-CA 3.43Å; T217-H219 PolarHBondContact O-N 3.04Å; T217-H219 PolarHBondContact O-ND1 3.31Å; T217-H219 VanDerWaalsContact O-ND1 3.12Å
220	N	78.6	Confident	71.5	Confident	8 Å²	8	70.7 Å²	70.7	4%	0.043	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	156.9	-177	-58.1	-85.5	0	0	0	110.2	G210 W211 L218 A224 C227 S228	G210-N220 CarbonylContact C-O 3.42Å; G210-N220 WeakPolarHBondContact CA-O 3.47Å; W211-N220 HydrophobicContact CD2-CB 4.09Å; W211-N220 HydrophobicContact CG-CB 4.42Å; W211-N220 HydrophobicContact CZ2-CB 3.87Å; W211-N220 PolarHBondContact N-O 3.42Å; W211-N220 PolarHBondContact O-N 3.04Å; W211-N220 PolarHBondContact O-ND2 2.73Å; L218-N220 PolarHBondContact O-ND2 3.25Å; N220-A224 HydrophobicContact CB-CB 4.14Å; N220-C227 VanDerWaalsContact OD1-CA 3.29Å; N220-C227 WeakPolarHBondContact OD1-CA 3.29Å; N220-C227 PolarHBondContact OD1-SG 2.98Å; N220-S228 PolarHBondContact OD1-N 3.04Å; N220-S228 PolarHBondContact OD1-OG 2.85Å
221	T	79.4	Confident	71.3	Confident	85 Å²	85	71.3 Å²	71.3	52%	0.521	44%	0.442	S	S	.	.			trans	-62.3	151	179.2	57.9	0	0	0	0	111.7	W211 V223 A224	W211-T221 PolarHBondContact NE1-O 3.1Å; T221-V223 PolarHBondContact O-N 3.18Å; T221-A224 WeakPolarHBondContact O-CB 3.38Å; T221-A224 PolarHBondContact O-N 3.42Å
222	P	68.4	Low	70.6	Confident	40 Å²	40	70.2 Å²	70.2	26%	0.26	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-11.2	-178.9	23	-33.3	0	0	0	114.6	N208 R234	N208-P222 HydrophobicContact CB-CG 4.43Å; P222-R234 PolarHBondContact O-NH1 3.11Å
223	V	65.7	Low	69.8	Low	124 Å²	124	70.5 Å²	70.5	75%	0.752	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-12.1	174.4	-64.6	0	0	0	0	113.9	T221	T221-V223 PolarHBondContact O-N 3.18Å
224	A	63.9	Low	69.8	Low	23 Å²	23	75.7 Å²	75.7	19%	0.19	45%	0.454	C	S	.	.			trans	-74	130.2	178.6	0	0	0	0	0	111.1	W211 N220 T221	W211-A224 HydrophobicContact CZ2-CB 4.36Å; W211-A224 PolarHBondContact NE1-O 3.44Å; N220-A224 HydrophobicContact CB-CB 4.14Å; T221-A224 WeakPolarHBondContact O-CB 3.38Å; T221-A224 PolarHBondContact O-N 3.42Å
225	L	70.6	Confident	69.4	Low	142 Å²	142	79.6 Å²	79.6	74%	0.743	45%	0.454	S	S	*	.	S	Bend	trans	-89.9	-23	175.4	-63.4	175.6	0	0	0	112.8	R234	L225-R234 PolarHBondContact O-N 3.33Å
226	S	76.2	Confident	68.2	Low	65 Å²	65	77.3 Å²	77.3	46%	0.455	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-132.4	157.4	176.2	61.4	0	0	0	0	111	G232	S226-G232 CarbonylContact C-O 3.58Å; S226-G232 WeakPolarHBondContact CA-O 3.42Å
227	C	76.7	Confident	66.1	Low	3 Å²	3	79.9 Å²	79.9	2%	0.02	47%	0.472	C	S	.	.			trans	-77.1	130.8	-176.4	176.5	0	0	0	0	112.1	W211 C213 C216 N220 A229 C230 G231 G232	W211-C227 HydrophobicContact CH2-CB 4.04Å; C213-C227 HydrophobicContact CB-CB 3.66Å; C213-C227 VanDerWaalsContact CB-SG 3.56Å; C213-C227 WeakPolarHBondContact SG-CB 3.35Å; C216-C227 PolarHBondContact SG-SG 2.97Å; N220-C227 VanDerWaalsContact OD1-CA 3.29Å; N220-C227 WeakPolarHBondContact OD1-CA 3.29Å; N220-C227 PolarHBondContact OD1-SG 2.98Å; C227-A229 VanDerWaalsContact C-N 3.28Å; C227-A229 PolarHBondContact O-N 3.1Å; C227-C230 PolarHBondContact O-N 3.03Å; C227-G231 WeakPolarHBondContact O-CA 3.39Å; C227-G231 PolarHBondContact O-N 3.05Å; C227-G232 PolarHBondContact N-O 2.9Å
228	S	61.6	Low	64	Low	104 Å²	104	82.4 Å²	82.4	73%	0.727	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-25	-174.5	57.4	0	0	0	0	114.6	L218 N220	L218-S228 WeakPolarHBondContact CD2-OG 3.13Å; N220-S228 PolarHBondContact OD1-N 3.04Å; N220-S228 PolarHBondContact OD1-OG 2.85Å
229	A	56	Low	61.9	Low	78 Å²	78	84.8 Å²	84.8	65%	0.645	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-21	178	0	0	0	0	0	115.1	L218 C227	L218-A229 HydrophobicContact CD2-CB 3.61Å; C227-A229 VanDerWaalsContact C-N 3.28Å; C227-A229 PolarHBondContact O-N 3.1Å
230	C	57.7	Low	59.7	Low	52 Å²	52	88 Å²	88	35%	0.351	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.6	2.4	-172.1	90.3	0	0	0	0	115.7	C213 C216 C227 G232	C213-C230 VanDerWaalsContact SG-SG 3.67Å; C216-C230 HydrophobicContact CB-CB 4.29Å; C216-C230 PolarHBondContact SG-SG 2.82Å; C227-C230 PolarHBondContact O-N 3.03Å; C230-G232 PolarHBondContact O-N 3.04Å; C230-G232 PolarHBondContact SG-N 3.45Å; C230-G232 VanDerWaalsContact SG-N 3.39Å
231	G	62	Low	57.4	Low	52 Å²	52	94.3 Å²	94.3	54%	0.536	55%	0.545	S	S	.	.			trans	62.6	7.2	-177.7	0	0	0	0	0	115.5	C227	C227-G231 WeakPolarHBondContact O-CA 3.39Å; C227-G231 PolarHBondContact O-N 3.05Å
232	G	67.6	Low	55.3	Low	0 Å²	0	94 Å²	94	0%	0	55%	0.545	C	S	.	.			trans	-66.9	134.1	-177.7	0	0	0	0	0	111.6	W211 S226 C227 C230	W211-G232 WeakPolarHBondContact CH2-O 3.1Å; S226-G232 CarbonylContact C-O 3.58Å; S226-G232 WeakPolarHBondContact CA-O 3.42Å; C227-G232 PolarHBondContact N-O 2.9Å; C230-G232 PolarHBondContact O-N 3.04Å; C230-G232 PolarHBondContact SG-N 3.45Å; C230-G232 VanDerWaalsContact SG-N 3.39Å
233	P	64.8	Low	53.7	Low	59 Å²	59	97.3 Å²	97.3	38%	0.383	57%	0.566	S	S	.	*	B	Isolated β-bridge	trans	-68.5	156.2	-178	29.2	-35.9	0	0	0	112.1	K235 L236	P233-K235 VanDerWaalsContact C-N 3.26Å; P233-K235 PolarHBondContact O-N 3.29Å; P233-L236 HydrophobicContact CG-CD2 4.01Å; P233-L236 HydrophobicContact CG-CG 4.21Å
234	R	70.6	Confident	52.3	Low	110 Å²	110	98.5 Å²	98.5	42%	0.415	56%	0.563	S	S	.	*	S	Bend	trans	-66.4	-21.6	179.5	-175.3	170.3	-176.3	179.5	4.4	114.6	W211 P222 L225	W211-R234 HydrophobicContact CD2-CB 4.11Å; W211-R234 HydrophobicContact CD2-CG 3.64Å; W211-R234 HydrophobicContact CE3-CB 4.21Å; W211-R234 HydrophobicContact CE3-CG 3.98Å; W211-R234 HydrophobicContact CG-CG 3.92Å; W211-R234 HydrophobicContact CH2-CB 3.94Å; W211-R234 HydrophobicContact CZ2-CB 3.83Å; W211-R234 HydrophobicContact CZ2-CG 4.25Å; W211-R234 HydrophobicContact CZ3-CB 4.13Å; W211-R234 HydrophobicContact CZ3-CG 4.41Å; P222-R234 PolarHBondContact O-NH1 3.11Å; L225-R234 PolarHBondContact O-N 3.33Å
235	K	62.7	Low	51	Low	178 Å²	178	100.9 Å²	100.9	77%	0.774	58%	0.583	S	S	*	*			trans	-128.9	143.6	172.5	-71	-174.1	176.2	-177.4	0	110.3	P233	P233-K235 VanDerWaalsContact C-N 3.26Å; P233-K235 PolarHBondContact O-N 3.29Å
236	L	45.3	Very low	49.2	Very low	127 Å²	127	101.6 Å²	101.6	67%	0.665	59%	0.587	S	S	*	*			trans	-135.9	119.8	162.9	-77.1	171.6	0	0	0	106.3	P233	P233-L236 HydrophobicContact CG-CD2 4.01Å; P233-L236 HydrophobicContact CG-CG 4.21Å
237	S	30.8	Very low	46.9	Very low	105 Å²	105	104.1 Å²	104.1	73%	0.734	60%	0.599	S	S	*	*			trans	-154.3	95.2	179.8	54.5	0	0	0	0	111.7
238	L	29.9	Very low	44.7	Very low	165 Å²	165	110.5 Å²	110.5	86%	0.864	64%	0.638	S	S	*	*			trans	-124.5	147.1	149.1	-75.7	174.8	0	0	0	107.5
239	P	32.8	Very low	43.2	Very low	121 Å²	121	110.6 Å²	110.6	79%	0.786	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-68.3	152.5	-176.5	-17.6	31.9	0	0	0	112.5
240	K	33.1	Very low	42	Very low	207 Å²	207	114.7 Å²	114.7	90%	0.9	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-85.4	122.2	165.1	-70.3	-177.8	177.8	-180	0	109.1
241	I	30.7	Very low	40.7	Very low	140 Å²	140	118.9 Å²	118.9	72%	0.718	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-75.9	131.3	169.4	-57.6	176	0	0	0	108.3	A245	I241-A245 HydrophobicContact CG2-CB 4.2Å
242	P	34	Very low	39	Very low	80 Å²	80	126.4 Å²	126.4	52%	0.519	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-66.9	150.8	175.9	-22.4	35	0	0	0	113.3	E244	P242-E244 WeakPolarHBondContact CB-OE2 3.39Å; P242-E244 PolarHBondContact O-N 3.47Å
243	P	34.7	Very low	37.1	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-64.4	-21.1	-176.1	-21.6	34.3	0	0	0	115.1	A245 L246	P243-A245 PolarHBondContact O-N 2.88Å; P243-L246 PolarHBondContact O-N 3.46Å
244	E	37	Very low	35.7	Very low	149 Å²	149	135.1 Å²	135.1	70%	0.696	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-69.1	-14.7	-174.1	-57.7	73.6	-157.9	0	0	113	P242 L246	P242-E244 WeakPolarHBondContact CB-OE2 3.39Å; P242-E244 PolarHBondContact O-N 3.47Å; E244-L246 VanDerWaalsContact C-N 3.33Å; E244-L246 PolarHBondContact O-N 2.76Å
245	A	37	Very low	33.6	Very low	74 Å²	74	135.9 Å²	135.9	61%	0.612	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-82.6	1.2	-178.7	0	0	0	0	0	114.9	I241 P243	I241-A245 HydrophobicContact CG2-CB 4.2Å; P243-A245 PolarHBondContact O-N 2.88Å
246	L	32.3	Very low	32	Very low	156 Å²	156	134.3 Å²	134.3	82%	0.817	75%	0.753	S	S	*	*			trans	-116.5	48.6	-175.4	-70.5	175.6	0	0	0	113.5	P243 E244	P243-L246 PolarHBondContact O-N 3.46Å; E244-L246 VanDerWaalsContact C-N 3.33Å; E244-L246 PolarHBondContact O-N 2.76Å
247	V	28	Very low	31	Very low	119 Å²	119	131.6 Å²	131.6	72%	0.721	76%	0.756	S	S	*	*			trans	-116.2	106.4	171.4	-176.4	0	0	0	0	110.1
248	V	30.6	Very low	30.8	Very low	137 Å²	137	136.6 Å²	136.6	83%	0.83	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-94.5	119.9	168.8	-179.3	0	0	0	0	108.3
249	P	30.4	Very low	31.2	Very low	105 Å²	105	134 Å²	134	68%	0.682	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.4	137.8	178.6	-20.5	33.5	0	0	0	112.9
250	E	31.3	Very low	30.9	Very low	165 Å²	165	134.8 Å²	134.8	77%	0.771	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-68	128.9	167.5	-67	-166.4	137	0	0	110.8
251	V	28.6	Very low	30.9	Very low	139 Å²	139	133.3 Å²	133.3	84%	0.842	76%	0.756	S	S	*	*			trans	-95.6	107.4	171.2	179.2	0	0	0	0	110
252	R	27.4	Very low	31.7	Very low	211 Å²	211	132.7 Å²	132.7	80%	0.796	76%	0.761	S	S	*	*			trans	-101.1	130.6	162	-68.5	-176.9	-179.5	-175.4	0.2	109.9
253	T	27.3	Very low	31.5	Very low	127 Å²	127	133.1 Å²	133.1	78%	0.779	77%	0.771	S	S	*	*			trans	-76	158.3	159.4	44.8	0	0	0	0	109.1
254	P	35.7	Very low	32	Very low	114 Å²	114	134.2 Å²	134.2	74%	0.74	78%	0.779	S	S	*	*			cis	-152.7	174.2	42.1	44.1	-23.1	0	0	0	120.3
255	V	26.6	Very low	31.7	Very low	126 Å²	126	132 Å²	132	76%	0.764	78%	0.78	S	S	*	*			trans	76	113.7	140.3	157.7	0	0	0	0	122
256	V	27.9	Very low	31.4	Very low	146 Å²	146	133 Å²	133	89%	0.885	79%	0.788	S	S	*	*			trans	62.3	127.2	139.6	178.8	0	0	0	0	121.5
257	G	25.5	Very low	32.3	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	78%	0.782	S	S	*	*			trans	157.2	107.4	153.6	0	0	0	0	0	116.6
258	F	27.2	Very low	32.6	Very low	209 Å²	209	132.4 Å²	132.4	92%	0.917	79%	0.787	S	S	*	*			trans	-123.3	151.3	160.9	-103.4	-67.2	0	0	0	106.7
259	P	37.8	Very low	32.6	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	78%	0.782	S	S	*	*				-162	179.7	78.9	38.5	-14.2	0	0	0	119.7
260	V	25.9	Very low	32.7	Very low	136 Å²	136	133.7 Å²	133.7	82%	0.824	79%	0.786	S	S	*	*			trans	83.2	141.4	156.6	-146.6	0	0	0	0	121.7
261	H	32.6	Very low	32.7	Very low	177 Å²	177	132 Å²	132	82%	0.819	78%	0.782	S	S	*	*			trans	-82.6	-174.6	173.4	-89.2	-63.9	0	0	0	112.8
262	P	47.4	Very low	32.9	Very low	126 Å²	126	131.9 Å²	131.9	82%	0.818	78%	0.776	S	S	*	*			cis	-142.4	-163.7	25.1	43.1	-20.3	0	0	0	118.2
263	A	31.2	Very low	33.4	Very low	89 Å²	89	126.9 Å²	126.9	74%	0.736	77%	0.769	S	S	*	*			trans	-92.5	-166.6	-175.6	0	0	0	0	0	112.7
264	P	44	Very low	33.8	Very low	131 Å²	131	127.5 Å²	127.5	85%	0.851	77%	0.767	S	S	*	*			cis	-142.5	-142.3	38.9	43.2	-19.7	0	0	0	116.4
265	S	30.5	Very low	33.7	Very low	104 Å²	104	129.6 Å²	129.6	73%	0.727	77%	0.767	S	S	*	*			trans	-121.6	145.8	-141.6	53.6	0	0	0	0	119.8
266	A	31.5	Very low	34.1	Very low	94 Å²	94	127.6 Å²	127.6	78%	0.777	76%	0.759	S	S	*	*			trans	57.6	-175	135.7	0	0	0	0	0	119.8
267	P	50.3	Low	34.2	Very low	108 Å²	108	126.5 Å²	126.5	70%	0.701	75%	0.748	S	S	*	*			cis	-145.9	-171	-4.7	48	-29.6	0	0	0	118.6
268	L	35.5	Very low	34.2	Very low	155 Å²	155	128.6 Å²	128.6	81%	0.812	75%	0.747	S	S	*	*			trans	71.3	147.2	148.1	-69.2	-167.4	0	0	0	126.3
269	V	29.2	Very low	35.3	Very low	122 Å²	122	123.2 Å²	123.2	74%	0.739	73%	0.733	S	S	*	*			trans	161.6	102.2	131.7	156.6	0	0	0	0	109.1
270	I	32.9	Very low	34.8	Very low	146 Å²	146	124.1 Å²	124.1	75%	0.749	74%	0.737	S	S	*	*				83.2	144.1	89.6	-75.7	169.5	0	0	0	115
271	D	32.2	Very low	36	Very low	131 Å²	131	123.2 Å²	123.2	70%	0.701	73%	0.734	S	S	*	*			cis	-177.3	-173	-26.5	-163.4	11.2	0	0	0	110.6
272	L	32.2	Very low	35.6	Very low	136 Å²	136	120.1 Å²	120.1	71%	0.712	73%	0.732	S	S	*	*			trans	89.2	135.7	161.1	-53.6	-179.1	0	0	0	118
273	T	38.1	Very low	34.5	Very low	106 Å²	106	121.5 Å²	121.5	65%	0.65	73%	0.732	S	S	*	*			cis	-167.3	-177.9	-19.8	14.3	0	0	0	0	105.9
274	D	34.8	Very low	35.4	Very low	139 Å²	139	122 Å²	122	74%	0.743	73%	0.729	S	S	*	*			cis	-161.5	174	-3	-99.7	-37.3	0	0	0	103.4
275	E	34.5	Very low	34.4	Very low	158 Å²	158	124 Å²	124	74%	0.738	73%	0.727	S	S	*	*			cis	-165.3	160.1	-9.6	-115.9	-80.8	78	0	0	102.7
276	S	35	Very low	34.1	Very low	85 Å²	85	127.7 Å²	127.7	59%	0.594	73%	0.732	S	S	*	*			cis	-159.5	-170.7	8.3	64.7	0	0	0	0	108.1
277	N	29	Very low	33.6	Very low	123 Å²	123	128 Å²	128	66%	0.658	73%	0.728	S	S	*	*			cis	-152.3	-153.6	7.6	-147.1	-70.5	0	0	0	111
278	T	27.1	Very low	33.3	Very low	114 Å²	114	127.9 Å²	127.9	70%	0.699	73%	0.728	S	S	*	*			trans	-142.7	-171.6	-167.3	65.4	0	0	0	0	110.6
279	P	48.9	Very low	32.9	Very low	96 Å²	96	128.8 Å²	128.8	62%	0.623	73%	0.728	S	S	*	*			cis	-142.4	152.8	-0.2	39.5	-19.8	0	0	0	119.1
280	T	28.2	Very low	32.7	Very low	130 Å²	130	128.5 Å²	128.5	80%	0.798	73%	0.726	S	S	*	*			trans	60.2	162.7	142.2	58	0	0	0	0	122.1
281	P	50.1	Low	32.3	Very low	117 Å²	117	126.6 Å²	126.6	76%	0.76	73%	0.726	S	S	*	*			cis	-116.5	-149.5	-23.1	23.1	2.7	0	0	0	109.6
282	S	24.2	Very low	32.1	Very low	112 Å²	112	126.3 Å²	126.3	78%	0.783	73%	0.734	S	S	*	*			cis	-155.1	163.6	10.7	-54.5	0	0	0	0	113.6
283	D	25.7	Very low	31.8	Very low	155 Å²	155	129.3 Å²	129.3	83%	0.829	75%	0.745	S	S	*	*			trans	-73	-177.3	161.9	-94.1	-47.3	0	0	0	114.3
284	P	49.1	Very low	31.4	Very low	101 Å²	101	127.6 Å²	127.6	66%	0.656	75%	0.748	S	S	*	*			cis	-142.6	-170.8	-34.4	40.1	-21.4	0	0	0	114.4
285	Q	23.4	Very low	30.8	Very low	173 Å²	173	129.2 Å²	129.2	81%	0.808	76%	0.756	S	S	*	*			trans	42.8	156.3	138.8	-86.9	-178.8	-121.6	0	0	126.5
286	E	24.3	Very low	30.4	Very low	181 Å²	181	127 Å²	127	85%	0.846	76%	0.757	S	S	*	*			trans	92	147.5	153	-87.6	-173.3	121.2	0	0	122.2
287	S	21	Very low	30.3	Very low	99 Å²	99	127.5 Å²	127.5	69%	0.692	76%	0.761	S	S	*	*			trans	-129.7	-179.5	-175.4	70	0	0	0	0	107.1
288	P	45	Very low	30.4	Very low	107 Å²	107	127.6 Å²	127.6	70%	0.695	77%	0.769	S	S	*	*			cis	-137.6	-177.6	6.6	35	-13.1	0	0	0	114.8
289	Q	25.5	Very low	30.9	Very low	173 Å²	173	132 Å²	132	81%	0.808	77%	0.774	S	S	*	*				165.1	140.5	117	-89.2	-161	-3.4	0	0	116.4
290	V	25.9	Very low	30	Very low	116 Å²	116	132.6 Å²	132.6	70%	0.703	78%	0.777	S	S	*	*			trans	70	90.3	142	-179.6	0	0	0	0	120.4
291	S	24	Very low	29.7	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	77%	0.772	S	S	*	*			trans	56.3	123.7	134.8	70.9	0	0	0	0	123.5
292	S	28.4	Very low	28.8	Very low	126 Å²	126	135.4 Å²	135.4	88%	0.881	78%	0.776	S	S	*	*				-156.2	166.1	116.2	36.9	0	0	0	0	111.2
293	Q	26.9	Very low	29	Very low	199 Å²	199	135.9 Å²	135.9	93%	0.93	78%	0.777	S	S	*	*			trans	-81.8	150.1	-159.9	-62.6	162.3	-32.8	0	0	114.5
294	G	28.3	Very low	28.9	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	77%	0.77	S	S	*	*			trans	167.2	47.9	171.9	0	0	0	0	0	115.9
295	L	23.6	Very low	27.7	Very low	172 Å²	172	135 Å²	135	90%	0.901	77%	0.773	S	S	*	*			trans	-64	141.4	-171.8	-70.7	96.6	0	0	0	114
296	S	24.3	Very low	27.8	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	77%	0.768	S	S	*	*			trans	-142.2	154.4	163.4	54.6	0	0	0	0	109.8
297	S	34.3	Very low	27.7	Very low	97 Å²	97	131.8 Å²	131.8	68%	0.678	76%	0.763	S	S	*	*			trans	69.3	140.9	-157.1	-137.2	0	0	0	0	111.7
298	P	30.1	Very low	28.1	Very low	125 Å²	125	134.4 Å²	134.4	81%	0.812	77%	0.769	S	S	*	*				-129.8	162.4	54.9	40.8	-28.3	0	0	0	116.8
299	Y	37.5	Very low	27.5	Very low	207 Å²	207	134.6 Å²	134.6	81%	0.812	77%	0.77	S	S	*	*			trans	-57.5	152.4	155.7	-80.5	-88.7	0	0	0	110.9
300	P	30.9	Very low	27.9	Very low	107 Å²	107	131.8 Å²	131.8	70%	0.695	77%	0.765	S	S	*	*				-155.1	177.7	63.9	42.8	-21.5	0	0	0	119
301	T	22.4	Very low	27.8	Very low	110 Å²	110	132.4 Å²	132.4	68%	0.675	77%	0.771	S	S	*	*			trans	33.4	127.1	150.2	52.5	0	0	0	0	122.8
302	F	29.3	Very low	27.8	Very low	196 Å²	196	138.5 Å²	138.5	86%	0.86	78%	0.778	S	S	*	*				28.6	133.5	129.7	-67.4	-67	0	0	0	120
303	P	28.4	Very low	27.9	Very low	123 Å²	123	138 Å²	138	80%	0.799	77%	0.774	S	S	*	*				-145.6	-178.9	77.7	41.4	-25.5	0	0	0	116.8
304	S	24.7	Very low	28.1	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	77%	0.769	S	S	*	*			trans	-70	151.7	171.7	49	0	0	0	0	113.6
305	L	23.3	Very low	28.3	Very low	139 Å²	139	146.1 Å²	146.1	73%	0.728	78%	0.775	S	S	*	*				169.1	151.7	115.4	-90.2	164.7	0	0	0	113.3
306	Q	24.8	Very low	28.3	Very low	147 Å²	147	145.8 Å²	145.8	69%	0.687	77%	0.768	S	S	*	*			trans	63.4	118.9	143.4	-75.6	165.1	-11.9	0	0	122.4
307	N	24.2	Very low	28.7	Very low	140 Å²	140	146.6 Å²	146.6	75%	0.749	77%	0.768	S	S	*	*				79.1	124.1	127	-60.3	-13.7	0	0	0	121.3
308	N	28.6	Very low	29	Very low	155 Å²	155	147.3 Å²	147.3	83%	0.829	77%	0.771	S	S	*	*			trans	-32.3	142	138.4	-74.2	-58.2	0	0	0	112.3
309	P	31.6	Very low	29.8	Very low	110 Å²	110	146.8 Å²	146.8	71%	0.714	77%	0.767	S	S	*	*				-151.5	158.4	62.2	40.2	-21	0	0	0	119.3
310	V	33.4	Very low	30.5	Very low	115 Å²	115	142.9 Å²	142.9	70%	0.697	77%	0.767	S	S	*	*			trans	21.2	111.1	136.4	-171.4	0	0	0	0	118.4
311	P	24.6	Very low	30.2	Very low	128 Å²	128	141.5 Å²	141.5	83%	0.831	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-79.1	125.8	151.8	-10.4	28.1	0	0	0	110.7
312	R	25	Very low	30.4	Very low	234 Å²	234	147.9 Å²	147.9	88%	0.883	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.8	154.5	165.3	-77.2	179.1	170.2	171.9	-3.3	110.3
313	S	29.5	Very low	31.3	Very low	115 Å²	115	143.3 Å²	143.3	80%	0.804	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-72.1	148.6	168	58.4	0	0	0	0	111.9
314	R	30.6	Very low	31.2	Very low	215 Å²	215	146.2 Å²	146.2	81%	0.811	78%	0.777	S	S	*	*				179.3	109.3	122.8	177.5	163.8	-68.9	-129.7	3.9	113.6
315	R	32.4	Very low	31.5	Very low	225 Å²	225	148.7 Å²	148.7	85%	0.849	78%	0.783	S	S	*	*			trans	-7.4	129.9	138.4	-178	-164.5	-144.4	175	7.6	117.1
316	E	25.4	Very low	31.7	Very low	165 Å²	165	151.8 Å²	151.8	77%	0.771	79%	0.794	S	S	*	*			trans	-167.9	163.6	131.1	-107.2	151.9	-132.4	0	0	113.9
317	V	31.8	Very low	31.8	Very low	128 Å²	128	147.8 Å²	147.8	78%	0.776	79%	0.791	S	S	*	*			trans	-158.5	150.7	-170.5	-145.7	0	0	0	0	103.3
318	P	41.5	Very low	31.9	Very low	113 Å²	113	147.4 Å²	147.4	73%	0.734	80%	0.795	S	S	*	*			cis	-149.6	-116	42.2	35.2	-5.7	0	0	0	117.9
319	P	46.3	Very low	31.8	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	80%	0.796	S	S	*	*				-118.2	-135.5	-101.2	34.3	-11	0	0	0	116
320	P	52.5	Low	31.6	Very low	125 Å²	125	147.7 Å²	147.7	81%	0.812	80%	0.799	S	S	*	*				-129.7	-175.5	-103.2	43.7	-25.5	0	0	0	116.3
321	G	24.5	Very low	31.9	Very low	78 Å²	78	148.2 Å²	148.2	80%	0.804	80%	0.804	S	S	*	*			trans	-152.1	158.9	171.5	0	0	0	0	0	115.2
322	R	26	Very low	32	Very low	245 Å²	245	147.4 Å²	147.4	93%	0.925	80%	0.802	S	S	*	*			trans	-156.3	176.6	-178.1	-124	-166.7	175.6	-171.8	0.5	107.2
323	P	49	Very low	33	Very low	100 Å²	100	141.5 Å²	141.5	65%	0.649	79%	0.794	S	S	*	*			cis	-132.2	-174.4	-26.2	35.8	-16.8	0	0	0	113.1
324	Q	26.6	Very low	32.8	Very low	184 Å²	184	142.6 Å²	142.6	86%	0.86	80%	0.796	S	S	*	*				168.2	172.2	122.1	-88.9	-168.2	-5.2	0	0	113.9
325	N	30	Very low	32.7	Very low	149 Å²	149	137.7 Å²	137.7	80%	0.797	80%	0.795	S	S	*	*			trans	-133.6	151.9	-164.4	-82.1	-0.3	0	0	0	114.3
326	Q	26.8	Very low	33.3	Very low	204 Å²	204	132.8 Å²	132.8	95%	0.953	79%	0.792	S	S	*	*			trans	166.1	152.6	145.1	-94.2	158	79.2	0	0	109.8
327	G	26.8	Very low	33.5	Very low	62 Å²	62	130 Å²	130	64%	0.639	79%	0.791	S	S	*	*			cis	172.7	174.1	-8.6	0	0	0	0	0	113.6
328	T	27.5	Very low	33.4	Very low	133 Å²	133	130.4 Å²	130.4	82%	0.816	79%	0.793	S	S	*	*			trans	74.5	136.2	155.1	45.6	0	0	0	0	125.6
329	N	25.6	Very low	32.7	Very low	159 Å²	159	128.7 Å²	128.7	85%	0.85	79%	0.789	S	S	*	*			trans	95.4	151.7	141.6	-66.2	-4.2	0	0	0	124.1
330	S	28.1	Very low	31.8	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	80%	0.796	S	S	*	*			trans	-128.2	172.5	-174.3	60.1	0	0	0	0	111.7
331	P	38.8	Very low	30.6	Very low	125 Å²	125	130.4 Å²	130.4	81%	0.812	80%	0.795	S	S	*	*				-154.4	-171.5	92.7	40.8	-20.3	0	0	0	116.7
332	S	28.1	Very low	31.6	Very low	111 Å²	111	132 Å²	132	78%	0.776	79%	0.791	S	S	*	*			trans	-84.6	-169.9	-179.4	-24.6	0	0	0	0	113.6
333	P	45.9	Very low	32.7	Very low	110 Å²	110	125.7 Å²	125.7	71%	0.714	78%	0.781	S	S	*	*			cis	-154.7	178.6	37.2	41.7	-17.4	0	0	0	121.9
334	T	24.9	Very low	32	Very low	138 Å²	138	129 Å²	129	85%	0.847	79%	0.788	S	S	*	*			trans	80.2	152	148.6	30.9	0	0	0	0	124.2
335	S	29.1	Very low	32.6	Very low	113 Å²	113	125.9 Å²	125.9	79%	0.79	78%	0.784	S	S	*	*			trans	-120.8	-179.8	-172.7	-43.7	0	0	0	0	112.3
336	P	43.5	Very low	32.6	Very low	122 Å²	122	121.6 Å²	121.6	79%	0.792	78%	0.775	S	S	*	*				-148.9	166.3	94.7	38.8	-21.6	0	0	0	118.1
337	S	30.6	Very low	33.8	Very low	107 Å²	107	117.5 Å²	117.5	75%	0.748	77%	0.766	S	S	*	*			trans	-4.5	151.8	153.9	-44.9	0	0	0	0	120.3
338	T	29.2	Very low	33.8	Very low	135 Å²	135	123.9 Å²	123.9	83%	0.828	78%	0.779	S	S	*	*			cis	-166.9	-172.2	16.9	-5.8	0	0	0	0	109.4
339	A	27.2	Very low	34	Very low	78 Å²	78	128.6 Å²	128.6	65%	0.645	78%	0.782	S	S	*	*			cis	-165.7	153.6	2.4	0	0	0	0	0	113.3
340	V	26.7	Very low	34.5	Very low	146 Å²	146	126.7 Å²	126.7	89%	0.885	78%	0.778	S	S	*	*			trans	68.7	144.5	145.3	176.8	0	0	0	0	121.5
341	V	28.5	Very low	34.4	Very low	128 Å²	128	126 Å²	126	78%	0.776	78%	0.78	S	S	*	*			trans	-164.7	155.6	-165.9	117.7	0	0	0	0	106.4
342	P	44.1	Very low	34.1	Very low	112 Å²	112	129.6 Å²	129.6	73%	0.727	78%	0.782	S	S	*	*				-138.6	-101.9	51.9	25.2	3.9	0	0	0	120.2
343	P	49.2	Very low	34.4	Very low	111 Å²	111	129.9 Å²	129.9	72%	0.721	78%	0.782	S	S	*	*				-137.7	179.3	-123.3	45.6	-26	0	0	0	120.7
344	Q	35.2	Very low	33.5	Very low	169 Å²	169	134.6 Å²	134.6	79%	0.79	79%	0.791	S	S	*	*			trans	-11.1	150.2	147.5	-72.8	-83.5	-18.3	0	0	118.2
345	P	39	Very low	33.9	Very low	120 Å²	120	137.4 Å²	137.4	78%	0.779	79%	0.794	S	S	*	*				-146.9	178	50.7	42.7	-23.5	0	0	0	118.5
346	G	28.9	Very low	33.7	Very low	58 Å²	58	136.9 Å²	136.9	60%	0.598	80%	0.796	S	S	*	*			trans	-90.7	-159.2	158.7	0	0	0	0	0	112.4
347	P	52.3	Low	33	Very low	119 Å²	119	140 Å²	140	77%	0.773	80%	0.801	S	S	*	*			cis	-127.4	-176.8	-1	42.6	-28.4	0	0	0	113.5
348	Q	27.5	Very low	33.6	Very low	195 Å²	195	139.8 Å²	139.8	91%	0.911	80%	0.796	S	S	*	*			trans	173.2	167.4	132.7	-96.6	173.6	30.9	0	0	114.1
349	R	32.7	Very low	33.3	Very low	232 Å²	232	142.2 Å²	142.2	88%	0.875	80%	0.798	S	S	*	*			trans	-119.4	148.1	174.3	-152.1	-172.1	-159.9	-176.9	8.3	107.1
350	P	34.8	Very low	33.4	Very low	119 Å²	119	146.9 Å²	146.9	77%	0.773	81%	0.807	S	S	*	*				-156.2	169.4	105.9	39.1	-21	0	0	0	117.7
351	A	26	Very low	33.7	Very low	98 Å²	98	146 Å²	146	81%	0.81	80%	0.804	S	S	*	*			trans	63.3	140.8	145	0	0	0	0	0	123.7
352	K	33.7	Very low	33.4	Very low	201 Å²	201	147.1 Å²	147.1	87%	0.874	81%	0.805	S	S	*	*			trans	-95.6	157.5	154.6	-67.9	-179.1	175.9	-178.3	0	109.6
353	P	33.7	Very low	32.8	Very low	117 Å²	117	152.4 Å²	152.4	76%	0.76	81%	0.812	S	S	*	*				-139	130.1	116.1	35.8	-23.2	0	0	0	112.3
354	K	26.5	Very low	32.3	Very low	208 Å²	208	152.4 Å²	152.4	90%	0.904	81%	0.812	S	S	*	*				91.9	155.4	92	-77.5	-167.9	172.3	-176.2	0	114.4
355	H	33.5	Very low	31.9	Very low	198 Å²	198	148.7 Å²	148.7	92%	0.917	80%	0.804	S	S	*	*			trans	-71.8	154.6	-173.2	-77.7	-96.9	0	0	0	114.7
356	A	24.7	Very low	31.5	Very low	101 Å²	101	151.3 Å²	151.3	84%	0.835	80%	0.804	S	S	*	*			trans	-142.3	137.8	143	0	0	0	0	0	111.3
357	Q	29.3	Very low	31.3	Very low	189 Å²	189	158.7 Å²	158.7	88%	0.883	81%	0.814	S	S	*	*			trans	-130.6	170.5	156.8	-114.5	-168.6	-13.5	0	0	104.6
358	P	43.2	Very low	30	Very low	102 Å²	102	159.3 Å²	159.3	66%	0.662	81%	0.809	S	S	*	*			cis	-132.8	-161.4	7.8	35.5	-13.5	0	0	0	113.4
359	Q	22.6	Very low	30	Very low	185 Å²	185	154.1 Å²	154.1	86%	0.864	80%	0.795	S	S	*	*			trans	131.2	140.1	143.5	-69.3	-171.9	-58.2	0	0	115.9
360	E	29.3	Very low	29.7	Very low	177 Å²	177	149.9 Å²	149.9	83%	0.827	79%	0.788	S	S	*	*			trans	-77.8	169.1	163.4	-57.6	178.3	116.6	0	0	110.5
361	P	32.4	Very low	29.4	Very low	128 Å²	128	150.9 Å²	150.9	83%	0.831	79%	0.786	S	S	*	*				-144.4	-177.4	105.2	39.1	-24.7	0	0	0	115.7
362	L	22.9	Very low	29.4	Very low	150 Å²	150	155 Å²	155	79%	0.785	79%	0.789	S	S	*	*			trans	-70.9	151.6	-168.1	-77.1	58.8	0	0	0	116.6
363	Y	31.6	Very low	29.3	Very low	223 Å²	223	154.2 Å²	154.2	88%	0.875	79%	0.788	S	S	*	*			trans	-9.1	149	133.2	-78.9	-71.7	0	0	0	117.8
364	P	38	Very low	28.9	Very low	111 Å²	111	158 Å²	158	72%	0.721	80%	0.796	S	S	*	*				-159.1	172.2	72.7	43.1	-23	0	0	0	120.7
365	S	27.3	Very low	29	Very low	91 Å²	91	154.8 Å²	154.8	64%	0.636	79%	0.789	S	S	*	*			trans	76.4	146.3	151.5	-69.9	0	0	0	0	119.4
366	K	29.4	Very low	29.5	Very low	175 Å²	175	150.5 Å²	150.5	76%	0.761	78%	0.778	S	S	*	*			cis	-167.8	160.5	-6.2	-119.6	167	-170.2	168.9	0	113.8
367	R	25.8	Very low	29.6	Very low	214 Å²	214	153 Å²	153	81%	0.808	77%	0.772	S	S	*	*			trans	74.4	145.2	148.8	-78.2	-168.8	160.2	-176.3	-5.7	119
368	L	25.1	Very low	29.8	Very low	131 Å²	131	150.5 Å²	150.5	69%	0.686	76%	0.761	S	S	*	*			cis	-150.7	137.9	-12.6	-83.6	155.5	0	0	0	105.3
369	S	26.7	Very low	29.1	Very low	87 Å²	87	153.2 Å²	153.2	61%	0.608	76%	0.764	S	S	*	*				52.9	127.7	69.4	75.1	0	0	0	0	114.6
370	I	27.4	Very low	30.1	Very low	142 Å²	142	149.3 Å²	149.3	73%	0.728	76%	0.755	S	S	*	*				-158.6	137.9	66.1	-88.6	159.5	0	0	0	107.9
371	L	27.1	Very low	30.1	Very low	141 Å²	141	149.4 Å²	149.4	74%	0.738	76%	0.76	S	S	*	*				82	125.9	56.6	-105	173.1	0	0	0	114.8
372	E	26.4	Very low	30	Very low	184 Å²	184	149.5 Å²	149.5	86%	0.86	76%	0.758	S	S	*	*				-178.2	148.3	120.1	-98.5	164.4	-174.7	0	0	112.7
373	E	31.3	Very low	30.8	Very low	184 Å²	184	148.2 Å²	148.2	86%	0.86	76%	0.759	S	S	*	*			trans	-124.1	156.1	169.1	-68.7	177.1	98	0	0	107.3
374	E	26.4	Very low	31.2	Very low	197 Å²	197	142.3 Å²	142.3	92%	0.921	76%	0.756	S	S	*	*			trans	-158.2	146.7	156.1	-126.5	-179.4	177	0	0	114.3
375	D	28.9	Very low	31.7	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	76%	0.76	S	S	*	*			trans	-156.2	133.6	170.9	168.7	56.5	0	0	0	109.9
376	P	43.9	Very low	33.1	Very low	108 Å²	108	144.2 Å²	144.2	70%	0.701	76%	0.759	S	S	*	*			trans	-140.4	101.6	163.9	34.1	-15.1	0	0	0	116.6
377	Q	27.3	Very low	35.3	Very low	152 Å²	152	140.3 Å²	140.3	71%	0.71	75%	0.749	S	S	*	*				59.5	130.2	118.9	-74.3	-171.7	6.2	0	0	125
378	H	31.7	Very low	37.8	Very low	138 Å²	138	131.2 Å²	131.2	64%	0.639	72%	0.715	S	S	*	*			trans	67.7	148.2	144	-62.9	-49.7	0	0	0	119.8
379	H	29	Very low	40.1	Very low	158 Å²	158	132.5 Å²	132.5	73%	0.731	72%	0.715	S	S	*	*			cis	-169.3	-174.4	-5.1	-110.3	-33.5	0	0	0	107.9
380	P	44.6	Very low	42.2	Very low	103 Å²	103	128.5 Å²	128.5	67%	0.669	69%	0.687	S	S	*	*				-132.3	151.6	-53.1	38.1	-21.6	0	0	0	114.5
381	L	28.1	Very low	44	Very low	179 Å²	179	126.3 Å²	126.3	94%	0.937	68%	0.682	S	S	*	*			trans	-147.8	157.9	158.9	-89.3	-174.4	0	0	0	112.5
382	T	31.5	Very low	45.8	Very low	130 Å²	130	123.6 Å²	123.6	80%	0.798	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-78.9	149.4	-169.9	38.8	0	0	0	0	114.9
383	P	39	Very low	48.2	Very low	124 Å²	124	117.1 Å²	117.1	81%	0.805	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-78.8	139.7	-178.1	31.7	-35.2	0	0	0	113.2
384	A	39.3	Very low	50.2	Low	98 Å²	98	112.6 Å²	112.6	81%	0.81	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-82.3	140.3	169.1	0	0	0	0	0	111.4
385	N	49	Very low	52.4	Low	151 Å²	151	107.2 Å²	107.2	81%	0.807	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-66.2	138.9	179.2	-84.8	-38.8	0	0	0	112.3
386	P	58.1	Low	54.5	Low	92 Å²	92	104.3 Å²	104.3	60%	0.597	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-70.2	140.3	179.6	29.2	-35.2	0	0	0	112.2	V399	P386-V399 HydrophobicContact CB-CG2 4.13Å; P386-V399 HydrophobicContact CG-CG2 4.34Å; P386-V399 VanDerWaalsContact O-CG2 3.24Å; P386-V399 WeakPolarHBondContact O-CG2 3.48Å
387	T	75.4	Confident	55.9	Low	93 Å²	93	99.5 Å²	99.5	57%	0.571	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.2	161.3	176.4	55	0	0	0	0	110.6	N397	T387-N397 CarbonylContact C-O 3.57Å; T387-N397 VanDerWaalsContact CA-O 3.27Å; T387-N397 WeakPolarHBondContact CA-O 3.45Å; T387-N397 VanDerWaalsContact CB-O 3.25Å; T387-N397 WeakPolarHBondContact CB-O 3.28Å
388	W	76.6	Confident	58.2	Low	23 Å²	23	94.3 Å²	94.3	9%	0.087	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.3	142.3	176.4	66.7	-77.7	0	0	0	110.8	C390 P396 N397 A398 S401 C404 R411	W388-C390 HydrophobicContact CZ3-CB 4.25Å; W388-P396 CarbonylContact O-C 3.51Å; W388-P396 WeakPolarHBondContact O-CA 3.18Å; W388-N397 VanDerWaalsContact CD1-O 3.24Å; W388-N397 HydrophobicContact CD2-CB 4.43Å; W388-N397 HydrophobicContact CZ2-CB 4.01Å; W388-N397 PolarHBondContact N-O 2.92Å; W388-N397 PolarHBondContact O-N 2.98Å; W388-A398 VanDerWaalsContact CD1-O 3.29Å; W388-A398 PolarHBondContact NE1-O 2.91Å; W388-S401 WeakPolarHBondContact CZ2-O 3.48Å; W388-S401 PolarHBondContact NE1-O 2.85Å; W388-S401 VanDerWaalsContact NE1-O 3.14Å; W388-C404 HydrophobicContact CH2-CB 4.41Å; W388-R411 HydrophobicContact CD2-CB 4.39Å; W388-R411 HydrophobicContact CD2-CG 3.76Å; W388-R411 HydrophobicContact CE3-CB 4.2Å; W388-R411 HydrophobicContact CE3-CG 3.67Å; W388-R411 HydrophobicContact CG-CG 4.46Å; W388-R411 HydrophobicContact CH2-CB 3.56Å; W388-R411 HydrophobicContact CH2-CG 3.99Å; W388-R411 HydrophobicContact CZ2-CB 3.76Å; W388-R411 HydrophobicContact CZ2-CG 4.06Å; W388-R411 HydrophobicContact CZ3-CB 3.78Å; W388-R411 HydrophobicContact CZ3-CG 3.77Å
389	K	73.9	Confident	60	Low	158 Å²	158	90.6 Å²	90.6	69%	0.687	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.3	177.2	-68.6	-176.4	178.7	179.8	0	111.1	L395 P396	K389-L395 CarbonylContact C-O 3.44Å; K389-L395 WeakPolarHBondContact CA-O 3.35Å; K389-P396 HydrophobicContact CG-CB 4.49Å
390	C	71.7	Confident	61.9	Low	2 Å²	2	88.7 Å²	88.7	1%	0.014	55%	0.547	C	S	.	.			trans	-71.6	128	179.8	-178.8	0	0	0	0	111.8	W388 S392 C393 S394 L395 C404	W388-C390 HydrophobicContact CZ3-CB 4.25Å; C390-S392 PolarHBondContact O-N 3.41Å; C390-S392 VanDerWaalsContact O-N 3.16Å; C390-S392 PolarHBondContact SG-N 3.47Å; C390-C393 PolarHBondContact O-N 2.81Å; C390-S394 VanDerWaalsContact O-CA 3.28Å; C390-S394 WeakPolarHBondContact O-CA 3.39Å; C390-S394 PolarHBondContact O-N 3.5Å; C390-L395 PolarHBondContact N-O 2.75Å; C390-C404 HydrophobicContact CB-CB 3.73Å; C390-C404 VanDerWaalsContact SG-CB 3.53Å
391	P	63.9	Low	62.9	Low	97 Å²	97	85.4 Å²	85.4	63%	0.63	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.6	177.8	-25.6	34.8	0	0	0	115
392	S	65.7	Low	64.7	Low	83 Å²	83	80.1 Å²	80.1	58%	0.58	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-21.6	-176.5	-50.6	0	0	0	0	114.7	C390 S409	C390-S392 PolarHBondContact O-N 3.41Å; C390-S392 VanDerWaalsContact O-N 3.16Å; C390-S392 PolarHBondContact SG-N 3.47Å; S392-S409 WeakPolarHBondContact CB-OG 3.44Å; S392-S409 WeakPolarHBondContact OG-CB 3.39Å; S392-S409 PolarHBondContact OG-OG 2.8Å
393	C	77.6	Confident	66.8	Low	49 Å²	49	80.1 Å²	80.1	33%	0.331	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	6.2	-173.3	67.3	0	0	0	0	114.9	C390 L395 C404 C407	C390-C393 PolarHBondContact O-N 2.81Å; C393-L395 PolarHBondContact O-N 3.39Å; C393-C404 VanDerWaalsContact SG-SG 3.63Å; C393-C407 HydrophobicContact CB-CB 4.35Å; C393-C407 PolarHBondContact SG-SG 3.16Å
394	S	72.9	Confident	68.6	Low	89 Å²	89	74.2 Å²	74.2	62%	0.622	46%	0.459	S	S	*	.			trans	60.2	-4.5	177.6	-60	0	0	0	0	117.7	C390	C390-S394 VanDerWaalsContact O-CA 3.28Å; C390-S394 WeakPolarHBondContact O-CA 3.39Å; C390-S394 PolarHBondContact O-N 3.5Å
395	L	71.8	Confident	70.2	Confident	84 Å²	84	76.8 Å²	76.8	44%	0.44	45%	0.454	S	S	.	.			trans	-57.7	136.6	176	-75.3	171.4	0	0	0	111.6	K389 C390 C393 N397	K389-L395 CarbonylContact C-O 3.44Å; K389-L395 WeakPolarHBondContact CA-O 3.35Å; C390-L395 PolarHBondContact N-O 2.75Å; C393-L395 PolarHBondContact O-N 3.39Å; L395-N397 PolarHBondContact O-ND2 3.41Å
396	P	73.8	Confident	71.3	Confident	79 Å²	79	72.4 Å²	72.4	51%	0.513	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	141	170.2	32.2	-33.5	0	0	0	110.8	W388 K389	W388-P396 CarbonylContact O-C 3.51Å; W388-P396 WeakPolarHBondContact O-CA 3.18Å; K389-P396 HydrophobicContact CG-CB 4.49Å
397	N	73.9	Confident	71.9	Confident	7 Å²	7	70.4 Å²	70.4	4%	0.037	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	154.4	-179.9	-58.9	-100.7	0	0	0	109.6	T387 W388 L395 C404 E405	T387-N397 CarbonylContact C-O 3.57Å; T387-N397 VanDerWaalsContact CA-O 3.27Å; T387-N397 WeakPolarHBondContact CA-O 3.45Å; T387-N397 VanDerWaalsContact CB-O 3.25Å; T387-N397 WeakPolarHBondContact CB-O 3.28Å; W388-N397 VanDerWaalsContact CD1-O 3.24Å; W388-N397 HydrophobicContact CD2-CB 4.43Å; W388-N397 HydrophobicContact CZ2-CB 4.01Å; W388-N397 PolarHBondContact N-O 2.92Å; W388-N397 PolarHBondContact O-N 2.98Å; L395-N397 PolarHBondContact O-ND2 3.41Å; N397-C404 PolarHBondContact ND2-SG 2.98Å; N397-C404 VanDerWaalsContact ND2-SG 3.41Å; N397-C404 VanDerWaalsContact OD1-CA 3.23Å; N397-C404 WeakPolarHBondContact OD1-CA 3.08Å; N397-C404 PolarHBondContact OD1-SG 3.42Å; N397-E405 PolarHBondContact OD1-N 2.91Å
398	A	73.8	Confident	71.6	Confident	43 Å²	43	76 Å²	76	36%	0.355	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	141.6	176.6	0	0	0	0	0	112	W388 S400 S401	W388-A398 VanDerWaalsContact CD1-O 3.29Å; W388-A398 PolarHBondContact NE1-O 2.91Å; A398-S400 PolarHBondContact O-N 2.85Å; A398-S401 PolarHBondContact O-N 2.76Å
399	V	69.6	Low	70.9	Confident	61 Å²	61	76.6 Å²	76.6	37%	0.37	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-22.2	179.3	159.6	0	0	0	0	113.6	P386 R411	P386-V399 HydrophobicContact CB-CG2 4.13Å; P386-V399 HydrophobicContact CG-CG2 4.34Å; P386-V399 VanDerWaalsContact O-CG2 3.24Å; P386-V399 WeakPolarHBondContact O-CG2 3.48Å; V399-R411 PolarHBondContact O-NH1 2.98Å
400	S	69.2	Low	70.5	Confident	117 Å²	117	71.8 Å²	71.8	82%	0.818	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-21.1	171.2	49	0	0	0	0	114.2	A398	A398-S400 PolarHBondContact O-N 2.85Å
401	S	65.2	Low	69.8	Low	35 Å²	35	77 Å²	77	25%	0.245	46%	0.457	C	S	.	.			trans	-86.6	125.9	178.7	-171.2	0	0	0	0	111.9	W388 A398 K403	W388-S401 WeakPolarHBondContact CZ2-O 3.48Å; W388-S401 PolarHBondContact NE1-O 2.85Å; W388-S401 VanDerWaalsContact NE1-O 3.14Å; A398-S401 PolarHBondContact O-N 2.76Å; S401-K403 VanDerWaalsContact C-N 3.34Å; S401-K403 PolarHBondContact OG-N 3.28Å; S401-K403 PolarHBondContact OG-O 2.91Å
402	A	67.7	Low	69.5	Low	67 Å²	67	75.3 Å²	75.3	55%	0.554	45%	0.451	S	S	*	.	S	Bend	trans	-81.6	-9.3	176.2	0	0	0	0	0	113.9	R411	A402-R411 PolarHBondContact O-N 3.43Å
403	K	74.1	Confident	68.5	Low	130 Å²	130	73.7 Å²	73.7	57%	0.565	45%	0.447	S	S	*	.	B	Isolated β-bridge	trans	-137	146.5	-178.9	-64.2	-177.6	-178	178.8	0	110.5	S401 S409	S401-K403 VanDerWaalsContact C-N 3.34Å; S401-K403 PolarHBondContact OG-N 3.28Å; S401-K403 PolarHBondContact OG-O 2.91Å; K403-S409 CarbonylContact C-O 3.54Å; K403-S409 VanDerWaalsContact CA-O 3.3Å; K403-S409 WeakPolarHBondContact CA-O 3.15Å
404	C	78.3	Confident	66.9	Low	1 Å²	1	76.2 Å²	76.2	1%	0.007	47%	0.472	C	S	.	.			trans	-68.7	134.4	177.3	178.7	0	0	0	0	111.3	W388 C390 C393 N397 G406 R408 S409	W388-C404 HydrophobicContact CH2-CB 4.41Å; C390-C404 HydrophobicContact CB-CB 3.73Å; C390-C404 VanDerWaalsContact SG-CB 3.53Å; C393-C404 VanDerWaalsContact SG-SG 3.63Å; N397-C404 PolarHBondContact ND2-SG 2.98Å; N397-C404 VanDerWaalsContact ND2-SG 3.41Å; N397-C404 VanDerWaalsContact OD1-CA 3.23Å; N397-C404 WeakPolarHBondContact OD1-CA 3.08Å; N397-C404 PolarHBondContact OD1-SG 3.42Å; C404-G406 PolarHBondContact O-N 3.41Å; C404-R408 WeakPolarHBondContact O-CA 3.23Å; C404-R408 PolarHBondContact O-N 3.48Å; C404-S409 PolarHBondContact N-O 3.48Å
405	E	71.9	Confident	65.5	Low	151 Å²	151	77.3 Å²	77.3	71%	0.706	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-38.3	-178.3	-64.2	-179.4	150.8	0	0	112	N397	N397-E405 PolarHBondContact OD1-N 2.91Å
406	G	71.3	Confident	63.9	Low	59 Å²	59	77.8 Å²	77.8	61%	0.608	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-51.7	178.8	0	0	0	0	0	114.5	C404	C404-G406 PolarHBondContact O-N 3.41Å
407	C	72.1	Confident	62.4	Low	51 Å²	51	80.1 Å²	80.1	35%	0.345	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-0.7	-172.6	77.5	0	0	0	0	115.3	C393 S409	C393-C407 HydrophobicContact CB-CB 4.35Å; C393-C407 PolarHBondContact SG-SG 3.16Å; C407-S409 PolarHBondContact O-N 3.11Å; C407-S409 VanDerWaalsContact SG-CB 3.58Å; C407-S409 PolarHBondContact SG-OG 3.47Å
408	R	67.8	Low	60.6	Low	209 Å²	209	85.5 Å²	85.5	79%	0.789	51%	0.509	S	S	*	.			trans	59.4	2.2	-179.8	-57.7	-171.6	177.7	-150.4	-2.9	116.9	C404	C404-R408 WeakPolarHBondContact O-CA 3.23Å; C404-R408 PolarHBondContact O-N 3.48Å
409	S	63.4	Low	58.9	Low	36 Å²	36	88.1 Å²	88.1	25%	0.252	52%	0.516	S	S	.	.			trans	-54.6	140.2	169.3	-61.5	0	0	0	0	111.8	S392 K403 C404 C407	S392-S409 WeakPolarHBondContact CB-OG 3.44Å; S392-S409 WeakPolarHBondContact OG-CB 3.39Å; S392-S409 PolarHBondContact OG-OG 2.8Å; K403-S409 CarbonylContact C-O 3.54Å; K403-S409 VanDerWaalsContact CA-O 3.3Å; K403-S409 WeakPolarHBondContact CA-O 3.15Å; C404-S409 PolarHBondContact N-O 3.48Å; C407-S409 PolarHBondContact O-N 3.11Å; C407-S409 VanDerWaalsContact SG-CB 3.58Å; C407-S409 PolarHBondContact SG-OG 3.47Å
410	S	64.5	Low	57.3	Low	58 Å²	58	93.2 Å²	93.2	41%	0.406	55%	0.547	S	S	.	.	B	Isolated β-bridge	trans	-64.4	153.4	174	-176.6	0	0	0	0	112.2	A412	S410-A412 VanDerWaalsContact C-N 3.26Å; S410-A412 VanDerWaalsContact CB-O 3.31Å; S410-A412 WeakPolarHBondContact CB-O 3.19Å; S410-A412 PolarHBondContact OG-N 3.26Å; S410-A412 PolarHBondContact OG-O 3.27Å
411	R	57.9	Low	55.9	Low	111 Å²	111	90.6 Å²	90.6	42%	0.419	54%	0.538	S	S	.	.	S	Bend	trans	-66.4	-28.4	169.9	-173.9	168.6	-179.2	-174.8	-3.9	112.7	W388 V399 A402	W388-R411 HydrophobicContact CD2-CB 4.39Å; W388-R411 HydrophobicContact CD2-CG 3.76Å; W388-R411 HydrophobicContact CE3-CB 4.2Å; W388-R411 HydrophobicContact CE3-CG 3.67Å; W388-R411 HydrophobicContact CG-CG 4.46Å; W388-R411 HydrophobicContact CH2-CB 3.56Å; W388-R411 HydrophobicContact CH2-CG 3.99Å; W388-R411 HydrophobicContact CZ2-CB 3.76Å; W388-R411 HydrophobicContact CZ2-CG 4.06Å; W388-R411 HydrophobicContact CZ3-CB 3.78Å; W388-R411 HydrophobicContact CZ3-CG 3.77Å; V399-R411 PolarHBondContact O-NH1 2.98Å; A402-R411 PolarHBondContact O-N 3.43Å
412	A	56.3	Low	54.7	Low	61 Å²	61	95.3 Å²	95.3	50%	0.504	57%	0.57	S	S	.	*	S	Bend	trans	-86.7	126.9	166.4	0	0	0	0	0	109.5	S410	S410-A412 VanDerWaalsContact C-N 3.26Å; S410-A412 VanDerWaalsContact CB-O 3.31Å; S410-A412 WeakPolarHBondContact CB-O 3.19Å; S410-A412 PolarHBondContact OG-N 3.26Å; S410-A412 PolarHBondContact OG-O 3.27Å
413	G	45.5	Very low	53	Low	49 Å²	49	99.3 Å²	99.3	51%	0.505	58%	0.577	S	S	.	*			trans	-64.8	161.9	179	0	0	0	0	0	113.5	D415	G413-D415 PolarHBondContact O-N 3.41Å
414	A	43.8	Very low	51.2	Low	102 Å²	102	97.4 Å²	97.4	84%	0.843	58%	0.577	S	S	*	*	S	Bend	trans	-73.8	7.9	-163.6	0	0	0	0	0	116.9
415	D	44.1	Very low	49.3	Very low	112 Å²	112	101.6 Å²	101.6	60%	0.599	60%	0.602	S	S	*	*			trans	-113.8	36.4	-169.3	-59.9	-59.8	0	0	0	113.9	G413	G413-D415 PolarHBondContact O-N 3.41Å
416	L	36.7	Very low	47.7	Very low	94 Å²	94	103.1 Å²	103.1	49%	0.492	60%	0.601	S	S	.	*			trans	-127.2	133.3	173.3	-79.6	164.8	0	0	0	110.4	R426	L416-R426 HydrophobicContact CD2-CB 4.19Å
417	I	43.8	Very low	46	Very low	128 Å²	128	107 Å²	107	66%	0.656	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120.6	130	173.2	-59.7	177.9	0	0	0	107.3
418	D	35.3	Very low	44.4	Very low	121 Å²	121	109.7 Å²	109.7	65%	0.647	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.2	140.4	179.9	-164.1	12.2	0	0	0	110.6
419	L	37.8	Very low	42.9	Very low	97 Å²	97	104 Å²	104	51%	0.508	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120	134.8	177.5	-67.4	177.2	0	0	0	108.6	G421	L419-G421 VanDerWaalsContact C-N 3.35Å; L419-G421 PolarHBondContact O-N 3.19Å
420	V	36.4	Very low	41.5	Very low	168 Å²	168	107.2 Å²	107.2	100%	1.018	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	90.6	-172.8	-176.8	0	0	0	0	110.5
421	G	39.6	Very low	39.9	Very low	62 Å²	62	108.7 Å²	108.7	64%	0.639	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	146.3	40.1	-174.6	0	0	0	0	0	115.4	L419 E423	L419-G421 VanDerWaalsContact C-N 3.35Å; L419-G421 PolarHBondContact O-N 3.19Å; G421-E423 VanDerWaalsContact C-N 3.33Å; G421-E423 PolarHBondContact O-N 3.05Å; G421-E423 VanDerWaalsContact O-N 3.15Å
422	C	40.8	Very low	38.8	Very low	135 Å²	135	109.9 Å²	109.9	91%	0.912	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.1	21.7	166.1	-62.3	0	0	0	0	118.4
423	E	32.1	Very low	37.7	Very low	151 Å²	151	111.7 Å²	111.7	71%	0.706	68%	0.676	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-129.5	121.9	165.9	-71.6	-163.5	160.8	0	0	112.1	G421	G421-E423 VanDerWaalsContact C-N 3.33Å; G421-E423 PolarHBondContact O-N 3.05Å; G421-E423 VanDerWaalsContact O-N 3.15Å
424	T	35.7	Very low	37.1	Very low	90 Å²	90	111.5 Å²	111.5	55%	0.552	67%	0.668	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.6	123.1	174.6	58.3	0	0	0	0	110.7
425	V	37.7	Very low	36.8	Very low	88 Å²	88	112.1 Å²	112.1	53%	0.533	66%	0.663	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	132.3	-176.1	-176.1	0	0	0	0	111.3
426	R	38.8	Very low	36.8	Very low	183 Å²	183	111.6 Å²	111.6	69%	0.691	66%	0.66	S	S	*	*			trans	-92	113.7	179.2	-169.2	177.9	-168.9	159	3.5	111	L416	L416-R426 HydrophobicContact CD2-CB 4.19Å
427	F	35.4	Very low	37.6	Very low	142 Å²	142	116 Å²	116	62%	0.623	68%	0.676	S	S	*	*			trans	-75.5	127.1	179.6	-178.8	-103.1	0	0	0	111.7	P429	F427-P429 HydrophobicContact CE1-CG 3.87Å; F427-P429 HydrophobicContact CZ-CG 4.4Å
428	T	39.2	Very low	38.3	Very low	107 Å²	107	113.2 Å²	113.2	66%	0.656	67%	0.668	S	S	*	*			trans	-137	121.5	174.7	-46.6	0	0	0	0	109.5
429	P	35.8	Very low	40.2	Very low	90 Å²	90	109.8 Å²	109.8	58%	0.584	65%	0.651	S	S	*	*			trans	-69.6	131.5	-177.3	-20.4	32.4	0	0	0	113.9	F427 S431	F427-P429 HydrophobicContact CE1-CG 3.87Å; F427-P429 HydrophobicContact CZ-CG 4.4Å; P429-S431 PolarHBondContact O-N 2.73Å
430	A	34	Very low	42	Very low	102 Å²	102	106.5 Å²	106.5	84%	0.843	63%	0.632	S	S	*	*	S	Bend	trans	-91.8	61.4	-178.6	0	0	0	0	0	113.8
431	S	31.2	Very low	43.7	Very low	89 Å²	89	101.5 Å²	101.5	62%	0.622	61%	0.608	S	S	*	*			trans	178.5	139.9	155	-85.1	0	0	0	0	112	P429 S433	P429-S431 PolarHBondContact O-N 2.73Å; S431-S433 VanDerWaalsContact C-N 3.29Å; S431-S433 PolarHBondContact O-N 2.9Å
432	P	34.6	Very low	45.1	Very low	137 Å²	137	98.6 Å²	98.6	89%	0.89	58%	0.578	S	S	*	*	S	Bend	trans	-84.8	16.6	-177.9	35.6	-37.2	0	0	0	114.9	S434	P432-S434 PolarHBondContact O-N 3.09Å
433	S	34.3	Very low	46.1	Very low	98 Å²	98	96.1 Å²	96.1	69%	0.685	56%	0.562	S	S	*	*			trans	-101.4	41.4	-168.2	45.8	0	0	0	0	114.7	S431	S431-S433 VanDerWaalsContact C-N 3.29Å; S431-S433 PolarHBondContact O-N 2.9Å
434	S	32.2	Very low	47.2	Very low	46 Å²	46	94.8 Å²	94.8	32%	0.322	55%	0.554	S	S	.	*			trans	-158	119.3	170.5	-171.4	0	0	0	0	109.7	P432 D436 R448	P432-S434 PolarHBondContact O-N 3.09Å; S434-D436 VanDerWaalsContact C-N 3.34Å; S434-R448 PolarHBondContact OG-NH1 3.31Å
435	P	37.9	Very low	48.5	Very low	114 Å²	114	91 Å²	91	74%	0.74	53%	0.532	S	S	*	.	S	Bend	trans	-75.3	-24	178	30.6	-34.6	0	0	0	112.8
436	D	43.4	Very low	49.7	Very low	102 Å²	102	91.3 Å²	91.3	55%	0.545	53%	0.534	S	S	.	.			trans	-87.5	111.3	-177.4	-70.3	-56.3	0	0	0	112.9	S434 S438	S434-D436 VanDerWaalsContact C-N 3.34Å; D436-S438 PolarHBondContact O-N 3.43Å
437	F	53.8	Low	51.1	Low	187 Å²	187	86 Å²	86	82%	0.82	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	5.4	170.6	-64.4	-89.8	0	0	0	113.6	T451	F437-T451 PolarHBondContact O-OG1 3.06Å
438	S	59.2	Low	52.9	Low	69 Å²	69	85.9 Å²	85.9	48%	0.483	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.1	-172.4	63.6	0	0	0	0	115	D436 P450 T451	D436-S438 PolarHBondContact O-N 3.43Å; S438-P450 CarbonylContact O-C 3.58Å; S438-P450 WeakPolarHBondContact O-CA 3.31Å; S438-T451 WeakPolarHBondContact CA-OG1 3.3Å; S438-T451 PolarHBondContact O-N 3.45Å; S438-T451 PolarHBondContact O-OG1 2.81Å
439	T	74.8	Confident	54.6	Low	48 Å²	48	80.9 Å²	80.9	29%	0.294	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.5	179.1	58.8	0	0	0	0	115	R448 N449 T451	T439-R448 PolarHBondContact OG1-NH1 3.29Å; T439-N449 CarbonylContact C-O 3.5Å; T439-N449 WeakPolarHBondContact CA-O 3.17Å; T439-N449 WeakPolarHBondContact CB-O 3.22Å; T439-T451 PolarHBondContact N-OG1 3.25Å; T439-T451 VanDerWaalsContact N-OG1 3.09Å
440	W	74.3	Confident	56.6	Low	28 Å²	28	80.2 Å²	80.2	11%	0.106	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.9	168.1	65.5	-77.8	0	0	0	110.9	C442 R448 N449 P450 T453 C456 K463	W440-C442 HydrophobicContact CH2-CB 4.47Å; W440-C442 HydrophobicContact CZ3-CB 4.01Å; W440-R448 CarbonylContact O-C 3.55Å; W440-R448 WeakPolarHBondContact O-CA 3.45Å; W440-N449 HydrophobicContact CD2-CB 4.29Å; W440-N449 HydrophobicContact CZ2-CB 3.97Å; W440-N449 PolarHBondContact N-O 2.85Å; W440-N449 PolarHBondContact O-N 3.03Å; W440-P450 VanDerWaalsContact CD1-O 3.23Å; W440-P450 PolarHBondContact NE1-O 3.49Å; W440-P450 VanDerWaalsContact NE1-O 3.17Å; W440-T453 WeakPolarHBondContact CZ2-O 3.28Å; W440-T453 PolarHBondContact NE1-O 2.79Å; W440-C456 HydrophobicContact CH2-CB 4.07Å; W440-K463 HydrophobicContact CD2-CB 4.2Å; W440-K463 HydrophobicContact CD2-CD 4.05Å; W440-K463 HydrophobicContact CD2-CG 3.68Å; W440-K463 HydrophobicContact CE3-CB 4.18Å; W440-K463 HydrophobicContact CE3-CG 3.85Å; W440-K463 HydrophobicContact CG-CD 4.03Å; W440-K463 HydrophobicContact CG-CG 4.08Å; W440-K463 HydrophobicContact CH2-CB 3.92Å; W440-K463 HydrophobicContact CH2-CG 4.45Å; W440-K463 HydrophobicContact CZ2-CB 3.91Å; W440-K463 HydrophobicContact CZ2-CG 4.3Å; W440-K463 VanDerWaalsContact CZ3-CA 3.48Å; W440-K463 HydrophobicContact CZ3-CB 4.05Å; W440-K463 HydrophobicContact CZ3-CG 4.24Å
441	A	73.4	Confident	58.5	Low	63 Å²	63	78.1 Å²	78.1	52%	0.521	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	134.9	176	0	0	0	0	0	111.3	S443 R448	A441-S443 PolarHBondContact O-N 2.8Å; A441-R448 HydrophobicContact CB-CG 4.44Å
442	C	69.1	Low	60.2	Low	1 Å²	1	77.5 Å²	77.5	1%	0.007	46%	0.463	C	S	.	.			trans	-75	119.7	-180	-178.5	0	0	0	0	112.1	W440 K444 C445 T446 L447 C456	W440-C442 HydrophobicContact CH2-CB 4.47Å; W440-C442 HydrophobicContact CZ3-CB 4.01Å; C442-K444 PolarHBondContact O-N 3.36Å; C442-C445 PolarHBondContact O-N 2.88Å; C442-T446 WeakPolarHBondContact O-CA 3.21Å; C442-T446 PolarHBondContact O-N 3.18Å; C442-L447 PolarHBondContact N-O 3.25Å; C442-C456 HydrophobicContact CB-CB 3.8Å; C442-C456 VanDerWaalsContact SG-CB 3.5Å
443	S	60.7	Low	62	Low	83 Å²	83	73.3 Å²	73.3	58%	0.58	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-32.1	177.2	53.3	0	0	0	0	114.2	A441 H465	A441-S443 PolarHBondContact O-N 2.8Å; S443-H465 WeakPolarHBondContact CB-O 3.45Å; S443-H465 PolarHBondContact OG-O 2.94Å
444	K	54.8	Low	63.5	Low	123 Å²	123	73.1 Å²	73.1	54%	0.535	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.8	-174.9	-146.6	170.7	-163.8	162.5	0	115.3	C442 S461 H465	C442-K444 PolarHBondContact O-N 3.36Å; K444-S461 VanDerWaalsContact CD-OG 3.22Å; K444-S461 WeakPolarHBondContact CD-OG 3.27Å; K444-H465 PolarHBondContact NZ-NE2 2.98Å
445	C	64.4	Low	65.7	Low	12 Å²	12	77.5 Å²	77.5	8%	0.081	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-157.7	15.1	-179.5	69	0	0	0	0	115.8	C442 L447 C456 C459 L538	C442-C445 PolarHBondContact O-N 2.88Å; C445-L447 PolarHBondContact O-N 3.12Å; C445-C456 PolarHBondContact SG-SG 3.14Å; C445-C459 HydrophobicContact CB-CB 4.43Å; C445-C459 PolarHBondContact SG-SG 3.09Å; C445-L538 HydrophobicContact CB-CD1 4.41Å
446	T	62.3	Low	67.6	Low	94 Å²	94	72.2 Å²	72.2	58%	0.577	41%	0.41	S	S	*	.			trans	54.4	-8.9	179.1	63.2	0	0	0	0	118.6	C442 R448	C442-T446 WeakPolarHBondContact O-CA 3.21Å; C442-T446 PolarHBondContact O-N 3.18Å; T446-R448 PolarHBondContact O-N 3.48Å
447	L	68.6	Low	68.7	Low	70 Å²	70	72.1 Å²	72.1	37%	0.366	42%	0.418	S	S	.	.			trans	-53.7	129.8	177.7	-175.2	68.2	0	0	0	112.3	C442 C445 N449 S457 A458	C442-L447 PolarHBondContact N-O 3.25Å; C445-L447 PolarHBondContact O-N 3.12Å; L447-N449 PolarHBondContact O-ND2 2.85Å; L447-S457 WeakPolarHBondContact CD2-OG 3.41Å; L447-A458 HydrophobicContact CD2-CB 3.62Å
448	R	73.6	Confident	69.2	Low	140 Å²	140	66.7 Å²	66.7	53%	0.528	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	127.2	170.2	-75.1	-173.4	177.6	-126.4	9.2	110.6	S434 T439 W440 A441 T446	S434-R448 PolarHBondContact OG-NH1 3.31Å; T439-R448 PolarHBondContact OG1-NH1 3.29Å; W440-R448 CarbonylContact O-C 3.55Å; W440-R448 WeakPolarHBondContact O-CA 3.45Å; A441-R448 HydrophobicContact CB-CG 4.44Å; T446-R448 PolarHBondContact O-N 3.48Å
449	N	73.8	Confident	69.4	Low	3 Å²	3	65.9 Å²	65.9	2%	0.016	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.8	-179.4	-72	-95.3	0	0	0	109.2	T439 W440 L447 C456 S457	T439-N449 CarbonylContact C-O 3.5Å; T439-N449 WeakPolarHBondContact CA-O 3.17Å; T439-N449 WeakPolarHBondContact CB-O 3.22Å; W440-N449 HydrophobicContact CD2-CB 4.29Å; W440-N449 HydrophobicContact CZ2-CB 3.97Å; W440-N449 PolarHBondContact N-O 2.85Å; W440-N449 PolarHBondContact O-N 3.03Å; L447-N449 PolarHBondContact O-ND2 2.85Å; N449-C456 PolarHBondContact ND2-SG 2.86Å; N449-C456 WeakPolarHBondContact OD1-CA 3.49Å; N449-S457 PolarHBondContact OD1-N 3.4Å; N449-S457 PolarHBondContact OD1-OG 3.23Å
450	P	78.8	Confident	68.9	Low	76 Å²	76	65.8 Å²	65.8	49%	0.494	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	144.1	178.7	-25.4	35	0	0	0	113.3	S438 W440 G452 T453	S438-P450 CarbonylContact O-C 3.58Å; S438-P450 WeakPolarHBondContact O-CA 3.31Å; W440-P450 VanDerWaalsContact CD1-O 3.23Å; W440-P450 PolarHBondContact NE1-O 3.49Å; W440-P450 VanDerWaalsContact NE1-O 3.17Å; P450-G452 PolarHBondContact O-N 2.8Å; P450-T453 HydrophobicContact CB-CG2 4.34Å; P450-T453 HydrophobicContact CG-CG2 4.41Å; P450-T453 PolarHBondContact O-N 2.88Å; P450-T453 PolarHBondContact O-OG1 2.95Å
451	T	74.2	Confident	68.8	Low	58 Å²	58	65.2 Å²	65.2	36%	0.356	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-31.4	-174.3	-54.2	0	0	0	0	113.7	F437 S438 T439 K463	F437-T451 PolarHBondContact O-OG1 3.06Å; S438-T451 WeakPolarHBondContact CA-OG1 3.3Å; S438-T451 PolarHBondContact O-N 3.45Å; S438-T451 PolarHBondContact O-OG1 2.81Å; T439-T451 PolarHBondContact N-OG1 3.25Å; T439-T451 VanDerWaalsContact N-OG1 3.09Å; T451-K463 PolarHBondContact O-NZ 2.92Å
452	G	65.8	Low	68.8	Low	75 Å²	75	64.5 Å²	64.5	77%	0.773	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.6	177	0	0	0	0	0	116.3	P450 P454	P450-G452 PolarHBondContact O-N 2.8Å; G452-P454 WeakPolarHBondContact O-CD 3.37Å
453	T	71.8	Confident	68.6	Low	50 Å²	50	67.8 Å²	67.8	31%	0.307	42%	0.415	S	S	.	.			trans	-86.1	120.9	173.9	59.7	0	0	0	0	110.2	W440 P450 K455	W440-T453 WeakPolarHBondContact CZ2-O 3.28Å; W440-T453 PolarHBondContact NE1-O 2.79Å; P450-T453 HydrophobicContact CB-CG2 4.34Å; P450-T453 HydrophobicContact CG-CG2 4.41Å; P450-T453 PolarHBondContact O-N 2.88Å; P450-T453 PolarHBondContact O-OG1 2.95Å; T453-K455 VanDerWaalsContact C-N 3.3Å; T453-K455 PolarHBondContact O-N 2.89Å
454	P	67.4	Low	68.4	Low	94 Å²	94	69 Å²	69	61%	0.61	42%	0.415	S	S	*	.	S	Bend	trans	-81.7	-6.9	-174.5	32.4	-36.6	0	0	0	113.9	G452 S462 K463	G452-P454 WeakPolarHBondContact O-CD 3.37Å; P454-S462 WeakPolarHBondContact O-CA 3.44Å; P454-K463 PolarHBondContact O-N 3.01Å
455	K	78.3	Confident	68	Low	137 Å²	137	65.8 Å²	65.8	60%	0.596	40%	0.402	S	S	*	.	B	Isolated β-bridge	trans	-137.2	146.7	-179.8	-65.3	-179.4	-178.7	179.1	0	110	T453 S461	T453-K455 VanDerWaalsContact C-N 3.3Å; T453-K455 PolarHBondContact O-N 2.89Å; K455-S461 CarbonylContact C-O 3.57Å; K455-S461 WeakPolarHBondContact CA-O 3.43Å
456	C	77.6	Confident	66.9	Low	3 Å²	3	68.4 Å²	68.4	2%	0.02	43%	0.431	C	S	.	.			trans	-69.7	131.4	178	176.1	0	0	0	0	111.3	W440 C442 C445 N449 A458 C459 G460 S461	W440-C456 HydrophobicContact CH2-CB 4.07Å; C442-C456 HydrophobicContact CB-CB 3.8Å; C442-C456 VanDerWaalsContact SG-CB 3.5Å; C445-C456 PolarHBondContact SG-SG 3.14Å; N449-C456 PolarHBondContact ND2-SG 2.86Å; N449-C456 WeakPolarHBondContact OD1-CA 3.49Å; C456-A458 VanDerWaalsContact C-N 3.33Å; C456-A458 PolarHBondContact O-N 3.28Å; C456-C459 VanDerWaalsContact SG-SG 3.66Å; C456-G460 VanDerWaalsContact O-CA 3.28Å; C456-G460 WeakPolarHBondContact O-CA 3.25Å; C456-G460 PolarHBondContact O-N 2.94Å; C456-S461 PolarHBondContact N-O 3.18Å
457	S	66.9	Low	65.8	Low	101 Å²	101	73.2 Å²	73.2	71%	0.706	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-32.9	-177.9	58	0	0	0	0	113.9	L447 N449	L447-S457 WeakPolarHBondContact CD2-OG 3.41Å; N449-S457 PolarHBondContact OD1-N 3.4Å; N449-S457 PolarHBondContact OD1-OG 3.23Å
458	A	64.2	Low	64.3	Low	73 Å²	73	78 Å²	78	60%	0.603	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-33.9	-177.1	0	0	0	0	0	114.6	L447 C456	L447-A458 HydrophobicContact CD2-CB 3.62Å; C456-A458 VanDerWaalsContact C-N 3.33Å; C456-A458 PolarHBondContact O-N 3.28Å
459	C	61.9	Low	62.2	Low	52 Å²	52	79.4 Å²	79.4	35%	0.351	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	1.8	-173.1	75.5	0	0	0	0	114.8	C445 C456 S461	C445-C459 HydrophobicContact CB-CB 4.43Å; C445-C459 PolarHBondContact SG-SG 3.09Å; C456-C459 VanDerWaalsContact SG-SG 3.66Å; C459-S461 PolarHBondContact O-N 2.73Å; C459-S461 VanDerWaalsContact SG-CB 3.59Å; C459-S461 PolarHBondContact SG-OG 3.27Å
460	G	66.1	Low	60.1	Low	46 Å²	46	88.1 Å²	88.1	47%	0.474	52%	0.518	S	S	.	.			trans	66.8	-3.9	179	0	0	0	0	0	116	C456	C456-G460 VanDerWaalsContact O-CA 3.28Å; C456-G460 WeakPolarHBondContact O-CA 3.25Å; C456-G460 PolarHBondContact O-N 2.94Å
461	S	71	Confident	57.6	Low	15 Å²	15	93.2 Å²	93.2	11%	0.105	54%	0.535	C	S	.	.			trans	-69.6	139.7	-175.5	-62.1	0	0	0	0	111.4	K444 K455 C456 C459	K444-S461 VanDerWaalsContact CD-OG 3.22Å; K444-S461 WeakPolarHBondContact CD-OG 3.27Å; K455-S461 CarbonylContact C-O 3.57Å; K455-S461 WeakPolarHBondContact CA-O 3.43Å; C456-S461 PolarHBondContact N-O 3.18Å; C459-S461 PolarHBondContact O-N 2.73Å; C459-S461 VanDerWaalsContact SG-CB 3.59Å; C459-S461 PolarHBondContact SG-OG 3.27Å
462	S	74.3	Confident	55.4	Low	49 Å²	49	96.6 Å²	96.6	34%	0.343	56%	0.556	S	S	.	*	B	Isolated β-bridge	trans	-68.5	155.4	-177.9	53.6	0	0	0	0	112.7	P454 L464 H465	P454-S462 WeakPolarHBondContact O-CA 3.44Å; S462-L464 PolarHBondContact O-N 2.91Å; S462-H465 WeakPolarHBondContact O-CB 3.34Å; S462-H465 PolarHBondContact O-N 3.41Å; S462-H465 VanDerWaalsContact O-N 3.09Å; S462-H465 PolarHBondContact OG-N 3.46Å
463	K	64.8	Low	53.7	Low	69 Å²	69	99.2 Å²	99.2	30%	0.3	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.9	-14.2	173.3	-170.4	171.7	-178.5	-169.6	0	114.3	W440 T451 P454	W440-K463 HydrophobicContact CD2-CB 4.2Å; W440-K463 HydrophobicContact CD2-CD 4.05Å; W440-K463 HydrophobicContact CD2-CG 3.68Å; W440-K463 HydrophobicContact CE3-CB 4.18Å; W440-K463 HydrophobicContact CE3-CG 3.85Å; W440-K463 HydrophobicContact CG-CD 4.03Å; W440-K463 HydrophobicContact CG-CG 4.08Å; W440-K463 HydrophobicContact CH2-CB 3.92Å; W440-K463 HydrophobicContact CH2-CG 4.45Å; W440-K463 HydrophobicContact CZ2-CB 3.91Å; W440-K463 HydrophobicContact CZ2-CG 4.3Å; W440-K463 VanDerWaalsContact CZ3-CA 3.48Å; W440-K463 HydrophobicContact CZ3-CB 4.05Å; W440-K463 HydrophobicContact CZ3-CG 4.24Å; T451-K463 PolarHBondContact O-NZ 2.92Å; P454-K463 PolarHBondContact O-N 3.01Å
464	L	55.5	Low	51.5	Low	108 Å²	108	104.9 Å²	104.9	57%	0.565	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	10	-179.7	-56.7	176.7	0	0	0	113.3	S462 G466 F467	S462-L464 PolarHBondContact O-N 2.91Å; L464-G466 PolarHBondContact O-N 2.72Å; L464-F467 PolarHBondContact O-N 3.2Å; L464-F467 VanDerWaalsContact O-N 3.12Å
465	H	47.3	Very low	49.7	Very low	56 Å²	56	105 Å²	105	26%	0.259	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.3	101.4	178.5	-164.7	-40.1	0	0	0	110	S443 K444 S462	S443-H465 WeakPolarHBondContact CB-O 3.45Å; S443-H465 PolarHBondContact OG-O 2.94Å; K444-H465 PolarHBondContact NZ-NE2 2.98Å; S462-H465 WeakPolarHBondContact O-CB 3.34Å; S462-H465 PolarHBondContact O-N 3.41Å; S462-H465 VanDerWaalsContact O-N 3.09Å; S462-H465 PolarHBondContact OG-N 3.46Å
466	G	41.8	Very low	47.4	Very low	68 Å²	68	110.3 Å²	110.3	70%	0.701	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	146	-20.3	-169.7	0	0	0	0	0	113.8	L464	L464-G466 PolarHBondContact O-N 2.72Å
467	F	37.3	Very low	45.1	Very low	195 Å²	195	116.2 Å²	116.2	86%	0.855	65%	0.652	S	S	*	*	S	Bend	trans	-113.2	-0	-178.6	-86	-82.7	0	0	0	115.5	L464	L464-F467 PolarHBondContact O-N 3.2Å; L464-F467 VanDerWaalsContact O-N 3.12Å
468	Q	38.9	Very low	43.2	Very low	169 Å²	169	116.6 Å²	116.6	79%	0.79	65%	0.653	S	S	*	*			trans	-148.4	82.3	-175.7	-165.5	169.6	52.1	0	0	112.1
469	E	29.3	Very low	42	Very low	171 Å²	171	119 Å²	119	80%	0.799	66%	0.663	S	S	*	*			trans	-143	43.5	169.8	-155.8	151.7	-138.6	0	0	112
470	Q	29.1	Very low	40.8	Very low	185 Å²	185	125 Å²	125	86%	0.864	69%	0.685	S	S	*	*			trans	-123.2	104.7	155	-83.6	-167.8	-14.2	0	0	109.4
471	Q	26.1	Very low	39.3	Very low	184 Å²	184	129 Å²	129	86%	0.86	70%	0.704	S	S	*	*			trans	-127.6	96.7	156.7	-78.1	-170.5	-14.9	0	0	107.6
472	T	27.3	Very low	37.6	Very low	128 Å²	128	131.2 Å²	131.2	79%	0.785	73%	0.73	S	S	*	*			trans	-67.8	140	164	34.4	0	0	0	0	109.2	L474	T472-L474 PolarHBondContact O-N 3.08Å
473	P	31.6	Very low	35.5	Very low	131 Å²	131	135.3 Å²	135.3	85%	0.851	76%	0.758	S	S	*	*			trans	-76.6	110.2	-171.7	29.1	-34.2	0	0	0	111.6
474	L	25.6	Very low	34.1	Very low	168 Å²	168	136.6 Å²	136.6	88%	0.88	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.4	143.7	165.9	-76.7	170.9	0	0	0	110.9	T472	T472-L474 PolarHBondContact O-N 3.08Å
475	A	29	Very low	32.9	Very low	97 Å²	97	136.7 Å²	136.7	80%	0.802	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.8	143.6	-171.3	0	0	0	0	0	113.3
476	R	30.7	Very low	32	Very low	249 Å²	249	139.8 Å²	139.8	94%	0.94	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-102.6	121.4	165.8	-75.1	-176.8	172.6	179.2	-2.6	110
477	C	28.1	Very low	31.4	Very low	126 Å²	126	141.1 Å²	141.1	85%	0.851	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84.3	166.3	164.1	-71.2	0	0	0	0	111.4
478	C	28.1	Very low	30.8	Very low	110 Å²	110	137.6 Å²	137.6	74%	0.743	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.1	138.7	-170.1	-167.2	0	0	0	0	112.9	H480	C478-H480 VanDerWaalsContact C-N 3.27Å; C478-H480 PolarHBondContact O-N 3.12Å
479	P	37.2	Very low	30.8	Very low	123 Å²	123	135.3 Å²	135.3	80%	0.799	82%	0.815	S	S	*	*	S	Bend	trans	-84.4	41.9	-172.4	36.5	-39.6	0	0	0	114.4
480	H	37.7	Very low	32	Very low	177 Å²	177	132.8 Å²	132.8	82%	0.819	81%	0.814	S	S	*	*	S	Bend	trans	-149.2	35.8	-173.3	-120.7	56	0	0	0	118.4	C478	C478-H480 VanDerWaalsContact C-N 3.27Å; C478-H480 PolarHBondContact O-N 3.12Å
481	C	33.8	Very low	31.9	Very low	130 Å²	130	129.7 Å²	129.7	88%	0.878	81%	0.812	S	S	*	*			trans	-160.4	165.7	153.9	55.5	0	0	0	0	110.9
482	G	36.1	Very low	32	Very low	62 Å²	62	126.3 Å²	126.3	64%	0.639	81%	0.809	S	S	*	*			trans	-143.2	163.1	176.6	0	0	0	0	0	112.3
483	S	30.8	Very low	32.2	Very low	135 Å²	135	126.3 Å²	126.3	94%	0.944	81%	0.809	S	S	*	*	S	Bend	trans	67.3	171.6	-168.8	80.1	0	0	0	0	114.8
484	A	34.7	Very low	32.8	Very low	97 Å²	97	125.3 Å²	125.3	80%	0.802	80%	0.802	S	S	*	*			trans	-144.5	133.7	-158.2	0	0	0	0	0	114.8
485	S	31.1	Very low	33.1	Very low	109 Å²	109	123 Å²	123	76%	0.762	80%	0.8	S	S	*	*			trans	-176.5	146.9	154.4	55.3	0	0	0	0	111.3
486	C	27.4	Very low	33	Very low	122 Å²	122	122 Å²	122	82%	0.824	80%	0.799	S	S	*	*			trans	49.8	154.8	141.3	-64.3	0	0	0	0	122.2
487	S	29.7	Very low	33.1	Very low	96 Å²	96	119 Å²	119	67%	0.671	80%	0.795	S	S	*	*			cis	-170.9	153.3	-12.5	-96.6	0	0	0	0	112.1
488	C	24.9	Very low	33.2	Very low	120 Å²	120	122.7 Å²	122.7	81%	0.811	80%	0.797	S	S	*	*			trans	71.1	160.9	147.2	-67.4	0	0	0	0	122.4
489	P	37.7	Very low	33.4	Very low	122 Å²	122	122 Å²	122	79%	0.792	80%	0.799	S	S	*	*			trans	-127	-123.4	-150	30.3	-3.1	0	0	0	117.3
490	P	55.6	Low	33.1	Very low	118 Å²	118	127 Å²	127	77%	0.766	80%	0.802	S	S	*	*				-131.8	157.2	-112.5	41.8	-24.1	0	0	0	119.4
491	S	26.5	Very low	32.7	Very low	119 Å²	119	126.1 Å²	126.1	83%	0.832	80%	0.796	S	S	*	*			trans	-172.4	155	165.9	52.9	0	0	0	0	110.3
492	S	27.7	Very low	32.3	Very low	113 Å²	113	127.6 Å²	127.6	79%	0.79	79%	0.79	S	S	*	*			cis	-165.4	161.6	-11	48.3	0	0	0	0	110.7
493	T	32.4	Very low	31.8	Very low	128 Å²	128	129.7 Å²	129.7	79%	0.785	80%	0.801	S	S	*	*			trans	-70.9	176.8	165.5	41.1	0	0	0	0	111.2
494	P	44.9	Very low	31.6	Very low	111 Å²	111	134.8 Å²	134.8	72%	0.721	80%	0.8	S	S	*	*			cis	-157.5	-173.3	32.4	45.9	-23	0	0	0	121.6
495	S	31	Very low	31.1	Very low	119 Å²	119	137 Å²	137	83%	0.832	80%	0.803	S	S	*	*			trans	100.6	142.5	141.7	80.4	0	0	0	0	120.7
496	G	27	Very low	30.7	Very low	76 Å²	76	140.7 Å²	140.7	78%	0.784	81%	0.805	S	S	*	*			trans	155	81.8	178.8	0	0	0	0	0	114.5
497	H	33.4	Very low	31.2	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.856	80%	0.803	S	S	*	*			trans	-77.9	160.2	176.6	-65.5	-73.4	0	0	0	112
498	K	29.8	Very low	30.9	Very low	205 Å²	205	141 Å²	141	89%	0.891	81%	0.806	S	S	*	*				-162.4	168.6	59.8	-75.4	174.1	-179.2	172.7	0	113.8
499	A	32.1	Very low	31	Very low	95 Å²	95	139.5 Å²	139.5	79%	0.785	80%	0.803	S	S	*	*			trans	-79.4	-176.9	174.8	0	0	0	0	0	112.3
500	R	29.7	Very low	30.4	Very low	229 Å²	229	139 Å²	139	86%	0.864	81%	0.809	S	S	*	*			cis	-173	142.3	40.8	-161.3	-174.3	-169.1	-169.9	4.8	113.9
501	K	29.8	Very low	28.9	Very low	158 Å²	158	137.3 Å²	137.3	69%	0.687	81%	0.813	S	S	*	*			trans	45	127.7	151.8	-78.1	-172.2	163.7	-140.1	0	123.8
502	Q	26.4	Very low	28.9	Very low	161 Å²	161	136.2 Å²	136.2	75%	0.752	81%	0.811	S	S	*	*				47.9	120.6	125.1	-56.5	177.8	-67.5	0	0	121.8
503	A	24.9	Very low	28.7	Very low	105 Å²	105	136 Å²	136	87%	0.868	81%	0.81	S	S	*	*				-162.1	160.2	125.4	0	0	0	0	0	111.7
504	R	26.2	Very low	28.5	Very low	242 Å²	242	135.6 Å²	135.6	91%	0.913	81%	0.812	S	S	*	*			trans	-88.2	157.8	165.3	-68.2	172.6	170	161.6	-5.7	109.6
505	V	24.9	Very low	27.6	Very low	144 Å²	144	133.8 Å²	133.8	87%	0.873	81%	0.814	S	S	*	*				178.3	145.9	125.1	145.9	0	0	0	0	110.9
506	F	23	Very low	27.4	Very low	186 Å²	186	134.6 Å²	134.6	82%	0.816	82%	0.819	S	S	*	*			trans	-86.3	157.7	173.8	-97.5	-81.8	0	0	0	109.9
