A0A087Y5N8_POEFO Loading...

Inter-alpha-trypsin inhibitor heavy chain 2

AlphaFold DB , UniProt , Accession A0A087Y5N8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 942 aa.

						>A0A087Y5N8_POEFO|A0A087Y5N8
MRRPLLLALGLLLLHHSCCFEFVINGDWEDEEPGVDLPQERQKRAALTSEEDQTFEAIRGDDITVNSYRVESRITSRFAHTSVRSSVLNSGSRAQSIGFNVQIPKRAFISNFTMNVNGITFVGSVKEKALARRLYAQASSRNKAAGIVRTNAQDLETFTTEVHVPPGSSVAFELHYQEMMERRLGVYQHNLFLQPGRPVPHFQVDVYIYEPKGISKLETPNTLGERFVNLIQVTATKDKAHVVFKPNLHQQRKCENCSGSAIDGIFSVKYDVTRDSNAGELQVSDLYFVHFFAPSNLSPLPKNIVFVIDVSGSMWGVKMKQTVEAMKAILDDLKMEDRFSIIDFNHNVRCWSEELLPASPLQVADAKRYVQNIKPTGGTNINEALIRAAQMLVRANSQGFVDPRSVSMIILVSDGDPTVGEIKLSKIQKNVKRVMTEELSLFSLGIGFDVDYDFLERIAMENRGMAQRIYANHDAAEQIRAFYSQVSSPLLKKVTVHFPEGAVTDVTQSHFDKFFGGSELVVAGKVQLSDSNTLTSFTSASAASLQLNLETETDITELDMELATQQHSFTGFAKQMWAYLTIKQLIRERSLVTTVGKKRKITKQITELALQHSFVTPLTALLVESEDATERLLADSARDPRHGCCSGVQILSGPPSVNVVYATPPPWIQVPITTPSSQVLSGPVETVLPPKVNLVDGDPHFIIRLPGSNMDVCFNIDSKPGHILSLVSDTGTGVVVNGQLISSKQPHKNTVSSYFGIISVYHQPAGVSVKVGTDRISMADGRSSHSFTWGATADITQDSVRISIVKNSHVTVTIDNSIRVTVLLHRVWRKHPVNVDFLGLYIPSDNQYSPLVHGLIGQFSREPEVSVYDVHEGPDPLKKEATMEVKGHTLRVTRGWQKDFRHDRKRGSNVYCWFVHNSGKGFIDGRYGDYIMPDLNSFLQTV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	30.9	Very low	233 Å²	233	159.1 Å²	159.1	100%	1.148	82%	0.823	S	S	*	*				0	119.6	0	-64.2	102.6	95.5	0	0	108.2
2	R	28.6	Very low	30.2	Very low	247 Å²	247	157.3 Å²	157.3	93%	0.932	82%	0.815	S	S	*	*				66.2	89.6	90.9	-78.8	-166.4	177.1	-172.8	0.1	115.8
3	R	34.7	Very low	29.7	Very low	237 Å²	237	155.3 Å²	155.3	89%	0.894	81%	0.805	S	S	*	*				-13.6	169	118.3	-90.9	-175.5	180	-171.6	1.2	116.6
4	P	56.7	Low	29.4	Very low	108 Å²	108	154 Å²	154	70%	0.701	80%	0.799	S	S	*	*			cis	-129.4	-144.9	-4.9	31.2	-5.2	0	0	0	110.9
5	L	30.4	Very low	29.2	Very low	151 Å²	151	153.1 Å²	153.1	79%	0.791	79%	0.789	S	S	*	*			cis	-157.2	178.1	0.1	-158.7	52.1	0	0	0	111.8
6	L	28.9	Very low	29.2	Very low	145 Å²	145	152.6 Å²	152.6	76%	0.759	78%	0.782	S	S	*	*			trans	-47.7	152.7	163.3	-72.7	138.5	0	0	0	117.7
7	L	28.9	Very low	29	Very low	178 Å²	178	147.8 Å²	147.8	93%	0.932	77%	0.765	S	S	*	*				-171.9	169.9	127.2	-101.6	159.5	0	0	0	112.2
8	A	24.8	Very low	28.7	Very low	69 Å²	69	146.2 Å²	146.2	57%	0.57	77%	0.767	S	S	*	*				-156.9	164.8	-124	0	0	0	0	0	114.6
9	L	24.6	Very low	28.4	Very low	171 Å²	171	143.6 Å²	143.6	90%	0.895	76%	0.761	S	S	*	*			trans	64.4	155	163.3	-86.9	73.7	0	0	0	119.8
10	G	24.4	Very low	28.2	Very low	65 Å²	65	147.2 Å²	147.2	67%	0.67	77%	0.77	S	S	*	*			trans	126.7	102.1	175.6	0	0	0	0	0	111.7
11	L	23	Very low	28	Very low	146 Å²	146	148.4 Å²	148.4	76%	0.764	77%	0.772	S	S	*	*				58.1	133.8	58.7	-72.2	102.2	0	0	0	114.3
12	L	22.8	Very low	27.4	Very low	137 Å²	137	146.8 Å²	146.8	72%	0.717	76%	0.759	S	S	*	*			cis	-166.4	162.9	-16.6	-153.4	77.4	0	0	0	109.4
13	L	23.8	Very low	27.1	Very low	132 Å²	132	140 Å²	140	69%	0.691	75%	0.745	S	S	*	*			trans	28	138.3	156.1	-75.7	173.5	0	0	0	122.8
14	L	25.7	Very low	26.7	Very low	137 Å²	137	136.6 Å²	136.6	72%	0.717	74%	0.743	S	S	*	*				168.2	116.9	113.9	-85.3	170.1	0	0	0	109.4
15	H	26.3	Very low	25.1	Very low	140 Å²	140	138 Å²	138	65%	0.648	74%	0.744	S	S	*	*				72.6	151	99.1	-76.2	-4.9	0	0	0	115.8
16	H	28.3	Very low	24.8	Very low	146 Å²	146	134.2 Å²	134.2	68%	0.676	74%	0.741	S	S	*	*			cis	-163.3	167.9	-13.6	-118.4	-49.9	0	0	0	107
17	S	25.9	Very low	24.6	Very low	71 Å²	71	134 Å²	134	50%	0.497	74%	0.741	S	S	.	*			cis	-139.4	-144.2	-7.3	-151.4	0	0	0	0	109.2	C19	S17-C19 PolarHBondContact OG-SG 3.4Å
18	C	25	Very low	24.4	Very low	119 Å²	119	137.8 Å²	137.8	80%	0.804	74%	0.743	S	S	*	*			cis	-125.1	158.9	11.9	-73.2	0	0	0	0	110.5
19	C	23	Very low	24.3	Very low	96 Å²	96	142.8 Å²	142.8	65%	0.649	76%	0.755	S	S	*	*			cis	84.9	92.3	31.3	-61	0	0	0	0	115.5	S17	S17-C19 PolarHBondContact OG-SG 3.4Å
20	F	23.7	Very low	24.3	Very low	216 Å²	216	141.7 Å²	141.7	95%	0.947	75%	0.75	S	S	*	*			trans	-140.7	142.1	139.3	-97.8	-75.9	0	0	0	107.6
21	E	23.5	Very low	24.3	Very low	172 Å²	172	147.8 Å²	147.8	80%	0.804	76%	0.761	S	S	*	*			trans	-148	148.9	-168.3	-175.7	172.2	-127.6	0	0	108.9
22	F	21.8	Very low	24.3	Very low	199 Å²	199	149.2 Å²	149.2	87%	0.873	76%	0.763	S	S	*	*			trans	-142.7	126.7	174.1	-97.4	-80.8	0	0	0	110
23	V	23.7	Very low	24.6	Very low	106 Å²	106	148.7 Å²	148.7	64%	0.642	77%	0.768	S	S	*	*			trans	-139.9	125.3	175.7	176.6	0	0	0	0	108.5
24	I	25.8	Very low	24.5	Very low	165 Å²	165	145.4 Å²	145.4	85%	0.846	77%	0.767	S	S	*	*			trans	-141.4	130.6	158.1	-60.8	-174.8	0	0	0	106.7
25	N	24	Very low	24.4	Very low	137 Å²	137	146.1 Å²	146.1	73%	0.733	78%	0.776	S	S	*	*			trans	-92.4	169.8	-178.9	-60.5	-3.9	0	0	0	111.6
26	G	24.1	Very low	24.2	Very low	71 Å²	71	146 Å²	146	73%	0.732	78%	0.78	S	S	*	*			trans	172	75.9	169.1	0	0	0	0	0	114.3
27	D	22.8	Very low	24	Very low	141 Å²	141	145.7 Å²	145.7	75%	0.754	78%	0.783	S	S	*	*			trans	-74.2	149.4	174	-46.8	-78.8	0	0	0	112.3
28	W	25.1	Very low	24.1	Very low	257 Å²	257	148.3 Å²	148.3	97%	0.973	80%	0.799	S	S	*	*			trans	-148.9	136.3	153.6	-78.4	100.2	0	0	0	109
29	E	23.2	Very low	24	Very low	175 Å²	175	151 Å²	151	82%	0.818	80%	0.799	S	S	*	*			trans	-99.7	161.1	-174.1	-66.2	173.7	129.5	0	0	112.9
30	D	24.3	Very low	24	Very low	148 Å²	148	153.7 Å²	153.7	79%	0.791	80%	0.802	S	S	*	*			trans	41.4	131.1	149.6	-62.1	-5.9	0	0	0	122.8
31	E	23.7	Very low	24	Very low	192 Å²	192	153.4 Å²	153.4	90%	0.897	80%	0.795	S	S	*	*				-174.2	136.8	99.8	-97.7	-173.1	167	0	0	112.2
32	E	24.6	Very low	24.1	Very low	176 Å²	176	154.5 Å²	154.5	82%	0.822	80%	0.8	S	S	*	*			trans	-95.1	159.3	154.7	-85.6	-159.1	167.8	0	0	109.5
33	P	27.9	Very low	24.1	Very low	126 Å²	126	155.1 Å²	155.1	82%	0.818	80%	0.802	S	S	*	*				-139.7	139.8	114.5	35.8	-24.7	0	0	0	114.8
34	G	21.6	Very low	24.1	Very low	64 Å²	64	162 Å²	162	66%	0.66	82%	0.817	S	S	*	*			trans	-83.6	174.4	174.2	0	0	0	0	0	115.3
35	V	24.2	Very low	24.1	Very low	152 Å²	152	159 Å²	159	92%	0.921	82%	0.816	S	S	*	*			trans	-140.5	142.5	173.5	-179.3	0	0	0	0	109.2
36	D	22.4	Very low	24	Very low	136 Å²	136	156.9 Å²	156.9	73%	0.727	82%	0.818	S	S	*	*			trans	-118.6	141.6	-160.8	-139.8	-6	0	0	0	114.2
37	L	22.9	Very low	24	Very low	140 Å²	140	161.7 Å²	161.7	73%	0.733	83%	0.826	S	S	*	*			trans	63.6	167.7	157.7	-66.9	166.4	0	0	0	119.3
38	P	29.6	Very low	23.9	Very low	127 Å²	127	161.5 Å²	161.5	83%	0.825	83%	0.831	S	S	*	*			cis	-125.2	-169	2.6	42.1	-26.2	0	0	0	116.2
39	Q	22.9	Very low	23.9	Very low	174 Å²	174	154.4 Å²	154.4	81%	0.813	82%	0.82	S	S	*	*			trans	-81.6	164.5	-162.3	-59.1	166.9	-47.2	0	0	118.3
40	E	23.1	Very low	24	Very low	153 Å²	153	155.1 Å²	155.1	72%	0.715	82%	0.823	S	S	*	*			trans	103.5	144.4	133.8	-129.1	-161.7	-133.4	0	0	121.4
41	R	23.5	Very low	24.2	Very low	211 Å²	211	155.4 Å²	155.4	80%	0.796	82%	0.82	S	S	*	*			trans	75.7	96	163.7	-55.9	-179.9	-178.8	-167.3	-3.5	119.7
42	Q	24.2	Very low	24.3	Very low	195 Å²	195	153.8 Å²	153.8	91%	0.911	82%	0.818	S	S	*	*				-160.7	120.6	98.9	-105.2	176.6	25.8	0	0	112.7
43	K	23.5	Very low	24.5	Very low	211 Å²	211	152.2 Å²	152.2	92%	0.917	81%	0.81	S	S	*	*			trans	-89.8	126.4	162	-79.5	-178.5	174.9	177.6	0	108.9
44	R	22.8	Very low	24.9	Very low	250 Å²	250	151.9 Å²	151.9	94%	0.943	81%	0.806	S	S	*	*			trans	-151.2	135.8	154.1	-116.8	173.2	-175.1	-178.1	0.7	111.4	A46	R44-A46 PolarHBondContact O-N 2.04Å
45	A	25.7	Very low	25.8	Very low	102 Å²	102	152.3 Å²	152.3	84%	0.843	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-47.7	121.6	-166.4	0	0	0	0	0	115.4
46	A	22.2	Very low	27	Very low	93 Å²	93	151.2 Å²	151.2	77%	0.769	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-83	137.9	143.8	0	0	0	0	0	107.9	R44	R44-A46 PolarHBondContact O-N 2.04Å
47	L	23.1	Very low	28.4	Very low	173 Å²	173	145.9 Å²	145.9	91%	0.906	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-73	128	172.3	-77.2	152.1	0	0	0	108.6	S49	L47-S49 PolarHBondContact O-N 3.15Å
48	T	21	Very low	30.1	Very low	137 Å²	137	140.3 Å²	140.3	84%	0.84	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-66.4	117.6	173.6	45.9	0	0	0	0	109.7
49	S	25.5	Very low	31.3	Very low	108 Å²	108	140.2 Å²	140.2	76%	0.755	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-58.8	151.6	155.4	49.3	0	0	0	0	109.5	L47	L47-S49 PolarHBondContact O-N 3.15Å
50	E	26	Very low	33	Very low	189 Å²	189	132.9 Å²	132.9	88%	0.883	68%	0.675	S	S	*	*	S	Bend	trans	-60.4	156	176.4	-63.2	-176.3	138.6	0	0	111.2	D52	E50-D52 PolarHBondContact O-N 2.81Å; E50-D52 VanDerWaalsContact O-N 3.15Å
51	E	26.9	Very low	34.9	Very low	154 Å²	154	131.9 Å²	131.9	72%	0.72	67%	0.674	S	S	*	*			trans	-61.3	111.5	-160.3	-59.3	175.2	166.8	0	0	114	Q53	E51-Q53 HydrophobicContact CB-CG 3.83Å; E51-Q53 PolarHBondContact O-N 3.41Å; E51-Q53 PolarHBondContact OE2-NE2 3.25Å
52	D	27.1	Very low	37.4	Very low	159 Å²	159	124.8 Å²	124.8	85%	0.85	65%	0.652	S	S	*	*			trans	-66.8	78.3	153	-103.8	-32.5	0	0	0	108.3	E50 T54	E50-D52 PolarHBondContact O-N 2.81Å; E50-D52 VanDerWaalsContact O-N 3.15Å; D52-T54 VanDerWaalsContact C-N 3.32Å; D52-T54 PolarHBondContact O-N 2.75Å
53	Q	28.6	Very low	40.1	Very low	143 Å²	143	115.7 Å²	115.7	67%	0.668	61%	0.609	S	S	*	*			trans	-68	91.6	172.2	-69.5	-164	8.2	0	0	109.1	E51 F55	E51-Q53 HydrophobicContact CB-CG 3.83Å; E51-Q53 PolarHBondContact O-N 3.41Å; E51-Q53 PolarHBondContact OE2-NE2 3.25Å; Q53-F55 PolarHBondContact O-N 2.78Å
54	T	35.4	Very low	43	Very low	119 Å²	119	108.5 Å²	108.5	73%	0.73	58%	0.583	S	S	*	*			trans	-57.7	103.5	173.3	50.8	0	0	0	0	109.8	D52 E56	D52-T54 VanDerWaalsContact C-N 3.32Å; D52-T54 PolarHBondContact O-N 2.75Å; T54-E56 PolarHBondContact O-N 2.82Å
55	F	41.5	Very low	46.1	Very low	73 Å²	73	96.8 Å²	96.8	32%	0.32	54%	0.54	S	S	.	.			trans	-71.6	91.6	-176.7	-176.5	-95.4	0	0	0	110.6	Q53 A57 N100 T159	Q53-F55 PolarHBondContact O-N 2.78Å; F55-A57 HydrophobicContact CD1-CB 4.43Å; F55-A57 HydrophobicContact CE1-CB 4.24Å; F55-A57 PolarHBondContact O-N 3.44Å; F55-N100 HydrophobicContact CE1-CB 4.48Å; F55-T159 HydrophobicContact CD1-CG2 3.95Å; F55-T159 HydrophobicContact CE1-CG2 3.43Å; F55-T159 VanDerWaalsContact CE1-CG2 3.43Å; F55-T159 HydrophobicContact CE2-CG2 4.08Å; F55-T159 HydrophobicContact CG-CG2 4.48Å; F55-T159 HydrophobicContact CZ-CG2 3.51Å
56	E	49	Very low	49.2	Very low	129 Å²	129	94.7 Å²	94.7	60%	0.603	51%	0.514	S	S	*	.			trans	-60.2	105.3	165.8	-69.7	-170.5	139.8	0	0	109.7	T54 I58 R59	T54-E56 PolarHBondContact O-N 2.82Å; E56-I58 PolarHBondContact O-N 3.04Å; E56-I58 VanDerWaalsContact O-N 3.09Å; E56-R59 HydrophobicContact CB-CG 4.19Å
57	A	51.4	Low	52.6	Low	24 Å²	24	92.1 Å²	92.1	20%	0.198	49%	0.491	C	S	.	.	S	Bend	trans	-64	-16.4	-175.5	0	0	0	0	0	114.1	F55 G98 N100	F55-A57 HydrophobicContact CD1-CB 4.43Å; F55-A57 HydrophobicContact CE1-CB 4.24Å; F55-A57 PolarHBondContact O-N 3.44Å; A57-G98 CarbonylContact O-C 3.5Å; A57-G98 WeakPolarHBondContact O-CA 3.38Å; A57-G98 PolarHBondContact O-N 2.91Å; A57-N100 HydrophobicContact CB-CB 4.03Å
58	I	58.3	Low	56.1	Low	23 Å²	23	84.3 Å²	84.3	12%	0.118	45%	0.449	C	S	.	.	B	Isolated β-bridge	trans	-138.7	104.1	-178.5	-56.3	-179.7	0	0	0	110.1	E56 I63 V65 R197	E56-I58 PolarHBondContact O-N 3.04Å; E56-I58 VanDerWaalsContact O-N 3.09Å; I58-I63 HydrophobicContact CG2-CB 3.63Å; I58-I63 HydrophobicContact CG2-CD1 3.77Å; I58-I63 HydrophobicContact CG2-CG1 4.31Å; I58-I63 HydrophobicContact CG2-CG2 3.53Å; I58-V65 HydrophobicContact CD1-CG2 3.27Å; I58-R197 HydrophobicContact CD1-CG 4.48Å
59	R	54.9	Low	59.7	Low	125 Å²	125	81.9 Å²	81.9	47%	0.472	43%	0.425	S	S	.	.			trans	-105.3	110	-177.8	-70.9	177	170.2	167.6	-2.6	111.5	E56 I63	E56-R59 HydrophobicContact CB-CG 4.19Å; R59-I63 VanDerWaalsContact O-CD1 3.32Å; R59-I63 WeakPolarHBondContact O-CD1 3.11Å
60	G	59.1	Low	63.1	Low	20 Å²	20	76.8 Å²	76.8	21%	0.206	39%	0.389	C	S	.	.	S	Bend	trans	125.4	137.4	177.4	0	0	0	0	0	113	D62 R197	G60-D62 PolarHBondContact O-N 2.77Å; G60-R197 VanDerWaalsContact O-CZ 3.22Å; G60-R197 PolarHBondContact O-NH1 3.48Å; G60-R197 PolarHBondContact O-NH2 2.83Å
61	D	63.8	Low	66.5	Low	131 Å²	131	68.3 Å²	68.3	70%	0.701	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-31.4	-170.4	-60.8	-58.8	0	0	0	113.2	I63 R197	D61-I63 PolarHBondContact O-N 2.84Å; D61-R197 PolarHBondContact O-NH1 2.88Å
62	D	75.2	Confident	69.9	Low	63 Å²	63	61 Å²	61	34%	0.337	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	7.9	-176.1	-33.1	-79.1	0	0	0	115	G60 S90 G91 Q95	G60-D62 PolarHBondContact O-N 2.77Å; D62-S90 PolarHBondContact O-N 3.49Å; D62-S90 PolarHBondContact O-OG 3.34Å; D62-G91 VanDerWaalsContact CB-N 3.33Å; D62-Q95 PolarHBondContact OD2-NE2 3.16Å
63	I	80.8	Confident	73.2	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.7	-177.9	-54.6	167.8	0	0	0	110.8	I58 R59 D61 V87 Q95 I97 R197	I58-I63 HydrophobicContact CG2-CB 3.63Å; I58-I63 HydrophobicContact CG2-CD1 3.77Å; I58-I63 HydrophobicContact CG2-CG1 4.31Å; I58-I63 HydrophobicContact CG2-CG2 3.53Å; R59-I63 VanDerWaalsContact O-CD1 3.32Å; R59-I63 WeakPolarHBondContact O-CD1 3.11Å; D61-I63 PolarHBondContact O-N 2.84Å; I63-V87 HydrophobicContact CG2-CG1 3.34Å; I63-Q95 HydrophobicContact CD1-CB 3.99Å; I63-Q95 HydrophobicContact CG1-CB 4.36Å; I63-I97 HydrophobicContact CD1-CG1 4.3Å; I63-I97 HydrophobicContact CG2-CD1 4.01Å; I63-I97 HydrophobicContact CG2-CG1 4.25Å; I63-R197 PolarHBondContact O-NH1 2.84Å
64	T	84.7	Confident	76.5	Confident	60 Å²	60	50.8 Å²	50.8	37%	0.368	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.8	179.2	49.1	0	0	0	0	111.6	N66 V87 L88	T64-N66 PolarHBondContact O-N 3.26Å; T64-V87 CarbonylContact O-C 3.53Å; T64-V87 WeakPolarHBondContact O-CA 3.01Å; T64-V87 WeakPolarHBondContact O-CG1 3.34Å; T64-L88 PolarHBondContact N-O 3.02Å; T64-L88 PolarHBondContact O-N 2.96Å; T64-L88 PolarHBondContact OG1-O 3.24Å
65	V	88	Confident	79.4	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.03	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	108.3	170.4	-174.2	0	0	0	0	107.4	I58 S86 V87 V199 P200	I58-V65 HydrophobicContact CD1-CG2 3.27Å; V65-S86 CarbonylContact C-O 3.52Å; V65-V87 HydrophobicContact CG2-CG1 4.29Å; V65-V87 HydrophobicContact CG2-CG2 4.43Å; V65-V199 HydrophobicContact CB-CG1 4.47Å; V65-V199 HydrophobicContact CB-CG2 4.01Å; V65-V199 HydrophobicContact CG1-CB 4.45Å; V65-V199 HydrophobicContact CG1-CG1 3.93Å; V65-V199 HydrophobicContact CG1-CG2 3.75Å; V65-P200 WeakPolarHBondContact O-CD 3.26Å
66	N	90.8	Very high	82	Confident	57 Å²	57	41.7 Å²	41.7	31%	0.305	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	-36.6	-175.8	-72.7	-27.9	0	0	0	112.4	T64 S86 L88 H201	T64-N66 PolarHBondContact O-N 3.26Å; N66-S86 PolarHBondContact N-O 2.98Å; N66-L88 WeakPolarHBondContact ND2-CB 3.37Å; N66-H201 PolarHBondContact O-N 3.35Å; N66-H201 PolarHBondContact O-ND1 3.16Å
67	S	94.3	Very high	84.2	Confident	40 Å²	40	35.6 Å²	35.6	28%	0.28	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	148.7	177.5	64.8	0	0	0	0	111.9	S85 S86 H201	S67-S85 WeakPolarHBondContact O-CA 3.5Å; S67-S86 PolarHBondContact N-O 3.24Å; S67-S86 PolarHBondContact O-N 2.9Å; S67-S86 WeakPolarHBondContact OG-CB 3.39Å; S67-H201 WeakPolarHBondContact CA-O 3.48Å
68	Y	95.4	Very high	86.3	Confident	8 Å²	8	34.5 Å²	34.5	3%	0.031	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	107.6	174.7	-172.8	-84	0	0	0	107	V70 R84 L193 P195 H201 F202 Q203	Y68-V70 HydrophobicContact CD1-CG2 4.39Å; Y68-V70 HydrophobicContact CE1-CG2 3.76Å; Y68-R84 CarbonylContact C-O 3.53Å; Y68-R84 WeakPolarHBondContact CA-O 3.32Å; Y68-L193 HydrophobicContact CE1-CD2 4.46Å; Y68-P195 HydrophobicContact CD1-CB 4.47Å; Y68-P195 HydrophobicContact CD2-CB 4.1Å; Y68-P195 HydrophobicContact CE2-CB 4.33Å; Y68-P195 HydrophobicContact CG-CB 4.16Å; Y68-H201 PolarHBondContact N-O 2.91Å; Y68-F202 AromaticContact CD1-CD2 3.9Å; Y68-F202 HydrophobicContact CD1-CD2 3.9Å; Y68-F202 AromaticContact CD1-CE2 3.41Å; Y68-F202 HydrophobicContact CD1-CE2 3.41Å; Y68-F202 VanDerWaalsContact CD1-CE2 3.41Å; Y68-F202 HydrophobicContact CD1-CZ 4.14Å; Y68-F202 AromaticContact CE1-CE2 3.94Å; Y68-F202 HydrophobicContact CE1-CE2 3.94Å; Y68-F202 HydrophobicContact CE1-CZ 4.42Å; Y68-F202 HydrophobicContact CG-CD2 4.34Å; Y68-F202 HydrophobicContact CG-CE2 4.2Å; Y68-F202 WeakPolarHBondContact O-CA 3.46Å; Y68-Q203 PolarHBondContact O-N 3.48Å
69	R	97.1	Very high	88.1	Confident	86 Å²	86	33.4 Å²	33.4	33%	0.325	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.4	-176.7	-179.8	170.4	170.9	152	-5.3	110.9	E71 R84 Q203 D205	R69-E71 IonicContact CZ-OE2 3.05Å; R69-E71 IonicContact NE-OE2 3.45Å; R69-E71 PolarHBondContact NE-OE2 3.13Å; R69-E71 IonicContact NH2-OE2 3.67Å; R69-E71 PolarHBondContact NH2-OE2 2.96Å; R69-R84 PolarHBondContact N-O 3.04Å; R69-R84 PolarHBondContact O-N 3.14Å; R69-Q203 VanDerWaalsContact CA-O 3.24Å; R69-Q203 WeakPolarHBondContact CA-O 3.33Å; R69-D205 IonicContact CZ-OD2 3.3Å; R69-D205 IonicContact NE-OD2 3.58Å; R69-D205 IonicContact NH2-OD2 2.95Å
70	V	97.6	Very high	90.1	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.2	168.8	-175.4	0	0	0	0	107.8	Y68 T81 S82 V83 L191 L193 Q203 V204 D205	Y68-V70 HydrophobicContact CD1-CG2 4.39Å; Y68-V70 HydrophobicContact CE1-CG2 3.76Å; V70-T81 HydrophobicContact CG1-CG2 4.02Å; V70-S82 WeakPolarHBondContact CA-O 3.24Å; V70-V83 HydrophobicContact CG1-CG2 4.15Å; V70-V83 HydrophobicContact CG2-CG1 4.28Å; V70-V83 HydrophobicContact CG2-CG2 4.2Å; V70-L191 HydrophobicContact CG1-CD1 3.88Å; V70-L191 HydrophobicContact CG1-CD2 4.02Å; V70-L191 HydrophobicContact CG1-CG 4.42Å; V70-L193 HydrophobicContact CG2-CD2 3.82Å; V70-Q203 PolarHBondContact N-O 3.44Å; V70-V204 HydrophobicContact CB-CG1 4.27Å; V70-V204 HydrophobicContact CB-CG2 4.17Å; V70-V204 HydrophobicContact CG2-CG2 4.43Å; V70-V204 CarbonylContact O-C 3.57Å; V70-V204 WeakPolarHBondContact O-CA 3.43Å; V70-D205 PolarHBondContact O-N 3.07Å
71	E	97.6	Very high	91.8	Very high	11 Å²	11	28.4 Å²	28.4	5%	0.051	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115	175.5	-178.3	178.4	134.7	0	0	109.2	R69 R73 S82 D205 Y207	R69-E71 IonicContact CZ-OE2 3.05Å; R69-E71 IonicContact NE-OE2 3.45Å; R69-E71 PolarHBondContact NE-OE2 3.13Å; R69-E71 IonicContact NH2-OE2 3.67Å; R69-E71 PolarHBondContact NH2-OE2 2.96Å; E71-R73 IonicContact OE1-CZ 2.83Å; E71-R73 IonicContact OE1-NE 3.39Å; E71-R73 PolarHBondContact OE1-NE 2.88Å; E71-R73 IonicContact OE1-NH2 2.73Å; E71-R73 PolarHBondContact OE1-NH2 3.31Å; E71-S82 PolarHBondContact N-O 2.78Å; E71-S82 PolarHBondContact O-N 3.21Å; E71-S82 PolarHBondContact O-OG 3.01Å; E71-S82 VanDerWaalsContact O-OG 3.14Å; E71-D205 WeakPolarHBondContact CA-O 3.46Å; E71-D205 HydrophobicContact CG-CB 4.36Å; E71-Y207 HydrophobicContact CG-CD2 4.24Å; E71-Y207 HydrophobicContact CG-CE2 4.01Å
72	S	97.4	Very high	93.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.9	173.3	-177.5	0	0	0	0	110.2	H80 T81 H189 D205 V206 Y207	S72-H80 WeakPolarHBondContact CA-O 3.07Å; S72-T81 PolarHBondContact OG-OG1 3.04Å; S72-H189 WeakPolarHBondContact CB-NE2 3.32Å; S72-H189 PolarHBondContact OG-NE2 2.91Å; S72-D205 PolarHBondContact N-O 2.65Å; S72-V206 WeakPolarHBondContact O-CA 3.41Å; S72-Y207 PolarHBondContact O-N 3.44Å
73	R	96.9	Very high	94.4	Very high	87 Å²	87	19.6 Å²	19.6	33%	0.328	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	112.7	174	-59	-176.7	-170.4	-171	2	108.5	E71 H80 Y207	E71-R73 IonicContact OE1-CZ 2.83Å; E71-R73 IonicContact OE1-NE 3.39Å; E71-R73 PolarHBondContact OE1-NE 2.88Å; E71-R73 IonicContact OE1-NH2 2.73Å; E71-R73 PolarHBondContact OE1-NH2 3.31Å; R73-H80 PolarHBondContact N-O 2.9Å; R73-H80 PolarHBondContact O-N 3.46Å; R73-Y207 WeakPolarHBondContact CA-O 3.42Å; R73-Y207 HydrophobicContact CG-CD2 4.32Å
74	I	97.3	Very high	95.1	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.4	177.4	-45.4	-172.9	0	0	0	107.8	F78 A79 M180 H189 V206 Y207 I208 Y209 Y270	I74-F78 WeakPolarHBondContact CA-O 3.46Å; I74-A79 HydrophobicContact CD1-CB 4.35Å; I74-A79 HydrophobicContact CG1-CB 3.89Å; I74-A79 HydrophobicContact CG2-CB 4.46Å; I74-M180 HydrophobicContact CG2-CG 4.24Å; I74-H189 HydrophobicContact CD1-CB 4.14Å; I74-V206 HydrophobicContact CD1-CG1 4.19Å; I74-V206 HydrophobicContact CG1-CG1 4.45Å; I74-Y207 PolarHBondContact N-O 3.28Å; I74-I208 HydrophobicContact CB-CG1 4.39Å; I74-I208 HydrophobicContact CB-CG2 4.44Å; I74-I208 HydrophobicContact CD1-CG1 4.23Å; I74-I208 HydrophobicContact CG1-CG1 4.45Å; I74-I208 CarbonylContact O-C 3.56Å; I74-I208 WeakPolarHBondContact O-CA 3.35Å; I74-Y209 PolarHBondContact O-N 3.15Å; I74-Y270 HydrophobicContact CD1-CE1 4.29Å; I74-Y270 WeakPolarHBondContact CG2-OH 3.02Å
75	T	96.4	Very high	95.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.7	173.9	-65.4	0	0	0	0	107.9	R77 F78 Y209 L562 S568 F569 F572	T75-R77 PolarHBondContact O-N 2.89Å; T75-F78 PolarHBondContact N-O 3.07Å; T75-F78 WeakPolarHBondContact O-CB 3.39Å; T75-F78 PolarHBondContact O-N 3.09Å; T75-Y209 WeakPolarHBondContact CA-O 3.46Å; T75-Y209 HydrophobicContact CG2-CD1 4.4Å; T75-L562 HydrophobicContact CG2-CD2 3.79Å; T75-S568 WeakPolarHBondContact OG1-CA 3.31Å; T75-F569 PolarHBondContact OG1-N 3.32Å; T75-F572 HydrophobicContact CG2-CB 4.26Å; T75-F572 HydrophobicContact CG2-CD1 3.89Å; T75-F572 HydrophobicContact CG2-CG 3.98Å
76	S	95.6	Very high	95.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	61	179.5	-63.8	0	0	0	0	112.8	F78 Y209 E210 P211 Q282 F291 M576	S76-F78 PolarHBondContact O-N 2.73Å; S76-Y209 PolarHBondContact N-O 2.77Å; S76-E210 WeakPolarHBondContact CA-OE2 3.21Å; S76-P211 WeakPolarHBondContact OG-CD 3.14Å; S76-Q282 VanDerWaalsContact OG-CD 3.3Å; S76-Q282 PolarHBondContact OG-NE2 3.25Å; S76-Q282 PolarHBondContact OG-OE1 3.28Å; S76-F291 WeakPolarHBondContact O-CZ 3.39Å; S76-M576 VanDerWaalsContact O-CE 3.23Å; S76-M576 WeakPolarHBondContact O-CE 3.27Å
77	R	95.4	Very high	95.8	Very high	1 Å²	1	20.3 Å²	20.3	0%	0.004	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	9.6	-177.9	-62.5	69.1	138.6	-171.8	-16.1	115.9	T75 M180 Y187 E210 E280 F291 E519 M576	T75-R77 PolarHBondContact O-N 2.89Å; R77-M180 HydrophobicContact CB-CB 4.09Å; R77-M180 VanDerWaalsContact O-CB 3.26Å; R77-M180 WeakPolarHBondContact O-CB 3.25Å; R77-M180 VanDerWaalsContact O-CG 3.26Å; R77-M180 WeakPolarHBondContact O-CG 3.44Å; R77-M180 PolarHBondContact O-N 3.26Å; R77-Y187 HydrophobicContact CB-CE1 4.37Å; R77-Y187 HydrophobicContact CG-CD1 4.08Å; R77-Y187 HydrophobicContact CG-CE1 3.37Å; R77-Y187 HydrophobicContact CG-CE2 4.13Å; R77-Y187 VanDerWaalsContact CG-CZ 3.41Å; R77-Y187 WeakPolarHBondContact CG-OH 3.27Å; R77-Y187 PolarHBondContact NE-OH 3.46Å; R77-E210 WeakPolarHBondContact CD-OE1 3.46Å; R77-E210 VanDerWaalsContact CD-OE2 3.25Å; R77-E210 WeakPolarHBondContact CD-OE2 3.44Å; R77-E210 IonicContact CZ-OE2 2.85Å; R77-E210 PolarHBondContact N-OE1 2.91Å; R77-E210 IonicContact NE-OE2 3.45Å; R77-E210 IonicContact NH1-OE2 3.33Å; R77-E210 PolarHBondContact NH1-OE2 2.93Å; R77-E280 IonicContact CZ-OE2 2.9Å; R77-E280 VanDerWaalsContact CZ-OE2 3.31Å; R77-E280 IonicContact NH1-OE1 2.72Å; R77-E280 PolarHBondContact NH1-OE1 3.02Å; R77-E280 IonicContact NH1-OE2 3.86Å; R77-E280 PolarHBondContact NH1-OE2 3.09Å; R77-E280 IonicContact NH2-OE2 2.7Å; R77-E280 PolarHBondContact NH2-OE2 2.99Å; R77-F291 HydrophobicContact CB-CE1 3.94Å; R77-F291 HydrophobicContact CB-CZ 4.35Å; R77-F291 HydrophobicContact CG-CE1 4.1Å; R77-E519 IonicContact NE-OE2 2.86Å; R77-E519 IonicContact NH2-OE1 2.91Å; R77-M576 HydrophobicContact CB-CE 4.44Å
78	F	96.3	Very high	95.6	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.009	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.9	172.1	-160.2	-107	0	0	0	110.2	I74 T75 S76 Q177 M179 F569 F572 Q575 M576	I74-F78 WeakPolarHBondContact CA-O 3.46Å; T75-F78 PolarHBondContact N-O 3.07Å; T75-F78 WeakPolarHBondContact O-CB 3.39Å; T75-F78 PolarHBondContact O-N 3.09Å; S76-F78 PolarHBondContact O-N 2.73Å; F78-Q177 HydrophobicContact CE1-CB 3.98Å; F78-Q177 HydrophobicContact CE1-CG 4.19Å; F78-Q177 HydrophobicContact CZ-CB 3.82Å; F78-Q177 HydrophobicContact CZ-CG 4.46Å; F78-M179 HydrophobicContact CD2-CB 4.41Å; F78-F569 HydrophobicContact CD1-CD1 4.47Å; F78-F569 HydrophobicContact CE1-CE1 4.48Å; F78-F572 HydrophobicContact CB-CB 4.11Å; F78-F572 HydrophobicContact CD1-CB 4.4Å; F78-Q575 HydrophobicContact CD1-CB 4.41Å; F78-Q575 HydrophobicContact CE1-CB 3.55Å; F78-Q575 HydrophobicContact CE1-CG 4.41Å; F78-Q575 HydrophobicContact CE2-CB 4.45Å; F78-Q575 HydrophobicContact CZ-CB 3.57Å; F78-M576 HydrophobicContact CB-CE 3.8Å; F78-M576 HydrophobicContact CD2-CB 3.87Å; F78-M576 HydrophobicContact CD2-CE 4.15Å; F78-M576 HydrophobicContact CD2-CG 4.18Å; F78-M576 HydrophobicContact CE2-CB 4.22Å; F78-M576 HydrophobicContact CG-CE 4.42Å
79	A	96.2	Very high	95.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	119.7	-177	0	0	0	0	0	111.2	I74 Q177 E178 M180	I74-A79 HydrophobicContact CD1-CB 4.35Å; I74-A79 HydrophobicContact CG1-CB 3.89Å; I74-A79 HydrophobicContact CG2-CB 4.46Å; A79-Q177 WeakPolarHBondContact O-CA 3.36Å; A79-E178 HydrophobicContact CB-CG 3.9Å; A79-E178 PolarHBondContact N-O 3.23Å; A79-E178 PolarHBondContact O-N 3.4Å; A79-M180 HydrophobicContact CB-CG 4.38Å; A79-M180 HydrophobicContact CB-SD 3.93Å
80	H	95.7	Very high	94.7	Very high	39 Å²	39	19.8 Å²	19.8	18%	0.181	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	108.6	171.8	-174.5	-67.7	0	0	0	109.4	S72 R73 H175 Q177	S72-H80 WeakPolarHBondContact CA-O 3.07Å; R73-H80 PolarHBondContact N-O 2.9Å; R73-H80 PolarHBondContact O-N 3.46Å; H80-H175 AromaticContact CE1-ND1 3.4Å; H80-H175 PolarHBondContact CE1-ND1 3.07Å; H80-Q177 HydrophobicContact CB-CG 4.48Å; H80-Q177 PolarHBondContact CD2-NE2 3.19Å; H80-Q177 PolarHBondContact NE2-NE2 3.09Å
81	T	96.5	Very high	94	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.3	-177.6	-53.9	0	0	0	0	111.7	V70 S72 V83 H175 Y176 L191	V70-T81 HydrophobicContact CG1-CG2 4.02Å; S72-T81 PolarHBondContact OG-OG1 3.04Å; T81-V83 HydrophobicContact CG2-CG2 4.45Å; T81-H175 WeakPolarHBondContact O-CA 3.44Å; T81-Y176 HydrophobicContact CG2-CE1 3.83Å; T81-Y176 HydrophobicContact CG2-CE2 4.11Å; T81-Y176 PolarHBondContact N-O 2.94Å; T81-Y176 PolarHBondContact O-N 3.06Å; T81-L191 HydrophobicContact CG2-CD2 3.67Å
82	S	96.3	Very high	93.3	Very high	6 Å²	6	25.2 Å²	25.2	4%	0.042	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.8	171.4	63.8	0	0	0	0	110.5	V70 E71 L174	V70-S82 WeakPolarHBondContact CA-O 3.24Å; E71-S82 PolarHBondContact N-O 2.78Å; E71-S82 PolarHBondContact O-N 3.21Å; E71-S82 PolarHBondContact O-OG 3.01Å; E71-S82 VanDerWaalsContact O-OG 3.14Å; S82-L174 CarbonylContact C-O 3.57Å; S82-L174 VanDerWaalsContact CA-O 3.31Å; S82-L174 WeakPolarHBondContact CA-O 3.32Å
83	V	96.6	Very high	92.6	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.024	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116	176.1	180	0	0	0	0	108.2	V70 T81 F99 V101 E173 L174 Y176	V70-V83 HydrophobicContact CG1-CG2 4.15Å; V70-V83 HydrophobicContact CG2-CG1 4.28Å; V70-V83 HydrophobicContact CG2-CG2 4.2Å; T81-V83 HydrophobicContact CG2-CG2 4.45Å; V83-F99 HydrophobicContact CG1-CE2 4.3Å; V83-F99 HydrophobicContact CG1-CZ 4.1Å; V83-V101 HydrophobicContact CB-CG1 4.5Å; V83-V101 HydrophobicContact CB-CG2 4.39Å; V83-V101 HydrophobicContact CG1-CG1 4.44Å; V83-V101 HydrophobicContact CG1-CG2 3.78Å; V83-V101 HydrophobicContact CG2-CG1 4.09Å; V83-E173 WeakPolarHBondContact O-CA 3.34Å; V83-L174 PolarHBondContact N-O 3.04Å; V83-L174 PolarHBondContact O-N 2.96Å; V83-Y176 HydrophobicContact CG2-CE1 4.08Å
84	R	96.2	Very high	91.6	Very high	97 Å²	97	30.7 Å²	30.7	37%	0.366	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.2	-177.2	-66.5	176.8	173.7	146.3	-2.4	110.2	Y68 R69 F172 E173	Y68-R84 CarbonylContact C-O 3.53Å; Y68-R84 WeakPolarHBondContact CA-O 3.32Å; R69-R84 PolarHBondContact N-O 3.04Å; R69-R84 PolarHBondContact O-N 3.14Å; R84-F172 CarbonylContact C-O 3.23Å; R84-F172 VanDerWaalsContact CA-O 3.29Å; R84-F172 WeakPolarHBondContact CA-O 3.06Å; R84-E173 HydrophobicContact CG-CB 4.09Å; R84-E173 HydrophobicContact CG-CG 3.94Å; R84-E173 IonicContact CZ-OE1 3.18Å; R84-E173 VanDerWaalsContact NE-CD 3.29Å; R84-E173 IonicContact NE-OE1 2.61Å; R84-E173 PolarHBondContact NE-OE1 3.2Å; R84-E173 IonicContact NE-OE2 3.64Å; R84-E173 IonicContact NH2-OE1 3.97Å; R84-E173 PolarHBondContact NH2-OE1 2.91Å
85	S	94	Very high	90.7	Very high	11 Å²	11	31.1 Å²	31.1	8%	0.077	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.3	175.5	-176.2	0	0	0	0	110.2	S67 A171 F172	S67-S85 WeakPolarHBondContact O-CA 3.5Å; S85-A171 CarbonylContact O-C 3.6Å; S85-A171 WeakPolarHBondContact O-CA 3.32Å; S85-F172 PolarHBondContact N-O 2.87Å; S85-F172 PolarHBondContact O-N 3.04Å
86	S	92.9	Very high	89.7	Confident	29 Å²	29	32.2 Å²	32.2	20%	0.203	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.9	172.2	-175.5	0	0	0	0	110.1	V65 N66 S67 V170	V65-S86 CarbonylContact C-O 3.52Å; N66-S86 PolarHBondContact N-O 2.98Å; S67-S86 PolarHBondContact N-O 3.24Å; S67-S86 PolarHBondContact O-N 2.9Å; S67-S86 WeakPolarHBondContact OG-CB 3.39Å; S86-V170 WeakPolarHBondContact CA-O 3.37Å
87	V	90.4	Very high	88.9	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.7	-173	-160.5	0	0	0	0	109.7	I63 T64 V65 I97 S169 V170 F172	I63-V87 HydrophobicContact CG2-CG1 3.34Å; T64-V87 CarbonylContact O-C 3.53Å; T64-V87 WeakPolarHBondContact O-CA 3.01Å; T64-V87 WeakPolarHBondContact O-CG1 3.34Å; V65-V87 HydrophobicContact CG2-CG1 4.29Å; V65-V87 HydrophobicContact CG2-CG2 4.43Å; V87-I97 HydrophobicContact CB-CD1 4.09Å; V87-I97 HydrophobicContact CB-CG2 4.01Å; V87-I97 HydrophobicContact CG1-CD1 3.77Å; V87-I97 HydrophobicContact CG1-CG2 3.91Å; V87-I97 HydrophobicContact CG2-CG2 4.04Å; V87-S169 CarbonylContact O-C 3.53Å; V87-S169 VanDerWaalsContact O-CA 3.31Å; V87-S169 WeakPolarHBondContact O-CA 3.19Å; V87-V170 PolarHBondContact N-O 2.83Å; V87-V170 PolarHBondContact O-N 3.11Å; V87-F172 HydrophobicContact CG2-CE2 4.4Å
88	L	89.4	Confident	88.1	Confident	50 Å²	50	32.6 Å²	32.6	26%	0.262	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.7	178.4	170.7	65.2	0	0	0	109.5	T64 N66 S90	T64-L88 PolarHBondContact N-O 3.02Å; T64-L88 PolarHBondContact O-N 2.96Å; T64-L88 PolarHBondContact OG1-O 3.24Å; N66-L88 WeakPolarHBondContact ND2-CB 3.37Å; L88-S90 PolarHBondContact O-N 2.89Å
89	N	88.1	Confident	87.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	101.6	165	177.9	14.1	0	0	0	108.4	G91 R93 V164 P165 G167 S168	N89-G91 VanDerWaalsContact C-N 3.31Å; N89-G91 PolarHBondContact OD1-N 2.87Å; N89-R93 PolarHBondContact ND2-O 2.99Å; N89-V164 HydrophobicContact CB-CB 4.42Å; N89-V164 HydrophobicContact CB-CG1 3.98Å; N89-V164 PolarHBondContact ND2-O 3.15Å; N89-P165 PolarHBondContact ND2-O 3.33Å; N89-P165 VanDerWaalsContact ND2-O 3.11Å; N89-G167 WeakPolarHBondContact O-CA 3.02Å; N89-G167 PolarHBondContact O-N 3.01Å; N89-S168 PolarHBondContact N-O 2.85Å
90	S	86.2	Confident	87	Confident	74 Å²	74	33.6 Å²	33.6	52%	0.517	19%	0.191	S	C	.	.			trans	-85.2	-3.7	175	65.3	0	0	0	0	113.9	D62 L88	D62-S90 PolarHBondContact O-N 3.49Å; D62-S90 PolarHBondContact O-OG 3.34Å; L88-S90 PolarHBondContact O-N 2.89Å
91	G	83.1	Confident	86.6	Confident	5 Å²	5	32 Å²	32	5%	0.052	18%	0.183	C	C	.	.	S	Bend	trans	-76.8	158.7	-177.2	0	0	0	0	0	114.2	D62 N89 R93 P166	D62-G91 VanDerWaalsContact CB-N 3.33Å; N89-G91 VanDerWaalsContact C-N 3.31Å; N89-G91 PolarHBondContact OD1-N 2.87Å; G91-R93 PolarHBondContact O-N 3.45Å; G91-P166 WeakPolarHBondContact O-CA 3.29Å; G91-P166 WeakPolarHBondContact O-CB 3.48Å
92	S	82.3	Confident	86.2	Confident	122 Å²	122	34.7 Å²	34.7	85%	0.853	20%	0.196	S	C	*	.	S	Bend	trans	-74.7	-6.2	178.7	56.5	0	0	0	0	114.6	P166	S92-P166 WeakPolarHBondContact O-CG 3.3Å
93	R	83.8	Confident	85.8	Confident	149 Å²	149	34.5 Å²	34.5	56%	0.562	19%	0.194	S	C	*	.	S	Bend	trans	-120.8	155.9	179	60.4	176.6	174.1	-177.1	-4	110.9	N89 G91 Q95	N89-R93 PolarHBondContact ND2-O 2.99Å; G91-R93 PolarHBondContact O-N 3.45Å; R93-Q95 HydrophobicContact CG-CG 4.01Å
94	A	75.8	Confident	85.4	Confident	52 Å²	52	34.9 Å²	34.9	43%	0.43	20%	0.197	S	C	.	.			trans	-64.9	142.5	167.2	0	0	0	0	0	110.1	V164	A94-V164 VanDerWaalsContact CA-O 3.24Å; A94-V164 WeakPolarHBondContact CA-O 3.37Å
95	Q	78.7	Confident	84.8	Confident	10 Å²	10	34.4 Å²	34.4	5%	0.047	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	151.2	-178.1	-51.5	-165.3	27.1	0	0	110.8	D62 I63 R93 V164	D62-Q95 PolarHBondContact OD2-NE2 3.16Å; I63-Q95 HydrophobicContact CD1-CB 3.99Å; I63-Q95 HydrophobicContact CG1-CB 4.36Å; R93-Q95 HydrophobicContact CG-CG 4.01Å; Q95-V164 PolarHBondContact N-O 2.6Å; Q95-V164 PolarHBondContact O-N 2.86Å
96	S	74.9	Confident	84.3	Confident	23 Å²	23	36.4 Å²	36.4	16%	0.161	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	126.4	172	-79.3	0	0	0	0	110.9	E161 V162 H163	S96-E161 WeakPolarHBondContact CB-OE1 3.29Å; S96-E161 PolarHBondContact OG-OE1 3.31Å; S96-V162 WeakPolarHBondContact CA-O 3.36Å; S96-H163 PolarHBondContact OG-CE1 3.02Å; S96-H163 PolarHBondContact OG-ND1 3.48Å
97	I	78.8	Confident	84.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	119	170.2	-55.6	-172.6	0	0	0	108.4	I63 V87 V162 V164 F172	I63-I97 HydrophobicContact CD1-CG1 4.3Å; I63-I97 HydrophobicContact CG2-CD1 4.01Å; I63-I97 HydrophobicContact CG2-CG1 4.25Å; V87-I97 HydrophobicContact CB-CD1 4.09Å; V87-I97 HydrophobicContact CB-CG2 4.01Å; V87-I97 HydrophobicContact CG1-CD1 3.77Å; V87-I97 HydrophobicContact CG1-CG2 3.91Å; V87-I97 HydrophobicContact CG2-CG2 4.04Å; I97-V162 PolarHBondContact N-O 2.79Å; I97-V162 PolarHBondContact O-N 2.87Å; I97-V164 HydrophobicContact CB-CG2 4Å; I97-V164 HydrophobicContact CD1-CB 3.9Å; I97-V164 HydrophobicContact CD1-CG1 4.12Å; I97-V164 HydrophobicContact CD1-CG2 3.63Å; I97-V164 HydrophobicContact CG1-CB 4.16Å; I97-V164 HydrophobicContact CG1-CG2 3.7Å; I97-F172 HydrophobicContact CG2-CE2 4.01Å; I97-F172 HydrophobicContact CG2-CZ 4.37Å
98	G	77.6	Confident	84.3	Confident	9 Å²	9	35.6 Å²	35.6	9%	0.093	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	145.8	171.7	0	0	0	0	0	111.8	A57 T160	A57-G98 CarbonylContact O-C 3.5Å; A57-G98 WeakPolarHBondContact O-CA 3.38Å; A57-G98 PolarHBondContact O-N 2.91Å; G98-T160 CarbonylContact C-O 3.34Å; G98-T160 VanDerWaalsContact CA-O 3.31Å; G98-T160 WeakPolarHBondContact CA-O 3.4Å
99	F	83.9	Confident	84.4	Confident	6 Å²	6	33.3 Å²	33.3	3%	0.026	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	116.1	164.2	175.4	-98.5	0	0	0	107.8	V83 V101 F112 F158 T159 T160 F172 L174	V83-F99 HydrophobicContact CG1-CE2 4.3Å; V83-F99 HydrophobicContact CG1-CZ 4.1Å; F99-V101 HydrophobicContact CD1-CG2 4.23Å; F99-V101 HydrophobicContact CE1-CG2 3.54Å; F99-V101 HydrophobicContact CE2-CG2 3.89Å; F99-V101 HydrophobicContact CZ-CG2 3.36Å; F99-F112 HydrophobicContact CD1-CE2 4.1Å; F99-F112 HydrophobicContact CE1-CE2 4.03Å; F99-F158 HydrophobicContact CD1-CD1 4.11Å; F99-F158 HydrophobicContact CD1-CE1 4.08Å; F99-F158 HydrophobicContact CE1-CD1 4.14Å; F99-F158 HydrophobicContact CE1-CE1 4.18Å; F99-T159 WeakPolarHBondContact O-CA 3.47Å; F99-T160 HydrophobicContact CB-CG2 3.82Å; F99-T160 HydrophobicContact CD1-CG2 4.2Å; F99-T160 PolarHBondContact N-O 2.9Å; F99-T160 PolarHBondContact O-N 3.3Å; F99-F172 HydrophobicContact CB-CB 4.3Å; F99-F172 HydrophobicContact CB-CD1 3.77Å; F99-F172 HydrophobicContact CB-CD2 3.78Å; F99-F172 HydrophobicContact CB-CE1 3.88Å; F99-F172 HydrophobicContact CB-CE2 3.89Å; F99-F172 HydrophobicContact CB-CG 3.7Å; F99-F172 HydrophobicContact CB-CZ 3.93Å; F99-F172 HydrophobicContact CD1-CB 4.18Å; F99-F172 HydrophobicContact CD1-CD1 4.49Å; F99-F172 HydrophobicContact CD1-CG 4.4Å; F99-F172 HydrophobicContact CD2-CB 3.47Å; F99-F172 VanDerWaalsContact CD2-CB 3.47Å; F99-F172 AromaticContact CD2-CD2 3.86Å; F99-F172 HydrophobicContact CD2-CD2 3.86Å; F99-F172 AromaticContact CD2-CG 3.74Å; F99-F172 HydrophobicContact CD2-CG 3.74Å; F99-F172 HydrophobicContact CE1-CB 4.33Å; F99-F172 HydrophobicContact CE2-CB 3.65Å; F99-F172 HydrophobicContact CE2-CG 4.42Å; F99-F172 HydrophobicContact CG-CB 3.74Å; F99-F172 HydrophobicContact CG-CD1 4.05Å; F99-F172 HydrophobicContact CG-CD2 4.06Å; F99-F172 AromaticContact CG-CG 3.7Å; F99-F172 HydrophobicContact CG-CG 3.7Å; F99-F172 HydrophobicContact CZ-CB 4.07Å; F99-L174 HydrophobicContact CE1-CB 3.93Å; F99-L174 HydrophobicContact CE1-CD2 4.38Å; F99-L174 HydrophobicContact CZ-CB 4.07Å
100	N	84.9	Confident	84.5	Confident	18 Å²	18	34 Å²	34	10%	0.096	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.1	-174.4	178.8	5.8	0	0	0	108.6	F55 A57 T157 F158 Q194	F55-N100 HydrophobicContact CE1-CB 4.48Å; A57-N100 HydrophobicContact CB-CB 4.03Å; N100-T157 WeakPolarHBondContact OD1-CG2 3.26Å; N100-F158 WeakPolarHBondContact CA-O 3.22Å; N100-Q194 PolarHBondContact ND2-OE1 2.61Å
101	V	87.6	Confident	84.8	Confident	4 Å²	4	33 Å²	33	2%	0.024	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	122.8	177.1	-178.8	0	0	0	0	109.6	V83 F99 I103 F158 L174	V83-V101 HydrophobicContact CB-CG1 4.5Å; V83-V101 HydrophobicContact CB-CG2 4.39Å; V83-V101 HydrophobicContact CG1-CG1 4.44Å; V83-V101 HydrophobicContact CG1-CG2 3.78Å; V83-V101 HydrophobicContact CG2-CG1 4.09Å; F99-V101 HydrophobicContact CD1-CG2 4.23Å; F99-V101 HydrophobicContact CE1-CG2 3.54Å; F99-V101 HydrophobicContact CE2-CG2 3.89Å; F99-V101 HydrophobicContact CZ-CG2 3.36Å; V101-I103 HydrophobicContact CG1-CG2 3.98Å; V101-F158 PolarHBondContact N-O 2.83Å; V101-F158 PolarHBondContact O-N 3.01Å; V101-L174 HydrophobicContact CB-CD2 4.01Å; V101-L174 HydrophobicContact CG1-CD2 4.1Å; V101-L174 HydrophobicContact CG2-CD2 4.37Å
102	Q	88.9	Confident	85.2	Confident	58 Å²	58	32.8 Å²	32.8	27%	0.271	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.6	168.9	-65.2	174.2	2.7	0	0	109.9	L155 E156 T157 F192	Q102-L155 HydrophobicContact CB-CD1 4.26Å; Q102-E156 WeakPolarHBondContact CA-O 3.12Å; Q102-T157 HydrophobicContact CG-CG2 4.25Å; Q102-F192 HydrophobicContact CB-CB 3.76Å; Q102-F192 HydrophobicContact CB-CD1 4.42Å; Q102-F192 HydrophobicContact CB-CD2 4.48Å; Q102-F192 HydrophobicContact CB-CG 3.96Å
103	I	88.7	Confident	85.6	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.1	177.3	66.1	173.1	0	0	0	110.5	V101 I109 L155 E156 L174 Y176	V101-I103 HydrophobicContact CG1-CG2 3.98Å; I103-I109 HydrophobicContact CD1-CD1 3.88Å; I103-I109 HydrophobicContact CD1-CG1 3.55Å; I103-L155 CarbonylContact O-C 3.59Å; I103-L155 WeakPolarHBondContact O-CA 3.24Å; I103-E156 HydrophobicContact CG1-CB 4.09Å; I103-E156 WeakPolarHBondContact CG1-O 3.48Å; I103-E156 PolarHBondContact N-O 3.31Å; I103-E156 PolarHBondContact O-N 3.24Å; I103-L174 HydrophobicContact CG2-CD2 4.38Å; I103-Y176 HydrophobicContact CB-CE1 4.45Å; I103-Y176 HydrophobicContact CB-CE2 4.45Å; I103-Y176 HydrophobicContact CG2-CD1 3.65Å; I103-Y176 HydrophobicContact CG2-CD2 4.45Å; I103-Y176 HydrophobicContact CG2-CE1 3.49Å; I103-Y176 VanDerWaalsContact CG2-CE1 3.49Å; I103-Y176 HydrophobicContact CG2-CE2 4.32Å; I103-Y176 HydrophobicContact CG2-CG 4.12Å
104	P	87.8	Confident	85.8	Confident	13 Å²	13	21.4 Å²	21.4	8%	0.084	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	135	175.4	-22.6	34.5	0	0	0	112.1	R106 A107	P104-R106 HydrophobicContact CB-CG 4.07Å; P104-R106 PolarHBondContact O-N 2.99Å; P104-A107 VanDerWaalsContact O-CB 3.27Å; P104-A107 WeakPolarHBondContact O-CB 3.31Å; P104-A107 PolarHBondContact O-N 3.5Å
105	K	82.1	Confident	86.4	Confident	87 Å²	87	21.3 Å²	21.3	38%	0.378	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.2	175.7	-85.3	177.6	178.4	177.3	0	114.7	Q153 D154 L155 E156	K105-Q153 VanDerWaalsContact CE-O 3.25Å; K105-Q153 WeakPolarHBondContact CE-O 3.4Å; K105-Q153 PolarHBondContact NZ-O 3.18Å; K105-D154 VanDerWaalsContact CB-O 3.29Å; K105-D154 WeakPolarHBondContact CB-O 3.34Å; K105-D154 WeakPolarHBondContact CG-O 3.43Å; K105-D154 PolarHBondContact N-O 2.86Å; K105-L155 VanDerWaalsContact CE-O 3.25Å; K105-L155 WeakPolarHBondContact CE-O 3.32Å; K105-E156 HydrophobicContact CB-CG 4.48Å; K105-E156 HydrophobicContact CG-CG 3.6Å
106	R	84.3	Confident	86.6	Confident	53 Å²	53	21.9 Å²	21.9	20%	0.2	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.9	175.5	69.4	180	-179.3	-163	-1.4	112.4	P104 E178 Q188 Y579 K583	P104-R106 HydrophobicContact CB-CG 4.07Å; P104-R106 PolarHBondContact O-N 2.99Å; R106-E178 HydrophobicContact CG-CB 4.44Å; R106-E178 IonicContact CZ-OE1 2.7Å; R106-E178 IonicContact CZ-OE2 2.63Å; R106-E178 IonicContact NE-OE2 3.98Å; R106-E178 PolarHBondContact NE-OE2 2.94Å; R106-E178 VanDerWaalsContact NH2-CD 3.31Å; R106-E178 IonicContact NH2-OE1 3.77Å; R106-E178 PolarHBondContact NH2-OE1 2.82Å; R106-E178 IonicContact NH2-OE2 3.94Å; R106-E178 PolarHBondContact NH2-OE2 2.91Å; R106-E178 VanDerWaalsContact NH2-OE2 3.09Å; R106-Q188 PolarHBondContact NH2-O 3.38Å; R106-Y579 VanDerWaalsContact O-CE2 3.22Å; R106-Y579 WeakPolarHBondContact O-CE2 3.44Å; R106-Y579 PolarHBondContact O-OH 3.28Å; R106-K583 WeakPolarHBondContact O-CE 3.3Å; R106-K583 PolarHBondContact O-NZ 3.21Å
107	A	90.9	Very high	86.7	Confident	4 Å²	4	26.1 Å²	26.1	3%	0.033	14%	0.135	C	C	.	.			trans	-69	160.8	-179	0	0	0	0	0	112.6	P104 Y176 Q177 E178	P104-A107 VanDerWaalsContact O-CB 3.27Å; P104-A107 WeakPolarHBondContact O-CB 3.31Å; P104-A107 PolarHBondContact O-N 3.5Å; A107-Y176 HydrophobicContact CB-CD2 3.95Å; A107-Q177 CarbonylContact C-O 3.59Å; A107-Q177 VanDerWaalsContact CA-O 3.26Å; A107-Q177 WeakPolarHBondContact CA-O 3.47Å; A107-E178 HydrophobicContact CB-CB 4.02Å
108	F	91.7	Very high	86.6	Confident	10 Å²	10	28.8 Å²	28.8	4%	0.044	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.6	164.3	-65.6	-40.4	0	0	0	109.4	S110 Y176 Q177 Y579 I582 K583 F614 V615 T616	F108-S110 PolarHBondContact O-N 3.11Å; F108-Y176 CarbonylContact O-C 3.59Å; F108-Y176 WeakPolarHBondContact O-CA 3.49Å; F108-Q177 PolarHBondContact N-O 3.4Å; F108-Q177 PolarHBondContact O-N 3.29Å; F108-Y579 AromaticContact CD2-CD2 3.59Å; F108-Y579 HydrophobicContact CD2-CD2 3.59Å; F108-Y579 HydrophobicContact CD2-CE2 4.03Å; F108-Y579 AromaticContact CE2-CD2 3.69Å; F108-Y579 HydrophobicContact CE2-CD2 3.69Å; F108-Y579 HydrophobicContact CE2-CE2 4.07Å; F108-Y579 HydrophobicContact CE2-CG 4.43Å; F108-Y579 HydrophobicContact CG-CD2 4.5Å; F108-I582 HydrophobicContact CE2-CB 4.4Å; F108-I582 HydrophobicContact CE2-CG2 3.86Å; F108-I582 HydrophobicContact CZ-CG2 3.75Å; F108-K583 HydrophobicContact CE2-CD 4.49Å; F108-K583 HydrophobicContact CZ-CD 3.83Å; F108-K583 VanDerWaalsContact CZ-CE 3.45Å; F108-K583 HydrophobicContact CZ-CG 4.35Å; F108-F614 HydrophobicContact CB-CB 4.05Å; F108-F614 HydrophobicContact CB-CD1 3.47Å; F108-F614 VanDerWaalsContact CB-CD1 3.47Å; F108-F614 HydrophobicContact CB-CE1 4.18Å; F108-F614 HydrophobicContact CB-CG 3.99Å; F108-F614 HydrophobicContact CD2-CB 3.95Å; F108-F614 AromaticContact CD2-CD1 3.84Å; F108-F614 HydrophobicContact CD2-CD1 3.84Å; F108-F614 HydrophobicContact CD2-CD2 4.08Å; F108-F614 HydrophobicContact CD2-CE1 4.32Å; F108-F614 AromaticContact CD2-CG 3.71Å; F108-F614 HydrophobicContact CD2-CG 3.71Å; F108-F614 HydrophobicContact CG-CB 4.14Å; F108-F614 HydrophobicContact CG-CD1 4.11Å; F108-F614 HydrophobicContact CG-CG 4.2Å; F108-V615 WeakPolarHBondContact CD1-O 3.4Å; F108-T616 HydrophobicContact CE1-CG2 4.28Å; F108-T616 HydrophobicContact CZ-CG2 4.33Å
109	I	91.6	Very high	86.7	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	132.8	167.6	-60	167.6	0	0	0	107.6	I103 F158 L174 V615 L621	I103-I109 HydrophobicContact CD1-CD1 3.88Å; I103-I109 HydrophobicContact CD1-CG1 3.55Å; I109-F158 HydrophobicContact CD1-CD2 3.74Å; I109-F158 HydrophobicContact CD1-CE2 4.26Å; I109-L174 HydrophobicContact CG2-CD1 3.82Å; I109-V615 HydrophobicContact CB-CB 4.12Å; I109-V615 HydrophobicContact CB-CG2 3.97Å; I109-V615 HydrophobicContact CG2-CG2 4.23Å; I109-V615 WeakPolarHBondContact O-CG2 3.1Å; I109-V615 PolarHBondContact O-N 2.77Å; I109-L621 HydrophobicContact CG2-CD2 4.01Å
110	S	90.4	Very high	86.8	Confident	16 Å²	16	34.6 Å²	34.6	11%	0.112	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-34.7	-178.7	57.5	0	0	0	0	113.1	F108 H175 S613	F108-S110 PolarHBondContact O-N 3.11Å; S110-H175 PolarHBondContact N-O 2.96Å; S110-H175 WeakPolarHBondContact OG-CB 3.39Å; S110-H175 PolarHBondContact OG-O 3.12Å; S110-S613 WeakPolarHBondContact CA-O 3.15Å
111	N	92.2	Very high	86.8	Confident	52 Å²	52	34.4 Å²	34.4	28%	0.278	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	156.6	177.8	-164.7	2.8	0	0	0	110.8	G123 H175	N111-G123 PolarHBondContact OD1-O 3.15Å; N111-H175 HydrophobicContact CB-CB 4.12Å; N111-H175 PolarHBondContact N-O 2.92Å; N111-H175 PolarHBondContact O-N 2.84Å
112	F	92.1	Very high	86.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	128.4	166	173.6	-103.2	0	0	0	108.8	F99 M114 G123 I147 F158 T160 F172 E173 L174 L621 V623	F99-F112 HydrophobicContact CD1-CE2 4.1Å; F99-F112 HydrophobicContact CE1-CE2 4.03Å; F112-M114 HydrophobicContact CE1-CB 3.88Å; F112-M114 HydrophobicContact CZ-CB 4.02Å; F112-G123 VanDerWaalsContact O-CA 3.3Å; F112-G123 WeakPolarHBondContact O-CA 3.1Å; F112-G123 PolarHBondContact O-N 3.5Å; F112-I147 HydrophobicContact CD1-CD1 4.48Å; F112-I147 HydrophobicContact CE1-CD1 4.3Å; F112-F158 HydrophobicContact CB-CZ 4.33Å; F112-F158 HydrophobicContact CD1-CZ 4.19Å; F112-F158 AromaticContact CD2-CE1 3.74Å; F112-F158 HydrophobicContact CD2-CE1 3.74Å; F112-F158 AromaticContact CD2-CZ 3.63Å; F112-F158 HydrophobicContact CD2-CZ 3.63Å; F112-F158 HydrophobicContact CE1-CZ 4.4Å; F112-F158 AromaticContact CE2-CE1 3.62Å; F112-F158 HydrophobicContact CE2-CE1 3.62Å; F112-F158 AromaticContact CE2-CZ 3.89Å; F112-F158 HydrophobicContact CE2-CZ 3.89Å; F112-F158 HydrophobicContact CG-CE1 4.35Å; F112-F158 AromaticContact CG-CZ 3.78Å; F112-F158 HydrophobicContact CG-CZ 3.78Å; F112-F158 HydrophobicContact CZ-CE1 4.13Å; F112-F158 HydrophobicContact CZ-CZ 4.26Å; F112-T160 HydrophobicContact CZ-CG2 3.95Å; F112-F172 HydrophobicContact CE2-CD1 4.43Å; F112-F172 HydrophobicContact CZ-CD1 4.02Å; F112-E173 CarbonylContact C-O 3.58Å; F112-E173 VanDerWaalsContact CA-O 3.32Å; F112-E173 WeakPolarHBondContact CA-O 3.21Å; F112-E173 WeakPolarHBondContact CD2-O 3.31Å; F112-L174 HydrophobicContact CB-CD1 4.17Å; F112-L174 HydrophobicContact CD2-CB 4.12Å; F112-L174 HydrophobicContact CD2-CD1 4.03Å; F112-L621 HydrophobicContact CB-CD2 3.57Å; F112-V623 HydrophobicContact CD1-CG1 4.34Å; F112-V623 HydrophobicContact CD1-CG2 3.84Å; F112-V623 HydrophobicContact CE1-CG2 4.47Å
113	T	91.4	Very high	86.7	Confident	27 Å²	27	35.2 Å²	35.2	17%	0.166	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.5	174.3	39.6	0	0	0	0	110.1	F121 V122 E173	T113-F121 WeakPolarHBondContact CA-O 3.43Å; T113-V122 HydrophobicContact CG2-CG1 4.26Å; T113-V122 HydrophobicContact CG2-CG2 4.37Å; T113-E173 PolarHBondContact N-O 2.87Å; T113-E173 PolarHBondContact O-N 2.83Å; T113-E173 WeakPolarHBondContact OG1-CB 3.23Å
114	M	87.9	Confident	86.7	Confident	6 Å²	6	37 Å²	37	3%	0.03	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	126.1	179	179.8	-173.9	77	0	0	108.3	F112 V116 F121 V162 V170 A171 F172 L632	F112-M114 HydrophobicContact CE1-CB 3.88Å; F112-M114 HydrophobicContact CZ-CB 4.02Å; M114-V116 HydrophobicContact CE-CG2 3.84Å; M114-V116 HydrophobicContact CG-CG2 4.05Å; M114-V116 HydrophobicContact SD-CG2 4.17Å; M114-F121 HydrophobicContact CB-CB 4.31Å; M114-F121 HydrophobicContact CE-CB 3.99Å; M114-F121 HydrophobicContact CE-CD1 4.16Å; M114-F121 HydrophobicContact CE-CD2 3.51Å; M114-F121 HydrophobicContact CE-CE2 3.94Å; M114-F121 HydrophobicContact CE-CG 3.64Å; M114-F121 HydrophobicContact CE-CZ 4.42Å; M114-F121 PolarHBondContact N-O 2.8Å; M114-F121 WeakPolarHBondContact O-CB 3.28Å; M114-F121 PolarHBondContact O-N 3.38Å; M114-V162 HydrophobicContact CE-CG2 4.47Å; M114-V162 HydrophobicContact SD-CG2 3.52Å; M114-V162 VanDerWaalsContact SD-CG2 3.52Å; M114-V170 HydrophobicContact CG-CG1 4.22Å; M114-A171 CarbonylContact C-O 3.54Å; M114-A171 VanDerWaalsContact CA-O 3.29Å; M114-A171 WeakPolarHBondContact CA-O 3.38Å; M114-F172 HydrophobicContact CB-CD1 4.45Å; M114-F172 HydrophobicContact CG-CD1 3.87Å; M114-F172 HydrophobicContact CG-CE1 3.94Å; M114-F172 HydrophobicContact SD-CD1 4.24Å; M114-F172 HydrophobicContact SD-CE1 3.82Å; M114-L632 HydrophobicContact CE-CD1 3.84Å; M114-L632 HydrophobicContact SD-CD1 4.32Å
115	N	88.4	Confident	86.8	Confident	50 Å²	50	37.3 Å²	37.3	27%	0.267	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.9	171.6	-171.2	-76.1	0	0	0	109.2	G118 I119 T120 V170 A171	N115-G118 VanDerWaalsContact ND2-C 3.32Å; N115-G118 PolarHBondContact ND2-O 2.59Å; N115-G118 VanDerWaalsContact OD1-CA 3.24Å; N115-G118 WeakPolarHBondContact OD1-CA 3.14Å; N115-G118 PolarHBondContact OD1-N 2.88Å; N115-I119 CarbonylContact C-O 3.54Å; N115-I119 WeakPolarHBondContact CA-O 3.33Å; N115-T120 PolarHBondContact ND2-OG1 3.21Å; N115-V170 CarbonylContact O-C 3.55Å; N115-V170 VanDerWaalsContact O-CA 3.28Å; N115-V170 WeakPolarHBondContact O-CA 3.39Å; N115-V170 WeakPolarHBondContact O-CG1 3.41Å; N115-A171 PolarHBondContact N-O 2.88Å; N115-A171 PolarHBondContact O-N 2.96Å
116	V	82.6	Confident	87.2	Confident	22 Å²	22	35.5 Å²	35.5	13%	0.133	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	109.9	179.6	-179.8	0	0	0	0	107.8	M114 G118 I119 F121 V162 V170	M114-V116 HydrophobicContact CE-CG2 3.84Å; M114-V116 HydrophobicContact CG-CG2 4.05Å; M114-V116 HydrophobicContact SD-CG2 4.17Å; V116-G118 PolarHBondContact O-N 3.37Å; V116-G118 VanDerWaalsContact O-N 3.12Å; V116-I119 PolarHBondContact N-O 3.06Å; V116-I119 PolarHBondContact O-N 3.29Å; V116-F121 HydrophobicContact CB-CE2 4.3Å; V116-F121 HydrophobicContact CG2-CD2 4.5Å; V116-F121 HydrophobicContact CG2-CE2 4.22Å; V116-V162 HydrophobicContact CG2-CG1 4.07Å; V116-V170 HydrophobicContact CB-CG2 4.38Å; V116-V170 HydrophobicContact CG1-CG2 4.12Å; V116-V170 HydrophobicContact CG2-CG1 4.1Å; V116-V170 HydrophobicContact CG2-CG2 4.04Å
117	N	77.1	Confident	87.5	Confident	111 Å²	111	37.6 Å²	37.6	59%	0.594	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	39.2	179.3	-164.3	42	0	0	0	114.3	S169	N117-S169 PolarHBondContact N-O 2.85Å
118	G	76.6	Confident	87.2	Confident	56 Å²	56	38.9 Å²	38.9	58%	0.577	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.1	-24.6	-178.5	0	0	0	0	0	114.9	N115 V116 T120	N115-G118 VanDerWaalsContact ND2-C 3.32Å; N115-G118 PolarHBondContact ND2-O 2.59Å; N115-G118 VanDerWaalsContact OD1-CA 3.24Å; N115-G118 WeakPolarHBondContact OD1-CA 3.14Å; N115-G118 PolarHBondContact OD1-N 2.88Å; V116-G118 PolarHBondContact O-N 3.37Å; V116-G118 VanDerWaalsContact O-N 3.12Å; G118-T120 PolarHBondContact O-N 2.89Å
119	I	80.6	Confident	87	Confident	100 Å²	100	41.5 Å²	41.5	51%	0.513	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	118.4	178	-56.6	176.4	0	0	0	109.4	N115 V116 F121	N115-I119 CarbonylContact C-O 3.54Å; N115-I119 WeakPolarHBondContact CA-O 3.33Å; V116-I119 PolarHBondContact N-O 3.06Å; V116-I119 PolarHBondContact O-N 3.29Å; I119-F121 HydrophobicContact CB-CE2 4.19Å; I119-F121 HydrophobicContact CG2-CD2 4.23Å; I119-F121 HydrophobicContact CG2-CE2 3.67Å; I119-F121 HydrophobicContact CG2-CZ 4.1Å
120	T	85.9	Confident	86.8	Confident	38 Å²	38	45.1 Å²	45.1	23%	0.233	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	137.4	175.6	-35.7	0	0	0	0	111.5	N115 G118 V122 E626	N115-T120 PolarHBondContact ND2-OG1 3.21Å; G118-T120 PolarHBondContact O-N 2.89Å; T120-V122 HydrophobicContact CG2-CG2 4.06Å; T120-E626 WeakPolarHBondContact CB-OE1 3.37Å; T120-E626 PolarHBondContact O-N 2.85Å; T120-E626 PolarHBondContact OG1-OE1 2.93Å
121	F	84.4	Confident	86.5	Confident	14 Å²	14	44.3 Å²	44.3	6%	0.061	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	128	170.7	-64.8	-102.2	0	0	0	108.2	T113 M114 V116 I119 V623 E624 E630	T113-F121 WeakPolarHBondContact CA-O 3.43Å; M114-F121 HydrophobicContact CB-CB 4.31Å; M114-F121 HydrophobicContact CE-CB 3.99Å; M114-F121 HydrophobicContact CE-CD1 4.16Å; M114-F121 HydrophobicContact CE-CD2 3.51Å; M114-F121 HydrophobicContact CE-CE2 3.94Å; M114-F121 HydrophobicContact CE-CG 3.64Å; M114-F121 HydrophobicContact CE-CZ 4.42Å; M114-F121 PolarHBondContact N-O 2.8Å; M114-F121 WeakPolarHBondContact O-CB 3.28Å; M114-F121 PolarHBondContact O-N 3.38Å; V116-F121 HydrophobicContact CB-CE2 4.3Å; V116-F121 HydrophobicContact CG2-CD2 4.5Å; V116-F121 HydrophobicContact CG2-CE2 4.22Å; I119-F121 HydrophobicContact CB-CE2 4.19Å; I119-F121 HydrophobicContact CG2-CD2 4.23Å; I119-F121 HydrophobicContact CG2-CE2 3.67Å; I119-F121 HydrophobicContact CG2-CZ 4.1Å; F121-V623 HydrophobicContact CB-CG1 3.8Å; F121-E624 CarbonylContact C-O 3.57Å; F121-E624 WeakPolarHBondContact CA-O 3.41Å; F121-E630 HydrophobicContact CE1-CB 4.03Å
122	V	88.3	Confident	86	Confident	68 Å²	68	46 Å²	46	41%	0.412	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.1	-172.7	-175.4	0	0	0	0	110.8	T113 T120 V623 E624	T113-V122 HydrophobicContact CG2-CG1 4.26Å; T113-V122 HydrophobicContact CG2-CG2 4.37Å; T120-V122 HydrophobicContact CG2-CG2 4.06Å; V122-V623 WeakPolarHBondContact O-CA 3.41Å; V122-E624 PolarHBondContact N-O 3.03Å; V122-E624 PolarHBondContact O-N 3.36Å; V122-E624 VanDerWaalsContact O-N 3.11Å
123	G	86.4	Confident	85.7	Confident	10 Å²	10	55 Å²	55	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	128.6	174.4	0	0	0	0	0	112	N111 F112	N111-G123 PolarHBondContact OD1-O 3.15Å; F112-G123 VanDerWaalsContact O-CA 3.3Å; F112-G123 WeakPolarHBondContact O-CA 3.1Å; F112-G123 PolarHBondContact O-N 3.5Å
124	S	88.6	Confident	85.2	Confident	39 Å²	39	55.2 Å²	55.2	27%	0.273	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129	174.6	57.5	0	0	0	0	110	K126 L622	S124-K126 PolarHBondContact O-N 3.03Å; S124-K126 WeakPolarHBondContact OG-CE 3.36Å; S124-L622 PolarHBondContact N-O 3.21Å; S124-L622 PolarHBondContact O-N 3.08Å; S124-L622 PolarHBondContact OG-O 2.81Å
125	V	89.9	Confident	84.7	Confident	20 Å²	20	57.6 Å²	57.6	12%	0.121	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.7	179.9	-179.5	0	0	0	0	109.2	L610 S613 F614 V615 T619 L621	V125-L610 HydrophobicContact CG1-CD2 4.31Å; V125-L610 VanDerWaalsContact O-CD2 3.27Å; V125-L610 WeakPolarHBondContact O-CD2 3.46Å; V125-S613 WeakPolarHBondContact CG2-O 3.22Å; V125-F614 WeakPolarHBondContact CG1-O 3.07Å; V125-V615 HydrophobicContact CG2-CG2 3.8Å; V125-T619 HydrophobicContact CG1-CG2 4.03Å; V125-L621 HydrophobicContact CG2-CD1 3.68Å
126	K	89.8	Confident	84.2	Confident	49 Å²	49	57.9 Å²	57.9	21%	0.213	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	163.1	179.4	-57.7	-169.5	-170.4	-172.6	0	110.1	S124 K128 A131 L134 T619 A620 L622 E624	S124-K126 PolarHBondContact O-N 3.03Å; S124-K126 WeakPolarHBondContact OG-CE 3.36Å; K126-K128 PolarHBondContact O-N 3.03Å; K126-A131 HydrophobicContact CB-CB 4.24Å; K126-L134 HydrophobicContact CD-CD1 4.17Å; K126-T619 CarbonylContact O-C 3.6Å; K126-T619 WeakPolarHBondContact O-CA 3.41Å; K126-T619 WeakPolarHBondContact O-CB 3.35Å; K126-A620 PolarHBondContact N-O 2.87Å; K126-A620 PolarHBondContact O-N 3.04Å; K126-L622 HydrophobicContact CD-CB 4.21Å; K126-L622 HydrophobicContact CD-CD2 3.92Å; K126-L622 HydrophobicContact CG-CB 4.48Å; K126-E624 IonicContact NZ-OE2 3.98Å; K126-E624 PolarHBondContact NZ-OE2 3.23Å
127	E	90.8	Very high	84	Confident	96 Å²	96	61 Å²	61	45%	0.449	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	133.2	171.7	-176.6	-173.4	-173.3	0	0	109.5	A129 L130 A131 T606	E127-A129 HydrophobicContact CG-CB 4.46Å; E127-A129 PolarHBondContact O-N 2.86Å; E127-A129 VanDerWaalsContact O-N 3.11Å; E127-L130 HydrophobicContact CB-CB 4.22Å; E127-L130 PolarHBondContact O-N 2.9Å; E127-A131 WeakPolarHBondContact O-CB 3.38Å; E127-A131 PolarHBondContact O-N 2.89Å; E127-T606 HydrophobicContact CB-CG2 4.28Å; E127-T606 HydrophobicContact CG-CG2 4.17Å
128	K	85.8	Confident	83.7	Confident	32 Å²	32	56 Å²	56	14%	0.139	30%	0.304	C	S	.	.	H	α-helix	trans	-56.5	-32.5	-173.9	-177.1	165.1	174.5	132.6	0	113.3	K126 R132 P617 L618 A620 D635 S636	K126-K128 PolarHBondContact O-N 3.03Å; K128-R132 VanDerWaalsContact CE-NH2 3.3Å; K128-R132 WeakPolarHBondContact O-CB 3.39Å; K128-R132 WeakPolarHBondContact O-CD 3.48Å; K128-R132 WeakPolarHBondContact O-CG 3.47Å; K128-R132 PolarHBondContact O-N 3.38Å; K128-P617 WeakPolarHBondContact CD-O 3.34Å; K128-L618 WeakPolarHBondContact CB-O 3.49Å; K128-L618 PolarHBondContact N-O 3.37Å; K128-A620 HydrophobicContact CB-CB 4.4Å; K128-A620 HydrophobicContact CG-CB 4.41Å; K128-D635 VanDerWaalsContact CD-OD1 3.3Å; K128-D635 WeakPolarHBondContact CD-OD1 3.36Å; K128-D635 WeakPolarHBondContact CE-OD1 3.49Å; K128-D635 WeakPolarHBondContact CE-OD2 3.44Å; K128-D635 IonicContact NZ-OD1 3.44Å; K128-D635 PolarHBondContact NZ-OD1 2.78Å; K128-D635 IonicContact NZ-OD2 2.77Å; K128-S636 PolarHBondContact NZ-O 3.3Å; K128-S636 PolarHBondContact NZ-OG 2.93Å
129	A	86.1	Confident	83.4	Confident	64 Å²	64	55.9 Å²	55.9	53%	0.529	29%	0.294	S	S	.	.	H	α-helix	trans	-69.3	-45.2	173.6	0	0	0	0	0	112.8	E127 R133	E127-A129 HydrophobicContact CG-CB 4.46Å; E127-A129 PolarHBondContact O-N 2.86Å; E127-A129 VanDerWaalsContact O-N 3.11Å; A129-R133 PolarHBondContact O-N 3.18Å; A129-R133 VanDerWaalsContact O-N 3.09Å
130	L	88.2	Confident	82.8	Confident	77 Å²	77	55.7 Å²	55.7	40%	0.403	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-45.5	177.6	178.4	60.4	0	0	0	111.6	E127 R132 R133 L134	E127-L130 HydrophobicContact CB-CB 4.22Å; E127-L130 PolarHBondContact O-N 2.9Å; L130-R132 PolarHBondContact O-N 2.9Å; L130-R133 WeakPolarHBondContact O-CB 2.97Å; L130-R133 PolarHBondContact O-N 2.95Å; L130-R133 VanDerWaalsContact O-N 3.14Å; L130-L134 HydrophobicContact CD1-CD1 3.98Å; L130-L134 HydrophobicContact CD1-CG 4.07Å; L130-L134 HydrophobicContact CG-CD1 3.9Å; L130-L134 HydrophobicContact CG-CG 4.4Å; L130-L134 WeakPolarHBondContact O-CG 3.48Å; L130-L134 PolarHBondContact O-N 3.06Å
131	A	83.7	Confident	82.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.7	-47.8	178.3	0	0	0	0	0	111.5	K126 E127 R133 L134 Y135 A620 L622 L633	K126-A131 HydrophobicContact CB-CB 4.24Å; E127-A131 WeakPolarHBondContact O-CB 3.38Å; E127-A131 PolarHBondContact O-N 2.89Å; A131-R133 VanDerWaalsContact C-N 3.34Å; A131-R133 PolarHBondContact O-N 3.35Å; A131-L134 PolarHBondContact O-N 3.39Å; A131-Y135 WeakPolarHBondContact O-CB 3.23Å; A131-Y135 PolarHBondContact O-N 3.14Å; A131-A620 HydrophobicContact CB-CB 3.93Å; A131-L622 HydrophobicContact CB-CB 4.42Å; A131-L633 HydrophobicContact CB-CD1 3.65Å
132	R	82.3	Confident	81.1	Confident	88 Å²	88	69 Å²	69	33%	0.332	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-39.1	173.9	-74.6	171.3	174	-168.9	-3.8	112.8	K128 L130 A136 L633 D635	K128-R132 VanDerWaalsContact CE-NH2 3.3Å; K128-R132 WeakPolarHBondContact O-CB 3.39Å; K128-R132 WeakPolarHBondContact O-CD 3.48Å; K128-R132 WeakPolarHBondContact O-CG 3.47Å; K128-R132 PolarHBondContact O-N 3.38Å; L130-R132 PolarHBondContact O-N 2.9Å; R132-A136 WeakPolarHBondContact O-CB 3.39Å; R132-A136 PolarHBondContact O-N 3.21Å; R132-L633 HydrophobicContact CG-CD2 4Å; R132-D635 IonicContact CZ-OD2 3.42Å; R132-D635 IonicContact NE-OD2 2.73Å; R132-D635 PolarHBondContact NE-OD2 3.43Å; R132-D635 IonicContact NH2-OD2 2.8Å; R132-D635 PolarHBondContact NH2-OD2 3.44Å
133	R	84.6	Confident	79.9	Confident	188 Å²	188	70.1 Å²	70.1	71%	0.709	36%	0.358	S	S	*	.	H	α-helix	trans	-66.8	-45.3	176.5	-177.2	-179.8	177.2	-175.5	-0.6	112.2	A129 L130 A131 Y135 A136 Q137	A129-R133 PolarHBondContact O-N 3.18Å; A129-R133 VanDerWaalsContact O-N 3.09Å; L130-R133 WeakPolarHBondContact O-CB 2.97Å; L130-R133 PolarHBondContact O-N 2.95Å; L130-R133 VanDerWaalsContact O-N 3.14Å; A131-R133 VanDerWaalsContact C-N 3.34Å; A131-R133 PolarHBondContact O-N 3.35Å; R133-Y135 VanDerWaalsContact C-N 3.34Å; R133-A136 PolarHBondContact O-N 2.87Å; R133-Q137 WeakPolarHBondContact O-CB 3.38Å; R133-Q137 PolarHBondContact O-N 2.97Å
134	L	81.3	Confident	78.5	Confident	32 Å²	32	71.2 Å²	71.2	17%	0.168	37%	0.366	C	S	.	.	H	α-helix	trans	-66.5	-36.1	179.1	-70	171.7	0	0	0	112.1	K126 L130 A131 A138 L622 R631	K126-L134 HydrophobicContact CD-CD1 4.17Å; L130-L134 HydrophobicContact CD1-CD1 3.98Å; L130-L134 HydrophobicContact CD1-CG 4.07Å; L130-L134 HydrophobicContact CG-CD1 3.9Å; L130-L134 HydrophobicContact CG-CG 4.4Å; L130-L134 WeakPolarHBondContact O-CG 3.48Å; L130-L134 PolarHBondContact O-N 3.06Å; A131-L134 PolarHBondContact O-N 3.39Å; L134-A138 PolarHBondContact O-N 3.39Å; L134-L622 HydrophobicContact CB-CD2 3.78Å; L134-L622 HydrophobicContact CD1-CD2 3.64Å; L134-L622 HydrophobicContact CG-CD2 4.37Å; L134-R631 WeakPolarHBondContact O-CD 3.23Å; L134-R631 PolarHBondContact O-NH1 3.37Å; L134-R631 VanDerWaalsContact O-NH1 3.16Å
135	Y	77	Confident	76.9	Confident	55 Å²	55	71.5 Å²	71.5	22%	0.216	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-50.4	171.3	178.9	-98.8	0	0	0	112	A131 R133 Q137 A138 S139 A144 A145 G146 L633	A131-Y135 WeakPolarHBondContact O-CB 3.23Å; A131-Y135 PolarHBondContact O-N 3.14Å; R133-Y135 VanDerWaalsContact C-N 3.34Å; Y135-Q137 PolarHBondContact O-N 3.49Å; Y135-A138 PolarHBondContact O-N 2.99Å; Y135-S139 WeakPolarHBondContact O-CB 3.37Å; Y135-S139 PolarHBondContact O-N 3.17Å; Y135-A144 HydrophobicContact CD2-CB 4.03Å; Y135-A144 HydrophobicContact CE2-CB 3.71Å; Y135-A145 WeakPolarHBondContact CE2-O 3.49Å; Y135-G146 PolarHBondContact OH-N 3.23Å; Y135-L633 HydrophobicContact CD1-CD2 4.12Å; Y135-L633 HydrophobicContact CD2-CB 3.43Å; Y135-L633 VanDerWaalsContact CD2-CB 3.43Å; Y135-L633 HydrophobicContact CD2-CD2 4.43Å; Y135-L633 HydrophobicContact CE2-CB 3.99Å; Y135-L633 HydrophobicContact CG-CB 3.74Å; Y135-L633 HydrophobicContact CG-CD2 3.86Å; Y135-L633 HydrophobicContact CG-CG 4.45Å
136	A	78.1	Confident	75.2	Confident	56 Å²	56	72.4 Å²	72.4	46%	0.463	38%	0.384	S	S	.	.	H	α-helix	trans	-59	-34.6	178.1	0	0	0	0	0	112.8	R132 R133 A138 S140	R132-A136 WeakPolarHBondContact O-CB 3.39Å; R132-A136 PolarHBondContact O-N 3.21Å; R133-A136 PolarHBondContact O-N 2.87Å; A136-A138 VanDerWaalsContact C-N 3.34Å; A136-S140 PolarHBondContact O-N 3.47Å; A136-S140 PolarHBondContact O-OG 2.65Å
137	Q	78.5	Confident	73.7	Confident	87 Å²	87	70.5 Å²	70.5	41%	0.407	38%	0.376	S	S	.	.	H	α-helix	trans	-68.7	-27.6	174.8	-172.3	-174.9	9.1	0	0	113.7	R133 Y135 S140 R141	R133-Q137 WeakPolarHBondContact O-CB 3.38Å; R133-Q137 PolarHBondContact O-N 2.97Å; Y135-Q137 PolarHBondContact O-N 3.49Å; Q137-S140 PolarHBondContact O-OG 2.94Å; Q137-R141 WeakPolarHBondContact O-CD 3.42Å; Q137-R141 WeakPolarHBondContact O-CG 3.46Å
138	A	70.7	Confident	72	Confident	7 Å²	7	69.8 Å²	69.8	6%	0.058	38%	0.378	C	S	.	.	H	α-helix	trans	-87.3	-36.9	175	0	0	0	0	0	111.7	L134 Y135 A136 S140 R141 N142 K143 A144 R631	L134-A138 PolarHBondContact O-N 3.39Å; Y135-A138 PolarHBondContact O-N 2.99Å; A136-A138 VanDerWaalsContact C-N 3.34Å; A138-S140 PolarHBondContact O-N 3.49Å; A138-R141 CarbonylContact O-C 3.53Å; A138-R141 WeakPolarHBondContact O-CA 3.42Å; A138-R141 WeakPolarHBondContact O-CB 3.29Å; A138-R141 PolarHBondContact O-N 2.74Å; A138-N142 PolarHBondContact O-N 3.32Å; A138-K143 PolarHBondContact O-N 3.5Å; A138-A144 HydrophobicContact CB-CB 3.98Å; A138-R631 HydrophobicContact CB-CB 3.9Å; A138-R631 HydrophobicContact CB-CG 3.96Å
139	S	69.8	Low	70.8	Confident	54 Å²	54	69.1 Å²	69.1	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-59.9	-43.4	173.3	176.9	0	0	0	0	111.9	Y135 R141 N142	Y135-S139 WeakPolarHBondContact O-CB 3.37Å; Y135-S139 PolarHBondContact O-N 3.17Å; S139-R141 PolarHBondContact O-N 2.78Å; S139-N142 PolarHBondContact O-N 3.01Å
140	S	69.9	Low	69.3	Low	95 Å²	95	69.3 Å²	69.3	66%	0.664	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-0.6	173.8	64.8	0	0	0	0	115	A136 Q137 A138	A136-S140 PolarHBondContact O-N 3.47Å; A136-S140 PolarHBondContact O-OG 2.65Å; Q137-S140 PolarHBondContact O-OG 2.94Å; A138-S140 PolarHBondContact O-N 3.49Å
141	R	71.1	Confident	67.7	Low	175 Å²	175	69.6 Å²	69.6	66%	0.66	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	9	173	-63.8	175.6	171.5	-170	-6.1	112.5	Q137 A138 S139 K143	Q137-R141 WeakPolarHBondContact O-CD 3.42Å; Q137-R141 WeakPolarHBondContact O-CG 3.46Å; A138-R141 CarbonylContact O-C 3.53Å; A138-R141 WeakPolarHBondContact O-CA 3.42Å; A138-R141 WeakPolarHBondContact O-CB 3.29Å; A138-R141 PolarHBondContact O-N 2.74Å; S139-R141 PolarHBondContact O-N 2.78Å; R141-K143 HydrophobicContact CB-CG 4.44Å; R141-K143 PolarHBondContact O-N 2.94Å
142	N	63.3	Low	66	Low	158 Å²	158	71.6 Å²	71.6	85%	0.845	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	31.7	-171.7	-60.8	-19	0	0	0	114	A138 S139	A138-N142 PolarHBondContact O-N 3.32Å; S139-N142 PolarHBondContact O-N 3.01Å
143	K	61.9	Low	65.1	Low	91 Å²	91	73.4 Å²	73.4	40%	0.396	40%	0.4	S	S	.	.			trans	-116.6	35.2	-179.5	-64.9	-149.5	172.6	-150.8	0	113.3	A138 R141 T629 E630 R631	A138-K143 PolarHBondContact O-N 3.5Å; R141-K143 HydrophobicContact CB-CG 4.44Å; R141-K143 PolarHBondContact O-N 2.94Å; K143-T629 WeakPolarHBondContact CD-O 3.11Å; K143-E630 HydrophobicContact CB-CG 4.25Å; K143-E630 HydrophobicContact CD-CG 4.26Å; K143-E630 WeakPolarHBondContact O-CA 3.35Å; K143-R631 PolarHBondContact O-N 2.87Å
144	A	56.9	Low	63.9	Low	32 Å²	32	69.4 Å²	69.4	26%	0.264	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	142.7	179.6	0	0	0	0	0	113.5	Y135 A138 R631	Y135-A144 HydrophobicContact CD2-CB 4.03Å; Y135-A144 HydrophobicContact CE2-CB 3.71Å; A138-A144 HydrophobicContact CB-CB 3.98Å; A144-R631 WeakPolarHBondContact CA-O 3.45Å; A144-R631 WeakPolarHBondContact CB-O 3.4Å
145	A	56.3	Low	63.4	Low	45 Å²	45	69 Å²	69	37%	0.372	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	150.8	169.9	0	0	0	0	0	110.1	Y135 R631 L632	Y135-A145 WeakPolarHBondContact CE2-O 3.49Å; A145-R631 PolarHBondContact N-O 3.1Å; A145-L632 HydrophobicContact CB-CD2 3.83Å; A145-L632 WeakPolarHBondContact O-CA 3.49Å; A145-L632 WeakPolarHBondContact O-CD2 3.48Å
146	G	53.2	Low	63.3	Low	39 Å²	39	67.7 Å²	67.7	40%	0.402	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	140.3	-173.3	0	0	0	0	0	113.2	Y135	Y135-G146 PolarHBondContact OH-N 3.23Å
147	I	57.4	Low	63.4	Low	9 Å²	9	65.6 Å²	65.6	5%	0.046	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	117.9	161.9	-56.4	174.6	0	0	0	106.5	F112 F158 T159 V623 L632 L633 A634	F112-I147 HydrophobicContact CD1-CD1 4.48Å; F112-I147 HydrophobicContact CE1-CD1 4.3Å; I147-F158 HydrophobicContact CD1-CZ 4.3Å; I147-F158 HydrophobicContact CG2-CD2 4.22Å; I147-F158 HydrophobicContact CG2-CE1 4.16Å; I147-F158 HydrophobicContact CG2-CE2 3.74Å; I147-F158 HydrophobicContact CG2-CZ 3.7Å; I147-T159 CarbonylContact C-O 3.58Å; I147-T159 WeakPolarHBondContact CG2-O 3.49Å; I147-V623 HydrophobicContact CD1-CG2 3.8Å; I147-L632 HydrophobicContact CD1-CB 3.76Å; I147-L632 HydrophobicContact CD1-CD1 4.15Å; I147-L632 HydrophobicContact CG1-CB 3.9Å; I147-L632 HydrophobicContact CG1-CD1 4.41Å; I147-L633 WeakPolarHBondContact CB-O 3.3Å; I147-L633 PolarHBondContact N-O 3.19Å; I147-L633 VanDerWaalsContact N-O 3.15Å; I147-L633 VanDerWaalsContact O-O 3.08Å; I147-A634 HydrophobicContact CB-CB 3.73Å; I147-A634 HydrophobicContact CD1-CB 4.11Å; I147-A634 HydrophobicContact CG1-CB 4.5Å; I147-A634 HydrophobicContact CG2-CB 3.57Å