507	P	36.7	Very low	27.4	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	82%	0.819	S	S	*	*				-153.5	-179	65	41.1	-19.4	0	0	0	118.3
508	S	24.6	Very low	27.1	Very low	104 Å²	104	132.4 Å²	132.4	73%	0.727	82%	0.819	S	S	*	*			trans	-51	172.9	160	-40.6	0	0	0	0	112.9
509	A	26.9	Very low	27	Very low	90 Å²	90	128.4 Å²	128.4	74%	0.744	82%	0.817	S	S	*	*			cis	-168.1	174.6	28.9	0	0	0	0	0	113.5
510	A	25	Very low	26.7	Very low	111 Å²	111	129.5 Å²	129.5	92%	0.917	81%	0.814	S	S	*	*			trans	65.5	167.1	153.8	0	0	0	0	0	118.7
511	G	24.8	Very low	26.6	Very low	82 Å²	82	127.2 Å²	127.2	85%	0.845	82%	0.818	S	S	*	*			trans	125.1	107.6	179.8	0	0	0	0	0	112.3
512	A	24.8	Very low	26.6	Very low	97 Å²	97	124.8 Å²	124.8	80%	0.802	82%	0.821	S	S	*	*			trans	-99.4	178.3	-179.3	0	0	0	0	0	112.6
513	S	25.1	Very low	26.5	Very low	109 Å²	109	120.8 Å²	120.8	76%	0.762	82%	0.823	S	S	*	*			trans	92.3	129.4	157.2	78.5	0	0	0	0	120.2
514	S	27.3	Very low	26.7	Very low	118 Å²	118	124.1 Å²	124.1	83%	0.825	83%	0.825	S	S	*	*			trans	35.8	118.2	144.1	54.7	0	0	0	0	121.5
515	G	25.3	Very low	26.9	Very low	74 Å²	74	122 Å²	122	76%	0.763	83%	0.826	S	S	*	*			trans	-175.1	95.7	159.3	0	0	0	0	0	112.3
516	S	27.8	Very low	27.3	Very low	135 Å²	135	124 Å²	124	94%	0.944	83%	0.825	S	S	*	*			trans	-96.3	107.9	177.7	-66	0	0	0	0	111.4
517	S	26.4	Very low	27.8	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	83%	0.827	S	S	*	*			trans	-156.2	85	170	42.9	0	0	0	0	111.4	S519	S517-S519 PolarHBondContact O-N 2.9Å
518	A	26.7	Very low	28.5	Very low	103 Å²	103	124 Å²	124	85%	0.851	83%	0.833	S	S	*	*			trans	-78.5	116.4	169.4	0	0	0	0	0	109.9
519	S	27.8	Very low	30.3	Very low	120 Å²	120	120.7 Å²	120.7	84%	0.839	82%	0.815	S	S	*	*			trans	-85.1	112.6	169.4	41.2	0	0	0	0	110.3	S517	S517-S519 PolarHBondContact O-N 2.9Å
520	T	27.1	Very low	32.5	Very low	119 Å²	119	121.8 Å²	121.8	73%	0.73	81%	0.805	S	S	*	*			trans	-72.1	134.2	179.2	-38.5	0	0	0	0	111.3
521	L	27.7	Very low	34.9	Very low	181 Å²	181	117.3 Å²	117.3	95%	0.948	77%	0.765	S	S	*	*			trans	-125.7	112.2	156.6	-104.1	167.8	0	0	0	109.1
522	S	29.1	Very low	37.3	Very low	107 Å²	107	116.5 Å²	116.5	75%	0.748	75%	0.746	S	S	*	*			trans	-94.9	144.1	-168.4	-49.9	0	0	0	0	111.4
523	G	24.5	Very low	39.4	Very low	77 Å²	77	111.9 Å²	111.9	79%	0.794	71%	0.708	S	S	*	*			trans	-162.1	28.1	-171.2	0	0	0	0	0	118.7
524	L	29.6	Very low	41.1	Very low	175 Å²	175	109.8 Å²	109.8	92%	0.916	69%	0.691	S	S	*	*			trans	-162.7	135.6	162.5	-106.6	165.5	0	0	0	109.8	E526	L524-E526 PolarHBondContact O-N 2.7Å
525	Q	30.7	Very low	42.4	Very low	198 Å²	198	107.5 Å²	107.5	93%	0.925	68%	0.68	S	S	*	*			trans	-88.6	104.1	-179.1	-80.3	-177.1	-34.8	0	0	111.9
526	E	32	Very low	44.4	Very low	184 Å²	184	105.8 Å²	105.8	86%	0.86	66%	0.655	S	S	*	*			trans	-71.2	143.2	159.6	-68	-169	125.4	0	0	110.8	L524 A528	L524-E526 PolarHBondContact O-N 2.7Å; E526-A528 VanDerWaalsContact C-N 3.34Å; E526-A528 PolarHBondContact O-N 2.81Å
527	K	34.9	Very low	46.3	Very low	198 Å²	198	104.4 Å²	104.4	86%	0.861	64%	0.642	S	S	*	*			trans	-74.5	87.4	168.2	-80.7	-174.1	173.2	-177.1	0	109.9	G529	K527-G529 PolarHBondContact O-N 3.47Å; K527-G529 VanDerWaalsContact O-N 3.1Å
528	A	51.3	Low	48.4	Very low	110 Å²	110	100.5 Å²	100.5	91%	0.909	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	112.7	173.7	0	0	0	0	0	110.8	E526	E526-A528 VanDerWaalsContact C-N 3.34Å; E526-A528 PolarHBondContact O-N 2.81Å
529	G	60.7	Low	51	Low	34 Å²	34	100.2 Å²	100.2	35%	0.351	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	154.4	-2.8	-178.2	0	0	0	0	0	116.7	K527 V542	K527-G529 PolarHBondContact O-N 3.47Å; K527-G529 VanDerWaalsContact O-N 3.1Å; G529-V542 WeakPolarHBondContact O-CB 3.48Å; G529-V542 WeakPolarHBondContact O-CG2 3.3Å; G529-V542 PolarHBondContact O-N 3.33Å
530	Q	73.9	Confident	53.5	Low	113 Å²	113	94.9 Å²	94.9	53%	0.528	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.7	157.5	-178.4	-66.7	178.3	-17.3	0	0	113.3	N540	Q530-N540 CarbonylContact C-O 3.44Å; Q530-N540 WeakPolarHBondContact CA-O 3.24Å; Q530-N540 WeakPolarHBondContact CB-O 3.31Å
531	W	75.9	Confident	56.1	Low	17 Å²	17	93.4 Å²	93.4	6%	0.064	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.9	173.6	66.2	-77.8	0	0	0	111.5	C533 N540 D541 A544 C547 Q554 L557	W531-C533 HydrophobicContact CZ3-CB 4.34Å; W531-N540 HydrophobicContact CD2-CB 4.16Å; W531-N540 HydrophobicContact CG-CB 4.4Å; W531-N540 HydrophobicContact CZ2-CB 3.88Å; W531-N540 PolarHBondContact N-O 3.12Å; W531-N540 PolarHBondContact O-N 3.42Å; W531-D541 PolarHBondContact NE1-O 2.93Å; W531-A544 VanDerWaalsContact CZ2-O 3.27Å; W531-A544 WeakPolarHBondContact CZ2-O 3.24Å; W531-A544 PolarHBondContact NE1-O 3.44Å; W531-C547 HydrophobicContact CH2-CB 4.18Å; W531-Q554 HydrophobicContact CD2-CB 4.27Å; W531-Q554 HydrophobicContact CD2-CG 3.8Å; W531-Q554 HydrophobicContact CE3-CB 4.49Å; W531-Q554 HydrophobicContact CE3-CG 4.25Å; W531-Q554 HydrophobicContact CG-CG 4.17Å; W531-Q554 HydrophobicContact CH2-CB 3.87Å; W531-Q554 HydrophobicContact CH2-CG 4.46Å; W531-Q554 HydrophobicContact CZ2-CB 3.61Å; W531-Q554 HydrophobicContact CZ2-CG 4.03Å; W531-Q554 HydrophobicContact CZ3-CB 4.29Å; W531-Q554 VanDerWaalsContact NE1-NE2 3.2Å; W531-L557 HydrophobicContact CB-CD1 4.13Å; W531-L557 HydrophobicContact CD2-CD1 4.33Å; W531-L557 HydrophobicContact CE3-CD1 3.66Å; W531-L557 HydrophobicContact CZ3-CD1 4.48Å
532	S	75.1	Confident	58.5	Low	64 Å²	64	88.5 Å²	88.5	45%	0.448	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.3	175	49.6	0	0	0	0	111.4	L538	S532-L538 CarbonylContact C-O 3.57Å; S532-L538 WeakPolarHBondContact CA-O 3.49Å
533	C	69.1	Low	60.7	Low	1 Å²	1	92.3 Å²	92.3	1%	0.007	53%	0.526	C	S	.	.			trans	-69.5	126.9	175.2	-179.7	0	0	0	0	110.7	W531 A535 C536 T537 L538 C547 C550	W531-C533 HydrophobicContact CZ3-CB 4.34Å; C533-A535 PolarHBondContact O-N 3.13Å; C533-A535 PolarHBondContact SG-N 3.25Å; C533-C536 VanDerWaalsContact SG-SG 3.69Å; C533-T537 WeakPolarHBondContact O-CA 3.43Å; C533-T537 PolarHBondContact O-N 2.9Å; C533-L538 PolarHBondContact N-O 2.79Å; C533-C547 HydrophobicContact CB-CB 4.01Å; C533-C550 PolarHBondContact SG-SG 3.39Å
534	P	61.2	Low	63.3	Low	64 Å²	64	90.3 Å²	90.3	42%	0.416	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.9	179.9	28.2	-35	0	0	0	114	T552 Y556	P534-T552 HydrophobicContact CG-CG2 4.27Å; P534-Y556 HydrophobicContact CG-CD1 4.15Å
535	A	53.8	Low	65.7	Low	70 Å²	70	89.5 Å²	89.5	58%	0.579	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-29.1	-178.8	0	0	0	0	0	114.3	C533 T552	C533-A535 PolarHBondContact O-N 3.13Å; C533-A535 PolarHBondContact SG-N 3.25Å; A535-T552 HydrophobicContact CB-CG2 4.3Å; A535-T552 WeakPolarHBondContact CB-OG1 3.41Å
536	C	67	Low	68	Low	38 Å²	38	84.1 Å²	84.1	26%	0.257	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	14	-176	70.8	0	0	0	0	114.8	C533 L538 C550	C533-C536 VanDerWaalsContact SG-SG 3.69Å; C536-L538 PolarHBondContact O-N 3.13Å; C536-C550 PolarHBondContact SG-SG 2.88Å
537	T	66.9	Low	70.2	Confident	107 Å²	107	75.4 Å²	75.4	66%	0.656	43%	0.427	S	S	*	.			trans	55.7	-9.7	-179.2	65.5	0	0	0	0	118.1	C533 L539	C533-T537 WeakPolarHBondContact O-CA 3.43Å; C533-T537 PolarHBondContact O-N 2.9Å; T537-L539 PolarHBondContact O-N 3.16Å
538	L	72.3	Confident	72.2	Confident	30 Å²	30	69.8 Å²	69.8	16%	0.157	42%	0.418	C	S	.	.			trans	-47.5	130.7	178.7	-177.1	69.2	0	0	0	112.3	C445 S532 C533 C536 N540 A548 A549	C445-L538 HydrophobicContact CB-CD1 4.41Å; S532-L538 CarbonylContact C-O 3.57Å; S532-L538 WeakPolarHBondContact CA-O 3.49Å; C533-L538 PolarHBondContact N-O 2.79Å; C536-L538 PolarHBondContact O-N 3.13Å; L538-N540 PolarHBondContact O-N 3.34Å; L538-N540 PolarHBondContact O-ND2 3.36Å; L538-A548 HydrophobicContact CD2-CB 4.16Å; L538-A549 HydrophobicContact CD2-CB 3.75Å
539	L	80.3	Confident	73.2	Confident	98 Å²	98	67.9 Å²	67.9	51%	0.513	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	112.9	170.3	-66.1	172.3	0	0	0	109.7	T537	T537-L539 PolarHBondContact O-N 3.16Å
540	N	80.2	Confident	73.4	Confident	8 Å²	8	68.6 Å²	68.6	4%	0.043	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	155.7	178.6	-61.5	-90.5	0	0	0	109.8	Q530 W531 L538 A544 C547 A548	Q530-N540 CarbonylContact C-O 3.44Å; Q530-N540 WeakPolarHBondContact CA-O 3.24Å; Q530-N540 WeakPolarHBondContact CB-O 3.31Å; W531-N540 HydrophobicContact CD2-CB 4.16Å; W531-N540 HydrophobicContact CG-CB 4.4Å; W531-N540 HydrophobicContact CZ2-CB 3.88Å; W531-N540 PolarHBondContact N-O 3.12Å; W531-N540 PolarHBondContact O-N 3.42Å; L538-N540 PolarHBondContact O-N 3.34Å; L538-N540 PolarHBondContact O-ND2 3.36Å; N540-A544 HydrophobicContact CB-CB 4.41Å; N540-C547 PolarHBondContact ND2-SG 3.46Å; N540-C547 VanDerWaalsContact ND2-SG 3.44Å; N540-C547 VanDerWaalsContact OD1-CA 3.31Å; N540-C547 WeakPolarHBondContact OD1-CA 3.39Å; N540-C547 PolarHBondContact OD1-SG 2.78Å; N540-A548 PolarHBondContact OD1-N 3.33Å
541	D	81	Confident	73.4	Confident	88 Å²	88	69.8 Å²	69.8	47%	0.471	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	142.4	173.4	-170.5	-72.3	0	0	0	111.3	W531 K543 A544	W531-D541 PolarHBondContact NE1-O 2.93Å; D541-K543 PolarHBondContact O-N 3.15Å; D541-K543 VanDerWaalsContact O-N 3.12Å; D541-K543 VanDerWaalsContact OD1-CB 3.27Å; D541-K543 WeakPolarHBondContact OD1-CB 3.5Å; D541-K543 WeakPolarHBondContact OD1-CG 3.35Å; D541-K543 PolarHBondContact OD1-N 2.96Å; D541-A544 HydrophobicContact CB-CB 4.42Å; D541-A544 VanDerWaalsContact O-CB 3.26Å; D541-A544 WeakPolarHBondContact O-CB 3.29Å; D541-A544 PolarHBondContact O-N 2.85Å
542	V	78.6	Confident	73.1	Confident	78 Å²	78	70.8 Å²	70.8	47%	0.473	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-22.5	177.6	157.1	0	0	0	0	113.5	G529 Q554	G529-V542 WeakPolarHBondContact O-CB 3.48Å; G529-V542 WeakPolarHBondContact O-CG2 3.3Å; G529-V542 PolarHBondContact O-N 3.33Å; V542-Q554 PolarHBondContact O-NE2 3.37Å
543	K	76.6	Confident	73.3	Confident	187 Å²	187	69.5 Å²	69.5	81%	0.813	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-16.4	172.7	-59.7	173.5	-177.3	174.3	0	113.4	D541 K545	D541-K543 PolarHBondContact O-N 3.15Å; D541-K543 VanDerWaalsContact O-N 3.12Å; D541-K543 VanDerWaalsContact OD1-CB 3.27Å; D541-K543 WeakPolarHBondContact OD1-CB 3.5Å; D541-K543 WeakPolarHBondContact OD1-CG 3.35Å; D541-K543 PolarHBondContact OD1-N 2.96Å; K543-K545 PolarHBondContact O-N 2.85Å
544	A	78.1	Confident	73.3	Confident	35 Å²	35	71.9 Å²	71.9	29%	0.289	42%	0.419	S	S	.	.			trans	-77	106.1	-179.7	0	0	0	0	0	110.8	W531 N540 D541 N546	W531-A544 VanDerWaalsContact CZ2-O 3.27Å; W531-A544 WeakPolarHBondContact CZ2-O 3.24Å; W531-A544 PolarHBondContact NE1-O 3.44Å; N540-A544 HydrophobicContact CB-CB 4.41Å; D541-A544 HydrophobicContact CB-CB 4.42Å; D541-A544 VanDerWaalsContact O-CB 3.26Å; D541-A544 WeakPolarHBondContact O-CB 3.29Å; D541-A544 PolarHBondContact O-N 2.85Å; A544-N546 PolarHBondContact O-N 3.43Å
545	K	79.5	Confident	73.2	Confident	158 Å²	158	75.8 Å²	75.8	69%	0.687	43%	0.432	S	S	*	.	S	Bend	trans	-65.5	-18	179	-65.2	-178	179.8	178	0	114	K543 A553 Q554	K543-K545 PolarHBondContact O-N 2.85Å; K545-A553 CarbonylContact O-C 3.57Å; K545-A553 WeakPolarHBondContact O-CA 3.43Å; K545-Q554 WeakPolarHBondContact O-CB 3.3Å; K545-Q554 PolarHBondContact O-N 3.43Å
546	N	79.9	Confident	73.3	Confident	84 Å²	84	78.8 Å²	78.8	45%	0.449	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-137.6	150.4	-177.4	-66	80.3	0	0	0	109.3	A544 H551 T552	A544-N546 PolarHBondContact O-N 3.43Å; N546-H551 PolarHBondContact ND2-O 3.43Å; N546-T552 CarbonylContact C-O 3.52Å; N546-T552 WeakPolarHBondContact CA-O 3.5Å
547	C	78.9	Confident	72.5	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.007	43%	0.432	C	S	.	.			trans	-66.7	134.8	175.9	179.9	0	0	0	0	111.7	W531 C533 N540 A549 H551 T552	W531-C547 HydrophobicContact CH2-CB 4.18Å; C533-C547 HydrophobicContact CB-CB 4.01Å; N540-C547 PolarHBondContact ND2-SG 3.46Å; N540-C547 VanDerWaalsContact ND2-SG 3.44Å; N540-C547 VanDerWaalsContact OD1-CA 3.31Å; N540-C547 WeakPolarHBondContact OD1-CA 3.39Å; N540-C547 PolarHBondContact OD1-SG 2.78Å; C547-A549 VanDerWaalsContact C-N 3.29Å; C547-A549 PolarHBondContact O-N 3.23Å; C547-H551 WeakPolarHBondContact O-CA 3.46Å; C547-H551 PolarHBondContact O-N 2.68Å; C547-H551 PolarHBondContact O-ND1 2.92Å; C547-T552 PolarHBondContact N-O 2.99Å
548	A	76.8	Confident	71.6	Confident	80 Å²	80	79.7 Å²	79.7	66%	0.661	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.7	-179.6	0	0	0	0	0	114.2	L538 N540	L538-A548 HydrophobicContact CD2-CB 4.16Å; N540-A548 PolarHBondContact OD1-N 3.33Å
549	A	70.8	Confident	70.4	Confident	71 Å²	71	84.6 Å²	84.6	59%	0.587	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-29.6	-178.4	0	0	0	0	0	115	L538 C547	L538-A549 HydrophobicContact CD2-CB 3.75Å; C547-A549 VanDerWaalsContact C-N 3.29Å; C547-A549 PolarHBondContact O-N 3.23Å
550	C	66.3	Low	68.8	Low	49 Å²	49	85.7 Å²	85.7	33%	0.331	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.3	9.3	-175.6	70	0	0	0	0	114.6	C533 C536 T552	C533-C550 PolarHBondContact SG-SG 3.39Å; C536-C550 PolarHBondContact SG-SG 2.88Å; C550-T552 PolarHBondContact O-N 2.77Å; C550-T552 PolarHBondContact SG-OG1 2.86Å
551	H	72.2	Confident	66.7	Low	138 Å²	138	93.8 Å²	93.8	64%	0.639	49%	0.489	S	S	*	.			trans	57.3	1.9	176.1	-52.2	-52	0	0	0	117.5	N546 C547 A553	N546-H551 PolarHBondContact ND2-O 3.43Å; C547-H551 WeakPolarHBondContact O-CA 3.46Å; C547-H551 PolarHBondContact O-N 2.68Å; C547-H551 PolarHBondContact O-ND1 2.92Å; H551-A553 PolarHBondContact O-N 2.82Å
552	T	71.3	Confident	64.7	Low	38 Å²	38	96.4 Å²	96.4	23%	0.233	51%	0.508	C	S	.	.			trans	-52.3	130	173.3	-52	0	0	0	0	111.1	P534 A535 N546 C547 C550	P534-T552 HydrophobicContact CG-CG2 4.27Å; A535-T552 HydrophobicContact CB-CG2 4.3Å; A535-T552 WeakPolarHBondContact CB-OG1 3.41Å; N546-T552 CarbonylContact C-O 3.52Å; N546-T552 WeakPolarHBondContact CA-O 3.5Å; C547-T552 PolarHBondContact N-O 2.99Å; C550-T552 PolarHBondContact O-N 2.77Å; C550-T552 PolarHBondContact SG-OG1 2.86Å
553	A	78.2	Confident	62.8	Low	37 Å²	37	98 Å²	98	31%	0.306	52%	0.517	S	S	.	.	B	Isolated β-bridge	trans	-72.6	138.9	-174.3	0	0	0	0	0	113	K545 H551 Q555 Y556	K545-A553 CarbonylContact O-C 3.57Å; K545-A553 WeakPolarHBondContact O-CA 3.43Å; H551-A553 PolarHBondContact O-N 2.82Å; A553-Q555 PolarHBondContact O-N 3.12Å; A553-Y556 VanDerWaalsContact O-CB 3.29Å; A553-Y556 WeakPolarHBondContact O-CB 3.25Å; A553-Y556 PolarHBondContact O-N 2.61Å
554	Q	69	Low	60.9	Low	51 Å²	51	98 Å²	98	24%	0.238	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.2	175.8	-174	-174.5	49.7	0	0	112.5	W531 V542 K545 Y556 L557	W531-Q554 HydrophobicContact CD2-CB 4.27Å; W531-Q554 HydrophobicContact CD2-CG 3.8Å; W531-Q554 HydrophobicContact CE3-CB 4.49Å; W531-Q554 HydrophobicContact CE3-CG 4.25Å; W531-Q554 HydrophobicContact CG-CG 4.17Å; W531-Q554 HydrophobicContact CH2-CB 3.87Å; W531-Q554 HydrophobicContact CH2-CG 4.46Å; W531-Q554 HydrophobicContact CZ2-CB 3.61Å; W531-Q554 HydrophobicContact CZ2-CG 4.03Å; W531-Q554 HydrophobicContact CZ3-CB 4.29Å; W531-Q554 VanDerWaalsContact NE1-NE2 3.2Å; V542-Q554 PolarHBondContact O-NE2 3.37Å; K545-Q554 WeakPolarHBondContact O-CB 3.3Å; K545-Q554 PolarHBondContact O-N 3.43Å; Q554-Y556 PolarHBondContact O-N 2.93Å; Q554-L557 PolarHBondContact O-N 2.92Å
555	Q	60.2	Low	59	Low	146 Å²	146	102.3 Å²	102.3	68%	0.682	54%	0.542	S	S	*	.	H	α-helix	trans	-59.7	-17.4	-180	-68.1	177.8	-20.8	0	0	113.7	A553 L557 T558	A553-Q555 PolarHBondContact O-N 3.12Å; Q555-L557 PolarHBondContact O-N 3.02Å; Q555-T558 WeakPolarHBondContact CA-OG1 3.13Å; Q555-T558 PolarHBondContact O-N 3.24Å; Q555-T558 PolarHBondContact O-OG1 2.67Å
556	Y	55.9	Low	57.4	Low	133 Å²	133	98.5 Å²	98.5	52%	0.522	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-26.2	173.9	-147.8	-93.6	0	0	0	112.8	P534 A553 Q554	P534-Y556 HydrophobicContact CG-CD1 4.15Å; A553-Y556 VanDerWaalsContact O-CB 3.29Å; A553-Y556 WeakPolarHBondContact O-CB 3.25Å; A553-Y556 PolarHBondContact O-N 2.61Å; Q554-Y556 PolarHBondContact O-N 2.93Å
557	L	49.5	Very low	56.1	Low	61 Å²	61	104 Å²	104	32%	0.319	55%	0.549	S	S	.	.	H	α-helix	trans	-74.7	-35.9	175.4	-72.4	173	0	0	0	112.9	W531 Q554 Q555 L559 R560	W531-L557 HydrophobicContact CB-CD1 4.13Å; W531-L557 HydrophobicContact CD2-CD1 4.33Å; W531-L557 HydrophobicContact CE3-CD1 3.66Å; W531-L557 HydrophobicContact CZ3-CD1 4.48Å; Q554-L557 PolarHBondContact O-N 2.92Å; Q555-L557 PolarHBondContact O-N 3.02Å; L557-L559 PolarHBondContact O-N 2.96Å; L557-R560 PolarHBondContact O-N 3.42Å; L557-R560 VanDerWaalsContact O-N 3.12Å
558	T	47.8	Very low	55.9	Low	102 Å²	102	109.6 Å²	109.6	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-62.3	-28.6	-177.9	11.2	0	0	0	0	113.2	Q555	Q555-T558 WeakPolarHBondContact CA-OG1 3.13Å; Q555-T558 PolarHBondContact O-N 3.24Å; Q555-T558 PolarHBondContact O-OG1 2.67Å
559	L	48.2	Very low	56.2	Low	134 Å²	134	110.4 Å²	110.4	70%	0.702	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-12.7	177.3	-78.6	163	0	0	0	114.5	L557	L557-L559 PolarHBondContact O-N 2.96Å
560	R	45.3	Very low	57.1	Low	121 Å²	121	112.2 Å²	112.2	46%	0.457	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.7	-0.5	-176.2	-80	-172.2	164.7	-165.3	-4.9	115.2	L557 V562 N976	L557-R560 PolarHBondContact O-N 3.42Å; L557-R560 VanDerWaalsContact O-N 3.12Å; R560-V562 VanDerWaalsContact C-N 3.29Å; R560-V562 PolarHBondContact O-N 3.11Å; R560-V562 VanDerWaalsContact O-N 3.16Å; R560-N976 PolarHBondContact NE-OD1 3.41Å; R560-N976 PolarHBondContact NH2-OD1 3.08Å
561	K	36.4	Very low	58.3	Low	178 Å²	178	109.9 Å²	109.9	77%	0.774	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-1.5	-172.5	-85	-166.6	172.9	-171.8	0	117.4
562	V	38.4	Very low	59.3	Low	143 Å²	143	105.9 Å²	105.9	87%	0.867	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-13.1	-171.8	-177.7	0	0	0	0	113.8	R560	R560-V562 VanDerWaalsContact C-N 3.29Å; R560-V562 PolarHBondContact O-N 3.11Å; R560-V562 VanDerWaalsContact O-N 3.16Å
563	V	39.8	Very low	60.4	Low	112 Å²	112	108.2 Å²	108.2	68%	0.679	53%	0.527	S	S	*	.	S	Bend	trans	-119.5	145.9	-179.7	-173.6	0	0	0	0	109.9
564	K	37.2	Very low	61.1	Low	187 Å²	187	107.3 Å²	107.3	81%	0.813	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-53.2	135.9	173.5	-66.2	172.2	-177	167.1	0	109.4	L566	K564-L566 PolarHBondContact O-N 3.37Å; K564-L566 VanDerWaalsContact O-N 3.1Å
565	P	38.3	Very low	62.1	Low	124 Å²	124	106.4 Å²	106.4	81%	0.805	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-62	118.1	-178.6	24.7	-33.3	0	0	0	110.4	K567	P565-K567 PolarHBondContact O-N 3.34Å
566	L	44.6	Very low	63.6	Low	79 Å²	79	101.4 Å²	101.4	41%	0.414	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-61.5	129.9	172.9	-62.9	173.1	0	0	0	108.6	K564 R568	K564-L566 PolarHBondContact O-N 3.37Å; K564-L566 VanDerWaalsContact O-N 3.1Å; L566-R568 VanDerWaalsContact C-N 3.31Å; L566-R568 PolarHBondContact O-N 2.75Å
567	K	53.2	Low	65.2	Low	199 Å²	199	97.1 Å²	97.1	87%	0.865	48%	0.479	S	S	*	.			trans	-76.9	82.4	178.9	-72.9	-170.8	175.6	-173.6	0	110	P565 R569	P565-K567 PolarHBondContact O-N 3.34Å; K567-R569 PolarHBondContact O-N 3.15Å
568	R	73.6	Confident	67.2	Low	119 Å²	119	95.5 Å²	95.5	45%	0.449	47%	0.469	S	S	.	.			trans	-55.2	123.2	165.2	-164	-177.9	-167.3	-152.6	6.4	108.5	L566 T934 M1059 E1061	L566-R568 VanDerWaalsContact C-N 3.31Å; L566-R568 PolarHBondContact O-N 2.75Å; R568-T934 PolarHBondContact NH2-OG1 3.45Å; R568-M1059 HydrophobicContact CG-CB 4.32Å; R568-M1059 HydrophobicContact CG-CE 4.18Å; R568-E1061 HydrophobicContact CB-CB 4.38Å; R568-E1061 HydrophobicContact CG-CB 4.38Å
569	R	84.3	Confident	69.3	Low	96 Å²	96	98.3 Å²	98.3	36%	0.362	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.2	-172.3	-179.8	173.3	-176.6	173.7	11.2	110	K567 V914 R915 V1060	K567-R569 PolarHBondContact O-N 3.15Å; R569-V914 HydrophobicContact CG-CG2 4.06Å; R569-R915 PolarHBondContact NH1-O 3.23Å; R569-V1060 PolarHBondContact N-O 3.26Å; R569-V1060 PolarHBondContact O-N 3.39Å
570	E	89.2	Confident	71.3	Confident	109 Å²	109	96.3 Å²	96.3	51%	0.509	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	141.8	169.5	-76	165.1	-134.8	0	0	110.6	Q1057 M1059	E570-Q1057 PolarHBondContact OE2-NE2 2.92Å; E570-M1059 HydrophobicContact CG-CE 3.5Å; E570-M1059 VanDerWaalsContact CG-CE 3.5Å; E570-M1059 HydrophobicContact CG-SD 3.58Å; E570-M1059 VanDerWaalsContact CG-SD 3.58Å
571	S	92.6	Very high	73.4	Confident	1 Å²	1	92 Å²	92	1%	0.007	44%	0.444	C	S	.	.			trans	-68.1	147.9	160.7	64.6	0	0	0	0	110.5	Q912 V1058	S571-Q912 WeakPolarHBondContact OG-CB 3.01Å; S571-V1058 PolarHBondContact N-O 3.15Å; S571-V1058 PolarHBondContact OG-N 3.45Å; S571-V1058 PolarHBondContact OG-O 3.05Å
572	M	92.6	Very high	76.1	Confident	53 Å²	53	85.1 Å²	85.1	26%	0.261	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.3	-176.9	65.8	-171.4	-61.5	0	0	111	V574 R577 Q912 E913	M572-V574 PolarHBondContact O-N 2.81Å; M572-R577 HydrophobicContact CE-CB 4.01Å; M572-R577 HydrophobicContact CE-CG 4.28Å; M572-R577 HydrophobicContact CG-CB 4.21Å; M572-R577 HydrophobicContact SD-CB 4.07Å; M572-R577 HydrophobicContact SD-CG 3.99Å; M572-Q912 VanDerWaalsContact CA-OE1 3.32Å; M572-Q912 CarbonylContact O-C 3.59Å; M572-Q912 VanDerWaalsContact O-CA 3.32Å; M572-Q912 WeakPolarHBondContact O-CA 3.38Å; M572-E913 PolarHBondContact N-O 3.05Å; M572-E913 PolarHBondContact O-N 3.12Å
573	H	94.3	Very high	78.5	Confident	87 Å²	87	80.2 Å²	80.2	40%	0.403	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	134.5	-179	-77.9	-79.6	0	0	0	111.7	E575 A576 R577 D910 W911 Q912	H573-E575 PolarHBondContact O-N 3.42Å; H573-A576 HydrophobicContact CB-CB 3.94Å; H573-A576 WeakPolarHBondContact O-CA 3.41Å; H573-A576 WeakPolarHBondContact O-CB 3.41Å; H573-A576 PolarHBondContact O-N 2.94Å; H573-R577 PolarHBondContact O-N 2.86Å; H573-D910 PolarHBondContact CE1-O 2.91Å; H573-D910 PolarHBondContact ND1-O 3.06Å; H573-W911 WeakPolarHBondContact CA-O 3.38Å; H573-Q912 PolarHBondContact CD2-NE2 2.92Å; H573-Q912 PolarHBondContact CE1-NE2 2.68Å; H573-Q912 PolarHBondContact ND1-NE2 2.81Å; H573-Q912 PolarHBondContact NE2-NE2 3.15Å
574	V	91.9	Very high	80.9	Confident	19 Å²	19	81.9 Å²	81.9	12%	0.115	39%	0.394	C	S	.	.	H	α-helix	trans	-53	-44.6	180	176.4	0	0	0	0	110.9	M572 A576 R577 R578 W911 E913 Y1053	M572-V574 PolarHBondContact O-N 2.81Å; V574-A576 PolarHBondContact O-N 2.82Å; V574-R577 PolarHBondContact O-N 3.16Å; V574-R578 PolarHBondContact O-N 3.36Å; V574-W911 PolarHBondContact N-O 2.94Å; V574-E913 HydrophobicContact CG2-CB 3.98Å; V574-E913 HydrophobicContact CG2-CG 3.98Å; V574-Y1053 HydrophobicContact CG2-CD1 4.08Å; V574-Y1053 HydrophobicContact CG2-CE1 3.7Å
575	E	91.3	Very high	83.5	Confident	32 Å²	32	73.3 Å²	73.3	15%	0.15	36%	0.358	C	S	.	.	H	α-helix	trans	-68.5	-29.1	176.5	-75.7	-61	130.8	0	0	114.3	H573 R578 R579 R685	H573-E575 PolarHBondContact O-N 3.42Å; E575-R578 IonicContact OE1-NE 3.23Å; E575-R578 PolarHBondContact OE1-NE 3.4Å; E575-R578 IonicContact OE2-CZ 2.99Å; E575-R578 VanDerWaalsContact OE2-CZ 3.23Å; E575-R578 IonicContact OE2-NE 2.91Å; E575-R578 PolarHBondContact OE2-NE 3.28Å; E575-R578 IonicContact OE2-NH2 2.87Å; E575-R578 PolarHBondContact OE2-NH2 3.03Å; E575-R579 WeakPolarHBondContact O-CD 3.45Å; E575-R579 VanDerWaalsContact O-CG 3.23Å; E575-R579 WeakPolarHBondContact O-CG 3.47Å; E575-R579 PolarHBondContact O-N 3.26Å; E575-R579 PolarHBondContact O-NE 3.03Å; E575-R685 WeakPolarHBondContact OE1-CD 3.3Å; E575-R685 IonicContact OE1-CZ 3.73Å; E575-R685 IonicContact OE1-NE 3.6Å; E575-R685 IonicContact OE1-NH1 2.72Å; E575-R685 PolarHBondContact OE1-NH1 3.04Å
576	A	91.3	Very high	86.1	Confident	40 Å²	40	72.3 Å²	72.3	33%	0.331	34%	0.341	S	S	.	.	H	α-helix	trans	-72.8	-40	173.4	0	0	0	0	0	110.7	H573 V574 R579 N580	H573-A576 HydrophobicContact CB-CB 3.94Å; H573-A576 WeakPolarHBondContact O-CA 3.41Å; H573-A576 WeakPolarHBondContact O-CB 3.41Å; H573-A576 PolarHBondContact O-N 2.94Å; V574-A576 PolarHBondContact O-N 2.82Å; A576-R579 PolarHBondContact O-N 2.85Å; A576-N580 PolarHBondContact O-N 2.94Å; A576-N580 PolarHBondContact O-OD1 3.03Å
577	R	89.9	Confident	88.3	Confident	43 Å²	43	74.8 Å²	74.8	16%	0.162	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-48.2	174.4	-163.6	-146.9	171.3	108.5	5.7	111.5	M572 H573 V574 R579 N580 D581 E913	M572-R577 HydrophobicContact CE-CB 4.01Å; M572-R577 HydrophobicContact CE-CG 4.28Å; M572-R577 HydrophobicContact CG-CB 4.21Å; M572-R577 HydrophobicContact SD-CB 4.07Å; M572-R577 HydrophobicContact SD-CG 3.99Å; H573-R577 PolarHBondContact O-N 2.86Å; V574-R577 PolarHBondContact O-N 3.16Å; R577-R579 VanDerWaalsContact C-N 3.28Å; R577-R579 PolarHBondContact O-N 3.33Å; R577-N580 WeakPolarHBondContact O-CB 3.47Å; R577-N580 PolarHBondContact O-N 3.38Å; R577-D581 IonicContact NE-OD1 3.11Å; R577-D581 PolarHBondContact NE-OD1 2.88Å; R577-D581 IonicContact NE-OD2 3.88Å; R577-D581 PolarHBondContact NE-OD2 2.85Å; R577-D581 PolarHBondContact O-N 2.87Å; R577-E913 WeakPolarHBondContact CD-OE1 3.09Å
578	R	92.1	Very high	90.1	Very high	27 Å²	27	69 Å²	69	10%	0.102	33%	0.329	C	S	.	.	H	α-helix	trans	-52.7	-45.2	177.3	-177.3	-176.1	66.3	74.6	9.9	111.8	V574 E575 N580 D581 E582	V574-R578 PolarHBondContact O-N 3.36Å; E575-R578 IonicContact OE1-NE 3.23Å; E575-R578 PolarHBondContact OE1-NE 3.4Å; E575-R578 IonicContact OE2-CZ 2.99Å; E575-R578 VanDerWaalsContact OE2-CZ 3.23Å; E575-R578 IonicContact OE2-NE 2.91Å; E575-R578 PolarHBondContact OE2-NE 3.28Å; E575-R578 IonicContact OE2-NH2 2.87Å; E575-R578 PolarHBondContact OE2-NH2 3.03Å; R578-N580 VanDerWaalsContact C-N 3.34Å; R578-N580 PolarHBondContact O-N 2.85Å; R578-D581 PolarHBondContact O-N 2.89Å; R578-E582 WeakPolarHBondContact CD-OE1 3.09Å; R578-E582 HydrophobicContact CG-CG 4.46Å; R578-E582 VanDerWaalsContact CG-OE1 3.22Å; R578-E582 WeakPolarHBondContact CG-OE1 3.14Å; R578-E582 IonicContact CZ-OE1 3.54Å; R578-E582 IonicContact CZ-OE2 3.25Å; R578-E582 IonicContact NE-OE1 3.83Å; R578-E582 IonicContact NH1-OE1 2.84Å; R578-E582 PolarHBondContact NH1-OE1 2.76Å; R578-E582 IonicContact NH1-OE2 2.7Å; R578-E582 PolarHBondContact NH1-OE2 2.94Å; R578-E582 WeakPolarHBondContact O-CB 3.43Å; R578-E582 VanDerWaalsContact O-CG 3.27Å; R578-E582 WeakPolarHBondContact O-CG 3.3Å; R578-E582 PolarHBondContact O-N 2.78Å
579	R	91.8	Very high	91.1	Very high	161 Å²	161	65.8 Å²	65.8	61%	0.608	32%	0.316	S	S	*	.	H	α-helix	trans	-64	-34.9	178.1	-69.3	168.3	-160.3	-162.3	3.4	113.3	E575 A576 R577 G583	E575-R579 WeakPolarHBondContact O-CD 3.45Å; E575-R579 VanDerWaalsContact O-CG 3.23Å; E575-R579 WeakPolarHBondContact O-CG 3.47Å; E575-R579 PolarHBondContact O-N 3.26Å; E575-R579 PolarHBondContact O-NE 3.03Å; A576-R579 PolarHBondContact O-N 2.85Å; R577-R579 VanDerWaalsContact C-N 3.28Å; R577-R579 PolarHBondContact O-N 3.33Å; R579-G583 PolarHBondContact O-N 3.1Å
580	N	90.4	Very high	91.7	Very high	93 Å²	93	65.5 Å²	65.5	50%	0.497	32%	0.319	S	S	.	.	H	α-helix	trans	-69.4	-49.5	174.6	-67.7	9.8	0	0	0	110.8	A576 R577 R578 E582 G583 E584	A576-N580 PolarHBondContact O-N 2.94Å; A576-N580 PolarHBondContact O-OD1 3.03Å; R577-N580 WeakPolarHBondContact O-CB 3.47Å; R577-N580 PolarHBondContact O-N 3.38Å; R578-N580 VanDerWaalsContact C-N 3.34Å; R578-N580 PolarHBondContact O-N 2.85Å; N580-E582 PolarHBondContact O-N 3.25Å; N580-G583 PolarHBondContact O-N 3.01Å; N580-E584 PolarHBondContact O-N 3.47Å; N580-E584 VanDerWaalsContact O-N 3.1Å
581	D	89.3	Confident	92	Very high	29 Å²	29	65.1 Å²	65.1	16%	0.155	32%	0.321	C	S	.	.	H	α-helix	trans	-57.6	-33.7	176.6	-56.5	-23.1	0	0	0	111.3	R577 R578 A585 R701	R577-D581 IonicContact NE-OD1 3.11Å; R577-D581 PolarHBondContact NE-OD1 2.88Å; R577-D581 IonicContact NE-OD2 3.88Å; R577-D581 PolarHBondContact NE-OD2 2.85Å; R577-D581 PolarHBondContact O-N 2.87Å; R578-D581 PolarHBondContact O-N 2.89Å; D581-A585 VanDerWaalsContact O-CB 3.29Å; D581-A585 WeakPolarHBondContact O-CB 3.27Å; D581-A585 PolarHBondContact O-N 3.41Å; D581-R701 IonicContact OD2-CZ 3.71Å; D581-R701 IonicContact OD2-NE 2.79Å; D581-R701 PolarHBondContact OD2-NE 2.93Å; D581-R701 IonicContact OD2-NH2 3.76Å; D581-R701 PolarHBondContact OD2-NH2 3.45Å
582	E	91.5	Very high	92.1	Very high	35 Å²	35	66.9 Å²	66.9	16%	0.164	33%	0.33	C	S	.	.	H	α-helix	trans	-75.7	-34.9	175.1	-78.1	171.1	-172.1	0	0	113.7	R578 N580 A585 K586 I688	R578-E582 WeakPolarHBondContact CD-OE1 3.09Å; R578-E582 HydrophobicContact CG-CG 4.46Å; R578-E582 VanDerWaalsContact CG-OE1 3.22Å; R578-E582 WeakPolarHBondContact CG-OE1 3.14Å; R578-E582 IonicContact CZ-OE1 3.54Å; R578-E582 IonicContact CZ-OE2 3.25Å; R578-E582 IonicContact NE-OE1 3.83Å; R578-E582 IonicContact NH1-OE1 2.84Å; R578-E582 PolarHBondContact NH1-OE1 2.76Å; R578-E582 IonicContact NH1-OE2 2.7Å; R578-E582 PolarHBondContact NH1-OE2 2.94Å; R578-E582 WeakPolarHBondContact O-CB 3.43Å; R578-E582 VanDerWaalsContact O-CG 3.27Å; R578-E582 WeakPolarHBondContact O-CG 3.3Å; R578-E582 PolarHBondContact O-N 2.78Å; N580-E582 PolarHBondContact O-N 3.25Å; E582-A585 PolarHBondContact O-N 2.9Å; E582-K586 WeakPolarHBondContact O-CB 3.5Å; E582-K586 PolarHBondContact O-N 3.39Å; E582-I688 HydrophobicContact CG-CD1 3.63Å; E582-I688 HydrophobicContact CG-CG1 4.32Å; E582-I688 HydrophobicContact CG-CG2 4.24Å; E582-I688 WeakPolarHBondContact OE1-CD1 3.21Å
583	G	90.2	Very high	92.3	Very high	40 Å²	40	64.7 Å²	64.7	41%	0.412	32%	0.319	S	S	.	.	H	α-helix	trans	-64.5	-50	175.8	0	0	0	0	0	112	R579 N580 A585 K586 E587	R579-G583 PolarHBondContact O-N 3.1Å; N580-G583 PolarHBondContact O-N 3.01Å; G583-A585 VanDerWaalsContact C-N 3.3Å; G583-A585 PolarHBondContact O-N 2.85Å; G583-K586 PolarHBondContact O-N 2.98Å; G583-E587 PolarHBondContact O-N 3.29Å; G583-E587 VanDerWaalsContact O-N 3.13Å
584	E	90.4	Very high	92.4	Very high	146 Å²	146	63 Å²	63	68%	0.682	32%	0.317	S	S	*	.	H	α-helix	trans	-60.2	-40.5	175.7	-66.5	179.1	-165.8	0	0	111.5	N580 L588	N580-E584 PolarHBondContact O-N 3.47Å; N580-E584 VanDerWaalsContact O-N 3.1Å; E584-L588 PolarHBondContact O-N 3.26Å
585	A	91.1	Very high	92.6	Very high	8 Å²	8	68 Å²	68	7%	0.066	34%	0.337	C	S	.	.	H	α-helix	trans	-67.9	-41	176.9	0	0	0	0	0	112.8	D581 E582 G583 L588 W589 Q699 T710	D581-A585 VanDerWaalsContact O-CB 3.29Å; D581-A585 WeakPolarHBondContact O-CB 3.27Å; D581-A585 PolarHBondContact O-N 3.41Å; E582-A585 PolarHBondContact O-N 2.9Å; G583-A585 VanDerWaalsContact C-N 3.3Å; G583-A585 PolarHBondContact O-N 2.85Å; A585-L588 PolarHBondContact O-N 2.84Å; A585-W589 PolarHBondContact O-N 2.81Å; A585-Q699 PolarHBondContact O-NE2 2.83Å; A585-Q699 PolarHBondContact O-OE1 2.94Å; A585-T710 HydrophobicContact CB-CG2 3.6Å
586	K	92.2	Very high	92.9	Very high	103 Å²	103	66.7 Å²	66.7	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-42.6	179.8	179.4	177.1	176	-71.1	0	111.7	E582 G583 L588 W589 E590	E582-K586 WeakPolarHBondContact O-CB 3.5Å; E582-K586 PolarHBondContact O-N 3.39Å; G583-K586 PolarHBondContact O-N 2.98Å; K586-L588 VanDerWaalsContact C-N 3.34Å; K586-L588 PolarHBondContact O-N 3.48Å; K586-W589 PolarHBondContact O-N 2.83Å; K586-E590 WeakPolarHBondContact CE-OE1 3.11Å; K586-E590 HydrophobicContact CG-CG 4.31Å; K586-E590 IonicContact NZ-OE1 3.19Å; K586-E590 PolarHBondContact NZ-OE1 3.01Å; K586-E590 IonicContact NZ-OE2 3.92Å; K586-E590 PolarHBondContact NZ-OE2 3.23Å; K586-E590 WeakPolarHBondContact O-CG 3.47Å; K586-E590 PolarHBondContact O-N 2.56Å
587	E	91.3	Very high	93.1	Very high	130 Å²	130	71.8 Å²	71.8	61%	0.607	34%	0.343	S	S	*	.	H	α-helix	trans	-57.8	-46.3	175.5	-175.2	-179.8	172.6	0	0	111.3	G583 W589 E590 N591	G583-E587 PolarHBondContact O-N 3.29Å; G583-E587 VanDerWaalsContact O-N 3.13Å; E587-W589 VanDerWaalsContact C-N 3.34Å; E587-W589 PolarHBondContact O-N 2.91Å; E587-E590 PolarHBondContact O-N 2.93Å; E587-N591 PolarHBondContact O-N 2.69Å; E587-N591 PolarHBondContact O-ND2 3.48Å
588	L	91.1	Very high	93.5	Very high	79 Å²	79	76.2 Å²	76.2	41%	0.414	37%	0.366	S	S	.	.	H	α-helix	trans	-61.8	-40.3	175.9	178.4	60.9	0	0	0	112.4	E584 A585 K586 I592 T1034	E584-L588 PolarHBondContact O-N 3.26Å; A585-L588 PolarHBondContact O-N 2.84Å; K586-L588 VanDerWaalsContact C-N 3.34Å; K586-L588 PolarHBondContact O-N 3.48Å; L588-I592 HydrophobicContact CD1-CD1 4.05Å; L588-I592 HydrophobicContact CG-CD1 4.15Å; L588-I592 WeakPolarHBondContact O-CG1 3.17Å; L588-I592 PolarHBondContact O-N 2.72Å; L588-T1034 HydrophobicContact CD2-CG2 4.39Å
589	W	95.2	Very high	93.7	Very high	50 Å²	50	79.1 Å²	79.1	19%	0.189	38%	0.383	C	S	.	.	H	α-helix	trans	-68.4	-42.9	178.7	-179.1	85.5	0	0	0	112.5	A585 K586 E587 N591 I592 V593 T689 C693 A697 Q699	A585-W589 PolarHBondContact O-N 2.81Å; K586-W589 PolarHBondContact O-N 2.83Å; E587-W589 VanDerWaalsContact C-N 3.34Å; E587-W589 PolarHBondContact O-N 2.91Å; W589-N591 VanDerWaalsContact C-N 3.34Å; W589-N591 PolarHBondContact O-N 3.11Å; W589-I592 PolarHBondContact O-N 2.84Å; W589-V593 HydrophobicContact CD2-CG2 3.88Å; W589-V593 HydrophobicContact CE3-CG2 4.29Å; W589-V593 HydrophobicContact CG-CG2 4.37Å; W589-V593 HydrophobicContact CH2-CG2 4.22Å; W589-V593 HydrophobicContact CZ2-CG2 3.81Å; W589-V593 HydrophobicContact CZ3-CG2 4.44Å; W589-V593 WeakPolarHBondContact O-CB 3.49Å; W589-V593 WeakPolarHBondContact O-CG2 3.31Å; W589-V593 PolarHBondContact O-N 2.87Å; W589-T689 HydrophobicContact CZ2-CG2 3.9Å; W589-C693 HydrophobicContact CZ2-CB 4.2Å; W589-A697 PolarHBondContact NE1-O 2.65Å; W589-Q699 HydrophobicContact CB-CG 4.48Å
590	E	95.4	Very high	93.9	Very high	90 Å²	90	76.9 Å²	76.9	42%	0.421	39%	0.392	S	S	.	.	H	α-helix	trans	-63.4	-39.5	178.9	-73	179.4	136.9	0	0	111.8	K586 E587 V593 S594	K586-E590 WeakPolarHBondContact CE-OE1 3.11Å; K586-E590 HydrophobicContact CG-CG 4.31Å; K586-E590 IonicContact NZ-OE1 3.19Å; K586-E590 PolarHBondContact NZ-OE1 3.01Å; K586-E590 IonicContact NZ-OE2 3.92Å; K586-E590 PolarHBondContact NZ-OE2 3.23Å; K586-E590 WeakPolarHBondContact O-CG 3.47Å; K586-E590 PolarHBondContact O-N 2.56Å; E587-E590 PolarHBondContact O-N 2.93Å; E590-V593 PolarHBondContact O-N 2.83Å; E590-S594 WeakPolarHBondContact O-CB 3.3Å; E590-S594 PolarHBondContact O-N 3.12Å
591	N	95.3	Very high	94.2	Very high	101 Å²	101	75.9 Å²	75.9	54%	0.54	39%	0.389	S	S	.	.	H	α-helix	trans	-60.3	-44.6	172.8	-78	-66.3	0	0	0	112.4	E587 W589 F595	E587-N591 PolarHBondContact O-N 2.69Å; E587-N591 PolarHBondContact O-ND2 3.48Å; W589-N591 VanDerWaalsContact C-N 3.34Å; W589-N591 PolarHBondContact O-N 3.11Å; N591-F595 PolarHBondContact O-N 2.85Å; N591-F595 VanDerWaalsContact O-N 3.08Å
592	I	95	Very high	94.5	Very high	38 Å²	38	78.4 Å²	78.4	20%	0.195	40%	0.402	C	S	.	.	H	α-helix	trans	-68.1	-42.4	179.5	-68.8	170.2	0	0	0	111.1	L588 W589 F595 C596 F603 L712	L588-I592 HydrophobicContact CD1-CD1 4.05Å; L588-I592 HydrophobicContact CG-CD1 4.15Å; L588-I592 WeakPolarHBondContact O-CG1 3.17Å; L588-I592 PolarHBondContact O-N 2.72Å; W589-I592 PolarHBondContact O-N 2.84Å; I592-F595 PolarHBondContact O-N 3.11Å; I592-C596 WeakPolarHBondContact O-CB 3.34Å; I592-C596 PolarHBondContact O-N 2.86Å; I592-C596 PolarHBondContact O-SG 3.08Å; I592-F603 HydrophobicContact CG2-CD2 3.61Å; I592-F603 HydrophobicContact CG2-CE2 3.93Å; I592-F603 HydrophobicContact CG2-CG 4.33Å; I592-L712 HydrophobicContact CD1-CD2 3.47Å; I592-L712 VanDerWaalsContact CD1-CD2 3.47Å
593	V	96.5	Very high	94.7	Very high	8 Å²	8	78.1 Å²	78.1	5%	0.048	40%	0.401	C	S	.	.	H	α-helix	trans	-65.5	-39.4	177.3	168.6	0	0	0	0	111.6	W589 E590 C596 R597 E695 A697	W589-V593 HydrophobicContact CD2-CG2 3.88Å; W589-V593 HydrophobicContact CE3-CG2 4.29Å; W589-V593 HydrophobicContact CG-CG2 4.37Å; W589-V593 HydrophobicContact CH2-CG2 4.22Å; W589-V593 HydrophobicContact CZ2-CG2 3.81Å; W589-V593 HydrophobicContact CZ3-CG2 4.44Å; W589-V593 WeakPolarHBondContact O-CB 3.49Å; W589-V593 WeakPolarHBondContact O-CG2 3.31Å; W589-V593 PolarHBondContact O-N 2.87Å; E590-V593 PolarHBondContact O-N 2.83Å; V593-C596 PolarHBondContact O-N 3.22Å; V593-R597 VanDerWaalsContact O-CB 3.31Å; V593-R597 WeakPolarHBondContact O-CB 3.42Å; V593-R597 PolarHBondContact O-N 2.83Å; V593-E695 HydrophobicContact CG1-CG 4.13Å; V593-A697 HydrophobicContact CG2-CB 4.35Å
594	S	96.9	Very high	95	Very high	51 Å²	51	79 Å²	79	36%	0.357	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-49.6	174.6	-153.4	0	0	0	0	111	E590 C596 R597 E598	E590-S594 WeakPolarHBondContact O-CB 3.3Å; E590-S594 PolarHBondContact O-N 3.12Å; S594-C596 PolarHBondContact O-N 2.67Å; S594-R597 PolarHBondContact O-N 3.42Å; S594-R597 VanDerWaalsContact O-N 3.15Å; S594-E598 WeakPolarHBondContact CB-OE1 3.03Å; S594-E598 WeakPolarHBondContact O-CB 3.37Å; S594-E598 VanDerWaalsContact O-CG 3.26Å; S594-E598 WeakPolarHBondContact O-CG 3.38Å; S594-E598 PolarHBondContact O-N 2.8Å; S594-E598 PolarHBondContact OG-OE1 2.76Å
595	F	96.6	Very high	95.2	Very high	123 Å²	123	72.2 Å²	72.2	54%	0.539	37%	0.367	S	S	.	.	H	α-helix	trans	-56.7	-46.9	176.3	176.9	-93	0	0	0	112.6	N591 I592 R597 N599	N591-F595 PolarHBondContact O-N 2.85Å; N591-F595 VanDerWaalsContact O-N 3.08Å; I592-F595 PolarHBondContact O-N 3.11Å; F595-R597 PolarHBondContact O-N 2.9Å; F595-N599 WeakPolarHBondContact CD2-ND2 3.46Å; F595-N599 WeakPolarHBondContact CE2-ND2 3.49Å; F595-N599 WeakPolarHBondContact O-CB 3.41Å; F595-N599 PolarHBondContact O-N 2.89Å; F595-N599 VanDerWaalsContact O-N 3.07Å; F595-N599 PolarHBondContact O-ND2 3.06Å
596	C	97	Very high	95.3	Very high	6 Å²	6	79 Å²	79	4%	0.041	40%	0.401	C	S	.	.	H	α-helix	trans	-58.4	-45.8	176	-82.1	0	0	0	0	112	I592 V593 S594 S600 V601 E695	I592-C596 WeakPolarHBondContact O-CB 3.34Å; I592-C596 PolarHBondContact O-N 2.86Å; I592-C596 PolarHBondContact O-SG 3.08Å; V593-C596 PolarHBondContact O-N 3.22Å; S594-C596 PolarHBondContact O-N 2.67Å; C596-S600 PolarHBondContact O-N 3.43Å; C596-V601 CarbonylContact C-O 3.1Å; C596-V601 WeakPolarHBondContact CA-O 3.33Å; C596-V601 WeakPolarHBondContact CB-O 3.44Å; C596-V601 PolarHBondContact O-N 2.97Å; C596-V601 VanDerWaalsContact O-O 3.12Å; C596-E695 HydrophobicContact CB-CB 3.96Å; C596-E695 HydrophobicContact CB-CG 3.95Å
597	R	96.6	Very high	95.5	Very high	146 Å²	146	77.3 Å²	77.3	55%	0.551	40%	0.403	S	S	*	.	H	α-helix	trans	-66.5	-46.3	179.7	-173.7	176.7	-63.2	153.7	6.3	112.7	V593 S594 F595 N599 S600 E695	V593-R597 VanDerWaalsContact O-CB 3.31Å; V593-R597 WeakPolarHBondContact O-CB 3.42Å; V593-R597 PolarHBondContact O-N 2.83Å; S594-R597 PolarHBondContact O-N 3.42Å; S594-R597 VanDerWaalsContact O-N 3.15Å; F595-R597 PolarHBondContact O-N 2.9Å; R597-N599 VanDerWaalsContact C-N 3.31Å; R597-N599 PolarHBondContact O-N 3.02Å; R597-S600 PolarHBondContact O-N 2.94Å; R597-S600 VanDerWaalsContact O-N 3.14Å; R597-E695 HydrophobicContact CB-CG 4.44Å; R597-E695 IonicContact CZ-OE1 3.5Å; R597-E695 IonicContact NE-OE1 3.65Å; R597-E695 PolarHBondContact NE-OE1 2.79Å; R597-E695 IonicContact NH2-OE1 3.31Å; R597-E695 PolarHBondContact NH2-OE1 2.88Å; R597-E695 IonicContact NH2-OE2 2.73Å; R597-E695 PolarHBondContact NH2-OE2 2.8Å
598	E	97.4	Very high	95.7	Very high	137 Å²	137	71.4 Å²	71.4	64%	0.64	38%	0.375	S	S	*	.	H	α-helix	trans	-60.3	-40.2	178.5	-73.3	162.2	-134.3	0	0	111.9	S594 S600	S594-E598 WeakPolarHBondContact CB-OE1 3.03Å; S594-E598 WeakPolarHBondContact O-CB 3.37Å; S594-E598 VanDerWaalsContact O-CG 3.26Å; S594-E598 WeakPolarHBondContact O-CG 3.38Å; S594-E598 PolarHBondContact O-N 2.8Å; S594-E598 PolarHBondContact OG-OE1 2.76Å; E598-S600 VanDerWaalsContact C-N 3.34Å
599	N	96.8	Very high	95.9	Very high	88 Å²	88	70.2 Å²	70.2	47%	0.471	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.7	178.9	-68.1	-91.3	0	0	0	113.3	F595 R597 V601	F595-N599 WeakPolarHBondContact CD2-ND2 3.46Å; F595-N599 WeakPolarHBondContact CE2-ND2 3.49Å; F595-N599 WeakPolarHBondContact O-CB 3.41Å; F595-N599 PolarHBondContact O-N 2.89Å; F595-N599 VanDerWaalsContact O-N 3.07Å; F595-N599 PolarHBondContact O-ND2 3.06Å; R597-N599 VanDerWaalsContact C-N 3.31Å; R597-N599 PolarHBondContact O-N 3.02Å; N599-V601 VanDerWaalsContact C-N 3.3Å; N599-V601 HydrophobicContact CB-CG2 4.02Å; N599-V601 PolarHBondContact O-N 2.85Å
600	S	96	Very high	95.9	Very high	113 Å²	113	70 Å²	70	79%	0.79	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	40.4	-175.7	-59.3	0	0	0	0	114.2	C596 R597 E598	C596-S600 PolarHBondContact O-N 3.43Å; R597-S600 PolarHBondContact O-N 2.94Å; R597-S600 VanDerWaalsContact O-N 3.14Å; E598-S600 VanDerWaalsContact C-N 3.34Å
601	V	95.6	Very high	95.8	Very high	72 Å²	72	66.6 Å²	66.6	44%	0.436	37%	0.366	S	S	.	.			trans	-121.8	146.4	178.7	-64.2	0	0	0	0	111.6	C596 N599	C596-V601 CarbonylContact C-O 3.1Å; C596-V601 WeakPolarHBondContact CA-O 3.33Å; C596-V601 WeakPolarHBondContact CB-O 3.44Å; C596-V601 PolarHBondContact O-N 2.97Å; C596-V601 VanDerWaalsContact O-O 3.12Å; N599-V601 VanDerWaalsContact C-N 3.3Å; N599-V601 HydrophobicContact CB-CG2 4.02Å; N599-V601 PolarHBondContact O-N 2.85Å
602	N	95.4	Very high	95.5	Very high	82 Å²	82	66 Å²	66	44%	0.439	37%	0.368	S	S	.	.			trans	-78	148.2	167.9	-72	103.6	0	0	0	111.4	P694 E695	N602-P694 PolarHBondContact ND2-O 3.2Å; N602-E695 CarbonylContact C-O 3.59Å; N602-E695 VanDerWaalsContact CA-O 3.29Å; N602-E695 WeakPolarHBondContact CA-O 3.27Å; N602-E695 WeakPolarHBondContact CB-O 3.46Å; N602-E695 PolarHBondContact ND2-O 3.21Å; N602-E695 VanDerWaalsContact ND2-O 3.13Å
603	F	96.9	Very high	95.4	Very high	29 Å²	29	75 Å²	75	13%	0.127	40%	0.399	C	S	.	.			trans	-64.3	137.2	171.3	-177.8	-110.9	0	0	0	111	I592 D605 R632 E695 A697 L712 D714	I592-F603 HydrophobicContact CG2-CD2 3.61Å; I592-F603 HydrophobicContact CG2-CE2 3.93Å; I592-F603 HydrophobicContact CG2-CG 4.33Å; F603-D605 HydrophobicContact CE1-CB 4.15Å; F603-D605 HydrophobicContact CZ-CB 4.36Å; F603-R632 PolarHBondContact O-NH1 2.69Å; F603-R632 VanDerWaalsContact O-NH1 3.15Å; F603-R632 PolarHBondContact O-NH2 3.28Å; F603-E695 PolarHBondContact N-O 3.47Å; F603-A697 HydrophobicContact CB-CB 3.82Å; F603-A697 HydrophobicContact CD1-CB 3.75Å; F603-A697 HydrophobicContact CG-CB 3.83Å; F603-L712 HydrophobicContact CE1-CD2 4.02Å; F603-L712 HydrophobicContact CE1-CG 3.97Å; F603-L712 HydrophobicContact CE2-CD2 4.08Å; F603-L712 HydrophobicContact CZ-CD2 3.49Å; F603-L712 VanDerWaalsContact CZ-CD2 3.49Å; F603-L712 HydrophobicContact CZ-CG 3.95Å; F603-D714 HydrophobicContact CD1-CB 3.67Å; F603-D714 HydrophobicContact CE1-CB 4.09Å; F603-D714 WeakPolarHBondContact O-CB 3.39Å
604	V	95.5	Very high	95.3	Very high	59 Å²	59	74.8 Å²	74.8	36%	0.358	40%	0.398	S	S	.	.			trans	-133.6	136.2	170.7	178.5	0	0	0	0	107	D606 P610 D714	V604-D606 PolarHBondContact O-N 2.91Å; V604-P610 HydrophobicContact CG1-CG 4.43Å; V604-D714 WeakPolarHBondContact CA-OD2 3.38Å
605	D	95.5	Very high	95.1	Very high	4 Å²	4	72.3 Å²	72.3	2%	0.021	38%	0.381	C	S	.	.			trans	-88.1	88	-173.6	-171.7	-8.4	0	0	0	111.3	F603 S607 F608 P609 D714 K746	F603-D605 HydrophobicContact CE1-CB 4.15Å; F603-D605 HydrophobicContact CZ-CB 4.36Å; D605-S607 PolarHBondContact O-N 2.89Å; D605-S607 PolarHBondContact OD1-N 3.31Å; D605-S607 PolarHBondContact OD1-OG 2.88Å; D605-F608 CarbonylContact O-C 3.51Å; D605-F608 PolarHBondContact O-N 2.8Å; D605-F608 PolarHBondContact OD1-N 2.8Å; D605-P609 WeakPolarHBondContact O-CA 3.42Å; D605-P609 VanDerWaalsContact O-N 3.08Å; D605-D714 HydrophobicContact CB-CB 4.45Å; D605-D714 WeakPolarHBondContact CB-OD2 3.42Å; D605-D714 PolarHBondContact N-OD2 2.78Å; D605-K746 IonicContact OD1-NZ 2.66Å; D605-K746 PolarHBondContact OD1-NZ 3.39Å; D605-K746 WeakPolarHBondContact OD2-CD 3.48Å; D605-K746 WeakPolarHBondContact OD2-CE 3.27Å; D605-K746 IonicContact OD2-NZ 2.97Å; D605-K746 PolarHBondContact OD2-NZ 2.74Å
606	D	94	Very high	94.8	Very high	149 Å²	149	67.7 Å²	67.7	80%	0.797	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-22.1	177	-72.4	-27.3	0	0	0	113.9	V604	V604-D606 PolarHBondContact O-N 2.91Å
607	S	94.6	Very high	94.4	Very high	69 Å²	69	68.4 Å²	68.4	48%	0.483	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-10.9	176.8	68.4	0	0	0	0	114.2	D605 K746	D605-S607 PolarHBondContact O-N 2.89Å; D605-S607 PolarHBondContact OD1-N 3.31Å; D605-S607 PolarHBondContact OD1-OG 2.88Å; S607-K746 WeakPolarHBondContact OG-CE 3.29Å; S607-K746 PolarHBondContact OG-NZ 3.48Å
608	F	96.8	Very high	94	Very high	5 Å²	5	64.9 Å²	64.9	2%	0.022	37%	0.367	C	S	.	.	S	Bend	trans	-146.9	60.8	173.2	-163.6	-111.3	0	0	0	111.2	D605 S614 K742 A745 K746 Y751	D605-F608 CarbonylContact O-C 3.51Å; D605-F608 PolarHBondContact O-N 2.8Å; D605-F608 PolarHBondContact OD1-N 2.8Å; F608-S614 VanDerWaalsContact C-OG 3.29Å; F608-S614 WeakPolarHBondContact CZ-O 3.39Å; F608-K742 HydrophobicContact CD1-CG 4.26Å; F608-K742 HydrophobicContact CE1-CG 4.02Å; F608-A745 HydrophobicContact CE1-CB 4.28Å; F608-A745 HydrophobicContact CZ-CB 3.75Å; F608-K746 HydrophobicContact CB-CB 4.14Å; F608-K746 HydrophobicContact CB-CD 3.73Å; F608-K746 HydrophobicContact CB-CG 3.85Å; F608-K746 HydrophobicContact CD1-CB 3.99Å; F608-K746 HydrophobicContact CD2-CB 3.84Å; F608-K746 HydrophobicContact CD2-CG 4.13Å; F608-K746 HydrophobicContact CE1-CB 4.34Å; F608-K746 HydrophobicContact CE2-CB 4.2Å; F608-K746 HydrophobicContact CG-CB 3.72Å; F608-K746 HydrophobicContact CG-CD 4.26Å; F608-K746 HydrophobicContact CG-CG 3.98Å; F608-K746 HydrophobicContact CZ-CB 4.43Å; F608-Y751 HydrophobicContact CE1-CD2 4.36Å; F608-Y751 AromaticContact CE1-CE2 3.98Å; F608-Y751 HydrophobicContact CE1-CE2 3.98Å; F608-Y751 HydrophobicContact CZ-CD2 4.14Å; F608-Y751 HydrophobicContact CZ-CE2 4.22Å
609	P	95.3	Very high	93.2	Very high	55 Å²	55	67.9 Å²	67.9	36%	0.357	38%	0.381	S	S	.	.			trans	-68.5	154.1	-163.8	27.6	-36.6	0	0	0	113	D605 G611 S614	D605-P609 WeakPolarHBondContact O-CA 3.42Å; D605-P609 VanDerWaalsContact O-N 3.08Å; P609-G611 PolarHBondContact O-N 2.9Å; P609-S614 VanDerWaalsContact O-CB 3.28Å; P609-S614 WeakPolarHBondContact O-CB 3.46Å; P609-S614 PolarHBondContact O-OG 3.38Å
610	P	94.9	Very high	92.4	Very high	46 Å²	46	66.2 Å²	66.2	30%	0.299	38%	0.384	S	S	.	.	S	Bend	trans	-68.9	88.9	179.6	27.4	-34.6	0	0	0	112	V604 W630 M716	V604-P610 HydrophobicContact CG1-CG 4.43Å; P610-W630 HydrophobicContact CB-CB 3.68Å; P610-W630 HydrophobicContact CB-CD2 3.48Å; P610-W630 VanDerWaalsContact CB-CD2 3.48Å; P610-W630 HydrophobicContact CB-CE3 3.6Å; P610-W630 HydrophobicContact CB-CG 3.55Å; P610-W630 HydrophobicContact CB-CZ3 4.29Å; P610-M716 HydrophobicContact CB-CB 4.23Å; P610-M716 HydrophobicContact CB-CE 4.37Å; P610-M716 HydrophobicContact CG-CE 4.37Å
611	G	92.2	Very high	92.1	Very high	18 Å²	18	63.2 Å²	63.2	19%	0.186	36%	0.36	C	S	.	.	S	Bend	trans	-179.4	-178	-179.3	0	0	0	0	0	114.7	P609 R613 S614 V615	P609-G611 PolarHBondContact O-N 2.9Å; G611-R613 VanDerWaalsContact C-N 3.27Å; G611-R613 PolarHBondContact O-N 3.03Å; G611-R613 VanDerWaalsContact O-N 3.12Å; G611-S614 PolarHBondContact O-N 2.83Å; G611-S614 VanDerWaalsContact O-N 3.12Å; G611-V615 PolarHBondContact O-N 2.97Å
612	P	91	Very high	91.8	Very high	89 Å²	89	63.2 Å²	63.2	58%	0.578	36%	0.363	S	S	*	.	H	α-helix	trans	-57.1	-30.3	-170.4	-28.7	36.4	0	0	0	115.6	S614 V615 G616	P612-S614 VanDerWaalsContact C-N 3.34Å; P612-S614 PolarHBondContact O-N 2.78Å; P612-V615 WeakPolarHBondContact O-CB 3.38Å; P612-V615 PolarHBondContact O-N 3.08Å; P612-G616 PolarHBondContact O-N 3.04Å
613	R	91.2	Very high	91.3	Very high	225 Å²	225	60.2 Å²	60.2	85%	0.849	35%	0.347	S	S	*	.	H	α-helix	trans	-62	-41.1	177.7	-69.6	-176.3	177.7	175.3	0.1	112.8	G611 G616	G611-R613 VanDerWaalsContact C-N 3.27Å; G611-R613 PolarHBondContact O-N 3.03Å; G611-R613 VanDerWaalsContact O-N 3.12Å; R613-G616 PolarHBondContact O-N 3.22Å
614	S	95	Very high	91	Very high	4 Å²	4	60 Å²	60	3%	0.028	35%	0.347	C	S	.	.	H	α-helix	trans	-77.9	-24.8	-179.5	-53	0	0	0	0	111.8	F608 P609 G611 P612 S750 Y751	F608-S614 VanDerWaalsContact C-OG 3.29Å; F608-S614 WeakPolarHBondContact CZ-O 3.39Å; P609-S614 VanDerWaalsContact O-CB 3.28Å; P609-S614 WeakPolarHBondContact O-CB 3.46Å; P609-S614 PolarHBondContact O-OG 3.38Å; G611-S614 PolarHBondContact O-N 2.83Å; G611-S614 VanDerWaalsContact O-N 3.12Å; P612-S614 VanDerWaalsContact C-N 3.34Å; P612-S614 PolarHBondContact O-N 2.78Å; S614-S750 CarbonylContact O-C 3.57Å; S614-S750 VanDerWaalsContact O-CA 3.28Å; S614-S750 WeakPolarHBondContact O-CA 3.05Å; S614-Y751 WeakPolarHBondContact O-CD2 3.28Å; S614-Y751 PolarHBondContact O-N 2.88Å
615	V	93.4	Very high	90.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-68.2	-53.2	166.1	177.5	0	0	0	0	110.1	G611 P612 F617 I627 W630 Y751 F752	G611-V615 PolarHBondContact O-N 2.97Å; P612-V615 WeakPolarHBondContact O-CB 3.38Å; P612-V615 PolarHBondContact O-N 3.08Å; V615-F617 VanDerWaalsContact C-N 3.34Å; V615-F617 HydrophobicContact CG1-CB 4.24Å; V615-F617 HydrophobicContact CG1-CD2 3.72Å; V615-F617 HydrophobicContact CG1-CG 4.4Å; V615-F617 PolarHBondContact O-N 2.83Å; V615-I627 HydrophobicContact CB-CD1 4.26Å; V615-I627 HydrophobicContact CG1-CD1 3.51Å; V615-I627 HydrophobicContact CG2-CD1 3.66Å; V615-I627 HydrophobicContact CG2-CG2 4.33Å; V615-W630 HydrophobicContact CG2-CZ2 3.85Å; V615-Y751 PolarHBondContact O-N 3.23Å; V615-F752 WeakPolarHBondContact O-CB 3.38Å; V615-F752 PolarHBondContact O-N 3.01Å
616	G	90.6	Very high	90.5	Very high	26 Å²	26	69 Å²	69	27%	0.268	38%	0.379	S	S	.	.			trans	79.9	2.8	172	0	0	0	0	0	116.3	P612 R613 F752	P612-G616 PolarHBondContact O-N 3.04Å; R613-G616 PolarHBondContact O-N 3.22Å; G616-F752 WeakPolarHBondContact O-CD1 3.44Å
617	F	88.5	Confident	90.5	Very high	20 Å²	20	62.8 Å²	62.8	9%	0.088	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-75	153.1	173.9	-80.7	-106	0	0	0	110.5	V615 D621 V623 Q624 L664 F752	V615-F617 VanDerWaalsContact C-N 3.34Å; V615-F617 HydrophobicContact CG1-CB 4.24Å; V615-F617 HydrophobicContact CG1-CD2 3.72Å; V615-F617 HydrophobicContact CG1-CG 4.4Å; V615-F617 PolarHBondContact O-N 2.83Å; F617-D621 HydrophobicContact CB-CB 4.2Å; F617-D621 HydrophobicContact CD1-CB 4.41Å; F617-D621 WeakPolarHBondContact CD1-OD1 3.42Å; F617-V623 HydrophobicContact CD1-CB 4.08Å; F617-V623 HydrophobicContact CE1-CB 3.93Å; F617-V623 HydrophobicContact CE1-CG1 4.29Å; F617-V623 HydrophobicContact CE1-CG2 3.99Å; F617-V623 HydrophobicContact CE2-CG1 4.18Å; F617-V623 HydrophobicContact CG-CB 4.49Å; F617-V623 HydrophobicContact CZ-CB 4.21Å; F617-V623 HydrophobicContact CZ-CG1 4.05Å; F617-V623 HydrophobicContact CZ-CG2 4.36Å; F617-Q624 HydrophobicContact CB-CB 3.89Å; F617-L664 HydrophobicContact CE2-CD1 4.07Å; F617-L664 HydrophobicContact CZ-CD1 4.01Å; F617-F752 AromaticContact CD1-CD2 3.66Å; F617-F752 HydrophobicContact CD1-CD2 3.66Å; F617-F752 AromaticContact CD1-CE2 3.97Å; F617-F752 HydrophobicContact CD1-CE2 3.97Å; F617-F752 HydrophobicContact CD2-CB 3.67Å; F617-F752 AromaticContact CD2-CD2 3.84Å; F617-F752 HydrophobicContact CD2-CD2 3.84Å; F617-F752 HydrophobicContact CD2-CG 4.09Å; F617-F752 AromaticContact CE1-CD2 3.69Å; F617-F752 HydrophobicContact CE1-CD2 3.69Å; F617-F752 HydrophobicContact CE1-CE2 4.06Å; F617-F752 HydrophobicContact CE2-CB 3.92Å; F617-F752 AromaticContact CE2-CD2 3.87Å; F617-F752 HydrophobicContact CE2-CD2 3.87Å; F617-F752 HydrophobicContact CE2-CG 4.36Å; F617-F752 HydrophobicContact CG-CB 4.24Å; F617-F752 AromaticContact CG-CD2 3.75Å; F617-F752 HydrophobicContact CG-CD2 3.75Å; F617-F752 HydrophobicContact CG-CE2 4.41Å; F617-F752 HydrophobicContact CG-CG 4.19Å; F617-F752 AromaticContact CZ-CD2 3.8Å; F617-F752 HydrophobicContact CZ-CD2 3.8Å
618	P	87.4	Confident	90.4	Very high	72 Å²	72	64.9 Å²	64.9	47%	0.468	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-59	150.6	178.8	-25.2	35.2	0	0	0	114.1	G620 D621	P618-G620 PolarHBondContact O-N 3.15Å; P618-D621 VanDerWaalsContact O-CB 3.26Å; P618-D621 WeakPolarHBondContact O-CB 3.44Å; P618-D621 PolarHBondContact O-N 3.48Å
619	E	80.8	Confident	90.3	Very high	200 Å²	200	68.7 Å²	68.7	94%	0.935	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	125.7	170.6	-67.1	-175.1	178.5	0	0	109.9
620	G	80.1	Confident	90.4	Very high	53 Å²	53	67.6 Å²	67.6	55%	0.546	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.5	-11.4	-172.8	0	0	0	0	0	115.1	P618 Q625	P618-G620 PolarHBondContact O-N 3.15Å; G620-Q625 PolarHBondContact O-NE2 3.05Å
621	D	90.1	Very high	90.4	Very high	50 Å²	50	66.7 Å²	66.7	27%	0.267	34%	0.344	S	S	.	.			trans	-64.5	140.5	177.8	-175	-80.1	0	0	0	112.8	F617 P618 V623 Q624 Q625	F617-D621 HydrophobicContact CB-CB 4.2Å; F617-D621 HydrophobicContact CD1-CB 4.41Å; F617-D621 WeakPolarHBondContact CD1-OD1 3.42Å; P618-D621 VanDerWaalsContact O-CB 3.26Å; P618-D621 WeakPolarHBondContact O-CB 3.44Å; P618-D621 PolarHBondContact O-N 3.48Å; D621-V623 VanDerWaalsContact C-N 3.29Å; D621-V623 PolarHBondContact O-N 2.97Å; D621-V623 WeakPolarHBondContact OD1-CA 3.42Å; D621-V623 WeakPolarHBondContact OD1-CB 3.48Å; D621-V623 PolarHBondContact OD1-N 2.99Å; D621-Q624 HydrophobicContact CB-CB 4.06Å; D621-Q624 WeakPolarHBondContact O-CB 3.08Å; D621-Q624 PolarHBondContact O-N 3.36Å; D621-Q624 VanDerWaalsContact O-N 3.11Å; D621-Q625 WeakPolarHBondContact O-CG 3.19Å; D621-Q625 PolarHBondContact O-N 3.15Å
622	S	87.9	Confident	90.6	Very high	73 Å²	73	67.4 Å²	67.4	51%	0.51	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-29.7	-176.6	73.4	0	0	0	0	114.7	R626	S622-R626 WeakPolarHBondContact O-CD 3.24Å; S622-R626 WeakPolarHBondContact O-CG 3.43Å; S622-R626 PolarHBondContact O-N 2.81Å
623	V	86.7	Confident	90.7	Very high	18 Å²	18	63.1 Å²	63.1	11%	0.109	31%	0.313	C	S	.	.	H	α-helix	trans	-75.6	-43.3	173.8	-176.6	0	0	0	0	109.7	F617 D621 Q625 R626 I627 L663 F727	F617-V623 HydrophobicContact CD1-CB 4.08Å; F617-V623 HydrophobicContact CE1-CB 3.93Å; F617-V623 HydrophobicContact CE1-CG1 4.29Å; F617-V623 HydrophobicContact CE1-CG2 3.99Å; F617-V623 HydrophobicContact CE2-CG1 4.18Å; F617-V623 HydrophobicContact CG-CB 4.49Å; F617-V623 HydrophobicContact CZ-CB 4.21Å; F617-V623 HydrophobicContact CZ-CG1 4.05Å; F617-V623 HydrophobicContact CZ-CG2 4.36Å; D621-V623 VanDerWaalsContact C-N 3.29Å; D621-V623 PolarHBondContact O-N 2.97Å; D621-V623 WeakPolarHBondContact OD1-CA 3.42Å; D621-V623 WeakPolarHBondContact OD1-CB 3.48Å; D621-V623 PolarHBondContact OD1-N 2.99Å; V623-Q625 VanDerWaalsContact C-N 3.27Å; V623-Q625 PolarHBondContact O-N 3.22Å; V623-R626 PolarHBondContact O-N 3Å; V623-R626 VanDerWaalsContact O-N 3.16Å; V623-I627 HydrophobicContact CG1-CD1 4.48Å; V623-I627 PolarHBondContact O-N 3.1Å; V623-L663 HydrophobicContact CG1-CB 4.5Å; V623-F727 HydrophobicContact CG1-CE1 3.99Å
624	Q	89.5	Confident	90.7	Very high	25 Å²	25	59.3 Å²	59.3	12%	0.117	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-35.8	176.2	-173.3	52.4	87	0	0	112.2	F617 D621	F617-Q624 HydrophobicContact CB-CB 3.89Å; D621-Q624 HydrophobicContact CB-CB 4.06Å; D621-Q624 WeakPolarHBondContact O-CB 3.08Å; D621-Q624 PolarHBondContact O-N 3.36Å; D621-Q624 VanDerWaalsContact O-N 3.11Å
625	Q	89.5	Confident	90.7	Very high	111 Å²	111	64.4 Å²	64.4	52%	0.519	33%	0.328	S	S	.	.	H	α-helix	trans	-73.1	-29.5	175.7	-69.5	-177.3	20.4	0	0	113.6	G620 D621 V623 K628	G620-Q625 PolarHBondContact O-NE2 3.05Å; D621-Q625 WeakPolarHBondContact O-CG 3.19Å; D621-Q625 PolarHBondContact O-N 3.15Å; V623-Q625 VanDerWaalsContact C-N 3.27Å; V623-Q625 PolarHBondContact O-N 3.22Å; Q625-K628 PolarHBondContact O-NZ 3.26Å
626	R	91.6	Very high	90.6	Very high	141 Å²	141	65 Å²	65	53%	0.532	33%	0.331	S	S	.	.	H	α-helix	trans	-72.4	-30.5	177.8	-76.5	166	-172	-123.6	2	112.7	S622 V623 K628 L726	S622-R626 WeakPolarHBondContact O-CD 3.24Å; S622-R626 WeakPolarHBondContact O-CG 3.43Å; S622-R626 PolarHBondContact O-N 2.81Å; V623-R626 PolarHBondContact O-N 3Å; V623-R626 VanDerWaalsContact O-N 3.16Å; R626-K628 WeakPolarHBondContact O-CG 3.49Å; R626-K628 PolarHBondContact O-N 2.88Å; R626-L726 HydrophobicContact CB-CD1 4.16Å; R626-L726 HydrophobicContact CB-CD2 4.23Å; R626-L726 WeakPolarHBondContact O-CD1 3.35Å
627	I	92.5	Very high	90.5	Very high	18 Å²	18	68 Å²	68	9%	0.092	34%	0.341	C	S	.	.			trans	-72.9	109.8	177.3	-63	162.7	0	0	0	108.9	V615 V623 P718 L726 F727	V615-I627 HydrophobicContact CB-CD1 4.26Å; V615-I627 HydrophobicContact CG1-CD1 3.51Å; V615-I627 HydrophobicContact CG2-CD1 3.66Å; V615-I627 HydrophobicContact CG2-CG2 4.33Å; V623-I627 HydrophobicContact CG1-CD1 4.48Å; V623-I627 PolarHBondContact O-N 3.1Å; I627-P718 HydrophobicContact CD1-CB 4.31Å; I627-P718 HydrophobicContact CG1-CB 4.26Å; I627-P718 HydrophobicContact CG2-CB 4.06Å; I627-L726 HydrophobicContact CB-CD1 4.14Å; I627-L726 HydrophobicContact CG1-CD1 3.48Å; I627-L726 VanDerWaalsContact CG1-CD1 3.48Å; I627-F727 HydrophobicContact CD1-CE1 4.38Å; I627-F727 HydrophobicContact CD1-CE2 4.17Å; I627-F727 HydrophobicContact CD1-CZ 3.66Å
628	K	93	Very high	89.7	Confident	113 Å²	113	69.2 Å²	69.2	49%	0.491	35%	0.352	S	S	.	.			trans	-120.2	-28.4	-170.7	-74	-88.1	-161.9	-82.6	0	112.5	Q625 R626 C719 D721	Q625-K628 PolarHBondContact O-NZ 3.26Å; R626-K628 WeakPolarHBondContact O-CG 3.49Å; R626-K628 PolarHBondContact O-N 2.88Å; K628-C719 PolarHBondContact N-O 2.77Å; K628-D721 WeakPolarHBondContact CB-OD1 3.45Å; K628-D721 WeakPolarHBondContact CD-OD1 3.49Å; K628-D721 WeakPolarHBondContact CD-OD2 3.35Å; K628-D721 WeakPolarHBondContact CE-OD2 3.49Å; K628-D721 VanDerWaalsContact CG-CG 3.48Å; K628-D721 WeakPolarHBondContact CG-OD1 3.17Å; K628-D721 WeakPolarHBondContact CG-OD2 3.48Å
629	K	95.1	Very high	88.6	Confident	86 Å²	86	69.3 Å²	69.3	37%	0.374	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	151.3	-178	-62.3	173.3	-176	171.6	0	109.4	L631 C719 D721	K629-L631 HydrophobicContact CB-CD1 4.29Å; K629-L631 HydrophobicContact CB-CD2 4.08Å; K629-L631 HydrophobicContact CB-CG 3.93Å; K629-L631 HydrophobicContact CD-CD1 4.5Å; K629-C719 HydrophobicContact CB-CB 4.37Å; K629-C719 PolarHBondContact N-O 2.72Å; K629-C719 VanDerWaalsContact N-O 3.1Å; K629-C719 PolarHBondContact O-N 3.28Å; K629-D721 PolarHBondContact NZ-O 3.24Å
630	W	96.6	Very high	88	Confident	32 Å²	32	62.6 Å²	62.6	12%	0.121	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121.6	162.1	-75.8	71.1	0	0	0	106.1	P610 V615 M716 L717 P718 Y751	P610-W630 HydrophobicContact CB-CB 3.68Å; P610-W630 HydrophobicContact CB-CD2 3.48Å; P610-W630 VanDerWaalsContact CB-CD2 3.48Å; P610-W630 HydrophobicContact CB-CE3 3.6Å; P610-W630 HydrophobicContact CB-CG 3.55Å; P610-W630 HydrophobicContact CB-CZ3 4.29Å; V615-W630 HydrophobicContact CG2-CZ2 3.85Å; W630-M716 HydrophobicContact CB-CB 4.4Å; W630-M716 HydrophobicContact CB-CE 4.01Å; W630-M716 HydrophobicContact CE3-CB 4.14Å; W630-M716 VanDerWaalsContact O-CE 3.26Å; W630-M716 WeakPolarHBondContact O-CE 3.48Å; W630-L717 WeakPolarHBondContact CA-O 3.41Å; W630-P718 HydrophobicContact CD2-CG 4.14Å; W630-P718 HydrophobicContact CE3-CG 4.02Å; W630-P718 HydrophobicContact CH2-CG 3.77Å; W630-P718 HydrophobicContact CZ2-CG 3.85Å; W630-P718 HydrophobicContact CZ3-CG 3.83Å; W630-Y751 HydrophobicContact CH2-CE2 4.07Å
631	L	96.8	Very high	87.1	Confident	27 Å²	27	67.3 Å²	67.3	14%	0.141	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.7	-167.1	-63.3	179.6	0	0	0	110.5	K629 E635 I636 L717 C719	K629-L631 HydrophobicContact CB-CD1 4.29Å; K629-L631 HydrophobicContact CB-CD2 4.08Å; K629-L631 HydrophobicContact CB-CG 3.93Å; K629-L631 HydrophobicContact CD-CD1 4.5Å; L631-E635 WeakPolarHBondContact CA-OE2 3.12Å; L631-E635 HydrophobicContact CB-CB 4.09Å; L631-E635 HydrophobicContact CD2-CB 4.19Å; L631-I636 HydrophobicContact CB-CD1 4.49Å; L631-I636 HydrophobicContact CB-CG1 3.73Å; L631-L717 PolarHBondContact N-O 2.96Å; L631-L717 PolarHBondContact O-N 3.38Å; L631-C719 HydrophobicContact CD1-CB 3.92Å; L631-C719 HydrophobicContact CG-CB 4.22Å
632	R	95.8	Very high	85.8	Confident	32 Å²	32	73.7 Å²	73.7	12%	0.121	36%	0.355	C	S	.	.			trans	-80.9	162.4	170.8	-64	-163.1	-173.1	-100.1	1.3	110.6	F603 H634 E635 I636 D715 M716	F603-R632 PolarHBondContact O-NH1 2.69Å; F603-R632 VanDerWaalsContact O-NH1 3.15Å; F603-R632 PolarHBondContact O-NH2 3.28Å; R632-H634 VanDerWaalsContact C-N 3.26Å; R632-H634 PolarHBondContact O-N 3.28Å; R632-H634 VanDerWaalsContact O-N 3.07Å; R632-E635 PolarHBondContact N-OE2 2.86Å; R632-E635 WeakPolarHBondContact O-CB 3.25Å; R632-E635 PolarHBondContact O-N 2.9Å; R632-I636 WeakPolarHBondContact O-CG1 3.49Å; R632-I636 PolarHBondContact O-N 3.31Å; R632-D715 WeakPolarHBondContact CD-OD1 3.3Å; R632-D715 IonicContact CZ-OD1 2.67Å; R632-D715 IonicContact NE-OD1 3.3Å; R632-D715 IonicContact NH1-OD1 3.7Å; R632-D715 PolarHBondContact NH1-OD1 3.28Å; R632-M716 HydrophobicContact CG-CG 4.4Å; R632-M716 HydrophobicContact CG-SD 3.41Å; R632-M716 WeakPolarHBondContact CG-SD 3.35Å
633	P	93.7	Very high	84.8	Confident	0 Å²	0	71 Å²	71	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-49.1	-43.5	-174.9	-30.9	36.9	0	0	0	114.4	E635 I636 W648 D715 L735	P633-E635 PolarHBondContact O-N 2.91Å; P633-E635 VanDerWaalsContact O-N 3.16Å; P633-I636 PolarHBondContact O-N 3.03Å; P633-W648 VanDerWaalsContact C-NE1 3.35Å; P633-W648 HydrophobicContact CB-CB 4.47Å; P633-W648 HydrophobicContact CB-CD2 3.78Å; P633-W648 HydrophobicContact CB-CE3 4.17Å; P633-W648 HydrophobicContact CB-CG 3.89Å; P633-W648 WeakPolarHBondContact O-CZ2 3.39Å; P633-W648 PolarHBondContact O-NE1 2.86Å; P633-D715 WeakPolarHBondContact CD-OD2 3.45Å; P633-D715 HydrophobicContact CG-CB 4.11Å; P633-L735 HydrophobicContact CB-CD1 4.06Å; P633-L735 HydrophobicContact CB-CD2 4.02Å; P633-L735 HydrophobicContact CG-CD1 3.45Å; P633-L735 VanDerWaalsContact CG-CD1 3.45Å; P633-L735 HydrophobicContact CG-CD2 3.73Å; P633-L735 HydrophobicContact CG-CG 4.23Å
634	H	90.8	Very high	83.8	Confident	145 Å²	145	79.2 Å²	79.2	67%	0.671	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-67.6	-13	-178.5	-58.4	100.7	0	0	0	114.8	R632 W648	R632-H634 VanDerWaalsContact C-N 3.26Å; R632-H634 PolarHBondContact O-N 3.28Å; R632-H634 VanDerWaalsContact O-N 3.07Å; H634-W648 AromaticContact CD2-CD1 3.9Å
635	E	93.6	Very high	83	Confident	111 Å²	111	81.8 Å²	81.8	52%	0.519	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-104.9	-12.6	-177.6	-55.2	170	147.5	0	0	112.4	L631 R632 P633	L631-E635 WeakPolarHBondContact CA-OE2 3.12Å; L631-E635 HydrophobicContact CB-CB 4.09Å; L631-E635 HydrophobicContact CD2-CB 4.19Å; R632-E635 PolarHBondContact N-OE2 2.86Å; R632-E635 WeakPolarHBondContact O-CB 3.25Å; R632-E635 PolarHBondContact O-N 2.9Å; P633-E635 PolarHBondContact O-N 2.91Å; P633-E635 VanDerWaalsContact O-N 3.16Å
636	I	92.4	Very high	82.8	Confident	13 Å²	13	78.6 Å²	78.6	7%	0.067	39%	0.385	C	S	.	.			trans	-81.4	132.8	-175.5	-69.2	168.6	0	0	0	111.1	L631 R632 P633 W648 L717 L725	L631-I636 HydrophobicContact CB-CD1 4.49Å; L631-I636 HydrophobicContact CB-CG1 3.73Å; R632-I636 WeakPolarHBondContact O-CG1 3.49Å; R632-I636 PolarHBondContact O-N 3.31Å; P633-I636 PolarHBondContact O-N 3.03Å; I636-W648 HydrophobicContact CB-CZ2 4.31Å; I636-W648 HydrophobicContact CG2-CH2 4.49Å; I636-W648 HydrophobicContact CG2-CZ2 4.47Å; I636-L717 HydrophobicContact CD1-CB 4.17Å; I636-L717 HydrophobicContact CD1-CD1 4.08Å; I636-L725 HydrophobicContact CD1-CD2 4.01Å; I636-L725 HydrophobicContact CD1-CG 4.39Å; I636-L725 HydrophobicContact CG2-CD1 4.4Å; I636-L725 HydrophobicContact CG2-CG 4.12Å
637	N	87.6	Confident	82.7	Confident	88 Å²	88	80.4 Å²	80.4	47%	0.471	40%	0.397	S	S	.	.			trans	-79.8	133.2	171.4	-77.7	-43.4	0	0	0	110.8	Y722 G723 Y724	N637-Y722 PolarHBondContact ND2-O 3.5Å; N637-G723 PolarHBondContact N-O 3.47Å; N637-Y724 HydrophobicContact CB-CD1 3.94Å; N637-Y724 HydrophobicContact CB-CE1 3.67Å; N637-Y724 VanDerWaalsContact O-CD1 3.24Å; N637-Y724 WeakPolarHBondContact O-CD1 3.46Å
638	C	73.1	Confident	82.7	Confident	46 Å²	46	81.1 Å²	81.1	31%	0.311	40%	0.399	S	S	.	.			trans	-104.1	127	174	-53.3	0	0	0	0	109.6	N640	C638-N640 VanDerWaalsContact C-N 3.26Å; C638-N640 PolarHBondContact O-N 3.46Å
639	S	63.9	Low	82.8	Confident	73 Å²	73	76.4 Å²	76.4	51%	0.51	38%	0.38	S	S	.	.	S	Bend	trans	-68.2	-21.2	-178.8	50.8	0	0	0	0	114.1	F641	S639-F641 PolarHBondContact O-N 3.42Å
640	N	67.8	Low	82.7	Confident	60 Å²	60	72.4 Å²	72.4	32%	0.321	36%	0.363	S	S	.	.			trans	-88.3	108.2	-177.8	-167.6	-9.6	0	0	0	111.8	C638 K642 D643	C638-N640 VanDerWaalsContact C-N 3.26Å; C638-N640 PolarHBondContact O-N 3.46Å; N640-K642 PolarHBondContact O-N 2.72Å; N640-K642 VanDerWaalsContact O-N 3.11Å; N640-K642 WeakPolarHBondContact OD1-CB 3.39Å; N640-K642 PolarHBondContact OD1-N 2.99Å; N640-D643 PolarHBondContact O-N 2.71Å
641	F	60.5	Low	82.4	Confident	152 Å²	152	72.2 Å²	72.2	67%	0.667	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-56.8	-27.5	178.7	-73.6	-98.6	0	0	0	113.7	S639 D643 R644	S639-F641 PolarHBondContact O-N 3.42Å; F641-D643 PolarHBondContact O-N 3.34Å; F641-R644 WeakPolarHBondContact O-CG 3.42Å; F641-R644 PolarHBondContact O-N 2.94Å
642	K	64.4	Low	81.9	Confident	183 Å²	183	76.1 Å²	76.1	80%	0.796	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-63.6	-26	177.4	-62.1	-179.3	179	178.5	0	112.6	N640 R644	N640-K642 PolarHBondContact O-N 2.72Å; N640-K642 VanDerWaalsContact O-N 3.11Å; N640-K642 WeakPolarHBondContact OD1-CB 3.39Å; N640-K642 PolarHBondContact OD1-N 2.99Å; K642-R644 VanDerWaalsContact C-N 3.33Å; K642-R644 PolarHBondContact O-N 3.2Å
643	D	65.8	Low	81.5	Confident	16 Å²	16	77.7 Å²	77.7	9%	0.086	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-84	1.1	-179.3	-72.7	-37.6	0	0	0	113.9	N640 F641 G645 V646 K733	N640-D643 PolarHBondContact O-N 2.71Å; F641-D643 PolarHBondContact O-N 3.34Å; D643-G645 VanDerWaalsContact C-N 3.34Å; D643-G645 PolarHBondContact O-N 2.97Å; D643-V646 HydrophobicContact CB-CB 4.46Å; D643-V646 WeakPolarHBondContact O-CB 3.37Å; D643-V646 PolarHBondContact O-N 3.35Å; D643-K733 HydrophobicContact CB-CD 4.37Å; D643-K733 HydrophobicContact CB-CG 4.43Å; D643-K733 WeakPolarHBondContact O-CE 3.47Å; D643-K733 PolarHBondContact O-NZ 2.92Å
644	R	66.8	Low	81.3	Confident	191 Å²	191	78 Å²	78	72%	0.721	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-42	-175.9	-80.2	-176.6	171.6	-158.1	-3.8	113.6	F641 K642 V646	F641-R644 WeakPolarHBondContact O-CG 3.42Å; F641-R644 PolarHBondContact O-N 2.94Å; K642-R644 VanDerWaalsContact C-N 3.33Å; K642-R644 PolarHBondContact O-N 3.2Å; R644-V646 VanDerWaalsContact C-N 3.34Å
645	G	72.4	Confident	81.1	Confident	79 Å²	79	77.2 Å²	77.2	81%	0.814	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.7	176.1	0	0	0	0	0	115.3	D643	D643-G645 VanDerWaalsContact C-N 3.34Å; D643-G645 PolarHBondContact O-N 2.97Å
646	V	85.5	Confident	80.7	Confident	44 Å²	44	72.1 Å²	72.1	27%	0.267	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-85.6	131.8	-174	-179.1	0	0	0	0	110	D643 R644 R652 K733	D643-V646 HydrophobicContact CB-CB 4.46Å; D643-V646 WeakPolarHBondContact O-CB 3.37Å; D643-V646 PolarHBondContact O-N 3.35Å; R644-V646 VanDerWaalsContact C-N 3.34Å; V646-R652 VanDerWaalsContact CG1-NH2 3.27Å; V646-K733 HydrophobicContact CB-CD 4.21Å; V646-K733 HydrophobicContact CG1-CB 4.31Å; V646-K733 HydrophobicContact CG1-CD 4.4Å; V646-K733 WeakPolarHBondContact O-CD 3.25Å; V646-K733 PolarHBondContact O-NZ 2.83Å
647	K	89	Confident	80.2	Confident	179 Å²	179	74.1 Å²	74.1	78%	0.778	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-74.5	165.1	172.8	-67.9	-172.5	177.4	-176.8	0	111.3	R652	K647-R652 PolarHBondContact O-NH2 3.31Å
648	W	92.4	Very high	80.2	Confident	34 Å²	34	70 Å²	70	13%	0.129	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-73.1	152.7	169.6	-74.8	105.7	0	0	0	112.4	P633 H634 I636 I692 A730 K733 L735	P633-W648 VanDerWaalsContact C-NE1 3.35Å; P633-W648 HydrophobicContact CB-CB 4.47Å; P633-W648 HydrophobicContact CB-CD2 3.78Å; P633-W648 HydrophobicContact CB-CE3 4.17Å; P633-W648 HydrophobicContact CB-CG 3.89Å; P633-W648 WeakPolarHBondContact O-CZ2 3.39Å; P633-W648 PolarHBondContact O-NE1 2.86Å; H634-W648 AromaticContact CD2-CD1 3.9Å; I636-W648 HydrophobicContact CB-CZ2 4.31Å; I636-W648 HydrophobicContact CG2-CH2 4.49Å; I636-W648 HydrophobicContact CG2-CZ2 4.47Å; W648-I692 HydrophobicContact CB-CD1 4.32Å; W648-A730 HydrophobicContact CH2-CB 4.07Å; W648-A730 HydrophobicContact CZ3-CB 3.75Å; W648-K733 HydrophobicContact CD2-CB 3.87Å; W648-K733 HydrophobicContact CD2-CD 4.45Å; W648-K733 HydrophobicContact CD2-CG 4.07Å; W648-K733 HydrophobicContact CE3-CB 3.6Å; W648-K733 HydrophobicContact CE3-CG 4.08Å; W648-K733 HydrophobicContact CH2-CB 4.34Å; W648-K733 HydrophobicContact CH2-CG 4.01Å; W648-K733 HydrophobicContact CZ2-CG 3.98Å; W648-K733 HydrophobicContact CZ3-CB 3.85Å; W648-K733 HydrophobicContact CZ3-CG 4.05Å; W648-L735 HydrophobicContact CE3-CD2 3.69Å; W648-L735 HydrophobicContact CE3-CG 4Å; W648-L735 HydrophobicContact CH2-CD2 4.43Å; W648-L735 HydrophobicContact CZ3-CD2 3.55Å; W648-L735 HydrophobicContact CZ3-CG 4.27Å
649	S	94.6	Very high	80.9	Confident	14 Å²	14	68 Å²	68	10%	0.098	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-153.5	157.5	177.1	54.7	0	0	0	0	109.7	R652 K733 Q734 L735	S649-R652 VanDerWaalsContact OG-CZ 3.29Å; S649-R652 PolarHBondContact OG-NH1 2.91Å; S649-R652 PolarHBondContact OG-NH2 3.42Å; S649-K733 PolarHBondContact N-O 3.41Å; S649-K733 VanDerWaalsContact N-O 3.1Å; S649-K733 PolarHBondContact OG-O 2.8Å; S649-Q734 WeakPolarHBondContact O-CA 3.44Å; S649-L735 PolarHBondContact O-N 2.77Å
650	V	93.2	Very high	81.8	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.012	33%	0.326	C	S	.	.	S	Bend	trans	-72.5	-57.1	168.7	-176.8	0	0	0	0	108.3	M687 T691 I692 Y698 Q734 L735 W736 L739	V650-M687 HydrophobicContact CG1-CE 3.69Å; V650-T691 VanDerWaalsContact CG2-C 3.44Å; V650-T691 WeakPolarHBondContact CG2-O 3.46Å; V650-I692 HydrophobicContact CG2-CD1 4.19Å; V650-Y698 HydrophobicContact CG2-CD1 4.15Å; V650-Y698 HydrophobicContact CG2-CE1 3.69Å; V650-Q734 CarbonylContact O-C 3.53Å; V650-L735 PolarHBondContact O-N 2.97Å; V650-W736 HydrophobicContact CG1-CB 4.33Å; V650-W736 WeakPolarHBondContact O-CB 3.07Å; V650-W736 PolarHBondContact O-N 2.85Å; V650-L739 HydrophobicContact CG1-CD1 4.26Å
651	F	90.8	Very high	82.7	Confident	28 Å²	28	66.6 Å²	66.6	12%	0.123	32%	0.322	C	S	.	.			trans	-147.9	161.2	162.8	50.4	-96.1	0	0	0	110.1	P654 E684 M687 R690 W736	F651-P654 HydrophobicContact CB-CG 3.87Å; F651-P654 HydrophobicContact CD2-CG 3.93Å; F651-P654 HydrophobicContact CG-CG 3.88Å; F651-E684 HydrophobicContact CE2-CG 3.81Å; F651-E684 HydrophobicContact CZ-CG 3.76Å; F651-M687 HydrophobicContact CE1-CB 3.77Å; F651-M687 HydrophobicContact CE1-CG 4.21Å; F651-R690 HydrophobicContact CE1-CB 4.26Å; F651-R690 HydrophobicContact CE1-CG 4.25Å; F651-R690 HydrophobicContact CZ-CB 3.82Å; F651-R690 HydrophobicContact CZ-CG 3.79Å; F651-W736 HydrophobicContact CB-CB 4.41Å; F651-W736 HydrophobicContact CB-CG 4.2Å; F651-W736 HydrophobicContact CD1-CB 4.12Å
652	R	86	Confident	84	Confident	109 Å²	109	60.4 Å²	60.4	41%	0.411	30%	0.301	S	S	.	.	S	Bend	trans	-116.5	-44.6	166.7	-58.5	-178	-176.3	83.8	9.4	111.3	V646 K647 S649 R732	V646-R652 VanDerWaalsContact CG1-NH2 3.27Å; K647-R652 PolarHBondContact O-NH2 3.31Å; S649-R652 VanDerWaalsContact OG-CZ 3.29Å; S649-R652 PolarHBondContact OG-NH1 2.91Å; S649-R652 PolarHBondContact OG-NH2 3.42Å; R652-R732 PolarHBondContact NH1-O 3.22Å
653	T	87.4	Confident	85.1	Confident	65 Å²	65	55.4 Å²	55.4	40%	0.399	28%	0.283	S	S	.	.	S	Bend	trans	-152	96.2	174.1	-43.6	0	0	0	0	103.8	R655 R732	T653-R655 PolarHBondContact O-N 2.82Å; T653-R732 PolarHBondContact O-NH1 3.24Å
654	P	89.8	Confident	86	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.032	28%	0.279	C	S	.	.			trans	-52	129.8	171.6	-22.9	31.8	0	0	0	108.9	F651 P680 V683 W736	F651-P654 HydrophobicContact CB-CG 3.87Å; F651-P654 HydrophobicContact CD2-CG 3.93Å; F651-P654 HydrophobicContact CG-CG 3.88Å; P654-P680 HydrophobicContact CB-CB 4.32Å; P654-P680 HydrophobicContact CG-CB 4.31Å; P654-V683 HydrophobicContact CB-CB 4.18Å; P654-V683 HydrophobicContact CB-CG1 4.09Å; P654-V683 HydrophobicContact CB-CG2 4.22Å; P654-V683 HydrophobicContact CG-CB 4.27Å; P654-V683 HydrophobicContact CG-CG1 4.12Å; P654-W736 HydrophobicContact CB-CH2 4.41Å; P654-W736 HydrophobicContact CB-CZ2 4.03Å
655	R	87.3	Confident	86.8	Confident	130 Å²	130	46.9 Å²	46.9	49%	0.491	26%	0.258	S	S	.	.			trans	-135.5	147.3	172	-65.7	179.4	-180	-171.5	-2.3	108.7	T653 S657 D658	T653-R655 PolarHBondContact O-N 2.82Å; R655-S657 WeakPolarHBondContact CB-OG 3.45Å; R655-S657 PolarHBondContact O-N 2.81Å; R655-D658 PolarHBondContact N-OD2 2.85Å; R655-D658 VanDerWaalsContact O-CB 3.26Å; R655-D658 WeakPolarHBondContact O-CB 3.45Å; R655-D658 VanDerWaalsContact O-CG 3.28Å; R655-D658 PolarHBondContact O-N 3.04Å
656	P	84.4	Confident	87.4	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.026	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-56.9	-32.7	174	-25.9	35.9	0	0	0	112.6	D658 I659 A674 A677 E678	P656-D658 PolarHBondContact O-N 3.4Å; P656-D658 VanDerWaalsContact O-N 3.09Å; P656-I659 WeakPolarHBondContact O-CB 3.47Å; P656-I659 PolarHBondContact O-N 3.1Å; P656-A674 HydrophobicContact CB-CB 4.12Å; P656-A674 WeakPolarHBondContact CG-O 3.38Å; P656-A677 HydrophobicContact CG-CB 3.91Å; P656-E678 VanDerWaalsContact CG-CD 3.49Å; P656-E678 HydrophobicContact CG-CG 3.94Å; P656-E678 WeakPolarHBondContact CG-OE1 3.47Å
657	S	82.2	Confident	87.3	Confident	54 Å²	54	42.8 Å²	42.8	38%	0.378	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-60.9	-12.7	173	60.4	0	0	0	0	115.2	R655 I659	R655-S657 WeakPolarHBondContact CB-OG 3.45Å; R655-S657 PolarHBondContact O-N 2.81Å; S657-I659 VanDerWaalsContact C-N 3.31Å
658	D	86.5	Confident	87.1	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.011	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-81.9	-14.8	175	-52.6	-24.6	0	0	0	111.7	R655 P656 L660 Q731 R732 Q734 W736	R655-D658 PolarHBondContact N-OD2 2.85Å; R655-D658 VanDerWaalsContact O-CB 3.26Å; R655-D658 WeakPolarHBondContact O-CB 3.45Å; R655-D658 VanDerWaalsContact O-CG 3.28Å; R655-D658 PolarHBondContact O-N 3.04Å; P656-D658 PolarHBondContact O-N 3.4Å; P656-D658 VanDerWaalsContact O-N 3.09Å; D658-L660 PolarHBondContact O-N 2.97Å; D658-Q731 HydrophobicContact CB-CB 4.41Å; D658-R732 VanDerWaalsContact OD1-CD 3.24Å; D658-R732 WeakPolarHBondContact OD1-CD 3.3Å; D658-R732 IonicContact OD1-CZ 3.76Å; D658-R732 IonicContact OD1-NE 3.23Å; D658-R732 IonicContact OD1-NH1 3.73Å; D658-R732 PolarHBondContact OD1-NH1 2.89Å; D658-R732 IonicContact OD2-NH1 3.65Å; D658-R732 PolarHBondContact OD2-NH1 2.88Å; D658-Q734 PolarHBondContact OD2-NE2 3.31Å; D658-W736 HydrophobicContact CB-CZ2 3.95Å
659	I	87.6	Confident	87	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	96	-174.7	-54.1	168.6	0	0	0	109.6	P656 S657 L670 L673 A674 A677 W736 V737	P656-I659 WeakPolarHBondContact O-CB 3.47Å; P656-I659 PolarHBondContact O-N 3.1Å; S657-I659 VanDerWaalsContact C-N 3.31Å; I659-L670 HydrophobicContact CG2-CB 3.83Å; I659-L670 HydrophobicContact CG2-CD2 4.12Å; I659-L670 HydrophobicContact CG2-CG 4.4Å; I659-L673 VanDerWaalsContact CD1-C 3.49Å; I659-L673 HydrophobicContact CD1-CB 4.11Å; I659-L673 HydrophobicContact CD1-CD2 4.39Å; I659-L673 HydrophobicContact CD1-CG 3.94Å; I659-A674 VanDerWaalsContact CD1-CA 3.42Å; I659-A674 HydrophobicContact CD1-CB 3.81Å; I659-A674 VanDerWaalsContact CD1-N 3.32Å; I659-A677 HydrophobicContact CD1-CB 4.38Å; I659-W736 HydrophobicContact CD1-CH2 3.81Å; I659-W736 HydrophobicContact CD1-CZ3 4.44Å; I659-W736 HydrophobicContact CG1-CH2 3.73Å; I659-W736 HydrophobicContact CG1-CZ2 4.14Å; I659-W736 HydrophobicContact CG1-CZ3 4.48Å; I659-V737 HydrophobicContact CB-CG1 4.46Å; I659-V737 HydrophobicContact CG1-CG1 4.3Å; I659-V737 HydrophobicContact CG1-CG2 3.93Å; I659-V737 HydrophobicContact CG2-CG1 4.05Å
660	L	84.2	Confident	86.8	Confident	51 Å²	51	32.4 Å²	32.4	27%	0.267	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.1	167.4	-59.9	179.8	0	0	0	110.3	D658 S728 Q729 Q731	D658-L660 PolarHBondContact O-N 2.97Å; L660-S728 WeakPolarHBondContact O-CA 2.99Å; L660-Q729 HydrophobicContact CB-CB 4.1Å; L660-Q729 HydrophobicContact CB-CG 4.11Å; L660-Q729 PolarHBondContact O-N 2.91Å; L660-Q731 HydrophobicContact CD1-CG 3.83Å; L660-Q731 HydrophobicContact CG-CG 4.09Å
661	Q	85.4	Confident	86.4	Confident	53 Å²	53	32.5 Å²	32.5	25%	0.248	17%	0.173	C	C	.	.			trans	-73.1	139.4	177.2	-176.8	177.5	-8.1	0	0	110.9	L664 L670	Q661-L664 PolarHBondContact NE2-O 2.92Å; Q661-L670 HydrophobicContact CB-CD1 3.64Å; Q661-L670 HydrophobicContact CG-CD1 3.75Å
662	G	88.1	Confident	86.4	Confident	22 Å²	22	31.1 Å²	31.1	23%	0.227	17%	0.167	C	C	.	.			trans	-95.1	-143	171.7	0	0	0	0	0	112.7	L664 F727	G662-L664 PolarHBondContact O-N 2.83Å; G662-F727 VanDerWaalsContact CA-O 3.23Å; G662-F727 WeakPolarHBondContact CA-O 3.25Å; G662-F727 PolarHBondContact N-O 2.77Å
663	L	87.4	Confident	86.7	Confident	79 Å²	79	26 Å²	26	41%	0.414	15%	0.147	S	C	.	.	S	Bend	trans	-74.1	-3.7	-177.6	-56.3	-175.3	0	0	0	114.6	V623 L726	V623-L663 HydrophobicContact CG1-CB 4.5Å; L663-L726 HydrophobicContact CD1-CD2 3.72Å; L663-L726 HydrophobicContact CG-CD2 4.46Å; L663-L726 PolarHBondContact N-O 2.91Å
664	L	85.7	Confident	86.8	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	13%	0.128	C	C	.	.	S	Bend	trans	-88	135	-174.8	-172.4	54.7	0	0	0	111.8	F617 Q661 G662 N666 F727 Y751 L754	F617-L664 HydrophobicContact CE2-CD1 4.07Å; F617-L664 HydrophobicContact CZ-CD1 4.01Å; Q661-L664 PolarHBondContact NE2-O 2.92Å; G662-L664 PolarHBondContact O-N 2.83Å; L664-N666 HydrophobicContact CD2-CB 4.27Å; L664-N666 HydrophobicContact CG-CB 4.03Å; L664-N666 PolarHBondContact O-N 2.85Å; L664-N666 PolarHBondContact O-OD1 3.47Å; L664-F727 HydrophobicContact CB-CD1 3.76Å; L664-F727 HydrophobicContact CB-CE1 4.19Å; L664-F727 HydrophobicContact CB-CG 4.45Å; L664-F727 HydrophobicContact CD2-CD1 4.42Å; L664-Y751 WeakPolarHBondContact CD1-O 3.48Å; L664-Y751 HydrophobicContact CD2-CD1 3.94Å; L664-L754 HydrophobicContact CD2-CB 4.25Å; L664-L754 HydrophobicContact CD2-CD1 4.3Å
665	G	82.6	Confident	86.9	Confident	26 Å²	26	22.8 Å²	22.8	27%	0.268	13%	0.128	S	C	.	.	S	Bend	trans	-77.2	42.7	178.9	0	0	0	0	0	114.8	A756	G665-A756 PolarHBondContact O-N 2.69Å
666	N	86.3	Confident	87.1	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	11%	0.105	C	C	.	.			trans	-107	24.9	-175	68.9	-18.1	0	0	0	114	L664 W668 F669 L670 E741 L754	L664-N666 HydrophobicContact CD2-CB 4.27Å; L664-N666 HydrophobicContact CG-CB 4.03Å; L664-N666 PolarHBondContact O-N 2.85Å; L664-N666 PolarHBondContact O-OD1 3.47Å; N666-W668 PolarHBondContact O-N 3.03Å; N666-F669 PolarHBondContact O-N 2.85Å; N666-L670 PolarHBondContact O-N 2.99Å; N666-L670 WeakPolarHBondContact OD1-CD1 3.17Å; N666-E741 PolarHBondContact ND2-OE1 3.41Å; N666-L754 HydrophobicContact CB-CB 3.98Å; N666-L754 WeakPolarHBondContact CB-O 3.23Å
667	C	82.1	Confident	87.5	Confident	37 Å²	37	16.6 Å²	16.6	25%	0.25	11%	0.105	C	C	.	.	H	α-helix	trans	-47.4	-36.5	179.6	53.9	0	0	0	0	113.8	F669 L670 S671	C667-F669 VanDerWaalsContact C-N 3.26Å; C667-F669 PolarHBondContact O-N 2.91Å; C667-L670 PolarHBondContact O-N 3.28Å; C667-S671 VanDerWaalsContact O-CB 3.25Å; C667-S671 WeakPolarHBondContact O-CB 3.41Å; C667-S671 PolarHBondContact O-N 3.38Å; C667-S671 PolarHBondContact O-OG 3.04Å
668	W	86.1	Confident	87.8	Confident	6 Å²	6	17 Å²	17	2%	0.023	10%	0.101	C	C	.	.	H	α-helix	trans	-53.6	-39.8	175.1	68.1	-85.9	0	0	0	113.4	N666 A672 L744 L754 A756 G757 E761	N666-W668 PolarHBondContact O-N 3.03Å; W668-A672 PolarHBondContact O-N 3.36Å; W668-L744 HydrophobicContact CH2-CD2 4.14Å; W668-L744 HydrophobicContact CZ2-CD2 4.4Å; W668-L754 PolarHBondContact NE1-O 3.22Å; W668-A756 PolarHBondContact NE1-O 2.72Å; W668-A756 VanDerWaalsContact NE1-O 3.15Å; W668-G757 VanDerWaalsContact CB-C 3.41Å; W668-E761 HydrophobicContact CE3-CB 4.17Å; W668-E761 HydrophobicContact CZ3-CB 3.94Å
669	F	89.9	Confident	88	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-82.7	-45.3	-178.4	179.7	-111.7	0	0	0	111.4	N666 C667 S671 A672 L673 I740 L744 L766	N666-F669 PolarHBondContact O-N 2.85Å; C667-F669 VanDerWaalsContact C-N 3.26Å; C667-F669 PolarHBondContact O-N 2.91Å; F669-S671 VanDerWaalsContact C-N 3.28Å; F669-S671 PolarHBondContact O-N 2.92Å; F669-A672 WeakPolarHBondContact O-CB 3.3Å; F669-A672 PolarHBondContact O-N 3.41Å; F669-A672 VanDerWaalsContact O-N 3.16Å; F669-L673 WeakPolarHBondContact O-CB 3.41Å; F669-L673 PolarHBondContact O-N 2.79Å; F669-I740 HydrophobicContact CE1-CG2 3.81Å; F669-I740 HydrophobicContact CZ-CG2 3.55Å; F669-L744 HydrophobicContact CB-CD2 4.26Å; F669-L744 HydrophobicContact CD1-CD2 3.62Å; F669-L744 HydrophobicContact CD2-CD2 3.53Å; F669-L744 HydrophobicContact CE1-CB 4.39Å; F669-L744 HydrophobicContact CE1-CD2 3.73Å; F669-L744 HydrophobicContact CE2-CD2 3.65Å; F669-L744 HydrophobicContact CG-CD2 3.5Å; F669-L744 HydrophobicContact CZ-CB 4.33Å; F669-L744 HydrophobicContact CZ-CD2 3.74Å; F669-L744 HydrophobicContact CZ-CG 4.48Å; F669-L766 HydrophobicContact CE2-CD1 4Å; F669-L766 HydrophobicContact CE2-CD2 3.84Å; F669-L766 HydrophobicContact CE2-CG 3.79Å; F669-L766 HydrophobicContact CZ-CD2 3.83Å; F669-L766 HydrophobicContact CZ-CG 4.29Å
670	L	89.5	Confident	88.2	Confident	4 Å²	4	22.2 Å²	22.2	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-65.7	-32.1	179.7	-63.4	-179.4	0	0	0	112	I659 Q661 N666 C667 L673 A674 V737	I659-L670 HydrophobicContact CG2-CB 3.83Å; I659-L670 HydrophobicContact CG2-CD2 4.12Å; I659-L670 HydrophobicContact CG2-CG 4.4Å; Q661-L670 HydrophobicContact CB-CD1 3.64Å; Q661-L670 HydrophobicContact CG-CD1 3.75Å; N666-L670 PolarHBondContact O-N 2.99Å; N666-L670 WeakPolarHBondContact OD1-CD1 3.17Å; C667-L670 PolarHBondContact O-N 3.28Å; L670-L673 PolarHBondContact O-N 3.04Å; L670-A674 PolarHBondContact O-N 2.89Å; L670-V737 HydrophobicContact CD2-CG1 4.11Å
671	S	84.4	Confident	88.6	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-71.1	-38.9	172.2	-52.3	0	0	0	0	112.1	C667 F669 L673 A674 V675 A833	C667-S671 VanDerWaalsContact O-CB 3.25Å; C667-S671 WeakPolarHBondContact O-CB 3.41Å; C667-S671 PolarHBondContact O-N 3.38Å; C667-S671 PolarHBondContact O-OG 3.04Å; F669-S671 VanDerWaalsContact C-N 3.28Å; F669-S671 PolarHBondContact O-N 2.92Å; S671-L673 VanDerWaalsContact C-N 3.3Å; S671-L673 PolarHBondContact O-N 3.37Å; S671-A674 WeakPolarHBondContact O-CB 3.47Å; S671-A674 PolarHBondContact O-N 2.89Å; S671-V675 WeakPolarHBondContact O-CG2 3.47Å; S671-V675 PolarHBondContact O-N 3.36Å; S671-A833 PolarHBondContact OG-O 2.7Å
672	A	91.6	Very high	89	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-35.3	171.9	0	0	0	0	0	112.4	W668 F669 A674 V675 L676 A759 L763 L766	W668-A672 PolarHBondContact O-N 3.36Å; F669-A672 WeakPolarHBondContact O-CB 3.3Å; F669-A672 PolarHBondContact O-N 3.41Å; F669-A672 VanDerWaalsContact O-N 3.16Å; A672-A674 VanDerWaalsContact C-N 3.33Å; A672-V675 PolarHBondContact O-N 2.88Å; A672-L676 PolarHBondContact O-N 3Å; A672-A759 WeakPolarHBondContact CB-O 3.39Å; A672-L763 HydrophobicContact CB-CD2 4.15Å; A672-L763 HydrophobicContact CB-CG 3.97Å; A672-L766 HydrophobicContact CB-CD1 4.28Å
673	L	93.3	Very high	89.3	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-69.2	-30.7	173.1	-170.8	62.1	0	0	0	112	I659 F669 L670 S671 L676 A677 W736 V737 I740 L766	I659-L673 VanDerWaalsContact CD1-C 3.49Å; I659-L673 HydrophobicContact CD1-CB 4.11Å; I659-L673 HydrophobicContact CD1-CD2 4.39Å; I659-L673 HydrophobicContact CD1-CG 3.94Å; F669-L673 WeakPolarHBondContact O-CB 3.41Å; F669-L673 PolarHBondContact O-N 2.79Å; L670-L673 PolarHBondContact O-N 3.04Å; S671-L673 VanDerWaalsContact C-N 3.3Å; S671-L673 PolarHBondContact O-N 3.37Å; L673-L676 HydrophobicContact CD1-CD2 4.07Å; L673-L676 WeakPolarHBondContact O-CB 3.45Å; L673-L676 PolarHBondContact O-N 2.9Å; L673-A677 VanDerWaalsContact O-CB 3.27Å; L673-A677 WeakPolarHBondContact O-CB 3.12Å; L673-A677 PolarHBondContact O-N 2.87Å; L673-W736 HydrophobicContact CD1-CZ3 3.88Å; L673-W736 HydrophobicContact CD2-CE3 4.46Å; L673-W736 HydrophobicContact CD2-CZ3 3.95Å; L673-W736 HydrophobicContact CG-CH2 4.46Å; L673-W736 HydrophobicContact CG-CZ3 3.77Å; L673-V737 HydrophobicContact CD2-CG1 4.16Å; L673-I740 HydrophobicContact CD1-CD1 3.96Å; L673-I740 HydrophobicContact CD1-CG2 4.38Å; L673-I740 HydrophobicContact CD2-CD1 4.46Å; L673-I740 HydrophobicContact CD2-CG2 4.25Å; L673-L766 HydrophobicContact CB-CD1 4.1Å; L673-L766 HydrophobicContact CD1-CD1 4Å; L673-L766 HydrophobicContact CD1-CD2 3.89Å
674	A	89.2	Confident	89.5	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.2	-46.1	171.9	0	0	0	0	0	111.9	P656 I659 L670 S671 A672 L676 A677 E678 P853	P656-A674 HydrophobicContact CB-CB 4.12Å; P656-A674 WeakPolarHBondContact CG-O 3.38Å; I659-A674 VanDerWaalsContact CD1-CA 3.42Å; I659-A674 HydrophobicContact CD1-CB 3.81Å; I659-A674 VanDerWaalsContact CD1-N 3.32Å; L670-A674 PolarHBondContact O-N 2.89Å; S671-A674 WeakPolarHBondContact O-CB 3.47Å; S671-A674 PolarHBondContact O-N 2.89Å; A672-A674 VanDerWaalsContact C-N 3.33Å; A674-L676 VanDerWaalsContact C-N 3.26Å; A674-L676 PolarHBondContact O-N 2.89Å; A674-A677 PolarHBondContact O-N 3.07Å; A674-E678 PolarHBondContact O-N 2.84Å; A674-P853 HydrophobicContact CB-CB 3.7Å; A674-P853 HydrophobicContact CB-CG 3.84Å
675	V	90.1	Very high	89.9	Confident	4 Å²	4	21.5 Å²	21.5	2%	0.024	11%	0.111	C	C	.	.	H	α-helix	trans	-56.4	-42.2	171.5	177.5	0	0	0	0	110.7	S671 A672 L763 L806 S835	S671-V675 WeakPolarHBondContact O-CG2 3.47Å; S671-V675 PolarHBondContact O-N 3.36Å; A672-V675 PolarHBondContact O-N 2.88Å; V675-L763 HydrophobicContact CB-CD2 4.11Å; V675-L763 HydrophobicContact CG1-CD2 3.95Å; V675-L806 HydrophobicContact CG1-CB 3.8Å; V675-L806 HydrophobicContact CG1-CD1 4.18Å; V675-L806 HydrophobicContact CG1-CD2 4.21Å; V675-L806 HydrophobicContact CG1-CG 4.29Å; V675-S835 VanDerWaalsContact CG2-OG 3.25Å; V675-S835 WeakPolarHBondContact CG2-OG 3.31Å
676	L	93.4	Very high	90.5	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-63.3	-39.5	175.2	-163.7	81.9	0	0	0	112.4	A672 L673 A674 E678 R679 L682 V683 V686 L766 T767 L806	A672-L676 PolarHBondContact O-N 3Å; L673-L676 HydrophobicContact CD1-CD2 4.07Å; L673-L676 WeakPolarHBondContact O-CB 3.45Å; L673-L676 PolarHBondContact O-N 2.9Å; A674-L676 VanDerWaalsContact C-N 3.26Å; A674-L676 PolarHBondContact O-N 2.89Å; L676-E678 VanDerWaalsContact C-N 3.31Å; L676-E678 PolarHBondContact O-N 3.04Å; L676-R679 CarbonylContact O-C 3.6Å; L676-R679 PolarHBondContact O-N 3.06Å; L676-L682 HydrophobicContact CD1-CB 3.71Å; L676-L682 HydrophobicContact CD1-CD1 4.03Å; L676-L682 HydrophobicContact CG-CB 3.86Å; L676-V683 HydrophobicContact CD2-CG2 4.13Å; L676-V683 HydrophobicContact CG-CG2 4.36Å; L676-V686 HydrophobicContact CD2-CG2 3.93Å; L676-L766 HydrophobicContact CB-CD1 4.45Å; L676-L766 HydrophobicContact CD1-CB 4.4Å; L676-L766 HydrophobicContact CD2-CB 4.14Å; L676-L766 HydrophobicContact CD2-CD1 4.24Å; L676-L766 HydrophobicContact CD2-CD2 4.28Å; L676-L766 HydrophobicContact CD2-CG 4.45Å; L676-T767 HydrophobicContact CD1-CG2 3.68Å; L676-L806 HydrophobicContact CD1-CD1 3.94Å
677	A	92.1	Very high	90.9	Very high	2 Å²	2	20.4 Å²	20.4	2%	0.017	10%	0.099	C	C	.	.	H	α-helix	trans	-76.5	-9.5	-174	0	0	0	0	0	115	P656 I659 L673 A674 R679 V683 W736	P656-A677 HydrophobicContact CG-CB 3.91Å; I659-A677 HydrophobicContact CD1-CB 4.38Å; L673-A677 VanDerWaalsContact O-CB 3.27Å; L673-A677 WeakPolarHBondContact O-CB 3.12Å; L673-A677 PolarHBondContact O-N 2.87Å; A674-A677 PolarHBondContact O-N 3.07Å; A677-R679 PolarHBondContact O-N 2.8Å; A677-V683 HydrophobicContact CB-CG2 3.92Å; A677-W736 HydrophobicContact CB-CH2 3.71Å; A677-W736 HydrophobicContact CB-CZ3 4.44Å
678	E	88.8	Confident	91.4	Very high	63 Å²	63	20 Å²	20	29%	0.294	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.7	163.4	-59.9	-67.3	-178.9	0	0	112	P656 A674 L676 L837 R851	P656-E678 VanDerWaalsContact CG-CD 3.49Å; P656-E678 HydrophobicContact CG-CG 3.94Å; P656-E678 WeakPolarHBondContact CG-OE1 3.47Å; A674-E678 PolarHBondContact O-N 2.84Å; L676-E678 VanDerWaalsContact C-N 3.31Å; L676-E678 PolarHBondContact O-N 3.04Å; E678-L837 VanDerWaalsContact CD-CD2 3.47Å; E678-L837 HydrophobicContact CG-CD2 3.6Å; E678-L837 VanDerWaalsContact OE1-CD2 3.26Å; E678-L837 WeakPolarHBondContact OE1-CD2 3.47Å; E678-R851 VanDerWaalsContact CD-NH1 3.32Å; E678-R851 WeakPolarHBondContact OE1-CD 3.24Å; E678-R851 IonicContact OE1-CZ 3.98Å; E678-R851 IonicContact OE1-NE 2.61Å; E678-R851 IonicContact OE1-NH1 3.76Å; E678-R851 PolarHBondContact OE1-NH1 2.82Å; E678-R851 IonicContact OE2-NH1 3.39Å; E678-R851 PolarHBondContact OE2-NH1 3.14Å; E678-R851 VanDerWaalsContact OE2-NH1 3.1Å
679	R	90.9	Very high	91.8	Very high	71 Å²	71	20.2 Å²	20.2	27%	0.268	10%	0.096	S	C	.	.	S	Bend	trans	-123	83.1	172.6	-71.2	-174	61.1	170.2	-1.1	109.8	L676 A677 E681 L682 G804 L806	L676-R679 CarbonylContact O-C 3.6Å; L676-R679 PolarHBondContact O-N 3.06Å; A677-R679 PolarHBondContact O-N 2.8Å; R679-E681 WeakPolarHBondContact CA-OE2 3.34Å; R679-E681 WeakPolarHBondContact CB-OE2 3.34Å; R679-E681 IonicContact CZ-OE1 2.82Å; R679-E681 VanDerWaalsContact CZ-OE1 3.26Å; R679-E681 IonicContact NE-OE1 3.66Å; R679-E681 PolarHBondContact NE-OE1 2.96Å; R679-E681 IonicContact NH2-OE1 2.83Å; R679-E681 PolarHBondContact NH2-OE1 2.94Å; R679-E681 PolarHBondContact O-N 3.23Å; R679-L682 HydrophobicContact CB-CD1 3.68Å; R679-L682 HydrophobicContact CB-CG 3.85Å; R679-L682 HydrophobicContact CG-CD1 4.45Å; R679-L682 WeakPolarHBondContact O-CB 3.47Å; R679-L682 PolarHBondContact O-N 2.9Å; R679-G804 PolarHBondContact NH1-O 2.8Å; R679-L806 HydrophobicContact CG-CD2 4.28Å
680	P	91.2	Very high	91.9	Very high	43 Å²	43	24.7 Å²	24.7	28%	0.279	11%	0.113	S	C	.	.	H	α-helix	trans	-55.4	-27.9	-172.4	-28.3	36.4	0	0	0	114.5	P654 L682 V683 E684	P654-P680 HydrophobicContact CB-CB 4.32Å; P654-P680 HydrophobicContact CG-CB 4.31Å; P680-L682 PolarHBondContact O-N 2.77Å; P680-L682 VanDerWaalsContact O-N 3.16Å; P680-V683 PolarHBondContact O-N 3.31Å; P680-E684 PolarHBondContact O-N 2.7Å; P680-E684 VanDerWaalsContact O-N 3.09Å
681	E	92.2	Very high	92	Very high	70 Å²	70	29.2 Å²	29.2	33%	0.327	14%	0.141	S	C	.	.	H	α-helix	trans	-69	-7.3	176.7	86.8	-68.8	174.8	0	0	113.8	R679 R685	R679-E681 WeakPolarHBondContact CA-OE2 3.34Å; R679-E681 WeakPolarHBondContact CB-OE2 3.34Å; R679-E681 IonicContact CZ-OE1 2.82Å; R679-E681 VanDerWaalsContact CZ-OE1 3.26Å; R679-E681 IonicContact NE-OE1 3.66Å; R679-E681 PolarHBondContact NE-OE1 2.96Å; R679-E681 IonicContact NH2-OE1 2.83Å; R679-E681 PolarHBondContact NH2-OE1 2.94Å; R679-E681 PolarHBondContact O-N 3.23Å; E681-R685 WeakPolarHBondContact O-CG 3.36Å; E681-R685 PolarHBondContact O-NE 3.15Å
682	L	93.8	Very high	92.5	Very high	9 Å²	9	31.6 Å²	31.6	5%	0.047	15%	0.153	C	C	.	.	H	α-helix	trans	-93.5	-38.6	170.7	-56.9	-178.1	0	0	0	111.8	L676 R679 P680 E684 R685 V686 L806 I907	L676-L682 HydrophobicContact CD1-CB 3.71Å; L676-L682 HydrophobicContact CD1-CD1 4.03Å; L676-L682 HydrophobicContact CG-CB 3.86Å; R679-L682 HydrophobicContact CB-CD1 3.68Å; R679-L682 HydrophobicContact CB-CG 3.85Å; R679-L682 HydrophobicContact CG-CD1 4.45Å; R679-L682 WeakPolarHBondContact O-CB 3.47Å; R679-L682 PolarHBondContact O-N 2.9Å; P680-L682 PolarHBondContact O-N 2.77Å; P680-L682 VanDerWaalsContact O-N 3.16Å; L682-E684 PolarHBondContact O-N 3.39Å; L682-R685 WeakPolarHBondContact O-CB 3.43Å; L682-R685 PolarHBondContact O-N 3.26Å; L682-V686 PolarHBondContact O-N 3.09Å; L682-L806 HydrophobicContact CD1-CD1 3.88Å; L682-L806 HydrophobicContact CD1-CG 4.37Å; L682-I907 HydrophobicContact CD1-CD1 3.56Å; L682-I907 HydrophobicContact CD2-CG2 4.4Å
683	V	94.8	Very high	92.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.5	-39.4	170.4	-178.7	0	0	0	0	110.1	P654 L676 A677 P680 R685 V686 M687 W736	P654-V683 HydrophobicContact CB-CB 4.18Å; P654-V683 HydrophobicContact CB-CG1 4.09Å; P654-V683 HydrophobicContact CB-CG2 4.22Å; P654-V683 HydrophobicContact CG-CB 4.27Å; P654-V683 HydrophobicContact CG-CG1 4.12Å; L676-V683 HydrophobicContact CD2-CG2 4.13Å; L676-V683 HydrophobicContact CG-CG2 4.36Å; A677-V683 HydrophobicContact CB-CG2 3.92Å; P680-V683 PolarHBondContact O-N 3.31Å; V683-R685 PolarHBondContact O-N 2.82Å; V683-V686 PolarHBondContact O-N 3.12Å; V683-V686 VanDerWaalsContact O-N 3.12Å; V683-M687 PolarHBondContact O-N 2.72Å; V683-W736 HydrophobicContact CG1-CD2 4.07Å; V683-W736 HydrophobicContact CG1-CE3 3.41Å; V683-W736 VanDerWaalsContact CG1-CE3 3.41Å; V683-W736 HydrophobicContact CG1-CH2 4.45Å; V683-W736 HydrophobicContact CG1-CZ3 3.63Å; V683-W736 HydrophobicContact CG2-CH2 4.44Å; V683-W736 HydrophobicContact CG2-CZ3 4.06Å
684	E	92.4	Very high	92.7	Very high	64 Å²	64	36.5 Å²	36.5	30%	0.299	19%	0.185	S	C	.	.	H	α-helix	trans	-61.1	-23.2	172.1	-81.1	-166.6	-155.9	0	0	115.1	F651 P680 L682 M687 R690	F651-E684 HydrophobicContact CE2-CG 3.81Å; F651-E684 HydrophobicContact CZ-CG 3.76Å; P680-E684 PolarHBondContact O-N 2.7Å; P680-E684 VanDerWaalsContact O-N 3.09Å; L682-E684 PolarHBondContact O-N 3.39Å; E684-M687 VanDerWaalsContact O-O 3.14Å; E684-R690 PolarHBondContact O-NE 2.84Å; E684-R690 PolarHBondContact O-NH2 2.97Å; E684-R690 IonicContact OE2-CZ 3.86Å; E684-R690 IonicContact OE2-NH1 3.4Å; E684-R690 PolarHBondContact OE2-NH1 2.89Å; E684-R690 IonicContact OE2-NH2 2.96Å
685	R	92.4	Very high	93.1	Very high	47 Å²	47	37.4 Å²	37.4	18%	0.177	19%	0.189	C	C	.	.	H	α-helix	trans	-88	-13.9	176	-64.7	176.5	-139.1	-166.9	12.2	112.9	E575 E681 L682 V683	E575-R685 WeakPolarHBondContact OE1-CD 3.3Å; E575-R685 IonicContact OE1-CZ 3.73Å; E575-R685 IonicContact OE1-NE 3.6Å; E575-R685 IonicContact OE1-NH1 2.72Å; E575-R685 PolarHBondContact OE1-NH1 3.04Å; E681-R685 WeakPolarHBondContact O-CG 3.36Å; E681-R685 PolarHBondContact O-NE 3.15Å; L682-R685 WeakPolarHBondContact O-CB 3.43Å; L682-R685 PolarHBondContact O-N 3.26Å; V683-R685 PolarHBondContact O-N 2.82Å
686	V	95.6	Very high	93.4	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-89	-40.1	171.5	176	0	0	0	0	110.2	L676 L682 V683 V700 R701 L702 I740 L766	L676-V686 HydrophobicContact CD2-CG2 3.93Å; L682-V686 PolarHBondContact O-N 3.09Å; V683-V686 PolarHBondContact O-N 3.12Å; V683-V686 VanDerWaalsContact O-N 3.12Å; V686-V700 HydrophobicContact CG1-CG1 3.63Å; V686-V700 CarbonylContact O-C 3.56Å; V686-V700 WeakPolarHBondContact O-CA 3.41Å; V686-V700 WeakPolarHBondContact O-CG1 3.35Å; V686-R701 PolarHBondContact O-N 3.04Å; V686-L702 HydrophobicContact CG1-CD2 3.98Å; V686-I740 HydrophobicContact CB-CD1 4.5Å; V686-I740 HydrophobicContact CG1-CD1 3.82Å; V686-I740 HydrophobicContact CG1-CG1 3.99Å; V686-I740 HydrophobicContact CG1-CG2 4.42Å; V686-L766 HydrophobicContact CG1-CD2 4.13Å; V686-L766 HydrophobicContact CG2-CB 4.47Å; V686-L766 HydrophobicContact CG2-CD2 4.17Å; V686-L766 WeakPolarHBondContact CG2-O 3.22Å
687	M	94.8	Very high	93.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-89.1	108.3	177.1	-71.6	-55.6	-58.2	0	0	112.8	V650 F651 V683 E684 R690 V700 W736 L739 I740	V650-M687 HydrophobicContact CG1-CE 3.69Å; F651-M687 HydrophobicContact CE1-CB 3.77Å; F651-M687 HydrophobicContact CE1-CG 4.21Å; V683-M687 PolarHBondContact O-N 2.72Å; E684-M687 VanDerWaalsContact O-O 3.14Å; M687-R690 WeakPolarHBondContact O-CG 3.45Å; M687-V700 HydrophobicContact CE-CG2 4.14Å; M687-V700 HydrophobicContact SD-CB 4.5Å; M687-V700 HydrophobicContact SD-CG1 4.19Å; M687-V700 HydrophobicContact SD-CG2 3.77Å; M687-W736 HydrophobicContact CG-CB 4.3Å; M687-L739 HydrophobicContact CE-CB 4.14Å; M687-L739 HydrophobicContact CE-CD1 4Å; M687-L739 HydrophobicContact SD-CB 4.49Å; M687-I740 HydrophobicContact CG-CD1 4.04Å; M687-I740 HydrophobicContact CG-CG1 4.2Å; M687-I740 HydrophobicContact SD-CD1 4.01Å; M687-I740 HydrophobicContact SD-CG1 3.48Å; M687-I740 WeakPolarHBondContact SD-CG1 3.23Å
688	I	93.9	Very high	93.8	Very high	30 Å²	30	37 Å²	37	15%	0.154	19%	0.187	C	C	.	.	S	Bend	trans	-82.2	-46.1	178.5	-49.6	-42.5	0	0	0	110.4	E582 R690 Q699 R701 T710	E582-I688 HydrophobicContact CG-CD1 3.63Å; E582-I688 HydrophobicContact CG-CG1 4.32Å; E582-I688 HydrophobicContact CG-CG2 4.24Å; E582-I688 WeakPolarHBondContact OE1-CD1 3.21Å; I688-R690 PolarHBondContact O-N 3.38Å; I688-R690 VanDerWaalsContact O-N 3.15Å; I688-Q699 HydrophobicContact CB-CB 3.91Å; I688-Q699 HydrophobicContact CG1-CB 4.48Å; I688-Q699 HydrophobicContact CG2-CB 4.42Å; I688-Q699 PolarHBondContact N-O 3.38Å; I688-R701 HydrophobicContact CD1-CB 3.7Å; I688-R701 HydrophobicContact CG1-CB 3.93Å; I688-T710 HydrophobicContact CG1-CG2 4.06Å
689	T	94	Very high	94.2	Very high	9 Å²	9	34.2 Å²	34.2	6%	0.055	17%	0.173	C	C	.	.			trans	-82.1	92.7	172	-49.8	0	0	0	0	109.7	W589 Y698 Q699	W589-T689 HydrophobicContact CZ2-CG2 3.9Å; T689-Y698 HydrophobicContact CG2-CD1 3.58Å; T689-Y698 HydrophobicContact CG2-CE1 4.15Å; T689-Y698 HydrophobicContact CG2-CG 4.3Å; T689-Q699 PolarHBondContact N-O 2.81Å; T689-Q699 PolarHBondContact OG1-N 3.35Å
690	R	91.3	Very high	94.6	Very high	95 Å²	95	30.9 Å²	30.9	36%	0.358	16%	0.161	S	C	.	.			trans	-85.4	-14.2	-173	-59.6	-177.5	176.7	-162.7	-0.9	115	F651 E684 M687 I688	F651-R690 HydrophobicContact CE1-CB 4.26Å; F651-R690 HydrophobicContact CE1-CG 4.25Å; F651-R690 HydrophobicContact CZ-CB 3.82Å; F651-R690 HydrophobicContact CZ-CG 3.79Å; E684-R690 PolarHBondContact O-NE 2.84Å; E684-R690 PolarHBondContact O-NH2 2.97Å; E684-R690 IonicContact OE2-CZ 3.86Å; E684-R690 IonicContact OE2-NH1 3.4Å; E684-R690 PolarHBondContact OE2-NH1 2.89Å; E684-R690 IonicContact OE2-NH2 2.96Å; M687-R690 WeakPolarHBondContact O-CG 3.45Å; I688-R690 PolarHBondContact O-N 3.38Å; I688-R690 VanDerWaalsContact O-N 3.15Å
691	T	92.7	Very high	94.8	Very high	99 Å²	99	29.1 Å²	29.1	61%	0.607	15%	0.148	S	C	*	.	S	Bend	trans	-114.3	158.9	-179.9	51.7	0	0	0	0	110.8	V650 C693	V650-T691 VanDerWaalsContact CG2-C 3.44Å; V650-T691 WeakPolarHBondContact CG2-O 3.46Å; T691-C693 PolarHBondContact O-N 2.9Å
692	I	94.8	Very high	95	Very high	52 Å²	52	25.8 Å²	25.8	27%	0.267	13%	0.133	S	C	.	.			trans	-59.9	130.2	171.3	-67	-64.7	0	0	0	109.1	W648 V650 L735	W648-I692 HydrophobicContact CB-CD1 4.32Å; V650-I692 HydrophobicContact CG2-CD1 4.19Å; I692-L735 HydrophobicContact CD1-CD1 3.61Å
693	C	95.1	Very high	95.1	Very high	5 Å²	5	25.5 Å²	25.5	3%	0.034	13%	0.132	C	C	.	.			trans	-96.1	113.9	171.9	-174.8	0	0	0	0	108	W589 T691 E695 G696 A697 Y698	W589-C693 HydrophobicContact CZ2-CB 4.2Å; T691-C693 PolarHBondContact O-N 2.9Å; C693-E695 PolarHBondContact O-N 3.08Å; C693-G696 WeakPolarHBondContact O-CA 3.45Å; C693-G696 PolarHBondContact O-N 3.47Å; C693-A697 VanDerWaalsContact CB-O 3.27Å; C693-A697 WeakPolarHBondContact CB-O 3.27Å; C693-A697 PolarHBondContact SG-O 2.56Å; C693-A697 VanDerWaalsContact SG-O 3.42Å; C693-Y698 HydrophobicContact CB-CE1 4.06Å; C693-Y698 HydrophobicContact CB-CE2 4.11Å; C693-Y698 PolarHBondContact N-OH 2.94Å; C693-Y698 PolarHBondContact O-OH 2.96Å
694	P	94.4	Very high	94.9	Very high	99 Å²	99	27.9 Å²	27.9	64%	0.643	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-34.8	176.9	-25.7	34.9	0	0	0	113.2	N602 G696	N602-P694 PolarHBondContact ND2-O 3.2Å; P694-G696 VanDerWaalsContact C-N 3.25Å; P694-G696 PolarHBondContact O-N 2.77Å
695	E	96.4	Very high	94.7	Very high	19 Å²	19	26.5 Å²	26.5	9%	0.089	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-15.4	176.5	-61.7	75.6	-170.2	0	0	112.4	V593 C596 R597 N602 F603 C693	V593-E695 HydrophobicContact CG1-CG 4.13Å; C596-E695 HydrophobicContact CB-CB 3.96Å; C596-E695 HydrophobicContact CB-CG 3.95Å; R597-E695 HydrophobicContact CB-CG 4.44Å; R597-E695 IonicContact CZ-OE1 3.5Å; R597-E695 IonicContact NE-OE1 3.65Å; R597-E695 PolarHBondContact NE-OE1 2.79Å; R597-E695 IonicContact NH2-OE1 3.31Å; R597-E695 PolarHBondContact NH2-OE1 2.88Å; R597-E695 IonicContact NH2-OE2 2.73Å; R597-E695 PolarHBondContact NH2-OE2 2.8Å; N602-E695 CarbonylContact C-O 3.59Å; N602-E695 VanDerWaalsContact CA-O 3.29Å; N602-E695 WeakPolarHBondContact CA-O 3.27Å; N602-E695 WeakPolarHBondContact CB-O 3.46Å; N602-E695 PolarHBondContact ND2-O 3.21Å; N602-E695 VanDerWaalsContact ND2-O 3.13Å; F603-E695 PolarHBondContact N-O 3.47Å; C693-E695 PolarHBondContact O-N 3.08Å
696	G	96.1	Very high	94.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.128	C	C	.	.			trans	88.1	12.4	173	0	0	0	0	0	116	C693 P694 Y698 D714 D715	C693-G696 WeakPolarHBondContact O-CA 3.45Å; C693-G696 PolarHBondContact O-N 3.47Å; P694-G696 VanDerWaalsContact C-N 3.25Å; P694-G696 PolarHBondContact O-N 2.77Å; G696-Y698 WeakPolarHBondContact O-CD2 3.49Å; G696-D714 CarbonylContact O-C 3.53Å; G696-D714 VanDerWaalsContact O-CA 3.26Å; G696-D714 WeakPolarHBondContact O-CA 3.37Å; G696-D715 PolarHBondContact O-N 3Å; G696-D715 VanDerWaalsContact O-N 3.15Å
697	A	97.3	Very high	94.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.5	179.8	0	0	0	0	0	112.5	W589 V593 F603 C693 L712	W589-A697 PolarHBondContact NE1-O 2.65Å; V593-A697 HydrophobicContact CG2-CB 4.35Å; F603-A697 HydrophobicContact CB-CB 3.82Å; F603-A697 HydrophobicContact CD1-CB 3.75Å; F603-A697 HydrophobicContact CG-CB 3.83Å; C693-A697 VanDerWaalsContact CB-O 3.27Å; C693-A697 WeakPolarHBondContact CB-O 3.27Å; C693-A697 PolarHBondContact SG-O 2.56Å; C693-A697 VanDerWaalsContact SG-O 3.42Å; A697-L712 HydrophobicContact CB-CD1 4.41Å
698	Y	97.8	Very high	94.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	147.1	-177.4	-60.9	-95.1	0	0	0	112.3	V650 T689 C693 G696 L712 V713 D715 L739	V650-Y698 HydrophobicContact CG2-CD1 4.15Å; V650-Y698 HydrophobicContact CG2-CE1 3.69Å; T689-Y698 HydrophobicContact CG2-CD1 3.58Å; T689-Y698 HydrophobicContact CG2-CE1 4.15Å; T689-Y698 HydrophobicContact CG2-CG 4.3Å; C693-Y698 HydrophobicContact CB-CE1 4.06Å; C693-Y698 HydrophobicContact CB-CE2 4.11Å; C693-Y698 PolarHBondContact N-OH 2.94Å; C693-Y698 PolarHBondContact O-OH 2.96Å; G696-Y698 WeakPolarHBondContact O-CD2 3.49Å; Y698-L712 CarbonylContact O-C 3.48Å; Y698-L712 WeakPolarHBondContact O-CA 3.25Å; Y698-V713 PolarHBondContact N-O 2.84Å; Y698-V713 PolarHBondContact O-N 3.43Å; Y698-D715 HydrophobicContact CD2-CB 4.01Å; Y698-D715 HydrophobicContact CE2-CB 3.56Å; Y698-D715 WeakPolarHBondContact CE2-OD2 3.36Å; Y698-L739 HydrophobicContact CD1-CD1 3.79Å; Y698-L739 HydrophobicContact CD2-CD1 4.47Å; Y698-L739 HydrophobicContact CD2-CD2 4.18Å; Y698-L739 HydrophobicContact CE1-CD1 4.28Å; Y698-L739 HydrophobicContact CG-CD1 3.9Å; Y698-L739 HydrophobicContact CG-CD2 4.17Å
699	Q	97.2	Very high	94.4	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.019	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.9	179.2	-75.6	-176.5	-27.5	0	0	113	A585 W589 I688 T689 T710 V711 L712	A585-Q699 PolarHBondContact O-NE2 2.83Å; A585-Q699 PolarHBondContact O-OE1 2.94Å; W589-Q699 HydrophobicContact CB-CG 4.48Å; I688-Q699 HydrophobicContact CB-CB 3.91Å; I688-Q699 HydrophobicContact CG1-CB 4.48Å; I688-Q699 HydrophobicContact CG2-CB 4.42Å; I688-Q699 PolarHBondContact N-O 3.38Å; T689-Q699 PolarHBondContact N-O 2.81Å; T689-Q699 PolarHBondContact OG1-N 3.35Å; Q699-T710 HydrophobicContact CB-CG2 3.89Å; Q699-T710 HydrophobicContact CG-CG2 4.21Å; Q699-V711 WeakPolarHBondContact CA-O 3.25Å; Q699-L712 HydrophobicContact CG-CB 4.44Å; Q699-L712 HydrophobicContact CG-CD1 3.72Å
700	V	97.6	Very high	94.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	127.8	-179.6	-168.9	0	0	0	0	109.9	V686 M687 L702 T710 V711 I740 A743	V686-V700 HydrophobicContact CG1-CG1 3.63Å; V686-V700 CarbonylContact O-C 3.56Å; V686-V700 WeakPolarHBondContact O-CA 3.41Å; V686-V700 WeakPolarHBondContact O-CG1 3.35Å; M687-V700 HydrophobicContact CE-CG2 4.14Å; M687-V700 HydrophobicContact SD-CB 4.5Å; M687-V700 HydrophobicContact SD-CG1 4.19Å; M687-V700 HydrophobicContact SD-CG2 3.77Å; V700-L702 HydrophobicContact CG1-CD2 4.26Å; V700-L702 HydrophobicContact CG1-CG 4.15Å; V700-T710 CarbonylContact O-C 3.53Å; V700-V711 PolarHBondContact N-O 3.01Å; V700-V711 PolarHBondContact O-N 2.93Å; V700-I740 HydrophobicContact CG1-CB 4.48Å; V700-I740 HydrophobicContact CG1-CG1 3.89Å; V700-A743 HydrophobicContact CB-CB 3.59Å; V700-A743 HydrophobicContact CG1-CB 4.02Å; V700-A743 HydrophobicContact CG2-CB 3.66Å
701	R	96.3	Very high	94.8	Very high	6 Å²	6	26.2 Å²	26.2	2%	0.023	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.9	-178.9	-175.7	173.2	175	-79.9	0.2	110.6	D581 V686 I688 W708	D581-R701 IonicContact OD2-CZ 3.71Å; D581-R701 IonicContact OD2-NE 2.79Å; D581-R701 PolarHBondContact OD2-NE 2.93Å; D581-R701 IonicContact OD2-NH2 3.76Å; D581-R701 PolarHBondContact OD2-NH2 3.45Å; V686-R701 PolarHBondContact O-N 3.04Å; I688-R701 HydrophobicContact CD1-CB 3.7Å; I688-R701 HydrophobicContact CG1-CB 3.93Å; R701-W708 HydrophobicContact CG-CE3 3.91Å; R701-W708 HydrophobicContact CG-CZ3 4.21Å; R701-W708 VanDerWaalsContact CZ-CD2 3.44Å; R701-W708 VanDerWaalsContact NH1-CE3 3.3Å; R701-W708 VanDerWaalsContact NH2-CD2 3.28Å; R701-W708 VanDerWaalsContact NH2-CE2 3.34Å; R701-W708 VanDerWaalsContact NH2-CG 3.34Å
702	L	96.7	Very high	95	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154.1	-176.3	-63.2	174.9	0	0	0	110.8	V686 V700 T709 A743 L744 L747 T765 L766	V686-L702 HydrophobicContact CG1-CD2 3.98Å; V700-L702 HydrophobicContact CG1-CD2 4.26Å; V700-L702 HydrophobicContact CG1-CG 4.15Å; L702-T709 PolarHBondContact N-O 3.48Å; L702-T709 PolarHBondContact O-N 2.91Å; L702-A743 HydrophobicContact CD1-CB 4.13Å; L702-L744 HydrophobicContact CD1-CB 4.15Å; L702-L744 HydrophobicContact CD1-CD1 4.23Å; L702-L747 HydrophobicContact CB-CD2 3.67Å; L702-L747 HydrophobicContact CD1-CD2 3.83Å; L702-L747 HydrophobicContact CG-CD2 4.41Å; L702-T765 HydrophobicContact CB-CG2 4.4Å; L702-L766 HydrophobicContact CD2-CD2 4.11Å
703	C	94.7	Very high	95.1	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.02	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	81.7	-178.9	-176	0	0	0	0	112.1	G706 T707 W708 T765 G768	C703-G706 VanDerWaalsContact SG-C 3.53Å; C703-T707 CarbonylContact C-O 3.47Å; C703-T707 VanDerWaalsContact CA-O 3.29Å; C703-T707 WeakPolarHBondContact CA-O 3.4Å; C703-W708 HydrophobicContact CB-CD2 3.93Å; C703-W708 HydrophobicContact CB-CE3 3.63Å; C703-W708 HydrophobicContact CB-CH2 4.21Å; C703-W708 HydrophobicContact CB-CZ2 4.48Å; C703-W708 HydrophobicContact CB-CZ3 3.77Å; C703-T765 PolarHBondContact N-O 3.28Å; C703-G768 VanDerWaalsContact SG-CA 3.51Å
704	K	90.6	Very high	95.2	Very high	50 Å²	50	20 Å²	20	22%	0.217	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.5	174.9	-179.5	178.7	-172.7	-65.3	0	110.3	G706 T707 L747 G949	K704-G706 PolarHBondContact O-N 2.92Å; K704-G706 VanDerWaalsContact O-N 3.14Å; K704-T707 PolarHBondContact N-O 3.23Å; K704-T707 WeakPolarHBondContact O-CA 3.44Å; K704-T707 WeakPolarHBondContact O-CB 3.31Å; K704-T707 PolarHBondContact O-N 2.83Å; K704-L747 HydrophobicContact CB-CD1 4.22Å; K704-L747 HydrophobicContact CB-CD2 4Å; K704-L747 HydrophobicContact CB-CG 4.13Å; K704-L747 HydrophobicContact CD-CD1 4.02Å; K704-L747 HydrophobicContact CD-CG 4.07Å; K704-G949 PolarHBondContact NZ-O 2.94Å
705	D	89.1	Confident	95.3	Very high	36 Å²	36	15.6 Å²	15.6	19%	0.193	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	41.2	173.2	-48.4	-19.6	0	0	0	113.6	T707 F946 G949 I1049	D705-T707 VanDerWaalsContact C-N 3.29Å; D705-T707 PolarHBondContact O-N 2.92Å; D705-F946 WeakPolarHBondContact O-CB 3.34Å; D705-G949 PolarHBondContact OD2-N 3.32Å; D705-I1049 WeakPolarHBondContact O-CG1 3.43Å
706	G	91.4	Very high	95.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	-0.3	-177.3	0	0	0	0	0	115.3	C703 K704 R915	C703-G706 VanDerWaalsContact SG-C 3.53Å; K704-G706 PolarHBondContact O-N 2.92Å; K704-G706 VanDerWaalsContact O-N 3.14Å; G706-R915 VanDerWaalsContact O-CD 3.28Å; G706-R915 WeakPolarHBondContact O-CD 3.47Å; G706-R915 PolarHBondContact O-NH1 3.04Å
707	T	92.4	Very high	95.4	Very high	65 Å²	65	16.4 Å²	16.4	40%	0.399	9%	0.088	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.3	176.1	-59.4	0	0	0	0	111.5	C703 K704 D705	C703-T707 CarbonylContact C-O 3.47Å; C703-T707 VanDerWaalsContact CA-O 3.29Å; C703-T707 WeakPolarHBondContact CA-O 3.4Å; K704-T707 PolarHBondContact N-O 3.23Å; K704-T707 WeakPolarHBondContact O-CA 3.44Å; K704-T707 WeakPolarHBondContact O-CB 3.31Å; K704-T707 PolarHBondContact O-N 2.83Å; D705-T707 VanDerWaalsContact C-N 3.29Å; D705-T707 PolarHBondContact O-N 2.92Å
708	W	94.2	Very high	95.4	Very high	29 Å²	29	16.6 Å²	16.6	11%	0.11	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	129.3	169.6	-74.9	120.8	0	0	0	111.2	R701 C703 T767	R701-W708 HydrophobicContact CG-CE3 3.91Å; R701-W708 HydrophobicContact CG-CZ3 4.21Å; R701-W708 VanDerWaalsContact CZ-CD2 3.44Å; R701-W708 VanDerWaalsContact NH1-CE3 3.3Å; R701-W708 VanDerWaalsContact NH2-CD2 3.28Å; R701-W708 VanDerWaalsContact NH2-CE2 3.34Å; R701-W708 VanDerWaalsContact NH2-CG 3.34Å; C703-W708 HydrophobicContact CB-CD2 3.93Å; C703-W708 HydrophobicContact CB-CE3 3.63Å; C703-W708 HydrophobicContact CB-CH2 4.21Å; C703-W708 HydrophobicContact CB-CZ2 4.48Å; C703-W708 HydrophobicContact CB-CZ3 3.77Å; W708-T767 VanDerWaalsContact CH2-O 3.3Å; W708-T767 WeakPolarHBondContact CH2-O 3.38Å; W708-T767 WeakPolarHBondContact CZ2-O 3.43Å
709	T	93.3	Very high	95.3	Very high	43 Å²	43	16.6 Å²	16.6	26%	0.264	9%	0.089	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	127.5	179.6	-59.2	0	0	0	0	109.2	L702 V711 L747	L702-T709 PolarHBondContact N-O 3.48Å; L702-T709 PolarHBondContact O-N 2.91Å; T709-V711 HydrophobicContact CG2-CG2 4.11Å; T709-L747 HydrophobicContact CG2-CD1 4.4Å
710	T	95.7	Very high	95.1	Very high	32 Å²	32	17.9 Å²	17.9	20%	0.196	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	109.5	169.8	-53.3	0	0	0	0	109.5	A585 I688 Q699 V700	A585-T710 HydrophobicContact CB-CG2 3.6Å; I688-T710 HydrophobicContact CG1-CG2 4.06Å; Q699-T710 HydrophobicContact CB-CG2 3.89Å; Q699-T710 HydrophobicContact CG-CG2 4.21Å; V700-T710 CarbonylContact O-C 3.53Å
711	V	96.5	Very high	95	Very high	9 Å²	9	21.9 Å²	21.9	6%	0.055	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	116.2	-177.2	-172.8	0	0	0	0	109.3	Q699 V700 T709 V713 A743 K746 L747	Q699-V711 WeakPolarHBondContact CA-O 3.25Å; V700-V711 PolarHBondContact N-O 3.01Å; V700-V711 PolarHBondContact O-N 2.93Å; T709-V711 HydrophobicContact CG2-CG2 4.11Å; V711-V713 HydrophobicContact CG1-CG1 4.13Å; V711-A743 HydrophobicContact CB-CB 4.14Å; V711-A743 HydrophobicContact CG1-CB 4.11Å; V711-K746 HydrophobicContact CG1-CB 4.35Å; V711-K746 HydrophobicContact CG1-CD 3.73Å; V711-K746 HydrophobicContact CG1-CG 4.12Å; V711-L747 HydrophobicContact CG2-CB 4.34Å; V711-L747 HydrophobicContact CG2-CD1 4.3Å; V711-L747 HydrophobicContact CG2-CD2 4.15Å
712	L	97.1	Very high	94.9	Very high	25 Å²	25	29.8 Å²	29.8	13%	0.131	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	137.2	166.9	-176.5	73.1	0	0	0	109.8	I592 F603 A697 Y698 Q699 K746	I592-L712 HydrophobicContact CD1-CD2 3.47Å; I592-L712 VanDerWaalsContact CD1-CD2 3.47Å; F603-L712 HydrophobicContact CE1-CD2 4.02Å; F603-L712 HydrophobicContact CE1-CG 3.97Å; F603-L712 HydrophobicContact CE2-CD2 4.08Å; F603-L712 HydrophobicContact CZ-CD2 3.49Å; F603-L712 VanDerWaalsContact CZ-CD2 3.49Å; F603-L712 HydrophobicContact CZ-CG 3.95Å; A697-L712 HydrophobicContact CB-CD1 4.41Å; Y698-L712 CarbonylContact O-C 3.48Å; Y698-L712 WeakPolarHBondContact O-CA 3.25Å; Q699-L712 HydrophobicContact CG-CB 4.44Å; Q699-L712 HydrophobicContact CG-CD1 3.72Å; L712-K746 PolarHBondContact O-NZ 3.21Å
713	V	97.9	Very high	94.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	156.3	173.8	-66.7	0	0	0	0	111	Y698 V711 L739 K742 A743 K746	Y698-V713 PolarHBondContact N-O 2.84Å; Y698-V713 PolarHBondContact O-N 3.43Å; V711-V713 HydrophobicContact CG1-CG1 4.13Å; V713-L739 HydrophobicContact CG2-CD2 4.2Å; V713-K742 HydrophobicContact CB-CD 4.34Å; V713-K742 HydrophobicContact CG1-CG 4.28Å; V713-A743 HydrophobicContact CG1-CB 4.21Å; V713-K746 HydrophobicContact CG1-CD 3.99Å
714	D	97.4	Very high	94.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	170.4	164.3	72.9	52.8	0	0	0	112.4	F603 V604 D605 G696 M716 K742	F603-D714 HydrophobicContact CD1-CB 3.67Å; F603-D714 HydrophobicContact CE1-CB 4.09Å; F603-D714 WeakPolarHBondContact O-CB 3.39Å; V604-D714 WeakPolarHBondContact CA-OD2 3.38Å; D605-D714 HydrophobicContact CB-CB 4.45Å; D605-D714 WeakPolarHBondContact CB-OD2 3.42Å; D605-D714 PolarHBondContact N-OD2 2.78Å; G696-D714 CarbonylContact O-C 3.53Å; G696-D714 VanDerWaalsContact O-CA 3.26Å; G696-D714 WeakPolarHBondContact O-CA 3.37Å; D714-M716 WeakPolarHBondContact OD1-CA 3.32Å; D714-M716 WeakPolarHBondContact OD1-CB 3.33Å; D714-M716 VanDerWaalsContact OD1-CG 3.24Å; D714-M716 WeakPolarHBondContact OD1-CG 3.37Å; D714-M716 PolarHBondContact OD1-N 3.42Å; D714-K742 WeakPolarHBondContact O-CE 3.32Å; D714-K742 PolarHBondContact O-NZ 3.09Å; D714-K742 IonicContact OD1-NZ 2.65Å; D714-K742 PolarHBondContact OD1-NZ 3.45Å; D714-K742 IonicContact OD2-NZ 2.69Å
715	D	96.4	Very high	94.7	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.037	16%	0.161	C	C	.	.	S	Bend	trans	-94.3	16.1	177.6	64.2	1.9	0	0	0	116.6	R632 P633 G696 Y698 L717	R632-D715 WeakPolarHBondContact CD-OD1 3.3Å; R632-D715 IonicContact CZ-OD1 2.67Å; R632-D715 IonicContact NE-OD1 3.3Å; R632-D715 IonicContact NH1-OD1 3.7Å; R632-D715 PolarHBondContact NH1-OD1 3.28Å; P633-D715 WeakPolarHBondContact CD-OD2 3.45Å; P633-D715 HydrophobicContact CG-CB 4.11Å; G696-D715 PolarHBondContact O-N 3Å; G696-D715 VanDerWaalsContact O-N 3.15Å; Y698-D715 HydrophobicContact CD2-CB 4.01Å; Y698-D715 HydrophobicContact CE2-CB 3.56Å; Y698-D715 WeakPolarHBondContact CE2-OD2 3.36Å; D715-L717 PolarHBondContact O-N 2.84Å
716	M	96.9	Very high	94.9	Very high	33 Å²	33	31.8 Å²	31.8	16%	0.163	16%	0.155	C	C	.	.			trans	-69.6	121.1	167.5	-56.6	-75	-71.5	0	0	109.8	P610 W630 R632 D714 K742	P610-M716 HydrophobicContact CB-CB 4.23Å; P610-M716 HydrophobicContact CB-CE 4.37Å; P610-M716 HydrophobicContact CG-CE 4.37Å; W630-M716 HydrophobicContact CB-CB 4.4Å; W630-M716 HydrophobicContact CB-CE 4.01Å; W630-M716 HydrophobicContact CE3-CB 4.14Å; W630-M716 VanDerWaalsContact O-CE 3.26Å; W630-M716 WeakPolarHBondContact O-CE 3.48Å; R632-M716 HydrophobicContact CG-CG 4.4Å; R632-M716 HydrophobicContact CG-SD 3.41Å; R632-M716 WeakPolarHBondContact CG-SD 3.35Å; D714-M716 WeakPolarHBondContact OD1-CA 3.32Å; D714-M716 WeakPolarHBondContact OD1-CB 3.33Å; D714-M716 VanDerWaalsContact OD1-CG 3.24Å; D714-M716 WeakPolarHBondContact OD1-CG 3.37Å; D714-M716 PolarHBondContact OD1-N 3.42Å; M716-K742 PolarHBondContact O-NZ 3.03Å
717	L	97.2	Very high	95	Very high	3 Å²	3	32 Å²	32	2%	0.016	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	141	-177.4	-62.5	175.4	0	0	0	112.9	W630 L631 I636 D715 C719 L725 L735 A738 K742	W630-L717 WeakPolarHBondContact CA-O 3.41Å; L631-L717 PolarHBondContact N-O 2.96Å; L631-L717 PolarHBondContact O-N 3.38Å; I636-L717 HydrophobicContact CD1-CB 4.17Å; I636-L717 HydrophobicContact CD1-CD1 4.08Å; D715-L717 PolarHBondContact O-N 2.84Å; L717-C719 PolarHBondContact O-N 3.04Å; L717-C719 PolarHBondContact O-SG 3.23Å; L717-L725 HydrophobicContact CB-CD2 3.49Å; L717-L725 VanDerWaalsContact CB-CD2 3.49Å; L717-L725 HydrophobicContact CD1-CD2 3.81Å; L717-L725 HydrophobicContact CG-CD2 4.27Å; L717-L735 HydrophobicContact CD1-CD2 4.44Å; L717-A738 HydrophobicContact CD1-CB 3.81Å; L717-A738 HydrophobicContact CD2-CB 4.1Å; L717-K742 HydrophobicContact CD2-CD 4.21Å
718	P	96.4	Very high	95	Very high	3 Å²	3	29 Å²	29	2%	0.019	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	123.1	179.9	-23.2	34.6	0	0	0	113.6	I627 W630 L726 F727 Y751	I627-P718 HydrophobicContact CD1-CB 4.31Å; I627-P718 HydrophobicContact CG1-CB 4.26Å; I627-P718 HydrophobicContact CG2-CB 4.06Å; W630-P718 HydrophobicContact CD2-CG 4.14Å; W630-P718 HydrophobicContact CE3-CG 4.02Å; W630-P718 HydrophobicContact CH2-CG 3.77Å; W630-P718 HydrophobicContact CZ2-CG 3.85Å; W630-P718 HydrophobicContact CZ3-CG 3.83Å; P718-L726 PolarHBondContact O-N 2.72Å; P718-L726 VanDerWaalsContact O-N 3.11Å; P718-F727 HydrophobicContact CB-CD2 4.15Å; P718-F727 HydrophobicContact CB-CE2 4.03Å; P718-F727 HydrophobicContact CG-CD2 3.91Å; P718-F727 HydrophobicContact CG-CE2 3.81Å; P718-Y751 HydrophobicContact CG-CE2 3.87Å
719	C	95.8	Very high	94.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	159.4	-176.7	-61.9	0	0	0	0	112.9	K628 K629 L631 L717 Y724 L726	K628-C719 PolarHBondContact N-O 2.77Å; K629-C719 HydrophobicContact CB-CB 4.37Å; K629-C719 PolarHBondContact N-O 2.72Å; K629-C719 VanDerWaalsContact N-O 3.1Å; K629-C719 PolarHBondContact O-N 3.28Å; L631-C719 HydrophobicContact CD1-CB 3.92Å; L631-C719 HydrophobicContact CG-CB 4.22Å; L717-C719 PolarHBondContact O-N 3.04Å; L717-C719 PolarHBondContact O-SG 3.23Å; C719-Y724 CarbonylContact C-O 3.54Å; C719-Y724 WeakPolarHBondContact CA-O 3.38Å; C719-Y724 WeakPolarHBondContact CB-O 3.41Å; C719-L726 VanDerWaalsContact C-CD1 3.48Å
720	D	94.3	Very high	94.6	Very high	32 Å²	32	28 Å²	28	17%	0.171	13%	0.133	C	C	.	.			trans	-79.3	-177.2	173.8	71.7	2.7	0	0	0	113.1	Y722 G723 Y724 L726	D720-Y722 PolarHBondContact O-N 2.92Å; D720-Y722 VanDerWaalsContact OD1-C 3.3Å; D720-Y722 WeakPolarHBondContact OD1-CA 3.46Å; D720-Y722 WeakPolarHBondContact OD1-CB 3.35Å; D720-Y722 PolarHBondContact OD1-N 2.88Å; D720-G723 PolarHBondContact O-N 3.41Å; D720-G723 PolarHBondContact OD1-N 2.75Å; D720-Y724 PolarHBondContact N-O 2.83Å; D720-Y724 PolarHBondContact OD1-N 2.81Å; D720-L726 HydrophobicContact CB-CD1 4.1Å; D720-L726 HydrophobicContact CB-CD2 4.13Å; D720-L726 HydrophobicContact CB-CG 4.18Å
721	D	94.6	Very high	94.1	Very high	84 Å²	84	28.3 Å²	28.3	45%	0.449	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.7	175.3	-82.8	-47.8	0	0	0	113.3	K628 K629	K628-D721 WeakPolarHBondContact CB-OD1 3.45Å; K628-D721 WeakPolarHBondContact CD-OD1 3.49Å; K628-D721 WeakPolarHBondContact CD-OD2 3.35Å; K628-D721 WeakPolarHBondContact CE-OD2 3.49Å; K628-D721 VanDerWaalsContact CG-CG 3.48Å; K628-D721 WeakPolarHBondContact CG-OD1 3.17Å; K628-D721 WeakPolarHBondContact CG-OD2 3.48Å; K629-D721 PolarHBondContact NZ-O 3.24Å
722	Y	93.3	Very high	93.7	Very high	172 Å²	172	31 Å²	31	68%	0.675	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-7.6	179.8	-53.3	-71.1	0	0	0	113.1	N637 D720	N637-Y722 PolarHBondContact ND2-O 3.5Å; D720-Y722 PolarHBondContact O-N 2.92Å; D720-Y722 VanDerWaalsContact OD1-C 3.3Å; D720-Y722 WeakPolarHBondContact OD1-CA 3.46Å; D720-Y722 WeakPolarHBondContact OD1-CB 3.35Å; D720-Y722 PolarHBondContact OD1-N 2.88Å
723	G	93	Very high	93.4	Very high	4 Å²	4	31.1 Å²	31.1	4%	0.041	14%	0.141	C	C	.	.	S	Bend	trans	85.1	19.9	179.7	0	0	0	0	0	114.8	N637 D720	N637-G723 PolarHBondContact N-O 3.47Å; D720-G723 PolarHBondContact O-N 3.41Å; D720-G723 PolarHBondContact OD1-N 2.75Å
724	Y	93	Very high	93.1	Very high	93 Å²	93	31.1 Å²	31.1	37%	0.365	14%	0.141	S	C	.	.			trans	-91.1	146.7	171.5	-61.8	-69.6	0	0	0	111.5	N637 C719 D720	N637-Y724 HydrophobicContact CB-CD1 3.94Å; N637-Y724 HydrophobicContact CB-CE1 3.67Å; N637-Y724 VanDerWaalsContact O-CD1 3.24Å; N637-Y724 WeakPolarHBondContact O-CD1 3.46Å; C719-Y724 CarbonylContact C-O 3.54Å; C719-Y724 WeakPolarHBondContact CA-O 3.38Å; C719-Y724 WeakPolarHBondContact CB-O 3.41Å; D720-Y724 PolarHBondContact N-O 2.83Å; D720-Y724 PolarHBondContact OD1-N 2.81Å
725	L	93.6	Very high	93	Very high	17 Å²	17	31.2 Å²	31.2	9%	0.089	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-64.2	134.6	176.5	-74.5	166.3	0	0	0	111.6	I636 L717 Q729 A730	I636-L725 HydrophobicContact CD1-CD2 4.01Å; I636-L725 HydrophobicContact CD1-CG 4.39Å; I636-L725 HydrophobicContact CG2-CD1 4.4Å; I636-L725 HydrophobicContact CG2-CG 4.12Å; L717-L725 HydrophobicContact CB-CD2 3.49Å; L717-L725 VanDerWaalsContact CB-CD2 3.49Å; L717-L725 HydrophobicContact CD1-CD2 3.81Å; L717-L725 HydrophobicContact CG-CD2 4.27Å; L725-Q729 PolarHBondContact O-NE2 3.45Å; L725-A730 HydrophobicContact CD1-CB 3.73Å
726	L	92.9	Very high	93	Very high	16 Å²	16	30.9 Å²	30.9	8%	0.084	14%	0.14	C	C	.	.	S	Bend	trans	-96.6	-20.3	-179.3	-75.8	165.6	0	0	0	114.6	R626 I627 L663 P718 C719 D720	R626-L726 HydrophobicContact CB-CD1 4.16Å; R626-L726 HydrophobicContact CB-CD2 4.23Å; R626-L726 WeakPolarHBondContact O-CD1 3.35Å; I627-L726 HydrophobicContact CB-CD1 4.14Å; I627-L726 HydrophobicContact CG1-CD1 3.48Å; I627-L726 VanDerWaalsContact CG1-CD1 3.48Å; L663-L726 HydrophobicContact CD1-CD2 3.72Å; L663-L726 HydrophobicContact CG-CD2 4.46Å; L663-L726 PolarHBondContact N-O 2.91Å; P718-L726 PolarHBondContact O-N 2.72Å; P718-L726 VanDerWaalsContact O-N 3.11Å; C719-L726 VanDerWaalsContact C-CD1 3.48Å; D720-L726 HydrophobicContact CB-CD1 4.1Å; D720-L726 HydrophobicContact CB-CD2 4.13Å; D720-L726 HydrophobicContact CB-CG 4.18Å
727	F	93.4	Very high	92.9	Very high	5 Å²	5	29.3 Å²	29.3	2%	0.022	13%	0.132	C	C	.	.	S	Bend	trans	-105.5	-140.9	174.8	-56	-39.8	0	0	0	110.2	V623 I627 G662 L664 P718 Q729 E741 Y751	V623-F727 HydrophobicContact CG1-CE1 3.99Å; I627-F727 HydrophobicContact CD1-CE1 4.38Å; I627-F727 HydrophobicContact CD1-CE2 4.17Å; I627-F727 HydrophobicContact CD1-CZ 3.66Å; G662-F727 VanDerWaalsContact CA-O 3.23Å; G662-F727 WeakPolarHBondContact CA-O 3.25Å; G662-F727 PolarHBondContact N-O 2.77Å; L664-F727 HydrophobicContact CB-CD1 3.76Å; L664-F727 HydrophobicContact CB-CE1 4.19Å; L664-F727 HydrophobicContact CB-CG 4.45Å; L664-F727 HydrophobicContact CD2-CD1 4.42Å; P718-F727 HydrophobicContact CB-CD2 4.15Å; P718-F727 HydrophobicContact CB-CE2 4.03Å; P718-F727 HydrophobicContact CG-CD2 3.91Å; P718-F727 HydrophobicContact CG-CE2 3.81Å; F727-Q729 PolarHBondContact O-N 2.95Å; F727-Q729 PolarHBondContact O-NE2 2.76Å; F727-E741 VanDerWaalsContact CB-OE2 3.26Å; F727-E741 WeakPolarHBondContact CB-OE2 3.49Å; F727-Y751 AromaticContact CD2-CD1 3.42Å; F727-Y751 HydrophobicContact CD2-CD1 3.42Å; F727-Y751 VanDerWaalsContact CD2-CD1 3.42Å; F727-Y751 HydrophobicContact CD2-CD2 4.1Å; F727-Y751 AromaticContact CD2-CE1 3.48Å; F727-Y751 HydrophobicContact CD2-CE1 3.48Å; F727-Y751 VanDerWaalsContact CD2-CE1 3.48Å; F727-Y751 HydrophobicContact CD2-CE2 4.16Å; F727-Y751 AromaticContact CD2-CG 3.73Å; F727-Y751 HydrophobicContact CD2-CG 3.73Å; F727-Y751 AromaticContact CD2-CZ 3.85Å; F727-Y751 AromaticContact CE2-CD1 3.6Å; F727-Y751 HydrophobicContact CE2-CD1 3.6Å; F727-Y751 AromaticContact CE2-CD2 3.6Å; F727-Y751 HydrophobicContact CE2-CD2 3.6Å; F727-Y751 HydrophobicContact CE2-CE1 4.01Å; F727-Y751 HydrophobicContact CE2-CE2 4.02Å; F727-Y751 AromaticContact CE2-CG 3.36Å; F727-Y751 HydrophobicContact CE2-CG 3.36Å; F727-Y751 HydrophobicContact CG-CD1 4.21Å; F727-Y751 HydrophobicContact CG-CE1 4.35Å; F727-Y751 HydrophobicContact CZ-CD1 4.5Å; F727-Y751 HydrophobicContact CZ-CG 4.15Å
728	S	92.1	Very high	92.8	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	13%	0.132	C	C	.	.	S	Bend	trans	-58.1	139.5	-178.7	61.7	0	0	0	0	112.7	L660 A738 E741	L660-S728 WeakPolarHBondContact O-CA 2.99Å; S728-A738 WeakPolarHBondContact OG-CA 3.1Å; S728-E741 WeakPolarHBondContact CB-OE2 3.46Å; S728-E741 PolarHBondContact N-OE2 2.67Å; S728-E741 PolarHBondContact OG-OE2 3.31Å
729	Q	89.1	Confident	92.9	Very high	42 Å²	42	29.2 Å²	29.2	20%	0.196	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.4	-172.2	-57.1	-65.9	-60.4	0	0	111.5	L660 L725 F727 Q731	L660-Q729 HydrophobicContact CB-CB 4.1Å; L660-Q729 HydrophobicContact CB-CG 4.11Å; L660-Q729 PolarHBondContact O-N 2.91Å; L725-Q729 PolarHBondContact O-NE2 3.45Å; F727-Q729 PolarHBondContact O-N 2.95Å; F727-Q729 PolarHBondContact O-NE2 2.76Å; Q729-Q731 VanDerWaalsContact C-N 3.27Å; Q729-Q731 HydrophobicContact CB-CG 4.45Å; Q729-Q731 PolarHBondContact O-N 3.4Å
730	A	88.8	Confident	93	Very high	9 Å²	9	29.2 Å²	29.2	7%	0.074	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	61.7	179.9	0	0	0	0	0	113	W648 L725 K733 Q734 L735	W648-A730 HydrophobicContact CH2-CB 4.07Å; W648-A730 HydrophobicContact CZ3-CB 3.75Å; L725-A730 HydrophobicContact CD1-CB 3.73Å; A730-K733 WeakPolarHBondContact O-CA 3.35Å; A730-K733 PolarHBondContact O-N 2.89Å; A730-K733 VanDerWaalsContact O-N 3.13Å; A730-Q734 CarbonylContact C-O 3.53Å; A730-Q734 VanDerWaalsContact CA-O 3.3Å; A730-Q734 WeakPolarHBondContact CA-O 3.4Å; A730-Q734 WeakPolarHBondContact CB-O 3.32Å; A730-Q734 PolarHBondContact O-N 2.94Å; A730-L735 HydrophobicContact CB-CD2 4.39Å
731	Q	86.7	Confident	93.2	Very high	39 Å²	39	27.8 Å²	27.8	18%	0.182	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-56.6	144	-174.7	-73.4	-59.9	-40.2	0	0	113.6	D658 L660 Q729 K733 Q734	D658-Q731 HydrophobicContact CB-CB 4.41Å; L660-Q731 HydrophobicContact CD1-CG 3.83Å; L660-Q731 HydrophobicContact CG-CG 4.09Å; Q729-Q731 VanDerWaalsContact C-N 3.27Å; Q729-Q731 HydrophobicContact CB-CG 4.45Å; Q729-Q731 PolarHBondContact O-N 3.4Å; Q731-K733 PolarHBondContact O-N 2.95Å; Q731-Q734 WeakPolarHBondContact O-CB 3.4Å; Q731-Q734 PolarHBondContact O-N 2.93Å; Q731-Q734 VanDerWaalsContact O-N 3.15Å