148	V	56.7	Low	63.5	Low	82 Å²	82	61.5 Å²	61.5	50%	0.497	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	131.3	-177.5	-171.5	0	0	0	0	108.7	T150 T159	V148-T150 HydrophobicContact CG1-CG2 3.81Å; V148-T159 PolarHBondContact N-O 3.48Å; V148-T159 PolarHBondContact O-N 2.9Å
149	R	59.1	Low	63.9	Low	17 Å²	17	62 Å²	62	6%	0.064	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.8	159.5	-77.3	163.8	69.5	-168.7	9.3	108.8	E156 T157 F158 A637	R149-E156 IonicContact CZ-OE2 3.79Å; R149-E156 IonicContact NE-OE2 2.66Å; R149-E156 PolarHBondContact NE-OE2 2.71Å; R149-E156 IonicContact NH2-OE1 3.93Å; R149-E156 IonicContact NH2-OE2 2.64Å; R149-E156 PolarHBondContact NH2-OE2 3.02Å; R149-T157 VanDerWaalsContact CA-O 3.26Å; R149-T157 WeakPolarHBondContact CA-O 3.13Å; R149-F158 HydrophobicContact CG-CD2 4.47Å; R149-A637 WeakPolarHBondContact O-CB 3.47Å
150	T	54.8	Low	64.3	Low	69 Å²	69	59.5 Å²	59.5	42%	0.423	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	150.6	170.3	61.3	0	0	0	0	109.7	V148 E156 T157	V148-T150 HydrophobicContact CG1-CG2 3.81Å; T150-E156 WeakPolarHBondContact O-CA 3.35Å; T150-T157 PolarHBondContact N-O 2.98Å; T150-T157 PolarHBondContact O-N 2.98Å; T150-T157 WeakPolarHBondContact OG1-CB 3.18Å
151	N	55.5	Low	64.5	Low	83 Å²	83	58.9 Å²	58.9	44%	0.444	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125	-178.6	-68.7	-6.9	0	0	0	109.2
152	A	47.9	Very low	64.7	Low	42 Å²	42	51.4 Å²	51.4	35%	0.347	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	118.2	179	0	0	0	0	0	109.9	D154 L155	A152-D154 PolarHBondContact O-N 2.93Å; A152-L155 PolarHBondContact N-O 3.13Å; A152-L155 CarbonylContact O-C 3.55Å; A152-L155 WeakPolarHBondContact O-CA 3.49Å; A152-L155 WeakPolarHBondContact O-CB 3.24Å; A152-L155 PolarHBondContact O-N 3.42Å; A152-L155 VanDerWaalsContact O-O 3.11Å
153	Q	62.8	Low	65.2	Low	125 Å²	125	50.4 Å²	50.4	58%	0.584	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	-120.4	-176.7	-58.6	179.5	1.9	0	0	112.4	K105 L155 Y470	K105-Q153 VanDerWaalsContact CE-O 3.25Å; K105-Q153 WeakPolarHBondContact CE-O 3.4Å; K105-Q153 PolarHBondContact NZ-O 3.18Å; Q153-L155 VanDerWaalsContact C-N 3.32Å; Q153-Y470 VanDerWaalsContact C-OH 3.23Å; Q153-Y470 VanDerWaalsContact CA-OH 3.27Å; Q153-Y470 WeakPolarHBondContact CA-OH 3.26Å; Q153-Y470 HydrophobicContact CB-CE1 4.13Å; Q153-Y470 HydrophobicContact CB-CE2 4.39Å; Q153-Y470 HydrophobicContact CG-CD1 4.41Å; Q153-Y470 HydrophobicContact CG-CE1 3.97Å
154	D	59	Low	65.9	Low	105 Å²	105	46 Å²	46	56%	0.561	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	12.4	177.6	-69	-3.8	0	0	0	113.3	K105 A152 Y470	K105-D154 VanDerWaalsContact CB-O 3.29Å; K105-D154 WeakPolarHBondContact CB-O 3.34Å; K105-D154 WeakPolarHBondContact CG-O 3.43Å; K105-D154 PolarHBondContact N-O 2.86Å; A152-D154 PolarHBondContact O-N 2.93Å; D154-Y470 PolarHBondContact OD1-OH 2.89Å
155	L	71.8	Confident	66.9	Low	24 Å²	24	47.5 Å²	47.5	13%	0.126	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	157.5	-173.3	-48.2	175.3	0	0	0	112.2	Q102 I103 K105 A152 Q153 F192	Q102-L155 HydrophobicContact CB-CD1 4.26Å; I103-L155 CarbonylContact O-C 3.59Å; I103-L155 WeakPolarHBondContact O-CA 3.24Å; K105-L155 VanDerWaalsContact CE-O 3.25Å; K105-L155 WeakPolarHBondContact CE-O 3.32Å; A152-L155 PolarHBondContact N-O 3.13Å; A152-L155 CarbonylContact O-C 3.55Å; A152-L155 WeakPolarHBondContact O-CA 3.49Å; A152-L155 WeakPolarHBondContact O-CB 3.24Å; A152-L155 PolarHBondContact O-N 3.42Å; A152-L155 VanDerWaalsContact O-O 3.11Å; Q153-L155 VanDerWaalsContact C-N 3.32Å; L155-F192 HydrophobicContact CD1-CD1 3.79Å; L155-F192 HydrophobicContact CD1-CD2 4.47Å; L155-F192 HydrophobicContact CD1-CE1 3.36Å; L155-F192 HydrophobicContact CD1-CE2 4.14Å; L155-F192 HydrophobicContact CD1-CG 4.34Å; L155-F192 HydrophobicContact CD1-CZ 3.59Å; L155-F192 HydrophobicContact CD2-CD2 4.21Å; L155-F192 HydrophobicContact CD2-CE1 4.15Å; L155-F192 HydrophobicContact CD2-CE2 3.46Å; L155-F192 VanDerWaalsContact CD2-CE2 3.46Å; L155-F192 HydrophobicContact CD2-CZ 3.44Å; L155-F192 VanDerWaalsContact CD2-CZ 3.44Å; L155-F192 HydrophobicContact CG-CE1 4.38Å; L155-F192 HydrophobicContact CG-CE2 4.46Å; L155-F192 HydrophobicContact CG-CZ 4.13Å
156	E	75.8	Confident	68.2	Low	26 Å²	26	48.4 Å²	48.4	12%	0.121	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.5	163.5	-54.6	-174.2	149.3	0	0	108.4	Q102 I103 K105 R149 T150	Q102-E156 WeakPolarHBondContact CA-O 3.12Å; I103-E156 HydrophobicContact CG1-CB 4.09Å; I103-E156 WeakPolarHBondContact CG1-O 3.48Å; I103-E156 PolarHBondContact N-O 3.31Å; I103-E156 PolarHBondContact O-N 3.24Å; K105-E156 HydrophobicContact CB-CG 4.48Å; K105-E156 HydrophobicContact CG-CG 3.6Å; R149-E156 IonicContact CZ-OE2 3.79Å; R149-E156 IonicContact NE-OE2 2.66Å; R149-E156 PolarHBondContact NE-OE2 2.71Å; R149-E156 IonicContact NH2-OE1 3.93Å; R149-E156 IonicContact NH2-OE2 2.64Å; R149-E156 PolarHBondContact NH2-OE2 3.02Å; T150-E156 WeakPolarHBondContact O-CA 3.35Å
157	T	78.8	Confident	69.6	Low	12 Å²	12	49.3 Å²	49.3	7%	0.074	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.8	177.1	-45.2	0	0	0	0	108.1	N100 Q102 R149 T150	N100-T157 WeakPolarHBondContact OD1-CG2 3.26Å; Q102-T157 HydrophobicContact CG-CG2 4.25Å; R149-T157 VanDerWaalsContact CA-O 3.26Å; R149-T157 WeakPolarHBondContact CA-O 3.13Å; T150-T157 PolarHBondContact N-O 2.98Å; T150-T157 PolarHBondContact O-N 2.98Å; T150-T157 WeakPolarHBondContact OG1-CB 3.18Å
158	F	81.8	Confident	70.9	Confident	1 Å²	1	49.4 Å²	49.4	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	113.9	170.6	-179	-84.8	0	0	0	108.9	F99 N100 V101 I109 F112 I147 R149 T160 L174 A634	F99-F158 HydrophobicContact CD1-CD1 4.11Å; F99-F158 HydrophobicContact CD1-CE1 4.08Å; F99-F158 HydrophobicContact CE1-CD1 4.14Å; F99-F158 HydrophobicContact CE1-CE1 4.18Å; N100-F158 WeakPolarHBondContact CA-O 3.22Å; V101-F158 PolarHBondContact N-O 2.83Å; V101-F158 PolarHBondContact O-N 3.01Å; I109-F158 HydrophobicContact CD1-CD2 3.74Å; I109-F158 HydrophobicContact CD1-CE2 4.26Å; F112-F158 HydrophobicContact CB-CZ 4.33Å; F112-F158 HydrophobicContact CD1-CZ 4.19Å; F112-F158 AromaticContact CD2-CE1 3.74Å; F112-F158 HydrophobicContact CD2-CE1 3.74Å; F112-F158 AromaticContact CD2-CZ 3.63Å; F112-F158 HydrophobicContact CD2-CZ 3.63Å; F112-F158 HydrophobicContact CE1-CZ 4.4Å; F112-F158 AromaticContact CE2-CE1 3.62Å; F112-F158 HydrophobicContact CE2-CE1 3.62Å; F112-F158 AromaticContact CE2-CZ 3.89Å; F112-F158 HydrophobicContact CE2-CZ 3.89Å; F112-F158 HydrophobicContact CG-CE1 4.35Å; F112-F158 AromaticContact CG-CZ 3.78Å; F112-F158 HydrophobicContact CG-CZ 3.78Å; F112-F158 HydrophobicContact CZ-CE1 4.13Å; F112-F158 HydrophobicContact CZ-CZ 4.26Å; I147-F158 HydrophobicContact CD1-CZ 4.3Å; I147-F158 HydrophobicContact CG2-CD2 4.22Å; I147-F158 HydrophobicContact CG2-CE1 4.16Å; I147-F158 HydrophobicContact CG2-CE2 3.74Å; I147-F158 HydrophobicContact CG2-CZ 3.7Å; R149-F158 HydrophobicContact CG-CD2 4.47Å; F158-T160 HydrophobicContact CE1-CG2 4.25Å; F158-L174 HydrophobicContact CB-CD2 4.12Å; F158-L174 HydrophobicContact CD1-CD1 4.4Å; F158-L174 HydrophobicContact CD1-CD2 4.01Å; F158-L174 HydrophobicContact CD2-CD1 4.18Å; F158-L174 HydrophobicContact CE1-CD1 4.29Å; F158-L174 HydrophobicContact CE2-CD1 4.04Å; F158-L174 HydrophobicContact CG-CD1 4.34Å; F158-L174 HydrophobicContact CG-CD2 3.99Å; F158-L174 HydrophobicContact CZ-CD1 4.1Å; F158-A634 HydrophobicContact CE2-CB 3.82Å
159	T	78.6	Confident	72.4	Confident	17 Å²	17	48 Å²	48	10%	0.104	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.8	-177.4	-54.1	0	0	0	0	111	F55 F99 I147 V148	F55-T159 HydrophobicContact CD1-CG2 3.95Å; F55-T159 HydrophobicContact CE1-CG2 3.43Å; F55-T159 VanDerWaalsContact CE1-CG2 3.43Å; F55-T159 HydrophobicContact CE2-CG2 4.08Å; F55-T159 HydrophobicContact CG-CG2 4.48Å; F55-T159 HydrophobicContact CZ-CG2 3.51Å; F99-T159 WeakPolarHBondContact O-CA 3.47Å; I147-T159 CarbonylContact C-O 3.58Å; I147-T159 WeakPolarHBondContact CG2-O 3.49Å; V148-T159 PolarHBondContact N-O 3.48Å; V148-T159 PolarHBondContact O-N 2.9Å
160	T	76.9	Confident	73.8	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.3	168.6	-174.5	0	0	0	0	109.9	G98 F99 F112 F158 F172	G98-T160 CarbonylContact C-O 3.34Å; G98-T160 VanDerWaalsContact CA-O 3.31Å; G98-T160 WeakPolarHBondContact CA-O 3.4Å; F99-T160 HydrophobicContact CB-CG2 3.82Å; F99-T160 HydrophobicContact CD1-CG2 4.2Å; F99-T160 PolarHBondContact N-O 2.9Å; F99-T160 PolarHBondContact O-N 3.3Å; F112-T160 HydrophobicContact CZ-CG2 3.95Å; F158-T160 HydrophobicContact CE1-CG2 4.25Å; T160-F172 HydrophobicContact CG2-CD1 4.29Å; T160-F172 HydrophobicContact CG2-CE1 4.02Å
161	E	75.3	Confident	75.6	Confident	83 Å²	83	46.1 Å²	46.1	39%	0.388	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	136.5	177	-172.3	-178.6	165.8	0	0	109.4	S96	S96-E161 WeakPolarHBondContact CB-OE1 3.29Å; S96-E161 PolarHBondContact OG-OE1 3.31Å
162	V	75.7	Confident	77.4	Confident	18 Å²	18	42.3 Å²	42.3	11%	0.109	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	133	-175.8	-171.7	0	0	0	0	109.3	S96 I97 M114 V116 V164 F172	S96-V162 WeakPolarHBondContact CA-O 3.36Å; I97-V162 PolarHBondContact N-O 2.79Å; I97-V162 PolarHBondContact O-N 2.87Å; M114-V162 HydrophobicContact CE-CG2 4.47Å; M114-V162 HydrophobicContact SD-CG2 3.52Å; M114-V162 VanDerWaalsContact SD-CG2 3.52Å; V116-V162 HydrophobicContact CG2-CG1 4.07Å; V162-V164 HydrophobicContact CB-CG2 4.35Å; V162-V164 HydrophobicContact CG1-CG2 4.19Å; V162-F172 HydrophobicContact CG2-CE1 3.77Å; V162-F172 HydrophobicContact CG2-CZ 3.95Å
163	H	74.1	Confident	79.6	Confident	136 Å²	136	42.5 Å²	42.5	63%	0.63	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80	120.3	168.6	-102.2	53.2	0	0	0	110.1	S96	S96-H163 PolarHBondContact OG-CE1 3.02Å; S96-H163 PolarHBondContact OG-ND1 3.48Å
164	V	75.1	Confident	81.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.8	-172.9	-174.9	0	0	0	0	109.9	N89 A94 Q95 I97 V162 S168 V170	N89-V164 HydrophobicContact CB-CB 4.42Å; N89-V164 HydrophobicContact CB-CG1 3.98Å; N89-V164 PolarHBondContact ND2-O 3.15Å; A94-V164 VanDerWaalsContact CA-O 3.24Å; A94-V164 WeakPolarHBondContact CA-O 3.37Å; Q95-V164 PolarHBondContact N-O 2.6Å; Q95-V164 PolarHBondContact O-N 2.86Å; I97-V164 HydrophobicContact CB-CG2 4Å; I97-V164 HydrophobicContact CD1-CB 3.9Å; I97-V164 HydrophobicContact CD1-CG1 4.12Å; I97-V164 HydrophobicContact CD1-CG2 3.63Å; I97-V164 HydrophobicContact CG1-CB 4.16Å; I97-V164 HydrophobicContact CG1-CG2 3.7Å; V162-V164 HydrophobicContact CB-CG2 4.35Å; V162-V164 HydrophobicContact CG1-CG2 4.19Å; V164-S168 WeakPolarHBondContact CG1-O 3.3Å; V164-V170 HydrophobicContact CB-CG2 4.34Å; V164-V170 HydrophobicContact CG1-CG2 3.9Å; V164-V170 HydrophobicContact CG2-CG2 3.45Å; V164-V170 VanDerWaalsContact CG2-CG2 3.45Å
165	P	78.5	Confident	82.8	Confident	63 Å²	63	32.9 Å²	32.9	41%	0.409	20%	0.199	S	C	.	.			trans	-62.3	165.4	179.8	-21.8	32.7	0	0	0	113.8	N89 S168	N89-P165 PolarHBondContact ND2-O 3.33Å; N89-P165 VanDerWaalsContact ND2-O 3.11Å; P165-S168 WeakPolarHBondContact O-CB 3.49Å; P165-S168 PolarHBondContact O-N 3.34Å; P165-S168 PolarHBondContact O-OG 2.92Å
166	P	83.7	Confident	83.9	Confident	63 Å²	63	31.9 Å²	31.9	41%	0.409	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	140.1	171.5	-25.8	34.5	0	0	0	112.5	G91 S92 S168	G91-P166 WeakPolarHBondContact O-CA 3.29Å; G91-P166 WeakPolarHBondContact O-CB 3.48Å; S92-P166 WeakPolarHBondContact O-CG 3.3Å; P166-S168 PolarHBondContact O-N 2.88Å; P166-S168 PolarHBondContact O-OG 2.83Å
167	G	83.1	Confident	84.8	Confident	59 Å²	59	31.1 Å²	31.1	61%	0.608	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	64	3	177.3	0	0	0	0	0	115.8	N89	N89-G167 WeakPolarHBondContact O-CA 3.02Å; N89-G167 PolarHBondContact O-N 3.01Å
168	S	84.6	Confident	85.4	Confident	10 Å²	10	30.5 Å²	30.5	7%	0.07	19%	0.186	C	C	.	.			trans	-93.2	145.9	-174.5	-59	0	0	0	0	111.8	N89 V164 P165 P166	N89-S168 PolarHBondContact N-O 2.85Å; V164-S168 WeakPolarHBondContact CG1-O 3.3Å; P165-S168 WeakPolarHBondContact O-CB 3.49Å; P165-S168 PolarHBondContact O-N 3.34Å; P165-S168 PolarHBondContact O-OG 2.92Å; P166-S168 PolarHBondContact O-N 2.88Å; P166-S168 PolarHBondContact O-OG 2.83Å
169	S	87.5	Confident	86.1	Confident	53 Å²	53	31.3 Å²	31.3	37%	0.371	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	153.9	174.8	60.3	0	0	0	0	112.5	V87 N117	V87-S169 CarbonylContact O-C 3.53Å; V87-S169 VanDerWaalsContact O-CA 3.31Å; V87-S169 WeakPolarHBondContact O-CA 3.19Å; N117-S169 PolarHBondContact N-O 2.85Å
170	V	89.1	Confident	86.8	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.4	172.2	-179.4	0	0	0	0	109.3	S86 V87 M114 N115 V116 V164 F172	S86-V170 WeakPolarHBondContact CA-O 3.37Å; V87-V170 PolarHBondContact N-O 2.83Å; V87-V170 PolarHBondContact O-N 3.11Å; M114-V170 HydrophobicContact CG-CG1 4.22Å; N115-V170 CarbonylContact O-C 3.55Å; N115-V170 VanDerWaalsContact O-CA 3.28Å; N115-V170 WeakPolarHBondContact O-CA 3.39Å; N115-V170 WeakPolarHBondContact O-CG1 3.41Å; V116-V170 HydrophobicContact CB-CG2 4.38Å; V116-V170 HydrophobicContact CG1-CG2 4.12Å; V116-V170 HydrophobicContact CG2-CG1 4.1Å; V116-V170 HydrophobicContact CG2-CG2 4.04Å; V164-V170 HydrophobicContact CB-CG2 4.34Å; V164-V170 HydrophobicContact CG1-CG2 3.9Å; V164-V170 HydrophobicContact CG2-CG2 3.45Å; V164-V170 VanDerWaalsContact CG2-CG2 3.45Å; V170-F172 HydrophobicContact CB-CE2 4.26Å; V170-F172 HydrophobicContact CB-CZ 4.43Å; V170-F172 HydrophobicContact CG1-CD1 4.23Å; V170-F172 HydrophobicContact CG1-CD2 4.01Å; V170-F172 HydrophobicContact CG1-CE1 3.83Å; V170-F172 HydrophobicContact CG1-CE2 3.58Å; V170-F172 HydrophobicContact CG1-CG 4.33Å; V170-F172 HydrophobicContact CG1-CZ 3.5Å; V170-F172 VanDerWaalsContact CG1-CZ 3.5Å
171	A	92.4	Very high	87.5	Confident	44 Å²	44	33.6 Å²	33.6	36%	0.364	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.1	167.1	0	0	0	0	0	109.5	S85 M114 N115	S85-A171 CarbonylContact O-C 3.6Å; S85-A171 WeakPolarHBondContact O-CA 3.32Å; M114-A171 CarbonylContact C-O 3.54Å; M114-A171 VanDerWaalsContact CA-O 3.29Å; M114-A171 WeakPolarHBondContact CA-O 3.38Å; N115-A171 PolarHBondContact N-O 2.88Å; N115-A171 PolarHBondContact O-N 2.96Å
172	F	92.4	Very high	88.4	Confident	3 Å²	3	31.3 Å²	31.3	1%	0.013	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.3	175.4	-58.5	-80.4	0	0	0	109.5	R84 S85 V87 I97 F99 F112 M114 T160 V162 V170	R84-F172 CarbonylContact C-O 3.23Å; R84-F172 VanDerWaalsContact CA-O 3.29Å; R84-F172 WeakPolarHBondContact CA-O 3.06Å; S85-F172 PolarHBondContact N-O 2.87Å; S85-F172 PolarHBondContact O-N 3.04Å; V87-F172 HydrophobicContact CG2-CE2 4.4Å; I97-F172 HydrophobicContact CG2-CE2 4.01Å; I97-F172 HydrophobicContact CG2-CZ 4.37Å; F99-F172 HydrophobicContact CB-CB 4.3Å; F99-F172 HydrophobicContact CB-CD1 3.77Å; F99-F172 HydrophobicContact CB-CD2 3.78Å; F99-F172 HydrophobicContact CB-CE1 3.88Å; F99-F172 HydrophobicContact CB-CE2 3.89Å; F99-F172 HydrophobicContact CB-CG 3.7Å; F99-F172 HydrophobicContact CB-CZ 3.93Å; F99-F172 HydrophobicContact CD1-CB 4.18Å; F99-F172 HydrophobicContact CD1-CD1 4.49Å; F99-F172 HydrophobicContact CD1-CG 4.4Å; F99-F172 HydrophobicContact CD2-CB 3.47Å; F99-F172 VanDerWaalsContact CD2-CB 3.47Å; F99-F172 AromaticContact CD2-CD2 3.86Å; F99-F172 HydrophobicContact CD2-CD2 3.86Å; F99-F172 AromaticContact CD2-CG 3.74Å; F99-F172 HydrophobicContact CD2-CG 3.74Å; F99-F172 HydrophobicContact CE1-CB 4.33Å; F99-F172 HydrophobicContact CE2-CB 3.65Å; F99-F172 HydrophobicContact CE2-CG 4.42Å; F99-F172 HydrophobicContact CG-CB 3.74Å; F99-F172 HydrophobicContact CG-CD1 4.05Å; F99-F172 HydrophobicContact CG-CD2 4.06Å; F99-F172 AromaticContact CG-CG 3.7Å; F99-F172 HydrophobicContact CG-CG 3.7Å; F99-F172 HydrophobicContact CZ-CB 4.07Å; F112-F172 HydrophobicContact CE2-CD1 4.43Å; F112-F172 HydrophobicContact CZ-CD1 4.02Å; M114-F172 HydrophobicContact CB-CD1 4.45Å; M114-F172 HydrophobicContact CG-CD1 3.87Å; M114-F172 HydrophobicContact CG-CE1 3.94Å; M114-F172 HydrophobicContact SD-CD1 4.24Å; M114-F172 HydrophobicContact SD-CE1 3.82Å; T160-F172 HydrophobicContact CG2-CD1 4.29Å; T160-F172 HydrophobicContact CG2-CE1 4.02Å; V162-F172 HydrophobicContact CG2-CE1 3.77Å; V162-F172 HydrophobicContact CG2-CZ 3.95Å; V170-F172 HydrophobicContact CB-CE2 4.26Å; V170-F172 HydrophobicContact CB-CZ 4.43Å; V170-F172 HydrophobicContact CG1-CD1 4.23Å; V170-F172 HydrophobicContact CG1-CD2 4.01Å; V170-F172 HydrophobicContact CG1-CE1 3.83Å; V170-F172 HydrophobicContact CG1-CE2 3.58Å; V170-F172 HydrophobicContact CG1-CG 4.33Å; V170-F172 HydrophobicContact CG1-CZ 3.5Å; V170-F172 VanDerWaalsContact CG1-CZ 3.5Å
173	E	95.1	Very high	89.2	Confident	47 Å²	47	36.1 Å²	36.1	22%	0.22	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	113.5	176.8	169	167.2	-158.4	0	0	110.4	V83 R84 F112 T113 H175	V83-E173 WeakPolarHBondContact O-CA 3.34Å; R84-E173 HydrophobicContact CG-CB 4.09Å; R84-E173 HydrophobicContact CG-CG 3.94Å; R84-E173 IonicContact CZ-OE1 3.18Å; R84-E173 VanDerWaalsContact NE-CD 3.29Å; R84-E173 IonicContact NE-OE1 2.61Å; R84-E173 PolarHBondContact NE-OE1 3.2Å; R84-E173 IonicContact NE-OE2 3.64Å; R84-E173 IonicContact NH2-OE1 3.97Å; R84-E173 PolarHBondContact NH2-OE1 2.91Å; F112-E173 CarbonylContact C-O 3.58Å; F112-E173 VanDerWaalsContact CA-O 3.32Å; F112-E173 WeakPolarHBondContact CA-O 3.21Å; F112-E173 WeakPolarHBondContact CD2-O 3.31Å; T113-E173 PolarHBondContact N-O 2.87Å; T113-E173 PolarHBondContact O-N 2.83Å; T113-E173 WeakPolarHBondContact OG1-CB 3.23Å; E173-H175 VanDerWaalsContact CD-NE2 3.32Å; E173-H175 VanDerWaalsContact CG-NE2 3.29Å; E173-H175 WeakPolarHBondContact CG-NE2 3.48Å; E173-H175 IonicContact OE1-CD2 2.67Å; E173-H175 IonicContact OE1-CE1 3.12Å; E173-H175 PolarHBondContact OE1-CE1 3.28Å; E173-H175 IonicContact OE1-NE2 3.9Å; E173-H175 PolarHBondContact OE1-NE2 2.8Å
174	L	93.4	Very high	89.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132	178.9	179.1	67.3	0	0	0	110	S82 V83 F99 V101 I103 I109 F112 F158	S82-L174 CarbonylContact C-O 3.57Å; S82-L174 VanDerWaalsContact CA-O 3.31Å; S82-L174 WeakPolarHBondContact CA-O 3.32Å; V83-L174 PolarHBondContact N-O 3.04Å; V83-L174 PolarHBondContact O-N 2.96Å; F99-L174 HydrophobicContact CE1-CB 3.93Å; F99-L174 HydrophobicContact CE1-CD2 4.38Å; F99-L174 HydrophobicContact CZ-CB 4.07Å; V101-L174 HydrophobicContact CB-CD2 4.01Å; V101-L174 HydrophobicContact CG1-CD2 4.1Å; V101-L174 HydrophobicContact CG2-CD2 4.37Å; I103-L174 HydrophobicContact CG2-CD2 4.38Å; I109-L174 HydrophobicContact CG2-CD1 3.82Å; F112-L174 HydrophobicContact CB-CD1 4.17Å; F112-L174 HydrophobicContact CD2-CB 4.12Å; F112-L174 HydrophobicContact CD2-CD1 4.03Å; F158-L174 HydrophobicContact CB-CD2 4.12Å; F158-L174 HydrophobicContact CD1-CD1 4.4Å; F158-L174 HydrophobicContact CD1-CD2 4.01Å; F158-L174 HydrophobicContact CD2-CD1 4.18Å; F158-L174 HydrophobicContact CE1-CD1 4.29Å; F158-L174 HydrophobicContact CE2-CD1 4.04Å; F158-L174 HydrophobicContact CG-CD1 4.34Å; F158-L174 HydrophobicContact CG-CD2 3.99Å; F158-L174 HydrophobicContact CZ-CD1 4.1Å
175	H	94.9	Very high	90.8	Very high	27 Å²	27	34.9 Å²	34.9	13%	0.125	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	133.6	174.9	-67	-93.9	0	0	0	110.9	H80 T81 S110 N111 E173	H80-H175 AromaticContact CE1-ND1 3.4Å; H80-H175 PolarHBondContact CE1-ND1 3.07Å; T81-H175 WeakPolarHBondContact O-CA 3.44Å; S110-H175 PolarHBondContact N-O 2.96Å; S110-H175 WeakPolarHBondContact OG-CB 3.39Å; S110-H175 PolarHBondContact OG-O 3.12Å; N111-H175 HydrophobicContact CB-CB 4.12Å; N111-H175 PolarHBondContact N-O 2.92Å; N111-H175 PolarHBondContact O-N 2.84Å; E173-H175 VanDerWaalsContact CD-NE2 3.32Å; E173-H175 VanDerWaalsContact CG-NE2 3.29Å; E173-H175 WeakPolarHBondContact CG-NE2 3.48Å; E173-H175 IonicContact OE1-CD2 2.67Å; E173-H175 IonicContact OE1-CE1 3.12Å; E173-H175 PolarHBondContact OE1-CE1 3.28Å; E173-H175 IonicContact OE1-NE2 3.9Å; E173-H175 PolarHBondContact OE1-NE2 2.8Å
176	Y	94.4	Very high	91.5	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.016	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	155.8	174	62.9	-91.9	0	0	0	112.1	T81 V83 I103 A107 F108	T81-Y176 HydrophobicContact CG2-CE1 3.83Å; T81-Y176 HydrophobicContact CG2-CE2 4.11Å; T81-Y176 PolarHBondContact N-O 2.94Å; T81-Y176 PolarHBondContact O-N 3.06Å; V83-Y176 HydrophobicContact CG2-CE1 4.08Å; I103-Y176 HydrophobicContact CB-CE1 4.45Å; I103-Y176 HydrophobicContact CB-CE2 4.45Å; I103-Y176 HydrophobicContact CG2-CD1 3.65Å; I103-Y176 HydrophobicContact CG2-CD2 4.45Å; I103-Y176 HydrophobicContact CG2-CE1 3.49Å; I103-Y176 VanDerWaalsContact CG2-CE1 3.49Å; I103-Y176 HydrophobicContact CG2-CE2 4.32Å; I103-Y176 HydrophobicContact CG2-CG 4.12Å; A107-Y176 HydrophobicContact CB-CD2 3.95Å; F108-Y176 CarbonylContact O-C 3.59Å; F108-Y176 WeakPolarHBondContact O-CA 3.49Å
177	Q	94.6	Very high	92.1	Very high	9 Å²	9	30.7 Å²	30.7	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.2	-175.1	-64.1	174.3	17	0	0	110.7	F78 A79 H80 A107 F108 F614	F78-Q177 HydrophobicContact CE1-CB 3.98Å; F78-Q177 HydrophobicContact CE1-CG 4.19Å; F78-Q177 HydrophobicContact CZ-CB 3.82Å; F78-Q177 HydrophobicContact CZ-CG 4.46Å; A79-Q177 WeakPolarHBondContact O-CA 3.36Å; H80-Q177 HydrophobicContact CB-CG 4.48Å; H80-Q177 PolarHBondContact CD2-NE2 3.19Å; H80-Q177 PolarHBondContact NE2-NE2 3.09Å; A107-Q177 CarbonylContact C-O 3.59Å; A107-Q177 VanDerWaalsContact CA-O 3.26Å; A107-Q177 WeakPolarHBondContact CA-O 3.47Å; F108-Q177 PolarHBondContact N-O 3.4Å; F108-Q177 PolarHBondContact O-N 3.29Å; Q177-F614 HydrophobicContact CB-CE1 4.23Å
178	E	93.3	Very high	92.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	147	172.2	65.5	171.9	-171.3	0	0	112.2	A79 R106 A107 M180 H189	A79-E178 HydrophobicContact CB-CG 3.9Å; A79-E178 PolarHBondContact N-O 3.23Å; A79-E178 PolarHBondContact O-N 3.4Å; R106-E178 HydrophobicContact CG-CB 4.44Å; R106-E178 IonicContact CZ-OE1 2.7Å; R106-E178 IonicContact CZ-OE2 2.63Å; R106-E178 IonicContact NE-OE2 3.98Å; R106-E178 PolarHBondContact NE-OE2 2.94Å; R106-E178 VanDerWaalsContact NH2-CD 3.31Å; R106-E178 IonicContact NH2-OE1 3.77Å; R106-E178 PolarHBondContact NH2-OE1 2.82Å; R106-E178 IonicContact NH2-OE2 3.94Å; R106-E178 PolarHBondContact NH2-OE2 2.91Å; R106-E178 VanDerWaalsContact NH2-OE2 3.09Å; A107-E178 HydrophobicContact CB-CB 4.02Å; E178-M180 HydrophobicContact CG-SD 4.28Å; E178-H189 IonicContact OE1-CE1 2.96Å; E178-H189 IonicContact OE1-ND1 3.28Å; E178-H189 PolarHBondContact OE1-ND1 2.83Å
179	M	94.6	Very high	93.2	Very high	18 Å²	18	30.8 Å²	30.8	9%	0.089	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130.5	160.1	-168.8	-168.8	84.5	0	0	108.5	F78 E181 V521 M576 Y579 L580	F78-M179 HydrophobicContact CD2-CB 4.41Å; M179-E181 HydrophobicContact CE-CG 4.42Å; M179-E181 PolarHBondContact O-N 3.45Å; M179-V521 HydrophobicContact CE-CG2 4.36Å; M179-V521 HydrophobicContact SD-CG1 4.43Å; M179-V521 HydrophobicContact SD-CG2 4.45Å; M179-M576 HydrophobicContact CG-CE 4.04Å; M179-M576 HydrophobicContact CG-CG 4.02Å; M179-M576 HydrophobicContact CG-SD 3.97Å; M179-M576 HydrophobicContact SD-CG 3.95Å; M179-M576 HydrophobicContact SD-SD 3.89Å; M179-Y579 HydrophobicContact CB-CD1 3.8Å; M179-Y579 HydrophobicContact CB-CE1 3.52Å; M179-L580 HydrophobicContact CE-CD2 4.23Å; M179-L580 HydrophobicContact SD-CD1 4.17Å; M179-L580 HydrophobicContact SD-CD2 3.73Å; M179-L580 HydrophobicContact SD-CG 4.04Å
180	M	94.3	Very high	93.5	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-72.2	122.3	175.3	-61.7	-57.1	-59.5	0	0	110	I74 R77 A79 E178 Y187 Q188 H189	I74-M180 HydrophobicContact CG2-CG 4.24Å; R77-M180 HydrophobicContact CB-CB 4.09Å; R77-M180 VanDerWaalsContact O-CB 3.26Å; R77-M180 WeakPolarHBondContact O-CB 3.25Å; R77-M180 VanDerWaalsContact O-CG 3.26Å; R77-M180 WeakPolarHBondContact O-CG 3.44Å; R77-M180 PolarHBondContact O-N 3.26Å; A79-M180 HydrophobicContact CB-CG 4.38Å; A79-M180 HydrophobicContact CB-SD 3.93Å; E178-M180 HydrophobicContact CG-SD 4.28Å; M180-Y187 HydrophobicContact CB-CD1 3.89Å; M180-Y187 HydrophobicContact CB-CG 4.41Å; M180-Q188 VanDerWaalsContact CE-C 3.42Å; M180-Q188 VanDerWaalsContact CE-O 3.3Å; M180-Q188 WeakPolarHBondContact CE-O 3.25Å; M180-H189 HydrophobicContact CE-CB 3.62Å; M180-H189 HydrophobicContact SD-CB 4.2Å
181	E	92	Very high	93.7	Very high	65 Å²	65	30.1 Å²	30.1	30%	0.304	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-91.9	131.9	171.8	-66.8	176.7	179.9	0	0	110.5	M179 R183	M179-E181 HydrophobicContact CE-CG 4.42Å; M179-E181 PolarHBondContact O-N 3.45Å; E181-R183 IonicContact OE2-CZ 2.64Å; E181-R183 IonicContact OE2-NE 3.57Å; E181-R183 PolarHBondContact OE2-NE 2.84Å; E181-R183 VanDerWaalsContact OE2-NE 3.14Å; E181-R183 IonicContact OE2-NH2 3.47Å; E181-R183 PolarHBondContact OE2-NH2 2.62Å
182	R	94.1	Very high	93.7	Very high	35 Å²	35	29.3 Å²	29.3	13%	0.132	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124.6	171.7	-162.3	170	175.6	-104.8	5.2	110.3	G185 V186 Y187 D271 R274 S518 E519	R182-G185 PolarHBondContact NE-O 3.28Å; R182-G185 PolarHBondContact NH2-O 3.39Å; R182-V186 WeakPolarHBondContact CA-O 3.26Å; R182-Y187 HydrophobicContact CB-CD1 3.8Å; R182-Y187 HydrophobicContact CB-CE1 3.57Å; R182-Y187 HydrophobicContact CG-CD1 4.31Å; R182-Y187 HydrophobicContact CG-CE1 4.13Å; R182-D271 IonicContact CZ-OD1 2.71Å; R182-D271 IonicContact CZ-OD2 2.67Å; R182-D271 IonicContact NE-OD1 2.77Å; R182-D271 PolarHBondContact NE-OD1 3.34Å; R182-D271 IonicContact NE-OD2 2.79Å; R182-D271 PolarHBondContact NE-OD2 3.29Å; R182-D271 IonicContact NH2-OD1 2.7Å; R182-D271 IonicContact NH2-OD2 3.19Å; R182-D271 PolarHBondContact NH2-OD2 3.06Å; R182-R274 VanDerWaalsContact NE-NH2 3.14Å; R182-S518 PolarHBondContact NH1-O 3.12Å; R182-E519 HydrophobicContact CB-CB 3.93Å
183	R	91.3	Very high	93.6	Very high	119 Å²	119	29.2 Å²	29.2	45%	0.449	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	137.5	177	-59.9	-179.1	-177.5	-159.5	6.5	109.1	E181 G185 V186 G517	E181-R183 IonicContact OE2-CZ 2.64Å; E181-R183 IonicContact OE2-NE 3.57Å; E181-R183 PolarHBondContact OE2-NE 2.84Å; E181-R183 VanDerWaalsContact OE2-NE 3.14Å; E181-R183 IonicContact OE2-NH2 3.47Å; E181-R183 PolarHBondContact OE2-NH2 2.62Å; R183-G185 PolarHBondContact O-N 3.03Å; R183-V186 PolarHBondContact N-O 2.94Å; R183-V186 PolarHBondContact O-N 3.28Å; R183-V186 VanDerWaalsContact O-O 3.07Å; R183-G517 CarbonylContact C-O 3.5Å
184	L	90.4	Very high	93.3	Very high	93 Å²	93	30 Å²	30	49%	0.487	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	30.2	-177.6	-55.8	178.6	0	0	0	114.1	S484 Q485 G517	L184-S484 VanDerWaalsContact CD2-C 3.49Å; L184-S484 WeakPolarHBondContact CD2-O 3.35Å; L184-Q485 HydrophobicContact CD2-CB 4.46Å; L184-Q485 HydrophobicContact CD2-CG 3.72Å; L184-Q485 HydrophobicContact CG-CG 3.94Å; L184-G517 PolarHBondContact N-O 3.44Å
185	G	92.3	Very high	93	Very high	16 Å²	16	30.4 Å²	30.4	17%	0.165	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.9	-0.6	178.7	0	0	0	0	0	115.8	R182 R183 D271 G517	R182-G185 PolarHBondContact NE-O 3.28Å; R182-G185 PolarHBondContact NH2-O 3.39Å; R183-G185 PolarHBondContact O-N 3.03Å; G185-D271 WeakPolarHBondContact O-CB 3.36Å; G185-D271 VanDerWaalsContact O-CG 3.27Å; G185-G517 VanDerWaalsContact N-CA 3.29Å; G185-G517 PolarHBondContact N-O 2.65Å
186	V	94.9	Very high	92.5	Very high	39 Å²	39	31 Å²	31	24%	0.236	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.3	-170.2	178.3	0	0	0	0	111.1	R182 R183 K269	R182-V186 WeakPolarHBondContact CA-O 3.26Å; R183-V186 PolarHBondContact N-O 2.94Å; R183-V186 PolarHBondContact O-N 3.28Å; R183-V186 VanDerWaalsContact O-O 3.07Å; V186-K269 HydrophobicContact CG1-CB 3.8Å; V186-K269 HydrophobicContact CG1-CD 4.45Å; V186-K269 HydrophobicContact CG1-CG 4.1Å
187	Y	96.2	Very high	92	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129.2	160.9	-48.3	-85.1	0	0	0	108.9	R77 M180 R182 K269 Y270 D271 V272 R274 E519	R77-Y187 HydrophobicContact CB-CE1 4.37Å; R77-Y187 HydrophobicContact CG-CD1 4.08Å; R77-Y187 HydrophobicContact CG-CE1 3.37Å; R77-Y187 HydrophobicContact CG-CE2 4.13Å; R77-Y187 VanDerWaalsContact CG-CZ 3.41Å; R77-Y187 WeakPolarHBondContact CG-OH 3.27Å; R77-Y187 PolarHBondContact NE-OH 3.46Å; M180-Y187 HydrophobicContact CB-CD1 3.89Å; M180-Y187 HydrophobicContact CB-CG 4.41Å; R182-Y187 HydrophobicContact CB-CD1 3.8Å; R182-Y187 HydrophobicContact CB-CE1 3.57Å; R182-Y187 HydrophobicContact CG-CD1 4.31Å; R182-Y187 HydrophobicContact CG-CE1 4.13Å; Y187-K269 WeakPolarHBondContact O-CA 3.38Å; Y187-Y270 HydrophobicContact CD2-CD1 4.48Å; Y187-Y270 HydrophobicContact CD2-CD2 4.06Å; Y187-Y270 HydrophobicContact CD2-CE1 4.23Å; Y187-Y270 AromaticContact CD2-CE2 3.79Å; Y187-Y270 HydrophobicContact CD2-CE2 3.79Å; Y187-Y270 HydrophobicContact CD2-CG 4.4Å; Y187-Y270 AromaticContact CD2-CZ 3.89Å; Y187-Y270 WeakPolarHBondContact CD2-O 3.34Å; Y187-Y270 HydrophobicContact CE2-CE2 4.22Å; Y187-Y270 HydrophobicContact CG-CE1 4.3Å; Y187-Y270 PolarHBondContact N-O 3.08Å; Y187-Y270 PolarHBondContact O-N 3.43Å; Y187-D271 VanDerWaalsContact CE2-OD1 3.3Å; Y187-D271 WeakPolarHBondContact CE2-OD1 3.26Å; Y187-V272 HydrophobicContact CE2-CG1 4.18Å; Y187-V272 HydrophobicContact CE2-CG2 4.33Å; Y187-R274 PolarHBondContact OH-NH2 3.31Å; Y187-E519 PolarHBondContact OH-OE1 3.16Å; Y187-E519 VanDerWaalsContact OH-OE1 3.12Å; Y187-E519 PolarHBondContact OH-OE2 3.5Å
188	Q	94.8	Very high	91.8	Very high	68 Å²	68	33.3 Å²	33.3	32%	0.318	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	119.6	175.4	-179.8	171.8	-20.7	0	0	110.3	R106 M180 N190 K269	R106-Q188 PolarHBondContact NH2-O 3.38Å; M180-Q188 VanDerWaalsContact CE-C 3.42Å; M180-Q188 VanDerWaalsContact CE-O 3.3Å; M180-Q188 WeakPolarHBondContact CE-O 3.25Å; Q188-N190 WeakPolarHBondContact CG-OD1 3.36Å; Q188-N190 PolarHBondContact NE2-ND2 3.41Å; Q188-N190 PolarHBondContact NE2-OD1 2.65Å; Q188-K269 HydrophobicContact CB-CG 4.23Å; Q188-K269 HydrophobicContact CG-CG 4.08Å
189	H	95.3	Very high	91.7	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.009	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.4	173.1	-173.1	54.9	0	0	0	108.5	S72 I74 E178 M180 L191 S267 V268	S72-H189 WeakPolarHBondContact CB-NE2 3.32Å; S72-H189 PolarHBondContact OG-NE2 2.91Å; I74-H189 HydrophobicContact CD1-CB 4.14Å; E178-H189 IonicContact OE1-CE1 2.96Å; E178-H189 IonicContact OE1-ND1 3.28Å; E178-H189 PolarHBondContact OE1-ND1 2.83Å; M180-H189 HydrophobicContact CE-CB 3.62Å; M180-H189 HydrophobicContact SD-CB 4.2Å; H189-L191 WeakPolarHBondContact NE2-CD2 3.43Å; H189-S267 WeakPolarHBondContact O-CA 3.23Å; H189-V268 PolarHBondContact N-O 2.88Å; H189-V268 PolarHBondContact O-N 3.03Å
190	N	93.6	Very high	91.6	Very high	39 Å²	39	35.7 Å²	35.7	21%	0.209	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	116.4	-175.2	-72.5	-22.1	0	0	0	109.2	Q188 F192 I265 S267	Q188-N190 WeakPolarHBondContact CG-OD1 3.36Å; Q188-N190 PolarHBondContact NE2-ND2 3.41Å; Q188-N190 PolarHBondContact NE2-OD1 2.65Å; N190-F192 HydrophobicContact CB-CE2 3.84Å; N190-F192 HydrophobicContact CB-CZ 4.19Å; N190-I265 HydrophobicContact CB-CG2 3.79Å; N190-S267 PolarHBondContact OD1-OG 2.8Å
191	L	94	Very high	91.6	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.6	174.4	-65.1	174.9	0	0	0	108.8	V70 T81 H189 L193 V204 V206 F266	V70-L191 HydrophobicContact CG1-CD1 3.88Å; V70-L191 HydrophobicContact CG1-CD2 4.02Å; V70-L191 HydrophobicContact CG1-CG 4.42Å; T81-L191 HydrophobicContact CG2-CD2 3.67Å; H189-L191 WeakPolarHBondContact NE2-CD2 3.43Å; L191-L193 HydrophobicContact CB-CD2 4.45Å; L191-V204 HydrophobicContact CD1-CG1 3.91Å; L191-V206 HydrophobicContact CD1-CG2 3.69Å; L191-F266 HydrophobicContact CB-CB 4.36Å; L191-F266 HydrophobicContact CB-CD1 4.38Å; L191-F266 HydrophobicContact CD1-CD1 4.17Å; L191-F266 PolarHBondContact N-O 2.87Å; L191-F266 PolarHBondContact O-N 2.87Å
192	F	91.1	Very high	91.8	Very high	27 Å²	27	39 Å²	39	12%	0.118	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.8	-179	-66.3	-94.7	0	0	0	109	Q102 L155 N190 I265	Q102-F192 HydrophobicContact CB-CB 3.76Å; Q102-F192 HydrophobicContact CB-CD1 4.42Å; Q102-F192 HydrophobicContact CB-CD2 4.48Å; Q102-F192 HydrophobicContact CB-CG 3.96Å; L155-F192 HydrophobicContact CD1-CD1 3.79Å; L155-F192 HydrophobicContact CD1-CD2 4.47Å; L155-F192 HydrophobicContact CD1-CE1 3.36Å; L155-F192 HydrophobicContact CD1-CE2 4.14Å; L155-F192 HydrophobicContact CD1-CG 4.34Å; L155-F192 HydrophobicContact CD1-CZ 3.59Å; L155-F192 HydrophobicContact CD2-CD2 4.21Å; L155-F192 HydrophobicContact CD2-CE1 4.15Å; L155-F192 HydrophobicContact CD2-CE2 3.46Å; L155-F192 VanDerWaalsContact CD2-CE2 3.46Å; L155-F192 HydrophobicContact CD2-CZ 3.44Å; L155-F192 VanDerWaalsContact CD2-CZ 3.44Å; L155-F192 HydrophobicContact CG-CE1 4.38Å; L155-F192 HydrophobicContact CG-CE2 4.46Å; L155-F192 HydrophobicContact CG-CZ 4.13Å; N190-F192 HydrophobicContact CB-CE2 3.84Å; N190-F192 HydrophobicContact CB-CZ 4.19Å; F192-I265 HydrophobicContact CD1-CD1 4.48Å; F192-I265 HydrophobicContact CD1-CG1 3.96Å; F192-I265 HydrophobicContact CE1-CB 4.4Å; F192-I265 HydrophobicContact CE1-CD1 3.57Å; F192-I265 HydrophobicContact CE1-CG1 3.52Å; F192-I265 HydrophobicContact CE1-CG2 4.23Å; F192-I265 HydrophobicContact CZ-CD1 3.98Å; F192-I265 HydrophobicContact CZ-CG1 4.22Å; F192-I265 HydrophobicContact CZ-CG2 4.2Å
193	L	91.9	Very high	91.9	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	106.3	-171.3	-56.1	-178.8	0	0	0	109.4	Y68 V70 L191 F202 V204 L223 F244 I262 D263 G264 F266	Y68-L193 HydrophobicContact CE1-CD2 4.46Å; V70-L193 HydrophobicContact CG2-CD2 3.82Å; L191-L193 HydrophobicContact CB-CD2 4.45Å; L193-F202 HydrophobicContact CD1-CZ 4.22Å; L193-V204 HydrophobicContact CD1-CG2 3.87Å; L193-V204 HydrophobicContact CD2-CG2 3.8Å; L193-L223 HydrophobicContact CD1-CD1 4.19Å; L193-L223 HydrophobicContact CD1-CD2 4.48Å; L193-F244 HydrophobicContact CD1-CD1 4.21Å; L193-F244 HydrophobicContact CD1-CE1 4.19Å; L193-I262 HydrophobicContact CB-CG2 3.64Å; L193-I262 HydrophobicContact CD1-CG2 4.33Å; L193-D263 WeakPolarHBondContact O-CA 3Å; L193-G264 PolarHBondContact N-O 2.68Å; L193-G264 PolarHBondContact O-N 2.62Å; L193-G264 VanDerWaalsContact O-N 3.15Å; L193-F266 HydrophobicContact CD1-CB 3.54Å; L193-F266 HydrophobicContact CD1-CD2 4.47Å; L193-F266 HydrophobicContact CD1-CG 4.19Å; L193-F266 HydrophobicContact CG-CB 4.03Å
194	Q	88.1	Confident	92.2	Very high	65 Å²	65	33.4 Å²	33.4	30%	0.304	18%	0.184	S	C	.	.			trans	-137	68.5	178.4	-167.4	172.2	59.8	0	0	111.1	N100 G196 D263	N100-Q194 PolarHBondContact ND2-OE1 2.61Å; Q194-G196 PolarHBondContact O-N 3.33Å; Q194-D263 WeakPolarHBondContact CG-OD1 3.41Å; Q194-D263 PolarHBondContact NE2-OD1 2.94Å
195	P	87.7	Confident	92.5	Very high	8 Å²	8	29 Å²	29	5%	0.052	16%	0.161	C	C	.	.			trans	-66.3	-15.6	174.9	29.1	-38.3	0	0	0	114	Y68 R197 V199 F202 I262	Y68-P195 HydrophobicContact CD1-CB 4.47Å; Y68-P195 HydrophobicContact CD2-CB 4.1Å; Y68-P195 HydrophobicContact CE2-CB 4.33Å; Y68-P195 HydrophobicContact CG-CB 4.16Å; P195-R197 PolarHBondContact O-N 3.19Å; P195-V199 HydrophobicContact CB-CG2 3.77Å; P195-F202 HydrophobicContact CB-CE2 4.26Å; P195-F202 HydrophobicContact CG-CD2 4.39Å; P195-F202 HydrophobicContact CG-CE2 3.89Å; P195-I262 WeakPolarHBondContact CD-O 3.25Å; P195-I262 HydrophobicContact CG-CB 4.03Å; P195-I262 HydrophobicContact CG-CG2 4.19Å
196	G	82.9	Confident	92.8	Very high	38 Å²	38	28.2 Å²	28.2	39%	0.392	15%	0.153	S	C	.	.	S	Bend	trans	73.3	-48.1	-179.8	0	0	0	0	0	114.6	Q194 S260	Q194-G196 PolarHBondContact O-N 3.33Å; G196-S260 PolarHBondContact O-N 2.98Å
197	R	84.7	Confident	92.9	Very high	35 Å²	35	27.9 Å²	27.9	13%	0.132	15%	0.148	C	C	.	.	S	Bend	trans	-118.3	157.6	179.1	-63.4	-174.6	176	-161	-5.9	111.3	I58 G60 D61 I63 P195 V199	I58-R197 HydrophobicContact CD1-CG 4.48Å; G60-R197 VanDerWaalsContact O-CZ 3.22Å; G60-R197 PolarHBondContact O-NH1 3.48Å; G60-R197 PolarHBondContact O-NH2 2.83Å; D61-R197 PolarHBondContact O-NH1 2.88Å; I63-R197 PolarHBondContact O-NH1 2.84Å; P195-R197 PolarHBondContact O-N 3.19Å; R197-V199 VanDerWaalsContact O-CG2 3.32Å; R197-V199 WeakPolarHBondContact O-CG2 3.32Å
198	P	89.6	Confident	93	Very high	28 Å²	28	28.1 Å²	28.1	18%	0.182	15%	0.149	C	C	.	.			trans	-59.4	135.9	169.2	-23.8	34.7	0	0	0	111.6	L248 Q251 R252 S258	P198-L248 HydrophobicContact CB-CD2 3.82Å; P198-Q251 HydrophobicContact CB-CB 4.22Å; P198-R252 HydrophobicContact CG-CG 4.18Å; P198-S258 WeakPolarHBondContact CD-O 3.44Å
199	V	92.8	Very high	93.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.			trans	-120.3	124	-171.7	-174	0	0	0	0	110	V65 P195 R197 H201 F202 Q251	V65-V199 HydrophobicContact CB-CG1 4.47Å; V65-V199 HydrophobicContact CB-CG2 4.01Å; V65-V199 HydrophobicContact CG1-CB 4.45Å; V65-V199 HydrophobicContact CG1-CG1 3.93Å; V65-V199 HydrophobicContact CG1-CG2 3.75Å; P195-V199 HydrophobicContact CB-CG2 3.77Å; R197-V199 VanDerWaalsContact O-CG2 3.32Å; R197-V199 WeakPolarHBondContact O-CG2 3.32Å; V199-H201 VanDerWaalsContact C-N 3.3Å; V199-H201 PolarHBondContact O-N 2.87Å; V199-F202 HydrophobicContact CB-CB 4.19Å; V199-F202 HydrophobicContact CB-CD2 4.37Å; V199-F202 HydrophobicContact CG2-CD2 4.36Å; V199-Q251 PolarHBondContact O-NE2 2.81Å; V199-Q251 PolarHBondContact O-OE1 2.82Å
200	P	91.5	Very high	93.1	Very high	68 Å²	68	25 Å²	25	44%	0.442	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-37.9	-179.7	-24.3	34.9	0	0	0	113.3	V65 L248	V65-P200 WeakPolarHBondContact O-CD 3.26Å; P200-L248 HydrophobicContact CB-CD1 4.2Å; P200-L248 HydrophobicContact CG-CD1 4.25Å; P200-L248 HydrophobicContact CG-CD2 4.37Å
201	H	94.1	Very high	93.1	Very high	132 Å²	132	24.2 Å²	24.2	61%	0.611	13%	0.131	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	66	177.7	-50.1	95.9	0	0	0	110.9	N66 S67 Y68 V199	N66-H201 PolarHBondContact O-N 3.35Å; N66-H201 PolarHBondContact O-ND1 3.16Å; S67-H201 WeakPolarHBondContact CA-O 3.48Å; Y68-H201 PolarHBondContact N-O 2.91Å; V199-H201 VanDerWaalsContact C-N 3.3Å; V199-H201 PolarHBondContact O-N 2.87Å
202	F	95.8	Very high	92.9	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	132.4	168.5	-166.4	-85.8	0	0	0	110.5	Y68 L193 P195 V199 V204 F244 P246 I262	Y68-F202 AromaticContact CD1-CD2 3.9Å; Y68-F202 HydrophobicContact CD1-CD2 3.9Å; Y68-F202 AromaticContact CD1-CE2 3.41Å; Y68-F202 HydrophobicContact CD1-CE2 3.41Å; Y68-F202 VanDerWaalsContact CD1-CE2 3.41Å; Y68-F202 HydrophobicContact CD1-CZ 4.14Å; Y68-F202 AromaticContact CE1-CE2 3.94Å; Y68-F202 HydrophobicContact CE1-CE2 3.94Å; Y68-F202 HydrophobicContact CE1-CZ 4.42Å; Y68-F202 HydrophobicContact CG-CD2 4.34Å; Y68-F202 HydrophobicContact CG-CE2 4.2Å; Y68-F202 WeakPolarHBondContact O-CA 3.46Å; L193-F202 HydrophobicContact CD1-CZ 4.22Å; P195-F202 HydrophobicContact CB-CE2 4.26Å; P195-F202 HydrophobicContact CG-CD2 4.39Å; P195-F202 HydrophobicContact CG-CE2 3.89Å; V199-F202 HydrophobicContact CB-CB 4.19Å; V199-F202 HydrophobicContact CB-CD2 4.37Å; V199-F202 HydrophobicContact CG2-CD2 4.36Å; F202-V204 HydrophobicContact CE1-CG2 3.75Å; F202-V204 HydrophobicContact CZ-CG2 4.01Å; F202-F244 AromaticContact CE1-CD1 3.85Å; F202-F244 HydrophobicContact CE1-CD1 3.85Å; F202-F244 AromaticContact CE1-CE1 3.84Å; F202-F244 HydrophobicContact CE1-CE1 3.84Å; F202-F244 HydrophobicContact CZ-CE1 4.45Å; F202-P246 HydrophobicContact CD1-CG 3.98Å; F202-P246 HydrophobicContact CE1-CG 4.37Å; F202-I262 HydrophobicContact CD1-CD1 3.99Å; F202-I262 HydrophobicContact CD2-CD1 4.01Å; F202-I262 HydrophobicContact CE1-CD1 3.71Å; F202-I262 HydrophobicContact CE2-CD1 3.75Å; F202-I262 HydrophobicContact CE2-CG2 4.34Å; F202-I262 HydrophobicContact CG-CD1 4.13Å; F202-I262 HydrophobicContact CZ-CD1 3.6Å; F202-I262 HydrophobicContact CZ-CG2 4.05Å
203	Q	96.8	Very high	93	Very high	37 Å²	37	27.1 Å²	27.1	17%	0.173	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	133.3	170.7	-174	164.7	-33.8	0	0	111.6	Y68 R69 V70 D205 K245	Y68-Q203 PolarHBondContact O-N 3.48Å; R69-Q203 VanDerWaalsContact CA-O 3.24Å; R69-Q203 WeakPolarHBondContact CA-O 3.33Å; V70-Q203 PolarHBondContact N-O 3.44Å; Q203-D205 WeakPolarHBondContact CG-OD2 3.48Å; Q203-D205 VanDerWaalsContact NE2-CG 3.31Å; Q203-D205 PolarHBondContact NE2-OD1 3.43Å; Q203-D205 PolarHBondContact NE2-OD2 3.06Å; Q203-K245 HydrophobicContact CG-CD 4.35Å; Q203-K245 HydrophobicContact CG-CG 4.48Å
204	V	97.6	Very high	93.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.4	166.1	-179.3	0	0	0	0	108.6	V70 L191 L193 F202 V206 V243 F244 F266	V70-V204 HydrophobicContact CB-CG1 4.27Å; V70-V204 HydrophobicContact CB-CG2 4.17Å; V70-V204 HydrophobicContact CG2-CG2 4.43Å; V70-V204 CarbonylContact O-C 3.57Å; V70-V204 WeakPolarHBondContact O-CA 3.43Å; L191-V204 HydrophobicContact CD1-CG1 3.91Å; L193-V204 HydrophobicContact CD1-CG2 3.87Å; L193-V204 HydrophobicContact CD2-CG2 3.8Å; F202-V204 HydrophobicContact CE1-CG2 3.75Å; F202-V204 HydrophobicContact CZ-CG2 4.01Å; V204-V206 HydrophobicContact CG1-CG2 4.46Å; V204-V243 WeakPolarHBondContact O-CA 3.35Å; V204-F244 HydrophobicContact CB-CB 4.27Å; V204-F244 HydrophobicContact CG2-CD1 4.26Å; V204-F244 PolarHBondContact N-O 2.86Å; V204-F244 PolarHBondContact O-N 2.84Å; V204-F266 HydrophobicContact CG1-CD1 4.12Å; V204-F266 HydrophobicContact CG1-CE1 3.98Å; V204-F266 HydrophobicContact CG1-CZ 4.44Å
205	D	97.6	Very high	93.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.1	174.2	-66.5	-74.7	0	0	0	109.5	R69 V70 E71 S72 Q203 Y207 H241	R69-D205 IonicContact CZ-OD2 3.3Å; R69-D205 IonicContact NE-OD2 3.58Å; R69-D205 IonicContact NH2-OD2 2.95Å; V70-D205 PolarHBondContact O-N 3.07Å; E71-D205 WeakPolarHBondContact CA-O 3.46Å; E71-D205 HydrophobicContact CG-CB 4.36Å; S72-D205 PolarHBondContact N-O 2.65Å; Q203-D205 WeakPolarHBondContact CG-OD2 3.48Å; Q203-D205 VanDerWaalsContact NE2-CG 3.31Å; Q203-D205 PolarHBondContact NE2-OD1 3.43Å; Q203-D205 PolarHBondContact NE2-OD2 3.06Å; D205-Y207 HydrophobicContact CB-CD2 4.32Å; D205-Y207 HydrophobicContact CB-CE2 3.63Å; D205-H241 IonicContact OD1-CE1 3.7Å; D205-H241 IonicContact OD1-NE2 3.67Å; D205-H241 PolarHBondContact OD1-NE2 3.03Å
206	V	98.1	Very high	93.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	111	167.1	-174.4	0	0	0	0	108.7	S72 I74 L191 V204 I208 H241 V242 F266 V268	S72-V206 WeakPolarHBondContact O-CA 3.41Å; I74-V206 HydrophobicContact CD1-CG1 4.19Å; I74-V206 HydrophobicContact CG1-CG1 4.45Å; L191-V206 HydrophobicContact CD1-CG2 3.69Å; V204-V206 HydrophobicContact CG1-CG2 4.46Å; V206-I208 HydrophobicContact CG1-CG1 4.13Å; V206-H241 WeakPolarHBondContact O-CA 3.4Å; V206-V242 HydrophobicContact CB-CB 4.26Å; V206-V242 PolarHBondContact N-O 2.86Å; V206-V242 PolarHBondContact O-N 2.82Å; V206-F266 HydrophobicContact CG2-CE1 3.98Å; V206-V268 HydrophobicContact CB-CG2 4.44Å; V206-V268 HydrophobicContact CG1-CG2 4.48Å; V206-V268 HydrophobicContact CG2-CG2 4.15Å
207	Y	97.7	Very high	94.5	Very high	32 Å²	32	32.7 Å²	32.7	13%	0.125	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	129	172.2	-59.1	-83.8	0	0	0	108.8	E71 S72 R73 I74 D205 A240 H241 H567	E71-Y207 HydrophobicContact CG-CD2 4.24Å; E71-Y207 HydrophobicContact CG-CE2 4.01Å; S72-Y207 PolarHBondContact O-N 3.44Å; R73-Y207 WeakPolarHBondContact CA-O 3.42Å; R73-Y207 HydrophobicContact CG-CD2 4.32Å; I74-Y207 PolarHBondContact N-O 3.28Å; D205-Y207 HydrophobicContact CB-CD2 4.32Å; D205-Y207 HydrophobicContact CB-CE2 3.63Å; Y207-A240 CarbonylContact C-O 3.58Å; Y207-A240 WeakPolarHBondContact CA-O 3.32Å; Y207-H241 HydrophobicContact CD1-CB 4.26Å; Y207-H241 AromaticContact CD1-CD2 3.68Å; Y207-H241 AromaticContact CD1-CG 3.92Å; Y207-H241 HydrophobicContact CE1-CB 4.4Å; Y207-H241 AromaticContact CE1-CD2 3.39Å; Y207-H241 WeakPolarHBondContact CE1-CD2 3.4Å; Y207-H241 AromaticContact CE1-CE1 3.68Å; Y207-H241 AromaticContact CE1-CG 3.65Å; Y207-H241 AromaticContact CE1-ND1 3.83Å; Y207-H241 AromaticContact CE1-NE2 3.42Å; Y207-H241 WeakPolarHBondContact CE1-NE2 3.38Å; Y207-H241 AromaticContact CZ-CD2 3.78Å; Y207-H241 AromaticContact CZ-CE1 3.87Å; Y207-H241 AromaticContact CZ-NE2 3.4Å; Y207-H241 PolarHBondContact OH-NE2 2.91Å; Y207-H567 HydrophobicContact CD1-CB 3.94Å; Y207-H567 AromaticContact CD1-CG 3.63Å; Y207-H567 AromaticContact CD1-ND1 3.51Å; Y207-H567 AromaticContact CD2-ND1 3.77Å; Y207-H567 AromaticContact CE1-CE1 3.46Å; Y207-H567 VanDerWaalsContact CE1-CE1 3.46Å; Y207-H567 WeakPolarHBondContact CE1-CE1 3.36Å; Y207-H567 AromaticContact CE1-CG 3.84Å; Y207-H567 AromaticContact CE1-ND1 3.38Å; Y207-H567 WeakPolarHBondContact CE1-ND1 3.42Å; Y207-H567 AromaticContact CE1-NE2 3.95Å; Y207-H567 AromaticContact CE2-ND1 3.65Å; Y207-H567 HydrophobicContact CG-CB 3.97Å; Y207-H567 AromaticContact CG-CG 3.98Å; Y207-H567 AromaticContact CG-ND1 3.71Å; Y207-H567 AromaticContact CZ-CE1 3.46Å; Y207-H567 VanDerWaalsContact CZ-CE1 3.46Å; Y207-H567 AromaticContact CZ-ND1 3.47Å
208	I	97.8	Very high	95	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.5	175.8	-51.7	-178.1	0	0	0	108	I74 V206 E210 I214 L217 K239 A240 V268 Y270	I74-I208 HydrophobicContact CB-CG1 4.39Å; I74-I208 HydrophobicContact CB-CG2 4.44Å; I74-I208 HydrophobicContact CD1-CG1 4.23Å; I74-I208 HydrophobicContact CG1-CG1 4.45Å; I74-I208 CarbonylContact O-C 3.56Å; I74-I208 WeakPolarHBondContact O-CA 3.35Å; V206-I208 HydrophobicContact CG1-CG1 4.13Å; I208-E210 HydrophobicContact CG2-CG 4Å; I208-I214 HydrophobicContact CB-CD1 4.2Å; I208-I214 HydrophobicContact CG2-CD1 3.87Å; I208-I214 HydrophobicContact CG2-CG1 4.48Å; I208-L217 HydrophobicContact CD1-CD1 4.1Å; I208-K239 CarbonylContact O-C 3.57Å; I208-K239 VanDerWaalsContact O-CA 3.24Å; I208-K239 WeakPolarHBondContact O-CA 3.47Å; I208-A240 HydrophobicContact CB-CB 4.23Å; I208-A240 PolarHBondContact N-O 3.19Å; I208-A240 PolarHBondContact O-N 3.2Å; I208-V268 HydrophobicContact CD1-CG1 4.08Å; I208-Y270 HydrophobicContact CD1-CD1 4.08Å; I208-Y270 HydrophobicContact CD1-CE1 4.41Å; I208-Y270 HydrophobicContact CD1-CG 4.34Å; I208-Y270 HydrophobicContact CG2-CE2 4.18Å
209	Y	96.4	Very high	95.2	Very high	6 Å²	6	35.7 Å²	35.7	2%	0.024	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	122.9	170.3	-178.7	-112.6	0	0	0	110.3	I74 T75 S76 P211 D238 K239 E561 L562 Q565	I74-Y209 PolarHBondContact O-N 3.15Å; T75-Y209 WeakPolarHBondContact CA-O 3.46Å; T75-Y209 HydrophobicContact CG2-CD1 4.4Å; S76-Y209 PolarHBondContact N-O 2.77Å; Y209-P211 HydrophobicContact CE1-CG 3.96Å; Y209-D238 WeakPolarHBondContact CD2-O 3.43Å; Y209-D238 HydrophobicContact CE2-CB 4.25Å; Y209-K239 HydrophobicContact CD2-CG 3.68Å; Y209-K239 HydrophobicContact CE2-CG 4.3Å; Y209-E561 WeakPolarHBondContact OH-CG 3.44Å; Y209-E561 PolarHBondContact OH-OE1 2.96Å; Y209-E561 PolarHBondContact OH-OE2 2.83Å; Y209-L562 HydrophobicContact CD1-CD2 3.81Å; Y209-L562 HydrophobicContact CE1-CD2 3.61Å; Y209-L562 HydrophobicContact CE1-CG 4.47Å; Y209-Q565 HydrophobicContact CD2-CG 4.49Å; Y209-Q565 HydrophobicContact CE1-CG 4.06Å; Y209-Q565 HydrophobicContact CE2-CG 3.96Å; Y209-Q565 PolarHBondContact OH-NE2 3.03Å
210	E	95.9	Very high	95.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.195	C	C	.	.			trans	-134.8	107.2	-176.6	-70.3	-69.7	170.3	0	0	109.3	S76 R77 I208 K212 G213 I214 D238 Y270 V272	S76-E210 WeakPolarHBondContact CA-OE2 3.21Å; R77-E210 WeakPolarHBondContact CD-OE1 3.46Å; R77-E210 VanDerWaalsContact CD-OE2 3.25Å; R77-E210 WeakPolarHBondContact CD-OE2 3.44Å; R77-E210 IonicContact CZ-OE2 2.85Å; R77-E210 PolarHBondContact N-OE1 2.91Å; R77-E210 IonicContact NE-OE2 3.45Å; R77-E210 IonicContact NH1-OE2 3.33Å; R77-E210 PolarHBondContact NH1-OE2 2.93Å; I208-E210 HydrophobicContact CG2-CG 4Å; E210-K212 VanDerWaalsContact C-N 3.33Å; E210-K212 PolarHBondContact O-N 3.25Å; E210-G213 VanDerWaalsContact O-CA 3.28Å; E210-G213 WeakPolarHBondContact O-CA 3.47Å; E210-G213 PolarHBondContact O-N 2.93Å; E210-I214 HydrophobicContact CB-CG1 4.19Å; E210-I214 HydrophobicContact CG-CG1 4.31Å; E210-D238 PolarHBondContact N-O 2.92Å; E210-Y270 HydrophobicContact CG-CE2 3.82Å; E210-Y270 WeakPolarHBondContact OE1-CE2 3.15Å; E210-Y270 PolarHBondContact OE1-OH 3.23Å; E210-V272 HydrophobicContact CB-CG1 4Å; E210-V272 HydrophobicContact CG-CG1 3.72Å
211	P	92.3	Very high	94.6	Very high	22 Å²	22	37.6 Å²	37.6	14%	0.143	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-35.3	-170.4	-29.8	35.4	0	0	0	115.8	S76 Y209 G213 L558	S76-P211 WeakPolarHBondContact OG-CD 3.14Å; Y209-P211 HydrophobicContact CE1-CG 3.96Å; P211-G213 VanDerWaalsContact C-N 3.31Å; P211-L558 HydrophobicContact CB-CD1 4.03Å; P211-L558 HydrophobicContact CG-CD1 3.57Å
212	K	89.9	Confident	94	Very high	90 Å²	90	34.3 Å²	34.3	39%	0.391	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.4	174.7	-54.5	-55.9	176.8	-162.4	0	112.8	E210 K237 E280	E210-K212 VanDerWaalsContact C-N 3.33Å; E210-K212 PolarHBondContact O-N 3.25Å; K212-K237 PolarHBondContact O-NZ 3.02Å; K212-E280 HydrophobicContact CG-CG 4.02Å; K212-E280 VanDerWaalsContact CG-OE1 3.24Å; K212-E280 WeakPolarHBondContact CG-OE1 3.49Å
213	G	94.3	Very high	93.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.			trans	110	154	176.8	0	0	0	0	0	113.9	E210 P211 K237 V272 T273	E210-G213 VanDerWaalsContact O-CA 3.28Å; E210-G213 WeakPolarHBondContact O-CA 3.47Å; E210-G213 PolarHBondContact O-N 2.93Å; P211-G213 VanDerWaalsContact C-N 3.31Å; G213-K237 CarbonylContact C-O 3.59Å; G213-K237 WeakPolarHBondContact CA-O 3.32Å; G213-V272 CarbonylContact O-C 3.59Å; G213-V272 WeakPolarHBondContact O-CA 3.27Å; G213-T273 WeakPolarHBondContact O-CB 3.4Å; G213-T273 PolarHBondContact O-N 3Å; G213-T273 PolarHBondContact O-OG1 3.48Å; G213-T273 VanDerWaalsContact O-OG1 3.08Å
214	I	96.4	Very high	92.7	Very high	23 Å²	23	35 Å²	35	12%	0.118	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	127.1	177.6	-56.3	173.8	0	0	0	108.4	I208 E210 K216 L217 K237 A240	I208-I214 HydrophobicContact CB-CD1 4.2Å; I208-I214 HydrophobicContact CG2-CD1 3.87Å; I208-I214 HydrophobicContact CG2-CG1 4.48Å; E210-I214 HydrophobicContact CB-CG1 4.19Å; E210-I214 HydrophobicContact CG-CG1 4.31Å; I214-K216 WeakPolarHBondContact CG2-O 3.45Å; I214-L217 HydrophobicContact CG2-CB 4.32Å; I214-K237 PolarHBondContact N-O 3.21Å; I214-A240 HydrophobicContact CD1-CB 3.75Å
215	S	94.6	Very high	91.9	Very high	67 Å²	67	43.3 Å²	43.3	47%	0.469	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-29.5	179.8	62.2	0	0	0	0	113.2	D271 V272	S215-D271 PolarHBondContact N-O 3.12Å; S215-D271 VanDerWaalsContact OG-C 3.26Å; S215-D271 PolarHBondContact OG-O 2.67Å; S215-D271 VanDerWaalsContact OG-O 3.13Å; S215-V272 WeakPolarHBondContact CB-O 3.18Å; S215-V272 PolarHBondContact OG-N 3.36Å; S215-V272 PolarHBondContact OG-O 3.45Å
216	K	94.8	Very high	91.2	Very high	97 Å²	97	50.2 Å²	50.2	42%	0.422	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	143.5	177.2	-164.3	-171.1	-171.9	-154.8	0	109.9	I214 E218 Y270 D271	I214-K216 WeakPolarHBondContact CG2-O 3.45Å; K216-E218 WeakPolarHBondContact CE-OE1 3.44Å; K216-E218 WeakPolarHBondContact CE-OE2 3.4Å; K216-E218 IonicContact NZ-OE1 3.31Å; K216-E218 PolarHBondContact NZ-OE1 2.87Å; K216-E218 IonicContact NZ-OE2 2.68Å; K216-E218 PolarHBondContact NZ-OE2 2.83Å; K216-Y270 CarbonylContact O-C 3.57Å; K216-Y270 WeakPolarHBondContact O-CA 3.24Å; K216-Y270 VanDerWaalsContact O-CB 3.28Å; K216-Y270 WeakPolarHBondContact O-CB 3.42Å; K216-D271 PolarHBondContact N-O 2.91Å; K216-D271 PolarHBondContact O-N 3.44Å; K216-D271 VanDerWaalsContact O-N 3.08Å
217	L	96.3	Very high	90.6	Very high	42 Å²	42	50.4 Å²	50.4	22%	0.22	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	131.7	172.9	-179.6	63.7	0	0	0	109.9	I208 I214 V233 A235 A240 V268 K269	I208-L217 HydrophobicContact CD1-CD1 4.1Å; I214-L217 HydrophobicContact CG2-CB 4.32Å; L217-V233 HydrophobicContact CD2-CG1 3.52Å; L217-V233 HydrophobicContact CG-CG1 4.38Å; L217-A235 HydrophobicContact CD2-CB 4.3Å; L217-A240 HydrophobicContact CD2-CB 3.49Å; L217-A240 VanDerWaalsContact CD2-CB 3.49Å; L217-V268 HydrophobicContact CD1-CG1 3.71Å; L217-K269 CarbonylContact C-O 3.48Å; L217-K269 WeakPolarHBondContact CA-O 3.36Å
218	E	95.1	Very high	89.8	Confident	86 Å²	86	52.4 Å²	52.4	40%	0.402	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	141.1	179.9	-74	173.6	151.9	0	0	110.7	K216 P220 K269	K216-E218 WeakPolarHBondContact CE-OE1 3.44Å; K216-E218 WeakPolarHBondContact CE-OE2 3.4Å; K216-E218 IonicContact NZ-OE1 3.31Å; K216-E218 PolarHBondContact NZ-OE1 2.87Å; K216-E218 IonicContact NZ-OE2 2.68Å; K216-E218 PolarHBondContact NZ-OE2 2.83Å; E218-P220 WeakPolarHBondContact O-CD 3.47Å; E218-K269 HydrophobicContact CB-CB 4.22Å; E218-K269 PolarHBondContact N-O 2.87Å; E218-K269 PolarHBondContact O-N 3Å
219	T	93.4	Very high	89.1	Confident	40 Å²	40	59.6 Å²	59.6	25%	0.245	31%	0.313	C	S	.	.			trans	-120.9	80	174.6	52.9	0	0	0	0	108.9	I231 V233 V242 V268	T219-I231 HydrophobicContact CG2-CG2 4.02Å; T219-V233 HydrophobicContact CG2-CG2 3.89Å; T219-V242 HydrophobicContact CG2-CG1 3.74Å; T219-V242 HydrophobicContact CG2-CG2 4.23Å; T219-V268 HydrophobicContact CG2-CG2 4.5Å
220	P	90.7	Very high	88.8	Confident	43 Å²	43	61.3 Å²	61.3	28%	0.279	32%	0.322	S	S	.	.			trans	-62.7	143.1	-179.1	27.9	-36.1	0	0	0	110.7	E218 T222 K269	E218-P220 WeakPolarHBondContact O-CD 3.47Å; P220-T222 VanDerWaalsContact C-N 3.31Å; P220-T222 HydrophobicContact CG-CG2 4.42Å; P220-T222 PolarHBondContact O-N 3.18Å; P220-K269 HydrophobicContact CG-CD 4.09Å; P220-K269 HydrophobicContact CG-CG 4.44Å
221	N	80.8	Confident	88.6	Confident	65 Å²	65	62.7 Å²	62.7	35%	0.348	33%	0.329	S	S	.	.			trans	-77.4	78.7	-177.3	-174.4	21.6	0	0	0	112.6	G224 V228	N221-G224 PolarHBondContact ND2-O 3.45Å; N221-G224 PolarHBondContact OD1-N 2.91Å; N221-G224 PolarHBondContact OD1-O 3.17Å; N221-V228 VanDerWaalsContact ND2-CG2 3.29Å; N221-V228 WeakPolarHBondContact ND2-CG2 3.48Å
222	T	82.6	Confident	88.7	Confident	62 Å²	62	68.2 Å²	68.2	38%	0.38	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2.3	178	49.4	0	0	0	0	114	P220 I265 S267	P220-T222 VanDerWaalsContact C-N 3.31Å; P220-T222 HydrophobicContact CG-CG2 4.42Å; P220-T222 PolarHBondContact O-N 3.18Å; T222-I265 CarbonylContact C-O 3.45Å; T222-I265 VanDerWaalsContact C-O 3.28Å; T222-I265 VanDerWaalsContact CB-O 3.23Å; T222-I265 WeakPolarHBondContact CB-O 3.43Å; T222-I265 PolarHBondContact OG1-O 2.97Å; T222-S267 PolarHBondContact OG1-N 2.81Å; T222-S267 PolarHBondContact OG1-OG 2.85Å
223	L	83.9	Confident	89	Confident	21 Å²	21	67.1 Å²	67.1	11%	0.11	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-6.3	174.9	-66	177.2	0	0	0	113.7	L193 F227 F244 I265 F266	L193-L223 HydrophobicContact CD1-CD1 4.19Å; L193-L223 HydrophobicContact CD1-CD2 4.48Å; L223-F227 HydrophobicContact CB-CB 4.35Å; L223-F227 HydrophobicContact CB-CD2 3.68Å; L223-F227 HydrophobicContact CB-CE2 4.37Å; L223-F227 HydrophobicContact CB-CG 4.3Å; L223-F227 WeakPolarHBondContact O-CD2 3.33Å; L223-F244 HydrophobicContact CD1-CD1 4.19Å; L223-F244 HydrophobicContact CD1-CE1 3.53Å; L223-F244 HydrophobicContact CD1-CE2 4.38Å; L223-F244 HydrophobicContact CD1-CZ 3.63Å; L223-I265 VanDerWaalsContact CD2-O 3.29Å; L223-I265 WeakPolarHBondContact CD2-O 3.47Å; L223-I265 WeakPolarHBondContact CG-O 3.48Å; L223-F266 HydrophobicContact CD1-CB 4.35Å; L223-F266 HydrophobicContact CD1-CD2 4.02Å
224	G	80.9	Confident	89	Confident	35 Å²	35	72 Å²	72	36%	0.361	38%	0.384	S	S	.	.			trans	95.9	163.3	179	0	0	0	0	0	114.5	N221 R226 F227	N221-G224 PolarHBondContact ND2-O 3.45Å; N221-G224 PolarHBondContact OD1-N 2.91Å; N221-G224 PolarHBondContact OD1-O 3.17Å; G224-R226 PolarHBondContact O-N 2.76Å; G224-R226 VanDerWaalsContact O-N 3.07Å; G224-F227 PolarHBondContact O-N 3.33Å
225	E	80.9	Confident	89	Confident	175 Å²	175	73.8 Å²	73.8	82%	0.818	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-59.5	-28.3	-163	-61.4	-175.6	156.3	0	0	114.8	F227 V228	E225-F227 PolarHBondContact O-N 3.04Å; E225-F227 VanDerWaalsContact O-N 3.09Å; E225-V228 WeakPolarHBondContact O-CB 3.49Å; E225-V228 VanDerWaalsContact O-CG2 3.27Å; E225-V228 WeakPolarHBondContact O-CG2 3.46Å; E225-V228 PolarHBondContact O-N 3.5Å
226	R	82	Confident	88.9	Confident	145 Å²	145	74.2 Å²	74.2	55%	0.547	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-57.8	-23.4	176.1	-178.7	167.4	-67.4	171.8	7	114	G224 R252 K253	G224-R226 PolarHBondContact O-N 2.76Å; G224-R226 VanDerWaalsContact O-N 3.07Å; R226-R252 PolarHBondContact NH1-O 3.46Å; R226-K253 PolarHBondContact NH1-O 2.83Å
227	F	86.3	Confident	88.8	Confident	4 Å²	4	75.9 Å²	75.9	2%	0.018	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-104.6	8.2	-176.4	-55	-70.6	0	0	0	114.2	L223 G224 E225 N229 L230 F244 A261 I262	L223-F227 HydrophobicContact CB-CB 4.35Å; L223-F227 HydrophobicContact CB-CD2 3.68Å; L223-F227 HydrophobicContact CB-CE2 4.37Å; L223-F227 HydrophobicContact CB-CG 4.3Å; L223-F227 WeakPolarHBondContact O-CD2 3.33Å; G224-F227 PolarHBondContact O-N 3.33Å; E225-F227 PolarHBondContact O-N 3.04Å; E225-F227 VanDerWaalsContact O-N 3.09Å; F227-N229 PolarHBondContact O-N 2.83Å; F227-L230 HydrophobicContact CD1-CD1 4.15Å; F227-L230 PolarHBondContact O-N 2.83Å; F227-F244 HydrophobicContact CB-CE2 4.04Å; F227-F244 HydrophobicContact CB-CZ 4.26Å; F227-F244 AromaticContact CD1-CE2 3.91Å; F227-F244 HydrophobicContact CD1-CE2 3.91Å; F227-F244 AromaticContact CD1-CZ 3.65Å; F227-F244 HydrophobicContact CD1-CZ 3.65Å; F227-F244 HydrophobicContact CE1-CZ 4.2Å; F227-F244 HydrophobicContact CG-CE2 4.22Å; F227-F244 HydrophobicContact CG-CZ 4Å; F227-A261 HydrophobicContact CE2-CB 4.3Å; F227-A261 WeakPolarHBondContact CE2-O 3.21Å; F227-A261 HydrophobicContact CZ-CB 3.73Å; F227-I262 HydrophobicContact CE1-CG1 3.91Å; F227-I262 HydrophobicContact CZ-CG1 3.7Å
228	V	79.4	Confident	88.7	Confident	74 Å²	74	75.8 Å²	75.8	45%	0.448	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	138.5	171.9	170.9	0	0	0	0	110.5	N221 E225 L230	N221-V228 VanDerWaalsContact ND2-CG2 3.29Å; N221-V228 WeakPolarHBondContact ND2-CG2 3.48Å; E225-V228 WeakPolarHBondContact O-CB 3.49Å; E225-V228 VanDerWaalsContact O-CG2 3.27Å; E225-V228 WeakPolarHBondContact O-CG2 3.46Å; E225-V228 PolarHBondContact O-N 3.5Å; V228-L230 PolarHBondContact O-N 3.3Å
229	N	83.8	Confident	88.7	Confident	155 Å²	155	75 Å²	75	83%	0.829	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	5.2	-179.1	-56.2	-23.8	0	0	0	116.5	F227	F227-N229 PolarHBondContact O-N 2.83Å
230	L	89.8	Confident	88.9	Confident	41 Å²	41	73.3 Å²	73.3	22%	0.215	39%	0.394	C	S	.	.			trans	-88.7	-6.3	173.9	-58	-172.2	0	0	0	113.8	F227 V228 F244 P246 Q250	F227-L230 HydrophobicContact CD1-CD1 4.15Å; F227-L230 PolarHBondContact O-N 2.83Å; V228-L230 PolarHBondContact O-N 3.3Å; L230-F244 HydrophobicContact CB-CD2 4.23Å; L230-F244 HydrophobicContact CB-CE2 4.05Å; L230-P246 HydrophobicContact CD1-CB 4.26Å; L230-Q250 HydrophobicContact CD1-CB 4.23Å; L230-Q250 HydrophobicContact CD1-CG 4.16Å
231	I	92.5	Very high	89.2	Confident	30 Å²	30	73.7 Å²	73.7	15%	0.154	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	114.5	173.1	-49.9	178.9	0	0	0	108	T219 V233 V242 V243 F244 F266	T219-I231 HydrophobicContact CG2-CG2 4.02Å; I231-V233 HydrophobicContact CG2-CG2 4.47Å; I231-V242 HydrophobicContact CG2-CG1 3.48Å; I231-V242 VanDerWaalsContact CG2-CG1 3.48Å; I231-V243 WeakPolarHBondContact CA-O 3.48Å; I231-F244 HydrophobicContact CG1-CD2 4.04Å; I231-F266 HydrophobicContact CD1-CD2 4.25Å; I231-F266 HydrophobicContact CD1-CE2 3.73Å; I231-F266 HydrophobicContact CG1-CE2 3.99Å; I231-F266 HydrophobicContact CG2-CE2 4.07Å; I231-F266 HydrophobicContact CG2-CZ 4.17Å
232	Q	94.4	Very high	90	Very high	137 Å²	137	70.6 Å²	70.6	64%	0.64	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	134.9	176.2	-65.4	-177.8	-16.8	0	0	109.7	V242 V243	Q232-V242 CarbonylContact O-C 3.53Å; Q232-V242 WeakPolarHBondContact O-CA 3.08Å; Q232-V243 HydrophobicContact CB-CB 4.42Å; Q232-V243 PolarHBondContact N-O 2.82Å; Q232-V243 PolarHBondContact O-N 3.15Å
233	V	95.5	Very high	90.7	Very high	68 Å²	68	68.7 Å²	68.7	41%	0.412	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118.5	-178.9	-179.3	0	0	0	0	109.1	L217 T219 I231 V242	L217-V233 HydrophobicContact CD2-CG1 3.52Å; L217-V233 HydrophobicContact CG-CG1 4.38Å; T219-V233 HydrophobicContact CG2-CG2 3.89Å; I231-V233 HydrophobicContact CG2-CG2 4.47Å; V233-V242 HydrophobicContact CG2-CG1 4.22Å; V233-V242 HydrophobicContact CG2-CG2 4.35Å
234	T	95.8	Very high	91.3	Very high	101 Å²	101	67.7 Å²	67.7	62%	0.62	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.7	170	-57.2	0	0	0	0	108.4	A240 H241	T234-A240 CarbonylContact O-C 3.59Å; T234-A240 WeakPolarHBondContact O-CA 3.41Å; T234-H241 PolarHBondContact N-O 2.99Å; T234-H241 PolarHBondContact O-N 2.91Å
235	A	94.6	Very high	92	Very high	61 Å²	61	72.2 Å²	72.2	50%	0.504	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.6	-177.5	0	0	0	0	0	112.7	L217 K239 A240	L217-A235 HydrophobicContact CD2-CB 4.3Å; A235-K239 WeakPolarHBondContact CA-O 3.29Å; A235-A240 HydrophobicContact CB-CB 4.2Å
236	T	93.6	Very high	92.6	Very high	77 Å²	77	64 Å²	64	47%	0.472	33%	0.331	S	S	.	.			trans	-114.9	-164.9	168.9	64.6	0	0	0	0	109	D238 K239	T236-D238 VanDerWaalsContact C-N 3.3Å; T236-D238 WeakPolarHBondContact CB-OD1 3.38Å; T236-D238 PolarHBondContact OG1-N 2.85Å; T236-D238 PolarHBondContact OG1-OD1 2.83Å; T236-K239 PolarHBondContact N-O 2.85Å; T236-K239 WeakPolarHBondContact OG1-CB 3.29Å; T236-K239 PolarHBondContact OG1-N 2.88Å; T236-K239 PolarHBondContact OG1-O 3.04Å
237	K	92.9	Very high	93.1	Very high	132 Å²	132	61.1 Å²	61.1	57%	0.574	33%	0.326	S	S	*	.	S	Bend	trans	-66.7	-35.3	172.4	-166.8	-135.7	170.1	-155.6	0	111.8	K212 G213 I214	K212-K237 PolarHBondContact O-NZ 3.02Å; G213-K237 CarbonylContact C-O 3.59Å; G213-K237 WeakPolarHBondContact CA-O 3.32Å; I214-K237 PolarHBondContact N-O 3.21Å
238	D	94.1	Very high	93.3	Very high	40 Å²	40	64.5 Å²	64.5	21%	0.214	34%	0.344	C	S	.	.	S	Bend	trans	-112.9	-21.9	-164.6	58.4	-50.7	0	0	0	113.9	Y209 E210 T236	Y209-D238 WeakPolarHBondContact CD2-O 3.43Å; Y209-D238 HydrophobicContact CE2-CB 4.25Å; E210-D238 PolarHBondContact N-O 2.92Å; T236-D238 VanDerWaalsContact C-N 3.3Å; T236-D238 WeakPolarHBondContact CB-OD1 3.38Å; T236-D238 PolarHBondContact OG1-N 2.85Å; T236-D238 PolarHBondContact OG1-OD1 2.83Å
239	K	95.7	Very high	93.7	Very high	69 Å²	69	67.9 Å²	67.9	30%	0.3	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	152.4	-172.9	-65.8	164	177.5	99.2	0	112	I208 Y209 A235 T236 Q565	I208-K239 CarbonylContact O-C 3.57Å; I208-K239 VanDerWaalsContact O-CA 3.24Å; I208-K239 WeakPolarHBondContact O-CA 3.47Å; Y209-K239 HydrophobicContact CD2-CG 3.68Å; Y209-K239 HydrophobicContact CE2-CG 4.3Å; A235-K239 WeakPolarHBondContact CA-O 3.29Å; T236-K239 PolarHBondContact N-O 2.85Å; T236-K239 WeakPolarHBondContact OG1-CB 3.29Å; T236-K239 PolarHBondContact OG1-N 2.88Å; T236-K239 PolarHBondContact OG1-O 3.04Å; K239-Q565 VanDerWaalsContact NZ-CD 3.35Å
240	A	97.1	Very high	93.9	Very high	5 Å²	5	63.2 Å²	63.2	4%	0.041	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.6	158.9	0	0	0	0	0	111.4	Y207 I208 I214 L217 T234 A235	Y207-A240 CarbonylContact C-O 3.58Å; Y207-A240 WeakPolarHBondContact CA-O 3.32Å; I208-A240 HydrophobicContact CB-CB 4.23Å; I208-A240 PolarHBondContact N-O 3.19Å; I208-A240 PolarHBondContact O-N 3.2Å; I214-A240 HydrophobicContact CD1-CB 3.75Å; L217-A240 HydrophobicContact CD2-CB 3.49Å; L217-A240 VanDerWaalsContact CD2-CB 3.49Å; T234-A240 CarbonylContact O-C 3.59Å; T234-A240 WeakPolarHBondContact O-CA 3.41Å; A235-A240 HydrophobicContact CB-CB 4.2Å
241	H	97.4	Very high	93.9	Very high	50 Å²	50	61.3 Å²	61.3	23%	0.231	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	116	167.7	-178	-157	0	0	0	107.8	D205 V206 Y207 T234 V243	D205-H241 IonicContact OD1-CE1 3.7Å; D205-H241 IonicContact OD1-NE2 3.67Å; D205-H241 PolarHBondContact OD1-NE2 3.03Å; V206-H241 WeakPolarHBondContact O-CA 3.4Å; Y207-H241 HydrophobicContact CD1-CB 4.26Å; Y207-H241 AromaticContact CD1-CD2 3.68Å; Y207-H241 AromaticContact CD1-CG 3.92Å; Y207-H241 HydrophobicContact CE1-CB 4.4Å; Y207-H241 AromaticContact CE1-CD2 3.39Å; Y207-H241 WeakPolarHBondContact CE1-CD2 3.4Å; Y207-H241 AromaticContact CE1-CE1 3.68Å; Y207-H241 AromaticContact CE1-CG 3.65Å; Y207-H241 AromaticContact CE1-ND1 3.83Å; Y207-H241 AromaticContact CE1-NE2 3.42Å; Y207-H241 WeakPolarHBondContact CE1-NE2 3.38Å; Y207-H241 AromaticContact CZ-CD2 3.78Å; Y207-H241 AromaticContact CZ-CE1 3.87Å; Y207-H241 AromaticContact CZ-NE2 3.4Å; Y207-H241 PolarHBondContact OH-NE2 2.91Å; T234-H241 PolarHBondContact N-O 2.99Å; T234-H241 PolarHBondContact O-N 2.91Å; H241-V243 WeakPolarHBondContact CE1-CG2 3.32Å; H241-V243 VanDerWaalsContact NE2-CG2 3.25Å; H241-V243 WeakPolarHBondContact NE2-CG2 3.05Å
242	V	97.3	Very high	93.7	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	126.4	173.1	-172.6	0	0	0	0	108.1	V206 T219 I231 Q232 V233 F266 V268	V206-V242 HydrophobicContact CB-CB 4.26Å; V206-V242 PolarHBondContact N-O 2.86Å; V206-V242 PolarHBondContact O-N 2.82Å; T219-V242 HydrophobicContact CG2-CG1 3.74Å; T219-V242 HydrophobicContact CG2-CG2 4.23Å; I231-V242 HydrophobicContact CG2-CG1 3.48Å; I231-V242 VanDerWaalsContact CG2-CG1 3.48Å; Q232-V242 CarbonylContact O-C 3.53Å; Q232-V242 WeakPolarHBondContact O-CA 3.08Å; V233-V242 HydrophobicContact CG2-CG1 4.22Å; V233-V242 HydrophobicContact CG2-CG2 4.35Å; V242-F266 HydrophobicContact CG1-CE1 4.44Å; V242-F266 HydrophobicContact CG1-CZ 3.79Å; V242-V268 HydrophobicContact CG1-CG2 4.48Å; V242-V268 HydrophobicContact CG2-CG1 4.21Å; V242-V268 HydrophobicContact CG2-CG2 4.44Å
243	V	97.1	Very high	93.2	Very high	22 Å²	22	65 Å²	65	13%	0.133	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.4	-179.9	179.2	0	0	0	0	109.7	V204 I231 Q232 H241 K245	V204-V243 WeakPolarHBondContact O-CA 3.35Å; I231-V243 WeakPolarHBondContact CA-O 3.48Å; Q232-V243 HydrophobicContact CB-CB 4.42Å; Q232-V243 PolarHBondContact N-O 2.82Å; Q232-V243 PolarHBondContact O-N 3.15Å; H241-V243 WeakPolarHBondContact CE1-CG2 3.32Å; H241-V243 VanDerWaalsContact NE2-CG2 3.25Å; H241-V243 WeakPolarHBondContact NE2-CG2 3.05Å; V243-K245 HydrophobicContact CG1-CB 4.12Å
244	F	96.1	Very high	92.6	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114.1	167.1	172.8	-117.4	0	0	0	109.4	L193 F202 V204 L223 F227 L230 I231 P246 I262 F266	L193-F244 HydrophobicContact CD1-CD1 4.21Å; L193-F244 HydrophobicContact CD1-CE1 4.19Å; F202-F244 AromaticContact CE1-CD1 3.85Å; F202-F244 HydrophobicContact CE1-CD1 3.85Å; F202-F244 AromaticContact CE1-CE1 3.84Å; F202-F244 HydrophobicContact CE1-CE1 3.84Å; F202-F244 HydrophobicContact CZ-CE1 4.45Å; V204-F244 HydrophobicContact CB-CB 4.27Å; V204-F244 HydrophobicContact CG2-CD1 4.26Å; V204-F244 PolarHBondContact N-O 2.86Å; V204-F244 PolarHBondContact O-N 2.84Å; L223-F244 HydrophobicContact CD1-CD1 4.19Å; L223-F244 HydrophobicContact CD1-CE1 3.53Å; L223-F244 HydrophobicContact CD1-CE2 4.38Å; L223-F244 HydrophobicContact CD1-CZ 3.63Å; F227-F244 HydrophobicContact CB-CE2 4.04Å; F227-F244 HydrophobicContact CB-CZ 4.26Å; F227-F244 AromaticContact CD1-CE2 3.91Å; F227-F244 HydrophobicContact CD1-CE2 3.91Å; F227-F244 AromaticContact CD1-CZ 3.65Å; F227-F244 HydrophobicContact CD1-CZ 3.65Å; F227-F244 HydrophobicContact CE1-CZ 4.2Å; F227-F244 HydrophobicContact CG-CE2 4.22Å; F227-F244 HydrophobicContact CG-CZ 4Å; L230-F244 HydrophobicContact CB-CD2 4.23Å; L230-F244 HydrophobicContact CB-CE2 4.05Å; I231-F244 HydrophobicContact CG1-CD2 4.04Å; F244-P246 HydrophobicContact CE1-CG 3.93Å; F244-P246 HydrophobicContact CE2-CB 4.35Å; F244-P246 HydrophobicContact CE2-CG 3.92Å; F244-P246 HydrophobicContact CZ-CB 4.36Å; F244-P246 HydrophobicContact CZ-CG 3.6Å; F244-I262 HydrophobicContact CE1-CD1 4.11Å; F244-I262 HydrophobicContact CZ-CD1 4.37Å; F244-F266 HydrophobicContact CB-CD2 4.29Å; F244-F266 HydrophobicContact CB-CE2 3.56Å; F244-F266 HydrophobicContact CB-CZ 4.07Å; F244-F266 HydrophobicContact CD1-CD2 4.24Å; F244-F266 HydrophobicContact CD1-CE2 4.34Å; F244-F266 HydrophobicContact CG-CD2 4.34Å; F244-F266 HydrophobicContact CG-CE2 4.01Å