732	R	87	Confident	93.3	Very high	65 Å²	65	23.8 Å²	23.8	25%	0.245	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	57.3	23	-173.9	-56.5	151.6	60.1	-149.5	-5.9	113.1	R652 T653 D658 Q734	R652-R732 PolarHBondContact NH1-O 3.22Å; T653-R732 PolarHBondContact O-NH1 3.24Å; D658-R732 VanDerWaalsContact OD1-CD 3.24Å; D658-R732 WeakPolarHBondContact OD1-CD 3.3Å; D658-R732 IonicContact OD1-CZ 3.76Å; D658-R732 IonicContact OD1-NE 3.23Å; D658-R732 IonicContact OD1-NH1 3.73Å; D658-R732 PolarHBondContact OD1-NH1 2.89Å; D658-R732 IonicContact OD2-NH1 3.65Å; D658-R732 PolarHBondContact OD2-NH1 2.88Å; R732-Q734 HydrophobicContact CB-CG 4.27Å; R732-Q734 VanDerWaalsContact NH1-NE2 3.15Å
733	K	90.7	Very high	93.5	Very high	28 Å²	28	15.6 Å²	15.6	12%	0.122	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	52.6	52.9	-169.7	-70.9	171.9	169.3	168.8	0	113	D643 V646 W648 S649 A730 Q731	D643-K733 HydrophobicContact CB-CD 4.37Å; D643-K733 HydrophobicContact CB-CG 4.43Å; D643-K733 WeakPolarHBondContact O-CE 3.47Å; D643-K733 PolarHBondContact O-NZ 2.92Å; V646-K733 HydrophobicContact CB-CD 4.21Å; V646-K733 HydrophobicContact CG1-CB 4.31Å; V646-K733 HydrophobicContact CG1-CD 4.4Å; V646-K733 WeakPolarHBondContact O-CD 3.25Å; V646-K733 PolarHBondContact O-NZ 2.83Å; W648-K733 HydrophobicContact CD2-CB 3.87Å; W648-K733 HydrophobicContact CD2-CD 4.45Å; W648-K733 HydrophobicContact CD2-CG 4.07Å; W648-K733 HydrophobicContact CE3-CB 3.6Å; W648-K733 HydrophobicContact CE3-CG 4.08Å; W648-K733 HydrophobicContact CH2-CB 4.34Å; W648-K733 HydrophobicContact CH2-CG 4.01Å; W648-K733 HydrophobicContact CZ2-CG 3.98Å; W648-K733 HydrophobicContact CZ3-CB 3.85Å; W648-K733 HydrophobicContact CZ3-CG 4.05Å; S649-K733 PolarHBondContact N-O 3.41Å; S649-K733 VanDerWaalsContact N-O 3.1Å; S649-K733 PolarHBondContact OG-O 2.8Å; A730-K733 WeakPolarHBondContact O-CA 3.35Å; A730-K733 PolarHBondContact O-N 2.89Å; A730-K733 VanDerWaalsContact O-N 3.13Å; Q731-K733 PolarHBondContact O-N 2.95Å
734	Q	92.9	Very high	93.7	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	7%	0.068	C	C	.	.	B	Isolated β-bridge	trans	-119.3	124.2	175.3	-58.2	-179.5	114.5	0	0	110.2	S649 V650 D658 A730 Q731 R732	S649-Q734 WeakPolarHBondContact O-CA 3.44Å; V650-Q734 CarbonylContact O-C 3.53Å; D658-Q734 PolarHBondContact OD2-NE2 3.31Å; A730-Q734 CarbonylContact C-O 3.53Å; A730-Q734 VanDerWaalsContact CA-O 3.3Å; A730-Q734 WeakPolarHBondContact CA-O 3.4Å; A730-Q734 WeakPolarHBondContact CB-O 3.32Å; A730-Q734 PolarHBondContact O-N 2.94Å; Q731-Q734 WeakPolarHBondContact O-CB 3.4Å; Q731-Q734 PolarHBondContact O-N 2.93Å; Q731-Q734 VanDerWaalsContact O-N 3.15Å; R732-Q734 HydrophobicContact CB-CG 4.27Å; R732-Q734 VanDerWaalsContact NH1-NE2 3.15Å
735	L	94.9	Very high	93.8	Very high	1 Å²	1	11 Å²	11	1%	0.005	5%	0.051	C	C	.	.			trans	-86.5	-13.7	-170.6	-61.2	170.6	0	0	0	114.9	P633 W648 S649 V650 I692 L717 A730 V737 A738 L739	P633-L735 HydrophobicContact CB-CD1 4.06Å; P633-L735 HydrophobicContact CB-CD2 4.02Å; P633-L735 HydrophobicContact CG-CD1 3.45Å; P633-L735 VanDerWaalsContact CG-CD1 3.45Å; P633-L735 HydrophobicContact CG-CD2 3.73Å; P633-L735 HydrophobicContact CG-CG 4.23Å; W648-L735 HydrophobicContact CE3-CD2 3.69Å; W648-L735 HydrophobicContact CE3-CG 4Å; W648-L735 HydrophobicContact CH2-CD2 4.43Å; W648-L735 HydrophobicContact CZ3-CD2 3.55Å; W648-L735 HydrophobicContact CZ3-CG 4.27Å; S649-L735 PolarHBondContact O-N 2.77Å; V650-L735 PolarHBondContact O-N 2.97Å; I692-L735 HydrophobicContact CD1-CD1 3.61Å; L717-L735 HydrophobicContact CD1-CD2 4.44Å; A730-L735 HydrophobicContact CB-CD2 4.39Å; L735-V737 VanDerWaalsContact C-N 3.33Å; L735-V737 PolarHBondContact O-N 3.28Å; L735-A738 PolarHBondContact O-N 3.17Å; L735-A738 VanDerWaalsContact O-N 3.14Å; L735-L739 HydrophobicContact CB-CD1 3.74Å; L735-L739 HydrophobicContact CB-CG 4.11Å; L735-L739 WeakPolarHBondContact O-CG 3.42Å; L735-L739 PolarHBondContact O-N 3.32Å
736	W	95.9	Very high	93.9	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-54.1	-42.6	-168.7	68.2	-83.2	0	0	0	114.3	V650 F651 P654 D658 I659 L673 A677 V683 M687 L739 I740	V650-W736 HydrophobicContact CG1-CB 4.33Å; V650-W736 WeakPolarHBondContact O-CB 3.07Å; V650-W736 PolarHBondContact O-N 2.85Å; F651-W736 HydrophobicContact CB-CB 4.41Å; F651-W736 HydrophobicContact CB-CG 4.2Å; F651-W736 HydrophobicContact CD1-CB 4.12Å; P654-W736 HydrophobicContact CB-CH2 4.41Å; P654-W736 HydrophobicContact CB-CZ2 4.03Å; D658-W736 HydrophobicContact CB-CZ2 3.95Å; I659-W736 HydrophobicContact CD1-CH2 3.81Å; I659-W736 HydrophobicContact CD1-CZ3 4.44Å; I659-W736 HydrophobicContact CG1-CH2 3.73Å; I659-W736 HydrophobicContact CG1-CZ2 4.14Å; I659-W736 HydrophobicContact CG1-CZ3 4.48Å; L673-W736 HydrophobicContact CD1-CZ3 3.88Å; L673-W736 HydrophobicContact CD2-CE3 4.46Å; L673-W736 HydrophobicContact CD2-CZ3 3.95Å; L673-W736 HydrophobicContact CG-CH2 4.46Å; L673-W736 HydrophobicContact CG-CZ3 3.77Å; A677-W736 HydrophobicContact CB-CH2 3.71Å; A677-W736 HydrophobicContact CB-CZ3 4.44Å; V683-W736 HydrophobicContact CG1-CD2 4.07Å; V683-W736 HydrophobicContact CG1-CE3 3.41Å; V683-W736 VanDerWaalsContact CG1-CE3 3.41Å; V683-W736 HydrophobicContact CG1-CH2 4.45Å; V683-W736 HydrophobicContact CG1-CZ3 3.63Å; V683-W736 HydrophobicContact CG2-CH2 4.44Å; V683-W736 HydrophobicContact CG2-CZ3 4.06Å; M687-W736 HydrophobicContact CG-CB 4.3Å; W736-L739 PolarHBondContact O-N 3.34Å; W736-I740 HydrophobicContact CE3-CD1 3.91Å; W736-I740 WeakPolarHBondContact O-CB 3.44Å; W736-I740 WeakPolarHBondContact O-CG1 3.44Å; W736-I740 PolarHBondContact O-N 3.42Å
737	V	95.3	Very high	93.9	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.006	6%	0.06	C	C	.	.	H	α-helix	trans	-60.8	-50	179.3	-168.5	0	0	0	0	111	I659 L670 L673 L735 I740 E741	I659-V737 HydrophobicContact CB-CG1 4.46Å; I659-V737 HydrophobicContact CG1-CG1 4.3Å; I659-V737 HydrophobicContact CG1-CG2 3.93Å; I659-V737 HydrophobicContact CG2-CG1 4.05Å; L670-V737 HydrophobicContact CD2-CG1 4.11Å; L673-V737 HydrophobicContact CD2-CG1 4.16Å; L735-V737 VanDerWaalsContact C-N 3.33Å; L735-V737 PolarHBondContact O-N 3.28Å; V737-I740 PolarHBondContact O-N 3.4Å; V737-E741 WeakPolarHBondContact O-CB 3.31Å; V737-E741 PolarHBondContact O-N 3.44Å
738	A	95.8	Very high	93.7	Very high	2 Å²	2	14.6 Å²	14.6	2%	0.017	7%	0.067	C	C	.	.	H	α-helix	trans	-69.5	-35.4	-178.4	0	0	0	0	0	113	L717 S728 L735 K742	L717-A738 HydrophobicContact CD1-CB 3.81Å; L717-A738 HydrophobicContact CD2-CB 4.1Å; S728-A738 WeakPolarHBondContact OG-CA 3.1Å; L735-A738 PolarHBondContact O-N 3.17Å; L735-A738 VanDerWaalsContact O-N 3.14Å; A738-K742 VanDerWaalsContact O-CB 3.22Å; A738-K742 WeakPolarHBondContact O-CB 3.39Å; A738-K742 PolarHBondContact O-N 2.73Å
739	L	97.8	Very high	93.7	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-68.4	-40.5	174.8	-70.2	171.8	0	0	0	111.8	V650 M687 Y698 V713 L735 W736 A743	V650-L739 HydrophobicContact CG1-CD1 4.26Å; M687-L739 HydrophobicContact CE-CB 4.14Å; M687-L739 HydrophobicContact CE-CD1 4Å; M687-L739 HydrophobicContact SD-CB 4.49Å; Y698-L739 HydrophobicContact CD1-CD1 3.79Å; Y698-L739 HydrophobicContact CD2-CD1 4.47Å; Y698-L739 HydrophobicContact CD2-CD2 4.18Å; Y698-L739 HydrophobicContact CE1-CD1 4.28Å; Y698-L739 HydrophobicContact CG-CD1 3.9Å; Y698-L739 HydrophobicContact CG-CD2 4.17Å; V713-L739 HydrophobicContact CG2-CD2 4.2Å; L735-L739 HydrophobicContact CB-CD1 3.74Å; L735-L739 HydrophobicContact CB-CG 4.11Å; L735-L739 WeakPolarHBondContact O-CG 3.42Å; L735-L739 PolarHBondContact O-N 3.32Å; W736-L739 PolarHBondContact O-N 3.34Å; L739-A743 VanDerWaalsContact O-CB 3.29Å; L739-A743 WeakPolarHBondContact O-CB 3.49Å; L739-A743 PolarHBondContact O-N 3.45Å
740	I	97.9	Very high	93.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.8	-44.4	175.1	-67.7	173.1	0	0	0	110.8	F669 L673 V686 M687 V700 W736 V737 A743 L744 L766	F669-I740 HydrophobicContact CE1-CG2 3.81Å; F669-I740 HydrophobicContact CZ-CG2 3.55Å; L673-I740 HydrophobicContact CD1-CD1 3.96Å; L673-I740 HydrophobicContact CD1-CG2 4.38Å; L673-I740 HydrophobicContact CD2-CD1 4.46Å; L673-I740 HydrophobicContact CD2-CG2 4.25Å; V686-I740 HydrophobicContact CB-CD1 4.5Å; V686-I740 HydrophobicContact CG1-CD1 3.82Å; V686-I740 HydrophobicContact CG1-CG1 3.99Å; V686-I740 HydrophobicContact CG1-CG2 4.42Å; M687-I740 HydrophobicContact CG-CD1 4.04Å; M687-I740 HydrophobicContact CG-CG1 4.2Å; M687-I740 HydrophobicContact SD-CD1 4.01Å; M687-I740 HydrophobicContact SD-CG1 3.48Å; M687-I740 WeakPolarHBondContact SD-CG1 3.23Å; V700-I740 HydrophobicContact CG1-CB 4.48Å; V700-I740 HydrophobicContact CG1-CG1 3.89Å; W736-I740 HydrophobicContact CE3-CD1 3.91Å; W736-I740 WeakPolarHBondContact O-CB 3.44Å; W736-I740 WeakPolarHBondContact O-CG1 3.44Å; W736-I740 PolarHBondContact O-N 3.42Å; V737-I740 PolarHBondContact O-N 3.4Å; I740-A743 PolarHBondContact O-N 2.92Å; I740-L744 WeakPolarHBondContact O-CB 3.43Å; I740-L744 PolarHBondContact O-N 3.08Å; I740-L766 HydrophobicContact CG2-CD2 4.16Å
741	E	97.6	Very high	94.2	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.009	8%	0.083	C	C	.	.	H	α-helix	trans	-60.5	-44.7	175.8	-173.6	-178.9	-118.4	0	0	111.6	N666 F727 S728 V737 L744 A745 Y751 L754	N666-E741 PolarHBondContact ND2-OE1 3.41Å; F727-E741 VanDerWaalsContact CB-OE2 3.26Å; F727-E741 WeakPolarHBondContact CB-OE2 3.49Å; S728-E741 WeakPolarHBondContact CB-OE2 3.46Å; S728-E741 PolarHBondContact N-OE2 2.67Å; S728-E741 PolarHBondContact OG-OE2 3.31Å; V737-E741 WeakPolarHBondContact O-CB 3.31Å; V737-E741 PolarHBondContact O-N 3.44Å; E741-L744 PolarHBondContact O-N 3.04Å; E741-A745 WeakPolarHBondContact O-CB 3.4Å; E741-A745 PolarHBondContact O-N 3.19Å; E741-Y751 HydrophobicContact CG-CD1 4.43Å; E741-Y751 HydrophobicContact CG-CE1 4.08Å; E741-L754 HydrophobicContact CG-CD1 4.28Å
742	K	97.9	Very high	94.4	Very high	1 Å²	1	15.1 Å²	15.1	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-63.8	-42.7	175.5	-174.3	175.2	177.1	177.2	0	112.6	F608 V713 D714 M716 L717 A738 L744 A745 K746 Y751	F608-K742 HydrophobicContact CD1-CG 4.26Å; F608-K742 HydrophobicContact CE1-CG 4.02Å; V713-K742 HydrophobicContact CB-CD 4.34Å; V713-K742 HydrophobicContact CG1-CG 4.28Å; D714-K742 WeakPolarHBondContact O-CE 3.32Å; D714-K742 PolarHBondContact O-NZ 3.09Å; D714-K742 IonicContact OD1-NZ 2.65Å; D714-K742 PolarHBondContact OD1-NZ 3.45Å; D714-K742 IonicContact OD2-NZ 2.69Å; M716-K742 PolarHBondContact O-NZ 3.03Å; L717-K742 HydrophobicContact CD2-CD 4.21Å; A738-K742 VanDerWaalsContact O-CB 3.22Å; A738-K742 WeakPolarHBondContact O-CB 3.39Å; A738-K742 PolarHBondContact O-N 2.73Å; K742-L744 VanDerWaalsContact C-N 3.32Å; K742-L744 PolarHBondContact O-N 3.37Å; K742-A745 WeakPolarHBondContact O-CB 3.42Å; K742-A745 PolarHBondContact O-N 3.34Å; K742-K746 WeakPolarHBondContact O-CB 3.49Å; K742-K746 PolarHBondContact O-N 3.12Å; K742-Y751 WeakPolarHBondContact CB-OH 3.42Å
743	A	98	Very high	94.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63.2	-39.4	176.8	0	0	0	0	0	111.8	V700 L702 V711 V713 L739 I740 L747	V700-A743 HydrophobicContact CB-CB 3.59Å; V700-A743 HydrophobicContact CG1-CB 4.02Å; V700-A743 HydrophobicContact CG2-CB 3.66Å; L702-A743 HydrophobicContact CD1-CB 4.13Å; V711-A743 HydrophobicContact CB-CB 4.14Å; V711-A743 HydrophobicContact CG1-CB 4.11Å; V713-A743 HydrophobicContact CG1-CB 4.21Å; L739-A743 VanDerWaalsContact O-CB 3.29Å; L739-A743 WeakPolarHBondContact O-CB 3.49Å; L739-A743 PolarHBondContact O-N 3.45Å; I740-A743 PolarHBondContact O-N 2.92Å; A743-L747 VanDerWaalsContact O-CB 3.23Å; A743-L747 WeakPolarHBondContact O-CB 3.49Å; A743-L747 PolarHBondContact O-N 3.25Å
744	L	96.1	Very high	94.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-67.4	-42	173.3	-172.8	71.8	0	0	0	111.9	W668 F669 L702 I740 E741 K742 K746 L747 H748 L754 T765	W668-L744 HydrophobicContact CH2-CD2 4.14Å; W668-L744 HydrophobicContact CZ2-CD2 4.4Å; F669-L744 HydrophobicContact CB-CD2 4.26Å; F669-L744 HydrophobicContact CD1-CD2 3.62Å; F669-L744 HydrophobicContact CD2-CD2 3.53Å; F669-L744 HydrophobicContact CE1-CB 4.39Å; F669-L744 HydrophobicContact CE1-CD2 3.73Å; F669-L744 HydrophobicContact CE2-CD2 3.65Å; F669-L744 HydrophobicContact CG-CD2 3.5Å; F669-L744 HydrophobicContact CZ-CB 4.33Å; F669-L744 HydrophobicContact CZ-CD2 3.74Å; F669-L744 HydrophobicContact CZ-CG 4.48Å; L702-L744 HydrophobicContact CD1-CB 4.15Å; L702-L744 HydrophobicContact CD1-CD1 4.23Å; I740-L744 WeakPolarHBondContact O-CB 3.43Å; I740-L744 PolarHBondContact O-N 3.08Å; E741-L744 PolarHBondContact O-N 3.04Å; K742-L744 VanDerWaalsContact C-N 3.32Å; K742-L744 PolarHBondContact O-N 3.37Å; L744-K746 PolarHBondContact O-N 3.31Å; L744-L747 PolarHBondContact O-N 2.75Å; L744-L747 VanDerWaalsContact O-N 3.16Å; L744-H748 PolarHBondContact O-CD2 2.98Å; L744-H748 PolarHBondContact O-N 2.9Å; L744-L754 HydrophobicContact CB-CD1 4.41Å; L744-L754 HydrophobicContact CB-CD2 4.41Å; L744-L754 HydrophobicContact CD2-CD1 4.13Å; L744-L754 HydrophobicContact CD2-CD2 3.76Å; L744-L754 HydrophobicContact CG-CD1 4.37Å; L744-L754 HydrophobicContact CG-CD2 3.67Å; L744-T765 HydrophobicContact CD1-CG2 3.71Å
745	A	95.6	Very high	94.1	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.9	-47.8	175.8	0	0	0	0	0	110.9	F608 E741 K742 L747 H748 G749 S750 Y751 L754	F608-A745 HydrophobicContact CE1-CB 4.28Å; F608-A745 HydrophobicContact CZ-CB 3.75Å; E741-A745 WeakPolarHBondContact O-CB 3.4Å; E741-A745 PolarHBondContact O-N 3.19Å; K742-A745 WeakPolarHBondContact O-CB 3.42Å; K742-A745 PolarHBondContact O-N 3.34Å; A745-L747 PolarHBondContact O-N 3.08Å; A745-H748 CarbonylContact O-C 3.52Å; A745-H748 PolarHBondContact O-N 2.66Å; A745-G749 CarbonylContact O-C 3.59Å; A745-G749 PolarHBondContact O-N 2.97Å; A745-S750 PolarHBondContact O-N 2.68Å; A745-Y751 HydrophobicContact CB-CD1 3.7Å; A745-Y751 HydrophobicContact CB-CD2 4.06Å; A745-Y751 HydrophobicContact CB-CE1 4Å; A745-Y751 HydrophobicContact CB-CE2 4.34Å; A745-Y751 HydrophobicContact CB-CG 3.75Å; A745-L754 HydrophobicContact CB-CD1 3.92Å; A745-L754 HydrophobicContact CB-CG 4.35Å
746	K	95.8	Very high	93.5	Very high	44 Å²	44	18 Å²	18	19%	0.191	11%	0.111	C	C	.	.	H	α-helix	trans	-57.8	-45.2	172.3	176.4	170.8	-179.8	173.8	0	112.5	D605 S607 F608 V711 L712 V713 K742 L744 H748 G749	D605-K746 IonicContact OD1-NZ 2.66Å; D605-K746 PolarHBondContact OD1-NZ 3.39Å; D605-K746 WeakPolarHBondContact OD2-CD 3.48Å; D605-K746 WeakPolarHBondContact OD2-CE 3.27Å; D605-K746 IonicContact OD2-NZ 2.97Å; D605-K746 PolarHBondContact OD2-NZ 2.74Å; S607-K746 WeakPolarHBondContact OG-CE 3.29Å; S607-K746 PolarHBondContact OG-NZ 3.48Å; F608-K746 HydrophobicContact CB-CB 4.14Å; F608-K746 HydrophobicContact CB-CD 3.73Å; F608-K746 HydrophobicContact CB-CG 3.85Å; F608-K746 HydrophobicContact CD1-CB 3.99Å; F608-K746 HydrophobicContact CD2-CB 3.84Å; F608-K746 HydrophobicContact CD2-CG 4.13Å; F608-K746 HydrophobicContact CE1-CB 4.34Å; F608-K746 HydrophobicContact CE2-CB 4.2Å; F608-K746 HydrophobicContact CG-CB 3.72Å; F608-K746 HydrophobicContact CG-CD 4.26Å; F608-K746 HydrophobicContact CG-CG 3.98Å; F608-K746 HydrophobicContact CZ-CB 4.43Å; V711-K746 HydrophobicContact CG1-CB 4.35Å; V711-K746 HydrophobicContact CG1-CD 3.73Å; V711-K746 HydrophobicContact CG1-CG 4.12Å; L712-K746 PolarHBondContact O-NZ 3.21Å; V713-K746 HydrophobicContact CG1-CD 3.99Å; K742-K746 WeakPolarHBondContact O-CB 3.49Å; K742-K746 PolarHBondContact O-N 3.12Å; L744-K746 PolarHBondContact O-N 3.31Å; K746-H748 PolarHBondContact O-N 3.39Å; K746-G749 PolarHBondContact O-N 2.76Å; K746-G749 VanDerWaalsContact O-N 3.1Å
747	L	93	Very high	92.7	Very high	34 Å²	34	19.8 Å²	19.8	18%	0.178	13%	0.129	C	C	.	.	H	α-helix	trans	-67.2	-18.7	-178.6	-172.7	55.9	0	0	0	113.7	L702 K704 T709 V711 A743 L744 A745	L702-L747 HydrophobicContact CB-CD2 3.67Å; L702-L747 HydrophobicContact CD1-CD2 3.83Å; L702-L747 HydrophobicContact CG-CD2 4.41Å; K704-L747 HydrophobicContact CB-CD1 4.22Å; K704-L747 HydrophobicContact CB-CD2 4Å; K704-L747 HydrophobicContact CB-CG 4.13Å; K704-L747 HydrophobicContact CD-CD1 4.02Å; K704-L747 HydrophobicContact CD-CG 4.07Å; T709-L747 HydrophobicContact CG2-CD1 4.4Å; V711-L747 HydrophobicContact CG2-CB 4.34Å; V711-L747 HydrophobicContact CG2-CD1 4.3Å; V711-L747 HydrophobicContact CG2-CD2 4.15Å; A743-L747 VanDerWaalsContact O-CB 3.23Å; A743-L747 WeakPolarHBondContact O-CB 3.49Å; A743-L747 PolarHBondContact O-N 3.25Å; L744-L747 PolarHBondContact O-N 2.75Å; L744-L747 VanDerWaalsContact O-N 3.16Å; A745-L747 PolarHBondContact O-N 3.08Å
748	H	89.6	Confident	92	Very high	36 Å²	36	25.3 Å²	25.3	17%	0.167	15%	0.15	C	C	.	.	H	α-helix	trans	-108	-2	170.3	-68.8	-58.3	0	0	0	114.7	L744 A745 K746 A753 L754 R951	L744-H748 PolarHBondContact O-CD2 2.98Å; L744-H748 PolarHBondContact O-N 2.9Å; A745-H748 CarbonylContact O-C 3.52Å; A745-H748 PolarHBondContact O-N 2.66Å; K746-H748 PolarHBondContact O-N 3.39Å; H748-A753 HydrophobicContact CB-CB 3.91Å; H748-L754 HydrophobicContact CB-CD2 4.23Å; H748-R951 HydrophobicContact CB-CB 4.49Å
749	G	91.5	Very high	91.6	Very high	47 Å²	47	25.4 Å²	25.4	49%	0.485	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	98	-19.7	174	0	0	0	0	0	116	A745 K746	A745-G749 CarbonylContact O-C 3.59Å; A745-G749 PolarHBondContact O-N 2.97Å; K746-G749 PolarHBondContact O-N 2.76Å; K746-G749 VanDerWaalsContact O-N 3.1Å
750	S	93.9	Very high	91.2	Very high	15 Å²	15	26.1 Å²	26.1	11%	0.105	15%	0.154	C	C	.	.	S	Bend	trans	-163.2	165.6	173.5	69.6	0	0	0	0	112.6	S614 A745 F752 A753	S614-S750 CarbonylContact O-C 3.57Å; S614-S750 VanDerWaalsContact O-CA 3.28Å; S614-S750 WeakPolarHBondContact O-CA 3.05Å; A745-S750 PolarHBondContact O-N 2.68Å; S750-F752 VanDerWaalsContact C-N 3.33Å; S750-F752 PolarHBondContact OG-N 2.99Å; S750-A753 PolarHBondContact O-N 2.71Å; S750-A753 PolarHBondContact OG-N 2.93Å
751	Y	94.2	Very high	90.8	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.008	16%	0.157	C	C	.	.	S	Bend	trans	-63.6	-38.9	169.8	-78.5	-84.6	0	0	0	111.8	F608 S614 V615 W630 L664 P718 F727 E741 K742 A745 A753 L754	F608-Y751 HydrophobicContact CE1-CD2 4.36Å; F608-Y751 AromaticContact CE1-CE2 3.98Å; F608-Y751 HydrophobicContact CE1-CE2 3.98Å; F608-Y751 HydrophobicContact CZ-CD2 4.14Å; F608-Y751 HydrophobicContact CZ-CE2 4.22Å; S614-Y751 WeakPolarHBondContact O-CD2 3.28Å; S614-Y751 PolarHBondContact O-N 2.88Å; V615-Y751 PolarHBondContact O-N 3.23Å; W630-Y751 HydrophobicContact CH2-CE2 4.07Å; L664-Y751 WeakPolarHBondContact CD1-O 3.48Å; L664-Y751 HydrophobicContact CD2-CD1 3.94Å; P718-Y751 HydrophobicContact CG-CE2 3.87Å; F727-Y751 AromaticContact CD2-CD1 3.42Å; F727-Y751 HydrophobicContact CD2-CD1 3.42Å; F727-Y751 VanDerWaalsContact CD2-CD1 3.42Å; F727-Y751 HydrophobicContact CD2-CD2 4.1Å; F727-Y751 AromaticContact CD2-CE1 3.48Å; F727-Y751 HydrophobicContact CD2-CE1 3.48Å; F727-Y751 VanDerWaalsContact CD2-CE1 3.48Å; F727-Y751 HydrophobicContact CD2-CE2 4.16Å; F727-Y751 AromaticContact CD2-CG 3.73Å; F727-Y751 HydrophobicContact CD2-CG 3.73Å; F727-Y751 AromaticContact CD2-CZ 3.85Å; F727-Y751 AromaticContact CE2-CD1 3.6Å; F727-Y751 HydrophobicContact CE2-CD1 3.6Å; F727-Y751 AromaticContact CE2-CD2 3.6Å; F727-Y751 HydrophobicContact CE2-CD2 3.6Å; F727-Y751 HydrophobicContact CE2-CE1 4.01Å; F727-Y751 HydrophobicContact CE2-CE2 4.02Å; F727-Y751 AromaticContact CE2-CG 3.36Å; F727-Y751 HydrophobicContact CE2-CG 3.36Å; F727-Y751 HydrophobicContact CG-CD1 4.21Å; F727-Y751 HydrophobicContact CG-CE1 4.35Å; F727-Y751 HydrophobicContact CZ-CD1 4.5Å; F727-Y751 HydrophobicContact CZ-CG 4.15Å; E741-Y751 HydrophobicContact CG-CD1 4.43Å; E741-Y751 HydrophobicContact CG-CE1 4.08Å; K742-Y751 WeakPolarHBondContact CB-OH 3.42Å; A745-Y751 HydrophobicContact CB-CD1 3.7Å; A745-Y751 HydrophobicContact CB-CD2 4.06Å; A745-Y751 HydrophobicContact CB-CE1 4Å; A745-Y751 HydrophobicContact CB-CE2 4.34Å; A745-Y751 HydrophobicContact CB-CG 3.75Å; Y751-A753 VanDerWaalsContact C-N 3.25Å; Y751-A753 PolarHBondContact O-N 3.38Å; Y751-L754 VanDerWaalsContact O-CB 3.3Å; Y751-L754 WeakPolarHBondContact O-CB 3.31Å; Y751-L754 WeakPolarHBondContact O-CG 3.23Å; Y751-L754 PolarHBondContact O-N 3.17Å
752	F	91.8	Very high	90.5	Very high	38 Å²	38	26.6 Å²	26.6	17%	0.167	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-56.5	-36.2	176.1	-175.1	-125.7	0	0	0	112.9	V615 G616 F617 S750 L754 Q755 S953	V615-F752 WeakPolarHBondContact O-CB 3.38Å; V615-F752 PolarHBondContact O-N 3.01Å; G616-F752 WeakPolarHBondContact O-CD1 3.44Å; F617-F752 AromaticContact CD1-CD2 3.66Å; F617-F752 HydrophobicContact CD1-CD2 3.66Å; F617-F752 AromaticContact CD1-CE2 3.97Å; F617-F752 HydrophobicContact CD1-CE2 3.97Å; F617-F752 HydrophobicContact CD2-CB 3.67Å; F617-F752 AromaticContact CD2-CD2 3.84Å; F617-F752 HydrophobicContact CD2-CD2 3.84Å; F617-F752 HydrophobicContact CD2-CG 4.09Å; F617-F752 AromaticContact CE1-CD2 3.69Å; F617-F752 HydrophobicContact CE1-CD2 3.69Å; F617-F752 HydrophobicContact CE1-CE2 4.06Å; F617-F752 HydrophobicContact CE2-CB 3.92Å; F617-F752 AromaticContact CE2-CD2 3.87Å; F617-F752 HydrophobicContact CE2-CD2 3.87Å; F617-F752 HydrophobicContact CE2-CG 4.36Å; F617-F752 HydrophobicContact CG-CB 4.24Å; F617-F752 AromaticContact CG-CD2 3.75Å; F617-F752 HydrophobicContact CG-CD2 3.75Å; F617-F752 HydrophobicContact CG-CE2 4.41Å; F617-F752 HydrophobicContact CG-CG 4.19Å; F617-F752 AromaticContact CZ-CD2 3.8Å; F617-F752 HydrophobicContact CZ-CD2 3.8Å; S750-F752 VanDerWaalsContact C-N 3.33Å; S750-F752 PolarHBondContact OG-N 2.99Å; F752-L754 PolarHBondContact O-N 2.87Å; F752-Q755 VanDerWaalsContact CE2-OE1 3.29Å; F752-Q755 WeakPolarHBondContact O-CB 3.26Å; F752-Q755 PolarHBondContact O-N 2.82Å; F752-S953 WeakPolarHBondContact CE1-OG 3.39Å
753	A	89.6	Confident	90.3	Very high	12 Å²	12	26.5 Å²	26.5	10%	0.099	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-64.2	-9.1	175.7	0	0	0	0	0	114.6	H748 S750 Y751 R951	H748-A753 HydrophobicContact CB-CB 3.91Å; S750-A753 PolarHBondContact O-N 2.71Å; S750-A753 PolarHBondContact OG-N 2.93Å; Y751-A753 VanDerWaalsContact C-N 3.25Å; Y751-A753 PolarHBondContact O-N 3.38Å; A753-R951 WeakPolarHBondContact CB-O 3.24Å
754	L	90.1	Very high	90.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-88.2	-6.5	174.2	-51.5	-170	0	0	0	113.6	L664 N666 W668 E741 L744 A745 H748 Y751 F752 A756	L664-L754 HydrophobicContact CD2-CB 4.25Å; L664-L754 HydrophobicContact CD2-CD1 4.3Å; N666-L754 HydrophobicContact CB-CB 3.98Å; N666-L754 WeakPolarHBondContact CB-O 3.23Å; W668-L754 PolarHBondContact NE1-O 3.22Å; E741-L754 HydrophobicContact CG-CD1 4.28Å; L744-L754 HydrophobicContact CB-CD1 4.41Å; L744-L754 HydrophobicContact CB-CD2 4.41Å; L744-L754 HydrophobicContact CD2-CD1 4.13Å; L744-L754 HydrophobicContact CD2-CD2 3.76Å; L744-L754 HydrophobicContact CG-CD1 4.37Å; L744-L754 HydrophobicContact CG-CD2 3.67Å; A745-L754 HydrophobicContact CB-CD1 3.92Å; A745-L754 HydrophobicContact CB-CG 4.35Å; H748-L754 HydrophobicContact CB-CD2 4.23Å; Y751-L754 VanDerWaalsContact O-CB 3.3Å; Y751-L754 WeakPolarHBondContact O-CB 3.31Å; Y751-L754 WeakPolarHBondContact O-CG 3.23Å; Y751-L754 PolarHBondContact O-N 3.17Å; F752-L754 PolarHBondContact O-N 2.87Å; L754-A756 PolarHBondContact O-N 2.65Å
755	Q	85	Confident	90.1	Very high	84 Å²	84	27.5 Å²	27.5	39%	0.393	16%	0.162	S	C	.	.	S	Bend	trans	-66.4	131	180	-168.5	169	4	0	0	111.1	F752	F752-Q755 VanDerWaalsContact CE2-OE1 3.29Å; F752-Q755 WeakPolarHBondContact O-CB 3.26Å; F752-Q755 PolarHBondContact O-N 2.82Å
756	A	80.3	Confident	90.1	Very high	60 Å²	60	27.6 Å²	27.6	50%	0.496	16%	0.163	S	C	.	.	S	Bend	trans	61.9	151	-176.9	0	0	0	0	0	116.9	G665 W668 L754 R951	G665-A756 PolarHBondContact O-N 2.69Å; W668-A756 PolarHBondContact NE1-O 2.72Å; W668-A756 VanDerWaalsContact NE1-O 3.15Å; L754-A756 PolarHBondContact O-N 2.65Å; A756-R951 PolarHBondContact O-NH1 2.95Å; A756-R951 PolarHBondContact O-NH2 3.4Å; A756-R951 VanDerWaalsContact O-NH2 3.12Å
757	G	79.4	Confident	90.1	Very high	37 Å²	37	26.4 Å²	26.4	38%	0.381	16%	0.16	S	C	.	.			trans	162.5	-168.2	-176.7	0	0	0	0	0	112.4	W668	W668-G757 VanDerWaalsContact CB-C 3.41Å
758	R	81.8	Confident	90	Very high	116 Å²	116	24.8 Å²	24.8	44%	0.438	15%	0.151	S	C	.	.			trans	-129.9	151.4	174.7	-71.5	171.8	-67.4	-143.8	-10.4	110.7	I760 E761	R758-I760 VanDerWaalsContact C-N 3.27Å; R758-I760 HydrophobicContact CB-CG2 4.2Å; R758-I760 PolarHBondContact O-N 2.92Å; R758-E761 HydrophobicContact CB-CG 4.46Å; R758-E761 IonicContact CZ-OE1 3.68Å; R758-E761 IonicContact NE-OE1 3.48Å; R758-E761 PolarHBondContact NE-OE1 3.07Å; R758-E761 IonicContact NH2-OE1 2.73Å; R758-E761 PolarHBondContact NH2-OE1 3.03Å; R758-E761 WeakPolarHBondContact O-CB 3.34Å; R758-E761 PolarHBondContact O-N 2.85Å
759	A	86.3	Confident	90.2	Very high	4 Å²	4	23.3 Å²	23.3	3%	0.033	15%	0.145	C	C	.	.	H	α-helix	trans	-56.6	-39.8	-177.9	0	0	0	0	0	112.4	A672 E761 G762 L763 A833	A672-A759 WeakPolarHBondContact CB-O 3.39Å; A759-E761 PolarHBondContact O-N 2.91Å; A759-E761 VanDerWaalsContact O-N 3.15Å; A759-G762 WeakPolarHBondContact O-CA 3.36Å; A759-G762 PolarHBondContact O-N 2.77Å; A759-L763 PolarHBondContact O-N 3.19Å; A759-A833 HydrophobicContact CB-CB 4.31Å
760	I	89.2	Confident	90.3	Very high	16 Å²	16	21.3 Å²	21.3	8%	0.082	12%	0.124	C	C	.	.	H	α-helix	trans	-53.5	-33.7	174	-150.2	174.5	0	0	0	114.5	R758 A764 C771 D772 D903 F994	R758-I760 VanDerWaalsContact C-N 3.27Å; R758-I760 HydrophobicContact CB-CG2 4.2Å; R758-I760 PolarHBondContact O-N 2.92Å; I760-A764 VanDerWaalsContact O-CB 3.31Å; I760-A764 WeakPolarHBondContact O-CB 3.38Å; I760-A764 PolarHBondContact O-N 3.45Å; I760-C771 HydrophobicContact CD1-CB 3.8Å; I760-C771 HydrophobicContact CG1-CB 3.42Å; I760-C771 VanDerWaalsContact CG1-CB 3.42Å; I760-D772 WeakPolarHBondContact CD1-O 3.3Å; I760-D903 HydrophobicContact CB-CB 4.03Å; I760-D903 WeakPolarHBondContact CB-OD2 3.41Å; I760-D903 HydrophobicContact CG1-CB 4.26Å; I760-D903 PolarHBondContact N-OD2 2.9Å; I760-F994 HydrophobicContact CB-CZ 4.49Å; I760-F994 HydrophobicContact CD1-CE2 4.08Å; I760-F994 HydrophobicContact CD1-CZ 4.2Å; I760-F994 HydrophobicContact CG1-CE2 4.24Å; I760-F994 HydrophobicContact CG1-CZ 3.92Å; I760-F994 HydrophobicContact CG2-CZ 4.14Å
761	E	89.8	Confident	90.2	Very high	12 Å²	12	20.9 Å²	20.9	6%	0.056	12%	0.12	C	C	.	.	H	α-helix	trans	-73.4	-33.8	178.7	-59	-179.8	-167.1	0	0	110.7	W668 R758 A759 T765 R951 K993	W668-E761 HydrophobicContact CE3-CB 4.17Å; W668-E761 HydrophobicContact CZ3-CB 3.94Å; R758-E761 HydrophobicContact CB-CG 4.46Å; R758-E761 IonicContact CZ-OE1 3.68Å; R758-E761 IonicContact NE-OE1 3.48Å; R758-E761 PolarHBondContact NE-OE1 3.07Å; R758-E761 IonicContact NH2-OE1 2.73Å; R758-E761 PolarHBondContact NH2-OE1 3.03Å; R758-E761 WeakPolarHBondContact O-CB 3.34Å; R758-E761 PolarHBondContact O-N 2.85Å; A759-E761 PolarHBondContact O-N 2.91Å; A759-E761 VanDerWaalsContact O-N 3.15Å; E761-T765 WeakPolarHBondContact O-CB 3.47Å; E761-T765 PolarHBondContact O-N 2.82Å; E761-T765 PolarHBondContact O-OG1 2.98Å; E761-R951 IonicContact OE2-CZ 2.72Å; E761-R951 IonicContact OE2-NH2 2.75Å; E761-R951 PolarHBondContact OE2-NH2 3.49Å; E761-K993 HydrophobicContact CG-CD 4.43Å; E761-K993 IonicContact OE1-NZ 3.93Å; E761-K993 PolarHBondContact OE1-NZ 2.91Å; E761-K993 IonicContact OE2-NZ 3.79Å; E761-K993 PolarHBondContact OE2-NZ 3.25Å
762	G	92.3	Very high	90.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-70.8	-44.2	173.7	0	0	0	0	0	111.6	A759 T765 L766	A759-G762 WeakPolarHBondContact O-CA 3.36Å; A759-G762 PolarHBondContact O-N 2.77Å; G762-T765 PolarHBondContact O-N 2.66Å; G762-L766 WeakPolarHBondContact O-CB 3.31Å; G762-L766 VanDerWaalsContact O-CG 3.28Å; G762-L766 WeakPolarHBondContact O-CG 3.25Å; G762-L766 PolarHBondContact O-N 3.3Å
763	L	94.1	Very high	90	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.9	-48.5	176.3	-69.5	172.5	0	0	0	111	A672 V675 A759 T765 L766 T767 L806 D903 C905	A672-L763 HydrophobicContact CB-CD2 4.15Å; A672-L763 HydrophobicContact CB-CG 3.97Å; V675-L763 HydrophobicContact CB-CD2 4.11Å; V675-L763 HydrophobicContact CG1-CD2 3.95Å; A759-L763 PolarHBondContact O-N 3.19Å; L763-T765 VanDerWaalsContact C-N 3.32Å; L763-T765 PolarHBondContact O-N 3.06Å; L763-L766 PolarHBondContact O-N 3.06Å; L763-T767 WeakPolarHBondContact O-CB 3.34Å; L763-T767 WeakPolarHBondContact O-CG2 3.22Å; L763-T767 PolarHBondContact O-N 2.86Å; L763-T767 PolarHBondContact O-OG1 3.2Å; L763-L806 HydrophobicContact CD2-CD1 4.46Å; L763-D903 HydrophobicContact CD1-CB 4.33Å; L763-C905 HydrophobicContact CB-CB 4.06Å; L763-C905 HydrophobicContact CD1-CB 4.05Å; L763-C905 HydrophobicContact CD2-CB 4.46Å; L763-C905 HydrophobicContact CG-CB 4.42Å
764	A	93.6	Very high	90	Very high	4 Å²	4	23.5 Å²	23.5	3%	0.033	14%	0.137	C	C	.	.	H	α-helix	trans	-61.5	-37.9	175.2	0	0	0	0	0	112.5	I760 G768 F946 F994	I760-A764 VanDerWaalsContact O-CB 3.31Å; I760-A764 WeakPolarHBondContact O-CB 3.38Å; I760-A764 PolarHBondContact O-N 3.45Å; A764-G768 WeakPolarHBondContact O-CA 3.29Å; A764-G768 PolarHBondContact O-N 2.76Å; A764-F946 HydrophobicContact CB-CE1 4.49Å; A764-F994 HydrophobicContact CB-CE1 3.74Å; A764-F994 HydrophobicContact CB-CZ 3.8Å
765	T	94.9	Very high	89.8	Confident	16 Å²	16	27.7 Å²	27.7	10%	0.098	16%	0.157	C	C	.	.	H	α-helix	trans	-71.9	-34.6	178.7	-54.6	0	0	0	0	112.8	L702 C703 L744 E761 G762 L763	L702-T765 HydrophobicContact CB-CG2 4.4Å; C703-T765 PolarHBondContact N-O 3.28Å; L744-T765 HydrophobicContact CD1-CG2 3.71Å; E761-T765 WeakPolarHBondContact O-CB 3.47Å; E761-T765 PolarHBondContact O-N 2.82Å; E761-T765 PolarHBondContact O-OG1 2.98Å; G762-T765 PolarHBondContact O-N 2.66Å; L763-T765 VanDerWaalsContact C-N 3.32Å; L763-T765 PolarHBondContact O-N 3.06Å
766	L	96.2	Very high	89.9	Confident	3 Å²	3	24 Å²	24	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-79.3	-34.8	179.6	-70.3	164	0	0	0	112.7	F669 A672 L673 L676 V686 L702 I740 G762 L763	F669-L766 HydrophobicContact CE2-CD1 4Å; F669-L766 HydrophobicContact CE2-CD2 3.84Å; F669-L766 HydrophobicContact CE2-CG 3.79Å; F669-L766 HydrophobicContact CZ-CD2 3.83Å; F669-L766 HydrophobicContact CZ-CG 4.29Å; A672-L766 HydrophobicContact CB-CD1 4.28Å; L673-L766 HydrophobicContact CB-CD1 4.1Å; L673-L766 HydrophobicContact CD1-CD1 4Å; L673-L766 HydrophobicContact CD1-CD2 3.89Å; L676-L766 HydrophobicContact CB-CD1 4.45Å; L676-L766 HydrophobicContact CD1-CB 4.4Å; L676-L766 HydrophobicContact CD2-CB 4.14Å; L676-L766 HydrophobicContact CD2-CD1 4.24Å; L676-L766 HydrophobicContact CD2-CD2 4.28Å; L676-L766 HydrophobicContact CD2-CG 4.45Å; V686-L766 HydrophobicContact CG1-CD2 4.13Å; V686-L766 HydrophobicContact CG2-CB 4.47Å; V686-L766 HydrophobicContact CG2-CD2 4.17Å; V686-L766 WeakPolarHBondContact CG2-O 3.22Å; L702-L766 HydrophobicContact CD2-CD2 4.11Å; I740-L766 HydrophobicContact CG2-CD2 4.16Å; G762-L766 WeakPolarHBondContact O-CB 3.31Å; G762-L766 VanDerWaalsContact O-CG 3.28Å; G762-L766 WeakPolarHBondContact O-CG 3.25Å; G762-L766 PolarHBondContact O-N 3.3Å; L763-L766 PolarHBondContact O-N 3.06Å
767	T	94.6	Very high	89.9	Confident	19 Å²	19	24.2 Å²	24.2	12%	0.117	13%	0.131	C	C	.	.	H	α-helix	trans	-109.3	-20.8	-168.9	67.8	0	0	0	0	113.9	L676 W708 L763 A769 C905 I907	L676-T767 HydrophobicContact CD1-CG2 3.68Å; W708-T767 VanDerWaalsContact CH2-O 3.3Å; W708-T767 WeakPolarHBondContact CH2-O 3.38Å; W708-T767 WeakPolarHBondContact CZ2-O 3.43Å; L763-T767 WeakPolarHBondContact O-CB 3.34Å; L763-T767 WeakPolarHBondContact O-CG2 3.22Å; L763-T767 PolarHBondContact O-N 2.86Å; L763-T767 PolarHBondContact O-OG1 3.2Å; T767-A769 PolarHBondContact O-N 2.83Å; T767-A769 VanDerWaalsContact O-N 3.07Å; T767-A769 WeakPolarHBondContact OG1-CB 3.39Å; T767-A769 PolarHBondContact OG1-N 3.24Å; T767-C905 PolarHBondContact OG1-SG 2.87Å; T767-I907 HydrophobicContact CG2-CD1 3.58Å; T767-I907 HydrophobicContact CG2-CG1 4.19Å
768	G	92.6	Very high	89.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.			trans	63.4	0.7	-170.1	0	0	0	0	0	115.5	C703 A764 R915 Y1053	C703-G768 VanDerWaalsContact SG-CA 3.51Å; A764-G768 WeakPolarHBondContact O-CA 3.29Å; A764-G768 PolarHBondContact O-N 2.76Å; G768-R915 PolarHBondContact O-NH1 2.84Å; G768-R915 PolarHBondContact O-NH2 2.68Å; G768-Y1053 PolarHBondContact O-OH 3.42Å
769	A	93.2	Very high	88.4	Confident	5 Å²	5	22.4 Å²	22.4	4%	0.041	13%	0.127	C	C	.	.			trans	-85.1	162.1	-167.7	0	0	0	0	0	113.2	T767 C771 I907 Y1053	T767-A769 PolarHBondContact O-N 2.83Å; T767-A769 VanDerWaalsContact O-N 3.07Å; T767-A769 WeakPolarHBondContact OG1-CB 3.39Å; T767-A769 PolarHBondContact OG1-N 3.24Å; A769-C771 PolarHBondContact O-N 2.9Å; A769-C771 PolarHBondContact O-SG 3.37Å; A769-I907 HydrophobicContact CB-CG1 4.4Å; A769-Y1053 WeakPolarHBondContact CA-OH 3.39Å
770	P	92.8	Very high	86.8	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.032	15%	0.154	C	C	.	.			trans	-60.9	132	173.6	-19.7	34.8	0	0	0	110	K906 E942 A944 Y1053	P770-K906 HydrophobicContact CB-CB 4.49Å; P770-K906 PolarHBondContact O-N 3.18Å; P770-E942 HydrophobicContact CB-CB 4.43Å; P770-E942 WeakPolarHBondContact CB-OE2 3.47Å; P770-E942 HydrophobicContact CG-CB 3.93Å; P770-E942 WeakPolarHBondContact CG-OE2 3.49Å; P770-A944 HydrophobicContact CB-CB 4.45Å; P770-Y1053 HydrophobicContact CG-CD2 3.56Å; P770-Y1053 HydrophobicContact CG-CE2 3.88Å; P770-Y1053 HydrophobicContact CG-CG 4.18Å
771	C	93.1	Very high	84.8	Confident	6 Å²	6	28.9 Å²	28.9	4%	0.041	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.1	178.4	-57.8	0	0	0	0	110.2	I760 A769 I904 F994	I760-C771 HydrophobicContact CD1-CB 3.8Å; I760-C771 HydrophobicContact CG1-CB 3.42Å; I760-C771 VanDerWaalsContact CG1-CB 3.42Å; A769-C771 PolarHBondContact O-N 2.9Å; A769-C771 PolarHBondContact O-SG 3.37Å; C771-I904 CarbonylContact C-O 3.57Å; C771-I904 WeakPolarHBondContact CA-O 3.49Å; C771-F994 HydrophobicContact CB-CE2 4.05Å; C771-F994 HydrophobicContact CB-CZ 4.33Å
772	D	90.8	Very high	83	Confident	51 Å²	51	31 Å²	31	27%	0.273	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	156.5	175.1	-78.4	-47.4	0	0	0	110.7	I760 I904 K906	I760-D772 WeakPolarHBondContact CD1-O 3.3Å; D772-I904 PolarHBondContact N-O 3.01Å; D772-I904 PolarHBondContact O-N 2.92Å; D772-K906 WeakPolarHBondContact OD2-CE 3.46Å; D772-K906 IonicContact OD2-NZ 3.8Å; D772-K906 PolarHBondContact OD2-NZ 3.05Å
773	S	89.8	Confident	80.7	Confident	32 Å²	32	37.3 Å²	37.3	22%	0.224	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	117.7	177.7	-161.5	0	0	0	0	109.4	M775 V902 D903	S773-M775 WeakPolarHBondContact OG-CE 3.35Å; S773-V902 CarbonylContact C-O 3.56Å; S773-V902 WeakPolarHBondContact CA-O 3.45Å; S773-D903 VanDerWaalsContact CB-OD1 3.31Å; S773-D903 WeakPolarHBondContact CB-OD1 3.37Å; S773-D903 PolarHBondContact OG-OD1 3.15Å
774	L	90	Very high	78.7	Confident	23 Å²	23	46.1 Å²	46.1	12%	0.12	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	119	173.7	-51.6	-175.6	0	0	0	108.3	I793 K796 M797 S901 V902 I904	L774-I793 HydrophobicContact CD1-CG2 4.14Å; L774-K796 HydrophobicContact CD1-CB 3.88Å; L774-K796 HydrophobicContact CD1-CD 4.2Å; L774-K796 HydrophobicContact CD2-CD 3.91Å; L774-M797 HydrophobicContact CD1-CG 4.42Å; L774-S901 CarbonylContact O-C 3.51Å; L774-S901 VanDerWaalsContact O-CA 3.25Å; L774-S901 WeakPolarHBondContact O-CA 3.47Å; L774-V902 HydrophobicContact CB-CB 4.33Å; L774-V902 PolarHBondContact N-O 3.45Å; L774-V902 PolarHBondContact O-N 3.27Å; L774-I904 HydrophobicContact CD1-CD1 3.73Å; L774-I904 HydrophobicContact CG-CD1 3.97Å
775	M	86.4	Confident	77.1	Confident	88 Å²	88	49.5 Å²	49.5	43%	0.433	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134.3	172.9	-53.4	-68.4	82.8	0	0	109.1	S773 I793 S901	S773-M775 WeakPolarHBondContact OG-CE 3.35Å; M775-I793 WeakPolarHBondContact O-CD1 3.37Å; M775-S901 VanDerWaalsContact CE-CB 3.5Å
776	L	87.4	Confident	75.4	Confident	6 Å²	6	56.4 Å²	56.4	3%	0.031	30%	0.303	C	S	.	.	S	Bend	trans	-98.1	-15.1	178.1	-48.1	-178.2	0	0	0	111.8	I793 F895 I896 F899 D900 V902	L776-I793 HydrophobicContact CD2-CD1 3.99Å; L776-I793 HydrophobicContact CD2-CG2 3.91Å; L776-F895 HydrophobicContact CD1-CD1 4.09Å; L776-F895 HydrophobicContact CD1-CE1 3.43Å; L776-F895 VanDerWaalsContact CD1-CE1 3.43Å; L776-F895 HydrophobicContact CD1-CZ 3.85Å; L776-I896 HydrophobicContact CB-CD1 4.17Å; L776-I896 HydrophobicContact CD1-CD1 4.28Å; L776-I896 HydrophobicContact CD2-CD1 3.84Å; L776-I896 HydrophobicContact CG-CD1 4.29Å; L776-F899 HydrophobicContact CD1-CB 3.76Å; L776-D900 PolarHBondContact N-O 2.69Å; L776-V902 HydrophobicContact CD1-CG2 4.32Å; L776-V902 HydrophobicContact CD2-CG2 4.23Å
777	Q	79.8	Confident	74.1	Confident	66 Å²	66	61.7 Å²	61.7	31%	0.308	34%	0.337	S	S	.	.	S	Bend	trans	-120.1	138.3	-177.2	-53.3	-60.4	-29.7	0	0	111	I788 M816 I896 F899 D900	Q777-I788 WeakPolarHBondContact O-CD1 3.44Å; Q777-M816 HydrophobicContact CG-CG 3.88Å; Q777-M816 HydrophobicContact CG-SD 4.11Å; Q777-I896 PolarHBondContact NE2-O 2.84Å; Q777-F899 PolarHBondContact NE2-O 2.79Å; Q777-F899 VanDerWaalsContact NE2-O 3.16Å; Q777-D900 HydrophobicContact CG-CB 4.41Å
778	V	68.2	Low	73.4	Confident	75 Å²	75	63.2 Å²	63.2	46%	0.455	34%	0.344	S	S	.	.			trans	-67.7	142.6	-176.5	-178.2	0	0	0	0	111.3	S780 I788	V778-S780 PolarHBondContact O-N 2.86Å; V778-S780 VanDerWaalsContact O-N 3.1Å; V778-I788 HydrophobicContact CG2-CD1 3.94Å; V778-I788 HydrophobicContact CG2-CG1 4.05Å
779	S	62.5	Low	73.2	Confident	40 Å²	40	67.2 Å²	67.2	28%	0.28	37%	0.366	S	S	.	.			trans	-65.3	108.2	176.7	-55.6	0	0	0	0	111.7	T781 N782 E785	S779-T781 PolarHBondContact O-N 2.88Å; S779-N782 PolarHBondContact O-N 3.06Å; S779-N782 VanDerWaalsContact O-N 3.16Å; S779-E785 WeakPolarHBondContact CB-OE2 3.46Å; S779-E785 PolarHBondContact OG-OE2 3.11Å
780	S	52.2	Low	73.1	Confident	84 Å²	84	69.5 Å²	69.5	59%	0.587	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-16.9	174	58.4	0	0	0	0	114.5	V778 N815	V778-S780 PolarHBondContact O-N 2.86Å; V778-S780 VanDerWaalsContact O-N 3.1Å; S780-N815 VanDerWaalsContact OG-CG 3.23Å; S780-N815 PolarHBondContact OG-ND2 3Å; S780-N815 VanDerWaalsContact OG-ND2 3.14Å; S780-N815 PolarHBondContact OG-OD1 2.75Å
781	T	47.2	Very low	73.1	Confident	71 Å²	71	73.4 Å²	73.4	44%	0.436	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-16.4	-177.7	51	0	0	0	0	114.7	S779	S779-T781 PolarHBondContact O-N 2.88Å
782	N	50.8	Low	73.1	Confident	58 Å²	58	77 Å²	77	31%	0.31	42%	0.418	S	S	.	.			trans	-141.7	86.1	-173.9	-164.1	-2.3	0	0	0	112.6	S779 R784 E785	S779-N782 PolarHBondContact O-N 3.06Å; S779-N782 VanDerWaalsContact O-N 3.16Å; N782-R784 PolarHBondContact O-N 2.47Å; N782-E785 WeakPolarHBondContact O-CB 3.24Å; N782-E785 PolarHBondContact O-N 3.19Å
783	P	45.5	Very low	73.2	Confident	131 Å²	131	75.1 Å²	75.1	85%	0.851	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	18.6	-176.2	31.9	-37.5	0	0	0	114.7
784	R	50.9	Low	73.5	Confident	186 Å²	186	74.1 Å²	74.1	70%	0.702	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-2	167.2	-66.9	-173	179	-169.9	0.4	113	N782	N782-R784 PolarHBondContact O-N 2.47Å
785	E	60.6	Low	73.7	Confident	75 Å²	75	75.4 Å²	75.4	35%	0.35	41%	0.413	S	S	.	.	S	Bend	trans	-65.6	138.5	173.2	-167.3	158.4	-131.6	0	0	109.6	S779 N782	S779-E785 WeakPolarHBondContact CB-OE2 3.46Å; S779-E785 PolarHBondContact OG-OE2 3.11Å; N782-E785 WeakPolarHBondContact O-CB 3.24Å; N782-E785 PolarHBondContact O-N 3.19Å
786	E	59.4	Low	74.1	Confident	161 Å²	161	75.2 Å²	75.2	75%	0.752	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-59.4	146.4	-177.3	-68.4	177.9	136.5	0	0	111
787	P	68.7	Low	74.6	Confident	114 Å²	114	74.9 Å²	74.9	74%	0.74	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-58	142.5	174.9	26.7	-34.9	0	0	0	110.1	D789	P787-D789 PolarHBondContact O-N 2.75Å; P787-D789 VanDerWaalsContact O-N 3.08Å
788	I	80.6	Confident	75.3	Confident	50 Å²	50	74 Å²	74	26%	0.256	41%	0.406	S	S	.	.			trans	-68.9	112	-175.9	-72.6	174.2	0	0	0	110.1	Q777 V778 T790 I793	Q777-I788 WeakPolarHBondContact O-CD1 3.44Å; V778-I788 HydrophobicContact CG2-CD1 3.94Å; V778-I788 HydrophobicContact CG2-CG1 4.05Å; I788-T790 HydrophobicContact CG2-CG2 4.39Å; I788-T790 PolarHBondContact O-N 3.44Å; I788-T790 VanDerWaalsContact O-N 3.09Å; I788-I793 HydrophobicContact CG2-CD1 3.37Å
789	D	87.9	Confident	76.6	Confident	85 Å²	85	73.3 Å²	73.3	46%	0.455	40%	0.404	S	S	.	.			trans	-70.2	98.2	171.2	-176.7	-14.4	0	0	0	109.8	P787 D791 L792 I793	P787-D789 PolarHBondContact O-N 2.75Å; P787-D789 VanDerWaalsContact O-N 3.08Å; D789-D791 VanDerWaalsContact C-N 3.33Å; D789-D791 WeakPolarHBondContact OD1-CB 3.46Å; D789-D791 PolarHBondContact OD1-N 2.73Å; D789-L792 HydrophobicContact CB-CB 3.89Å; D789-L792 PolarHBondContact O-N 2.99Å; D789-L792 PolarHBondContact OD1-N 2.67Å; D789-L792 VanDerWaalsContact OD2-CB 3.3Å; D789-L792 WeakPolarHBondContact OD2-CB 3.43Å; D789-I793 WeakPolarHBondContact O-CG1 3.46Å; D789-I793 PolarHBondContact O-N 2.66Å; D789-I793 VanDerWaalsContact O-N 3.15Å
790	T	91.2	Very high	78.2	Confident	53 Å²	53	71.9 Å²	71.9	33%	0.325	39%	0.394	S	S	.	.	H	α-helix	trans	-73	-23.1	178.9	54.2	0	0	0	0	112.5	I788 W794 Y892 I896	I788-T790 HydrophobicContact CG2-CG2 4.39Å; I788-T790 PolarHBondContact O-N 3.44Å; I788-T790 VanDerWaalsContact O-N 3.09Å; T790-W794 WeakPolarHBondContact O-CB 3.36Å; T790-W794 PolarHBondContact O-N 3.21Å; T790-Y892 WeakPolarHBondContact O-CE1 3.21Å; T790-Y892 PolarHBondContact O-OH 3.03Å; T790-I896 HydrophobicContact CG2-CD1 4.32Å; T790-I896 HydrophobicContact CG2-CG1 4.34Å; T790-I896 HydrophobicContact CG2-CG2 4.22Å
791	D	92.9	Very high	80.1	Confident	87 Å²	87	71.5 Å²	71.5	47%	0.465	38%	0.382	S	S	.	.	H	α-helix	trans	-72	-40.5	172.7	-79.7	-47.8	0	0	0	111	D789 I793 W794 A795 R846	D789-D791 VanDerWaalsContact C-N 3.33Å; D789-D791 WeakPolarHBondContact OD1-CB 3.46Å; D789-D791 PolarHBondContact OD1-N 2.73Å; D791-I793 VanDerWaalsContact C-N 3.34Å; D791-W794 PolarHBondContact O-N 3.47Å; D791-A795 WeakPolarHBondContact O-CB 3.43Å; D791-A795 PolarHBondContact O-N 3.23Å; D791-R846 IonicContact OD1-CZ 2.72Å; D791-R846 IonicContact OD1-NH1 2.89Å; D791-R846 PolarHBondContact OD1-NH1 2.67Å; D791-R846 IonicContact OD1-NH2 2.83Å; D791-R846 PolarHBondContact OD1-NH2 3.35Å
792	L	91.9	Very high	82.3	Confident	82 Å²	82	75.4 Å²	75.4	43%	0.429	40%	0.395	S	S	.	.	H	α-helix	trans	-66.5	-34.1	173.7	180	61.5	0	0	0	112.5	D789 K796	D789-L792 HydrophobicContact CB-CB 3.89Å; D789-L792 PolarHBondContact O-N 2.99Å; D789-L792 PolarHBondContact OD1-N 2.67Å; D789-L792 VanDerWaalsContact OD2-CB 3.3Å; D789-L792 WeakPolarHBondContact OD2-CB 3.43Å; L792-K796 HydrophobicContact CG-CD 4.37Å; L792-K796 WeakPolarHBondContact O-CB 3.46Å; L792-K796 WeakPolarHBondContact O-CD 3.02Å; L792-K796 VanDerWaalsContact O-CG 3.24Å; L792-K796 WeakPolarHBondContact O-CG 3.14Å; L792-K796 PolarHBondContact O-N 3.49Å; L792-K796 VanDerWaalsContact O-N 3.09Å
793	I	93.9	Very high	84.3	Confident	11 Å²	11	75.3 Å²	75.3	6%	0.056	40%	0.402	C	S	.	.	H	α-helix	trans	-66.6	-47.4	171.4	-70.3	169.9	0	0	0	110.2	L774 M775 L776 I788 D789 D791 A795 K796 M797 Y892	L774-I793 HydrophobicContact CD1-CG2 4.14Å; M775-I793 WeakPolarHBondContact O-CD1 3.37Å; L776-I793 HydrophobicContact CD2-CD1 3.99Å; L776-I793 HydrophobicContact CD2-CG2 3.91Å; I788-I793 HydrophobicContact CG2-CD1 3.37Å; D789-I793 WeakPolarHBondContact O-CG1 3.46Å; D789-I793 PolarHBondContact O-N 2.66Å; D789-I793 VanDerWaalsContact O-N 3.15Å; D791-I793 VanDerWaalsContact C-N 3.34Å; I793-A795 VanDerWaalsContact C-N 3.35Å; I793-A795 PolarHBondContact O-N 2.86Å; I793-K796 PolarHBondContact O-N 3.22Å; I793-K796 VanDerWaalsContact O-N 3.12Å; I793-M797 HydrophobicContact CG2-CG 4.31Å; I793-M797 HydrophobicContact CG2-SD 3.78Å; I793-M797 WeakPolarHBondContact O-CG 3.48Å; I793-M797 PolarHBondContact O-N 3.1Å; I793-Y892 WeakPolarHBondContact CB-OH 3.46Å; I793-Y892 VanDerWaalsContact CG2-OH 3.25Å; I793-Y892 WeakPolarHBondContact CG2-OH 3.38Å
794	W	95.4	Very high	86.5	Confident	10 Å²	10	70.7 Å²	70.7	4%	0.038	38%	0.378	C	S	.	.	H	α-helix	trans	-56.2	-48.2	176.4	-179.7	-113.2	0	0	0	111.7	T790 D791 K796 M797 L798 V839 R840 D841 R846 L848 Y892	T790-W794 WeakPolarHBondContact O-CB 3.36Å; T790-W794 PolarHBondContact O-N 3.21Å; D791-W794 PolarHBondContact O-N 3.47Å; W794-K796 VanDerWaalsContact C-N 3.31Å; W794-K796 PolarHBondContact O-N 3.28Å; W794-M797 PolarHBondContact O-N 3.4Å; W794-L798 WeakPolarHBondContact O-CB 3.3Å; W794-L798 PolarHBondContact O-N 2.45Å; W794-V839 HydrophobicContact CE3-CG1 4.15Å; W794-V839 HydrophobicContact CH2-CG1 3.64Å; W794-V839 HydrophobicContact CZ2-CG1 4.17Å; W794-V839 HydrophobicContact CZ3-CG1 3.65Å; W794-R840 WeakPolarHBondContact CH2-O 3.32Å; W794-R840 WeakPolarHBondContact CZ2-O 3.36Å; W794-D841 HydrophobicContact CZ2-CB 4.1Å; W794-D841 PolarHBondContact NE1-OD2 3.28Å; W794-R846 HydrophobicContact CD2-CB 4.25Å; W794-R846 HydrophobicContact CD2-CG 4.17Å; W794-R846 HydrophobicContact CE3-CB 4.27Å; W794-R846 HydrophobicContact CH2-CB 3.62Å; W794-R846 HydrophobicContact CH2-CG 4.21Å; W794-R846 HydrophobicContact CZ2-CB 3.56Å; W794-R846 HydrophobicContact CZ2-CG 3.62Å; W794-R846 HydrophobicContact CZ3-CB 3.96Å; W794-L848 HydrophobicContact CZ3-CD2 3.77Å; W794-L848 HydrophobicContact CZ3-CG 4.12Å; W794-Y892 HydrophobicContact CB-CE1 3.88Å; W794-Y892 HydrophobicContact CD2-CD1 4.5Å; W794-Y892 HydrophobicContact CE3-CD1 4.05Å; W794-Y892 AromaticContact CE3-CD2 3.63Å; W794-Y892 HydrophobicContact CE3-CD2 3.63Å; W794-Y892 HydrophobicContact CE3-CE1 4.35Å; W794-Y892 AromaticContact CE3-CE2 3.99Å; W794-Y892 HydrophobicContact CE3-CE2 3.99Å; W794-Y892 AromaticContact CE3-CG 3.66Å; W794-Y892 HydrophobicContact CE3-CG 3.66Å; W794-Y892 HydrophobicContact CZ3-CD2 4.01Å; W794-Y892 HydrophobicContact CZ3-CG 4.02Å; W794-Y892 PolarHBondContact N-OH 3.06Å
795	A	95.3	Very high	88.6	Confident	51 Å²	51	63.3 Å²	63.3	42%	0.421	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-36.4	177.5	0	0	0	0	0	112.9	D791 I793 S799	D791-A795 WeakPolarHBondContact O-CB 3.43Å; D791-A795 PolarHBondContact O-N 3.23Å; I793-A795 VanDerWaalsContact C-N 3.35Å; I793-A795 PolarHBondContact O-N 2.86Å; A795-S799 WeakPolarHBondContact O-CB 3.41Å; A795-S799 PolarHBondContact O-N 2.94Å; A795-S799 PolarHBondContact O-OG 3.08Å
796	K	94.6	Very high	90.3	Very high	83 Å²	83	60.3 Å²	60.3	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-70.9	-40.4	175	-76	169.4	-178.5	171.1	0	112.7	L774 L792 I793 W794 S799 S800	L774-K796 HydrophobicContact CD1-CB 3.88Å; L774-K796 HydrophobicContact CD1-CD 4.2Å; L774-K796 HydrophobicContact CD2-CD 3.91Å; L792-K796 HydrophobicContact CG-CD 4.37Å; L792-K796 WeakPolarHBondContact O-CB 3.46Å; L792-K796 WeakPolarHBondContact O-CD 3.02Å; L792-K796 VanDerWaalsContact O-CG 3.24Å; L792-K796 WeakPolarHBondContact O-CG 3.14Å; L792-K796 PolarHBondContact O-N 3.49Å; L792-K796 VanDerWaalsContact O-N 3.09Å; I793-K796 PolarHBondContact O-N 3.22Å; I793-K796 VanDerWaalsContact O-N 3.12Å; W794-K796 VanDerWaalsContact C-N 3.31Å; W794-K796 PolarHBondContact O-N 3.28Å; K796-S799 PolarHBondContact O-OG 3.25Å; K796-S800 WeakPolarHBondContact O-CB 3.39Å; K796-S800 PolarHBondContact O-N 3.13Å; K796-S800 PolarHBondContact O-OG 3.42Å
797	M	96.3	Very high	92	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65	-45.9	176.2	-67.3	174.3	75	0	0	110.9	L774 I793 W794 S800 K801 I836 V839 L848 Y892 F895 V902	L774-M797 HydrophobicContact CD1-CG 4.42Å; I793-M797 HydrophobicContact CG2-CG 4.31Å; I793-M797 HydrophobicContact CG2-SD 3.78Å; I793-M797 WeakPolarHBondContact O-CG 3.48Å; I793-M797 PolarHBondContact O-N 3.1Å; W794-M797 PolarHBondContact O-N 3.4Å; M797-S800 PolarHBondContact O-N 2.81Å; M797-K801 PolarHBondContact O-N 3.23Å; M797-I836 HydrophobicContact CE-CD1 3.54Å; M797-V839 HydrophobicContact CB-CG1 4.15Å; M797-V839 HydrophobicContact CB-CG2 4.21Å; M797-L848 HydrophobicContact CE-CD1 3.86Å; M797-L848 HydrophobicContact CE-CD2 3.66Å; M797-L848 HydrophobicContact CE-CG 4.45Å; M797-Y892 HydrophobicContact SD-CE2 4.04Å; M797-F895 HydrophobicContact CE-CE1 3.91Å; M797-F895 HydrophobicContact CE-CZ 4.32Å; M797-F895 HydrophobicContact SD-CE1 4.36Å; M797-V902 HydrophobicContact CE-CG1 4.47Å; M797-V902 HydrophobicContact CE-CG2 3.89Å; M797-V902 HydrophobicContact CG-CG1 4.49Å; M797-V902 HydrophobicContact SD-CG2 4.1Å
798	L	95.4	Very high	93.1	Very high	47 Å²	47	47.5 Å²	47.5	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-49.2	179	-175.5	62.8	0	0	0	111.7	W794 S800 K801 E802 V839	W794-L798 WeakPolarHBondContact O-CB 3.3Å; W794-L798 PolarHBondContact O-N 2.45Å; L798-S800 VanDerWaalsContact C-N 3.32Å; L798-S800 PolarHBondContact O-N 2.89Å; L798-K801 WeakPolarHBondContact O-CB 3.15Å; L798-K801 PolarHBondContact O-N 2.89Å; L798-E802 PolarHBondContact O-N 3.25Å; L798-V839 HydrophobicContact CB-CG1 4.14Å; L798-V839 HydrophobicContact CD1-CG1 4.21Å; L798-V839 WeakPolarHBondContact CD1-O 3.17Å
799	S	95.1	Very high	93.6	Very high	60 Å²	60	45.1 Å²	45.1	42%	0.42	26%	0.256	S	S	.	.	H	α-helix	trans	-66.4	-30.9	177.5	53.3	0	0	0	0	113.3	A795 K796 E802 A803	A795-S799 WeakPolarHBondContact O-CB 3.41Å; A795-S799 PolarHBondContact O-N 2.94Å; A795-S799 PolarHBondContact O-OG 3.08Å; K796-S799 PolarHBondContact O-OG 3.25Å; S799-E802 PolarHBondContact O-N 3.47Å; S799-A803 WeakPolarHBondContact O-CB 3.09Å; S799-A803 PolarHBondContact O-N 3.09Å
800	S	95.5	Very high	93.6	Very high	11 Å²	11	42 Å²	42	8%	0.077	24%	0.241	C	C	.	.	H	α-helix	trans	-68.6	-37.8	172.3	-61.2	0	0	0	0	112.2	K796 M797 L798 A803 G804 F805	K796-S800 WeakPolarHBondContact O-CB 3.39Å; K796-S800 PolarHBondContact O-N 3.13Å; K796-S800 PolarHBondContact O-OG 3.42Å; M797-S800 PolarHBondContact O-N 2.81Å; L798-S800 VanDerWaalsContact C-N 3.32Å; L798-S800 PolarHBondContact O-N 2.89Å; S800-A803 PolarHBondContact O-N 2.74Å; S800-G804 PolarHBondContact O-N 2.67Å; S800-F805 WeakPolarHBondContact O-CB 3.28Å; S800-F805 PolarHBondContact O-N 2.9Å
801	K	93.6	Very high	93.4	Very high	75 Å²	75	39.5 Å²	39.5	33%	0.326	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-42	171.2	179.5	-93.9	166.7	122.1	0	111.7	M797 L798 A803 G804 M807 D838 V839	M797-K801 PolarHBondContact O-N 3.23Å; L798-K801 WeakPolarHBondContact O-CB 3.15Å; L798-K801 PolarHBondContact O-N 2.89Å; K801-A803 VanDerWaalsContact C-N 3.29Å; K801-A803 PolarHBondContact O-N 3.44Å; K801-G804 PolarHBondContact O-N 3.27Å; K801-G804 VanDerWaalsContact O-N 3.08Å; K801-M807 HydrophobicContact CB-CE 3.89Å; K801-D838 WeakPolarHBondContact CE-OD1 3.44Å; K801-D838 IonicContact NZ-OD1 3.45Å; K801-D838 PolarHBondContact NZ-OD1 2.95Å; K801-D838 IonicContact NZ-OD2 2.72Å; K801-V839 HydrophobicContact CB-CB 4.11Å; K801-V839 HydrophobicContact CB-CG2 4.12Å; K801-V839 HydrophobicContact CG-CB 4.36Å
802	E	93.3	Very high	92.5	Very high	154 Å²	154	35.5 Å²	35.5	72%	0.72	21%	0.205	S	C	*	.	H	α-helix	trans	-64	-33.3	175.1	-71.4	-173.6	152.1	0	0	112.7	L798 S799 G804	L798-E802 PolarHBondContact O-N 3.25Å; S799-E802 PolarHBondContact O-N 3.47Å; E802-G804 PolarHBondContact O-N 2.98Å
803	A	92.6	Very high	91.4	Very high	55 Å²	55	32.4 Å²	32.4	46%	0.455	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-6.5	172.8	0	0	0	0	0	114.1	S799 S800 K801 F805	S799-A803 WeakPolarHBondContact O-CB 3.09Å; S799-A803 PolarHBondContact O-N 3.09Å; S800-A803 PolarHBondContact O-N 2.74Å; K801-A803 VanDerWaalsContact C-N 3.29Å; K801-A803 PolarHBondContact O-N 3.44Å; A803-F805 VanDerWaalsContact C-N 3.29Å; A803-F805 HydrophobicContact CB-CD1 3.95Å; A803-F805 HydrophobicContact CB-CD2 3.89Å; A803-F805 HydrophobicContact CB-CE1 3.82Å; A803-F805 HydrophobicContact CB-CE2 3.74Å; A803-F805 HydrophobicContact CB-CG 4Å; A803-F805 HydrophobicContact CB-CZ 3.72Å; A803-F805 PolarHBondContact O-N 3.4Å
804	G	92.3	Very high	90.1	Very high	34 Å²	34	35.7 Å²	35.7	35%	0.351	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	21.4	-177.5	0	0	0	0	0	114.4	R679 S800 K801 E802	R679-G804 PolarHBondContact NH1-O 2.8Å; S800-G804 PolarHBondContact O-N 2.67Å; K801-G804 PolarHBondContact O-N 3.27Å; K801-G804 VanDerWaalsContact O-N 3.08Å; E802-G804 PolarHBondContact O-N 2.98Å
805	F	95.2	Very high	88.6	Confident	31 Å²	31	40.1 Å²	40.1	14%	0.136	25%	0.254	C	S	.	.			trans	-70.8	152.1	176.9	-63.2	-22	0	0	0	111.8	S800 A803 I904 C905 K906 H908	S800-F805 WeakPolarHBondContact O-CB 3.28Å; S800-F805 PolarHBondContact O-N 2.9Å; A803-F805 VanDerWaalsContact C-N 3.29Å; A803-F805 HydrophobicContact CB-CD1 3.95Å; A803-F805 HydrophobicContact CB-CD2 3.89Å; A803-F805 HydrophobicContact CB-CE1 3.82Å; A803-F805 HydrophobicContact CB-CE2 3.74Å; A803-F805 HydrophobicContact CB-CG 4Å; A803-F805 HydrophobicContact CB-CZ 3.72Å; A803-F805 PolarHBondContact O-N 3.4Å; F805-I904 HydrophobicContact CB-CG2 4.24Å; F805-I904 HydrophobicContact CD2-CG2 4.21Å; F805-C905 WeakPolarHBondContact CB-O 3.48Å; F805-K906 HydrophobicContact CD1-CB 4.35Å; F805-K906 HydrophobicContact CD2-CB 4.37Å; F805-K906 HydrophobicContact CD2-CG 3.91Å; F805-K906 HydrophobicContact CE1-CB 4.07Å; F805-K906 HydrophobicContact CE2-CB 4.1Å; F805-K906 HydrophobicContact CE2-CD 4.26Å; F805-K906 HydrophobicContact CE2-CG 3.71Å; F805-K906 HydrophobicContact CG-CB 4.49Å; F805-K906 HydrophobicContact CG-CG 4.43Å; F805-K906 HydrophobicContact CZ-CB 3.93Å; F805-K906 HydrophobicContact CZ-CG 4.05Å; F805-H908 AromaticContact CE1-CE1 3.53Å; F805-H908 AromaticContact CE1-ND1 3.97Å; F805-H908 AromaticContact CE1-NE2 3.8Å; F805-H908 AromaticContact CZ-CE1 3.5Å; F805-H908 AromaticContact CZ-NE2 3.68Å
806	L	94.7	Very high	87.6	Confident	12 Å²	12	39.3 Å²	39.3	6%	0.063	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	140.7	173.9	-72	-173.1	0	0	0	110.4	V675 L676 R679 L682 L763 C905 I907	V675-L806 HydrophobicContact CG1-CB 3.8Å; V675-L806 HydrophobicContact CG1-CD1 4.18Å; V675-L806 HydrophobicContact CG1-CD2 4.21Å; V675-L806 HydrophobicContact CG1-CG 4.29Å; L676-L806 HydrophobicContact CD1-CD1 3.94Å; R679-L806 HydrophobicContact CG-CD2 4.28Å; L682-L806 HydrophobicContact CD1-CD1 3.88Å; L682-L806 HydrophobicContact CD1-CG 4.37Å; L763-L806 HydrophobicContact CD2-CD1 4.46Å; L806-C905 HydrophobicContact CB-CB 4.17Å; L806-C905 PolarHBondContact N-O 2.99Å; L806-C905 PolarHBondContact O-N 2.79Å; L806-I907 HydrophobicContact CD1-CD1 3.55Å; L806-I907 HydrophobicContact CG-CD1 3.87Å
807	M	94.7	Very high	86.8	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.5	178.6	-67.9	-171	-72	0	0	111.7	K801 I836 V839 D903 I904	K801-M807 HydrophobicContact CB-CE 3.89Å; M807-I836 HydrophobicContact CB-CB 3.92Å; M807-I836 HydrophobicContact CB-CD1 4.34Å; M807-I836 HydrophobicContact CB-CG1 4.48Å; M807-I836 HydrophobicContact CE-CG2 4.27Å; M807-I836 PolarHBondContact O-N 3.34Å; M807-V839 HydrophobicContact CE-CG2 3.68Å; M807-D903 WeakPolarHBondContact CA-O 3.33Å; M807-I904 HydrophobicContact CG-CB 4.46Å; M807-I904 HydrophobicContact CG-CG1 4.09Å; M807-I904 HydrophobicContact CG-CG2 4.25Å; M807-I904 HydrophobicContact SD-CG1 4.25Å
808	G	92.8	Very high	86.1	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	162.1	168.2	0	0	0	0	0	111.2	Y834 V902 D903	G808-Y834 CarbonylContact C-O 3.58Å; G808-Y834 VanDerWaalsContact CA-O 3.23Å; G808-Y834 WeakPolarHBondContact CA-O 3.28Å; G808-V902 CarbonylContact O-C 3.54Å; G808-V902 WeakPolarHBondContact O-CA 3.44Å; G808-D903 PolarHBondContact N-O 2.72Å; G808-D903 PolarHBondContact O-N 2.95Å
809	A	91.8	Very high	85.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.9	176.5	0	0	0	0	0	111.7	A833 Y834 I836 F895 F899 S901	A809-A833 CarbonylContact O-C 3.53Å; A809-A833 WeakPolarHBondContact O-CA 3.27Å; A809-Y834 PolarHBondContact N-O 2.69Å; A809-Y834 PolarHBondContact O-N 2.68Å; A809-I836 HydrophobicContact CB-CD1 4.08Å; A809-I836 HydrophobicContact CB-CG1 4.13Å; A809-F895 HydrophobicContact CB-CE2 3.77Å; A809-F895 HydrophobicContact CB-CZ 3.77Å; A809-F899 HydrophobicContact CB-CD1 3.63Å; A809-F899 HydrophobicContact CB-CE1 3.99Å; A809-S901 CarbonylContact C-O 3.5Å; A809-S901 VanDerWaalsContact CA-O 3.27Å; A809-S901 WeakPolarHBondContact CA-O 3.32Å
810	S	88.1	Confident	85.3	Confident	21 Å²	21	49.3 Å²	49.3	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.8	174.6	-51.4	0	0	0	0	110.2	F899 D900 S901	S810-F899 CarbonylContact O-C 3.51Å; S810-F899 VanDerWaalsContact O-CA 3.28Å; S810-F899 WeakPolarHBondContact O-CA 3.42Å; S810-F899 VanDerWaalsContact O-CB 3.31Å; S810-F899 WeakPolarHBondContact O-CB 3.34Å; S810-F899 VanDerWaalsContact O-CD1 3.28Å; S810-F899 WeakPolarHBondContact O-CD1 3.44Å; S810-D900 WeakPolarHBondContact CB-OD1 3.32Å; S810-D900 WeakPolarHBondContact CB-OD2 3.22Å; S810-D900 PolarHBondContact O-N 2.99Å; S810-D900 VanDerWaalsContact O-OD2 3.09Å; S810-S901 WeakPolarHBondContact CB-OG 3.49Å; S810-S901 PolarHBondContact N-O 2.88Å; S810-S901 PolarHBondContact OG-OG 2.97Å
811	C	86.9	Confident	84.9	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.3	-179.5	-173.3	0	0	0	0	110.2	G813 P830 R831 H832 Y834 Y898 F899	C811-G813 PolarHBondContact O-N 2.87Å; C811-P830 CarbonylContact O-C 3.59Å; C811-R831 WeakPolarHBondContact O-CA 3.34Å; C811-R831 PolarHBondContact O-N 2.83Å; C811-H832 PolarHBondContact N-O 3.48Å; C811-Y834 HydrophobicContact CB-CD2 3.86Å; C811-Y834 HydrophobicContact CB-CE2 3.64Å; C811-Y898 PolarHBondContact SG-O 3.3Å; C811-F899 HydrophobicContact CB-CD1 3.85Å; C811-F899 HydrophobicContact CB-CE1 3.64Å; C811-F899 HydrophobicContact CB-CG 4.49Å; C811-F899 HydrophobicContact CB-CZ 4.11Å
812	G	72.9	Confident	84.8	Confident	2 Å²	2	51.6 Å²	51.6	2%	0.021	31%	0.313	C	S	.	.	S	Bend	trans	55.7	40.7	173.9	0	0	0	0	0	115.6	V818 R831 Y898	G812-V818 VanDerWaalsContact O-CG2 3.23Å; G812-V818 WeakPolarHBondContact O-CG2 3.37Å; G812-R831 WeakPolarHBondContact O-CG 3.39Å; G812-Y898 PolarHBondContact N-O 2.93Å
813	G	69.8	Low	84.6	Confident	18 Å²	18	44.7 Å²	44.7	19%	0.186	28%	0.28	C	S	.	.			trans	-103.5	-172.9	176.3	0	0	0	0	0	114.9	C811 N815 M816 D900	C811-G813 PolarHBondContact O-N 2.87Å; G813-N815 PolarHBondContact O-N 3.04Å; G813-M816 WeakPolarHBondContact O-CB 3.27Å; G813-M816 VanDerWaalsContact O-CG 3.32Å; G813-M816 WeakPolarHBondContact O-CG 3.23Å; G813-M816 PolarHBondContact O-N 3.09Å; G813-D900 WeakPolarHBondContact CA-OD2 3.31Å; G813-D900 PolarHBondContact N-OD2 3.44Å
814	G	66.3	Low	84.5	Confident	80 Å²	80	46.1 Å²	46.1	83%	0.825	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	-123.9	171	0	0	0	0	0	114.7
815	N	63	Low	84.4	Confident	103 Å²	103	48.2 Å²	48.2	55%	0.551	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	1.1	-179.4	-70.2	-60.5	0	0	0	113.5	S780 G813 K817	S780-N815 VanDerWaalsContact OG-CG 3.23Å; S780-N815 PolarHBondContact OG-ND2 3Å; S780-N815 VanDerWaalsContact OG-ND2 3.14Å; S780-N815 PolarHBondContact OG-OD1 2.75Å; G813-N815 PolarHBondContact O-N 3.04Å; N815-K817 PolarHBondContact O-N 2.62Å
816	M	75.7	Confident	84.2	Confident	33 Å²	33	48.3 Å²	48.3	16%	0.163	29%	0.289	C	S	.	.			trans	-67.6	134.6	-174.1	-62.7	-176.2	81.7	0	0	111.4	Q777 G813 V818 Y823 K897 D900	Q777-M816 HydrophobicContact CG-CG 3.88Å; Q777-M816 HydrophobicContact CG-SD 4.11Å; G813-M816 WeakPolarHBondContact O-CB 3.27Å; G813-M816 VanDerWaalsContact O-CG 3.32Å; G813-M816 WeakPolarHBondContact O-CG 3.23Å; G813-M816 PolarHBondContact O-N 3.09Å; M816-V818 HydrophobicContact CB-CG2 4.46Å; M816-V818 PolarHBondContact O-N 2.62Å; M816-V818 VanDerWaalsContact O-N 3.11Å; M816-Y823 WeakPolarHBondContact CE-OH 3.44Å; M816-K897 WeakPolarHBondContact CE-O 3.31Å; M816-D900 HydrophobicContact CG-CB 4.41Å; M816-D900 HydrophobicContact SD-CB 3.8Å
817	K	76.2	Confident	83.9	Confident	208 Å²	208	48 Å²	48	90%	0.904	29%	0.288	S	S	*	.			trans	-75.3	97.5	166.5	-69.8	-176	179.4	-179.5	0	108.2	N815	N815-K817 PolarHBondContact O-N 2.62Å
818	V	82.2	Confident	83.7	Confident	39 Å²	39	47.7 Å²	47.7	24%	0.236	29%	0.286	C	S	.	.			trans	-85.9	126.4	174.1	-176	0	0	0	0	109.5	G812 M816 D820 Y823 P830	G812-V818 VanDerWaalsContact O-CG2 3.23Å; G812-V818 WeakPolarHBondContact O-CG2 3.37Å; M816-V818 HydrophobicContact CB-CG2 4.46Å; M816-V818 PolarHBondContact O-N 2.62Å; M816-V818 VanDerWaalsContact O-N 3.11Å; V818-D820 WeakPolarHBondContact CG1-OD1 3.36Å; V818-Y823 HydrophobicContact CB-CE2 4.47Å; V818-Y823 HydrophobicContact CG1-CD2 3.89Å; V818-Y823 HydrophobicContact CG1-CE2 3.97Å; V818-Y823 HydrophobicContact CG1-CG 4.28Å; V818-P830 HydrophobicContact CB-CB 4.47Å; V818-P830 HydrophobicContact CG1-CB 3.41Å; V818-P830 VanDerWaalsContact CG1-CB 3.41Å; V818-P830 HydrophobicContact CG1-CG 3.63Å; V818-P830 HydrophobicContact CG2-CB 4.25Å
819	D	86.3	Confident	83.4	Confident	91 Å²	91	50.4 Å²	50.4	49%	0.487	30%	0.296	S	S	.	.			trans	-101.5	113.1	156.7	-178.1	-44.5	0	0	0	106.8	A821 V822 Y823	D819-A821 VanDerWaalsContact C-N 3.27Å; D819-A821 PolarHBondContact O-N 3.37Å; D819-A821 WeakPolarHBondContact OD1-CB 3.4Å; D819-A821 PolarHBondContact OD1-N 2.96Å; D819-V822 HydrophobicContact CB-CB 4.02Å; D819-V822 HydrophobicContact CB-CG2 3.86Å; D819-V822 PolarHBondContact O-N 2.89Å; D819-V822 PolarHBondContact OD1-N 3.22Å; D819-V822 VanDerWaalsContact OD1-N 3.1Å; D819-Y823 VanDerWaalsContact O-CD2 3.29Å; D819-Y823 WeakPolarHBondContact O-CD2 3.39Å; D819-Y823 PolarHBondContact O-N 2.91Å; D819-Y823 VanDerWaalsContact O-N 3.11Å
820	D	86.6	Confident	83.1	Confident	62 Å²	62	50.9 Å²	50.9	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-64.1	-33.4	-173.9	-75.1	-0.7	0	0	0	111.8	V818 Y823 E824 P830 R831	V818-D820 WeakPolarHBondContact CG1-OD1 3.36Å; D820-Y823 PolarHBondContact O-N 3.4Å; D820-E824 WeakPolarHBondContact O-CB 3.25Å; D820-E824 VanDerWaalsContact O-CG 3.25Å; D820-E824 WeakPolarHBondContact O-CG 3.34Å; D820-E824 PolarHBondContact O-N 3.28Å; D820-P830 WeakPolarHBondContact OD1-CG 3.34Å; D820-R831 IonicContact OD1-CZ 2.66Å; D820-R831 VanDerWaalsContact OD1-CZ 3.3Å; D820-R831 IonicContact OD1-NH1 2.95Å; D820-R831 PolarHBondContact OD1-NH1 3.31Å; D820-R831 IonicContact OD1-NH2 2.68Å; D820-R831 PolarHBondContact OD1-NH2 2.99Å; D820-R831 IonicContact OD2-CZ 3.15Å; D820-R831 IonicContact OD2-NH1 2.72Å; D820-R831 IonicContact OD2-NH2 2.83Å; D820-R831 PolarHBondContact OD2-NH2 2.98Å
821	A	89	Confident	82.7	Confident	68 Å²	68	56.7 Å²	56.7	56%	0.562	32%	0.318	S	S	*	.	H	α-helix	trans	-71	-38.4	179	0	0	0	0	0	111.6	D819 E824 S825	D819-A821 VanDerWaalsContact C-N 3.27Å; D819-A821 PolarHBondContact O-N 3.37Å; D819-A821 WeakPolarHBondContact OD1-CB 3.4Å; D819-A821 PolarHBondContact OD1-N 2.96Å; A821-E824 PolarHBondContact O-N 3.15Å; A821-S825 WeakPolarHBondContact O-CB 3.2Å; A821-S825 PolarHBondContact O-N 2.98Å; A821-S825 PolarHBondContact O-OG 2.96Å
822	V	89.4	Confident	82.3	Confident	66 Å²	66	57.2 Å²	57.2	40%	0.4	32%	0.321	S	S	.	.	H	α-helix	trans	-62.3	-46.5	173	175.4	0	0	0	0	110.9	D819 S825 L826	D819-V822 HydrophobicContact CB-CB 4.02Å; D819-V822 HydrophobicContact CB-CG2 3.86Å; D819-V822 PolarHBondContact O-N 2.89Å; D819-V822 PolarHBondContact OD1-N 3.22Å; D819-V822 VanDerWaalsContact OD1-N 3.1Å; V822-S825 PolarHBondContact O-OG 3.18Å; V822-L826 HydrophobicContact CG1-CD1 4.15Å; V822-L826 WeakPolarHBondContact O-CG 3.29Å; V822-L826 PolarHBondContact O-N 2.84Å
823	Y	90.9	Very high	82.7	Confident	10 Å²	10	57.7 Å²	57.7	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-43.8	178.2	-82.8	-117.3	0	0	0	111.5	M816 V818 D819 D820 L826 G827 L828 P830 Y898	M816-Y823 WeakPolarHBondContact CE-OH 3.44Å; V818-Y823 HydrophobicContact CB-CE2 4.47Å; V818-Y823 HydrophobicContact CG1-CD2 3.89Å; V818-Y823 HydrophobicContact CG1-CE2 3.97Å; V818-Y823 HydrophobicContact CG1-CG 4.28Å; D819-Y823 VanDerWaalsContact O-CD2 3.29Å; D819-Y823 WeakPolarHBondContact O-CD2 3.39Å; D819-Y823 PolarHBondContact O-N 2.91Å; D819-Y823 VanDerWaalsContact O-N 3.11Å; D820-Y823 PolarHBondContact O-N 3.4Å; Y823-L826 CarbonylContact O-C 3.25Å; Y823-L826 PolarHBondContact O-N 2.9Å; Y823-G827 PolarHBondContact O-N 2.82Å; Y823-L828 CarbonylContact C-O 3.59Å; Y823-L828 VanDerWaalsContact C-O 3.25Å; Y823-L828 HydrophobicContact CD1-CB 4.04Å; Y823-L828 HydrophobicContact CD1-CD1 4.46Å; Y823-L828 PolarHBondContact O-N 2.88Å; Y823-L828 VanDerWaalsContact O-O 3.08Å; Y823-P830 HydrophobicContact CD1-CB 3.76Å; Y823-P830 HydrophobicContact CD1-CG 4.36Å; Y823-P830 HydrophobicContact CE1-CB 4.16Å; Y823-P830 HydrophobicContact CG-CB 4.12Å; Y823-P830 HydrophobicContact CG-CG 4.3Å; Y823-Y898 HydrophobicContact CE1-CD1 4.05Å; Y823-Y898 HydrophobicContact CE2-CD1 4.04Å; Y823-Y898 AromaticContact CZ-CD1 3.8Å
824	E	89.7	Confident	83.6	Confident	85 Å²	85	56.9 Å²	56.9	40%	0.397	32%	0.315	S	S	.	.	H	α-helix	trans	-65.7	-38.8	-180	-73.8	-176.3	-174.4	0	0	112.9	D820 A821 L826 G827 R829	D820-E824 WeakPolarHBondContact O-CB 3.25Å; D820-E824 VanDerWaalsContact O-CG 3.25Å; D820-E824 WeakPolarHBondContact O-CG 3.34Å; D820-E824 PolarHBondContact O-N 3.28Å; A821-E824 PolarHBondContact O-N 3.15Å; E824-L826 VanDerWaalsContact C-N 3.25Å; E824-L826 PolarHBondContact O-N 2.83Å; E824-G827 PolarHBondContact O-N 3.03Å; E824-R829 IonicContact OE1-CZ 2.71Å; E824-R829 IonicContact OE1-NH1 3.4Å; E824-R829 PolarHBondContact OE1-NH1 3.28Å; E824-R829 IonicContact OE1-NH2 2.99Å; E824-R829 PolarHBondContact OE1-NH2 3.08Å; E824-R829 IonicContact OE2-NH1 3.97Å
825	S	90.5	Very high	84.7	Confident	77 Å²	77	53.1 Å²	53.1	54%	0.538	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-32.9	174	68.6	0	0	0	0	113.2	A821 V822 G827 N860	A821-S825 WeakPolarHBondContact O-CB 3.2Å; A821-S825 PolarHBondContact O-N 2.98Å; A821-S825 PolarHBondContact O-OG 2.96Å; V822-S825 PolarHBondContact O-OG 3.18Å; S825-G827 PolarHBondContact O-N 2.86Å; S825-N860 PolarHBondContact O-ND2 3.14Å
826	L	91.1	Very high	86.1	Confident	34 Å²	34	48.8 Å²	48.8	18%	0.178	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	0.6	174.5	-66.2	168.5	0	0	0	113.2	V822 Y823 E824 L828 W859 N860 Y898	V822-L826 HydrophobicContact CG1-CD1 4.15Å; V822-L826 WeakPolarHBondContact O-CG 3.29Å; V822-L826 PolarHBondContact O-N 2.84Å; Y823-L826 CarbonylContact O-C 3.25Å; Y823-L826 PolarHBondContact O-N 2.9Å; E824-L826 VanDerWaalsContact C-N 3.25Å; E824-L826 PolarHBondContact O-N 2.83Å; L826-L828 VanDerWaalsContact C-N 3.29Å; L826-L828 PolarHBondContact O-N 3.16Å; L826-W859 HydrophobicContact CB-CE3 4.2Å; L826-W859 HydrophobicContact CB-CZ3 3.9Å; L826-W859 HydrophobicContact CD1-CZ3 4.27Å; L826-W859 HydrophobicContact CD2-CH2 4.45Å; L826-W859 HydrophobicContact CD2-CZ3 4.26Å; L826-W859 HydrophobicContact CG-CZ3 4.38Å; L826-W859 WeakPolarHBondContact O-CA 3.37Å; L826-N860 PolarHBondContact O-N 2.8Å; L826-Y898 HydrophobicContact CD1-CD1 4.48Å; L826-Y898 HydrophobicContact CD1-CE1 3.57Å; L826-Y898 HydrophobicContact CD1-CE2 4.14Å; L826-Y898 WeakPolarHBondContact CD1-OH 3.43Å
827	G	88.6	Confident	86.8	Confident	4 Å²	4	49.6 Å²	49.6	4%	0.041	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	14.6	-178.9	0	0	0	0	0	114.6	Y823 E824 S825 F857 S858	Y823-G827 PolarHBondContact O-N 2.82Å; E824-G827 PolarHBondContact O-N 3.03Å; S825-G827 PolarHBondContact O-N 2.86Å; G827-F857 CarbonylContact O-C 3.52Å; G827-F857 WeakPolarHBondContact O-CB 3.49Å; G827-S858 VanDerWaalsContact CA-O 3.31Å; G827-S858 WeakPolarHBondContact CA-O 3.35Å
828	L	90.2	Very high	87.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.223	C	C	.	.			trans	-96	146	175.5	-60.5	-178.1	0	0	0	111.2	Y823 L826 W859 F888 Y898 F899	Y823-L828 CarbonylContact C-O 3.59Å; Y823-L828 VanDerWaalsContact C-O 3.25Å; Y823-L828 HydrophobicContact CD1-CB 4.04Å; Y823-L828 HydrophobicContact CD1-CD1 4.46Å; Y823-L828 PolarHBondContact O-N 2.88Å; Y823-L828 VanDerWaalsContact O-O 3.08Å; L826-L828 VanDerWaalsContact C-N 3.29Å; L826-L828 PolarHBondContact O-N 3.16Å; L828-W859 HydrophobicContact CD1-CE3 3.96Å; L828-W859 HydrophobicContact CD1-CZ3 3.84Å; L828-W859 HydrophobicContact CD2-CE3 4.09Å; L828-W859 HydrophobicContact CG-CE3 3.92Å; L828-W859 HydrophobicContact CG-CZ3 4.25Å; L828-F888 HydrophobicContact CD2-CE2 4.49Å; L828-F888 HydrophobicContact CD2-CZ 4.05Å; L828-Y898 HydrophobicContact CD1-CD1 4.27Å; L828-Y898 HydrophobicContact CD1-CD2 4.28Å; L828-Y898 HydrophobicContact CD1-CG 3.83Å; L828-F899 HydrophobicContact CD1-CE2 4.49Å
829	R	86.4	Confident	88.3	Confident	57 Å²	57	39.2 Å²	39.2	22%	0.215	21%	0.211	C	C	.	.			trans	-105.3	114.8	168.6	-61	-54	-55.5	-173.8	12.9	107.9	E824 H832 Y834 W854 F857	E824-R829 IonicContact OE1-CZ 2.71Å; E824-R829 IonicContact OE1-NH1 3.4Å; E824-R829 PolarHBondContact OE1-NH1 3.28Å; E824-R829 IonicContact OE1-NH2 2.99Å; E824-R829 PolarHBondContact OE1-NH2 3.08Å; E824-R829 IonicContact OE2-NH1 3.97Å; R829-H832 HydrophobicContact CB-CB 4.13Å; R829-H832 WeakPolarHBondContact O-CB 3.49Å; R829-Y834 PolarHBondContact N-OH 2.68Å; R829-W854 HydrophobicContact CG-CE3 4.34Å; R829-W854 HydrophobicContact CG-CZ3 3.96Å; R829-F857 HydrophobicContact CG-CB 4.33Å; R829-F857 HydrophobicContact CG-CD2 3.81Å; R829-F857 HydrophobicContact CG-CE2 4.31Å; R829-F857 HydrophobicContact CG-CG 4.11Å
830	P	85.3	Confident	88.6	Confident	11 Å²	11	38.1 Å²	38.1	7%	0.071	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	162.4	176.1	31.1	-32.8	0	0	0	111.3	C811 V818 D820 Y823 H832	C811-P830 CarbonylContact O-C 3.59Å; V818-P830 HydrophobicContact CB-CB 4.47Å; V818-P830 HydrophobicContact CG1-CB 3.41Å; V818-P830 VanDerWaalsContact CG1-CB 3.41Å; V818-P830 HydrophobicContact CG1-CG 3.63Å; V818-P830 HydrophobicContact CG2-CB 4.25Å; D820-P830 WeakPolarHBondContact OD1-CG 3.34Å; Y823-P830 HydrophobicContact CD1-CB 3.76Å; Y823-P830 HydrophobicContact CD1-CG 4.36Å; Y823-P830 HydrophobicContact CE1-CB 4.16Å; Y823-P830 HydrophobicContact CG-CB 4.12Å; Y823-P830 HydrophobicContact CG-CG 4.3Å; P830-H832 PolarHBondContact O-N 3.02Å
831	R	79.1	Confident	89	Confident	143 Å²	143	39 Å²	39	54%	0.54	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	32.7	-177.6	-55.6	171	-64.1	-85.6	2	112.2	C811 G812 D820	C811-R831 WeakPolarHBondContact O-CA 3.34Å; C811-R831 PolarHBondContact O-N 2.83Å; G812-R831 WeakPolarHBondContact O-CG 3.39Å; D820-R831 IonicContact OD1-CZ 2.66Å; D820-R831 VanDerWaalsContact OD1-CZ 3.3Å; D820-R831 IonicContact OD1-NH1 2.95Å; D820-R831 PolarHBondContact OD1-NH1 3.31Å; D820-R831 IonicContact OD1-NH2 2.68Å; D820-R831 PolarHBondContact OD1-NH2 2.99Å; D820-R831 IonicContact OD2-CZ 3.15Å; D820-R831 IonicContact OD2-NH1 2.72Å; D820-R831 IonicContact OD2-NH2 2.83Å; D820-R831 PolarHBondContact OD2-NH2 2.98Å
832	H	79.9	Confident	89.1	Confident	11 Å²	11	36.3 Å²	36.3	5%	0.051	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	158.3	-176	-174.6	46.8	0	0	0	110.4	C811 R829 P830 Y834 N852 W854	C811-H832 PolarHBondContact N-O 3.48Å; R829-H832 HydrophobicContact CB-CB 4.13Å; R829-H832 WeakPolarHBondContact O-CB 3.49Å; P830-H832 PolarHBondContact O-N 3.02Å; H832-Y834 HydrophobicContact CB-CE2 4.4Å; H832-Y834 AromaticContact CD2-CE2 3.8Å; H832-N852 PolarHBondContact NE2-OD1 3.17Å; H832-W854 AromaticContact CE1-CE2 3.64Å; H832-W854 AromaticContact CE1-CZ2 3.96Å; H832-W854 AromaticContact CE1-NE1 3.65Å; H832-W854 AromaticContact NE2-CD2 3.95Å; H832-W854 AromaticContact NE2-CE2 3.95Å
833	A	81.4	Confident	89	Confident	11 Å²	11	39.4 Å²	39.4	9%	0.091	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.7	-175	0	0	0	0	0	112.1	S671 A759 A809 P853	S671-A833 PolarHBondContact OG-O 2.7Å; A759-A833 HydrophobicContact CB-CB 4.31Å; A809-A833 CarbonylContact O-C 3.53Å; A809-A833 WeakPolarHBondContact O-CA 3.27Å; A833-P853 WeakPolarHBondContact O-CD 3.48Å; A833-P853 WeakPolarHBondContact O-CG 3.25Å
834	Y	87.3	Confident	88.9	Confident	1 Å²	1	42 Å²	42	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	155.9	-174.6	-72.5	-108.6	0	0	0	110.1	G808 A809 C811 R829 H832 R851 N852 F888 F899	G808-Y834 CarbonylContact C-O 3.58Å; G808-Y834 VanDerWaalsContact CA-O 3.23Å; G808-Y834 WeakPolarHBondContact CA-O 3.28Å; A809-Y834 PolarHBondContact N-O 2.69Å; A809-Y834 PolarHBondContact O-N 2.68Å; C811-Y834 HydrophobicContact CB-CD2 3.86Å; C811-Y834 HydrophobicContact CB-CE2 3.64Å; R829-Y834 PolarHBondContact N-OH 2.68Å; H832-Y834 HydrophobicContact CB-CE2 4.4Å; H832-Y834 AromaticContact CD2-CE2 3.8Å; Y834-R851 CarbonylContact C-O 3.46Å; Y834-R851 WeakPolarHBondContact CA-O 3.2Å; Y834-N852 HydrophobicContact CD1-CB 4.11Å; Y834-N852 HydrophobicContact CE1-CB 3.66Å; Y834-F888 HydrophobicContact CD1-CE1 4.29Å; Y834-F888 HydrophobicContact CD1-CZ 4Å; Y834-F888 AromaticContact CE1-CE1 3.97Å; Y834-F888 HydrophobicContact CE1-CE1 3.97Å; Y834-F888 AromaticContact CE1-CZ 3.82Å; Y834-F888 HydrophobicContact CE1-CZ 3.82Å; Y834-F899 AromaticContact CD2-CE1 3.83Å; Y834-F899 HydrophobicContact CD2-CE1 3.83Å; Y834-F899 HydrophobicContact CD2-CZ 4.31Å; Y834-F899 HydrophobicContact CE2-CE1 4.49Å; Y834-F899 AromaticContact CG-CE1 3.98Å; Y834-F899 HydrophobicContact CG-CE1 3.98Å; Y834-F899 HydrophobicContact CG-CZ 4.32Å
835	S	89.2	Confident	89	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.007	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	139.1	169.2	-48.7	0	0	0	0	109.9	V675 L850 R851	V675-S835 VanDerWaalsContact CG2-OG 3.25Å; V675-S835 WeakPolarHBondContact CG2-OG 3.31Å; S835-L850 CarbonylContact O-C 3.56Å; S835-L850 WeakPolarHBondContact O-CA 3.47Å; S835-R851 PolarHBondContact N-O 2.73Å; S835-R851 PolarHBondContact O-N 2.93Å
836	I	93.4	Very high	89.3	Confident	12 Å²	12	42.8 Å²	42.8	6%	0.062	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	117	168.1	-56.8	178.7	0	0	0	107.2	M797 M807 A809 V839 L850 F895 V902	M797-I836 HydrophobicContact CE-CD1 3.54Å; M807-I836 HydrophobicContact CB-CB 3.92Å; M807-I836 HydrophobicContact CB-CD1 4.34Å; M807-I836 HydrophobicContact CB-CG1 4.48Å; M807-I836 HydrophobicContact CE-CG2 4.27Å; M807-I836 PolarHBondContact O-N 3.34Å; A809-I836 HydrophobicContact CB-CD1 4.08Å; A809-I836 HydrophobicContact CB-CG1 4.13Å; I836-V839 HydrophobicContact CG2-CG2 3.96Å; I836-L850 HydrophobicContact CG1-CG 4.5Å; I836-F895 HydrophobicContact CD1-CZ 4.25Å; I836-V902 HydrophobicContact CD1-CG1 3.97Å; I836-V902 HydrophobicContact CD1-CG2 4.1Å
837	L	90.8	Very high	89.5	Confident	51 Å²	51	41.1 Å²	41.1	27%	0.267	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-33.7	-175.5	-51	-169.4	0	0	0	112.3	E678 R849 R851 V887	E678-L837 VanDerWaalsContact CD-CD2 3.47Å; E678-L837 HydrophobicContact CG-CD2 3.6Å; E678-L837 VanDerWaalsContact OE1-CD2 3.26Å; E678-L837 WeakPolarHBondContact OE1-CD2 3.47Å; L837-R849 HydrophobicContact CB-CB 4.34Å; L837-R849 HydrophobicContact CB-CG 4.32Å; L837-R849 PolarHBondContact N-O 2.97Å; L837-R851 HydrophobicContact CD1-CB 4.11Å; L837-R851 HydrophobicContact CD2-CB 4.26Å; L837-R851 HydrophobicContact CG-CB 4.26Å; L837-V887 HydrophobicContact CD1-CG1 3.92Å; L837-V887 HydrophobicContact CD1-CG2 4.32Å
838	D	92.3	Very high	89.9	Confident	29 Å²	29	41 Å²	41	16%	0.155	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	151.9	-179.1	-155.7	-7.4	0	0	0	111.5	K801 R840 R849 W889	K801-D838 WeakPolarHBondContact CE-OD1 3.44Å; K801-D838 IonicContact NZ-OD1 3.45Å; K801-D838 PolarHBondContact NZ-OD1 2.95Å; K801-D838 IonicContact NZ-OD2 2.72Å; D838-R840 WeakPolarHBondContact OD1-CG 3.48Å; D838-R840 VanDerWaalsContact OD2-CD 3.31Å; D838-R840 WeakPolarHBondContact OD2-CD 3.39Å; D838-R840 WeakPolarHBondContact OD2-CG 3.5Å; D838-R849 HydrophobicContact CB-CB 3.79Å; D838-R849 PolarHBondContact N-O 3.32Å; D838-R849 PolarHBondContact O-N 3.12Å; D838-W889 HydrophobicContact CB-CH2 3.94Å; D838-W889 HydrophobicContact CB-CZ3 4.42Å
839	V	96	Very high	90.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	117.2	176.2	-174.9	0	0	0	0	106.2	W794 M797 L798 K801 M807 I836 L848	W794-V839 HydrophobicContact CE3-CG1 4.15Å; W794-V839 HydrophobicContact CH2-CG1 3.64Å; W794-V839 HydrophobicContact CZ2-CG1 4.17Å; W794-V839 HydrophobicContact CZ3-CG1 3.65Å; M797-V839 HydrophobicContact CB-CG1 4.15Å; M797-V839 HydrophobicContact CB-CG2 4.21Å; L798-V839 HydrophobicContact CB-CG1 4.14Å; L798-V839 HydrophobicContact CD1-CG1 4.21Å; L798-V839 WeakPolarHBondContact CD1-O 3.17Å; K801-V839 HydrophobicContact CB-CB 4.11Å; K801-V839 HydrophobicContact CB-CG2 4.12Å; K801-V839 HydrophobicContact CG-CB 4.36Å; M807-V839 HydrophobicContact CE-CG2 3.68Å; I836-V839 HydrophobicContact CG2-CG2 3.96Å; V839-L848 HydrophobicContact CB-CD2 4.11Å; V839-L848 HydrophobicContact CG1-CD2 3.85Å; V839-L848 HydrophobicContact CG2-CD2 3.72Å
840	R	94.6	Very high	90.3	Very high	67 Å²	67	41.5 Å²	41.5	25%	0.253	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	133	-175.8	-58.5	-163.4	63.7	-176.8	-8.9	112.4	W794 D838 V842 L847 E877 L878 W889	W794-R840 WeakPolarHBondContact CH2-O 3.32Å; W794-R840 WeakPolarHBondContact CZ2-O 3.36Å; D838-R840 WeakPolarHBondContact OD1-CG 3.48Å; D838-R840 VanDerWaalsContact OD2-CD 3.31Å; D838-R840 WeakPolarHBondContact OD2-CD 3.39Å; D838-R840 WeakPolarHBondContact OD2-CG 3.5Å; R840-V842 HydrophobicContact CB-CG2 3.65Å; R840-L847 PolarHBondContact N-O 3.13Å; R840-L847 PolarHBondContact O-N 3.41Å; R840-E877 IonicContact CZ-OE1 2.78Å; R840-E877 IonicContact NH1-OE1 3.84Å; R840-E877 PolarHBondContact NH1-OE1 2.95Å; R840-E877 IonicContact NH2-OE1 2.67Å; R840-E877 PolarHBondContact NH2-OE1 3.39Å; R840-L878 VanDerWaalsContact NH1-CD2 3.25Å; R840-W889 HydrophobicContact CG-CH2 4.09Å; R840-W889 HydrophobicContact CG-CZ3 4.34Å
841	D	93.9	Very high	90.4	Very high	81 Å²	81	42.3 Å²	42.3	43%	0.433	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.9	163.3	-158.4	-56.2	0	0	0	107.1	W794 Y845 R846	W794-D841 HydrophobicContact CZ2-CB 4.1Å; W794-D841 PolarHBondContact NE1-OD2 3.28Å; D841-Y845 WeakPolarHBondContact CA-O 3.44Å; D841-R846 IonicContact OD2-NE 2.77Å
842	V	91.6	Very high	90.6	Very high	12 Å²	12	35.5 Å²	35.5	7%	0.073	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	114.6	-172.6	-166.1	0	0	0	0	109.8	R840 G844 Y845 L874	R840-V842 HydrophobicContact CB-CG2 3.65Å; V842-G844 PolarHBondContact O-N 2.97Å; V842-G844 VanDerWaalsContact O-N 3.09Å; V842-Y845 PolarHBondContact N-O 3.36Å; V842-Y845 WeakPolarHBondContact O-CB 3.47Å; V842-Y845 PolarHBondContact O-N 2.89Å; V842-L874 HydrophobicContact CG1-CD2 3.58Å
843	Q	87.8	Confident	90.1	Very high	131 Å²	131	35.2 Å²	35.2	61%	0.612	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	26.2	179.3	-59.3	179.8	-1.4	0	0	114.2	Y845 H873	Q843-Y845 HydrophobicContact CB-CD2 4.49Å; Q843-H873 PolarHBondContact NE2-CD2 3.45Å; Q843-H873 PolarHBondContact NE2-NE2 3.44Å; Q843-H873 PolarHBondContact OE1-NE2 3.17Å
844	G	87.2	Confident	89.7	Confident	65 Å²	65	37.9 Å²	37.9	67%	0.67	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.7	-11.5	-176.3	0	0	0	0	0	114.5	V842	V842-G844 PolarHBondContact O-N 2.97Å; V842-G844 VanDerWaalsContact O-N 3.09Å
845	Y	93.1	Very high	88.7	Confident	100 Å²	100	38.8 Å²	38.8	39%	0.392	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	129.2	173	-58	-73.4	0	0	0	110.9	D841 V842 Q843 W863 L874	D841-Y845 WeakPolarHBondContact CA-O 3.44Å; V842-Y845 PolarHBondContact N-O 3.36Å; V842-Y845 WeakPolarHBondContact O-CB 3.47Å; V842-Y845 PolarHBondContact O-N 2.89Å; Q843-Y845 HydrophobicContact CB-CD2 4.49Å; Y845-W863 HydrophobicContact CD1-CH2 4.33Å; Y845-W863 AromaticContact CD1-CZ2 3.6Å; Y845-W863 HydrophobicContact CD1-CZ2 3.6Å; Y845-W863 HydrophobicContact CD2-CH2 4.01Å; Y845-W863 HydrophobicContact CD2-CZ2 4.11Å; Y845-W863 AromaticContact CE1-CZ2 3.95Å; Y845-W863 HydrophobicContact CE1-CZ2 3.95Å; Y845-W863 HydrophobicContact CE2-CH2 4.31Å; Y845-W863 HydrophobicContact CE2-CZ2 4.43Å; Y845-W863 HydrophobicContact CG-CH2 4.02Å; Y845-W863 AromaticContact CG-CZ2 3.68Å; Y845-W863 HydrophobicContact CG-CZ2 3.68Å; Y845-L874 HydrophobicContact CD2-CD1 4.14Å; Y845-L874 HydrophobicContact CE2-CD1 4.44Å
846	R	96.3	Very high	87.9	Confident	77 Å²	77	45.7 Å²	45.7	29%	0.291	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	100.8	174.4	-68.3	-175.2	178.1	176.5	5.1	109.4	D791 W794 D841 Y892	D791-R846 IonicContact OD1-CZ 2.72Å; D791-R846 IonicContact OD1-NH1 2.89Å; D791-R846 PolarHBondContact OD1-NH1 2.67Å; D791-R846 IonicContact OD1-NH2 2.83Å; D791-R846 PolarHBondContact OD1-NH2 3.35Å; W794-R846 HydrophobicContact CD2-CB 4.25Å; W794-R846 HydrophobicContact CD2-CG 4.17Å; W794-R846 HydrophobicContact CE3-CB 4.27Å; W794-R846 HydrophobicContact CH2-CB 3.62Å; W794-R846 HydrophobicContact CH2-CG 4.21Å; W794-R846 HydrophobicContact CZ2-CB 3.56Å; W794-R846 HydrophobicContact CZ2-CG 3.62Å; W794-R846 HydrophobicContact CZ3-CB 3.96Å; D841-R846 IonicContact OD2-NE 2.77Å; R846-Y892 WeakPolarHBondContact O-CB 3.23Å; R846-Y892 PolarHBondContact O-N 2.66Å
847	L	96.2	Very high	87.1	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137.8	-171	-56.5	-179.8	0	0	0	111.6	R840 W863 L878 W889 E891	R840-L847 PolarHBondContact N-O 3.13Å; R840-L847 PolarHBondContact O-N 3.41Å; L847-W863 HydrophobicContact CD1-CD2 4.08Å; L847-W863 HydrophobicContact CD1-CE3 3.82Å; L847-W863 HydrophobicContact CD1-CH2 4.08Å; L847-W863 HydrophobicContact CD1-CZ2 4.32Å; L847-W863 HydrophobicContact CD1-CZ3 3.82Å; L847-W863 HydrophobicContact CD2-CD2 3.69Å; L847-W863 HydrophobicContact CD2-CE3 4.31Å; L847-W863 HydrophobicContact CD2-CG 3.88Å; L847-W863 HydrophobicContact CD2-CZ2 4.08Å; L847-L878 HydrophobicContact CD1-CD1 3.59Å; L847-W889 HydrophobicContact CB-CE3 3.85Å; L847-W889 HydrophobicContact CB-CZ3 4.08Å; L847-E891 HydrophobicContact CD2-CB 4.48Å; L847-E891 HydrophobicContact CD2-CG 4.47Å
848	L	96.1	Very high	86.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137	173.8	-66	175.4	0	0	0	109.4	W794 M797 V839 L850 W889 M890 Y892 F895	W794-L848 HydrophobicContact CZ3-CD2 3.77Å; W794-L848 HydrophobicContact CZ3-CG 4.12Å; M797-L848 HydrophobicContact CE-CD1 3.86Å; M797-L848 HydrophobicContact CE-CD2 3.66Å; M797-L848 HydrophobicContact CE-CG 4.45Å; V839-L848 HydrophobicContact CB-CD2 4.11Å; V839-L848 HydrophobicContact CG1-CD2 3.85Å; V839-L848 HydrophobicContact CG2-CD2 3.72Å; L848-L850 HydrophobicContact CB-CD1 3.6Å; L848-W889 VanDerWaalsContact C-CE3 3.48Å; L848-W889 CarbonylContact O-C 3.59Å; L848-W889 WeakPolarHBondContact O-CA 3.39Å; L848-M890 HydrophobicContact CB-CG 4.46Å; L848-M890 PolarHBondContact N-O 2.78Å; L848-M890 PolarHBondContact O-N 2.93Å; L848-Y892 HydrophobicContact CD1-CD2 4.05Å; L848-F895 HydrophobicContact CD1-CB 3.64Å; L848-F895 HydrophobicContact CD1-CD1 3.45Å; L848-F895 VanDerWaalsContact CD1-CD1 3.45Å; L848-F895 HydrophobicContact CD1-CD2 3.69Å; L848-F895 HydrophobicContact CD1-CE1 4Å; L848-F895 HydrophobicContact CD1-CE2 4.23Å; L848-F895 HydrophobicContact CD1-CG 3.27Å; L848-F895 HydrophobicContact CD1-CZ 4.37Å
849	R	93.5	Very high	86.7	Confident	69 Å²	69	47 Å²	47	26%	0.26	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	120.3	169	-164.8	-178.5	-174.5	-172.4	2.7	108.9	L837 D838 V887 F888 W889	L837-R849 HydrophobicContact CB-CB 4.34Å; L837-R849 HydrophobicContact CB-CG 4.32Å; L837-R849 PolarHBondContact N-O 2.97Å; D838-R849 HydrophobicContact CB-CB 3.79Å; D838-R849 PolarHBondContact N-O 3.32Å; D838-R849 PolarHBondContact O-N 3.12Å; R849-V887 HydrophobicContact CG-CG1 4.17Å; R849-F888 CarbonylContact C-O 3.56Å; R849-F888 WeakPolarHBondContact CA-O 3.32Å; R849-W889 HydrophobicContact CB-CD2 3.84Å; R849-W889 HydrophobicContact CB-CE3 3.73Å; R849-W889 HydrophobicContact CB-CH2 3.83Å; R849-W889 HydrophobicContact CB-CZ2 3.95Å; R849-W889 HydrophobicContact CB-CZ3 3.73Å; R849-W889 HydrophobicContact CG-CD2 4.05Å; R849-W889 HydrophobicContact CG-CE3 4.45Å; R849-W889 HydrophobicContact CG-CG 4.48Å; R849-W889 HydrophobicContact CG-CZ2 4.13Å
850	L	91.9	Very high	86.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	164.9	-178.5	-65.9	91.3	0	0	0	111.8	S835 I836 L848 V887 F888 M890 F895 F899	S835-L850 CarbonylContact O-C 3.56Å; S835-L850 WeakPolarHBondContact O-CA 3.47Å; I836-L850 HydrophobicContact CG1-CG 4.5Å; L848-L850 HydrophobicContact CB-CD1 3.6Å; L850-V887 WeakPolarHBondContact O-CA 3.39Å; L850-F888 HydrophobicContact CB-CD2 4.33Å; L850-F888 HydrophobicContact CB-CE2 3.79Å; L850-F888 HydrophobicContact CB-CZ 3.96Å; L850-F888 HydrophobicContact CD1-CE2 4.27Å; L850-F888 HydrophobicContact CG-CE2 4.48Å; L850-F888 PolarHBondContact N-O 3.43Å; L850-F888 PolarHBondContact O-N 2.94Å; L850-M890 HydrophobicContact CD1-CG 3.64Å; L850-M890 HydrophobicContact CD1-SD 3.63Å; L850-M890 HydrophobicContact CD2-SD 4.35Å; L850-F895 HydrophobicContact CD2-CD2 4.06Å; L850-F895 HydrophobicContact CD2-CE2 3.86Å; L850-F899 HydrophobicContact CD2-CE1 3.86Å; L850-F899 HydrophobicContact CD2-CE2 4.27Å; L850-F899 HydrophobicContact CD2-CZ 3.63Å
851	R	86.6	Confident	86.2	Confident	28 Å²	28	49.3 Å²	49.3	11%	0.106	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	131.8	171.5	-173.4	177.3	-158.5	157.1	11.9	112.7	E678 Y834 S835 L837 P853 G886 V887	E678-R851 VanDerWaalsContact CD-NH1 3.32Å; E678-R851 WeakPolarHBondContact OE1-CD 3.24Å; E678-R851 IonicContact OE1-CZ 3.98Å; E678-R851 IonicContact OE1-NE 2.61Å; E678-R851 IonicContact OE1-NH1 3.76Å; E678-R851 PolarHBondContact OE1-NH1 2.82Å; E678-R851 IonicContact OE2-NH1 3.39Å; E678-R851 PolarHBondContact OE2-NH1 3.14Å; E678-R851 VanDerWaalsContact OE2-NH1 3.1Å; Y834-R851 CarbonylContact C-O 3.46Å; Y834-R851 WeakPolarHBondContact CA-O 3.2Å; S835-R851 PolarHBondContact N-O 2.73Å; S835-R851 PolarHBondContact O-N 2.93Å; L837-R851 HydrophobicContact CD1-CB 4.11Å; L837-R851 HydrophobicContact CD2-CB 4.26Å; L837-R851 HydrophobicContact CG-CB 4.26Å; R851-P853 WeakPolarHBondContact O-CD 3.34Å; R851-G886 CarbonylContact C-O 3.44Å; R851-G886 VanDerWaalsContact CA-O 3.27Å; R851-G886 WeakPolarHBondContact CA-O 3.23Å; R851-V887 HydrophobicContact CB-CG2 4.12Å; R851-V887 HydrophobicContact CG-CG2 3.74Å
852	N	84.2	Confident	86.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.242	C	C	.	.			trans	-78.2	119.4	162.8	-169.8	-21	0	0	0	109.9	H832 Y834 W854 G855 R856 G886	H832-N852 PolarHBondContact NE2-OD1 3.17Å; Y834-N852 HydrophobicContact CD1-CB 4.11Å; Y834-N852 HydrophobicContact CE1-CB 3.66Å; N852-W854 PolarHBondContact O-N 3.18Å; N852-W854 PolarHBondContact OD1-N 2.83Å; N852-W854 VanDerWaalsContact OD1-N 3.13Å; N852-G855 PolarHBondContact O-N 2.63Å; N852-G855 VanDerWaalsContact O-N 3.09Å; N852-R856 PolarHBondContact ND2-O 3Å; N852-G886 PolarHBondContact N-O 2.88Å
853	P	69.4	Low	86.2	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.026	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-27.9	177.6	-30.8	37.9	0	0	0	114.9	A674 A833 R851 G855	A674-P853 HydrophobicContact CB-CB 3.7Å; A674-P853 HydrophobicContact CB-CG 3.84Å; A833-P853 WeakPolarHBondContact O-CD 3.48Å; A833-P853 WeakPolarHBondContact O-CG 3.25Å; R851-P853 WeakPolarHBondContact O-CD 3.34Å; P853-G855 PolarHBondContact O-N 2.78Å
854	W	72	Confident	86.3	Confident	68 Å²	68	41.3 Å²	41.3	26%	0.258	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-7.9	-179	-64.8	-14.5	0	0	0	114.6	R829 H832 N852 R856 F857	R829-W854 HydrophobicContact CG-CE3 4.34Å; R829-W854 HydrophobicContact CG-CZ3 3.96Å; H832-W854 AromaticContact CE1-CE2 3.64Å; H832-W854 AromaticContact CE1-CZ2 3.96Å; H832-W854 AromaticContact CE1-NE1 3.65Å; H832-W854 AromaticContact NE2-CD2 3.95Å; H832-W854 AromaticContact NE2-CE2 3.95Å; N852-W854 PolarHBondContact O-N 3.18Å; N852-W854 PolarHBondContact OD1-N 2.83Å; N852-W854 VanDerWaalsContact OD1-N 3.13Å; W854-R856 VanDerWaalsContact C-N 3.32Å; W854-R856 HydrophobicContact CB-CG 4.03Å; W854-R856 PolarHBondContact O-N 2.95Å; W854-F857 HydrophobicContact CE3-CD2 4.32Å; W854-F857 HydrophobicContact CE3-CE2 4.19Å; W854-F857 HydrophobicContact CZ3-CE2 4.43Å
855	G	67.6	Low	86.2	Confident	20 Å²	20	39.5 Å²	39.5	21%	0.206	19%	0.187	C	C	.	.	S	Bend	trans	63.2	35.6	-179.6	0	0	0	0	0	113.6	N852 P853	N852-G855 PolarHBondContact O-N 2.63Å; N852-G855 VanDerWaalsContact O-N 3.09Å; P853-G855 PolarHBondContact O-N 2.78Å
856	R	71.6	Confident	85.9	Confident	145 Å²	145	43.4 Å²	43.4	55%	0.547	21%	0.209	S	C	.	.			trans	-165.4	163.1	177.7	52.9	179	169.4	178.9	-1.6	109	N852 W854	N852-R856 PolarHBondContact ND2-O 3Å; W854-R856 VanDerWaalsContact C-N 3.32Å; W854-R856 HydrophobicContact CB-CG 4.03Å; W854-R856 PolarHBondContact O-N 2.95Å
857	F	75.9	Confident	85.6	Confident	83 Å²	83	42.3 Å²	42.3	36%	0.364	21%	0.205	S	C	.	.			trans	60.4	91.4	-167.7	-44.4	-80.1	0	0	0	111.2	G827 R829 W854	G827-F857 CarbonylContact O-C 3.52Å; G827-F857 WeakPolarHBondContact O-CB 3.49Å; R829-F857 HydrophobicContact CG-CB 4.33Å; R829-F857 HydrophobicContact CG-CD2 3.81Å; R829-F857 HydrophobicContact CG-CE2 4.31Å; R829-F857 HydrophobicContact CG-CG 4.11Å; W854-F857 HydrophobicContact CE3-CD2 4.32Å; W854-F857 HydrophobicContact CE3-CE2 4.19Å; W854-F857 HydrophobicContact CZ3-CE2 4.43Å
858	S	84	Confident	85.2	Confident	32 Å²	32	47.6 Å²	47.6	22%	0.224	24%	0.239	C	C	.	.			trans	-98.3	154.1	168.3	-68.6	0	0	0	0	109.6	G827 N860 G886	G827-S858 VanDerWaalsContact CA-O 3.31Å; G827-S858 WeakPolarHBondContact CA-O 3.35Å; S858-N860 PolarHBondContact O-OD1 3.12Å; S858-G886 WeakPolarHBondContact OG-CA 3.49Å
859	W	90.9	Very high	84.9	Confident	5 Å²	5	52.8 Å²	52.8	2%	0.019	27%	0.267	C	S	.	.			trans	-57.6	138	175	170.1	-113.6	0	0	0	112.3	L826 L828 G861 S862 S864 F888 W889 M890 D894 Y898	L826-W859 HydrophobicContact CB-CE3 4.2Å; L826-W859 HydrophobicContact CB-CZ3 3.9Å; L826-W859 HydrophobicContact CD1-CZ3 4.27Å; L826-W859 HydrophobicContact CD2-CH2 4.45Å; L826-W859 HydrophobicContact CD2-CZ3 4.26Å; L826-W859 HydrophobicContact CG-CZ3 4.38Å; L826-W859 WeakPolarHBondContact O-CA 3.37Å; L828-W859 HydrophobicContact CD1-CE3 3.96Å; L828-W859 HydrophobicContact CD1-CZ3 3.84Å; L828-W859 HydrophobicContact CD2-CE3 4.09Å; L828-W859 HydrophobicContact CG-CE3 3.92Å; L828-W859 HydrophobicContact CG-CZ3 4.25Å; W859-G861 VanDerWaalsContact CE2-CA 3.49Å; W859-S862 PolarHBondContact NE1-O 2.87Å; W859-S864 WeakPolarHBondContact O-CB 3.19Å; W859-F888 HydrophobicContact CB-CB 4.08Å; W859-F888 HydrophobicContact CB-CD1 4.17Å; W859-F888 HydrophobicContact CB-CD2 3.29Å; W859-F888 HydrophobicContact CB-CE1 4.42Å; W859-F888 HydrophobicContact CB-CE2 3.6Å; W859-F888 HydrophobicContact CB-CG 3.59Å; W859-F888 HydrophobicContact CB-CZ 4.16Å; W859-F888 HydrophobicContact CG-CD2 4.14Å; W859-F888 HydrophobicContact CG-CE2 4.43Å; W859-W889 VanDerWaalsContact CD1-O 3.28Å; W859-M890 HydrophobicContact CD2-CE 4.5Å; W859-M890 HydrophobicContact CE3-CE 4.47Å; W859-M890 HydrophobicContact CG-CB 4.42Å; W859-M890 HydrophobicContact CH2-CE 4.36Å; W859-M890 HydrophobicContact CZ2-CE 4.38Å; W859-M890 HydrophobicContact CZ3-CE 4.4Å; W859-D894 HydrophobicContact CH2-CB 3.95Å; W859-D894 HydrophobicContact CZ2-CB 3.95Å; W859-Y898 HydrophobicContact CH2-CD2 4.05Å; W859-Y898 AromaticContact CH2-CE2 3.75Å; W859-Y898 HydrophobicContact CH2-CE2 3.75Å; W859-Y898 HydrophobicContact CZ3-CD2 4.07Å; W859-Y898 HydrophobicContact CZ3-CE2 4.03Å
860	N	90.3	Very high	84.7	Confident	98 Å²	98	50.3 Å²	50.3	52%	0.524	26%	0.257	S	S	.	.			trans	-107.2	1.2	-178.4	-64.8	-21.6	0	0	0	114.1	S825 L826 S858	S825-N860 PolarHBondContact O-ND2 3.14Å; L826-N860 PolarHBondContact O-N 2.8Å; S858-N860 PolarHBondContact O-OD1 3.12Å
861	G	90.6	Very high	84.7	Confident	17 Å²	17	51.9 Å²	51.9	18%	0.175	27%	0.268	C	S	.	.	S	Bend	trans	-89.6	-157.2	-177	0	0	0	0	0	114.1	W859 S864	W859-G861 VanDerWaalsContact CE2-CA 3.49Å; G861-S864 WeakPolarHBondContact O-CB 3.43Å; G861-S864 PolarHBondContact O-N 3.06Å; G861-S864 PolarHBondContact O-OG 2.9Å
862	S	91.6	Very high	84.7	Confident	47 Å²	47	56.3 Å²	56.3	33%	0.329	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	137.9	173.8	-50.3	0	0	0	0	111.2	W859 S864	W859-S862 PolarHBondContact NE1-O 2.87Å; S862-S864 PolarHBondContact O-N 3.39Å
863	W	92.6	Very high	84.9	Confident	3 Å²	3	61 Å²	61	1%	0.011	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	9.8	-172.3	-47.3	92.6	0	0	0	116	Y845 L847 W867 W870 P871 L874 W889	Y845-W863 HydrophobicContact CD1-CH2 4.33Å; Y845-W863 AromaticContact CD1-CZ2 3.6Å; Y845-W863 HydrophobicContact CD1-CZ2 3.6Å; Y845-W863 HydrophobicContact CD2-CH2 4.01Å; Y845-W863 HydrophobicContact CD2-CZ2 4.11Å; Y845-W863 AromaticContact CE1-CZ2 3.95Å; Y845-W863 HydrophobicContact CE1-CZ2 3.95Å; Y845-W863 HydrophobicContact CE2-CH2 4.31Å; Y845-W863 HydrophobicContact CE2-CZ2 4.43Å; Y845-W863 HydrophobicContact CG-CH2 4.02Å; Y845-W863 AromaticContact CG-CZ2 3.68Å; Y845-W863 HydrophobicContact CG-CZ2 3.68Å; L847-W863 HydrophobicContact CD1-CD2 4.08Å; L847-W863 HydrophobicContact CD1-CE3 3.82Å; L847-W863 HydrophobicContact CD1-CH2 4.08Å; L847-W863 HydrophobicContact CD1-CZ2 4.32Å; L847-W863 HydrophobicContact CD1-CZ3 3.82Å; L847-W863 HydrophobicContact CD2-CD2 3.69Å; L847-W863 HydrophobicContact CD2-CE3 4.31Å; L847-W863 HydrophobicContact CD2-CG 3.88Å; L847-W863 HydrophobicContact CD2-CZ2 4.08Å; W863-W867 HydrophobicContact CD2-CE3 4.3Å; W863-W867 HydrophobicContact CD2-CH2 4.41Å; W863-W867 AromaticContact CD2-CZ3 3.65Å; W863-W867 HydrophobicContact CD2-CZ3 3.65Å; W863-W867 AromaticContact CE2-CZ3 3.78Å; W863-W867 HydrophobicContact CE3-CE3 4.49Å; W863-W867 AromaticContact CE3-CZ3 3.92Å; W863-W867 HydrophobicContact CE3-CZ3 3.92Å; W863-W867 HydrophobicContact CG-CE3 4.36Å; W863-W867 HydrophobicContact CG-CZ3 4.03Å; W863-W867 HydrophobicContact CH2-CZ3 4.43Å; W863-W867 HydrophobicContact CZ2-CH2 4.4Å; W863-W867 HydrophobicContact CZ2-CZ3 4.18Å; W863-W867 HydrophobicContact CZ3-CZ3 4.31Å; W863-W870 HydrophobicContact CB-CZ2 4.25Å; W863-W870 HydrophobicContact CE3-CD2 4.04Å; W863-W870 AromaticContact CE3-CE3 3.79Å; W863-W870 HydrophobicContact CE3-CE3 3.79Å; W863-W870 AromaticContact CE3-CH2 3.8Å; W863-W870 HydrophobicContact CE3-CH2 3.8Å; W863-W870 HydrophobicContact CE3-CZ2 4.03Å; W863-W870 AromaticContact CE3-CZ3 3.67Å; W863-W870 HydrophobicContact CE3-CZ3 3.67Å; W863-W870 HydrophobicContact CZ3-CD2 4.41Å; W863-W870 AromaticContact CZ3-CE3 3.82Å; W863-W870 HydrophobicContact CZ3-CE3 3.82Å; W863-W870 HydrophobicContact CZ3-CH2 4.4Å; W863-W870 AromaticContact CZ3-CZ3 3.83Å; W863-W870 HydrophobicContact CZ3-CZ3 3.83Å; W863-W870 WeakPolarHBondContact O-CZ2 3.37Å; W863-P871 HydrophobicContact CH2-CG 4.2Å; W863-L874 HydrophobicContact CH2-CD1 3.84Å; W863-L874 HydrophobicContact CZ3-CB 4.47Å; W863-L874 HydrophobicContact CZ3-CD1 4.04Å; W863-W889 CarbonylContact C-O 3.49Å; W863-W889 HydrophobicContact CB-CB 4.14Å; W863-W889 VanDerWaalsContact O-O 3.13Å
864	S	90.8	Very high	85.9	Confident	7 Å²	7	60.9 Å²	60.9	5%	0.049	31%	0.31	C	S	.	.			trans	-61.5	160	165	60.7	0	0	0	0	112.2	W859 G861 S862 E866 W867 W870	W859-S864 WeakPolarHBondContact O-CB 3.19Å; G861-S864 WeakPolarHBondContact O-CB 3.43Å; G861-S864 PolarHBondContact O-N 3.06Å; G861-S864 PolarHBondContact O-OG 2.9Å; S862-S864 PolarHBondContact O-N 3.39Å; S864-E866 PolarHBondContact O-N 3.4Å; S864-E866 VanDerWaalsContact O-N 3.14Å; S864-W867 WeakPolarHBondContact O-CB 3.47Å; S864-W867 PolarHBondContact O-N 3.33Å; S864-W867 VanDerWaalsContact O-N 3.16Å; S864-W867 WeakPolarHBondContact OG-CB 3.4Å; S864-W867 PolarHBondContact OG-N 3.26Å; S864-W870 PolarHBondContact O-NE1 3.19Å
865	D	85.8	Confident	86.6	Confident	27 Å²	27	61.2 Å²	61.2	14%	0.144	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.5	-177.4	-70.3	-4.4	0	0	0	112.8	R875 M879 S883	D865-R875 VanDerWaalsContact O-CZ 3.3Å; D865-R875 PolarHBondContact O-NH1 3.3Å; D865-R875 PolarHBondContact O-NH2 3.4Å; D865-M879 HydrophobicContact CB-CE 3.86Å; D865-M879 VanDerWaalsContact OD1-CE 3.22Å; D865-M879 WeakPolarHBondContact OD1-CE 3.24Å; D865-S883 WeakPolarHBondContact OD2-CA 3.47Å; D865-S883 WeakPolarHBondContact OD2-CB 3.47Å
866	E	85.8	Confident	87.6	Confident	181 Å²	181	66.1 Å²	66.1	85%	0.846	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-1.4	-178.8	-60.1	-172.5	170	0	0	114.2	S864	S864-E866 PolarHBondContact O-N 3.4Å; S864-E866 VanDerWaalsContact O-N 3.14Å
867	W	89.3	Confident	88.3	Confident	55 Å²	55	63.8 Å²	63.8	21%	0.208	32%	0.324	C	S	.	.			trans	-59.5	128	-178.3	-176.2	50.7	0	0	0	111.6	W863 S864 D869 W870	W863-W867 HydrophobicContact CD2-CE3 4.3Å; W863-W867 HydrophobicContact CD2-CH2 4.41Å; W863-W867 AromaticContact CD2-CZ3 3.65Å; W863-W867 HydrophobicContact CD2-CZ3 3.65Å; W863-W867 AromaticContact CE2-CZ3 3.78Å; W863-W867 HydrophobicContact CE3-CE3 4.49Å; W863-W867 AromaticContact CE3-CZ3 3.92Å; W863-W867 HydrophobicContact CE3-CZ3 3.92Å; W863-W867 HydrophobicContact CG-CE3 4.36Å; W863-W867 HydrophobicContact CG-CZ3 4.03Å; W863-W867 HydrophobicContact CH2-CZ3 4.43Å; W863-W867 HydrophobicContact CZ2-CH2 4.4Å; W863-W867 HydrophobicContact CZ2-CZ3 4.18Å; W863-W867 HydrophobicContact CZ3-CZ3 4.31Å; S864-W867 WeakPolarHBondContact O-CB 3.47Å; S864-W867 PolarHBondContact O-N 3.33Å; S864-W867 VanDerWaalsContact O-N 3.16Å; S864-W867 WeakPolarHBondContact OG-CB 3.4Å; S864-W867 PolarHBondContact OG-N 3.26Å; W867-D869 HydrophobicContact CD2-CB 4.29Å; W867-D869 HydrophobicContact CH2-CB 4.21Å; W867-D869 HydrophobicContact CZ2-CB 3.68Å; W867-D869 PolarHBondContact NE1-OD2 2.81Å; W867-W870 HydrophobicContact CE3-CB 4.44Å; W867-W870 AromaticContact CE3-CD1 3.69Å; W867-W870 AromaticContact CE3-CG 3.97Å; W867-W870 HydrophobicContact CE3-CG 3.97Å; W867-W870 VanDerWaalsContact O-CD1 3.32Å
868	P	88.1	Confident	88.8	Confident	111 Å²	111	60.3 Å²	60.3	72%	0.721	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-31.7	-176	26.1	-34.9	0	0	0	113.6	W870	P868-W870 PolarHBondContact O-N 3.31Å
869	D	90.8	Very high	88.9	Confident	109 Å²	109	59.7 Å²	59.7	58%	0.583	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	15.3	-168.8	-42.2	-67.8	0	0	0	114	W867 P871	W867-D869 HydrophobicContact CD2-CB 4.29Å; W867-D869 HydrophobicContact CH2-CB 4.21Å; W867-D869 HydrophobicContact CZ2-CB 3.68Å; W867-D869 PolarHBondContact NE1-OD2 2.81Å; D869-P871 VanDerWaalsContact O-CD 3.31Å; D869-P871 WeakPolarHBondContact O-CD 3.34Å
870	W	89.4	Confident	88	Confident	16 Å²	16	62.8 Å²	62.8	6%	0.061	33%	0.329	C	S	.	.			trans	-56.4	121.4	175.6	-99.6	97.5	0	0	0	111.2	W863 S864 W867 P868 Q872 L874 R875 L878 M879 W889	W863-W870 HydrophobicContact CB-CZ2 4.25Å; W863-W870 HydrophobicContact CE3-CD2 4.04Å; W863-W870 AromaticContact CE3-CE3 3.79Å; W863-W870 HydrophobicContact CE3-CE3 3.79Å; W863-W870 AromaticContact CE3-CH2 3.8Å; W863-W870 HydrophobicContact CE3-CH2 3.8Å; W863-W870 HydrophobicContact CE3-CZ2 4.03Å; W863-W870 AromaticContact CE3-CZ3 3.67Å; W863-W870 HydrophobicContact CE3-CZ3 3.67Å; W863-W870 HydrophobicContact CZ3-CD2 4.41Å; W863-W870 AromaticContact CZ3-CE3 3.82Å; W863-W870 HydrophobicContact CZ3-CE3 3.82Å; W863-W870 HydrophobicContact CZ3-CH2 4.4Å; W863-W870 AromaticContact CZ3-CZ3 3.83Å; W863-W870 HydrophobicContact CZ3-CZ3 3.83Å; W863-W870 WeakPolarHBondContact O-CZ2 3.37Å; S864-W870 PolarHBondContact O-NE1 3.19Å; W867-W870 HydrophobicContact CE3-CB 4.44Å; W867-W870 AromaticContact CE3-CD1 3.69Å; W867-W870 AromaticContact CE3-CG 3.97Å; W867-W870 HydrophobicContact CE3-CG 3.97Å; W867-W870 VanDerWaalsContact O-CD1 3.32Å; P868-W870 PolarHBondContact O-N 3.31Å; W870-Q872 PolarHBondContact O-N 3.39Å; W870-Q872 VanDerWaalsContact O-N 3.11Å; W870-L874 HydrophobicContact CE3-CB 4.44Å; W870-L874 HydrophobicContact CZ3-CB 4.34Å; W870-R875 HydrophobicContact CB-CB 4.17Å; W870-R875 HydrophobicContact CB-CG 4.33Å; W870-R875 HydrophobicContact CD2-CB 4.1Å; W870-R875 HydrophobicContact CD2-CG 4.1Å; W870-R875 VanDerWaalsContact CE3-CA 3.5Å; W870-R875 HydrophobicContact CE3-CB 3.68Å; W870-R875 HydrophobicContact CE3-CG 4.1Å; W870-R875 HydrophobicContact CG-CB 4.33Å; W870-R875 HydrophobicContact CG-CG 4.22Å; W870-R875 HydrophobicContact CZ3-CB 4.38Å; W870-L878 HydrophobicContact CH2-CB 4.1Å; W870-L878 HydrophobicContact CH2-CD1 4.32Å; W870-L878 HydrophobicContact CZ3-CB 4.1Å; W870-L878 HydrophobicContact CZ3-CD1 4.12Å; W870-M879 HydrophobicContact CD2-SD 4.42Å; W870-M879 HydrophobicContact CH2-CG 3.93Å; W870-M879 HydrophobicContact CH2-SD 4.04Å; W870-M879 HydrophobicContact CZ2-CG 4.06Å; W870-M879 HydrophobicContact CZ2-SD 3.57Å; W870-M879 VanDerWaalsContact CZ2-SD 3.57Å; W870-M879 HydrophobicContact CZ3-CG 4.49Å; W870-W889 HydrophobicContact CH2-CB 4.33Å; W870-W889 AromaticContact CH2-CD1 3.92Å; W870-W889 HydrophobicContact CH2-CG 4.17Å; W870-W889 HydrophobicContact CZ2-CB 4.23Å; W870-W889 HydrophobicContact CZ2-CG 4.43Å
871	P	90.4	Very high	87	Confident	34 Å²	34	66.7 Å²	66.7	22%	0.221	34%	0.344	C	S	.	.			trans	-62.1	117.9	171	-22.1	34.7	0	0	0	109.4	W863 D869 H873 L874 R875	W863-P871 HydrophobicContact CH2-CG 4.2Å; D869-P871 VanDerWaalsContact O-CD 3.31Å; D869-P871 WeakPolarHBondContact O-CD 3.34Å; P871-H873 VanDerWaalsContact C-N 3.28Å; P871-H873 PolarHBondContact O-N 3.23Å; P871-H873 VanDerWaalsContact O-N 3.12Å; P871-L874 HydrophobicContact CB-CB 4.33Å; P871-L874 HydrophobicContact CB-CD1 4.17Å; P871-L874 HydrophobicContact CB-CG 4.18Å; P871-L874 HydrophobicContact CG-CD1 4.15Å; P871-L874 CarbonylContact O-C 3.49Å; P871-L874 WeakPolarHBondContact O-CA 3.16Å; P871-L874 WeakPolarHBondContact O-CB 3.25Å; P871-L874 PolarHBondContact O-N 2.82Å; P871-R875 PolarHBondContact O-N 3Å
872	Q	87.8	Confident	86.1	Confident	120 Å²	120	67.8 Å²	67.8	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-57.6	-36.2	-164.3	-176.7	68.8	-31.1	0	0	113.6	W870 R875 H876	W870-Q872 PolarHBondContact O-N 3.39Å; W870-Q872 VanDerWaalsContact O-N 3.11Å; Q872-R875 PolarHBondContact O-N 3.43Å; Q872-H876 PolarHBondContact NE2-NE2 3.46Å; Q872-H876 PolarHBondContact O-CD2 2.91Å; Q872-H876 PolarHBondContact O-N 2.89Å
873	H	88.3	Confident	85.1	Confident	100 Å²	100	69.6 Å²	69.6	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-65.6	-39.6	174.4	58.8	-73	0	0	0	112.6	Q843 P871 H876 E877	Q843-H873 PolarHBondContact NE2-CD2 3.45Å; Q843-H873 PolarHBondContact NE2-NE2 3.44Å; Q843-H873 PolarHBondContact OE1-NE2 3.17Å; P871-H873 VanDerWaalsContact C-N 3.28Å; P871-H873 PolarHBondContact O-N 3.23Å; P871-H873 VanDerWaalsContact O-N 3.12Å; H873-H876 PolarHBondContact O-N 2.78Å; H873-E877 WeakPolarHBondContact O-CB 3.33Å; H873-E877 PolarHBondContact O-N 2.87Å
874	L	90	Very high	84.1	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-70.2	-34.7	174.3	-60.7	-174.9	0	0	0	111.5	V842 Y845 W863 W870 P871 E877 L878	V842-L874 HydrophobicContact CG1-CD2 3.58Å; Y845-L874 HydrophobicContact CD2-CD1 4.14Å; Y845-L874 HydrophobicContact CE2-CD1 4.44Å; W863-L874 HydrophobicContact CH2-CD1 3.84Å; W863-L874 HydrophobicContact CZ3-CB 4.47Å; W863-L874 HydrophobicContact CZ3-CD1 4.04Å; W870-L874 HydrophobicContact CE3-CB 4.44Å; W870-L874 HydrophobicContact CZ3-CB 4.34Å; P871-L874 HydrophobicContact CB-CB 4.33Å; P871-L874 HydrophobicContact CB-CD1 4.17Å; P871-L874 HydrophobicContact CB-CG 4.18Å; P871-L874 HydrophobicContact CG-CD1 4.15Å; P871-L874 CarbonylContact O-C 3.49Å; P871-L874 WeakPolarHBondContact O-CA 3.16Å; P871-L874 WeakPolarHBondContact O-CB 3.25Å; P871-L874 PolarHBondContact O-N 2.82Å; L874-E877 PolarHBondContact O-N 3.25Å; L874-L878 HydrophobicContact CB-CD1 4.48Å; L874-L878 VanDerWaalsContact O-CB 3.22Å; L874-L878 WeakPolarHBondContact O-CB 3.48Å; L874-L878 WeakPolarHBondContact O-CG 3.35Å; L874-L878 PolarHBondContact O-N 3.23Å
875	R	87.9	Confident	83.3	Confident	76 Å²	76	78.6 Å²	78.6	29%	0.287	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-44.2	174	-164.4	173.6	173.8	89	-2.7	110.9	D865 W870 P871 Q872 M879	D865-R875 VanDerWaalsContact O-CZ 3.3Å; D865-R875 PolarHBondContact O-NH1 3.3Å; D865-R875 PolarHBondContact O-NH2 3.4Å; W870-R875 HydrophobicContact CB-CB 4.17Å; W870-R875 HydrophobicContact CB-CG 4.33Å; W870-R875 HydrophobicContact CD2-CB 4.1Å; W870-R875 HydrophobicContact CD2-CG 4.1Å; W870-R875 VanDerWaalsContact CE3-CA 3.5Å; W870-R875 HydrophobicContact CE3-CB 3.68Å; W870-R875 HydrophobicContact CE3-CG 4.1Å; W870-R875 HydrophobicContact CG-CB 4.33Å; W870-R875 HydrophobicContact CG-CG 4.22Å; W870-R875 HydrophobicContact CZ3-CB 4.38Å; P871-R875 PolarHBondContact O-N 3Å; Q872-R875 PolarHBondContact O-N 3.43Å; R875-M879 HydrophobicContact CG-CB 4.48Å; R875-M879 HydrophobicContact CG-CG 4.48Å; R875-M879 HydrophobicContact CG-SD 3.96Å; R875-M879 CarbonylContact O-C 3.58Å; R875-M879 VanDerWaalsContact O-CA 3.31Å; R875-M879 WeakPolarHBondContact O-CA 3.35Å; R875-M879 VanDerWaalsContact O-CB 3.23Å; R875-M879 WeakPolarHBondContact O-CB 3.42Å; R875-M879 PolarHBondContact O-N 3.27Å
876	H	86.8	Confident	82.9	Confident	123 Å²	123	77.3 Å²	77.3	57%	0.569	41%	0.409	S	S	*	.	H	α-helix	trans	-66.7	-35.4	175.5	-78	-125.9	0	0	0	112.6	Q872 H873 A880	Q872-H876 PolarHBondContact NE2-NE2 3.46Å; Q872-H876 PolarHBondContact O-CD2 2.91Å; Q872-H876 PolarHBondContact O-N 2.89Å; H873-H876 PolarHBondContact O-N 2.78Å; H876-A880 WeakPolarHBondContact O-CA 3.49Å; H876-A880 VanDerWaalsContact O-CB 3.3Å; H876-A880 WeakPolarHBondContact O-CB 3.21Å; H876-A880 PolarHBondContact O-N 3.18Å
877	E	87.8	Confident	83	Confident	96 Å²	96	69 Å²	69	45%	0.449	37%	0.371	S	S	.	.	H	α-helix	trans	-75	-47.2	177.5	-161.4	-163.3	144.7	0	0	113.1	R840 H873 L874	R840-E877 IonicContact CZ-OE1 2.78Å; R840-E877 IonicContact NH1-OE1 3.84Å; R840-E877 PolarHBondContact NH1-OE1 2.95Å; R840-E877 IonicContact NH2-OE1 2.67Å; R840-E877 PolarHBondContact NH2-OE1 3.39Å; H873-E877 WeakPolarHBondContact O-CB 3.33Å; H873-E877 PolarHBondContact O-N 2.87Å; L874-E877 PolarHBondContact O-N 3.25Å
878	L	86.9	Confident	83.1	Confident	9 Å²	9	66.5 Å²	66.5	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-90.8	-21.1	-170.6	-57.8	-175.8	0	0	0	113.5	R840 L847 W870 L874 W889	R840-L878 VanDerWaalsContact NH1-CD2 3.25Å; L847-L878 HydrophobicContact CD1-CD1 3.59Å; W870-L878 HydrophobicContact CH2-CB 4.1Å; W870-L878 HydrophobicContact CH2-CD1 4.32Å; W870-L878 HydrophobicContact CZ3-CB 4.1Å; W870-L878 HydrophobicContact CZ3-CD1 4.12Å; L874-L878 HydrophobicContact CB-CD1 4.48Å; L874-L878 VanDerWaalsContact O-CB 3.22Å; L874-L878 WeakPolarHBondContact O-CB 3.48Å; L874-L878 WeakPolarHBondContact O-CG 3.35Å; L874-L878 PolarHBondContact O-N 3.23Å; L878-W889 HydrophobicContact CB-CZ2 3.86Å; L878-W889 HydrophobicContact CD2-CH2 4.05Å; L878-W889 HydrophobicContact CD2-CZ2 3.96Å; L878-W889 HydrophobicContact CG-CZ2 4.34Å; L878-W889 PolarHBondContact O-NE1 2.8Å
879	M	84.2	Confident	83.4	Confident	20 Å²	20	61.5 Å²	61.5	10%	0.099	33%	0.328	C	S	.	.	S	Bend	trans	-119.8	28.7	176.1	-51.6	-177.1	68.5	0	0	112.5	D865 W870 R875 H881 G882	D865-M879 HydrophobicContact CB-CE 3.86Å; D865-M879 VanDerWaalsContact OD1-CE 3.22Å; D865-M879 WeakPolarHBondContact OD1-CE 3.24Å; W870-M879 HydrophobicContact CD2-SD 4.42Å; W870-M879 HydrophobicContact CH2-CG 3.93Å; W870-M879 HydrophobicContact CH2-SD 4.04Å; W870-M879 HydrophobicContact CZ2-CG 4.06Å; W870-M879 HydrophobicContact CZ2-SD 3.57Å; W870-M879 VanDerWaalsContact CZ2-SD 3.57Å; W870-M879 HydrophobicContact CZ3-CG 4.49Å; R875-M879 HydrophobicContact CG-CB 4.48Å; R875-M879 HydrophobicContact CG-CG 4.48Å; R875-M879 HydrophobicContact CG-SD 3.96Å; R875-M879 CarbonylContact O-C 3.58Å; R875-M879 VanDerWaalsContact O-CA 3.31Å; R875-M879 WeakPolarHBondContact O-CA 3.35Å; R875-M879 VanDerWaalsContact O-CB 3.23Å; R875-M879 WeakPolarHBondContact O-CB 3.42Å; R875-M879 PolarHBondContact O-N 3.27Å; M879-H881 PolarHBondContact O-N 2.92Å; M879-G882 PolarHBondContact O-N 3.4Å
880	A	71.9	Confident	83.6	Confident	69 Å²	69	56.3 Å²	56.3	57%	0.57	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-20.5	179.6	0	0	0	0	0	115.6	H876	H876-A880 WeakPolarHBondContact O-CA 3.49Å; H876-A880 VanDerWaalsContact O-CB 3.3Å; H876-A880 WeakPolarHBondContact O-CB 3.21Å; H876-A880 PolarHBondContact O-N 3.18Å
881	H	69.8	Low	83.9	Confident	181 Å²	181	58.1 Å²	58.1	84%	0.838	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	9.2	-179.4	-62.1	77.6	0	0	0	113.2	M879	M879-H881 PolarHBondContact O-N 2.92Å
882	G	71.3	Confident	84.2	Confident	39 Å²	39	57 Å²	57	40%	0.402	30%	0.3	S	S	.	.			trans	77.5	-175.7	-172.5	0	0	0	0	0	114.1	M879	M879-G882 PolarHBondContact O-N 3.4Å
883	S	70.6	Confident	84.4	Confident	85 Å²	85	55.2 Å²	55.2	59%	0.594	30%	0.298	S	S	*	.			trans	-66.6	157.6	167.5	47	0	0	0	0	111.2	D865	D865-S883 WeakPolarHBondContact OD2-CA 3.47Å; D865-S883 WeakPolarHBondContact OD2-CB 3.47Å
884	S	71.4	Confident	84.7	Confident	58 Å²	58	51.6 Å²	51.6	41%	0.406	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	-146.6	139.8	176.6	-163.5	0	0	0	0	110.6	G886 V887	S884-G886 PolarHBondContact O-N 2.94Å; S884-V887 WeakPolarHBondContact O-CB 3.16Å; S884-V887 PolarHBondContact O-N 2.95Å
885	E	74.9	Confident	84.9	Confident	142 Å²	142	51.6 Å²	51.6	66%	0.664	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	112.9	-171.8	-66.4	-64.7	172	0	0	113.5	V887	E885-V887 VanDerWaalsContact C-N 3.28Å; E885-V887 PolarHBondContact O-N 2.88Å
886	G	78.2	Confident	85.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	8.2	-178.4	0	0	0	0	0	115.8	R851 N852 S858 S884	R851-G886 CarbonylContact C-O 3.44Å; R851-G886 VanDerWaalsContact CA-O 3.27Å; R851-G886 WeakPolarHBondContact CA-O 3.23Å; N852-G886 PolarHBondContact N-O 2.88Å; S858-G886 WeakPolarHBondContact OG-CA 3.49Å; S884-G886 PolarHBondContact O-N 2.94Å
887	V	87.4	Confident	85.3	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.042	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.3	174.1	-179	0	0	0	0	109.1	L837 R849 L850 R851 S884 E885	L837-V887 HydrophobicContact CD1-CG1 3.92Å; L837-V887 HydrophobicContact CD1-CG2 4.32Å; R849-V887 HydrophobicContact CG-CG1 4.17Å; L850-V887 WeakPolarHBondContact O-CA 3.39Å; R851-V887 HydrophobicContact CB-CG2 4.12Å; R851-V887 HydrophobicContact CG-CG2 3.74Å; S884-V887 WeakPolarHBondContact O-CB 3.16Å; S884-V887 PolarHBondContact O-N 2.95Å; E885-V887 VanDerWaalsContact C-N 3.28Å; E885-V887 PolarHBondContact O-N 2.88Å
888	F	91.6	Very high	85.4	Confident	1 Å²	1	45.7 Å²	45.7	0%	0.004	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	163.7	-179.8	51.9	-93.2	0	0	0	111.8	L828 Y834 R849 L850 W859 M890	L828-F888 HydrophobicContact CD2-CE2 4.49Å; L828-F888 HydrophobicContact CD2-CZ 4.05Å; Y834-F888 HydrophobicContact CD1-CE1 4.29Å; Y834-F888 HydrophobicContact CD1-CZ 4Å; Y834-F888 AromaticContact CE1-CE1 3.97Å; Y834-F888 HydrophobicContact CE1-CE1 3.97Å; Y834-F888 AromaticContact CE1-CZ 3.82Å; Y834-F888 HydrophobicContact CE1-CZ 3.82Å; R849-F888 CarbonylContact C-O 3.56Å; R849-F888 WeakPolarHBondContact CA-O 3.32Å; L850-F888 HydrophobicContact CB-CD2 4.33Å; L850-F888 HydrophobicContact CB-CE2 3.79Å; L850-F888 HydrophobicContact CB-CZ 3.96Å; L850-F888 HydrophobicContact CD1-CE2 4.27Å; L850-F888 HydrophobicContact CG-CE2 4.48Å; L850-F888 PolarHBondContact N-O 3.43Å; L850-F888 PolarHBondContact O-N 2.94Å; W859-F888 HydrophobicContact CB-CB 4.08Å; W859-F888 HydrophobicContact CB-CD1 4.17Å; W859-F888 HydrophobicContact CB-CD2 3.29Å; W859-F888 HydrophobicContact CB-CE1 4.42Å; W859-F888 HydrophobicContact CB-CE2 3.6Å; W859-F888 HydrophobicContact CB-CG 3.59Å; W859-F888 HydrophobicContact CB-CZ 4.16Å; W859-F888 HydrophobicContact CG-CD2 4.14Å; W859-F888 HydrophobicContact CG-CE2 4.43Å; F888-M890 HydrophobicContact CE2-SD 4.27Å
889	W	94	Very high	85.7	Confident	6 Å²	6	45.3 Å²	45.3	2%	0.023	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	152.4	164.1	-69.9	95.1	0	0	0	110.3	D838 R840 L847 L848 R849 W859 W863 W870 L878	D838-W889 HydrophobicContact CB-CH2 3.94Å; D838-W889 HydrophobicContact CB-CZ3 4.42Å; R840-W889 HydrophobicContact CG-CH2 4.09Å; R840-W889 HydrophobicContact CG-CZ3 4.34Å; L847-W889 HydrophobicContact CB-CE3 3.85Å; L847-W889 HydrophobicContact CB-CZ3 4.08Å; L848-W889 VanDerWaalsContact C-CE3 3.48Å; L848-W889 CarbonylContact O-C 3.59Å; L848-W889 WeakPolarHBondContact O-CA 3.39Å; R849-W889 HydrophobicContact CB-CD2 3.84Å; R849-W889 HydrophobicContact CB-CE3 3.73Å; R849-W889 HydrophobicContact CB-CH2 3.83Å; R849-W889 HydrophobicContact CB-CZ2 3.95Å; R849-W889 HydrophobicContact CB-CZ3 3.73Å; R849-W889 HydrophobicContact CG-CD2 4.05Å; R849-W889 HydrophobicContact CG-CE3 4.45Å; R849-W889 HydrophobicContact CG-CG 4.48Å; R849-W889 HydrophobicContact CG-CZ2 4.13Å; W859-W889 VanDerWaalsContact CD1-O 3.28Å; W863-W889 CarbonylContact C-O 3.49Å; W863-W889 HydrophobicContact CB-CB 4.14Å; W863-W889 VanDerWaalsContact O-O 3.13Å; W870-W889 HydrophobicContact CH2-CB 4.33Å; W870-W889 AromaticContact CH2-CD1 3.92Å; W870-W889 HydrophobicContact CH2-CG 4.17Å; W870-W889 HydrophobicContact CZ2-CB 4.23Å; W870-W889 HydrophobicContact CZ2-CG 4.43Å; L878-W889 HydrophobicContact CB-CZ2 3.86Å; L878-W889 HydrophobicContact CD2-CH2 4.05Å; L878-W889 HydrophobicContact CD2-CZ2 3.96Å; L878-W889 HydrophobicContact CG-CZ2 4.34Å; L878-W889 PolarHBondContact O-NE1 2.8Å
890	M	95.1	Very high	85.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	161	167.7	75.7	-174.2	-55.1	0	0	110.8	L848 L850 W859 F888 D894 F895 F899	L848-M890 HydrophobicContact CB-CG 4.46Å; L848-M890 PolarHBondContact N-O 2.78Å; L848-M890 PolarHBondContact O-N 2.93Å; L850-M890 HydrophobicContact CD1-CG 3.64Å; L850-M890 HydrophobicContact CD1-SD 3.63Å; L850-M890 HydrophobicContact CD2-SD 4.35Å; W859-M890 HydrophobicContact CD2-CE 4.5Å; W859-M890 HydrophobicContact CE3-CE 4.47Å; W859-M890 HydrophobicContact CG-CB 4.42Å; W859-M890 HydrophobicContact CH2-CE 4.36Å; W859-M890 HydrophobicContact CZ2-CE 4.38Å; W859-M890 HydrophobicContact CZ3-CE 4.4Å; F888-M890 HydrophobicContact CE2-SD 4.27Å; M890-D894 HydrophobicContact CE-CB 3.84Å; M890-F895 HydrophobicContact CE-CB 4.24Å; M890-F895 HydrophobicContact CG-CB 4.44Å; M890-F895 HydrophobicContact SD-CB 4.05Å; M890-F895 HydrophobicContact SD-CD2 3.96Å; M890-F899 HydrophobicContact CE-CE2 4.14Å; M890-F899 HydrophobicContact SD-CE2 3.83Å
891	E	95.4	Very high	86.7	Confident	54 Å²	54	42.6 Å²	42.6	25%	0.252	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	146.9	173.6	-160	177.6	117.1	0	0	111.6	L847 T893 D894 F895	L847-E891 HydrophobicContact CD2-CB 4.48Å; L847-E891 HydrophobicContact CD2-CG 4.47Å; E891-T893 VanDerWaalsContact CD-OG1 3.24Å; E891-T893 WeakPolarHBondContact CG-OG1 3.35Å; E891-T893 PolarHBondContact O-N 2.91Å; E891-T893 VanDerWaalsContact OE1-CG2 3.27Å; E891-T893 WeakPolarHBondContact OE1-CG2 3.3Å; E891-T893 PolarHBondContact OE1-OG1 2.87Å; E891-D894 PolarHBondContact O-N 2.87Å; E891-F895 PolarHBondContact O-N 3.32Å
892	Y	95.9	Very high	87.9	Confident	10 Å²	10	34 Å²	34	4%	0.039	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-29.2	178	-177.5	-122.1	0	0	0	113.6	T790 I793 W794 M797 R846 L848 F895 I896	T790-Y892 WeakPolarHBondContact O-CE1 3.21Å; T790-Y892 PolarHBondContact O-OH 3.03Å; I793-Y892 WeakPolarHBondContact CB-OH 3.46Å; I793-Y892 VanDerWaalsContact CG2-OH 3.25Å; I793-Y892 WeakPolarHBondContact CG2-OH 3.38Å; W794-Y892 HydrophobicContact CB-CE1 3.88Å; W794-Y892 HydrophobicContact CD2-CD1 4.5Å; W794-Y892 HydrophobicContact CE3-CD1 4.05Å; W794-Y892 AromaticContact CE3-CD2 3.63Å; W794-Y892 HydrophobicContact CE3-CD2 3.63Å; W794-Y892 HydrophobicContact CE3-CE1 4.35Å; W794-Y892 AromaticContact CE3-CE2 3.99Å; W794-Y892 HydrophobicContact CE3-CE2 3.99Å; W794-Y892 AromaticContact CE3-CG 3.66Å; W794-Y892 HydrophobicContact CE3-CG 3.66Å; W794-Y892 HydrophobicContact CZ3-CD2 4.01Å; W794-Y892 HydrophobicContact CZ3-CG 4.02Å; W794-Y892 PolarHBondContact N-OH 3.06Å; M797-Y892 HydrophobicContact SD-CE2 4.04Å; R846-Y892 WeakPolarHBondContact O-CB 3.23Å; R846-Y892 PolarHBondContact O-N 2.66Å; L848-Y892 HydrophobicContact CD1-CD2 4.05Å; Y892-F895 HydrophobicContact CD2-CD1 4.15Å; Y892-F895 HydrophobicContact CE2-CD1 4.2Å; Y892-F895 WeakPolarHBondContact O-CB 3.38Å; Y892-F895 PolarHBondContact O-N 3.05Å; Y892-I896 HydrophobicContact CD2-CG1 4.31Å; Y892-I896 HydrophobicContact CE1-CG1 4.21Å; Y892-I896 HydrophobicContact CE2-CD1 3.85Å; Y892-I896 HydrophobicContact CE2-CG1 3.86Å; Y892-I896 WeakPolarHBondContact O-CG1 3.33Å; Y892-I896 PolarHBondContact O-N 2.96Å; Y892-I896 VanDerWaalsContact O-N 3.08Å
893	T	93.9	Very high	89	Confident	83 Å²	83	32.2 Å²	32.2	51%	0.509	17%	0.172	S	C	.	.	H	α-helix	trans	-63.8	-49.2	176.6	51	0	0	0	0	112	E891 F895 K897	E891-T893 VanDerWaalsContact CD-OG1 3.24Å; E891-T893 WeakPolarHBondContact CG-OG1 3.35Å; E891-T893 PolarHBondContact O-N 2.91Å; E891-T893 VanDerWaalsContact OE1-CG2 3.27Å; E891-T893 WeakPolarHBondContact OE1-CG2 3.3Å; E891-T893 PolarHBondContact OE1-OG1 2.87Å; T893-F895 VanDerWaalsContact C-N 3.34Å; T893-K897 PolarHBondContact O-N 3.16Å
894	D	94.1	Very high	90.1	Very high	25 Å²	25	28.4 Å²	28.4	13%	0.134	15%	0.145	C	C	.	.	H	α-helix	trans	-68	-33.2	172.5	-84	-47.4	0	0	0	111.9	W859 M890 E891 I896 K897 Y898	W859-D894 HydrophobicContact CH2-CB 3.95Å; W859-D894 HydrophobicContact CZ2-CB 3.95Å; M890-D894 HydrophobicContact CE-CB 3.84Å; E891-D894 PolarHBondContact O-N 2.87Å; D894-I896 PolarHBondContact O-N 2.89Å; D894-K897 WeakPolarHBondContact O-CB 3.23Å; D894-K897 PolarHBondContact O-N 2.61Å; D894-K897 IonicContact OD1-NZ 2.71Å; D894-K897 PolarHBondContact OD1-NZ 3.09Å; D894-Y898 HydrophobicContact CB-CD2 4.18Å; D894-Y898 HydrophobicContact CB-CE2 4.23Å; D894-Y898 WeakPolarHBondContact O-CD2 3.39Å; D894-Y898 PolarHBondContact O-N 3.19Å; D894-Y898 WeakPolarHBondContact OD1-CE2 3.46Å
895	F	94.5	Very high	91.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.4	-48	176.3	179.4	-102.6	0	0	0	112.2	L776 M797 A809 I836 L848 L850 M890 E891 Y892 T893 K897 Y898 F899 V902	L776-F895 HydrophobicContact CD1-CD1 4.09Å; L776-F895 HydrophobicContact CD1-CE1 3.43Å; L776-F895 VanDerWaalsContact CD1-CE1 3.43Å; L776-F895 HydrophobicContact CD1-CZ 3.85Å; M797-F895 HydrophobicContact CE-CE1 3.91Å; M797-F895 HydrophobicContact CE-CZ 4.32Å; M797-F895 HydrophobicContact SD-CE1 4.36Å; A809-F895 HydrophobicContact CB-CE2 3.77Å; A809-F895 HydrophobicContact CB-CZ 3.77Å; I836-F895 HydrophobicContact CD1-CZ 4.25Å; L848-F895 HydrophobicContact CD1-CB 3.64Å; L848-F895 HydrophobicContact CD1-CD1 3.45Å; L848-F895 VanDerWaalsContact CD1-CD1 3.45Å; L848-F895 HydrophobicContact CD1-CD2 3.69Å; L848-F895 HydrophobicContact CD1-CE1 4Å; L848-F895 HydrophobicContact CD1-CE2 4.23Å; L848-F895 HydrophobicContact CD1-CG 3.27Å; L848-F895 HydrophobicContact CD1-CZ 4.37Å; L850-F895 HydrophobicContact CD2-CD2 4.06Å; L850-F895 HydrophobicContact CD2-CE2 3.86Å; M890-F895 HydrophobicContact CE-CB 4.24Å; M890-F895 HydrophobicContact CG-CB 4.44Å; M890-F895 HydrophobicContact SD-CB 4.05Å; M890-F895 HydrophobicContact SD-CD2 3.96Å; E891-F895 PolarHBondContact O-N 3.32Å; Y892-F895 HydrophobicContact CD2-CD1 4.15Å; Y892-F895 HydrophobicContact CE2-CD1 4.2Å; Y892-F895 WeakPolarHBondContact O-CB 3.38Å; Y892-F895 PolarHBondContact O-N 3.05Å; T893-F895 VanDerWaalsContact C-N 3.34Å; F895-K897 PolarHBondContact O-N 2.59Å; F895-Y898 PolarHBondContact O-N 3.38Å; F895-F899 HydrophobicContact CD2-CB 4.08Å; F895-F899 HydrophobicContact CD2-CD1 4.22Å; F895-F899 AromaticContact CD2-CD2 3.34Å; F895-F899 HydrophobicContact CD2-CD2 3.34Å; F895-F899 AromaticContact CD2-CE2 3.76Å; F895-F899 HydrophobicContact CD2-CE2 3.76Å; F895-F899 AromaticContact CD2-CG 3.62Å; F895-F899 HydrophobicContact CD2-CG 3.62Å; F895-F899 HydrophobicContact CD2-CZ 4.35Å; F895-F899 HydrophobicContact CE1-CB 4.47Å; F895-F899 HydrophobicContact CE2-CB 3.69Å; F895-F899 AromaticContact CE2-CD1 3.57Å; F895-F899 HydrophobicContact CE2-CD1 3.57Å; F895-F899 AromaticContact CE2-CD2 3.57Å; F895-F899 HydrophobicContact CE2-CD2 3.57Å; F895-F899 HydrophobicContact CE2-CE1 4.06Å; F895-F899 HydrophobicContact CE2-CE2 4.07Å; F895-F899 AromaticContact CE2-CG 3.31Å; F895-F899 HydrophobicContact CE2-CG 3.31Å; F895-F899 HydrophobicContact CE2-CZ 4.3Å; F895-F899 HydrophobicContact CG-CD2 4.19Å; F895-F899 HydrophobicContact CZ-CB 3.9Å; F895-F899 HydrophobicContact CZ-CD1 4.31Å; F895-F899 HydrophobicContact CZ-CG 4.03Å; F895-F899 WeakPolarHBondContact O-CB 3.29Å; F895-F899 WeakPolarHBondContact O-CD2 3.42Å; F895-F899 PolarHBondContact O-N 3.31Å; F895-V902 HydrophobicContact CE1-CG2 3.64Å; F895-V902 HydrophobicContact CZ-CG2 3.54Å
896	I	91.9	Very high	92.2	Very high	33 Å²	33	20 Å²	20	17%	0.169	10%	0.099	C	C	.	.	H	α-helix	trans	-62.9	-21.9	175.4	-65.6	-64.8	0	0	0	112.7	L776 Q777 T790 Y892 D894	L776-I896 HydrophobicContact CB-CD1 4.17Å; L776-I896 HydrophobicContact CD1-CD1 4.28Å; L776-I896 HydrophobicContact CD2-CD1 3.84Å; L776-I896 HydrophobicContact CG-CD1 4.29Å; Q777-I896 PolarHBondContact NE2-O 2.84Å; T790-I896 HydrophobicContact CG2-CD1 4.32Å; T790-I896 HydrophobicContact CG2-CG1 4.34Å; T790-I896 HydrophobicContact CG2-CG2 4.22Å; Y892-I896 HydrophobicContact CD2-CG1 4.31Å; Y892-I896 HydrophobicContact CE1-CG1 4.21Å; Y892-I896 HydrophobicContact CE2-CD1 3.85Å; Y892-I896 HydrophobicContact CE2-CG1 3.86Å; Y892-I896 WeakPolarHBondContact O-CG1 3.33Å; Y892-I896 PolarHBondContact O-N 2.96Å; Y892-I896 VanDerWaalsContact O-N 3.08Å; D894-I896 PolarHBondContact O-N 2.89Å
897	K	89.9	Confident	92.9	Very high	114 Å²	114	21.2 Å²	21.2	50%	0.496	11%	0.105	S	C	.	.	H	α-helix	trans	-86.7	-28.1	-179.4	175.5	-179.4	156.6	-144.7	0	113.8	M816 T893 D894 F895	M816-K897 WeakPolarHBondContact CE-O 3.31Å; T893-K897 PolarHBondContact O-N 3.16Å; D894-K897 WeakPolarHBondContact O-CB 3.23Å; D894-K897 PolarHBondContact O-N 2.61Å; D894-K897 IonicContact OD1-NZ 2.71Å; D894-K897 PolarHBondContact OD1-NZ 3.09Å; F895-K897 PolarHBondContact O-N 2.59Å
898	Y	91.4	Very high	93	Very high	24 Å²	24	22.2 Å²	22.2	9%	0.094	11%	0.11	C	C	.	.	H	α-helix	trans	-114.2	-10.9	-176.1	-64.1	-70.7	0	0	0	115.3	C811 G812 Y823 L826 L828 W859 D894 F895	C811-Y898 PolarHBondContact SG-O 3.3Å; G812-Y898 PolarHBondContact N-O 2.93Å; Y823-Y898 HydrophobicContact CE1-CD1 4.05Å; Y823-Y898 HydrophobicContact CE2-CD1 4.04Å; Y823-Y898 AromaticContact CZ-CD1 3.8Å; L826-Y898 HydrophobicContact CD1-CD1 4.48Å; L826-Y898 HydrophobicContact CD1-CE1 3.57Å; L826-Y898 HydrophobicContact CD1-CE2 4.14Å; L826-Y898 WeakPolarHBondContact CD1-OH 3.43Å; L828-Y898 HydrophobicContact CD1-CD1 4.27Å; L828-Y898 HydrophobicContact CD1-CD2 4.28Å; L828-Y898 HydrophobicContact CD1-CG 3.83Å; W859-Y898 HydrophobicContact CH2-CD2 4.05Å; W859-Y898 AromaticContact CH2-CE2 3.75Å; W859-Y898 HydrophobicContact CH2-CE2 3.75Å; W859-Y898 HydrophobicContact CZ3-CD2 4.07Å; W859-Y898 HydrophobicContact CZ3-CE2 4.03Å; D894-Y898 HydrophobicContact CB-CD2 4.18Å; D894-Y898 HydrophobicContact CB-CE2 4.23Å; D894-Y898 WeakPolarHBondContact O-CD2 3.39Å; D894-Y898 PolarHBondContact O-N 3.19Å; D894-Y898 WeakPolarHBondContact OD1-CE2 3.46Å; F895-Y898 PolarHBondContact O-N 3.38Å
899	F	91.4	Very high	92.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	149.8	179.2	-67.1	-105.2	0	0	0	111.8	L776 Q777 A809 S810 C811 L828 Y834 L850 M890 F895	L776-F899 HydrophobicContact CD1-CB 3.76Å; Q777-F899 PolarHBondContact NE2-O 2.79Å; Q777-F899 VanDerWaalsContact NE2-O 3.16Å; A809-F899 HydrophobicContact CB-CD1 3.63Å; A809-F899 HydrophobicContact CB-CE1 3.99Å; S810-F899 CarbonylContact O-C 3.51Å; S810-F899 VanDerWaalsContact O-CA 3.28Å; S810-F899 WeakPolarHBondContact O-CA 3.42Å; S810-F899 VanDerWaalsContact O-CB 3.31Å; S810-F899 WeakPolarHBondContact O-CB 3.34Å; S810-F899 VanDerWaalsContact O-CD1 3.28Å; S810-F899 WeakPolarHBondContact O-CD1 3.44Å; C811-F899 HydrophobicContact CB-CD1 3.85Å; C811-F899 HydrophobicContact CB-CE1 3.64Å; C811-F899 HydrophobicContact CB-CG 4.49Å; C811-F899 HydrophobicContact CB-CZ 4.11Å; L828-F899 HydrophobicContact CD1-CE2 4.49Å; Y834-F899 AromaticContact CD2-CE1 3.83Å; Y834-F899 HydrophobicContact CD2-CE1 3.83Å; Y834-F899 HydrophobicContact CD2-CZ 4.31Å; Y834-F899 HydrophobicContact CE2-CE1 4.49Å; Y834-F899 AromaticContact CG-CE1 3.98Å; Y834-F899 HydrophobicContact CG-CE1 3.98Å; Y834-F899 HydrophobicContact CG-CZ 4.32Å; L850-F899 HydrophobicContact CD2-CE1 3.86Å; L850-F899 HydrophobicContact CD2-CE2 4.27Å; L850-F899 HydrophobicContact CD2-CZ 3.63Å; M890-F899 HydrophobicContact CE-CE2 4.14Å; M890-F899 HydrophobicContact SD-CE2 3.83Å; F895-F899 HydrophobicContact CD2-CB 4.08Å; F895-F899 HydrophobicContact CD2-CD1 4.22Å; F895-F899 AromaticContact CD2-CD2 3.34Å; F895-F899 HydrophobicContact CD2-CD2 3.34Å; F895-F899 AromaticContact CD2-CE2 3.76Å; F895-F899 HydrophobicContact CD2-CE2 3.76Å; F895-F899 AromaticContact CD2-CG 3.62Å; F895-F899 HydrophobicContact CD2-CG 3.62Å; F895-F899 HydrophobicContact CD2-CZ 4.35Å; F895-F899 HydrophobicContact CE1-CB 4.47Å; F895-F899 HydrophobicContact CE2-CB 3.69Å; F895-F899 AromaticContact CE2-CD1 3.57Å; F895-F899 HydrophobicContact CE2-CD1 3.57Å; F895-F899 AromaticContact CE2-CD2 3.57Å; F895-F899 HydrophobicContact CE2-CD2 3.57Å; F895-F899 HydrophobicContact CE2-CE1 4.06Å; F895-F899 HydrophobicContact CE2-CE2 4.07Å; F895-F899 AromaticContact CE2-CG 3.31Å; F895-F899 HydrophobicContact CE2-CG 3.31Å; F895-F899 HydrophobicContact CE2-CZ 4.3Å; F895-F899 HydrophobicContact CG-CD2 4.19Å; F895-F899 HydrophobicContact CZ-CB 3.9Å; F895-F899 HydrophobicContact CZ-CD1 4.31Å; F895-F899 HydrophobicContact CZ-CG 4.03Å; F895-F899 WeakPolarHBondContact O-CB 3.29Å; F895-F899 WeakPolarHBondContact O-CD2 3.42Å; F895-F899 PolarHBondContact O-N 3.31Å