245	K	95.2	Very high	91.6	Very high	130 Å²	130	67.2 Å²	67.2	57%	0.565	33%	0.333	S	S	*	.			trans	-140.1	60.3	-169.5	-164.6	173.9	-177.9	158.7	0	112.7	Q203 V243	Q203-K245 HydrophobicContact CG-CD 4.35Å; Q203-K245 HydrophobicContact CG-CG 4.48Å; V243-K245 HydrophobicContact CG1-CB 4.12Å
246	P	94.1	Very high	90.7	Very high	4 Å²	4	72 Å²	72	3%	0.026	35%	0.349	C	S	.	.			trans	-64.9	139.6	177.7	28.3	-36.9	0	0	0	112.1	F202 L230 F244 Q250 Q251 I262	F202-P246 HydrophobicContact CD1-CG 3.98Å; F202-P246 HydrophobicContact CE1-CG 4.37Å; L230-P246 HydrophobicContact CD1-CB 4.26Å; F244-P246 HydrophobicContact CE1-CG 3.93Å; F244-P246 HydrophobicContact CE2-CB 4.35Å; F244-P246 HydrophobicContact CE2-CG 3.92Å; F244-P246 HydrophobicContact CZ-CB 4.36Å; F244-P246 HydrophobicContact CZ-CG 3.6Å; P246-Q250 HydrophobicContact CB-CB 4Å; P246-Q251 HydrophobicContact CB-CG 4.14Å; P246-Q251 HydrophobicContact CG-CG 4.05Å; P246-Q251 PolarHBondContact O-NE2 2.88Å; P246-I262 HydrophobicContact CG-CD1 3.67Å
247	N	91.9	Very high	89.7	Confident	84 Å²	84	70.3 Å²	70.3	45%	0.449	34%	0.341	S	S	.	.			trans	-76	168.4	175.6	71.3	48.7	0	0	0	112.3	H249 Q250 Q251	N247-H249 PolarHBondContact O-N 2.77Å; N247-H249 VanDerWaalsContact O-N 3.13Å; N247-H249 WeakPolarHBondContact OD1-CB 3.25Å; N247-H249 PolarHBondContact OD1-N 3Å; N247-Q250 VanDerWaalsContact ND2-CD 3.34Å; N247-Q250 PolarHBondContact ND2-OE1 2.92Å; N247-Q250 PolarHBondContact O-N 3.14Å; N247-Q250 VanDerWaalsContact O-N 3.15Å; N247-Q250 PolarHBondContact OD1-N 3.03Å; N247-Q251 WeakPolarHBondContact O-CG 3.28Å; N247-Q251 PolarHBondContact O-N 2.85Å
248	L	90.3	Very high	88.8	Confident	74 Å²	74	67.8 Å²	67.8	39%	0.387	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-30.4	-177.8	-82.9	172.4	0	0	0	114.9	P198 P200 R252	P198-L248 HydrophobicContact CB-CD2 3.82Å; P200-L248 HydrophobicContact CB-CD1 4.2Å; P200-L248 HydrophobicContact CG-CD1 4.25Å; P200-L248 HydrophobicContact CG-CD2 4.37Å; L248-R252 PolarHBondContact O-N 3Å
249	H	87.9	Confident	88.1	Confident	145 Å²	145	67 Å²	67	67%	0.671	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-45.5	178.2	179.3	72.6	0	0	0	110.8	N247 Q251 R252	N247-H249 PolarHBondContact O-N 2.77Å; N247-H249 VanDerWaalsContact O-N 3.13Å; N247-H249 WeakPolarHBondContact OD1-CB 3.25Å; N247-H249 PolarHBondContact OD1-N 3Å; H249-Q251 PolarHBondContact O-N 2.89Å; H249-R252 PolarHBondContact O-N 3.17Å; H249-R252 VanDerWaalsContact O-N 3.16Å
250	Q	89.2	Confident	87.6	Confident	58 Å²	58	64.2 Å²	64.2	27%	0.271	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.5	173.5	-68.3	165.8	-27.4	0	0	112.7	L230 P246 N247	L230-Q250 HydrophobicContact CD1-CB 4.23Å; L230-Q250 HydrophobicContact CD1-CG 4.16Å; P246-Q250 HydrophobicContact CB-CB 4Å; N247-Q250 VanDerWaalsContact ND2-CD 3.34Å; N247-Q250 PolarHBondContact ND2-OE1 2.92Å; N247-Q250 PolarHBondContact O-N 3.14Å; N247-Q250 VanDerWaalsContact O-N 3.15Å; N247-Q250 PolarHBondContact OD1-N 3.03Å
251	Q	90.3	Very high	87.1	Confident	1 Å²	1	65 Å²	65	1%	0.005	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-20.7	177.5	-73.1	180	51.5	0	0	114.9	P198 V199 P246 N247 H249 S260 A261 I262	P198-Q251 HydrophobicContact CB-CB 4.22Å; V199-Q251 PolarHBondContact O-NE2 2.81Å; V199-Q251 PolarHBondContact O-OE1 2.82Å; P246-Q251 HydrophobicContact CB-CG 4.14Å; P246-Q251 HydrophobicContact CG-CG 4.05Å; P246-Q251 PolarHBondContact O-NE2 2.88Å; N247-Q251 WeakPolarHBondContact O-CG 3.28Å; N247-Q251 PolarHBondContact O-N 2.85Å; H249-Q251 PolarHBondContact O-N 2.89Å; Q251-S260 CarbonylContact O-C 3.55Å; Q251-S260 WeakPolarHBondContact O-CA 3.37Å; Q251-A261 PolarHBondContact O-N 3.26Å; Q251-I262 HydrophobicContact CG-CD1 3.86Å; Q251-I262 HydrophobicContact CG-CG1 4.46Å
252	R	87.8	Confident	86.8	Confident	114 Å²	114	62.7 Å²	62.7	43%	0.43	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-68.6	138.3	-177.7	-77.7	-176.6	-170.4	-168.3	3.7	111	P198 R226 L248 H249 E255	P198-R252 HydrophobicContact CG-CG 4.18Å; R226-R252 PolarHBondContact NH1-O 3.46Å; L248-R252 PolarHBondContact O-N 3Å; H249-R252 PolarHBondContact O-N 3.17Å; H249-R252 VanDerWaalsContact O-N 3.16Å; R252-E255 PolarHBondContact NH1-O 3.4Å
253	K	84.3	Confident	86.3	Confident	130 Å²	130	67.4 Å²	67.4	57%	0.565	35%	0.351	S	S	*	.	S	Bend	trans	-69	-40.5	172.7	-164.3	165.2	-174.7	166.9	0	111.9	R226 G259	R226-K253 PolarHBondContact NH1-O 2.83Å; K253-G259 WeakPolarHBondContact CB-O 3.4Å; K253-G259 PolarHBondContact N-O 3.42Å
254	C	81	Confident	85.9	Confident	64 Å²	64	67.5 Å²	67.5	43%	0.432	36%	0.357	S	S	.	.	S	Bend	trans	-148.8	166.3	175.4	76.2	0	0	0	0	109.4	N256 C257	C254-N256 VanDerWaalsContact C-N 3.32Å; C254-N256 PolarHBondContact O-N 3.39Å; C254-C257 VanDerWaalsContact CA-SG 3.51Å; C254-C257 WeakPolarHBondContact CB-SG 3.4Å; C254-C257 PolarHBondContact N-SG 2.89Å; C254-C257 WeakPolarHBondContact SG-CB 3.42Å; C254-C257 PolarHBondContact SG-N 3.39Å; C254-C257 VanDerWaalsContact SG-N 3.41Å; C254-C257 CovalentContact SG-SG 2.04Å; C254-C257 PolarHBondContact SG-SG 3.07Å
255	E	74.9	Confident	85.6	Confident	152 Å²	152	70.2 Å²	70.2	71%	0.71	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-41.9	-170.9	-58.2	-170.6	133	0	0	113.6	R252	R252-E255 PolarHBondContact NH1-O 3.4Å
256	N	75.7	Confident	85.5	Confident	160 Å²	160	64.1 Å²	64.1	86%	0.856	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	15.7	-171.5	-72.3	-24	0	0	0	115	C254	C254-N256 VanDerWaalsContact C-N 3.32Å; C254-N256 PolarHBondContact O-N 3.39Å
257	C	74.1	Confident	85.5	Confident	43 Å²	43	64 Å²	64	29%	0.291	34%	0.344	S	S	.	.			trans	-112.5	148.8	178.6	51.2	0	0	0	0	114	C254 G259	C254-C257 VanDerWaalsContact CA-SG 3.51Å; C254-C257 WeakPolarHBondContact CB-SG 3.4Å; C254-C257 PolarHBondContact N-SG 2.89Å; C254-C257 WeakPolarHBondContact SG-CB 3.42Å; C254-C257 PolarHBondContact SG-N 3.39Å; C254-C257 VanDerWaalsContact SG-N 3.41Å; C254-C257 CovalentContact SG-SG 2.04Å; C254-C257 PolarHBondContact SG-SG 3.07Å; C257-G259 VanDerWaalsContact C-N 3.28Å; C257-G259 PolarHBondContact O-N 2.8Å
258	S	73.1	Confident	85.7	Confident	79 Å²	79	60 Å²	60	55%	0.552	32%	0.322	S	S	*	.	S	Bend	trans	-79.2	-2.7	179.1	50.9	0	0	0	0	114.5	P198	P198-S258 WeakPolarHBondContact CD-O 3.44Å
259	G	79.7	Confident	86	Confident	24 Å²	24	59.6 Å²	59.6	25%	0.247	32%	0.317	C	S	.	.			trans	-85	142.2	-179.2	0	0	0	0	0	113.6	K253 C257	K253-G259 WeakPolarHBondContact CB-O 3.4Å; K253-G259 PolarHBondContact N-O 3.42Å; C257-G259 VanDerWaalsContact C-N 3.28Å; C257-G259 PolarHBondContact O-N 2.8Å
260	S	85.2	Confident	86.4	Confident	9 Å²	9	52.8 Å²	52.8	6%	0.063	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-74.9	149.7	171.5	-163.4	0	0	0	0	112	G196 Q251 I262	G196-S260 PolarHBondContact O-N 2.98Å; Q251-S260 CarbonylContact O-C 3.55Å; Q251-S260 WeakPolarHBondContact O-CA 3.37Å; S260-I262 PolarHBondContact OG-N 2.73Å
261	A	87.6	Confident	86.8	Confident	23 Å²	23	50.9 Å²	50.9	19%	0.19	28%	0.277	C	S	.	.	S	Bend	trans	-85.3	-14.1	162.2	0	0	0	0	0	112.4	F227 Q251 D263	F227-A261 HydrophobicContact CE2-CB 4.3Å; F227-A261 WeakPolarHBondContact CE2-O 3.21Å; F227-A261 HydrophobicContact CZ-CB 3.73Å; Q251-A261 PolarHBondContact O-N 3.26Å; A261-D263 PolarHBondContact O-N 3.39Å
262	I	89.4	Confident	87	Confident	1 Å²	1	51 Å²	51	1%	0.005	28%	0.278	C	S	.	.			trans	-80.4	98.9	172.6	-54.4	179.1	0	0	0	107.8	L193 P195 F202 F227 F244 P246 Q251 S260	L193-I262 HydrophobicContact CB-CG2 3.64Å; L193-I262 HydrophobicContact CD1-CG2 4.33Å; P195-I262 WeakPolarHBondContact CD-O 3.25Å; P195-I262 HydrophobicContact CG-CB 4.03Å; P195-I262 HydrophobicContact CG-CG2 4.19Å; F202-I262 HydrophobicContact CD1-CD1 3.99Å; F202-I262 HydrophobicContact CD2-CD1 4.01Å; F202-I262 HydrophobicContact CE1-CD1 3.71Å; F202-I262 HydrophobicContact CE2-CD1 3.75Å; F202-I262 HydrophobicContact CE2-CG2 4.34Å; F202-I262 HydrophobicContact CG-CD1 4.13Å; F202-I262 HydrophobicContact CZ-CD1 3.6Å; F202-I262 HydrophobicContact CZ-CG2 4.05Å; F227-I262 HydrophobicContact CE1-CG1 3.91Å; F227-I262 HydrophobicContact CZ-CG1 3.7Å; F244-I262 HydrophobicContact CE1-CD1 4.11Å; F244-I262 HydrophobicContact CZ-CD1 4.37Å; P246-I262 HydrophobicContact CG-CD1 3.67Å; Q251-I262 HydrophobicContact CG-CD1 3.86Å; Q251-I262 HydrophobicContact CG-CG1 4.46Å; S260-I262 PolarHBondContact OG-N 2.73Å
263	D	87.8	Confident	87.2	Confident	98 Å²	98	47 Å²	47	52%	0.524	27%	0.267	S	S	.	.			trans	-151.5	99.9	171.4	-167	8.8	0	0	0	107.8	L193 Q194 A261	L193-D263 WeakPolarHBondContact O-CA 3Å; Q194-D263 WeakPolarHBondContact CG-OD1 3.41Å; Q194-D263 PolarHBondContact NE2-OD1 2.94Å; A261-D263 PolarHBondContact O-N 3.39Å
264	G	87.9	Confident	87.4	Confident	24 Å²	24	43.1 Å²	43.1	25%	0.247	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.1	-162.4	-176.1	0	0	0	0	0	115.6	L193	L193-G264 PolarHBondContact N-O 2.68Å; L193-G264 PolarHBondContact O-N 2.62Å; L193-G264 VanDerWaalsContact O-N 3.15Å
265	I	90.2	Very high	87.3	Confident	58 Å²	58	45.2 Å²	45.2	30%	0.297	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.4	-175.2	-41.2	-174	0	0	0	110.1	N190 F192 T222 L223	N190-I265 HydrophobicContact CB-CG2 3.79Å; F192-I265 HydrophobicContact CD1-CD1 4.48Å; F192-I265 HydrophobicContact CD1-CG1 3.96Å; F192-I265 HydrophobicContact CE1-CB 4.4Å; F192-I265 HydrophobicContact CE1-CD1 3.57Å; F192-I265 HydrophobicContact CE1-CG1 3.52Å; F192-I265 HydrophobicContact CE1-CG2 4.23Å; F192-I265 HydrophobicContact CZ-CD1 3.98Å; F192-I265 HydrophobicContact CZ-CG1 4.22Å; F192-I265 HydrophobicContact CZ-CG2 4.2Å; T222-I265 CarbonylContact C-O 3.45Å; T222-I265 VanDerWaalsContact C-O 3.28Å; T222-I265 VanDerWaalsContact CB-O 3.23Å; T222-I265 WeakPolarHBondContact CB-O 3.43Å; T222-I265 PolarHBondContact OG1-O 2.97Å; L223-I265 VanDerWaalsContact CD2-O 3.29Å; L223-I265 WeakPolarHBondContact CD2-O 3.47Å; L223-I265 WeakPolarHBondContact CG-O 3.48Å
266	F	93.6	Very high	87.6	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	112	163.3	178.4	-92.2	0	0	0	109	L191 L193 V204 V206 L223 I231 V242 F244 V268	L191-F266 HydrophobicContact CB-CB 4.36Å; L191-F266 HydrophobicContact CB-CD1 4.38Å; L191-F266 HydrophobicContact CD1-CD1 4.17Å; L191-F266 PolarHBondContact N-O 2.87Å; L191-F266 PolarHBondContact O-N 2.87Å; L193-F266 HydrophobicContact CD1-CB 3.54Å; L193-F266 HydrophobicContact CD1-CD2 4.47Å; L193-F266 HydrophobicContact CD1-CG 4.19Å; L193-F266 HydrophobicContact CG-CB 4.03Å; V204-F266 HydrophobicContact CG1-CD1 4.12Å; V204-F266 HydrophobicContact CG1-CE1 3.98Å; V204-F266 HydrophobicContact CG1-CZ 4.44Å; V206-F266 HydrophobicContact CG2-CE1 3.98Å; L223-F266 HydrophobicContact CD1-CB 4.35Å; L223-F266 HydrophobicContact CD1-CD2 4.02Å; I231-F266 HydrophobicContact CD1-CD2 4.25Å; I231-F266 HydrophobicContact CD1-CE2 3.73Å; I231-F266 HydrophobicContact CG1-CE2 3.99Å; I231-F266 HydrophobicContact CG2-CE2 4.07Å; I231-F266 HydrophobicContact CG2-CZ 4.17Å; V242-F266 HydrophobicContact CG1-CE1 4.44Å; V242-F266 HydrophobicContact CG1-CZ 3.79Å; F244-F266 HydrophobicContact CB-CD2 4.29Å; F244-F266 HydrophobicContact CB-CE2 3.56Å; F244-F266 HydrophobicContact CB-CZ 4.07Å; F244-F266 HydrophobicContact CD1-CD2 4.24Å; F244-F266 HydrophobicContact CD1-CE2 4.34Å; F244-F266 HydrophobicContact CG-CD2 4.34Å; F244-F266 HydrophobicContact CG-CE2 4.01Å; F266-V268 HydrophobicContact CD1-CG2 4.3Å; F266-V268 HydrophobicContact CE1-CG2 3.66Å; F266-V268 HydrophobicContact CZ-CG2 4.34Å
267	S	93.9	Very high	88	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.3	-175.3	-69.2	0	0	0	0	112.4	H189 N190 T222	H189-S267 WeakPolarHBondContact O-CA 3.23Å; N190-S267 PolarHBondContact OD1-OG 2.8Å; T222-S267 PolarHBondContact OG1-N 2.81Å; T222-S267 PolarHBondContact OG1-OG 2.85Å
268	V	95.9	Very high	88.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.9	166.5	-173.3	0	0	0	0	108.6	H189 V206 I208 L217 T219 V242 F266	H189-V268 PolarHBondContact N-O 2.88Å; H189-V268 PolarHBondContact O-N 3.03Å; V206-V268 HydrophobicContact CB-CG2 4.44Å; V206-V268 HydrophobicContact CG1-CG2 4.48Å; V206-V268 HydrophobicContact CG2-CG2 4.15Å; I208-V268 HydrophobicContact CD1-CG1 4.08Å; L217-V268 HydrophobicContact CD1-CG1 3.71Å; T219-V268 HydrophobicContact CG2-CG2 4.5Å; V242-V268 HydrophobicContact CG1-CG2 4.48Å; V242-V268 HydrophobicContact CG2-CG1 4.21Å; V242-V268 HydrophobicContact CG2-CG2 4.44Å; F266-V268 HydrophobicContact CD1-CG2 4.3Å; F266-V268 HydrophobicContact CE1-CG2 3.66Å; F266-V268 HydrophobicContact CZ-CG2 4.34Å
269	K	96.8	Very high	89.3	Confident	65 Å²	65	26.6 Å²	26.6	28%	0.283	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.4	179.9	-75.3	-177.2	175.8	-178.7	0	109.6	V186 Y187 Q188 L217 E218 P220	V186-K269 HydrophobicContact CG1-CB 3.8Å; V186-K269 HydrophobicContact CG1-CD 4.45Å; V186-K269 HydrophobicContact CG1-CG 4.1Å; Y187-K269 WeakPolarHBondContact O-CA 3.38Å; Q188-K269 HydrophobicContact CB-CG 4.23Å; Q188-K269 HydrophobicContact CG-CG 4.08Å; L217-K269 CarbonylContact C-O 3.48Å; L217-K269 WeakPolarHBondContact CA-O 3.36Å; E218-K269 HydrophobicContact CB-CB 4.22Å; E218-K269 PolarHBondContact N-O 2.87Å; E218-K269 PolarHBondContact O-N 3Å; P220-K269 HydrophobicContact CG-CD 4.09Å; P220-K269 HydrophobicContact CG-CG 4.44Å
270	Y	97.1	Very high	89.9	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.008	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	165.8	176.8	81	-81.5	0	0	0	112.8	I74 Y187 I208 E210 K216 V272	I74-Y270 HydrophobicContact CD1-CE1 4.29Å; I74-Y270 WeakPolarHBondContact CG2-OH 3.02Å; Y187-Y270 HydrophobicContact CD2-CD1 4.48Å; Y187-Y270 HydrophobicContact CD2-CD2 4.06Å; Y187-Y270 HydrophobicContact CD2-CE1 4.23Å; Y187-Y270 AromaticContact CD2-CE2 3.79Å; Y187-Y270 HydrophobicContact CD2-CE2 3.79Å; Y187-Y270 HydrophobicContact CD2-CG 4.4Å; Y187-Y270 AromaticContact CD2-CZ 3.89Å; Y187-Y270 WeakPolarHBondContact CD2-O 3.34Å; Y187-Y270 HydrophobicContact CE2-CE2 4.22Å; Y187-Y270 HydrophobicContact CG-CE1 4.3Å; Y187-Y270 PolarHBondContact N-O 3.08Å; Y187-Y270 PolarHBondContact O-N 3.43Å; I208-Y270 HydrophobicContact CD1-CD1 4.08Å; I208-Y270 HydrophobicContact CD1-CE1 4.41Å; I208-Y270 HydrophobicContact CD1-CG 4.34Å; I208-Y270 HydrophobicContact CG2-CE2 4.18Å; E210-Y270 HydrophobicContact CG-CE2 3.82Å; E210-Y270 WeakPolarHBondContact OE1-CE2 3.15Å; E210-Y270 PolarHBondContact OE1-OH 3.23Å; K216-Y270 CarbonylContact O-C 3.57Å; K216-Y270 WeakPolarHBondContact O-CA 3.24Å; K216-Y270 VanDerWaalsContact O-CB 3.28Å; K216-Y270 WeakPolarHBondContact O-CB 3.42Å; Y270-V272 HydrophobicContact CE2-CG1 4.06Å
271	D	96.6	Very high	90.4	Very high	18 Å²	18	25.9 Å²	25.9	10%	0.096	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	166.6	160.5	-167.7	25.8	0	0	0	109.6	R182 G185 Y187 S215 K216 R274	R182-D271 IonicContact CZ-OD1 2.71Å; R182-D271 IonicContact CZ-OD2 2.67Å; R182-D271 IonicContact NE-OD1 2.77Å; R182-D271 PolarHBondContact NE-OD1 3.34Å; R182-D271 IonicContact NE-OD2 2.79Å; R182-D271 PolarHBondContact NE-OD2 3.29Å; R182-D271 IonicContact NH2-OD1 2.7Å; R182-D271 IonicContact NH2-OD2 3.19Å; R182-D271 PolarHBondContact NH2-OD2 3.06Å; G185-D271 WeakPolarHBondContact O-CB 3.36Å; G185-D271 VanDerWaalsContact O-CG 3.27Å; Y187-D271 VanDerWaalsContact CE2-OD1 3.3Å; Y187-D271 WeakPolarHBondContact CE2-OD1 3.26Å; S215-D271 PolarHBondContact N-O 3.12Å; S215-D271 VanDerWaalsContact OG-C 3.26Å; S215-D271 PolarHBondContact OG-O 2.67Å; S215-D271 VanDerWaalsContact OG-O 3.13Å; K216-D271 PolarHBondContact N-O 2.91Å; K216-D271 PolarHBondContact O-N 3.44Å; K216-D271 VanDerWaalsContact O-N 3.08Å; D271-R274 IonicContact OD1-CZ 3.95Å; D271-R274 IonicContact OD1-NE 2.69Å; D271-R274 PolarHBondContact OD1-NE 2.64Å; D271-R274 IonicContact OD1-NH2 3.78Å; D271-R274 PolarHBondContact OD1-NH2 3.27Å; D271-R274 IonicContact OD2-NE 3.47Å; D271-R274 PolarHBondContact OD2-NE 2.89Å
272	V	95.2	Very high	90.7	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	166	-177	-62.9	0	0	0	0	112.4	Y187 E210 G213 S215 Y270 R274	Y187-V272 HydrophobicContact CE2-CG1 4.18Å; Y187-V272 HydrophobicContact CE2-CG2 4.33Å; E210-V272 HydrophobicContact CB-CG1 4Å; E210-V272 HydrophobicContact CG-CG1 3.72Å; G213-V272 CarbonylContact O-C 3.59Å; G213-V272 WeakPolarHBondContact O-CA 3.27Å; S215-V272 WeakPolarHBondContact CB-O 3.18Å; S215-V272 PolarHBondContact OG-N 3.36Å; S215-V272 PolarHBondContact OG-O 3.45Å; Y270-V272 HydrophobicContact CE2-CG1 4.06Å; V272-R274 HydrophobicContact CG2-CG 4.27Å; V272-R274 VanDerWaalsContact CG2-NH2 3.35Å
273	T	92.3	Very high	91	Very high	32 Å²	32	24.9 Å²	24.9	20%	0.196	14%	0.137	C	C	.	.			trans	-77.9	132.8	175.6	-55.1	0	0	0	0	109.8	G213 D275	G213-T273 WeakPolarHBondContact O-CB 3.4Å; G213-T273 PolarHBondContact O-N 3Å; G213-T273 PolarHBondContact O-OG1 3.48Å; G213-T273 VanDerWaalsContact O-OG1 3.08Å; T273-D275 WeakPolarHBondContact CG2-OD1 3.41Å
274	R	88.4	Confident	91.3	Very high	47 Å²	47	20.2 Å²	20.2	18%	0.177	11%	0.112	C	C	.	.			trans	-127.6	70.9	-169.1	-63.9	177.8	-173.3	-80.6	-0.7	111	R182 Y187 D271 V272 S276 E519	R182-R274 VanDerWaalsContact NE-NH2 3.14Å; Y187-R274 PolarHBondContact OH-NH2 3.31Å; D271-R274 IonicContact OD1-CZ 3.95Å; D271-R274 IonicContact OD1-NE 2.69Å; D271-R274 PolarHBondContact OD1-NE 2.64Å; D271-R274 IonicContact OD1-NH2 3.78Å; D271-R274 PolarHBondContact OD1-NH2 3.27Å; D271-R274 IonicContact OD2-NE 3.47Å; D271-R274 PolarHBondContact OD2-NE 2.89Å; V272-R274 HydrophobicContact CG2-CG 4.27Å; V272-R274 VanDerWaalsContact CG2-NH2 3.35Å; R274-S276 PolarHBondContact O-N 2.84Å; R274-E519 IonicContact CZ-OE1 3.1Å; R274-E519 VanDerWaalsContact CZ-OE1 3.28Å; R274-E519 IonicContact NH1-OE1 2.75Å; R274-E519 PolarHBondContact NH1-OE1 2.86Å; R274-E519 IonicContact NH2-OE1 3.46Å; R274-E519 PolarHBondContact NH2-OE1 3.48Å
275	D	77.3	Confident	91.4	Very high	108 Å²	108	22.5 Å²	22.5	58%	0.578	12%	0.119	S	C	*	.			trans	-77.9	9.2	-178	-61.1	-26.7	0	0	0	114	T273 T788	T273-D275 WeakPolarHBondContact CG2-OD1 3.41Å; D275-T788 VanDerWaalsContact O-CB 3.32Å; D275-T788 WeakPolarHBondContact O-CB 3.32Å; D275-T788 PolarHBondContact O-OG1 3.2Å
276	S	81.8	Confident	91.5	Very high	24 Å²	24	23.1 Å²	23.1	17%	0.168	12%	0.122	C	C	.	.			trans	-145.7	126.5	-171.4	169.3	0	0	0	0	111.7	R274 A278 G279 T788	R274-S276 PolarHBondContact O-N 2.84Å; S276-A278 VanDerWaalsContact C-N 3.32Å; S276-A278 PolarHBondContact OG-N 2.89Å; S276-A278 VanDerWaalsContact OG-N 3.13Å; S276-G279 WeakPolarHBondContact CB-O 3.41Å; S276-G279 PolarHBondContact OG-N 2.85Å; S276-G279 PolarHBondContact OG-O 2.97Å; S276-T788 WeakPolarHBondContact CA-OG1 3.49Å
277	N	83.6	Confident	91.6	Very high	7 Å²	7	24.6 Å²	24.6	4%	0.037	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-21.1	167.9	-57.9	83.9	0	0	0	113.1	G279 F292 P294 S295 S786 F787 T788	N277-G279 PolarHBondContact O-N 2.97Å; N277-F292 WeakPolarHBondContact O-CE2 3.48Å; N277-P294 HydrophobicContact CB-CB 4.41Å; N277-S295 PolarHBondContact ND2-O 3.37Å; N277-S786 PolarHBondContact ND2-O 3.16Å; N277-S786 VanDerWaalsContact ND2-O 3.09Å; N277-F787 HydrophobicContact CB-CD1 4.47Å; N277-F787 VanDerWaalsContact OD1-CA 3.26Å; N277-F787 WeakPolarHBondContact OD1-CA 3.33Å; N277-T788 PolarHBondContact N-OG1 2.87Å; N277-T788 PolarHBondContact OD1-N 3.45Å; N277-T788 PolarHBondContact OD1-OG1 3.49Å; N277-T788 VanDerWaalsContact OD1-OG1 3.12Å
278	A	85.8	Confident	91.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-5.5	176.2	0	0	0	0	0	112.9	S276 H290 F292 L549 T551 A791	S276-A278 VanDerWaalsContact C-N 3.32Å; S276-A278 PolarHBondContact OG-N 2.89Å; S276-A278 VanDerWaalsContact OG-N 3.13Å; A278-H290 PolarHBondContact O-NE2 3.13Å; A278-F292 WeakPolarHBondContact O-CD2 3.35Å; A278-L549 HydrophobicContact CB-CB 3.81Å; A278-T551 VanDerWaalsContact CB-OG1 3.24Å; A278-T551 WeakPolarHBondContact CB-OG1 3.45Å; A278-T551 PolarHBondContact O-OG1 3.01Å; A278-A791 HydrophobicContact CB-CB 3.59Å
279	G	89.9	Confident	91.8	Very high	13 Å²	13	24.5 Å²	24.5	13%	0.134	13%	0.127	C	C	.	.			trans	84.7	-154.9	-174.8	0	0	0	0	0	112.3	S276 N277 F291	S276-G279 WeakPolarHBondContact CB-O 3.41Å; S276-G279 PolarHBondContact OG-N 2.85Å; S276-G279 PolarHBondContact OG-O 2.97Å; N277-G279 PolarHBondContact O-N 2.97Å; G279-F291 CarbonylContact C-O 3.47Å; G279-F291 VanDerWaalsContact CA-O 3.29Å; G279-F291 WeakPolarHBondContact CA-O 3.36Å
280	E	92.4	Very high	91.8	Very high	14 Å²	14	21.4 Å²	21.4	7%	0.065	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	113.4	-171.4	169.2	179.9	-175.7	0	0	109.3	R77 K212 Q282 H290 F291	R77-E280 IonicContact CZ-OE2 2.9Å; R77-E280 VanDerWaalsContact CZ-OE2 3.31Å; R77-E280 IonicContact NH1-OE1 2.72Å; R77-E280 PolarHBondContact NH1-OE1 3.02Å; R77-E280 IonicContact NH1-OE2 3.86Å; R77-E280 PolarHBondContact NH1-OE2 3.09Å; R77-E280 IonicContact NH2-OE2 2.7Å; R77-E280 PolarHBondContact NH2-OE2 2.99Å; K212-E280 HydrophobicContact CG-CG 4.02Å; K212-E280 VanDerWaalsContact CG-OE1 3.24Å; K212-E280 WeakPolarHBondContact CG-OE1 3.49Å; E280-Q282 HydrophobicContact CG-CG 4.16Å; E280-Q282 PolarHBondContact OE1-NE2 3.38Å; E280-H290 CarbonylContact O-C 3.57Å; E280-H290 WeakPolarHBondContact O-CA 3.32Å; E280-H290 PolarHBondContact O-CD2 3.04Å; E280-F291 HydrophobicContact CB-CB 4.38Å; E280-F291 HydrophobicContact CG-CD2 4.28Å; E280-F291 PolarHBondContact N-O 3.07Å; E280-F291 PolarHBondContact O-N 2.81Å
281	L	94.6	Very high	91.8	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.016	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.4	169.5	-173.1	62.9	0	0	0	108.7	F288 H290 F498 L534 T551 T553	L281-F288 HydrophobicContact CD1-CB 4.44Å; L281-F288 HydrophobicContact CD1-CD2 4.04Å; L281-H290 HydrophobicContact CD1-CB 3.8Å; L281-F498 HydrophobicContact CD1-CE1 4.33Å; L281-L534 HydrophobicContact CD1-CD2 4.23Å; L281-L534 HydrophobicContact CD2-CB 4.37Å; L281-L534 HydrophobicContact CD2-CD2 4.1Å; L281-L534 HydrophobicContact CD2-CG 4.05Å; L281-L534 WeakPolarHBondContact CD2-O 3.46Å; L281-L534 HydrophobicContact CG-CD2 4.45Å; L281-T551 HydrophobicContact CB-CG2 3.59Å; L281-T553 HydrophobicContact CB-CG2 4.29Å; L281-T553 HydrophobicContact CD2-CG2 3.86Å; L281-T553 HydrophobicContact CG-CG2 3.76Å
282	Q	94.9	Very high	91.7	Very high	3 Å²	3	20.7 Å²	20.7	1%	0.014	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145	172.9	-67.2	-169.2	4	0	0	109.2	S76 E280 F288 V289 F291 L558	S76-Q282 VanDerWaalsContact OG-CD 3.3Å; S76-Q282 PolarHBondContact OG-NE2 3.25Å; S76-Q282 PolarHBondContact OG-OE1 3.28Å; E280-Q282 HydrophobicContact CG-CG 4.16Å; E280-Q282 PolarHBondContact OE1-NE2 3.38Å; Q282-F288 CarbonylContact O-C 3.51Å; Q282-F288 VanDerWaalsContact O-CA 3.22Å; Q282-F288 WeakPolarHBondContact O-CA 3.29Å; Q282-F288 WeakPolarHBondContact O-CB 3.18Å; Q282-V289 PolarHBondContact N-O 2.81Å; Q282-V289 PolarHBondContact O-N 3.2Å; Q282-F291 HydrophobicContact CG-CE2 4.41Å; Q282-L558 HydrophobicContact CB-CD2 3.69Å; Q282-L558 HydrophobicContact CG-CD2 3.91Å
283	V	94.6	Very high	91.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136	170.9	178.2	0	0	0	0	108.7	Y287 F288 V526 L534 T553 I555	V283-Y287 CarbonylContact C-O 3.55Å; V283-Y287 WeakPolarHBondContact CA-O 3.37Å; V283-F288 HydrophobicContact CG2-CB 3.92Å; V283-V526 HydrophobicContact CG1-CG2 3.91Å; V283-V526 HydrophobicContact CG2-CG2 4.22Å; V283-L534 HydrophobicContact CG2-CB 4.14Å; V283-L534 HydrophobicContact CG2-CD2 3.7Å; V283-T553 HydrophobicContact CB-CG2 4.43Å; V283-T553 HydrophobicContact CG2-CG2 3.69Å; V283-I555 HydrophobicContact CG1-CB 4.27Å; V283-I555 HydrophobicContact CG1-CG1 4.34Å; V283-I555 HydrophobicContact CG1-CG2 4Å
284	S	93.5	Very high	91.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	139.7	178.7	174.5	0	0	0	0	110.1	L286 Y287 D559 T570	S284-L286 PolarHBondContact O-N 3.39Å; S284-L286 VanDerWaalsContact O-N 3.12Å; S284-Y287 PolarHBondContact N-O 2.86Å; S284-Y287 PolarHBondContact O-N 2.92Å; S284-D559 VanDerWaalsContact CA-OD1 3.29Å; S284-D559 WeakPolarHBondContact CA-OD1 3.5Å; S284-D559 WeakPolarHBondContact CA-OD2 3.44Å; S284-D559 WeakPolarHBondContact CB-OD1 3.25Å; S284-D559 PolarHBondContact OG-OD1 3.24Å; S284-T570 PolarHBondContact OG-O 3.09Å
285	D	90.6	Very high	91.3	Very high	73 Å²	73	19 Å²	19	39%	0.39	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	22	-178.7	-103.3	-0.7	0	0	0	113.8	Y287 D559	D285-Y287 VanDerWaalsContact C-N 3.27Å; D285-Y287 HydrophobicContact CB-CD2 4.34Å; D285-Y287 VanDerWaalsContact O-CD2 3.24Å; D285-Y287 WeakPolarHBondContact O-CD2 3.41Å; D285-Y287 PolarHBondContact O-N 3.13Å; D285-D559 PolarHBondContact N-OD1 3.05Å; D285-D559 PolarHBondContact N-OD2 3.46Å
286	L	93.2	Very high	91.6	Very high	71 Å²	71	18.6 Å²	18.6	37%	0.372	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	19.2	-167.3	-53.4	177.8	0	0	0	115.6	S284 V526 L528 I555	S284-L286 PolarHBondContact O-N 3.39Å; S284-L286 VanDerWaalsContact O-N 3.12Å; L286-V526 PolarHBondContact O-N 2.7Å; L286-L528 HydrophobicContact CD1-CD1 4.16Å; L286-L528 HydrophobicContact CD1-CG 4.38Å; L286-L528 HydrophobicContact CD2-CD2 3.81Å; L286-L528 HydrophobicContact CD2-CG 4.26Å; L286-I555 HydrophobicContact CD2-CG2 4.1Å
287	Y	96.1	Very high	91.9	Very high	32 Å²	32	18.1 Å²	18.1	13%	0.125	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	147	166.7	-66.3	-101.7	0	0	0	109.2	V283 S284 D285 G524 K525 K574 W577	V283-Y287 CarbonylContact C-O 3.55Å; V283-Y287 WeakPolarHBondContact CA-O 3.37Å; S284-Y287 PolarHBondContact N-O 2.86Å; S284-Y287 PolarHBondContact O-N 2.92Å; D285-Y287 VanDerWaalsContact C-N 3.27Å; D285-Y287 HydrophobicContact CB-CD2 4.34Å; D285-Y287 VanDerWaalsContact O-CD2 3.24Å; D285-Y287 WeakPolarHBondContact O-CD2 3.41Å; D285-Y287 PolarHBondContact O-N 3.13Å; Y287-G524 CarbonylContact C-O 3.59Å; Y287-G524 WeakPolarHBondContact CA-O 3.47Å; Y287-K525 HydrophobicContact CD1-CG 3.81Å; Y287-K525 HydrophobicContact CE1-CD 4.13Å; Y287-K525 HydrophobicContact CE1-CG 3.46Å; Y287-K525 VanDerWaalsContact CE1-CG 3.46Å; Y287-K574 HydrophobicContact CD1-CB 4.4Å; Y287-K574 HydrophobicContact CD2-CB 3.57Å; Y287-K574 HydrophobicContact CD2-CD 4.27Å; Y287-K574 HydrophobicContact CD2-CG 3.91Å; Y287-K574 HydrophobicContact CE1-CG 4.32Å; Y287-K574 HydrophobicContact CE2-CB 3.89Å; Y287-K574 HydrophobicContact CE2-CD 3.81Å; Y287-K574 HydrophobicContact CE2-CG 3.67Å; Y287-K574 HydrophobicContact CG-CB 3.9Å; Y287-K574 HydrophobicContact CG-CG 4.4Å; Y287-W577 HydrophobicContact CD1-CB 3.86Å; Y287-W577 AromaticContact CD1-CD2 3.86Å; Y287-W577 HydrophobicContact CD1-CD2 3.86Å; Y287-W577 AromaticContact CD1-CE3 3.93Å; Y287-W577 HydrophobicContact CD1-CE3 3.93Å; Y287-W577 AromaticContact CD1-CG 3.81Å; Y287-W577 HydrophobicContact CD1-CG 3.81Å; Y287-W577 AromaticContact CE1-CD2 3.7Å; Y287-W577 HydrophobicContact CE1-CD2 3.7Å; Y287-W577 AromaticContact CE1-CE3 3.41Å; Y287-W577 HydrophobicContact CE1-CE3 3.41Å; Y287-W577 VanDerWaalsContact CE1-CE3 3.41Å; Y287-W577 HydrophobicContact CE1-CG 4.18Å; Y287-W577 AromaticContact CE1-CZ3 3.96Å; Y287-W577 HydrophobicContact CE1-CZ3 3.96Å
288	F	96.3	Very high	92	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	153.6	173.8	78.5	-97.1	0	0	0	111.6	L281 Q282 V283 F498 V503 V506 V522 A523 G524 V526 L534	L281-F288 HydrophobicContact CD1-CB 4.44Å; L281-F288 HydrophobicContact CD1-CD2 4.04Å; Q282-F288 CarbonylContact O-C 3.51Å; Q282-F288 VanDerWaalsContact O-CA 3.22Å; Q282-F288 WeakPolarHBondContact O-CA 3.29Å; Q282-F288 WeakPolarHBondContact O-CB 3.18Å; V283-F288 HydrophobicContact CG2-CB 3.92Å; F288-F498 HydrophobicContact CD2-CE1 4.08Å; F288-F498 HydrophobicContact CD2-CZ 4.08Å; F288-F498 HydrophobicContact CE1-CE1 4.42Å; F288-F498 HydrophobicContact CE1-CZ 4.45Å; F288-F498 AromaticContact CE2-CE1 3.63Å; F288-F498 HydrophobicContact CE2-CE1 3.63Å; F288-F498 AromaticContact CE2-CE2 3.99Å; F288-F498 HydrophobicContact CE2-CE2 3.99Å; F288-F498 AromaticContact CE2-CZ 3.24Å; F288-F498 HydrophobicContact CE2-CZ 3.24Å; F288-F498 HydrophobicContact CZ-CD1 4.46Å; F288-F498 HydrophobicContact CZ-CD2 4.42Å; F288-F498 AromaticContact CZ-CE1 3.8Å; F288-F498 HydrophobicContact CZ-CE1 3.8Å; F288-F498 AromaticContact CZ-CE2 3.78Å; F288-F498 HydrophobicContact CZ-CE2 3.78Å; F288-F498 AromaticContact CZ-CZ 3.45Å; F288-F498 HydrophobicContact CZ-CZ 3.45Å; F288-F498 VanDerWaalsContact CZ-CZ 3.45Å; F288-V503 HydrophobicContact CD1-CG1 3.85Å; F288-V503 HydrophobicContact CE1-CB 3.86Å; F288-V503 HydrophobicContact CE1-CG1 3.48Å; F288-V503 VanDerWaalsContact CE1-CG1 3.48Å; F288-V503 HydrophobicContact CZ-CG1 4.36Å; F288-V506 HydrophobicContact CE1-CG2 4.14Å; F288-V506 HydrophobicContact CZ-CG1 3.99Å; F288-V506 HydrophobicContact CZ-CG2 4.01Å; F288-V522 HydrophobicContact CE2-CG1 4.33Å; F288-A523 VanDerWaalsContact O-CA 3.24Å; F288-A523 WeakPolarHBondContact O-CA 3.37Å; F288-A523 WeakPolarHBondContact O-CB 3.39Å; F288-G524 PolarHBondContact N-O 2.95Å; F288-G524 PolarHBondContact O-N 2.89Å; F288-V526 HydrophobicContact CB-CG2 4Å; F288-V526 HydrophobicContact CD1-CG2 4.13Å; F288-L534 HydrophobicContact CB-CD2 3.69Å; F288-L534 HydrophobicContact CD1-CD2 4.14Å; F288-L534 HydrophobicContact CG-CD2 3.93Å
289	V	97.1	Very high	92.2	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	126.2	166.3	-173.5	0	0	0	0	108.7	Q282 F291 V521 V522 A523 A573 M576	Q282-V289 PolarHBondContact N-O 2.81Å; Q282-V289 PolarHBondContact O-N 3.2Å; V289-F291 HydrophobicContact CB-CE2 4.08Å; V289-F291 HydrophobicContact CB-CZ 4.28Å; V289-F291 HydrophobicContact CG1-CD1 4.33Å; V289-F291 HydrophobicContact CG1-CD2 4.07Å; V289-F291 HydrophobicContact CG1-CE1 3.88Å; V289-F291 HydrophobicContact CG1-CE2 3.61Å; V289-F291 HydrophobicContact CG1-CG 4.42Å; V289-F291 HydrophobicContact CG1-CZ 3.5Å; V289-V521 HydrophobicContact CG1-CG1 3.56Å; V289-V522 CarbonylContact C-O 2.89Å; V289-V522 WeakPolarHBondContact CA-O 3.43Å; V289-A523 HydrophobicContact CG2-CB 4.3Å; V289-A573 HydrophobicContact CG2-CB 4.09Å; V289-M576 HydrophobicContact CG1-SD 3.69Å; V289-M576 HydrophobicContact CG2-CB 4.49Å; V289-M576 HydrophobicContact CG2-SD 4.1Å
290	H	96.9	Very high	92.2	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110	172.2	-168.9	174.9	0	0	0	108.9	A278 E280 L281 V496 V521 V522 S536 T538	A278-H290 PolarHBondContact O-NE2 3.13Å; E280-H290 CarbonylContact O-C 3.57Å; E280-H290 WeakPolarHBondContact O-CA 3.32Å; E280-H290 PolarHBondContact O-CD2 3.04Å; L281-H290 HydrophobicContact CD1-CB 3.8Å; H290-V496 WeakPolarHBondContact ND1-CG1 3.21Å; H290-V521 WeakPolarHBondContact O-CA 3.43Å; H290-V522 HydrophobicContact CB-CB 4.46Å; H290-V522 PolarHBondContact N-O 3.28Å; H290-V522 PolarHBondContact O-N 2.89Å; H290-S536 PolarHBondContact CE1-OG 2.87Å; H290-S536 PolarHBondContact ND1-OG 3.15Å; H290-T538 PolarHBondContact CE1-OG1 2.86Å
291	F	96.4	Very high	92.1	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.009	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.8	171.3	-55.7	-86.7	0	0	0	109.1	S76 R77 G279 E280 Q282 V289 E519 V521 M576	S76-F291 WeakPolarHBondContact O-CZ 3.39Å; R77-F291 HydrophobicContact CB-CE1 3.94Å; R77-F291 HydrophobicContact CB-CZ 4.35Å; R77-F291 HydrophobicContact CG-CE1 4.1Å; G279-F291 CarbonylContact C-O 3.47Å; G279-F291 VanDerWaalsContact CA-O 3.29Å; G279-F291 WeakPolarHBondContact CA-O 3.36Å; E280-F291 HydrophobicContact CB-CB 4.38Å; E280-F291 HydrophobicContact CG-CD2 4.28Å; E280-F291 PolarHBondContact N-O 3.07Å; E280-F291 PolarHBondContact O-N 2.81Å; Q282-F291 HydrophobicContact CG-CE2 4.41Å; V289-F291 HydrophobicContact CB-CE2 4.08Å; V289-F291 HydrophobicContact CB-CZ 4.28Å; V289-F291 HydrophobicContact CG1-CD1 4.33Å; V289-F291 HydrophobicContact CG1-CD2 4.07Å; V289-F291 HydrophobicContact CG1-CE1 3.88Å; V289-F291 HydrophobicContact CG1-CE2 3.61Å; V289-F291 HydrophobicContact CG1-CG 4.42Å; V289-F291 HydrophobicContact CG1-CZ 3.5Å; F291-E519 HydrophobicContact CB-CG 4.4Å; F291-E519 WeakPolarHBondContact CD1-OE2 3.06Å; F291-V521 HydrophobicContact CD1-CG1 4.28Å; F291-V521 HydrophobicContact CD1-CG2 4Å; F291-V521 HydrophobicContact CE1-CG1 4.29Å; F291-V521 HydrophobicContact CE1-CG2 4.42Å; F291-M576 HydrophobicContact CE1-CE 4.11Å; F291-M576 HydrophobicContact CE1-SD 4.13Å; F291-M576 HydrophobicContact CZ-CE 3.91Å; F291-M576 HydrophobicContact CZ-SD 4.15Å
292	F	95.6	Very high	92	Very high	2 Å²	2	21 Å²	21	1%	0.009	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	108.4	-179.8	-176.9	-99.2	0	0	0	111.2	N277 A278 P294 L491 V494 L520 T538 L549	N277-F292 WeakPolarHBondContact O-CE2 3.48Å; A278-F292 WeakPolarHBondContact O-CD2 3.35Å; F292-P294 VanDerWaalsContact CE1-CD 3.47Å; F292-P294 HydrophobicContact CE1-CG 3.83Å; F292-P294 HydrophobicContact CE2-CG 4.27Å; F292-P294 HydrophobicContact CZ-CG 3.64Å; F292-L491 HydrophobicContact CE1-CD1 3.79Å; F292-L491 HydrophobicContact CZ-CD1 3.89Å; F292-V494 HydrophobicContact CD1-CG1 4.08Å; F292-V494 HydrophobicContact CE1-CG1 3.77Å; F292-V494 HydrophobicContact CZ-CG1 4.47Å; F292-L520 HydrophobicContact CB-CB 4.37Å; F292-L520 HydrophobicContact CD1-CD1 4.16Å; F292-L520 PolarHBondContact N-O 3.14Å; F292-L520 PolarHBondContact O-N 3.39Å; F292-T538 HydrophobicContact CD2-CG2 4.02Å; F292-T538 HydrophobicContact CE1-CG2 4.23Å; F292-T538 HydrophobicContact CE2-CG2 3.7Å; F292-T538 HydrophobicContact CG-CG2 4.43Å; F292-T538 HydrophobicContact CZ-CG2 3.79Å; F292-L549 HydrophobicContact CE2-CD1 3.89Å; F292-L549 HydrophobicContact CZ-CD1 4.17Å
293	A	94.2	Very high	91.9	Very high	4 Å²	4	21 Å²	21	3%	0.033	12%	0.119	C	C	.	.			trans	-149.1	79.4	173.2	0	0	0	0	0	110.9	F514 E519	A293-F514 HydrophobicContact CB-CE2 4.27Å; A293-F514 HydrophobicContact CB-CZ 3.93Å; A293-E519 HydrophobicContact CB-CB 4.05Å; A293-E519 HydrophobicContact CB-CG 3.96Å
294	P	90.6	Very high	92	Very high	6 Å²	6	21 Å²	21	4%	0.039	12%	0.119	C	C	.	.			trans	-60.6	138.5	175.6	22.6	-32.4	0	0	0	111.7	N277 F292 L297 L491 F514	N277-P294 HydrophobicContact CB-CB 4.41Å; F292-P294 VanDerWaalsContact CE1-CD 3.47Å; F292-P294 HydrophobicContact CE1-CG 3.83Å; F292-P294 HydrophobicContact CE2-CG 4.27Å; F292-P294 HydrophobicContact CZ-CG 3.64Å; P294-L297 HydrophobicContact CB-CD1 3.97Å; P294-L297 HydrophobicContact CG-CD1 3.98Å; P294-L491 HydrophobicContact CG-CD1 3.83Å; P294-F514 HydrophobicContact CG-CD1 4.19Å; P294-F514 HydrophobicContact CG-CE1 3.79Å
295	S	81.9	Confident	92.2	Very high	37 Å²	37	21 Å²	21	26%	0.259	12%	0.119	S	C	.	.			trans	-96.1	169.2	172.2	58.3	0	0	0	0	111.3	N277 L297	N277-S295 PolarHBondContact ND2-O 3.37Å; S295-L297 VanDerWaalsContact C-N 3.33Å; S295-L297 PolarHBondContact O-N 2.96Å
296	N	83	Confident	92.5	Very high	98 Å²	98	17.6 Å²	17.6	52%	0.524	10%	0.1	S	C	.	.	S	Bend	trans	55.9	38.7	166.6	-51.4	-24.1	0	0	0	115.5	S786	N296-S786 WeakPolarHBondContact CB-OG 3.3Å; N296-S786 PolarHBondContact O-N 3.39Å
297	L	87.8	Confident	92.7	Very high	14 Å²	14	14.2 Å²	14.2	7%	0.073	8%	0.083	C	C	.	.	P	Polyproline II helix	trans	-103.5	143.4	166.8	-58.3	176.1	0	0	0	109.4	P294 S295 L490 L491 H785 F787	P294-L297 HydrophobicContact CB-CD1 3.97Å; P294-L297 HydrophobicContact CG-CD1 3.98Å; S295-L297 VanDerWaalsContact C-N 3.33Å; S295-L297 PolarHBondContact O-N 2.96Å; L297-L490 HydrophobicContact CB-CB 4.46Å; L297-L490 HydrophobicContact CD1-CB 4.49Å; L297-L491 HydrophobicContact CD1-CD1 4.21Å; L297-L491 HydrophobicContact CD1-CD2 3.88Å; L297-L491 HydrophobicContact CD1-CG 4Å; L297-H785 HydrophobicContact CD2-CB 4.28Å; L297-H785 WeakPolarHBondContact CD2-ND1 3.29Å; L297-F787 HydrophobicContact CD2-CE1 4.2Å; L297-F787 HydrophobicContact CD2-CZ 4.44Å
298	S	87.7	Confident	92.7	Very high	28 Å²	28	12.8 Å²	12.8	20%	0.196	8%	0.077	C	C	.	.	P	Polyproline II helix	trans	-67	135.5	171.3	-72.4	0	0	0	0	111.3	S784 H785	S298-S784 PolarHBondContact N-O 2.98Å; S298-S784 PolarHBondContact OG-N 2.87Å; S298-S784 PolarHBondContact OG-O 3.18Å; S298-H785 PolarHBondContact N-CE1 3.45Å
299	P	89.6	Confident	92.7	Very high	41 Å²	41	12.8 Å²	12.8	27%	0.266	8%	0.077	S	C	.	.	P	Polyproline II helix	trans	-63	147.7	174.4	-22.6	33.2	0	0	0	113.5	P489 L490	P299-P489 CarbonylContact C-O 3.6Å; P299-P489 VanDerWaalsContact CA-O 3.29Å; P299-P489 WeakPolarHBondContact CA-O 3.12Å; P299-L490 HydrophobicContact CB-CD2 4.12Å; P299-L490 HydrophobicContact CG-CD2 3.93Å
300	L	89.5	Confident	92.6	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.077	C	C	.	.	P	Polyproline II helix	trans	-76.8	140.7	173.9	-48.7	179.4	0	0	0	110	V406 P489 K492 A543	L300-V406 HydrophobicContact CD1-CG1 3.85Å; L300-P489 HydrophobicContact CB-CB 4.47Å; L300-P489 HydrophobicContact CB-CG 4.14Å; L300-P489 HydrophobicContact CD1-CB 4.49Å; L300-P489 PolarHBondContact N-O 2.67Å; L300-K492 HydrophobicContact CD1-CD 4.48Å; L300-K492 HydrophobicContact CD1-CG 3.64Å; L300-A543 HydrophobicContact CD2-CB 3.75Å; L300-A543 VanDerWaalsContact CD2-N 3.29Å
301	P	90.5	Very high	92.5	Very high	23 Å²	23	12.8 Å²	12.8	15%	0.149	8%	0.077	C	C	.	.	P	Polyproline II helix	trans	-58.9	155.4	168.2	-22.1	32.9	0	0	0	111.7	E336 S405 V406	P301-E336 HydrophobicContact CB-CB 4.31Å; P301-E336 HydrophobicContact CB-CG 4.15Å; P301-E336 HydrophobicContact CG-CB 4.29Å; P301-E336 HydrophobicContact CG-CG 4.17Å; P301-S405 CarbonylContact O-C 3.54Å; P301-S405 WeakPolarHBondContact O-CA 3.27Å; P301-S405 WeakPolarHBondContact O-CB 3.34Å; P301-V406 PolarHBondContact O-N 2.77Å
302	K	91.7	Very high	92.2	Very high	5 Å²	5	14.4 Å²	14.4	2%	0.022	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.7	-174.1	-59.1	173.9	-62.2	-56.5	0	111.9	I304 D337 R338 V406 M408 S487 P489	K302-I304 HydrophobicContact CB-CD1 4.02Å; K302-I304 HydrophobicContact CB-CG1 3.8Å; K302-I304 HydrophobicContact CD-CD1 4.02Å; K302-D337 WeakPolarHBondContact CB-OD1 3.35Å; K302-D337 PolarHBondContact N-OD1 3.26Å; K302-D337 IonicContact NZ-OD1 3.21Å; K302-D337 PolarHBondContact NZ-OD1 3.24Å; K302-D337 IonicContact NZ-OD2 3.78Å; K302-D337 PolarHBondContact NZ-OD2 3Å; K302-D337 CarbonylContact O-C 3.51Å; K302-D337 WeakPolarHBondContact O-CA 3.17Å; K302-R338 PolarHBondContact O-N 2.99Å; K302-V406 CarbonylContact C-O 3.59Å; K302-V406 WeakPolarHBondContact CA-O 3.32Å; K302-V406 HydrophobicContact CG-CG2 4.02Å; K302-M408 HydrophobicContact CB-CE 4.5Å; K302-M408 HydrophobicContact CD-CE 4Å; K302-M408 HydrophobicContact CG-CE 4.1Å; K302-S487 VanDerWaalsContact CD-O 3.27Å; K302-S487 WeakPolarHBondContact CD-O 3.15Å; K302-S487 WeakPolarHBondContact CE-O 3.36Å; K302-S487 PolarHBondContact NZ-O 2.81Å; K302-P489 HydrophobicContact CD-CG 4.21Å; K302-P489 HydrophobicContact CG-CG 3.93Å
303	N	94.3	Very high	91.9	Very high	4 Å²	4	16.9 Å²	16.9	2%	0.021	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	110.6	164.3	-43.2	-78.5	0	0	0	107.5	R338 L355 L392 V401 S405 V406 S407 M408	N303-R338 CarbonylContact C-O 3.56Å; N303-R338 VanDerWaalsContact CA-O 3.31Å; N303-R338 WeakPolarHBondContact CA-O 3.18Å; N303-L355 HydrophobicContact CB-CD1 4.29Å; N303-L392 HydrophobicContact CB-CD2 3.79Å; N303-V401 VanDerWaalsContact ND2-CG1 3.35Å; N303-V401 WeakPolarHBondContact ND2-CG1 3.42Å; N303-S405 PolarHBondContact ND2-OG 3.47Å; N303-V406 PolarHBondContact N-O 2.92Å; N303-V406 PolarHBondContact ND2-O 3.4Å; N303-S407 PolarHBondContact ND2-OG 2.95Å; N303-S407 WeakPolarHBondContact O-CA 3.1Å; N303-M408 PolarHBondContact O-N 2.64Å
304	I	95.6	Very high	91.8	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.3	-172	-47.6	-174.6	0	0	0	110.8	K302 F306 L333 R338 F339 S340 M408 I410 Y483	K302-I304 HydrophobicContact CB-CD1 4.02Å; K302-I304 HydrophobicContact CB-CG1 3.8Å; K302-I304 HydrophobicContact CD-CD1 4.02Å; I304-F306 HydrophobicContact CB-CE2 4.1Å; I304-F306 HydrophobicContact CB-CZ 4.24Å; I304-F306 HydrophobicContact CD1-CZ 4.32Å; I304-F306 HydrophobicContact CG2-CD1 4.14Å; I304-F306 HydrophobicContact CG2-CD2 4.05Å; I304-F306 HydrophobicContact CG2-CE1 3.79Å; I304-F306 HydrophobicContact CG2-CE2 3.69Å; I304-F306 HydrophobicContact CG2-CG 4.27Å; I304-F306 HydrophobicContact CG2-CZ 3.56Å; I304-L333 HydrophobicContact CD1-CD2 4.04Å; I304-R338 PolarHBondContact N-O 2.8Å; I304-F339 CarbonylContact O-C 3.58Å; I304-F339 WeakPolarHBondContact O-CA 3.26Å; I304-F339 WeakPolarHBondContact O-CB 3.45Å; I304-S340 PolarHBondContact O-N 3.08Å; I304-M408 WeakPolarHBondContact CA-O 3.37Å; I304-M408 HydrophobicContact CB-CG 4.43Å; I304-M408 HydrophobicContact CD1-SD 4.32Å; I304-M408 HydrophobicContact CG1-CG 3.97Å; I304-M408 HydrophobicContact CG1-SD 4.32Å; I304-M408 HydrophobicContact CG2-CG 4.24Å; I304-I410 HydrophobicContact CG2-CD1 4Å; I304-I410 HydrophobicContact CG2-CG1 4.3Å; I304-Y483 HydrophobicContact CD1-CE2 4.01Å
305	V	97.5	Very high	91.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	113.3	163.8	-175.6	0	0	0	0	108.8	V307 I342 L355 A388 M391 L392 M408 I409 I410	V305-V307 HydrophobicContact CG1-CG2 4.01Å; V305-I342 HydrophobicContact CG1-CD1 3.75Å; V305-I342 HydrophobicContact CG1-CG1 3.9Å; V305-L355 HydrophobicContact CG2-CD2 3.86Å; V305-A388 HydrophobicContact CB-CB 4.08Å; V305-A388 HydrophobicContact CG1-CB 3.63Å; V305-M391 HydrophobicContact CG2-SD 3.95Å; V305-L392 HydrophobicContact CG2-CD1 4.1Å; V305-L392 HydrophobicContact CG2-CD2 4.06Å; V305-L392 HydrophobicContact CG2-CG 3.82Å; V305-M408 PolarHBondContact N-O 2.75Å; V305-I409 WeakPolarHBondContact O-CA 3.47Å; V305-I410 PolarHBondContact O-N 2.92Å
306	F	97.4	Very high	92.1	Very high	1 Å²	1	26 Å²	26	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	125.3	171.3	-60.3	-81.2	0	0	0	108.7	I304 M326 I329 L330 F339 S340 I341 I342 I410	I304-F306 HydrophobicContact CB-CE2 4.1Å; I304-F306 HydrophobicContact CB-CZ 4.24Å; I304-F306 HydrophobicContact CD1-CZ 4.32Å; I304-F306 HydrophobicContact CG2-CD1 4.14Å; I304-F306 HydrophobicContact CG2-CD2 4.05Å; I304-F306 HydrophobicContact CG2-CE1 3.79Å; I304-F306 HydrophobicContact CG2-CE2 3.69Å; I304-F306 HydrophobicContact CG2-CG 4.27Å; I304-F306 HydrophobicContact CG2-CZ 3.56Å; F306-M326 HydrophobicContact CB-CE 3.98Å; F306-M326 HydrophobicContact CB-SD 4.5Å; F306-M326 HydrophobicContact CD1-CE 3.6Å; F306-M326 HydrophobicContact CD1-SD 3.82Å; F306-M326 HydrophobicContact CD2-CE 3.88Å; F306-M326 HydrophobicContact CE1-CE 3.97Å; F306-M326 HydrophobicContact CE1-SD 4.29Å; F306-M326 HydrophobicContact CE2-CE 4.22Å; F306-M326 HydrophobicContact CG-CE 3.54Å; F306-M326 HydrophobicContact CG-SD 4.24Å; F306-M326 HydrophobicContact CZ-CE 4.26Å; F306-I329 HydrophobicContact CE1-CG2 3.57Å; F306-I329 HydrophobicContact CZ-CG2 3.49Å; F306-I329 VanDerWaalsContact CZ-CG2 3.49Å; F306-L330 HydrophobicContact CE2-CD2 4.44Å; F306-F339 HydrophobicContact CE2-CB 4.37Å; F306-F339 HydrophobicContact CE2-CD2 4.45Å; F306-S340 PolarHBondContact N-O 2.95Å; F306-S340 VanDerWaalsContact N-O 3.09Å; F306-I341 HydrophobicContact CB-CG1 4.45Å; F306-I341 HydrophobicContact CD2-CG1 4.31Å; F306-I342 PolarHBondContact O-N 2.85Å; F306-I410 HydrophobicContact CD1-CB 4.11Å; F306-I410 HydrophobicContact CD1-CD1 4.32Å; F306-I410 HydrophobicContact CD1-CG2 4.46Å; F306-I410 HydrophobicContact CE1-CD1 3.85Å
307	V	97.5	Very high	92.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	101.2	-177.9	-178.6	0	0	0	0	107.7	V305 I342 F344 A384 A388 I409 I410 L411 V412	V305-V307 HydrophobicContact CG1-CG2 4.01Å; V307-I342 CarbonylContact C-O 3.57Å; V307-I342 WeakPolarHBondContact CA-O 3.39Å; V307-I342 HydrophobicContact CG2-CB 4.43Å; V307-F344 HydrophobicContact CG1-CD1 3.63Å; V307-F344 HydrophobicContact CG1-CE1 3.72Å; V307-A384 HydrophobicContact CG1-CB 3.7Å; V307-A388 HydrophobicContact CG2-CB 3.62Å; V307-I409 HydrophobicContact CB-CG2 4.47Å; V307-I409 HydrophobicContact CG2-CG2 3.66Å; V307-I410 PolarHBondContact N-O 2.93Å; V307-L411 HydrophobicContact CB-CD1 4.19Å; V307-L411 HydrophobicContact CG1-CD1 3.8Å; V307-L411 CarbonylContact O-C 3.6Å; V307-L411 WeakPolarHBondContact O-CA 3.44Å; V307-V412 PolarHBondContact O-N 2.99Å
308	I	96.2	Very high	92.3	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.6	-167.8	-53.8	174.8	0	0	0	109.5	V310 T322 M326 I341 I342 D343 F344	I308-V310 HydrophobicContact CG2-CG1 4.22Å; I308-V310 PolarHBondContact O-N 3.24Å; I308-T322 HydrophobicContact CG2-CG2 3.91Å; I308-M326 HydrophobicContact CD1-CE 4.42Å; I308-M326 HydrophobicContact CD1-CG 3.89Å; I308-M326 HydrophobicContact CD1-SD 4.22Å; I308-I341 HydrophobicContact CD1-CG2 3.76Å; I308-I341 HydrophobicContact CG1-CG2 4.44Å; I308-I342 PolarHBondContact N-O 3.05Å; I308-D343 WeakPolarHBondContact O-CA 3.35Å; I308-F344 VanDerWaalsContact C-CE1 3.49Å; I308-F344 VanDerWaalsContact O-CD1 3.24Å; I308-F344 WeakPolarHBondContact O-CD1 3.39Å; I308-F344 PolarHBondContact O-N 2.78Å
309	D	95.3	Very high	92.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	126	171.4	-166.7	-26.3	0	0	0	110.3	S311 M314 M319 F344 T379 V412 S413	D309-S311 WeakPolarHBondContact OD1-CB 3.29Å; D309-S311 PolarHBondContact OD1-N 2.96Å; D309-S311 PolarHBondContact OD1-OG 2.87Å; D309-M314 HydrophobicContact CB-CG 4.41Å; D309-M314 WeakPolarHBondContact O-CE 3.32Å; D309-M319 VanDerWaalsContact O-CE 3.3Å; D309-M319 WeakPolarHBondContact O-CE 3.23Å; D309-F344 VanDerWaalsContact CA-CE1 3.44Å; D309-F344 HydrophobicContact CB-CE1 3.82Å; D309-F344 HydrophobicContact CB-CE2 4.36Å; D309-F344 HydrophobicContact CB-CZ 3.63Å; D309-F344 VanDerWaalsContact N-CE1 3.28Å; D309-T379 WeakPolarHBondContact OD2-CG2 3.3Å; D309-V412 WeakPolarHBondContact CB-O 3.39Å; D309-V412 PolarHBondContact N-O 3.32Å; D309-S413 WeakPolarHBondContact OD2-CB 3.41Å; D309-S413 PolarHBondContact OD2-OG 3.04Å
310	V	95.6	Very high	92.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.167	C	C	.	.			trans	-127.4	27.8	177.6	-50.6	0	0	0	0	111.4	I308 M319 D343 F344 N345 I373 P375 T376	I308-V310 HydrophobicContact CG2-CG1 4.22Å; I308-V310 PolarHBondContact O-N 3.24Å; V310-M319 HydrophobicContact CB-CE 4.24Å; V310-M319 HydrophobicContact CG1-CE 3.79Å; V310-D343 HydrophobicContact CG1-CB 3.81Å; V310-D343 HydrophobicContact CG2-CB 4.08Å; V310-D343 WeakPolarHBondContact CG2-OD1 3.48Å; V310-F344 WeakPolarHBondContact CG2-O 3.31Å; V310-F344 PolarHBondContact N-O 3.07Å; V310-N345 HydrophobicContact CG2-CB 4.04Å; V310-I373 HydrophobicContact CB-CG2 3.97Å; V310-I373 HydrophobicContact CG1-CD1 4.37Å; V310-I373 HydrophobicContact CG1-CG2 3.36Å; V310-P375 CarbonylContact O-C 3.53Å; V310-P375 WeakPolarHBondContact O-CA 3.33Å; V310-T376 PolarHBondContact O-N 3.46Å
311	S	94.1	Very high	92.5	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.007	17%	0.17	C	C	.	.	S	Bend	trans	-63.1	171.6	169	64.5	0	0	0	0	112.5	D309 S313 M314 P375 G377 G378 T379	D309-S311 WeakPolarHBondContact OD1-CB 3.29Å; D309-S311 PolarHBondContact OD1-N 2.96Å; D309-S311 PolarHBondContact OD1-OG 2.87Å; S311-S313 VanDerWaalsContact C-N 3.29Å; S311-S313 PolarHBondContact O-N 2.87Å; S311-S313 PolarHBondContact OG-OG 2.99Å; S311-M314 PolarHBondContact O-N 2.93Å; S311-P375 WeakPolarHBondContact O-CB 3.33Å; S311-G377 CarbonylContact C-O 3.59Å; S311-G377 WeakPolarHBondContact CA-O 3.42Å; S311-G378 VanDerWaalsContact CB-O 3.26Å; S311-G378 WeakPolarHBondContact CB-O 3.47Å; S311-T379 WeakPolarHBondContact CB-OG1 3.37Å; S311-T379 PolarHBondContact OG-OG1 2.91Å
312	G	91.3	Very high	92.5	Very high	37 Å²	37	30.6 Å²	30.6	38%	0.381	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-65.7	-25.6	-176.6	0	0	0	0	0	114.9	M314 W315 G377	G312-M314 VanDerWaalsContact C-N 3.3Å; G312-M314 PolarHBondContact O-N 3.16Å; G312-W315 WeakPolarHBondContact O-CB 3.47Å; G312-W315 PolarHBondContact O-N 2.71Å; G312-G377 PolarHBondContact N-O 2.88Å
313	S	89.6	Confident	92.6	Very high	53 Å²	53	31 Å²	31	37%	0.371	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-66.2	-31	179.4	38.8	0	0	0	0	113	S311 W315 K318 D414	S311-S313 VanDerWaalsContact C-N 3.29Å; S311-S313 PolarHBondContact O-N 2.87Å; S311-S313 PolarHBondContact OG-OG 2.99Å; S313-W315 PolarHBondContact O-N 2.99Å; S313-W315 VanDerWaalsContact O-N 3.14Å; S313-K318 WeakPolarHBondContact O-CE 3.39Å; S313-K318 PolarHBondContact O-NZ 3.33Å; S313-D414 WeakPolarHBondContact CB-OD1 3.39Å; S313-D414 WeakPolarHBondContact CB-OD2 3.34Å; S313-D414 PolarHBondContact OG-OD1 3.05Å
314	M	90.4	Very high	92.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-69.1	-5.5	179.4	-75.5	-75	-88.8	0	0	114.2	D309 S311 G312 K318 M319 T322 P375 D414 I446	D309-M314 HydrophobicContact CB-CG 4.41Å; D309-M314 WeakPolarHBondContact O-CE 3.32Å; S311-M314 PolarHBondContact O-N 2.93Å; G312-M314 VanDerWaalsContact C-N 3.3Å; G312-M314 PolarHBondContact O-N 3.16Å; M314-K318 HydrophobicContact SD-CB 4.08Å; M314-M319 HydrophobicContact CB-CB 4.49Å; M314-M319 HydrophobicContact CB-CE 4.04Å; M314-M319 HydrophobicContact CE-CE 3.88Å; M314-M319 WeakPolarHBondContact O-CB 3.5Å; M314-M319 PolarHBondContact O-N 2.67Å; M314-T322 HydrophobicContact CE-CG2 4.21Å; M314-T322 WeakPolarHBondContact CE-OG1 3.36Å; M314-P375 HydrophobicContact CB-CB 4.35Å; M314-P375 HydrophobicContact CB-CG 4.43Å; M314-D414 WeakPolarHBondContact CA-OD2 3.39Å; M314-D414 HydrophobicContact CG-CB 4.32Å; M314-D414 PolarHBondContact N-OD2 3.32Å; M314-D414 HydrophobicContact SD-CB 3.66Å; M314-D414 VanDerWaalsContact SD-CG 3.55Å; M314-I446 HydrophobicContact CE-CD1 4.01Å; M314-I446 HydrophobicContact SD-CD1 4.17Å
315	W	89.8	Confident	92.2	Very high	203 Å²	203	35.9 Å²	35.9	77%	0.769	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	149.8	-175.7	-171.5	86.8	0	0	0	113.7	G312 S313 P375	G312-W315 WeakPolarHBondContact O-CB 3.47Å; G312-W315 PolarHBondContact O-N 2.71Å; S313-W315 PolarHBondContact O-N 2.99Å; S313-W315 VanDerWaalsContact O-N 3.14Å; W315-P375 HydrophobicContact CB-CB 4.16Å
316	G	89.5	Confident	92.1	Very high	37 Å²	37	36.1 Å²	36.1	38%	0.381	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	-126.5	-179.1	0	0	0	0	0	113.1	K318 K320	G316-K318 PolarHBondContact O-N 2.8Å; G316-K320 PolarHBondContact O-N 2.88Å
317	V	87.4	Confident	91.9	Very high	92 Å²	92	39.2 Å²	39.2	56%	0.558	21%	0.205	S	C	*	.	H	α-helix	trans	-65.7	-41.2	-167.3	179.9	0	0	0	0	112.4	M319 K320 Q321	V317-M319 PolarHBondContact O-N 3.25Å; V317-K320 WeakPolarHBondContact O-CB 3.46Å; V317-K320 PolarHBondContact O-N 3.11Å; V317-K320 VanDerWaalsContact O-N 3.17Å; V317-Q321 HydrophobicContact CG1-CG 4.31Å; V317-Q321 WeakPolarHBondContact O-CG 3.48Å; V317-Q321 PolarHBondContact O-N 2.7Å; V317-Q321 PolarHBondContact O-OE1 2.9Å
318	K	88.9	Confident	91.6	Very high	35 Å²	35	40.2 Å²	40.2	15%	0.152	21%	0.213	C	C	.	.	H	α-helix	trans	-57.6	-51.5	-178.5	-70.6	-176.6	-79.7	178.3	0	112.4	S313 M314 G316 T322 D414 I446 D449 A471	S313-K318 WeakPolarHBondContact O-CE 3.39Å; S313-K318 PolarHBondContact O-NZ 3.33Å; M314-K318 HydrophobicContact SD-CB 4.08Å; G316-K318 PolarHBondContact O-N 2.8Å; K318-T322 WeakPolarHBondContact O-CB 3.46Å; K318-T322 PolarHBondContact O-N 2.82Å; K318-T322 PolarHBondContact O-OG1 3.29Å; K318-D414 HydrophobicContact CD-CB 4.23Å; K318-D414 VanDerWaalsContact CE-OD2 3.23Å; K318-D414 WeakPolarHBondContact CE-OD2 3.38Å; K318-D414 IonicContact NZ-OD2 3.91Å; K318-D414 PolarHBondContact NZ-OD2 2.94Å; K318-I446 HydrophobicContact CB-CG2 4.33Å; K318-I446 HydrophobicContact CD-CG2 3.72Å; K318-I446 HydrophobicContact CG-CG2 3.8Å; K318-D449 IonicContact NZ-OD2 3.8Å; K318-A471 HydrophobicContact CD-CB 4.46Å; K318-A471 HydrophobicContact CG-CB 4.15Å
319	M	91.4	Very high	91.5	Very high	10 Å²	10	40.4 Å²	40.4	5%	0.049	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-40.1	174.9	-178.3	55.4	61	0	0	112.4	D309 V310 M314 V317 Q321 T322 V323 I373 P375	D309-M319 VanDerWaalsContact O-CE 3.3Å; D309-M319 WeakPolarHBondContact O-CE 3.23Å; V310-M319 HydrophobicContact CB-CE 4.24Å; V310-M319 HydrophobicContact CG1-CE 3.79Å; M314-M319 HydrophobicContact CB-CB 4.49Å; M314-M319 HydrophobicContact CB-CE 4.04Å; M314-M319 HydrophobicContact CE-CE 3.88Å; M314-M319 WeakPolarHBondContact O-CB 3.5Å; M314-M319 PolarHBondContact O-N 2.67Å; V317-M319 PolarHBondContact O-N 3.25Å; M319-Q321 VanDerWaalsContact C-N 3.32Å; M319-Q321 PolarHBondContact O-N 2.79Å; M319-T322 PolarHBondContact O-N 2.9Å; M319-V323 HydrophobicContact CG-CG2 4.17Å; M319-V323 WeakPolarHBondContact O-CB 3.48Å; M319-V323 WeakPolarHBondContact O-CG2 3.49Å; M319-V323 PolarHBondContact O-N 3.42Å; M319-V323 HydrophobicContact SD-CG2 3.77Å; M319-I373 HydrophobicContact CE-CG2 3.96Å; M319-I373 HydrophobicContact SD-CG2 3.86Å; M319-P375 HydrophobicContact CB-CG 3.6Å; M319-P375 HydrophobicContact CE-CG 4.01Å; M319-P375 HydrophobicContact CG-CG 3.58Å
320	K	90.5	Very high	91.5	Very high	144 Å²	144	40.5 Å²	40.5	63%	0.626	21%	0.214	S	C	*	.	H	α-helix	trans	-55.9	-48.8	178.1	-173.5	-165	170.4	-163.2	0	111.1	G316 V317 V323 E324	G316-K320 PolarHBondContact O-N 2.88Å; V317-K320 WeakPolarHBondContact O-CB 3.46Å; V317-K320 PolarHBondContact O-N 3.11Å; V317-K320 VanDerWaalsContact O-N 3.17Å; K320-V323 PolarHBondContact O-N 2.99Å; K320-E324 WeakPolarHBondContact O-CB 3.31Å; K320-E324 PolarHBondContact O-N 2.83Å
321	Q	88.4	Confident	91.3	Very high	14 Å²	14	45.3 Å²	45.3	7%	0.065	24%	0.24	C	C	.	.	H	α-helix	trans	-69.7	-33.9	180	-69.1	169.4	-42.9	0	0	112.6	V317 M319 E324 A325 N472 H473 A475 A476	V317-Q321 HydrophobicContact CG1-CG 4.31Å; V317-Q321 WeakPolarHBondContact O-CG 3.48Å; V317-Q321 PolarHBondContact O-N 2.7Å; V317-Q321 PolarHBondContact O-OE1 2.9Å; M319-Q321 VanDerWaalsContact C-N 3.32Å; M319-Q321 PolarHBondContact O-N 2.79Å; Q321-E324 PolarHBondContact O-N 2.77Å; Q321-A325 WeakPolarHBondContact O-CB 3.44Å; Q321-A325 PolarHBondContact O-N 2.77Å; Q321-N472 PolarHBondContact NE2-O 2.9Å; Q321-H473 PolarHBondContact NE2-O 2.82Å; Q321-A475 HydrophobicContact CB-CB 4.27Å; Q321-A475 HydrophobicContact CG-CB 4.46Å; Q321-A476 HydrophobicContact CB-CB 4.29Å
322	T	91.2	Very high	91.2	Very high	4 Å²	4	49 Å²	49	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-46.3	173	-57.2	0	0	0	0	111.1	I308 M314 K318 M319 E324 M326 V412	I308-T322 HydrophobicContact CG2-CG2 3.91Å; M314-T322 HydrophobicContact CE-CG2 4.21Å; M314-T322 WeakPolarHBondContact CE-OG1 3.36Å; K318-T322 WeakPolarHBondContact O-CB 3.46Å; K318-T322 PolarHBondContact O-N 2.82Å; K318-T322 PolarHBondContact O-OG1 3.29Å; M319-T322 PolarHBondContact O-N 2.9Å; T322-E324 VanDerWaalsContact C-N 3.33Å; T322-E324 PolarHBondContact O-N 3.4Å; T322-M326 HydrophobicContact CG2-CG 4.46Å; T322-M326 WeakPolarHBondContact O-CB 3.4Å; T322-M326 VanDerWaalsContact O-CG 3.23Å; T322-M326 WeakPolarHBondContact O-CG 3.16Å; T322-M326 PolarHBondContact O-N 3.14Å; T322-V412 HydrophobicContact CG2-CG1 4.1Å
323	V	93.2	Very high	91.3	Very high	15 Å²	15	47.9 Å²	47.9	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-40.6	174.7	166.9	0	0	0	0	111.6	M319 K320 K327 V370	M319-V323 HydrophobicContact CG-CG2 4.17Å; M319-V323 WeakPolarHBondContact O-CB 3.48Å; M319-V323 WeakPolarHBondContact O-CG2 3.49Å; M319-V323 PolarHBondContact O-N 3.42Å; M319-V323 HydrophobicContact SD-CG2 3.77Å; K320-V323 PolarHBondContact O-N 2.99Å; V323-K327 WeakPolarHBondContact O-CG 3.41Å; V323-K327 PolarHBondContact O-N 3.25Å; V323-K327 VanDerWaalsContact O-N 3.08Å; V323-V370 HydrophobicContact CB-CG1 4.22Å; V323-V370 HydrophobicContact CG1-CG1 4.2Å; V323-V370 HydrophobicContact CG2-CG1 3.94Å; V323-V370 WeakPolarHBondContact CG2-O 3.26Å
324	E	91.4	Very high	91.3	Very high	105 Å²	105	49.4 Å²	49.4	49%	0.491	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-50.8	179.2	-170.4	170.6	159.5	0	0	112.2	K320 Q321 T322 M326 K327 A328	K320-E324 WeakPolarHBondContact O-CB 3.31Å; K320-E324 PolarHBondContact O-N 2.83Å; Q321-E324 PolarHBondContact O-N 2.77Å; T322-E324 VanDerWaalsContact C-N 3.33Å; T322-E324 PolarHBondContact O-N 3.4Å; E324-M326 PolarHBondContact O-N 3.33Å; E324-K327 PolarHBondContact O-N 3.06Å; E324-A328 PolarHBondContact O-N 2.89Å
325	A	90.7	Very high	91.3	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-62.8	-42.3	176.2	0	0	0	0	0	112.1	Q321 K327 A328 I329 A476 I479 R480	Q321-A325 WeakPolarHBondContact O-CB 3.44Å; Q321-A325 PolarHBondContact O-N 2.77Å; A325-K327 VanDerWaalsContact C-N 3.31Å; A325-K327 PolarHBondContact O-N 2.81Å; A325-A328 PolarHBondContact O-N 2.82Å; A325-I329 WeakPolarHBondContact O-CG1 3.41Å; A325-I329 PolarHBondContact O-N 2.88Å; A325-A476 HydrophobicContact CB-CB 4.23Å; A325-I479 HydrophobicContact CB-CB 3.76Å; A325-I479 HydrophobicContact CB-CD1 4.19Å; A325-I479 HydrophobicContact CB-CG2 3.57Å; A325-R480 HydrophobicContact CB-CG 4.44Å
326	M	94	Very high	91.2	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.02	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-37.5	176.7	-80.3	-56.9	-46.4	0	0	112.5	F306 I308 T322 E324 A328 I329 L330 V370	F306-M326 HydrophobicContact CB-CE 3.98Å; F306-M326 HydrophobicContact CB-SD 4.5Å; F306-M326 HydrophobicContact CD1-CE 3.6Å; F306-M326 HydrophobicContact CD1-SD 3.82Å; F306-M326 HydrophobicContact CD2-CE 3.88Å; F306-M326 HydrophobicContact CE1-CE 3.97Å; F306-M326 HydrophobicContact CE1-SD 4.29Å; F306-M326 HydrophobicContact CE2-CE 4.22Å; F306-M326 HydrophobicContact CG-CE 3.54Å; F306-M326 HydrophobicContact CG-SD 4.24Å; F306-M326 HydrophobicContact CZ-CE 4.26Å; I308-M326 HydrophobicContact CD1-CE 4.42Å; I308-M326 HydrophobicContact CD1-CG 3.89Å; I308-M326 HydrophobicContact CD1-SD 4.22Å; T322-M326 HydrophobicContact CG2-CG 4.46Å; T322-M326 WeakPolarHBondContact O-CB 3.4Å; T322-M326 VanDerWaalsContact O-CG 3.23Å; T322-M326 WeakPolarHBondContact O-CG 3.16Å; T322-M326 PolarHBondContact O-N 3.14Å; E324-M326 PolarHBondContact O-N 3.33Å; M326-A328 PolarHBondContact O-N 2.92Å; M326-I329 PolarHBondContact O-N 2.83Å; M326-L330 HydrophobicContact CE-CG 4.35Å; M326-L330 WeakPolarHBondContact O-CB 3.5Å; M326-L330 WeakPolarHBondContact O-CG 3.38Å; M326-L330 PolarHBondContact O-N 3.37Å; M326-V370 HydrophobicContact CB-CG1 4.05Å
327	K	93.9	Very high	91.4	Very high	67 Å²	67	49 Å²	49	29%	0.291	24%	0.243	S	C	.	.	H	α-helix	trans	-61.8	-43	174.4	-76.9	171.1	-179.2	-178.9	0	112.3	V323 E324 A325 L330 D331 K367	V323-K327 WeakPolarHBondContact O-CG 3.41Å; V323-K327 PolarHBondContact O-N 3.25Å; V323-K327 VanDerWaalsContact O-N 3.08Å; E324-K327 PolarHBondContact O-N 3.06Å; A325-K327 VanDerWaalsContact C-N 3.31Å; A325-K327 PolarHBondContact O-N 2.81Å; K327-L330 PolarHBondContact O-N 2.69Å; K327-D331 PolarHBondContact O-N 2.85Å; K327-K367 HydrophobicContact CG-CG 4.21Å; K327-K367 WeakPolarHBondContact O-CE 3.39Å
328	A	91.1	Very high	91.7	Very high	21 Å²	21	47.9 Å²	47.9	17%	0.174	23%	0.229	C	C	.	.	H	α-helix	trans	-67.9	-43.1	178.1	0	0	0	0	0	111.7	E324 A325 M326 L330 D331 D332 R480	E324-A328 PolarHBondContact O-N 2.89Å; A325-A328 PolarHBondContact O-N 2.82Å; M326-A328 PolarHBondContact O-N 2.92Å; A328-L330 PolarHBondContact O-N 3.45Å; A328-D331 WeakPolarHBondContact O-CB 3.42Å; A328-D331 PolarHBondContact O-N 2.72Å; A328-D332 PolarHBondContact O-N 3.33Å; A328-D332 VanDerWaalsContact O-N 3.09Å; A328-R480 HydrophobicContact CB-CG 4.2Å
329	I	93.7	Very high	92.1	Very high	6 Å²	6	46.2 Å²	46.2	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-35.1	175	-71.7	172.1	0	0	0	111.7	F306 A325 M326 D332 I479 Y483	F306-I329 HydrophobicContact CE1-CG2 3.57Å; F306-I329 HydrophobicContact CZ-CG2 3.49Å; F306-I329 VanDerWaalsContact CZ-CG2 3.49Å; A325-I329 WeakPolarHBondContact O-CG1 3.41Å; A325-I329 PolarHBondContact O-N 2.88Å; M326-I329 PolarHBondContact O-N 2.83Å; I329-D332 PolarHBondContact O-N 2.7Å; I329-I479 HydrophobicContact CD1-CG2 3.85Å; I329-Y483 HydrophobicContact CB-CD1 4.23Å; I329-Y483 HydrophobicContact CB-CE1 4.47Å; I329-Y483 HydrophobicContact CB-CG 4.44Å; I329-Y483 HydrophobicContact CD1-CD1 4.49Å; I329-Y483 HydrophobicContact CD1-CG 4.01Å; I329-Y483 HydrophobicContact CG1-CD1 3.75Å; I329-Y483 HydrophobicContact CG1-CE1 4.47Å; I329-Y483 HydrophobicContact CG1-CG 3.77Å; I329-Y483 HydrophobicContact CG2-CD1 3.97Å; I329-Y483 HydrophobicContact CG2-CD2 3.97Å; I329-Y483 HydrophobicContact CG2-CE1 3.93Å; I329-Y483 HydrophobicContact CG2-CE2 3.96Å; I329-Y483 HydrophobicContact CG2-CG 3.98Å
330	L	94.8	Very high	92.4	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-73.3	-21.8	175.1	-70.8	170.9	0	0	0	113.8	F306 M326 K327 A328 L333 F339 I341 V363 A366 K367	F306-L330 HydrophobicContact CE2-CD2 4.44Å; M326-L330 HydrophobicContact CE-CG 4.35Å; M326-L330 WeakPolarHBondContact O-CB 3.5Å; M326-L330 WeakPolarHBondContact O-CG 3.38Å; M326-L330 PolarHBondContact O-N 3.37Å; K327-L330 PolarHBondContact O-N 2.69Å; A328-L330 PolarHBondContact O-N 3.45Å; L330-L333 HydrophobicContact CD2-CD1 3.74Å; L330-F339 HydrophobicContact CD2-CD2 3.77Å; L330-F339 HydrophobicContact CD2-CE2 3.45Å; L330-F339 VanDerWaalsContact CD2-CE2 3.45Å; L330-F339 HydrophobicContact CD2-CZ 4.1Å; L330-I341 HydrophobicContact CD1-CD1 4.11Å; L330-I341 HydrophobicContact CD2-CD1 4.36Å; L330-V363 HydrophobicContact CB-CG1 4.29Å; L330-V363 VanDerWaalsContact O-CG1 3.27Å; L330-V363 WeakPolarHBondContact O-CG1 3.22Å; L330-A366 HydrophobicContact CD1-CB 4.13Å; L330-K367 HydrophobicContact CB-CG 4.28Å; L330-K367 HydrophobicContact CD1-CG 3.86Å
331	D	92.7	Very high	92.8	Very high	102 Å²	102	38.9 Å²	38.9	55%	0.545	19%	0.19	S	C	.	.	H	α-helix	trans	-77.5	-33.5	168.4	-71.9	-48.8	0	0	0	112.1	K327 A328 L333 K367	K327-D331 PolarHBondContact O-N 2.85Å; A328-D331 WeakPolarHBondContact O-CB 3.42Å; A328-D331 PolarHBondContact O-N 2.72Å; D331-L333 PolarHBondContact O-N 2.82Å; D331-K367 IonicContact OD1-NZ 2.65Å; D331-K367 PolarHBondContact OD1-NZ 3Å; D331-K367 IonicContact OD2-NZ 3.89Å; D331-K367 PolarHBondContact OD2-NZ 3.17Å
332	D	91.3	Very high	93.2	Very high	77 Å²	77	38.2 Å²	38.2	41%	0.412	19%	0.186	S	C	.	.	S	Bend	trans	-74.4	0.3	178.2	-67.7	-28.2	0	0	0	113.3	A328 I329 Y483	A328-D332 PolarHBondContact O-N 3.33Å; A328-D332 VanDerWaalsContact O-N 3.09Å; I329-D332 PolarHBondContact O-N 2.7Å; D332-Y483 HydrophobicContact CB-CD1 4.48Å; D332-Y483 HydrophobicContact CB-CE1 3.81Å
333	L	92.5	Very high	93.4	Very high	14 Å²	14	38.2 Å²	38.2	7%	0.073	19%	0.186	C	C	.	.			trans	-80.9	132.8	173.6	-70.2	178.2	0	0	0	111.5	I304 L330 D331 D337 F339 A358 Y483	I304-L333 HydrophobicContact CD1-CD2 4.04Å; L330-L333 HydrophobicContact CD2-CD1 3.74Å; D331-L333 PolarHBondContact O-N 2.82Å; L333-D337 HydrophobicContact CD2-CB 4.24Å; L333-F339 HydrophobicContact CD1-CB 4.13Å; L333-F339 HydrophobicContact CD1-CD1 3.86Å; L333-F339 HydrophobicContact CD1-CD2 4.18Å; L333-F339 HydrophobicContact CD1-CE1 4.33Å; L333-F339 HydrophobicContact CD1-CG 3.78Å; L333-A358 HydrophobicContact CB-CB 3.66Å; L333-A358 HydrophobicContact CD1-CB 4.06Å; L333-A358 HydrophobicContact CG-CB 4.46Å; L333-Y483 WeakPolarHBondContact CD2-OH 3.35Å
334	K	90.8	Very high	93.6	Very high	85 Å²	85	37.5 Å²	37.5	37%	0.37	18%	0.182	S	C	.	.			trans	-86.6	157.1	175.3	-59.6	178.9	-179.4	-175	0	111.4	E336 D337 A358	K334-E336 HydrophobicContact CB-CG 3.81Å; K334-E336 HydrophobicContact CD-CG 3.89Å; K334-E336 WeakPolarHBondContact CD-OE1 3.32Å; K334-E336 WeakPolarHBondContact CE-OE1 3.46Å; K334-E336 IonicContact NZ-OE1 2.96Å; K334-E336 PolarHBondContact NZ-OE1 2.9Å; K334-E336 PolarHBondContact O-N 3.38Å; K334-D337 PolarHBondContact N-OD2 2.85Å; K334-D337 WeakPolarHBondContact O-CB 3.22Å; K334-D337 PolarHBondContact O-N 3.48Å; K334-A358 WeakPolarHBondContact O-CB 3.45Å
335	M	90.1	Very high	93.7	Very high	142 Å²	142	32.6 Å²	32.6	70%	0.7	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.1	174.6	-166.1	-177.9	-63.4	0	0	114.5
336	E	88.2	Confident	93.8	Very high	89 Å²	89	36.4 Å²	36.4	42%	0.416	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-17.6	173.7	64.7	-173.5	-176.3	0	0	114.1	P301 K334	P301-E336 HydrophobicContact CB-CB 4.31Å; P301-E336 HydrophobicContact CB-CG 4.15Å; P301-E336 HydrophobicContact CG-CB 4.29Å; P301-E336 HydrophobicContact CG-CG 4.17Å; K334-E336 HydrophobicContact CB-CG 3.81Å; K334-E336 HydrophobicContact CD-CG 3.89Å; K334-E336 WeakPolarHBondContact CD-OE1 3.32Å; K334-E336 WeakPolarHBondContact CE-OE1 3.46Å; K334-E336 IonicContact NZ-OE1 2.96Å; K334-E336 PolarHBondContact NZ-OE1 2.9Å; K334-E336 PolarHBondContact O-N 3.38Å
337	D	92.8	Very high	93.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.			trans	-79.2	148.3	175.8	-62.2	-46.7	0	0	0	110.9	K302 L333 K334 P357 A358	K302-D337 WeakPolarHBondContact CB-OD1 3.35Å; K302-D337 PolarHBondContact N-OD1 3.26Å; K302-D337 IonicContact NZ-OD1 3.21Å; K302-D337 PolarHBondContact NZ-OD1 3.24Å; K302-D337 IonicContact NZ-OD2 3.78Å; K302-D337 PolarHBondContact NZ-OD2 3Å; K302-D337 CarbonylContact O-C 3.51Å; K302-D337 WeakPolarHBondContact O-CA 3.17Å; L333-D337 HydrophobicContact CD2-CB 4.24Å; K334-D337 PolarHBondContact N-OD2 2.85Å; K334-D337 WeakPolarHBondContact O-CB 3.22Å; K334-D337 PolarHBondContact O-N 3.48Å; D337-P357 WeakPolarHBondContact O-CA 3.38Å; D337-A358 PolarHBondContact O-N 2.93Å
338	R	94.8	Very high	93.8	Very high	70 Å²	70	38.3 Å²	38.3	26%	0.264	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.8	169.8	-65.7	-177.7	174.5	-86.1	2.6	110.7	K302 N303 I304 L355 L356 F400	K302-R338 PolarHBondContact O-N 2.99Å; N303-R338 CarbonylContact C-O 3.56Å; N303-R338 VanDerWaalsContact CA-O 3.31Å; N303-R338 WeakPolarHBondContact CA-O 3.18Å; I304-R338 PolarHBondContact N-O 2.8Å; R338-L355 HydrophobicContact CB-CB 4.14Å; R338-L355 PolarHBondContact NH1-O 3.05Å; R338-L356 CarbonylContact C-O 3.59Å; R338-L356 VanDerWaalsContact CA-O 3.29Å; R338-L356 WeakPolarHBondContact CA-O 3.5Å; R338-F400 PolarHBondContact NE-O 3.09Å; R338-F400 PolarHBondContact NH2-O 2.98Å