900	D	88.3	Confident	92.4	Very high	25 Å²	25	29.3 Å²	29.3	13%	0.134	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-28.8	-178.9	66.9	83.5	0	0	0	113.8	L776 Q777 S810 G813 M816	L776-D900 PolarHBondContact N-O 2.69Å; Q777-D900 HydrophobicContact CG-CB 4.41Å; S810-D900 WeakPolarHBondContact CB-OD1 3.32Å; S810-D900 WeakPolarHBondContact CB-OD2 3.22Å; S810-D900 PolarHBondContact O-N 2.99Å; S810-D900 VanDerWaalsContact O-OD2 3.09Å; G813-D900 WeakPolarHBondContact CA-OD2 3.31Å; G813-D900 PolarHBondContact N-OD2 3.44Å; M816-D900 HydrophobicContact CG-CB 4.41Å; M816-D900 HydrophobicContact SD-CB 3.8Å
901	S	90.7	Very high	92.5	Very high	7 Å²	7	30.5 Å²	30.5	5%	0.049	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	152.5	-173.3	52	0	0	0	0	113.9	L774 M775 A809 S810	L774-S901 CarbonylContact O-C 3.51Å; L774-S901 VanDerWaalsContact O-CA 3.25Å; L774-S901 WeakPolarHBondContact O-CA 3.47Å; M775-S901 VanDerWaalsContact CE-CB 3.5Å; A809-S901 CarbonylContact C-O 3.5Å; A809-S901 VanDerWaalsContact CA-O 3.27Å; A809-S901 WeakPolarHBondContact CA-O 3.32Å; S810-S901 WeakPolarHBondContact CB-OG 3.49Å; S810-S901 PolarHBondContact N-O 2.88Å; S810-S901 PolarHBondContact OG-OG 2.97Å
902	V	93.6	Very high	92.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.7	166.9	177.2	0	0	0	0	109.1	S773 L774 L776 M797 G808 I836 F895 I904	S773-V902 CarbonylContact C-O 3.56Å; S773-V902 WeakPolarHBondContact CA-O 3.45Å; L774-V902 HydrophobicContact CB-CB 4.33Å; L774-V902 PolarHBondContact N-O 3.45Å; L774-V902 PolarHBondContact O-N 3.27Å; L776-V902 HydrophobicContact CD1-CG2 4.32Å; L776-V902 HydrophobicContact CD2-CG2 4.23Å; M797-V902 HydrophobicContact CE-CG1 4.47Å; M797-V902 HydrophobicContact CE-CG2 3.89Å; M797-V902 HydrophobicContact CG-CG1 4.49Å; M797-V902 HydrophobicContact SD-CG2 4.1Å; G808-V902 CarbonylContact O-C 3.54Å; G808-V902 WeakPolarHBondContact O-CA 3.44Å; I836-V902 HydrophobicContact CD1-CG1 3.97Å; I836-V902 HydrophobicContact CD1-CG2 4.1Å; F895-V902 HydrophobicContact CE1-CG2 3.64Å; F895-V902 HydrophobicContact CZ-CG2 3.54Å; V902-I904 HydrophobicContact CG1-CG1 3.95Å
903	D	93.9	Very high	92.4	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.011	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	117.5	176	-72.1	-25.5	0	0	0	109.6	I760 L763 S773 M807 G808	I760-D903 HydrophobicContact CB-CB 4.03Å; I760-D903 WeakPolarHBondContact CB-OD2 3.41Å; I760-D903 HydrophobicContact CG1-CB 4.26Å; I760-D903 PolarHBondContact N-OD2 2.9Å; L763-D903 HydrophobicContact CD1-CB 4.33Å; S773-D903 VanDerWaalsContact CB-OD1 3.31Å; S773-D903 WeakPolarHBondContact CB-OD1 3.37Å; S773-D903 PolarHBondContact OG-OD1 3.15Å; M807-D903 WeakPolarHBondContact CA-O 3.33Å; G808-D903 PolarHBondContact N-O 2.72Å; G808-D903 PolarHBondContact O-N 2.95Å
904	I	94.9	Very high	92.5	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.026	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.1	-176.4	-53.9	173.7	0	0	0	109	C771 D772 L774 F805 M807 V902	C771-I904 CarbonylContact C-O 3.57Å; C771-I904 WeakPolarHBondContact CA-O 3.49Å; D772-I904 PolarHBondContact N-O 3.01Å; D772-I904 PolarHBondContact O-N 2.92Å; L774-I904 HydrophobicContact CD1-CD1 3.73Å; L774-I904 HydrophobicContact CG-CD1 3.97Å; F805-I904 HydrophobicContact CB-CG2 4.24Å; F805-I904 HydrophobicContact CD2-CG2 4.21Å; M807-I904 HydrophobicContact CG-CB 4.46Å; M807-I904 HydrophobicContact CG-CG1 4.09Å; M807-I904 HydrophobicContact CG-CG2 4.25Å; M807-I904 HydrophobicContact SD-CG1 4.25Å; V902-I904 HydrophobicContact CG1-CG1 3.95Å
905	C	95.5	Very high	92.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.1	178.8	177.1	0	0	0	0	111	L763 T767 F805 L806 I907	L763-C905 HydrophobicContact CB-CB 4.06Å; L763-C905 HydrophobicContact CD1-CB 4.05Å; L763-C905 HydrophobicContact CD2-CB 4.46Å; L763-C905 HydrophobicContact CG-CB 4.42Å; T767-C905 PolarHBondContact OG1-SG 2.87Å; F805-C905 WeakPolarHBondContact CB-O 3.48Å; L806-C905 HydrophobicContact CB-CB 4.17Å; L806-C905 PolarHBondContact N-O 2.99Å; L806-C905 PolarHBondContact O-N 2.79Å; C905-I907 PolarHBondContact O-N 2.66Å; C905-I907 VanDerWaalsContact O-N 3.08Å
906	K	94.5	Very high	92.5	Very high	24 Å²	24	25 Å²	25	10%	0.104	13%	0.125	C	C	.	.			trans	-86.6	73.6	-168.6	-59.8	-179.9	175	167.2	0	111.5	P770 D772 F805 H908 E942	P770-K906 HydrophobicContact CB-CB 4.49Å; P770-K906 PolarHBondContact O-N 3.18Å; D772-K906 WeakPolarHBondContact OD2-CE 3.46Å; D772-K906 IonicContact OD2-NZ 3.8Å; D772-K906 PolarHBondContact OD2-NZ 3.05Å; F805-K906 HydrophobicContact CD1-CB 4.35Å; F805-K906 HydrophobicContact CD2-CB 4.37Å; F805-K906 HydrophobicContact CD2-CG 3.91Å; F805-K906 HydrophobicContact CE1-CB 4.07Å; F805-K906 HydrophobicContact CE2-CB 4.1Å; F805-K906 HydrophobicContact CE2-CD 4.26Å; F805-K906 HydrophobicContact CE2-CG 3.71Å; F805-K906 HydrophobicContact CG-CB 4.49Å; F805-K906 HydrophobicContact CG-CG 4.43Å; F805-K906 HydrophobicContact CZ-CB 3.93Å; F805-K906 HydrophobicContact CZ-CG 4.05Å; K906-H908 PolarHBondContact O-CD2 2.84Å; K906-H908 PolarHBondContact O-N 2.98Å; K906-E942 WeakPolarHBondContact CB-OE2 3.37Å; K906-E942 WeakPolarHBondContact CD-OE2 3.25Å
907	I	92.2	Very high	92.5	Very high	25 Å²	25	28.5 Å²	28.5	13%	0.128	14%	0.14	C	C	.	.			trans	-79.5	103.3	-178	-54.8	-177	0	0	0	110.8	L682 T767 A769 L806 C905	L682-I907 HydrophobicContact CD1-CD1 3.56Å; L682-I907 HydrophobicContact CD2-CG2 4.4Å; T767-I907 HydrophobicContact CG2-CD1 3.58Å; T767-I907 HydrophobicContact CG2-CG1 4.19Å; A769-I907 HydrophobicContact CB-CG1 4.4Å; L806-I907 HydrophobicContact CD1-CD1 3.55Å; L806-I907 HydrophobicContact CG-CD1 3.87Å; C905-I907 PolarHBondContact O-N 2.66Å; C905-I907 VanDerWaalsContact O-N 3.08Å
908	H	90.3	Very high	92.5	Very high	29 Å²	29	23.7 Å²	23.7	13%	0.134	12%	0.123	C	C	.	.			trans	-104.1	113.3	170.9	-58.5	-82.7	0	0	0	110.6	F805 K906 W911 E942	F805-H908 AromaticContact CE1-CE1 3.53Å; F805-H908 AromaticContact CE1-ND1 3.97Å; F805-H908 AromaticContact CE1-NE2 3.8Å; F805-H908 AromaticContact CZ-CE1 3.5Å; F805-H908 AromaticContact CZ-NE2 3.68Å; K906-H908 PolarHBondContact O-CD2 2.84Å; K906-H908 PolarHBondContact O-N 2.98Å; H908-W911 HydrophobicContact CB-CB 3.79Å; H908-W911 HydrophobicContact CB-CD2 3.84Å; H908-W911 HydrophobicContact CB-CG 3.47Å; H908-W911 VanDerWaalsContact CB-CG 3.47Å; H908-W911 AromaticContact CE1-CE2 3.64Å; H908-W911 AromaticContact CE1-CH2 3.98Å; H908-W911 AromaticContact CE1-CZ2 3.43Å; H908-W911 VanDerWaalsContact CE1-CZ2 3.43Å; H908-W911 WeakPolarHBondContact CE1-CZ2 3.23Å; H908-W911 AromaticContact CE1-NE1 3.98Å; H908-W911 AromaticContact CG-CD1 3.93Å; H908-W911 AromaticContact CG-CD2 3.74Å; H908-W911 AromaticContact CG-CE2 3.66Å; H908-W911 AromaticContact CG-CG 3.91Å; H908-W911 AromaticContact CG-NE1 3.76Å; H908-W911 AromaticContact ND1-CD1 3.93Å; H908-W911 AromaticContact ND1-CE2 3.41Å; H908-W911 AromaticContact ND1-CZ2 3.71Å; H908-W911 AromaticContact ND1-NE1 3.35Å; H908-W911 PolarHBondContact ND1-NE1 3.35Å; H908-W911 AromaticContact NE2-CH2 3.85Å; H908-W911 AromaticContact NE2-CZ2 3.76Å; H908-E942 IonicContact CD2-OE1 2.76Å; H908-E942 IonicContact CE1-OE1 3.1Å; H908-E942 IonicContact NE2-OE1 2.72Å; H908-E942 PolarHBondContact NE2-OE1 3.41Å; H908-E942 IonicContact NE2-OE2 3.76Å
909	S	83.4	Confident	92.5	Very high	52 Å²	52	24.4 Å²	24.4	36%	0.364	13%	0.131	S	C	.	.	S	Bend	trans	-89	-21.8	-177.8	50.6	0	0	0	0	114.9
910	D	90.7	Very high	92.4	Very high	103 Å²	103	24.4 Å²	24.4	55%	0.551	13%	0.131	S	C	*	.	S	Bend	trans	-92.8	-16.1	-180	62.3	-48.8	0	0	0	113	H573	H573-D910 PolarHBondContact CE1-O 2.91Å; H573-D910 PolarHBondContact ND1-O 3.06Å
911	W	95.5	Very high	92.3	Very high	26 Å²	26	24.3 Å²	24.3	10%	0.098	13%	0.131	C	C	.	.	S	Bend	trans	-71.6	163.4	179.3	-74.4	36.1	0	0	0	113	H573 V574 H908 A940 E942 S1054 S1055	H573-W911 WeakPolarHBondContact CA-O 3.38Å; V574-W911 PolarHBondContact N-O 2.94Å; H908-W911 HydrophobicContact CB-CB 3.79Å; H908-W911 HydrophobicContact CB-CD2 3.84Å; H908-W911 HydrophobicContact CB-CG 3.47Å; H908-W911 VanDerWaalsContact CB-CG 3.47Å; H908-W911 AromaticContact CE1-CE2 3.64Å; H908-W911 AromaticContact CE1-CH2 3.98Å; H908-W911 AromaticContact CE1-CZ2 3.43Å; H908-W911 VanDerWaalsContact CE1-CZ2 3.43Å; H908-W911 WeakPolarHBondContact CE1-CZ2 3.23Å; H908-W911 AromaticContact CE1-NE1 3.98Å; H908-W911 AromaticContact CG-CD1 3.93Å; H908-W911 AromaticContact CG-CD2 3.74Å; H908-W911 AromaticContact CG-CE2 3.66Å; H908-W911 AromaticContact CG-CG 3.91Å; H908-W911 AromaticContact CG-NE1 3.76Å; H908-W911 AromaticContact ND1-CD1 3.93Å; H908-W911 AromaticContact ND1-CE2 3.41Å; H908-W911 AromaticContact ND1-CZ2 3.71Å; H908-W911 AromaticContact ND1-NE1 3.35Å; H908-W911 PolarHBondContact ND1-NE1 3.35Å; H908-W911 AromaticContact NE2-CH2 3.85Å; H908-W911 AromaticContact NE2-CZ2 3.76Å; W911-A940 HydrophobicContact CH2-CB 3.98Å; W911-A940 HydrophobicContact CZ2-CB 4.26Å; W911-E942 HydrophobicContact CH2-CG 4.13Å; W911-E942 HydrophobicContact CZ3-CB 4.36Å; W911-E942 HydrophobicContact CZ3-CG 3.97Å; W911-S1054 VanDerWaalsContact CE3-C 3.44Å; W911-S1055 VanDerWaalsContact CE3-N 3.34Å
912	Q	96	Very high	92	Very high	21 Å²	21	25.6 Å²	25.6	10%	0.098	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	152.2	166.9	-38.2	-68.4	-39.1	0	0	110.4	S571 M572 H573 Y1053 S1054 R1056	S571-Q912 WeakPolarHBondContact OG-CB 3.01Å; M572-Q912 VanDerWaalsContact CA-OE1 3.32Å; M572-Q912 CarbonylContact O-C 3.59Å; M572-Q912 VanDerWaalsContact O-CA 3.32Å; M572-Q912 WeakPolarHBondContact O-CA 3.38Å; H573-Q912 PolarHBondContact CD2-NE2 2.92Å; H573-Q912 PolarHBondContact CE1-NE2 2.68Å; H573-Q912 PolarHBondContact ND1-NE2 2.81Å; H573-Q912 PolarHBondContact NE2-NE2 3.15Å; Q912-Y1053 WeakPolarHBondContact O-CA 3.31Å; Q912-S1054 PolarHBondContact N-O 2.75Å; Q912-S1054 PolarHBondContact O-N 3.15Å; Q912-R1056 WeakPolarHBondContact CG-O 3.49Å
913	E	95	Very high	91.7	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	153.7	161.6	68	172.5	159	0	0	112.1	M572 V574 R577 R915 I1052 Y1053	M572-E913 PolarHBondContact N-O 3.05Å; M572-E913 PolarHBondContact O-N 3.12Å; V574-E913 HydrophobicContact CG2-CB 3.98Å; V574-E913 HydrophobicContact CG2-CG 3.98Å; R577-E913 WeakPolarHBondContact CD-OE1 3.09Å; E913-R915 IonicContact OE2-CZ 3.62Å; E913-R915 IonicContact OE2-NE 3.36Å; E913-R915 PolarHBondContact OE2-NE 3.07Å; E913-R915 IonicContact OE2-NH2 3.68Å; E913-R915 PolarHBondContact OE2-NH2 3.36Å; E913-I1052 CarbonylContact C-O 3.53Å; E913-I1052 WeakPolarHBondContact CA-O 3.19Å; E913-Y1053 HydrophobicContact CB-CD1 4.04Å; E913-Y1053 HydrophobicContact CB-CE1 3.97Å
914	V	95.1	Very high	91.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	140.9	159.9	57.5	0	0	0	0	109.2	R569 L916 I1052 V1060	R569-V914 HydrophobicContact CG-CG2 4.06Å; V914-L916 HydrophobicContact CG2-CD2 4.29Å; V914-I1052 HydrophobicContact CG1-CB 3.84Å; V914-I1052 HydrophobicContact CG1-CD1 4.28Å; V914-I1052 HydrophobicContact CG1-CG1 4.36Å; V914-I1052 PolarHBondContact N-O 2.78Å; V914-I1052 PolarHBondContact O-N 3.21Å; V914-V1060 HydrophobicContact CG1-CB 4.42Å; V914-V1060 HydrophobicContact CG1-CG2 3.76Å
915	R	94.1	Very high	90.9	Very high	18 Å²	18	31.7 Å²	31.7	7%	0.068	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132	-179.1	-59.8	-175.8	-176.9	-108.3	-11.1	109.8	R569 G706 G768 E913 I1049 L1050 A1051 Y1053	R569-R915 PolarHBondContact NH1-O 3.23Å; G706-R915 VanDerWaalsContact O-CD 3.28Å; G706-R915 WeakPolarHBondContact O-CD 3.47Å; G706-R915 PolarHBondContact O-NH1 3.04Å; G768-R915 PolarHBondContact O-NH1 2.84Å; G768-R915 PolarHBondContact O-NH2 2.68Å; E913-R915 IonicContact OE2-CZ 3.62Å; E913-R915 IonicContact OE2-NE 3.36Å; E913-R915 PolarHBondContact OE2-NE 3.07Å; E913-R915 IonicContact OE2-NH2 3.68Å; E913-R915 PolarHBondContact OE2-NH2 3.36Å; R915-I1049 HydrophobicContact CB-CG2 4.23Å; R915-L1050 WeakPolarHBondContact CA-O 3.11Å; R915-A1051 HydrophobicContact CG-CB 4.08Å; R915-Y1053 PolarHBondContact NH2-OH 2.87Å
916	L	93.4	Very high	90.4	Very high	17 Å²	17	33.1 Å²	33.1	9%	0.089	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.7	-178.3	-55.7	178.6	0	0	0	109.9	V914 T931 I1049 L1050 V1060 Q1062	V914-L916 HydrophobicContact CG2-CD2 4.29Å; L916-T931 HydrophobicContact CD1-CG2 3.43Å; L916-T931 VanDerWaalsContact CD1-CG2 3.43Å; L916-T931 WeakPolarHBondContact CD1-OG1 3.31Å; L916-I1049 CarbonylContact O-C 3.51Å; L916-I1049 WeakPolarHBondContact O-CA 3.39Å; L916-L1050 PolarHBondContact N-O 2.85Å; L916-L1050 PolarHBondContact O-N 2.97Å; L916-V1060 HydrophobicContact CD1-CG1 3.74Å; L916-Q1062 HydrophobicContact CD1-CG 4.15Å
917	Q	92.7	Very high	89.9	Confident	106 Å²	106	36.2 Å²	36.2	50%	0.495	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	138.4	167.5	-168.2	175.2	26.2	0	0	109.8	E948 Y1048 I1049 Q1062	Q917-E948 PolarHBondContact NE2-OE1 3.25Å; Q917-Y1048 CarbonylContact C-O 3.46Å; Q917-Y1048 WeakPolarHBondContact CA-O 3.47Å; Q917-I1049 HydrophobicContact CB-CD1 3.92Å; Q917-I1049 HydrophobicContact CG-CD1 3.98Å; Q917-Q1062 PolarHBondContact O-NE2 3.47Å
918	G	90.8	Very high	89.7	Confident	13 Å²	13	35.6 Å²	35.6	13%	0.134	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	-172.6	172.9	0	0	0	0	0	111.2	G1047 Y1048	G918-G1047 WeakPolarHBondContact O-CA 3.45Å; G918-Y1048 PolarHBondContact N-O 3.15Å; G918-Y1048 PolarHBondContact O-N 3.01Å
919	C	90.2	Very high	89.7	Confident	39 Å²	39	36.7 Å²	36.7	26%	0.264	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150	175.3	59.9	0	0	0	0	111.1	F1045 P1046 Y1048	C919-F1045 HydrophobicContact CB-CB 3.9Å; C919-P1046 CarbonylContact C-O 3.6Å; C919-P1046 VanDerWaalsContact CA-O 3.22Å; C919-P1046 WeakPolarHBondContact CA-O 3.42Å; C919-Y1048 VanDerWaalsContact O-CE1 3.31Å; C919-Y1048 WeakPolarHBondContact O-CE1 3.44Å
920	F	89.9	Confident	90.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.2	C	C	.	.			trans	-85.4	117.9	176	-64.8	-64.9	0	0	0	110.5	S922 L945 Q947 L961 L963 C1010 A1012 H1015 P1046 Y1048	F920-S922 PolarHBondContact O-N 3.26Å; F920-L945 HydrophobicContact CE1-CD2 4.12Å; F920-L945 HydrophobicContact CZ-CD1 4.11Å; F920-L945 HydrophobicContact CZ-CD2 4.01Å; F920-L945 HydrophobicContact CZ-CG 4.23Å; F920-Q947 HydrophobicContact CE2-CB 4.34Å; F920-L961 HydrophobicContact CB-CD1 4.48Å; F920-L961 HydrophobicContact CD2-CD1 3.41Å; F920-L961 VanDerWaalsContact CD2-CD1 3.41Å; F920-L961 HydrophobicContact CE2-CD1 3.95Å; F920-L961 HydrophobicContact CG-CD1 4.21Å; F920-L963 HydrophobicContact CE1-CD2 4.38Å; F920-L963 HydrophobicContact CE2-CD2 3.63Å; F920-L963 HydrophobicContact CZ-CD2 3.51Å; F920-C1010 HydrophobicContact CE1-CB 4.29Å; F920-A1012 HydrophobicContact CB-CB 4.47Å; F920-A1012 HydrophobicContact CD1-CB 4Å; F920-A1012 HydrophobicContact CD2-CB 4.43Å; F920-A1012 HydrophobicContact CE1-CB 4.38Å; F920-A1012 HydrophobicContact CG-CB 4.04Å; F920-H1015 WeakPolarHBondContact CB-CE1 3.36Å; F920-H1015 PolarHBondContact O-NE2 2.92Å; F920-P1046 HydrophobicContact CD2-CB 4.48Å; F920-P1046 PolarHBondContact N-O 2.8Å; F920-Y1048 AromaticContact CD1-CD1 3.76Å; F920-Y1048 HydrophobicContact CD1-CD1 3.76Å; F920-Y1048 HydrophobicContact CD1-CE1 4.05Å; F920-Y1048 AromaticContact CD2-CD1 3.97Å; F920-Y1048 HydrophobicContact CD2-CD1 3.97Å; F920-Y1048 AromaticContact CE1-CD1 3.52Å; F920-Y1048 HydrophobicContact CE1-CD1 3.52Å; F920-Y1048 AromaticContact CE1-CE1 3.95Å; F920-Y1048 HydrophobicContact CE1-CE1 3.95Å; F920-Y1048 HydrophobicContact CE1-CG 4.21Å; F920-Y1048 AromaticContact CE2-CD1 3.77Å; F920-Y1048 HydrophobicContact CE2-CD1 3.77Å; F920-Y1048 HydrophobicContact CE2-CG 4.07Å; F920-Y1048 AromaticContact CG-CD1 3.97Å; F920-Y1048 HydrophobicContact CG-CD1 3.97Å; F920-Y1048 AromaticContact CZ-CD1 3.51Å; F920-Y1048 HydrophobicContact CZ-CD1 3.51Å; F920-Y1048 HydrophobicContact CZ-CE1 4.37Å; F920-Y1048 AromaticContact CZ-CG 3.8Å; F920-Y1048 HydrophobicContact CZ-CG 3.8Å
921	P	86.5	Confident	90.4	Very high	22 Å²	22	29.4 Å²	29.4	14%	0.143	17%	0.174	C	C	.	.			trans	-64.1	128.9	175.9	27.5	-33.4	0	0	0	109.3	K923 H1015 W1016	P921-K923 VanDerWaalsContact C-N 3.27Å; P921-H1015 PolarHBondContact O-CE1 3.17Å; P921-H1015 PolarHBondContact O-NE2 2.97Å; P921-W1016 PolarHBondContact O-NE1 2.91Å
922	S	83.4	Confident	90.4	Very high	35 Å²	35	28.4 Å²	28.4	25%	0.245	17%	0.171	C	C	.	.	S	Bend	trans	-86.9	0.4	170.5	62	0	0	0	0	113.1	F920 H1015 F1045	F920-S922 PolarHBondContact O-N 3.26Å; S922-H1015 WeakPolarHBondContact CA-NE2 3.45Å; S922-H1015 WeakPolarHBondContact CB-NE2 3.11Å; S922-H1015 PolarHBondContact N-NE2 2.95Å; S922-F1045 VanDerWaalsContact OG-CE1 3.25Å; S922-F1045 WeakPolarHBondContact OG-CE1 3.46Å
923	K	86.9	Confident	90.4	Very high	82 Å²	82	27.4 Å²	27.4	36%	0.357	17%	0.167	S	C	.	.			trans	-160.8	153.8	-175	64.3	-165.2	-146.9	147	0	111.8	P921 S925 F1045 D1194	P921-K923 VanDerWaalsContact C-N 3.27Å; K923-S925 WeakPolarHBondContact CE-OG 3.42Å; K923-F1045 HydrophobicContact CG-CE1 4.34Å; K923-F1045 HydrophobicContact CG-CZ 4.5Å; K923-D1194 CarbonylContact C-O 3.56Å; K923-D1194 WeakPolarHBondContact CA-O 3.39Å; K923-D1194 HydrophobicContact CB-CB 3.94Å; K923-D1194 WeakPolarHBondContact CB-O 3.5Å; K923-D1194 HydrophobicContact CD-CB 4.34Å; K923-D1194 VanDerWaalsContact CD-OD1 3.29Å; K923-D1194 WeakPolarHBondContact CD-OD1 3.28Å; K923-D1194 WeakPolarHBondContact CE-OD1 3.43Å; K923-D1194 IonicContact NZ-OD1 2.67Å; K923-D1194 PolarHBondContact NZ-OD1 2.86Å; K923-D1194 IonicContact NZ-OD2 3.68Å
924	A	87.9	Confident	90.4	Very high	2 Å²	2	28.5 Å²	28.5	2%	0.017	17%	0.174	C	C	.	.	S	Bend	trans	-111.2	37.3	-178.1	0	0	0	0	0	113.5	W1016 P1067 D1194 G1197 L1198	A924-W1016 HydrophobicContact CB-CH2 4.02Å; A924-P1067 WeakPolarHBondContact O-CB 3.18Å; A924-D1194 PolarHBondContact N-O 2.93Å; A924-G1197 WeakPolarHBondContact O-CA 3.35Å; A924-G1197 PolarHBondContact O-N 3.28Å; A924-L1198 HydrophobicContact CB-CB 4.06Å
925	S	85.3	Confident	90.3	Very high	50 Å²	50	28.7 Å²	28.7	35%	0.35	17%	0.174	S	C	.	.	S	Bend	trans	-89.3	-26.4	171.9	42.1	0	0	0	0	114	K923 P1193 D1194	K923-S925 WeakPolarHBondContact CE-OG 3.42Å; S925-P1193 WeakPolarHBondContact CB-O 3.41Å; S925-D1194 VanDerWaalsContact CB-OD1 3.25Å; S925-D1194 WeakPolarHBondContact CB-OD1 3.33Å; S925-D1194 PolarHBondContact OG-OD1 2.76Å
926	G	83.9	Confident	90.1	Very high	30 Å²	30	32.8 Å²	32.8	31%	0.309	20%	0.197	S	C	.	.	S	Bend	trans	-106.4	172.1	-178	0	0	0	0	0	113.9	P1067	G926-P1067 WeakPolarHBondContact O-CA 3.47Å; G926-P1067 WeakPolarHBondContact O-CB 3.46Å; G926-P1067 WeakPolarHBondContact O-CG 3.26Å
927	P	84.9	Confident	90	Very high	90 Å²	90	36.1 Å²	36.1	58%	0.584	21%	0.212	S	C	*	.			trans	-55.9	147.1	170.6	-21.9	33.4	0	0	0	111.9	E1064 A1065	P927-E1064 HydrophobicContact CB-CB 4.17Å; P927-A1065 CarbonylContact C-O 3.52Å; P927-A1065 VanDerWaalsContact CA-O 3.24Å; P927-A1065 WeakPolarHBondContact CA-O 3.41Å; P927-A1065 WeakPolarHBondContact CB-O 3.46Å
928	V	87.8	Confident	90.2	Very high	11 Å²	11	38.2 Å²	38.2	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.6	-179.9	178.7	0	0	0	0	109.2	V930 A1065	V928-V930 HydrophobicContact CG1-CG2 4.47Å; V928-V930 PolarHBondContact O-N 2.8Å; V928-A1065 PolarHBondContact N-O 2.87Å; V928-A1065 WeakPolarHBondContact O-CB 3.46Å; V928-A1065 PolarHBondContact O-N 2.6Å
929	T	90.4	Very high	90.5	Very high	52 Å²	52	37.6 Å²	37.6	32%	0.319	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	118.2	175.2	-52.5	0	0	0	0	110.2	Q1062	T929-Q1062 HydrophobicContact CG2-CB 4.04Å; T929-Q1062 HydrophobicContact CG2-CG 4.26Å
930	V	93.4	Very high	90.9	Very high	2 Å²	2	37 Å²	37	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.3	175.5	179.5	0	0	0	0	109.2	V928 L978 A1007 V1009 V1063 A1065 T1069	V928-V930 HydrophobicContact CG1-CG2 4.47Å; V928-V930 PolarHBondContact O-N 2.8Å; V930-L978 HydrophobicContact CB-CD2 3.98Å; V930-L978 HydrophobicContact CG1-CD2 3.79Å; V930-L978 HydrophobicContact CG2-CD2 4.03Å; V930-A1007 HydrophobicContact CG1-CB 3.89Å; V930-V1009 HydrophobicContact CG1-CG2 3.97Å; V930-V1009 HydrophobicContact CG2-CG2 4.23Å; V930-V1063 PolarHBondContact N-O 3.25Å; V930-V1063 PolarHBondContact O-N 3.25Å; V930-A1065 HydrophobicContact CB-CB 4.44Å; V930-A1065 HydrophobicContact CG2-CB 3.73Å; V930-T1069 HydrophobicContact CG2-CG2 4.2Å
931	T	95.5	Very high	91.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	113.1	174.9	-65	0	0	0	0	109.4	L916 A1007 V1008 L1050 I1052 V1060	L916-T931 HydrophobicContact CD1-CG2 3.43Å; L916-T931 VanDerWaalsContact CD1-CG2 3.43Å; L916-T931 WeakPolarHBondContact CD1-OG1 3.31Å; T931-A1007 WeakPolarHBondContact O-CA 3.45Å; T931-V1008 PolarHBondContact N-O 3.48Å; T931-V1008 PolarHBondContact O-N 3.16Å; T931-L1050 HydrophobicContact CG2-CD2 4.24Å; T931-I1052 HydrophobicContact CG2-CD1 4.08Å; T931-V1060 HydrophobicContact CG2-CG1 3.45Å; T931-V1060 VanDerWaalsContact CG2-CG1 3.45Å
932	A	94.9	Very high	91.7	Very high	5 Å²	5	36.9 Å²	36.9	4%	0.041	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.9	171.3	0	0	0	0	0	110.1	F972 Y1006 V1060 E1061 V1063	A932-F972 HydrophobicContact CB-CE1 3.91Å; A932-F972 HydrophobicContact CB-CE2 4.1Å; A932-F972 HydrophobicContact CB-CZ 3.37Å; A932-Y1006 WeakPolarHBondContact CA-O 3.27Å; A932-V1060 WeakPolarHBondContact O-CA 3.44Å; A932-V1060 WeakPolarHBondContact O-CG1 3.43Å; A932-E1061 HydrophobicContact CB-CG 3.83Å; A932-E1061 PolarHBondContact N-O 2.72Å; A932-E1061 PolarHBondContact O-N 2.85Å; A932-V1063 HydrophobicContact CB-CG2 3.76Å
933	L	95.5	Very high	92.4	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	120.6	-175.4	169.9	66.1	0	0	0	109.1	V935 L941 F943 L1001 Y1006 V1008 V1058 V1060	L933-V935 HydrophobicContact CD1-CG2 4.45Å; L933-V935 HydrophobicContact CD2-CG2 4.28Å; L933-V935 HydrophobicContact CG-CG2 4.07Å; L933-L941 HydrophobicContact CD2-CD1 4.33Å; L933-L941 HydrophobicContact CD2-CD2 4.23Å; L933-F943 HydrophobicContact CD2-CE1 4.3Å; L933-F943 HydrophobicContact CD2-CZ 3.81Å; L933-L1001 HydrophobicContact CD2-CD1 3.95Å; L933-Y1006 PolarHBondContact N-O 3.41Å; L933-Y1006 PolarHBondContact O-N 3.17Å; L933-V1008 HydrophobicContact CD2-CG2 4.5Å; L933-V1058 HydrophobicContact CD1-CB 3.71Å; L933-V1058 HydrophobicContact CD1-CG1 4.26Å; L933-V1058 HydrophobicContact CD1-CG2 3.76Å; L933-V1060 HydrophobicContact CD1-CG2 3.79Å
934	T	94.8	Very high	92.8	Very high	24 Å²	24	31.4 Å²	31.4	15%	0.147	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.7	169.2	-35.4	0	0	0	0	109.6	R568 L936 M1059	R568-T934 PolarHBondContact NH2-OG1 3.45Å; T934-L936 HydrophobicContact CG2-CD2 4.2Å; T934-M1059 PolarHBondContact N-O 2.87Å; T934-M1059 PolarHBondContact O-N 3.2Å
935	V	93.1	Very high	93.1	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.4	174.5	177.4	0	0	0	0	108	L933 E937 L941 L1001 E1002 P1003 G1004 Y1006 V1058	L933-V935 HydrophobicContact CD1-CG2 4.45Å; L933-V935 HydrophobicContact CD2-CG2 4.28Å; L933-V935 HydrophobicContact CG-CG2 4.07Å; V935-E937 WeakPolarHBondContact CG1-O 3.48Å; V935-L941 HydrophobicContact CG2-CD1 4.2Å; V935-L1001 HydrophobicContact CG1-CB 4.36Å; V935-L1001 HydrophobicContact CG2-CB 4.07Å; V935-L1001 HydrophobicContact CG2-CD1 3.96Å; V935-E1002 WeakPolarHBondContact CG1-O 3.39Å; V935-P1003 WeakPolarHBondContact O-CA 3.26Å; V935-G1004 PolarHBondContact N-O 2.98Å; V935-G1004 PolarHBondContact O-N 2.98Å; V935-Y1006 HydrophobicContact CB-CD2 4.25Å; V935-Y1006 HydrophobicContact CB-CE2 3.98Å; V935-Y1006 HydrophobicContact CG2-CD2 3.84Å; V935-Y1006 HydrophobicContact CG2-CE2 3.95Å; V935-V1058 HydrophobicContact CG2-CG1 4.31Å
936	L	90.6	Very high	93.5	Very high	104 Å²	104	29.2 Å²	29.2	55%	0.545	16%	0.161	S	C	.	.			trans	-92.7	-37.8	-172.9	-58.4	179.6	0	0	0	112.7	T934	T934-L936 HydrophobicContact CG2-CD2 4.2Å
937	E	92.4	Very high	93.8	Very high	88 Å²	88	28.1 Å²	28.1	41%	0.411	15%	0.148	S	C	.	.	S	Bend	trans	-131.6	166.1	176.3	61.3	176.7	143.9	0	0	109.5	V935 T939 R1056	V935-E937 WeakPolarHBondContact CG1-O 3.48Å; E937-T939 PolarHBondContact O-N 2.97Å; E937-T939 VanDerWaalsContact O-N 3.11Å; E937-T939 PolarHBondContact O-OG1 2.58Å; E937-R1056 HydrophobicContact CG-CB 3.92Å; E937-R1056 HydrophobicContact CG-CG 3.85Å; E937-R1056 VanDerWaalsContact OE1-CD 3.25Å; E937-R1056 WeakPolarHBondContact OE1-CD 3.3Å; E937-R1056 IonicContact OE1-NE 3.99Å; E937-R1056 IonicContact OE2-CZ 2.66Å; E937-R1056 IonicContact OE2-NE 2.74Å
938	R	96.5	Very high	93.6	Very high	150 Å²	150	29 Å²	29	57%	0.566	14%	0.144	S	C	*	.			trans	-60.5	117.9	-179.3	-177.8	180	171	142.4	-8.5	110.9	M1000 L1001 E1002	R938-M1000 HydrophobicContact CG-CG 4.41Å; R938-M1000 PolarHBondContact NE-SD 2.85Å; R938-M1000 PolarHBondContact NH2-SD 2.81Å; R938-L1001 CarbonylContact C-O 3.52Å; R938-L1001 WeakPolarHBondContact CA-O 3.34Å; R938-E1002 WeakPolarHBondContact CB-OE2 3.47Å; R938-E1002 VanDerWaalsContact CD-OE1 3.3Å; R938-E1002 WeakPolarHBondContact CD-OE1 3.48Å; R938-E1002 WeakPolarHBondContact CD-OE2 3.33Å; R938-E1002 WeakPolarHBondContact CG-OE2 2.91Å; R938-E1002 IonicContact CZ-OE1 3.39Å; R938-E1002 VanDerWaalsContact CZ-OE1 3.24Å; R938-E1002 IonicContact NE-OE1 2.67Å; R938-E1002 PolarHBondContact NE-OE1 2.84Å; R938-E1002 IonicContact NH1-OE1 2.69Å; R938-E1002 PolarHBondContact NH1-OE1 3.32Å
939	T	97.4	Very high	92.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	126.7	-165.3	-58.3	0	0	0	0	111.2	E937 L941 L1001 R1056 V1058	E937-T939 PolarHBondContact O-N 2.97Å; E937-T939 VanDerWaalsContact O-N 3.11Å; E937-T939 PolarHBondContact O-OG1 2.58Å; T939-L941 HydrophobicContact CG2-CD1 4.11Å; T939-L941 HydrophobicContact CG2-CG 4.05Å; T939-L1001 PolarHBondContact N-O 3.49Å; T939-L1001 PolarHBondContact O-N 2.99Å; T939-R1056 HydrophobicContact CG2-CB 3.95Å; T939-R1056 HydrophobicContact CG2-CG 4.42Å; T939-R1056 WeakPolarHBondContact OG1-CB 3.49Å; T939-V1058 HydrophobicContact CG2-CG1 4.17Å
940	A	97.6	Very high	91	Very high	27 Å²	27	31.8 Å²	31.8	22%	0.223	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	132.7	161.4	0	0	0	0	0	109.7	W911 M1000 S1055	W911-A940 HydrophobicContact CH2-CB 3.98Å; W911-A940 HydrophobicContact CZ2-CB 4.26Å; A940-M1000 HydrophobicContact CB-CE 4.24Å; A940-S1055 WeakPolarHBondContact CA-OG 3.29Å; A940-S1055 PolarHBondContact N-OG 3.47Å; A940-S1055 PolarHBondContact O-N 2.67Å; A940-S1055 PolarHBondContact O-OG 2.85Å
941	L	97.4	Very high	89.5	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.3	-177.1	-79.2	131.3	0	0	0	111	L933 V935 T939 F943 D998 V999 L1001 I1052 Y1053	L933-L941 HydrophobicContact CD2-CD1 4.33Å; L933-L941 HydrophobicContact CD2-CD2 4.23Å; V935-L941 HydrophobicContact CG2-CD1 4.2Å; T939-L941 HydrophobicContact CG2-CD1 4.11Å; T939-L941 HydrophobicContact CG2-CG 4.05Å; L941-F943 HydrophobicContact CB-CE2 4.03Å; L941-F943 HydrophobicContact CB-CZ 4.38Å; L941-F943 HydrophobicContact CD2-CZ 4.16Å; L941-D998 WeakPolarHBondContact O-CA 3.22Å; L941-V999 HydrophobicContact CB-CG1 4.26Å; L941-V999 PolarHBondContact N-O 3.06Å; L941-V999 PolarHBondContact O-N 3.36Å; L941-L1001 HydrophobicContact CD1-CB 4.02Å; L941-L1001 HydrophobicContact CD1-CD1 3.63Å; L941-L1001 HydrophobicContact CD1-CG 3.78Å; L941-I1052 HydrophobicContact CD2-CG2 3.51Å; L941-Y1053 CarbonylContact C-O 3.54Å; L941-Y1053 VanDerWaalsContact CA-O 3.27Å; L941-Y1053 WeakPolarHBondContact CA-O 3.48Å
942	E	96.8	Very high	87.4	Confident	16 Å²	16	41 Å²	41	8%	0.075	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	125	169.4	-65.3	-176.3	-156.6	0	0	109.5	P770 K906 H908 W911 D998 Y1053	P770-E942 HydrophobicContact CB-CB 4.43Å; P770-E942 WeakPolarHBondContact CB-OE2 3.47Å; P770-E942 HydrophobicContact CG-CB 3.93Å; P770-E942 WeakPolarHBondContact CG-OE2 3.49Å; K906-E942 WeakPolarHBondContact CB-OE2 3.37Å; K906-E942 WeakPolarHBondContact CD-OE2 3.25Å; H908-E942 IonicContact CD2-OE1 2.76Å; H908-E942 IonicContact CE1-OE1 3.1Å; H908-E942 IonicContact NE2-OE1 2.72Å; H908-E942 PolarHBondContact NE2-OE1 3.41Å; H908-E942 IonicContact NE2-OE2 3.76Å; W911-E942 HydrophobicContact CH2-CG 4.13Å; W911-E942 HydrophobicContact CZ3-CB 4.36Å; W911-E942 HydrophobicContact CZ3-CG 3.97Å; E942-D998 HydrophobicContact CG-CB 4.08Å; E942-Y1053 PolarHBondContact N-O 3.44Å; E942-Y1053 PolarHBondContact O-N 2.93Å
943	F	96.6	Very high	84.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	133.4	177.3	-60.9	-87.8	0	0	0	109.6	L933 L941 I965 V967 G996 C997 V999 V1008 L1050 A1051 I1052	L933-F943 HydrophobicContact CD2-CE1 4.3Å; L933-F943 HydrophobicContact CD2-CZ 3.81Å; L941-F943 HydrophobicContact CB-CE2 4.03Å; L941-F943 HydrophobicContact CB-CZ 4.38Å; L941-F943 HydrophobicContact CD2-CZ 4.16Å; F943-I965 HydrophobicContact CB-CD1 3.94Å; F943-I965 HydrophobicContact CB-CG2 4.39Å; F943-V967 HydrophobicContact CD2-CG2 4.12Å; F943-V967 HydrophobicContact CE2-CG2 3.85Å; F943-V967 HydrophobicContact CZ-CG2 4.3Å; F943-G996 CarbonylContact O-C 3.58Å; F943-G996 WeakPolarHBondContact O-CA 3.42Å; F943-C997 HydrophobicContact CB-CB 4.3Å; F943-C997 WeakPolarHBondContact CD2-O 3.23Å; F943-C997 PolarHBondContact N-O 3.08Å; F943-C997 PolarHBondContact O-N 2.98Å; F943-V999 HydrophobicContact CD2-CG1 4.41Å; F943-V999 HydrophobicContact CE2-CG1 3.74Å; F943-V1008 HydrophobicContact CD1-CG1 4.29Å; F943-V1008 HydrophobicContact CD1-CG2 4.45Å; F943-V1008 HydrophobicContact CE1-CG1 4.3Å; F943-V1008 HydrophobicContact CE1-CG2 3.66Å; F943-V1008 HydrophobicContact CZ-CG2 3.89Å; F943-L1050 HydrophobicContact CB-CD1 4.42Å; F943-L1050 HydrophobicContact CD1-CD1 4.32Å; F943-A1051 WeakPolarHBondContact CA-O 3.33Å; F943-I1052 HydrophobicContact CD1-CB 4.32Å; F943-I1052 HydrophobicContact CD1-CD1 4.38Å; F943-I1052 HydrophobicContact CD1-CG1 3.84Å; F943-I1052 HydrophobicContact CD1-CG2 4.01Å; F943-I1052 HydrophobicContact CE1-CB 4.31Å; F943-I1052 HydrophobicContact CE1-CD1 4Å; F943-I1052 HydrophobicContact CE1-CG1 3.9Å; F943-I1052 HydrophobicContact CE1-CG2 3.63Å; F943-I1052 HydrophobicContact CZ-CG2 4.3Å
944	A	95.6	Very high	82.4	Confident	2 Å²	2	49.8 Å²	49.8	2%	0.017	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	116.7	170.3	0	0	0	0	0	109.3	P770 F946 A1051	P770-A944 HydrophobicContact CB-CB 4.45Å; A944-F946 HydrophobicContact CB-CD2 4.4Å; A944-F946 HydrophobicContact CB-CE2 3.56Å; A944-F946 HydrophobicContact CB-CZ 3.91Å; A944-A1051 HydrophobicContact CB-CB 4.44Å; A944-A1051 PolarHBondContact N-O 3.49Å; A944-A1051 PolarHBondContact O-N 3.04Å
945	L	95.5	Very high	80.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114.4	179.3	175.6	64.1	0	0	0	108.9	F920 L963 I965 F994 V995 C1010 Y1048 L1050	F920-L945 HydrophobicContact CE1-CD2 4.12Å; F920-L945 HydrophobicContact CZ-CD1 4.11Å; F920-L945 HydrophobicContact CZ-CD2 4.01Å; F920-L945 HydrophobicContact CZ-CG 4.23Å; L945-L963 HydrophobicContact CD2-CB 4.3Å; L945-I965 HydrophobicContact CB-CD1 3.62Å; L945-I965 HydrophobicContact CB-CG1 3.63Å; L945-I965 HydrophobicContact CD2-CG1 3.82Å; L945-I965 HydrophobicContact CG-CG1 4.38Å; L945-F994 CarbonylContact O-C 3.52Å; L945-F994 WeakPolarHBondContact O-CA 3.37Å; L945-F994 VanDerWaalsContact O-CB 3.28Å; L945-F994 WeakPolarHBondContact O-CB 3.46Å; L945-V995 HydrophobicContact CB-CG2 4.12Å; L945-V995 HydrophobicContact CD2-CG2 4.37Å; L945-V995 PolarHBondContact N-O 3.47Å; L945-V995 PolarHBondContact O-N 3.1Å; L945-C1010 HydrophobicContact CD1-CB 4.01Å; L945-C1010 HydrophobicContact CD2-CB 3.79Å; L945-Y1048 HydrophobicContact CD1-CD2 3.47Å; L945-Y1048 VanDerWaalsContact CD1-CD2 3.47Å; L945-Y1048 HydrophobicContact CD1-CE2 4.04Å; L945-Y1048 HydrophobicContact CD1-CG 3.76Å; L945-L1050 HydrophobicContact CB-CD1 4.34Å; L945-L1050 HydrophobicContact CD1-CB 4.44Å
946	F	93.3	Very high	77.9	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.026	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.9	178.7	-56.4	-97.7	0	0	0	110	D705 A764 A944 F994 Y1048 I1049 A1051	D705-F946 WeakPolarHBondContact O-CB 3.34Å; A764-F946 HydrophobicContact CB-CE1 4.49Å; A944-F946 HydrophobicContact CB-CD2 4.4Å; A944-F946 HydrophobicContact CB-CE2 3.56Å; A944-F946 HydrophobicContact CB-CZ 3.91Å; F946-F994 HydrophobicContact CB-CB 4.46Å; F946-F994 HydrophobicContact CD1-CB 3.56Å; F946-F994 AromaticContact CD1-CD1 3.93Å; F946-F994 HydrophobicContact CD1-CD1 3.93Å; F946-F994 AromaticContact CD1-CG 3.96Å; F946-F994 HydrophobicContact CD1-CG 3.96Å; F946-F994 HydrophobicContact CE1-CB 3.95Å; F946-F994 AromaticContact CE1-CD1 3.95Å; F946-F994 HydrophobicContact CE1-CD1 3.95Å; F946-F994 AromaticContact CE1-CG 3.94Å; F946-F994 HydrophobicContact CE1-CG 3.94Å; F946-F994 HydrophobicContact CG-CB 4.04Å; F946-Y1048 CarbonylContact O-C 3.55Å; F946-Y1048 VanDerWaalsContact O-CA 3.23Å; F946-Y1048 WeakPolarHBondContact O-CA 3.31Å; F946-Y1048 VanDerWaalsContact O-CB 3.27Å; F946-Y1048 WeakPolarHBondContact O-CB 3.41Å; F946-I1049 HydrophobicContact CB-CB 4.47Å; F946-I1049 PolarHBondContact N-O 3.48Å; F946-I1049 PolarHBondContact O-N 2.89Å; F946-A1051 HydrophobicContact CE2-CB 4.01Å
947	Q	90.3	Very high	76	Confident	7 Å²	7	51.5 Å²	51.5	3%	0.033	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	148.4	168.9	62	-177.4	-67.2	0	0	111	F920 G949 L961 L963 K992 K993	F920-Q947 HydrophobicContact CE2-CB 4.34Å; Q947-G949 PolarHBondContact O-N 3.09Å; Q947-L961 VanDerWaalsContact NE2-N 3.19Å; Q947-L961 PolarHBondContact NE2-O 2.98Å; Q947-L963 HydrophobicContact CB-CD1 4.21Å; Q947-L963 HydrophobicContact CB-CD2 4.09Å; Q947-L963 HydrophobicContact CG-CD1 4.11Å; Q947-L963 HydrophobicContact CG-CD2 4.4Å; Q947-K992 PolarHBondContact NE2-O 2.9Å; Q947-K993 PolarHBondContact N-O 2.97Å; Q947-K993 VanDerWaalsContact N-O 3.12Å
948	E	80.7	Confident	74.1	Confident	110 Å²	110	49.8 Å²	49.8	51%	0.514	28%	0.275	S	S	.	.			trans	-64.3	123	175.8	-68.8	-178.4	-161.9	0	0	110.5	Q917 G1047	Q917-E948 PolarHBondContact NE2-OE1 3.25Å; E948-G1047 PolarHBondContact N-O 3.16Å
949	G	67.5	Low	72.8	Confident	24 Å²	24	49.3 Å²	49.3	25%	0.247	28%	0.28	C	S	.	.			trans	-123	149.5	-170.1	0	0	0	0	0	113.9	K704 D705 Q947	K704-G949 PolarHBondContact NZ-O 2.94Å; D705-G949 PolarHBondContact OD2-N 3.32Å; Q947-G949 PolarHBondContact O-N 3.09Å
950	S	56.9	Low	72.2	Confident	96 Å²	96	50.1 Å²	50.1	67%	0.671	28%	0.284	S	S	*	.			trans	-122.1	125.4	172.1	-164.4	0	0	0	0	109.9	R952	S950-R952 VanDerWaalsContact C-N 3.27Å; S950-R952 PolarHBondContact O-N 2.84Å
951	R	61.5	Low	71.8	Confident	39 Å²	39	49.3 Å²	49.3	15%	0.147	28%	0.276	C	S	.	.			trans	-89.1	60.8	175	-79.6	-177.8	148.3	-90.2	-4.5	110.2	H748 A753 A756 E761	H748-R951 HydrophobicContact CB-CB 4.49Å; A753-R951 WeakPolarHBondContact CB-O 3.24Å; A756-R951 PolarHBondContact O-NH1 2.95Å; A756-R951 PolarHBondContact O-NH2 3.4Å; A756-R951 VanDerWaalsContact O-NH2 3.12Å; E761-R951 IonicContact OE2-CZ 2.72Å; E761-R951 IonicContact OE2-NH2 2.75Å; E761-R951 PolarHBondContact OE2-NH2 3.49Å
952	R	51.3	Low	71.5	Confident	158 Å²	158	49.2 Å²	49.2	60%	0.596	28%	0.275	S	S	*	.			trans	-83.4	140.7	171.2	-75.3	-172.5	168.5	-148.2	2.6	111	S950 D954	S950-R952 VanDerWaalsContact C-N 3.27Å; S950-R952 PolarHBondContact O-N 2.84Å; R952-D954 VanDerWaalsContact C-N 3.25Å; R952-D954 WeakPolarHBondContact CB-OD1 3.26Å; R952-D954 IonicContact NH1-OD2 3.56Å; R952-D954 PolarHBondContact NH1-OD2 3.17Å; R952-D954 PolarHBondContact O-N 3.38Å
953	S	41.3	Very low	71.3	Confident	86 Å²	86	48.5 Å²	48.5	60%	0.601	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.5	178	54.2	0	0	0	0	114.2	F752	F752-S953 WeakPolarHBondContact CE1-OG 3.39Å
954	D	43.4	Very low	71.2	Confident	103 Å²	103	48.6 Å²	48.6	55%	0.551	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-18.8	-174.9	58.8	13.5	0	0	0	114.1	R952	R952-D954 VanDerWaalsContact C-N 3.25Å; R952-D954 WeakPolarHBondContact CB-OD1 3.26Å; R952-D954 IonicContact NH1-OD2 3.56Å; R952-D954 PolarHBondContact NH1-OD2 3.17Å; R952-D954 PolarHBondContact O-N 3.38Å
955	T	46.9	Very low	71.2	Confident	55 Å²	55	48.5 Å²	48.5	34%	0.337	27%	0.271	S	S	.	.	S	Bend	trans	-140.8	57.4	-164.6	42.3	0	0	0	0	112.1	D957	T955-D957 PolarHBondContact O-N 2.84Å
956	A	46.1	Very low	71.3	Confident	71 Å²	71	48.5 Å²	48.5	59%	0.587	27%	0.271	S	S	*	.	S	Bend	trans	-61.7	99.8	-176.6	0	0	0	0	0	113.4	S958 N1158	A956-S958 PolarHBondContact O-N 3.1Å; A956-S958 VanDerWaalsContact O-N 3.1Å; A956-N1158 PolarHBondContact O-ND2 3.35Å
957	D	52.2	Low	71.5	Confident	42 Å²	42	48.2 Å²	48.2	23%	0.225	27%	0.27	C	S	.	.	S	Bend	trans	61	6.4	173.2	-42.6	-76.2	0	0	0	117.3	T955 H959 L960 K993 N1158	T955-D957 PolarHBondContact O-N 2.84Å; D957-H959 PolarHBondContact O-N 2.89Å; D957-L960 HydrophobicContact CB-CD1 3.81Å; D957-L960 HydrophobicContact CB-CG 3.99Å; D957-L960 PolarHBondContact O-N 3.45Å; D957-L960 VanDerWaalsContact O-N 3.17Å; D957-L960 WeakPolarHBondContact OD1-CD1 3.45Å; D957-K993 IonicContact OD1-NZ 2.75Å; D957-N1158 WeakPolarHBondContact CB-ND2 3.41Å; D957-N1158 PolarHBondContact OD2-ND2 3.21Å
958	S	52.2	Low	71.9	Confident	51 Å²	51	47.9 Å²	47.9	36%	0.357	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-2.5	178.3	58.6	0	0	0	0	115.3	A956	A956-S958 PolarHBondContact O-N 3.1Å; A956-S958 VanDerWaalsContact O-N 3.1Å
959	H	67.9	Low	72.6	Confident	141 Å²	141	48.2 Å²	48.2	65%	0.653	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	7.2	-179.5	-58.6	-57.2	0	0	0	113.3	D957	D957-H959 PolarHBondContact O-N 2.89Å
960	L	85.6	Confident	73.9	Confident	17 Å²	17	47.6 Å²	47.6	9%	0.089	26%	0.258	C	S	.	.			trans	-71.2	139.1	176.4	-70	-171.5	0	0	0	111.6	D957 V991 K993 N1014	D957-L960 HydrophobicContact CB-CD1 3.81Å; D957-L960 HydrophobicContact CB-CG 3.99Å; D957-L960 PolarHBondContact O-N 3.45Å; D957-L960 VanDerWaalsContact O-N 3.17Å; D957-L960 WeakPolarHBondContact OD1-CD1 3.45Å; L960-V991 HydrophobicContact CB-CG1 3.61Å; L960-V991 WeakPolarHBondContact O-CG1 3.5Å; L960-K993 HydrophobicContact CD1-CG 4Å; L960-K993 HydrophobicContact CD2-CG 3.83Å; L960-N1014 PolarHBondContact O-ND2 2.96Å
961	L	89.1	Confident	75.3	Confident	10 Å²	10	46 Å²	46	5%	0.052	25%	0.247	C	C	.	.			trans	-88.2	152.1	178	-55.5	-176.9	0	0	0	113.2	F920 Q947 L963 V991 A1012 N1014 H1015 P1046	F920-L961 HydrophobicContact CB-CD1 4.48Å; F920-L961 HydrophobicContact CD2-CD1 3.41Å; F920-L961 VanDerWaalsContact CD2-CD1 3.41Å; F920-L961 HydrophobicContact CE2-CD1 3.95Å; F920-L961 HydrophobicContact CG-CD1 4.21Å; Q947-L961 VanDerWaalsContact NE2-N 3.19Å; Q947-L961 PolarHBondContact NE2-O 2.98Å; L961-L963 VanDerWaalsContact C-N 3.3Å; L961-L963 HydrophobicContact CB-CD2 3.79Å; L961-L963 PolarHBondContact O-N 2.88Å; L961-V991 WeakPolarHBondContact O-CA 3.42Å; L961-A1012 HydrophobicContact CB-CB 3.86Å; L961-A1012 HydrophobicContact CD1-CB 4.32Å; L961-N1014 WeakPolarHBondContact CA-OD1 3.4Å; L961-N1014 VanDerWaalsContact CD2-OD1 3.23Å; L961-N1014 WeakPolarHBondContact CD2-OD1 3.33Å; L961-H1015 HydrophobicContact CD2-CB 3.67Å; L961-P1046 HydrophobicContact CD1-CB 3.64Å; L961-P1046 HydrophobicContact CD1-CG 4.02Å
962	D	90.1	Very high	76.4	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	62.8	178.8	62	-59.5	0	0	0	112.9	C964 R989 A990 V991 F1013 N1014	D962-C964 PolarHBondContact O-N 3.11Å; D962-R989 HydrophobicContact CB-CG 4.49Å; D962-R989 WeakPolarHBondContact O-CG 3.34Å; D962-R989 IonicContact OD2-CZ 2.96Å; D962-R989 IonicContact OD2-NE 3.39Å; D962-R989 PolarHBondContact OD2-NE 2.88Å; D962-R989 IonicContact OD2-NH2 3.28Å; D962-R989 PolarHBondContact OD2-NH2 3.1Å; D962-A990 CarbonylContact C-O 3.56Å; D962-V991 HydrophobicContact CB-CG2 4.06Å; D962-F1013 VanDerWaalsContact CG-N 3.29Å; D962-F1013 PolarHBondContact OD1-N 2.88Å; D962-F1013 PolarHBondContact OD2-N 2.71Å; D962-N1014 HydrophobicContact CB-CB 4.44Å; D962-N1014 WeakPolarHBondContact OD1-CB 3.37Å; D962-N1014 VanDerWaalsContact OD1-CG 3.3Å; D962-N1014 PolarHBondContact OD1-N 3.34Å; D962-N1014 PolarHBondContact OD1-OD1 2.91Å; D962-N1014 VanDerWaalsContact OD1-OD1 3.11Å
963	L	92.9	Very high	77.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	136.9	-169	-51.5	-172.4	0	0	0	113.8	F920 L945 Q947 L961 R989 A990 K992 V995 A1012	F920-L963 HydrophobicContact CE1-CD2 4.38Å; F920-L963 HydrophobicContact CE2-CD2 3.63Å; F920-L963 HydrophobicContact CZ-CD2 3.51Å; L945-L963 HydrophobicContact CD2-CB 4.3Å; Q947-L963 HydrophobicContact CB-CD1 4.21Å; Q947-L963 HydrophobicContact CB-CD2 4.09Å; Q947-L963 HydrophobicContact CG-CD1 4.11Å; Q947-L963 HydrophobicContact CG-CD2 4.4Å; L961-L963 VanDerWaalsContact C-N 3.3Å; L961-L963 HydrophobicContact CB-CD2 3.79Å; L961-L963 PolarHBondContact O-N 2.88Å; L963-R989 WeakPolarHBondContact O-CA 3.27Å; L963-A990 PolarHBondContact N-O 2.96Å; L963-A990 PolarHBondContact O-N 3.12Å; L963-K992 VanDerWaalsContact CD1-O 3.24Å; L963-K992 WeakPolarHBondContact CD1-O 3.41Å; L963-V995 HydrophobicContact CB-CB 4.42Å; L963-V995 HydrophobicContact CB-CG1 3.96Å; L963-V995 HydrophobicContact CB-CG2 3.6Å; L963-V995 HydrophobicContact CD1-CG2 4.49Å; L963-A1012 HydrophobicContact CD2-CB 4.5Å
964	C	94	Very high	78	Confident	2 Å²	2	42 Å²	42	1%	0.014	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	138.7	172.9	-170.2	0	0	0	0	111.7	D962 S987 R989 C1010 C1011	D962-C964 PolarHBondContact O-N 3.11Å; C964-S987 WeakPolarHBondContact CA-OG 3.22Å; C964-R989 HydrophobicContact CB-CB 4.16Å; C964-R989 HydrophobicContact CB-CG 4.11Å; C964-C1010 WeakPolarHBondContact O-CA 3.47Å; C964-C1011 PolarHBondContact N-O 3.41Å; C964-C1011 PolarHBondContact O-N 2.89Å
965	I	96.4	Very high	78.7	Confident	0 Å²	0	40 Å²	40	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.8	170	-53.7	168.5	0	0	0	108.1	F943 L945 V967 H986 S987 V995 C997 V1008	F943-I965 HydrophobicContact CB-CD1 3.94Å; F943-I965 HydrophobicContact CB-CG2 4.39Å; L945-I965 HydrophobicContact CB-CD1 3.62Å; L945-I965 HydrophobicContact CB-CG1 3.63Å; L945-I965 HydrophobicContact CD2-CG1 3.82Å; L945-I965 HydrophobicContact CG-CG1 4.38Å; I965-V967 HydrophobicContact CG2-CG2 4.3Å; I965-H986 CarbonylContact O-C 3.55Å; I965-H986 WeakPolarHBondContact O-CA 3.3Å; I965-H986 VanDerWaalsContact O-CB 3.31Å; I965-H986 WeakPolarHBondContact O-CB 3.23Å; I965-S987 PolarHBondContact N-OG 2.98Å; I965-S987 PolarHBondContact O-N 3.46Å; I965-V995 HydrophobicContact CD1-CG2 4.2Å; I965-V995 HydrophobicContact CG1-CG2 4.11Å; I965-C997 HydrophobicContact CB-CB 4.26Å; I965-C997 HydrophobicContact CD1-CB 4.02Å; I965-C997 HydrophobicContact CG2-CB 4.33Å; I965-V1008 HydrophobicContact CG2-CG1 3.8Å
966	M	97.2	Very high	79.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.1	172.2	-60.5	174.6	-73.2	0	0	110.3	F968 L983 H986 V1008 V1009 A1073 I1074 L1077	M966-F968 HydrophobicContact CB-CD2 4.36Å; M966-F968 HydrophobicContact CB-CE2 3.46Å; M966-F968 VanDerWaalsContact CB-CE2 3.46Å; M966-F968 HydrophobicContact CB-CZ 3.81Å; M966-F968 HydrophobicContact SD-CE2 4.46Å; M966-F968 HydrophobicContact SD-CZ 4.17Å; M966-L983 HydrophobicContact CB-CD1 4.23Å; M966-H986 HydrophobicContact CG-CB 4.41Å; M966-V1008 WeakPolarHBondContact O-CA 3.25Å; M966-V1009 HydrophobicContact CB-CB 4.49Å; M966-V1009 HydrophobicContact CE-CB 4.02Å; M966-V1009 HydrophobicContact CE-CG1 3.7Å; M966-V1009 PolarHBondContact N-O 3.36Å; M966-V1009 PolarHBondContact O-N 2.8Å; M966-A1073 HydrophobicContact CE-CB 3.72Å; M966-A1073 HydrophobicContact SD-CB 4.19Å; M966-I1074 HydrophobicContact CE-CD1 4.3Å; M966-I1074 HydrophobicContact SD-CD1 4.25Å; M966-L1077 HydrophobicContact CG-CD2 3.97Å; M966-L1077 HydrophobicContact SD-CB 4.21Å; M966-L1077 HydrophobicContact SD-CD2 3.55Å; M966-L1077 VanDerWaalsContact SD-CD2 3.55Å
967	V	98.3	Very high	80.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	115.6	-177.8	-173.8	0	0	0	0	110	F943 I965 L984 A985 V1008	F943-V967 HydrophobicContact CD2-CG2 4.12Å; F943-V967 HydrophobicContact CE2-CG2 3.85Å; F943-V967 HydrophobicContact CZ-CG2 4.3Å; I965-V967 HydrophobicContact CG2-CG2 4.3Å; V967-L984 PolarHBondContact O-N 3.19Å; V967-A985 HydrophobicContact CB-CB 4.47Å; V967-A985 PolarHBondContact N-O 3.05Å; V967-A985 PolarHBondContact O-N 3.33Å; V967-V1008 HydrophobicContact CG1-CG2 4.4Å; V967-V1008 HydrophobicContact CG2-CG1 4.4Å; V967-V1008 HydrophobicContact CG2-CG2 4.32Å
968	F	98.1	Very high	82.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	149.5	179.7	-56	-89.1	0	0	0	110.9	M966 L980 R982 L983 Y1006 A1007 V1009 A1073 L1076	M966-F968 HydrophobicContact CB-CD2 4.36Å; M966-F968 HydrophobicContact CB-CE2 3.46Å; M966-F968 VanDerWaalsContact CB-CE2 3.46Å; M966-F968 HydrophobicContact CB-CZ 3.81Å; M966-F968 HydrophobicContact SD-CE2 4.46Å; M966-F968 HydrophobicContact SD-CZ 4.17Å; F968-L980 HydrophobicContact CB-CD2 4.14Å; F968-L980 HydrophobicContact CD2-CD1 4.25Å; F968-L980 HydrophobicContact CD2-CD2 3.99Å; F968-L980 HydrophobicContact CE2-CD1 4.23Å; F968-L980 HydrophobicContact CG-CB 4.45Å; F968-L980 HydrophobicContact CG-CD2 4.14Å; F968-R982 WeakPolarHBondContact CA-O 3.37Å; F968-L983 HydrophobicContact CD1-CB 3.99Å; F968-L983 HydrophobicContact CD1-CD1 3.94Å; F968-L983 HydrophobicContact CE1-CB 3.91Å; F968-L983 HydrophobicContact CE1-CD1 3.52Å; F968-L983 HydrophobicContact CE1-CG 4.32Å; F968-L983 HydrophobicContact CE2-CD1 4.35Å; F968-L983 HydrophobicContact CG-CD1 4.5Å; F968-L983 HydrophobicContact CZ-CD1 3.75Å; F968-Y1006 CarbonylContact O-C 3.56Å; F968-Y1006 VanDerWaalsContact O-CA 3.27Å; F968-Y1006 WeakPolarHBondContact O-CA 3.28Å; F968-A1007 PolarHBondContact N-O 3.36Å; F968-A1007 PolarHBondContact O-N 3.46Å; F968-V1009 HydrophobicContact CD2-CG2 4.18Å; F968-V1009 HydrophobicContact CE2-CB 4.32Å; F968-V1009 HydrophobicContact CE2-CG2 4Å; F968-A1073 HydrophobicContact CE2-CB 3.73Å; F968-A1073 HydrophobicContact CZ-CB 3.65Å; F968-L1076 HydrophobicContact CD1-CD1 4.22Å; F968-L1076 HydrophobicContact CE1-CB 3.79Å; F968-L1076 HydrophobicContact CE1-CD1 4.11Å
969	R	96	Very high	84.5	Confident	118 Å²	118	42.6 Å²	42.6	45%	0.445	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	137.4	156.2	-168.9	170.7	-178.6	86.7	-10.2	107.9	G981 R982 L984 Y1006	R969-G981 VanDerWaalsContact O-CA 3.3Å; R969-G981 WeakPolarHBondContact O-CA 3.46Å; R969-G981 PolarHBondContact O-N 2.89Å; R969-R982 PolarHBondContact N-O 2.63Å; R969-L984 HydrophobicContact CB-CD1 4.23Å; R969-Y1006 HydrophobicContact CB-CD1 4.34Å; R969-Y1006 HydrophobicContact CB-CE1 4.23Å; R969-Y1006 HydrophobicContact CG-CE1 4.24Å; R969-Y1006 PolarHBondContact NH1-OH 2.85Å
970	A	93.5	Very high	85.7	Confident	11 Å²	11	37.3 Å²	37.3	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	165.5	-174.8	0	0	0	0	0	111.9	F972 L978 T979 E1005 A1007	A970-F972 HydrophobicContact CB-CE2 3.88Å; A970-F972 HydrophobicContact CB-CZ 4.18Å; A970-L978 HydrophobicContact CB-CD1 3.84Å; A970-T979 WeakPolarHBondContact CA-O 3.43Å; A970-E1005 PolarHBondContact N-O 2.92Å; A970-A1007 HydrophobicContact CB-CB 3.72Å
971	S	88.1	Confident	86.1	Confident	62 Å²	62	38 Å²	38	43%	0.434	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	136.3	163.9	43.6	0	0	0	0	109.8	T979	S971-T979 PolarHBondContact N-O 2.86Å; S971-T979 PolarHBondContact O-N 2.95Å; S971-T979 PolarHBondContact O-OG1 2.93Å; S971-T979 VanDerWaalsContact O-OG1 3.08Å; S971-T979 PolarHBondContact OG-OG1 3.02Å
972	F	83.6	Confident	86.4	Confident	39 Å²	39	46.4 Å²	46.4	17%	0.171	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	99	-177.7	-63.2	-89.1	0	0	0	109.7	A932 A970 L978 E1005 V1063	A932-F972 HydrophobicContact CB-CE1 3.91Å; A932-F972 HydrophobicContact CB-CE2 4.1Å; A932-F972 HydrophobicContact CB-CZ 3.37Å; A970-F972 HydrophobicContact CB-CE2 3.88Å; A970-F972 HydrophobicContact CB-CZ 4.18Å; F972-L978 HydrophobicContact CD1-CB 4.3Å; F972-L978 HydrophobicContact CD1-CD1 4.3Å; F972-L978 HydrophobicContact CE1-CB 4.1Å; F972-L978 HydrophobicContact CE1-CD1 3.67Å; F972-L978 HydrophobicContact CE1-CG 4.37Å; F972-L978 HydrophobicContact CZ-CD1 3.78Å; F972-E1005 HydrophobicContact CD2-CB 4.31Å; F972-E1005 HydrophobicContact CE2-CB 4.21Å; F972-V1063 HydrophobicContact CE1-CG1 4.47Å; F972-V1063 HydrophobicContact CE1-CG2 4.22Å
973	G	70.1	Confident	86.7	Confident	37 Å²	37	46.8 Å²	46.8	38%	0.381	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	168	-174.9	0	0	0	0	0	114	G975 N976 K977	G973-G975 PolarHBondContact O-N 3.3Å; G973-G975 VanDerWaalsContact O-N 3.09Å; G973-N976 WeakPolarHBondContact O-CA 3.31Å; G973-N976 PolarHBondContact O-N 3.24Å; G973-K977 PolarHBondContact N-O 3.34Å
974	S	56.5	Low	86.9	Confident	122 Å²	122	49.9 Å²	49.9	85%	0.853	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	116.6	172.8	54	0	0	0	0	110.8
975	G	57.2	Low	87	Confident	63 Å²	63	50.4 Å²	50.4	65%	0.649	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.1	18.3	-169.4	0	0	0	0	0	115	G973 K977	G973-G975 PolarHBondContact O-N 3.3Å; G973-G975 VanDerWaalsContact O-N 3.09Å; G975-K977 PolarHBondContact O-N 2.89Å; G975-K977 VanDerWaalsContact O-N 3.13Å
976	N	61.1	Low	86.9	Confident	56 Å²	56	53 Å²	53	30%	0.299	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	16.2	-178.9	-75.4	13.4	0	0	0	115	R560 G973 L978	R560-N976 PolarHBondContact NE-OD1 3.41Å; R560-N976 PolarHBondContact NH2-OD1 3.08Å; G973-N976 WeakPolarHBondContact O-CA 3.31Å; G973-N976 PolarHBondContact O-N 3.24Å; N976-L978 PolarHBondContact O-N 3.02Å
977	K	78	Confident	86.7	Confident	137 Å²	137	53.1 Å²	53.1	60%	0.596	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	108	178	-174.3	179.1	179.3	-177.7	0	109.8	G973 G975	G973-K977 PolarHBondContact N-O 3.34Å; G975-K977 PolarHBondContact O-N 2.89Å; G975-K977 VanDerWaalsContact O-N 3.13Å
978	L	89.6	Confident	86.2	Confident	14 Å²	14	59.8 Å²	59.8	7%	0.073	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	135.6	170.5	170.6	61.5	0	0	0	110.3	V930 A970 F972 N976 L980 A1007 A1065 T1069	V930-L978 HydrophobicContact CB-CD2 3.98Å; V930-L978 HydrophobicContact CG1-CD2 3.79Å; V930-L978 HydrophobicContact CG2-CD2 4.03Å; A970-L978 HydrophobicContact CB-CD1 3.84Å; F972-L978 HydrophobicContact CD1-CB 4.3Å; F972-L978 HydrophobicContact CD1-CD1 4.3Å; F972-L978 HydrophobicContact CE1-CB 4.1Å; F972-L978 HydrophobicContact CE1-CD1 3.67Å; F972-L978 HydrophobicContact CE1-CG 4.37Å; F972-L978 HydrophobicContact CZ-CD1 3.78Å; N976-L978 PolarHBondContact O-N 3.02Å; L978-L980 HydrophobicContact CD1-CD2 4.21Å; L978-L980 HydrophobicContact CD2-CD2 4.1Å; L978-L980 HydrophobicContact CG-CD2 4.31Å; L978-A1007 HydrophobicContact CD1-CB 3.99Å; L978-A1007 HydrophobicContact CD2-CB 4.38Å; L978-A1065 HydrophobicContact CD2-CB 3.89Å; L978-T1069 HydrophobicContact CD2-CG2 4.09Å
979	T	90.7	Very high	85.7	Confident	65 Å²	65	60 Å²	60	40%	0.399	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.5	161.2	51	0	0	0	0	109.9	A970 S971	A970-T979 WeakPolarHBondContact CA-O 3.43Å; S971-T979 PolarHBondContact N-O 2.86Å; S971-T979 PolarHBondContact O-N 2.95Å; S971-T979 PolarHBondContact O-OG1 2.93Å; S971-T979 VanDerWaalsContact O-OG1 3.08Å; S971-T979 PolarHBondContact OG-OG1 3.02Å
980	L	94.8	Very high	85.2	Confident	30 Å²	30	55.2 Å²	55.2	16%	0.157	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	128	174.4	-60.3	-178.5	0	0	0	109.4	F968 L978 A1007 T1069 D1072 A1073 L1076	F968-L980 HydrophobicContact CB-CD2 4.14Å; F968-L980 HydrophobicContact CD2-CD1 4.25Å; F968-L980 HydrophobicContact CD2-CD2 3.99Å; F968-L980 HydrophobicContact CE2-CD1 4.23Å; F968-L980 HydrophobicContact CG-CB 4.45Å; F968-L980 HydrophobicContact CG-CD2 4.14Å; L978-L980 HydrophobicContact CD1-CD2 4.21Å; L978-L980 HydrophobicContact CD2-CD2 4.1Å; L978-L980 HydrophobicContact CG-CD2 4.31Å; L980-A1007 HydrophobicContact CD2-CB 3.67Å; L980-T1069 HydrophobicContact CD1-CG2 3.9Å; L980-T1069 HydrophobicContact CG-CG2 4.2Å; L980-D1072 HydrophobicContact CD1-CB 4.16Å; L980-A1073 HydrophobicContact CD1-CB 3.76Å; L980-L1076 HydrophobicContact CB-CD1 3.78Å
981	G	93.6	Very high	84.9	Confident	32 Å²	32	55.5 Å²	55.5	33%	0.33	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-148.4	170.1	0	0	0	0	0	111.5	R969 L983	R969-G981 VanDerWaalsContact O-CA 3.3Å; R969-G981 WeakPolarHBondContact O-CA 3.46Å; R969-G981 PolarHBondContact O-N 2.89Å; G981-L983 PolarHBondContact O-N 2.79Å
982	R	93.9	Very high	84.8	Confident	187 Å²	187	56.5 Å²	56.5	71%	0.706	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.6	132.3	-179.5	169.4	171.8	176.8	-173	0.8	112.5	F968 R969 L984	F968-R982 WeakPolarHBondContact CA-O 3.37Å; R969-R982 PolarHBondContact N-O 2.63Å; R982-L984 HydrophobicContact CG-CD2 4.19Å
983	L	96.8	Very high	85	Confident	7 Å²	7	56.8 Å²	56.8	4%	0.037	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	137.5	163.6	-176.2	78.1	0	0	0	110.8	M966 F968 G981 L1077 N1080 K1081	M966-L983 HydrophobicContact CB-CD1 4.23Å; F968-L983 HydrophobicContact CD1-CB 3.99Å; F968-L983 HydrophobicContact CD1-CD1 3.94Å; F968-L983 HydrophobicContact CE1-CB 3.91Å; F968-L983 HydrophobicContact CE1-CD1 3.52Å; F968-L983 HydrophobicContact CE1-CG 4.32Å; F968-L983 HydrophobicContact CE2-CD1 4.35Å; F968-L983 HydrophobicContact CG-CD1 4.5Å; F968-L983 HydrophobicContact CZ-CD1 3.75Å; G981-L983 PolarHBondContact O-N 2.79Å; L983-L1077 HydrophobicContact CD2-CB 4.48Å; L983-L1077 HydrophobicContact CD2-CD1 3.49Å; L983-L1077 VanDerWaalsContact CD2-CD1 3.49Å; L983-N1080 HydrophobicContact CD2-CB 4.19Å; L983-K1081 HydrophobicContact CD2-CG 4.39Å
984	L	96.9	Very high	86	Confident	65 Å²	65	56.2 Å²	56.2	34%	0.34	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-45.5	-176.3	-56	170.8	0	0	0	111.7	V967 R969 R982 L1001 Y1006	V967-L984 PolarHBondContact O-N 3.19Å; R969-L984 HydrophobicContact CB-CD1 4.23Å; R982-L984 HydrophobicContact CG-CD2 4.19Å; L984-L1001 HydrophobicContact CD1-CD2 3.76Å; L984-Y1006 HydrophobicContact CD1-CD1 3.5Å; L984-Y1006 VanDerWaalsContact CD1-CD1 3.5Å; L984-Y1006 HydrophobicContact CD1-CE1 3.31Å
985	A	96.6	Very high	87.7	Confident	14 Å²	14	51 Å²	51	12%	0.116	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	160	177.6	0	0	0	0	0	110.8	V967 V999	V967-A985 HydrophobicContact CB-CB 4.47Å; V967-A985 PolarHBondContact N-O 3.05Å; V967-A985 PolarHBondContact O-N 3.33Å; A985-V999 HydrophobicContact CB-CB 3.71Å; A985-V999 HydrophobicContact CB-CG1 4.44Å; A985-V999 HydrophobicContact CB-CG2 3.78Å
986	H	95	Very high	89.4	Confident	53 Å²	53	48.9 Å²	48.9	25%	0.245	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	155.1	172.7	64.4	88.7	0	0	0	109.8	I965 M966 C997 L1077 K1081	I965-H986 CarbonylContact O-C 3.55Å; I965-H986 WeakPolarHBondContact O-CA 3.3Å; I965-H986 VanDerWaalsContact O-CB 3.31Å; I965-H986 WeakPolarHBondContact O-CB 3.23Å; M966-H986 HydrophobicContact CG-CB 4.41Å; H986-C997 VanDerWaalsContact C-SG 3.5Å; H986-L1077 HydrophobicContact CB-CD1 4.36Å; H986-K1081 VanDerWaalsContact NE2-CE 3.3Å; H986-K1081 WeakPolarHBondContact NE2-CE 3.33Å
987	S	92.8	Very high	91	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.021	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-73.2	165.2	169.5	72.1	0	0	0	0	110.8	C964 I965 G996	C964-S987 WeakPolarHBondContact CA-OG 3.22Å; I965-S987 PolarHBondContact N-OG 2.98Å; I965-S987 PolarHBondContact O-N 3.46Å; S987-G996 WeakPolarHBondContact CB-O 3.31Å
988	K	86.7	Confident	91.8	Very high	140 Å²	140	45 Å²	45	61%	0.609	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-62.3	142.8	151.8	-71	-168.1	175.8	-169.8	0	108
989	R	88.1	Confident	92.2	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.015	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-90.1	117.6	174.4	177.9	178.1	168.5	-133	6.3	108.7	D962 L963 C964 W1100 A1101 L1152 S1153	D962-R989 HydrophobicContact CB-CG 4.49Å; D962-R989 WeakPolarHBondContact O-CG 3.34Å; D962-R989 IonicContact OD2-CZ 2.96Å; D962-R989 IonicContact OD2-NE 3.39Å; D962-R989 PolarHBondContact OD2-NE 2.88Å; D962-R989 IonicContact OD2-NH2 3.28Å; D962-R989 PolarHBondContact OD2-NH2 3.1Å; L963-R989 WeakPolarHBondContact O-CA 3.27Å; C964-R989 HydrophobicContact CB-CB 4.16Å; C964-R989 HydrophobicContact CB-CG 4.11Å; R989-W1100 VanDerWaalsContact CB-CD1 3.43Å; R989-W1100 HydrophobicContact CB-CD2 4.39Å; R989-W1100 HydrophobicContact CB-CG 3.95Å; R989-A1101 WeakPolarHBondContact O-CB 3.4Å; R989-A1101 PolarHBondContact O-N 3.32Å; R989-L1152 PolarHBondContact NH1-O 3.16Å; R989-L1152 PolarHBondContact NH2-O 2.76Å; R989-S1153 PolarHBondContact NH2-OG 2.85Å
990	A	86.1	Confident	92.5	Very high	18 Å²	18	47.4 Å²	47.4	15%	0.149	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	145.1	-171.5	0	0	0	0	0	113.1	D962 L963 K992 V995	D962-A990 CarbonylContact C-O 3.56Å; L963-A990 PolarHBondContact N-O 2.96Å; L963-A990 PolarHBondContact O-N 3.12Å; A990-K992 VanDerWaalsContact C-N 3.33Å; A990-K992 HydrophobicContact CB-CD 4.16Å; A990-K992 HydrophobicContact CB-CG 4.01Å; A990-K992 PolarHBondContact O-N 2.91Å; A990-V995 HydrophobicContact CB-CG1 4.45Å
991	V	87.1	Confident	92.6	Very high	18 Å²	18	46.1 Å²	46.1	11%	0.109	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	86.5	171	-177.1	0	0	0	0	108.9	L960 L961 D962 Q1154	L960-V991 HydrophobicContact CB-CG1 3.61Å; L960-V991 WeakPolarHBondContact O-CG1 3.5Å; L961-V991 WeakPolarHBondContact O-CA 3.42Å; D962-V991 HydrophobicContact CB-CG2 4.06Å; V991-Q1154 HydrophobicContact CG2-CB 4.04Å; V991-Q1154 HydrophobicContact CG2-CG 4.19Å
992	K	86.1	Confident	92.7	Very high	82 Å²	82	48.7 Å²	48.7	36%	0.357	24%	0.236	S	C	.	.	S	Bend	trans	-145.8	149.9	-175.7	-69.9	-170.6	178.4	-169.8	0	111	Q947 L963 A990 F994	Q947-K992 PolarHBondContact NE2-O 2.9Å; L963-K992 VanDerWaalsContact CD1-O 3.24Å; L963-K992 WeakPolarHBondContact CD1-O 3.41Å; A990-K992 VanDerWaalsContact C-N 3.33Å; A990-K992 HydrophobicContact CB-CD 4.16Å; A990-K992 HydrophobicContact CB-CG 4.01Å; A990-K992 PolarHBondContact O-N 2.91Å; K992-F994 WeakPolarHBondContact CB-O 3.33Å; K992-F994 PolarHBondContact O-N 2.91Å; K992-F994 VanDerWaalsContact O-N 3.13Å
993	K	86.9	Confident	92.8	Very high	46 Å²	46	42.9 Å²	42.9	20%	0.2	22%	0.223	C	C	.	.	S	Bend	trans	-56.8	-27.6	177.3	-68.8	169.7	-175.6	153.8	0	113.5	E761 Q947 D957 L960	E761-K993 HydrophobicContact CG-CD 4.43Å; E761-K993 IonicContact OE1-NZ 3.93Å; E761-K993 PolarHBondContact OE1-NZ 2.91Å; E761-K993 IonicContact OE2-NZ 3.79Å; E761-K993 PolarHBondContact OE2-NZ 3.25Å; Q947-K993 PolarHBondContact N-O 2.97Å; Q947-K993 VanDerWaalsContact N-O 3.12Å; D957-K993 IonicContact OD1-NZ 2.75Å; L960-K993 HydrophobicContact CD1-CG 4Å; L960-K993 HydrophobicContact CD2-CG 3.83Å
994	F	91.6	Very high	92.5	Very high	25 Å²	25	43.5 Å²	43.5	11%	0.11	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	162.7	167.9	53.5	-93.3	0	0	0	111.9	I760 A764 C771 L945 F946 K992	I760-F994 HydrophobicContact CB-CZ 4.49Å; I760-F994 HydrophobicContact CD1-CE2 4.08Å; I760-F994 HydrophobicContact CD1-CZ 4.2Å; I760-F994 HydrophobicContact CG1-CE2 4.24Å; I760-F994 HydrophobicContact CG1-CZ 3.92Å; I760-F994 HydrophobicContact CG2-CZ 4.14Å; A764-F994 HydrophobicContact CB-CE1 3.74Å; A764-F994 HydrophobicContact CB-CZ 3.8Å; C771-F994 HydrophobicContact CB-CE2 4.05Å; C771-F994 HydrophobicContact CB-CZ 4.33Å; L945-F994 CarbonylContact O-C 3.52Å; L945-F994 WeakPolarHBondContact O-CA 3.37Å; L945-F994 VanDerWaalsContact O-CB 3.28Å; L945-F994 WeakPolarHBondContact O-CB 3.46Å; F946-F994 HydrophobicContact CB-CB 4.46Å; F946-F994 HydrophobicContact CD1-CB 3.56Å; F946-F994 AromaticContact CD1-CD1 3.93Å; F946-F994 HydrophobicContact CD1-CD1 3.93Å; F946-F994 AromaticContact CD1-CG 3.96Å; F946-F994 HydrophobicContact CD1-CG 3.96Å; F946-F994 HydrophobicContact CE1-CB 3.95Å; F946-F994 AromaticContact CE1-CD1 3.95Å; F946-F994 HydrophobicContact CE1-CD1 3.95Å; F946-F994 AromaticContact CE1-CG 3.94Å; F946-F994 HydrophobicContact CE1-CG 3.94Å; F946-F994 HydrophobicContact CG-CB 4.04Å; K992-F994 WeakPolarHBondContact CB-O 3.33Å; K992-F994 PolarHBondContact O-N 2.91Å; K992-F994 VanDerWaalsContact O-N 3.13Å
995	V	92.8	Very high	92.3	Very high	11 Å²	11	44.3 Å²	44.3	7%	0.067	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.8	170.4	-67.3	0	0	0	0	111.1	L945 L963 I965 A990	L945-V995 HydrophobicContact CB-CG2 4.12Å; L945-V995 HydrophobicContact CD2-CG2 4.37Å; L945-V995 PolarHBondContact N-O 3.47Å; L945-V995 PolarHBondContact O-N 3.1Å; L963-V995 HydrophobicContact CB-CB 4.42Å; L963-V995 HydrophobicContact CB-CG1 3.96Å; L963-V995 HydrophobicContact CB-CG2 3.6Å; L963-V995 HydrophobicContact CD1-CG2 4.49Å; I965-V995 HydrophobicContact CD1-CG2 4.2Å; I965-V995 HydrophobicContact CG1-CG2 4.11Å; A990-V995 HydrophobicContact CB-CG1 4.45Å
996	G	93.1	Very high	92.4	Very high	19 Å²	19	44 Å²	44	20%	0.196	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	157.8	177.2	0	0	0	0	0	113.6	F943 S987	F943-G996 CarbonylContact O-C 3.58Å; F943-G996 WeakPolarHBondContact O-CA 3.42Å; S987-G996 WeakPolarHBondContact CB-O 3.31Å
997	C	93.8	Very high	92.5	Very high	10 Å²	10	41.5 Å²	41.5	7%	0.068	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	118.4	170.5	178.4	0	0	0	0	109.6	F943 I965 H986	F943-C997 HydrophobicContact CB-CB 4.3Å; F943-C997 WeakPolarHBondContact CD2-O 3.23Å; F943-C997 PolarHBondContact N-O 3.08Å; F943-C997 PolarHBondContact O-N 2.98Å; I965-C997 HydrophobicContact CB-CB 4.26Å; I965-C997 HydrophobicContact CD1-CB 4.02Å; I965-C997 HydrophobicContact CG2-CB 4.33Å; H986-C997 VanDerWaalsContact C-SG 3.5Å
998	D	94.9	Very high	92.7	Very high	101 Å²	101	41.3 Å²	41.3	54%	0.54	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	148.8	174.2	63.8	-80.4	0	0	0	112.5	L941 E942	L941-D998 WeakPolarHBondContact O-CA 3.22Å; E942-D998 HydrophobicContact CG-CB 4.08Å
999	V	97.2	Very high	93.2	Very high	22 Å²	22	34.8 Å²	34.8	13%	0.133	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	148.3	177.5	66.5	0	0	0	0	111.6	L941 F943 A985 L1001	L941-V999 HydrophobicContact CB-CG1 4.26Å; L941-V999 PolarHBondContact N-O 3.06Å; L941-V999 PolarHBondContact O-N 3.36Å; F943-V999 HydrophobicContact CD2-CG1 4.41Å; F943-V999 HydrophobicContact CE2-CG1 3.74Å; A985-V999 HydrophobicContact CB-CB 3.71Å; A985-V999 HydrophobicContact CB-CG1 4.44Å; A985-V999 HydrophobicContact CB-CG2 3.78Å; V999-L1001 HydrophobicContact CG1-CD1 4.49Å; V999-L1001 HydrophobicContact CG1-CD2 4.03Å; V999-L1001 HydrophobicContact CG1-CG 4.01Å; V999-L1001 HydrophobicContact CG2-CD2 3.7Å; V999-L1001 HydrophobicContact CG2-CG 4.43Å
1000	M	97.4	Very high	93.5	Very high	108 Å²	108	35 Å²	35	53%	0.532	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.4	166.9	-169.5	173.5	-71	0	0	109.7	R938 A940	R938-M1000 HydrophobicContact CG-CG 4.41Å; R938-M1000 PolarHBondContact NE-SD 2.85Å; R938-M1000 PolarHBondContact NH2-SD 2.81Å; A940-M1000 HydrophobicContact CB-CE 4.24Å
1001	L	97.2	Very high	93.8	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	139.2	179.4	-59.8	-173.2	0	0	0	111.3	L933 V935 R938 T939 L941 L984 V999 Y1006	L933-L1001 HydrophobicContact CD2-CD1 3.95Å; V935-L1001 HydrophobicContact CG1-CB 4.36Å; V935-L1001 HydrophobicContact CG2-CB 4.07Å; V935-L1001 HydrophobicContact CG2-CD1 3.96Å; R938-L1001 CarbonylContact C-O 3.52Å; R938-L1001 WeakPolarHBondContact CA-O 3.34Å; T939-L1001 PolarHBondContact N-O 3.49Å; T939-L1001 PolarHBondContact O-N 2.99Å; L941-L1001 HydrophobicContact CD1-CB 4.02Å; L941-L1001 HydrophobicContact CD1-CD1 3.63Å; L941-L1001 HydrophobicContact CD1-CG 3.78Å; L984-L1001 HydrophobicContact CD1-CD2 3.76Å; V999-L1001 HydrophobicContact CG1-CD1 4.49Å; V999-L1001 HydrophobicContact CG1-CD2 4.03Å; V999-L1001 HydrophobicContact CG1-CG 4.01Å; V999-L1001 HydrophobicContact CG2-CD2 3.7Å; V999-L1001 HydrophobicContact CG2-CG 4.43Å; L1001-Y1006 HydrophobicContact CB-CE2 4.27Å; L1001-Y1006 HydrophobicContact CD1-CD1 3.87Å; L1001-Y1006 HydrophobicContact CD1-CD2 3.91Å; L1001-Y1006 HydrophobicContact CD1-CE1 4.13Å; L1001-Y1006 HydrophobicContact CD1-CE2 4.18Å; L1001-Y1006 HydrophobicContact CD1-CG 3.76Å; L1001-Y1006 HydrophobicContact CD2-CD1 4.16Å; L1001-Y1006 HydrophobicContact CD2-CE1 3.87Å; L1001-Y1006 HydrophobicContact CG-CE1 4.41Å
1002	E	96.2	Very high	94.1	Very high	85 Å²	85	33.4 Å²	33.4	40%	0.397	18%	0.179	S	C	.	.			trans	-80.5	173.2	166.6	-64.3	-62.4	168.1	0	0	110.3	V935 R938 Y1006	V935-E1002 WeakPolarHBondContact CG1-O 3.39Å; R938-E1002 WeakPolarHBondContact CB-OE2 3.47Å; R938-E1002 VanDerWaalsContact CD-OE1 3.3Å; R938-E1002 WeakPolarHBondContact CD-OE1 3.48Å; R938-E1002 WeakPolarHBondContact CD-OE2 3.33Å; R938-E1002 WeakPolarHBondContact CG-OE2 2.91Å; R938-E1002 IonicContact CZ-OE1 3.39Å; R938-E1002 VanDerWaalsContact CZ-OE1 3.24Å; R938-E1002 IonicContact NE-OE1 2.67Å; R938-E1002 PolarHBondContact NE-OE1 2.84Å; R938-E1002 IonicContact NH1-OE1 2.69Å; R938-E1002 PolarHBondContact NH1-OE1 3.32Å; E1002-Y1006 WeakPolarHBondContact O-CE2 3.49Å; E1002-Y1006 PolarHBondContact O-OH 3.14Å
1003	P	94.8	Very high	94.4	Very high	65 Å²	65	29.6 Å²	29.6	42%	0.422	16%	0.163	S	C	.	.	S	Bend	trans	-57.3	139.4	175	-26.8	36.2	0	0	0	113.7	V935	V935-P1003 WeakPolarHBondContact O-CA 3.26Å
1004	G	90.6	Very high	94.5	Very high	21 Å²	21	27.8 Å²	27.8	22%	0.216	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-165.4	175.1	0	0	0	0	0	115.4	V935 Y1006	V935-G1004 PolarHBondContact N-O 2.98Å; V935-G1004 PolarHBondContact O-N 2.98Å; G1004-Y1006 VanDerWaalsContact C-CE2 3.48Å; G1004-Y1006 WeakPolarHBondContact O-CD2 3.31Å; G1004-Y1006 WeakPolarHBondContact O-CE2 3.28Å
1005	E	94.3	Very high	94.2	Very high	82 Å²	82	27.3 Å²	27.3	38%	0.383	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.5	179.9	-62.2	-174.5	146.2	0	0	111.3	A970 F972	A970-E1005 PolarHBondContact N-O 2.92Å; F972-E1005 HydrophobicContact CD2-CB 4.31Å; F972-E1005 HydrophobicContact CE2-CB 4.21Å
1006	Y	97.3	Very high	93.9	Very high	7 Å²	7	27 Å²	27	3%	0.027	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	153.8	-172.4	-61.5	-85.6	0	0	0	110.7	A932 L933 V935 F968 R969 L984 L1001 E1002 G1004	A932-Y1006 WeakPolarHBondContact CA-O 3.27Å; L933-Y1006 PolarHBondContact N-O 3.41Å; L933-Y1006 PolarHBondContact O-N 3.17Å; V935-Y1006 HydrophobicContact CB-CD2 4.25Å; V935-Y1006 HydrophobicContact CB-CE2 3.98Å; V935-Y1006 HydrophobicContact CG2-CD2 3.84Å; V935-Y1006 HydrophobicContact CG2-CE2 3.95Å; F968-Y1006 CarbonylContact O-C 3.56Å; F968-Y1006 VanDerWaalsContact O-CA 3.27Å; F968-Y1006 WeakPolarHBondContact O-CA 3.28Å; R969-Y1006 HydrophobicContact CB-CD1 4.34Å; R969-Y1006 HydrophobicContact CB-CE1 4.23Å; R969-Y1006 HydrophobicContact CG-CE1 4.24Å; R969-Y1006 PolarHBondContact NH1-OH 2.85Å; L984-Y1006 HydrophobicContact CD1-CD1 3.5Å; L984-Y1006 VanDerWaalsContact CD1-CD1 3.5Å; L984-Y1006 HydrophobicContact CD1-CE1 3.31Å; L1001-Y1006 HydrophobicContact CB-CE2 4.27Å; L1001-Y1006 HydrophobicContact CD1-CD1 3.87Å; L1001-Y1006 HydrophobicContact CD1-CD2 3.91Å; L1001-Y1006 HydrophobicContact CD1-CE1 4.13Å; L1001-Y1006 HydrophobicContact CD1-CE2 4.18Å; L1001-Y1006 HydrophobicContact CD1-CG 3.76Å; L1001-Y1006 HydrophobicContact CD2-CD1 4.16Å; L1001-Y1006 HydrophobicContact CD2-CE1 3.87Å; L1001-Y1006 HydrophobicContact CG-CE1 4.41Å; E1002-Y1006 WeakPolarHBondContact O-CE2 3.49Å; E1002-Y1006 PolarHBondContact O-OH 3.14Å; G1004-Y1006 VanDerWaalsContact C-CE2 3.48Å; G1004-Y1006 WeakPolarHBondContact O-CD2 3.31Å; G1004-Y1006 WeakPolarHBondContact O-CE2 3.28Å
1007	A	97	Very high	93	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.8	176.2	0	0	0	0	0	109.7	V930 T931 F968 A970 L978 L980	V930-A1007 HydrophobicContact CG1-CB 3.89Å; T931-A1007 WeakPolarHBondContact O-CA 3.45Å; F968-A1007 PolarHBondContact N-O 3.36Å; F968-A1007 PolarHBondContact O-N 3.46Å; A970-A1007 HydrophobicContact CB-CB 3.72Å; L978-A1007 HydrophobicContact CD1-CB 3.99Å; L978-A1007 HydrophobicContact CD2-CB 4.38Å; L980-A1007 HydrophobicContact CD2-CB 3.67Å
1008	V	97.6	Very high	91.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	114.6	176	-172.9	0	0	0	0	108.1	T931 L933 F943 I965 M966 V967 L1050	T931-V1008 PolarHBondContact N-O 3.48Å; T931-V1008 PolarHBondContact O-N 3.16Å; L933-V1008 HydrophobicContact CD2-CG2 4.5Å; F943-V1008 HydrophobicContact CD1-CG1 4.29Å; F943-V1008 HydrophobicContact CD1-CG2 4.45Å; F943-V1008 HydrophobicContact CE1-CG1 4.3Å; F943-V1008 HydrophobicContact CE1-CG2 3.66Å; F943-V1008 HydrophobicContact CZ-CG2 3.89Å; I965-V1008 HydrophobicContact CG2-CG1 3.8Å; M966-V1008 WeakPolarHBondContact O-CA 3.25Å; V967-V1008 HydrophobicContact CG1-CG2 4.4Å; V967-V1008 HydrophobicContact CG2-CG1 4.4Å; V967-V1008 HydrophobicContact CG2-CG2 4.32Å; V1008-L1050 HydrophobicContact CG1-CD2 4.01Å
1009	V	96.4	Very high	89.5	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121	179.6	-178.1	0	0	0	0	108	V930 M966 F968 L1070 A1073	V930-V1009 HydrophobicContact CG1-CG2 3.97Å; V930-V1009 HydrophobicContact CG2-CG2 4.23Å; M966-V1009 HydrophobicContact CB-CB 4.49Å; M966-V1009 HydrophobicContact CE-CB 4.02Å; M966-V1009 HydrophobicContact CE-CG1 3.7Å; M966-V1009 PolarHBondContact N-O 3.36Å; M966-V1009 PolarHBondContact O-N 2.8Å; F968-V1009 HydrophobicContact CD2-CG2 4.18Å; F968-V1009 HydrophobicContact CE2-CB 4.32Å; F968-V1009 HydrophobicContact CE2-CG2 4Å; V1009-L1070 HydrophobicContact CG1-CD1 4.36Å; V1009-A1073 HydrophobicContact CG1-CB 4.28Å; V1009-A1073 HydrophobicContact CG2-CB 4.36Å
1010	C	95.6	Very high	87.1	Confident	9 Å²	9	40.9 Å²	40.9	6%	0.061	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.9	175.7	-62.2	0	0	0	0	108.9	F920 L945 C964 Y1048	F920-C1010 HydrophobicContact CE1-CB 4.29Å; L945-C1010 HydrophobicContact CD1-CB 4.01Å; L945-C1010 HydrophobicContact CD2-CB 3.79Å; C964-C1010 WeakPolarHBondContact O-CA 3.47Å; C1010-Y1048 HydrophobicContact CB-CE1 4.12Å; C1010-Y1048 HydrophobicContact CB-CE2 4.21Å
1011	C	93.1	Very high	84.3	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.014	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.3	-177.9	62.7	0	0	0	0	113.4	C964 F1013 L1070	C964-C1011 PolarHBondContact N-O 3.41Å; C964-C1011 PolarHBondContact O-N 2.89Å; C1011-F1013 HydrophobicContact CB-CE2 4.02Å; C1011-F1013 HydrophobicContact CB-CZ 4.11Å; C1011-L1070 HydrophobicContact CB-CD1 3.89Å
1012	A	92.8	Very high	81.3	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.008	26%	0.261	C	S	.	.			trans	-151.5	153.9	169.5	0	0	0	0	0	107.5	F920 L961 L963 H1015 W1016	F920-A1012 HydrophobicContact CB-CB 4.47Å; F920-A1012 HydrophobicContact CD1-CB 4Å; F920-A1012 HydrophobicContact CD2-CB 4.43Å; F920-A1012 HydrophobicContact CE1-CB 4.38Å; F920-A1012 HydrophobicContact CG-CB 4.04Å; L961-A1012 HydrophobicContact CB-CB 3.86Å; L961-A1012 HydrophobicContact CD1-CB 4.32Å; L963-A1012 HydrophobicContact CD2-CB 4.5Å; A1012-H1015 PolarHBondContact O-CE1 2.98Å; A1012-W1016 PolarHBondContact O-NE1 2.98Å
1013	F	91.6	Very high	78.1	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.009	28%	0.28	C	S	.	.			trans	-137.6	-11.6	-169.7	-61	-80.6	0	0	0	115	D962 C1011 H1015 W1016 L1070 I1074 T1131 V1151 S1153 L1198	D962-F1013 VanDerWaalsContact CG-N 3.29Å; D962-F1013 PolarHBondContact OD1-N 2.88Å; D962-F1013 PolarHBondContact OD2-N 2.71Å; C1011-F1013 HydrophobicContact CB-CE2 4.02Å; C1011-F1013 HydrophobicContact CB-CZ 4.11Å; F1013-H1015 VanDerWaalsContact C-N 3.3Å; F1013-H1015 PolarHBondContact O-N 2.91Å; F1013-W1016 VanDerWaalsContact CA-CD1 3.49Å; F1013-W1016 HydrophobicContact CD1-CD2 4.22Å; F1013-W1016 AromaticContact CD1-CE2 3.73Å; F1013-W1016 AromaticContact CD1-CZ2 3.92Å; F1013-W1016 HydrophobicContact CD1-CZ2 3.92Å; F1013-W1016 AromaticContact CD1-NE1 3.84Å; F1013-W1016 HydrophobicContact CE1-CH2 4.45Å; F1013-W1016 AromaticContact CE1-CZ2 3.98Å; F1013-W1016 HydrophobicContact CE1-CZ2 3.98Å; F1013-W1016 WeakPolarHBondContact O-CB 3.38Å; F1013-W1016 PolarHBondContact O-N 2.84Å; F1013-L1070 HydrophobicContact CE1-CD2 3.83Å; F1013-L1070 HydrophobicContact CE1-CG 4.27Å; F1013-L1070 HydrophobicContact CZ-CD1 4.07Å; F1013-L1070 HydrophobicContact CZ-CD2 4.22Å; F1013-L1070 HydrophobicContact CZ-CG 4.23Å; F1013-I1074 HydrophobicContact CE2-CD1 4.05Å; F1013-I1074 HydrophobicContact CZ-CD1 3.94Å; F1013-I1074 HydrophobicContact CZ-CG1 4.05Å; F1013-T1131 HydrophobicContact CB-CG2 3.91Å; F1013-T1131 HydrophobicContact CD1-CG2 3.68Å; F1013-T1131 HydrophobicContact CG-CG2 4.16Å; F1013-V1151 HydrophobicContact CB-CG1 4.06Å; F1013-V1151 HydrophobicContact CD1-CG1 4.21Å; F1013-V1151 HydrophobicContact CD2-CG1 3.96Å; F1013-V1151 HydrophobicContact CE2-CG1 4.42Å; F1013-V1151 HydrophobicContact CG-CG1 3.83Å; F1013-S1153 WeakPolarHBondContact CB-OG 3.13Å; F1013-L1198 HydrophobicContact CD1-CD2 4.31Å; F1013-L1198 HydrophobicContact CE1-CD2 3.87Å
1014	N	88.9	Confident	74.9	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.037	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-19.6	-177.4	74.1	-14.4	0	0	0	113.6	L960 L961 D962 W1016 V1129 Q1154 L1155	L960-N1014 PolarHBondContact O-ND2 2.96Å; L961-N1014 WeakPolarHBondContact CA-OD1 3.4Å; L961-N1014 VanDerWaalsContact CD2-OD1 3.23Å; L961-N1014 WeakPolarHBondContact CD2-OD1 3.33Å; D962-N1014 HydrophobicContact CB-CB 4.44Å; D962-N1014 WeakPolarHBondContact OD1-CB 3.37Å; D962-N1014 VanDerWaalsContact OD1-CG 3.3Å; D962-N1014 PolarHBondContact OD1-N 3.34Å; D962-N1014 PolarHBondContact OD1-OD1 2.91Å; D962-N1014 VanDerWaalsContact OD1-OD1 3.11Å; N1014-W1016 VanDerWaalsContact C-N 3.34Å; N1014-V1129 HydrophobicContact CB-CG2 4.02Å; N1014-Q1154 VanDerWaalsContact CB-O 3.31Å; N1014-Q1154 WeakPolarHBondContact CB-O 3.41Å; N1014-Q1154 PolarHBondContact ND2-O 2.97Å; N1014-L1155 PolarHBondContact ND2-O 3.4Å
1015	H	86.3	Confident	71.8	Confident	15 Å²	15	50 Å²	50	7%	0.069	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.8	170.8	69.1	-65.2	0	0	0	113.9	F920 P921 S922 L961 A1012 F1013 Q1017 M1018	F920-H1015 WeakPolarHBondContact CB-CE1 3.36Å; F920-H1015 PolarHBondContact O-NE2 2.92Å; P921-H1015 PolarHBondContact O-CE1 3.17Å; P921-H1015 PolarHBondContact O-NE2 2.97Å; S922-H1015 WeakPolarHBondContact CA-NE2 3.45Å; S922-H1015 WeakPolarHBondContact CB-NE2 3.11Å; S922-H1015 PolarHBondContact N-NE2 2.95Å; L961-H1015 HydrophobicContact CD2-CB 3.67Å; A1012-H1015 PolarHBondContact O-CE1 2.98Å; F1013-H1015 VanDerWaalsContact C-N 3.3Å; F1013-H1015 PolarHBondContact O-N 2.91Å; H1015-Q1017 PolarHBondContact O-N 2.9Å; H1015-M1018 WeakPolarHBondContact O-CB 3.21Å; H1015-M1018 PolarHBondContact O-N 3.47Å
1016	W	85.2	Confident	68.4	Low	5 Å²	5	51 Å²	51	2%	0.019	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	133	178.5	-75.4	40.3	0	0	0	109.7	P921 A924 A1012 F1013 N1014 M1018 L1070 T1131 L1198	P921-W1016 PolarHBondContact O-NE1 2.91Å; A924-W1016 HydrophobicContact CB-CH2 4.02Å; A1012-W1016 PolarHBondContact O-NE1 2.98Å; F1013-W1016 VanDerWaalsContact CA-CD1 3.49Å; F1013-W1016 HydrophobicContact CD1-CD2 4.22Å; F1013-W1016 AromaticContact CD1-CE2 3.73Å; F1013-W1016 AromaticContact CD1-CZ2 3.92Å; F1013-W1016 HydrophobicContact CD1-CZ2 3.92Å; F1013-W1016 AromaticContact CD1-NE1 3.84Å; F1013-W1016 HydrophobicContact CE1-CH2 4.45Å; F1013-W1016 AromaticContact CE1-CZ2 3.98Å; F1013-W1016 HydrophobicContact CE1-CZ2 3.98Å; F1013-W1016 WeakPolarHBondContact O-CB 3.38Å; F1013-W1016 PolarHBondContact O-N 2.84Å; N1014-W1016 VanDerWaalsContact C-N 3.34Å; W1016-M1018 PolarHBondContact O-N 3.35Å; W1016-L1070 HydrophobicContact CH2-CD2 3.96Å; W1016-L1070 HydrophobicContact CZ2-CD2 3.73Å; W1016-T1131 HydrophobicContact CB-CG2 4.26Å; W1016-T1131 HydrophobicContact CD2-CG2 3.85Å; W1016-T1131 HydrophobicContact CE3-CG2 3.72Å; W1016-T1131 HydrophobicContact CG-CG2 4.1Å; W1016-T1131 HydrophobicContact CZ3-CG2 4.38Å; W1016-L1198 HydrophobicContact CE3-CD2 4.33Å; W1016-L1198 HydrophobicContact CH2-CB 4.15Å; W1016-L1198 HydrophobicContact CH2-CD2 3.58Å; W1016-L1198 HydrophobicContact CH2-CG 4.46Å; W1016-L1198 HydrophobicContact CZ2-CD2 4.4Å; W1016-L1198 HydrophobicContact CZ3-CB 4.23Å; W1016-L1198 HydrophobicContact CZ3-CD2 3.53Å
1017	Q	74.6	Confident	65.1	Low	100 Å²	100	56.8 Å²	56.8	47%	0.467	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	6.9	-175.4	-40.6	-163.5	7.6	0	0	115.9	H1015 N1019 T1131 G1133	H1015-Q1017 PolarHBondContact O-N 2.9Å; Q1017-N1019 PolarHBondContact O-N 3.1Å; Q1017-T1131 PolarHBondContact NE2-O 3.02Å; Q1017-G1133 VanDerWaalsContact CD-CA 3.49Å
1018	M	65.8	Low	61.6	Low	88 Å²	88	62 Å²	62	43%	0.433	41%	0.408	S	S	.	.			trans	-75.2	116.6	163.5	-64.8	-64.6	162.8	0	0	109	H1015 W1016 V1020 V1129 L1155	H1015-M1018 WeakPolarHBondContact O-CB 3.21Å; H1015-M1018 PolarHBondContact O-N 3.47Å; W1016-M1018 PolarHBondContact O-N 3.35Å; M1018-V1020 VanDerWaalsContact C-N 3.31Å; M1018-V1020 PolarHBondContact O-N 2.93Å; M1018-V1129 HydrophobicContact CE-CG1 3.78Å; M1018-L1155 HydrophobicContact CE-CD1 3.67Å; M1018-L1155 HydrophobicContact CE-CD2 4.47Å
1019	N	50.5	Low	58.2	Low	141 Å²	141	67.4 Å²	67.4	75%	0.754	44%	0.443	S	S	*	.			trans	-73.1	83.1	175.8	-78.9	-13.2	0	0	0	110.6	Q1017 S1021	Q1017-N1019 PolarHBondContact O-N 3.1Å; N1019-S1021 PolarHBondContact O-N 2.95Å
1020	V	47.2	Very low	55	Low	115 Å²	115	73.8 Å²	73.8	70%	0.697	48%	0.476	S	S	*	.	S	Bend	trans	-61.3	-25.5	177.9	-177.6	0	0	0	0	111.9	M1018 G1022	M1018-V1020 VanDerWaalsContact C-N 3.31Å; M1018-V1020 PolarHBondContact O-N 2.93Å; V1020-G1022 VanDerWaalsContact C-N 3.34Å; V1020-G1022 PolarHBondContact O-N 3.39Å; V1020-G1022 VanDerWaalsContact O-N 3.09Å
1021	S	38.2	Very low	51.7	Low	116 Å²	116	78.1 Å²	78.1	81%	0.811	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	71.5	170.5	51.9	0	0	0	0	111.9	N1019	N1019-S1021 PolarHBondContact O-N 2.95Å
1022	G	33.5	Very low	48.6	Very low	63 Å²	63	82.3 Å²	82.3	65%	0.649	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.8	-8.5	-169.8	0	0	0	0	0	119.9	V1020	V1020-G1022 VanDerWaalsContact C-N 3.34Å; V1020-G1022 PolarHBondContact O-N 3.39Å; V1020-G1022 VanDerWaalsContact O-N 3.09Å
1023	T	29.1	Very low	45.6	Very low	128 Å²	128	87 Å²	87	79%	0.785	57%	0.565	S	S	*	*			trans	-118.9	118.1	180	49.3	0	0	0	0	112.3	A1025	T1023-A1025 PolarHBondContact O-N 3.28Å
1024	G	27.1	Very low	42.8	Very low	91 Å²	91	91.7 Å²	91.7	94%	0.938	60%	0.595	S	S	*	*			trans	-75.1	36.7	-172.1	0	0	0	0	0	116.3
1025	A	25.1	Very low	40.2	Very low	76 Å²	76	96.9 Å²	96.9	63%	0.628	63%	0.632	S	S	*	*			trans	-76.2	134.3	166.7	0	0	0	0	0	109.2	T1023	T1023-A1025 PolarHBondContact O-N 3.28Å
1026	P	24.4	Very low	37.4	Very low	103 Å²	103	100 Å²	100	67%	0.669	67%	0.668	S	S	*	*			trans	-63.2	139.6	174.1	27.3	-33.7	0	0	0	109.6	T1028	P1026-T1028 PolarHBondContact O-N 3.33Å
1027	P	26.9	Very low	35.1	Very low	129 Å²	129	105.1 Å²	105.1	84%	0.838	71%	0.711	S	S	*	*			trans	-69.2	92.9	179.3	28.2	-34.3	0	0	0	109.8
1028	T	23.9	Very low	33	Very low	110 Å²	110	104.4 Å²	104.4	68%	0.675	72%	0.723	S	S	*	*			trans	-65	130.5	169.6	45.8	0	0	0	0	108.6	P1026 I1030	P1026-T1028 PolarHBondContact O-N 3.33Å; T1028-I1030 PolarHBondContact O-N 3.03Å; T1028-I1030 VanDerWaalsContact O-N 3.17Å
1029	P	25.5	Very low	31.3	Very low	112 Å²	112	112 Å²	112	73%	0.727	75%	0.746	S	S	*	*			trans	-65.7	121.2	-176.1	25.3	-33.1	0	0	0	109.7	S1031	P1029-S1031 VanDerWaalsContact C-N 3.27Å; P1029-S1031 PolarHBondContact O-N 2.84Å
1030	I	29.5	Very low	30.6	Very low	137 Å²	137	113.4 Å²	113.4	70%	0.703	74%	0.741	S	S	*	*			trans	-70.8	90.4	169.8	-59.3	177.5	0	0	0	107.4	T1028 S1032	T1028-I1030 PolarHBondContact O-N 3.03Å; T1028-I1030 VanDerWaalsContact O-N 3.17Å; I1030-S1032 PolarHBondContact O-N 3.48Å
1031	S	25.5	Very low	29.9	Very low	100 Å²	100	112.7 Å²	112.7	70%	0.699	74%	0.739	S	S	*	*			trans	-73.3	89.7	176.6	-63.3	0	0	0	0	110.1	P1029 P1033	P1029-S1031 VanDerWaalsContact C-N 3.27Å; P1029-S1031 PolarHBondContact O-N 2.84Å; S1031-P1033 VanDerWaalsContact O-CD 3.24Å; S1031-P1033 WeakPolarHBondContact O-CD 3.27Å
1032	S	28.7	Very low	29.8	Very low	89 Å²	89	110 Å²	110	62%	0.622	72%	0.72	S	S	*	*			trans	-105.5	86.5	166.4	-58.3	0	0	0	0	109.3	I1030 T1034	I1030-S1032 PolarHBondContact O-N 3.48Å; S1032-T1034 VanDerWaalsContact C-N 3.29Å; S1032-T1034 PolarHBondContact O-N 2.97Å
1033	P	30.9	Very low	30.4	Very low	99 Å²	99	115.1 Å²	115.1	64%	0.643	73%	0.726	S	S	*	*			trans	-83.3	62.4	-169.8	35.9	-38.3	0	0	0	112.7	S1031	S1031-P1033 VanDerWaalsContact O-CD 3.24Å; S1031-P1033 WeakPolarHBondContact O-CD 3.27Å
1034	T	32.3	Very low	31.7	Very low	101 Å²	101	114.7 Å²	114.7	62%	0.62	72%	0.72	S	S	*	*			trans	-173.8	92.4	160.1	12.3	0	0	0	0	111	L588 S1032	L588-T1034 HydrophobicContact CD2-CG2 4.39Å; S1032-T1034 VanDerWaalsContact C-N 3.29Å; S1032-T1034 PolarHBondContact O-N 2.97Å
1035	S	34.2	Very low	33.6	Very low	117 Å²	117	113.2 Å²	113.2	82%	0.818	69%	0.687	S	S	*	*			trans	-167	125	154.4	37.8	0	0	0	0	109.9	A1037	S1035-A1037 PolarHBondContact O-N 2.89Å
1036	G	28	Very low	36.3	Very low	81 Å²	81	111.7 Å²	111.7	84%	0.835	67%	0.671	S	S	*	*			trans	-75.2	114.2	-174.2	0	0	0	0	0	113.5	A1038	G1036-A1038 PolarHBondContact O-N 3.27Å
1037	A	35.1	Very low	39.3	Very low	111 Å²	111	107.4 Å²	107.4	92%	0.917	65%	0.645	S	S	*	*			trans	44.4	61.9	149.8	0	0	0	0	0	118.5	S1035	S1035-A1037 PolarHBondContact O-N 2.89Å
1038	A	31.3	Very low	42.5	Very low	86 Å²	86	101.4 Å²	101.4	71%	0.711	61%	0.606	S	S	*	*			trans	-112.8	127.2	154.6	0	0	0	0	0	110.1	G1036 R1040	G1036-A1038 PolarHBondContact O-N 3.27Å; A1038-R1040 PolarHBondContact O-N 3.26Å
1039	R	30.1	Very low	45.9	Very low	247 Å²	247	96.8 Å²	96.8	93%	0.932	58%	0.577	S	S	*	*			trans	-72.9	114.4	174.9	-73.2	-175.3	178.1	-177.9	-0.6	109.2
1040	R	36.8	Very low	49.2	Very low	171 Å²	171	91.4 Å²	91.4	65%	0.645	54%	0.543	S	S	*	.			trans	-54.9	128.5	173.5	-63.3	-177.5	-175.9	172.4	-0.4	110.7	A1038 H1043	A1038-R1040 PolarHBondContact O-N 3.26Å; R1040-H1043 PolarHBondContact NH1-NE2 3.03Å
1041	P	32.5	Very low	52.4	Low	100 Å²	100	84.9 Å²	84.9	65%	0.649	51%	0.509	S	S	*	.			trans	-63	154.3	158.1	-17.5	32.1	0	0	0	110.6
1042	S	35.5	Very low	55.8	Low	59 Å²	59	80.1 Å²	80.1	41%	0.413	48%	0.476	S	S	.	.			trans	-3.4	119.4	169.5	52.8	0	0	0	0	117.6	D1044	S1042-D1044 WeakPolarHBondContact CB-OD2 3.49Å; S1042-D1044 PolarHBondContact O-N 3.26Å
1043	H	45.1	Very low	59.1	Low	170 Å²	170	76.1 Å²	76.1	79%	0.787	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	6.6	177.1	-112.3	-89.3	0	0	0	114.6	R1040	R1040-H1043 PolarHBondContact NH1-NE2 3.03Å
1044	D	56.7	Low	62.2	Low	120 Å²	120	71.4 Å²	71.4	64%	0.642	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.7	-166.1	-47.4	-57.9	0	0	0	114.4	S1042	S1042-D1044 WeakPolarHBondContact CB-OD2 3.49Å; S1042-D1044 PolarHBondContact O-N 3.26Å
1045	F	66.9	Low	65.3	Low	59 Å²	59	68.1 Å²	68.1	26%	0.259	40%	0.398	S	S	.	.	S	Bend	trans	-131.7	141	-174.3	-61.6	-72	0	0	0	111.8	C919 S922 K923 G1047	C919-F1045 HydrophobicContact CB-CB 3.9Å; S922-F1045 VanDerWaalsContact OG-CE1 3.25Å; S922-F1045 WeakPolarHBondContact OG-CE1 3.46Å; K923-F1045 HydrophobicContact CG-CE1 4.34Å; K923-F1045 HydrophobicContact CG-CZ 4.5Å; F1045-G1047 PolarHBondContact O-N 3.46Å
1046	P	81.9	Confident	68.2	Low	44 Å²	44	68.6 Å²	68.6	29%	0.286	38%	0.382	S	S	.	.			trans	-61.4	133.5	176	-23.4	34.3	0	0	0	112.9	C919 F920 L961	C919-P1046 CarbonylContact C-O 3.6Å; C919-P1046 VanDerWaalsContact CA-O 3.22Å; C919-P1046 WeakPolarHBondContact CA-O 3.42Å; F920-P1046 HydrophobicContact CD2-CB 4.48Å; F920-P1046 PolarHBondContact N-O 2.8Å; L961-P1046 HydrophobicContact CD1-CB 3.64Å; L961-P1046 HydrophobicContact CD1-CG 4.02Å
1047	G	88.1	Confident	71.4	Confident	13 Å²	13	68.4 Å²	68.4	13%	0.134	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	152.4	180	0	0	0	0	0	114.1	G918 E948 F1045	G918-G1047 WeakPolarHBondContact O-CA 3.45Å; E948-G1047 PolarHBondContact N-O 3.16Å; F1045-G1047 PolarHBondContact O-N 3.46Å
1048	Y	93.1	Very high	74.2	Confident	3 Å²	3	63.1 Å²	63.1	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	156.2	172.1	71.5	-113.1	0	0	0	112.7	Q917 G918 C919 F920 L945 F946 C1010 L1050	Q917-Y1048 CarbonylContact C-O 3.46Å; Q917-Y1048 WeakPolarHBondContact CA-O 3.47Å; G918-Y1048 PolarHBondContact N-O 3.15Å; G918-Y1048 PolarHBondContact O-N 3.01Å; C919-Y1048 VanDerWaalsContact O-CE1 3.31Å; C919-Y1048 WeakPolarHBondContact O-CE1 3.44Å; F920-Y1048 AromaticContact CD1-CD1 3.76Å; F920-Y1048 HydrophobicContact CD1-CD1 3.76Å; F920-Y1048 HydrophobicContact CD1-CE1 4.05Å; F920-Y1048 AromaticContact CD2-CD1 3.97Å; F920-Y1048 HydrophobicContact CD2-CD1 3.97Å; F920-Y1048 AromaticContact CE1-CD1 3.52Å; F920-Y1048 HydrophobicContact CE1-CD1 3.52Å; F920-Y1048 AromaticContact CE1-CE1 3.95Å; F920-Y1048 HydrophobicContact CE1-CE1 3.95Å; F920-Y1048 HydrophobicContact CE1-CG 4.21Å; F920-Y1048 AromaticContact CE2-CD1 3.77Å; F920-Y1048 HydrophobicContact CE2-CD1 3.77Å; F920-Y1048 HydrophobicContact CE2-CG 4.07Å; F920-Y1048 AromaticContact CG-CD1 3.97Å; F920-Y1048 HydrophobicContact CG-CD1 3.97Å; F920-Y1048 AromaticContact CZ-CD1 3.51Å; F920-Y1048 HydrophobicContact CZ-CD1 3.51Å; F920-Y1048 HydrophobicContact CZ-CE1 4.37Å; F920-Y1048 AromaticContact CZ-CG 3.8Å; F920-Y1048 HydrophobicContact CZ-CG 3.8Å; L945-Y1048 HydrophobicContact CD1-CD2 3.47Å; L945-Y1048 VanDerWaalsContact CD1-CD2 3.47Å; L945-Y1048 HydrophobicContact CD1-CE2 4.04Å; L945-Y1048 HydrophobicContact CD1-CG 3.76Å; F946-Y1048 CarbonylContact O-C 3.55Å; F946-Y1048 VanDerWaalsContact O-CA 3.23Å; F946-Y1048 WeakPolarHBondContact O-CA 3.31Å; F946-Y1048 VanDerWaalsContact O-CB 3.27Å; F946-Y1048 WeakPolarHBondContact O-CB 3.41Å; C1010-Y1048 HydrophobicContact CB-CE1 4.12Å; C1010-Y1048 HydrophobicContact CB-CE2 4.21Å; Y1048-L1050 HydrophobicContact CD2-CB 4.4Å; Y1048-L1050 HydrophobicContact CE2-CB 4.15Å
1049	I	95.3	Very high	77.2	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.067	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	121.1	164.6	-55.1	-63.2	0	0	0	109.1	D705 R915 L916 Q917 F946	D705-I1049 WeakPolarHBondContact O-CG1 3.43Å; R915-I1049 HydrophobicContact CB-CG2 4.23Å; L916-I1049 CarbonylContact O-C 3.51Å; L916-I1049 WeakPolarHBondContact O-CA 3.39Å; Q917-I1049 HydrophobicContact CB-CD1 3.92Å; Q917-I1049 HydrophobicContact CG-CD1 3.98Å; F946-I1049 HydrophobicContact CB-CB 4.47Å; F946-I1049 PolarHBondContact N-O 3.48Å; F946-I1049 PolarHBondContact O-N 2.89Å
1050	L	96.3	Very high	80.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	111.3	165	179.3	64.7	0	0	0	108.3	R915 L916 T931 F943 L945 V1008 Y1048 I1052	R915-L1050 WeakPolarHBondContact CA-O 3.11Å; L916-L1050 PolarHBondContact N-O 2.85Å; L916-L1050 PolarHBondContact O-N 2.97Å; T931-L1050 HydrophobicContact CG2-CD2 4.24Å; F943-L1050 HydrophobicContact CB-CD1 4.42Å; F943-L1050 HydrophobicContact CD1-CD1 4.32Å; L945-L1050 HydrophobicContact CB-CD1 4.34Å; L945-L1050 HydrophobicContact CD1-CB 4.44Å; V1008-L1050 HydrophobicContact CG1-CD2 4.01Å; Y1048-L1050 HydrophobicContact CD2-CB 4.4Å; Y1048-L1050 HydrophobicContact CE2-CB 4.15Å; L1050-I1052 HydrophobicContact CD2-CD1 4.14Å; L1050-I1052 HydrophobicContact CD2-CG1 4.17Å; L1050-I1052 HydrophobicContact CG-CD1 4.49Å; L1050-I1052 HydrophobicContact CG-CG1 4Å
1051	A	96.1	Very high	82.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133	164.9	0	0	0	0	0	109.4	R915 F943 A944 F946 Y1053	R915-A1051 HydrophobicContact CG-CB 4.08Å; F943-A1051 WeakPolarHBondContact CA-O 3.33Å; A944-A1051 HydrophobicContact CB-CB 4.44Å; A944-A1051 PolarHBondContact N-O 3.49Å; A944-A1051 PolarHBondContact O-N 3.04Å; F946-A1051 HydrophobicContact CE2-CB 4.01Å; A1051-Y1053 HydrophobicContact CB-CE2 4.18Å
1052	I	97.1	Very high	85.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.5	175.5	-48.8	178.8	0	0	0	106.7	E913 V914 T931 L941 F943 L1050 V1060	E913-I1052 CarbonylContact C-O 3.53Å; E913-I1052 WeakPolarHBondContact CA-O 3.19Å; V914-I1052 HydrophobicContact CG1-CB 3.84Å; V914-I1052 HydrophobicContact CG1-CD1 4.28Å; V914-I1052 HydrophobicContact CG1-CG1 4.36Å; V914-I1052 PolarHBondContact N-O 2.78Å; V914-I1052 PolarHBondContact O-N 3.21Å; T931-I1052 HydrophobicContact CG2-CD1 4.08Å; L941-I1052 HydrophobicContact CD2-CG2 3.51Å; F943-I1052 HydrophobicContact CD1-CB 4.32Å; F943-I1052 HydrophobicContact CD1-CD1 4.38Å; F943-I1052 HydrophobicContact CD1-CG1 3.84Å; F943-I1052 HydrophobicContact CD1-CG2 4.01Å; F943-I1052 HydrophobicContact CE1-CB 4.31Å; F943-I1052 HydrophobicContact CE1-CD1 4Å; F943-I1052 HydrophobicContact CE1-CG1 3.9Å; F943-I1052 HydrophobicContact CE1-CG2 3.63Å; F943-I1052 HydrophobicContact CZ-CG2 4.3Å; L1050-I1052 HydrophobicContact CD2-CD1 4.14Å; L1050-I1052 HydrophobicContact CD2-CG1 4.17Å; L1050-I1052 HydrophobicContact CG-CD1 4.49Å; L1050-I1052 HydrophobicContact CG-CG1 4Å; I1052-V1060 HydrophobicContact CD1-CG1 3.99Å; I1052-V1060 HydrophobicContact CD1-CG2 4.27Å
1053	Y	97.3	Very high	88.2	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136	172.1	-76.5	-91.4	0	0	0	109.1	V574 G768 A769 P770 Q912 E913 R915 L941 E942 A1051	V574-Y1053 HydrophobicContact CG2-CD1 4.08Å; V574-Y1053 HydrophobicContact CG2-CE1 3.7Å; G768-Y1053 PolarHBondContact O-OH 3.42Å; A769-Y1053 WeakPolarHBondContact CA-OH 3.39Å; P770-Y1053 HydrophobicContact CG-CD2 3.56Å; P770-Y1053 HydrophobicContact CG-CE2 3.88Å; P770-Y1053 HydrophobicContact CG-CG 4.18Å; Q912-Y1053 WeakPolarHBondContact O-CA 3.31Å; E913-Y1053 HydrophobicContact CB-CD1 4.04Å; E913-Y1053 HydrophobicContact CB-CE1 3.97Å; R915-Y1053 PolarHBondContact NH2-OH 2.87Å; L941-Y1053 CarbonylContact C-O 3.54Å; L941-Y1053 VanDerWaalsContact CA-O 3.27Å; L941-Y1053 WeakPolarHBondContact CA-O 3.48Å; E942-Y1053 PolarHBondContact N-O 3.44Å; E942-Y1053 PolarHBondContact O-N 2.93Å; A1051-Y1053 HydrophobicContact CB-CE2 4.18Å
1054	S	97.2	Very high	90.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	131.1	-179.6	60.8	0	0	0	0	112.8	W911 Q912 R1056	W911-S1054 VanDerWaalsContact CE3-C 3.44Å; Q912-S1054 PolarHBondContact N-O 2.75Å; Q912-S1054 PolarHBondContact O-N 3.15Å; S1054-R1056 VanDerWaalsContact CB-O 3.27Å; S1054-R1056 WeakPolarHBondContact CB-O 3.27Å; S1054-R1056 PolarHBondContact O-N 2.89Å; S1054-R1056 VanDerWaalsContact O-N 3.12Å; S1054-R1056 PolarHBondContact OG-O 3.1Å
1055	S	96.9	Very high	91.9	Very high	33 Å²	33	31.4 Å²	31.4	23%	0.231	15%	0.153	C	C	.	.	S	Bend	trans	-60.5	-17.6	175.1	49	0	0	0	0	114.2	W911 A940	W911-S1055 VanDerWaalsContact CE3-N 3.34Å; A940-S1055 WeakPolarHBondContact CA-OG 3.29Å; A940-S1055 PolarHBondContact N-OG 3.47Å; A940-S1055 PolarHBondContact O-N 2.67Å; A940-S1055 PolarHBondContact O-OG 2.85Å
1056	R	95.3	Very high	93	Very high	127 Å²	127	31.6 Å²	31.6	48%	0.479	16%	0.159	S	C	.	.	S	Bend	trans	-135.4	170.5	178	-58.4	-62.8	-170.9	170	-2.9	110.3	Q912 E937 T939 S1054	Q912-R1056 WeakPolarHBondContact CG-O 3.49Å; E937-R1056 HydrophobicContact CG-CB 3.92Å; E937-R1056 HydrophobicContact CG-CG 3.85Å; E937-R1056 VanDerWaalsContact OE1-CD 3.25Å; E937-R1056 WeakPolarHBondContact OE1-CD 3.3Å; E937-R1056 IonicContact OE1-NE 3.99Å; E937-R1056 IonicContact OE2-CZ 2.66Å; E937-R1056 IonicContact OE2-NE 2.74Å; T939-R1056 HydrophobicContact CG2-CB 3.95Å; T939-R1056 HydrophobicContact CG2-CG 4.42Å; T939-R1056 WeakPolarHBondContact OG1-CB 3.49Å; S1054-R1056 VanDerWaalsContact CB-O 3.27Å; S1054-R1056 WeakPolarHBondContact CB-O 3.27Å; S1054-R1056 PolarHBondContact O-N 2.89Å; S1054-R1056 VanDerWaalsContact O-N 3.12Å; S1054-R1056 PolarHBondContact OG-O 3.1Å
1057	Q	94.6	Very high	93.3	Very high	77 Å²	77	31.3 Å²	31.3	36%	0.36	16%	0.157	S	C	.	.			trans	-71.1	132.7	177.5	-156.3	-173.9	26.5	0	0	111.4	E570	E570-Q1057 PolarHBondContact OE2-NE2 2.92Å
1058	V	94.6	Very high	93.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	151.5	175.5	-61.4	0	0	0	0	111	S571 L933 V935 T939 V1060	S571-V1058 PolarHBondContact N-O 3.15Å; S571-V1058 PolarHBondContact OG-N 3.45Å; S571-V1058 PolarHBondContact OG-O 3.05Å; L933-V1058 HydrophobicContact CD1-CB 3.71Å; L933-V1058 HydrophobicContact CD1-CG1 4.26Å; L933-V1058 HydrophobicContact CD1-CG2 3.76Å; V935-V1058 HydrophobicContact CG2-CG1 4.31Å; T939-V1058 HydrophobicContact CG2-CG1 4.17Å; V1058-V1060 HydrophobicContact CG2-CG2 4.06Å
1059	M	94.3	Very high	93.5	Very high	23 Å²	23	33 Å²	33	11%	0.113	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135	175.2	-47.9	-62	-60.5	0	0	109.3	R568 E570 T934	R568-M1059 HydrophobicContact CG-CB 4.32Å; R568-M1059 HydrophobicContact CG-CE 4.18Å; E570-M1059 HydrophobicContact CG-CE 3.5Å; E570-M1059 VanDerWaalsContact CG-CE 3.5Å; E570-M1059 HydrophobicContact CG-SD 3.58Å; E570-M1059 VanDerWaalsContact CG-SD 3.58Å; T934-M1059 PolarHBondContact N-O 2.87Å; T934-M1059 PolarHBondContact O-N 3.2Å
1060	V	93.8	Very high	93.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135	-176.4	-167.5	0	0	0	0	111.1	R569 V914 L916 T931 A932 L933 I1052 V1058	R569-V1060 PolarHBondContact N-O 3.26Å; R569-V1060 PolarHBondContact O-N 3.39Å; V914-V1060 HydrophobicContact CG1-CB 4.42Å; V914-V1060 HydrophobicContact CG1-CG2 3.76Å; L916-V1060 HydrophobicContact CD1-CG1 3.74Å; T931-V1060 HydrophobicContact CG2-CG1 3.45Å; T931-V1060 VanDerWaalsContact CG2-CG1 3.45Å; A932-V1060 WeakPolarHBondContact O-CA 3.44Å; A932-V1060 WeakPolarHBondContact O-CG1 3.43Å; L933-V1060 HydrophobicContact CD1-CG2 3.79Å; I1052-V1060 HydrophobicContact CD1-CG1 3.99Å; I1052-V1060 HydrophobicContact CD1-CG2 4.27Å; V1058-V1060 HydrophobicContact CG2-CG2 4.06Å
1061	E	90.3	Very high	93.4	Very high	31 Å²	31	32.5 Å²	32.5	15%	0.145	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	153.7	173.5	63.4	-174.2	-163.6	0	0	110.9	R568 A932 V1063	R568-E1061 HydrophobicContact CB-CB 4.38Å; R568-E1061 HydrophobicContact CG-CB 4.38Å; A932-E1061 HydrophobicContact CB-CG 3.83Å; A932-E1061 PolarHBondContact N-O 2.72Å; A932-E1061 PolarHBondContact O-N 2.85Å; E1061-V1063 HydrophobicContact CG-CG2 4.02Å
1062	Q	90.6	Very high	93.4	Very high	66 Å²	66	34.3 Å²	34.3	31%	0.308	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	131.3	172.1	-73.7	177.3	-44.4	0	0	109.2	L916 Q917 T929	L916-Q1062 HydrophobicContact CD1-CG 4.15Å; Q917-Q1062 PolarHBondContact O-NE2 3.47Å; T929-Q1062 HydrophobicContact CG2-CB 4.04Å; T929-Q1062 HydrophobicContact CG2-CG 4.26Å
1063	V	89.9	Confident	93.3	Very high	6 Å²	6	34.3 Å²	34.3	4%	0.036	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133	-174.4	-174.5	0	0	0	0	109.1	V930 A932 F972 E1061 A1065	V930-V1063 PolarHBondContact N-O 3.25Å; V930-V1063 PolarHBondContact O-N 3.25Å; A932-V1063 HydrophobicContact CB-CG2 3.76Å; F972-V1063 HydrophobicContact CE1-CG1 4.47Å; F972-V1063 HydrophobicContact CE1-CG2 4.22Å; E1061-V1063 HydrophobicContact CG-CG2 4.02Å; V1063-A1065 PolarHBondContact O-N 3.17Å
1064	E	90	Very high	93.2	Very high	155 Å²	155	34.2 Å²	34.2	72%	0.724	17%	0.173	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	114.8	170.5	-68.7	178.6	-178.4	0	0	109.5	P927	P927-E1064 HydrophobicContact CB-CB 4.17Å
1065	A	90.3	Very high	93.2	Very high	6 Å²	6	34.3 Å²	34.3	5%	0.05	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	163.9	176.8	0	0	0	0	0	111.3	P927 V928 V930 L978 V1063 T1069	P927-A1065 CarbonylContact C-O 3.52Å; P927-A1065 VanDerWaalsContact CA-O 3.24Å; P927-A1065 WeakPolarHBondContact CA-O 3.41Å; P927-A1065 WeakPolarHBondContact CB-O 3.46Å; V928-A1065 PolarHBondContact N-O 2.87Å; V928-A1065 WeakPolarHBondContact O-CB 3.46Å; V928-A1065 PolarHBondContact O-N 2.6Å; V930-A1065 HydrophobicContact CB-CB 4.44Å; V930-A1065 HydrophobicContact CG2-CB 3.73Å; L978-A1065 HydrophobicContact CD2-CB 3.89Å; V1063-A1065 PolarHBondContact O-N 3.17Å; A1065-T1069 HydrophobicContact CB-CG2 3.92Å; A1065-T1069 VanDerWaalsContact CB-OG1 3.3Å; A1065-T1069 WeakPolarHBondContact CB-OG1 3.21Å
1066	T	90.4	Very high	93.1	Very high	62 Å²	62	34.6 Å²	34.6	38%	0.38	17%	0.172	S	C	.	.			trans	-64.8	153.1	179.4	52.7	0	0	0	0	111.3	T1068 T1069	T1066-T1068 PolarHBondContact O-N 3Å; T1066-T1068 PolarHBondContact OG1-OG1 3.03Å; T1066-T1069 PolarHBondContact N-OG1 2.9Å; T1066-T1069 VanDerWaalsContact O-CB 3.25Å; T1066-T1069 WeakPolarHBondContact O-CB 3.15Å; T1066-T1069 PolarHBondContact O-N 3.14Å; T1066-T1069 PolarHBondContact O-OG1 2.79Å; T1066-T1069 PolarHBondContact OG1-OG1 3.42Å
1067	P	88.5	Confident	93.1	Very high	38 Å²	38	28.5 Å²	28.5	25%	0.247	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.2	-179.8	-20	26.7	0	0	0	113.3	A924 G926 T1069	A924-P1067 WeakPolarHBondContact O-CB 3.18Å; G926-P1067 WeakPolarHBondContact O-CA 3.47Å; G926-P1067 WeakPolarHBondContact O-CB 3.46Å; G926-P1067 WeakPolarHBondContact O-CG 3.26Å; P1067-T1069 PolarHBondContact O-N 3.29Å
1068	T	92.1	Very high	93.1	Very high	46 Å²	46	24.9 Å²	24.9	28%	0.282	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.6	176.7	63.6	0	0	0	0	115	T1066 L1070 A1071 D1072 G1197 R1202	T1066-T1068 PolarHBondContact O-N 3Å; T1066-T1068 PolarHBondContact OG1-OG1 3.03Å; T1068-L1070 PolarHBondContact O-N 3.07Å; T1068-A1071 WeakPolarHBondContact O-CB 3.34Å; T1068-A1071 PolarHBondContact O-N 2.92Å; T1068-D1072 PolarHBondContact O-N 3.34Å; T1068-D1072 VanDerWaalsContact O-OD2 3.05Å; T1068-G1197 WeakPolarHBondContact CA-O 3.44Å; T1068-R1202 PolarHBondContact O-NH1 2.84Å; T1068-R1202 VanDerWaalsContact O-NH1 3.15Å
1069	T	93.8	Very high	93	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-62.6	-30	-173	-50.9	0	0	0	0	112	V930 L978 L980 A1065 T1066 P1067 D1072 A1073	V930-T1069 HydrophobicContact CG2-CG2 4.2Å; L978-T1069 HydrophobicContact CD2-CG2 4.09Å; L980-T1069 HydrophobicContact CD1-CG2 3.9Å; L980-T1069 HydrophobicContact CG-CG2 4.2Å; A1065-T1069 HydrophobicContact CB-CG2 3.92Å; A1065-T1069 VanDerWaalsContact CB-OG1 3.3Å; A1065-T1069 WeakPolarHBondContact CB-OG1 3.21Å; T1066-T1069 PolarHBondContact N-OG1 2.9Å; T1066-T1069 VanDerWaalsContact O-CB 3.25Å; T1066-T1069 WeakPolarHBondContact O-CB 3.15Å; T1066-T1069 PolarHBondContact O-N 3.14Å; T1066-T1069 PolarHBondContact O-OG1 2.79Å; T1066-T1069 PolarHBondContact OG1-OG1 3.42Å; P1067-T1069 PolarHBondContact O-N 3.29Å; T1069-D1072 PolarHBondContact O-N 3.21Å; T1069-A1073 WeakPolarHBondContact O-CB 3.22Å; T1069-A1073 PolarHBondContact O-N 3.07Å
1070	L	93.6	Very high	93	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-70.2	-38.5	176	-169.6	60.4	0	0	0	111.6	V1009 C1011 F1013 W1016 T1068 I1074 L1198	V1009-L1070 HydrophobicContact CG1-CD1 4.36Å; C1011-L1070 HydrophobicContact CB-CD1 3.89Å; F1013-L1070 HydrophobicContact CE1-CD2 3.83Å; F1013-L1070 HydrophobicContact CE1-CG 4.27Å; F1013-L1070 HydrophobicContact CZ-CD1 4.07Å; F1013-L1070 HydrophobicContact CZ-CD2 4.22Å; F1013-L1070 HydrophobicContact CZ-CG 4.23Å; W1016-L1070 HydrophobicContact CH2-CD2 3.96Å; W1016-L1070 HydrophobicContact CZ2-CD2 3.73Å; T1068-L1070 PolarHBondContact O-N 3.07Å; L1070-I1074 WeakPolarHBondContact O-CB 3.42Å; L1070-I1074 VanDerWaalsContact O-CG1 3.3Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.38Å; L1070-I1074 PolarHBondContact O-N 3.39Å; L1070-L1198 HydrophobicContact CG-CD1 4.18Å
1071	A	95.1	Very high	92.9	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-44.6	170.1	0	0	0	0	0	111.3	T1068 A1073 I1074 I1075 G1197 L1198	T1068-A1071 WeakPolarHBondContact O-CB 3.34Å; T1068-A1071 PolarHBondContact O-N 2.92Å; A1071-A1073 VanDerWaalsContact C-N 3.35Å; A1071-A1073 PolarHBondContact O-N 2.82Å; A1071-I1074 PolarHBondContact O-N 3.16Å; A1071-I1075 HydrophobicContact CB-CD1 4.47Å; A1071-I1075 VanDerWaalsContact O-CB 3.25Å; A1071-I1075 WeakPolarHBondContact O-CB 3.4Å; A1071-I1075 WeakPolarHBondContact O-CD1 3.45Å; A1071-I1075 WeakPolarHBondContact O-CG1 3.44Å; A1071-I1075 PolarHBondContact O-N 3.14Å; A1071-G1197 WeakPolarHBondContact CB-O 3.48Å; A1071-L1198 HydrophobicContact CB-CD1 4.42Å; A1071-L1198 WeakPolarHBondContact CB-O 3.44Å
1072	D	95.1	Very high	92.9	Very high	38 Å²	38	35 Å²	35	20%	0.203	18%	0.184	C	C	.	.	H	α-helix	trans	-59.2	-44.7	178.4	-67	-48.3	0	0	0	111.7	L980 T1068 T1069 L1076 R1202	L980-D1072 HydrophobicContact CD1-CB 4.16Å; T1068-D1072 PolarHBondContact O-N 3.34Å; T1068-D1072 VanDerWaalsContact O-OD2 3.05Å; T1069-D1072 PolarHBondContact O-N 3.21Å; D1072-L1076 WeakPolarHBondContact O-CB 3.19Å; D1072-L1076 WeakPolarHBondContact O-CD1 3.27Å; D1072-L1076 VanDerWaalsContact O-CG 3.24Å; D1072-L1076 WeakPolarHBondContact O-CG 3.16Å; D1072-L1076 PolarHBondContact O-N 3Å; D1072-R1202 VanDerWaalsContact CG-NH2 3.25Å; D1072-R1202 IonicContact OD1-CZ 2.68Å; D1072-R1202 IonicContact OD1-NH1 3.43Å; D1072-R1202 PolarHBondContact OD1-NH1 2.79Å; D1072-R1202 IonicContact OD1-NH2 3.43Å; D1072-R1202 PolarHBondContact OD1-NH2 2.7Å; D1072-R1202 IonicContact OD2-CZ 2.7Å; D1072-R1202 IonicContact OD2-NH1 2.69Å; D1072-R1202 PolarHBondContact OD2-NH1 2.82Å; D1072-R1202 VanDerWaalsContact OD2-NH1 3.08Å; D1072-R1202 IonicContact OD2-NH2 2.68Å; D1072-R1202 PolarHBondContact OD2-NH2 2.87Å
1073	A	96.1	Very high	93	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-45.2	177.1	0	0	0	0	0	112.7	M966 F968 L980 V1009 T1069 A1071 L1077	M966-A1073 HydrophobicContact CE-CB 3.72Å; M966-A1073 HydrophobicContact SD-CB 4.19Å; F968-A1073 HydrophobicContact CE2-CB 3.73Å; F968-A1073 HydrophobicContact CZ-CB 3.65Å; L980-A1073 HydrophobicContact CD1-CB 3.76Å; V1009-A1073 HydrophobicContact CG1-CB 4.28Å; V1009-A1073 HydrophobicContact CG2-CB 4.36Å; T1069-A1073 WeakPolarHBondContact O-CB 3.22Å; T1069-A1073 PolarHBondContact O-N 3.07Å; A1071-A1073 VanDerWaalsContact C-N 3.35Å; A1071-A1073 PolarHBondContact O-N 2.82Å; A1073-L1077 WeakPolarHBondContact O-CB 3.45Å; A1073-L1077 PolarHBondContact O-N 3.19Å
1074	I	95.5	Very high	93.2	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-66.5	-43.5	178.7	-71.2	-55.7	0	0	0	111.7	M966 F1013 L1070 A1071 L1077 T1078 I1104 V1148 L1198	M966-I1074 HydrophobicContact CE-CD1 4.3Å; M966-I1074 HydrophobicContact SD-CD1 4.25Å; F1013-I1074 HydrophobicContact CE2-CD1 4.05Å; F1013-I1074 HydrophobicContact CZ-CD1 3.94Å; F1013-I1074 HydrophobicContact CZ-CG1 4.05Å; L1070-I1074 WeakPolarHBondContact O-CB 3.42Å; L1070-I1074 VanDerWaalsContact O-CG1 3.3Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.38Å; L1070-I1074 PolarHBondContact O-N 3.39Å; A1071-I1074 PolarHBondContact O-N 3.16Å; I1074-L1077 PolarHBondContact O-N 3.49Å; I1074-T1078 WeakPolarHBondContact O-CG2 3.5Å; I1074-T1078 PolarHBondContact O-N 3.18Å; I1074-T1078 PolarHBondContact O-OG1 3Å; I1074-I1104 HydrophobicContact CD1-CD1 3.81Å; I1074-I1104 HydrophobicContact CG1-CD1 4.31Å; I1074-I1104 HydrophobicContact CG2-CD1 3.59Å; I1074-I1104 HydrophobicContact CG2-CG2 3.78Å; I1074-V1148 HydrophobicContact CG2-CG1 4.19Å; I1074-V1148 HydrophobicContact CG2-CG2 4.01Å; I1074-L1198 HydrophobicContact CG1-CD1 4.48Å
1075	I	96.1	Very high	93.2	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-55.5	176	-75.6	168.2	0	0	0	109.9	A1071 L1077 T1078 E1079 V1106 R1146 V1148 R1202	A1071-I1075 HydrophobicContact CB-CD1 4.47Å; A1071-I1075 VanDerWaalsContact O-CB 3.25Å; A1071-I1075 WeakPolarHBondContact O-CB 3.4Å; A1071-I1075 WeakPolarHBondContact O-CD1 3.45Å; A1071-I1075 WeakPolarHBondContact O-CG1 3.44Å; A1071-I1075 PolarHBondContact O-N 3.14Å; I1075-L1077 PolarHBondContact O-N 3.03Å; I1075-T1078 PolarHBondContact O-N 2.81Å; I1075-T1078 VanDerWaalsContact O-N 3.08Å; I1075-T1078 PolarHBondContact O-OG1 3.5Å; I1075-E1079 HydrophobicContact CG2-CG 4.42Å; I1075-E1079 WeakPolarHBondContact CG2-OE1 3.38Å; I1075-E1079 WeakPolarHBondContact O-CG 3.46Å; I1075-E1079 PolarHBondContact O-N 2.93Å; I1075-V1106 HydrophobicContact CG1-CG1 4.29Å; I1075-V1106 HydrophobicContact CG1-CG2 4.38Å; I1075-R1146 HydrophobicContact CD1-CG 4.41Å; I1075-R1146 VanDerWaalsContact CG2-NH1 3.33Å; I1075-V1148 HydrophobicContact CD1-CG2 4.2Å; I1075-V1148 HydrophobicContact CG1-CG2 3.77Å; I1075-R1202 HydrophobicContact CD1-CB 4.49Å; I1075-R1202 HydrophobicContact CD1-CG 4.04Å
1076	L	95.9	Very high	93.3	Very high	39 Å²	39	43.3 Å²	43.3	20%	0.204	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-30.6	179.7	-71.5	167.1	0	0	0	113.2	F968 L980 D1072 N1080	F968-L1076 HydrophobicContact CD1-CD1 4.22Å; F968-L1076 HydrophobicContact CE1-CB 3.79Å; F968-L1076 HydrophobicContact CE1-CD1 4.11Å; L980-L1076 HydrophobicContact CB-CD1 3.78Å; D1072-L1076 WeakPolarHBondContact O-CB 3.19Å; D1072-L1076 WeakPolarHBondContact O-CD1 3.27Å; D1072-L1076 VanDerWaalsContact O-CG 3.24Å; D1072-L1076 WeakPolarHBondContact O-CG 3.16Å; D1072-L1076 PolarHBondContact O-N 3Å; L1076-N1080 WeakPolarHBondContact O-CB 3.38Å; L1076-N1080 PolarHBondContact O-N 3.06Å
1077	L	94.9	Very high	92.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-71.1	-47	172.9	177.3	56.7	0	0	0	111.8	M966 L983 H986 A1073 I1074 I1075 E1079 N1080 K1081 L1096 W1100	M966-L1077 HydrophobicContact CG-CD2 3.97Å; M966-L1077 HydrophobicContact SD-CB 4.21Å; M966-L1077 HydrophobicContact SD-CD2 3.55Å; M966-L1077 VanDerWaalsContact SD-CD2 3.55Å; L983-L1077 HydrophobicContact CD2-CB 4.48Å; L983-L1077 HydrophobicContact CD2-CD1 3.49Å; L983-L1077 VanDerWaalsContact CD2-CD1 3.49Å; H986-L1077 HydrophobicContact CB-CD1 4.36Å; A1073-L1077 WeakPolarHBondContact O-CB 3.45Å; A1073-L1077 PolarHBondContact O-N 3.19Å; I1074-L1077 PolarHBondContact O-N 3.49Å; I1075-L1077 PolarHBondContact O-N 3.03Å; L1077-E1079 PolarHBondContact O-N 3.09Å; L1077-N1080 PolarHBondContact O-N 3.44Å; L1077-K1081 HydrophobicContact CD1-CB 4.15Å; L1077-K1081 HydrophobicContact CD1-CG 3.74Å; L1077-K1081 WeakPolarHBondContact O-CB 3.17Å; L1077-K1081 PolarHBondContact O-N 2.88Å; L1077-L1096 HydrophobicContact CD1-CD2 4.28Å; L1077-L1096 HydrophobicContact CD2-CD2 4.43Å; L1077-L1096 HydrophobicContact CG-CD2 3.84Å; L1077-W1100 HydrophobicContact CD2-CZ2 3.67Å; L1077-W1100 HydrophobicContact CG-CZ2 4.34Å
1078	T	94.1	Very high	92.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-34.5	176.7	55.7	0	0	0	0	113.3	I1074 I1075 N1080 G1082 Y1094 L1096 I1104 V1106	I1074-T1078 WeakPolarHBondContact O-CG2 3.5Å; I1074-T1078 PolarHBondContact O-N 3.18Å; I1074-T1078 PolarHBondContact O-OG1 3Å; I1075-T1078 PolarHBondContact O-N 2.81Å; I1075-T1078 VanDerWaalsContact O-N 3.08Å; I1075-T1078 PolarHBondContact O-OG1 3.5Å; T1078-N1080 VanDerWaalsContact C-N 3.28Å; T1078-N1080 PolarHBondContact O-N 3.28Å; T1078-G1082 VanDerWaalsContact O-CA 3.27Å; T1078-G1082 WeakPolarHBondContact O-CA 3.35Å; T1078-G1082 PolarHBondContact O-N 3.32Å; T1078-Y1094 WeakPolarHBondContact O-CD1 3.44Å; T1078-L1096 HydrophobicContact CG2-CB 4.05Å; T1078-L1096 HydrophobicContact CG2-CD2 4.35Å; T1078-I1104 HydrophobicContact CG2-CB 4.18Å; T1078-I1104 HydrophobicContact CG2-CG2 3.91Å; T1078-V1106 HydrophobicContact CG2-CG2 3.97Å; T1078-V1106 VanDerWaalsContact OG1-CG2 3.25Å; T1078-V1106 WeakPolarHBondContact OG1-CG2 3.32Å
1079	E	93.5	Very high	92.2	Very high	60 Å²	60	52.1 Å²	52.1	28%	0.28	25%	0.251	S	S	.	.	H	α-helix	trans	-67.4	-27.4	174.6	-73.9	169.3	-176.1	0	0	112.7	I1075 L1077 Y1094 R1146	I1075-E1079 HydrophobicContact CG2-CG 4.42Å; I1075-E1079 WeakPolarHBondContact CG2-OE1 3.38Å; I1075-E1079 WeakPolarHBondContact O-CG 3.46Å; I1075-E1079 PolarHBondContact O-N 2.93Å; L1077-E1079 PolarHBondContact O-N 3.09Å; E1079-Y1094 HydrophobicContact CG-CE2 4.5Å; E1079-R1146 VanDerWaalsContact CD-NH1 3.28Å; E1079-R1146 WeakPolarHBondContact OE1-CD 3.34Å; E1079-R1146 IonicContact OE1-CZ 3.26Å; E1079-R1146 IonicContact OE1-NE 3.12Å; E1079-R1146 IonicContact OE1-NH1 2.86Å; E1079-R1146 PolarHBondContact OE1-NH1 3.29Å; E1079-R1146 IonicContact OE2-NH1 2.62Å; E1079-R1146 PolarHBondContact OE2-NH1 3.09Å; E1079-R1146 VanDerWaalsContact OE2-NH1 3.11Å
1080	N	93.4	Very high	91.8	Very high	84 Å²	84	52.7 Å²	52.7	45%	0.449	26%	0.259	S	S	.	.	H	α-helix	trans	-96.7	-24.2	-179	-168.7	-112.1	0	0	0	114.6	L983 L1076 L1077 T1078	L983-N1080 HydrophobicContact CD2-CB 4.19Å; L1076-N1080 WeakPolarHBondContact O-CB 3.38Å; L1076-N1080 PolarHBondContact O-N 3.06Å; L1077-N1080 PolarHBondContact O-N 3.44Å; T1078-N1080 VanDerWaalsContact C-N 3.28Å; T1078-N1080 PolarHBondContact O-N 3.28Å
1081	K	91.6	Very high	91.8	Very high	107 Å²	107	52.7 Å²	52.7	47%	0.465	26%	0.259	S	S	.	.	H	α-helix	trans	-131	-16.5	-170.3	-60.9	-65.9	179.8	173.8	0	115	L983 H986 L1077 L1096	L983-K1081 HydrophobicContact CD2-CG 4.39Å; H986-K1081 VanDerWaalsContact NE2-CE 3.3Å; H986-K1081 WeakPolarHBondContact NE2-CE 3.33Å; L1077-K1081 HydrophobicContact CD1-CB 4.15Å; L1077-K1081 HydrophobicContact CD1-CG 3.74Å; L1077-K1081 WeakPolarHBondContact O-CB 3.17Å; L1077-K1081 PolarHBondContact O-N 2.88Å; K1081-L1096 HydrophobicContact CB-CD1 4.18Å; K1081-L1096 HydrophobicContact CB-CD2 3.99Å
1082	G	91.1	Very high	91.8	Very high	16 Å²	16	52.7 Å²	52.7	17%	0.165	26%	0.258	C	S	.	.	S	Bend	trans	-76.1	149.1	179.4	0	0	0	0	0	112.8	T1078 R1084 Y1095	T1078-G1082 VanDerWaalsContact O-CA 3.27Å; T1078-G1082 WeakPolarHBondContact O-CA 3.35Å; T1078-G1082 PolarHBondContact O-N 3.32Å; G1082-R1084 PolarHBondContact O-N 3.34Å; G1082-Y1095 CarbonylContact C-O 3.55Å; G1082-Y1095 VanDerWaalsContact CA-O 3.3Å; G1082-Y1095 WeakPolarHBondContact CA-O 3.33Å
1083	E	91.9	Very high	91.8	Very high	74 Å²	74	51 Å²	51	35%	0.346	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	115.8	168	-58.6	-179.3	99.3	0	0	108.6	H1085 Y1094 Y1095 T1097 H1098	E1083-H1085 PolarHBondContact O-CD2 2.73Å; E1083-Y1094 WeakPolarHBondContact O-CA 3.11Å; E1083-Y1095 PolarHBondContact N-O 3.02Å; E1083-Y1095 PolarHBondContact O-N 3.46Å; E1083-T1097 PolarHBondContact OE2-OG1 3.1Å; E1083-H1098 VanDerWaalsContact CD-CE1 3.44Å; E1083-H1098 IonicContact OE1-CE1 3.98Å; E1083-H1098 PolarHBondContact OE1-CE1 2.97Å; E1083-H1098 VanDerWaalsContact OE1-CE1 3.31Å; E1083-H1098 IonicContact OE1-ND1 3.08Å; E1083-H1098 IonicContact OE2-CE1 3.46Å; E1083-H1098 PolarHBondContact OE2-CE1 3.15Å; E1083-H1098 IonicContact OE2-ND1 3.12Å; E1083-H1098 PolarHBondContact OE2-ND1 2.77Å
1084	R	93.4	Very high	91.8	Very high	136 Å²	136	51.6 Å²	51.6	51%	0.513	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.2	-178.1	176.9	178	168.5	154.3	-5.7	110.8	G1082 E1086 T1092 C1093 Y1094	G1082-R1084 PolarHBondContact O-N 3.34Å; R1084-E1086 IonicContact CZ-OE1 2.67Å; R1084-E1086 IonicContact NE-OE1 3.15Å; R1084-E1086 IonicContact NH2-OE1 3.84Å; R1084-E1086 PolarHBondContact NH2-OE1 2.77Å; R1084-T1092 HydrophobicContact CG-CG2 3.7Å; R1084-C1093 WeakPolarHBondContact CA-O 3.25Å; R1084-Y1094 HydrophobicContact CB-CD1 4.05Å; R1084-Y1094 HydrophobicContact CB-CE1 3.92Å; R1084-Y1094 HydrophobicContact CG-CD1 4.34Å; R1084-Y1094 HydrophobicContact CG-CE1 3.83Å
1085	H	91.5	Very high	91.7	Very high	96 Å²	96	52.6 Å²	52.6	44%	0.444	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.1	174.4	-64.2	-107.6	0	0	0	109.8	E1083 C1093 Y1095	E1083-H1085 PolarHBondContact O-CD2 2.73Å; H1085-C1093 PolarHBondContact N-O 3.04Å; H1085-C1093 PolarHBondContact O-N 3.29Å; H1085-Y1095 HydrophobicContact CB-CE2 4.11Å; H1085-Y1095 AromaticContact CD2-CD2 3.44Å; H1085-Y1095 VanDerWaalsContact CD2-CD2 3.44Å; H1085-Y1095 WeakPolarHBondContact CD2-CD2 3.46Å; H1085-Y1095 AromaticContact CD2-CE2 3.62Å; H1085-Y1095 AromaticContact CG-CE2 3.87Å; H1085-Y1095 AromaticContact NE2-CD2 3.94Å
1086	E	91.1	Very high	91.4	Very high	102 Å²	102	53 Å²	53	48%	0.477	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	126.1	166.4	-63.1	-70.9	-161.6	0	0	108.8	R1084 T1092 R1110	R1084-E1086 IonicContact CZ-OE1 2.67Å; R1084-E1086 IonicContact NE-OE1 3.15Å; R1084-E1086 IonicContact NH2-OE1 3.84Å; R1084-E1086 PolarHBondContact NH2-OE1 2.77Å; E1086-T1092 WeakPolarHBondContact OE2-CB 3.26Å; E1086-T1092 PolarHBondContact OE2-OG1 3.42Å; E1086-R1110 IonicContact OE1-CZ 2.72Å; E1086-R1110 IonicContact OE1-NH2 2.68Å; E1086-R1110 PolarHBondContact OE1-NH2 2.96Å; E1086-R1110 IonicContact OE2-CZ 3.8Å; E1086-R1110 IonicContact OE2-NH2 3.24Å; E1086-R1110 PolarHBondContact OE2-NH2 2.61Å
1087	G	81.4	Confident	90.6	Very high	43 Å²	43	52.5 Å²	52.5	44%	0.443	26%	0.257	S	S	.	.			trans	-95.2	-115.2	-177.2	0	0	0	0	0	111.4	M1091	G1087-M1091 PolarHBondContact N-O 3.38Å
1088	R	84.7	Confident	89.3	Confident	137 Å²	137	56.5 Å²	56.5	52%	0.517	28%	0.275	S	S	.	.	S	Bend	trans	-79.1	162.5	165.9	-66.3	-179.7	-176.7	-144.5	4.4	110.1	G1090 M1091 H1169	R1088-G1090 PolarHBondContact O-N 2.74Å; R1088-G1090 VanDerWaalsContact O-N 3.12Å; R1088-M1091 WeakPolarHBondContact O-CB 3.34Å; R1088-M1091 PolarHBondContact O-N 2.87Å; R1088-H1169 PolarHBondContact NE-ND1 2.72Å
1089	E	83.2	Confident	87.7	Confident	150 Å²	150	58.1 Å²	58.1	70%	0.701	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	119.5	170	178.1	-143.7	-144.2	0	0	111.4	K1171	E1089-K1171 WeakPolarHBondContact O-CE 3.45Å; E1089-K1171 PolarHBondContact O-NZ 3.39Å; E1089-K1171 IonicContact OE2-NZ 3.14Å; E1089-K1171 PolarHBondContact OE2-NZ 2.91Å
1090	G	85.1	Confident	86.6	Confident	18 Å²	18	56 Å²	56	19%	0.186	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	8	-176.3	0	0	0	0	0	115.4	R1088 N1109 R1110 H1111	R1088-G1090 PolarHBondContact O-N 2.74Å; R1088-G1090 VanDerWaalsContact O-N 3.12Å; G1090-N1109 CarbonylContact O-C 3.57Å; G1090-R1110 WeakPolarHBondContact O-CA 3.37Å; G1090-R1110 PolarHBondContact O-N 3.14Å; G1090-H1111 PolarHBondContact O-N 2.73Å
1091	M	92.8	Very high	85.6	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.015	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.9	177.4	171.5	179.6	-176.5	0	0	111.5	G1087 R1088 C1093 V1107 E1108 L1116 V1118 L1167 H1169	G1087-M1091 PolarHBondContact N-O 3.38Å; R1088-M1091 WeakPolarHBondContact O-CB 3.34Å; R1088-M1091 PolarHBondContact O-N 2.87Å; M1091-C1093 WeakPolarHBondContact CE-SG 3.36Å; M1091-V1107 HydrophobicContact CE-CG2 3.96Å; M1091-V1107 HydrophobicContact CG-CG2 4.3Å; M1091-E1108 WeakPolarHBondContact CA-O 3.38Å; M1091-L1116 HydrophobicContact CB-CD1 4.29Å; M1091-L1116 HydrophobicContact CB-CD2 4Å; M1091-L1116 HydrophobicContact CE-CD2 4.13Å; M1091-L1116 HydrophobicContact CG-CD1 4.31Å; M1091-L1116 HydrophobicContact CG-CD2 3.6Å; M1091-L1116 HydrophobicContact SD-CD1 3.67Å; M1091-L1116 HydrophobicContact SD-CD2 3.72Å; M1091-L1116 HydrophobicContact SD-CG 4.21Å; M1091-V1118 HydrophobicContact CE-CG1 4.45Å; M1091-V1118 HydrophobicContact CE-CG2 4.21Å; M1091-L1167 HydrophobicContact CE-CD2 3.73Å; M1091-H1169 HydrophobicContact CE-CB 3.73Å; M1091-H1169 WeakPolarHBondContact CE-CD2 3.24Å; M1091-H1169 HydrophobicContact SD-CB 3.66Å; M1091-H1169 PolarHBondContact SD-CD2 2.75Å
1092	T	95.1	Very high	85.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.2	174.5	-49.5	0	0	0	0	109.6	R1084 E1086 Y1094 V1107 E1108 R1110	R1084-T1092 HydrophobicContact CG-CG2 3.7Å; E1086-T1092 WeakPolarHBondContact OE2-CB 3.26Å; E1086-T1092 PolarHBondContact OE2-OG1 3.42Å; T1092-Y1094 HydrophobicContact CG2-CE2 3.76Å; T1092-V1107 CarbonylContact O-C 3.59Å; T1092-V1107 WeakPolarHBondContact O-CA 3.26Å; T1092-E1108 PolarHBondContact N-O 2.78Å; T1092-E1108 PolarHBondContact O-N 3.12Å; T1092-R1110 PolarHBondContact OG1-NE 2.89Å; T1092-R1110 PolarHBondContact OG1-NH2 2.88Å
1093	C	95.4	Very high	85.4	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.027	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	145.9	174	-76.8	0	0	0	0	111.1	R1084 H1085 M1091 Y1095 V1106 L1167	R1084-C1093 WeakPolarHBondContact CA-O 3.25Å; H1085-C1093 PolarHBondContact N-O 3.04Å; H1085-C1093 PolarHBondContact O-N 3.29Å; M1091-C1093 WeakPolarHBondContact CE-SG 3.36Å; C1093-Y1095 HydrophobicContact CB-CE2 3.9Å; C1093-V1106 CarbonylContact C-O 3.5Å; C1093-V1106 WeakPolarHBondContact CA-O 3.36Å; C1093-L1167 HydrophobicContact CB-CD2 4.49Å; C1093-L1167 WeakPolarHBondContact SG-CD2 3.3Å
1094	Y	95.7	Very high	85.5	Confident	11 Å²	11	43.1 Å²	43.1	4%	0.043	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.9	174.4	-56.4	-96.4	0	0	0	108	T1078 E1079 E1083 R1084 T1092 V1106 E1108	T1078-Y1094 WeakPolarHBondContact O-CD1 3.44Å; E1079-Y1094 HydrophobicContact CG-CE2 4.5Å; E1083-Y1094 WeakPolarHBondContact O-CA 3.11Å; R1084-Y1094 HydrophobicContact CB-CD1 4.05Å; R1084-Y1094 HydrophobicContact CB-CE1 3.92Å; R1084-Y1094 HydrophobicContact CG-CD1 4.34Å; R1084-Y1094 HydrophobicContact CG-CE1 3.83Å; T1092-Y1094 HydrophobicContact CG2-CE2 3.76Å; Y1094-V1106 HydrophobicContact CD2-CG1 4.48Å; Y1094-V1106 PolarHBondContact N-O 3.15Å; Y1094-V1106 PolarHBondContact O-N 3.23Å; Y1094-E1108 HydrophobicContact CE2-CG 3.9Å; Y1094-E1108 WeakPolarHBondContact CE2-OE2 3.48Å; Y1094-E1108 PolarHBondContact OH-OE2 2.68Å
1095	Y	93.3	Very high	85.7	Confident	24 Å²	24	36.7 Å²	36.7	9%	0.094	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.3	173.4	-53.4	-90.3	0	0	0	108.1	G1082 E1083 H1085 C1093 L1103 I1104 V1105 H1165 L1167	G1082-Y1095 CarbonylContact C-O 3.55Å; G1082-Y1095 VanDerWaalsContact CA-O 3.3Å; G1082-Y1095 WeakPolarHBondContact CA-O 3.33Å; E1083-Y1095 PolarHBondContact N-O 3.02Å; E1083-Y1095 PolarHBondContact O-N 3.46Å; H1085-Y1095 HydrophobicContact CB-CE2 4.11Å; H1085-Y1095 AromaticContact CD2-CD2 3.44Å; H1085-Y1095 VanDerWaalsContact CD2-CD2 3.44Å; H1085-Y1095 WeakPolarHBondContact CD2-CD2 3.46Å; H1085-Y1095 AromaticContact CD2-CE2 3.62Å; H1085-Y1095 AromaticContact CG-CE2 3.87Å; H1085-Y1095 AromaticContact NE2-CD2 3.94Å; C1093-Y1095 HydrophobicContact CB-CE2 3.9Å; Y1095-L1103 HydrophobicContact CD1-CD1 4.37Å; Y1095-I1104 WeakPolarHBondContact CA-O 3.34Å; Y1095-V1105 HydrophobicContact CD1-CB 4.5Å; Y1095-V1105 HydrophobicContact CD1-CG1 4.05Å; Y1095-V1105 HydrophobicContact CD1-CG2 3.93Å; Y1095-V1105 HydrophobicContact CE1-CG1 3.83Å; Y1095-V1105 HydrophobicContact CE1-CG2 4.21Å; Y1095-H1165 AromaticContact CD1-CD2 3.99Å; Y1095-H1165 AromaticContact CD1-NE2 3.54Å; Y1095-H1165 AromaticContact CE1-CD2 3.68Å; Y1095-H1165 AromaticContact CE1-NE2 3.51Å; Y1095-L1167 WeakPolarHBondContact OH-CD2 3.35Å
1096	L	89.9	Confident	85.9	Confident	8 Å²	8	32.1 Å²	32.1	4%	0.042	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	116	173.1	-174.1	44.8	0	0	0	109	L1077 T1078 K1081 W1100 L1103 I1104	L1077-L1096 HydrophobicContact CD1-CD2 4.28Å; L1077-L1096 HydrophobicContact CD2-CD2 4.43Å; L1077-L1096 HydrophobicContact CG-CD2 3.84Å; T1078-L1096 HydrophobicContact CG2-CB 4.05Å; T1078-L1096 HydrophobicContact CG2-CD2 4.35Å; K1081-L1096 HydrophobicContact CB-CD1 4.18Å; K1081-L1096 HydrophobicContact CB-CD2 3.99Å; L1096-W1100 HydrophobicContact CB-CE3 4Å; L1096-W1100 HydrophobicContact CB-CH2 3.83Å; L1096-W1100 HydrophobicContact CB-CZ3 3.51Å; L1096-W1100 HydrophobicContact CD2-CD2 4.34Å; L1096-W1100 HydrophobicContact CD2-CE3 4.41Å; L1096-W1100 HydrophobicContact CD2-CH2 3.47Å; L1096-W1100 VanDerWaalsContact CD2-CH2 3.47Å; L1096-W1100 HydrophobicContact CD2-CZ2 3.47Å; L1096-W1100 VanDerWaalsContact CD2-CZ2 3.47Å; L1096-W1100 HydrophobicContact CD2-CZ3 3.96Å; L1096-W1100 HydrophobicContact CG-CD2 3.82Å; L1096-W1100 HydrophobicContact CG-CE3 3.68Å; L1096-W1100 HydrophobicContact CG-CH2 3.6Å; L1096-W1100 HydrophobicContact CG-CZ2 3.84Å; L1096-W1100 HydrophobicContact CG-CZ3 3.51Å; L1096-W1100 VanDerWaalsContact O-CE3 3.22Å; L1096-W1100 WeakPolarHBondContact O-CZ3 3.46Å; L1096-L1103 WeakPolarHBondContact O-CA 3.22Å; L1096-I1104 PolarHBondContact N-O 3.29Å; L1096-I1104 PolarHBondContact O-N 3.21Å
1097	T	79.9	Confident	86.2	Confident	30 Å²	30	27.2 Å²	27.2	18%	0.184	15%	0.149	C	C	.	.			trans	-138.6	-49.9	-159.6	42.5	0	0	0	0	110.4	E1083 L1103	E1083-T1097 PolarHBondContact OE2-OG1 3.1Å; T1097-L1103 HydrophobicContact CG2-CD1 3.58Å
1098	H	67.9	Low	86.9	Confident	84 Å²	84	26.3 Å²	26.3	39%	0.389	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	138	-179.4	-63.1	97.3	0	0	0	112	E1083 W1100	E1083-H1098 VanDerWaalsContact CD-CE1 3.44Å; E1083-H1098 IonicContact OE1-CE1 3.98Å; E1083-H1098 PolarHBondContact OE1-CE1 2.97Å; E1083-H1098 VanDerWaalsContact OE1-CE1 3.31Å; E1083-H1098 IonicContact OE1-ND1 3.08Å; E1083-H1098 IonicContact OE2-CE1 3.46Å; E1083-H1098 PolarHBondContact OE2-CE1 3.15Å; E1083-H1098 IonicContact OE2-ND1 3.12Å; E1083-H1098 PolarHBondContact OE2-ND1 2.77Å; H1098-W1100 VanDerWaalsContact C-N 3.29Å; H1098-W1100 PolarHBondContact O-N 3.29Å
1099	G	60.3	Low	87.5	Confident	33 Å²	33	20 Å²	20	34%	0.34	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	19.2	-179.8	0	0	0	0	0	115.4
1100	W	70.1	Confident	88.1	Confident	17 Å²	17	17.4 Å²	17.4	6%	0.064	9%	0.093	C	C	.	.	B	Isolated β-bridge	trans	-139.4	134.9	-166.2	-109.2	33.7	0	0	0	113.5	R989 L1077 L1096 H1098 G1102 I1104	R989-W1100 VanDerWaalsContact CB-CD1 3.43Å; R989-W1100 HydrophobicContact CB-CD2 4.39Å; R989-W1100 HydrophobicContact CB-CG 3.95Å; L1077-W1100 HydrophobicContact CD2-CZ2 3.67Å; L1077-W1100 HydrophobicContact CG-CZ2 4.34Å; L1096-W1100 HydrophobicContact CB-CE3 4Å; L1096-W1100 HydrophobicContact CB-CH2 3.83Å; L1096-W1100 HydrophobicContact CB-CZ3 3.51Å; L1096-W1100 HydrophobicContact CD2-CD2 4.34Å; L1096-W1100 HydrophobicContact CD2-CE3 4.41Å; L1096-W1100 HydrophobicContact CD2-CH2 3.47Å; L1096-W1100 VanDerWaalsContact CD2-CH2 3.47Å; L1096-W1100 HydrophobicContact CD2-CZ2 3.47Å; L1096-W1100 VanDerWaalsContact CD2-CZ2 3.47Å; L1096-W1100 HydrophobicContact CD2-CZ3 3.96Å; L1096-W1100 HydrophobicContact CG-CD2 3.82Å; L1096-W1100 HydrophobicContact CG-CE3 3.68Å; L1096-W1100 HydrophobicContact CG-CH2 3.6Å; L1096-W1100 HydrophobicContact CG-CZ2 3.84Å; L1096-W1100 HydrophobicContact CG-CZ3 3.51Å; L1096-W1100 VanDerWaalsContact O-CE3 3.22Å; L1096-W1100 WeakPolarHBondContact O-CZ3 3.46Å; H1098-W1100 VanDerWaalsContact C-N 3.29Å; H1098-W1100 PolarHBondContact O-N 3.29Å; W1100-G1102 PolarHBondContact O-N 3.47Å; W1100-I1104 HydrophobicContact CE3-CG1 4.47Å; W1100-I1104 HydrophobicContact CH2-CB 3.86Å; W1100-I1104 HydrophobicContact CH2-CD1 3.43Å; W1100-I1104 VanDerWaalsContact CH2-CD1 3.43Å; W1100-I1104 HydrophobicContact CH2-CG1 3.58Å; W1100-I1104 HydrophobicContact CZ2-CD1 4.39Å; W1100-I1104 HydrophobicContact CZ3-CB 3.57Å; W1100-I1104 HydrophobicContact CZ3-CD1 3.8Å; W1100-I1104 HydrophobicContact CZ3-CG1 3.37Å
1101	A	73	Confident	88.5	Confident	9 Å²	9	17.7 Å²	17.7	7%	0.074	9%	0.09	C	C	.	.	S	Bend	trans	-79.5	57.1	170.9	0	0	0	0	0	112.3	R989 Q1154	R989-A1101 WeakPolarHBondContact O-CB 3.4Å; R989-A1101 PolarHBondContact O-N 3.32Å; A1101-Q1154 HydrophobicContact CB-CB 4.07Å; A1101-Q1154 PolarHBondContact O-N 2.86Å
1102	G	86.4	Confident	88.6	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.5	-164.8	-176.8	0	0	0	0	0	114.5	W1100 L1152 I1163	W1100-G1102 PolarHBondContact O-N 3.47Å; G1102-L1152 WeakPolarHBondContact CA-O 3.41Å; G1102-I1163 WeakPolarHBondContact O-CD1 3.47Å
1103	L	91.6	Very high	88.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	137.3	174.9	165.3	69.2	0	0	0	108.9	Y1095 L1096 T1097 V1105 L1152 I1163 H1165	Y1095-L1103 HydrophobicContact CD1-CD1 4.37Å; L1096-L1103 WeakPolarHBondContact O-CA 3.22Å; T1097-L1103 HydrophobicContact CG2-CD1 3.58Å; L1103-V1105 HydrophobicContact CD1-CG2 4.04Å; L1103-V1105 HydrophobicContact CD2-CG2 3.83Å; L1103-V1105 HydrophobicContact CG-CG2 3.9Å; L1103-L1152 HydrophobicContact CB-CB 4.21Å; L1103-L1152 HydrophobicContact CB-CD1 4.3Å; L1103-L1152 HydrophobicContact CB-CG 4.49Å; L1103-L1152 HydrophobicContact CD2-CD1 4.16Å; L1103-L1152 PolarHBondContact N-O 3.44Å; L1103-L1152 PolarHBondContact O-N 3.12Å; L1103-I1163 HydrophobicContact CB-CD1 3.88Å; L1103-I1163 HydrophobicContact CB-CG2 3.94Å; L1103-I1163 HydrophobicContact CD2-CG2 3.8Å; L1103-I1163 HydrophobicContact CG-CG2 4.46Å; L1103-H1165 HydrophobicContact CD2-CB 3.88Å
1104	I	94.8	Very high	88.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	136.5	159.4	-62.7	-173.4	0	0	0	108.7	I1074 T1078 Y1095 L1096 W1100 V1106 V1148 V1150 V1151	I1074-I1104 HydrophobicContact CD1-CD1 3.81Å; I1074-I1104 HydrophobicContact CG1-CD1 4.31Å; I1074-I1104 HydrophobicContact CG2-CD1 3.59Å; I1074-I1104 HydrophobicContact CG2-CG2 3.78Å; T1078-I1104 HydrophobicContact CG2-CB 4.18Å; T1078-I1104 HydrophobicContact CG2-CG2 3.91Å; Y1095-I1104 WeakPolarHBondContact CA-O 3.34Å; L1096-I1104 PolarHBondContact N-O 3.29Å; L1096-I1104 PolarHBondContact O-N 3.21Å; W1100-I1104 HydrophobicContact CE3-CG1 4.47Å; W1100-I1104 HydrophobicContact CH2-CB 3.86Å; W1100-I1104 HydrophobicContact CH2-CD1 3.43Å; W1100-I1104 VanDerWaalsContact CH2-CD1 3.43Å; W1100-I1104 HydrophobicContact CH2-CG1 3.58Å; W1100-I1104 HydrophobicContact CZ2-CD1 4.39Å; W1100-I1104 HydrophobicContact CZ3-CB 3.57Å; W1100-I1104 HydrophobicContact CZ3-CD1 3.8Å; W1100-I1104 HydrophobicContact CZ3-CG1 3.37Å; I1104-V1106 HydrophobicContact CG2-CG2 4.06Å; I1104-V1148 HydrophobicContact CG2-CG1 3.96Å; I1104-V1150 WeakPolarHBondContact CA-O 3.37Å; I1104-V1151 HydrophobicContact CD1-CB 4.11Å; I1104-V1151 HydrophobicContact CD1-CG1 3.65Å; I1104-V1151 HydrophobicContact CD1-CG2 3.59Å; I1104-V1151 HydrophobicContact CG1-CB 3.99Å; I1104-V1151 HydrophobicContact CG1-CG1 3.71Å; I1104-V1151 HydrophobicContact CG1-CG2 3.79Å; I1104-V1151 HydrophobicContact CG2-CG2 4.28Å