339	F	96.8	Very high	94	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	163.6	178.4	78.9	-68.6	0	0	0	114.1	I304 F306 L330 L333 I341 W351 L356 A358 V363 A366	I304-F339 CarbonylContact O-C 3.58Å; I304-F339 WeakPolarHBondContact O-CA 3.26Å; I304-F339 WeakPolarHBondContact O-CB 3.45Å; F306-F339 HydrophobicContact CE2-CB 4.37Å; F306-F339 HydrophobicContact CE2-CD2 4.45Å; L330-F339 HydrophobicContact CD2-CD2 3.77Å; L330-F339 HydrophobicContact CD2-CE2 3.45Å; L330-F339 VanDerWaalsContact CD2-CE2 3.45Å; L330-F339 HydrophobicContact CD2-CZ 4.1Å; L333-F339 HydrophobicContact CD1-CB 4.13Å; L333-F339 HydrophobicContact CD1-CD1 3.86Å; L333-F339 HydrophobicContact CD1-CD2 4.18Å; L333-F339 HydrophobicContact CD1-CE1 4.33Å; L333-F339 HydrophobicContact CD1-CG 3.78Å; F339-I341 HydrophobicContact CD2-CG1 4.23Å; F339-I341 HydrophobicContact CE2-CD1 4.31Å; F339-I341 HydrophobicContact CE2-CG1 4.26Å; F339-W351 HydrophobicContact CD2-CZ3 4.04Å; F339-W351 HydrophobicContact CE1-CH2 4.12Å; F339-W351 HydrophobicContact CE1-CZ3 4.12Å; F339-W351 HydrophobicContact CE2-CE3 4.05Å; F339-W351 AromaticContact CE2-CH2 3.9Å; F339-W351 HydrophobicContact CE2-CH2 3.9Å; F339-W351 AromaticContact CE2-CZ3 3.4Å; F339-W351 HydrophobicContact CE2-CZ3 3.4Å; F339-W351 HydrophobicContact CZ-CE3 4.46Å; F339-W351 AromaticContact CZ-CH2 3.47Å; F339-W351 HydrophobicContact CZ-CH2 3.47Å; F339-W351 VanDerWaalsContact CZ-CH2 3.47Å; F339-W351 HydrophobicContact CZ-CZ2 4.49Å; F339-W351 AromaticContact CZ-CZ3 3.45Å; F339-W351 HydrophobicContact CZ-CZ3 3.45Å; F339-W351 VanDerWaalsContact CZ-CZ3 3.45Å; F339-L356 PolarHBondContact N-O 2.78Å; F339-L356 PolarHBondContact O-N 3.47Å; F339-L356 VanDerWaalsContact O-N 3.09Å; F339-A358 HydrophobicContact CD1-CB 3.98Å; F339-A358 HydrophobicContact CE1-CB 4.06Å; F339-V363 HydrophobicContact CE1-CG2 4.46Å; F339-A366 HydrophobicContact CE2-CB 3.51Å; F339-A366 HydrophobicContact CZ-CB 3.64Å
340	S	97.4	Very high	94.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	167.9	156.6	-170.9	0	0	0	0	109.7	I304 F306 S352 M391	I304-S340 PolarHBondContact O-N 3.08Å; F306-S340 PolarHBondContact N-O 2.95Å; F306-S340 VanDerWaalsContact N-O 3.09Å; S340-S352 PolarHBondContact OG-O 3.13Å; S340-M391 VanDerWaalsContact CB-SD 3.53Å
341	I	98.2	Very high	94.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.6	179.3	-53.4	-177.5	0	0	0	107.9	F306 I308 L330 F339 W351 A366 V370	F306-I341 HydrophobicContact CB-CG1 4.45Å; F306-I341 HydrophobicContact CD2-CG1 4.31Å; I308-I341 HydrophobicContact CD1-CG2 3.76Å; I308-I341 HydrophobicContact CG1-CG2 4.44Å; L330-I341 HydrophobicContact CD1-CD1 4.11Å; L330-I341 HydrophobicContact CD2-CD1 4.36Å; F339-I341 HydrophobicContact CD2-CG1 4.23Å; F339-I341 HydrophobicContact CE2-CD1 4.31Å; F339-I341 HydrophobicContact CE2-CG1 4.26Å; I341-W351 HydrophobicContact CB-CB 4.16Å; I341-W351 HydrophobicContact CG1-CE3 4.45Å; I341-W351 PolarHBondContact O-N 2.85Å; I341-A366 HydrophobicContact CD1-CB 4Å; I341-V370 HydrophobicContact CD1-CG2 3.5Å; I341-V370 HydrophobicContact CG2-CG2 4.35Å
342	I	97.9	Very high	94.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.9	171.6	-63.9	-177.8	0	0	0	107.1	V305 F306 V307 I308 V348 R349 R387 A388 M391	V305-I342 HydrophobicContact CG1-CD1 3.75Å; V305-I342 HydrophobicContact CG1-CG1 3.9Å; F306-I342 PolarHBondContact O-N 2.85Å; V307-I342 CarbonylContact C-O 3.57Å; V307-I342 WeakPolarHBondContact CA-O 3.39Å; V307-I342 HydrophobicContact CG2-CB 4.43Å; I308-I342 PolarHBondContact N-O 3.05Å; I342-V348 HydrophobicContact CG2-CG1 3.5Å; I342-V348 VanDerWaalsContact CG2-CG1 3.5Å; I342-R349 CarbonylContact C-O 3.6Å; I342-R349 VanDerWaalsContact CA-O 3.23Å; I342-R349 WeakPolarHBondContact CA-O 3.38Å; I342-R349 WeakPolarHBondContact CG2-O 2.97Å; I342-R387 HydrophobicContact CD1-CB 4.19Å; I342-R387 HydrophobicContact CD1-CG 4.11Å; I342-A388 HydrophobicContact CD1-CB 4.02Å; I342-M391 HydrophobicContact CD1-CE 4.23Å; I342-M391 HydrophobicContact CG1-CE 4.43Å
343	D	96.1	Very high	94.4	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	141.2	164.5	82.2	81	0	0	0	109.6	I308 V310 R349 Y369 I373	I308-D343 WeakPolarHBondContact O-CA 3.35Å; V310-D343 HydrophobicContact CG1-CB 3.81Å; V310-D343 HydrophobicContact CG2-CB 4.08Å; V310-D343 WeakPolarHBondContact CG2-OD1 3.48Å; D343-R349 PolarHBondContact N-O 3.11Å; D343-R349 PolarHBondContact O-N 2.83Å; D343-R349 VanDerWaalsContact O-O 3.14Å; D343-R349 IonicContact OD1-CZ 2.82Å; D343-R349 IonicContact OD1-NE 3.69Å; D343-R349 PolarHBondContact OD1-NE 3.21Å; D343-R349 IonicContact OD1-NH2 3.15Å; D343-R349 PolarHBondContact OD1-NH2 3.32Å; D343-R349 WeakPolarHBondContact OD2-CB 3.2Å; D343-R349 IonicContact OD2-NE 2.89Å; D343-R349 PolarHBondContact OD2-NE 3.19Å; D343-Y369 PolarHBondContact OD2-OH 3.11Å; D343-I373 HydrophobicContact CB-CD1 4.2Å
344	F	96.4	Very high	94.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	139.7	179.7	77.2	-82.4	0	0	0	112.8	V307 I308 D309 V310 N347 V348 T379 I381 A384 L411	V307-F344 HydrophobicContact CG1-CD1 3.63Å; V307-F344 HydrophobicContact CG1-CE1 3.72Å; I308-F344 VanDerWaalsContact C-CE1 3.49Å; I308-F344 VanDerWaalsContact O-CD1 3.24Å; I308-F344 WeakPolarHBondContact O-CD1 3.39Å; I308-F344 PolarHBondContact O-N 2.78Å; D309-F344 VanDerWaalsContact CA-CE1 3.44Å; D309-F344 HydrophobicContact CB-CE1 3.82Å; D309-F344 HydrophobicContact CB-CE2 4.36Å; D309-F344 HydrophobicContact CB-CZ 3.63Å; D309-F344 VanDerWaalsContact N-CE1 3.28Å; V310-F344 WeakPolarHBondContact CG2-O 3.31Å; V310-F344 PolarHBondContact N-O 3.07Å; F344-N347 WeakPolarHBondContact CA-O 3.37Å; F344-V348 HydrophobicContact CB-CG2 4.22Å; F344-T379 HydrophobicContact CE2-CG2 3.78Å; F344-I381 HydrophobicContact CE2-CB 4.38Å; F344-I381 HydrophobicContact CE2-CG1 3.71Å; F344-I381 HydrophobicContact CZ-CG1 3.95Å; F344-A384 HydrophobicContact CB-CB 3.63Å; F344-A384 HydrophobicContact CD1-CB 3.77Å; F344-A384 HydrophobicContact CD2-CB 4.06Å; F344-A384 HydrophobicContact CE1-CB 4.48Å; F344-A384 HydrophobicContact CG-CB 3.53Å; F344-L411 HydrophobicContact CE1-CD1 3.76Å; F344-L411 HydrophobicContact CZ-CD1 3.95Å
345	N	94.2	Very high	94.6	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	20%	0.197	C	C	.	.	S	Bend	trans	-136	-111.9	167.6	58.3	14.1	0	0	0	109.2	V310 N347 T376 G378 T379 N380	V310-N345 HydrophobicContact CG2-CB 4.04Å; N345-N347 PolarHBondContact N-O 2.82Å; N345-N347 PolarHBondContact OD1-N 3.48Å; N345-N347 PolarHBondContact OD1-O 2.94Å; N345-T376 WeakPolarHBondContact CB-O 3.35Å; N345-T376 PolarHBondContact ND2-O 3.33Å; N345-T376 PolarHBondContact ND2-OG1 3.09Å; N345-G378 CarbonylContact C-O 3.56Å; N345-G378 WeakPolarHBondContact CA-O 3.27Å; N345-G378 VanDerWaalsContact CB-O 3.25Å; N345-G378 WeakPolarHBondContact CB-O 3.4Å; N345-T379 CarbonylContact O-C 3.28Å; N345-N380 WeakPolarHBondContact O-CB 3.39Å; N345-N380 PolarHBondContact O-N 3.24Å
346	H	91.9	Very high	94.8	Very high	81 Å²	81	36.8 Å²	36.8	38%	0.375	17%	0.174	S	C	.	.	S	Bend	trans	-76.5	-30.6	164.3	55	-77.6	0	0	0	111.5	G378 V419	H346-G378 PolarHBondContact N-O 3.09Å; H346-V419 HydrophobicContact CB-CB 4.49Å; H346-V419 HydrophobicContact CB-CG1 4.04Å; H346-V419 HydrophobicContact CB-CG2 4.14Å
347	N	92.4	Very high	95.1	Very high	82 Å²	82	35.2 Å²	35.2	44%	0.439	17%	0.171	S	C	.	.	S	Bend	trans	-102.1	159.2	171.4	-54.1	-42.8	0	0	0	110	F344 N345	F344-N347 WeakPolarHBondContact CA-O 3.37Å; N345-N347 PolarHBondContact N-O 2.82Å; N345-N347 PolarHBondContact OD1-N 3.48Å; N345-N347 PolarHBondContact OD1-O 2.94Å
348	V	95.1	Very high	95.2	Very high	30 Å²	30	35.5 Å²	35.5	18%	0.182	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.1	168.3	-177.5	0	0	0	0	108.6	I342 F344 E383 A384 R387	I342-V348 HydrophobicContact CG2-CG1 3.5Å; I342-V348 VanDerWaalsContact CG2-CG1 3.5Å; F344-V348 HydrophobicContact CB-CG2 4.22Å; V348-E383 HydrophobicContact CG2-CB 3.77Å; V348-E383 HydrophobicContact CG2-CG 3.74Å; V348-A384 HydrophobicContact CG1-CB 4.38Å; V348-A384 HydrophobicContact CG2-CB 4.15Å; V348-R387 HydrophobicContact CG1-CB 4.27Å; V348-R387 HydrophobicContact CG1-CG 4.33Å
349	R	95.7	Very high	95.2	Very high	102 Å²	102	33.7 Å²	33.7	39%	0.385	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.3	-179.2	-67.9	179.9	-67.2	-143.8	-5.6	110.4	I342 D343	I342-R349 CarbonylContact C-O 3.6Å; I342-R349 VanDerWaalsContact CA-O 3.23Å; I342-R349 WeakPolarHBondContact CA-O 3.38Å; I342-R349 WeakPolarHBondContact CG2-O 2.97Å; D343-R349 PolarHBondContact N-O 3.11Å; D343-R349 PolarHBondContact O-N 2.83Å; D343-R349 VanDerWaalsContact O-O 3.14Å; D343-R349 IonicContact OD1-CZ 2.82Å; D343-R349 IonicContact OD1-NE 3.69Å; D343-R349 PolarHBondContact OD1-NE 3.21Å; D343-R349 IonicContact OD1-NH2 3.15Å; D343-R349 PolarHBondContact OD1-NH2 3.32Å; D343-R349 WeakPolarHBondContact OD2-CB 3.2Å; D343-R349 IonicContact OD2-NE 2.89Å; D343-R349 PolarHBondContact OD2-NE 3.19Å
350	C	95.9	Very high	95.2	Very high	28 Å²	28	38.4 Å²	38.4	19%	0.189	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.4	177.3	-50.4	0	0	0	0	109.3	S352 E353	C350-S352 VanDerWaalsContact C-N 3.35Å; C350-S352 WeakPolarHBondContact CB-O 3.3Å; C350-E353 PolarHBondContact SG-OE1 2.76Å; C350-E353 VanDerWaalsContact SG-OE1 3.4Å
351	W	97.1	Very high	95.1	Very high	33 Å²	33	44.9 Å²	44.9	13%	0.125	24%	0.236	C	C	.	.	S	Bend	trans	-65.2	-42.5	163.7	164.8	62.7	0	0	0	110.7	F339 I341 L356 Q362 D365 A366 Y369	F339-W351 HydrophobicContact CD2-CZ3 4.04Å; F339-W351 HydrophobicContact CE1-CH2 4.12Å; F339-W351 HydrophobicContact CE1-CZ3 4.12Å; F339-W351 HydrophobicContact CE2-CE3 4.05Å; F339-W351 AromaticContact CE2-CH2 3.9Å; F339-W351 HydrophobicContact CE2-CH2 3.9Å; F339-W351 AromaticContact CE2-CZ3 3.4Å; F339-W351 HydrophobicContact CE2-CZ3 3.4Å; F339-W351 HydrophobicContact CZ-CE3 4.46Å; F339-W351 AromaticContact CZ-CH2 3.47Å; F339-W351 HydrophobicContact CZ-CH2 3.47Å; F339-W351 VanDerWaalsContact CZ-CH2 3.47Å; F339-W351 HydrophobicContact CZ-CZ2 4.49Å; F339-W351 AromaticContact CZ-CZ3 3.45Å; F339-W351 HydrophobicContact CZ-CZ3 3.45Å; F339-W351 VanDerWaalsContact CZ-CZ3 3.45Å; I341-W351 HydrophobicContact CB-CB 4.16Å; I341-W351 HydrophobicContact CG1-CE3 4.45Å; I341-W351 PolarHBondContact O-N 2.85Å; W351-L356 HydrophobicContact CH2-CB 4.48Å; W351-L356 HydrophobicContact CH2-CD1 3.87Å; W351-L356 HydrophobicContact CZ2-CD1 4.32Å; W351-L356 HydrophobicContact CZ3-CD1 4.3Å; W351-Q362 HydrophobicContact CH2-CB 4.19Å; W351-Q362 WeakPolarHBondContact CZ2-O 3.26Å; W351-D365 PolarHBondContact NE1-OD2 2.69Å; W351-A366 HydrophobicContact CD2-CB 4.07Å; W351-A366 HydrophobicContact CE3-CB 4.19Å; W351-A366 HydrophobicContact CH2-CB 3.93Å; W351-A366 HydrophobicContact CZ2-CB 3.78Å; W351-A366 HydrophobicContact CZ3-CB 4.13Å; W351-Y369 HydrophobicContact CB-CD1 3.84Å; W351-Y369 HydrophobicContact CB-CD2 3.86Å; W351-Y369 HydrophobicContact CB-CE1 3.88Å; W351-Y369 HydrophobicContact CB-CE2 3.87Å; W351-Y369 HydrophobicContact CB-CG 3.83Å; W351-Y369 AromaticContact CD1-CD2 3.55Å; W351-Y369 AromaticContact CD1-CG 3.63Å; W351-Y369 HydrophobicContact CG-CD1 4.36Å; W351-Y369 HydrophobicContact CG-CD2 4.06Å; W351-Y369 AromaticContact CG-CG 3.96Å; W351-Y369 HydrophobicContact CG-CG 3.96Å
352	S	95.3	Very high	95.1	Very high	18 Å²	18	47.6 Å²	47.6	13%	0.126	25%	0.249	C	C	.	.			trans	-134.3	136.3	171.3	175.1	0	0	0	0	110.4	S340 C350 E354 L356 M391	S340-S352 PolarHBondContact OG-O 3.13Å; C350-S352 VanDerWaalsContact C-N 3.35Å; C350-S352 WeakPolarHBondContact CB-O 3.3Å; S352-E354 WeakPolarHBondContact CB-O 3.13Å; S352-E354 PolarHBondContact O-N 3.39Å; S352-E354 PolarHBondContact OG-N 3.45Å; S352-E354 PolarHBondContact OG-O 2.93Å; S352-L356 WeakPolarHBondContact OG-CG 3.5Å; S352-M391 VanDerWaalsContact O-CE 3.23Å; S352-M391 WeakPolarHBondContact O-CE 3.47Å
353	E	92.9	Very high	95	Very high	85 Å²	85	48.3 Å²	48.3	40%	0.397	25%	0.253	S	S	.	.	S	Bend	trans	-71.7	-14.1	173.3	-80.1	-66.3	148.6	0	0	113.5	C350 R387	C350-E353 PolarHBondContact SG-OE1 2.76Å; C350-E353 VanDerWaalsContact SG-OE1 3.4Å; E353-R387 IonicContact OE1-CZ 2.65Å; E353-R387 IonicContact OE1-NH1 2.68Å; E353-R387 IonicContact OE1-NH2 3.65Å; E353-R387 PolarHBondContact OE1-NH2 3.23Å; E353-R387 IonicContact OE2-CZ 2.82Å; E353-R387 IonicContact OE2-NH1 2.98Å; E353-R387 PolarHBondContact OE2-NH1 3.03Å; E353-R387 IonicContact OE2-NH2 3.04Å; E353-R387 PolarHBondContact OE2-NH2 3.46Å
354	E	92.4	Very high	95.1	Very high	100 Å²	100	50.4 Å²	50.4	47%	0.467	27%	0.271	S	S	.	.	S	Bend	trans	-129.9	162.1	-178.4	-59.9	-171	163.4	0	0	111.7	S352 L356	S352-E354 WeakPolarHBondContact CB-O 3.13Å; S352-E354 PolarHBondContact O-N 3.39Å; S352-E354 PolarHBondContact OG-N 3.45Å; S352-E354 PolarHBondContact OG-O 2.93Å; E354-L356 PolarHBondContact O-N 3.3Å
355	L	94.1	Very high	95.1	Very high	8 Å²	8	53.2 Å²	53.2	4%	0.042	29%	0.286	C	S	.	.			trans	-85	97.1	-176.8	-64.7	174.3	0	0	0	111.6	N303 V305 R338 M391 L392 A395	N303-L355 HydrophobicContact CB-CD1 4.29Å; V305-L355 HydrophobicContact CG2-CD2 3.86Å; R338-L355 HydrophobicContact CB-CB 4.14Å; R338-L355 PolarHBondContact NH1-O 3.05Å; L355-M391 HydrophobicContact CD2-CG 4.13Å; L355-M391 HydrophobicContact CD2-SD 3.74Å; L355-M391 HydrophobicContact CG-CG 4.14Å; L355-M391 HydrophobicContact CG-SD 4.31Å; L355-L392 HydrophobicContact CD1-CD2 3.81Å; L355-L392 HydrophobicContact CD2-CD2 4.49Å; L355-A395 HydrophobicContact CD1-CB 3.55Å; L355-A395 HydrophobicContact CG-CB 4.24Å
356	L	94.6	Very high	95.3	Very high	42 Å²	42	53.2 Å²	53.2	22%	0.22	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	144.6	-177.4	-56	-177.1	0	0	0	110.8	R338 F339 W351 S352 E354	R338-L356 CarbonylContact C-O 3.59Å; R338-L356 VanDerWaalsContact CA-O 3.29Å; R338-L356 WeakPolarHBondContact CA-O 3.5Å; F339-L356 PolarHBondContact N-O 2.78Å; F339-L356 PolarHBondContact O-N 3.47Å; F339-L356 VanDerWaalsContact O-N 3.09Å; W351-L356 HydrophobicContact CH2-CB 4.48Å; W351-L356 HydrophobicContact CH2-CD1 3.87Å; W351-L356 HydrophobicContact CZ2-CD1 4.32Å; W351-L356 HydrophobicContact CZ3-CD1 4.3Å; S352-L356 WeakPolarHBondContact OG-CG 3.5Å; E354-L356 PolarHBondContact O-N 3.3Å
357	P	94.3	Very high	95.5	Very high	56 Å²	56	51.5 Å²	51.5	36%	0.364	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	143.7	173.5	30.2	-34.9	0	0	0	110.4	D337 S359	D337-P357 WeakPolarHBondContact O-CA 3.38Å; P357-S359 PolarHBondContact O-N 3.12Å
358	A	95.1	Very high	95.7	Very high	5 Å²	5	54.5 Å²	54.5	4%	0.041	28%	0.283	C	S	.	.			trans	-75.5	60.5	178.4	0	0	0	0	0	112.5	L333 K334 D337 F339 V363	L333-A358 HydrophobicContact CB-CB 3.66Å; L333-A358 HydrophobicContact CD1-CB 4.06Å; L333-A358 HydrophobicContact CG-CB 4.46Å; K334-A358 WeakPolarHBondContact O-CB 3.45Å; D337-A358 PolarHBondContact O-N 2.93Å; F339-A358 HydrophobicContact CD1-CB 3.98Å; F339-A358 HydrophobicContact CE1-CB 4.06Å; A358-V363 HydrophobicContact CB-CG2 4.06Å
359	S	95.8	Very high	95.8	Very high	33 Å²	33	55.9 Å²	55.9	23%	0.231	29%	0.285	C	S	.	.			trans	-74.1	152	165.7	66.2	0	0	0	0	110.6	P357 L361 Q362 V363	P357-S359 PolarHBondContact O-N 3.12Å; S359-L361 PolarHBondContact O-N 2.65Å; S359-L361 VanDerWaalsContact O-N 3.08Å; S359-Q362 PolarHBondContact O-N 3.03Å; S359-Q362 WeakPolarHBondContact OG-CG 3.49Å; S359-V363 PolarHBondContact O-N 2.97Å
360	P	95.6	Very high	95.8	Very high	99 Å²	99	51 Å²	51	64%	0.643	27%	0.267	S	S	*	.	H	α-helix	trans	-55	-32.1	-178.3	-29.2	36.3	0	0	0	114.5	A364	P360-A364 VanDerWaalsContact O-CB 3.23Å; P360-A364 WeakPolarHBondContact O-CB 3.42Å; P360-A364 PolarHBondContact O-N 3.15Å
361	L	96.3	Very high	95.8	Very high	135 Å²	135	54.4 Å²	54.4	71%	0.707	28%	0.28	S	S	*	.	H	α-helix	trans	-65.7	-46.2	176	-176.8	67.5	0	0	0	112	S359 A364 D365	S359-L361 PolarHBondContact O-N 2.65Å; S359-L361 VanDerWaalsContact O-N 3.08Å; L361-A364 PolarHBondContact O-N 2.79Å; L361-D365 PolarHBondContact O-N 2.87Å; L361-D365 VanDerWaalsContact O-N 3.12Å
362	Q	96.9	Very high	95.7	Very high	57 Å²	57	58.1 Å²	58.1	27%	0.266	30%	0.302	S	S	.	.	H	α-helix	trans	-72.7	-38.2	-178.9	-65.1	-63	-8.2	0	0	111.6	W351 S359 D365 A366	W351-Q362 HydrophobicContact CH2-CB 4.19Å; W351-Q362 WeakPolarHBondContact CZ2-O 3.26Å; S359-Q362 PolarHBondContact O-N 3.03Å; S359-Q362 WeakPolarHBondContact OG-CG 3.49Å; Q362-D365 PolarHBondContact O-N 3.27Å; Q362-A366 WeakPolarHBondContact O-CB 3.43Å; Q362-A366 PolarHBondContact O-N 3.14Å
363	V	97.1	Very high	95.5	Very high	15 Å²	15	58.4 Å²	58.4	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-60.3	-44.7	171.2	167.6	0	0	0	0	111	L330 F339 A358 S359 D365 K367	L330-V363 HydrophobicContact CB-CG1 4.29Å; L330-V363 VanDerWaalsContact O-CG1 3.27Å; L330-V363 WeakPolarHBondContact O-CG1 3.22Å; F339-V363 HydrophobicContact CE1-CG2 4.46Å; A358-V363 HydrophobicContact CB-CG2 4.06Å; S359-V363 PolarHBondContact O-N 2.97Å; V363-D365 PolarHBondContact O-N 3.01Å; V363-K367 HydrophobicContact CG1-CD 4.19Å; V363-K367 WeakPolarHBondContact O-CB 3.43Å; V363-K367 VanDerWaalsContact O-CG 3.26Å; V363-K367 WeakPolarHBondContact O-CG 3.43Å; V363-K367 PolarHBondContact O-N 2.79Å
364	A	97	Very high	95.4	Very high	49 Å²	49	61.8 Å²	61.8	41%	0.405	32%	0.316	S	S	.	.	H	α-helix	trans	-64.4	-36.3	178.3	0	0	0	0	0	113.1	P360 L361 R368	P360-A364 VanDerWaalsContact O-CB 3.23Å; P360-A364 WeakPolarHBondContact O-CB 3.42Å; P360-A364 PolarHBondContact O-N 3.15Å; L361-A364 PolarHBondContact O-N 2.79Å; A364-R368 PolarHBondContact O-N 3.28Å
365	D	97.6	Very high	95.4	Very high	59 Å²	59	58.2 Å²	58.2	32%	0.316	30%	0.301	S	S	.	.	H	α-helix	trans	-75.8	-42.6	176	-166.3	69.1	0	0	0	113	W351 L361 Q362 V363 K367 R368 Y369	W351-D365 PolarHBondContact NE1-OD2 2.69Å; L361-D365 PolarHBondContact O-N 2.87Å; L361-D365 VanDerWaalsContact O-N 3.12Å; Q362-D365 PolarHBondContact O-N 3.27Å; V363-D365 PolarHBondContact O-N 3.01Å; D365-K367 PolarHBondContact O-N 2.95Å; D365-R368 CarbonylContact O-C 3.59Å; D365-R368 WeakPolarHBondContact O-CA 3.28Å; D365-R368 VanDerWaalsContact O-CB 3.29Å; D365-R368 WeakPolarHBondContact O-CB 3.17Å; D365-R368 PolarHBondContact O-N 2.89Å; D365-R368 IonicContact OD1-CZ 2.65Å; D365-R368 IonicContact OD1-NH1 3.57Å; D365-R368 PolarHBondContact OD1-NH1 3.04Å; D365-Y369 PolarHBondContact O-N 3.35Å
366	A	97.3	Very high	95.3	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-56.6	-39.6	172.8	0	0	0	0	0	112.3	L330 F339 I341 W351 Q362 R368 Y369 V370	L330-A366 HydrophobicContact CD1-CB 4.13Å; F339-A366 HydrophobicContact CE2-CB 3.51Å; F339-A366 HydrophobicContact CZ-CB 3.64Å; I341-A366 HydrophobicContact CD1-CB 4Å; W351-A366 HydrophobicContact CD2-CB 4.07Å; W351-A366 HydrophobicContact CE3-CB 4.19Å; W351-A366 HydrophobicContact CH2-CB 3.93Å; W351-A366 HydrophobicContact CZ2-CB 3.78Å; W351-A366 HydrophobicContact CZ3-CB 4.13Å; Q362-A366 WeakPolarHBondContact O-CB 3.43Å; Q362-A366 PolarHBondContact O-N 3.14Å; A366-R368 VanDerWaalsContact C-N 3.32Å; A366-R368 PolarHBondContact O-N 3.43Å; A366-Y369 WeakPolarHBondContact O-CB 3.37Å; A366-Y369 PolarHBondContact O-N 3.19Å; A366-V370 WeakPolarHBondContact O-CG2 3.48Å; A366-V370 PolarHBondContact O-N 3.14Å
367	K	97.3	Very high	95.1	Very high	45 Å²	45	61.3 Å²	61.3	20%	0.196	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-36.6	172	-77.4	176.9	162.2	-165.8	0	113.1	K327 L330 D331 V363 D365 Q371	K327-K367 HydrophobicContact CG-CG 4.21Å; K327-K367 WeakPolarHBondContact O-CE 3.39Å; L330-K367 HydrophobicContact CB-CG 4.28Å; L330-K367 HydrophobicContact CD1-CG 3.86Å; D331-K367 IonicContact OD1-NZ 2.65Å; D331-K367 PolarHBondContact OD1-NZ 3Å; D331-K367 IonicContact OD2-NZ 3.89Å; D331-K367 PolarHBondContact OD2-NZ 3.17Å; V363-K367 HydrophobicContact CG1-CD 4.19Å; V363-K367 WeakPolarHBondContact O-CB 3.43Å; V363-K367 VanDerWaalsContact O-CG 3.26Å; V363-K367 WeakPolarHBondContact O-CG 3.43Å; V363-K367 PolarHBondContact O-N 2.79Å; D365-K367 PolarHBondContact O-N 2.95Å; K367-Q371 VanDerWaalsContact O-CB 3.3Å; K367-Q371 WeakPolarHBondContact O-CB 3.26Å; K367-Q371 PolarHBondContact O-N 3.09Å
368	R	97.3	Very high	95.1	Very high	145 Å²	145	59.6 Å²	59.6	55%	0.547	32%	0.324	S	S	.	.	H	α-helix	trans	-69.8	-38.9	174.8	-171.6	-171.9	-67.2	120	-2.9	111.4	A364 D365 A366 N372	A364-R368 PolarHBondContact O-N 3.28Å; D365-R368 CarbonylContact O-C 3.59Å; D365-R368 WeakPolarHBondContact O-CA 3.28Å; D365-R368 VanDerWaalsContact O-CB 3.29Å; D365-R368 WeakPolarHBondContact O-CB 3.17Å; D365-R368 PolarHBondContact O-N 2.89Å; D365-R368 IonicContact OD1-CZ 2.65Å; D365-R368 IonicContact OD1-NH1 3.57Å; D365-R368 PolarHBondContact OD1-NH1 3.04Å; A366-R368 VanDerWaalsContact C-N 3.32Å; A366-R368 PolarHBondContact O-N 3.43Å; R368-N372 PolarHBondContact O-N 3.4Å; R368-N372 PolarHBondContact O-ND2 3.33Å
369	Y	97	Very high	94.9	Very high	59 Å²	59	59.6 Å²	59.6	23%	0.231	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-55.7	172.7	-174.9	-87.8	0	0	0	111.1	D343 W351 D365 A366 Q371 N372 I373	D343-Y369 PolarHBondContact OD2-OH 3.11Å; W351-Y369 HydrophobicContact CB-CD1 3.84Å; W351-Y369 HydrophobicContact CB-CD2 3.86Å; W351-Y369 HydrophobicContact CB-CE1 3.88Å; W351-Y369 HydrophobicContact CB-CE2 3.87Å; W351-Y369 HydrophobicContact CB-CG 3.83Å; W351-Y369 AromaticContact CD1-CD2 3.55Å; W351-Y369 AromaticContact CD1-CG 3.63Å; W351-Y369 HydrophobicContact CG-CD1 4.36Å; W351-Y369 HydrophobicContact CG-CD2 4.06Å; W351-Y369 AromaticContact CG-CG 3.96Å; W351-Y369 HydrophobicContact CG-CG 3.96Å; D365-Y369 PolarHBondContact O-N 3.35Å; A366-Y369 WeakPolarHBondContact O-CB 3.37Å; A366-Y369 PolarHBondContact O-N 3.19Å; Y369-Q371 VanDerWaalsContact C-N 3.29Å; Y369-Q371 PolarHBondContact O-N 3.48Å; Y369-N372 PolarHBondContact O-N 2.85Å; Y369-I373 HydrophobicContact CD1-CD1 4.45Å; Y369-I373 HydrophobicContact CE1-CD1 4.38Å; Y369-I373 HydrophobicContact CE1-CG1 4.49Å; Y369-I373 PolarHBondContact O-N 2.96Å
370	V	95.6	Very high	94.9	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-37.2	-179	174.1	0	0	0	0	111.9	V323 M326 I341 A366 N372 I373	V323-V370 HydrophobicContact CB-CG1 4.22Å; V323-V370 HydrophobicContact CG1-CG1 4.2Å; V323-V370 HydrophobicContact CG2-CG1 3.94Å; V323-V370 WeakPolarHBondContact CG2-O 3.26Å; M326-V370 HydrophobicContact CB-CG1 4.05Å; I341-V370 HydrophobicContact CD1-CG2 3.5Å; I341-V370 HydrophobicContact CG2-CG2 4.35Å; A366-V370 WeakPolarHBondContact O-CG2 3.48Å; A366-V370 PolarHBondContact O-N 3.14Å; V370-N372 PolarHBondContact O-N 2.9Å; V370-I373 HydrophobicContact CG2-CD1 4.48Å; V370-I373 WeakPolarHBondContact O-CB 3.32Å; V370-I373 PolarHBondContact O-N 3.27Å
371	Q	95	Very high	94.9	Very high	99 Å²	99	53.6 Å²	53.6	46%	0.463	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-24.8	174.6	179.8	58.4	79.5	0	0	113.9	K367 Y369	K367-Q371 VanDerWaalsContact O-CB 3.3Å; K367-Q371 WeakPolarHBondContact O-CB 3.26Å; K367-Q371 PolarHBondContact O-N 3.09Å; Y369-Q371 VanDerWaalsContact C-N 3.29Å; Y369-Q371 PolarHBondContact O-N 3.48Å
372	N	94.6	Very high	94.9	Very high	111 Å²	111	48 Å²	48	59%	0.594	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-1.2	-176.7	-72.3	-31.9	0	0	0	113.9	R368 Y369 V370	R368-N372 PolarHBondContact O-N 3.4Å; R368-N372 PolarHBondContact O-ND2 3.33Å; Y369-N372 PolarHBondContact O-N 2.85Å; V370-N372 PolarHBondContact O-N 2.9Å
373	I	91.9	Very high	94.8	Very high	23 Å²	23	50 Å²	50	12%	0.118	26%	0.263	C	S	.	.			trans	-59.9	139.7	175.5	-73.9	177.1	0	0	0	111.2	V310 M319 D343 Y369 V370	V310-I373 HydrophobicContact CB-CG2 3.97Å; V310-I373 HydrophobicContact CG1-CD1 4.37Å; V310-I373 HydrophobicContact CG1-CG2 3.36Å; M319-I373 HydrophobicContact CE-CG2 3.96Å; M319-I373 HydrophobicContact SD-CG2 3.86Å; D343-I373 HydrophobicContact CB-CD1 4.2Å; Y369-I373 HydrophobicContact CD1-CD1 4.45Å; Y369-I373 HydrophobicContact CE1-CD1 4.38Å; Y369-I373 HydrophobicContact CE1-CG1 4.49Å; Y369-I373 PolarHBondContact O-N 2.96Å; V370-I373 HydrophobicContact CG2-CD1 4.48Å; V370-I373 WeakPolarHBondContact O-CB 3.32Å; V370-I373 PolarHBondContact O-N 3.27Å
374	K	90.4	Very high	94.8	Very high	157 Å²	157	49.2 Å²	49.2	68%	0.683	26%	0.259	S	S	*	.			trans	-129.4	110.1	179.1	-67.7	-176.1	-178.2	179.9	0	111.7	T376	K374-T376 PolarHBondContact O-N 2.82Å; K374-T376 PolarHBondContact O-OG1 2.7Å; K374-T376 VanDerWaalsContact O-OG1 3.07Å
375	P	92.8	Very high	94.8	Very high	25 Å²	25	47 Å²	47	16%	0.162	24%	0.24	C	C	.	.			trans	-53.8	117.5	176.6	-29.8	37.6	0	0	0	112.7	V310 S311 M314 W315 M319	V310-P375 CarbonylContact O-C 3.53Å; V310-P375 WeakPolarHBondContact O-CA 3.33Å; S311-P375 WeakPolarHBondContact O-CB 3.33Å; M314-P375 HydrophobicContact CB-CB 4.35Å; M314-P375 HydrophobicContact CB-CG 4.43Å; W315-P375 HydrophobicContact CB-CB 4.16Å; M319-P375 HydrophobicContact CB-CG 3.6Å; M319-P375 HydrophobicContact CE-CG 4.01Å; M319-P375 HydrophobicContact CG-CG 3.58Å
376	T	91.8	Very high	94.7	Very high	68 Å²	68	45.6 Å²	45.6	42%	0.417	23%	0.232	S	C	.	.			trans	-158.5	142.4	-174.3	45	0	0	0	0	112.2	V310 N345 K374	V310-T376 PolarHBondContact O-N 3.46Å; N345-T376 WeakPolarHBondContact CB-O 3.35Å; N345-T376 PolarHBondContact ND2-O 3.33Å; N345-T376 PolarHBondContact ND2-OG1 3.09Å; K374-T376 PolarHBondContact O-N 2.82Å; K374-T376 PolarHBondContact O-OG1 2.7Å; K374-T376 VanDerWaalsContact O-OG1 3.07Å
377	G	91.5	Very high	94.7	Very high	46 Å²	46	48.7 Å²	48.7	47%	0.474	24%	0.244	S	C	.	.	S	Bend	trans	77	-165.8	170.2	0	0	0	0	0	115.7	S311 G312	S311-G377 CarbonylContact C-O 3.59Å; S311-G377 WeakPolarHBondContact CA-O 3.42Å; G312-G377 PolarHBondContact N-O 2.88Å
378	G	92.4	Very high	94.7	Very high	20 Å²	20	46.6 Å²	46.6	21%	0.206	24%	0.235	C	C	.	.			trans	-88.1	-158.4	178.8	0	0	0	0	0	114.1	S311 N345 H346 T418	S311-G378 VanDerWaalsContact CB-O 3.26Å; S311-G378 WeakPolarHBondContact CB-O 3.47Å; N345-G378 CarbonylContact C-O 3.56Å; N345-G378 WeakPolarHBondContact CA-O 3.27Å; N345-G378 VanDerWaalsContact CB-O 3.25Å; N345-G378 WeakPolarHBondContact CB-O 3.4Å; H346-G378 PolarHBondContact N-O 3.09Å; G378-T418 WeakPolarHBondContact CA-OG1 3Å
379	T	92.8	Very high	94.6	Very high	6 Å²	6	39.7 Å²	39.7	4%	0.037	21%	0.209	C	C	.	.			trans	-139.5	110.1	-159.6	-42.7	0	0	0	0	111.9	D309 S311 F344 N345 I381 P417 T418 V419	D309-T379 WeakPolarHBondContact OD2-CG2 3.3Å; S311-T379 WeakPolarHBondContact CB-OG1 3.37Å; S311-T379 PolarHBondContact OG-OG1 2.91Å; F344-T379 HydrophobicContact CE2-CG2 3.78Å; N345-T379 CarbonylContact O-C 3.28Å; T379-I381 HydrophobicContact CG2-CD1 4.48Å; T379-I381 HydrophobicContact CG2-CG1 4.08Å; T379-P417 CarbonylContact O-C 3.57Å; T379-P417 WeakPolarHBondContact O-CA 3.47Å; T379-T418 WeakPolarHBondContact CB-OG1 3.41Å; T379-T418 PolarHBondContact N-OG1 2.89Å; T379-T418 PolarHBondContact O-N 2.72Å; T379-T418 PolarHBondContact OG1-OG1 2.79Å; T379-V419 PolarHBondContact O-N 2.99Å
380	N	95.6	Very high	94.5	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	22%	0.218	C	C	.	.			trans	-115.2	66.6	-175.8	-175	0.2	0	0	0	112.2	N345 N382 E383 A384 V419	N345-N380 WeakPolarHBondContact O-CB 3.39Å; N345-N380 PolarHBondContact O-N 3.24Å; N380-N382 PolarHBondContact O-N 2.92Å; N380-E383 WeakPolarHBondContact ND2-CB 3.34Å; N380-E383 PolarHBondContact ND2-OE2 3.48Å; N380-E383 PolarHBondContact O-N 2.91Å; N380-E383 VanDerWaalsContact OD1-CB 3.31Å; N380-E383 WeakPolarHBondContact OD1-CB 3.49Å; N380-E383 PolarHBondContact OD1-N 3.08Å; N380-A384 PolarHBondContact O-N 3.47Å; N380-V419 WeakPolarHBondContact CA-O 3.42Å; N380-V419 HydrophobicContact CB-CB 4.21Å; N380-V419 HydrophobicContact CB-CG1 4.4Å
381	I	94.7	Very high	94.5	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-38.2	-179	-59.5	176.3	0	0	0	111.8	F344 T379 A384 L385 L411 P417 F454	F344-I381 HydrophobicContact CE2-CB 4.38Å; F344-I381 HydrophobicContact CE2-CG1 3.71Å; F344-I381 HydrophobicContact CZ-CG1 3.95Å; T379-I381 HydrophobicContact CG2-CD1 4.48Å; T379-I381 HydrophobicContact CG2-CG1 4.08Å; I381-A384 PolarHBondContact O-N 2.58Å; I381-L385 HydrophobicContact CG2-CD1 3.65Å; I381-L385 HydrophobicContact CG2-CG 4.08Å; I381-L385 WeakPolarHBondContact O-CB 3.24Å; I381-L385 WeakPolarHBondContact O-CG 3.42Å; I381-L385 PolarHBondContact O-N 2.66Å; I381-L411 HydrophobicContact CG2-CD2 4.19Å; I381-P417 HydrophobicContact CD1-CB 4.29Å; I381-P417 HydrophobicContact CG1-CB 4.41Å; I381-F454 HydrophobicContact CD1-CE1 4.33Å
382	N	95.8	Very high	94.5	Very high	18 Å²	18	36.7 Å²	36.7	10%	0.096	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-48.8	-175	174.5	90.7	0	0	0	112.6	N380 I386 E421 I427 N430	N380-N382 PolarHBondContact O-N 2.92Å; N382-I386 VanDerWaalsContact O-CD1 3.32Å; N382-I386 WeakPolarHBondContact O-CD1 3.5Å; N382-I386 WeakPolarHBondContact O-CG1 3.43Å; N382-I386 PolarHBondContact O-N 2.86Å; N382-E421 HydrophobicContact CB-CB 3.98Å; N382-I427 HydrophobicContact CB-CG1 4.17Å; N382-I427 HydrophobicContact CB-CG2 3.98Å; N382-N430 WeakPolarHBondContact OD1-CB 3.4Å; N382-N430 PolarHBondContact OD1-ND2 2.97Å
383	E	96.1	Very high	94.3	Very high	98 Å²	98	34 Å²	34	46%	0.458	18%	0.184	S	C	.	.	H	α-helix	trans	-71.2	-40.4	-178.8	-168.1	178.9	149.4	0	0	111.4	V348 N380 L385 I386 R387	V348-E383 HydrophobicContact CG2-CB 3.77Å; V348-E383 HydrophobicContact CG2-CG 3.74Å; N380-E383 WeakPolarHBondContact ND2-CB 3.34Å; N380-E383 PolarHBondContact ND2-OE2 3.48Å; N380-E383 PolarHBondContact O-N 2.91Å; N380-E383 VanDerWaalsContact OD1-CB 3.31Å; N380-E383 WeakPolarHBondContact OD1-CB 3.49Å; N380-E383 PolarHBondContact OD1-N 3.08Å; E383-L385 PolarHBondContact O-N 2.89Å; E383-I386 PolarHBondContact O-N 2.87Å; E383-R387 WeakPolarHBondContact O-CB 3.37Å; E383-R387 PolarHBondContact O-N 2.79Å
384	A	96.5	Very high	94.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.8	-45.8	179.6	0	0	0	0	0	112.6	V307 F344 V348 N380 I381 R387 A388	V307-A384 HydrophobicContact CG1-CB 3.7Å; F344-A384 HydrophobicContact CB-CB 3.63Å; F344-A384 HydrophobicContact CD1-CB 3.77Å; F344-A384 HydrophobicContact CD2-CB 4.06Å; F344-A384 HydrophobicContact CE1-CB 4.48Å; F344-A384 HydrophobicContact CG-CB 3.53Å; V348-A384 HydrophobicContact CG1-CB 4.38Å; V348-A384 HydrophobicContact CG2-CB 4.15Å; N380-A384 PolarHBondContact O-N 3.47Å; I381-A384 PolarHBondContact O-N 2.58Å; A384-R387 PolarHBondContact O-N 2.84Å; A384-A388 WeakPolarHBondContact O-CB 3.32Å; A384-A388 PolarHBondContact O-N 2.94Å
385	L	97	Very high	94.3	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-67.6	-38.2	176.6	-70.1	-179.8	0	0	0	112.9	I381 E383 R387 A389 I409 L411 V431 L441 I458	I381-L385 HydrophobicContact CG2-CD1 3.65Å; I381-L385 HydrophobicContact CG2-CG 4.08Å; I381-L385 WeakPolarHBondContact O-CB 3.24Å; I381-L385 WeakPolarHBondContact O-CG 3.42Å; I381-L385 PolarHBondContact O-N 2.66Å; E383-L385 PolarHBondContact O-N 2.89Å; L385-R387 VanDerWaalsContact C-N 3.33Å; L385-A389 WeakPolarHBondContact O-CB 3.23Å; L385-A389 PolarHBondContact O-N 3.41Å; L385-I409 HydrophobicContact CD2-CG2 4.07Å; L385-L411 HydrophobicContact CD1-CD2 4.34Å; L385-L411 HydrophobicContact CD2-CB 4.29Å; L385-L411 HydrophobicContact CD2-CD1 4.4Å; L385-L411 HydrophobicContact CD2-CD2 4.33Å; L385-V431 HydrophobicContact CB-CG2 3.75Å; L385-V431 HydrophobicContact CD1-CG1 4.49Å; L385-V431 HydrophobicContact CD1-CG2 3.83Å; L385-V431 HydrophobicContact CG-CG2 4.47Å; L385-L441 HydrophobicContact CD1-CD2 4.12Å; L385-L441 HydrophobicContact CD2-CD1 3.7Å; L385-L441 HydrophobicContact CD2-CD2 4.33Å; L385-I458 HydrophobicContact CD1-CD1 4.11Å
386	I	96.6	Very high	94.1	Very high	31 Å²	31	32.4 Å²	32.4	16%	0.159	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-43.3	173.9	-70.4	167	0	0	0	110.2	N382 E383 A389 Q390 N430 V434	N382-I386 VanDerWaalsContact O-CD1 3.32Å; N382-I386 WeakPolarHBondContact O-CD1 3.5Å; N382-I386 WeakPolarHBondContact O-CG1 3.43Å; N382-I386 PolarHBondContact O-N 2.86Å; E383-I386 PolarHBondContact O-N 2.87Å; I386-A389 PolarHBondContact O-N 2.87Å; I386-Q390 HydrophobicContact CG2-CG 4.34Å; I386-Q390 WeakPolarHBondContact O-CB 3.21Å; I386-Q390 VanDerWaalsContact O-CG 3.26Å; I386-Q390 WeakPolarHBondContact O-CG 3.25Å; I386-Q390 PolarHBondContact O-N 2.82Å; I386-N430 HydrophobicContact CD1-CB 4.21Å; I386-V434 HydrophobicContact CG1-CG2 4.42Å; I386-V434 HydrophobicContact CG2-CG2 4.46Å
387	R	96.6	Very high	93.8	Very high	65 Å²	65	33.7 Å²	33.7	25%	0.245	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-42.6	-179.7	-164.3	59	154.2	93.3	-0.1	112.2	I342 V348 E353 E383 A384 L385 Q390 M391	I342-R387 HydrophobicContact CD1-CB 4.19Å; I342-R387 HydrophobicContact CD1-CG 4.11Å; V348-R387 HydrophobicContact CG1-CB 4.27Å; V348-R387 HydrophobicContact CG1-CG 4.33Å; E353-R387 IonicContact OE1-CZ 2.65Å; E353-R387 IonicContact OE1-NH1 2.68Å; E353-R387 IonicContact OE1-NH2 3.65Å; E353-R387 PolarHBondContact OE1-NH2 3.23Å; E353-R387 IonicContact OE2-CZ 2.82Å; E353-R387 IonicContact OE2-NH1 2.98Å; E353-R387 PolarHBondContact OE2-NH1 3.03Å; E353-R387 IonicContact OE2-NH2 3.04Å; E353-R387 PolarHBondContact OE2-NH2 3.46Å; E383-R387 WeakPolarHBondContact O-CB 3.37Å; E383-R387 PolarHBondContact O-N 2.79Å; A384-R387 PolarHBondContact O-N 2.84Å; L385-R387 VanDerWaalsContact C-N 3.33Å; R387-Q390 PolarHBondContact O-N 2.9Å; R387-M391 WeakPolarHBondContact O-CB 3.47Å; R387-M391 PolarHBondContact O-N 3Å
388	A	97	Very high	93.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-47.4	174.9	0	0	0	0	0	112.4	V305 V307 I342 A384 M391 L392 I409	V305-A388 HydrophobicContact CB-CB 4.08Å; V305-A388 HydrophobicContact CG1-CB 3.63Å; V307-A388 HydrophobicContact CG2-CB 3.62Å; I342-A388 HydrophobicContact CD1-CB 4.02Å; A384-A388 WeakPolarHBondContact O-CB 3.32Å; A384-A388 PolarHBondContact O-N 2.94Å; A388-M391 PolarHBondContact O-N 2.6Å; A388-L392 PolarHBondContact O-N 2.72Å; A388-I409 HydrophobicContact CB-CD1 3.81Å; A388-I409 HydrophobicContact CB-CG1 4.09Å; A388-I409 HydrophobicContact CB-CG2 4.04Å
389	A	96	Very high	93.2	Very high	1 Å²	1	38 Å²	38	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-42	177.5	0	0	0	0	0	111.9	L385 I386 M391 L392 V393 I409 V434 M435 L439	L385-A389 WeakPolarHBondContact O-CB 3.23Å; L385-A389 PolarHBondContact O-N 3.41Å; I386-A389 PolarHBondContact O-N 2.87Å; A389-M391 VanDerWaalsContact C-N 3.34Å; A389-M391 PolarHBondContact O-N 3Å; A389-L392 PolarHBondContact O-N 3.4Å; A389-V393 WeakPolarHBondContact O-CB 3.2Å; A389-V393 VanDerWaalsContact O-CG2 3.31Å; A389-V393 WeakPolarHBondContact O-CG2 3.12Å; A389-V393 PolarHBondContact O-N 3.44Å; A389-I409 HydrophobicContact CB-CD1 4.08Å; A389-V434 HydrophobicContact CB-CB 4.1Å; A389-V434 HydrophobicContact CB-CG1 3.59Å; A389-M435 HydrophobicContact CB-SD 3.9Å; A389-L439 HydrophobicContact CB-CD1 4.21Å
390	Q	94.7	Very high	92.6	Very high	90 Å²	90	42.6 Å²	42.6	42%	0.421	23%	0.225	S	C	.	.	H	α-helix	trans	-61.5	-37.8	174.8	-76.5	175.6	-4.9	0	0	113.1	I386 R387 R394 V434	I386-Q390 HydrophobicContact CG2-CG 4.34Å; I386-Q390 WeakPolarHBondContact O-CB 3.21Å; I386-Q390 VanDerWaalsContact O-CG 3.26Å; I386-Q390 WeakPolarHBondContact O-CG 3.25Å; I386-Q390 PolarHBondContact O-N 2.82Å; R387-Q390 PolarHBondContact O-N 2.9Å; Q390-R394 VanDerWaalsContact O-CB 3.23Å; Q390-R394 WeakPolarHBondContact O-CB 3.38Å; Q390-R394 PolarHBondContact O-N 2.85Å; Q390-V434 HydrophobicContact CG-CG1 4.06Å
391	M	94.8	Very high	91.9	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-46.7	176.8	-173.2	-173.9	-72.3	0	0	111.4	V305 S340 I342 S352 L355 R387 A388 A389 R394 A395	V305-M391 HydrophobicContact CG2-SD 3.95Å; S340-M391 VanDerWaalsContact CB-SD 3.53Å; I342-M391 HydrophobicContact CD1-CE 4.23Å; I342-M391 HydrophobicContact CG1-CE 4.43Å; S352-M391 VanDerWaalsContact O-CE 3.23Å; S352-M391 WeakPolarHBondContact O-CE 3.47Å; L355-M391 HydrophobicContact CD2-CG 4.13Å; L355-M391 HydrophobicContact CD2-SD 3.74Å; L355-M391 HydrophobicContact CG-CG 4.14Å; L355-M391 HydrophobicContact CG-SD 4.31Å; R387-M391 WeakPolarHBondContact O-CB 3.47Å; R387-M391 PolarHBondContact O-N 3Å; A388-M391 PolarHBondContact O-N 2.6Å; A389-M391 VanDerWaalsContact C-N 3.34Å; A389-M391 PolarHBondContact O-N 3Å; M391-R394 PolarHBondContact O-N 2.76Å; M391-A395 WeakPolarHBondContact O-CB 3.29Å; M391-A395 PolarHBondContact O-N 2.76Å; M391-A395 VanDerWaalsContact O-N 3.08Å
392	L	94.1	Very high	91.1	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-44.2	176.6	-69.1	163.8	0	0	0	112.1	N303 V305 L355 A388 A389 N396 I409 L439	N303-L392 HydrophobicContact CB-CD2 3.79Å; V305-L392 HydrophobicContact CG2-CD1 4.1Å; V305-L392 HydrophobicContact CG2-CD2 4.06Å; V305-L392 HydrophobicContact CG2-CG 3.82Å; L355-L392 HydrophobicContact CD1-CD2 3.81Å; L355-L392 HydrophobicContact CD2-CD2 4.49Å; A388-L392 PolarHBondContact O-N 2.72Å; A389-L392 PolarHBondContact O-N 3.4Å; L392-N396 WeakPolarHBondContact O-CB 3.45Å; L392-N396 PolarHBondContact O-N 3.29Å; L392-N396 VanDerWaalsContact O-N 3.11Å; L392-I409 HydrophobicContact CD1-CD1 4.19Å; L392-I409 HydrophobicContact CD1-CG1 3.54Å; L392-L439 HydrophobicContact CB-CD1 4.29Å; L392-L439 HydrophobicContact CB-CD2 3.9Å; L392-L439 HydrophobicContact CD1-CD1 4.47Å; L392-L439 HydrophobicContact CD1-CD2 4.19Å
393	V	92.3	Very high	90.2	Very high	53 Å²	53	49.4 Å²	49.4	32%	0.321	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-43.4	177.2	170.8	0	0	0	0	111.6	A389 N396 S397 T436 L439	A389-V393 WeakPolarHBondContact O-CB 3.2Å; A389-V393 VanDerWaalsContact O-CG2 3.31Å; A389-V393 WeakPolarHBondContact O-CG2 3.12Å; A389-V393 PolarHBondContact O-N 3.44Å; V393-N396 PolarHBondContact O-N 3.47Å; V393-S397 PolarHBondContact O-N 3.17Å; V393-S397 PolarHBondContact O-OG 2.81Å; V393-T436 HydrophobicContact CG2-CG2 3.94Å; V393-L439 HydrophobicContact CG2-CD1 4.23Å
394	R	91.5	Very high	89.2	Confident	109 Å²	109	48.3 Å²	48.3	41%	0.411	26%	0.259	S	S	.	.	H	α-helix	trans	-59.8	-51.6	177.7	-173.8	-167.9	-68.4	173.1	-0.5	110.9	Q390 M391 N396 S397 Q398	Q390-R394 VanDerWaalsContact O-CB 3.23Å; Q390-R394 WeakPolarHBondContact O-CB 3.38Å; Q390-R394 PolarHBondContact O-N 2.85Å; M391-R394 PolarHBondContact O-N 2.76Å; R394-N396 VanDerWaalsContact C-N 3.27Å; R394-N396 PolarHBondContact O-N 3.41Å; R394-S397 WeakPolarHBondContact CA-OG 3.44Å; R394-S397 PolarHBondContact O-N 2.68Å; R394-S397 VanDerWaalsContact O-N 3.1Å; R394-S397 PolarHBondContact O-OG 2.72Å; R394-Q398 HydrophobicContact CG-CG 4.48Å; R394-Q398 WeakPolarHBondContact O-CG 3.48Å; R394-Q398 PolarHBondContact O-N 2.87Å
395	A	89.6	Confident	88.8	Confident	7 Å²	7	48.7 Å²	48.7	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-62.8	-32.3	-178.7	0	0	0	0	0	113.2	L355 M391 G399 F400 V401	L355-A395 HydrophobicContact CD1-CB 3.55Å; L355-A395 HydrophobicContact CG-CB 4.24Å; M391-A395 WeakPolarHBondContact O-CB 3.29Å; M391-A395 PolarHBondContact O-N 2.76Å; M391-A395 VanDerWaalsContact O-N 3.08Å; A395-G399 PolarHBondContact O-N 3.34Å; A395-F400 PolarHBondContact O-N 3.26Å; A395-V401 HydrophobicContact CB-CG2 3.78Å; A395-V401 PolarHBondContact O-N 3.47Å
396	N	88	Confident	88.5	Confident	56 Å²	56	48.8 Å²	48.8	30%	0.299	26%	0.262	S	S	.	.	H	α-helix	trans	-66	-50.5	170.8	-158.4	22.6	0	0	0	111.2	L392 V393 R394 Q398 G399 E438	L392-N396 WeakPolarHBondContact O-CB 3.45Å; L392-N396 PolarHBondContact O-N 3.29Å; L392-N396 VanDerWaalsContact O-N 3.11Å; V393-N396 PolarHBondContact O-N 3.47Å; R394-N396 VanDerWaalsContact C-N 3.27Å; R394-N396 PolarHBondContact O-N 3.41Å; N396-Q398 PolarHBondContact O-N 3.24Å; N396-G399 PolarHBondContact O-N 2.89Å; N396-E438 PolarHBondContact ND2-OE2 2.8Å
397	S	86.7	Confident	88.3	Confident	96 Å²	96	47.7 Å²	47.7	67%	0.671	26%	0.257	S	S	*	.	H	α-helix	trans	-63.2	-23.6	179.2	67.4	0	0	0	0	115.1	V393 R394	V393-S397 PolarHBondContact O-N 3.17Å; V393-S397 PolarHBondContact O-OG 2.81Å; R394-S397 WeakPolarHBondContact CA-OG 3.44Å; R394-S397 PolarHBondContact O-N 2.68Å; R394-S397 VanDerWaalsContact O-N 3.1Å; R394-S397 PolarHBondContact O-OG 2.72Å
398	Q	87.6	Confident	88.2	Confident	97 Å²	97	44.6 Å²	44.6	45%	0.453	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.7	176.1	-69.7	175.6	-51.6	0	0	113.5	R394 N396 F400	R394-Q398 HydrophobicContact CG-CG 4.48Å; R394-Q398 WeakPolarHBondContact O-CG 3.48Å; R394-Q398 PolarHBondContact O-N 2.87Å; N396-Q398 PolarHBondContact O-N 3.24Å; Q398-F400 VanDerWaalsContact C-N 3.28Å; Q398-F400 HydrophobicContact CB-CD2 3.57Å; Q398-F400 HydrophobicContact CB-CE2 3.71Å; Q398-F400 HydrophobicContact CB-CG 4.38Å; Q398-F400 HydrophobicContact CG-CD2 4.48Å; Q398-F400 HydrophobicContact CG-CE2 4.32Å; Q398-F400 PolarHBondContact O-N 3.09Å
399	G	83.1	Confident	88.2	Confident	60 Å²	60	44.6 Å²	44.6	62%	0.619	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.2	14.3	-178.3	0	0	0	0	0	115	A395 N396 V401	A395-G399 PolarHBondContact O-N 3.34Å; N396-G399 PolarHBondContact O-N 2.89Å; G399-V401 VanDerWaalsContact C-N 3.31Å
400	F	80.4	Confident	88.3	Confident	102 Å²	102	44.9 Å²	44.9	45%	0.447	25%	0.247	S	C	.	.			trans	-76.9	-20.9	175.2	-65.6	-50.4	0	0	0	112.9	R338 A395 Q398	R338-F400 PolarHBondContact NE-O 3.09Å; R338-F400 PolarHBondContact NH2-O 2.98Å; A395-F400 PolarHBondContact O-N 3.26Å; Q398-F400 VanDerWaalsContact C-N 3.28Å; Q398-F400 HydrophobicContact CB-CD2 3.57Å; Q398-F400 HydrophobicContact CB-CE2 3.71Å; Q398-F400 HydrophobicContact CB-CG 4.38Å; Q398-F400 HydrophobicContact CG-CD2 4.48Å; Q398-F400 HydrophobicContact CG-CE2 4.32Å; Q398-F400 PolarHBondContact O-N 3.09Å
401	V	80.1	Confident	88.3	Confident	8 Å²	8	40.6 Å²	40.6	5%	0.048	23%	0.227	C	C	.	.	S	Bend	trans	-90.9	130.8	175.2	172.4	0	0	0	0	109.8	N303 A395 G399 P403 S405	N303-V401 VanDerWaalsContact ND2-CG1 3.35Å; N303-V401 WeakPolarHBondContact ND2-CG1 3.42Å; A395-V401 HydrophobicContact CB-CG2 3.78Å; A395-V401 PolarHBondContact O-N 3.47Å; G399-V401 VanDerWaalsContact C-N 3.31Å; V401-P403 WeakPolarHBondContact O-CD 3.37Å; V401-S405 WeakPolarHBondContact CG1-OG 3.49Å
402	D	78.8	Confident	88.3	Confident	52 Å²	52	40.6 Å²	40.6	28%	0.278	23%	0.227	S	C	.	.			trans	-69.8	124.5	169.6	-174.6	-38.4	0	0	0	108.7	R404 S405	D402-R404 PolarHBondContact O-N 3.05Å; D402-R404 WeakPolarHBondContact OD1-CB 3.5Å; D402-R404 WeakPolarHBondContact OD1-CG 3.47Å; D402-R404 IonicContact OD1-CZ 3.53Å; D402-R404 PolarHBondContact OD1-N 2.99Å; D402-R404 IonicContact OD1-NE 2.65Å; D402-R404 PolarHBondContact OD1-NE 3.22Å; D402-R404 IonicContact OD1-NH2 3.62Å; D402-R404 IonicContact OD2-CZ 2.68Å; D402-R404 IonicContact OD2-NE 2.72Å; D402-R404 PolarHBondContact OD2-NE 3.04Å; D402-R404 IonicContact OD2-NH2 3.91Å; D402-R404 PolarHBondContact OD2-NH2 2.93Å; D402-S405 WeakPolarHBondContact O-CB 3.39Å; D402-S405 PolarHBondContact O-N 3.06Å; D402-S405 PolarHBondContact O-OG 3.36Å
403	P	76.6	Confident	88.2	Confident	106 Å²	106	40.5 Å²	40.5	69%	0.688	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-19.4	179	-27.7	35.9	0	0	0	114.5	V401 K492	V401-P403 WeakPolarHBondContact O-CD 3.37Å; P403-K492 PolarHBondContact O-NZ 3.3Å
404	R	76.1	Confident	87.9	Confident	75 Å²	75	38 Å²	38	28%	0.283	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-19.1	179.2	-52.5	175	-64.1	166.5	0.4	112.7	D402 K492 A543 S544	D402-R404 PolarHBondContact O-N 3.05Å; D402-R404 WeakPolarHBondContact OD1-CB 3.5Å; D402-R404 WeakPolarHBondContact OD1-CG 3.47Å; D402-R404 IonicContact OD1-CZ 3.53Å; D402-R404 PolarHBondContact OD1-N 2.99Å; D402-R404 IonicContact OD1-NE 2.65Å; D402-R404 PolarHBondContact OD1-NE 3.22Å; D402-R404 IonicContact OD1-NH2 3.62Å; D402-R404 IonicContact OD2-CZ 2.68Å; D402-R404 IonicContact OD2-NE 2.72Å; D402-R404 PolarHBondContact OD2-NE 3.04Å; D402-R404 IonicContact OD2-NH2 3.91Å; D402-R404 PolarHBondContact OD2-NH2 2.93Å; R404-K492 WeakPolarHBondContact O-CE 3.16Å; R404-K492 PolarHBondContact O-NZ 3.41Å; R404-A543 WeakPolarHBondContact CB-O 3.33Å; R404-A543 WeakPolarHBondContact CD-O 3.43Å; R404-A543 WeakPolarHBondContact CG-O 3.31Å; R404-S544 PolarHBondContact NH1-OG 2.77Å; R404-S544 VanDerWaalsContact NH1-OG 3.07Å
405	S	87.1	Confident	87.4	Confident	7 Å²	7	33.2 Å²	33.2	5%	0.049	20%	0.197	C	C	.	.	S	Bend	trans	-75.6	154.1	175.9	70.1	0	0	0	0	113	P301 N303 V401 D402 K492	P301-S405 CarbonylContact O-C 3.54Å; P301-S405 WeakPolarHBondContact O-CA 3.27Å; P301-S405 WeakPolarHBondContact O-CB 3.34Å; N303-S405 PolarHBondContact ND2-OG 3.47Å; V401-S405 WeakPolarHBondContact CG1-OG 3.49Å; D402-S405 WeakPolarHBondContact O-CB 3.39Å; D402-S405 PolarHBondContact O-N 3.06Å; D402-S405 PolarHBondContact O-OG 3.36Å; S405-K492 WeakPolarHBondContact O-CE 3.5Å; S405-K492 PolarHBondContact O-NZ 2.9Å
406	V	90.8	Very high	87.3	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	142.9	174.3	-63.8	0	0	0	0	111.9	L300 P301 K302 N303 M408 P489 K492 K513	L300-V406 HydrophobicContact CD1-CG1 3.85Å; P301-V406 PolarHBondContact O-N 2.77Å; K302-V406 CarbonylContact C-O 3.59Å; K302-V406 WeakPolarHBondContact CA-O 3.32Å; K302-V406 HydrophobicContact CG-CG2 4.02Å; N303-V406 PolarHBondContact N-O 2.92Å; N303-V406 PolarHBondContact ND2-O 3.4Å; V406-M408 HydrophobicContact CG2-CE 3.7Å; V406-P489 HydrophobicContact CG1-CB 4.36Å; V406-P489 HydrophobicContact CG2-CB 3.86Å; V406-P489 HydrophobicContact CG2-CG 3.5Å; V406-P489 VanDerWaalsContact CG2-CG 3.5Å; V406-K492 HydrophobicContact CG1-CD 4.01Å; V406-K492 HydrophobicContact CG1-CG 3.93Å; V406-K513 HydrophobicContact CB-CD 4.44Å; V406-K513 HydrophobicContact CG1-CD 4.34Å
407	S	93	Very high	87.4	Confident	8 Å²	8	33.5 Å²	33.5	6%	0.056	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131	179.3	-67.1	0	0	0	0	111.1	N303 S440	N303-S407 PolarHBondContact ND2-OG 2.95Å; N303-S407 WeakPolarHBondContact O-CA 3.1Å; S407-S440 PolarHBondContact O-N 2.75Å
408	M	94.9	Very high	87.6	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	152.4	-177.2	66.6	-177.8	81.1	0	0	113.3	K302 N303 I304 V305 V406 I410 S440 F442	K302-M408 HydrophobicContact CB-CE 4.5Å; K302-M408 HydrophobicContact CD-CE 4Å; K302-M408 HydrophobicContact CG-CE 4.1Å; N303-M408 PolarHBondContact O-N 2.64Å; I304-M408 WeakPolarHBondContact CA-O 3.37Å; I304-M408 HydrophobicContact CB-CG 4.43Å; I304-M408 HydrophobicContact CD1-SD 4.32Å; I304-M408 HydrophobicContact CG1-CG 3.97Å; I304-M408 HydrophobicContact CG1-SD 4.32Å; I304-M408 HydrophobicContact CG2-CG 4.24Å; V305-M408 PolarHBondContact N-O 2.75Å; V406-M408 HydrophobicContact CG2-CE 3.7Å; M408-I410 HydrophobicContact SD-CD1 4.49Å; M408-S440 CarbonylContact C-O 3.58Å; M408-S440 VanDerWaalsContact CA-O 3.31Å; M408-S440 WeakPolarHBondContact CA-O 3.27Å; M408-F442 HydrophobicContact CB-CD2 4.26Å; M408-F442 HydrophobicContact CB-CE2 4.11Å; M408-F442 HydrophobicContact SD-CD2 4.37Å; M408-F442 HydrophobicContact SD-CE2 4.1Å
409	I	97	Very high	87.8	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.6	173.2	-56.9	172.1	0	0	0	107.4	V305 V307 L385 A388 A389 L392 M435 S440 L441 F442	V305-I409 WeakPolarHBondContact O-CA 3.47Å; V307-I409 HydrophobicContact CB-CG2 4.47Å; V307-I409 HydrophobicContact CG2-CG2 3.66Å; L385-I409 HydrophobicContact CD2-CG2 4.07Å; A388-I409 HydrophobicContact CB-CD1 3.81Å; A388-I409 HydrophobicContact CB-CG1 4.09Å; A388-I409 HydrophobicContact CB-CG2 4.04Å; A389-I409 HydrophobicContact CB-CD1 4.08Å; L392-I409 HydrophobicContact CD1-CD1 4.19Å; L392-I409 HydrophobicContact CD1-CG1 3.54Å; I409-M435 HydrophobicContact CD1-CE 4.22Å; I409-M435 HydrophobicContact CD1-SD 3.63Å; I409-S440 PolarHBondContact N-O 3.01Å; I409-L441 HydrophobicContact CB-CD1 3.9Å; I409-L441 HydrophobicContact CG2-CD1 3.75Å; I409-F442 PolarHBondContact O-N 2.78Å
410	I	96.6	Very high	88.2	Confident	6 Å²	6	30.2 Å²	30.2	3%	0.031	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	103.5	173.3	-61.1	175.7	0	0	0	107.5	I304 V305 F306 V307 M408 F442 L444 Y483	I304-I410 HydrophobicContact CG2-CD1 4Å; I304-I410 HydrophobicContact CG2-CG1 4.3Å; V305-I410 PolarHBondContact O-N 2.92Å; F306-I410 HydrophobicContact CD1-CB 4.11Å; F306-I410 HydrophobicContact CD1-CD1 4.32Å; F306-I410 HydrophobicContact CD1-CG2 4.46Å; F306-I410 HydrophobicContact CE1-CD1 3.85Å; V307-I410 PolarHBondContact N-O 2.93Å; M408-I410 HydrophobicContact SD-CD1 4.49Å; I410-F442 HydrophobicContact CG1-CB 4.32Å; I410-F442 HydrophobicContact CG1-CD2 4.44Å; I410-L444 HydrophobicContact CG2-CD1 4.45Å; I410-Y483 HydrophobicContact CD1-CD2 4.03Å; I410-Y483 HydrophobicContact CD1-CE2 4.31Å
411	L	96.4	Very high	88.9	Confident	1 Å²	1	27 Å²	27	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	133.7	174.1	174.6	66.4	0	0	0	109.8	V307 F344 I381 L385 L441 F442 L444 L455	V307-L411 HydrophobicContact CB-CD1 4.19Å; V307-L411 HydrophobicContact CG1-CD1 3.8Å; V307-L411 CarbonylContact O-C 3.6Å; V307-L411 WeakPolarHBondContact O-CA 3.44Å; F344-L411 HydrophobicContact CE1-CD1 3.76Å; F344-L411 HydrophobicContact CZ-CD1 3.95Å; I381-L411 HydrophobicContact CG2-CD2 4.19Å; L385-L411 HydrophobicContact CD1-CD2 4.34Å; L385-L411 HydrophobicContact CD2-CB 4.29Å; L385-L411 HydrophobicContact CD2-CD1 4.4Å; L385-L411 HydrophobicContact CD2-CD2 4.33Å; L411-L441 HydrophobicContact CB-CD1 4.18Å; L411-F442 PolarHBondContact N-O 2.83Å; L411-L444 PolarHBondContact O-N 3.06Å; L411-L455 HydrophobicContact CD2-CD2 3.91Å
412	V	94.6	Very high	89.5	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	121.6	170.2	-172.2	0	0	0	0	107.7	V307 D309 T322 L444 I446	V307-V412 PolarHBondContact O-N 2.99Å; D309-V412 WeakPolarHBondContact CB-O 3.39Å; D309-V412 PolarHBondContact N-O 3.32Å; T322-V412 HydrophobicContact CG2-CG1 4.1Å; V412-L444 HydrophobicContact CG1-CB 4.45Å; V412-L444 HydrophobicContact CG2-CB 4.32Å; V412-L444 HydrophobicContact CG2-CD1 4.26Å; V412-I446 HydrophobicContact CG1-CD1 3.55Å; V412-I446 HydrophobicContact CG1-CG1 4.24Å
413	S	91.6	Very high	90.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	149	-176.8	-178.3	0	0	0	0	111.9	D309 G415 L444 G445 I446	D309-S413 WeakPolarHBondContact OD2-CB 3.41Å; D309-S413 PolarHBondContact OD2-OG 3.04Å; S413-G415 PolarHBondContact OG-O 2.94Å; S413-L444 PolarHBondContact N-O 2.84Å; S413-G445 WeakPolarHBondContact O-CA 3.36Å; S413-I446 PolarHBondContact O-N 2.85Å
414	D	85.8	Confident	90.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-116.7	-5.7	-179.4	80.9	-20	0	0	0	114.4	S313 M314 K318 I446	S313-D414 WeakPolarHBondContact CB-OD1 3.39Å; S313-D414 WeakPolarHBondContact CB-OD2 3.34Å; S313-D414 PolarHBondContact OG-OD1 3.05Å; M314-D414 WeakPolarHBondContact CA-OD2 3.39Å; M314-D414 HydrophobicContact CG-CB 4.32Å; M314-D414 PolarHBondContact N-OD2 3.32Å; M314-D414 HydrophobicContact SD-CB 3.66Å; M314-D414 VanDerWaalsContact SD-CG 3.55Å; K318-D414 HydrophobicContact CD-CB 4.23Å; K318-D414 VanDerWaalsContact CE-OD2 3.23Å; K318-D414 WeakPolarHBondContact CE-OD2 3.38Å; K318-D414 IonicContact NZ-OD2 3.91Å; K318-D414 PolarHBondContact NZ-OD2 2.94Å; D414-I446 WeakPolarHBondContact CA-O 3.32Å; D414-I446 HydrophobicContact CB-CB 3.96Å; D414-I446 HydrophobicContact CB-CG2 4.37Å
415	G	80.4	Confident	91.4	Very high	9 Å²	9	32.9 Å²	32.9	9%	0.093	19%	0.194	C	C	.	.	S	Bend	trans	-144	165.3	-173.7	0	0	0	0	0	114	S413	S413-G415 PolarHBondContact OG-O 2.94Å
416	D	87.6	Confident	91.7	Very high	63 Å²	63	37.4 Å²	37.4	34%	0.337	21%	0.213	S	C	.	.			trans	-73.4	156	178.3	-75.2	-13.8	0	0	0	112.1	T418 D451	D416-T418 PolarHBondContact O-N 2.72Å; D416-D451 WeakPolarHBondContact OD1-CB 3.33Å; D416-D451 PolarHBondContact OD1-N 3.37Å
417	P	90	Very high	91.8	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.039	21%	0.212	C	C	.	.			trans	-66.1	120.4	179.1	26.3	-32.8	0	0	0	111.2	T379 I381 I422 L424 I427	T379-P417 CarbonylContact O-C 3.57Å; T379-P417 WeakPolarHBondContact O-CA 3.47Å; I381-P417 HydrophobicContact CD1-CB 4.29Å; I381-P417 HydrophobicContact CG1-CB 4.41Å; P417-I422 WeakPolarHBondContact O-CG2 3.36Å; P417-L424 HydrophobicContact CG-CD2 3.54Å; P417-I427 HydrophobicContact CB-CD1 3.9Å; P417-I427 HydrophobicContact CG-CD1 3.55Å
418	T	91.3	Very high	91.7	Very high	79 Å²	79	38 Å²	38	49%	0.485	22%	0.215	S	C	.	.			trans	-114.9	-11.1	-176.7	49	0	0	0	0	113.7	G378 T379 D416	G378-T418 WeakPolarHBondContact CA-OG1 3Å; T379-T418 WeakPolarHBondContact CB-OG1 3.41Å; T379-T418 PolarHBondContact N-OG1 2.89Å; T379-T418 PolarHBondContact O-N 2.72Å; T379-T418 PolarHBondContact OG1-OG1 2.79Å; D416-T418 PolarHBondContact O-N 2.72Å
419	V	91.2	Very high	91.6	Very high	47 Å²	47	45.1 Å²	45.1	29%	0.285	25%	0.246	S	C	.	.	S	Bend	trans	-132.9	147.1	-178.1	-179.7	0	0	0	0	110.2	H346 T379 N380	H346-V419 HydrophobicContact CB-CB 4.49Å; H346-V419 HydrophobicContact CB-CG1 4.04Å; H346-V419 HydrophobicContact CB-CG2 4.14Å; T379-V419 PolarHBondContact O-N 2.99Å; N380-V419 WeakPolarHBondContact CA-O 3.42Å; N380-V419 HydrophobicContact CB-CB 4.21Å; N380-V419 HydrophobicContact CB-CG1 4.4Å
420	G	92.5	Very high	91.5	Very high	58 Å²	58	46.2 Å²	46.2	60%	0.598	25%	0.251	S	S	*	.	S	Bend	trans	78	-124.1	-178.2	0	0	0	0	0	111.8
421	E	94.3	Very high	91.4	Very high	35 Å²	35	46 Å²	46	16%	0.164	25%	0.251	C	S	.	.			trans	-89	110.2	174.8	-178	57.8	-115.7	0	0	110.8	N382 K423 K426 I427	N382-E421 HydrophobicContact CB-CB 3.98Å; E421-K423 VanDerWaalsContact OE1-CB 3.25Å; E421-K423 WeakPolarHBondContact OE1-CB 3.4Å; E421-K423 PolarHBondContact OE1-N 2.86Å; E421-K426 HydrophobicContact CG-CB 4.2Å; E421-K426 HydrophobicContact CG-CD 4.23Å; E421-K426 HydrophobicContact CG-CG 4.12Å; E421-K426 WeakPolarHBondContact OE2-CD 3.37Å; E421-K426 WeakPolarHBondContact OE2-CE 3.42Å; E421-K426 IonicContact OE2-NZ 3.22Å; E421-K426 PolarHBondContact OE2-NZ 3.41Å; E421-I427 HydrophobicContact CB-CG1 4.44Å; E421-I427 HydrophobicContact CG-CG1 4Å; E421-I427 WeakPolarHBondContact O-CD1 3.44Å; E421-I427 WeakPolarHBondContact O-CG1 3.32Å
422	I	92.5	Very high	91.1	Very high	94 Å²	94	50.9 Å²	50.9	48%	0.482	27%	0.272	S	S	.	.			trans	-90	-23.1	-177.4	-63.9	172	0	0	0	111.8	P417 L424	P417-I422 WeakPolarHBondContact O-CG2 3.36Å; I422-L424 PolarHBondContact O-N 2.75Å
423	K	92.7	Very high	91	Very high	150 Å²	150	59.7 Å²	59.7	65%	0.652	30%	0.304	S	S	*	.			trans	-76.6	99	-174.3	-61.2	-179.9	-179.7	179.5	0	110.3	E421 S425 K426 I427	E421-K423 VanDerWaalsContact OE1-CB 3.25Å; E421-K423 WeakPolarHBondContact OE1-CB 3.4Å; E421-K423 PolarHBondContact OE1-N 2.86Å; K423-S425 PolarHBondContact O-N 3.42Å; K423-K426 HydrophobicContact CB-CB 4.24Å; K423-K426 WeakPolarHBondContact O-CA 3.46Å; K423-K426 WeakPolarHBondContact O-CB 2.96Å; K423-K426 PolarHBondContact O-N 3.34Å; K423-I427 PolarHBondContact O-N 2.89Å
424	L	90.7	Very high	91.1	Very high	45 Å²	45	61.1 Å²	61.1	24%	0.236	31%	0.313	C	S	.	.	H	α-helix	trans	-39.4	-45.7	-179.1	-54.3	-178.4	0	0	0	114.6	P417 I422 K426 I427 Q428 D451 F454	P417-L424 HydrophobicContact CG-CD2 3.54Å; I422-L424 PolarHBondContact O-N 2.75Å; L424-K426 VanDerWaalsContact C-N 3.29Å; L424-K426 PolarHBondContact O-N 2.9Å; L424-I427 HydrophobicContact CD2-CD1 4.27Å; L424-I427 PolarHBondContact O-N 2.9Å; L424-Q428 WeakPolarHBondContact O-CG 3.42Å; L424-Q428 PolarHBondContact O-N 3.21Å; L424-D451 VanDerWaalsContact CD1-OD2 3.32Å; L424-D451 WeakPolarHBondContact CD1-OD2 3.3Å; L424-F454 HydrophobicContact CB-CD2 3.73Å; L424-F454 HydrophobicContact CB-CE2 3.95Å; L424-F454 HydrophobicContact CB-CG 4.47Å; L424-F454 HydrophobicContact CD1-CB 4.24Å; L424-F454 HydrophobicContact CD1-CD2 4.38Å; L424-F454 HydrophobicContact CD1-CG 4.36Å; L424-F454 HydrophobicContact CD2-CD1 4.13Å; L424-F454 HydrophobicContact CD2-CD2 3.88Å; L424-F454 HydrophobicContact CD2-CE1 4.21Å; L424-F454 HydrophobicContact CD2-CE2 3.95Å; L424-F454 HydrophobicContact CD2-CG 3.97Å; L424-F454 HydrophobicContact CD2-CZ 4.13Å; L424-F454 HydrophobicContact CG-CD2 4.19Å; L424-F454 HydrophobicContact CG-CG 4.49Å
425	S	88.7	Confident	91.3	Very high	75 Å²	75	61.7 Å²	61.7	52%	0.524	32%	0.316	S	S	.	.	H	α-helix	trans	-73.7	-13.3	180	62.8	0	0	0	0	115.2	K423 K429	K423-S425 PolarHBondContact O-N 3.42Å; S425-K429 WeakPolarHBondContact O-CD 3.22Å; S425-K429 VanDerWaalsContact O-CG 3.31Å; S425-K429 WeakPolarHBondContact O-CG 3.29Å
426	K	92.8	Very high	91.5	Very high	102 Å²	102	64.1 Å²	64.1	44%	0.443	33%	0.329	S	S	.	.	H	α-helix	trans	-91.7	-35	167.4	-174	170.6	162.8	-152.5	0	111	E421 K423 L424 K429 N430	E421-K426 HydrophobicContact CG-CB 4.2Å; E421-K426 HydrophobicContact CG-CD 4.23Å; E421-K426 HydrophobicContact CG-CG 4.12Å; E421-K426 WeakPolarHBondContact OE2-CD 3.37Å; E421-K426 WeakPolarHBondContact OE2-CE 3.42Å; E421-K426 IonicContact OE2-NZ 3.22Å; E421-K426 PolarHBondContact OE2-NZ 3.41Å; K423-K426 HydrophobicContact CB-CB 4.24Å; K423-K426 WeakPolarHBondContact O-CA 3.46Å; K423-K426 WeakPolarHBondContact O-CB 2.96Å; K423-K426 PolarHBondContact O-N 3.34Å; L424-K426 VanDerWaalsContact C-N 3.29Å; L424-K426 PolarHBondContact O-N 2.9Å; K426-K429 PolarHBondContact O-N 3.39Å; K426-N430 WeakPolarHBondContact O-CB 3.41Å; K426-N430 PolarHBondContact O-N 2.92Å; K426-N430 PolarHBondContact O-ND2 3.34Å
427	I	93.3	Very high	91.1	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.2	-50	170.9	-50.5	176	0	0	0	110.3	N382 P417 E421 K423 L424 K429 N430 V431 F454 I458	N382-I427 HydrophobicContact CB-CG1 4.17Å; N382-I427 HydrophobicContact CB-CG2 3.98Å; P417-I427 HydrophobicContact CB-CD1 3.9Å; P417-I427 HydrophobicContact CG-CD1 3.55Å; E421-I427 HydrophobicContact CB-CG1 4.44Å; E421-I427 HydrophobicContact CG-CG1 4Å; E421-I427 WeakPolarHBondContact O-CD1 3.44Å; E421-I427 WeakPolarHBondContact O-CG1 3.32Å; K423-I427 PolarHBondContact O-N 2.89Å; L424-I427 HydrophobicContact CD2-CD1 4.27Å; L424-I427 PolarHBondContact O-N 2.9Å; I427-K429 PolarHBondContact O-N 3.39Å; I427-N430 WeakPolarHBondContact O-CB 3.34Å; I427-N430 PolarHBondContact O-N 2.67Å; I427-N430 VanDerWaalsContact O-N 3.07Å; I427-V431 HydrophobicContact CG2-CG2 4.23Å; I427-V431 WeakPolarHBondContact O-CG2 3.43Å; I427-V431 PolarHBondContact O-N 3.49Å; I427-F454 HydrophobicContact CB-CE2 4.27Å; I427-F454 HydrophobicContact CB-CZ 4.24Å; I427-F454 HydrophobicContact CD1-CZ 4.11Å; I427-F454 HydrophobicContact CG2-CE2 4.48Å; I427-F454 HydrophobicContact CG2-CZ 4.06Å; I427-I458 HydrophobicContact CG2-CD1 4.21Å
428	Q	91.6	Very high	90.7	Very high	23 Å²	23	72.2 Å²	72.2	11%	0.107	37%	0.365	C	S	.	.	H	α-helix	trans	-51.9	-50.7	175.2	-79.5	164	-15.7	0	0	111.8	L424 N430 V431 K432 F454 I458	L424-Q428 WeakPolarHBondContact O-CG 3.42Å; L424-Q428 PolarHBondContact O-N 3.21Å; Q428-N430 PolarHBondContact O-N 2.78Å; Q428-V431 PolarHBondContact O-N 2.66Å; Q428-K432 WeakPolarHBondContact O-CB 3.21Å; Q428-K432 PolarHBondContact O-N 2.85Å; Q428-F454 HydrophobicContact CG-CD2 4.29Å; Q428-F454 HydrophobicContact CG-CE2 4.02Å; Q428-I458 HydrophobicContact CG-CB 4.23Å; Q428-I458 HydrophobicContact CG-CD1 4.2Å; Q428-I458 HydrophobicContact CG-CG1 4.13Å
429	K	91.6	Very high	90.7	Very high	150 Å²	150	68.7 Å²	68.7	65%	0.652	34%	0.343	S	S	*	.	H	α-helix	trans	-63.3	-36.9	176.3	-70.8	173.7	-176.1	178.2	0	113.7	S425 K426 I427 R433	S425-K429 WeakPolarHBondContact O-CD 3.22Å; S425-K429 VanDerWaalsContact O-CG 3.31Å; S425-K429 WeakPolarHBondContact O-CG 3.29Å; K426-K429 PolarHBondContact O-N 3.39Å; I427-K429 PolarHBondContact O-N 3.39Å; K429-R433 WeakPolarHBondContact O-CB 3.27Å; K429-R433 PolarHBondContact O-N 3.49Å
430	N	94.8	Very high	90.8	Very high	23 Å²	23	66.5 Å²	66.5	12%	0.123	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-50.4	178.4	-77.1	-19.5	0	0	0	110.8	N382 I386 K426 I427 Q428 R433	N382-N430 WeakPolarHBondContact OD1-CB 3.4Å; N382-N430 PolarHBondContact OD1-ND2 2.97Å; I386-N430 HydrophobicContact CD1-CB 4.21Å; K426-N430 WeakPolarHBondContact O-CB 3.41Å; K426-N430 PolarHBondContact O-N 2.92Å; K426-N430 PolarHBondContact O-ND2 3.34Å; I427-N430 WeakPolarHBondContact O-CB 3.34Å; I427-N430 PolarHBondContact O-N 2.67Å; I427-N430 VanDerWaalsContact O-N 3.07Å; Q428-N430 PolarHBondContact O-N 2.78Å; N430-R433 PolarHBondContact O-N 3.49Å
431	V	94.4	Very high	91	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-48.8	179.9	172.7	0	0	0	0	110.6	L385 I427 Q428 R433 V434 M435 L441 I458	L385-V431 HydrophobicContact CB-CG2 3.75Å; L385-V431 HydrophobicContact CD1-CG1 4.49Å; L385-V431 HydrophobicContact CD1-CG2 3.83Å; L385-V431 HydrophobicContact CG-CG2 4.47Å; I427-V431 HydrophobicContact CG2-CG2 4.23Å; I427-V431 WeakPolarHBondContact O-CG2 3.43Å; I427-V431 PolarHBondContact O-N 3.49Å; Q428-V431 PolarHBondContact O-N 2.66Å; V431-R433 PolarHBondContact O-N 3.05Å; V431-V434 PolarHBondContact O-N 2.99Å; V431-M435 HydrophobicContact CG1-CG 3.66Å; V431-M435 WeakPolarHBondContact O-CG 3.22Å; V431-M435 PolarHBondContact O-N 3.11Å; V431-L441 HydrophobicContact CG1-CD2 4.31Å; V431-I458 HydrophobicContact CB-CD1 4.12Å; V431-I458 HydrophobicContact CG1-CD1 4.32Å; V431-I458 HydrophobicContact CG1-CG1 4.43Å; V431-I458 HydrophobicContact CG2-CD1 4.01Å
432	K	91.1	Very high	91	Very high	104 Å²	104	62.2 Å²	62.2	45%	0.452	29%	0.294	S	S	.	.	H	α-helix	trans	-59.2	-19.6	178.8	-168.2	172.5	-165.2	173.3	0	114.6	Q428 E461	Q428-K432 WeakPolarHBondContact O-CB 3.21Å; Q428-K432 PolarHBondContact O-N 2.85Å; K432-E461 IonicContact NZ-OE1 3.29Å; K432-E461 PolarHBondContact NZ-OE1 2.91Å
433	R	92.1	Very high	91.1	Very high	188 Å²	188	57.7 Å²	57.7	71%	0.709	27%	0.271	S	S	*	.	H	α-helix	trans	-83.6	-22.4	174.6	176.9	179.6	57.7	163.1	-3.5	113.4	K429 N430 V431	K429-R433 WeakPolarHBondContact O-CB 3.27Å; K429-R433 PolarHBondContact O-N 3.49Å; N430-R433 PolarHBondContact O-N 3.49Å; V431-R433 PolarHBondContact O-N 3.05Å
434	V	93	Very high	91.2	Very high	30 Å²	30	50.7 Å²	50.7	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-102.9	-25.6	-179.8	-166.5	0	0	0	0	111.4	I386 A389 Q390 V431 T436	I386-V434 HydrophobicContact CG1-CG2 4.42Å; I386-V434 HydrophobicContact CG2-CG2 4.46Å; A389-V434 HydrophobicContact CB-CB 4.1Å; A389-V434 HydrophobicContact CB-CG1 3.59Å; Q390-V434 HydrophobicContact CG-CG1 4.06Å; V431-V434 PolarHBondContact O-N 2.99Å; V434-T436 PolarHBondContact O-N 3.16Å
435	M	91.7	Very high	91.2	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.059	23%	0.229	C	C	.	.			trans	-71.2	95.8	173.4	-68.2	-62.6	-73.2	0	0	111.1	A389 I409 V431 L439 L441 N462	A389-M435 HydrophobicContact CB-SD 3.9Å; I409-M435 HydrophobicContact CD1-CE 4.22Å; I409-M435 HydrophobicContact CD1-SD 3.63Å; V431-M435 HydrophobicContact CG1-CG 3.66Å; V431-M435 WeakPolarHBondContact O-CG 3.22Å; V431-M435 PolarHBondContact O-N 3.11Å; M435-L439 HydrophobicContact CE-CB 3.46Å; M435-L439 VanDerWaalsContact CE-CB 3.46Å; M435-L439 HydrophobicContact CE-CD1 4.46Å; M435-L439 HydrophobicContact SD-CB 4.04Å; M435-L439 HydrophobicContact SD-CD1 3.93Å; M435-L441 HydrophobicContact CE-CB 3.9Å; M435-N462 HydrophobicContact CB-CB 4.41Å; M435-N462 WeakPolarHBondContact CB-OD1 3.41Å; M435-N462 HydrophobicContact CE-CB 4.04Å; M435-N462 HydrophobicContact CG-CB 4.21Å; M435-N462 WeakPolarHBondContact CG-OD1 3.17Å
436	T	84.8	Confident	91.2	Very high	61 Å²	61	45.1 Å²	45.1	37%	0.374	21%	0.205	S	C	.	.			trans	-69.6	170.1	172.3	65.5	0	0	0	0	111.4	V393 V434 E438 L439	V393-T436 HydrophobicContact CG2-CG2 3.94Å; V434-T436 PolarHBondContact O-N 3.16Å; T436-E438 PolarHBondContact O-N 2.7Å; T436-E438 VanDerWaalsContact O-N 3.07Å; T436-L439 PolarHBondContact O-N 3.3Å; T436-L439 VanDerWaalsContact O-N 3.17Å
437	E	78.9	Confident	90.7	Very high	146 Å²	146	40.5 Å²	40.5	68%	0.682	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.3	-169.6	-53.9	-141.3	108.3	0	0	115.2	R463	E437-R463 VanDerWaalsContact O-CD 3.31Å; E437-R463 WeakPolarHBondContact O-CD 3.37Å; E437-R463 PolarHBondContact O-NE 2.95Å; E437-R463 IonicContact OE1-CZ 3.18Å; E437-R463 IonicContact OE1-NH2 3.33Å; E437-R463 PolarHBondContact OE1-NH2 3.47Å
438	E	80.6	Confident	90.1	Very high	93 Å²	93	46.8 Å²	46.8	44%	0.435	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-22.1	-176.9	-51.9	-170.9	128.9	0	0	112.1	N396 T436 K513	N396-E438 PolarHBondContact ND2-OE2 2.8Å; T436-E438 PolarHBondContact O-N 2.7Å; T436-E438 VanDerWaalsContact O-N 3.07Å; E438-K513 PolarHBondContact O-NZ 2.9Å
439	L	91	Very high	89.4	Confident	5 Å²	5	50.6 Å²	50.6	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	142.4	-175.3	-52.3	-168.4	0	0	0	112	A389 L392 V393 M435 T436	A389-L439 HydrophobicContact CB-CD1 4.21Å; L392-L439 HydrophobicContact CB-CD1 4.29Å; L392-L439 HydrophobicContact CB-CD2 3.9Å; L392-L439 HydrophobicContact CD1-CD1 4.47Å; L392-L439 HydrophobicContact CD1-CD2 4.19Å; V393-L439 HydrophobicContact CG2-CD1 4.23Å; M435-L439 HydrophobicContact CE-CB 3.46Å; M435-L439 VanDerWaalsContact CE-CB 3.46Å; M435-L439 HydrophobicContact CE-CD1 4.46Å; M435-L439 HydrophobicContact SD-CB 4.04Å; M435-L439 HydrophobicContact SD-CD1 3.93Å; T436-L439 PolarHBondContact O-N 3.3Å; T436-L439 VanDerWaalsContact O-N 3.17Å
440	S	94.4	Very high	89	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.007	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	141.3	166.8	-72.7	0	0	0	0	110.9	S407 M408 I409 N462 R463 K513	S407-S440 PolarHBondContact O-N 2.75Å; M408-S440 CarbonylContact C-O 3.58Å; M408-S440 VanDerWaalsContact CA-O 3.31Å; M408-S440 WeakPolarHBondContact CA-O 3.27Å; I409-S440 PolarHBondContact N-O 3.01Å; S440-N462 CarbonylContact C-O 3.5Å; S440-N462 WeakPolarHBondContact CA-O 3.29Å; S440-R463 VanDerWaalsContact CB-O 3.24Å; S440-R463 WeakPolarHBondContact CB-O 3.4Å; S440-R463 PolarHBondContact OG-O 2.83Å; S440-K513 WeakPolarHBondContact OG-CE 3.34Å; S440-K513 PolarHBondContact OG-NZ 3.15Å
441	L	95.5	Very high	88.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.1	168.3	174.1	61.1	0	0	0	110.3	L385 I409 L411 V431 M435 I458 A459 N462 G464	L385-L441 HydrophobicContact CD1-CD2 4.12Å; L385-L441 HydrophobicContact CD2-CD1 3.7Å; L385-L441 HydrophobicContact CD2-CD2 4.33Å; I409-L441 HydrophobicContact CB-CD1 3.9Å; I409-L441 HydrophobicContact CG2-CD1 3.75Å; L411-L441 HydrophobicContact CB-CD1 4.18Å; V431-L441 HydrophobicContact CG1-CD2 4.31Å; M435-L441 HydrophobicContact CE-CB 3.9Å; L441-I458 HydrophobicContact CD2-CG1 4.14Å; L441-I458 HydrophobicContact CD2-CG2 4.16Å; L441-A459 WeakPolarHBondContact O-CB 3.24Å; L441-N462 HydrophobicContact CB-CB 3.96Å; L441-N462 PolarHBondContact N-O 3.04Å; L441-G464 VanDerWaalsContact O-CA 3.32Å; L441-G464 WeakPolarHBondContact O-CA 3.47Å
442	F	95.8	Very high	88.2	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	140	171.3	-65	-71	0	0	0	110.1	M408 I409 I410 L411 M465 F482 V486 F515	M408-F442 HydrophobicContact CB-CD2 4.26Å; M408-F442 HydrophobicContact CB-CE2 4.11Å; M408-F442 HydrophobicContact SD-CD2 4.37Å; M408-F442 HydrophobicContact SD-CE2 4.1Å; I409-F442 PolarHBondContact O-N 2.78Å; I410-F442 HydrophobicContact CG1-CB 4.32Å; I410-F442 HydrophobicContact CG1-CD2 4.44Å; L411-F442 PolarHBondContact N-O 2.83Å; F442-M465 WeakPolarHBondContact CA-O 3.45Å; F442-M465 HydrophobicContact CD1-CG 3.94Å; F442-M465 HydrophobicContact CE1-CG 4.14Å; F442-F482 HydrophobicContact CB-CE1 4.05Å; F442-F482 HydrophobicContact CB-CZ 3.76Å; F442-F482 AromaticContact CD1-CZ 3.75Å; F442-F482 HydrophobicContact CD1-CZ 3.75Å; F442-F482 HydrophobicContact CG-CE1 4.44Å; F442-F482 AromaticContact CG-CZ 3.92Å; F442-F482 HydrophobicContact CG-CZ 3.92Å; F442-V486 HydrophobicContact CD1-CG1 4.21Å; F442-V486 HydrophobicContact CE1-CG1 3.77Å; F442-V486 HydrophobicContact CE2-CB 4.39Å; F442-V486 HydrophobicContact CE2-CG1 4.27Å; F442-V486 HydrophobicContact CZ-CB 4.33Å; F442-V486 HydrophobicContact CZ-CG1 3.8Å; F442-F515 HydrophobicContact CZ-CE2 4.42Å; F442-F515 AromaticContact CZ-CZ 3.99Å; F442-F515 HydrophobicContact CZ-CZ 3.99Å
443	S	94.6	Very high	87.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.3	-174.9	-59.7	0	0	0	0	112	L455 M465 A466 Q467	S443-L455 PolarHBondContact OG-O 2.77Å; S443-M465 PolarHBondContact N-O 3.49Å; S443-M465 VanDerWaalsContact N-O 3.09Å; S443-A466 CarbonylContact O-C 3.6Å; S443-A466 WeakPolarHBondContact O-CA 3.27Å; S443-Q467 PolarHBondContact O-N 3.42Å