1105	V	96.1	Very high	88.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.8	172.5	-169.6	0	0	0	0	108.7	Y1095 L1103 L1149 V1150 L1167	Y1095-V1105 HydrophobicContact CD1-CB 4.5Å; Y1095-V1105 HydrophobicContact CD1-CG1 4.05Å; Y1095-V1105 HydrophobicContact CD1-CG2 3.93Å; Y1095-V1105 HydrophobicContact CE1-CG1 3.83Å; Y1095-V1105 HydrophobicContact CE1-CG2 4.21Å; L1103-V1105 HydrophobicContact CD1-CG2 4.04Å; L1103-V1105 HydrophobicContact CD2-CG2 3.83Å; L1103-V1105 HydrophobicContact CG-CG2 3.9Å; V1105-L1149 HydrophobicContact CB-CB 4.42Å; V1105-L1149 HydrophobicContact CG1-CD1 4.02Å; V1105-L1149 PolarHBondContact O-N 3.45Å; V1105-V1150 HydrophobicContact CB-CG1 4.15Å; V1105-V1150 HydrophobicContact CG2-CG1 3.87Å; V1105-V1150 PolarHBondContact N-O 2.79Å; V1105-L1167 HydrophobicContact CG1-CD1 4.37Å
1106	V	97.3	Very high	88.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	142.9	169.3	172.9	0	0	0	0	109.2	I1075 T1078 C1093 Y1094 I1104 Q1147 V1148	I1075-V1106 HydrophobicContact CG1-CG1 4.29Å; I1075-V1106 HydrophobicContact CG1-CG2 4.38Å; T1078-V1106 HydrophobicContact CG2-CG2 3.97Å; T1078-V1106 VanDerWaalsContact OG1-CG2 3.25Å; T1078-V1106 WeakPolarHBondContact OG1-CG2 3.32Å; C1093-V1106 CarbonylContact C-O 3.5Å; C1093-V1106 WeakPolarHBondContact CA-O 3.36Å; Y1094-V1106 HydrophobicContact CD2-CG1 4.48Å; Y1094-V1106 PolarHBondContact N-O 3.15Å; Y1094-V1106 PolarHBondContact O-N 3.23Å; I1104-V1106 HydrophobicContact CG2-CG2 4.06Å; V1106-Q1147 WeakPolarHBondContact CA-O 3.2Å; V1106-V1148 HydrophobicContact CG2-CB 4.39Å; V1106-V1148 HydrophobicContact CG2-CG1 4.47Å; V1106-V1148 HydrophobicContact CG2-CG2 4.02Å
1107	V	96.9	Very high	88.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	139.9	175	61	0	0	0	0	110.8	M1091 T1092 L1116 V1118 V1141 R1146 Q1147 L1149	M1091-V1107 HydrophobicContact CE-CG2 3.96Å; M1091-V1107 HydrophobicContact CG-CG2 4.3Å; T1092-V1107 CarbonylContact O-C 3.59Å; T1092-V1107 WeakPolarHBondContact O-CA 3.26Å; V1107-L1116 HydrophobicContact CG2-CD2 3.64Å; V1107-V1118 HydrophobicContact CG1-CG2 4.5Å; V1107-V1118 HydrophobicContact CG2-CG2 4.29Å; V1107-V1141 HydrophobicContact CG1-CG2 3.65Å; V1107-R1146 CarbonylContact O-C 3.42Å; V1107-R1146 WeakPolarHBondContact O-CA 3.38Å; V1107-R1146 WeakPolarHBondContact O-CB 3.23Å; V1107-Q1147 HydrophobicContact CG1-CB 4.27Å; V1107-Q1147 PolarHBondContact N-O 2.85Å; V1107-Q1147 PolarHBondContact O-N 2.89Å; V1107-L1149 HydrophobicContact CB-CD1 4.27Å; V1107-L1149 HydrophobicContact CG1-CD1 3.88Å; V1107-L1149 HydrophobicContact CG1-CD2 3.69Å; V1107-L1149 HydrophobicContact CG1-CG 3.78Å
1108	E	96.6	Very high	89.7	Confident	24 Å²	24	35 Å²	35	11%	0.112	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.8	166.6	-63.4	-179.3	99.5	0	0	109.9	M1091 T1092 Y1094 R1110 R1146 L1204	M1091-E1108 WeakPolarHBondContact CA-O 3.38Å; T1092-E1108 PolarHBondContact N-O 2.78Å; T1092-E1108 PolarHBondContact O-N 3.12Å; Y1094-E1108 HydrophobicContact CE2-CG 3.9Å; Y1094-E1108 WeakPolarHBondContact CE2-OE2 3.48Å; Y1094-E1108 PolarHBondContact OH-OE2 2.68Å; E1108-R1110 HydrophobicContact CB-CG 3.99Å; E1108-R1146 HydrophobicContact CG-CB 4.05Å; E1108-L1204 HydrophobicContact CB-CD2 4.09Å; E1108-L1204 HydrophobicContact CG-CD2 3.92Å; E1108-L1204 WeakPolarHBondContact OE1-CD2 3.34Å
1109	N	96.4	Very high	91	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.016	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	89.2	162.6	-177.8	10.6	0	0	0	109.2	G1090 H1111 Y1114 L1116 V1141 P1142 L1144 H1145	G1090-N1109 CarbonylContact O-C 3.57Å; N1109-H1111 PolarHBondContact O-N 3.36Å; N1109-H1111 WeakPolarHBondContact OD1-CB 3.3Å; N1109-H1111 PolarHBondContact OD1-N 2.86Å; N1109-H1111 VanDerWaalsContact OD1-N 3.11Å; N1109-Y1114 PolarHBondContact ND2-O 3.45Å; N1109-L1116 HydrophobicContact CB-CB 3.93Å; N1109-L1116 HydrophobicContact CB-CD2 4.13Å; N1109-L1116 PolarHBondContact ND2-N 2.81Å; N1109-V1141 HydrophobicContact CB-CB 4.03Å; N1109-V1141 HydrophobicContact CB-CG1 3.77Å; N1109-V1141 PolarHBondContact ND2-O 2.94Å; N1109-P1142 WeakPolarHBondContact CB-O 3.29Å; N1109-P1142 VanDerWaalsContact ND2-C 3.34Å; N1109-P1142 PolarHBondContact ND2-O 2.81Å; N1109-L1144 WeakPolarHBondContact O-CA 3.05Å; N1109-L1144 PolarHBondContact O-N 3.16Å; N1109-H1145 PolarHBondContact N-O 2.92Å; N1109-H1145 PolarHBondContact O-N 3.07Å
1110	R	95.4	Very high	92.7	Very high	97 Å²	97	30.2 Å²	30.2	37%	0.366	14%	0.138	S	C	.	.			trans	-78.1	4	174.9	-55	-173.6	-72.6	145	-1.2	112.6	E1086 G1090 T1092 E1108 L1204	E1086-R1110 IonicContact OE1-CZ 2.72Å; E1086-R1110 IonicContact OE1-NH2 2.68Å; E1086-R1110 PolarHBondContact OE1-NH2 2.96Å; E1086-R1110 IonicContact OE2-CZ 3.8Å; E1086-R1110 IonicContact OE2-NH2 3.24Å; E1086-R1110 PolarHBondContact OE2-NH2 2.61Å; G1090-R1110 WeakPolarHBondContact O-CA 3.37Å; G1090-R1110 PolarHBondContact O-N 3.14Å; T1092-R1110 PolarHBondContact OG1-NE 2.89Å; T1092-R1110 PolarHBondContact OG1-NH2 2.88Å; E1108-R1110 HydrophobicContact CB-CG 3.99Å; R1110-L1204 HydrophobicContact CB-CD1 4.39Å; R1110-L1204 HydrophobicContact CG-CD1 3.96Å
1111	H	94.1	Very high	93.9	Very high	24 Å²	24	30.7 Å²	30.7	11%	0.111	14%	0.142	C	C	.	.			trans	-78.2	132.8	178.3	-159.9	-91.7	0	0	0	111.6	G1090 N1109 K1113 Y1114 P1143 L1144 K1171	G1090-H1111 PolarHBondContact O-N 2.73Å; N1109-H1111 PolarHBondContact O-N 3.36Å; N1109-H1111 WeakPolarHBondContact OD1-CB 3.3Å; N1109-H1111 PolarHBondContact OD1-N 2.86Å; N1109-H1111 VanDerWaalsContact OD1-N 3.11Å; H1111-K1113 PolarHBondContact ND1-N 3.06Å; H1111-K1113 PolarHBondContact O-N 3.35Å; H1111-Y1114 AromaticContact CE1-CD2 3.09Å; H1111-Y1114 WeakPolarHBondContact CE1-CD2 3.35Å; H1111-Y1114 AromaticContact CE1-CE2 3.7Å; H1111-Y1114 AromaticContact CE1-CG 3.84Å; H1111-Y1114 AromaticContact ND1-CD2 3.55Å; H1111-Y1114 AromaticContact ND1-CG 3.86Å; H1111-Y1114 PolarHBondContact ND1-N 2.99Å; H1111-Y1114 AromaticContact NE2-CD2 3.82Å; H1111-P1143 VanDerWaalsContact O-CA 3.3Å; H1111-P1143 WeakPolarHBondContact O-CA 3.23Å; H1111-P1143 WeakPolarHBondContact O-CB 3.37Å; H1111-L1144 PolarHBondContact O-N 2.8Å; H1111-K1171 PolarHBondContact CD2-NZ 3.06Å; H1111-K1171 PolarHBondContact NE2-NZ 3.28Å; H1111-K1171 VanDerWaalsContact NE2-NZ 3.15Å
1112	P	94	Very high	95	Very high	87 Å²	87	30.2 Å²	30.2	57%	0.565	14%	0.139	S	C	*	.	S	Bend	trans	-81.5	-11.8	-172.7	30.9	-36.5	0	0	0	115.3
1113	K	94.4	Very high	95.4	Very high	167 Å²	167	33.7 Å²	33.7	73%	0.726	16%	0.159	S	C	*	.	S	Bend	trans	-133.9	-6.6	-169	-68.1	-175.1	179.7	-180	0	116.9	H1111	H1111-K1113 PolarHBondContact ND1-N 3.06Å; H1111-K1113 PolarHBondContact O-N 3.35Å
1114	Y	95.3	Very high	95.4	Very high	107 Å²	107	37.8 Å²	37.8	42%	0.42	18%	0.182	S	C	.	.			trans	-131.8	144.2	-173.6	-67.2	-46.2	0	0	0	110.9	N1109 H1111 K1171 A1172	N1109-Y1114 PolarHBondContact ND2-O 3.45Å; H1111-Y1114 AromaticContact CE1-CD2 3.09Å; H1111-Y1114 WeakPolarHBondContact CE1-CD2 3.35Å; H1111-Y1114 AromaticContact CE1-CE2 3.7Å; H1111-Y1114 AromaticContact CE1-CG 3.84Å; H1111-Y1114 AromaticContact ND1-CD2 3.55Å; H1111-Y1114 AromaticContact ND1-CG 3.86Å; H1111-Y1114 PolarHBondContact ND1-N 2.99Å; H1111-Y1114 AromaticContact NE2-CD2 3.82Å; Y1114-K1171 HydrophobicContact CD2-CD 4.16Å; Y1114-A1172 WeakPolarHBondContact CA-O 3.48Å; Y1114-A1172 WeakPolarHBondContact CB-O 3.26Å
1115	Y	95.6	Very high	95.3	Very high	74 Å²	74	38.7 Å²	38.7	29%	0.29	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	150.7	166.2	-67.5	-93.8	0	0	0	109.1	V1141 P1142 K1171 A1172 A1175	Y1115-V1141 WeakPolarHBondContact CA-O 3.39Å; Y1115-P1142 HydrophobicContact CD1-CB 4.34Å; Y1115-P1142 HydrophobicContact CE1-CB 3.99Å; Y1115-P1142 HydrophobicContact CE1-CG 4.27Å; Y1115-K1171 CarbonylContact O-C 3.54Å; Y1115-A1172 PolarHBondContact N-O 2.94Å; Y1115-A1172 PolarHBondContact O-N 3.4Å; Y1115-A1175 HydrophobicContact CD1-CB 3.79Å; Y1115-A1175 HydrophobicContact CE1-CB 3.52Å; Y1115-A1175 HydrophobicContact CE2-CB 4.41Å; Y1115-A1175 HydrophobicContact CG-CB 4.36Å
1116	L	95.4	Very high	94.9	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	110.3	173.3	178.9	72.1	0	0	0	107.9	M1091 V1107 N1109 V1118 V1141	M1091-L1116 HydrophobicContact CB-CD1 4.29Å; M1091-L1116 HydrophobicContact CB-CD2 4Å; M1091-L1116 HydrophobicContact CE-CD2 4.13Å; M1091-L1116 HydrophobicContact CG-CD1 4.31Å; M1091-L1116 HydrophobicContact CG-CD2 3.6Å; M1091-L1116 HydrophobicContact SD-CD1 3.67Å; M1091-L1116 HydrophobicContact SD-CD2 3.72Å; M1091-L1116 HydrophobicContact SD-CG 4.21Å; V1107-L1116 HydrophobicContact CG2-CD2 3.64Å; N1109-L1116 HydrophobicContact CB-CB 3.93Å; N1109-L1116 HydrophobicContact CB-CD2 4.13Å; N1109-L1116 PolarHBondContact ND2-N 2.81Å; L1116-V1118 HydrophobicContact CD2-CG2 3.77Å; L1116-V1118 HydrophobicContact CG-CG2 3.68Å; L1116-V1141 HydrophobicContact CB-CB 4.26Å; L1116-V1141 PolarHBondContact N-O 2.9Å; L1116-V1141 PolarHBondContact O-N 3.18Å
1117	H	95.7	Very high	94.5	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.023	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124	172.8	-64	174.2	0	0	0	108.3	D1139 S1140 H1169 R1170 A1172 Q1174 S1176 L1177 W1180	H1117-D1139 WeakPolarHBondContact CA-O 3.29Å; H1117-S1140 PolarHBondContact CD2-OG 3.47Å; H1117-S1140 PolarHBondContact NE2-OG 2.94Å; H1117-H1169 CarbonylContact O-C 3.5Å; H1117-H1169 VanDerWaalsContact O-CA 3.25Å; H1117-H1169 WeakPolarHBondContact O-CA 3.4Å; H1117-R1170 HydrophobicContact CB-CG 3.86Å; H1117-R1170 PolarHBondContact N-O 3.36Å; H1117-R1170 PolarHBondContact O-N 2.67Å; H1117-A1172 WeakPolarHBondContact CE1-CB 3.5Å; H1117-Q1174 PolarHBondContact CE1-O 3.3Å; H1117-Q1174 PolarHBondContact NE2-O 3.19Å; H1117-Q1174 VanDerWaalsContact NE2-O 3.1Å; H1117-S1176 PolarHBondContact CE1-O 2.78Å; H1117-L1177 HydrophobicContact CB-CD2 4.1Å; H1117-W1180 HydrophobicContact CB-CE3 4Å; H1117-W1180 HydrophobicContact CB-CZ3 3.8Å
1118	V	95.6	Very high	94.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.7	-178.2	-168.5	0	0	0	0	109.3	M1091 V1107 L1116 I1138 D1139 V1141 L1149 L1167 A1168 H1169	M1091-V1118 HydrophobicContact CE-CG1 4.45Å; M1091-V1118 HydrophobicContact CE-CG2 4.21Å; V1107-V1118 HydrophobicContact CG1-CG2 4.5Å; V1107-V1118 HydrophobicContact CG2-CG2 4.29Å; L1116-V1118 HydrophobicContact CD2-CG2 3.77Å; L1116-V1118 HydrophobicContact CG-CG2 3.68Å; V1118-I1138 CarbonylContact O-C 3.4Å; V1118-I1138 VanDerWaalsContact O-CA 3.29Å; V1118-I1138 WeakPolarHBondContact O-CA 3.49Å; V1118-D1139 PolarHBondContact N-O 3.4Å; V1118-D1139 PolarHBondContact O-N 2.99Å; V1118-V1141 HydrophobicContact CG2-CG2 4.28Å; V1118-L1149 HydrophobicContact CB-CD1 4.19Å; V1118-L1149 HydrophobicContact CG1-CD1 3.68Å; V1118-L1167 HydrophobicContact CG1-CD1 3.56Å; V1118-L1167 HydrophobicContact CG1-CD2 3.91Å; V1118-L1167 HydrophobicContact CG1-CG 3.72Å; V1118-A1168 CarbonylContact C-O 3.56Å; V1118-A1168 WeakPolarHBondContact CA-O 3.42Å; V1118-H1169 HydrophobicContact CG2-CB 4.49Å
1119	S	95.8	Very high	93.9	Very high	15 Å²	15	47.1 Å²	47.1	11%	0.105	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117.7	169.6	172.5	0	0	0	0	108.4	T1137 L1167 A1168	S1119-T1137 CarbonylContact C-O 3.57Å; S1119-T1137 VanDerWaalsContact CA-O 3.32Å; S1119-T1137 WeakPolarHBondContact CA-O 3.47Å; S1119-L1167 WeakPolarHBondContact O-CA 3.43Å; S1119-A1168 PolarHBondContact N-O 2.98Å; S1119-A1168 PolarHBondContact O-N 3.1Å
1120	C	95.8	Very high	93.7	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	114.8	172.1	-169.5	0	0	0	0	108.8	K1136 T1137 L1149 L1167	C1120-K1136 CarbonylContact O-C 3.58Å; C1120-K1136 WeakPolarHBondContact O-CA 3.35Å; C1120-T1137 PolarHBondContact N-O 3.13Å; C1120-T1137 PolarHBondContact O-N 2.8Å; C1120-L1149 HydrophobicContact CB-CD1 4.43Å; C1120-L1167 HydrophobicContact CB-CD1 3.84Å
1121	D	96.3	Very high	93.6	Very high	27 Å²	27	42.9 Å²	42.9	14%	0.144	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	109	-178.3	-164.5	-19.6	0	0	0	110.4	T1123 K1136 H1165 R1166	D1121-T1123 WeakPolarHBondContact OD1-CB 3.34Å; D1121-T1123 VanDerWaalsContact OD1-CG2 3.3Å; D1121-T1123 WeakPolarHBondContact OD1-CG2 3.46Å; D1121-T1123 PolarHBondContact OD1-N 2.61Å; D1121-T1123 PolarHBondContact OD1-OG1 2.76Å; D1121-K1136 HydrophobicContact CB-CD 4.36Å; D1121-K1136 HydrophobicContact CB-CG 4.22Å; D1121-K1136 WeakPolarHBondContact OD2-CD 3.13Å; D1121-K1136 VanDerWaalsContact OD2-CE 3.23Å; D1121-K1136 WeakPolarHBondContact OD2-CE 3.48Å; D1121-K1136 IonicContact OD2-NZ 2.72Å; D1121-K1136 PolarHBondContact OD2-NZ 3.13Å; D1121-H1165 CarbonylContact O-C 3.51Å; D1121-H1165 WeakPolarHBondContact O-CA 3.15Å; D1121-R1166 PolarHBondContact N-O 3.44Å; D1121-R1166 PolarHBondContact O-N 3.47Å
1122	C	95.3	Very high	93.5	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.			trans	-114.4	18.4	-179.7	-51.7	0	0	0	0	112.8	D1124 S1125 L1135 L1152 T1164 H1165	C1122-D1124 PolarHBondContact O-N 2.73Å; C1122-S1125 VanDerWaalsContact O-CB 3.23Å; C1122-S1125 WeakPolarHBondContact O-CB 3.28Å; C1122-S1125 PolarHBondContact O-N 3.15Å; C1122-S1125 VanDerWaalsContact O-N 3.14Å; C1122-S1125 PolarHBondContact O-OG 2.78Å; C1122-L1135 WeakPolarHBondContact CA-O 3.24Å; C1122-L1135 WeakPolarHBondContact CB-O 3.28Å; C1122-L1135 PolarHBondContact N-O 2.81Å; C1122-L1152 HydrophobicContact CB-CD1 3.79Å; C1122-T1164 CarbonylContact C-O 3.46Å; C1122-T1164 WeakPolarHBondContact CA-O 3.35Å; C1122-H1165 VanDerWaalsContact SG-CB 3.56Å
1123	T	94.8	Very high	93.4	Very high	73 Å²	73	40.2 Å²	40.2	45%	0.448	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.9	-172.5	48.4	0	0	0	0	114.7	D1121 S1125 L1135 K1136	D1121-T1123 WeakPolarHBondContact OD1-CB 3.34Å; D1121-T1123 VanDerWaalsContact OD1-CG2 3.3Å; D1121-T1123 WeakPolarHBondContact OD1-CG2 3.46Å; D1121-T1123 PolarHBondContact OD1-N 2.61Å; D1121-T1123 PolarHBondContact OD1-OG1 2.76Å; T1123-S1125 PolarHBondContact O-N 2.76Å; T1123-L1135 HydrophobicContact CG2-CB 4.09Å; T1123-K1136 HydrophobicContact CG2-CB 4.13Å
1124	D	92.6	Very high	93.3	Very high	87 Å²	87	34.2 Å²	34.2	47%	0.465	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	24.3	174.2	-68.6	-35.4	0	0	0	113.5	C1122 T1164 R1166	C1122-D1124 PolarHBondContact O-N 2.73Å; D1124-T1164 HydrophobicContact CB-CG2 3.7Å; D1124-T1164 VanDerWaalsContact O-CB 3.25Å; D1124-T1164 WeakPolarHBondContact O-CB 3.24Å; D1124-T1164 PolarHBondContact O-OG1 2.91Å; D1124-R1166 IonicContact OD2-CZ 3.78Å; D1124-R1166 IonicContact OD2-NH1 3.45Å; D1124-R1166 PolarHBondContact OD2-NH1 3.11Å; D1124-R1166 IonicContact OD2-NH2 3.77Å; D1124-R1166 PolarHBondContact OD2-NH2 3.31Å
1125	S	91.3	Very high	93.2	Very high	18 Å²	18	31.3 Å²	31.3	13%	0.126	18%	0.178	C	C	.	.			trans	-102.2	152.7	178.9	-56.2	0	0	0	0	112.2	C1122 T1123 V1128 S1162 T1164	C1122-S1125 VanDerWaalsContact O-CB 3.23Å; C1122-S1125 WeakPolarHBondContact O-CB 3.28Å; C1122-S1125 PolarHBondContact O-N 3.15Å; C1122-S1125 VanDerWaalsContact O-N 3.14Å; C1122-S1125 PolarHBondContact O-OG 2.78Å; T1123-S1125 PolarHBondContact O-N 2.76Å; S1125-V1128 VanDerWaalsContact CB-CG2 3.49Å; S1125-S1162 WeakPolarHBondContact CA-O 3.34Å; S1125-S1162 WeakPolarHBondContact CB-O 3.4Å; S1125-T1164 PolarHBondContact OG-N 3.3Å; S1125-T1164 PolarHBondContact OG-O 2.92Å
1126	F	89.2	Confident	93.2	Very high	137 Å²	137	31.9 Å²	31.9	60%	0.601	18%	0.182	S	C	*	.	B	Isolated β-bridge	trans	-129.5	144.4	-175.9	176.4	-97	0	0	0	112.7	V1128 F1161 S1162	F1126-V1128 VanDerWaalsContact C-N 3.26Å; F1126-V1128 PolarHBondContact O-N 2.98Å; F1126-F1161 WeakPolarHBondContact O-CA 3.46Å; F1126-F1161 WeakPolarHBondContact O-CB 3.25Å; F1126-S1162 WeakPolarHBondContact CB-OG 3.41Å; F1126-S1162 PolarHBondContact N-O 2.85Å; F1126-S1162 PolarHBondContact O-N 3.3Å
1127	N	87.8	Confident	93.3	Very high	21 Å²	21	31.8 Å²	31.8	11%	0.112	18%	0.182	C	C	.	.	S	Bend	trans	52.1	41.3	-176	-173.4	22.5	0	0	0	113.2	Q1154 L1155 E1156 A1159 G1160 F1161	N1127-Q1154 WeakPolarHBondContact O-CA 3.26Å; N1127-L1155 PolarHBondContact O-N 2.63Å; N1127-L1155 WeakPolarHBondContact OD1-CB 3.48Å; N1127-E1156 PolarHBondContact ND2-O 3.44Å; N1127-E1156 PolarHBondContact OD1-N 2.91Å; N1127-A1159 PolarHBondContact ND2-O 2.81Å; N1127-G1160 VanDerWaalsContact CB-O 3.3Å; N1127-G1160 WeakPolarHBondContact CB-O 3.33Å; N1127-G1160 PolarHBondContact ND2-O 3.38Å; N1127-F1161 HydrophobicContact CB-CB 3.96Å
1128	V	89.1	Confident	93.3	Very high	17 Å²	17	32.5 Å²	32.5	10%	0.103	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.6	175	-65.1	0	0	0	0	112.4	S1125 F1126 L1135 S1153 F1161 I1163	S1125-V1128 VanDerWaalsContact CB-CG2 3.49Å; F1126-V1128 VanDerWaalsContact C-N 3.26Å; F1126-V1128 PolarHBondContact O-N 2.98Å; V1128-L1135 HydrophobicContact CG2-CD2 4.2Å; V1128-S1153 CarbonylContact C-O 3.57Å; V1128-S1153 WeakPolarHBondContact CA-O 3.47Å; V1128-S1153 WeakPolarHBondContact CB-O 3.1Å; V1128-F1161 HydrophobicContact CG1-CB 4.29Å; V1128-F1161 HydrophobicContact CG1-CD2 4.13Å; V1128-I1163 HydrophobicContact CG1-CG1 4.21Å
1129	V	91.1	Very high	93.4	Very high	26 Å²	26	32.5 Å²	32.5	16%	0.158	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	157	173.6	-73.1	0	0	0	0	111	N1014 M1018 L1152 S1153 L1155	N1014-V1129 HydrophobicContact CB-CG2 4.02Å; M1018-V1129 HydrophobicContact CE-CG1 3.78Å; V1129-L1152 CarbonylContact O-C 3.46Å; V1129-L1152 VanDerWaalsContact O-CA 3.28Å; V1129-L1152 WeakPolarHBondContact O-CA 3.39Å; V1129-S1153 PolarHBondContact N-O 3.29Å; V1129-S1153 PolarHBondContact O-N 2.82Å; V1129-L1155 HydrophobicContact CG1-CB 4.14Å; V1129-L1155 HydrophobicContact CG1-CD1 3.98Å; V1129-L1155 HydrophobicContact CG1-CD2 3.95Å; V1129-L1155 HydrophobicContact CG1-CG 4.24Å; V1129-L1155 HydrophobicContact CG2-CB 4.4Å; V1129-L1155 HydrophobicContact CG2-CD1 4.28Å
1130	S	92.8	Very high	93.4	Very high	11 Å²	11	31.9 Å²	31.9	8%	0.077	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.9	-170.9	172.6	0	0	0	0	111.2	R1132 G1133 S1134 V1150 V1151	S1130-R1132 PolarHBondContact O-N 2.75Å; S1130-R1132 VanDerWaalsContact O-N 3.08Å; S1130-R1132 PolarHBondContact OG-N 2.7Å; S1130-G1133 PolarHBondContact O-N 3.37Å; S1130-S1134 VanDerWaalsContact CB-O 3.25Å; S1130-S1134 WeakPolarHBondContact CB-O 2.92Å; S1130-S1134 PolarHBondContact OG-O 2.89Å; S1130-V1150 WeakPolarHBondContact OG-CG2 3.49Å; S1130-V1151 WeakPolarHBondContact CA-O 3.38Å
1131	T	93	Very high	93.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.7	172.9	55.5	0	0	0	0	113.4	F1013 W1016 Q1017 V1151 L1198 H1199	F1013-T1131 HydrophobicContact CB-CG2 3.91Å; F1013-T1131 HydrophobicContact CD1-CG2 3.68Å; F1013-T1131 HydrophobicContact CG-CG2 4.16Å; W1016-T1131 HydrophobicContact CB-CG2 4.26Å; W1016-T1131 HydrophobicContact CD2-CG2 3.85Å; W1016-T1131 HydrophobicContact CE3-CG2 3.72Å; W1016-T1131 HydrophobicContact CG-CG2 4.1Å; W1016-T1131 HydrophobicContact CZ3-CG2 4.38Å; Q1017-T1131 PolarHBondContact NE2-O 3.02Å; T1131-V1151 HydrophobicContact CG2-CB 3.71Å; T1131-V1151 HydrophobicContact CG2-CG1 4.09Å; T1131-V1151 HydrophobicContact CG2-CG2 4.46Å; T1131-V1151 PolarHBondContact N-O 3.36Å; T1131-V1151 WeakPolarHBondContact OG1-CB 3.43Å; T1131-V1151 PolarHBondContact OG1-N 3.12Å; T1131-V1151 PolarHBondContact OG1-O 2.94Å; T1131-L1198 HydrophobicContact CG2-CD2 4.16Å; T1131-H1199 PolarHBondContact OG1-CE1 3.29Å; T1131-H1199 VanDerWaalsContact OG1-CE1 3.24Å; T1131-H1199 PolarHBondContact OG1-NE2 3.1Å
1132	R	92.7	Very high	93.5	Very high	5 Å²	5	32 Å²	32	2%	0.019	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-7.3	175	-67.2	-74	-57.8	-91.1	9	113.8	S1130 S1134 T1137 D1139 L1149 V1150 P1189 H1199	S1130-R1132 PolarHBondContact O-N 2.75Å; S1130-R1132 VanDerWaalsContact O-N 3.08Å; S1130-R1132 PolarHBondContact OG-N 2.7Å; R1132-S1134 PolarHBondContact O-N 2.88Å; R1132-T1137 HydrophobicContact CB-CG2 3.99Å; R1132-T1137 HydrophobicContact CG-CG2 3.88Å; R1132-D1139 IonicContact CZ-OD1 3.48Å; R1132-D1139 VanDerWaalsContact CZ-OD1 3.28Å; R1132-D1139 IonicContact CZ-OD2 3.88Å; R1132-D1139 IonicContact NH1-OD1 3.17Å; R1132-D1139 PolarHBondContact NH1-OD1 2.82Å; R1132-D1139 IonicContact NH1-OD2 2.81Å; R1132-D1139 PolarHBondContact NH1-OD2 3.48Å; R1132-D1139 IonicContact NH2-OD1 3.55Å; R1132-D1139 PolarHBondContact NH2-OD1 2.99Å; R1132-D1139 IonicContact NH2-OD2 2.71Å; R1132-L1149 VanDerWaalsContact CG-O 3.31Å; R1132-L1149 WeakPolarHBondContact CG-O 3.47Å; R1132-L1149 PolarHBondContact NH1-O 3.5Å; R1132-V1150 HydrophobicContact CG-CG2 4.45Å; R1132-P1189 PolarHBondContact NH2-O 2.83Å; R1132-P1189 VanDerWaalsContact O-CG 3.32Å; R1132-P1189 WeakPolarHBondContact O-CG 2.92Å; R1132-H1199 VanDerWaalsContact CD-CG 3.45Å
1133	G	90.9	Very high	93.5	Very high	51 Å²	51	33.5 Å²	33.5	53%	0.526	19%	0.193	S	C	.	.	S	Bend	trans	73.3	4.4	-177.2	0	0	0	0	0	114.6	Q1017 S1130	Q1017-G1133 VanDerWaalsContact CD-CA 3.49Å; S1130-G1133 PolarHBondContact O-N 3.37Å
1134	S	92.9	Very high	93.6	Very high	40 Å²	40	34.2 Å²	34.2	28%	0.28	19%	0.194	S	C	.	.	S	Bend	trans	-143.2	141.2	178.5	177.7	0	0	0	0	108.8	S1130 R1132 K1136	S1130-S1134 VanDerWaalsContact CB-O 3.25Å; S1130-S1134 WeakPolarHBondContact CB-O 2.92Å; S1130-S1134 PolarHBondContact OG-O 2.89Å; R1132-S1134 PolarHBondContact O-N 2.88Å; S1134-K1136 WeakPolarHBondContact CB-O 3.4Å; S1134-K1136 PolarHBondContact O-N 3.42Å; S1134-K1136 PolarHBondContact OG-N 2.89Å; S1134-K1136 PolarHBondContact OG-O 3.11Å
1135	L	94.6	Very high	93.8	Very high	46 Å²	46	32.4 Å²	32.4	24%	0.241	18%	0.182	C	C	.	.	S	Bend	trans	-76.4	-6.8	168.2	-63.5	179.1	0	0	0	112.2	C1122 T1123 V1128 L1152	C1122-L1135 WeakPolarHBondContact CA-O 3.24Å; C1122-L1135 WeakPolarHBondContact CB-O 3.28Å; C1122-L1135 PolarHBondContact N-O 2.81Å; T1123-L1135 HydrophobicContact CG2-CB 4.09Å; V1128-L1135 HydrophobicContact CG2-CD2 4.2Å; L1135-L1152 HydrophobicContact CD2-CD2 3.75Å
1136	K	95.4	Very high	94	Very high	86 Å²	86	33.5 Å²	33.5	37%	0.374	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.4	174.6	-172.4	169.2	-171.1	149.2	0	111.1	C1120 D1121 T1123 S1134	C1120-K1136 CarbonylContact O-C 3.58Å; C1120-K1136 WeakPolarHBondContact O-CA 3.35Å; D1121-K1136 HydrophobicContact CB-CD 4.36Å; D1121-K1136 HydrophobicContact CB-CG 4.22Å; D1121-K1136 WeakPolarHBondContact OD2-CD 3.13Å; D1121-K1136 VanDerWaalsContact OD2-CE 3.23Å; D1121-K1136 WeakPolarHBondContact OD2-CE 3.48Å; D1121-K1136 IonicContact OD2-NZ 2.72Å; D1121-K1136 PolarHBondContact OD2-NZ 3.13Å; T1123-K1136 HydrophobicContact CG2-CB 4.13Å; S1134-K1136 WeakPolarHBondContact CB-O 3.4Å; S1134-K1136 PolarHBondContact O-N 3.42Å; S1134-K1136 PolarHBondContact OG-N 2.89Å; S1134-K1136 PolarHBondContact OG-O 3.11Å
1137	T	95.9	Very high	94.4	Very high	1 Å²	1	27 Å²	27	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.8	173.4	83.6	0	0	0	0	110.8	S1119 C1120 R1132 D1139 V1150 S1188	S1119-T1137 CarbonylContact C-O 3.57Å; S1119-T1137 VanDerWaalsContact CA-O 3.32Å; S1119-T1137 WeakPolarHBondContact CA-O 3.47Å; C1120-T1137 PolarHBondContact N-O 3.13Å; C1120-T1137 PolarHBondContact O-N 2.8Å; R1132-T1137 HydrophobicContact CB-CG2 3.99Å; R1132-T1137 HydrophobicContact CG-CG2 3.88Å; T1137-D1139 VanDerWaalsContact CB-OD2 3.23Å; T1137-D1139 WeakPolarHBondContact CB-OD2 3.31Å; T1137-D1139 PolarHBondContact OG1-OD2 3.13Å; T1137-V1150 HydrophobicContact CG2-CB 4.29Å; T1137-S1188 CarbonylContact C-O 3.59Å; T1137-S1188 VanDerWaalsContact CA-O 3.26Å; T1137-S1188 WeakPolarHBondContact CA-O 3.19Å
1138	I	96.4	Very high	94.9	Very high	20 Å²	20	26 Å²	26	10%	0.103	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	119.3	170.9	-47	-178.5	0	0	0	107	V1118 L1177 W1180 H1187 S1188	V1118-I1138 CarbonylContact O-C 3.4Å; V1118-I1138 VanDerWaalsContact O-CA 3.29Å; V1118-I1138 WeakPolarHBondContact O-CA 3.49Å; I1138-L1177 HydrophobicContact CB-CD1 4.18Å; I1138-L1177 HydrophobicContact CG2-CD1 3.89Å; I1138-L1177 HydrophobicContact CG2-CD2 3.94Å; I1138-L1177 HydrophobicContact CG2-CG 4.43Å; I1138-L1177 WeakPolarHBondContact O-CD1 3.48Å; I1138-W1180 HydrophobicContact CD1-CB 4.42Å; I1138-W1180 HydrophobicContact CG2-CB 4.21Å; I1138-W1180 HydrophobicContact CG2-CD2 4.38Å; I1138-W1180 HydrophobicContact CG2-CE3 3.52Å; I1138-W1180 HydrophobicContact CG2-CZ3 4.23Å; I1138-H1187 CarbonylContact O-C 3.41Å; I1138-H1187 WeakPolarHBondContact O-CA 3.41Å; I1138-S1188 PolarHBondContact N-O 2.9Å; I1138-S1188 PolarHBondContact O-N 2.72Å
1139	D	96.9	Very high	95.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.5	-165.1	-59.6	-61.3	0	0	0	111.4	H1117 V1118 R1132 T1137 L1149 H1187	H1117-D1139 WeakPolarHBondContact CA-O 3.29Å; V1118-D1139 PolarHBondContact N-O 3.4Å; V1118-D1139 PolarHBondContact O-N 2.99Å; R1132-D1139 IonicContact CZ-OD1 3.48Å; R1132-D1139 VanDerWaalsContact CZ-OD1 3.28Å; R1132-D1139 IonicContact CZ-OD2 3.88Å; R1132-D1139 IonicContact NH1-OD1 3.17Å; R1132-D1139 PolarHBondContact NH1-OD1 2.82Å; R1132-D1139 IonicContact NH1-OD2 2.81Å; R1132-D1139 PolarHBondContact NH1-OD2 3.48Å; R1132-D1139 IonicContact NH2-OD1 3.55Å; R1132-D1139 PolarHBondContact NH2-OD1 2.99Å; R1132-D1139 IonicContact NH2-OD2 2.71Å; T1137-D1139 VanDerWaalsContact CB-OD2 3.23Å; T1137-D1139 WeakPolarHBondContact CB-OD2 3.31Å; T1137-D1139 PolarHBondContact OG1-OD2 3.13Å; D1139-L1149 HydrophobicContact CB-CD2 3.8Å; D1139-H1187 IonicContact OD1-CD2 2.84Å; D1139-H1187 PolarHBondContact OD1-CD2 3.19Å; D1139-H1187 VanDerWaalsContact OD1-CD2 3.23Å; D1139-H1187 IonicContact OD1-CG 3.06Å
1140	S	96.6	Very high	95.4	Very high	3 Å²	3	24 Å²	24	2%	0.021	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	100.9	179.5	-171.6	0	0	0	0	111	H1117 P1142 A1175 T1186	H1117-S1140 PolarHBondContact CD2-OG 3.47Å; H1117-S1140 PolarHBondContact NE2-OG 2.94Å; S1140-P1142 WeakPolarHBondContact O-CD 3.19Å; S1140-A1175 WeakPolarHBondContact CB-O 3.39Å; S1140-A1175 WeakPolarHBondContact OG-CA 3.49Å; S1140-A1175 PolarHBondContact OG-O 3.34Å; S1140-T1186 VanDerWaalsContact CB-O 3.23Å; S1140-T1186 WeakPolarHBondContact CB-O 3.44Å; S1140-T1186 PolarHBondContact N-O 2.97Å
1141	V	96.9	Very high	95.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.3	-179.5	-161.8	0	0	0	0	109.2	V1107 N1109 Y1115 L1116 V1118 H1145 Q1147	V1107-V1141 HydrophobicContact CG1-CG2 3.65Å; N1109-V1141 HydrophobicContact CB-CB 4.03Å; N1109-V1141 HydrophobicContact CB-CG1 3.77Å; N1109-V1141 PolarHBondContact ND2-O 2.94Å; Y1115-V1141 WeakPolarHBondContact CA-O 3.39Å; L1116-V1141 HydrophobicContact CB-CB 4.26Å; L1116-V1141 PolarHBondContact N-O 2.9Å; L1116-V1141 PolarHBondContact O-N 3.18Å; V1118-V1141 HydrophobicContact CG2-CG2 4.28Å; V1141-H1145 HydrophobicContact CG1-CB 4.11Å; V1141-H1145 WeakPolarHBondContact CG1-O 3.2Å; V1141-Q1147 HydrophobicContact CG1-CB 4.39Å; V1141-Q1147 HydrophobicContact CG2-CB 4.46Å
1142	P	96.9	Very high	95.5	Very high	29 Å²	29	23.5 Å²	23.5	19%	0.188	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-63	164.3	177.8	-21.5	33.4	0	0	0	113.4	N1109 Y1115 S1140 H1145 P1201	N1109-P1142 WeakPolarHBondContact CB-O 3.29Å; N1109-P1142 VanDerWaalsContact ND2-C 3.34Å; N1109-P1142 PolarHBondContact ND2-O 2.81Å; Y1115-P1142 HydrophobicContact CD1-CB 4.34Å; Y1115-P1142 HydrophobicContact CE1-CB 3.99Å; Y1115-P1142 HydrophobicContact CE1-CG 4.27Å; S1140-P1142 WeakPolarHBondContact O-CD 3.19Å; P1142-H1145 HydrophobicContact CB-CB 4.27Å; P1142-H1145 HydrophobicContact CG-CB 4.48Å; P1142-H1145 PolarHBondContact O-N 3.3Å; P1142-P1201 HydrophobicContact CG-CB 4.15Å; P1142-P1201 HydrophobicContact CG-CG 4.43Å
1143	P	95.6	Very high	95.4	Very high	33 Å²	33	23.3 Å²	23.3	21%	0.214	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	137.9	170	-22.5	32.2	0	0	0	112	H1111 H1145	H1111-P1143 VanDerWaalsContact O-CA 3.3Å; H1111-P1143 WeakPolarHBondContact O-CA 3.23Å; H1111-P1143 WeakPolarHBondContact O-CB 3.37Å; P1143-H1145 VanDerWaalsContact C-N 3.3Å; P1143-H1145 PolarHBondContact O-N 3.16Å; P1143-H1145 PolarHBondContact O-ND1 2.94Å
1144	L	96.2	Very high	95.2	Very high	87 Å²	87	21.8 Å²	21.8	46%	0.455	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	40.5	-179.6	-51.5	179.2	0	0	0	114	N1109 H1111 L1204	N1109-L1144 WeakPolarHBondContact O-CA 3.05Å; N1109-L1144 PolarHBondContact O-N 3.16Å; H1111-L1144 PolarHBondContact O-N 2.8Å; L1144-L1204 HydrophobicContact CB-CD1 4.41Å; L1144-L1204 PolarHBondContact O-N 2.88Å; L1144-L1204 VanDerWaalsContact O-N 3.16Å
1145	H	96.7	Very high	94.8	Very high	49 Å²	49	22.6 Å²	22.6	23%	0.227	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	158.4	177.2	-75.6	59.7	0	0	0	112.4	N1109 V1141 P1142 P1143 P1201 R1202	N1109-H1145 PolarHBondContact N-O 2.92Å; N1109-H1145 PolarHBondContact O-N 3.07Å; V1141-H1145 HydrophobicContact CG1-CB 4.11Å; V1141-H1145 WeakPolarHBondContact CG1-O 3.2Å; P1142-H1145 HydrophobicContact CB-CB 4.27Å; P1142-H1145 HydrophobicContact CG-CB 4.48Å; P1142-H1145 PolarHBondContact O-N 3.3Å; P1143-H1145 VanDerWaalsContact C-N 3.3Å; P1143-H1145 PolarHBondContact O-N 3.16Å; P1143-H1145 PolarHBondContact O-ND1 2.94Å; H1145-P1201 HydrophobicContact CB-CB 4.37Å; H1145-R1202 CarbonylContact C-O 3.59Å; H1145-R1202 WeakPolarHBondContact CA-O 3.4Å; H1145-R1202 WeakPolarHBondContact CB-O 3.38Å; H1145-R1202 PolarHBondContact CD2-O 3.27Å
1146	R	96.6	Very high	94	Very high	42 Å²	42	24.9 Å²	24.9	16%	0.158	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	152.4	172.8	51.7	-171.9	161.9	164.1	-8.8	111.6	I1075 E1079 V1107 E1108 R1202 P1203 L1204	I1075-R1146 HydrophobicContact CD1-CG 4.41Å; I1075-R1146 VanDerWaalsContact CG2-NH1 3.33Å; E1079-R1146 VanDerWaalsContact CD-NH1 3.28Å; E1079-R1146 WeakPolarHBondContact OE1-CD 3.34Å; E1079-R1146 IonicContact OE1-CZ 3.26Å; E1079-R1146 IonicContact OE1-NE 3.12Å; E1079-R1146 IonicContact OE1-NH1 2.86Å; E1079-R1146 PolarHBondContact OE1-NH1 3.29Å; E1079-R1146 IonicContact OE2-NH1 2.62Å; E1079-R1146 PolarHBondContact OE2-NH1 3.09Å; E1079-R1146 VanDerWaalsContact OE2-NH1 3.11Å; V1107-R1146 CarbonylContact O-C 3.42Å; V1107-R1146 WeakPolarHBondContact O-CA 3.38Å; V1107-R1146 WeakPolarHBondContact O-CB 3.23Å; E1108-R1146 HydrophobicContact CG-CB 4.05Å; R1146-R1202 HydrophobicContact CG-CB 4.31Å; R1146-R1202 PolarHBondContact N-O 3.41Å; R1146-R1202 PolarHBondContact O-N 3.41Å; R1146-P1203 PolarHBondContact NE-O 3.27Å; R1146-P1203 VanDerWaalsContact NE-O 3.15Å; R1146-L1204 HydrophobicContact CB-CD2 3.78Å; R1146-L1204 HydrophobicContact CG-CD2 3.89Å; R1146-L1204 PolarHBondContact NH2-OXT 2.69Å
1147	Q	97.3	Very high	92.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	135.7	-173.7	-171.2	172.1	13	0	0	112.4	V1106 V1107 V1141 L1149 H1187 H1199 P1201	V1106-Q1147 WeakPolarHBondContact CA-O 3.2Å; V1107-Q1147 HydrophobicContact CG1-CB 4.27Å; V1107-Q1147 PolarHBondContact N-O 2.85Å; V1107-Q1147 PolarHBondContact O-N 2.89Å; V1141-Q1147 HydrophobicContact CG1-CB 4.39Å; V1141-Q1147 HydrophobicContact CG2-CB 4.46Å; Q1147-L1149 HydrophobicContact CB-CD2 4.42Å; Q1147-L1149 HydrophobicContact CG-CD2 4.22Å; Q1147-L1149 PolarHBondContact O-N 2.91Å; Q1147-H1187 PolarHBondContact NE2-CD2 3.3Å; Q1147-H1187 VanDerWaalsContact NE2-CD2 3.31Å; Q1147-H1187 PolarHBondContact NE2-NE2 3.37Å; Q1147-H1199 WeakPolarHBondContact CG-O 3.47Å; Q1147-H1199 PolarHBondContact NE2-O 2.79Å; Q1147-P1201 HydrophobicContact CG-CG 4.4Å
1148	V	97.6	Very high	91.3	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	106.3	163.6	-172	0	0	0	0	107.6	I1074 I1075 I1104 V1106 V1151 H1199	I1074-V1148 HydrophobicContact CG2-CG1 4.19Å; I1074-V1148 HydrophobicContact CG2-CG2 4.01Å; I1075-V1148 HydrophobicContact CD1-CG2 4.2Å; I1075-V1148 HydrophobicContact CG1-CG2 3.77Å; I1104-V1148 HydrophobicContact CG2-CG1 3.96Å; V1106-V1148 HydrophobicContact CG2-CB 4.39Å; V1106-V1148 HydrophobicContact CG2-CG1 4.47Å; V1106-V1148 HydrophobicContact CG2-CG2 4.02Å; V1148-V1151 HydrophobicContact CG1-CG2 3.79Å; V1148-H1199 PolarHBondContact O-ND1 3.06Å
1149	L	96.4	Very high	89.9	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-51.6	-178.4	-61.6	-178.6	0	0	0	110.6	V1105 V1107 V1118 C1120 R1132 D1139 Q1147 L1167 H1199	V1105-L1149 HydrophobicContact CB-CB 4.42Å; V1105-L1149 HydrophobicContact CG1-CD1 4.02Å; V1105-L1149 PolarHBondContact O-N 3.45Å; V1107-L1149 HydrophobicContact CB-CD1 4.27Å; V1107-L1149 HydrophobicContact CG1-CD1 3.88Å; V1107-L1149 HydrophobicContact CG1-CD2 3.69Å; V1107-L1149 HydrophobicContact CG1-CG 3.78Å; V1118-L1149 HydrophobicContact CB-CD1 4.19Å; V1118-L1149 HydrophobicContact CG1-CD1 3.68Å; C1120-L1149 HydrophobicContact CB-CD1 4.43Å; R1132-L1149 VanDerWaalsContact CG-O 3.31Å; R1132-L1149 WeakPolarHBondContact CG-O 3.47Å; R1132-L1149 PolarHBondContact NH1-O 3.5Å; D1139-L1149 HydrophobicContact CB-CD2 3.8Å; Q1147-L1149 HydrophobicContact CB-CD2 4.42Å; Q1147-L1149 HydrophobicContact CG-CD2 4.22Å; Q1147-L1149 PolarHBondContact O-N 2.91Å; L1149-L1167 HydrophobicContact CD1-CD1 4.23Å; L1149-H1199 PolarHBondContact O-ND1 3.22Å
1150	V	94.9	Very high	88.7	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	144.2	-177.5	66	0	0	0	0	110.8	I1104 V1105 S1130 R1132 T1137 L1152	I1104-V1150 WeakPolarHBondContact CA-O 3.37Å; V1105-V1150 HydrophobicContact CB-CG1 4.15Å; V1105-V1150 HydrophobicContact CG2-CG1 3.87Å; V1105-V1150 PolarHBondContact N-O 2.79Å; S1130-V1150 WeakPolarHBondContact OG-CG2 3.49Å; R1132-V1150 HydrophobicContact CG-CG2 4.45Å; T1137-V1150 HydrophobicContact CG2-CB 4.29Å; V1150-L1152 HydrophobicContact CG2-CD2 3.64Å; V1150-L1152 HydrophobicContact CG2-CG 4.08Å
1151	V	94.8	Very high	88	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.7	163.2	179.3	0	0	0	0	107.7	F1013 I1104 S1130 T1131 V1148 L1198	F1013-V1151 HydrophobicContact CB-CG1 4.06Å; F1013-V1151 HydrophobicContact CD1-CG1 4.21Å; F1013-V1151 HydrophobicContact CD2-CG1 3.96Å; F1013-V1151 HydrophobicContact CE2-CG1 4.42Å; F1013-V1151 HydrophobicContact CG-CG1 3.83Å; I1104-V1151 HydrophobicContact CD1-CB 4.11Å; I1104-V1151 HydrophobicContact CD1-CG1 3.65Å; I1104-V1151 HydrophobicContact CD1-CG2 3.59Å; I1104-V1151 HydrophobicContact CG1-CB 3.99Å; I1104-V1151 HydrophobicContact CG1-CG1 3.71Å; I1104-V1151 HydrophobicContact CG1-CG2 3.79Å; I1104-V1151 HydrophobicContact CG2-CG2 4.28Å; S1130-V1151 WeakPolarHBondContact CA-O 3.38Å; T1131-V1151 HydrophobicContact CG2-CB 3.71Å; T1131-V1151 HydrophobicContact CG2-CG1 4.09Å; T1131-V1151 HydrophobicContact CG2-CG2 4.46Å; T1131-V1151 PolarHBondContact N-O 3.36Å; T1131-V1151 WeakPolarHBondContact OG1-CB 3.43Å; T1131-V1151 PolarHBondContact OG1-N 3.12Å; T1131-V1151 PolarHBondContact OG1-O 2.94Å; V1148-V1151 HydrophobicContact CG1-CG2 3.79Å; V1151-L1198 HydrophobicContact CG2-CD2 4.18Å
1152	L	93.4	Very high	87.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	143	170.3	-58	-174.5	0	0	0	110.2	R989 G1102 L1103 C1122 V1129 L1135 V1150 I1163	R989-L1152 PolarHBondContact NH1-O 3.16Å; R989-L1152 PolarHBondContact NH2-O 2.76Å; G1102-L1152 WeakPolarHBondContact CA-O 3.41Å; L1103-L1152 HydrophobicContact CB-CB 4.21Å; L1103-L1152 HydrophobicContact CB-CD1 4.3Å; L1103-L1152 HydrophobicContact CB-CG 4.49Å; L1103-L1152 HydrophobicContact CD2-CD1 4.16Å; L1103-L1152 PolarHBondContact N-O 3.44Å; L1103-L1152 PolarHBondContact O-N 3.12Å; C1122-L1152 HydrophobicContact CB-CD1 3.79Å; V1129-L1152 CarbonylContact O-C 3.46Å; V1129-L1152 VanDerWaalsContact O-CA 3.28Å; V1129-L1152 WeakPolarHBondContact O-CA 3.39Å; L1135-L1152 HydrophobicContact CD2-CD2 3.75Å; V1150-L1152 HydrophobicContact CG2-CD2 3.64Å; V1150-L1152 HydrophobicContact CG2-CG 4.08Å; L1152-I1163 HydrophobicContact CD1-CG2 4.4Å
1153	S	90.8	Very high	87	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.2	-175.6	-37.5	0	0	0	0	108.8	R989 F1013 V1128 V1129 L1155	R989-S1153 PolarHBondContact NH2-OG 2.85Å; F1013-S1153 WeakPolarHBondContact CB-OG 3.13Å; V1128-S1153 CarbonylContact C-O 3.57Å; V1128-S1153 WeakPolarHBondContact CA-O 3.47Å; V1128-S1153 WeakPolarHBondContact CB-O 3.1Å; V1129-S1153 PolarHBondContact N-O 3.29Å; V1129-S1153 PolarHBondContact O-N 2.82Å; S1153-L1155 PolarHBondContact O-N 3.43Å
1154	Q	87.4	Confident	86.7	Confident	20 Å²	20	34.4 Å²	34.4	9%	0.093	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	129.9	165	179.8	177.1	9.8	0	0	109.1	V991 N1014 A1101 N1127 E1156 A1159 F1161	V991-Q1154 HydrophobicContact CG2-CB 4.04Å; V991-Q1154 HydrophobicContact CG2-CG 4.19Å; N1014-Q1154 VanDerWaalsContact CB-O 3.31Å; N1014-Q1154 WeakPolarHBondContact CB-O 3.41Å; N1014-Q1154 PolarHBondContact ND2-O 2.97Å; A1101-Q1154 HydrophobicContact CB-CB 4.07Å; A1101-Q1154 PolarHBondContact O-N 2.86Å; N1127-Q1154 WeakPolarHBondContact O-CA 3.26Å; Q1154-E1156 PolarHBondContact NE2-O 2.97Å; Q1154-A1159 PolarHBondContact NE2-O 3.3Å; Q1154-A1159 VanDerWaalsContact NE2-O 3.12Å; Q1154-F1161 HydrophobicContact CB-CD1 4.12Å; Q1154-F1161 HydrophobicContact CB-CG 4.28Å; Q1154-F1161 VanDerWaalsContact CD-CD1 3.43Å; Q1154-F1161 HydrophobicContact CG-CB 4.19Å; Q1154-F1161 HydrophobicContact CG-CD1 3.84Å; Q1154-F1161 HydrophobicContact CG-CG 4.16Å
1155	L	82.7	Confident	86.4	Confident	57 Å²	57	33.1 Å²	33.1	30%	0.298	19%	0.19	S	C	.	.	S	Bend	trans	-80.5	-66.8	179.1	178.1	58.4	0	0	0	110.3	N1014 M1018 N1127 V1129 S1153	N1014-L1155 PolarHBondContact ND2-O 3.4Å; M1018-L1155 HydrophobicContact CE-CD1 3.67Å; M1018-L1155 HydrophobicContact CE-CD2 4.47Å; N1127-L1155 PolarHBondContact O-N 2.63Å; N1127-L1155 WeakPolarHBondContact OD1-CB 3.48Å; V1129-L1155 HydrophobicContact CG1-CB 4.14Å; V1129-L1155 HydrophobicContact CG1-CD1 3.98Å; V1129-L1155 HydrophobicContact CG1-CD2 3.95Å; V1129-L1155 HydrophobicContact CG1-CG 4.24Å; V1129-L1155 HydrophobicContact CG2-CB 4.4Å; V1129-L1155 HydrophobicContact CG2-CD1 4.28Å; S1153-L1155 PolarHBondContact O-N 3.43Å
1156	E	78.2	Confident	86.3	Confident	94 Å²	94	37.5 Å²	37.5	44%	0.439	20%	0.204	S	C	.	.			trans	-99.2	121.1	179.9	-64.8	-179.5	-173.2	0	0	111.1	N1127 Q1154 N1158	N1127-E1156 PolarHBondContact ND2-O 3.44Å; N1127-E1156 PolarHBondContact OD1-N 2.91Å; Q1154-E1156 PolarHBondContact NE2-O 2.97Å; E1156-N1158 PolarHBondContact O-N 3.24Å
1157	G	69.8	Low	86.1	Confident	28 Å²	28	37.4 Å²	37.4	29%	0.289	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.5	176.8	0	0	0	0	0	114.4
1158	N	65.6	Low	85.9	Confident	86 Å²	86	39.7 Å²	39.7	46%	0.46	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.4	-174.2	-79.7	-11.5	0	0	0	114.6	A956 D957 E1156	A956-N1158 PolarHBondContact O-ND2 3.35Å; D957-N1158 WeakPolarHBondContact CB-ND2 3.41Å; D957-N1158 PolarHBondContact OD2-ND2 3.21Å; E1156-N1158 PolarHBondContact O-N 3.24Å
1159	A	66.8	Low	85.8	Confident	37 Å²	37	42 Å²	42	31%	0.306	24%	0.237	S	C	.	.	S	Bend	trans	-119.8	152.2	173	0	0	0	0	0	110.5	N1127 Q1154	N1127-A1159 PolarHBondContact ND2-O 2.81Å; Q1154-A1159 PolarHBondContact NE2-O 3.3Å; Q1154-A1159 VanDerWaalsContact NE2-O 3.12Å
1160	G	72.2	Confident	85.6	Confident	32 Å²	32	44.9 Å²	44.9	33%	0.33	25%	0.247	S	C	.	.			trans	-61.9	153.6	170.6	0	0	0	0	0	111.7	N1127	N1127-G1160 VanDerWaalsContact CB-O 3.3Å; N1127-G1160 WeakPolarHBondContact CB-O 3.33Å; N1127-G1160 PolarHBondContact ND2-O 3.38Å
1161	F	82.1	Confident	85.5	Confident	34 Å²	34	48.3 Å²	48.3	15%	0.149	26%	0.262	C	S	.	.			trans	-125.7	155.8	172.7	73.4	-84.8	0	0	0	109.8	F1126 N1127 V1128 Q1154 I1163	F1126-F1161 WeakPolarHBondContact O-CA 3.46Å; F1126-F1161 WeakPolarHBondContact O-CB 3.25Å; N1127-F1161 HydrophobicContact CB-CB 3.96Å; V1128-F1161 HydrophobicContact CG1-CB 4.29Å; V1128-F1161 HydrophobicContact CG1-CD2 4.13Å; Q1154-F1161 HydrophobicContact CB-CD1 4.12Å; Q1154-F1161 HydrophobicContact CB-CG 4.28Å; Q1154-F1161 VanDerWaalsContact CD-CD1 3.43Å; Q1154-F1161 HydrophobicContact CG-CB 4.19Å; Q1154-F1161 HydrophobicContact CG-CD1 3.84Å; Q1154-F1161 HydrophobicContact CG-CG 4.16Å; F1161-I1163 HydrophobicContact CD2-CD1 4.09Å; F1161-I1163 HydrophobicContact CD2-CG1 3.92Å; F1161-I1163 HydrophobicContact CE2-CD1 3.79Å; F1161-I1163 HydrophobicContact CE2-CG1 4.03Å
1162	S	84.1	Confident	85.4	Confident	55 Å²	55	49.1 Å²	49.1	39%	0.385	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-137.8	145.5	173.4	71.4	0	0	0	0	110.4	S1125 F1126	S1125-S1162 WeakPolarHBondContact CA-O 3.34Å; S1125-S1162 WeakPolarHBondContact CB-O 3.4Å; F1126-S1162 WeakPolarHBondContact CB-OG 3.41Å; F1126-S1162 PolarHBondContact N-O 2.85Å; F1126-S1162 PolarHBondContact O-N 3.3Å
1163	I	87.4	Confident	85.4	Confident	49 Å²	49	53 Å²	53	25%	0.251	30%	0.301	S	S	.	.			trans	-124.7	115.5	-176.8	-57.5	-175.1	0	0	0	108.9	G1102 L1103 V1128 L1152 F1161	G1102-I1163 WeakPolarHBondContact O-CD1 3.47Å; L1103-I1163 HydrophobicContact CB-CD1 3.88Å; L1103-I1163 HydrophobicContact CB-CG2 3.94Å; L1103-I1163 HydrophobicContact CD2-CG2 3.8Å; L1103-I1163 HydrophobicContact CG-CG2 4.46Å; V1128-I1163 HydrophobicContact CG1-CG1 4.21Å; L1152-I1163 HydrophobicContact CD1-CG2 4.4Å; F1161-I1163 HydrophobicContact CD2-CD1 4.09Å; F1161-I1163 HydrophobicContact CD2-CG1 3.92Å; F1161-I1163 HydrophobicContact CE2-CD1 3.79Å; F1161-I1163 HydrophobicContact CE2-CG1 4.03Å
1164	T	89.2	Confident	85.4	Confident	51 Å²	51	59.4 Å²	59.4	31%	0.313	33%	0.331	S	S	.	.			trans	-114.4	126.7	169.4	-51.6	0	0	0	0	107	C1122 D1124 S1125	C1122-T1164 CarbonylContact C-O 3.46Å; C1122-T1164 WeakPolarHBondContact CA-O 3.35Å; D1124-T1164 HydrophobicContact CB-CG2 3.7Å; D1124-T1164 VanDerWaalsContact O-CB 3.25Å; D1124-T1164 WeakPolarHBondContact O-CB 3.24Å; D1124-T1164 PolarHBondContact O-OG1 2.91Å; S1125-T1164 PolarHBondContact OG-N 3.3Å; S1125-T1164 PolarHBondContact OG-O 2.92Å
1165	H	90.9	Very high	85.6	Confident	60 Å²	60	59.8 Å²	59.8	28%	0.278	34%	0.337	S	S	.	.			trans	-132.4	147.2	174.8	68.8	-96.1	0	0	0	111.1	Y1095 L1103 D1121 C1122	Y1095-H1165 AromaticContact CD1-CD2 3.99Å; Y1095-H1165 AromaticContact CD1-NE2 3.54Å; Y1095-H1165 AromaticContact CE1-CD2 3.68Å; Y1095-H1165 AromaticContact CE1-NE2 3.51Å; L1103-H1165 HydrophobicContact CD2-CB 3.88Å; D1121-H1165 CarbonylContact O-C 3.51Å; D1121-H1165 WeakPolarHBondContact O-CA 3.15Å; C1122-H1165 VanDerWaalsContact SG-CB 3.56Å
1166	R	93.5	Very high	86.1	Confident	140 Å²	140	58.9 Å²	58.9	53%	0.528	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	132.5	171.9	-57.8	-173.4	-173.2	100.6	10.3	108.9	D1121 D1124	D1121-R1166 PolarHBondContact N-O 3.44Å; D1121-R1166 PolarHBondContact O-N 3.47Å; D1124-R1166 IonicContact OD2-CZ 3.78Å; D1124-R1166 IonicContact OD2-NH1 3.45Å; D1124-R1166 PolarHBondContact OD2-NH1 3.11Å; D1124-R1166 IonicContact OD2-NH2 3.77Å; D1124-R1166 PolarHBondContact OD2-NH2 3.31Å
1167	L	93.6	Very high	86.7	Confident	41 Å²	41	54.5 Å²	54.5	22%	0.215	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.2	176.3	-154.1	81.1	0	0	0	110.3	M1091 C1093 Y1095 V1105 V1118 S1119 C1120 L1149	M1091-L1167 HydrophobicContact CE-CD2 3.73Å; C1093-L1167 HydrophobicContact CB-CD2 4.49Å; C1093-L1167 WeakPolarHBondContact SG-CD2 3.3Å; Y1095-L1167 WeakPolarHBondContact OH-CD2 3.35Å; V1105-L1167 HydrophobicContact CG1-CD1 4.37Å; V1118-L1167 HydrophobicContact CG1-CD1 3.56Å; V1118-L1167 HydrophobicContact CG1-CD2 3.91Å; V1118-L1167 HydrophobicContact CG1-CG 3.72Å; S1119-L1167 WeakPolarHBondContact O-CA 3.43Å; C1120-L1167 HydrophobicContact CB-CD1 3.84Å; L1149-L1167 HydrophobicContact CD1-CD1 4.23Å
1168	A	93.6	Very high	87.5	Confident	48 Å²	48	54.9 Å²	54.9	40%	0.397	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	138.4	171.3	0	0	0	0	0	109.6	V1118 S1119	V1118-A1168 CarbonylContact C-O 3.56Å; V1118-A1168 WeakPolarHBondContact CA-O 3.42Å; S1119-A1168 PolarHBondContact N-O 2.98Å; S1119-A1168 PolarHBondContact O-N 3.1Å
1169	H	93.9	Very high	88.5	Confident	50 Å²	50	57 Å²	57	23%	0.231	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	147	-169.3	55.2	47.1	0	0	0	114.6	R1088 M1091 H1117 V1118	R1088-H1169 PolarHBondContact NE-ND1 2.72Å; M1091-H1169 HydrophobicContact CE-CB 3.73Å; M1091-H1169 WeakPolarHBondContact CE-CD2 3.24Å; M1091-H1169 HydrophobicContact SD-CB 3.66Å; M1091-H1169 PolarHBondContact SD-CD2 2.75Å; H1117-H1169 CarbonylContact O-C 3.5Å; H1117-H1169 VanDerWaalsContact O-CA 3.25Å; H1117-H1169 WeakPolarHBondContact O-CA 3.4Å; V1118-H1169 HydrophobicContact CG2-CB 4.49Å
1170	R	93.1	Very high	89.4	Confident	60 Å²	60	58.5 Å²	58.5	23%	0.226	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	143	176.7	61.1	-172.6	-177.8	168.8	3.9	112.7	H1117 L1177 D1179 W1180	H1117-R1170 HydrophobicContact CB-CG 3.86Å; H1117-R1170 PolarHBondContact N-O 3.36Å; H1117-R1170 PolarHBondContact O-N 2.67Å; R1170-L1177 PolarHBondContact NH2-O 2.82Å; R1170-D1179 IonicContact CZ-OD1 2.89Å; R1170-D1179 VanDerWaalsContact CZ-OD1 3.25Å; R1170-D1179 IonicContact CZ-OD2 2.61Å; R1170-D1179 VanDerWaalsContact NH1-CG 3.27Å; R1170-D1179 IonicContact NH1-OD1 3.53Å; R1170-D1179 PolarHBondContact NH1-OD1 2.71Å; R1170-D1179 IonicContact NH1-OD2 2.78Å; R1170-D1179 PolarHBondContact NH1-OD2 2.99Å; R1170-D1179 VanDerWaalsContact NH2-CG 3.33Å; R1170-D1179 IonicContact NH2-OD1 3.5Å; R1170-D1179 PolarHBondContact NH2-OD1 3.44Å; R1170-D1179 IonicContact NH2-OD2 2.72Å; R1170-D1179 PolarHBondContact NH2-OD2 3.02Å; R1170-W1180 HydrophobicContact CG-CH2 3.87Å; R1170-W1180 HydrophobicContact CG-CZ2 3.95Å; R1170-W1180 HydrophobicContact CG-CZ3 4.32Å; R1170-W1180 VanDerWaalsContact NE-CE2 3.34Å; R1170-W1180 VanDerWaalsContact NH2-CD1 3.32Å
1171	K	93.4	Very high	89.9	Confident	72 Å²	72	57.5 Å²	57.5	31%	0.313	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	140.8	166	-64.7	-171.9	178	-171.4	0	108.6	E1089 H1111 Y1114 Y1115	E1089-K1171 WeakPolarHBondContact O-CE 3.45Å; E1089-K1171 PolarHBondContact O-NZ 3.39Å; E1089-K1171 IonicContact OE2-NZ 3.14Å; E1089-K1171 PolarHBondContact OE2-NZ 2.91Å; H1111-K1171 PolarHBondContact CD2-NZ 3.06Å; H1111-K1171 PolarHBondContact NE2-NZ 3.28Å; H1111-K1171 VanDerWaalsContact NE2-NZ 3.15Å; Y1114-K1171 HydrophobicContact CD2-CD 4.16Å; Y1115-K1171 CarbonylContact O-C 3.54Å
1172	A	92.1	Very high	89.4	Confident	18 Å²	18	62.8 Å²	62.8	15%	0.149	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.9	-178.4	0	0	0	0	0	112.2	Y1114 Y1115 H1117	Y1114-A1172 WeakPolarHBondContact CA-O 3.48Å; Y1114-A1172 WeakPolarHBondContact CB-O 3.26Å; Y1115-A1172 PolarHBondContact N-O 2.94Å; Y1115-A1172 PolarHBondContact O-N 3.4Å; H1117-A1172 WeakPolarHBondContact CE1-CB 3.5Å
1173	A	92.4	Very high	89	Confident	81 Å²	81	64.4 Å²	64.4	67%	0.669	36%	0.362	S	S	*	.	S	Bend	trans	-85.3	-12.5	178.9	0	0	0	0	0	113.9
1174	Q	91.8	Very high	88.7	Confident	135 Å²	135	71.6 Å²	71.6	63%	0.631	39%	0.391	S	S	*	.	S	Bend	trans	-137.9	154.8	-176.4	-64.1	179.9	-4.5	0	0	109.4	H1117	H1117-Q1174 PolarHBondContact CE1-O 3.3Å; H1117-Q1174 PolarHBondContact NE2-O 3.19Å; H1117-Q1174 VanDerWaalsContact NE2-O 3.1Å
1175	A	91.7	Very high	88.7	Confident	27 Å²	27	70.1 Å²	70.1	22%	0.223	38%	0.384	C	S	.	.	S	Bend	trans	-75	-21.9	-178.4	0	0	0	0	0	114.4	Y1115 S1140 L1177 T1186	Y1115-A1175 HydrophobicContact CD1-CB 3.79Å; Y1115-A1175 HydrophobicContact CE1-CB 3.52Å; Y1115-A1175 HydrophobicContact CE2-CB 4.41Å; Y1115-A1175 HydrophobicContact CG-CB 4.36Å; S1140-A1175 WeakPolarHBondContact CB-O 3.39Å; S1140-A1175 WeakPolarHBondContact OG-CA 3.49Å; S1140-A1175 PolarHBondContact OG-O 3.34Å; A1175-L1177 PolarHBondContact O-N 3.11Å; A1175-T1186 HydrophobicContact CB-CG2 3.87Å
1176	S	92.1	Very high	88.8	Confident	39 Å²	39	69.8 Å²	69.8	27%	0.273	39%	0.386	S	S	.	.	S	Bend	trans	-71.6	126.6	-179.1	53.2	0	0	0	0	110.6	H1117 G1178 A1185	H1117-S1176 PolarHBondContact CE1-O 2.78Å; S1176-G1178 PolarHBondContact O-N 3.28Å; S1176-A1185 WeakPolarHBondContact CA-O 3.43Å
1177	L	90.7	Very high	88.8	Confident	1 Å²	1	64 Å²	64	1%	0.005	37%	0.365	C	S	.	.			trans	-62.2	-16.2	-170.3	-70.2	172	0	0	0	114.8	H1117 I1138 R1170 A1175 W1180 T1181 A1185	H1117-L1177 HydrophobicContact CB-CD2 4.1Å; I1138-L1177 HydrophobicContact CB-CD1 4.18Å; I1138-L1177 HydrophobicContact CG2-CD1 3.89Å; I1138-L1177 HydrophobicContact CG2-CD2 3.94Å; I1138-L1177 HydrophobicContact CG2-CG 4.43Å; I1138-L1177 WeakPolarHBondContact O-CD1 3.48Å; R1170-L1177 PolarHBondContact NH2-O 2.82Å; A1175-L1177 PolarHBondContact O-N 3.11Å; L1177-W1180 HydrophobicContact CB-CB 4.45Å; L1177-T1181 HydrophobicContact CB-CG2 4.01Å; L1177-T1181 WeakPolarHBondContact CB-OG1 3.49Å; L1177-T1181 HydrophobicContact CD1-CG2 3.69Å; L1177-A1185 WeakPolarHBondContact CG-O 3.34Å; L1177-A1185 PolarHBondContact N-O 3.11Å
1178	G	87.8	Confident	88.8	Confident	37 Å²	37	64.3 Å²	64.3	38%	0.381	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	72.7	-137.9	171.1	0	0	0	0	0	112.1	S1176 W1180 T1181	S1176-G1178 PolarHBondContact O-N 3.28Å; G1178-W1180 PolarHBondContact O-N 2.89Å; G1178-T1181 CarbonylContact O-C 3.57Å; G1178-T1181 PolarHBondContact O-N 3.23Å
1179	D	85.3	Confident	88.8	Confident	130 Å²	130	64 Å²	64	70%	0.695	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-52.2	-14.3	174.6	54.2	-65.7	0	0	0	115.2	R1170	R1170-D1179 IonicContact CZ-OD1 2.89Å; R1170-D1179 VanDerWaalsContact CZ-OD1 3.25Å; R1170-D1179 IonicContact CZ-OD2 2.61Å; R1170-D1179 VanDerWaalsContact NH1-CG 3.27Å; R1170-D1179 IonicContact NH1-OD1 3.53Å; R1170-D1179 PolarHBondContact NH1-OD1 2.71Å; R1170-D1179 IonicContact NH1-OD2 2.78Å; R1170-D1179 PolarHBondContact NH1-OD2 2.99Å; R1170-D1179 VanDerWaalsContact NH2-CG 3.33Å; R1170-D1179 IonicContact NH2-OD1 3.5Å; R1170-D1179 PolarHBondContact NH2-OD1 3.44Å; R1170-D1179 IonicContact NH2-OD2 2.72Å; R1170-D1179 PolarHBondContact NH2-OD2 3.02Å
1180	W	85.9	Confident	88.7	Confident	68 Å²	68	68.3 Å²	68.3	26%	0.258	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-80.2	-12	174.3	-70.5	6.6	0	0	0	114	H1117 I1138 R1170 L1177 G1178	H1117-W1180 HydrophobicContact CB-CE3 4Å; H1117-W1180 HydrophobicContact CB-CZ3 3.8Å; I1138-W1180 HydrophobicContact CD1-CB 4.42Å; I1138-W1180 HydrophobicContact CG2-CB 4.21Å; I1138-W1180 HydrophobicContact CG2-CD2 4.38Å; I1138-W1180 HydrophobicContact CG2-CE3 3.52Å; I1138-W1180 HydrophobicContact CG2-CZ3 4.23Å; R1170-W1180 HydrophobicContact CG-CH2 3.87Å; R1170-W1180 HydrophobicContact CG-CZ2 3.95Å; R1170-W1180 HydrophobicContact CG-CZ3 4.32Å; R1170-W1180 VanDerWaalsContact NE-CE2 3.34Å; R1170-W1180 VanDerWaalsContact NH2-CD1 3.32Å; L1177-W1180 HydrophobicContact CB-CB 4.45Å; G1178-W1180 PolarHBondContact O-N 2.89Å
1181	T	83.9	Confident	88.7	Confident	11 Å²	11	66.1 Å²	66.1	7%	0.067	38%	0.378	C	S	.	.	S	Bend	trans	-145.9	137.1	175.1	55.1	0	0	0	0	111.8	L1177 G1178 T1183	L1177-T1181 HydrophobicContact CB-CG2 4.01Å; L1177-T1181 WeakPolarHBondContact CB-OG1 3.49Å; L1177-T1181 HydrophobicContact CD1-CG2 3.69Å; G1178-T1181 CarbonylContact O-C 3.57Å; G1178-T1181 PolarHBondContact O-N 3.23Å; T1181-T1183 PolarHBondContact O-N 3.17Å; T1181-T1183 PolarHBondContact OG1-O 2.91Å
1182	P	70.4	Confident	88.6	Confident	145 Å²	145	66 Å²	66	94%	0.942	38%	0.383	S	S	*	.	S	Bend	trans	-68	0.4	178.6	29.1	-36.1	0	0	0	114.7
1183	T	75.6	Confident	88.5	Confident	89 Å²	89	70 Å²	70	55%	0.546	41%	0.408	S	S	.	.	S	Bend	trans	-122.5	164.1	179.1	57.9	0	0	0	0	110.7	T1181 A1185	T1181-T1183 PolarHBondContact O-N 3.17Å; T1181-T1183 PolarHBondContact OG1-O 2.91Å; T1183-A1185 PolarHBondContact O-N 3.03Å; T1183-A1185 WeakPolarHBondContact OG1-CB 3.37Å
1184	K	81.3	Confident	88.4	Confident	200 Å²	200	69.1 Å²	69.1	87%	0.87	39%	0.391	S	S	*	.	S	Bend	trans	-72.9	30.1	172.2	-65.7	-174.6	176.9	-179.9	0	113.3
1185	A	88.6	Confident	88.4	Confident	20 Å²	20	63.1 Å²	63.1	17%	0.165	36%	0.364	C	S	.	.			trans	-69.9	153.9	-177.9	0	0	0	0	0	112.2	S1176 L1177 T1183	S1176-A1185 WeakPolarHBondContact CA-O 3.43Å; L1177-A1185 WeakPolarHBondContact CG-O 3.34Å; L1177-A1185 PolarHBondContact N-O 3.11Å; T1183-A1185 PolarHBondContact O-N 3.03Å; T1183-A1185 WeakPolarHBondContact OG1-CB 3.37Å
1186	T	93.1	Very high	88.4	Confident	54 Å²	54	63.7 Å²	63.7	33%	0.331	36%	0.363	S	S	.	.	S	Bend	trans	-99.8	-16.3	171.1	56.9	0	0	0	0	112.4	S1140 A1175	S1140-T1186 VanDerWaalsContact CB-O 3.23Å; S1140-T1186 WeakPolarHBondContact CB-O 3.44Å; S1140-T1186 PolarHBondContact N-O 2.97Å; A1175-T1186 HydrophobicContact CB-CG2 3.87Å
1187	H	95	Very high	88.4	Confident	18 Å²	18	62.1 Å²	62.1	8%	0.083	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	140.8	-177.7	-62	74.9	0	0	0	109.8	I1138 D1139 Q1147 L1191	I1138-H1187 CarbonylContact O-C 3.41Å; I1138-H1187 WeakPolarHBondContact O-CA 3.41Å; D1139-H1187 IonicContact OD1-CD2 2.84Å; D1139-H1187 PolarHBondContact OD1-CD2 3.19Å; D1139-H1187 VanDerWaalsContact OD1-CD2 3.23Å; D1139-H1187 IonicContact OD1-CG 3.06Å; Q1147-H1187 PolarHBondContact NE2-CD2 3.3Å; Q1147-H1187 VanDerWaalsContact NE2-CD2 3.31Å; Q1147-H1187 PolarHBondContact NE2-NE2 3.37Å; H1187-L1191 HydrophobicContact CB-CG 4.15Å
1188	S	93.5	Very high	88.6	Confident	48 Å²	48	62 Å²	62	34%	0.336	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	118.2	176.3	-172.4	0	0	0	0	109.8	T1137 I1138	T1137-S1188 CarbonylContact C-O 3.59Å; T1137-S1188 VanDerWaalsContact CA-O 3.26Å; T1137-S1188 WeakPolarHBondContact CA-O 3.19Å; I1138-S1188 PolarHBondContact N-O 2.9Å; I1138-S1188 PolarHBondContact O-N 2.72Å
1189	P	93.3	Very high	89	Confident	41 Å²	41	60.3 Å²	60.3	27%	0.266	33%	0.334	S	S	.	.	S	Bend	cis	-59.5	150.9	-8.8	27.9	-35.2	0	0	0	111.5	R1132	R1132-P1189 PolarHBondContact NH2-O 2.83Å; R1132-P1189 VanDerWaalsContact O-CG 3.32Å; R1132-P1189 WeakPolarHBondContact O-CG 2.92Å
1190	H	91.9	Very high	89.5	Confident	140 Å²	140	60.8 Å²	60.8	65%	0.648	33%	0.327	S	S	*	.			trans	-58.5	138.9	178.7	-173.4	-76.6	0	0	0	110.7	T1192	H1190-T1192 PolarHBondContact O-N 3.11Å; H1190-T1192 VanDerWaalsContact O-N 3.17Å
1191	L	92.1	Very high	89.9	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.079	32%	0.321	C	S	.	.			trans	-69.1	113.6	176.2	-57.3	-173.4	0	0	0	109.7	H1187 I1195 H1199	H1187-L1191 HydrophobicContact CB-CG 4.15Å; L1191-I1195 HydrophobicContact CD2-CD1 4.27Å; L1191-I1195 HydrophobicContact CD2-CG1 4.4Å; L1191-H1199 HydrophobicContact CD1-CB 4.32Å; L1191-H1199 HydrophobicContact CD2-CB 3.75Å
1192	T	91.8	Very high	90.4	Very high	68 Å²	68	60 Å²	60	42%	0.417	33%	0.325	S	S	.	.			trans	-76.5	156.8	170.7	63.5	0	0	0	0	109.7	H1190 D1194 I1195 D1196	H1190-T1192 PolarHBondContact O-N 3.11Å; H1190-T1192 VanDerWaalsContact O-N 3.17Å; T1192-D1194 PolarHBondContact O-N 3.3Å; T1192-D1194 VanDerWaalsContact O-N 3.08Å; T1192-I1195 PolarHBondContact O-N 3.16Å; T1192-D1196 WeakPolarHBondContact O-CB 3.21Å; T1192-D1196 PolarHBondContact O-N 2.76Å
1193	P	89.8	Confident	91.4	Very high	104 Å²	104	57 Å²	57	68%	0.675	31%	0.306	S	S	*	.	H	α-helix	trans	-54.3	-30.5	176.3	-27	35.7	0	0	0	113.4	S925 I1195	S925-P1193 WeakPolarHBondContact CB-O 3.41Å; P1193-I1195 VanDerWaalsContact C-N 3.33Å; P1193-I1195 PolarHBondContact O-N 3.36Å
1194	D	89.7	Confident	91.9	Very high	61 Å²	61	57.3 Å²	57.3	33%	0.326	30%	0.303	S	S	.	.	H	α-helix	trans	-73.6	-14.8	178	-75.6	-38.9	0	0	0	114.7	K923 A924 S925 T1192	K923-D1194 CarbonylContact C-O 3.56Å; K923-D1194 WeakPolarHBondContact CA-O 3.39Å; K923-D1194 HydrophobicContact CB-CB 3.94Å; K923-D1194 WeakPolarHBondContact CB-O 3.5Å; K923-D1194 HydrophobicContact CD-CB 4.34Å; K923-D1194 VanDerWaalsContact CD-OD1 3.29Å; K923-D1194 WeakPolarHBondContact CD-OD1 3.28Å; K923-D1194 WeakPolarHBondContact CE-OD1 3.43Å; K923-D1194 IonicContact NZ-OD1 2.67Å; K923-D1194 PolarHBondContact NZ-OD1 2.86Å; K923-D1194 IonicContact NZ-OD2 3.68Å; A924-D1194 PolarHBondContact N-O 2.93Å; S925-D1194 VanDerWaalsContact CB-OD1 3.25Å; S925-D1194 WeakPolarHBondContact CB-OD1 3.33Å; S925-D1194 PolarHBondContact OG-OD1 2.76Å; T1192-D1194 PolarHBondContact O-N 3.3Å; T1192-D1194 VanDerWaalsContact O-N 3.08Å
1195	I	92.3	Very high	92.5	Very high	10 Å²	10	50.2 Å²	50.2	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-120	-10.9	176.2	73.2	179.2	0	0	0	113.6	L1191 T1192 P1193 G1197 L1198 H1199	L1191-I1195 HydrophobicContact CD2-CD1 4.27Å; L1191-I1195 HydrophobicContact CD2-CG1 4.4Å; T1192-I1195 PolarHBondContact O-N 3.16Å; P1193-I1195 VanDerWaalsContact C-N 3.33Å; P1193-I1195 PolarHBondContact O-N 3.36Å; I1195-G1197 PolarHBondContact O-N 3.48Å; I1195-L1198 PolarHBondContact O-N 3.33Å; I1195-L1198 VanDerWaalsContact O-N 3.12Å; I1195-H1199 PolarHBondContact O-N 2.85Å
1196	D	91.4	Very high	92.7	Very high	38 Å²	38	51.7 Å²	51.7	20%	0.203	28%	0.281	C	S	.	.	H	α-helix	trans	-55.5	-44.9	-179.1	-178.6	81.8	0	0	0	112.6	T1192 L1198 H1199 R1200	T1192-D1196 WeakPolarHBondContact O-CB 3.21Å; T1192-D1196 PolarHBondContact O-N 2.76Å; D1196-L1198 PolarHBondContact O-N 2.8Å; D1196-L1198 VanDerWaalsContact O-N 3.09Å; D1196-H1199 PolarHBondContact O-N 2.92Å; D1196-H1199 VanDerWaalsContact O-N 3.15Å; D1196-R1200 WeakPolarHBondContact O-CB 3.41Å; D1196-R1200 PolarHBondContact O-N 3.03Å; D1196-R1200 WeakPolarHBondContact OD1-CD 3.37Å; D1196-R1200 IonicContact OD1-CZ 3.9Å; D1196-R1200 IonicContact OD1-NE 3.73Å; D1196-R1200 IonicContact OD1-NH1 2.77Å; D1196-R1200 PolarHBondContact OD1-NH1 2.98Å; D1196-R1200 WeakPolarHBondContact OD2-CD 3Å; D1196-R1200 IonicContact OD2-CZ 3.75Å; D1196-R1200 IonicContact OD2-NH1 3.79Å; D1196-R1200 PolarHBondContact OD2-NH1 3.29Å
1197	G	92.9	Very high	92.6	Very high	6 Å²	6	51.6 Å²	51.6	6%	0.062	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-23.8	178.8	0	0	0	0	0	114.9	A924 T1068 A1071 I1195	A924-G1197 WeakPolarHBondContact O-CA 3.35Å; A924-G1197 PolarHBondContact O-N 3.28Å; T1068-G1197 WeakPolarHBondContact CA-O 3.44Å; A1071-G1197 WeakPolarHBondContact CB-O 3.48Å; I1195-G1197 PolarHBondContact O-N 3.48Å
1198	L	95.1	Very high	92.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-91.6	-37.6	174.1	-179.2	58.6	0	0	0	112.6	A924 F1013 W1016 L1070 A1071 I1074 T1131 V1151 I1195 D1196	A924-L1198 HydrophobicContact CB-CB 4.06Å; F1013-L1198 HydrophobicContact CD1-CD2 4.31Å; F1013-L1198 HydrophobicContact CE1-CD2 3.87Å; W1016-L1198 HydrophobicContact CE3-CD2 4.33Å; W1016-L1198 HydrophobicContact CH2-CB 4.15Å; W1016-L1198 HydrophobicContact CH2-CD2 3.58Å; W1016-L1198 HydrophobicContact CH2-CG 4.46Å; W1016-L1198 HydrophobicContact CZ2-CD2 4.4Å; W1016-L1198 HydrophobicContact CZ3-CB 4.23Å; W1016-L1198 HydrophobicContact CZ3-CD2 3.53Å; L1070-L1198 HydrophobicContact CG-CD1 4.18Å; A1071-L1198 HydrophobicContact CB-CD1 4.42Å; A1071-L1198 WeakPolarHBondContact CB-O 3.44Å; I1074-L1198 HydrophobicContact CG1-CD1 4.48Å; T1131-L1198 HydrophobicContact CG2-CD2 4.16Å; V1151-L1198 HydrophobicContact CG2-CD2 4.18Å; I1195-L1198 PolarHBondContact O-N 3.33Å; I1195-L1198 VanDerWaalsContact O-N 3.12Å; D1196-L1198 PolarHBondContact O-N 2.8Å; D1196-L1198 VanDerWaalsContact O-N 3.09Å
1199	H	96.1	Very high	92.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-112.7	-5	-164.5	-71.2	-69.7	0	0	0	115.8	T1131 R1132 Q1147 V1148 L1149 L1191 I1195 D1196	T1131-H1199 PolarHBondContact OG1-CE1 3.29Å; T1131-H1199 VanDerWaalsContact OG1-CE1 3.24Å; T1131-H1199 PolarHBondContact OG1-NE2 3.1Å; R1132-H1199 VanDerWaalsContact CD-CG 3.45Å; Q1147-H1199 WeakPolarHBondContact CG-O 3.47Å; Q1147-H1199 PolarHBondContact NE2-O 2.79Å; V1148-H1199 PolarHBondContact O-ND1 3.06Å; L1149-H1199 PolarHBondContact O-ND1 3.22Å; L1191-H1199 HydrophobicContact CD1-CB 4.32Å; L1191-H1199 HydrophobicContact CD2-CB 3.75Å; I1195-H1199 PolarHBondContact O-N 2.85Å; D1196-H1199 PolarHBondContact O-N 2.92Å; D1196-H1199 VanDerWaalsContact O-N 3.15Å
1200	R	94.8	Very high	92.4	Very high	141 Å²	141	54.8 Å²	54.8	53%	0.532	29%	0.288	S	S	.	.	S	Bend	trans	-66.7	139.9	176.8	-167	-178.1	-157.5	120.2	2.9	110.9	D1196 R1202	D1196-R1200 WeakPolarHBondContact O-CB 3.41Å; D1196-R1200 PolarHBondContact O-N 3.03Å; D1196-R1200 WeakPolarHBondContact OD1-CD 3.37Å; D1196-R1200 IonicContact OD1-CZ 3.9Å; D1196-R1200 IonicContact OD1-NE 3.73Å; D1196-R1200 IonicContact OD1-NH1 2.77Å; D1196-R1200 PolarHBondContact OD1-NH1 2.98Å; D1196-R1200 WeakPolarHBondContact OD2-CD 3Å; D1196-R1200 IonicContact OD2-CZ 3.75Å; D1196-R1200 IonicContact OD2-NH1 3.79Å; D1196-R1200 PolarHBondContact OD2-NH1 3.29Å; R1200-R1202 WeakPolarHBondContact O-CD 3.34Å; R1200-R1202 WeakPolarHBondContact O-CG 3.32Å; R1200-R1202 PolarHBondContact O-N 3.19Å
1201	P	95	Very high	92.4	Very high	21 Å²	21	48.7 Å²	48.7	14%	0.136	26%	0.262	C	S	.	.			trans	-55.1	139.2	171.2	-22.9	31.2	0	0	0	112.3	P1142 H1145 Q1147	P1142-P1201 HydrophobicContact CG-CB 4.15Å; P1142-P1201 HydrophobicContact CG-CG 4.43Å; H1145-P1201 HydrophobicContact CB-CB 4.37Å; Q1147-P1201 HydrophobicContact CG-CG 4.4Å
1202	R	93.9	Very high	92.4	Very high	42 Å²	42	51.3 Å²	51.3	16%	0.158	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.5	-177.8	-53	-59.5	-61.1	-69.4	-11	109.1	T1068 D1072 I1075 H1145 R1146 R1200	T1068-R1202 PolarHBondContact O-NH1 2.84Å; T1068-R1202 VanDerWaalsContact O-NH1 3.15Å; D1072-R1202 VanDerWaalsContact CG-NH2 3.25Å; D1072-R1202 IonicContact OD1-CZ 2.68Å; D1072-R1202 IonicContact OD1-NH1 3.43Å; D1072-R1202 PolarHBondContact OD1-NH1 2.79Å; D1072-R1202 IonicContact OD1-NH2 3.43Å; D1072-R1202 PolarHBondContact OD1-NH2 2.7Å; D1072-R1202 IonicContact OD2-CZ 2.7Å; D1072-R1202 IonicContact OD2-NH1 2.69Å; D1072-R1202 PolarHBondContact OD2-NH1 2.82Å; D1072-R1202 VanDerWaalsContact OD2-NH1 3.08Å; D1072-R1202 IonicContact OD2-NH2 2.68Å; D1072-R1202 PolarHBondContact OD2-NH2 2.87Å; I1075-R1202 HydrophobicContact CD1-CB 4.49Å; I1075-R1202 HydrophobicContact CD1-CG 4.04Å; H1145-R1202 CarbonylContact C-O 3.59Å; H1145-R1202 WeakPolarHBondContact CA-O 3.4Å; H1145-R1202 WeakPolarHBondContact CB-O 3.38Å; H1145-R1202 PolarHBondContact CD2-O 3.27Å; R1146-R1202 HydrophobicContact CG-CB 4.31Å; R1146-R1202 PolarHBondContact N-O 3.41Å; R1146-R1202 PolarHBondContact O-N 3.41Å; R1200-R1202 WeakPolarHBondContact O-CD 3.34Å; R1200-R1202 WeakPolarHBondContact O-CG 3.32Å; R1200-R1202 PolarHBondContact O-N 3.19Å
1203	P	91.8	Very high	92.5	Very high	82 Å²	82	49.9 Å²	49.9	53%	0.532	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	154.7	169.1	-25.5	35.6	0	0	0	112.1	R1146	R1146-P1203 PolarHBondContact NE-O 3.27Å; R1146-P1203 VanDerWaalsContact NE-O 3.15Å
1204	L	87.1	Confident	92.7	Very high	94 Å²	94	45 Å²	45	49%	0.492	23%	0.227	S	C	.	.			trans	-68.9	0	166.1	-63.2	174.2	0	0	0	109.9	E1108 R1110 L1144 R1146	E1108-L1204 HydrophobicContact CB-CD2 4.09Å; E1108-L1204 HydrophobicContact CG-CD2 3.92Å; E1108-L1204 WeakPolarHBondContact OE1-CD2 3.34Å; R1110-L1204 HydrophobicContact CB-CD1 4.39Å; R1110-L1204 HydrophobicContact CG-CD1 3.96Å; L1144-L1204 HydrophobicContact CB-CD1 4.41Å; L1144-L1204 PolarHBondContact O-N 2.88Å; L1144-L1204 VanDerWaalsContact O-N 3.16Å; R1146-L1204 HydrophobicContact CB-CD2 3.78Å; R1146-L1204 HydrophobicContact CG-CD2 3.89Å; R1146-L1204 PolarHBondContact NH2-OXT 2.69Å

Retrieved 1,204 of 1,204 residues in 339.2 ms (Link to these results)

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