444	L	93.6	Very high	87.8	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	105.1	173.2	-66.4	-176.6	0	0	0	109.8	I410 L411 V412 S413 Q467 I469 I479 F482	I410-L444 HydrophobicContact CG2-CD1 4.45Å; L411-L444 PolarHBondContact O-N 3.06Å; V412-L444 HydrophobicContact CG1-CB 4.45Å; V412-L444 HydrophobicContact CG2-CB 4.32Å; V412-L444 HydrophobicContact CG2-CD1 4.26Å; S413-L444 PolarHBondContact N-O 2.84Å; L444-Q467 HydrophobicContact CD2-CB 3.92Å; L444-I469 HydrophobicContact CB-CG1 4.25Å; L444-I469 HydrophobicContact CD2-CD1 4.09Å; L444-I469 HydrophobicContact CD2-CG1 4.14Å; L444-I479 HydrophobicContact CD1-CB 4.49Å; L444-I479 HydrophobicContact CD1-CG1 4.27Å; L444-I479 HydrophobicContact CD1-CG2 3.94Å; L444-F482 HydrophobicContact CD1-CD1 3.92Å; L444-F482 HydrophobicContact CD1-CG 4.49Å; L444-F482 HydrophobicContact CD2-CB 4.1Å; L444-F482 HydrophobicContact CD2-CD1 3.67Å; L444-F482 HydrophobicContact CD2-CD2 4.06Å; L444-F482 HydrophobicContact CD2-CE1 4.15Å; L444-F482 HydrophobicContact CD2-CG 3.63Å; L444-F482 HydrophobicContact CG-CD1 4.08Å; L444-F482 HydrophobicContact CG-CE1 4.39Å
445	G	91.6	Very high	87.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	108	177.9	0	0	0	0	0	110.9	S413 Q467 R468 I469	S413-G445 WeakPolarHBondContact O-CA 3.36Å; G445-Q467 PolarHBondContact N-O 3.49Å; G445-Q467 VanDerWaalsContact N-O 3.13Å; G445-R468 WeakPolarHBondContact O-CA 3.19Å; G445-I469 PolarHBondContact O-N 2.88Å
446	I	88.4	Confident	87.5	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.015	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	131.4	-179.3	-61.6	174.9	0	0	0	110.2	M314 K318 V412 S413 D414 I469 A471	M314-I446 HydrophobicContact CE-CD1 4.01Å; M314-I446 HydrophobicContact SD-CD1 4.17Å; K318-I446 HydrophobicContact CB-CG2 4.33Å; K318-I446 HydrophobicContact CD-CG2 3.72Å; K318-I446 HydrophobicContact CG-CG2 3.8Å; V412-I446 HydrophobicContact CG1-CD1 3.55Å; V412-I446 HydrophobicContact CG1-CG1 4.24Å; S413-I446 PolarHBondContact O-N 2.85Å; D414-I446 WeakPolarHBondContact CA-O 3.32Å; D414-I446 HydrophobicContact CB-CB 3.96Å; D414-I446 HydrophobicContact CB-CG2 4.37Å; I446-I469 CarbonylContact C-O 3.52Å; I446-I469 WeakPolarHBondContact CA-O 3.46Å; I446-I469 HydrophobicContact CG1-CB 4.07Å; I446-I469 HydrophobicContact CG1-CG2 4.29Å; I446-A471 HydrophobicContact CG2-CB 4.34Å
447	G	82.8	Confident	87.7	Confident	5 Å²	5	37 Å²	37	5%	0.052	18%	0.175	C	C	.	.	S	Bend	trans	73	-160.6	174.2	0	0	0	0	0	114.4	R468 I469	G447-R468 VanDerWaalsContact O-CZ 3.28Å; G447-R468 PolarHBondContact O-NE 3.13Å; G447-R468 PolarHBondContact O-NH2 2.85Å; G447-I469 PolarHBondContact N-O 2.9Å
448	F	79.8	Confident	88.3	Confident	131 Å²	131	30 Å²	30	58%	0.575	14%	0.142	S	C	*	.	S	Bend	trans	-102.6	-16	-175	-70.9	-72.8	0	0	0	114.4	V450 R468 Y470	F448-V450 PolarHBondContact O-N 2.88Å; F448-R468 PolarHBondContact O-NH2 3.04Å; F448-Y470 HydrophobicContact CE1-CD1 4.45Å; F448-Y470 HydrophobicContact CE1-CE1 4.15Å; F448-Y470 HydrophobicContact CE2-CD1 4.31Å; F448-Y470 AromaticContact CZ-CD1 3.77Å; F448-Y470 HydrophobicContact CZ-CD1 3.77Å; F448-Y470 AromaticContact CZ-CE1 3.82Å; F448-Y470 HydrophobicContact CZ-CE1 3.82Å
449	D	78.1	Confident	88.9	Confident	104 Å²	104	25.6 Å²	25.6	56%	0.556	12%	0.122	S	C	*	.	S	Bend	trans	-70.3	-32.1	-167.3	-50.2	-58.5	0	0	0	113.3	K318	K318-D449 IonicContact NZ-OD2 3.8Å
450	V	83.1	Confident	88.8	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.006	13%	0.132	C	C	.	.	S	Bend	trans	-74.2	147.8	-178	68.5	0	0	0	0	115.5	F448 Y452 L455 R641	F448-V450 PolarHBondContact O-N 2.88Å; V450-Y452 VanDerWaalsContact C-N 3.29Å; V450-Y452 PolarHBondContact O-N 3.32Å; V450-L455 HydrophobicContact CG1-CD1 4.2Å; V450-L455 HydrophobicContact CG2-CD1 3.74Å; V450-L455 HydrophobicContact CG2-CG 4.08Å; V450-R641 PolarHBondContact O-NH2 2.92Å
451	D	85.5	Confident	88.5	Confident	29 Å²	29	29.6 Å²	29.6	16%	0.155	14%	0.141	C	C	.	.			trans	-66.3	85.9	160.2	-177.9	-3	0	0	0	109.8	D416 L424 D453 F454 L455 R457	D416-D451 WeakPolarHBondContact OD1-CB 3.33Å; D416-D451 PolarHBondContact OD1-N 3.37Å; L424-D451 VanDerWaalsContact CD1-OD2 3.32Å; L424-D451 WeakPolarHBondContact CD1-OD2 3.3Å; D451-D453 VanDerWaalsContact C-N 3.26Å; D451-D453 PolarHBondContact O-N 3.3Å; D451-D453 WeakPolarHBondContact OD1-CA 3.25Å; D451-D453 WeakPolarHBondContact OD1-CB 3.35Å; D451-D453 PolarHBondContact OD1-N 3.08Å; D451-F454 HydrophobicContact CB-CB 3.93Å; D451-F454 WeakPolarHBondContact O-CB 3.23Å; D451-F454 PolarHBondContact O-N 3.07Å; D451-F454 VanDerWaalsContact O-N 3.13Å; D451-F454 PolarHBondContact OD1-N 2.94Å; D451-F454 VanDerWaalsContact OD2-CB 3.22Å; D451-F454 WeakPolarHBondContact OD2-CB 3.45Å; D451-L455 PolarHBondContact O-N 3.39Å; D451-R457 IonicContact OD1-NH2 2.77Å; D451-R457 PolarHBondContact OD1-NH2 3.02Å; D451-R457 IonicContact OD2-NH2 3.88Å; D451-R457 PolarHBondContact OD2-NH2 2.93Å; D451-R457 VanDerWaalsContact OD2-NH2 3.07Å
452	Y	86.6	Confident	88.4	Confident	40 Å²	40	29.7 Å²	29.7	16%	0.157	14%	0.141	C	C	.	.	H	α-helix	trans	-60.6	-34.8	175	-173.9	-94.4	0	0	0	112.6	V450 F454 L455 E456 A466 R468	V450-Y452 VanDerWaalsContact C-N 3.29Å; V450-Y452 PolarHBondContact O-N 3.32Å; Y452-F454 PolarHBondContact O-N 3.04Å; Y452-L455 PolarHBondContact O-N 2.82Å; Y452-E456 HydrophobicContact CE1-CB 4.21Å; Y452-E456 WeakPolarHBondContact O-CB 3.48Å; Y452-E456 PolarHBondContact O-N 3.05Å; Y452-A466 HydrophobicContact CE2-CB 4.01Å; Y452-A466 PolarHBondContact OH-O 2.94Å; Y452-R468 HydrophobicContact CD2-CB 4.07Å; Y452-R468 HydrophobicContact CD2-CG 4.21Å; Y452-R468 HydrophobicContact CE2-CB 3.72Å; Y452-R468 HydrophobicContact CE2-CG 4.37Å
453	D	84.6	Confident	88.1	Confident	67 Å²	67	33 Å²	33	36%	0.358	15%	0.153	S	C	.	.	H	α-helix	trans	-63.1	-34	177.1	-67.5	13.2	0	0	0	110.1	D451 R457 H642	D451-D453 VanDerWaalsContact C-N 3.26Å; D451-D453 PolarHBondContact O-N 3.3Å; D451-D453 WeakPolarHBondContact OD1-CA 3.25Å; D451-D453 WeakPolarHBondContact OD1-CB 3.35Å; D451-D453 PolarHBondContact OD1-N 3.08Å; D453-R457 VanDerWaalsContact C-NE 3.28Å; D453-R457 VanDerWaalsContact C-NH2 3.3Å; D453-R457 VanDerWaalsContact O-CB 3.26Å; D453-R457 WeakPolarHBondContact O-CB 3.42Å; D453-R457 WeakPolarHBondContact O-CG 3.43Å; D453-R457 PolarHBondContact O-N 2.75Å; D453-R457 PolarHBondContact O-NE 2.82Å; D453-H642 IonicContact OD2-CE1 3.3Å
454	F	89.1	Confident	87.9	Confident	1 Å²	1	33.9 Å²	33.9	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-68.5	-45.8	174.8	161.8	-103.2	0	0	0	111.6	I381 L424 I427 Q428 D451 Y452 E456 R457 I458	I381-F454 HydrophobicContact CD1-CE1 4.33Å; L424-F454 HydrophobicContact CB-CD2 3.73Å; L424-F454 HydrophobicContact CB-CE2 3.95Å; L424-F454 HydrophobicContact CB-CG 4.47Å; L424-F454 HydrophobicContact CD1-CB 4.24Å; L424-F454 HydrophobicContact CD1-CD2 4.38Å; L424-F454 HydrophobicContact CD1-CG 4.36Å; L424-F454 HydrophobicContact CD2-CD1 4.13Å; L424-F454 HydrophobicContact CD2-CD2 3.88Å; L424-F454 HydrophobicContact CD2-CE1 4.21Å; L424-F454 HydrophobicContact CD2-CE2 3.95Å; L424-F454 HydrophobicContact CD2-CG 3.97Å; L424-F454 HydrophobicContact CD2-CZ 4.13Å; L424-F454 HydrophobicContact CG-CD2 4.19Å; L424-F454 HydrophobicContact CG-CG 4.49Å; I427-F454 HydrophobicContact CB-CE2 4.27Å; I427-F454 HydrophobicContact CB-CZ 4.24Å; I427-F454 HydrophobicContact CD1-CZ 4.11Å; I427-F454 HydrophobicContact CG2-CE2 4.48Å; I427-F454 HydrophobicContact CG2-CZ 4.06Å; Q428-F454 HydrophobicContact CG-CD2 4.29Å; Q428-F454 HydrophobicContact CG-CE2 4.02Å; D451-F454 HydrophobicContact CB-CB 3.93Å; D451-F454 WeakPolarHBondContact O-CB 3.23Å; D451-F454 PolarHBondContact O-N 3.07Å; D451-F454 VanDerWaalsContact O-N 3.13Å; D451-F454 PolarHBondContact OD1-N 2.94Å; D451-F454 VanDerWaalsContact OD2-CB 3.22Å; D451-F454 WeakPolarHBondContact OD2-CB 3.45Å; Y452-F454 PolarHBondContact O-N 3.04Å; F454-E456 VanDerWaalsContact C-N 3.33Å; F454-E456 PolarHBondContact O-N 3.43Å; F454-R457 VanDerWaalsContact CA-NH2 3.3Å; F454-R457 PolarHBondContact O-N 3.19Å; F454-I458 HydrophobicContact CE2-CD1 4.15Å; F454-I458 HydrophobicContact CZ-CD1 4.05Å; F454-I458 WeakPolarHBondContact O-CB 2.96Å; F454-I458 WeakPolarHBondContact O-CG2 3.28Å; F454-I458 PolarHBondContact O-N 2.9Å
455	L	91.8	Very high	87.7	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-40.1	175.5	-69.1	-173.4	0	0	0	112.3	L411 S443 V450 D451 Y452 I458 A459 A466	L411-L455 HydrophobicContact CD2-CD2 3.91Å; S443-L455 PolarHBondContact OG-O 2.77Å; V450-L455 HydrophobicContact CG1-CD1 4.2Å; V450-L455 HydrophobicContact CG2-CD1 3.74Å; V450-L455 HydrophobicContact CG2-CG 4.08Å; D451-L455 PolarHBondContact O-N 3.39Å; Y452-L455 PolarHBondContact O-N 2.82Å; L455-I458 WeakPolarHBondContact O-CG2 3.5Å; L455-A459 WeakPolarHBondContact O-CB 3.49Å; L455-A459 PolarHBondContact O-N 3.46Å; L455-A459 VanDerWaalsContact O-N 3.11Å; L455-A466 HydrophobicContact CB-CB 4.46Å
456	E	88.3	Confident	87.7	Confident	72 Å²	72	38.2 Å²	38.2	34%	0.336	19%	0.186	S	C	.	.	H	α-helix	trans	-66	-50.9	175.1	-171.8	-178.5	-108.7	0	0	111.2	Y452 F454 I458 A459 M460 A466	Y452-E456 HydrophobicContact CE1-CB 4.21Å; Y452-E456 WeakPolarHBondContact O-CB 3.48Å; Y452-E456 PolarHBondContact O-N 3.05Å; F454-E456 VanDerWaalsContact C-N 3.33Å; F454-E456 PolarHBondContact O-N 3.43Å; E456-I458 PolarHBondContact O-N 2.96Å; E456-A459 PolarHBondContact O-N 2.64Å; E456-M460 HydrophobicContact CG-CE 3.51Å; E456-M460 HydrophobicContact CG-CG 4.39Å; E456-M460 HydrophobicContact CG-SD 4.14Å; E456-M460 WeakPolarHBondContact O-CB 3.44Å; E456-M460 WeakPolarHBondContact O-CG 3.45Å; E456-M460 PolarHBondContact O-N 3.43Å; E456-A466 HydrophobicContact CB-CB 4.13Å
457	R	88	Confident	87.7	Confident	72 Å²	72	39.9 Å²	39.9	27%	0.272	19%	0.194	S	C	.	.	H	α-helix	trans	-56.3	-47.7	177.1	-78.7	171.5	-74.9	157.1	-2.9	111.7	D451 D453 F454 M460 E461	D451-R457 IonicContact OD1-NH2 2.77Å; D451-R457 PolarHBondContact OD1-NH2 3.02Å; D451-R457 IonicContact OD2-NH2 3.88Å; D451-R457 PolarHBondContact OD2-NH2 2.93Å; D451-R457 VanDerWaalsContact OD2-NH2 3.07Å; D453-R457 VanDerWaalsContact C-NE 3.28Å; D453-R457 VanDerWaalsContact C-NH2 3.3Å; D453-R457 VanDerWaalsContact O-CB 3.26Å; D453-R457 WeakPolarHBondContact O-CB 3.42Å; D453-R457 WeakPolarHBondContact O-CG 3.43Å; D453-R457 PolarHBondContact O-N 2.75Å; D453-R457 PolarHBondContact O-NE 2.82Å; F454-R457 VanDerWaalsContact CA-NH2 3.3Å; F454-R457 PolarHBondContact O-N 3.19Å; R457-M460 PolarHBondContact O-N 3.31Å; R457-E461 WeakPolarHBondContact O-CB 3.47Å; R457-E461 WeakPolarHBondContact O-CG 3.38Å; R457-E461 PolarHBondContact O-N 3.04Å
458	I	91.8	Very high	88	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-72.1	-30.7	-176	-157	170.1	0	0	0	112.5	L385 I427 Q428 V431 L441 F454 L455 E456 N462	L385-I458 HydrophobicContact CD1-CD1 4.11Å; I427-I458 HydrophobicContact CG2-CD1 4.21Å; Q428-I458 HydrophobicContact CG-CB 4.23Å; Q428-I458 HydrophobicContact CG-CD1 4.2Å; Q428-I458 HydrophobicContact CG-CG1 4.13Å; V431-I458 HydrophobicContact CB-CD1 4.12Å; V431-I458 HydrophobicContact CG1-CD1 4.32Å; V431-I458 HydrophobicContact CG1-CG1 4.43Å; V431-I458 HydrophobicContact CG2-CD1 4.01Å; L441-I458 HydrophobicContact CD2-CG1 4.14Å; L441-I458 HydrophobicContact CD2-CG2 4.16Å; F454-I458 HydrophobicContact CE2-CD1 4.15Å; F454-I458 HydrophobicContact CZ-CD1 4.05Å; F454-I458 WeakPolarHBondContact O-CB 2.96Å; F454-I458 WeakPolarHBondContact O-CG2 3.28Å; F454-I458 PolarHBondContact O-N 2.9Å; L455-I458 WeakPolarHBondContact O-CG2 3.5Å; E456-I458 PolarHBondContact O-N 2.96Å; I458-N462 PolarHBondContact O-ND2 3.35Å
459	A	92.8	Very high	88.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70.4	-46.1	171.1	0	0	0	0	0	111.9	L441 L455 E456 E461 N462 R463 G464 M465	L441-A459 WeakPolarHBondContact O-CB 3.24Å; L455-A459 WeakPolarHBondContact O-CB 3.49Å; L455-A459 PolarHBondContact O-N 3.46Å; L455-A459 VanDerWaalsContact O-N 3.11Å; E456-A459 PolarHBondContact O-N 2.64Å; A459-E461 PolarHBondContact O-N 3.45Å; A459-N462 CarbonylContact O-C 3.59Å; A459-N462 VanDerWaalsContact O-C 3.23Å; A459-N462 PolarHBondContact O-N 3.42Å; A459-R463 PolarHBondContact O-N 3.18Å; A459-G464 PolarHBondContact O-N 2.99Å; A459-M465 VanDerWaalsContact CB-C 3.42Å
460	M	88.8	Confident	88.7	Confident	50 Å²	50	32 Å²	32	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-65.3	-34.9	178.6	-71.9	-169.4	-173.6	0	0	113.1	E456 R457 N462 R587	E456-M460 HydrophobicContact CG-CE 3.51Å; E456-M460 HydrophobicContact CG-CG 4.39Å; E456-M460 HydrophobicContact CG-SD 4.14Å; E456-M460 WeakPolarHBondContact O-CB 3.44Å; E456-M460 WeakPolarHBondContact O-CG 3.45Å; E456-M460 PolarHBondContact O-N 3.43Å; R457-M460 PolarHBondContact O-N 3.31Å; M460-N462 PolarHBondContact O-N 3.43Å; M460-R587 HydrophobicContact SD-CG 3.9Å; M460-R587 PolarHBondContact SD-NE 2.89Å
461	E	88.7	Confident	88.5	Confident	40 Å²	40	34.4 Å²	34.4	19%	0.187	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-20.7	172.6	-79.4	-153.6	116.2	0	0	113.5	K432 R457 A459 L591	K432-E461 IonicContact NZ-OE1 3.29Å; K432-E461 PolarHBondContact NZ-OE1 2.91Å; R457-E461 WeakPolarHBondContact O-CB 3.47Å; R457-E461 WeakPolarHBondContact O-CG 3.38Å; R457-E461 PolarHBondContact O-N 3.04Å; A459-E461 PolarHBondContact O-N 3.45Å; E461-L591 HydrophobicContact CG-CD2 3.56Å
462	N	92.3	Very high	88.1	Confident	2 Å²	2	36 Å²	36	1%	0.011	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.2	44.5	-171	-60.4	-77.6	0	0	0	111.4	M435 S440 L441 I458 A459 M460 G464	M435-N462 HydrophobicContact CB-CB 4.41Å; M435-N462 WeakPolarHBondContact CB-OD1 3.41Å; M435-N462 HydrophobicContact CE-CB 4.04Å; M435-N462 HydrophobicContact CG-CB 4.21Å; M435-N462 WeakPolarHBondContact CG-OD1 3.17Å; S440-N462 CarbonylContact C-O 3.5Å; S440-N462 WeakPolarHBondContact CA-O 3.29Å; L441-N462 HydrophobicContact CB-CB 3.96Å; L441-N462 PolarHBondContact N-O 3.04Å; I458-N462 PolarHBondContact O-ND2 3.35Å; A459-N462 CarbonylContact O-C 3.59Å; A459-N462 VanDerWaalsContact O-C 3.23Å; A459-N462 PolarHBondContact O-N 3.42Å; M460-N462 PolarHBondContact O-N 3.43Å; N462-G464 VanDerWaalsContact C-N 3.33Å; N462-G464 PolarHBondContact O-N 2.91Å
463	R	91.3	Very high	87.2	Confident	70 Å²	70	41.6 Å²	41.6	26%	0.264	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	33.8	165.3	-56.6	170.3	167.7	90.3	-1.8	115.2	E437 S440 A459 D512	E437-R463 VanDerWaalsContact O-CD 3.31Å; E437-R463 WeakPolarHBondContact O-CD 3.37Å; E437-R463 PolarHBondContact O-NE 2.95Å; E437-R463 IonicContact OE1-CZ 3.18Å; E437-R463 IonicContact OE1-NH2 3.33Å; E437-R463 PolarHBondContact OE1-NH2 3.47Å; S440-R463 VanDerWaalsContact CB-O 3.24Å; S440-R463 WeakPolarHBondContact CB-O 3.4Å; S440-R463 PolarHBondContact OG-O 2.83Å; A459-R463 PolarHBondContact O-N 3.18Å; R463-D512 WeakPolarHBondContact CD-OD1 3.44Å; R463-D512 IonicContact CZ-OD1 2.7Å; R463-D512 IonicContact NE-OD1 3.07Å; R463-D512 PolarHBondContact NE-OD1 3.08Å
464	G	90.3	Very high	87	Confident	19 Å²	19	41.2 Å²	41.2	20%	0.196	21%	0.205	C	C	.	.			trans	-143.6	-157.5	172.5	0	0	0	0	0	112.5	L441 A459 N462	L441-G464 VanDerWaalsContact O-CA 3.32Å; L441-G464 WeakPolarHBondContact O-CA 3.47Å; A459-G464 PolarHBondContact O-N 2.99Å; N462-G464 VanDerWaalsContact C-N 3.33Å; N462-G464 PolarHBondContact O-N 2.91Å
465	M	89.2	Confident	86.8	Confident	81 Å²	81	41.3 Å²	41.3	40%	0.399	21%	0.206	S	C	.	.			trans	-139.4	158.8	-178.6	68.4	-179	79.7	0	0	110.8	F442 S443 A459 F482	F442-M465 WeakPolarHBondContact CA-O 3.45Å; F442-M465 HydrophobicContact CD1-CG 3.94Å; F442-M465 HydrophobicContact CE1-CG 4.14Å; S443-M465 PolarHBondContact N-O 3.49Å; S443-M465 VanDerWaalsContact N-O 3.09Å; A459-M465 VanDerWaalsContact CB-C 3.42Å; M465-F482 HydrophobicContact CG-CE2 3.91Å; M465-F482 HydrophobicContact CG-CZ 4.41Å; M465-F482 HydrophobicContact SD-CE2 4.07Å
466	A	90.1	Very high	86.5	Confident	13 Å²	13	41.8 Å²	41.8	11%	0.107	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	150.8	163.5	0	0	0	0	0	110.5	S443 Y452 L455 E456	S443-A466 CarbonylContact O-C 3.6Å; S443-A466 WeakPolarHBondContact O-CA 3.27Å; Y452-A466 HydrophobicContact CE2-CB 4.01Å; Y452-A466 PolarHBondContact OH-O 2.94Å; L455-A466 HydrophobicContact CB-CB 4.46Å; E456-A466 HydrophobicContact CB-CB 4.13Å
467	Q	90.1	Very high	86.5	Confident	38 Å²	38	44.5 Å²	44.5	18%	0.178	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	140	162.7	-179.3	178.3	-50.8	0	0	108.7	S443 L444 G445 I469 Q478 F482	S443-Q467 PolarHBondContact O-N 3.42Å; L444-Q467 HydrophobicContact CD2-CB 3.92Å; G445-Q467 PolarHBondContact N-O 3.49Å; G445-Q467 VanDerWaalsContact N-O 3.13Å; Q467-I469 HydrophobicContact CG-CD1 4.48Å; Q467-Q478 PolarHBondContact NE2-O 2.8Å; Q467-F482 HydrophobicContact CB-CD2 3.82Å; Q467-F482 HydrophobicContact CB-CE2 4.3Å
468	R	88.3	Confident	86.5	Confident	44 Å²	44	42.7 Å²	42.7	17%	0.166	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	136.7	171.5	-159.3	169.9	-156	122.7	21.7	109.7	G445 G447 F448 Y452 Y470	G445-R468 WeakPolarHBondContact O-CA 3.19Å; G447-R468 VanDerWaalsContact O-CZ 3.28Å; G447-R468 PolarHBondContact O-NE 3.13Å; G447-R468 PolarHBondContact O-NH2 2.85Å; F448-R468 PolarHBondContact O-NH2 3.04Å; Y452-R468 HydrophobicContact CD2-CB 4.07Å; Y452-R468 HydrophobicContact CD2-CG 4.21Å; Y452-R468 HydrophobicContact CE2-CB 3.72Å; Y452-R468 HydrophobicContact CE2-CG 4.37Å; R468-Y470 HydrophobicContact CG-CE1 4.46Å
469	I	88.4	Confident	86.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	115.6	175.9	-57.3	-61.3	0	0	0	107.4	L444 G445 I446 G447 Q467 A475 Q478 I479	L444-I469 HydrophobicContact CB-CG1 4.25Å; L444-I469 HydrophobicContact CD2-CD1 4.09Å; L444-I469 HydrophobicContact CD2-CG1 4.14Å; G445-I469 PolarHBondContact O-N 2.88Å; I446-I469 CarbonylContact C-O 3.52Å; I446-I469 WeakPolarHBondContact CA-O 3.46Å; I446-I469 HydrophobicContact CG1-CB 4.07Å; I446-I469 HydrophobicContact CG1-CG2 4.29Å; G447-I469 PolarHBondContact N-O 2.9Å; Q467-I469 HydrophobicContact CG-CD1 4.48Å; I469-A475 HydrophobicContact CG2-CB 3.8Å; I469-Q478 HydrophobicContact CD1-CB 3.71Å; I469-Q478 HydrophobicContact CG2-CB 4.33Å; I469-I479 HydrophobicContact CD1-CG1 3.84Å; I469-I479 HydrophobicContact CG1-CG1 3.87Å; I469-I479 HydrophobicContact CG2-CD1 4.22Å; I469-I479 HydrophobicContact CG2-CG1 3.97Å
470	Y	84.9	Confident	86.2	Confident	31 Å²	31	48.1 Å²	48.1	12%	0.122	24%	0.238	C	C	.	.			trans	-77.7	128.2	177.7	-58.6	-76.5	0	0	0	109	Q153 D154 F448 R468 N472 A475 Q478	Q153-Y470 VanDerWaalsContact C-OH 3.23Å; Q153-Y470 VanDerWaalsContact CA-OH 3.27Å; Q153-Y470 WeakPolarHBondContact CA-OH 3.26Å; Q153-Y470 HydrophobicContact CB-CE1 4.13Å; Q153-Y470 HydrophobicContact CB-CE2 4.39Å; Q153-Y470 HydrophobicContact CG-CD1 4.41Å; Q153-Y470 HydrophobicContact CG-CE1 3.97Å; D154-Y470 PolarHBondContact OD1-OH 2.89Å; F448-Y470 HydrophobicContact CE1-CD1 4.45Å; F448-Y470 HydrophobicContact CE1-CE1 4.15Å; F448-Y470 HydrophobicContact CE2-CD1 4.31Å; F448-Y470 AromaticContact CZ-CD1 3.77Å; F448-Y470 HydrophobicContact CZ-CD1 3.77Å; F448-Y470 AromaticContact CZ-CE1 3.82Å; F448-Y470 HydrophobicContact CZ-CE1 3.82Å; R468-Y470 HydrophobicContact CG-CE1 4.46Å; Y470-N472 PolarHBondContact O-N 3.47Å; Y470-N472 PolarHBondContact O-OD1 3.34Å; Y470-A475 WeakPolarHBondContact O-CB 3.49Å; Y470-Q478 PolarHBondContact O-NE2 2.9Å
471	A	77.1	Confident	86.2	Confident	52 Å²	52	47.7 Å²	47.7	43%	0.43	24%	0.242	S	C	.	.	S	Bend	trans	-77.9	46.4	-178.2	0	0	0	0	0	112.6	K318 I446	K318-A471 HydrophobicContact CD-CB 4.46Å; K318-A471 HydrophobicContact CG-CB 4.15Å; I446-A471 HydrophobicContact CG2-CB 4.34Å
472	N	78.1	Confident	86.3	Confident	62 Å²	62	45.9 Å²	45.9	33%	0.332	23%	0.234	S	C	.	.	S	Bend	trans	-90.5	-166.6	168.9	76.5	-22.2	0	0	0	109.7	Q321 Y470 D474 A475 Q478	Q321-N472 PolarHBondContact NE2-O 2.9Å; Y470-N472 PolarHBondContact O-N 3.47Å; Y470-N472 PolarHBondContact O-OD1 3.34Å; N472-D474 VanDerWaalsContact C-N 3.31Å; N472-D474 PolarHBondContact ND2-OD2 2.84Å; N472-D474 PolarHBondContact O-N 3.36Å; N472-D474 PolarHBondContact OD1-N 2.85Å; N472-D474 VanDerWaalsContact OD1-N 3.13Å; N472-A475 PolarHBondContact OD1-N 2.83Å; N472-Q478 PolarHBondContact OD1-NE2 3.07Å
473	H	68.8	Low	86.3	Confident	157 Å²	157	45.8 Å²	45.8	73%	0.727	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-32.8	178.9	42.1	-82.9	0	0	0	113.3	Q321 A475	Q321-H473 PolarHBondContact NE2-O 2.82Å; H473-A475 VanDerWaalsContact C-N 3.32Å; H473-A475 PolarHBondContact O-N 3.05Å
474	D	80.1	Confident	86.3	Confident	60 Å²	60	44.6 Å²	44.6	32%	0.321	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	6.1	-173.3	-39	-56.7	0	0	0	114.7	N472 A476 E477 Q478	N472-D474 VanDerWaalsContact C-N 3.31Å; N472-D474 PolarHBondContact ND2-OD2 2.84Å; N472-D474 PolarHBondContact O-N 3.36Å; N472-D474 PolarHBondContact OD1-N 2.85Å; N472-D474 VanDerWaalsContact OD1-N 3.13Å; D474-A476 PolarHBondContact O-N 3.44Å; D474-A476 VanDerWaalsContact O-N 3.1Å; D474-E477 WeakPolarHBondContact O-CA 3.23Å; D474-E477 WeakPolarHBondContact O-CB 3.38Å; D474-E477 PolarHBondContact O-N 3.35Å; D474-Q478 PolarHBondContact O-N 3.35Å
475	A	83.3	Confident	86.3	Confident	2 Å²	2	45.3 Å²	45.3	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-55	-34.7	-175.1	0	0	0	0	0	112.7	Q321 I469 Y470 N472 H473 Q478 I479	Q321-A475 HydrophobicContact CB-CB 4.27Å; Q321-A475 HydrophobicContact CG-CB 4.46Å; I469-A475 HydrophobicContact CG2-CB 3.8Å; Y470-A475 WeakPolarHBondContact O-CB 3.49Å; N472-A475 PolarHBondContact OD1-N 2.83Å; H473-A475 VanDerWaalsContact C-N 3.32Å; H473-A475 PolarHBondContact O-N 3.05Å; A475-Q478 PolarHBondContact O-N 2.94Å; A475-I479 WeakPolarHBondContact O-CD1 3.48Å; A475-I479 VanDerWaalsContact O-CG1 3.25Å; A475-I479 WeakPolarHBondContact O-CG1 3.37Å; A475-I479 PolarHBondContact O-N 2.88Å
476	A	86	Confident	86.4	Confident	11 Å²	11	41.4 Å²	41.4	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-67.1	-37.6	175.6	0	0	0	0	0	112.6	Q321 A325 D474 R480	Q321-A476 HydrophobicContact CB-CB 4.29Å; A325-A476 HydrophobicContact CB-CB 4.23Å; D474-A476 PolarHBondContact O-N 3.44Å; D474-A476 VanDerWaalsContact O-N 3.1Å; A476-R480 WeakPolarHBondContact O-CG 3.31Å; A476-R480 PolarHBondContact O-N 3.42Å
477	E	88.3	Confident	86.3	Confident	130 Å²	130	41.8 Å²	41.8	61%	0.607	22%	0.217	S	C	*	.	H	α-helix	trans	-70	-39.7	174.5	-58.1	-153.8	151.2	0	0	111.7	D474 I479 R480 A481	D474-E477 WeakPolarHBondContact O-CA 3.23Å; D474-E477 WeakPolarHBondContact O-CB 3.38Å; D474-E477 PolarHBondContact O-N 3.35Å; E477-I479 VanDerWaalsContact C-N 3.33Å; E477-I479 PolarHBondContact O-N 2.83Å; E477-R480 PolarHBondContact O-N 2.91Å; E477-A481 VanDerWaalsContact O-CB 3.26Å; E477-A481 WeakPolarHBondContact O-CB 3.46Å; E477-A481 PolarHBondContact O-N 2.78Å
478	Q	89.1	Confident	86.3	Confident	34 Å²	34	42.1 Å²	42.1	16%	0.159	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-41.5	175.3	-66.4	167.5	57	0	0	111.9	Q467 I469 Y470 N472 D474 A475 F482	Q467-Q478 PolarHBondContact NE2-O 2.8Å; I469-Q478 HydrophobicContact CD1-CB 3.71Å; I469-Q478 HydrophobicContact CG2-CB 4.33Å; Y470-Q478 PolarHBondContact O-NE2 2.9Å; N472-Q478 PolarHBondContact OD1-NE2 3.07Å; D474-Q478 PolarHBondContact O-N 3.35Å; A475-Q478 PolarHBondContact O-N 2.94Å; Q478-F482 PolarHBondContact O-N 3.29Å
479	I	88.6	Confident	86.5	Confident	5 Å²	5	40 Å²	40	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-43	176.1	-66.9	165	0	0	0	110.9	A325 I329 L444 I469 A475 E477 F482 Y483	A325-I479 HydrophobicContact CB-CB 3.76Å; A325-I479 HydrophobicContact CB-CD1 4.19Å; A325-I479 HydrophobicContact CB-CG2 3.57Å; I329-I479 HydrophobicContact CD1-CG2 3.85Å; L444-I479 HydrophobicContact CD1-CB 4.49Å; L444-I479 HydrophobicContact CD1-CG1 4.27Å; L444-I479 HydrophobicContact CD1-CG2 3.94Å; I469-I479 HydrophobicContact CD1-CG1 3.84Å; I469-I479 HydrophobicContact CG1-CG1 3.87Å; I469-I479 HydrophobicContact CG2-CD1 4.22Å; I469-I479 HydrophobicContact CG2-CG1 3.97Å; A475-I479 WeakPolarHBondContact O-CD1 3.48Å; A475-I479 VanDerWaalsContact O-CG1 3.25Å; A475-I479 WeakPolarHBondContact O-CG1 3.37Å; A475-I479 PolarHBondContact O-N 2.88Å; E477-I479 VanDerWaalsContact C-N 3.33Å; E477-I479 PolarHBondContact O-N 2.83Å; I479-F482 WeakPolarHBondContact O-CB 3.36Å; I479-F482 PolarHBondContact O-N 3.45Å; I479-Y483 PolarHBondContact O-N 2.66Å
480	R	88.9	Confident	86.7	Confident	110 Å²	110	40.7 Å²	40.7	42%	0.415	22%	0.219	S	C	.	.	H	α-helix	trans	-63.8	-45.4	174.8	-72.6	177.7	70.4	-156.1	2	112	A325 A328 A476 E477 F482 Y483 S484	A325-R480 HydrophobicContact CB-CG 4.44Å; A328-R480 HydrophobicContact CB-CG 4.2Å; A476-R480 WeakPolarHBondContact O-CG 3.31Å; A476-R480 PolarHBondContact O-N 3.42Å; E477-R480 PolarHBondContact O-N 2.91Å; R480-F482 VanDerWaalsContact C-N 3.28Å; R480-F482 PolarHBondContact O-N 3.19Å; R480-Y483 PolarHBondContact O-N 3.32Å; R480-Y483 VanDerWaalsContact O-N 3.07Å; R480-S484 PolarHBondContact O-N 2.87Å; R480-S484 PolarHBondContact O-OG 3.23Å; R480-S484 VanDerWaalsContact O-OG 3.13Å
481	A	89	Confident	87.1	Confident	41 Å²	41	39.2 Å²	39.2	34%	0.339	21%	0.213	S	C	.	.	H	α-helix	trans	-63.8	-32	177.8	0	0	0	0	0	112.4	E477 Q485	E477-A481 VanDerWaalsContact O-CB 3.26Å; E477-A481 WeakPolarHBondContact O-CB 3.46Å; E477-A481 PolarHBondContact O-N 2.78Å; A481-Q485 WeakPolarHBondContact O-CG 3.49Å; A481-Q485 PolarHBondContact O-NE2 3.05Å
482	F	90.8	Very high	87.7	Confident	1 Å²	1	38.5 Å²	38.5	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-52.8	166.5	176.2	-97.5	0	0	0	111.5	F442 L444 M465 Q467 Q478 I479 R480 S484 Q485 V486	F442-F482 HydrophobicContact CB-CE1 4.05Å; F442-F482 HydrophobicContact CB-CZ 3.76Å; F442-F482 AromaticContact CD1-CZ 3.75Å; F442-F482 HydrophobicContact CD1-CZ 3.75Å; F442-F482 HydrophobicContact CG-CE1 4.44Å; F442-F482 AromaticContact CG-CZ 3.92Å; F442-F482 HydrophobicContact CG-CZ 3.92Å; L444-F482 HydrophobicContact CD1-CD1 3.92Å; L444-F482 HydrophobicContact CD1-CG 4.49Å; L444-F482 HydrophobicContact CD2-CB 4.1Å; L444-F482 HydrophobicContact CD2-CD1 3.67Å; L444-F482 HydrophobicContact CD2-CD2 4.06Å; L444-F482 HydrophobicContact CD2-CE1 4.15Å; L444-F482 HydrophobicContact CD2-CG 3.63Å; L444-F482 HydrophobicContact CG-CD1 4.08Å; L444-F482 HydrophobicContact CG-CE1 4.39Å; M465-F482 HydrophobicContact CG-CE2 3.91Å; M465-F482 HydrophobicContact CG-CZ 4.41Å; M465-F482 HydrophobicContact SD-CE2 4.07Å; Q467-F482 HydrophobicContact CB-CD2 3.82Å; Q467-F482 HydrophobicContact CB-CE2 4.3Å; Q478-F482 PolarHBondContact O-N 3.29Å; I479-F482 WeakPolarHBondContact O-CB 3.36Å; I479-F482 PolarHBondContact O-N 3.45Å; R480-F482 VanDerWaalsContact C-N 3.28Å; R480-F482 PolarHBondContact O-N 3.19Å; F482-S484 VanDerWaalsContact C-N 3.3Å; F482-S484 PolarHBondContact O-N 3.21Å; F482-Q485 WeakPolarHBondContact O-CB 3.31Å; F482-Q485 PolarHBondContact O-N 3.03Å; F482-V486 HydrophobicContact CD1-CG2 4.5Å; F482-V486 HydrophobicContact CE1-CG2 3.97Å; F482-V486 HydrophobicContact CE2-CG1 4.47Å; F482-V486 HydrophobicContact CZ-CG1 4.07Å; F482-V486 HydrophobicContact CZ-CG2 4.31Å
483	Y	91.2	Very high	88.3	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-42.8	-178.9	-179.9	-110.5	0	0	0	112.1	I304 I329 D332 L333 I410 I479 R480 Q485 V486 S487	I304-Y483 HydrophobicContact CD1-CE2 4.01Å; I329-Y483 HydrophobicContact CB-CD1 4.23Å; I329-Y483 HydrophobicContact CB-CE1 4.47Å; I329-Y483 HydrophobicContact CB-CG 4.44Å; I329-Y483 HydrophobicContact CD1-CD1 4.49Å; I329-Y483 HydrophobicContact CD1-CG 4.01Å; I329-Y483 HydrophobicContact CG1-CD1 3.75Å; I329-Y483 HydrophobicContact CG1-CE1 4.47Å; I329-Y483 HydrophobicContact CG1-CG 3.77Å; I329-Y483 HydrophobicContact CG2-CD1 3.97Å; I329-Y483 HydrophobicContact CG2-CD2 3.97Å; I329-Y483 HydrophobicContact CG2-CE1 3.93Å; I329-Y483 HydrophobicContact CG2-CE2 3.96Å; I329-Y483 HydrophobicContact CG2-CG 3.98Å; D332-Y483 HydrophobicContact CB-CD1 4.48Å; D332-Y483 HydrophobicContact CB-CE1 3.81Å; L333-Y483 WeakPolarHBondContact CD2-OH 3.35Å; I410-Y483 HydrophobicContact CD1-CD2 4.03Å; I410-Y483 HydrophobicContact CD1-CE2 4.31Å; I479-Y483 PolarHBondContact O-N 2.66Å; R480-Y483 PolarHBondContact O-N 3.32Å; R480-Y483 VanDerWaalsContact O-N 3.07Å; Y483-Q485 PolarHBondContact O-N 2.66Å; Y483-Q485 VanDerWaalsContact O-N 3.12Å; Y483-V486 HydrophobicContact CD2-CG2 4.35Å; Y483-V486 CarbonylContact O-C 3.53Å; Y483-V486 WeakPolarHBondContact O-CG2 3.45Å; Y483-V486 PolarHBondContact O-N 2.96Å; Y483-S487 VanDerWaalsContact CE1-CB 3.48Å; Y483-S487 VanDerWaalsContact CZ-CB 3.5Å; Y483-S487 VanDerWaalsContact O-CB 3.27Å; Y483-S487 WeakPolarHBondContact O-CB 3.2Å; Y483-S487 PolarHBondContact O-N 3.32Å; Y483-S487 PolarHBondContact O-OG 3.18Å
484	S	91.6	Very high	89.5	Confident	45 Å²	45	34 Å²	34	32%	0.315	18%	0.176	S	C	.	.	H	α-helix	trans	-58.8	-23.4	176	-60.3	0	0	0	0	114.4	L184 R480 F482	L184-S484 VanDerWaalsContact CD2-C 3.49Å; L184-S484 WeakPolarHBondContact CD2-O 3.35Å; R480-S484 PolarHBondContact O-N 2.87Å; R480-S484 PolarHBondContact O-OG 3.23Å; R480-S484 VanDerWaalsContact O-OG 3.13Å; F482-S484 VanDerWaalsContact C-N 3.3Å; F482-S484 PolarHBondContact O-N 3.21Å
485	Q	90.9	Very high	90.3	Very high	33 Å²	33	33.1 Å²	33.1	15%	0.154	17%	0.172	C	C	.	.	H	α-helix	trans	-79.4	-20.7	174.7	-68.9	166.5	86.9	0	0	112.8	L184 A481 F482 Y483 F515	L184-Q485 HydrophobicContact CD2-CB 4.46Å; L184-Q485 HydrophobicContact CD2-CG 3.72Å; L184-Q485 HydrophobicContact CG-CG 3.94Å; A481-Q485 WeakPolarHBondContact O-CG 3.49Å; A481-Q485 PolarHBondContact O-NE2 3.05Å; F482-Q485 WeakPolarHBondContact O-CB 3.31Å; F482-Q485 PolarHBondContact O-N 3.03Å; Y483-Q485 PolarHBondContact O-N 2.66Å; Y483-Q485 VanDerWaalsContact O-N 3.12Å; Q485-F515 WeakPolarHBondContact O-CB 3.29Å
486	V	90.3	Very high	90.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-117.4	-10.6	-176.8	-60.8	0	0	0	0	114.4	F442 F482 Y483 S488 F515	F442-V486 HydrophobicContact CD1-CG1 4.21Å; F442-V486 HydrophobicContact CE1-CG1 3.77Å; F442-V486 HydrophobicContact CE2-CB 4.39Å; F442-V486 HydrophobicContact CE2-CG1 4.27Å; F442-V486 HydrophobicContact CZ-CB 4.33Å; F442-V486 HydrophobicContact CZ-CG1 3.8Å; F482-V486 HydrophobicContact CD1-CG2 4.5Å; F482-V486 HydrophobicContact CE1-CG2 3.97Å; F482-V486 HydrophobicContact CE2-CG1 4.47Å; F482-V486 HydrophobicContact CZ-CG1 4.07Å; F482-V486 HydrophobicContact CZ-CG2 4.31Å; Y483-V486 HydrophobicContact CD2-CG2 4.35Å; Y483-V486 CarbonylContact O-C 3.53Å; Y483-V486 WeakPolarHBondContact O-CG2 3.45Å; Y483-V486 PolarHBondContact O-N 2.96Å; V486-S488 VanDerWaalsContact C-N 3.3Å; V486-S488 PolarHBondContact O-N 3.38Å; V486-F515 HydrophobicContact CB-CD1 4.44Å; V486-F515 HydrophobicContact CB-CE1 4.14Å; V486-F515 WeakPolarHBondContact O-CD1 3.43Å; V486-F515 VanDerWaalsContact O-CE1 3.22Å; V486-F515 WeakPolarHBondContact O-CE1 3.4Å
487	S	89.4	Confident	91.4	Very high	21 Å²	21	37.1 Å²	37.1	15%	0.147	19%	0.189	C	C	.	.	S	Bend	trans	-74.2	-15.8	-176.8	68.8	0	0	0	0	114.7	K302 Y483 P489	K302-S487 VanDerWaalsContact CD-O 3.27Å; K302-S487 WeakPolarHBondContact CD-O 3.15Å; K302-S487 WeakPolarHBondContact CE-O 3.36Å; K302-S487 PolarHBondContact NZ-O 2.81Å; Y483-S487 VanDerWaalsContact CE1-CB 3.48Å; Y483-S487 VanDerWaalsContact CZ-CB 3.5Å; Y483-S487 VanDerWaalsContact O-CB 3.27Å; Y483-S487 WeakPolarHBondContact O-CB 3.2Å; Y483-S487 PolarHBondContact O-N 3.32Å; Y483-S487 PolarHBondContact O-OG 3.18Å; S487-P489 VanDerWaalsContact O-CD 3.29Å; S487-P489 WeakPolarHBondContact O-CD 3.2Å
488	S	90.3	Very high	91.7	Very high	44 Å²	44	32.2 Å²	32.2	31%	0.308	17%	0.165	S	C	.	.			trans	-120.5	61.5	-175.9	-63.8	0	0	0	0	112.9	V486 L490 G516	V486-S488 VanDerWaalsContact C-N 3.3Å; V486-S488 PolarHBondContact O-N 3.38Å; S488-L490 PolarHBondContact O-N 3.28Å; S488-G516 PolarHBondContact O-N 2.98Å
489	P	92.4	Very high	91.8	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	133.1	172	28.9	-35	0	0	0	110	P299 L300 K302 V406 S487 F515	P299-P489 CarbonylContact C-O 3.6Å; P299-P489 VanDerWaalsContact CA-O 3.29Å; P299-P489 WeakPolarHBondContact CA-O 3.12Å; L300-P489 HydrophobicContact CB-CB 4.47Å; L300-P489 HydrophobicContact CB-CG 4.14Å; L300-P489 HydrophobicContact CD1-CB 4.49Å; L300-P489 PolarHBondContact N-O 2.67Å; K302-P489 HydrophobicContact CD-CG 4.21Å; K302-P489 HydrophobicContact CG-CG 3.93Å; V406-P489 HydrophobicContact CG1-CB 4.36Å; V406-P489 HydrophobicContact CG2-CB 3.86Å; V406-P489 HydrophobicContact CG2-CG 3.5Å; V406-P489 VanDerWaalsContact CG2-CG 3.5Å; S487-P489 VanDerWaalsContact O-CD 3.29Å; S487-P489 WeakPolarHBondContact O-CD 3.2Å; P489-F515 HydrophobicContact CB-CD1 3.93Å; P489-F515 HydrophobicContact CB-CE1 3.86Å
490	L	91.6	Very high	91.8	Very high	14 Å²	14	42.3 Å²	42.3	7%	0.073	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-32.6	-179.1	-58.5	-173	0	0	0	113	L297 P299 S488 F514	L297-L490 HydrophobicContact CB-CB 4.46Å; L297-L490 HydrophobicContact CD1-CB 4.49Å; P299-L490 HydrophobicContact CB-CD2 4.12Å; P299-L490 HydrophobicContact CG-CD2 3.93Å; S488-L490 PolarHBondContact O-N 3.28Å; L490-F514 HydrophobicContact CB-CD1 4.09Å; L490-F514 HydrophobicContact CB-CE1 4.44Å; L490-F514 HydrophobicContact CD1-CE1 4.03Å; L490-F514 PolarHBondContact N-O 3.48Å
491	L	92.4	Very high	91.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	155.4	-179.1	-60	170.2	0	0	0	111.6	F292 P294 L297 V494 K513 F514 A540 S541 A542 L547	F292-L491 HydrophobicContact CE1-CD1 3.79Å; F292-L491 HydrophobicContact CZ-CD1 3.89Å; P294-L491 HydrophobicContact CG-CD1 3.83Å; L297-L491 HydrophobicContact CD1-CD1 4.21Å; L297-L491 HydrophobicContact CD1-CD2 3.88Å; L297-L491 HydrophobicContact CD1-CG 4Å; L491-V494 HydrophobicContact CB-CG2 3.81Å; L491-V494 HydrophobicContact CD1-CG2 4.25Å; L491-K513 CarbonylContact O-C 3.58Å; L491-K513 WeakPolarHBondContact O-CA 3.31Å; L491-F514 HydrophobicContact CB-CB 4.16Å; L491-F514 HydrophobicContact CD1-CD1 4.23Å; L491-F514 HydrophobicContact CG-CD1 4.45Å; L491-F514 PolarHBondContact N-O 3.41Å; L491-F514 PolarHBondContact O-N 2.86Å; L491-A540 HydrophobicContact CB-CB 4.37Å; L491-A540 HydrophobicContact CD1-CB 3.97Å; L491-A540 HydrophobicContact CD2-CB 4.17Å; L491-A540 HydrophobicContact CG-CB 4.42Å; L491-S541 CarbonylContact C-O 3.51Å; L491-S541 WeakPolarHBondContact CA-O 3.44Å; L491-A542 HydrophobicContact CD2-CB 3.74Å; L491-L547 HydrophobicContact CD1-CD1 4.41Å; L491-L547 HydrophobicContact CD2-CD1 3.62Å
492	K	90.6	Very high	92	Very high	37 Å²	37	38.3 Å²	38.3	16%	0.161	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	162.1	166.3	-42.8	-172.4	-162.8	178.9	0	111.3	L300 P403 R404 S405 V406 V494 D512 S541	L300-K492 HydrophobicContact CD1-CD 4.48Å; L300-K492 HydrophobicContact CD1-CG 3.64Å; P403-K492 PolarHBondContact O-NZ 3.3Å; R404-K492 WeakPolarHBondContact O-CE 3.16Å; R404-K492 PolarHBondContact O-NZ 3.41Å; S405-K492 WeakPolarHBondContact O-CE 3.5Å; S405-K492 PolarHBondContact O-NZ 2.9Å; V406-K492 HydrophobicContact CG1-CD 4.01Å; V406-K492 HydrophobicContact CG1-CG 3.93Å; K492-V494 VanDerWaalsContact C-N 3.25Å; K492-V494 PolarHBondContact O-N 3.19Å; K492-D512 CarbonylContact C-O 3.53Å; K492-D512 VanDerWaalsContact CA-O 3.28Å; K492-D512 WeakPolarHBondContact CA-O 3.24Å; K492-S541 PolarHBondContact N-O 3.11Å; K492-S541 PolarHBondContact O-N 3.26Å
493	K	90.8	Very high	92.3	Very high	126 Å²	126	39.4 Å²	39.4	55%	0.548	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.4	40.2	168.1	-59.5	-176.6	179.2	179.4	0	113.4	T495 F511 D512	K493-T495 PolarHBondContact O-N 2.89Å; K493-T495 PolarHBondContact O-OG1 3.42Å; K493-F511 CarbonylContact C-O 3.6Å; K493-D512 PolarHBondContact N-O 3Å
494	V	94.8	Very high	92.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	123.5	-177.6	-173.6	0	0	0	0	108.9	F292 L491 K492 H510 F511 F514 L520 T538 S539 A540	F292-V494 HydrophobicContact CD1-CG1 4.08Å; F292-V494 HydrophobicContact CE1-CG1 3.77Å; F292-V494 HydrophobicContact CZ-CG1 4.47Å; L491-V494 HydrophobicContact CB-CG2 3.81Å; L491-V494 HydrophobicContact CD1-CG2 4.25Å; K492-V494 VanDerWaalsContact C-N 3.25Å; K492-V494 PolarHBondContact O-N 3.19Å; V494-H510 CarbonylContact O-C 3.58Å; V494-H510 WeakPolarHBondContact O-CA 3.46Å; V494-F511 HydrophobicContact CB-CB 4.43Å; V494-F511 PolarHBondContact N-O 3.13Å; V494-F511 PolarHBondContact O-N 2.89Å; V494-F514 HydrophobicContact CG2-CB 4.23Å; V494-L520 HydrophobicContact CB-CD1 4.21Å; V494-L520 HydrophobicContact CG1-CD1 4.04Å; V494-L520 HydrophobicContact CG2-CD1 4.43Å; V494-T538 HydrophobicContact CG1-CG2 3.78Å; V494-S539 CarbonylContact C-O 3.6Å; V494-S539 WeakPolarHBondContact CA-O 3.34Å; V494-A540 HydrophobicContact CB-CB 4.47Å; V494-A540 HydrophobicContact CG1-CB 4.48Å; V494-A540 HydrophobicContact CG2-CB 4.03Å
495	T	96.2	Very high	92.6	Very high	40 Å²	40	44.5 Å²	44.5	25%	0.245	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	114.2	-178.2	-47.8	0	0	0	0	110.1	K493 S509 H510 T538 S539	K493-T495 PolarHBondContact O-N 2.89Å; K493-T495 PolarHBondContact O-OG1 3.42Å; T495-S509 WeakPolarHBondContact CA-O 3.34Å; T495-H510 PolarHBondContact OG1-CE1 3.35Å; T495-H510 PolarHBondContact OG1-ND1 3.22Å; T495-T538 WeakPolarHBondContact O-CA 3.24Å; T495-S539 PolarHBondContact N-O 2.64Å; T495-S539 PolarHBondContact O-N 2.96Å
496	V	96.6	Very high	92.9	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.024	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125.7	170.7	-171.8	0	0	0	0	108.6	H290 F498 S509 V522 F537 T538	H290-V496 WeakPolarHBondContact ND1-CG1 3.21Å; V496-F498 HydrophobicContact CG1-CE2 3.69Å; V496-F498 HydrophobicContact CG1-CZ 3.69Å; V496-S509 PolarHBondContact N-O 3.44Å; V496-S509 VanDerWaalsContact O-CB 3.3Å; V496-S509 WeakPolarHBondContact O-CB 3.29Å; V496-S509 PolarHBondContact O-OG 2.7Å; V496-V522 HydrophobicContact CB-CG2 4.17Å; V496-V522 HydrophobicContact CG2-CG2 3.89Å; V496-F537 WeakPolarHBondContact CA-O 3.3Å; V496-T538 HydrophobicContact CG2-CG2 4.11Å
497	H	95.3	Very high	93.2	Very high	94 Å²	94	45.8 Å²	45.8	44%	0.435	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	159.2	173.2	64.9	-73.5	0	0	0	111.3	F537	H497-F537 WeakPolarHBondContact CE1-CB 3.27Å; H497-F537 PolarHBondContact N-O 2.92Å; H497-F537 PolarHBondContact ND1-O 3.5Å; H497-F537 WeakPolarHBondContact NE2-CB 3.29Å; H497-F537 PolarHBondContact O-N 2.89Å
498	F	94.3	Very high	93.4	Very high	27 Å²	27	48.1 Å²	48.1	12%	0.118	26%	0.263	C	S	.	.			trans	-132.9	156.5	-176.7	-59	-94.2	0	0	0	107.6	L281 F288 V496 V503 V506 V522 L534	L281-F498 HydrophobicContact CD1-CE1 4.33Å; F288-F498 HydrophobicContact CD2-CE1 4.08Å; F288-F498 HydrophobicContact CD2-CZ 4.08Å; F288-F498 HydrophobicContact CE1-CE1 4.42Å; F288-F498 HydrophobicContact CE1-CZ 4.45Å; F288-F498 AromaticContact CE2-CE1 3.63Å; F288-F498 HydrophobicContact CE2-CE1 3.63Å; F288-F498 AromaticContact CE2-CE2 3.99Å; F288-F498 HydrophobicContact CE2-CE2 3.99Å; F288-F498 AromaticContact CE2-CZ 3.24Å; F288-F498 HydrophobicContact CE2-CZ 3.24Å; F288-F498 HydrophobicContact CZ-CD1 4.46Å; F288-F498 HydrophobicContact CZ-CD2 4.42Å; F288-F498 AromaticContact CZ-CE1 3.8Å; F288-F498 HydrophobicContact CZ-CE1 3.8Å; F288-F498 AromaticContact CZ-CE2 3.78Å; F288-F498 HydrophobicContact CZ-CE2 3.78Å; F288-F498 AromaticContact CZ-CZ 3.45Å; F288-F498 HydrophobicContact CZ-CZ 3.45Å; F288-F498 VanDerWaalsContact CZ-CZ 3.45Å; V496-F498 HydrophobicContact CG1-CE2 3.69Å; V496-F498 HydrophobicContact CG1-CZ 3.69Å; F498-V503 HydrophobicContact CB-CG1 4.26Å; F498-V503 HydrophobicContact CB-CG2 3.57Å; F498-V503 HydrophobicContact CD1-CG1 4.12Å; F498-V503 HydrophobicContact CD2-CG2 4.14Å; F498-V503 HydrophobicContact CG-CG1 4.2Å; F498-V503 HydrophobicContact CG-CG2 3.88Å; F498-V506 HydrophobicContact CE2-CG1 4.26Å; F498-V522 HydrophobicContact CE2-CG1 4.25Å; F498-V522 HydrophobicContact CZ-CG1 4.45Å; F498-L534 HydrophobicContact CD1-CD1 4.48Å
499	P	92.8	Very high	93.6	Very high	49 Å²	49	47.8 Å²	47.8	32%	0.318	26%	0.261	S	S	.	.			trans	-55.4	146.2	174.6	-24	33.3	0	0	0	112.5	A502 T535 F537	P499-A502 HydrophobicContact CB-CB 4.05Å; P499-A502 HydrophobicContact CG-CB 4.44Å; P499-A502 WeakPolarHBondContact O-CB 3.44Å; P499-A502 PolarHBondContact O-N 3.45Å; P499-T535 WeakPolarHBondContact CD-O 3.37Å; P499-T535 WeakPolarHBondContact CG-OG1 3.28Å; P499-F537 HydrophobicContact CG-CE2 4.34Å
500	E	88.8	Confident	93.7	Very high	202 Å²	202	52 Å²	52	94%	0.944	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	140.2	174.5	-66	-166.4	163.4	0	0	110.8	A502	E500-A502 PolarHBondContact O-N 2.83Å; E500-A502 VanDerWaalsContact O-N 3.13Å
501	G	89.3	Confident	93.8	Very high	49 Å²	49	52.7 Å²	52.7	51%	0.505	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-28.7	-175.6	0	0	0	0	0	115.3	V503 Q527	G501-V503 VanDerWaalsContact C-N 3.29Å; G501-V503 PolarHBondContact O-N 2.93Å; G501-Q527 VanDerWaalsContact O-CB 3.27Å; G501-Q527 WeakPolarHBondContact O-CB 3.41Å; G501-Q527 VanDerWaalsContact O-CG 3.32Å; G501-Q527 WeakPolarHBondContact O-CG 3.35Å; G501-Q527 PolarHBondContact O-NE2 3.12Å
502	A	92.7	Very high	93.7	Very high	17 Å²	17	55 Å²	55	14%	0.14	30%	0.295	C	S	.	.	S	Bend	trans	-66.9	-22.4	-172.3	0	0	0	0	0	115.1	P499 E500 Q527 L534	P499-A502 HydrophobicContact CB-CB 4.05Å; P499-A502 HydrophobicContact CG-CB 4.44Å; P499-A502 WeakPolarHBondContact O-CB 3.44Å; P499-A502 PolarHBondContact O-N 3.45Å; E500-A502 PolarHBondContact O-N 2.83Å; E500-A502 VanDerWaalsContact O-N 3.13Å; A502-Q527 PolarHBondContact O-N 3.46Å; A502-L534 HydrophobicContact CB-CD1 4.24Å
503	V	95.2	Very high	93.7	Very high	25 Å²	25	54.2 Å²	54.2	15%	0.152	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	156.7	-175.1	-64.2	0	0	0	0	113.8	F288 F498 G501 V506 K525 L534	F288-V503 HydrophobicContact CD1-CG1 3.85Å; F288-V503 HydrophobicContact CE1-CB 3.86Å; F288-V503 HydrophobicContact CE1-CG1 3.48Å; F288-V503 VanDerWaalsContact CE1-CG1 3.48Å; F288-V503 HydrophobicContact CZ-CG1 4.36Å; F498-V503 HydrophobicContact CB-CG1 4.26Å; F498-V503 HydrophobicContact CB-CG2 3.57Å; F498-V503 HydrophobicContact CD1-CG1 4.12Å; F498-V503 HydrophobicContact CD2-CG2 4.14Å; F498-V503 HydrophobicContact CG-CG1 4.2Å; F498-V503 HydrophobicContact CG-CG2 3.88Å; G501-V503 VanDerWaalsContact C-N 3.29Å; G501-V503 PolarHBondContact O-N 2.93Å; V503-V506 HydrophobicContact CB-CG2 4.02Å; V503-V506 HydrophobicContact CG2-CG2 3.68Å; V503-K525 CarbonylContact C-O 3.58Å; V503-K525 WeakPolarHBondContact CA-O 3.24Å; V503-K525 WeakPolarHBondContact CB-O 3.41Å; V503-L534 HydrophobicContact CG1-CD1 3.84Å
504	T	96	Very high	93.8	Very high	58 Å²	58	48.3 Å²	48.3	36%	0.356	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	166.2	172.1	37.7	0	0	0	0	112.3	V506 K525 Q527	T504-V506 PolarHBondContact O-N 3.38Å; T504-V506 VanDerWaalsContact O-N 3.13Å; T504-K525 PolarHBondContact N-O 3.22Å; T504-K525 PolarHBondContact O-N 3.48Å; T504-Q527 HydrophobicContact CG2-CG 4.48Å
505	D	94.3	Very high	93.7	Very high	94 Å²	94	49.4 Å²	49.4	50%	0.503	27%	0.271	S	S	.	.	S	Bend	trans	49	38.4	178	-61.9	-21.7	0	0	0	114.5	K525 W577	D505-K525 HydrophobicContact CB-CD 4.17Å; D505-K525 WeakPolarHBondContact OD2-CE 3.31Å; D505-K525 IonicContact OD2-NZ 2.91Å; D505-K525 PolarHBondContact OD2-NZ 3.01Å; D505-W577 HydrophobicContact CB-CZ2 3.81Å; D505-W577 PolarHBondContact O-NE1 3.11Å
506	V	96.4	Very high	93.5	Very high	50 Å²	50	48.5 Å²	48.5	30%	0.303	27%	0.269	S	S	.	.			trans	-69.3	137.7	-178.3	-173.1	0	0	0	0	110.7	F288 F498 V503 T504 V522 A523	F288-V506 HydrophobicContact CE1-CG2 4.14Å; F288-V506 HydrophobicContact CZ-CG1 3.99Å; F288-V506 HydrophobicContact CZ-CG2 4.01Å; F498-V506 HydrophobicContact CE2-CG1 4.26Å; V503-V506 HydrophobicContact CB-CG2 4.02Å; V503-V506 HydrophobicContact CG2-CG2 3.68Å; T504-V506 PolarHBondContact O-N 3.38Å; T504-V506 VanDerWaalsContact O-N 3.13Å; V506-V522 HydrophobicContact CG1-CG1 3.65Å; V506-A523 CarbonylContact C-O 3.55Å; V506-A523 WeakPolarHBondContact CA-O 3.24Å
507	T	96.7	Very high	93.2	Very high	10 Å²	10	49.1 Å²	49.1	6%	0.061	28%	0.277	C	S	.	.			trans	-69.4	-176.3	174.4	62.1	0	0	0	0	111.6	S509 A523 L580	T507-S509 PolarHBondContact O-N 3.44Å; T507-A523 HydrophobicContact CG2-CB 4.27Å; T507-A523 PolarHBondContact N-O 2.92Å; T507-A523 PolarHBondContact OG1-N 3.42Å; T507-A523 PolarHBondContact OG1-O 2.9Å; T507-L580 HydrophobicContact CG2-CB 3.86Å
508	Q	93.9	Very high	93.2	Very high	71 Å²	71	46.1 Å²	46.1	33%	0.332	27%	0.266	S	S	.	.			trans	-49.5	118.8	170.4	178.5	174.3	-3.4	0	0	110.5	H510 F511	Q508-H510 WeakPolarHBondContact CG-O 3.34Å; Q508-H510 PolarHBondContact NE2-O 2.97Å; Q508-F511 HydrophobicContact CG-CD1 4.34Å; Q508-F511 HydrophobicContact CG-CE1 3.98Å; Q508-F511 HydrophobicContact CG-CZ 4.25Å; Q508-F511 WeakPolarHBondContact O-CZ 3.41Å
509	S	95.3	Very high	93.2	Very high	37 Å²	37	46 Å²	46	26%	0.259	27%	0.266	S	S	.	.			trans	-116.2	-5.6	179.4	71.1	0	0	0	0	113.9	T495 V496 T507	T495-S509 WeakPolarHBondContact CA-O 3.34Å; V496-S509 PolarHBondContact N-O 3.44Å; V496-S509 VanDerWaalsContact O-CB 3.3Å; V496-S509 WeakPolarHBondContact O-CB 3.29Å; V496-S509 PolarHBondContact O-OG 2.7Å; T507-S509 PolarHBondContact O-N 3.44Å
510	H	94.4	Very high	93.3	Very high	87 Å²	87	44.7 Å²	44.7	40%	0.403	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.4	174.1	-173.4	77.2	0	0	0	110.5	V494 T495 Q508	V494-H510 CarbonylContact O-C 3.58Å; V494-H510 WeakPolarHBondContact O-CA 3.46Å; T495-H510 PolarHBondContact OG1-CE1 3.35Å; T495-H510 PolarHBondContact OG1-ND1 3.22Å; Q508-H510 WeakPolarHBondContact CG-O 3.34Å; Q508-H510 PolarHBondContact NE2-O 2.97Å
511	F	92.8	Very high	93.7	Very high	29 Å²	29	36 Å²	36	13%	0.127	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	125.5	-174.4	-52.8	-93.9	0	0	0	110.5	K493 V494 Q508 K513 L520 V522	K493-F511 CarbonylContact C-O 3.6Å; V494-F511 HydrophobicContact CB-CB 4.43Å; V494-F511 PolarHBondContact N-O 3.13Å; V494-F511 PolarHBondContact O-N 2.89Å; Q508-F511 HydrophobicContact CG-CD1 4.34Å; Q508-F511 HydrophobicContact CG-CE1 3.98Å; Q508-F511 HydrophobicContact CG-CZ 4.25Å; Q508-F511 WeakPolarHBondContact O-CZ 3.41Å; F511-K513 VanDerWaalsContact C-N 3.3Å; F511-K513 PolarHBondContact O-N 3.21Å; F511-L520 HydrophobicContact CB-CD1 3.92Å; F511-L520 HydrophobicContact CB-CD2 4.49Å; F511-L520 HydrophobicContact CD1-CD1 4.37Å; F511-L520 HydrophobicContact CD1-CD2 3.92Å; F511-L520 HydrophobicContact CD2-CD1 3.77Å; F511-L520 HydrophobicContact CE1-CD2 4.26Å; F511-L520 HydrophobicContact CE2-CB 4.35Å; F511-L520 HydrophobicContact CE2-CD1 4.33Å; F511-L520 HydrophobicContact CG-CD1 3.78Å; F511-L520 HydrophobicContact CG-CD2 4.15Å; F511-L520 HydrophobicContact CG-CG 4.47Å; F511-L520 HydrophobicContact CZ-CB 4.35Å; F511-V522 HydrophobicContact CE2-CG2 3.75Å; F511-V522 HydrophobicContact CZ-CG2 3.99Å
512	D	89.9	Confident	94.1	Very high	48 Å²	48	33.8 Å²	33.8	26%	0.257	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	-34	-173.1	-50	-94.9	0	0	0	113.2	R463 K492 K493	R463-D512 WeakPolarHBondContact CD-OD1 3.44Å; R463-D512 IonicContact CZ-OD1 2.7Å; R463-D512 IonicContact NE-OD1 3.07Å; R463-D512 PolarHBondContact NE-OD1 3.08Å; K492-D512 CarbonylContact C-O 3.53Å; K492-D512 VanDerWaalsContact CA-O 3.28Å; K492-D512 WeakPolarHBondContact CA-O 3.24Å; K493-D512 PolarHBondContact N-O 3Å
513	K	90.9	Very high	94.4	Very high	22 Å²	22	33 Å²	33	10%	0.096	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	144.9	-171.9	-59.8	-179.1	176.6	73	0	110.7	V406 E438 S440 L491 F511 F515	V406-K513 HydrophobicContact CB-CD 4.44Å; V406-K513 HydrophobicContact CG1-CD 4.34Å; E438-K513 PolarHBondContact O-NZ 2.9Å; S440-K513 WeakPolarHBondContact OG-CE 3.34Å; S440-K513 PolarHBondContact OG-NZ 3.15Å; L491-K513 CarbonylContact O-C 3.58Å; L491-K513 WeakPolarHBondContact O-CA 3.31Å; F511-K513 VanDerWaalsContact C-N 3.3Å; F511-K513 PolarHBondContact O-N 3.21Å; K513-F515 HydrophobicContact CB-CE2 3.92Å; K513-F515 HydrophobicContact CB-CZ 4Å; K513-F515 HydrophobicContact CD-CZ 4.11Å
514	F	92.9	Very high	94.5	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.009	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139	168.1	171	-113.4	0	0	0	110	A293 P294 L490 L491 V494 S518 L520	A293-F514 HydrophobicContact CB-CE2 4.27Å; A293-F514 HydrophobicContact CB-CZ 3.93Å; P294-F514 HydrophobicContact CG-CD1 4.19Å; P294-F514 HydrophobicContact CG-CE1 3.79Å; L490-F514 HydrophobicContact CB-CD1 4.09Å; L490-F514 HydrophobicContact CB-CE1 4.44Å; L490-F514 HydrophobicContact CD1-CE1 4.03Å; L490-F514 PolarHBondContact N-O 3.48Å; L491-F514 HydrophobicContact CB-CB 4.16Å; L491-F514 HydrophobicContact CD1-CD1 4.23Å; L491-F514 HydrophobicContact CG-CD1 4.45Å; L491-F514 PolarHBondContact N-O 3.41Å; L491-F514 PolarHBondContact O-N 2.86Å; V494-F514 HydrophobicContact CG2-CB 4.23Å; F514-S518 WeakPolarHBondContact CD2-OG 3.12Å; F514-S518 WeakPolarHBondContact CE2-OG 3.48Å; F514-L520 HydrophobicContact CB-CD1 4.25Å; F514-L520 HydrophobicContact CD2-CD1 4.22Å; F514-L520 HydrophobicContact CD2-CD2 4.3Å; F514-L520 HydrophobicContact CD2-CG 3.83Å
515	F	92.5	Very high	94.5	Very high	22 Å²	22	31.4 Å²	31.4	10%	0.096	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143.2	-175.7	-60.9	-86.3	0	0	0	112.2	F442 Q485 V486 P489 K513 G517 S518	F442-F515 HydrophobicContact CZ-CE2 4.42Å; F442-F515 AromaticContact CZ-CZ 3.99Å; F442-F515 HydrophobicContact CZ-CZ 3.99Å; Q485-F515 WeakPolarHBondContact O-CB 3.29Å; V486-F515 HydrophobicContact CB-CD1 4.44Å; V486-F515 HydrophobicContact CB-CE1 4.14Å; V486-F515 WeakPolarHBondContact O-CD1 3.43Å; V486-F515 VanDerWaalsContact O-CE1 3.22Å; V486-F515 WeakPolarHBondContact O-CE1 3.4Å; P489-F515 HydrophobicContact CB-CD1 3.93Å; P489-F515 HydrophobicContact CB-CE1 3.86Å; K513-F515 HydrophobicContact CB-CE2 3.92Å; K513-F515 HydrophobicContact CB-CZ 4Å; K513-F515 HydrophobicContact CD-CZ 4.11Å; F515-G517 PolarHBondContact O-N 3.36Å; F515-S518 WeakPolarHBondContact O-CB 3.26Å; F515-S518 PolarHBondContact O-N 3.25Å; F515-S518 PolarHBondContact O-OG 3.42Å
516	G	92.2	Very high	94.5	Very high	21 Å²	21	27.6 Å²	27.6	22%	0.216	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	125.9	178.1	0	0	0	0	0	111.2	S488 S518	S488-G516 PolarHBondContact O-N 2.98Å; G516-S518 VanDerWaalsContact C-N 3.32Å; G516-S518 PolarHBondContact O-N 2.88Å
517	G	91.4	Very high	94.4	Very high	18 Å²	18	29.4 Å²	29.4	19%	0.186	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-0.6	-177.7	0	0	0	0	0	115.9	R183 L184 G185 F515	R183-G517 CarbonylContact C-O 3.5Å; L184-G517 PolarHBondContact N-O 3.44Å; G185-G517 VanDerWaalsContact N-CA 3.29Å; G185-G517 PolarHBondContact N-O 2.65Å; F515-G517 PolarHBondContact O-N 3.36Å
518	S	93.7	Very high	93.8	Very high	30 Å²	30	34.9 Å²	34.9	21%	0.21	19%	0.187	C	C	.	.			trans	-86	-172.1	163.4	74	0	0	0	0	111.8	R182 F514 F515 G516	R182-S518 PolarHBondContact NH1-O 3.12Å; F514-S518 WeakPolarHBondContact CD2-OG 3.12Å; F514-S518 WeakPolarHBondContact CE2-OG 3.48Å; F515-S518 WeakPolarHBondContact O-CB 3.26Å; F515-S518 PolarHBondContact O-N 3.25Å; F515-S518 PolarHBondContact O-OG 3.42Å; G516-S518 VanDerWaalsContact C-N 3.32Å; G516-S518 PolarHBondContact O-N 2.88Å
519	E	95.3	Very high	93.1	Very high	25 Å²	25	35 Å²	35	12%	0.117	20%	0.196	C	C	.	.			trans	-148.8	140.7	167.7	-175.7	163.7	-98.6	0	0	109.4	R77 R182 Y187 R274 F291 A293 V521	R77-E519 IonicContact NE-OE2 2.86Å; R77-E519 IonicContact NH2-OE1 2.91Å; R182-E519 HydrophobicContact CB-CB 3.93Å; Y187-E519 PolarHBondContact OH-OE1 3.16Å; Y187-E519 VanDerWaalsContact OH-OE1 3.12Å; Y187-E519 PolarHBondContact OH-OE2 3.5Å; R274-E519 IonicContact CZ-OE1 3.1Å; R274-E519 VanDerWaalsContact CZ-OE1 3.28Å; R274-E519 IonicContact NH1-OE1 2.75Å; R274-E519 PolarHBondContact NH1-OE1 2.86Å; R274-E519 IonicContact NH2-OE1 3.46Å; R274-E519 PolarHBondContact NH2-OE1 3.48Å; F291-E519 HydrophobicContact CB-CG 4.4Å; F291-E519 WeakPolarHBondContact CD1-OE2 3.06Å; A293-E519 HydrophobicContact CB-CB 4.05Å; A293-E519 HydrophobicContact CB-CG 3.96Å; E519-V521 HydrophobicContact CG-CG2 4.38Å
520	L	95.7	Very high	92.3	Very high	22 Å²	22	41.9 Å²	41.9	12%	0.115	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	141.8	168.7	-55.5	-178.7	0	0	0	108.7	F292 V494 F511 F514	F292-L520 HydrophobicContact CB-CB 4.37Å; F292-L520 HydrophobicContact CD1-CD1 4.16Å; F292-L520 PolarHBondContact N-O 3.14Å; F292-L520 PolarHBondContact O-N 3.39Å; V494-L520 HydrophobicContact CB-CD1 4.21Å; V494-L520 HydrophobicContact CG1-CD1 4.04Å; V494-L520 HydrophobicContact CG2-CD1 4.43Å; F511-L520 HydrophobicContact CB-CD1 3.92Å; F511-L520 HydrophobicContact CB-CD2 4.49Å; F511-L520 HydrophobicContact CD1-CD1 4.37Å; F511-L520 HydrophobicContact CD1-CD2 3.92Å; F511-L520 HydrophobicContact CD2-CD1 3.77Å; F511-L520 HydrophobicContact CE1-CD2 4.26Å; F511-L520 HydrophobicContact CE2-CB 4.35Å; F511-L520 HydrophobicContact CE2-CD1 4.33Å; F511-L520 HydrophobicContact CG-CD1 3.78Å; F511-L520 HydrophobicContact CG-CD2 4.15Å; F511-L520 HydrophobicContact CG-CG 4.47Å; F511-L520 HydrophobicContact CZ-CB 4.35Å; F514-L520 HydrophobicContact CB-CD1 4.25Å; F514-L520 HydrophobicContact CD2-CD1 4.22Å; F514-L520 HydrophobicContact CD2-CD2 4.3Å; F514-L520 HydrophobicContact CD2-CG 3.83Å
521	V	96.9	Very high	91.6	Very high	20 Å²	20	40.7 Å²	40.7	12%	0.121	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.4	-179.4	-170.8	0	0	0	0	109.1	M179 V289 H290 F291 E519 M576 L580	M179-V521 HydrophobicContact CE-CG2 4.36Å; M179-V521 HydrophobicContact SD-CG1 4.43Å; M179-V521 HydrophobicContact SD-CG2 4.45Å; V289-V521 HydrophobicContact CG1-CG1 3.56Å; H290-V521 WeakPolarHBondContact O-CA 3.43Å; F291-V521 HydrophobicContact CD1-CG1 4.28Å; F291-V521 HydrophobicContact CD1-CG2 4Å; F291-V521 HydrophobicContact CE1-CG1 4.29Å; F291-V521 HydrophobicContact CE1-CG2 4.42Å; E519-V521 HydrophobicContact CG-CG2 4.38Å; V521-M576 HydrophobicContact CG1-SD 4.04Å; V521-L580 HydrophobicContact CB-CD1 4.41Å; V521-L580 HydrophobicContact CG1-CD1 3.83Å
522	V	97.8	Very high	91.4	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.5	173.9	-172.8	0	0	0	0	108.1	F288 V289 H290 V496 F498 V506 F511	F288-V522 HydrophobicContact CE2-CG1 4.33Å; V289-V522 CarbonylContact C-O 2.89Å; V289-V522 WeakPolarHBondContact CA-O 3.43Å; H290-V522 HydrophobicContact CB-CB 4.46Å; H290-V522 PolarHBondContact N-O 3.28Å; H290-V522 PolarHBondContact O-N 2.89Å; V496-V522 HydrophobicContact CB-CG2 4.17Å; V496-V522 HydrophobicContact CG2-CG2 3.89Å; F498-V522 HydrophobicContact CE2-CG1 4.25Å; F498-V522 HydrophobicContact CZ-CG1 4.45Å; V506-V522 HydrophobicContact CG1-CG1 3.65Å; F511-V522 HydrophobicContact CE2-CG2 3.75Å; F511-V522 HydrophobicContact CZ-CG2 3.99Å
523	A	97.8	Very high	91.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	159.5	179	0	0	0	0	0	111.2	F288 V289 V506 T507 W577 L580	F288-A523 VanDerWaalsContact O-CA 3.24Å; F288-A523 WeakPolarHBondContact O-CA 3.37Å; F288-A523 WeakPolarHBondContact O-CB 3.39Å; V289-A523 HydrophobicContact CG2-CB 4.3Å; V506-A523 CarbonylContact C-O 3.55Å; V506-A523 WeakPolarHBondContact CA-O 3.24Å; T507-A523 HydrophobicContact CG2-CB 4.27Å; T507-A523 PolarHBondContact N-O 2.92Å; T507-A523 PolarHBondContact OG1-N 3.42Å; T507-A523 PolarHBondContact OG1-O 2.9Å; A523-W577 HydrophobicContact CB-CB 4.07Å; A523-L580 HydrophobicContact CB-CD1 3.9Å
524	G	97.1	Very high	91.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.4	-171.9	178.8	0	0	0	0	0	112.4	Y287 F288 W577	Y287-G524 CarbonylContact C-O 3.59Å; Y287-G524 WeakPolarHBondContact CA-O 3.47Å; F288-G524 PolarHBondContact N-O 2.95Å; F288-G524 PolarHBondContact O-N 2.89Å; G524-W577 VanDerWaalsContact CA-CD1 3.46Å
525	K	96.4	Very high	91.7	Very high	50 Å²	50	45.4 Å²	45.4	22%	0.217	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	141.1	174.3	-67.1	168.7	-174.1	167.9	0	109.9	Y287 V503 T504 D505 W577	Y287-K525 HydrophobicContact CD1-CG 3.81Å; Y287-K525 HydrophobicContact CE1-CD 4.13Å; Y287-K525 HydrophobicContact CE1-CG 3.46Å; Y287-K525 VanDerWaalsContact CE1-CG 3.46Å; V503-K525 CarbonylContact C-O 3.58Å; V503-K525 WeakPolarHBondContact CA-O 3.24Å; V503-K525 WeakPolarHBondContact CB-O 3.41Å; T504-K525 PolarHBondContact N-O 3.22Å; T504-K525 PolarHBondContact O-N 3.48Å; D505-K525 HydrophobicContact CB-CD 4.17Å; D505-K525 WeakPolarHBondContact OD2-CE 3.31Å; D505-K525 IonicContact OD2-NZ 2.91Å; D505-K525 PolarHBondContact OD2-NZ 3.01Å; K525-W577 VanDerWaalsContact CE-CH2 3.49Å
526	V	95.3	Very high	91.8	Very high	13 Å²	13	44.4 Å²	44.4	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	135.5	173.3	-174.3	0	0	0	0	109	V283 L286 F288 L534 I555	V283-V526 HydrophobicContact CG1-CG2 3.91Å; V283-V526 HydrophobicContact CG2-CG2 4.22Å; L286-V526 PolarHBondContact O-N 2.7Å; F288-V526 HydrophobicContact CB-CG2 4Å; F288-V526 HydrophobicContact CD1-CG2 4.13Å; V526-L534 HydrophobicContact CG2-CD2 4Å; V526-I555 HydrophobicContact CG1-CD1 3.98Å; V526-I555 HydrophobicContact CG1-CG1 4.43Å
527	Q	92.8	Very high	91.9	Very high	89 Å²	89	46.4 Å²	46.4	42%	0.416	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-93.2	129.8	164.9	-61.3	-158.9	54.4	0	0	109.3	G501 A502 T504 S529	G501-Q527 VanDerWaalsContact O-CB 3.27Å; G501-Q527 WeakPolarHBondContact O-CB 3.41Å; G501-Q527 VanDerWaalsContact O-CG 3.32Å; G501-Q527 WeakPolarHBondContact O-CG 3.35Å; G501-Q527 PolarHBondContact O-NE2 3.12Å; A502-Q527 PolarHBondContact O-N 3.46Å; T504-Q527 HydrophobicContact CG2-CG 4.48Å; Q527-S529 PolarHBondContact O-N 2.96Å
528	L	84.6	Confident	92.1	Very high	125 Å²	125	45.6 Å²	45.6	65%	0.654	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-65.7	133.7	173.2	-68.7	172.1	0	0	0	110	L286	L286-L528 HydrophobicContact CD1-CD1 4.16Å; L286-L528 HydrophobicContact CD1-CG 4.38Å; L286-L528 HydrophobicContact CD2-CD2 3.81Å; L286-L528 HydrophobicContact CD2-CG 4.26Å
529	S	79.9	Confident	92.2	Very high	74 Å²	74	45.6 Å²	45.6	52%	0.517	25%	0.252	S	S	.	.			trans	-138.8	177.5	180	-60.8	0	0	0	0	108.3	Q527 S531	Q527-S529 PolarHBondContact O-N 2.96Å; S529-S531 PolarHBondContact O-N 2.81Å
530	D	77.5	Confident	92.1	Very high	181 Å²	181	44.6 Å²	44.6	97%	0.968	25%	0.248	S	C	*	.	S	Bend	trans	-65.3	-5.3	177.4	-58.8	-40.4	0	0	0	114.3
531	S	81.2	Confident	91.7	Very high	62 Å²	62	45.8 Å²	45.8	43%	0.434	26%	0.258	S	S	.	.			trans	-105	131.1	174.6	-175.9	0	0	0	0	111.7	S529 T533	S529-S531 PolarHBondContact O-N 2.81Å; S531-T533 PolarHBondContact O-N 3.49Å; S531-T533 PolarHBondContact OG-N 2.89Å; S531-T533 PolarHBondContact OG-OG1 3.47Å; S531-T533 VanDerWaalsContact OG-OG1 3.08Å
532	N	87.5	Confident	91	Very high	104 Å²	104	45.1 Å²	45.1	56%	0.556	26%	0.255	S	S	*	.	S	Bend	trans	-77.9	-2.7	173.3	-72.9	12	0	0	0	113.6	I555	N532-I555 WeakPolarHBondContact O-CB 3.39Å; N532-I555 VanDerWaalsContact O-CG1 3.25Å; N532-I555 WeakPolarHBondContact O-CG1 3.34Å; N532-I555 PolarHBondContact O-N 3.45Å
533	T	91.6	Very high	89.7	Confident	65 Å²	65	45.9 Å²	45.9	40%	0.399	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.5	-177.3	62.3	0	0	0	0	112.3	S531 T553	S531-T533 PolarHBondContact O-N 3.49Å; S531-T533 PolarHBondContact OG-N 2.89Å; S531-T533 PolarHBondContact OG-OG1 3.47Å; S531-T533 VanDerWaalsContact OG-OG1 3.08Å; T533-T553 CarbonylContact C-O 3.6Å; T533-T553 WeakPolarHBondContact CA-O 3.39Å
534	L	93.8	Very high	88.5	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.1	166	-176.8	67.2	0	0	0	109.7	L281 V283 F288 F498 A502 V503 V526 E552 T553 I555	L281-L534 HydrophobicContact CD1-CD2 4.23Å; L281-L534 HydrophobicContact CD2-CB 4.37Å; L281-L534 HydrophobicContact CD2-CD2 4.1Å; L281-L534 HydrophobicContact CD2-CG 4.05Å; L281-L534 WeakPolarHBondContact CD2-O 3.46Å; L281-L534 HydrophobicContact CG-CD2 4.45Å; V283-L534 HydrophobicContact CG2-CB 4.14Å; V283-L534 HydrophobicContact CG2-CD2 3.7Å; F288-L534 HydrophobicContact CB-CD2 3.69Å; F288-L534 HydrophobicContact CD1-CD2 4.14Å; F288-L534 HydrophobicContact CG-CD2 3.93Å; F498-L534 HydrophobicContact CD1-CD1 4.48Å; A502-L534 HydrophobicContact CB-CD1 4.24Å; V503-L534 HydrophobicContact CG1-CD1 3.84Å; V526-L534 HydrophobicContact CG2-CD2 4Å; L534-E552 WeakPolarHBondContact O-CA 3.35Å; L534-T553 HydrophobicContact CB-CG2 4.41Å; L534-T553 PolarHBondContact N-O 3Å; L534-T553 PolarHBondContact O-N 3.27Å; L534-I555 HydrophobicContact CB-CG1 4.34Å
535	T	93.8	Very high	87.8	Confident	28 Å²	28	47.1 Å²	47.1	17%	0.172	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146.2	170.4	55.1	0	0	0	0	111.4	P499 T551 E552	P499-T535 WeakPolarHBondContact CD-O 3.37Å; P499-T535 WeakPolarHBondContact CG-OG1 3.28Å; T535-T551 CarbonylContact C-O 3.54Å; T535-T551 VanDerWaalsContact CA-O 3.32Å; T535-T551 WeakPolarHBondContact CA-O 3.25Å; T535-E552 HydrophobicContact CG2-CB 4.08Å
536	S	94.8	Very high	87.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	144.1	170.6	73.8	0	0	0	0	111	H290 T551	H290-S536 PolarHBondContact CE1-OG 2.87Å; H290-S536 PolarHBondContact ND1-OG 3.15Å; S536-T551 PolarHBondContact N-O 3Å; S536-T551 PolarHBondContact O-N 3.45Å
537	F	95.4	Very high	87.3	Confident	63 Å²	63	49.4 Å²	49.4	28%	0.276	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	121.9	-175.6	-60.6	-83.2	0	0	0	109	V496 H497 P499 L549 E550	V496-F537 WeakPolarHBondContact CA-O 3.3Å; H497-F537 WeakPolarHBondContact CE1-CB 3.27Å; H497-F537 PolarHBondContact N-O 2.92Å; H497-F537 PolarHBondContact ND1-O 3.5Å; H497-F537 WeakPolarHBondContact NE2-CB 3.29Å; H497-F537 PolarHBondContact O-N 2.89Å; P499-F537 HydrophobicContact CG-CE2 4.34Å; F537-L549 CarbonylContact C-O 3.54Å; F537-L549 WeakPolarHBondContact CA-O 3.49Å; F537-E550 HydrophobicContact CD1-CB 4Å; F537-E550 HydrophobicContact CD1-CG 4Å; F537-E550 HydrophobicContact CE1-CB 4.08Å; F537-E550 HydrophobicContact CE1-CG 3.66Å; F537-E550 WeakPolarHBondContact CE1-OE1 3.4Å; F537-E550 HydrophobicContact CZ-CG 4.43Å
538	T	95.7	Very high	87.3	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.2	179.7	-53	0	0	0	0	110	H290 F292 V494 T495 V496 L549	H290-T538 PolarHBondContact CE1-OG1 2.86Å; F292-T538 HydrophobicContact CD2-CG2 4.02Å; F292-T538 HydrophobicContact CE1-CG2 4.23Å; F292-T538 HydrophobicContact CE2-CG2 3.7Å; F292-T538 HydrophobicContact CG-CG2 4.43Å; F292-T538 HydrophobicContact CZ-CG2 3.79Å; V494-T538 HydrophobicContact CG1-CG2 3.78Å; T495-T538 WeakPolarHBondContact O-CA 3.24Å; V496-T538 HydrophobicContact CG2-CG2 4.11Å; T538-L549 PolarHBondContact N-O 2.97Å; T538-L549 PolarHBondContact O-N 3.37Å
539	S	94.9	Very high	87.7	Confident	30 Å²	30	42.7 Å²	42.7	21%	0.21	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	142.4	170.6	60.2	0	0	0	0	110.8	V494 T495 L547 N548	V494-S539 CarbonylContact C-O 3.6Å; V494-S539 WeakPolarHBondContact CA-O 3.34Å; T495-S539 PolarHBondContact N-O 2.64Å; T495-S539 PolarHBondContact O-N 2.96Å; S539-L547 CarbonylContact C-O 3.55Å; S539-L547 VanDerWaalsContact CA-O 3.27Å; S539-L547 WeakPolarHBondContact CA-O 3.3Å; S539-N548 WeakPolarHBondContact CB-OD1 3.43Å
540	A	93.3	Very high	88.4	Confident	5 Å²	5	42.1 Å²	42.1	4%	0.041	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	163.5	-179.9	0	0	0	0	0	112.2	L491 V494 L547	L491-A540 HydrophobicContact CB-CB 4.37Å; L491-A540 HydrophobicContact CD1-CB 3.97Å; L491-A540 HydrophobicContact CD2-CB 4.17Å; L491-A540 HydrophobicContact CG-CB 4.42Å; V494-A540 HydrophobicContact CB-CB 4.47Å; V494-A540 HydrophobicContact CG1-CB 4.48Å; V494-A540 HydrophobicContact CG2-CB 4.03Å; A540-L547 HydrophobicContact CB-CB 4.4Å; A540-L547 PolarHBondContact N-O 3.46Å; A540-L547 PolarHBondContact O-N 3.38Å
541	S	88.5	Confident	89.1	Confident	47 Å²	47	34.3 Å²	34.3	33%	0.329	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.4	170.3	-52.7	0	0	0	0	110.6	L491 K492	L491-S541 CarbonylContact C-O 3.51Å; L491-S541 WeakPolarHBondContact CA-O 3.44Å; K492-S541 PolarHBondContact N-O 3.11Å; K492-S541 PolarHBondContact O-N 3.26Å
542	A	81.1	Confident	89.6	Confident	6 Å²	6	35.9 Å²	35.9	5%	0.05	20%	0.196	C	C	.	.			trans	-82	-166.7	157.9	0	0	0	0	0	109.3	L491 L545	L491-A542 HydrophobicContact CD2-CB 3.74Å; A542-L545 HydrophobicContact CB-CB 4.24Å; A542-L545 HydrophobicContact CB-CD2 4.16Å; A542-L545 PolarHBondContact N-O 3.44Å
543	A	70.9	Confident	89.8	Confident	17 Å²	17	31.7 Å²	31.7	14%	0.14	17%	0.174	C	C	.	.	S	Bend	trans	-57.2	-76.6	-173.3	0	0	0	0	0	112.7	L300 R404 L545	L300-A543 HydrophobicContact CD2-CB 3.75Å; L300-A543 VanDerWaalsContact CD2-N 3.29Å; R404-A543 WeakPolarHBondContact CB-O 3.33Å; R404-A543 WeakPolarHBondContact CD-O 3.43Å; R404-A543 WeakPolarHBondContact CG-O 3.31Å; A543-L545 VanDerWaalsContact C-N 3.32Å
544	S	72.4	Confident	89.8	Confident	22 Å²	22	30.7 Å²	30.7	15%	0.154	17%	0.166	C	C	.	.	S	Bend	trans	-90	2.1	179.8	-39.1	0	0	0	0	113.1	R404 D780 Q797	R404-S544 PolarHBondContact NH1-OG 2.77Å; R404-S544 VanDerWaalsContact NH1-OG 3.07Å; S544-D780 PolarHBondContact OG-OD2 3.41Å; S544-Q797 WeakPolarHBondContact O-CG 3.29Å
545	L	82.4	Confident	89.6	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.026	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	119.4	-144	-178.3	162.8	0	0	0	111	A542 A543 L547 M778 F787 I795 T796 Q797	A542-L545 HydrophobicContact CB-CB 4.24Å; A542-L545 HydrophobicContact CB-CD2 4.16Å; A542-L545 PolarHBondContact N-O 3.44Å; A543-L545 VanDerWaalsContact C-N 3.32Å; L545-L547 HydrophobicContact CD2-CD2 3.33Å; L545-L547 HydrophobicContact CD2-CG 3.65Å; L545-M778 HydrophobicContact CD1-SD 3.65Å; L545-F787 HydrophobicContact CD1-CZ 4.28Å; L545-F787 HydrophobicContact CD2-CZ 4.42Å; L545-I795 HydrophobicContact CD1-CG2 3.9Å; L545-I795 HydrophobicContact CD2-CG2 3.73Å; L545-I795 HydrophobicContact CG-CG2 3.77Å; L545-T796 CarbonylContact C-O 3.52Å; L545-T796 WeakPolarHBondContact CA-O 3.41Å; L545-Q797 HydrophobicContact CB-CB 4.26Å; L545-Q797 HydrophobicContact CG-CB 4.42Å
546	Q	88.9	Confident	89.4	Confident	108 Å²	108	33 Å²	33	51%	0.505	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.3	174.9	-175.4	173.1	-5.2	0	0	110	I795 T796	Q546-I795 WeakPolarHBondContact O-CA 3.22Å; Q546-T796 PolarHBondContact N-O 3.06Å; Q546-T796 PolarHBondContact O-N 3.47Å
547	L	91.3	Very high	89.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.2	177.5	-65.2	175.2	0	0	0	110.1	L491 S539 A540 L545 L549 F787 I795	L491-L547 HydrophobicContact CD1-CD1 4.41Å; L491-L547 HydrophobicContact CD2-CD1 3.62Å; S539-L547 CarbonylContact C-O 3.55Å; S539-L547 VanDerWaalsContact CA-O 3.27Å; S539-L547 WeakPolarHBondContact CA-O 3.3Å; A540-L547 HydrophobicContact CB-CB 4.4Å; A540-L547 PolarHBondContact N-O 3.46Å; A540-L547 PolarHBondContact O-N 3.38Å; L545-L547 HydrophobicContact CD2-CD2 3.33Å; L545-L547 HydrophobicContact CD2-CG 3.65Å; L547-L549 HydrophobicContact CB-CD1 4.44Å; L547-L549 HydrophobicContact CB-CG 4.23Å; L547-L549 HydrophobicContact CD1-CD1 4.35Å; L547-L549 HydrophobicContact CD2-CD2 4.39Å; L547-F787 HydrophobicContact CD2-CE1 3.74Å; L547-F787 HydrophobicContact CD2-CZ 4.08Å; L547-I795 HydrophobicContact CD2-CG1 3.95Å; L547-I795 HydrophobicContact CD2-CG2 4.42Å
548	N	94.2	Very high	89	Confident	68 Å²	68	37 Å²	37	36%	0.364	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	118.7	158	-59.7	-55.4	0	0	0	107.3	S539 A793 D794	S539-N548 WeakPolarHBondContact CB-OD1 3.43Å; N548-A793 CarbonylContact O-C 3.58Å; N548-A793 WeakPolarHBondContact O-CA 3.43Å; N548-D794 HydrophobicContact CB-CB 4.31Å; N548-D794 PolarHBondContact N-O 3.26Å; N548-D794 PolarHBondContact O-N 2.89Å
549	L	93.3	Very high	88.7	Confident	5 Å²	5	39 Å²	39	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.3	-169.4	-56.5	173.7	0	0	0	110	A278 F292 F537 T538 L547 A793	A278-L549 HydrophobicContact CB-CB 3.81Å; F292-L549 HydrophobicContact CE2-CD1 3.89Å; F292-L549 HydrophobicContact CZ-CD1 4.17Å; F537-L549 CarbonylContact C-O 3.54Å; F537-L549 WeakPolarHBondContact CA-O 3.49Å; T538-L549 PolarHBondContact N-O 2.97Å; T538-L549 PolarHBondContact O-N 3.37Å; L547-L549 HydrophobicContact CB-CD1 4.44Å; L547-L549 HydrophobicContact CB-CG 4.23Å; L547-L549 HydrophobicContact CD1-CD1 4.35Å; L547-L549 HydrophobicContact CD2-CD2 4.39Å; L549-A793 HydrophobicContact CD2-CB 3.5Å
550	E	94	Very high	88.5	Confident	63 Å²	63	44.1 Å²	44.1	29%	0.294	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	131.8	-178.1	177.8	177.9	-157.2	0	0	111	F537 T792	F537-E550 HydrophobicContact CD1-CB 4Å; F537-E550 HydrophobicContact CD1-CG 4Å; F537-E550 HydrophobicContact CE1-CB 4.08Å; F537-E550 HydrophobicContact CE1-CG 3.66Å; F537-E550 WeakPolarHBondContact CE1-OE1 3.4Å; F537-E550 HydrophobicContact CZ-CG 4.43Å; E550-T792 HydrophobicContact CB-CG2 4.31Å; E550-T792 PolarHBondContact N-O 3.45Å; E550-T792 WeakPolarHBondContact OE2-CG2 3.22Å
551	T	91.7	Very high	88.3	Confident	16 Å²	16	47.6 Å²	47.6	10%	0.098	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134	174.1	-50	0	0	0	0	109.7	A278 L281 T535 S536	A278-T551 VanDerWaalsContact CB-OG1 3.24Å; A278-T551 WeakPolarHBondContact CB-OG1 3.45Å; A278-T551 PolarHBondContact O-OG1 3.01Å; L281-T551 HydrophobicContact CB-CG2 3.59Å; T535-T551 CarbonylContact C-O 3.54Å; T535-T551 VanDerWaalsContact CA-O 3.32Å; T535-T551 WeakPolarHBondContact CA-O 3.25Å; S536-T551 PolarHBondContact N-O 3Å; S536-T551 PolarHBondContact O-N 3.45Å
552	E	91.3	Very high	88.4	Confident	95 Å²	95	45.5 Å²	45.5	44%	0.444	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.6	177	64.9	-176.5	178.9	0	0	109.8	L534 T535 K806	L534-E552 WeakPolarHBondContact O-CA 3.35Å; T535-E552 HydrophobicContact CG2-CB 4.08Å; E552-K806 VanDerWaalsContact OE1-CD 3.32Å; E552-K806 WeakPolarHBondContact OE1-CD 3.3Å; E552-K806 WeakPolarHBondContact OE1-CE 3.45Å; E552-K806 IonicContact OE1-NZ 2.69Å; E552-K806 PolarHBondContact OE1-NZ 3.4Å
553	T	91.7	Very high	88.7	Confident	17 Å²	17	49.1 Å²	49.1	10%	0.104	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	149.5	167.3	-170.5	0	0	0	0	110.4	L281 V283 T533 L534	L281-T553 HydrophobicContact CB-CG2 4.29Å; L281-T553 HydrophobicContact CD2-CG2 3.86Å; L281-T553 HydrophobicContact CG-CG2 3.76Å; V283-T553 HydrophobicContact CB-CG2 4.43Å; V283-T553 HydrophobicContact CG2-CG2 3.69Å; T533-T553 CarbonylContact C-O 3.6Å; T533-T553 WeakPolarHBondContact CA-O 3.39Å; L534-T553 HydrophobicContact CB-CG2 4.41Å; L534-T553 PolarHBondContact N-O 3Å; L534-T553 PolarHBondContact O-N 3.27Å
554	D	92.1	Very high	89.6	Confident	43 Å²	43	53.1 Å²	53.1	23%	0.23	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	148.2	162.3	-171.8	-84.4	0	0	0	109.7	T556 E557	D554-T556 WeakPolarHBondContact OD1-CA 3.45Å; D554-T556 WeakPolarHBondContact OD1-CB 3.34Å; D554-T556 PolarHBondContact OD1-N 3.22Å; D554-T556 PolarHBondContact OD1-OG1 2.69Å; D554-E557 HydrophobicContact CB-CB 3.91Å; D554-E557 PolarHBondContact OD1-N 3.05Å
555	I	90.6	Very high	90.3	Very high	14 Å²	14	53.6 Å²	53.6	7%	0.072	29%	0.286	C	S	.	.	S	Bend	trans	-78.7	-19.9	-177.8	-71.9	167.5	0	0	0	112.3	V283 L286 V526 N532 L534	V283-I555 HydrophobicContact CG1-CB 4.27Å; V283-I555 HydrophobicContact CG1-CG1 4.34Å; V283-I555 HydrophobicContact CG1-CG2 4Å; L286-I555 HydrophobicContact CD2-CG2 4.1Å; V526-I555 HydrophobicContact CG1-CD1 3.98Å; V526-I555 HydrophobicContact CG1-CG1 4.43Å; N532-I555 WeakPolarHBondContact O-CB 3.39Å; N532-I555 VanDerWaalsContact O-CG1 3.25Å; N532-I555 WeakPolarHBondContact O-CG1 3.34Å; N532-I555 PolarHBondContact O-N 3.45Å; L534-I555 HydrophobicContact CB-CG1 4.34Å
556	T	88.5	Confident	90.2	Very high	66 Å²	66	61.5 Å²	61.5	41%	0.405	32%	0.323	S	S	.	.	S	Bend	trans	-117.3	-25.7	-169.9	64.8	0	0	0	0	114.6	D554 L558 D559 M560	D554-T556 WeakPolarHBondContact OD1-CA 3.45Å; D554-T556 WeakPolarHBondContact OD1-CB 3.34Å; D554-T556 PolarHBondContact OD1-N 3.22Å; D554-T556 PolarHBondContact OD1-OG1 2.69Å; T556-L558 VanDerWaalsContact C-N 3.31Å; T556-L558 PolarHBondContact O-N 2.89Å; T556-D559 PolarHBondContact O-N 3.48Å; T556-M560 PolarHBondContact O-N 2.79Å
557	E	90.9	Very high	90	Very high	133 Å²	133	59.6 Å²	59.6	62%	0.621	31%	0.314	S	S	*	.	H	α-helix	trans	-50.9	-46	-177.8	-179.3	178.6	-154.6	0	0	112.9	D554 M560 E561	D554-E557 HydrophobicContact CB-CB 3.91Å; D554-E557 PolarHBondContact OD1-N 3.05Å; E557-M560 PolarHBondContact O-N 2.83Å; E557-E561 PolarHBondContact O-N 3.32Å
558	L	91.1	Very high	89.6	Confident	13 Å²	13	60.3 Å²	60.3	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-73.2	-35.9	-177.4	178.8	59.8	0	0	0	113.1	P211 Q282 T556 M560 E561 L562 F572	P211-L558 HydrophobicContact CB-CD1 4.03Å; P211-L558 HydrophobicContact CG-CD1 3.57Å; Q282-L558 HydrophobicContact CB-CD2 3.69Å; Q282-L558 HydrophobicContact CG-CD2 3.91Å; T556-L558 VanDerWaalsContact C-N 3.31Å; T556-L558 PolarHBondContact O-N 2.89Å; L558-M560 VanDerWaalsContact C-N 3.34Å; L558-E561 PolarHBondContact O-N 3.4Å; L558-L562 HydrophobicContact CD1-CD1 3.98Å; L558-L562 HydrophobicContact CD1-CG 3.98Å; L558-L562 HydrophobicContact CD2-CD1 4.47Å; L558-L562 HydrophobicContact CG-CD1 3.78Å; L558-L562 HydrophobicContact CG-CG 4.28Å; L558-L562 WeakPolarHBondContact O-CB 3.48Å; L558-L562 WeakPolarHBondContact O-CD1 3.37Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.49Å; L558-L562 PolarHBondContact O-N 2.8Å; L558-F572 HydrophobicContact CD2-CE1 4.38Å; L558-F572 HydrophobicContact CD2-CZ 4.07Å
559	D	90.6	Very high	89	Confident	44 Å²	44	59.9 Å²	59.9	24%	0.235	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-37.8	174.7	-81.2	-26.1	0	0	0	111.1	S284 D285 T556 A563	S284-D559 VanDerWaalsContact CA-OD1 3.29Å; S284-D559 WeakPolarHBondContact CA-OD1 3.5Å; S284-D559 WeakPolarHBondContact CA-OD2 3.44Å; S284-D559 WeakPolarHBondContact CB-OD1 3.25Å; S284-D559 PolarHBondContact OG-OD1 3.24Å; D285-D559 PolarHBondContact N-OD1 3.05Å; D285-D559 PolarHBondContact N-OD2 3.46Å; T556-D559 PolarHBondContact O-N 3.48Å; D559-A563 WeakPolarHBondContact O-CB 3.49Å; D559-A563 PolarHBondContact O-N 2.95Å
560	M	89.5	Confident	88.3	Confident	138 Å²	138	62.6 Å²	62.6	68%	0.68	33%	0.331	S	S	*	.	H	α-helix	trans	-63.7	-40.7	171.2	-70.9	-177.8	61.3	0	0	112.3	T556 E557 L558	T556-M560 PolarHBondContact O-N 2.79Å; E557-M560 PolarHBondContact O-N 2.83Å; L558-M560 VanDerWaalsContact C-N 3.34Å
561	E	90.3	Very high	87.9	Confident	78 Å²	78	60 Å²	60	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-66.2	-50.8	176.8	-164.1	-172.4	-144.2	0	0	111.2	Y209 E557 L558 A563 T564 Q565	Y209-E561 WeakPolarHBondContact OH-CG 3.44Å; Y209-E561 PolarHBondContact OH-OE1 2.96Å; Y209-E561 PolarHBondContact OH-OE2 2.83Å; E557-E561 PolarHBondContact O-N 3.32Å; L558-E561 PolarHBondContact O-N 3.4Å; E561-A563 VanDerWaalsContact C-N 3.3Å; E561-A563 PolarHBondContact O-N 2.71Å; E561-T564 PolarHBondContact O-N 3.18Å; E561-T564 PolarHBondContact O-OG1 2.76Å; E561-Q565 WeakPolarHBondContact O-CG 3.35Å
562	L	89.8	Confident	88	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-38.4	180	-74.9	164.8	0	0	0	112.6	T75 Y209 L558 T564 Q565 S568 T570 F572	T75-L562 HydrophobicContact CG2-CD2 3.79Å; Y209-L562 HydrophobicContact CD1-CD2 3.81Å; Y209-L562 HydrophobicContact CE1-CD2 3.61Å; Y209-L562 HydrophobicContact CE1-CG 4.47Å; L558-L562 HydrophobicContact CD1-CD1 3.98Å; L558-L562 HydrophobicContact CD1-CG 3.98Å; L558-L562 HydrophobicContact CD2-CD1 4.47Å; L558-L562 HydrophobicContact CG-CD1 3.78Å; L558-L562 HydrophobicContact CG-CG 4.28Å; L558-L562 WeakPolarHBondContact O-CB 3.48Å; L558-L562 WeakPolarHBondContact O-CD1 3.37Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.49Å; L558-L562 PolarHBondContact O-N 2.8Å; L562-T564 PolarHBondContact O-N 3.36Å; L562-T564 VanDerWaalsContact O-N 3.09Å; L562-Q565 PolarHBondContact O-N 2.79Å; L562-S568 PolarHBondContact O-OG 2.69Å; L562-T570 HydrophobicContact CB-CG2 4.05Å; L562-F572 HydrophobicContact CD1-CD1 4.18Å; L562-F572 HydrophobicContact CD1-CE1 3.71Å
563	A	87.9	Confident	88.2	Confident	82 Å²	82	54.7 Å²	54.7	68%	0.678	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.4	176.5	0	0	0	0	0	113.9	D559 E561	D559-A563 WeakPolarHBondContact O-CB 3.49Å; D559-A563 PolarHBondContact O-N 2.95Å; E561-A563 VanDerWaalsContact C-N 3.3Å; E561-A563 PolarHBondContact O-N 2.71Å
564	T	88.6	Confident	88.3	Confident	102 Å²	102	57.6 Å²	57.6	63%	0.626	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-13	173.8	71.2	0	0	0	0	114	E561 L562	E561-T564 PolarHBondContact O-N 3.18Å; E561-T564 PolarHBondContact O-OG1 2.76Å; L562-T564 PolarHBondContact O-N 3.36Å; L562-T564 VanDerWaalsContact O-N 3.09Å
565	Q	87.3	Confident	88.5	Confident	32 Å²	32	57 Å²	57	15%	0.15	30%	0.302	C	S	.	.			trans	-101.3	101.5	-169	-46.3	-55.2	-7.9	0	0	112.6	Y209 K239 E561 L562 H567 S568	Y209-Q565 HydrophobicContact CD2-CG 4.49Å; Y209-Q565 HydrophobicContact CE1-CG 4.06Å; Y209-Q565 HydrophobicContact CE2-CG 3.96Å; Y209-Q565 PolarHBondContact OH-NE2 3.03Å; K239-Q565 VanDerWaalsContact NZ-CD 3.35Å; E561-Q565 WeakPolarHBondContact O-CG 3.35Å; L562-Q565 PolarHBondContact O-N 2.79Å; Q565-H567 PolarHBondContact O-N 3.23Å; Q565-S568 PolarHBondContact O-N 3.34Å; Q565-S568 PolarHBondContact O-OG 3.03Å
566	Q	81.9	Confident	88.7	Confident	171 Å²	171	56.4 Å²	56.4	80%	0.799	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-26.5	-175.8	-175.3	174	5.9	0	0	116
567	H	83.8	Confident	89.2	Confident	67 Å²	67	53.5 Å²	53.5	31%	0.31	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	7.9	-177.9	-66.8	-90	0	0	0	114.2	Y207 Q565	Y207-H567 HydrophobicContact CD1-CB 3.94Å; Y207-H567 AromaticContact CD1-CG 3.63Å; Y207-H567 AromaticContact CD1-ND1 3.51Å; Y207-H567 AromaticContact CD2-ND1 3.77Å; Y207-H567 AromaticContact CE1-CE1 3.46Å; Y207-H567 VanDerWaalsContact CE1-CE1 3.46Å; Y207-H567 WeakPolarHBondContact CE1-CE1 3.36Å; Y207-H567 AromaticContact CE1-CG 3.84Å; Y207-H567 AromaticContact CE1-ND1 3.38Å; Y207-H567 WeakPolarHBondContact CE1-ND1 3.42Å; Y207-H567 AromaticContact CE1-NE2 3.95Å; Y207-H567 AromaticContact CE2-ND1 3.65Å; Y207-H567 HydrophobicContact CG-CB 3.97Å; Y207-H567 AromaticContact CG-CG 3.98Å; Y207-H567 AromaticContact CG-ND1 3.71Å; Y207-H567 AromaticContact CZ-CE1 3.46Å; Y207-H567 VanDerWaalsContact CZ-CE1 3.46Å; Y207-H567 AromaticContact CZ-ND1 3.47Å; Q565-H567 PolarHBondContact O-N 3.23Å
568	S	83.6	Confident	89.4	Confident	17 Å²	17	47.1 Å²	47.1	12%	0.119	25%	0.251	C	S	.	.			trans	-77.9	174.7	173.1	74.5	0	0	0	0	112.4	T75 L562 Q565	T75-S568 WeakPolarHBondContact OG1-CA 3.31Å; L562-S568 PolarHBondContact O-OG 2.69Å; Q565-S568 PolarHBondContact O-N 3.34Å; Q565-S568 PolarHBondContact O-OG 3.03Å
569	F	81.8	Confident	89.6	Confident	60 Å²	60	46.9 Å²	46.9	26%	0.263	25%	0.249	S	C	.	.			trans	-131	106.7	168.7	175.9	-118.1	0	0	0	109.5	T75 F78 G571 F572 Q575	T75-F569 PolarHBondContact OG1-N 3.32Å; F78-F569 HydrophobicContact CD1-CD1 4.47Å; F78-F569 HydrophobicContact CE1-CE1 4.48Å; F569-G571 WeakPolarHBondContact CE1-O 3.15Å; F569-G571 PolarHBondContact O-N 3.04Å; F569-F572 HydrophobicContact CD1-CB 3.89Å; F569-F572 HydrophobicContact CE1-CB 4.49Å; F569-F572 WeakPolarHBondContact O-CB 3.43Å; F569-F572 WeakPolarHBondContact O-CD1 3Å; F569-F572 PolarHBondContact O-N 3.03Å; F569-Q575 HydrophobicContact CE1-CB 4.41Å; F569-Q575 HydrophobicContact CE1-CG 3.89Å; F569-Q575 HydrophobicContact CZ-CG 4.03Å
570	T	78.3	Confident	89.9	Confident	62 Å²	62	46.2 Å²	46.2	38%	0.38	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-45.1	-177.5	51.4	0	0	0	0	112.4	S284 L562 F572	S284-T570 PolarHBondContact OG-O 3.09Å; L562-T570 HydrophobicContact CB-CG2 4.05Å; T570-F572 VanDerWaalsContact O-CD1 3.3Å; T570-F572 WeakPolarHBondContact O-CD1 3.28Å; T570-F572 PolarHBondContact O-N 2.72Å
571	G	85.4	Confident	90.2	Very high	8 Å²	8	40.6 Å²	40.6	8%	0.082	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	13.6	-179	0	0	0	0	0	116.2	F569 Q575	F569-G571 WeakPolarHBondContact CE1-O 3.15Å; F569-G571 PolarHBondContact O-N 3.04Å; G571-Q575 WeakPolarHBondContact O-CG 3.38Å; G571-Q575 PolarHBondContact O-N 3.3Å
572	F	93.1	Very high	90.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-45	-176.1	81.2	-77.9	0	0	0	112.2	T75 F78 L558 L562 F569 T570 K574 Q575 M576	T75-F572 HydrophobicContact CG2-CB 4.26Å; T75-F572 HydrophobicContact CG2-CD1 3.89Å; T75-F572 HydrophobicContact CG2-CG 3.98Å; F78-F572 HydrophobicContact CB-CB 4.11Å; F78-F572 HydrophobicContact CD1-CB 4.4Å; L558-F572 HydrophobicContact CD2-CE1 4.38Å; L558-F572 HydrophobicContact CD2-CZ 4.07Å; L562-F572 HydrophobicContact CD1-CD1 4.18Å; L562-F572 HydrophobicContact CD1-CE1 3.71Å; F569-F572 HydrophobicContact CD1-CB 3.89Å; F569-F572 HydrophobicContact CE1-CB 4.49Å; F569-F572 WeakPolarHBondContact O-CB 3.43Å; F569-F572 WeakPolarHBondContact O-CD1 3Å; F569-F572 PolarHBondContact O-N 3.03Å; T570-F572 VanDerWaalsContact O-CD1 3.3Å; T570-F572 WeakPolarHBondContact O-CD1 3.28Å; T570-F572 PolarHBondContact O-N 2.72Å; F572-K574 PolarHBondContact O-N 3.1Å; F572-Q575 PolarHBondContact O-N 2.98Å; F572-M576 WeakPolarHBondContact O-CB 3.48Å; F572-M576 PolarHBondContact O-N 3.39Å
573	A	94.9	Very high	90.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-44.6	-176.9	0	0	0	0	0	111.1	V289 Q575 M576 W577	V289-A573 HydrophobicContact CG2-CB 4.09Å; A573-Q575 PolarHBondContact O-N 3.04Å; A573-M576 PolarHBondContact O-N 3.43Å; A573-W577 WeakPolarHBondContact O-CB 3.33Å; A573-W577 PolarHBondContact O-N 3.39Å
574	K	95.7	Very high	90.8	Very high	78 Å²	78	39.4 Å²	39.4	34%	0.339	20%	0.198	S	C	.	.	H	α-helix	trans	-59.7	-42.5	174.3	177.9	173.4	176.1	-177.1	0	113.1	Y287 F572 A578	Y287-K574 HydrophobicContact CD1-CB 4.4Å; Y287-K574 HydrophobicContact CD2-CB 3.57Å; Y287-K574 HydrophobicContact CD2-CD 4.27Å; Y287-K574 HydrophobicContact CD2-CG 3.91Å; Y287-K574 HydrophobicContact CE1-CG 4.32Å; Y287-K574 HydrophobicContact CE2-CB 3.89Å; Y287-K574 HydrophobicContact CE2-CD 3.81Å; Y287-K574 HydrophobicContact CE2-CG 3.67Å; Y287-K574 HydrophobicContact CG-CB 3.9Å; Y287-K574 HydrophobicContact CG-CG 4.4Å; F572-K574 PolarHBondContact O-N 3.1Å; K574-A578 PolarHBondContact O-N 2.96Å
575	Q	94.9	Very high	91	Very high	31 Å²	31	35.5 Å²	35.5	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-75.5	-36.2	178.1	-65.9	-66	23.7	0	0	112.7	F78 F569 G571 F572 A573 A578 Y579 H612 F614	F78-Q575 HydrophobicContact CD1-CB 4.41Å; F78-Q575 HydrophobicContact CE1-CB 3.55Å; F78-Q575 HydrophobicContact CE1-CG 4.41Å; F78-Q575 HydrophobicContact CE2-CB 4.45Å; F78-Q575 HydrophobicContact CZ-CB 3.57Å; F569-Q575 HydrophobicContact CE1-CB 4.41Å; F569-Q575 HydrophobicContact CE1-CG 3.89Å; F569-Q575 HydrophobicContact CZ-CG 4.03Å; G571-Q575 WeakPolarHBondContact O-CG 3.38Å; G571-Q575 PolarHBondContact O-N 3.3Å; F572-Q575 PolarHBondContact O-N 2.98Å; A573-Q575 PolarHBondContact O-N 3.04Å; Q575-A578 PolarHBondContact O-N 3.06Å; Q575-Y579 VanDerWaalsContact O-CB 3.24Å; Q575-Y579 WeakPolarHBondContact O-CB 3.26Å; Q575-Y579 PolarHBondContact O-N 3.07Å; Q575-H612 PolarHBondContact OE1-ND1 2.85Å; Q575-F614 HydrophobicContact CB-CZ 4.4Å
576	M	95.8	Very high	91.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.6	-42	175.2	-167.7	-175.1	-63	0	0	111.6	S76 R77 F78 M179 V289 F291 V521 F572 A573 A578 Y579 L580	S76-M576 VanDerWaalsContact O-CE 3.23Å; S76-M576 WeakPolarHBondContact O-CE 3.27Å; R77-M576 HydrophobicContact CB-CE 4.44Å; F78-M576 HydrophobicContact CB-CE 3.8Å; F78-M576 HydrophobicContact CD2-CB 3.87Å; F78-M576 HydrophobicContact CD2-CE 4.15Å; F78-M576 HydrophobicContact CD2-CG 4.18Å; F78-M576 HydrophobicContact CE2-CB 4.22Å; F78-M576 HydrophobicContact CG-CE 4.42Å; M179-M576 HydrophobicContact CG-CE 4.04Å; M179-M576 HydrophobicContact CG-CG 4.02Å; M179-M576 HydrophobicContact CG-SD 3.97Å; M179-M576 HydrophobicContact SD-CG 3.95Å; M179-M576 HydrophobicContact SD-SD 3.89Å; V289-M576 HydrophobicContact CG1-SD 3.69Å; V289-M576 HydrophobicContact CG2-CB 4.49Å; V289-M576 HydrophobicContact CG2-SD 4.1Å; F291-M576 HydrophobicContact CE1-CE 4.11Å; F291-M576 HydrophobicContact CE1-SD 4.13Å; F291-M576 HydrophobicContact CZ-CE 3.91Å; F291-M576 HydrophobicContact CZ-SD 4.15Å; V521-M576 HydrophobicContact CG1-SD 4.04Å; F572-M576 WeakPolarHBondContact O-CB 3.48Å; F572-M576 PolarHBondContact O-N 3.39Å; A573-M576 PolarHBondContact O-N 3.43Å; M576-A578 PolarHBondContact O-N 3.17Å; M576-Y579 PolarHBondContact O-N 2.73Å; M576-L580 HydrophobicContact CG-CD1 4.04Å; M576-L580 HydrophobicContact CG-CG 4.42Å; M576-L580 WeakPolarHBondContact O-CB 3.4Å; M576-L580 WeakPolarHBondContact O-CG 3.37Å; M576-L580 PolarHBondContact O-N 3.18Å
577	W	97.4	Very high	91.4	Very high	5 Å²	5	33.5 Å²	33.5	2%	0.019	16%	0.16	C	C	.	.	H	α-helix	trans	-56	-48.7	172.1	167.2	76.6	0	0	0	111.8	Y287 D505 A523 G524 K525 A573 L580 T581 L608 H612	Y287-W577 HydrophobicContact CD1-CB 3.86Å; Y287-W577 AromaticContact CD1-CD2 3.86Å; Y287-W577 HydrophobicContact CD1-CD2 3.86Å; Y287-W577 AromaticContact CD1-CE3 3.93Å; Y287-W577 HydrophobicContact CD1-CE3 3.93Å; Y287-W577 AromaticContact CD1-CG 3.81Å; Y287-W577 HydrophobicContact CD1-CG 3.81Å; Y287-W577 AromaticContact CE1-CD2 3.7Å; Y287-W577 HydrophobicContact CE1-CD2 3.7Å; Y287-W577 AromaticContact CE1-CE3 3.41Å; Y287-W577 HydrophobicContact CE1-CE3 3.41Å; Y287-W577 VanDerWaalsContact CE1-CE3 3.41Å; Y287-W577 HydrophobicContact CE1-CG 4.18Å; Y287-W577 AromaticContact CE1-CZ3 3.96Å; Y287-W577 HydrophobicContact CE1-CZ3 3.96Å; D505-W577 HydrophobicContact CB-CZ2 3.81Å; D505-W577 PolarHBondContact O-NE1 3.11Å; A523-W577 HydrophobicContact CB-CB 4.07Å; G524-W577 VanDerWaalsContact CA-CD1 3.46Å; K525-W577 VanDerWaalsContact CE-CH2 3.49Å; A573-W577 WeakPolarHBondContact O-CB 3.33Å; A573-W577 PolarHBondContact O-N 3.39Å; W577-L580 PolarHBondContact O-N 2.61Å; W577-T581 HydrophobicContact CZ2-CG2 4.5Å; W577-T581 PolarHBondContact NE1-OG1 3.31Å; W577-T581 VanDerWaalsContact O-CB 3.24Å; W577-T581 WeakPolarHBondContact O-CB 3.45Å; W577-T581 PolarHBondContact O-N 2.71Å; W577-T581 PolarHBondContact O-OG1 3.36Å; W577-L608 HydrophobicContact CH2-CD2 3.7Å; W577-L608 HydrophobicContact CZ3-CD2 4.14Å; W577-H612 AromaticContact CZ3-NE2 3.81Å
578	A	96.7	Very high	91.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67.3	-40.9	-179.7	0	0	0	0	0	112.1	K574 Q575 M576 T581 I582 H612 F614	K574-A578 PolarHBondContact O-N 2.96Å; Q575-A578 PolarHBondContact O-N 3.06Å; M576-A578 PolarHBondContact O-N 3.17Å; A578-T581 PolarHBondContact O-N 2.7Å; A578-I582 VanDerWaalsContact O-CB 3.29Å; A578-I582 WeakPolarHBondContact O-CB 3.36Å; A578-I582 WeakPolarHBondContact O-CD1 3.49Å; A578-I582 VanDerWaalsContact O-CG1 3.24Å; A578-I582 WeakPolarHBondContact O-CG1 3.43Å; A578-I582 PolarHBondContact O-N 2.87Å; A578-H612 HydrophobicContact CB-CB 4.26Å; A578-H612 WeakPolarHBondContact CB-CE1 3.09Å; A578-H612 VanDerWaalsContact CB-ND1 3.28Å; A578-H612 WeakPolarHBondContact CB-ND1 3.23Å; A578-F614 HydrophobicContact CB-CE2 4.06Å
579	Y	95.6	Very high	91.9	Very high	8 Å²	8	37.3 Å²	37.3	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-56.2	-54.3	173.2	175.9	-87.9	0	0	0	111.4	R106 F108 M179 Q575 M576 I582 K583	R106-Y579 VanDerWaalsContact O-CE2 3.22Å; R106-Y579 WeakPolarHBondContact O-CE2 3.44Å; R106-Y579 PolarHBondContact O-OH 3.28Å; F108-Y579 AromaticContact CD2-CD2 3.59Å; F108-Y579 HydrophobicContact CD2-CD2 3.59Å; F108-Y579 HydrophobicContact CD2-CE2 4.03Å; F108-Y579 AromaticContact CE2-CD2 3.69Å; F108-Y579 HydrophobicContact CE2-CD2 3.69Å; F108-Y579 HydrophobicContact CE2-CE2 4.07Å; F108-Y579 HydrophobicContact CE2-CG 4.43Å; F108-Y579 HydrophobicContact CG-CD2 4.5Å; M179-Y579 HydrophobicContact CB-CD1 3.8Å; M179-Y579 HydrophobicContact CB-CE1 3.52Å; Q575-Y579 VanDerWaalsContact O-CB 3.24Å; Q575-Y579 WeakPolarHBondContact O-CB 3.26Å; Q575-Y579 PolarHBondContact O-N 3.07Å; M576-Y579 PolarHBondContact O-N 2.73Å; Y579-I582 PolarHBondContact O-N 3.19Å; Y579-K583 HydrophobicContact CD1-CG 4.37Å; Y579-K583 HydrophobicContact CE1-CG 4.12Å; Y579-K583 VanDerWaalsContact O-CG 3.27Å; Y579-K583 WeakPolarHBondContact O-CG 3.44Å; Y579-K583 PolarHBondContact O-N 2.77Å; Y579-K583 VanDerWaalsContact OH-CE 3.29Å; Y579-K583 WeakPolarHBondContact OH-CE 3.14Å
580	L	95.7	Very high	91.9	Very high	29 Å²	29	36.9 Å²	36.9	15%	0.152	18%	0.178	C	C	.	.	H	α-helix	trans	-61.3	-47	179.3	-75	170	0	0	0	111.7	M179 T507 V521 A523 M576 W577 I582 K583 Q584	M179-L580 HydrophobicContact CE-CD2 4.23Å; M179-L580 HydrophobicContact SD-CD1 4.17Å; M179-L580 HydrophobicContact SD-CD2 3.73Å; M179-L580 HydrophobicContact SD-CG 4.04Å; T507-L580 HydrophobicContact CG2-CB 3.86Å; V521-L580 HydrophobicContact CB-CD1 4.41Å; V521-L580 HydrophobicContact CG1-CD1 3.83Å; A523-L580 HydrophobicContact CB-CD1 3.9Å; M576-L580 HydrophobicContact CG-CD1 4.04Å; M576-L580 HydrophobicContact CG-CG 4.42Å; M576-L580 WeakPolarHBondContact O-CB 3.4Å; M576-L580 WeakPolarHBondContact O-CG 3.37Å; M576-L580 PolarHBondContact O-N 3.18Å; W577-L580 PolarHBondContact O-N 2.61Å; L580-I582 PolarHBondContact O-N 2.89Å; L580-K583 PolarHBondContact O-N 2.92Å; L580-Q584 WeakPolarHBondContact O-CB 3.41Å; L580-Q584 PolarHBondContact O-N 3.47Å
581	T	96.9	Very high	92	Very high	21 Å²	21	36.8 Å²	36.8	13%	0.129	18%	0.175	C	C	.	.	H	α-helix	trans	-59.9	-43.7	178.3	-59.7	0	0	0	0	111.5	W577 A578 Q584 L585 L608	W577-T581 HydrophobicContact CZ2-CG2 4.5Å; W577-T581 PolarHBondContact NE1-OG1 3.31Å; W577-T581 VanDerWaalsContact O-CB 3.24Å; W577-T581 WeakPolarHBondContact O-CB 3.45Å; W577-T581 PolarHBondContact O-N 2.71Å; W577-T581 PolarHBondContact O-OG1 3.36Å; A578-T581 PolarHBondContact O-N 2.7Å; T581-Q584 PolarHBondContact O-N 3.08Å; T581-L585 HydrophobicContact CG2-CD1 3.93Å; T581-L585 HydrophobicContact CG2-CG 4.41Å; T581-L585 WeakPolarHBondContact O-CB 3.47Å; T581-L585 VanDerWaalsContact O-CG 3.26Å; T581-L585 WeakPolarHBondContact O-CG 3.35Å; T581-L585 PolarHBondContact O-N 3.5Å; T581-L608 HydrophobicContact CG2-CD1 3.67Å
582	I	95.1	Very high	91.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-45.6	176.3	-75	166.2	0	0	0	111.2	F108 A578 Y579 L580 Q584 L585 I586 I605 L608 A609 F614 T616	F108-I582 HydrophobicContact CE2-CB 4.4Å; F108-I582 HydrophobicContact CE2-CG2 3.86Å; F108-I582 HydrophobicContact CZ-CG2 3.75Å; A578-I582 VanDerWaalsContact O-CB 3.29Å; A578-I582 WeakPolarHBondContact O-CB 3.36Å; A578-I582 WeakPolarHBondContact O-CD1 3.49Å; A578-I582 VanDerWaalsContact O-CG1 3.24Å; A578-I582 WeakPolarHBondContact O-CG1 3.43Å; A578-I582 PolarHBondContact O-N 2.87Å; Y579-I582 PolarHBondContact O-N 3.19Å; L580-I582 PolarHBondContact O-N 2.89Å; I582-Q584 VanDerWaalsContact C-N 3.35Å; I582-Q584 PolarHBondContact O-N 3.18Å; I582-L585 PolarHBondContact O-N 3.36Å; I582-I586 HydrophobicContact CG2-CD1 3.73Å; I582-I586 HydrophobicContact CG2-CG1 4.49Å; I582-I586 WeakPolarHBondContact O-CB 3Å; I582-I586 WeakPolarHBondContact O-CG1 3.26Å; I582-I586 PolarHBondContact O-N 2.97Å; I582-I605 HydrophobicContact CG2-CG2 4.23Å; I582-L608 HydrophobicContact CD1-CB 4.04Å; I582-L608 HydrophobicContact CG1-CB 3.98Å; I582-L608 HydrophobicContact CG1-CD1 4.5Å; I582-A609 HydrophobicContact CD1-CB 4.2Å; I582-F614 HydrophobicContact CD1-CD2 3.78Å; I582-T616 HydrophobicContact CG2-CG2 3.97Å
583	K	91.5	Very high	91.2	Very high	62 Å²	62	43.7 Å²	43.7	27%	0.27	22%	0.215	S	C	.	.	H	α-helix	trans	-62.2	-41.7	176.9	-63.7	-74.3	-170.3	-173	0	111.3	R106 F108 Y579 L580 I586 R587	R106-K583 WeakPolarHBondContact O-CE 3.3Å; R106-K583 PolarHBondContact O-NZ 3.21Å; F108-K583 HydrophobicContact CE2-CD 4.49Å; F108-K583 HydrophobicContact CZ-CD 3.83Å; F108-K583 VanDerWaalsContact CZ-CE 3.45Å; F108-K583 HydrophobicContact CZ-CG 4.35Å; Y579-K583 HydrophobicContact CD1-CG 4.37Å; Y579-K583 HydrophobicContact CE1-CG 4.12Å; Y579-K583 VanDerWaalsContact O-CG 3.27Å; Y579-K583 WeakPolarHBondContact O-CG 3.44Å; Y579-K583 PolarHBondContact O-N 2.77Å; Y579-K583 VanDerWaalsContact OH-CE 3.29Å; Y579-K583 WeakPolarHBondContact OH-CE 3.14Å; L580-K583 PolarHBondContact O-N 2.92Å; K583-I586 PolarHBondContact O-N 2.93Å; K583-R587 PolarHBondContact O-N 3.22Å
584	Q	92.7	Very high	90.8	Very high	74 Å²	74	47.6 Å²	47.6	35%	0.346	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-45.9	176.7	-179.5	175.5	-22.6	0	0	112.3	L580 T581 I582 I586 R587 E588	L580-Q584 WeakPolarHBondContact O-CB 3.41Å; L580-Q584 PolarHBondContact O-N 3.47Å; T581-Q584 PolarHBondContact O-N 3.08Å; I582-Q584 VanDerWaalsContact C-N 3.35Å; I582-Q584 PolarHBondContact O-N 3.18Å; Q584-I586 VanDerWaalsContact C-N 3.34Å; Q584-I586 PolarHBondContact O-N 3.29Å; Q584-R587 WeakPolarHBondContact O-CB 3.48Å; Q584-R587 PolarHBondContact O-N 2.92Å; Q584-E588 PolarHBondContact O-N 3.08Å
585	L	94	Very high	90.5	Very high	21 Å²	21	49.6 Å²	49.6	11%	0.11	26%	0.258	C	S	.	.	H	α-helix	trans	-65.8	-35.3	176.1	-70.2	169.4	0	0	0	112	T581 I582 E588 R589 I601 Q604 I605 L608	T581-L585 HydrophobicContact CG2-CD1 3.93Å; T581-L585 HydrophobicContact CG2-CG 4.41Å; T581-L585 WeakPolarHBondContact O-CB 3.47Å; T581-L585 VanDerWaalsContact O-CG 3.26Å; T581-L585 WeakPolarHBondContact O-CG 3.35Å; T581-L585 PolarHBondContact O-N 3.5Å; I582-L585 PolarHBondContact O-N 3.36Å; L585-E588 PolarHBondContact O-N 3.29Å; L585-R589 WeakPolarHBondContact O-CB 3.48Å; L585-R589 PolarHBondContact O-N 3.29Å; L585-I601 HydrophobicContact CB-CG2 4.05Å; L585-I601 HydrophobicContact CD2-CG2 4.1Å; L585-I601 VanDerWaalsContact O-CG2 3.31Å; L585-I601 WeakPolarHBondContact O-CG2 3.42Å; L585-Q604 HydrophobicContact CD1-CB 4.28Å; L585-I605 HydrophobicContact CB-CD1 3.97Å; L585-I605 HydrophobicContact CB-CG1 3.47Å; L585-I605 VanDerWaalsContact CB-CG1 3.47Å; L585-I605 HydrophobicContact CD1-CG1 4.16Å; L585-I605 HydrophobicContact CG-CG1 4.46Å; L585-L608 HydrophobicContact CD1-CD1 3.86Å
586	I	90	Very high	90.3	Very high	48 Å²	48	50.7 Å²	50.7	25%	0.246	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-42.5	172.8	-72.7	166.7	0	0	0	110.6	I582 K583 Q584 R589 S590 I605	I582-I586 HydrophobicContact CG2-CD1 3.73Å; I582-I586 HydrophobicContact CG2-CG1 4.49Å; I582-I586 WeakPolarHBondContact O-CB 3Å; I582-I586 WeakPolarHBondContact O-CG1 3.26Å; I582-I586 PolarHBondContact O-N 2.97Å; K583-I586 PolarHBondContact O-N 2.93Å; Q584-I586 VanDerWaalsContact C-N 3.34Å; Q584-I586 PolarHBondContact O-N 3.29Å; I586-R589 PolarHBondContact O-N 2.87Å; I586-S590 PolarHBondContact O-N 2.76Å; I586-I605 HydrophobicContact CG1-CD1 3.91Å; I586-I605 HydrophobicContact CG1-CG1 4.47Å; I586-I605 HydrophobicContact CG1-CG2 4.32Å
587	R	86.3	Confident	90	Very high	112 Å²	112	57.1 Å²	57.1	42%	0.423	31%	0.305	S	S	.	.	H	α-helix	trans	-62	-49.7	173.1	-174.7	-175	-71.7	158	-1.5	111.3	M460 K583 Q584 R589 S590 L591	M460-R587 HydrophobicContact SD-CG 3.9Å; M460-R587 PolarHBondContact SD-NE 2.89Å; K583-R587 PolarHBondContact O-N 3.22Å; Q584-R587 WeakPolarHBondContact O-CB 3.48Å; Q584-R587 PolarHBondContact O-N 2.92Å; R587-R589 VanDerWaalsContact C-N 3.28Å; R587-R589 PolarHBondContact O-N 3.08Å; R587-S590 PolarHBondContact O-N 2.81Å; R587-S590 VanDerWaalsContact O-N 3.11Å; R587-S590 PolarHBondContact O-OG 3.3Å; R587-L591 PolarHBondContact O-N 2.82Å
588	E	88.7	Confident	89.7	Confident	88 Å²	88	60.2 Å²	60.2	41%	0.411	32%	0.319	S	S	.	.	H	α-helix	trans	-57.6	-42.6	177.1	-164.8	-164.1	157.7	0	0	111.5	Q584 L585 S590 L591 V592 I601	Q584-E588 PolarHBondContact O-N 3.08Å; L585-E588 PolarHBondContact O-N 3.29Å; E588-S590 VanDerWaalsContact C-N 3.27Å; E588-S590 PolarHBondContact O-N 3.49Å; E588-L591 PolarHBondContact O-N 2.88Å; E588-V592 HydrophobicContact CG-CG2 4.11Å; E588-V592 VanDerWaalsContact O-CG2 3.3Å; E588-V592 WeakPolarHBondContact O-CG2 3.26Å; E588-V592 PolarHBondContact O-N 2.87Å; E588-I601 HydrophobicContact CB-CD1 4.45Å; E588-I601 HydrophobicContact CG-CD1 3.95Å; E588-I601 WeakPolarHBondContact OE1-CD1 3.5Å
589	R	89.1	Confident	89.5	Confident	76 Å²	76	69.9 Å²	69.9	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-26.9	178.5	-172.4	-175.8	166.2	-80.5	1.6	113.8	L585 I586 R587 K598 I601 T602 I605	L585-R589 WeakPolarHBondContact O-CB 3.48Å; L585-R589 PolarHBondContact O-N 3.29Å; I586-R589 PolarHBondContact O-N 2.87Å; R587-R589 VanDerWaalsContact C-N 3.28Å; R587-R589 PolarHBondContact O-N 3.08Å; R589-K598 HydrophobicContact CG-CG 3.99Å; R589-K598 VanDerWaalsContact O-CE 3.29Å; R589-K598 WeakPolarHBondContact O-CE 3.35Å; R589-K598 PolarHBondContact O-NZ 2.78Å; R589-I601 HydrophobicContact CB-CG2 3.83Å; R589-I601 HydrophobicContact CG-CG2 4.47Å; R589-T602 WeakPolarHBondContact CD-OG1 3.29Å; R589-T602 PolarHBondContact NE-OG1 3.23Å; R589-I605 HydrophobicContact CB-CD1 4.38Å
590	S	83.1	Confident	89.4	Confident	52 Å²	52	76.2 Å²	76.2	36%	0.364	38%	0.383	S	S	.	.	H	α-helix	trans	-75.6	-37.8	175.7	79.5	0	0	0	0	111.4	I586 R587 E588	I586-S590 PolarHBondContact O-N 2.76Å; R587-S590 PolarHBondContact O-N 2.81Å; R587-S590 VanDerWaalsContact O-N 3.11Å; R587-S590 PolarHBondContact O-OG 3.3Å; E588-S590 VanDerWaalsContact C-N 3.27Å; E588-S590 PolarHBondContact O-N 3.49Å
591	L	79.3	Confident	89.4	Confident	60 Å²	60	75 Å²	75	31%	0.314	38%	0.377	S	S	.	.	H	α-helix	trans	-79.6	-27.3	-179.4	-55.1	-173.2	0	0	0	113.8	E461 R587 E588 T593	E461-L591 HydrophobicContact CG-CD2 3.56Å; R587-L591 PolarHBondContact O-N 2.82Å; E588-L591 PolarHBondContact O-N 2.88Å; L591-T593 PolarHBondContact O-N 2.84Å
592	V	84.1	Confident	89.2	Confident	24 Å²	24	75.8 Å²	75.8	15%	0.145	38%	0.381	C	S	.	.			trans	-73	117.7	-177.9	166.4	0	0	0	0	112.4	E588 K597 K598 I601	E588-V592 HydrophobicContact CG-CG2 4.11Å; E588-V592 VanDerWaalsContact O-CG2 3.3Å; E588-V592 WeakPolarHBondContact O-CG2 3.26Å; E588-V592 PolarHBondContact O-N 2.87Å; V592-K597 HydrophobicContact CG1-CB 3.58Å; V592-K598 HydrophobicContact CG1-CB 4.12Å; V592-I601 HydrophobicContact CB-CD1 4.33Å; V592-I601 HydrophobicContact CG1-CD1 4.49Å; V592-I601 HydrophobicContact CG2-CD1 3.86Å
593	T	78.4	Confident	89.2	Confident	129 Å²	129	81.7 Å²	81.7	79%	0.791	41%	0.407	S	S	*	.			trans	-81.2	-30	176	55	0	0	0	0	113.6	L591 V595	L591-T593 PolarHBondContact O-N 2.84Å; T593-V595 PolarHBondContact O-N 3.04Å
594	T	87	Confident	89.4	Confident	81 Å²	81	82.1 Å²	82.1	50%	0.497	41%	0.41	S	S	.	.			trans	-79	119.5	-174.7	-42.8	0	0	0	0	112.1	G596 K597 K598	T594-G596 VanDerWaalsContact C-N 3.29Å; T594-G596 PolarHBondContact O-N 2.82Å; T594-K597 PolarHBondContact O-N 2.89Å; T594-K598 WeakPolarHBondContact O-CB 3.36Å; T594-K598 PolarHBondContact O-N 3Å
595	V	88.1	Confident	89.5	Confident	121 Å²	121	78.6 Å²	78.6	73%	0.733	39%	0.394	S	S	*	.	H	α-helix	trans	-52.8	-42.5	-178.7	-177	0	0	0	0	112.9	T593 K598 R599	T593-V595 PolarHBondContact O-N 3.04Å; V595-K598 PolarHBondContact O-N 3.47Å; V595-R599 WeakPolarHBondContact O-CB 3.39Å; V595-R599 PolarHBondContact O-N 3.09Å
596	G	91.3	Very high	89.5	Confident	54 Å²	54	78.4 Å²	78.4	56%	0.557	39%	0.393	S	S	*	.	H	α-helix	trans	-61.3	-50.9	178.9	0	0	0	0	0	113.6	T594 K598 R599 K600	T594-G596 VanDerWaalsContact C-N 3.29Å; T594-G596 PolarHBondContact O-N 2.82Å; G596-K598 PolarHBondContact O-N 3.3Å; G596-R599 PolarHBondContact O-N 3.12Å; G596-K600 PolarHBondContact O-N 3.34Å; G596-K600 VanDerWaalsContact O-N 3.08Å
597	K	89.9	Confident	89.8	Confident	135 Å²	135	80.5 Å²	80.5	59%	0.587	40%	0.402	S	S	*	.	H	α-helix	trans	-60.7	-45.2	174.1	-73.2	-168.8	175.3	-169.2	0	111	V592 T594 R599 K600 I601	V592-K597 HydrophobicContact CG1-CB 3.58Å; T594-K597 PolarHBondContact O-N 2.89Å; K597-R599 VanDerWaalsContact C-N 3.27Å; K597-R599 PolarHBondContact O-N 2.96Å; K597-K600 WeakPolarHBondContact O-CB 3.44Å; K597-K600 PolarHBondContact O-N 2.87Å; K597-K600 VanDerWaalsContact O-N 3.08Å; K597-I601 WeakPolarHBondContact O-CG1 3.24Å; K597-I601 PolarHBondContact O-N 3.07Å
598	K	90.8	Very high	90.2	Very high	70 Å²	70	76.5 Å²	76.5	30%	0.304	39%	0.389	S	S	.	.	H	α-helix	trans	-58.4	-37.5	178.2	-161.7	166.6	-169.4	140.3	0	112.2	R589 V592 T594 V595 G596 T602	R589-K598 HydrophobicContact CG-CG 3.99Å; R589-K598 VanDerWaalsContact O-CE 3.29Å; R589-K598 WeakPolarHBondContact O-CE 3.35Å; R589-K598 PolarHBondContact O-NZ 2.78Å; V592-K598 HydrophobicContact CG1-CB 4.12Å; T594-K598 WeakPolarHBondContact O-CB 3.36Å; T594-K598 PolarHBondContact O-N 3Å; V595-K598 PolarHBondContact O-N 3.47Å; G596-K598 PolarHBondContact O-N 3.3Å; K598-T602 VanDerWaalsContact O-CB 3.27Å; K598-T602 WeakPolarHBondContact O-CB 3.47Å; K598-T602 PolarHBondContact O-N 2.63Å; K598-T602 PolarHBondContact O-OG1 3.17Å
599	R	92.1	Very high	90.5	Very high	203 Å²	203	72.3 Å²	72.3	77%	0.766	37%	0.369	S	S	*	.	H	α-helix	trans	-68.6	-41.8	174	-170.3	176.3	-177.9	178.7	0.7	112.3	V595 G596 K597 T602 K603	V595-R599 WeakPolarHBondContact O-CB 3.39Å; V595-R599 PolarHBondContact O-N 3.09Å; G596-R599 PolarHBondContact O-N 3.12Å; K597-R599 VanDerWaalsContact C-N 3.27Å; K597-R599 PolarHBondContact O-N 2.96Å; R599-T602 PolarHBondContact O-N 3.01Å; R599-K603 PolarHBondContact O-N 3.37Å
600	K	94.4	Very high	90.7	Very high	140 Å²	140	72 Å²	72	61%	0.609	37%	0.373	S	S	*	.	H	α-helix	trans	-59	-52.2	174.9	-169.2	-166.8	172.6	-174.4	0	111.2	G596 K597 T602 K603 Q604	G596-K600 PolarHBondContact O-N 3.34Å; G596-K600 VanDerWaalsContact O-N 3.08Å; K597-K600 WeakPolarHBondContact O-CB 3.44Å; K597-K600 PolarHBondContact O-N 2.87Å; K597-K600 VanDerWaalsContact O-N 3.08Å; K600-T602 PolarHBondContact O-N 2.77Å; K600-K603 WeakPolarHBondContact O-CB 3.32Å; K600-K603 PolarHBondContact O-N 2.83Å; K600-K603 VanDerWaalsContact O-N 3.13Å; K600-Q604 PolarHBondContact O-N 2.86Å
601	I	93.9	Very high	91.3	Very high	5 Å²	5	75.9 Å²	75.9	3%	0.026	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-42.7	179.9	-59	158.9	0	0	0	110.8	L585 E588 R589 V592 K597 K603 Q604 I605	L585-I601 HydrophobicContact CB-CG2 4.05Å; L585-I601 HydrophobicContact CD2-CG2 4.1Å; L585-I601 VanDerWaalsContact O-CG2 3.31Å; L585-I601 WeakPolarHBondContact O-CG2 3.42Å; E588-I601 HydrophobicContact CB-CD1 4.45Å; E588-I601 HydrophobicContact CG-CD1 3.95Å; E588-I601 WeakPolarHBondContact OE1-CD1 3.5Å; R589-I601 HydrophobicContact CB-CG2 3.83Å; R589-I601 HydrophobicContact CG-CG2 4.47Å; V592-I601 HydrophobicContact CB-CD1 4.33Å; V592-I601 HydrophobicContact CG1-CD1 4.49Å; V592-I601 HydrophobicContact CG2-CD1 3.86Å; K597-I601 WeakPolarHBondContact O-CG1 3.24Å; K597-I601 PolarHBondContact O-N 3.07Å; I601-K603 VanDerWaalsContact C-N 3.29Å; I601-K603 PolarHBondContact O-N 3.31Å; I601-Q604 PolarHBondContact O-N 2.85Å; I601-I605 HydrophobicContact CG2-CD1 3.93Å; I601-I605 HydrophobicContact CG2-CG1 4.41Å; I601-I605 WeakPolarHBondContact O-CG1 3.35Å; I601-I605 PolarHBondContact O-N 3.43Å
602	T	93.8	Very high	92	Very high	36 Å²	36	73.4 Å²	73.4	22%	0.221	37%	0.372	C	S	.	.	H	α-helix	trans	-56.8	-42.5	174.6	-59.6	0	0	0	0	111.5	R589 K598 R599 K600 T606 L618	R589-T602 WeakPolarHBondContact CD-OG1 3.29Å; R589-T602 PolarHBondContact NE-OG1 3.23Å; K598-T602 VanDerWaalsContact O-CB 3.27Å; K598-T602 WeakPolarHBondContact O-CB 3.47Å; K598-T602 PolarHBondContact O-N 2.63Å; K598-T602 PolarHBondContact O-OG1 3.17Å; R599-T602 PolarHBondContact O-N 3.01Å; K600-T602 PolarHBondContact O-N 2.77Å; T602-T606 PolarHBondContact O-N 2.82Å; T602-T606 VanDerWaalsContact O-N 3.16Å; T602-T606 PolarHBondContact O-OG1 2.91Å; T602-L618 HydrophobicContact CG2-CD1 3.84Å; T602-L618 HydrophobicContact CG2-CD2 4.08Å
603	K	95	Very high	92.4	Very high	125 Å²	125	75 Å²	75	54%	0.543	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-49	176.2	-168.3	-168.5	177.6	-132.2	0	111.5	R599 K600 I601 I605 T606 E607	R599-K603 PolarHBondContact O-N 3.37Å; K600-K603 WeakPolarHBondContact O-CB 3.32Å; K600-K603 PolarHBondContact O-N 2.83Å; K600-K603 VanDerWaalsContact O-N 3.13Å; I601-K603 VanDerWaalsContact C-N 3.29Å; I601-K603 PolarHBondContact O-N 3.31Å; K603-I605 VanDerWaalsContact C-N 3.34Å; K603-I605 PolarHBondContact O-N 3.29Å; K603-T606 PolarHBondContact O-N 2.84Å; K603-T606 VanDerWaalsContact O-N 3.12Å; K603-E607 VanDerWaalsContact CE-CD 3.41Å; K603-E607 WeakPolarHBondContact CE-OE1 3.22Å; K603-E607 WeakPolarHBondContact CE-OE2 3.24Å; K603-E607 HydrophobicContact CG-CG 4.37Å; K603-E607 WeakPolarHBondContact CG-OE2 3.44Å; K603-E607 VanDerWaalsContact NZ-CD 3.32Å; K603-E607 IonicContact NZ-OE1 3.45Å; K603-E607 PolarHBondContact NZ-OE1 3.24Å; K603-E607 IonicContact NZ-OE2 2.77Å; K603-E607 PolarHBondContact NZ-OE2 3.11Å; K603-E607 WeakPolarHBondContact O-CG 3.35Å; K603-E607 PolarHBondContact O-N 3.18Å
604	Q	95.2	Very high	93.1	Very high	71 Å²	71	68.8 Å²	68.8	33%	0.332	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-40.7	-179.3	-68.5	174.6	-96.2	0	0	112.5	L585 K600 I601 E607 L608	L585-Q604 HydrophobicContact CD1-CB 4.28Å; K600-Q604 PolarHBondContact O-N 2.86Å; I601-Q604 PolarHBondContact O-N 2.85Å; Q604-E607 PolarHBondContact O-N 2.88Å; Q604-L608 WeakPolarHBondContact O-CG 3.36Å; Q604-L608 PolarHBondContact O-N 2.89Å; Q604-L608 VanDerWaalsContact O-N 3.07Å
605	I	94.7	Very high	93.3	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-47.2	174.2	-62.4	158.3	0	0	0	110.6	I582 L585 I586 R589 I601 K603 E607 L608 A609 L618	I582-I605 HydrophobicContact CG2-CG2 4.23Å; L585-I605 HydrophobicContact CB-CD1 3.97Å; L585-I605 HydrophobicContact CB-CG1 3.47Å; L585-I605 VanDerWaalsContact CB-CG1 3.47Å; L585-I605 HydrophobicContact CD1-CG1 4.16Å; L585-I605 HydrophobicContact CG-CG1 4.46Å; I586-I605 HydrophobicContact CG1-CD1 3.91Å; I586-I605 HydrophobicContact CG1-CG1 4.47Å; I586-I605 HydrophobicContact CG1-CG2 4.32Å; R589-I605 HydrophobicContact CB-CD1 4.38Å; I601-I605 HydrophobicContact CG2-CD1 3.93Å; I601-I605 HydrophobicContact CG2-CG1 4.41Å; I601-I605 WeakPolarHBondContact O-CG1 3.35Å; I601-I605 PolarHBondContact O-N 3.43Å; K603-I605 VanDerWaalsContact C-N 3.34Å; K603-I605 PolarHBondContact O-N 3.29Å; I605-E607 PolarHBondContact O-N 3.37Å; I605-L608 PolarHBondContact O-N 3.32Å; I605-A609 WeakPolarHBondContact O-CB 3.21Å; I605-A609 PolarHBondContact O-N 2.92Å; I605-L618 HydrophobicContact CB-CD1 3.82Å; I605-L618 HydrophobicContact CD1-CD1 3.87Å; I605-L618 HydrophobicContact CG1-CD1 4.48Å; I605-L618 HydrophobicContact CG2-CD1 3.78Å
606	T	94.3	Very high	93.3	Very high	16 Å²	16	59.4 Å²	59.4	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-42.2	179.8	-60.2	0	0	0	0	111.7	E127 T602 K603 A609 L610 T619	E127-T606 HydrophobicContact CB-CG2 4.28Å; E127-T606 HydrophobicContact CG-CG2 4.17Å; T602-T606 PolarHBondContact O-N 2.82Å; T602-T606 VanDerWaalsContact O-N 3.16Å; T602-T606 PolarHBondContact O-OG1 2.91Å; K603-T606 PolarHBondContact O-N 2.84Å; K603-T606 VanDerWaalsContact O-N 3.12Å; T606-A609 PolarHBondContact O-N 3.47Å; T606-L610 HydrophobicContact CG2-CD1 3.84Å; T606-L610 HydrophobicContact CG2-CG 4.34Å; T606-L610 WeakPolarHBondContact O-CB 3.47Å; T606-L610 WeakPolarHBondContact O-CG 3.14Å; T606-L610 PolarHBondContact O-N 3.24Å; T606-T619 HydrophobicContact CG2-CG2 4.44Å
607	E	96.1	Very high	92.9	Very high	93 Å²	93	60.4 Å²	60.4	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-48.2	178	-73.3	174.6	134.5	0	0	111.8	K603 Q604 I605 L610 Q611	K603-E607 VanDerWaalsContact CE-CD 3.41Å; K603-E607 WeakPolarHBondContact CE-OE1 3.22Å; K603-E607 WeakPolarHBondContact CE-OE2 3.24Å; K603-E607 HydrophobicContact CG-CG 4.37Å; K603-E607 WeakPolarHBondContact CG-OE2 3.44Å; K603-E607 VanDerWaalsContact NZ-CD 3.32Å; K603-E607 IonicContact NZ-OE1 3.45Å; K603-E607 PolarHBondContact NZ-OE1 3.24Å; K603-E607 IonicContact NZ-OE2 2.77Å; K603-E607 PolarHBondContact NZ-OE2 3.11Å; K603-E607 WeakPolarHBondContact O-CG 3.35Å; K603-E607 PolarHBondContact O-N 3.18Å; Q604-E607 PolarHBondContact O-N 2.88Å; I605-E607 PolarHBondContact O-N 3.37Å; E607-L610 PolarHBondContact O-N 2.56Å; E607-Q611 WeakPolarHBondContact O-CB 3.29Å; E607-Q611 PolarHBondContact O-N 2.9Å
608	L	95.6	Very high	92.8	Very high	27 Å²	27	55.3 Å²	55.3	14%	0.141	27%	0.265	C	S	.	.	H	α-helix	trans	-65.3	-42.4	176.3	-69.3	171.4	0	0	0	112.6	W577 T581 I582 L585 Q604 I605 L610 Q611 H612	W577-L608 HydrophobicContact CH2-CD2 3.7Å; W577-L608 HydrophobicContact CZ3-CD2 4.14Å; T581-L608 HydrophobicContact CG2-CD1 3.67Å; I582-L608 HydrophobicContact CD1-CB 4.04Å; I582-L608 HydrophobicContact CG1-CB 3.98Å; I582-L608 HydrophobicContact CG1-CD1 4.5Å; L585-L608 HydrophobicContact CD1-CD1 3.86Å; Q604-L608 WeakPolarHBondContact O-CG 3.36Å; Q604-L608 PolarHBondContact O-N 2.89Å; Q604-L608 VanDerWaalsContact O-N 3.07Å; I605-L608 PolarHBondContact O-N 3.32Å; L608-L610 VanDerWaalsContact C-N 3.3Å; L608-L610 PolarHBondContact O-N 3.44Å; L608-Q611 PolarHBondContact O-N 3.5Å; L608-H612 PolarHBondContact O-CD2 2.88Å; L608-H612 PolarHBondContact O-N 2.81Å
609	A	94.3	Very high	92.7	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.4	-32.8	179.7	0	0	0	0	0	112.5	I582 I605 T606 S613 F614 T616 T619	I582-A609 HydrophobicContact CD1-CB 4.2Å; I605-A609 WeakPolarHBondContact O-CB 3.21Å; I605-A609 PolarHBondContact O-N 2.92Å; T606-A609 PolarHBondContact O-N 3.47Å; A609-S613 CarbonylContact O-C 3.55Å; A609-S613 WeakPolarHBondContact O-CA 3.49Å; A609-S613 PolarHBondContact O-N 2.87Å; A609-S613 VanDerWaalsContact O-N 3.15Å; A609-F614 PolarHBondContact O-N 3.12Å; A609-T616 HydrophobicContact CB-CG2 3.71Å; A609-T619 HydrophobicContact CB-CG2 3.76Å
610	L	94.3	Very high	92.4	Very high	69 Å²	69	42.3 Å²	42.3	36%	0.361	21%	0.214	S	C	.	.	H	α-helix	trans	-73	-44.2	171.8	-69.2	170.3	0	0	0	111.7	V125 T606 E607 L608 H612 S613 T619	V125-L610 HydrophobicContact CG1-CD2 4.31Å; V125-L610 VanDerWaalsContact O-CD2 3.27Å; V125-L610 WeakPolarHBondContact O-CD2 3.46Å; T606-L610 HydrophobicContact CG2-CD1 3.84Å; T606-L610 HydrophobicContact CG2-CG 4.34Å; T606-L610 WeakPolarHBondContact O-CB 3.47Å; T606-L610 WeakPolarHBondContact O-CG 3.14Å; T606-L610 PolarHBondContact O-N 3.24Å; E607-L610 PolarHBondContact O-N 2.56Å; L608-L610 VanDerWaalsContact C-N 3.3Å; L608-L610 PolarHBondContact O-N 3.44Å; L610-H612 VanDerWaalsContact C-N 3.26Å; L610-H612 PolarHBondContact O-N 3.2Å; L610-S613 PolarHBondContact O-N 3.28Å; L610-T619 HydrophobicContact CD2-CG2 4.24Å; L610-T619 HydrophobicContact CG-CG2 4.3Å
611	Q	95.3	Very high	92	Very high	134 Å²	134	35.7 Å²	35.7	63%	0.626	19%	0.185	S	C	*	.	H	α-helix	trans	-62	-32.2	179.8	-179.9	177.9	9.9	0	0	113.2	E607 L608	E607-Q611 WeakPolarHBondContact O-CB 3.29Å; E607-Q611 PolarHBondContact O-N 2.9Å; L608-Q611 PolarHBondContact O-N 3.5Å
612	H	93.5	Very high	91.6	Very high	8 Å²	8	35.5 Å²	35.5	4%	0.037	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	6.4	-179	-71.4	-103.8	0	0	0	113.8	Q575 W577 A578 L608 L610 F614	Q575-H612 PolarHBondContact OE1-ND1 2.85Å; W577-H612 AromaticContact CZ3-NE2 3.81Å; A578-H612 HydrophobicContact CB-CB 4.26Å; A578-H612 WeakPolarHBondContact CB-CE1 3.09Å; A578-H612 VanDerWaalsContact CB-ND1 3.28Å; A578-H612 WeakPolarHBondContact CB-ND1 3.23Å; L608-H612 PolarHBondContact O-CD2 2.88Å; L608-H612 PolarHBondContact O-N 2.81Å; L610-H612 VanDerWaalsContact C-N 3.26Å; L610-H612 PolarHBondContact O-N 3.2Å; H612-F614 VanDerWaalsContact C-N 3.29Å; H612-F614 HydrophobicContact CB-CD2 3.65Å; H612-F614 HydrophobicContact CB-CE2 3.7Å; H612-F614 HydrophobicContact CB-CG 4.44Å; H612-F614 PolarHBondContact O-N 2.92Å
613	S	93.6	Very high	91.1	Very high	57 Å²	57	33.8 Å²	33.8	40%	0.399	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	36.2	-177.2	-59.6	0	0	0	0	114.7	S110 V125 A609 L610	S110-S613 WeakPolarHBondContact CA-O 3.15Å; V125-S613 WeakPolarHBondContact CG2-O 3.22Å; A609-S613 CarbonylContact O-C 3.55Å; A609-S613 WeakPolarHBondContact O-CA 3.49Å; A609-S613 PolarHBondContact O-N 2.87Å; A609-S613 VanDerWaalsContact O-N 3.15Å; L610-S613 PolarHBondContact O-N 3.28Å
614	F	92.4	Very high	90.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.			trans	-90.9	128.7	177.6	-70.2	-47.6	0	0	0	112.8	F108 V125 Q177 Q575 A578 I582 A609 H612 T616 T619	F108-F614 HydrophobicContact CB-CB 4.05Å; F108-F614 HydrophobicContact CB-CD1 3.47Å; F108-F614 VanDerWaalsContact CB-CD1 3.47Å; F108-F614 HydrophobicContact CB-CE1 4.18Å; F108-F614 HydrophobicContact CB-CG 3.99Å; F108-F614 HydrophobicContact CD2-CB 3.95Å; F108-F614 AromaticContact CD2-CD1 3.84Å; F108-F614 HydrophobicContact CD2-CD1 3.84Å; F108-F614 HydrophobicContact CD2-CD2 4.08Å; F108-F614 HydrophobicContact CD2-CE1 4.32Å; F108-F614 AromaticContact CD2-CG 3.71Å; F108-F614 HydrophobicContact CD2-CG 3.71Å; F108-F614 HydrophobicContact CG-CB 4.14Å; F108-F614 HydrophobicContact CG-CD1 4.11Å; F108-F614 HydrophobicContact CG-CG 4.2Å; V125-F614 WeakPolarHBondContact CG1-O 3.07Å; Q177-F614 HydrophobicContact CB-CE1 4.23Å; Q575-F614 HydrophobicContact CB-CZ 4.4Å; A578-F614 HydrophobicContact CB-CE2 4.06Å; I582-F614 HydrophobicContact CD1-CD2 3.78Å; A609-F614 PolarHBondContact O-N 3.12Å; H612-F614 VanDerWaalsContact C-N 3.29Å; H612-F614 HydrophobicContact CB-CD2 3.65Å; H612-F614 HydrophobicContact CB-CE2 3.7Å; H612-F614 HydrophobicContact CB-CG 4.44Å; H612-F614 PolarHBondContact O-N 2.92Å; F614-T616 HydrophobicContact CB-CG2 4.19Å; F614-T616 PolarHBondContact O-N 2.74Å; F614-T619 PolarHBondContact O-OG1 3.46Å
615	V	90	Very high	89.8	Confident	2 Å²	2	26 Å²	26	1%	0.012	14%	0.14	C	C	.	.			trans	-80.8	111.9	168.9	-173.9	0	0	0	0	110.2	F108 I109 V125 L621	F108-V615 WeakPolarHBondContact CD1-O 3.4Å; I109-V615 HydrophobicContact CB-CB 4.12Å; I109-V615 HydrophobicContact CB-CG2 3.97Å; I109-V615 HydrophobicContact CG2-CG2 4.23Å; I109-V615 WeakPolarHBondContact O-CG2 3.1Å; I109-V615 PolarHBondContact O-N 2.77Å; V125-V615 HydrophobicContact CG2-CG2 3.8Å; V615-L621 HydrophobicContact CG2-CB 3.86Å; V615-L621 HydrophobicContact CG2-CD1 4.24Å; V615-L621 HydrophobicContact CG2-CG 4.49Å
616	T	88.7	Confident	89	Confident	3 Å²	3	33 Å²	33	2%	0.018	17%	0.173	C	C	.	.			trans	-117.4	-173.9	-174.6	69.3	0	0	0	0	111	F108 I582 A609 F614 L618 T619 S636	F108-T616 HydrophobicContact CE1-CG2 4.28Å; F108-T616 HydrophobicContact CZ-CG2 4.33Å; I582-T616 HydrophobicContact CG2-CG2 3.97Å; A609-T616 HydrophobicContact CB-CG2 3.71Å; F614-T616 HydrophobicContact CB-CG2 4.19Å; F614-T616 PolarHBondContact O-N 2.74Å; T616-L618 PolarHBondContact O-N 3.42Å; T616-L618 PolarHBondContact OG1-N 2.98Å; T616-L618 VanDerWaalsContact OG1-N 3.11Å; T616-T619 PolarHBondContact N-OG1 3.05Å; T616-T619 PolarHBondContact OG1-N 2.81Å; T616-T619 VanDerWaalsContact OG1-N 3.16Å; T616-T619 PolarHBondContact OG1-OG1 3.3Å; T616-S636 PolarHBondContact O-OG 3.43Å
617	P	84.3	Confident	88	Confident	75 Å²	75	38.9 Å²	38.9	49%	0.487	20%	0.203	S	C	.	.	S	Bend	trans	-64.8	-14.1	166.8	-26	37.4	0	0	0	115	K128	K128-P617 WeakPolarHBondContact CD-O 3.34Å
618	L	86.6	Confident	86.5	Confident	28 Å²	28	36.7 Å²	36.7	15%	0.147	20%	0.202	C	C	.	.	S	Bend	trans	-112.4	-13.9	-175.4	-62.6	176.4	0	0	0	114.2	K128 T602 I605 T616	K128-L618 WeakPolarHBondContact CB-O 3.49Å; K128-L618 PolarHBondContact N-O 3.37Å; T602-L618 HydrophobicContact CG2-CD1 3.84Å; T602-L618 HydrophobicContact CG2-CD2 4.08Å; I605-L618 HydrophobicContact CB-CD1 3.82Å; I605-L618 HydrophobicContact CD1-CD1 3.87Å; I605-L618 HydrophobicContact CG1-CD1 4.48Å; I605-L618 HydrophobicContact CG2-CD1 3.78Å; T616-L618 PolarHBondContact O-N 3.42Å; T616-L618 PolarHBondContact OG1-N 2.98Å; T616-L618 VanDerWaalsContact OG1-N 3.11Å
619	T	89.3	Confident	85	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	162.6	173.3	47.1	0	0	0	0	110.4	V125 K126 T606 A609 L610 F614 T616	V125-T619 HydrophobicContact CG1-CG2 4.03Å; K126-T619 CarbonylContact O-C 3.6Å; K126-T619 WeakPolarHBondContact O-CA 3.41Å; K126-T619 WeakPolarHBondContact O-CB 3.35Å; T606-T619 HydrophobicContact CG2-CG2 4.44Å; A609-T619 HydrophobicContact CB-CG2 3.76Å; L610-T619 HydrophobicContact CD2-CG2 4.24Å; L610-T619 HydrophobicContact CG-CG2 4.3Å; F614-T619 PolarHBondContact O-OG1 3.46Å; T616-T619 PolarHBondContact N-OG1 3.05Å; T616-T619 PolarHBondContact OG1-N 2.81Å; T616-T619 VanDerWaalsContact OG1-N 3.16Å; T616-T619 PolarHBondContact OG1-OG1 3.3Å
620	A	86.3	Confident	83.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	155.5	173.7	0	0	0	0	0	109.9	K126 K128 A131 L633 D635	K126-A620 PolarHBondContact N-O 2.87Å; K126-A620 PolarHBondContact O-N 3.04Å; K128-A620 HydrophobicContact CB-CB 4.4Å; K128-A620 HydrophobicContact CG-CB 4.41Å; A131-A620 HydrophobicContact CB-CB 3.93Å; A620-L633 HydrophobicContact CB-CD1 3.91Å; A620-D635 HydrophobicContact CB-CB 4.31Å
621	L	85.7	Confident	82.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	111.1	178.7	-165.6	66.2	0	0	0	108.8	I109 F112 V125 V615 V623 A634	I109-L621 HydrophobicContact CG2-CD2 4.01Å; F112-L621 HydrophobicContact CB-CD2 3.57Å; V125-L621 HydrophobicContact CG2-CD1 3.68Å; V615-L621 HydrophobicContact CG2-CB 3.86Å; V615-L621 HydrophobicContact CG2-CD1 4.24Å; V615-L621 HydrophobicContact CG2-CG 4.49Å; L621-V623 HydrophobicContact CG-CG2 4.46Å; L621-A634 HydrophobicContact CB-CB 4.17Å; L621-A634 PolarHBondContact N-O 2.83Å; L621-A634 PolarHBondContact O-N 3.36Å
622	L	83.9	Confident	81.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	115.8	171.6	-170.1	75.4	0	0	0	108.1	S124 K126 A131 L134 E624 L633	S124-L622 PolarHBondContact N-O 3.21Å; S124-L622 PolarHBondContact O-N 3.08Å; S124-L622 PolarHBondContact OG-O 2.81Å; K126-L622 HydrophobicContact CD-CB 4.21Å; K126-L622 HydrophobicContact CD-CD2 3.92Å; K126-L622 HydrophobicContact CG-CB 4.48Å; A131-L622 HydrophobicContact CB-CB 4.42Å; L134-L622 HydrophobicContact CB-CD2 3.78Å; L134-L622 HydrophobicContact CD1-CD2 3.64Å; L134-L622 HydrophobicContact CG-CD2 4.37Å; L622-E624 HydrophobicContact CD2-CG 3.99Å; L622-E624 WeakPolarHBondContact CD2-OE2 3.39Å; L622-E624 HydrophobicContact CG-CG 4Å; L622-L633 HydrophobicContact CD1-CB 4.46Å; L622-L633 HydrophobicContact CD1-CD1 4.22Å
623	V	83.3	Confident	79.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	125	177.8	-171.3	0	0	0	0	107.4	F112 F121 V122 I147 L621 R631 L632	F112-V623 HydrophobicContact CD1-CG1 4.34Å; F112-V623 HydrophobicContact CD1-CG2 3.84Å; F112-V623 HydrophobicContact CE1-CG2 4.47Å; F121-V623 HydrophobicContact CB-CG1 3.8Å; V122-V623 WeakPolarHBondContact O-CA 3.41Å; I147-V623 HydrophobicContact CD1-CG2 3.8Å; L621-V623 HydrophobicContact CG-CG2 4.46Å; V623-R631 CarbonylContact O-C 3.49Å; V623-R631 WeakPolarHBondContact O-CA 3.33Å; V623-L632 HydrophobicContact CB-CB 4.01Å; V623-L632 HydrophobicContact CB-CD1 4.49Å; V623-L632 HydrophobicContact CB-CG 4.4Å; V623-L632 HydrophobicContact CG1-CD1 4.42Å; V623-L632 HydrophobicContact CG2-CB 4.44Å; V623-L632 PolarHBondContact N-O 2.88Å; V623-L632 PolarHBondContact O-N 3Å
624	E	83.1	Confident	78.2	Confident	25 Å²	25	33.2 Å²	33.2	12%	0.117	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.3	-178.3	-54.1	-169.1	78.4	0	0	110	F121 V122 K126 L622 E630 R631	F121-E624 CarbonylContact C-O 3.57Å; F121-E624 WeakPolarHBondContact CA-O 3.41Å; V122-E624 PolarHBondContact N-O 3.03Å; V122-E624 PolarHBondContact O-N 3.36Å; V122-E624 VanDerWaalsContact O-N 3.11Å; K126-E624 IonicContact NZ-OE2 3.98Å; K126-E624 PolarHBondContact NZ-OE2 3.23Å; L622-E624 HydrophobicContact CD2-CG 3.99Å; L622-E624 WeakPolarHBondContact CD2-OE2 3.39Å; L622-E624 HydrophobicContact CG-CG 4Å; E624-E630 WeakPolarHBondContact CA-O 3.5Å; E624-R631 HydrophobicContact CG-CG 4.18Å; E624-R631 IonicContact OE1-CZ 3.64Å; E624-R631 IonicContact OE1-NE 2.81Å; E624-R631 PolarHBondContact OE1-NE 2.85Å; E624-R631 IonicContact OE1-NH2 2.69Å; E624-R631 PolarHBondContact OE1-NH2 3.2Å
625	S	81.5	Confident	76.7	Confident	9 Å²	9	34.4 Å²	34.4	6%	0.063	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	162.5	167.3	56.3	0	0	0	0	111.2	D627 A628 T629 E630	S625-D627 VanDerWaalsContact C-N 3.25Å; S625-D627 PolarHBondContact O-N 2.91Å; S625-A628 WeakPolarHBondContact O-CA 3.4Å; S625-A628 PolarHBondContact O-N 2.82Å; S625-T629 PolarHBondContact OG-N 2.98Å; S625-T629 VanDerWaalsContact OG-N 3.14Å; S625-T629 PolarHBondContact OG-OG1 2.87Å; S625-E630 PolarHBondContact N-O 3.39Å; S625-E630 PolarHBondContact OG-N 2.91Å
626	E	77	Confident	74.9	Confident	147 Å²	147	35 Å²	35	69%	0.687	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-38.6	177.8	-71.1	174.4	-153.5	0	0	113	T120 A628	T120-E626 WeakPolarHBondContact CB-OE1 3.37Å; T120-E626 PolarHBondContact O-N 2.85Å; T120-E626 PolarHBondContact OG1-OE1 2.93Å; E626-A628 VanDerWaalsContact C-N 3.26Å; E626-A628 PolarHBondContact O-N 3.07Å
627	D	72.5	Confident	72.7	Confident	138 Å²	138	36.6 Å²	36.6	74%	0.738	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	0.1	174.4	-62.5	-43.5	0	0	0	114.4	S625 T629	S625-D627 VanDerWaalsContact C-N 3.25Å; S625-D627 PolarHBondContact O-N 2.91Å; D627-T629 HydrophobicContact CB-CG2 3.67Å; D627-T629 PolarHBondContact O-N 2.77Å
628	A	66	Low	70.7	Confident	48 Å²	48	42.1 Å²	42.1	40%	0.397	22%	0.216	S	C	.	.	S	Bend	trans	51.2	24.8	-169.6	0	0	0	0	0	114.8	S625 E626	S625-A628 WeakPolarHBondContact O-CA 3.4Å; S625-A628 PolarHBondContact O-N 2.82Å; E626-A628 VanDerWaalsContact C-N 3.26Å; E626-A628 PolarHBondContact O-N 3.07Å
629	T	63.9	Low	68.3	Low	63 Å²	63	43.6 Å²	43.6	39%	0.387	22%	0.223	S	C	.	.			trans	-79.7	-30.1	-176.8	44.9	0	0	0	0	113.2	K143 S625 D627	K143-T629 WeakPolarHBondContact CD-O 3.11Å; S625-T629 PolarHBondContact OG-N 2.98Å; S625-T629 VanDerWaalsContact OG-N 3.14Å; S625-T629 PolarHBondContact OG-OG1 2.87Å; D627-T629 HydrophobicContact CB-CG2 3.67Å; D627-T629 PolarHBondContact O-N 2.77Å
630	E	66.7	Low	65.4	Low	86 Å²	86	49.7 Å²	49.7	40%	0.402	26%	0.263	S	S	.	.	S	Bend	trans	-127.1	146.8	-177.2	-70.8	178.5	-171.4	0	0	110.5	F121 K143 E624 S625	F121-E630 HydrophobicContact CE1-CB 4.03Å; K143-E630 HydrophobicContact CB-CG 4.25Å; K143-E630 HydrophobicContact CD-CG 4.26Å; K143-E630 WeakPolarHBondContact O-CA 3.35Å; E624-E630 WeakPolarHBondContact CA-O 3.5Å; S625-E630 PolarHBondContact N-O 3.39Å; S625-E630 PolarHBondContact OG-N 2.91Å
631	R	72.1	Confident	63	Low	37 Å²	37	56.5 Å²	56.5	14%	0.14	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	133.6	-172.1	-62.6	-170	164.1	132.7	7.5	114.1	L134 A138 K143 A144 A145 V623 E624	L134-R631 WeakPolarHBondContact O-CD 3.23Å; L134-R631 PolarHBondContact O-NH1 3.37Å; L134-R631 VanDerWaalsContact O-NH1 3.16Å; A138-R631 HydrophobicContact CB-CB 3.9Å; A138-R631 HydrophobicContact CB-CG 3.96Å; K143-R631 PolarHBondContact O-N 2.87Å; A144-R631 WeakPolarHBondContact CA-O 3.45Å; A144-R631 WeakPolarHBondContact CB-O 3.4Å; A145-R631 PolarHBondContact N-O 3.1Å; V623-R631 CarbonylContact O-C 3.49Å; V623-R631 WeakPolarHBondContact O-CA 3.33Å; E624-R631 HydrophobicContact CG-CG 4.18Å; E624-R631 IonicContact OE1-CZ 3.64Å; E624-R631 IonicContact OE1-NE 2.81Å; E624-R631 PolarHBondContact OE1-NE 2.85Å; E624-R631 IonicContact OE1-NH2 2.69Å; E624-R631 PolarHBondContact OE1-NH2 3.2Å
632	L	66.4	Low	60.5	Low	18 Å²	18	62.5 Å²	62.5	9%	0.094	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	154.8	164.8	-35.5	173.4	0	0	0	109.8	M114 A145 I147 V623	M114-L632 HydrophobicContact CE-CD1 3.84Å; M114-L632 HydrophobicContact SD-CD1 4.32Å; A145-L632 HydrophobicContact CB-CD2 3.83Å; A145-L632 WeakPolarHBondContact O-CA 3.49Å; A145-L632 WeakPolarHBondContact O-CD2 3.48Å; I147-L632 HydrophobicContact CD1-CB 3.76Å; I147-L632 HydrophobicContact CD1-CD1 4.15Å; I147-L632 HydrophobicContact CG1-CB 3.9Å; I147-L632 HydrophobicContact CG1-CD1 4.41Å; V623-L632 HydrophobicContact CB-CB 4.01Å; V623-L632 HydrophobicContact CB-CD1 4.49Å; V623-L632 HydrophobicContact CB-CG 4.4Å; V623-L632 HydrophobicContact CG1-CD1 4.42Å; V623-L632 HydrophobicContact CG2-CB 4.44Å; V623-L632 PolarHBondContact N-O 2.88Å; V623-L632 PolarHBondContact O-N 3Å
633	L	64.5	Low	57.8	Low	17 Å²	17	65.9 Å²	65.9	9%	0.089	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	118.8	179.5	176.4	67.1	0	0	0	110.1	A131 R132 Y135 I147 A620 L622 D635	A131-L633 HydrophobicContact CB-CD1 3.65Å; R132-L633 HydrophobicContact CG-CD2 4Å; Y135-L633 HydrophobicContact CD1-CD2 4.12Å; Y135-L633 HydrophobicContact CD2-CB 3.43Å; Y135-L633 VanDerWaalsContact CD2-CB 3.43Å; Y135-L633 HydrophobicContact CD2-CD2 4.43Å; Y135-L633 HydrophobicContact CE2-CB 3.99Å; Y135-L633 HydrophobicContact CG-CB 3.74Å; Y135-L633 HydrophobicContact CG-CD2 3.86Å; Y135-L633 HydrophobicContact CG-CG 4.45Å; I147-L633 WeakPolarHBondContact CB-O 3.3Å; I147-L633 PolarHBondContact N-O 3.19Å; I147-L633 VanDerWaalsContact N-O 3.15Å; I147-L633 VanDerWaalsContact O-O 3.08Å; A620-L633 HydrophobicContact CB-CD1 3.91Å; L622-L633 HydrophobicContact CD1-CB 4.46Å; L622-L633 HydrophobicContact CD1-CD1 4.22Å; L633-D635 HydrophobicContact CG-CB 4.39Å
634	A	58.4	Low	55.1	Low	1 Å²	1	72.1 Å²	72.1	1%	0.008	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	108.2	166.7	0	0	0	0	0	109.6	I147 F158 L621	I147-A634 HydrophobicContact CB-CB 3.73Å; I147-A634 HydrophobicContact CD1-CB 4.11Å; I147-A634 HydrophobicContact CG1-CB 4.5Å; I147-A634 HydrophobicContact CG2-CB 3.57Å; F158-A634 HydrophobicContact CE2-CB 3.82Å; L621-A634 HydrophobicContact CB-CB 4.17Å; L621-A634 PolarHBondContact N-O 2.83Å; L621-A634 PolarHBondContact O-N 3.36Å
635	D	59.8	Low	52.5	Low	24 Å²	24	77 Å²	77	13%	0.128	43%	0.429	C	S	.	.			trans	-114.5	147.3	-179.7	-169.4	15.1	0	0	0	110.5	K128 R132 A620 L633	K128-D635 VanDerWaalsContact CD-OD1 3.3Å; K128-D635 WeakPolarHBondContact CD-OD1 3.36Å; K128-D635 WeakPolarHBondContact CE-OD1 3.49Å; K128-D635 WeakPolarHBondContact CE-OD2 3.44Å; K128-D635 IonicContact NZ-OD1 3.44Å; K128-D635 PolarHBondContact NZ-OD1 2.78Å; K128-D635 IonicContact NZ-OD2 2.77Å; R132-D635 IonicContact CZ-OD2 3.42Å; R132-D635 IonicContact NE-OD2 2.73Å; R132-D635 PolarHBondContact NE-OD2 3.43Å; R132-D635 IonicContact NH2-OD2 2.8Å; R132-D635 PolarHBondContact NH2-OD2 3.44Å; A620-D635 HydrophobicContact CB-CB 4.31Å; L633-D635 HydrophobicContact CG-CB 4.39Å
636	S	53.4	Low	49.9	Very low	14 Å²	14	82.6 Å²	82.6	10%	0.098	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-65.2	134.2	173.6	33.4	0	0	0	0	110.7	K128 T616	K128-S636 PolarHBondContact NZ-O 3.3Å; K128-S636 PolarHBondContact NZ-OG 2.93Å; T616-S636 PolarHBondContact O-OG 3.43Å
637	A	41.9	Very low	47.4	Very low	37 Å²	37	79 Å²	79	31%	0.306	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-50.4	148.2	-174.1	0	0	0	0	0	112.9	R149	R149-A637 WeakPolarHBondContact O-CB 3.47Å
638	R	41.8	Very low	45.2	Very low	192 Å²	192	78.8 Å²	78.8	73%	0.725	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-84.7	129.4	163.6	-61.6	-172.7	-170.7	-165	4.8	108.2
639	D	36.9	Very low	43.2	Very low	58 Å²	58	85.5 Å²	85.5	31%	0.31	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-62	123.4	154.7	167.4	15.3	0	0	0	107.9	R641 H642	D639-R641 PolarHBondContact O-N 3.14Å; D639-R641 VanDerWaalsContact O-N 3.16Å; D639-R641 WeakPolarHBondContact OD1-CB 3.38Å; D639-R641 PolarHBondContact OD1-N 2.93Å; D639-H642 HydrophobicContact CB-CB 4.4Å; D639-H642 PolarHBondContact O-N 3.2Å; D639-H642 IonicContact OD2-CE1 3.49Å; D639-H642 IonicContact OD2-CG 2.88Å; D639-H642 IonicContact OD2-ND1 3.42Å; D639-H642 PolarHBondContact OD2-ND1 2.84Å
640	P	28.7	Very low	41.4	Very low	129 Å²	129	90 Å²	90	84%	0.838	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-19.8	179.5	24.6	-34.1	0	0	0	113.5	H642	P640-H642 VanDerWaalsContact C-N 3.3Å; P640-H642 PolarHBondContact O-N 3.38Å
641	R	35.4	Very low	39.5	Very low	143 Å²	143	93.9 Å²	93.9	54%	0.54	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-15.6	174.9	-58	-163.5	-76.2	-167	0.7	113.4	V450 D639 G643	V450-R641 PolarHBondContact O-NH2 2.92Å; D639-R641 PolarHBondContact O-N 3.14Å; D639-R641 VanDerWaalsContact O-N 3.16Å; D639-R641 WeakPolarHBondContact OD1-CB 3.38Å; D639-R641 PolarHBondContact OD1-N 2.93Å; R641-G643 PolarHBondContact O-N 2.82Å; R641-G643 VanDerWaalsContact O-N 3.15Å
642	H	33.9	Very low	37.5	Very low	127 Å²	127	98 Å²	98	59%	0.588	58%	0.575	S	S	*	*			trans	-90.2	66.6	-175.4	-90.2	92.9	0	0	0	114	D453 D639 P640	D453-H642 IonicContact OD2-CE1 3.3Å; D639-H642 HydrophobicContact CB-CB 4.4Å; D639-H642 PolarHBondContact O-N 3.2Å; D639-H642 IonicContact OD2-CE1 3.49Å; D639-H642 IonicContact OD2-CG 2.88Å; D639-H642 IonicContact OD2-ND1 3.42Å; D639-H642 PolarHBondContact OD2-ND1 2.84Å; P640-H642 VanDerWaalsContact C-N 3.3Å; P640-H642 PolarHBondContact O-N 3.38Å
643	G	26.5	Very low	35.6	Very low	71 Å²	71	100.3 Å²	100.3	73%	0.732	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-72.8	128.3	169.6	0	0	0	0	0	113	R641	R641-G643 PolarHBondContact O-N 2.82Å; R641-G643 VanDerWaalsContact O-N 3.15Å
644	C	26.3	Very low	34	Very low	130 Å²	130	105.7 Å²	105.7	88%	0.878	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-77	144.4	171.9	-74.5	0	0	0	0	112.3
645	C	27.7	Very low	32.5	Very low	128 Å²	128	111.6 Å²	111.6	87%	0.865	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-63.3	150.8	176.3	-52.4	0	0	0	0	113.2
646	S	27.7	Very low	30.9	Very low	126 Å²	126	116.1 Å²	116.1	88%	0.881	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-84.2	150.9	-177.5	-45	0	0	0	0	113.9
647	G	24.5	Very low	29.6	Very low	71 Å²	71	121.3 Å²	121.3	73%	0.732	74%	0.741	S	S	*	*			trans	91.9	140.6	176.3	0	0	0	0	0	113.2
648	V	25.6	Very low	28.8	Very low	135 Å²	135	127.3 Å²	127.3	82%	0.818	77%	0.768	S	S	*	*			cis	-141.5	148.5	17	167.3	0	0	0	0	110.1
649	Q	24.9	Very low	28.1	Very low	189 Å²	189	123.4 Å²	123.4	88%	0.883	77%	0.765	S	S	*	*			trans	-82.7	136.4	171.7	-66.6	171.3	-58.4	0	0	111.5
650	I	25.5	Very low	27.5	Very low	158 Å²	158	127.4 Å²	127.4	81%	0.81	79%	0.791	S	S	*	*			trans	-137.5	138.4	161.6	-61.2	-176.6	0	0	0	108.2
651	L	27.4	Very low	27.4	Very low	167 Å²	167	131.5 Å²	131.5	87%	0.874	79%	0.792	S	S	*	*			trans	-92.3	139.2	-179.6	-60.5	98	0	0	0	112.3
652	S	29.2	Very low	26.9	Very low	124 Å²	124	129.4 Å²	129.4	87%	0.867	81%	0.805	S	S	*	*			trans	-160.9	149.7	149.8	54.7	0	0	0	0	111.2
653	G	27.1	Very low	26.6	Very low	66 Å²	66	130 Å²	130	68%	0.68	82%	0.817	S	S	*	*			trans	-90	175.7	-175.3	0	0	0	0	0	114.9
654	P	30.5	Very low	27.2	Very low	129 Å²	129	132.3 Å²	132.3	84%	0.838	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-90.1	141.2	-174.5	34.6	-33.8	0	0	0	113.9
655	P	28.3	Very low	27.4	Very low	125 Å²	125	131.6 Å²	131.6	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-88.1	163.9	158.8	33.7	-29.4	0	0	0	112.1
656	S	25.7	Very low	27.6	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90.2	166.8	-169.3	46.8	0	0	0	0	115.3
657	V	25.2	Very low	27.5	Very low	123 Å²	123	135.8 Å²	135.8	75%	0.745	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-103.5	147.5	173.8	177.8	0	0	0	0	109.6	V659	V657-V659 HydrophobicContact CG1-CG2 4.06Å
658	N	26	Very low	27.5	Very low	163 Å²	163	139.8 Å²	139.8	87%	0.872	81%	0.808	S	S	*	*			trans	-132.4	148.8	162.7	-94.8	-24.2	0	0	0	110
659	V	26.7	Very low	27.5	Very low	109 Å²	109	141.6 Å²	141.6	66%	0.661	81%	0.808	S	S	*	*			trans	-138.7	137.8	-175.9	178.9	0	0	0	0	109.5	V657 Y661	V657-V659 HydrophobicContact CG1-CG2 4.06Å; V659-Y661 HydrophobicContact CG1-CD2 4.36Å; V659-Y661 HydrophobicContact CG1-CE2 4.22Å
660	V	25	Very low	27.8	Very low	143 Å²	143	138.6 Å²	138.6	87%	0.867	80%	0.802	S	S	*	*			trans	-143.6	141.6	168.8	-174.8	0	0	0	0	109.5
661	Y	27.2	Very low	28.3	Very low	215 Å²	215	136.2 Å²	136.2	84%	0.843	80%	0.797	S	S	*	*			trans	-111.1	148.5	175.7	-76.2	-100.6	0	0	0	111.3	V659	V659-Y661 HydrophobicContact CG1-CD2 4.36Å; V659-Y661 HydrophobicContact CG1-CE2 4.22Å
662	A	24.7	Very low	28.2	Very low	99 Å²	99	135.6 Å²	135.6	82%	0.818	79%	0.793	S	S	*	*			trans	-171.1	144.6	154.3	0	0	0	0	0	113.8
663	T	26.6	Very low	28	Very low	138 Å²	138	136 Å²	136	85%	0.847	79%	0.79	S	S	*	*			trans	-166	164.1	171.1	48.4	0	0	0	0	110.3
664	P	40.3	Very low	28.1	Very low	120 Å²	120	139.2 Å²	139.2	78%	0.779	80%	0.797	S	S	*	*			cis	-107.6	-100.9	-10.7	23.2	-0.3	0	0	0	112.9
665	P	30.6	Very low	28.3	Very low	115 Å²	115	138.7 Å²	138.7	75%	0.747	79%	0.794	S	S	*	*			cis	-121.1	-126.4	5	48.7	-30	0	0	0	113.1
666	P	30.8	Very low	28.1	Very low	103 Å²	103	137.7 Å²	137.7	67%	0.669	79%	0.789	S	S	*	*			trans	-123.4	-136.5	-159.2	40.2	-15.2	0	0	0	116.1
667	W	25.3	Very low	28.2	Very low	240 Å²	240	137.1 Å²	137.1	91%	0.909	79%	0.785	S	S	*	*			trans	-126.5	158.4	-154.8	-21.7	-75.5	0	0	0	118.1
668	I	25.3	Very low	28.4	Very low	154 Å²	154	139.5 Å²	139.5	79%	0.79	79%	0.788	S	S	*	*			trans	-171.9	145.6	158.9	-113.8	162.8	0	0	0	107.7
669	Q	26.1	Very low	28.5	Very low	173 Å²	173	137.7 Å²	137.7	81%	0.808	78%	0.783	S	S	*	*			cis	-158.4	-158.8	-16.3	-139.1	171.5	10.9	0	0	109.6
670	V	29.8	Very low	28.5	Very low	127 Å²	127	140.5 Å²	140.5	77%	0.77	79%	0.793	S	S	*	*			trans	-136.2	158.4	176	-150.1	0	0	0	0	109.7
671	P	36.3	Very low	28.7	Very low	107 Å²	107	139.1 Å²	139.1	70%	0.695	79%	0.79	S	S	*	*				-158.1	148.2	104	37.6	-17.9	0	0	0	119.1
672	I	25.6	Very low	28.7	Very low	154 Å²	154	132.3 Å²	132.3	79%	0.79	79%	0.785	S	S	*	*			trans	69.3	141	139.2	-65.3	170	0	0	0	117.1
673	T	26	Very low	29	Very low	133 Å²	133	133.5 Å²	133.5	82%	0.816	79%	0.785	S	S	*	*			cis	-129.7	161.9	34.5	31.9	0	0	0	0	117.4
674	T	27.5	Very low	29.4	Very low	133 Å²	133	133.1 Å²	133.1	82%	0.816	78%	0.782	S	S	*	*			trans	-108	180	167.2	42.8	0	0	0	0	110.7
675	P	36	Very low	28.7	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	78%	0.784	S	S	*	*			cis	-112.6	-160.4	6.9	42.8	-27.1	0	0	0	112.4
676	S	24.6	Very low	28.7	Very low	103 Å²	103	136.4 Å²	136.4	72%	0.72	79%	0.786	S	S	*	*			cis	-155.6	178.3	19.8	-138.7	0	0	0	0	110.1
677	S	27.7	Very low	28.5	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	79%	0.792	S	S	*	*			cis	-151.6	-162.2	16.5	-141.3	0	0	0	0	115
678	Q	28.3	Very low	28.9	Very low	173 Å²	173	133.4 Å²	133.4	81%	0.808	79%	0.786	S	S	*	*			trans	-79.6	140.1	-171.5	-66.9	176	-35.1	0	0	117.6
679	V	27.5	Very low	29.5	Very low	126 Å²	126	131.2 Å²	131.2	76%	0.764	78%	0.782	S	S	*	*				42.8	115.5	124.8	-170.9	0	0	0	0	120
680	L	27.6	Very low	30	Very low	167 Å²	167	128.9 Å²	128.9	87%	0.874	78%	0.781	S	S	*	*				-160.5	155.9	112.2	-108.4	170.5	0	0	0	111.3
681	S	30	Very low	30.2	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	79%	0.785	S	S	*	*			trans	-136.9	147.9	-174.2	53.7	0	0	0	0	113
682	G	26.2	Very low	30	Very low	72 Å²	72	131.6 Å²	131.6	74%	0.742	78%	0.78	S	S	*	*			trans	115.7	169	166.4	0	0	0	0	0	115.2
683	P	32	Very low	30.3	Very low	125 Å²	125	128.6 Å²	128.6	81%	0.812	77%	0.765	S	S	*	*			cis	-113.8	171.9	-13.8	38.3	-26.5	0	0	0	112.9
684	V	34.4	Very low	30.8	Very low	130 Å²	130	130.7 Å²	130.7	79%	0.788	77%	0.77	S	S	*	*			trans	-82.8	131.2	170.1	173.8	0	0	0	0	109.6
685	E	25.4	Very low	31.4	Very low	174 Å²	174	126.6 Å²	126.6	81%	0.813	75%	0.745	S	S	*	*			trans	-111.9	121.9	159.6	-84.6	-159.6	142	0	0	111.3	V687	E685-V687 PolarHBondContact O-N 2.79Å
686	T	30.2	Very low	31.9	Very low	130 Å²	130	128.4 Å²	128.4	80%	0.798	75%	0.749	S	S	*	*			trans	-89.4	94.5	177.1	21.5	0	0	0	0	111	L688	T686-L688 PolarHBondContact O-N 2.94Å; T686-L688 VanDerWaalsContact O-N 3.14Å
687	V	27.6	Very low	33.5	Very low	132 Å²	132	124.2 Å²	124.2	80%	0.8	72%	0.721	S	S	*	*			trans	-79.9	96	175.9	-175.7	0	0	0	0	110.7	E685	E685-V687 PolarHBondContact O-N 2.79Å
688	L	33.7	Very low	34.9	Very low	148 Å²	148	120.9 Å²	120.9	78%	0.775	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-64.9	150.9	164.9	-76.9	168.1	0	0	0	110.9	T686	T686-L688 PolarHBondContact O-N 2.94Å; T686-L688 VanDerWaalsContact O-N 3.14Å
689	P	36.7	Very low	36.4	Very low	108 Å²	108	113 Å²	113	70%	0.701	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-62.9	143.6	-173.3	24.9	-34.8	0	0	0	112.4	K691	P689-K691 PolarHBondContact O-N 2.94Å
690	P	37.4	Very low	39	Very low	123 Å²	123	109.7 Å²	109.7	80%	0.799	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-64	133.5	-178	26.4	-34.3	0	0	0	111.2
691	K	33.2	Very low	41.9	Very low	195 Å²	195	102.5 Å²	102.5	85%	0.848	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-60.3	147.5	176.8	-70.2	179.6	177.8	176.4	0	111.1	P689	P689-K691 PolarHBondContact O-N 2.94Å
692	V	32.5	Very low	44.7	Very low	97 Å²	97	99.7 Å²	99.7	59%	0.588	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-57.1	136.7	173.1	179.8	0	0	0	0	109.8
693	N	32.1	Very low	47.7	Very low	90 Å²	90	97.1 Å²	97.1	48%	0.481	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-66.3	143.5	-178.9	-75.9	-27.6	0	0	0	112.8	K905	N693-K905 PolarHBondContact ND2-O 2.85Å; N693-K905 PolarHBondContact OD1-O 2.93Å
694	L	36.3	Very low	50.4	Low	177 Å²	177	98.1 Å²	98.1	93%	0.927	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-65.2	142.9	161.9	-155.7	71.2	0	0	0	108.9
695	V	39.4	Very low	53	Low	48 Å²	48	92.1 Å²	92.1	29%	0.291	49%	0.492	S	S	.	.			trans	-119	139.9	179.5	176.5	0	0	0	0	108.7	Y754 N834	V695-Y754 HydrophobicContact CG1-CE1 4.11Å; V695-Y754 WeakPolarHBondContact CG1-OH 3.38Å; V695-N834 VanDerWaalsContact CB-ND2 3.3Å; V695-N834 WeakPolarHBondContact CB-ND2 3.33Å; V695-N834 HydrophobicContact CG2-CB 4.3Å; V695-N834 VanDerWaalsContact CG2-ND2 3.27Å; V695-N834 WeakPolarHBondContact CG2-ND2 3.25Å
696	D	47.7	Very low	55.8	Low	157 Å²	157	87.5 Å²	87.5	84%	0.84	48%	0.478	S	S	*	.			trans	-116.1	158.1	170.2	-140.6	-26.7	0	0	0	109.1
697	G	56.8	Low	58.3	Low	14 Å²	14	84.8 Å²	84.8	14%	0.144	48%	0.475	C	S	.	.			trans	-117.2	164.2	-160	0	0	0	0	0	116.6
698	D	58.6	Low	60.9	Low	38 Å²	38	80.5 Å²	80.5	20%	0.203	45%	0.451	C	S	.	.	S	Bend	trans	70.5	142.8	175.6	-62.1	-69.1	0	0	0	114.5	H700 S752 S753	D698-H700 PolarHBondContact O-N 2.88Å; D698-S752 WeakPolarHBondContact OD2-CA 3.25Å; D698-S752 PolarHBondContact OD2-OG 3.23Å; D698-S753 VanDerWaalsContact CA-O 3.22Å; D698-S753 WeakPolarHBondContact CA-O 3.34Å; D698-S753 PolarHBondContact N-O 3.44Å; D698-S753 WeakPolarHBondContact OD1-CB 3.23Å; D698-S753 PolarHBondContact OD1-N 3.02Å; D698-S753 PolarHBondContact OD1-OG 3.21Å
699	P	60.1	Low	63.3	Low	9 Å²	9	79.4 Å²	79.4	6%	0.058	45%	0.446	C	S	.	.			trans	-66.5	107	-164.9	25.1	-35.5	0	0	0	111.3	F701 N715 I716 L740 S753 F755	P699-F701 HydrophobicContact CB-CE2 4.11Å; P699-F701 WeakPolarHBondContact O-CD2 3.4Å; P699-F701 WeakPolarHBondContact O-CE2 3.34Å; P699-N715 WeakPolarHBondContact O-CA 3.34Å; P699-I716 WeakPolarHBondContact CD-O 3.4Å; P699-I716 HydrophobicContact CG-CB 4.26Å; P699-I716 VanDerWaalsContact CG-O 3.26Å; P699-I716 WeakPolarHBondContact CG-O 3.43Å; P699-I716 PolarHBondContact O-N 2.68Å; P699-L740 HydrophobicContact CB-CD2 4.43Å; P699-L740 HydrophobicContact CG-CD2 4.06Å; P699-S753 WeakPolarHBondContact CD-OG 3.32Å; P699-F755 HydrophobicContact CB-CD2 4.37Å; P699-F755 HydrophobicContact CB-CE2 3.79Å; P699-F755 HydrophobicContact CB-CZ 4.17Å
700	H	81	Confident	65.7	Low	56 Å²	56	75.8 Å²	75.8	26%	0.259	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	127	-179.6	-172.4	68.7	0	0	0	111.3	D698 N715 Q897 F914	D698-H700 PolarHBondContact O-N 2.88Å; H700-N715 PolarHBondContact ND1-OD1 2.88Å; H700-Q897 WeakPolarHBondContact NE2-CB 3.42Å; H700-Q897 VanDerWaalsContact NE2-CG 3.32Å; H700-Q897 WeakPolarHBondContact NE2-CG 3.42Å; H700-F914 AromaticContact CE1-CE2 3.81Å
701	F	87.9	Confident	68.3	Low	16 Å²	16	71.6 Å²	71.6	7%	0.07	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.9	178.6	-65.3	-91.4	0	0	0	110	P699 C713 F714 I716 L726 F755 I856	P699-F701 HydrophobicContact CB-CE2 4.11Å; P699-F701 WeakPolarHBondContact O-CD2 3.4Å; P699-F701 WeakPolarHBondContact O-CE2 3.34Å; F701-C713 VanDerWaalsContact O-CA 3.25Å; F701-C713 WeakPolarHBondContact O-CA 3.47Å; F701-F714 HydrophobicContact CB-CD1 4.17Å; F701-F714 HydrophobicContact CB-CD2 4.13Å; F701-F714 HydrophobicContact CB-CE1 3.84Å; F701-F714 HydrophobicContact CB-CE2 3.8Å; F701-F714 HydrophobicContact CB-CG 4.31Å; F701-F714 HydrophobicContact CB-CZ 3.65Å; F701-F714 HydrophobicContact CD1-CZ 4.44Å; F701-F714 AromaticContact CD2-CD2 3.94Å; F701-F714 HydrophobicContact CD2-CD2 3.94Å; F701-F714 AromaticContact CD2-CE2 3.54Å; F701-F714 HydrophobicContact CD2-CE2 3.54Å; F701-F714 HydrophobicContact CD2-CZ 4.16Å; F701-F714 HydrophobicContact CE2-CE2 4.26Å; F701-F714 HydrophobicContact CG-CD2 4.31Å; F701-F714 AromaticContact CG-CE2 3.71Å; F701-F714 HydrophobicContact CG-CE2 3.71Å; F701-F714 AromaticContact CG-CZ 3.84Å; F701-F714 HydrophobicContact CG-CZ 3.84Å; F701-F714 PolarHBondContact N-O 3.24Å; F701-F714 PolarHBondContact O-N 3.13Å; F701-F714 VanDerWaalsContact O-N 3.07Å; F701-I716 HydrophobicContact CD2-CG1 3.93Å; F701-I716 HydrophobicContact CE2-CB 4Å; F701-I716 HydrophobicContact CE2-CG1 3.49Å; F701-I716 VanDerWaalsContact CE2-CG1 3.49Å; F701-I716 HydrophobicContact CZ-CG1 4.39Å; F701-L726 HydrophobicContact CE1-CD2 4.2Å; F701-L726 HydrophobicContact CZ-CD2 4.19Å; F701-F755 HydrophobicContact CZ-CE2 4.23Å; F701-F755 AromaticContact CZ-CZ 3.98Å; F701-F755 HydrophobicContact CZ-CZ 3.98Å; F701-I856 HydrophobicContact CD1-CG2 3.56Å; F701-I856 HydrophobicContact CE1-CG2 3.88Å
702	I	88.8	Confident	71.1	Confident	54 Å²	54	62.3 Å²	62.3	28%	0.277	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.5	173.1	-52.6	-179.4	0	0	0	107.2	D711 Q897 D899 V910	I702-D711 HydrophobicContact CG2-CB 4.47Å; I702-Q897 HydrophobicContact CD1-CB 4.43Å; I702-D899 HydrophobicContact CD1-CB 4.34Å; I702-V910 HydrophobicContact CD1-CB 4.43Å; I702-V910 HydrophobicContact CD1-CG2 4.4Å; I702-V910 HydrophobicContact CG2-CG1 4.12Å
703	I	90.8	Very high	73.9	Confident	19 Å²	19	57.7 Å²	57.7	10%	0.097	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	119.2	178.8	-51.6	-56.2	0	0	0	108.3	L705 V712 F714 I856 F859 F922	I703-L705 HydrophobicContact CG2-CD2 3.87Å; I703-V712 PolarHBondContact N-O 3.07Å; I703-V712 PolarHBondContact O-N 2.96Å; I703-F714 HydrophobicContact CD1-CE1 4.44Å; I703-F714 HydrophobicContact CG1-CE1 3.84Å; I703-I856 HydrophobicContact CD1-CB 4.39Å; I703-I856 HydrophobicContact CD1-CG2 3.81Å; I703-F859 HydrophobicContact CD1-CD2 4.16Å; I703-F859 HydrophobicContact CG1-CD2 4.17Å; I703-F859 HydrophobicContact CG1-CE2 4.37Å; I703-F859 HydrophobicContact CG2-CB 3.97Å; I703-F859 HydrophobicContact CG2-CD1 4.47Å; I703-F859 HydrophobicContact CG2-CD2 4.14Å; I703-F859 HydrophobicContact CG2-CG 3.94Å; I703-F922 HydrophobicContact CB-CZ 4.49Å; I703-F922 HydrophobicContact CG1-CE1 4.23Å
704	R	88.3	Confident	76.6	Confident	146 Å²	146	53.4 Å²	53.4	55%	0.551	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	126.3	174.7	-177.8	172.8	-177.7	109.9	-1.9	109.9	P706 D711	R704-P706 WeakPolarHBondContact O-CD 3.34Å; R704-D711 WeakPolarHBondContact CB-OD1 3.47Å; R704-D711 VanDerWaalsContact CG-OD1 3.3Å; R704-D711 WeakPolarHBondContact CG-OD1 3.44Å; R704-D711 IonicContact NH1-OD1 3.7Å
705	L	89	Confident	79.1	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	96	177.3	-54.6	-177.3	0	0	0	107.8	I703 N709 M710 V712 E862 V865	I703-L705 HydrophobicContact CG2-CD2 3.87Å; L705-N709 WeakPolarHBondContact O-CA 3.46Å; L705-N709 PolarHBondContact O-N 2.84Å; L705-M710 HydrophobicContact CB-CG 4.18Å; L705-M710 HydrophobicContact CD1-CG 4.12Å; L705-M710 PolarHBondContact N-O 2.82Å; L705-M710 PolarHBondContact O-N 3.13Å; L705-M710 VanDerWaalsContact O-N 3.12Å; L705-V712 HydrophobicContact CD1-CG2 3.71Å; L705-V712 HydrophobicContact CG-CG2 4.32Å; L705-E862 HydrophobicContact CB-CG 4.23Å; L705-E862 WeakPolarHBondContact CB-OE1 3.35Å; L705-E862 HydrophobicContact CD2-CG 4.24Å; L705-V865 HydrophobicContact CD1-CB 4.25Å; L705-V865 HydrophobicContact CD1-CG2 3.68Å
706	P	83.6	Confident	81.2	Confident	78 Å²	78	44.2 Å²	44.2	51%	0.506	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-38.7	-167.9	26.1	-34.9	0	0	0	114.7	R704 S708 N709 E862	R704-P706 WeakPolarHBondContact O-CD 3.34Å; P706-S708 VanDerWaalsContact C-N 3.34Å; P706-N709 PolarHBondContact O-N 3.05Å; P706-E862 WeakPolarHBondContact CD-OE2 3.19Å; P706-E862 WeakPolarHBondContact CG-OE2 3.45Å
707	G	82.5	Confident	82.6	Confident	72 Å²	72	40.7 Å²	40.7	74%	0.742	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-37	176.7	0	0	0	0	0	112.2	N709 E862	G707-N709 VanDerWaalsContact C-N 3.29Å; G707-E862 PolarHBondContact N-OE1 3.18Å; G707-E862 PolarHBondContact N-OE2 3.26Å
708	S	81.7	Confident	83.9	Confident	43 Å²	43	40.5 Å²	40.5	30%	0.301	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.2	174.4	-48.5	0	0	0	0	113.5	P706 M710 E862	P706-S708 VanDerWaalsContact C-N 3.34Å; S708-M710 VanDerWaalsContact C-N 3.27Å; S708-M710 PolarHBondContact O-N 3.41Å; S708-E862 VanDerWaalsContact CB-OE1 3.3Å; S708-E862 WeakPolarHBondContact CB-OE1 3.25Å; S708-E862 PolarHBondContact N-OE1 3.01Å; S708-E862 PolarHBondContact OG-OE1 2.82Å
709	N	85	Confident	85.2	Confident	125 Å²	125	45.7 Å²	45.7	67%	0.668	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	42.6	46.7	-173.8	-168.6	39.3	0	0	0	114.2	L705 P706 G707	L705-N709 WeakPolarHBondContact O-CA 3.46Å; L705-N709 PolarHBondContact O-N 2.84Å; P706-N709 PolarHBondContact O-N 3.05Å; G707-N709 VanDerWaalsContact C-N 3.29Å
710	M	88	Confident	86.4	Confident	31 Å²	31	47.9 Å²	47.9	15%	0.153	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	150.9	178.8	73.1	171.9	94.3	0	0	112.9	L705 S708 V712 V865 V867 M883	L705-M710 HydrophobicContact CB-CG 4.18Å; L705-M710 HydrophobicContact CD1-CG 4.12Å; L705-M710 PolarHBondContact N-O 2.82Å; L705-M710 PolarHBondContact O-N 3.13Å; L705-M710 VanDerWaalsContact O-N 3.12Å; S708-M710 VanDerWaalsContact C-N 3.27Å; S708-M710 PolarHBondContact O-N 3.41Å; M710-V712 HydrophobicContact CG-CG2 4.29Å; M710-V712 HydrophobicContact SD-CG2 4.21Å; M710-V865 HydrophobicContact CE-CB 4.29Å; M710-V865 HydrophobicContact CE-CG1 3.96Å; M710-V865 HydrophobicContact SD-CG1 4.04Å; M710-V867 HydrophobicContact CE-CG2 4.21Å; M710-V867 HydrophobicContact SD-CG2 4.13Å; M710-M883 HydrophobicContact SD-CE 4.48Å
711	D	90.7	Very high	86.7	Confident	36 Å²	36	47.2 Å²	47.2	19%	0.193	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.2	170.6	-58.4	-55.8	0	0	0	109.2	I702 R704 V910 C912 W913	I702-D711 HydrophobicContact CG2-CB 4.47Å; R704-D711 WeakPolarHBondContact CB-OD1 3.47Å; R704-D711 VanDerWaalsContact CG-OD1 3.3Å; R704-D711 WeakPolarHBondContact CG-OD1 3.44Å; R704-D711 IonicContact NH1-OD1 3.7Å; D711-V910 HydrophobicContact CB-CG1 3.9Å; D711-C912 HydrophobicContact CB-CB 3.82Å; D711-C912 WeakPolarHBondContact O-CA 3.18Å; D711-C912 WeakPolarHBondContact O-CB 3.24Å; D711-W913 PolarHBondContact O-N 3Å
712	V	91.6	Very high	86.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	139.6	178	-175.3	0	0	0	0	109	I703 L705 M710 M883 W913 V915 F922	I703-V712 PolarHBondContact N-O 3.07Å; I703-V712 PolarHBondContact O-N 2.96Å; L705-V712 HydrophobicContact CD1-CG2 3.71Å; L705-V712 HydrophobicContact CG-CG2 4.32Å; M710-V712 HydrophobicContact CG-CG2 4.29Å; M710-V712 HydrophobicContact SD-CG2 4.21Å; V712-M883 HydrophobicContact CG1-CE 4.28Å; V712-M883 HydrophobicContact CG2-CE 3.97Å; V712-W913 CarbonylContact C-O 3.51Å; V712-W913 WeakPolarHBondContact CA-O 3.5Å; V712-V915 HydrophobicContact CG1-CG2 3.71Å; V712-F922 HydrophobicContact CB-CE1 4.43Å; V712-F922 HydrophobicContact CB-CE2 4.26Å; V712-F922 HydrophobicContact CB-CZ 3.87Å; V712-F922 HydrophobicContact CG1-CD1 4.37Å; V712-F922 HydrophobicContact CG1-CD2 4.25Å; V712-F922 HydrophobicContact CG1-CE1 3.92Å; V712-F922 HydrophobicContact CG1-CE2 3.8Å; V712-F922 HydrophobicContact CG1-CZ 3.62Å; V712-F922 HydrophobicContact CG2-CE2 4.37Å; V712-F922 HydrophobicContact CG2-CZ 4.36Å
713	C	91.3	Very high	87.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.5	-169.9	-75.5	0	0	0	0	112.4	F701 Q897 C912 W913 F914 V915	F701-C713 VanDerWaalsContact O-CA 3.25Å; F701-C713 WeakPolarHBondContact O-CA 3.47Å; C713-Q897 HydrophobicContact CB-CG 4.46Å; C713-C912 HydrophobicContact CB-CB 3.92Å; C713-C912 WeakPolarHBondContact CB-SG 3.18Å; C713-C912 WeakPolarHBondContact SG-CB 3.36Å; C713-C912 CovalentContact SG-SG 2.03Å; C713-C912 PolarHBondContact SG-SG 3.01Å; C713-W913 PolarHBondContact N-O 3.16Å; C713-F914 HydrophobicContact CB-CD2 3.96Å; C713-F914 CarbonylContact O-C 3.56Å; C713-F914 WeakPolarHBondContact O-CA 3.4Å; C713-V915 PolarHBondContact O-N 2.96Å
714	F	90.4	Very high	87.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	160.9	170.5	61	-88.4	0	0	0	111.8	F701 I703 I716 V915 F922 I923	F701-F714 HydrophobicContact CB-CD1 4.17Å; F701-F714 HydrophobicContact CB-CD2 4.13Å; F701-F714 HydrophobicContact CB-CE1 3.84Å; F701-F714 HydrophobicContact CB-CE2 3.8Å; F701-F714 HydrophobicContact CB-CG 4.31Å; F701-F714 HydrophobicContact CB-CZ 3.65Å; F701-F714 HydrophobicContact CD1-CZ 4.44Å; F701-F714 AromaticContact CD2-CD2 3.94Å; F701-F714 HydrophobicContact CD2-CD2 3.94Å; F701-F714 AromaticContact CD2-CE2 3.54Å; F701-F714 HydrophobicContact CD2-CE2 3.54Å; F701-F714 HydrophobicContact CD2-CZ 4.16Å; F701-F714 HydrophobicContact CE2-CE2 4.26Å; F701-F714 HydrophobicContact CG-CD2 4.31Å; F701-F714 AromaticContact CG-CE2 3.71Å; F701-F714 HydrophobicContact CG-CE2 3.71Å; F701-F714 AromaticContact CG-CZ 3.84Å; F701-F714 HydrophobicContact CG-CZ 3.84Å; F701-F714 PolarHBondContact N-O 3.24Å; F701-F714 PolarHBondContact O-N 3.13Å; F701-F714 VanDerWaalsContact O-N 3.07Å; I703-F714 HydrophobicContact CD1-CE1 4.44Å; I703-F714 HydrophobicContact CG1-CE1 3.84Å; F714-I716 HydrophobicContact CD2-CD1 3.76Å; F714-I716 HydrophobicContact CD2-CG1 3.99Å; F714-I716 HydrophobicContact CE2-CD1 3.73Å; F714-I716 HydrophobicContact CE2-CG1 3.81Å; F714-V915 HydrophobicContact CB-CB 4.38Å; F714-F922 HydrophobicContact CD1-CD1 4.02Å; F714-F922 HydrophobicContact CD1-CE1 4.11Å; F714-F922 HydrophobicContact CE1-CD1 4.04Å; F714-F922 AromaticContact CE1-CE1 3.93Å; F714-F922 HydrophobicContact CE1-CE1 3.93Å; F714-I923 HydrophobicContact CE1-CG2 4.4Å; F714-I923 HydrophobicContact CE2-CG2 4.27Å; F714-I923 HydrophobicContact CZ-CG2 3.98Å
715	N	87.4	Confident	87.7	Confident	32 Å²	32	39.4 Å²	39.4	17%	0.171	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	156.6	170.7	-69.8	25.9	0	0	0	109.8	P699 H700 F914 S918	P699-N715 WeakPolarHBondContact O-CA 3.34Å; H700-N715 PolarHBondContact ND1-OD1 2.88Å; N715-F914 HydrophobicContact CB-CZ 4.42Å; N715-F914 WeakPolarHBondContact OD1-CE2 3.24Å; N715-F914 WeakPolarHBondContact OD1-CZ 3.28Å; N715-S918 VanDerWaalsContact O-CA 3.27Å; N715-S918 WeakPolarHBondContact O-CA 3.3Å
716	I	84.4	Confident	88	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.239	C	C	.	.			trans	-119.2	102.4	170	-61.7	-63.9	0	0	0	110.4	P699 F701 F714 S718 L724 S918 Y927	P699-I716 WeakPolarHBondContact CD-O 3.4Å; P699-I716 HydrophobicContact CG-CB 4.26Å; P699-I716 VanDerWaalsContact CG-O 3.26Å; P699-I716 WeakPolarHBondContact CG-O 3.43Å; P699-I716 PolarHBondContact O-N 2.68Å; F701-I716 HydrophobicContact CD2-CG1 3.93Å; F701-I716 HydrophobicContact CE2-CB 4Å; F701-I716 HydrophobicContact CE2-CG1 3.49Å; F701-I716 VanDerWaalsContact CE2-CG1 3.49Å; F701-I716 HydrophobicContact CZ-CG1 4.39Å; F714-I716 HydrophobicContact CD2-CD1 3.76Å; F714-I716 HydrophobicContact CD2-CG1 3.99Å; F714-I716 HydrophobicContact CE2-CD1 3.73Å; F714-I716 HydrophobicContact CE2-CG1 3.81Å; I716-S718 PolarHBondContact O-N 2.87Å; I716-L724 HydrophobicContact CB-CD1 4.42Å; I716-L724 HydrophobicContact CG2-CD1 3.86Å; I716-L724 HydrophobicContact CG2-CD2 4.36Å; I716-S918 WeakPolarHBondContact CD1-O 3.43Å; I716-Y927 HydrophobicContact CG2-CD2 3.85Å; I716-Y927 HydrophobicContact CG2-CG 3.97Å
717	D	77.6	Confident	88.6	Confident	83 Å²	83	35.6 Å²	35.6	44%	0.444	22%	0.215	S	C	.	.			trans	-82.2	79.2	-173.3	-41.7	-64.6	0	0	0	110.5	S918 Y927	D717-S918 PolarHBondContact OD2-OG 2.99Å; D717-Y927 PolarHBondContact O-OH 2.94Å; D717-Y927 VanDerWaalsContact O-OH 3.06Å
718	S	83.9	Confident	89.2	Confident	9 Å²	9	32.4 Å²	32.4	6%	0.063	18%	0.181	C	C	.	.			trans	-122.1	157.3	-170.5	-174.4	0	0	0	0	112.2	I716 H722	I716-S718 PolarHBondContact O-N 2.87Å; S718-H722 PolarHBondContact OG-ND1 3.09Å
719	K	85.4	Confident	89.9	Confident	147 Å²	147	30.4 Å²	30.4	64%	0.639	17%	0.167	S	C	*	.			trans	-76.5	142.8	-171.9	-61.9	179.2	-179.2	175	0	111.8	G721 H722	K719-G721 PolarHBondContact O-N 2.83Å; K719-H722 VanDerWaalsContact O-CB 3.24Å; K719-H722 WeakPolarHBondContact O-CB 3.15Å; K719-H722 PolarHBondContact O-N 2.85Å; K719-H722 VanDerWaalsContact O-N 3.11Å
720	P	85.9	Confident	90.2	Very high	55 Å²	55	28.2 Å²	28.2	36%	0.357	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	140.4	164.7	-26.9	35.4	0	0	0	111.8	H722 V751	P720-H722 VanDerWaalsContact C-N 3.33Å; P720-V751 HydrophobicContact CG-CG1 4.42Å
721	G	86.4	Confident	90.4	Very high	43 Å²	43	29 Å²	29	44%	0.443	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-27	-172.9	0	0	0	0	0	114.4	K719 Q739 L740	K719-G721 PolarHBondContact O-N 2.83Å; G721-Q739 PolarHBondContact O-NE2 2.89Å; G721-L740 PolarHBondContact N-O 2.85Å
722	H	92.9	Very high	90.5	Very high	55 Å²	55	29.2 Å²	29.2	26%	0.255	18%	0.177	S	C	.	.			trans	-61.3	145.2	174.6	-70.6	-175.4	0	0	0	111.3	S718 K719 P720 L740	S718-H722 PolarHBondContact OG-ND1 3.09Å; K719-H722 VanDerWaalsContact O-CB 3.24Å; K719-H722 WeakPolarHBondContact O-CB 3.15Å; K719-H722 PolarHBondContact O-N 2.85Å; K719-H722 VanDerWaalsContact O-N 3.11Å; P720-H722 VanDerWaalsContact C-N 3.33Å; H722-L740 PolarHBondContact O-N 3.41Å
723	I	94.1	Very high	90.5	Very high	15 Å²	15	29.4 Å²	29.4	8%	0.077	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.7	173.5	-58.3	165.3	0	0	0	107.4	N737 G738 Q739 I931 M932 L935	I723-N737 HydrophobicContact CG2-CB 3.91Å; I723-G738 WeakPolarHBondContact CA-O 3.41Å; I723-Q739 HydrophobicContact CG1-CB 4.08Å; I723-Q739 HydrophobicContact CG1-CG 3.95Å; I723-I931 CarbonylContact O-C 3.54Å; I723-I931 WeakPolarHBondContact O-CA 3.32Å; I723-M932 HydrophobicContact CB-CB 4.37Å; I723-M932 HydrophobicContact CG2-CB 4.09Å; I723-M932 PolarHBondContact O-N 2.9Å; I723-L935 HydrophobicContact CD1-CG 4.15Å; I723-L935 HydrophobicContact CG2-CD2 3.9Å; I723-L935 HydrophobicContact CG2-CG 4.4Å
724	L	94.5	Very high	90.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134	178.4	-63.8	-179.5	0	0	0	110.5	I716 L726 N737 G738 L740 F755 L855 I931	I716-L724 HydrophobicContact CB-CD1 4.42Å; I716-L724 HydrophobicContact CG2-CD1 3.86Å; I716-L724 HydrophobicContact CG2-CD2 4.36Å; L724-L726 HydrophobicContact CB-CD2 3.91Å; L724-N737 CarbonylContact O-C 3.46Å; L724-N737 VanDerWaalsContact O-CA 3.32Å; L724-N737 WeakPolarHBondContact O-CA 3.04Å; L724-G738 PolarHBondContact N-O 2.96Å; L724-G738 PolarHBondContact O-N 2.88Å; L724-L740 HydrophobicContact CD1-CD1 4.11Å; L724-L740 HydrophobicContact CD1-CD2 4.5Å; L724-L740 HydrophobicContact CD1-CG 4.46Å; L724-L740 HydrophobicContact CG-CD1 4.41Å; L724-F755 HydrophobicContact CD1-CE1 4.4Å; L724-F755 HydrophobicContact CD1-CZ 4.37Å; L724-L855 HydrophobicContact CB-CD1 3.95Å; L724-L855 HydrophobicContact CD1-CD1 4.21Å; L724-L855 HydrophobicContact CD2-CD1 4.28Å; L724-L855 HydrophobicContact CG-CD1 4.38Å; L724-I931 HydrophobicContact CD2-CG1 4.25Å
725	S	95.4	Very high	91	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115	171.1	-162.6	0	0	0	0	111.6	N737 L855 Y930	S725-N737 VanDerWaalsContact CA-OD1 3.23Å; S725-N737 WeakPolarHBondContact CA-OD1 3.47Å; S725-N737 WeakPolarHBondContact CB-OD1 3.42Å; S725-N737 PolarHBondContact OG-OD1 2.65Å; S725-L855 WeakPolarHBondContact O-CB 3.29Å; S725-L855 WeakPolarHBondContact O-CG 3.23Å; S725-L855 PolarHBondContact O-N 3.05Å; S725-Y930 PolarHBondContact N-O 2.91Å
726	L	95.2	Very high	91.5	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-49.2	-172.2	-48.9	-180	0	0	0	109.4	F701 L724 V736 F755 L840 G854 L855 I856 G857	F701-L726 HydrophobicContact CE1-CD2 4.2Å; F701-L726 HydrophobicContact CZ-CD2 4.19Å; L724-L726 HydrophobicContact CB-CD2 3.91Å; L726-V736 WeakPolarHBondContact CA-O 3.46Å; L726-V736 VanDerWaalsContact CB-O 3.3Å; L726-V736 WeakPolarHBondContact CB-O 3.48Å; L726-V736 PolarHBondContact N-O 2.65Å; L726-F755 HydrophobicContact CD1-CE1 4.18Å; L726-F755 HydrophobicContact CD1-CZ 4.09Å; L726-F755 HydrophobicContact CD2-CE1 4.41Å; L726-F755 HydrophobicContact CD2-CZ 4.06Å; L726-L840 HydrophobicContact CB-CD2 4.47Å; L726-L840 HydrophobicContact CD1-CD2 3.43Å; L726-L840 VanDerWaalsContact CD1-CD2 3.43Å; L726-G854 CarbonylContact O-C 3.46Å; L726-L855 HydrophobicContact CD2-CD1 4.19Å; L726-L855 PolarHBondContact O-N 3.23Å; L726-I856 HydrophobicContact CB-CD1 4.07Å; L726-I856 HydrophobicContact CB-CG1 3.97Å; L726-I856 WeakPolarHBondContact O-CG1 3.41Å; L726-I856 PolarHBondContact O-N 2.9Å; L726-G857 PolarHBondContact O-N 2.96Å
727	V	95.9	Very high	92.1	Very high	2 Å²	2	28 Å²	28	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.8	170	-175.1	0	0	0	0	108.9	V735 V736 I842 Y848 V852 H853 I856	V727-V735 CarbonylContact O-C 3.58Å; V727-V735 WeakPolarHBondContact O-CA 3.47Å; V727-V736 HydrophobicContact CB-CB 4.04Å; V727-V736 HydrophobicContact CB-CG2 4.14Å; V727-V736 HydrophobicContact CG2-CB 4.39Å; V727-V736 PolarHBondContact N-O 3.01Å; V727-V736 PolarHBondContact O-N 2.81Å; V727-I842 HydrophobicContact CG2-CD1 3.52Å; V727-Y848 HydrophobicContact CG1-CD1 4.34Å; V727-Y848 HydrophobicContact CG1-CE1 3.81Å; V727-V852 HydrophobicContact CG1-CG2 3.75Å; V727-H853 CarbonylContact C-O 3.54Å; V727-H853 WeakPolarHBondContact CA-O 3.5Å; V727-I856 HydrophobicContact CG2-CD1 4.46Å; V727-I856 HydrophobicContact CG2-CG1 4Å
728	S	95.9	Very high	92.9	Very high	5 Å²	5	24 Å²	24	4%	0.035	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	109.8	171.6	177.6	0	0	0	0	108.1	H853 L939	S728-H853 PolarHBondContact N-O 2.8Å; S728-H853 PolarHBondContact O-N 2.94Å; S728-L939 PolarHBondContact OG-N 2.88Å
729	D	95.5	Very high	93.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	101.8	-179.5	179.3	1.8	0	0	0	109.9	G731 T732 G733 V734 Y848 S849 V852	D729-G731 VanDerWaalsContact C-N 3.25Å; D729-G731 PolarHBondContact O-N 3.33Å; D729-G731 WeakPolarHBondContact OD1-CA 3.32Å; D729-G731 PolarHBondContact OD1-N 2.85Å; D729-T732 PolarHBondContact OD1-N 3.17Å; D729-T732 WeakPolarHBondContact OD2-CB 3.48Å; D729-T732 VanDerWaalsContact OD2-CG2 3.31Å; D729-T732 WeakPolarHBondContact OD2-CG2 3.36Å; D729-T732 PolarHBondContact OD2-OG1 3.35Å; D729-G733 CarbonylContact O-C 3.52Å; D729-G733 VanDerWaalsContact O-CA 3.29Å; D729-G733 WeakPolarHBondContact O-CA 3.46Å; D729-G733 PolarHBondContact O-N 2.74Å; D729-V734 PolarHBondContact N-O 3.43Å; D729-V734 PolarHBondContact O-N 2.85Å; D729-Y848 HydrophobicContact CB-CD1 4.43Å; D729-S849 VanDerWaalsContact OD1-CB 3.28Å; D729-S849 WeakPolarHBondContact OD1-CB 3.46Å; D729-S849 PolarHBondContact OD1-OG 3.2Å; D729-S849 PolarHBondContact OD2-N 3.43Å; D729-V852 HydrophobicContact CB-CB 3.98Å; D729-V852 HydrophobicContact CB-CG2 4.05Å
730	T	91.9	Very high	93.7	Very high	80 Å²	80	19.3 Å²	19.3	49%	0.491	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-13	179.2	50.6	0	0	0	0	113.6	F938	T730-F938 HydrophobicContact CG2-CD1 3.69Å; T730-F938 HydrophobicContact CG2-CE1 4.21Å; T730-F938 HydrophobicContact CG2-CG 4.39Å
731	G	91.7	Very high	93.8	Very high	48 Å²	48	19.1 Å²	19.1	50%	0.495	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-33	178.6	0	0	0	0	0	113.8	D729 S849	D729-G731 VanDerWaalsContact C-N 3.25Å; D729-G731 PolarHBondContact O-N 3.33Å; D729-G731 WeakPolarHBondContact OD1-CA 3.32Å; D729-G731 PolarHBondContact OD1-N 2.85Å; G731-S849 WeakPolarHBondContact CA-OG 3.18Å
732	T	92.3	Very high	93.7	Very high	39 Å²	39	19.6 Å²	19.6	24%	0.239	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-17.5	164.8	57.9	0	0	0	0	112.8	D729 I818	D729-T732 PolarHBondContact OD1-N 3.17Å; D729-T732 WeakPolarHBondContact OD2-CB 3.48Å; D729-T732 VanDerWaalsContact OD2-CG2 3.31Å; D729-T732 WeakPolarHBondContact OD2-CG2 3.36Å; D729-T732 PolarHBondContact OD2-OG1 3.35Å; T732-I818 HydrophobicContact CG2-CD1 4.09Å
733	G	93.1	Very high	93.1	Very high	5 Å²	5	17.3 Å²	17.3	5%	0.052	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	29.6	-175.3	0	0	0	0	0	113.1	D729 Q763	D729-G733 CarbonylContact O-C 3.52Å; D729-G733 VanDerWaalsContact O-CA 3.29Å; D729-G733 WeakPolarHBondContact O-CA 3.46Å; D729-G733 PolarHBondContact O-N 2.74Å; G733-Q763 PolarHBondContact O-N 2.93Å
734	V	95.3	Very high	92.1	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	133.3	-178	177.5	0	0	0	0	111.3	D729 Y761 I814 I818	D729-V734 PolarHBondContact N-O 3.43Å; D729-V734 PolarHBondContact O-N 2.85Å; V734-Y761 WeakPolarHBondContact CA-O 3.39Å; V734-I814 HydrophobicContact CB-CD1 4.43Å; V734-I814 HydrophobicContact CG1-CD1 3.73Å; V734-I814 HydrophobicContact CG2-CD1 3.78Å; V734-I814 HydrophobicContact CG2-CG2 4.26Å; V734-I818 HydrophobicContact CG2-CD1 4.01Å
735	V	95.9	Very high	90.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.1	173.7	178.1	0	0	0	0	110.3	V727 N737 V760 Y761 S937 F938	V727-V735 CarbonylContact O-C 3.58Å; V727-V735 WeakPolarHBondContact O-CA 3.47Å; V735-N737 VanDerWaalsContact CG1-CG 3.46Å; V735-N737 WeakPolarHBondContact CG1-ND2 3.27Å; V735-N737 WeakPolarHBondContact CG1-OD1 3.3Å; V735-V760 CarbonylContact O-C 3.57Å; V735-V760 WeakPolarHBondContact O-CA 3.16Å; V735-Y761 PolarHBondContact N-O 2.85Å; V735-Y761 PolarHBondContact O-N 2.95Å; V735-S937 WeakPolarHBondContact CG1-O 3.42Å; V735-F938 HydrophobicContact CG2-CB 4.27Å; V735-F938 HydrophobicContact CG2-CD1 3.31Å; V735-F938 HydrophobicContact CG2-CD2 3.7Å; V735-F938 HydrophobicContact CG2-CE1 3.37Å; V735-F938 HydrophobicContact CG2-CE2 3.75Å; V735-F938 HydrophobicContact CG2-CG 3.48Å; V735-F938 VanDerWaalsContact CG2-CG 3.48Å; V735-F938 HydrophobicContact CG2-CZ 3.6Å
736	V	97.3	Very high	88.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	110.9	168.8	-172.9	0	0	0	0	108.7	L726 V727 I758 S759 V760 V820 L840	L726-V736 WeakPolarHBondContact CA-O 3.46Å; L726-V736 VanDerWaalsContact CB-O 3.3Å; L726-V736 WeakPolarHBondContact CB-O 3.48Å; L726-V736 PolarHBondContact N-O 2.65Å; V727-V736 HydrophobicContact CB-CB 4.04Å; V727-V736 HydrophobicContact CB-CG2 4.14Å; V727-V736 HydrophobicContact CG2-CB 4.39Å; V727-V736 PolarHBondContact N-O 3.01Å; V727-V736 PolarHBondContact O-N 2.81Å; V736-I758 HydrophobicContact CG1-CG2 4.11Å; V736-S759 WeakPolarHBondContact CA-O 3.49Å; V736-V760 HydrophobicContact CG1-CG2 4.37Å; V736-V760 HydrophobicContact CG2-CG1 4.43Å; V736-V760 HydrophobicContact CG2-CG2 4.33Å; V736-V820 HydrophobicContact CG1-CG1 4.2Å; V736-V820 HydrophobicContact CG2-CG1 4.49Å; V736-V820 HydrophobicContact CG2-CG2 3.92Å; V736-L840 HydrophobicContact CG1-CD2 4.3Å
737	N	96.9	Very high	86.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.9	-180	-65.6	-26.5	0	0	0	110.3	I723 L724 S725 V735 S759 L935 S937	I723-N737 HydrophobicContact CG2-CB 3.91Å; L724-N737 CarbonylContact O-C 3.46Å; L724-N737 VanDerWaalsContact O-CA 3.32Å; L724-N737 WeakPolarHBondContact O-CA 3.04Å; S725-N737 VanDerWaalsContact CA-OD1 3.23Å; S725-N737 WeakPolarHBondContact CA-OD1 3.47Å; S725-N737 WeakPolarHBondContact CB-OD1 3.42Å; S725-N737 PolarHBondContact OG-OD1 2.65Å; V735-N737 VanDerWaalsContact CG1-CG 3.46Å; V735-N737 WeakPolarHBondContact CG1-ND2 3.27Å; V735-N737 WeakPolarHBondContact CG1-OD1 3.3Å; N737-S759 PolarHBondContact N-O 3.25Å; N737-S759 PolarHBondContact O-N 2.86Å; N737-L935 HydrophobicContact CB-CD2 4.33Å; N737-L935 WeakPolarHBondContact CB-O 3.39Å; N737-L935 PolarHBondContact ND2-O 2.94Å; N737-S937 PolarHBondContact ND2-O 3.22Å
738	G	95.3	Very high	84.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.4	-179.2	0	0	0	0	0	112.9	I723 L724 I757	I723-G738 WeakPolarHBondContact CA-O 3.41Å; L724-G738 PolarHBondContact N-O 2.96Å; L724-G738 PolarHBondContact O-N 2.88Å; G738-I757 CarbonylContact C-O 3.59Å; G738-I757 WeakPolarHBondContact CA-O 3.5Å
739	Q	94.5	Very high	82.6	Confident	55 Å²	55	52.2 Å²	52.2	26%	0.257	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.4	175.3	-170	173.1	29.7	0	0	111.6	G721 I723 G756 I757 L935	G721-Q739 PolarHBondContact O-NE2 2.89Å; I723-Q739 HydrophobicContact CG1-CB 4.08Å; I723-Q739 HydrophobicContact CG1-CG 3.95Å; Q739-G756 PolarHBondContact O-N 3.01Å; Q739-I757 HydrophobicContact CB-CB 4.38Å; Q739-I757 PolarHBondContact N-O 3.27Å; Q739-L935 HydrophobicContact CB-CD2 4.18Å
740	L	91.4	Very high	80.8	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	140.8	179.4	-60.8	178.8	0	0	0	112.8	P699 G721 H722 L724 Y754 F755	P699-L740 HydrophobicContact CB-CD2 4.43Å; P699-L740 HydrophobicContact CG-CD2 4.06Å; G721-L740 PolarHBondContact N-O 2.85Å; H722-L740 PolarHBondContact O-N 3.41Å; L724-L740 HydrophobicContact CD1-CD1 4.11Å; L724-L740 HydrophobicContact CD1-CD2 4.5Å; L724-L740 HydrophobicContact CD1-CG 4.46Å; L724-L740 HydrophobicContact CG-CD1 4.41Å; L740-Y754 CarbonylContact C-O 3.51Å; L740-Y754 VanDerWaalsContact CA-O 3.28Å; L740-Y754 WeakPolarHBondContact CA-O 3.44Å; L740-F755 HydrophobicContact CD2-CD1 3.8Å; L740-F755 HydrophobicContact CD2-CE1 3.82Å; L740-F755 HydrophobicContact CD2-CG 4.33Å; L740-F755 HydrophobicContact CD2-CZ 4.37Å
741	I	88.6	Confident	79.6	Confident	52 Å²	52	56 Å²	56	27%	0.267	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	160.3	171.8	60	169.7	0	0	0	110.3	S753 Y754 V835	I741-S753 CarbonylContact O-C 3.56Å; I741-S753 VanDerWaalsContact O-CA 3.32Å; I741-S753 WeakPolarHBondContact O-CA 3.41Å; I741-Y754 WeakPolarHBondContact CG1-O 3.38Å; I741-Y754 PolarHBondContact N-O 2.76Å; I741-Y754 PolarHBondContact O-N 3.27Å; I741-V835 HydrophobicContact CD1-CG2 3.83Å; I741-V835 HydrophobicContact CG1-CG2 4.46Å
742	S	84.2	Confident	78.9	Confident	52 Å²	52	55 Å²	55	36%	0.364	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	161	-179.5	66.3	0	0	0	0	113.3
743	S	80.3	Confident	78.5	Confident	7 Å²	7	53.1 Å²	53.1	5%	0.049	28%	0.279	C	S	.	.			trans	-57.2	162.3	152.9	62.6	0	0	0	0	111.9	Q745 S752 V833	S743-Q745 VanDerWaalsContact C-N 3.32Å; S743-Q745 WeakPolarHBondContact CB-O 3.23Å; S743-Q745 PolarHBondContact OG-O 2.99Å; S743-S752 PolarHBondContact N-O 2.87Å; S743-V833 WeakPolarHBondContact CB-O 3.29Å
744	K	73.1	Confident	78.2	Confident	102 Å²	102	53.7 Å²	53.7	44%	0.443	28%	0.28	S	S	.	.	S	Bend	trans	-72.1	-25.5	174.2	-58	179.3	-174.1	166.8	0	113	R829 H831 P832 V833 N834 V835	K744-R829 PolarHBondContact NZ-O 2.86Å; K744-H831 PolarHBondContact NZ-O 2.73Å; K744-P832 WeakPolarHBondContact CB-O 3.29Å; K744-V833 WeakPolarHBondContact CB-O 3.43Å; K744-V833 PolarHBondContact N-O 2.68Å; K744-N834 WeakPolarHBondContact CE-O 3.4Å; K744-N834 PolarHBondContact NZ-O 2.83Å; K744-V835 HydrophobicContact CD-CG1 4.48Å; K744-V835 HydrophobicContact CG-CG1 3.62Å
745	Q	62.4	Low	78	Confident	108 Å²	108	54.4 Å²	54.4	51%	0.505	28%	0.283	S	S	.	.	S	Bend	trans	-143	144.6	-179.1	-67.7	-172.5	-25.1	0	0	110.1	S743	S743-Q745 VanDerWaalsContact C-N 3.32Å; S743-Q745 WeakPolarHBondContact CB-O 3.23Å; S743-Q745 PolarHBondContact OG-O 2.99Å
746	P	59.5	Low	77.7	Confident	83 Å²	83	54.6 Å²	54.6	54%	0.539	29%	0.285	S	S	.	.			trans	-67	145.7	169.3	28.5	-33.7	0	0	0	110.7	T750 V751	P746-T750 CarbonylContact C-O 3.56Å; P746-T750 VanDerWaalsContact CA-O 3.23Å; P746-T750 WeakPolarHBondContact CA-O 3.38Å; P746-T750 WeakPolarHBondContact CB-O 3.27Å; P746-V751 HydrophobicContact CB-CG2 3.8Å
747	H	51.6	Low	77.6	Confident	120 Å²	120	57.2 Å²	57.2	56%	0.556	30%	0.298	S	S	*	.	B	Isolated β-bridge	trans	-117.3	125.9	170.6	-168.5	35.7	0	0	0	108.6	N749 T750	H747-N749 VanDerWaalsContact C-N 3.26Å; H747-N749 PolarHBondContact O-N 2.78Å; H747-T750 PolarHBondContact N-O 3.06Å; H747-T750 PolarHBondContact O-N 3.41Å; H747-T750 PolarHBondContact O-OG1 3.06Å; H747-T750 VanDerWaalsContact O-OG1 3.06Å
748	K	50.3	Low	77.6	Confident	177 Å²	177	57.2 Å²	57.2	77%	0.77	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	41.3	-177.5	-55.2	176.7	-176.4	172.7	0	113.9	T750	K748-T750 PolarHBondContact O-N 3.23Å
749	N	53.1	Low	77.6	Confident	166 Å²	166	57.2 Å²	57.2	89%	0.888	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	2.9	-176.7	-58.7	-8.6	0	0	0	116.5	H747	H747-N749 VanDerWaalsContact C-N 3.26Å; H747-N749 PolarHBondContact O-N 2.78Å
750	T	58.2	Low	77.7	Confident	91 Å²	91	54.7 Å²	54.7	56%	0.558	29%	0.286	S	S	*	.	B	Isolated β-bridge	trans	-101.3	150.7	168	53.6	0	0	0	0	111.2	P746 H747 K748	P746-T750 CarbonylContact C-O 3.56Å; P746-T750 VanDerWaalsContact CA-O 3.23Å; P746-T750 WeakPolarHBondContact CA-O 3.38Å; P746-T750 WeakPolarHBondContact CB-O 3.27Å; H747-T750 PolarHBondContact N-O 3.06Å; H747-T750 PolarHBondContact O-N 3.41Å; H747-T750 PolarHBondContact O-OG1 3.06Å; H747-T750 VanDerWaalsContact O-OG1 3.06Å; K748-T750 PolarHBondContact O-N 3.23Å
751	V	67.1	Low	77.9	Confident	69 Å²	69	56.8 Å²	56.8	42%	0.418	30%	0.295	S	S	.	.			trans	-115.1	105.9	175.5	175.4	0	0	0	0	107.2	P720 P746	P720-V751 HydrophobicContact CG-CG1 4.42Å; P746-V751 HydrophobicContact CB-CG2 3.8Å
752	S	76.5	Confident	78.2	Confident	26 Å²	26	54.9 Å²	54.9	18%	0.182	28%	0.284	C	S	.	.			trans	-68.3	138.8	178.2	-61.5	0	0	0	0	111.7	D698 S743	D698-S752 WeakPolarHBondContact OD2-CA 3.25Å; D698-S752 PolarHBondContact OD2-OG 3.23Å; S743-S752 PolarHBondContact N-O 2.87Å
753	S	83.3	Confident	78.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	150.9	178.1	65.5	0	0	0	0	111.9	D698 P699 I741	D698-S753 VanDerWaalsContact CA-O 3.22Å; D698-S753 WeakPolarHBondContact CA-O 3.34Å; D698-S753 PolarHBondContact N-O 3.44Å; D698-S753 WeakPolarHBondContact OD1-CB 3.23Å; D698-S753 PolarHBondContact OD1-N 3.02Å; D698-S753 PolarHBondContact OD1-OG 3.21Å; P699-S753 WeakPolarHBondContact CD-OG 3.32Å; I741-S753 CarbonylContact O-C 3.56Å; I741-S753 VanDerWaalsContact O-CA 3.32Å; I741-S753 WeakPolarHBondContact O-CA 3.41Å
754	Y	87	Confident	79.2	Confident	16 Å²	16	61.7 Å²	61.7	6%	0.063	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	156.5	178.2	-52.5	-90.4	0	0	0	109.8	V695 L740 I741 G756 V835 F837	V695-Y754 HydrophobicContact CG1-CE1 4.11Å; V695-Y754 WeakPolarHBondContact CG1-OH 3.38Å; L740-Y754 CarbonylContact C-O 3.51Å; L740-Y754 VanDerWaalsContact CA-O 3.28Å; L740-Y754 WeakPolarHBondContact CA-O 3.44Å; I741-Y754 WeakPolarHBondContact CG1-O 3.38Å; I741-Y754 PolarHBondContact N-O 2.76Å; I741-Y754 PolarHBondContact O-N 3.27Å; Y754-G756 PolarHBondContact O-N 3Å; Y754-V835 HydrophobicContact CD2-CG2 4.38Å; Y754-F837 HydrophobicContact CD1-CB 4.37Å; Y754-F837 HydrophobicContact CD1-CD1 4.22Å; Y754-F837 HydrophobicContact CD1-CD2 4.28Å; Y754-F837 HydrophobicContact CD1-CG 4.06Å; Y754-F837 HydrophobicContact CG-CB 4.17Å; Y754-F837 HydrophobicContact CG-CG 4.35Å
755	F	90.7	Very high	79.9	Confident	16 Å²	16	58.2 Å²	58.2	7%	0.07	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	122.3	169.8	-69.7	-67.3	0	0	0	110.6	P699 F701 L724 L726 L740 I758 L838	P699-F755 HydrophobicContact CB-CD2 4.37Å; P699-F755 HydrophobicContact CB-CE2 3.79Å; P699-F755 HydrophobicContact CB-CZ 4.17Å; F701-F755 HydrophobicContact CZ-CE2 4.23Å; F701-F755 AromaticContact CZ-CZ 3.98Å; F701-F755 HydrophobicContact CZ-CZ 3.98Å; L724-F755 HydrophobicContact CD1-CE1 4.4Å; L724-F755 HydrophobicContact CD1-CZ 4.37Å; L726-F755 HydrophobicContact CD1-CE1 4.18Å; L726-F755 HydrophobicContact CD1-CZ 4.09Å; L726-F755 HydrophobicContact CD2-CE1 4.41Å; L726-F755 HydrophobicContact CD2-CZ 4.06Å; L740-F755 HydrophobicContact CD2-CD1 3.8Å; L740-F755 HydrophobicContact CD2-CE1 3.82Å; L740-F755 HydrophobicContact CD2-CG 4.33Å; L740-F755 HydrophobicContact CD2-CZ 4.37Å; F755-I758 HydrophobicContact CB-CD1 4.36Å; F755-I758 HydrophobicContact CB-CG1 4.32Å; F755-I758 HydrophobicContact CG-CD1 4.49Å; F755-L838 HydrophobicContact CB-CB 4.17Å; F755-L838 PolarHBondContact O-N 3.38Å
756	G	89.6	Confident	81.2	Confident	4 Å²	4	54.4 Å²	54.4	4%	0.041	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	-29.6	176.1	0	0	0	0	0	113.6	Q739 Y754 T773 L838	Q739-G756 PolarHBondContact O-N 3.01Å; Y754-G756 PolarHBondContact O-N 3Å; G756-T773 PolarHBondContact O-N 2.85Å; G756-L838 WeakPolarHBondContact O-CD1 3.35Å
757	I	95.3	Very high	82.8	Confident	55 Å²	55	50.5 Å²	50.5	28%	0.282	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	136.1	174.1	-58	176.9	0	0	0	108.4	G738 Q739 K770 V771 L935	G738-I757 CarbonylContact C-O 3.59Å; G738-I757 WeakPolarHBondContact CA-O 3.5Å; Q739-I757 HydrophobicContact CB-CB 4.38Å; Q739-I757 PolarHBondContact N-O 3.27Å; I757-K770 HydrophobicContact CG2-CB 4.43Å; I757-V771 CarbonylContact C-O 3.53Å; I757-V771 WeakPolarHBondContact CA-O 3.46Å; I757-L935 HydrophobicContact CG2-CD1 3.83Å
758	I	97	Very high	84.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.2	167.3	-58.2	-174.1	0	0	0	108.1	V736 F755 V771 V822 L838 L840	V736-I758 HydrophobicContact CG1-CG2 4.11Å; F755-I758 HydrophobicContact CB-CD1 4.36Å; F755-I758 HydrophobicContact CB-CG1 4.32Å; F755-I758 HydrophobicContact CG-CD1 4.49Å; I758-V771 PolarHBondContact N-O 2.85Å; I758-V771 PolarHBondContact O-N 3.02Å; I758-V822 HydrophobicContact CB-CG2 4.18Å; I758-V822 HydrophobicContact CD1-CG1 4.08Å; I758-V822 HydrophobicContact CD1-CG2 4.22Å; I758-V822 HydrophobicContact CG2-CG2 4.13Å; I758-L838 HydrophobicContact CD1-CB 4.23Å; I758-L838 HydrophobicContact CG1-CB 4.47Å; I758-L838 HydrophobicContact CG1-CD1 4.05Å; I758-L840 HydrophobicContact CD1-CB 3.88Å; I758-L840 HydrophobicContact CD1-CD1 3.99Å; I758-L840 HydrophobicContact CD1-CD2 4.46Å; I758-L840 HydrophobicContact CD1-CG 4.33Å; I758-L840 HydrophobicContact CG2-CD1 4.31Å
759	S	96.7	Very high	87	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	133.9	174.8	-164.4	0	0	0	0	110.1	V736 N737 V769 K770 N936	V736-S759 WeakPolarHBondContact CA-O 3.49Å; N737-S759 PolarHBondContact N-O 3.25Å; N737-S759 PolarHBondContact O-N 2.86Å; S759-V769 CarbonylContact C-O 3.56Å; S759-V769 WeakPolarHBondContact CA-O 3.49Å; S759-K770 WeakPolarHBondContact OG-CG 3.37Å; S759-N936 PolarHBondContact OG-OD1 2.79Å
760	V	96.8	Very high	89	Confident	2 Å²	2	32 Å²	32	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	119	167.7	-177.6	0	0	0	0	107	V735 V736 V769 V812 I814 V820	V735-V760 CarbonylContact O-C 3.57Å; V735-V760 WeakPolarHBondContact O-CA 3.16Å; V736-V760 HydrophobicContact CG1-CG2 4.37Å; V736-V760 HydrophobicContact CG2-CG1 4.43Å; V736-V760 HydrophobicContact CG2-CG2 4.33Å; V760-V769 PolarHBondContact N-O 2.95Å; V760-V769 PolarHBondContact O-N 2.82Å; V760-V812 HydrophobicContact CB-CG1 4.28Å; V760-V812 HydrophobicContact CG1-CB 4.48Å; V760-V812 HydrophobicContact CG1-CG1 3.97Å; V760-V812 HydrophobicContact CG2-CB 4.42Å; V760-V812 HydrophobicContact CG2-CG2 4.34Å; V760-I814 HydrophobicContact CG1-CD1 3.85Å; V760-V820 HydrophobicContact CG2-CB 4.16Å; V760-V820 HydrophobicContact CG2-CG1 3.88Å; V760-V820 HydrophobicContact CG2-CG2 4.43Å
761	Y	95.5	Very high	90.9	Very high	47 Å²	47	27.7 Å²	27.7	18%	0.184	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.2	-178.9	176.3	-126.1	0	0	0	110.5	V734 V735 Q763 V767 N936 F938	V734-Y761 WeakPolarHBondContact CA-O 3.39Å; V735-Y761 PolarHBondContact N-O 2.85Å; V735-Y761 PolarHBondContact O-N 2.95Å; Y761-Q763 HydrophobicContact CE1-CB 3.89Å; Y761-Q763 HydrophobicContact CE1-CG 4.42Å; Y761-V767 VanDerWaalsContact CD2-O 3.29Å; Y761-V767 WeakPolarHBondContact CD2-O 3.33Å; Y761-N936 HydrophobicContact CD1-CB 4.12Å; Y761-N936 HydrophobicContact CG-CB 4.14Å; Y761-F938 HydrophobicContact CD1-CE2 4.36Å; Y761-F938 HydrophobicContact CE1-CE2 4.2Å
762	H	95.1	Very high	92.2	Very high	11 Å²	11	24.7 Å²	24.7	5%	0.051	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	102	175.2	-172.7	-143.2	0	0	0	109.5	A765 G766 V767 S799 V800 I814 D815	H762-A765 PolarHBondContact O-N 2.87Å; H762-G766 PolarHBondContact O-N 2.85Å; H762-V767 PolarHBondContact N-O 2.94Å; H762-V767 PolarHBondContact O-N 2.85Å; H762-S799 PolarHBondContact CE1-OG 3Å; H762-S799 PolarHBondContact ND1-OG 3.43Å; H762-V800 HydrophobicContact CB-CG2 4.1Å; H762-I814 HydrophobicContact CB-CD1 4.17Å; H762-I814 HydrophobicContact CB-CG2 4.43Å; H762-D815 IonicContact CE1-OD2 3.33Å; H762-D815 PolarHBondContact CE1-OD2 2.91Å; H762-D815 IonicContact NE2-OD2 3.14Å
763	Q	92.6	Very high	92.9	Very high	107 Å²	107	24.8 Å²	24.8	50%	0.5	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-44.6	-173.6	-179.2	-175	0.8	0	0	113.8	G733 Y761 A765 G766 F938	G733-Q763 PolarHBondContact O-N 2.93Å; Y761-Q763 HydrophobicContact CE1-CB 3.89Å; Y761-Q763 HydrophobicContact CE1-CG 4.42Å; Q763-A765 VanDerWaalsContact C-N 3.28Å; Q763-A765 PolarHBondContact O-N 2.79Å; Q763-G766 PolarHBondContact O-N 2.9Å; Q763-F938 HydrophobicContact CB-CE2 4.07Å; Q763-F938 HydrophobicContact CB-CZ 3.95Å; Q763-F938 HydrophobicContact CG-CE2 4.5Å
764	P	91.4	Very high	93.1	Very high	95 Å²	95	30.8 Å²	30.8	62%	0.617	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-37.5	175.9	-29.9	35.1	0	0	0	115
765	A	87.5	Confident	93.3	Very high	29 Å²	29	35.6 Å²	35.6	24%	0.24	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-13.4	176.1	0	0	0	0	0	113.3	H762 Q763 V767 D798	H762-A765 PolarHBondContact O-N 2.87Å; Q763-A765 VanDerWaalsContact C-N 3.28Å; Q763-A765 PolarHBondContact O-N 2.79Å; A765-V767 HydrophobicContact CB-CB 4.23Å; A765-V767 HydrophobicContact CB-CG2 3.93Å; A765-V767 PolarHBondContact O-N 3Å; A765-D798 HydrophobicContact CB-CB 4.48Å
766	G	90.4	Very high	93.4	Very high	29 Å²	29	34.8 Å²	34.8	30%	0.299	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	3.4	-169.8	0	0	0	0	0	114.6	H762 Q763	H762-G766 PolarHBondContact O-N 2.85Å; Q763-G766 PolarHBondContact O-N 2.9Å
767	V	92.6	Very high	93.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	126.3	-172	172.7	0	0	0	0	111.1	Y761 H762 A765 V769 M778 D780 Q797 V800	Y761-V767 VanDerWaalsContact CD2-O 3.29Å; Y761-V767 WeakPolarHBondContact CD2-O 3.33Å; H762-V767 PolarHBondContact N-O 2.94Å; H762-V767 PolarHBondContact O-N 2.85Å; A765-V767 HydrophobicContact CB-CB 4.23Å; A765-V767 HydrophobicContact CB-CG2 3.93Å; A765-V767 PolarHBondContact O-N 3Å; V767-V769 HydrophobicContact CG1-CG2 4.17Å; V767-M778 HydrophobicContact CG1-CE 3.54Å; V767-M778 HydrophobicContact CG1-CG 4.26Å; V767-D780 HydrophobicContact CG2-CB 4.25Å; V767-Q797 HydrophobicContact CG2-CG 4.18Å; V767-V800 HydrophobicContact CB-CG2 4.08Å; V767-V800 HydrophobicContact CG1-CB 4.11Å; V767-V800 HydrophobicContact CG1-CG1 4.11Å; V767-V800 HydrophobicContact CG1-CG2 4.03Å
768	S	94.1	Very high	93.3	Very high	17 Å²	17	33.2 Å²	33.2	12%	0.119	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	136.3	169	62.5	0	0	0	0	111.5	M778 A779 N936	S768-M778 CarbonylContact O-C 3.48Å; S768-M778 WeakPolarHBondContact O-CA 3.32Å; S768-A779 PolarHBondContact N-O 2.97Å; S768-A779 PolarHBondContact O-N 2.91Å; S768-A779 PolarHBondContact OG-O 3.33Å; S768-N936 VanDerWaalsContact CB-ND2 3.35Å; S768-N936 WeakPolarHBondContact CB-ND2 3.36Å
769	V	96.3	Very high	93	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	108.2	179.2	-174	0	0	0	0	108.8	S759 V760 V767 V771 S777 M778 V800 I802 V812	S759-V769 CarbonylContact C-O 3.56Å; S759-V769 WeakPolarHBondContact CA-O 3.49Å; V760-V769 PolarHBondContact N-O 2.95Å; V760-V769 PolarHBondContact O-N 2.82Å; V767-V769 HydrophobicContact CG1-CG2 4.17Å; V769-V771 HydrophobicContact CG1-CG2 4.34Å; V769-S777 CarbonylContact C-O 3.57Å; V769-S777 WeakPolarHBondContact CA-O 3.33Å; V769-M778 HydrophobicContact CG2-CE 4.47Å; V769-M778 HydrophobicContact CG2-CG 4.34Å; V769-V800 HydrophobicContact CG2-CG1 4.14Å; V769-I802 HydrophobicContact CB-CD1 4.29Å; V769-I802 HydrophobicContact CG1-CD1 3.54Å; V769-I802 HydrophobicContact CG1-CG1 4.1Å; V769-I802 HydrophobicContact CG2-CD1 3.72Å; V769-I802 HydrophobicContact CG2-CG1 4.1Å; V769-V812 HydrophobicContact CB-CG2 4.34Å; V769-V812 HydrophobicContact CG1-CG2 3.85Å; V769-V812 HydrophobicContact CG2-CG1 4.26Å
770	K	96.1	Very high	92.5	Very high	57 Å²	57	35.6 Å²	35.6	25%	0.248	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	108.9	178.7	-68	-178.8	-179	-173.2	0	109.3	I757 S759 S777 L935 N936	I757-K770 HydrophobicContact CG2-CB 4.43Å; S759-K770 WeakPolarHBondContact OG-CG 3.37Å; K770-S777 PolarHBondContact N-O 3.05Å; K770-S777 PolarHBondContact O-N 2.9Å; K770-S777 PolarHBondContact O-OG 2.78Å; K770-L935 HydrophobicContact CD-CD1 4.24Å; K770-N936 WeakPolarHBondContact CE-OD1 3.12Å
771	V	97	Very high	91.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	110.5	176	-179.1	0	0	0	0	108.3	I757 I758 V769 I776 W789 V810 V822 L838	I757-V771 CarbonylContact C-O 3.53Å; I757-V771 WeakPolarHBondContact CA-O 3.46Å; I758-V771 PolarHBondContact N-O 2.85Å; I758-V771 PolarHBondContact O-N 3.02Å; V769-V771 HydrophobicContact CG1-CG2 4.34Å; V771-I776 HydrophobicContact CG1-CG1 4.25Å; V771-I776 HydrophobicContact CG2-CG2 4.4Å; V771-W789 HydrophobicContact CG1-CH2 4Å; V771-W789 HydrophobicContact CG1-CZ2 3.55Å; V771-V810 HydrophobicContact CG1-CB 4.5Å; V771-V810 HydrophobicContact CG1-CG2 4.29Å; V771-V810 HydrophobicContact CG2-CB 4.23Å; V771-V810 HydrophobicContact CG2-CG1 4.03Å; V771-V810 HydrophobicContact CG2-CG2 4.49Å; V771-V822 HydrophobicContact CB-CB 4.48Å; V771-V822 HydrophobicContact CB-CG1 4.24Å; V771-V822 HydrophobicContact CB-CG2 4.43Å; V771-V822 HydrophobicContact CG1-CB 4.06Å; V771-V822 HydrophobicContact CG1-CG1 3.63Å; V771-V822 HydrophobicContact CG2-CG2 4.4Å; V771-L838 HydrophobicContact CG1-CD1 4.47Å; V771-L838 WeakPolarHBondContact O-CD1 3.26Å
772	G	94.4	Very high	90.6	Very high	5 Å²	5	46.8 Å²	46.8	5%	0.052	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	170.7	169.6	0	0	0	0	0	112.1	D774 R775 W789	G772-D774 VanDerWaalsContact C-N 3.34Å; G772-R775 WeakPolarHBondContact CA-O 3.45Å; G772-R775 PolarHBondContact N-O 2.79Å; G772-W789 PolarHBondContact O-NE1 2.86Å
773	T	90.9	Very high	90	Very high	29 Å²	29	46.9 Å²	46.9	18%	0.178	27%	0.266	C	S	.	.	S	Bend	trans	-71.2	-27.9	179.5	52.8	0	0	0	0	113.5	G756 W789 L824 D836 L838	G756-T773 PolarHBondContact O-N 2.85Å; T773-W789 PolarHBondContact O-NE1 2.83Å; T773-L824 HydrophobicContact CG2-CD1 4.16Å; T773-D836 HydrophobicContact CG2-CB 4.3Å; T773-L838 HydrophobicContact CG2-CD1 4.5Å; T773-L838 HydrophobicContact CG2-CD2 3.78Å; T773-L838 HydrophobicContact CG2-CG 3.75Å
774	D	87.5	Confident	89.7	Confident	126 Å²	126	45 Å²	45	67%	0.674	26%	0.264	S	S	*	.	S	Bend	trans	-91	-43.1	175.7	68.1	-39.9	0	0	0	112.5	G772	G772-D774 VanDerWaalsContact C-N 3.34Å
775	R	90.9	Very high	89.6	Confident	116 Å²	116	40.5 Å²	40.5	44%	0.438	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	144.4	-166.1	-161.4	-179.9	72.5	162.4	-0.7	112.4	G772	G772-R775 WeakPolarHBondContact CA-O 3.45Å; G772-R775 PolarHBondContact N-O 2.79Å
776	I	94.1	Very high	89.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142.8	172.1	-60.4	150.4	0	0	0	107.4	V771 S786 F787 W789 I804 V810	V771-I776 HydrophobicContact CG1-CG1 4.25Å; V771-I776 HydrophobicContact CG2-CG2 4.4Å; I776-S786 CarbonylContact O-C 3.59Å; I776-S786 VanDerWaalsContact O-CA 3.26Å; I776-S786 WeakPolarHBondContact O-CA 3.15Å; I776-S786 WeakPolarHBondContact O-CB 3.45Å; I776-F787 HydrophobicContact CB-CB 4.24Å; I776-F787 PolarHBondContact N-O 2.88Å; I776-F787 PolarHBondContact O-N 2.84Å; I776-W789 HydrophobicContact CD1-CD2 3.88Å; I776-W789 HydrophobicContact CD1-CE3 4.21Å; I776-W789 HydrophobicContact CD1-CG 4.26Å; I776-W789 HydrophobicContact CD1-CZ2 4.36Å; I776-W789 HydrophobicContact CG1-CD2 4.44Å; I776-W789 HydrophobicContact CG1-CZ2 4.28Å; I776-I804 HydrophobicContact CD1-CD1 3.78Å; I776-I804 HydrophobicContact CD1-CG1 4.09Å; I776-I804 HydrophobicContact CD1-CG2 3.81Å; I776-I804 HydrophobicContact CG2-CD1 4.34Å; I776-V810 HydrophobicContact CD1-CG2 3.39Å; I776-V810 HydrophobicContact CG1-CG2 3.91Å
777	S	92.2	Very high	89.7	Confident	25 Å²	25	38.1 Å²	38.1	18%	0.175	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	146.1	179.3	49.2	0	0	0	0	112.7	V769 K770 H785	V769-S777 CarbonylContact C-O 3.57Å; V769-S777 WeakPolarHBondContact CA-O 3.33Å; K770-S777 PolarHBondContact N-O 3.05Å; K770-S777 PolarHBondContact O-N 2.9Å; K770-S777 PolarHBondContact O-OG 2.78Å; S777-H785 CarbonylContact C-O 3.6Å; S777-H785 VanDerWaalsContact CA-O 3.3Å; S777-H785 WeakPolarHBondContact CA-O 3.31Å
778	M	91.1	Very high	89.6	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.5	-176.8	-173.7	175.9	-157.4	0	0	108.8	L545 V767 S768 V769 S784 H785 F787 I795 Q797 V800 I802	L545-M778 HydrophobicContact CD1-SD 3.65Å; V767-M778 HydrophobicContact CG1-CE 3.54Å; V767-M778 HydrophobicContact CG1-CG 4.26Å; S768-M778 CarbonylContact O-C 3.48Å; S768-M778 WeakPolarHBondContact O-CA 3.32Å; V769-M778 HydrophobicContact CG2-CE 4.47Å; V769-M778 HydrophobicContact CG2-CG 4.34Å; M778-S784 WeakPolarHBondContact O-CA 3.27Å; M778-H785 PolarHBondContact N-O 2.87Å; M778-H785 PolarHBondContact O-N 2.84Å; M778-F787 HydrophobicContact CB-CE2 4.27Å; M778-I795 HydrophobicContact SD-CG2 4.02Å; M778-Q797 HydrophobicContact CE-CB 3.74Å; M778-Q797 HydrophobicContact CE-CG 4.45Å; M778-V800 HydrophobicContact CE-CB 4.29Å; M778-V800 HydrophobicContact CE-CG1 4.09Å; M778-I802 HydrophobicContact CB-CD1 4.06Å; M778-I802 HydrophobicContact CE-CD1 3.96Å; M778-I802 HydrophobicContact CE-CG1 4.34Å; M778-I802 HydrophobicContact CG-CD1 4Å; M778-I802 HydrophobicContact SD-CD1 3.45Å; M778-I802 WeakPolarHBondContact SD-CD1 3.45Å; M778-I802 HydrophobicContact SD-CG1 4.35Å
779	A	90.4	Very high	89.4	Confident	25 Å²	25	39 Å²	39	21%	0.207	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	138.8	-179.3	0	0	0	0	0	112.1	S768 S783	S768-A779 PolarHBondContact N-O 2.97Å; S768-A779 PolarHBondContact O-N 2.91Å; S768-A779 PolarHBondContact OG-O 3.33Å; A779-S783 VanDerWaalsContact CA-O 3.26Å; A779-S783 WeakPolarHBondContact CA-O 3.34Å; A779-S783 WeakPolarHBondContact CB-O 3.32Å
780	D	85.6	Confident	88.9	Confident	25 Å²	25	40.2 Å²	40.2	13%	0.134	23%	0.229	C	C	.	.			trans	-115.3	18.8	-175.6	70.1	0.8	0	0	0	113.4	S544 V767 R782 S783 Q797	S544-D780 PolarHBondContact OG-OD2 3.41Å; V767-D780 HydrophobicContact CG2-CB 4.25Å; D780-R782 PolarHBondContact O-N 3.33Å; D780-R782 PolarHBondContact OD1-N 2.84Å; D780-R782 VanDerWaalsContact OD1-N 3.08Å; D780-S783 VanDerWaalsContact CG-OG 3.23Å; D780-S783 PolarHBondContact N-O 2.94Å; D780-S783 PolarHBondContact OD1-N 3.23Å; D780-S783 PolarHBondContact OD1-OG 3.3Å; D780-S783 PolarHBondContact OD2-OG 2.86Å; D780-Q797 VanDerWaalsContact CB-NE2 3.3Å; D780-Q797 PolarHBondContact OD2-NE2 2.77Å
781	G	76.8	Confident	88.3	Confident	81 Å²	81	37.8 Å²	37.8	84%	0.835	22%	0.22	S	C	*	.	S	Bend	trans	77.4	-13.2	-177.1	0	0	0	0	0	115.1
782	R	76.6	Confident	88.1	Confident	202 Å²	202	39.5 Å²	39.5	76%	0.762	23%	0.23	S	C	*	.	S	Bend	trans	-109.5	-42.6	170.6	-56.7	-173	-171.7	-163.7	4.8	111.8	D780	D780-R782 PolarHBondContact O-N 3.33Å; D780-R782 PolarHBondContact OD1-N 2.84Å; D780-R782 VanDerWaalsContact OD1-N 3.08Å
783	S	81.6	Confident	88	Confident	14 Å²	14	39.6 Å²	39.6	10%	0.098	23%	0.231	C	C	.	.			trans	-114.6	157	-179.3	68.9	0	0	0	0	111.2	A779 D780 H785	A779-S783 VanDerWaalsContact CA-O 3.26Å; A779-S783 WeakPolarHBondContact CA-O 3.34Å; A779-S783 WeakPolarHBondContact CB-O 3.32Å; D780-S783 VanDerWaalsContact CG-OG 3.23Å; D780-S783 PolarHBondContact N-O 2.94Å; D780-S783 PolarHBondContact OD1-N 3.23Å; D780-S783 PolarHBondContact OD1-OG 3.3Å; D780-S783 PolarHBondContact OD2-OG 2.86Å; S783-H785 PolarHBondContact OG-NE2 2.91Å
784	S	87.1	Confident	88.2	Confident	66 Å²	66	40.3 Å²	40.3	46%	0.462	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	130.8	166.8	-177.8	0	0	0	0	108.9	S298 M778	S298-S784 PolarHBondContact N-O 2.98Å; S298-S784 PolarHBondContact OG-N 2.87Å; S298-S784 PolarHBondContact OG-O 3.18Å; M778-S784 WeakPolarHBondContact O-CA 3.27Å
785	H	89	Confident	88.5	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.3	179.8	-63.4	-88.2	0	0	0	108.6	L297 S298 S777 M778 S783 F787	L297-H785 HydrophobicContact CD2-CB 4.28Å; L297-H785 WeakPolarHBondContact CD2-ND1 3.29Å; S298-H785 PolarHBondContact N-CE1 3.45Å; S777-H785 CarbonylContact C-O 3.6Å; S777-H785 VanDerWaalsContact CA-O 3.3Å; S777-H785 WeakPolarHBondContact CA-O 3.31Å; M778-H785 PolarHBondContact N-O 2.87Å; M778-H785 PolarHBondContact O-N 2.84Å; S783-H785 PolarHBondContact OG-NE2 2.91Å; H785-F787 HydrophobicContact CB-CE2 3.85Å; H785-F787 HydrophobicContact CB-CZ 3.89Å
786	S	89.3	Confident	88.5	Confident	6 Å²	6	31.2 Å²	31.2	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	136.8	174.4	82.2	0	0	0	0	113.1	N277 N296 I776	N277-S786 PolarHBondContact ND2-O 3.16Å; N277-S786 VanDerWaalsContact ND2-O 3.09Å; N296-S786 WeakPolarHBondContact CB-OG 3.3Å; N296-S786 PolarHBondContact O-N 3.39Å; I776-S786 CarbonylContact O-C 3.59Å; I776-S786 VanDerWaalsContact O-CA 3.26Å; I776-S786 WeakPolarHBondContact O-CA 3.15Å; I776-S786 WeakPolarHBondContact O-CB 3.45Å
787	F	91.1	Very high	88.2	Confident	3 Å²	3	31.4 Å²	31.4	1%	0.013	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.1	-173.1	-55	-78.5	0	0	0	111.2	N277 L297 L545 L547 I776 M778 H785 I795 I804	N277-F787 HydrophobicContact CB-CD1 4.47Å; N277-F787 VanDerWaalsContact OD1-CA 3.26Å; N277-F787 WeakPolarHBondContact OD1-CA 3.33Å; L297-F787 HydrophobicContact CD2-CE1 4.2Å; L297-F787 HydrophobicContact CD2-CZ 4.44Å; L545-F787 HydrophobicContact CD1-CZ 4.28Å; L545-F787 HydrophobicContact CD2-CZ 4.42Å; L547-F787 HydrophobicContact CD2-CE1 3.74Å; L547-F787 HydrophobicContact CD2-CZ 4.08Å; I776-F787 HydrophobicContact CB-CB 4.24Å; I776-F787 PolarHBondContact N-O 2.88Å; I776-F787 PolarHBondContact O-N 2.84Å; M778-F787 HydrophobicContact CB-CE2 4.27Å; H785-F787 HydrophobicContact CB-CE2 3.85Å; H785-F787 HydrophobicContact CB-CZ 3.89Å; F787-I795 HydrophobicContact CD1-CD1 3.79Å; F787-I795 HydrophobicContact CD2-CD1 3.73Å; F787-I795 HydrophobicContact CE1-CD1 3.84Å; F787-I795 HydrophobicContact CE1-CG1 4.37Å; F787-I795 HydrophobicContact CE2-CD1 3.78Å; F787-I795 HydrophobicContact CE2-CG2 4.49Å; F787-I795 HydrophobicContact CG-CD1 3.74Å; F787-I795 HydrophobicContact CZ-CD1 3.83Å; F787-I795 HydrophobicContact CZ-CG1 4.36Å; F787-I795 HydrophobicContact CZ-CG2 4.3Å; F787-I804 HydrophobicContact CB-CD1 3.63Å; F787-I804 HydrophobicContact CG-CD1 4.19Å
788	T	89.5	Confident	87.8	Confident	33 Å²	33	35.6 Å²	35.6	20%	0.202	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	145.7	179.2	56.2	0	0	0	0	111.7	D275 S276 N277 G790	D275-T788 VanDerWaalsContact O-CB 3.32Å; D275-T788 WeakPolarHBondContact O-CB 3.32Å; D275-T788 PolarHBondContact O-OG1 3.2Å; S276-T788 WeakPolarHBondContact CA-OG1 3.49Å; N277-T788 PolarHBondContact N-OG1 2.87Å; N277-T788 PolarHBondContact OD1-N 3.45Å; N277-T788 PolarHBondContact OD1-OG1 3.49Å; N277-T788 VanDerWaalsContact OD1-OG1 3.12Å; T788-G790 PolarHBondContact O-N 2.87Å; T788-G790 VanDerWaalsContact O-N 3.09Å
789	W	89.3	Confident	87.6	Confident	3 Å²	3	37.2 Å²	37.2	1%	0.011	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-6.1	165.6	-68.9	101.7	0	0	0	114.7	V771 G772 T773 I776 A791 N807 V810 L824 L838	V771-W789 HydrophobicContact CG1-CH2 4Å; V771-W789 HydrophobicContact CG1-CZ2 3.55Å; G772-W789 PolarHBondContact O-NE1 2.86Å; T773-W789 PolarHBondContact O-NE1 2.83Å; I776-W789 HydrophobicContact CD1-CD2 3.88Å; I776-W789 HydrophobicContact CD1-CE3 4.21Å; I776-W789 HydrophobicContact CD1-CG 4.26Å; I776-W789 HydrophobicContact CD1-CZ2 4.36Å; I776-W789 HydrophobicContact CG1-CD2 4.44Å; I776-W789 HydrophobicContact CG1-CZ2 4.28Å; W789-A791 VanDerWaalsContact C-N 3.34Å; W789-A791 PolarHBondContact O-N 3.39Å; W789-N807 PolarHBondContact O-N 3.01Å; W789-N807 PolarHBondContact O-OD1 3.21Å; W789-V810 HydrophobicContact CE3-CG2 4.37Å; W789-V810 HydrophobicContact CH2-CB 4.44Å; W789-V810 HydrophobicContact CH2-CG2 3.63Å; W789-V810 HydrophobicContact CZ2-CG2 4.24Å; W789-V810 HydrophobicContact CZ3-CG2 3.7Å; W789-L824 HydrophobicContact CB-CD2 4.4Å; W789-L824 HydrophobicContact CD2-CB 4.42Å; W789-L824 HydrophobicContact CD2-CD2 3.69Å; W789-L824 HydrophobicContact CE3-CB 4.14Å; W789-L824 HydrophobicContact CE3-CD2 4.01Å; W789-L824 HydrophobicContact CG-CD2 3.88Å; W789-L824 HydrophobicContact CH2-CB 3.69Å; W789-L824 HydrophobicContact CZ2-CB 3.99Å; W789-L824 HydrophobicContact CZ2-CD1 4.25Å; W789-L824 HydrophobicContact CZ2-CD2 4.4Å; W789-L824 HydrophobicContact CZ2-CG 4.44Å; W789-L824 HydrophobicContact CZ3-CB 3.77Å; W789-L824 HydrophobicContact CZ3-CD2 4.48Å; W789-L838 HydrophobicContact CZ2-CD2 4.17Å
790	G	85.4	Confident	87.7	Confident	26 Å²	26	36.2 Å²	36.2	27%	0.268	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.3	-172.5	0	0	0	0	0	116.4	T788 K806	T788-G790 PolarHBondContact O-N 2.87Å; T788-G790 VanDerWaalsContact O-N 3.09Å; G790-K806 WeakPolarHBondContact O-CE 3.45Å
791	A	84.6	Confident	88.2	Confident	7 Å²	7	40 Å²	40	6%	0.058	23%	0.232	C	C	.	.	S	Bend	trans	-137.2	166.8	-178.3	0	0	0	0	0	111.8	A278 W789	A278-A791 HydrophobicContact CB-CB 3.59Å; W789-A791 VanDerWaalsContact C-N 3.34Å; W789-A791 PolarHBondContact O-N 3.39Å
792	T	93	Very high	89	Confident	36 Å²	36	36.1 Å²	36.1	22%	0.221	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	138.8	168.3	-67.6	0	0	0	0	108.7	E550 I804 K806	E550-T792 HydrophobicContact CB-CG2 4.31Å; E550-T792 PolarHBondContact N-O 3.45Å; E550-T792 WeakPolarHBondContact OE2-CG2 3.22Å; T792-I804 CarbonylContact C-O 3.59Å; T792-I804 VanDerWaalsContact CA-O 3.26Å; T792-I804 WeakPolarHBondContact CA-O 3.44Å; T792-I804 WeakPolarHBondContact CG2-O 3.44Å; T792-K806 WeakPolarHBondContact OG1-CB 3.25Å; T792-K806 PolarHBondContact OG1-N 3.44Å; T792-K806 VanDerWaalsContact OG1-N 3.16Å
793	A	92.9	Very high	90	Very high	7 Å²	7	28.2 Å²	28.2	6%	0.058	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	131.2	-174.8	0	0	0	0	0	112.3	N548 L549 I795 S803 I804	N548-A793 CarbonylContact O-C 3.58Å; N548-A793 WeakPolarHBondContact O-CA 3.43Å; L549-A793 HydrophobicContact CD2-CB 3.5Å; A793-I795 HydrophobicContact CB-CD1 4.29Å; A793-I795 HydrophobicContact CB-CG1 4.3Å; A793-S803 CarbonylContact O-C 3.53Å; A793-S803 WeakPolarHBondContact O-CA 3.26Å; A793-I804 HydrophobicContact CB-CB 4.24Å; A793-I804 HydrophobicContact CB-CD1 4.26Å; A793-I804 HydrophobicContact CB-CG1 4.48Å; A793-I804 PolarHBondContact N-O 3.02Å; A793-I804 PolarHBondContact O-N 3.01Å
794	D	94.2	Very high	90.6	Very high	44 Å²	44	27.6 Å²	27.6	24%	0.235	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.5	163.5	-97.2	-49.2	0	0	0	109.5	N548 R801 S803	N548-D794 HydrophobicContact CB-CB 4.31Å; N548-D794 PolarHBondContact N-O 3.26Å; N548-D794 PolarHBondContact O-N 2.89Å; D794-R801 IonicContact OD1-CZ 2.7Å; D794-R801 VanDerWaalsContact OD1-CZ 3.29Å; D794-R801 IonicContact OD1-NE 2.58Å; D794-R801 PolarHBondContact OD1-NE 3.38Å; D794-R801 IonicContact OD1-NH2 2.76Å; D794-R801 PolarHBondContact OD1-NH2 2.72Å; D794-R801 IonicContact OD2-CZ 3.09Å; D794-R801 IonicContact OD2-NH2 2.76Å; D794-R801 PolarHBondContact OD2-NH2 3.43Å; D794-S803 VanDerWaalsContact OD1-CB 3.27Å; D794-S803 WeakPolarHBondContact OD1-CB 3.34Å; D794-S803 PolarHBondContact OD1-OG 2.86Å
795	I	93.1	Very high	90.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.1	-172.3	-59.6	159.5	0	0	0	107.3	L545 Q546 L547 M778 F787 A793 R801 I802 I804	L545-I795 HydrophobicContact CD1-CG2 3.9Å; L545-I795 HydrophobicContact CD2-CG2 3.73Å; L545-I795 HydrophobicContact CG-CG2 3.77Å; Q546-I795 WeakPolarHBondContact O-CA 3.22Å; L547-I795 HydrophobicContact CD2-CG1 3.95Å; L547-I795 HydrophobicContact CD2-CG2 4.42Å; M778-I795 HydrophobicContact SD-CG2 4.02Å; F787-I795 HydrophobicContact CD1-CD1 3.79Å; F787-I795 HydrophobicContact CD2-CD1 3.73Å; F787-I795 HydrophobicContact CE1-CD1 3.84Å; F787-I795 HydrophobicContact CE1-CG1 4.37Å; F787-I795 HydrophobicContact CE2-CD1 3.78Å; F787-I795 HydrophobicContact CE2-CG2 4.49Å; F787-I795 HydrophobicContact CG-CD1 3.74Å; F787-I795 HydrophobicContact CZ-CD1 3.83Å; F787-I795 HydrophobicContact CZ-CG1 4.36Å; F787-I795 HydrophobicContact CZ-CG2 4.3Å; A793-I795 HydrophobicContact CB-CD1 4.29Å; A793-I795 HydrophobicContact CB-CG1 4.3Å; I795-R801 CarbonylContact O-C 3.59Å; I795-R801 VanDerWaalsContact O-CA 3.29Å; I795-R801 WeakPolarHBondContact O-CA 3.48Å; I795-I802 HydrophobicContact CB-CB 4.21Å; I795-I802 HydrophobicContact CD1-CB 4.48Å; I795-I802 PolarHBondContact N-O 2.91Å; I795-I802 PolarHBondContact O-N 3.14Å; I795-I804 HydrophobicContact CD1-CD1 3.62Å; I795-I804 HydrophobicContact CD1-CG1 4.27Å
796	T	90.9	Very high	91	Very high	51 Å²	51	30 Å²	30	31%	0.313	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130	178.6	-53.3	0	0	0	0	110.5	L545 Q546	L545-T796 CarbonylContact C-O 3.52Å; L545-T796 WeakPolarHBondContact CA-O 3.41Å; Q546-T796 PolarHBondContact N-O 3.06Å; Q546-T796 PolarHBondContact O-N 3.47Å
797	Q	88	Confident	90.9	Very high	3 Å²	3	32.5 Å²	32.5	1%	0.014	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	128.1	168.9	163.6	168.9	0.3	0	0	108.8	S544 L545 V767 M778 D780 S799 V800	S544-Q797 WeakPolarHBondContact O-CG 3.29Å; L545-Q797 HydrophobicContact CB-CB 4.26Å; L545-Q797 HydrophobicContact CG-CB 4.42Å; V767-Q797 HydrophobicContact CG2-CG 4.18Å; M778-Q797 HydrophobicContact CE-CB 3.74Å; M778-Q797 HydrophobicContact CE-CG 4.45Å; D780-Q797 VanDerWaalsContact CB-NE2 3.3Å; D780-Q797 PolarHBondContact OD2-NE2 2.77Å; Q797-S799 PolarHBondContact O-N 3.26Å; Q797-V800 PolarHBondContact N-O 2.99Å; Q797-V800 CarbonylContact O-C 3.5Å; Q797-V800 WeakPolarHBondContact O-CA 3.33Å; Q797-V800 PolarHBondContact O-N 2.84Å
798	D	84	Confident	90.9	Very high	113 Å²	113	33.3 Å²	33.3	60%	0.604	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	-122.9	179.2	-54.3	-55.6	0	0	0	111.1	A765	A765-D798 HydrophobicContact CB-CB 4.48Å
799	S	87.1	Confident	91.1	Very high	36 Å²	36	34.2 Å²	34.2	25%	0.252	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	4.5	174.1	75.2	0	0	0	0	115.2	H762 Q797 D815	H762-S799 PolarHBondContact CE1-OG 3Å; H762-S799 PolarHBondContact ND1-OG 3.43Å; Q797-S799 PolarHBondContact O-N 3.26Å; S799-D815 VanDerWaalsContact CB-CG 3.4Å; S799-D815 WeakPolarHBondContact CB-OD1 3.23Å; S799-D815 VanDerWaalsContact CB-OD2 3.23Å; S799-D815 WeakPolarHBondContact CB-OD2 3.17Å; S799-D815 PolarHBondContact O-N 2.88Å; S799-D815 PolarHBondContact OG-OD2 3.42Å
800	V	93.1	Very high	91.4	Very high	3 Å²	3	34 Å²	34	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.8	-175.7	-174.6	0	0	0	0	110.9	H762 V767 V769 M778 Q797 V812 T813 I814	H762-V800 HydrophobicContact CB-CG2 4.1Å; V767-V800 HydrophobicContact CB-CG2 4.08Å; V767-V800 HydrophobicContact CG1-CB 4.11Å; V767-V800 HydrophobicContact CG1-CG1 4.11Å; V767-V800 HydrophobicContact CG1-CG2 4.03Å; V769-V800 HydrophobicContact CG2-CG1 4.14Å; M778-V800 HydrophobicContact CE-CB 4.29Å; M778-V800 HydrophobicContact CE-CG1 4.09Å; Q797-V800 PolarHBondContact N-O 2.99Å; Q797-V800 CarbonylContact O-C 3.5Å; Q797-V800 WeakPolarHBondContact O-CA 3.33Å; Q797-V800 PolarHBondContact O-N 2.84Å; V800-V812 HydrophobicContact CG1-CG1 4.01Å; V800-T813 WeakPolarHBondContact CA-O 3.34Å; V800-I814 HydrophobicContact CG2-CG1 4.47Å
801	R	94.9	Very high	91.9	Very high	105 Å²	105	34 Å²	34	40%	0.396	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.4	170.1	-179.8	174.9	172.8	177.3	-3	110.4	D794 I795 V812 T813	D794-R801 IonicContact OD1-CZ 2.7Å; D794-R801 VanDerWaalsContact OD1-CZ 3.29Å; D794-R801 IonicContact OD1-NE 2.58Å; D794-R801 PolarHBondContact OD1-NE 3.38Å; D794-R801 IonicContact OD1-NH2 2.76Å; D794-R801 PolarHBondContact OD1-NH2 2.72Å; D794-R801 IonicContact OD2-CZ 3.09Å; D794-R801 IonicContact OD2-NH2 2.76Å; D794-R801 PolarHBondContact OD2-NH2 3.43Å; I795-R801 CarbonylContact O-C 3.59Å; I795-R801 VanDerWaalsContact O-CA 3.29Å; I795-R801 WeakPolarHBondContact O-CA 3.48Å; R801-V812 CarbonylContact O-C 3.6Å; R801-V812 WeakPolarHBondContact O-CA 3.46Å; R801-T813 PolarHBondContact N-O 2.79Å; R801-T813 PolarHBondContact O-N 3.41Å
802	I	95.2	Very high	92.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.2	170.5	-49.3	171.6	0	0	0	107.5	V769 M778 I795 I804 V810 T811	V769-I802 HydrophobicContact CB-CD1 4.29Å; V769-I802 HydrophobicContact CG1-CD1 3.54Å; V769-I802 HydrophobicContact CG1-CG1 4.1Å; V769-I802 HydrophobicContact CG2-CD1 3.72Å; V769-I802 HydrophobicContact CG2-CG1 4.1Å; M778-I802 HydrophobicContact CB-CD1 4.06Å; M778-I802 HydrophobicContact CE-CD1 3.96Å; M778-I802 HydrophobicContact CE-CG1 4.34Å; M778-I802 HydrophobicContact CG-CD1 4Å; M778-I802 HydrophobicContact SD-CD1 3.45Å; M778-I802 WeakPolarHBondContact SD-CD1 3.45Å; M778-I802 HydrophobicContact SD-CG1 4.35Å; I795-I802 HydrophobicContact CB-CB 4.21Å; I795-I802 HydrophobicContact CD1-CB 4.48Å; I795-I802 PolarHBondContact N-O 2.91Å; I795-I802 PolarHBondContact O-N 3.14Å; I802-I804 HydrophobicContact CG2-CG1 3.97Å; I802-V810 HydrophobicContact CG2-CG1 3.42Å; I802-V810 VanDerWaalsContact CG2-CG1 3.42Å; I802-T811 WeakPolarHBondContact CA-O 3.44Å
803	S	96.4	Very high	92.7	Very high	35 Å²	35	33 Å²	33	25%	0.245	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	110.3	172.8	-154.1	0	0	0	0	108.9	A793 D794 V810 T811	A793-S803 CarbonylContact O-C 3.53Å; A793-S803 WeakPolarHBondContact O-CA 3.26Å; D794-S803 VanDerWaalsContact OD1-CB 3.27Å; D794-S803 WeakPolarHBondContact OD1-CB 3.34Å; D794-S803 PolarHBondContact OD1-OG 2.86Å; S803-V810 CarbonylContact O-C 3.55Å; S803-V810 WeakPolarHBondContact O-CA 3.46Å; S803-T811 PolarHBondContact N-O 2.86Å; S803-T811 PolarHBondContact O-N 2.81Å
804	I	95.2	Very high	92.8	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124	-179.4	-52	176.3	0	0	0	107.8	I776 F787 T792 A793 I795 I802 V810	I776-I804 HydrophobicContact CD1-CD1 3.78Å; I776-I804 HydrophobicContact CD1-CG1 4.09Å; I776-I804 HydrophobicContact CD1-CG2 3.81Å; I776-I804 HydrophobicContact CG2-CD1 4.34Å; F787-I804 HydrophobicContact CB-CD1 3.63Å; F787-I804 HydrophobicContact CG-CD1 4.19Å; T792-I804 CarbonylContact C-O 3.59Å; T792-I804 VanDerWaalsContact CA-O 3.26Å; T792-I804 WeakPolarHBondContact CA-O 3.44Å; T792-I804 WeakPolarHBondContact CG2-O 3.44Å; A793-I804 HydrophobicContact CB-CB 4.24Å; A793-I804 HydrophobicContact CB-CD1 4.26Å; A793-I804 HydrophobicContact CB-CG1 4.48Å; A793-I804 PolarHBondContact N-O 3.02Å; A793-I804 PolarHBondContact O-N 3.01Å; I795-I804 HydrophobicContact CD1-CD1 3.62Å; I795-I804 HydrophobicContact CD1-CG1 4.27Å; I802-I804 HydrophobicContact CG2-CG1 3.97Å; I804-V810 HydrophobicContact CB-CG2 4.49Å; I804-V810 HydrophobicContact CG1-CG2 4.19Å; I804-V810 HydrophobicContact CG2-CG2 4.23Å
805	V	92.8	Very high	92.6	Very high	50 Å²	50	34.9 Å²	34.9	30%	0.303	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.2	172.4	-177.8	0	0	0	0	109.2	N807 S808 H809	V805-N807 PolarHBondContact O-N 3.21Å; V805-S808 WeakPolarHBondContact O-CA 3.43Å; V805-S808 WeakPolarHBondContact O-CB 3.27Å; V805-S808 PolarHBondContact O-N 2.69Å; V805-H809 PolarHBondContact N-O 2.85Å; V805-H809 PolarHBondContact O-N 2.89Å
806	K	90.2	Very high	92.4	Very high	68 Å²	68	41.8 Å²	41.8	30%	0.296	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.2	119.5	-174.2	-177.2	173.8	177.5	-170.1	0	113.5	E552 G790 T792 S808	E552-K806 VanDerWaalsContact OE1-CD 3.32Å; E552-K806 WeakPolarHBondContact OE1-CD 3.3Å; E552-K806 WeakPolarHBondContact OE1-CE 3.45Å; E552-K806 IonicContact OE1-NZ 2.69Å; E552-K806 PolarHBondContact OE1-NZ 3.4Å; G790-K806 WeakPolarHBondContact O-CE 3.45Å; T792-K806 WeakPolarHBondContact OG1-CB 3.25Å; T792-K806 PolarHBondContact OG1-N 3.44Å; T792-K806 VanDerWaalsContact OG1-N 3.16Å; K806-S808 PolarHBondContact O-N 2.97Å
807	N	88	Confident	92.4	Very high	57 Å²	57	41 Å²	41	31%	0.305	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	25.2	-178.3	-57.1	-64.2	0	0	0	114.8	W789 V805 R826 R904	W789-N807 PolarHBondContact O-N 3.01Å; W789-N807 PolarHBondContact O-OD1 3.21Å; V805-N807 PolarHBondContact O-N 3.21Å; N807-R826 PolarHBondContact OD1-NH1 3.34Å; N807-R826 PolarHBondContact OD1-NH2 2.76Å; N807-R904 PolarHBondContact O-NH1 2.68Å; N807-R904 PolarHBondContact O-NH2 2.72Å
808	S	90.5	Very high	92.7	Very high	21 Å²	21	40.9 Å²	40.9	15%	0.147	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-77.7	-167.5	-166	0	0	0	0	113.7	V805 K806 L824 R904	V805-S808 WeakPolarHBondContact O-CA 3.43Å; V805-S808 WeakPolarHBondContact O-CB 3.27Å; V805-S808 PolarHBondContact O-N 2.69Å; K806-S808 PolarHBondContact O-N 2.97Å; S808-L824 PolarHBondContact O-N 2.91Å; S808-R904 PolarHBondContact O-NH2 3.32Å; S808-R904 PolarHBondContact OG-NH1 2.87Å
809	H	93.4	Very high	93.3	Very high	51 Å²	51	40.1 Å²	40.1	24%	0.236	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	163.6	-176.2	61.6	-88.6	0	0	0	110.9	V805 T821 V822 L823	V805-H809 PolarHBondContact N-O 2.85Å; V805-H809 PolarHBondContact O-N 2.89Å; H809-T821 HydrophobicContact CB-CG2 4.18Å; H809-V822 CarbonylContact C-O 3.59Å; H809-V822 WeakPolarHBondContact CA-O 3.35Å; H809-V822 VanDerWaalsContact CB-O 3.29Å; H809-V822 WeakPolarHBondContact CB-O 3.43Å; H809-L823 HydrophobicContact CB-CD2 3.77Å
810	V	96.6	Very high	93.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127	171.3	176.9	0	0	0	0	108.2	V771 I776 W789 I802 S803 I804 V812 T821 V822	V771-V810 HydrophobicContact CG1-CB 4.5Å; V771-V810 HydrophobicContact CG1-CG2 4.29Å; V771-V810 HydrophobicContact CG2-CB 4.23Å; V771-V810 HydrophobicContact CG2-CG1 4.03Å; V771-V810 HydrophobicContact CG2-CG2 4.49Å; I776-V810 HydrophobicContact CD1-CG2 3.39Å; I776-V810 HydrophobicContact CG1-CG2 3.91Å; W789-V810 HydrophobicContact CE3-CG2 4.37Å; W789-V810 HydrophobicContact CH2-CB 4.44Å; W789-V810 HydrophobicContact CH2-CG2 3.63Å; W789-V810 HydrophobicContact CZ2-CG2 4.24Å; W789-V810 HydrophobicContact CZ3-CG2 3.7Å; I802-V810 HydrophobicContact CG2-CG1 3.42Å; I802-V810 VanDerWaalsContact CG2-CG1 3.42Å; S803-V810 CarbonylContact O-C 3.55Å; S803-V810 WeakPolarHBondContact O-CA 3.46Å; I804-V810 HydrophobicContact CB-CG2 4.49Å; I804-V810 HydrophobicContact CG1-CG2 4.19Å; I804-V810 HydrophobicContact CG2-CG2 4.23Å; V810-V812 HydrophobicContact CG1-CG2 4.18Å; V810-T821 CarbonylContact O-C 3.58Å; V810-T821 WeakPolarHBondContact O-CA 3.16Å; V810-V822 PolarHBondContact N-O 2.88Å; V810-V822 PolarHBondContact O-N 2.99Å
811	T	96.8	Very high	93.8	Very high	25 Å²	25	39.3 Å²	39.3	15%	0.153	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117.8	169	-62.2	0	0	0	0	109.1	I802 S803 V820 T821	I802-T811 WeakPolarHBondContact CA-O 3.44Å; S803-T811 PolarHBondContact N-O 2.86Å; S803-T811 PolarHBondContact O-N 2.81Å; T811-V820 WeakPolarHBondContact CA-O 3.43Å; T811-T821 PolarHBondContact OG1-OG1 2.85Å
812	V	97.1	Very high	93.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	127	169.7	-172.6	0	0	0	0	107.9	V760 V769 V800 R801 V810 R819 V820	V760-V812 HydrophobicContact CB-CG1 4.28Å; V760-V812 HydrophobicContact CG1-CB 4.48Å; V760-V812 HydrophobicContact CG1-CG1 3.97Å; V760-V812 HydrophobicContact CG2-CB 4.42Å; V760-V812 HydrophobicContact CG2-CG2 4.34Å; V769-V812 HydrophobicContact CB-CG2 4.34Å; V769-V812 HydrophobicContact CG1-CG2 3.85Å; V769-V812 HydrophobicContact CG2-CG1 4.26Å; V800-V812 HydrophobicContact CG1-CG1 4.01Å; R801-V812 CarbonylContact O-C 3.6Å; R801-V812 WeakPolarHBondContact O-CA 3.46Å; V810-V812 HydrophobicContact CG1-CG2 4.18Å; V812-R819 CarbonylContact O-C 3.57Å; V812-R819 WeakPolarHBondContact O-CA 3.45Å; V812-V820 PolarHBondContact N-O 3.04Å; V812-V820 PolarHBondContact O-N 2.94Å
813	T	96.3	Very high	93.7	Very high	22 Å²	22	35 Å²	35	14%	0.135	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.1	178.6	-59.3	0	0	0	0	108.8	V800 R801 I818 R819	V800-T813 WeakPolarHBondContact CA-O 3.34Å; R801-T813 PolarHBondContact N-O 2.79Å; R801-T813 PolarHBondContact O-N 3.41Å; T813-I818 CarbonylContact C-O 3.56Å; T813-I818 WeakPolarHBondContact CA-O 3.35Å; T813-R819 HydrophobicContact CG2-CG 4.13Å
814	I	95.3	Very high	93.5	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.015	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129	178.6	-55.6	171.5	0	0	0	107.7	V734 V760 H762 V800 N816 S817 I818	V734-I814 HydrophobicContact CB-CD1 4.43Å; V734-I814 HydrophobicContact CG1-CD1 3.73Å; V734-I814 HydrophobicContact CG2-CD1 3.78Å; V734-I814 HydrophobicContact CG2-CG2 4.26Å; V760-I814 HydrophobicContact CG1-CD1 3.85Å; H762-I814 HydrophobicContact CB-CD1 4.17Å; H762-I814 HydrophobicContact CB-CG2 4.43Å; V800-I814 HydrophobicContact CG2-CG1 4.47Å; I814-N816 PolarHBondContact O-N 2.84Å; I814-S817 PolarHBondContact O-N 2.77Å; I814-S817 PolarHBondContact O-OG 2.75Å; I814-I818 HydrophobicContact CB-CB 4.4Å; I814-I818 PolarHBondContact N-O 2.81Å; I814-I818 PolarHBondContact O-N 2.91Å; I814-I818 VanDerWaalsContact O-N 3.09Å
815	D	90.4	Very high	93.1	Very high	87 Å²	87	34.3 Å²	34.3	47%	0.465	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	24.6	176.4	-73.3	-79.8	0	0	0	114.8	H762 S799 S817	H762-D815 IonicContact CE1-OD2 3.33Å; H762-D815 PolarHBondContact CE1-OD2 2.91Å; H762-D815 IonicContact NE2-OD2 3.14Å; S799-D815 VanDerWaalsContact CB-CG 3.4Å; S799-D815 WeakPolarHBondContact CB-OD1 3.23Å; S799-D815 VanDerWaalsContact CB-OD2 3.23Å; S799-D815 WeakPolarHBondContact CB-OD2 3.17Å; S799-D815 PolarHBondContact O-N 2.88Å; S799-D815 PolarHBondContact OG-OD2 3.42Å; D815-S817 PolarHBondContact O-N 2.83Å
816	N	88.7	Confident	92.6	Very high	146 Å²	146	38.2 Å²	38.2	78%	0.781	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	8.4	-171.1	-57.3	-62.1	0	0	0	115.5	I814	I814-N816 PolarHBondContact O-N 2.84Å
817	S	90.5	Very high	92	Very high	33 Å²	33	36.3 Å²	36.3	23%	0.231	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-22.3	-168.5	64.2	0	0	0	0	113.8	I814 D815 N846 Q847	I814-S817 PolarHBondContact O-N 2.77Å; I814-S817 PolarHBondContact O-OG 2.75Å; D815-S817 PolarHBondContact O-N 2.83Å; S817-N846 WeakPolarHBondContact O-CA 3.27Å; S817-Q847 PolarHBondContact O-N 3.01Å
818	I	94.3	Very high	91.3	Very high	2 Å²	2	41 Å²	41	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.6	175.6	-66.9	167.7	0	0	0	108.7	T732 V734 T813 I814 Y848	T732-I818 HydrophobicContact CG2-CD1 4.09Å; V734-I818 HydrophobicContact CG2-CD1 4.01Å; T813-I818 CarbonylContact C-O 3.56Å; T813-I818 WeakPolarHBondContact CA-O 3.35Å; I814-I818 HydrophobicContact CB-CB 4.4Å; I814-I818 PolarHBondContact N-O 2.81Å; I814-I818 PolarHBondContact O-N 2.91Å; I814-I818 VanDerWaalsContact O-N 3.09Å; I818-Y848 HydrophobicContact CB-CE1 4.5Å; I818-Y848 HydrophobicContact CD1-CD1 3.67Å; I818-Y848 HydrophobicContact CD1-CE1 3.81Å; I818-Y848 HydrophobicContact CG1-CD1 4.07Å; I818-Y848 HydrophobicContact CG1-CE1 3.97Å; I818-Y848 HydrophobicContact CG2-CE1 3.7Å
819	R	95.8	Very high	89.9	Confident	96 Å²	96	51.2 Å²	51.2	36%	0.362	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.6	-179.7	-63.1	175.8	-64	-169.5	1.1	111.4	V812 T813 P843 D845 N846	V812-R819 CarbonylContact O-C 3.57Å; V812-R819 WeakPolarHBondContact O-CA 3.45Å; T813-R819 HydrophobicContact CG2-CG 4.13Å; R819-P843 HydrophobicContact CB-CG 4.21Å; R819-P843 VanDerWaalsContact O-CD 3.23Å; R819-P843 WeakPolarHBondContact O-CD 3.42Å; R819-D845 IonicContact CZ-OD1 3.2Å; R819-D845 IonicContact CZ-OD2 2.72Å; R819-D845 IonicContact NH2-OD1 2.68Å; R819-D845 PolarHBondContact NH2-OD1 3.18Å; R819-D845 IonicContact NH2-OD2 2.75Å; R819-D845 PolarHBondContact NH2-OD2 2.75Å; R819-N846 PolarHBondContact N-ND2 2.94Å; R819-N846 PolarHBondContact N-OD1 3.22Å; R819-N846 PolarHBondContact O-ND2 3.36Å
820	V	96.3	Very high	88.5	Confident	1 Å²	1	57 Å²	57	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	112.7	-179.9	-174.9	0	0	0	0	108.6	V736 V760 T811 V812 L840 I842	V736-V820 HydrophobicContact CG1-CG1 4.2Å; V736-V820 HydrophobicContact CG2-CG1 4.49Å; V736-V820 HydrophobicContact CG2-CG2 3.92Å; V760-V820 HydrophobicContact CG2-CB 4.16Å; V760-V820 HydrophobicContact CG2-CG1 3.88Å; V760-V820 HydrophobicContact CG2-CG2 4.43Å; T811-V820 WeakPolarHBondContact CA-O 3.43Å; V812-V820 PolarHBondContact N-O 3.04Å; V812-V820 PolarHBondContact O-N 2.94Å; V820-L840 HydrophobicContact CG1-CD1 3.59Å; V820-I842 HydrophobicContact CG1-CG1 4.35Å
821	T	96	Very high	87.2	Confident	21 Å²	21	58.5 Å²	58.5	13%	0.129	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.8	-178.8	-60.4	0	0	0	0	110.8	H809 V810 T811 L823 Y841	H809-T821 HydrophobicContact CB-CG2 4.18Å; V810-T821 CarbonylContact O-C 3.58Å; V810-T821 WeakPolarHBondContact O-CA 3.16Å; T811-T821 PolarHBondContact OG1-OG1 2.85Å; T821-L823 HydrophobicContact CG2-CD2 4.15Å; T821-Y841 PolarHBondContact N-O 3.03Å; T821-Y841 PolarHBondContact O-N 3.32Å
822	V	95.4	Very high	85.4	Confident	0 Å²	0	61 Å²	61	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.2	177.6	-177.9	0	0	0	0	109.5	I758 V771 H809 V810 L838 G839 L840	I758-V822 HydrophobicContact CB-CG2 4.18Å; I758-V822 HydrophobicContact CD1-CG1 4.08Å; I758-V822 HydrophobicContact CD1-CG2 4.22Å; I758-V822 HydrophobicContact CG2-CG2 4.13Å; V771-V822 HydrophobicContact CB-CB 4.48Å; V771-V822 HydrophobicContact CB-CG1 4.24Å; V771-V822 HydrophobicContact CB-CG2 4.43Å; V771-V822 HydrophobicContact CG1-CB 4.06Å; V771-V822 HydrophobicContact CG1-CG1 3.63Å; V771-V822 HydrophobicContact CG2-CG2 4.4Å; H809-V822 CarbonylContact C-O 3.59Å; H809-V822 WeakPolarHBondContact CA-O 3.35Å; H809-V822 VanDerWaalsContact CB-O 3.29Å; H809-V822 WeakPolarHBondContact CB-O 3.43Å; V810-V822 PolarHBondContact N-O 2.88Å; V810-V822 PolarHBondContact O-N 2.99Å; V822-L838 HydrophobicContact CG1-CB 4.01Å; V822-L838 HydrophobicContact CG1-CD1 4.06Å; V822-L838 HydrophobicContact CG1-CD2 3.99Å; V822-L838 HydrophobicContact CG1-CG 4.23Å; V822-G839 CarbonylContact C-O 3.41Å; V822-G839 WeakPolarHBondContact CA-O 3.37Å; V822-L840 HydrophobicContact CG2-CD1 4.09Å
823	L	92.6	Very high	83.9	Confident	15 Å²	15	62.9 Å²	62.9	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.4	179.5	-56.1	178	0	0	0	110.3	H809 T821 L838 G839 R901	H809-L823 HydrophobicContact CB-CD2 3.77Å; T821-L823 HydrophobicContact CG2-CD2 4.15Å; L823-L838 CarbonylContact O-C 3.56Å; L823-L838 VanDerWaalsContact O-CA 3.31Å; L823-L838 WeakPolarHBondContact O-CA 3.41Å; L823-G839 PolarHBondContact N-O 3.32Å; L823-G839 PolarHBondContact O-N 2.73Å; L823-R901 HydrophobicContact CD1-CG 4.45Å
824	L	90.9	Very high	82.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.5	171.3	-176.5	64.4	0	0	0	111.3	T773 W789 S808 R826 L838 R904	T773-L824 HydrophobicContact CG2-CD1 4.16Å; W789-L824 HydrophobicContact CB-CD2 4.4Å; W789-L824 HydrophobicContact CD2-CB 4.42Å; W789-L824 HydrophobicContact CD2-CD2 3.69Å; W789-L824 HydrophobicContact CE3-CB 4.14Å; W789-L824 HydrophobicContact CE3-CD2 4.01Å; W789-L824 HydrophobicContact CG-CD2 3.88Å; W789-L824 HydrophobicContact CH2-CB 3.69Å; W789-L824 HydrophobicContact CZ2-CB 3.99Å; W789-L824 HydrophobicContact CZ2-CD1 4.25Å; W789-L824 HydrophobicContact CZ2-CD2 4.4Å; W789-L824 HydrophobicContact CZ2-CG 4.44Å; W789-L824 HydrophobicContact CZ3-CB 3.77Å; W789-L824 HydrophobicContact CZ3-CD2 4.48Å; S808-L824 PolarHBondContact O-N 2.91Å; L824-R826 HydrophobicContact CD2-CG 3.8Å; L824-R826 HydrophobicContact CG-CG 3.99Å; L824-L838 HydrophobicContact CD1-CD2 3.81Å; L824-R904 PolarHBondContact O-NH2 2.95Å
825	H	86.4	Confident	82.1	Confident	22 Å²	22	63.8 Å²	63.8	10%	0.102	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	106.7	170.5	-67.4	-97.5	0	0	0	109.7	D836 F837 F900	H825-D836 WeakPolarHBondContact O-CA 3.43Å; H825-F837 HydrophobicContact CB-CD1 3.79Å; H825-F837 HydrophobicContact CB-CD2 3.84Å; H825-F837 HydrophobicContact CB-CE1 3.57Å; H825-F837 HydrophobicContact CB-CE2 3.61Å; H825-F837 HydrophobicContact CB-CG 3.93Å; H825-F837 HydrophobicContact CB-CZ 3.48Å; H825-F837 VanDerWaalsContact CB-CZ 3.48Å; H825-F837 WeakPolarHBondContact CB-O 3.46Å; H825-F837 AromaticContact CD2-CE2 3.66Å; H825-F837 AromaticContact CG-CE2 3.45Å; H825-F837 VanDerWaalsContact CG-CE2 3.45Å; H825-F837 AromaticContact CG-CZ 3.56Å; H825-F837 PolarHBondContact N-O 3.28Å; H825-F837 AromaticContact ND1-CE2 3.96Å; H825-F837 AromaticContact ND1-CZ 3.81Å; H825-F837 PolarHBondContact O-N 3.17Å; H825-F900 AromaticContact CE1-CD2 3.93Å; H825-F900 AromaticContact CE1-CG 3.6Å
826	R	83.1	Confident	81.9	Confident	132 Å²	132	62 Å²	62	50%	0.498	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-90.9	130.5	176.1	-70.9	-162.3	170.9	160.2	8.9	111.9	N807 L824 D836	N807-R826 PolarHBondContact OD1-NH1 3.34Å; N807-R826 PolarHBondContact OD1-NH2 2.76Å; L824-R826 HydrophobicContact CD2-CG 3.8Å; L824-R826 HydrophobicContact CG-CG 3.99Å; R826-D836 WeakPolarHBondContact CA-OD1 3.31Å
827	V	78.1	Confident	81.9	Confident	29 Å²	29	56.8 Å²	56.8	18%	0.176	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-103.7	152.9	174.9	173.3	0	0	0	0	108.8	R829 H831 N834 V835 D836	V827-R829 PolarHBondContact O-N 2.8Å; V827-H831 HydrophobicContact CG1-CB 3.5Å; V827-H831 VanDerWaalsContact CG1-CB 3.5Å; V827-N834 HydrophobicContact CG1-CB 4Å; V827-N834 HydrophobicContact CG2-CB 4.21Å; V827-V835 WeakPolarHBondContact CG2-O 3.27Å; V827-D836 PolarHBondContact N-OD1 3.27Å
828	W	72.3	Confident	81.9	Confident	155 Å²	155	55.4 Å²	55.4	59%	0.587	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-60.9	128.8	175.5	177.7	64.6	0	0	0	110.8	K830 H831	W828-K830 HydrophobicContact CD2-CB 4.18Å; W828-K830 VanDerWaalsContact CE3-C 3.48Å; W828-K830 HydrophobicContact CE3-CB 3.96Å; W828-K830 HydrophobicContact CH2-CB 3.54Å; W828-K830 HydrophobicContact CH2-CD 4.43Å; W828-K830 HydrophobicContact CZ2-CB 3.75Å; W828-K830 HydrophobicContact CZ2-CD 4.32Å; W828-K830 HydrophobicContact CZ2-CG 4.48Å; W828-K830 HydrophobicContact CZ3-CB 3.63Å; W828-K830 PolarHBondContact O-N 2.89Å; W828-H831 HydrophobicContact CB-CB 4.49Å; W828-H831 HydrophobicContact CE3-CB 4.24Å; W828-H831 VanDerWaalsContact CE3-N 3.32Å; W828-H831 WeakPolarHBondContact O-CB 3.43Å; W828-H831 PolarHBondContact O-N 2.84Å
829	R	62.4	Low	81.7	Confident	236 Å²	236	56.1 Å²	56.1	89%	0.891	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-35.7	-168	-160.9	173.1	-174.6	173.1	2.5	114.3	K744 V827	K744-R829 PolarHBondContact NZ-O 2.86Å; V827-R829 PolarHBondContact O-N 2.8Å
830	K	63.9	Low	81.6	Confident	173 Å²	173	53.7 Å²	53.7	75%	0.752	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	8.9	177.7	-70.5	-173.1	178	-175.4	0	114.7	W828	W828-K830 HydrophobicContact CD2-CB 4.18Å; W828-K830 VanDerWaalsContact CE3-C 3.48Å; W828-K830 HydrophobicContact CE3-CB 3.96Å; W828-K830 HydrophobicContact CH2-CB 3.54Å; W828-K830 HydrophobicContact CH2-CD 4.43Å; W828-K830 HydrophobicContact CZ2-CB 3.75Å; W828-K830 HydrophobicContact CZ2-CD 4.32Å; W828-K830 HydrophobicContact CZ2-CG 4.48Å; W828-K830 HydrophobicContact CZ3-CB 3.63Å; W828-K830 PolarHBondContact O-N 2.89Å
831	H	67.9	Low	81.3	Confident	31 Å²	31	57.5 Å²	57.5	14%	0.144	26%	0.263	C	S	.	.			trans	-60.3	133.4	178.7	-171.5	-67.2	0	0	0	110.7	K744 V827 W828 V833 N834	K744-H831 PolarHBondContact NZ-O 2.73Å; V827-H831 HydrophobicContact CG1-CB 3.5Å; V827-H831 VanDerWaalsContact CG1-CB 3.5Å; W828-H831 HydrophobicContact CB-CB 4.49Å; W828-H831 HydrophobicContact CE3-CB 4.24Å; W828-H831 VanDerWaalsContact CE3-N 3.32Å; W828-H831 WeakPolarHBondContact O-CB 3.43Å; W828-H831 PolarHBondContact O-N 2.84Å; H831-V833 PolarHBondContact ND1-N 3.13Å; H831-N834 PolarHBondContact CE1-ND2 3.35Å; H831-N834 PolarHBondContact ND1-N 3.04Å; H831-N834 PolarHBondContact NE2-ND2 3.08Å
832	P	59.5	Low	81.1	Confident	77 Å²	77	58.1 Å²	58.1	50%	0.5	27%	0.265	S	S	.	.	S	Bend	trans	-69.2	-45.3	-171.2	24.1	-33.8	0	0	0	113.9	K744	K744-P832 WeakPolarHBondContact CB-O 3.29Å
833	V	65.3	Low	80.8	Confident	39 Å²	39	58.8 Å²	58.8	24%	0.236	27%	0.269	C	S	.	.	S	Bend	trans	-93.8	-53.9	-174.3	-175.3	0	0	0	0	112.9	S743 K744 H831	S743-V833 WeakPolarHBondContact CB-O 3.29Å; K744-V833 WeakPolarHBondContact CB-O 3.43Å; K744-V833 PolarHBondContact N-O 2.68Å; H831-V833 PolarHBondContact ND1-N 3.13Å
834	N	72.5	Confident	80.4	Confident	14 Å²	14	63.3 Å²	63.3	8%	0.075	30%	0.303	C	S	.	.			trans	-87.5	158.5	-165	-53.5	-42.7	0	0	0	114.4	V695 K744 V827 H831	V695-N834 VanDerWaalsContact CB-ND2 3.3Å; V695-N834 WeakPolarHBondContact CB-ND2 3.33Å; V695-N834 HydrophobicContact CG2-CB 4.3Å; V695-N834 VanDerWaalsContact CG2-ND2 3.27Å; V695-N834 WeakPolarHBondContact CG2-ND2 3.25Å; K744-N834 WeakPolarHBondContact CE-O 3.4Å; K744-N834 PolarHBondContact NZ-O 2.83Å; V827-N834 HydrophobicContact CG1-CB 4Å; V827-N834 HydrophobicContact CG2-CB 4.21Å; H831-N834 PolarHBondContact CE1-ND2 3.35Å; H831-N834 PolarHBondContact ND1-N 3.04Å; H831-N834 PolarHBondContact NE2-ND2 3.08Å
835	V	81.4	Confident	80.2	Confident	30 Å²	30	68 Å²	68	18%	0.182	33%	0.327	C	S	.	.			trans	-119.5	163.7	178.4	-66	0	0	0	0	110	I741 K744 Y754 V827	I741-V835 HydrophobicContact CD1-CG2 3.83Å; I741-V835 HydrophobicContact CG1-CG2 4.46Å; K744-V835 HydrophobicContact CD-CG1 4.48Å; K744-V835 HydrophobicContact CG-CG1 3.62Å; Y754-V835 HydrophobicContact CD2-CG2 4.38Å; V827-V835 WeakPolarHBondContact CG2-O 3.27Å
836	D	86.1	Confident	80.5	Confident	49 Å²	49	67.4 Å²	67.4	26%	0.262	33%	0.325	S	S	.	.			trans	-62.7	141.3	165.4	-71.2	6.4	0	0	0	109.1	T773 H825 R826 V827	T773-D836 HydrophobicContact CG2-CB 4.3Å; H825-D836 WeakPolarHBondContact O-CA 3.43Å; R826-D836 WeakPolarHBondContact CA-OD1 3.31Å; V827-D836 PolarHBondContact N-OD1 3.27Å
837	F	88.8	Confident	80.9	Confident	38 Å²	38	67.9 Å²	67.9	17%	0.167	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	171.3	-177.5	68.3	-89.7	0	0	0	112.8	Y754 H825	Y754-F837 HydrophobicContact CD1-CB 4.37Å; Y754-F837 HydrophobicContact CD1-CD1 4.22Å; Y754-F837 HydrophobicContact CD1-CD2 4.28Å; Y754-F837 HydrophobicContact CD1-CG 4.06Å; Y754-F837 HydrophobicContact CG-CB 4.17Å; Y754-F837 HydrophobicContact CG-CG 4.35Å; H825-F837 HydrophobicContact CB-CD1 3.79Å; H825-F837 HydrophobicContact CB-CD2 3.84Å; H825-F837 HydrophobicContact CB-CE1 3.57Å; H825-F837 HydrophobicContact CB-CE2 3.61Å; H825-F837 HydrophobicContact CB-CG 3.93Å; H825-F837 HydrophobicContact CB-CZ 3.48Å; H825-F837 VanDerWaalsContact CB-CZ 3.48Å; H825-F837 WeakPolarHBondContact CB-O 3.46Å; H825-F837 AromaticContact CD2-CE2 3.66Å; H825-F837 AromaticContact CG-CE2 3.45Å; H825-F837 VanDerWaalsContact CG-CE2 3.45Å; H825-F837 AromaticContact CG-CZ 3.56Å; H825-F837 PolarHBondContact N-O 3.28Å; H825-F837 AromaticContact ND1-CE2 3.96Å; H825-F837 AromaticContact ND1-CZ 3.81Å; H825-F837 PolarHBondContact O-N 3.17Å
838	L	91.6	Very high	81.6	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	139.3	-178.8	-55.4	176	0	0	0	111.5	F755 G756 I758 V771 T773 W789 V822 L823 L824	F755-L838 HydrophobicContact CB-CB 4.17Å; F755-L838 PolarHBondContact O-N 3.38Å; G756-L838 WeakPolarHBondContact O-CD1 3.35Å; I758-L838 HydrophobicContact CD1-CB 4.23Å; I758-L838 HydrophobicContact CG1-CB 4.47Å; I758-L838 HydrophobicContact CG1-CD1 4.05Å; V771-L838 HydrophobicContact CG1-CD1 4.47Å; V771-L838 WeakPolarHBondContact O-CD1 3.26Å; T773-L838 HydrophobicContact CG2-CD1 4.5Å; T773-L838 HydrophobicContact CG2-CD2 3.78Å; T773-L838 HydrophobicContact CG2-CG 3.75Å; W789-L838 HydrophobicContact CZ2-CD2 4.17Å; V822-L838 HydrophobicContact CG1-CB 4.01Å; V822-L838 HydrophobicContact CG1-CD1 4.06Å; V822-L838 HydrophobicContact CG1-CD2 3.99Å; V822-L838 HydrophobicContact CG1-CG 4.23Å; L823-L838 CarbonylContact O-C 3.56Å; L823-L838 VanDerWaalsContact O-CA 3.31Å; L823-L838 WeakPolarHBondContact O-CA 3.41Å; L824-L838 HydrophobicContact CD1-CD2 3.81Å
839	G	90.1	Very high	82.6	Confident	17 Å²	17	61.9 Å²	61.9	18%	0.175	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	153.9	162.1	0	0	0	0	0	110.3	V822 L823	V822-G839 CarbonylContact C-O 3.41Å; V822-G839 WeakPolarHBondContact CA-O 3.37Å; L823-G839 PolarHBondContact N-O 3.32Å; L823-G839 PolarHBondContact O-N 2.73Å
840	L	92.2	Very high	84	Confident	45 Å²	45	55.3 Å²	55.3	24%	0.236	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.9	176.8	-174.5	61.3	0	0	0	110.8	L726 V736 I758 V820 V822 I842 I856	L726-L840 HydrophobicContact CB-CD2 4.47Å; L726-L840 HydrophobicContact CD1-CD2 3.43Å; L726-L840 VanDerWaalsContact CD1-CD2 3.43Å; V736-L840 HydrophobicContact CG1-CD2 4.3Å; I758-L840 HydrophobicContact CD1-CB 3.88Å; I758-L840 HydrophobicContact CD1-CD1 3.99Å; I758-L840 HydrophobicContact CD1-CD2 4.46Å; I758-L840 HydrophobicContact CD1-CG 4.33Å; I758-L840 HydrophobicContact CG2-CD1 4.31Å; V820-L840 HydrophobicContact CG1-CD1 3.59Å; V822-L840 HydrophobicContact CG2-CD1 4.09Å; L840-I842 HydrophobicContact CD1-CG1 4.44Å; L840-I842 HydrophobicContact CD2-CD1 4.29Å; L840-I842 HydrophobicContact CD2-CG1 4.42Å; L840-I842 HydrophobicContact CG-CG1 4.25Å; L840-I856 HydrophobicContact CD2-CD1 4.09Å
841	Y	91.4	Very high	85.3	Confident	81 Å²	81	52.2 Å²	52.2	32%	0.318	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.7	167.9	177.6	-121.7	0	0	0	110.5	T821 P843 R901	T821-Y841 PolarHBondContact N-O 3.03Å; T821-Y841 PolarHBondContact O-N 3.32Å; Y841-P843 HydrophobicContact CE1-CG 3.97Å; Y841-R901 VanDerWaalsContact CD2-CD 3.42Å; Y841-R901 HydrophobicContact CD2-CG 4.46Å; Y841-R901 HydrophobicContact CG-CG 4.31Å; Y841-R901 PolarHBondContact OH-NH1 3.19Å
842	I	91.2	Very high	86.6	Confident	34 Å²	34	51.5 Å²	51.5	17%	0.174	29%	0.287	C	S	.	.			trans	-125.6	120.6	174.7	-60.3	-167.4	0	0	0	107	V727 V820 L840 N846 Y848 I856	V727-I842 HydrophobicContact CG2-CD1 3.52Å; V820-I842 HydrophobicContact CG1-CG1 4.35Å; L840-I842 HydrophobicContact CD1-CG1 4.44Å; L840-I842 HydrophobicContact CD2-CD1 4.29Å; L840-I842 HydrophobicContact CD2-CG1 4.42Å; L840-I842 HydrophobicContact CG-CG1 4.25Å; I842-N846 VanDerWaalsContact CG2-ND2 3.33Å; I842-N846 WeakPolarHBondContact CG2-ND2 3.5Å; I842-Y848 HydrophobicContact CG2-CE2 4.38Å; I842-Y848 VanDerWaalsContact CG2-OH 3.29Å; I842-Y848 WeakPolarHBondContact CG2-OH 3.31Å; I842-I856 HydrophobicContact CD1-CD1 3.69Å; I842-I856 HydrophobicContact CD1-CG1 4.49Å; I842-I856 HydrophobicContact CG1-CD1 4.24Å
843	P	89.3	Confident	88.2	Confident	13 Å²	13	50.5 Å²	50.5	8%	0.084	28%	0.276	C	S	.	.			trans	-64.9	144.9	175.2	-24.9	37.5	0	0	0	113	R819 Y841 D845 N846	R819-P843 HydrophobicContact CB-CG 4.21Å; R819-P843 VanDerWaalsContact O-CD 3.23Å; R819-P843 WeakPolarHBondContact O-CD 3.42Å; Y841-P843 HydrophobicContact CE1-CG 3.97Å; P843-D845 WeakPolarHBondContact CB-OD1 3.36Å; P843-D845 PolarHBondContact O-N 3.42Å; P843-N846 PolarHBondContact O-N 2.82Å
844	S	83.8	Confident	89.5	Confident	111 Å²	111	48.6 Å²	48.6	78%	0.776	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-1.2	176.6	60.6	0	0	0	0	114.3
845	D	87.3	Confident	90.4	Very high	97 Å²	97	48 Å²	48	52%	0.519	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	6.3	175.2	66.4	-15.7	0	0	0	113	R819 P843	R819-D845 IonicContact CZ-OD1 3.2Å; R819-D845 IonicContact CZ-OD2 2.72Å; R819-D845 IonicContact NH2-OD1 2.68Å; R819-D845 PolarHBondContact NH2-OD1 3.18Å; R819-D845 IonicContact NH2-OD2 2.75Å; R819-D845 PolarHBondContact NH2-OD2 2.75Å; P843-D845 WeakPolarHBondContact CB-OD1 3.36Å; P843-D845 PolarHBondContact O-N 3.42Å
846	N	91.3	Very high	90.9	Very high	10 Å²	10	48 Å²	48	5%	0.053	26%	0.26	C	S	.	.			trans	-64.3	131.4	173.5	-79.7	-1.7	0	0	0	111.5	S817 R819 I842 P843 Y848	S817-N846 WeakPolarHBondContact O-CA 3.27Å; R819-N846 PolarHBondContact N-ND2 2.94Å; R819-N846 PolarHBondContact N-OD1 3.22Å; R819-N846 PolarHBondContact O-ND2 3.36Å; I842-N846 VanDerWaalsContact CG2-ND2 3.33Å; I842-N846 WeakPolarHBondContact CG2-ND2 3.5Å; P843-N846 PolarHBondContact O-N 2.82Å; N846-Y848 HydrophobicContact CB-CD2 3.9Å; N846-Y848 HydrophobicContact CB-CE2 3.39Å; N846-Y848 PolarHBondContact ND2-OH 2.8Å; N846-Y848 PolarHBondContact O-N 2.81Å; N846-Y848 VanDerWaalsContact O-N 3.14Å
847	Q	91.4	Very high	91.2	Very high	143 Å²	143	45.8 Å²	45.8	67%	0.668	25%	0.249	S	C	*	.			trans	-91.5	74.7	-174.7	-58.3	177.9	24.3	0	0	111.5	S817	S817-Q847 PolarHBondContact O-N 3.01Å
848	Y	93.4	Very high	91.3	Very high	35 Å²	35	44.8 Å²	44.8	14%	0.137	25%	0.245	C	C	.	.			trans	-75.6	160.4	173.7	-63.3	-69	0	0	0	112.9	V727 D729 I818 I842 N846 V852 S860	V727-Y848 HydrophobicContact CG1-CD1 4.34Å; V727-Y848 HydrophobicContact CG1-CE1 3.81Å; D729-Y848 HydrophobicContact CB-CD1 4.43Å; I818-Y848 HydrophobicContact CB-CE1 4.5Å; I818-Y848 HydrophobicContact CD1-CD1 3.67Å; I818-Y848 HydrophobicContact CD1-CE1 3.81Å; I818-Y848 HydrophobicContact CG1-CD1 4.07Å; I818-Y848 HydrophobicContact CG1-CE1 3.97Å; I818-Y848 HydrophobicContact CG2-CE1 3.7Å; I842-Y848 HydrophobicContact CG2-CE2 4.38Å; I842-Y848 VanDerWaalsContact CG2-OH 3.29Å; I842-Y848 WeakPolarHBondContact CG2-OH 3.31Å; N846-Y848 HydrophobicContact CB-CD2 3.9Å; N846-Y848 HydrophobicContact CB-CE2 3.39Å; N846-Y848 PolarHBondContact ND2-OH 2.8Å; N846-Y848 PolarHBondContact O-N 2.81Å; N846-Y848 VanDerWaalsContact O-N 3.14Å; Y848-V852 HydrophobicContact CD1-CG2 4.12Å; Y848-V852 HydrophobicContact CD2-CG2 4.38Å; Y848-V852 HydrophobicContact CG-CB 4.31Å; Y848-V852 HydrophobicContact CG-CG2 3.92Å; Y848-S860 WeakPolarHBondContact CD2-OG 3.33Å
849	S	93.6	Very high	91.3	Very high	22 Å²	22	45.8 Å²	45.8	15%	0.154	25%	0.249	C	C	.	.			trans	-75.5	166.6	174.1	97.7	0	0	0	0	112.2	D729 G731 L851 V852	D729-S849 VanDerWaalsContact OD1-CB 3.28Å; D729-S849 WeakPolarHBondContact OD1-CB 3.46Å; D729-S849 PolarHBondContact OD1-OG 3.2Å; D729-S849 PolarHBondContact OD2-N 3.43Å; G731-S849 WeakPolarHBondContact CA-OG 3.18Å; S849-L851 PolarHBondContact O-N 2.98Å; S849-L851 PolarHBondContact OG-N 3.43Å; S849-V852 WeakPolarHBondContact O-CG1 3.49Å; S849-V852 PolarHBondContact O-N 2.91Å
850	P	90.9	Very high	91.2	Very high	98 Å²	98	47.6 Å²	47.6	64%	0.636	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.1	170.7	-25.8	36	0	0	0	115.3	R861	P850-R861 PolarHBondContact O-NH2 3.01Å
851	L	92.1	Very high	90.8	Very high	108 Å²	108	53.3 Å²	53.3	57%	0.565	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	6.1	-177.2	-55.4	-179.9	0	0	0	113.9	S849 H853	S849-L851 PolarHBondContact O-N 2.98Å; S849-L851 PolarHBondContact OG-N 3.43Å; L851-H853 PolarHBondContact O-N 2.55Å
852	V	94.5	Very high	90.6	Very high	16 Å²	16	52.8 Å²	52.8	10%	0.097	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.6	179.1	65.7	0	0	0	0	113	V727 D729 Y848 S849	V727-V852 HydrophobicContact CG1-CG2 3.75Å; D729-V852 HydrophobicContact CB-CB 3.98Å; D729-V852 HydrophobicContact CB-CG2 4.05Å; Y848-V852 HydrophobicContact CD1-CG2 4.12Å; Y848-V852 HydrophobicContact CD2-CG2 4.38Å; Y848-V852 HydrophobicContact CG-CB 4.31Å; Y848-V852 HydrophobicContact CG-CG2 3.92Å; S849-V852 WeakPolarHBondContact O-CG1 3.49Å; S849-V852 PolarHBondContact O-N 2.91Å
853	H	93.9	Very high	90.5	Very high	56 Å²	56	52 Å²	52	26%	0.259	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	-167.2	175.8	-157.6	50.5	0	0	0	111.2	V727 S728 L851 G857 D924 Y930	V727-H853 CarbonylContact C-O 3.54Å; V727-H853 WeakPolarHBondContact CA-O 3.5Å; S728-H853 PolarHBondContact N-O 2.8Å; S728-H853 PolarHBondContact O-N 2.94Å; L851-H853 PolarHBondContact O-N 2.55Å; H853-G857 WeakPolarHBondContact O-CA 3.37Å; H853-D924 IonicContact CE1-OD2 2.72Å; H853-D924 PolarHBondContact CE1-OD2 3.22Å; H853-Y930 AromaticContact NE2-CE1 3.99Å
854	G	92.6	Very high	90.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	107.5	171	-173.8	0	0	0	0	0	112.9	L726 I856 G857 Q858	L726-G854 CarbonylContact O-C 3.46Å; G854-I856 PolarHBondContact O-N 3.47Å; G854-I856 VanDerWaalsContact O-N 3.1Å; G854-G857 PolarHBondContact O-N 2.81Å; G854-Q858 WeakPolarHBondContact O-CB 3.44Å; G854-Q858 WeakPolarHBondContact O-CG 3.44Å; G854-Q858 PolarHBondContact O-N 2.98Å; G854-Q858 PolarHBondContact O-NE2 3.46Å
855	L	92.1	Very high	90.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-30.3	-173.8	-76.8	169.6	0	0	0	114.3	L724 S725 L726 F859 I923 Y930	L724-L855 HydrophobicContact CB-CD1 3.95Å; L724-L855 HydrophobicContact CD1-CD1 4.21Å; L724-L855 HydrophobicContact CD2-CD1 4.28Å; L724-L855 HydrophobicContact CG-CD1 4.38Å; S725-L855 WeakPolarHBondContact O-CB 3.29Å; S725-L855 WeakPolarHBondContact O-CG 3.23Å; S725-L855 PolarHBondContact O-N 3.05Å; L726-L855 HydrophobicContact CD2-CD1 4.19Å; L726-L855 PolarHBondContact O-N 3.23Å; L855-F859 WeakPolarHBondContact O-CE2 3.33Å; L855-I923 HydrophobicContact CD2-CD1 3.86Å; L855-Y930 HydrophobicContact CD1-CG 4.47Å; L855-Y930 HydrophobicContact CD2-CD1 4.29Å; L855-Y930 HydrophobicContact CD2-CD2 3.44Å; L855-Y930 VanDerWaalsContact CD2-CD2 3.44Å; L855-Y930 HydrophobicContact CD2-CE2 3.82Å; L855-Y930 HydrophobicContact CD2-CG 3.7Å; L855-Y930 HydrophobicContact CG-CD1 3.97Å; L855-Y930 HydrophobicContact CG-CD2 3.94Å; L855-Y930 HydrophobicContact CG-CG 3.62Å
856	I	91.8	Very high	90.7	Very high	30 Å²	30	53.6 Å²	53.6	15%	0.154	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-28.4	174.6	59.5	176.7	0	0	0	112.9	F701 I703 L726 V727 L840 I842 G854 Q858 F859	F701-I856 HydrophobicContact CD1-CG2 3.56Å; F701-I856 HydrophobicContact CE1-CG2 3.88Å; I703-I856 HydrophobicContact CD1-CB 4.39Å; I703-I856 HydrophobicContact CD1-CG2 3.81Å; L726-I856 HydrophobicContact CB-CD1 4.07Å; L726-I856 HydrophobicContact CB-CG1 3.97Å; L726-I856 WeakPolarHBondContact O-CG1 3.41Å; L726-I856 PolarHBondContact O-N 2.9Å; V727-I856 HydrophobicContact CG2-CD1 4.46Å; V727-I856 HydrophobicContact CG2-CG1 4Å; L840-I856 HydrophobicContact CD2-CD1 4.09Å; I842-I856 HydrophobicContact CD1-CD1 3.69Å; I842-I856 HydrophobicContact CD1-CG1 4.49Å; I842-I856 HydrophobicContact CG1-CD1 4.24Å; G854-I856 PolarHBondContact O-N 3.47Å; G854-I856 VanDerWaalsContact O-N 3.1Å; I856-Q858 PolarHBondContact O-N 2.91Å; I856-F859 PolarHBondContact O-N 2.64Å
857	G	90.9	Very high	90.7	Very high	3 Å²	3	55.1 Å²	55.1	3%	0.031	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-59.7	-29.6	177	0	0	0	0	0	113.8	L726 H853 G854 F859 S860	L726-G857 PolarHBondContact O-N 2.96Å; H853-G857 WeakPolarHBondContact O-CA 3.37Å; G854-G857 PolarHBondContact O-N 2.81Å; G857-F859 PolarHBondContact O-N 3.45Å; G857-S860 WeakPolarHBondContact O-CB 3.45Å; G857-S860 PolarHBondContact O-N 3.09Å
858	Q	91.8	Very high	90.6	Very high	18 Å²	18	53.3 Å²	53.3	8%	0.084	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-59.7	-24.9	174.4	70.6	-171.9	-100.3	0	0	114.2	G854 I856 S860 I923 D924 Y930	G854-Q858 WeakPolarHBondContact O-CB 3.44Å; G854-Q858 WeakPolarHBondContact O-CG 3.44Å; G854-Q858 PolarHBondContact O-N 2.98Å; G854-Q858 PolarHBondContact O-NE2 3.46Å; I856-Q858 PolarHBondContact O-N 2.91Å; Q858-S860 VanDerWaalsContact C-N 3.31Å; Q858-I923 VanDerWaalsContact OE1-CA 3.25Å; Q858-D924 PolarHBondContact OE1-OD2 3.23Å; Q858-D924 VanDerWaalsContact OE1-OD2 3.05Å; Q858-Y930 PolarHBondContact NE2-OH 3.37Å
859	F	91.4	Very high	90.4	Very high	25 Å²	25	56.7 Å²	56.7	11%	0.11	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-89.4	7.1	177.4	-54.5	-69.2	0	0	0	113.2	I703 L855 I856 G857 R861 P863 F922 I923	I703-F859 HydrophobicContact CD1-CD2 4.16Å; I703-F859 HydrophobicContact CG1-CD2 4.17Å; I703-F859 HydrophobicContact CG1-CE2 4.37Å; I703-F859 HydrophobicContact CG2-CB 3.97Å; I703-F859 HydrophobicContact CG2-CD1 4.47Å; I703-F859 HydrophobicContact CG2-CD2 4.14Å; I703-F859 HydrophobicContact CG2-CG 3.94Å; L855-F859 WeakPolarHBondContact O-CE2 3.33Å; I856-F859 PolarHBondContact O-N 2.64Å; G857-F859 PolarHBondContact O-N 3.45Å; F859-R861 CarbonylContact C-O 3.55Å; F859-R861 CarbonylContact O-C 3.59Å; F859-R861 PolarHBondContact O-N 3.18Å; F859-P863 HydrophobicContact CD1-CG 4.1Å; F859-P863 HydrophobicContact CE1-CG 4.34Å; F859-F922 HydrophobicContact CD1-CE1 4.5Å; F859-F922 HydrophobicContact CD1-CZ 4.24Å; F859-F922 HydrophobicContact CE1-CD1 4.13Å; F859-F922 HydrophobicContact CE1-CD2 4.5Å; F859-F922 AromaticContact CE1-CE1 3.66Å; F859-F922 HydrophobicContact CE1-CE1 3.66Å; F859-F922 HydrophobicContact CE1-CE2 4.06Å; F859-F922 AromaticContact CE1-CZ 3.61Å; F859-F922 HydrophobicContact CE1-CZ 3.61Å; F859-F922 HydrophobicContact CE2-CD1 4.36Å; F859-F922 AromaticContact CE2-CE1 3.88Å; F859-F922 HydrophobicContact CE2-CE1 3.88Å; F859-F922 AromaticContact CZ-CD1 3.58Å; F859-F922 HydrophobicContact CZ-CD1 3.58Å; F859-F922 AromaticContact CZ-CE1 3.3Å; F859-F922 HydrophobicContact CZ-CE1 3.3Å; F859-F922 HydrophobicContact CZ-CE2 4.46Å; F859-F922 HydrophobicContact CZ-CG 4.28Å; F859-F922 AromaticContact CZ-CZ 3.79Å; F859-F922 HydrophobicContact CZ-CZ 3.79Å; F859-I923 HydrophobicContact CE2-CG2 4.33Å; F859-I923 HydrophobicContact CZ-CG2 4.25Å
860	S	87.4	Confident	90.2	Very high	55 Å²	55	59.5 Å²	59.5	39%	0.385	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-62.4	-15.3	167.9	-176.2	0	0	0	0	112.7	Y848 G857 Q858	Y848-S860 WeakPolarHBondContact CD2-OG 3.33Å; G857-S860 WeakPolarHBondContact O-CB 3.45Å; G857-S860 PolarHBondContact O-N 3.09Å; Q858-S860 VanDerWaalsContact C-N 3.31Å
861	R	84.9	Confident	90	Very high	164 Å²	164	58.3 Å²	58.3	62%	0.619	29%	0.293	S	S	*	.	S	Bend	trans	-115.4	127.5	159.5	-46.8	-168.8	-156.1	-176.2	12.1	106.8	P850 F859 P863	P850-R861 PolarHBondContact O-NH2 3.01Å; F859-R861 CarbonylContact C-O 3.55Å; F859-R861 CarbonylContact O-C 3.59Å; F859-R861 PolarHBondContact O-N 3.18Å; R861-P863 WeakPolarHBondContact O-CD 3.29Å
862	E	87.3	Confident	89.7	Confident	70 Å²	70	59.4 Å²	59.4	33%	0.327	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-67.4	122.3	-179.8	-174	170.6	168.1	0	0	109.9	L705 P706 G707 S708	L705-E862 HydrophobicContact CB-CG 4.23Å; L705-E862 WeakPolarHBondContact CB-OE1 3.35Å; L705-E862 HydrophobicContact CD2-CG 4.24Å; P706-E862 WeakPolarHBondContact CD-OE2 3.19Å; P706-E862 WeakPolarHBondContact CG-OE2 3.45Å; G707-E862 PolarHBondContact N-OE1 3.18Å; G707-E862 PolarHBondContact N-OE2 3.26Å; S708-E862 VanDerWaalsContact CB-OE1 3.3Å; S708-E862 WeakPolarHBondContact CB-OE1 3.25Å; S708-E862 PolarHBondContact N-OE1 3.01Å; S708-E862 PolarHBondContact OG-OE1 2.82Å
863	P	87.8	Confident	88.8	Confident	19 Å²	19	59.5 Å²	59.5	12%	0.123	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-73.5	151.3	171.9	31.4	-34.1	0	0	0	110.1	F859 R861 V865 V885 K886	F859-P863 HydrophobicContact CD1-CG 4.1Å; F859-P863 HydrophobicContact CE1-CG 4.34Å; R861-P863 WeakPolarHBondContact O-CD 3.29Å; P863-V865 HydrophobicContact CG-CG2 4.13Å; P863-V865 PolarHBondContact O-N 2.92Å; P863-V885 HydrophobicContact CB-CG2 4.34Å; P863-V885 HydrophobicContact CG-CG2 4.39Å; P863-K886 HydrophobicContact CB-CG 4.22Å
864	E	87.2	Confident	87.9	Confident	184 Å²	184	62.8 Å²	62.8	86%	0.86	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-65.5	125.5	167.2	-65.2	-178.5	175.8	0	0	109.5
865	V	89.6	Confident	87	Confident	21 Å²	21	65.3 Å²	65.3	13%	0.127	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.1	-179.6	-178.9	0	0	0	0	109.9	L705 M710 P863 V867 M883 E884 V885	L705-V865 HydrophobicContact CD1-CB 4.25Å; L705-V865 HydrophobicContact CD1-CG2 3.68Å; M710-V865 HydrophobicContact CE-CB 4.29Å; M710-V865 HydrophobicContact CE-CG1 3.96Å; M710-V865 HydrophobicContact SD-CG1 4.04Å; P863-V865 HydrophobicContact CG-CG2 4.13Å; P863-V865 PolarHBondContact O-N 2.92Å; V865-V867 HydrophobicContact CG1-CG2 4.31Å; V865-M883 HydrophobicContact CG1-CE 3.99Å; V865-M883 HydrophobicContact CG1-CG 3.79Å; V865-M883 HydrophobicContact CG1-SD 3.97Å; V865-E884 WeakPolarHBondContact CA-O 3.32Å; V865-V885 HydrophobicContact CG2-CB 4.07Å; V865-V885 HydrophobicContact CG2-CG2 3.77Å
866	S	89.6	Confident	86	Confident	49 Å²	49	70.2 Å²	70.2	34%	0.343	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	149.2	167.5	95.1	0	0	0	0	110.2	M883 E884	S866-M883 CarbonylContact O-C 3.58Å; S866-M883 VanDerWaalsContact O-CA 3.32Å; S866-M883 WeakPolarHBondContact O-CA 3.37Å; S866-E884 PolarHBondContact N-O 2.9Å; S866-E884 PolarHBondContact O-N 3.1Å
867	V	90.1	Very high	85.1	Confident	42 Å²	42	75.5 Å²	75.5	26%	0.255	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	123.5	172.9	-175.7	0	0	0	0	109	M710 V865 V870 A881 T882 M883 W913	M710-V867 HydrophobicContact CE-CG2 4.21Å; M710-V867 HydrophobicContact SD-CG2 4.13Å; V865-V867 HydrophobicContact CG1-CG2 4.31Å; V867-V870 HydrophobicContact CG1-CG2 4.48Å; V867-A881 HydrophobicContact CG1-CB 3.69Å; V867-T882 WeakPolarHBondContact CA-O 3.03Å; V867-M883 HydrophobicContact CG2-CB 4.18Å; V867-M883 HydrophobicContact CG2-CE 3.74Å; V867-M883 HydrophobicContact CG2-CG 4.11Å; V867-W913 HydrophobicContact CG1-CD2 4.34Å; V867-W913 HydrophobicContact CG1-CH2 4.1Å; V867-W913 HydrophobicContact CG1-CZ2 3.72Å
868	Y	90.6	Very high	84.6	Confident	104 Å²	104	79.7 Å²	79.7	41%	0.408	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	178.1	-175.1	60.6	-92	0	0	0	111.1	V870 T882 E884	Y868-V870 PolarHBondContact O-N 2.71Å; Y868-T882 HydrophobicContact CD2-CG2 4.49Å; Y868-T882 HydrophobicContact CE1-CG2 4.13Å; Y868-T882 HydrophobicContact CE2-CG2 3.71Å; Y868-T882 VanDerWaalsContact CZ-CG2 3.49Å; Y868-T882 PolarHBondContact N-O 2.8Å; Y868-T882 PolarHBondContact O-N 3.07Å; Y868-T882 VanDerWaalsContact O-O 3.14Å; Y868-T882 WeakPolarHBondContact OH-CG2 3.32Å; Y868-E884 HydrophobicContact CE1-CB 4.12Å
869	D	88	Confident	84.3	Confident	106 Å²	106	82.9 Å²	82.9	57%	0.567	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.7	48.6	-177.6	-163.1	27.7	0	0	0	113.2	H871	D869-H871 PolarHBondContact O-CD2 3.05Å; D869-H871 PolarHBondContact O-N 2.94Å
870	V	89.2	Confident	84.3	Confident	81 Å²	81	83.8 Å²	83.8	49%	0.491	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	105.3	-177.5	-175.4	0	0	0	0	110.2	V867 Y868 K879 E880 A881 W913	V867-V870 HydrophobicContact CG1-CG2 4.48Å; Y868-V870 PolarHBondContact O-N 2.71Å; V870-K879 HydrophobicContact CG1-CB 4.25Å; V870-K879 HydrophobicContact CG1-CD 4.29Å; V870-E880 CarbonylContact C-O 3.59Å; V870-E880 WeakPolarHBondContact CA-O 3.47Å; V870-A881 HydrophobicContact CB-CB 4.39Å; V870-A881 HydrophobicContact CG2-CB 3.87Å; V870-W913 HydrophobicContact CG1-CH2 3.93Å; V870-W913 HydrophobicContact CG2-CH2 3.96Å; V870-W913 HydrophobicContact CG2-CZ2 4.35Å
871	H	86.9	Confident	84.5	Confident	74 Å²	74	81.3 Å²	81.3	34%	0.343	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	173.5	179.7	65.2	81.3	0	0	0	112.3	D869 K879 E880	D869-H871 PolarHBondContact O-CD2 3.05Å; D869-H871 PolarHBondContact O-N 2.94Å; H871-K879 CarbonylContact O-C 3.56Å; H871-K879 WeakPolarHBondContact O-CA 3.2Å; H871-K879 WeakPolarHBondContact O-CB 3.33Å; H871-E880 WeakPolarHBondContact CE1-CB 3.43Å; H871-E880 IonicContact CE1-OE2 3.82Å; H871-E880 PolarHBondContact N-O 3.47Å; H871-E880 PolarHBondContact O-N 2.95Å
872	E	85.3	Confident	84.8	Confident	131 Å²	131	74.6 Å²	74.6	61%	0.612	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	137	172.4	-59	-167.4	157.7	0	0	109.4	K879	E872-K879 IonicContact OE1-NZ 2.7Å
873	G	75.9	Confident	85.1	Confident	17 Å²	17	71.3 Å²	71.3	18%	0.175	38%	0.378	C	S	.	.			trans	-92.8	-177.4	177.6	0	0	0	0	0	112.4	D875 K878	G873-D875 PolarHBondContact O-N 2.89Å; G873-K878 PolarHBondContact N-O 3.2Å
874	P	74.4	Confident	85.3	Confident	125 Å²	125	74.6 Å²	74.6	81%	0.812	39%	0.392	S	S	*	.	S	Bend	trans	-61.7	-21.5	175.1	-22.7	34	0	0	0	114.2	E880	P874-E880 WeakPolarHBondContact CD-OE1 3.36Å
875	D	74.8	Confident	85.5	Confident	53 Å²	53	65.9 Å²	65.9	28%	0.283	35%	0.351	S	S	.	.	S	Bend	trans	-104.5	112	168.5	175.8	-2.5	0	0	0	108	G873 L877 K878	G873-D875 PolarHBondContact O-N 2.89Å; D875-L877 PolarHBondContact O-N 3.5Å; D875-L877 WeakPolarHBondContact OD1-CB 3.37Å; D875-L877 PolarHBondContact OD1-N 3.1Å; D875-K878 HydrophobicContact CB-CB 4.3Å; D875-K878 HydrophobicContact CB-CG 4.44Å; D875-K878 CarbonylContact O-C 3.57Å; D875-K878 PolarHBondContact O-N 3.06Å; D875-K878 WeakPolarHBondContact OD2-CG 3.41Å; D875-K878 IonicContact OD2-NZ 3.54Å; D875-K878 PolarHBondContact OD2-NZ 2.99Å
876	P	71.7	Confident	85.3	Confident	103 Å²	103	68.1 Å²	68.1	67%	0.669	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-11.1	-177.1	27.3	-34.9	0	0	0	113.7	K878	P876-K878 VanDerWaalsContact C-N 3.32Å
877	L	71.4	Confident	85.1	Confident	142 Å²	142	69.1 Å²	69.1	74%	0.743	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-7.7	171.3	-58.7	174	0	0	0	112.8	D875	D875-L877 PolarHBondContact O-N 3.5Å; D875-L877 WeakPolarHBondContact OD1-CB 3.37Å; D875-L877 PolarHBondContact OD1-N 3.1Å
878	K	80.6	Confident	85.1	Confident	91 Å²	91	72.1 Å²	72.1	40%	0.396	39%	0.389	S	S	.	.	S	Bend	trans	-128.1	104.4	-179.2	-60.4	-170.7	-172.2	98.3	0	111.5	G873 D875 P876 R894	G873-K878 PolarHBondContact N-O 3.2Å; D875-K878 HydrophobicContact CB-CB 4.3Å; D875-K878 HydrophobicContact CB-CG 4.44Å; D875-K878 CarbonylContact O-C 3.57Å; D875-K878 PolarHBondContact O-N 3.06Å; D875-K878 WeakPolarHBondContact OD2-CG 3.41Å; D875-K878 IonicContact OD2-NZ 3.54Å; D875-K878 PolarHBondContact OD2-NZ 2.99Å; P876-K878 VanDerWaalsContact C-N 3.32Å; K878-R894 WeakPolarHBondContact CA-O 3.37Å
879	K	86.2	Confident	85.1	Confident	85 Å²	85	71.7 Å²	71.7	37%	0.37	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	136.2	173	-61.9	-158.2	174	-147.5	0	110.3	V870 H871 E872 T893 R894	V870-K879 HydrophobicContact CG1-CB 4.25Å; V870-K879 HydrophobicContact CG1-CD 4.29Å; H871-K879 CarbonylContact O-C 3.56Å; H871-K879 WeakPolarHBondContact O-CA 3.2Å; H871-K879 WeakPolarHBondContact O-CB 3.33Å; E872-K879 IonicContact OE1-NZ 2.7Å; K879-T893 CarbonylContact O-C 3.52Å; K879-T893 WeakPolarHBondContact O-CA 3.01Å; K879-R894 PolarHBondContact O-N 2.76Å
880	E	90.2	Very high	85.3	Confident	44 Å²	44	67.8 Å²	67.8	21%	0.206	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	151	171.9	-83.2	178.4	-149.5	0	0	109.7	V870 H871 P874 R891 V892 T893	V870-E880 CarbonylContact C-O 3.59Å; V870-E880 WeakPolarHBondContact CA-O 3.47Å; H871-E880 WeakPolarHBondContact CE1-CB 3.43Å; H871-E880 IonicContact CE1-OE2 3.82Å; H871-E880 PolarHBondContact N-O 3.47Å; H871-E880 PolarHBondContact O-N 2.95Å; P874-E880 WeakPolarHBondContact CD-OE1 3.36Å; E880-R891 IonicContact OE2-NH1 3.77Å; E880-V892 WeakPolarHBondContact CA-O 3.45Å; E880-T893 HydrophobicContact CG-CG2 3.71Å
881	A	92.1	Very high	85.4	Confident	3 Å²	3	72.6 Å²	72.6	3%	0.025	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	163.9	174.6	0	0	0	0	0	111.4	V867 V870 V892 W913	V867-A881 HydrophobicContact CG1-CB 3.69Å; V870-A881 HydrophobicContact CB-CB 4.39Å; V870-A881 HydrophobicContact CG2-CB 3.87Å; A881-V892 HydrophobicContact CB-CG2 4.08Å; A881-V892 PolarHBondContact N-O 2.85Å; A881-V892 PolarHBondContact O-N 2.73Å; A881-W913 HydrophobicContact CB-CE3 4.27Å; A881-W913 HydrophobicContact CB-CH2 3.6Å; A881-W913 HydrophobicContact CB-CZ2 4.49Å; A881-W913 HydrophobicContact CB-CZ3 3.45Å; A881-W913 VanDerWaalsContact CB-CZ3 3.45Å
882	T	91.9	Very high	85.6	Confident	23 Å²	23	69.1 Å²	69.1	14%	0.141	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.6	167.3	-59.1	0	0	0	0	109.5	V867 Y868 T889 L890	V867-T882 WeakPolarHBondContact CA-O 3.03Å; Y868-T882 HydrophobicContact CD2-CG2 4.49Å; Y868-T882 HydrophobicContact CE1-CG2 4.13Å; Y868-T882 HydrophobicContact CE2-CG2 3.71Å; Y868-T882 VanDerWaalsContact CZ-CG2 3.49Å; Y868-T882 PolarHBondContact N-O 2.8Å; Y868-T882 PolarHBondContact O-N 3.07Å; Y868-T882 VanDerWaalsContact O-O 3.14Å; Y868-T882 WeakPolarHBondContact OH-CG2 3.32Å; T882-T889 HydrophobicContact CG2-CG2 3.35Å; T882-L890 WeakPolarHBondContact CA-O 3.4Å
883	M	92.9	Very high	85.8	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.2	173.4	175.4	-179.6	-76.6	0	0	109.2	M710 V712 V865 S866 V867 V885 L890 V892 W913 V915 F922	M710-M883 HydrophobicContact SD-CE 4.48Å; V712-M883 HydrophobicContact CG1-CE 4.28Å; V712-M883 HydrophobicContact CG2-CE 3.97Å; V865-M883 HydrophobicContact CG1-CE 3.99Å; V865-M883 HydrophobicContact CG1-CG 3.79Å; V865-M883 HydrophobicContact CG1-SD 3.97Å; S866-M883 CarbonylContact O-C 3.58Å; S866-M883 VanDerWaalsContact O-CA 3.32Å; S866-M883 WeakPolarHBondContact O-CA 3.37Å; V867-M883 HydrophobicContact CG2-CB 4.18Å; V867-M883 HydrophobicContact CG2-CE 3.74Å; V867-M883 HydrophobicContact CG2-CG 4.11Å; M883-V885 HydrophobicContact CG-CB 4.5Å; M883-V885 HydrophobicContact CG-CG1 4.22Å; M883-V885 HydrophobicContact SD-CG1 4.31Å; M883-L890 HydrophobicContact CB-CB 4.44Å; M883-L890 PolarHBondContact N-O 3.24Å; M883-L890 PolarHBondContact O-N 2.86Å; M883-V892 HydrophobicContact CB-CG1 3.89Å; M883-V892 HydrophobicContact CB-CG2 3.97Å; M883-V892 HydrophobicContact CE-CG1 4.24Å; M883-V892 HydrophobicContact SD-CG1 4.11Å; M883-W913 HydrophobicContact CE-CB 3.85Å; M883-W913 HydrophobicContact CE-CG 4.24Å; M883-V915 HydrophobicContact SD-CG2 4.49Å; M883-F922 HydrophobicContact SD-CD2 4.46Å
884	E	92.2	Very high	86.3	Confident	88 Å²	88	67 Å²	67	41%	0.411	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127	169.4	-174.4	176.6	-153.5	0	0	109.4	V865 S866 Y868 H888	V865-E884 WeakPolarHBondContact CA-O 3.32Å; S866-E884 PolarHBondContact N-O 2.9Å; S866-E884 PolarHBondContact O-N 3.1Å; Y868-E884 HydrophobicContact CE1-CB 4.12Å; E884-H888 WeakPolarHBondContact CA-O 3.32Å
885	V	91.3	Very high	86.8	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	133.8	-174.1	52.2	0	0	0	0	109.1	P863 V865 M883 G887 H888 L890 F922	P863-V885 HydrophobicContact CB-CG2 4.34Å; P863-V885 HydrophobicContact CG-CG2 4.39Å; V865-V885 HydrophobicContact CG2-CB 4.07Å; V865-V885 HydrophobicContact CG2-CG2 3.77Å; M883-V885 HydrophobicContact CG-CB 4.5Å; M883-V885 HydrophobicContact CG-CG1 4.22Å; M883-V885 HydrophobicContact SD-CG1 4.31Å; V885-G887 PolarHBondContact O-N 2.86Å; V885-H888 PolarHBondContact N-O 2.91Å; V885-H888 WeakPolarHBondContact O-CA 3.49Å; V885-H888 WeakPolarHBondContact O-CB 3.28Å; V885-H888 PolarHBondContact O-N 2.82Å; V885-L890 HydrophobicContact CG1-CD1 3.52Å; V885-L890 HydrophobicContact CG1-CG 4.16Å; V885-F922 HydrophobicContact CG1-CD2 4.21Å; V885-F922 HydrophobicContact CG2-CD2 4.01Å; V885-F922 HydrophobicContact CG2-CE2 4.39Å
886	K	86.3	Confident	87.1	Confident	69 Å²	69	66.6 Å²	66.6	30%	0.3	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	36.8	179.5	-60.4	171.8	175.1	-179	0	113.6	P863 H888 F922 D924	P863-K886 HydrophobicContact CB-CG 4.22Å; K886-H888 PolarHBondContact O-N 2.89Å; K886-H888 PolarHBondContact O-ND1 2.87Å; K886-F922 PolarHBondContact NZ-O 2.76Å; K886-D924 WeakPolarHBondContact CD-OD1 3.4Å; K886-D924 WeakPolarHBondContact CE-OD1 3.32Å; K886-D924 IonicContact NZ-OD1 4Å; K886-D924 PolarHBondContact NZ-OD1 3.06Å; K886-D924 IonicContact NZ-OD2 3.5Å; K886-D924 PolarHBondContact NZ-OD2 3.04Å
887	G	85.4	Confident	87.7	Confident	70 Å²	70	64.2 Å²	64.2	72%	0.722	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	13	-176.3	0	0	0	0	0	115.8	V885	V885-G887 PolarHBondContact O-N 2.86Å
888	H	88.8	Confident	88.2	Confident	104 Å²	104	61.7 Å²	61.7	48%	0.481	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135.1	176.9	-68	71.3	0	0	0	110.9	E884 V885 K886 L890	E884-H888 WeakPolarHBondContact CA-O 3.32Å; V885-H888 PolarHBondContact N-O 2.91Å; V885-H888 WeakPolarHBondContact O-CA 3.49Å; V885-H888 WeakPolarHBondContact O-CB 3.28Å; V885-H888 PolarHBondContact O-N 2.82Å; K886-H888 PolarHBondContact O-N 2.89Å; K886-H888 PolarHBondContact O-ND1 2.87Å; H888-L890 HydrophobicContact CB-CD2 4.3Å
889	T	90.8	Very high	88.2	Confident	95 Å²	95	58.1 Å²	58.1	58%	0.583	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	118.5	174.6	-42.8	0	0	0	0	110.2	T882	T882-T889 HydrophobicContact CG2-CG2 3.35Å
890	L	92.1	Very high	87.9	Confident	24 Å²	24	57.1 Å²	57.1	13%	0.126	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.5	-173.9	-51.9	-179.9	0	0	0	111	T882 M883 V885 H888 V915 F922	T882-L890 WeakPolarHBondContact CA-O 3.4Å; M883-L890 HydrophobicContact CB-CB 4.44Å; M883-L890 PolarHBondContact N-O 3.24Å; M883-L890 PolarHBondContact O-N 2.86Å; V885-L890 HydrophobicContact CG1-CD1 3.52Å; V885-L890 HydrophobicContact CG1-CG 4.16Å; H888-L890 HydrophobicContact CB-CD2 4.3Å; L890-V915 HydrophobicContact CD1-CG1 4.1Å; L890-F922 HydrophobicContact CD1-CB 3.91Å
891	R	91.1	Very high	87.2	Confident	183 Å²	183	59.8 Å²	59.8	69%	0.691	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	128	164.3	-72.7	-176	174.7	-123.1	-3.3	109.5	E880	E880-R891 IonicContact OE2-NH1 3.77Å
892	V	91.3	Very high	86.4	Confident	1 Å²	1	67 Å²	67	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.5	-179.7	-64.7	0	0	0	0	111.2	E880 A881 M883 W913 F914 V915	E880-V892 WeakPolarHBondContact CA-O 3.45Å; A881-V892 HydrophobicContact CB-CG2 4.08Å; A881-V892 PolarHBondContact N-O 2.85Å; A881-V892 PolarHBondContact O-N 2.73Å; M883-V892 HydrophobicContact CB-CG1 3.89Å; M883-V892 HydrophobicContact CB-CG2 3.97Å; M883-V892 HydrophobicContact CE-CG1 4.24Å; M883-V892 HydrophobicContact SD-CG1 4.11Å; V892-W913 HydrophobicContact CB-CB 4.41Å; V892-W913 HydrophobicContact CB-CE3 4.41Å; V892-W913 HydrophobicContact CG2-CB 4.35Å; V892-W913 HydrophobicContact CG2-CD2 4.21Å; V892-W913 HydrophobicContact CG2-CE3 3.68Å; V892-W913 HydrophobicContact CG2-CZ3 4.29Å; V892-F914 VanDerWaalsContact CA-O 3.3Å; V892-F914 WeakPolarHBondContact CA-O 3.38Å; V892-F914 WeakPolarHBondContact CB-O 3.44Å; V892-V915 HydrophobicContact CG1-CG2 3.96Å
893	T	90	Very high	85.5	Confident	22 Å²	22	68.7 Å²	68.7	14%	0.135	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.1	172.3	50.6	0	0	0	0	110.4	K879 E880 F914 H916	K879-T893 CarbonylContact O-C 3.52Å; K879-T893 WeakPolarHBondContact O-CA 3.01Å; E880-T893 HydrophobicContact CG-CG2 3.71Å; T893-F914 PolarHBondContact N-O 3.1Å; T893-F914 VanDerWaalsContact O-CB 3.27Å; T893-F914 WeakPolarHBondContact O-CB 3.49Å; T893-F914 PolarHBondContact O-N 2.03Å; T893-H916 WeakPolarHBondContact CG2-NE2 3.32Å; T893-H916 PolarHBondContact OG1-CE1 2.97Å; T893-H916 VanDerWaalsContact OG1-CE1 3.24Å; T893-H916 PolarHBondContact OG1-NE2 2.78Å
894	R	86.6	Confident	84.3	Confident	80 Å²	80	72.9 Å²	72.9	30%	0.302	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.4	176.8	-146.8	172.2	178.3	157.9	0.8	110.8	K878 K879 Y911 C912 W913	K878-R894 WeakPolarHBondContact CA-O 3.37Å; K879-R894 PolarHBondContact O-N 2.76Å; R894-Y911 HydrophobicContact CB-CE2 4.5Å; R894-Y911 HydrophobicContact CG-CD1 4.33Å; R894-Y911 HydrophobicContact CG-CE1 3.82Å; R894-Y911 HydrophobicContact CG-CE2 4.08Å; R894-C912 WeakPolarHBondContact CA-O 3.4Å; R894-C912 WeakPolarHBondContact CG-O 3.38Å; R894-W913 HydrophobicContact CB-CD2 4.3Å; R894-W913 HydrophobicContact CB-CE3 3.62Å; R894-W913 HydrophobicContact CB-CH2 4.21Å; R894-W913 HydrophobicContact CB-CZ3 3.58Å; R894-W913 HydrophobicContact CG-CD2 3.97Å; R894-W913 HydrophobicContact CG-CE3 3.81Å; R894-W913 HydrophobicContact CG-CH2 4.39Å; R894-W913 HydrophobicContact CG-CZ3 4.05Å
895	G	84.3	Confident	83.1	Confident	10 Å²	10	76.3 Å²	76.3	10%	0.103	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	163.1	-173.9	0	0	0	0	0	113.9	Y911 C912	G895-Y911 WeakPolarHBondContact O-CA 3.06Å; G895-Y911 WeakPolarHBondContact O-CD2 3.44Å; G895-C912 PolarHBondContact N-O 2.76Å; G895-C912 PolarHBondContact O-N 3.18Å; G895-C912 VanDerWaalsContact O-N 3.1Å
896	W	82.3	Confident	82	Confident	160 Å²	160	85.7 Å²	85.7	61%	0.606	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	133.5	171.6	-68.4	104.3	0	0	0	110.5	N909 V910 Y911	W896-N909 HydrophobicContact CD2-CB 4.33Å; W896-N909 HydrophobicContact CE3-CB 3.5Å; W896-N909 VanDerWaalsContact CE3-CB 3.5Å; W896-N909 HydrophobicContact CZ3-CB 3.79Å; W896-V910 CarbonylContact C-O 3.58Å; W896-V910 WeakPolarHBondContact CA-O 3.4Å; W896-Y911 AromaticContact CD2-CD2 3.68Å; W896-Y911 HydrophobicContact CD2-CD2 3.68Å; W896-Y911 HydrophobicContact CD2-CG 4.26Å; W896-Y911 AromaticContact CE2-CD2 3.74Å; W896-Y911 HydrophobicContact CE3-CD2 4.11Å; W896-Y911 HydrophobicContact CE3-CG 4.3Å; W896-Y911 AromaticContact CG-CD2 3.94Å; W896-Y911 HydrophobicContact CG-CD2 3.94Å; W896-Y911 HydrophobicContact CH2-CG 4.46Å; W896-Y911 HydrophobicContact CZ2-CD2 4.28Å; W896-Y911 HydrophobicContact CZ2-CG 4.35Å; W896-Y911 HydrophobicContact CZ3-CG 4.43Å; W896-Y911 AromaticContact NE1-CD2 3.9Å
897	Q	83.1	Confident	81.3	Confident	54 Å²	54	82.7 Å²	82.7	25%	0.252	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	164.5	178	-69.1	-65.4	-2.7	0	0	111.2	H700 I702 C713 N909 V910 C912	H700-Q897 WeakPolarHBondContact NE2-CB 3.42Å; H700-Q897 VanDerWaalsContact NE2-CG 3.32Å; H700-Q897 WeakPolarHBondContact NE2-CG 3.42Å; I702-Q897 HydrophobicContact CD1-CB 4.43Å; C713-Q897 HydrophobicContact CB-CG 4.46Å; Q897-N909 CarbonylContact O-C 3.56Å; Q897-N909 WeakPolarHBondContact O-CA 3.39Å; Q897-V910 PolarHBondContact N-O 2.97Å; Q897-V910 PolarHBondContact O-N 2.7Å; Q897-C912 VanDerWaalsContact CG-SG 3.57Å
898	K	81.9	Confident	81.1	Confident	89 Å²	89	81.6 Å²	81.6	39%	0.387	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.6	-172.6	-74.8	-62.9	-165.6	176.2	0	113.2	F900 R906 G907 N909	K898-F900 HydrophobicContact CB-CD2 4.46Å; K898-F900 HydrophobicContact CB-CE2 3.67Å; K898-F900 HydrophobicContact CB-CZ 3.81Å; K898-F900 HydrophobicContact CG-CZ 4.35Å; K898-R906 WeakPolarHBondContact CE-O 3.3Å; K898-R906 PolarHBondContact NZ-O 3.01Å; K898-G907 PolarHBondContact NZ-O 2.79Å; K898-N909 WeakPolarHBondContact CE-OD1 3.35Å; K898-N909 PolarHBondContact NZ-OD1 2.68Å
899	D	81.2	Confident	80.8	Confident	16 Å²	16	81 Å²	81	9%	0.086	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123	171	175.7	4.2	0	0	0	110.1	I702 R901 G907 S908 V910	I702-D899 HydrophobicContact CD1-CB 4.34Å; D899-R901 VanDerWaalsContact OD1-CB 3.29Å; D899-R901 WeakPolarHBondContact OD1-CB 3.37Å; D899-R901 WeakPolarHBondContact OD1-CG 3.42Å; D899-R901 PolarHBondContact OD1-N 3.03Å; D899-R901 IonicContact OD1-NE 3.17Å; D899-R901 PolarHBondContact OD1-NE 3.14Å; D899-R901 VanDerWaalsContact OD1-NE 3.1Å; D899-R901 IonicContact OD2-CZ 2.67Å; D899-R901 IonicContact OD2-NE 3.75Å; D899-R901 PolarHBondContact OD2-NE 2.98Å; D899-R901 IonicContact OD2-NH2 3.41Å; D899-R901 PolarHBondContact OD2-NH2 3.49Å; D899-G907 CarbonylContact O-C 3.55Å; D899-G907 WeakPolarHBondContact O-CA 3.38Å; D899-S908 PolarHBondContact N-O 2.8Å; D899-S908 PolarHBondContact O-N 3.46Å; D899-V910 HydrophobicContact CB-CG2 3.64Å
900	F	80.6	Confident	80.4	Confident	63 Å²	63	77.4 Å²	77.4	28%	0.276	34%	0.34	S	S	.	.			trans	-103.2	7.6	-176.3	-63.4	-82.8	0	0	0	114.3	H825 K898 H902 R904	H825-F900 AromaticContact CE1-CD2 3.93Å; H825-F900 AromaticContact CE1-CG 3.6Å; K898-F900 HydrophobicContact CB-CD2 4.46Å; K898-F900 HydrophobicContact CB-CE2 3.67Å; K898-F900 HydrophobicContact CB-CZ 3.81Å; K898-F900 HydrophobicContact CG-CZ 4.35Å; F900-H902 VanDerWaalsContact C-N 3.3Å; F900-H902 PolarHBondContact O-N 2.73Å; F900-R904 VanDerWaalsContact O-CG 3.31Å; F900-R904 WeakPolarHBondContact O-CG 3.27Å
901	R	74.6	Confident	80.2	Confident	101 Å²	101	79.8 Å²	79.8	38%	0.381	35%	0.348	S	S	.	.	S	Bend	trans	-59.8	-37.4	180	-70	177.2	-60.5	166	-0.9	113.2	L823 Y841 D899	L823-R901 HydrophobicContact CD1-CG 4.45Å; Y841-R901 VanDerWaalsContact CD2-CD 3.42Å; Y841-R901 HydrophobicContact CD2-CG 4.46Å; Y841-R901 HydrophobicContact CG-CG 4.31Å; Y841-R901 PolarHBondContact OH-NH1 3.19Å; D899-R901 VanDerWaalsContact OD1-CB 3.29Å; D899-R901 WeakPolarHBondContact OD1-CB 3.37Å; D899-R901 WeakPolarHBondContact OD1-CG 3.42Å; D899-R901 PolarHBondContact OD1-N 3.03Å; D899-R901 IonicContact OD1-NE 3.17Å; D899-R901 PolarHBondContact OD1-NE 3.14Å; D899-R901 VanDerWaalsContact OD1-NE 3.1Å; D899-R901 IonicContact OD2-CZ 2.67Å; D899-R901 IonicContact OD2-NE 3.75Å; D899-R901 PolarHBondContact OD2-NE 2.98Å; D899-R901 IonicContact OD2-NH2 3.41Å; D899-R901 PolarHBondContact OD2-NH2 3.49Å
902	H	74.8	Confident	80.1	Confident	154 Å²	154	71.1 Å²	71.1	71%	0.713	32%	0.315	S	S	*	.	S	Bend	trans	-104.6	-48.3	-176.3	-60.7	-62.2	0	0	0	113.2	F900	F900-H902 VanDerWaalsContact C-N 3.3Å; F900-H902 PolarHBondContact O-N 2.73Å
903	D	74.3	Confident	80.1	Confident	58 Å²	58	71.8 Å²	71.8	31%	0.31	32%	0.318	S	S	.	.			trans	-111.3	93.5	172.3	-172.1	-18.2	0	0	0	110.7	K905 R906 G907	D903-K905 PolarHBondContact O-N 2.77Å; D903-K905 WeakPolarHBondContact OD1-CA 3.49Å; D903-K905 WeakPolarHBondContact OD1-CB 2.98Å; D903-K905 PolarHBondContact OD1-N 2.91Å; D903-R906 PolarHBondContact OD1-N 3.36Å; D903-R906 VanDerWaalsContact OD2-CB 3.32Å; D903-R906 WeakPolarHBondContact OD2-CB 3.32Å; D903-G907 WeakPolarHBondContact O-CA 3.46Å; D903-G907 PolarHBondContact O-N 2.82Å
904	R	67.1	Low	80.1	Confident	88 Å²	88	72.4 Å²	72.4	33%	0.332	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.5	175.3	-72.3	175	61.7	-136.4	4.1	114.3	N807 S808 L824 F900	N807-R904 PolarHBondContact O-NH1 2.68Å; N807-R904 PolarHBondContact O-NH2 2.72Å; S808-R904 PolarHBondContact O-NH2 3.32Å; S808-R904 PolarHBondContact OG-NH1 2.87Å; L824-R904 PolarHBondContact O-NH2 2.95Å; F900-R904 VanDerWaalsContact O-CG 3.31Å; F900-R904 WeakPolarHBondContact O-CG 3.27Å
905	K	66.8	Low	80.2	Confident	161 Å²	161	68.7 Å²	68.7	70%	0.7	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-44	-179.7	-71.1	-177.3	179.9	175.1	0	112.5	N693 D903	N693-K905 PolarHBondContact ND2-O 2.85Å; N693-K905 PolarHBondContact OD1-O 2.93Å; D903-K905 PolarHBondContact O-N 2.77Å; D903-K905 WeakPolarHBondContact OD1-CA 3.49Å; D903-K905 WeakPolarHBondContact OD1-CB 2.98Å; D903-K905 PolarHBondContact OD1-N 2.91Å
906	R	68.2	Low	80.4	Confident	198 Å²	198	71.9 Å²	71.9	75%	0.747	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-21.5	-177.3	-56.2	177.3	168.8	175.2	-2.4	113.6	K898 D903	K898-R906 WeakPolarHBondContact CE-O 3.3Å; K898-R906 PolarHBondContact NZ-O 3.01Å; D903-R906 PolarHBondContact OD1-N 3.36Å; D903-R906 VanDerWaalsContact OD2-CB 3.32Å; D903-R906 WeakPolarHBondContact OD2-CB 3.32Å
907	G	73.1	Confident	80.5	Confident	6 Å²	6	70.7 Å²	70.7	6%	0.062	32%	0.323	C	S	.	.			trans	67	128.2	-170.4	0	0	0	0	0	112.4	K898 D899 D903	K898-G907 PolarHBondContact NZ-O 2.79Å; D899-G907 CarbonylContact O-C 3.55Å; D899-G907 WeakPolarHBondContact O-CA 3.38Å; D903-G907 WeakPolarHBondContact O-CA 3.46Å; D903-G907 PolarHBondContact O-N 2.82Å
908	S	80.6	Confident	80.6	Confident	46 Å²	46	69.1 Å²	69.1	32%	0.322	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	142.4	166.2	-60.9	0	0	0	0	109.6	D899	D899-S908 PolarHBondContact N-O 2.8Å; D899-S908 PolarHBondContact O-N 3.46Å
909	N	81.6	Confident	80.8	Confident	93 Å²	93	64.9 Å²	64.9	50%	0.497	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.3	176.2	-64.7	-2.2	0	0	0	109.6	W896 Q897 K898	W896-N909 HydrophobicContact CD2-CB 4.33Å; W896-N909 HydrophobicContact CE3-CB 3.5Å; W896-N909 VanDerWaalsContact CE3-CB 3.5Å; W896-N909 HydrophobicContact CZ3-CB 3.79Å; Q897-N909 CarbonylContact O-C 3.56Å; Q897-N909 WeakPolarHBondContact O-CA 3.39Å; K898-N909 WeakPolarHBondContact CE-OD1 3.35Å; K898-N909 PolarHBondContact NZ-OD1 2.68Å
910	V	83.7	Confident	81.1	Confident	19 Å²	19	70.2 Å²	70.2	12%	0.115	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.7	172.2	176.8	0	0	0	0	109	I702 D711 W896 Q897 D899 C912	I702-V910 HydrophobicContact CD1-CB 4.43Å; I702-V910 HydrophobicContact CD1-CG2 4.4Å; I702-V910 HydrophobicContact CG2-CG1 4.12Å; D711-V910 HydrophobicContact CB-CG1 3.9Å; W896-V910 CarbonylContact C-O 3.58Å; W896-V910 WeakPolarHBondContact CA-O 3.4Å; Q897-V910 PolarHBondContact N-O 2.97Å; Q897-V910 PolarHBondContact O-N 2.7Å; D899-V910 HydrophobicContact CB-CG2 3.64Å; V910-C912 HydrophobicContact CG1-CB 4.41Å
911	Y	86.5	Confident	81.4	Confident	74 Å²	74	67.7 Å²	67.7	29%	0.29	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	82.3	-176.3	-168	-124.1	0	0	0	112.5	R894 G895 W896	R894-Y911 HydrophobicContact CB-CE2 4.5Å; R894-Y911 HydrophobicContact CG-CD1 4.33Å; R894-Y911 HydrophobicContact CG-CE1 3.82Å; R894-Y911 HydrophobicContact CG-CE2 4.08Å; G895-Y911 WeakPolarHBondContact O-CA 3.06Å; G895-Y911 WeakPolarHBondContact O-CD2 3.44Å; W896-Y911 AromaticContact CD2-CD2 3.68Å; W896-Y911 HydrophobicContact CD2-CD2 3.68Å; W896-Y911 HydrophobicContact CD2-CG 4.26Å; W896-Y911 AromaticContact CE2-CD2 3.74Å; W896-Y911 HydrophobicContact CE3-CD2 4.11Å; W896-Y911 HydrophobicContact CE3-CG 4.3Å; W896-Y911 AromaticContact CG-CD2 3.94Å; W896-Y911 HydrophobicContact CG-CD2 3.94Å; W896-Y911 HydrophobicContact CH2-CG 4.46Å; W896-Y911 HydrophobicContact CZ2-CD2 4.28Å; W896-Y911 HydrophobicContact CZ2-CG 4.35Å; W896-Y911 HydrophobicContact CZ3-CG 4.43Å; W896-Y911 AromaticContact NE1-CD2 3.9Å
912	C	89.9	Confident	82.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	165.2	-168.2	53.2	0	0	0	0	114	D711 C713 R894 G895 Q897 V910	D711-C912 HydrophobicContact CB-CB 3.82Å; D711-C912 WeakPolarHBondContact O-CA 3.18Å; D711-C912 WeakPolarHBondContact O-CB 3.24Å; C713-C912 HydrophobicContact CB-CB 3.92Å; C713-C912 WeakPolarHBondContact CB-SG 3.18Å; C713-C912 WeakPolarHBondContact SG-CB 3.36Å; C713-C912 CovalentContact SG-SG 2.03Å; C713-C912 PolarHBondContact SG-SG 3.01Å; R894-C912 WeakPolarHBondContact CA-O 3.4Å; R894-C912 WeakPolarHBondContact CG-O 3.38Å; G895-C912 PolarHBondContact N-O 2.76Å; G895-C912 PolarHBondContact O-N 3.18Å; G895-C912 VanDerWaalsContact O-N 3.1Å; Q897-C912 VanDerWaalsContact CG-SG 3.57Å; V910-C912 HydrophobicContact CG1-CB 4.41Å
913	W	91.5	Very high	83	Confident	15 Å²	15	55.7 Å²	55.7	6%	0.057	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.9	166.6	-66.9	114	0	0	0	110.1	D711 V712 C713 V867 V870 A881 M883 V892 R894	D711-W913 PolarHBondContact O-N 3Å; V712-W913 CarbonylContact C-O 3.51Å; V712-W913 WeakPolarHBondContact CA-O 3.5Å; C713-W913 PolarHBondContact N-O 3.16Å; V867-W913 HydrophobicContact CG1-CD2 4.34Å; V867-W913 HydrophobicContact CG1-CH2 4.1Å; V867-W913 HydrophobicContact CG1-CZ2 3.72Å; V870-W913 HydrophobicContact CG1-CH2 3.93Å; V870-W913 HydrophobicContact CG2-CH2 3.96Å; V870-W913 HydrophobicContact CG2-CZ2 4.35Å; A881-W913 HydrophobicContact CB-CE3 4.27Å; A881-W913 HydrophobicContact CB-CH2 3.6Å; A881-W913 HydrophobicContact CB-CZ2 4.49Å; A881-W913 HydrophobicContact CB-CZ3 3.45Å; A881-W913 VanDerWaalsContact CB-CZ3 3.45Å; M883-W913 HydrophobicContact CE-CB 3.85Å; M883-W913 HydrophobicContact CE-CG 4.24Å; V892-W913 HydrophobicContact CB-CB 4.41Å; V892-W913 HydrophobicContact CB-CE3 4.41Å; V892-W913 HydrophobicContact CG2-CB 4.35Å; V892-W913 HydrophobicContact CG2-CD2 4.21Å; V892-W913 HydrophobicContact CG2-CE3 3.68Å; V892-W913 HydrophobicContact CG2-CZ3 4.29Å; R894-W913 HydrophobicContact CB-CD2 4.3Å; R894-W913 HydrophobicContact CB-CE3 3.62Å; R894-W913 HydrophobicContact CB-CH2 4.21Å; R894-W913 HydrophobicContact CB-CZ3 3.58Å; R894-W913 HydrophobicContact CG-CD2 3.97Å; R894-W913 HydrophobicContact CG-CE3 3.81Å; R894-W913 HydrophobicContact CG-CH2 4.39Å; R894-W913 HydrophobicContact CG-CZ3 4.05Å
914	F	89.1	Confident	83.7	Confident	35 Å²	35	55.9 Å²	55.9	15%	0.154	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	123.4	-177.1	-165.5	-82.8	0	0	0	111.5	H700 C713 N715 V892 T893 H916	H700-F914 AromaticContact CE1-CE2 3.81Å; C713-F914 HydrophobicContact CB-CD2 3.96Å; C713-F914 CarbonylContact O-C 3.56Å; C713-F914 WeakPolarHBondContact O-CA 3.4Å; N715-F914 HydrophobicContact CB-CZ 4.42Å; N715-F914 WeakPolarHBondContact OD1-CE2 3.24Å; N715-F914 WeakPolarHBondContact OD1-CZ 3.28Å; V892-F914 VanDerWaalsContact CA-O 3.3Å; V892-F914 WeakPolarHBondContact CA-O 3.38Å; V892-F914 WeakPolarHBondContact CB-O 3.44Å; T893-F914 PolarHBondContact N-O 3.1Å; T893-F914 VanDerWaalsContact O-CB 3.27Å; T893-F914 WeakPolarHBondContact O-CB 3.49Å; T893-F914 PolarHBondContact O-N 2.03Å; F914-H916 AromaticContact CD1-CE1 3.7Å; F914-H916 AromaticContact CD1-ND1 3.75Å; F914-H916 AromaticContact CE1-ND1 3.89Å
915	V	89.9	Confident	84.7	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.1	176.3	-174.9	0	0	0	0	109.3	V712 C713 F714 M883 L890 V892 F922	V712-V915 HydrophobicContact CG1-CG2 3.71Å; C713-V915 PolarHBondContact O-N 2.96Å; F714-V915 HydrophobicContact CB-CB 4.38Å; M883-V915 HydrophobicContact SD-CG2 4.49Å; L890-V915 HydrophobicContact CD1-CG1 4.1Å; V892-V915 HydrophobicContact CG1-CG2 3.96Å; V915-F922 HydrophobicContact CG1-CB 4.03Å; V915-F922 HydrophobicContact CG2-CB 4.14Å; V915-F922 HydrophobicContact CG2-CG 4.2Å
916	H	87.3	Confident	85.8	Confident	77 Å²	77	54.8 Å²	54.8	36%	0.356	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	178.9	-179.7	-59.6	-78.3	0	0	0	112.5	T893 F914 S918 G919	T893-H916 WeakPolarHBondContact CG2-NE2 3.32Å; T893-H916 PolarHBondContact OG1-CE1 2.97Å; T893-H916 VanDerWaalsContact OG1-CE1 3.24Å; T893-H916 PolarHBondContact OG1-NE2 2.78Å; F914-H916 AromaticContact CD1-CE1 3.7Å; F914-H916 AromaticContact CD1-ND1 3.75Å; F914-H916 AromaticContact CE1-ND1 3.89Å; H916-S918 PolarHBondContact O-N 2.87Å; H916-G919 PolarHBondContact O-N 2.84Å
917	N	84.9	Confident	86.7	Confident	135 Å²	135	48.7 Å²	48.7	72%	0.722	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	46.9	178	-54.9	-48.5	0	0	0	113.3	G919 K920	N917-G919 VanDerWaalsContact C-N 3.31Å; N917-G919 PolarHBondContact O-N 3.46Å; N917-K920 HydrophobicContact CB-CB 4.36Å; N917-K920 VanDerWaalsContact O-CB 3.25Å; N917-K920 WeakPolarHBondContact O-CB 3.39Å; N917-K920 PolarHBondContact O-N 3.06Å; N917-K920 VanDerWaalsContact O-N 3.17Å
918	S	85.4	Confident	87.4	Confident	20 Å²	20	50.1 Å²	50.1	14%	0.14	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	43.4	178.3	-33.4	0	0	0	0	114.1	N715 I716 D717 H916 K920	N715-S918 VanDerWaalsContact O-CA 3.27Å; N715-S918 WeakPolarHBondContact O-CA 3.3Å; I716-S918 WeakPolarHBondContact CD1-O 3.43Å; D717-S918 PolarHBondContact OD2-OG 2.99Å; H916-S918 PolarHBondContact O-N 2.87Å; S918-K920 VanDerWaalsContact C-N 3.29Å; S918-K920 PolarHBondContact O-N 3.2Å
919	G	85.6	Confident	87.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	2.8	177.4	0	0	0	0	0	116	H916 N917 G921 F922 I923	H916-G919 PolarHBondContact O-N 2.84Å; N917-G919 VanDerWaalsContact C-N 3.31Å; N917-G919 PolarHBondContact O-N 3.46Å; G919-G921 PolarHBondContact O-N 2.92Å; G919-F922 WeakPolarHBondContact O-CB 3.35Å; G919-F922 PolarHBondContact O-N 3.3Å; G919-I923 PolarHBondContact O-N 3.34Å
920	K	87.8	Confident	88.4	Confident	129 Å²	129	47.8 Å²	47.8	56%	0.561	25%	0.246	S	C	*	.	B	Isolated β-bridge	trans	-50.9	120	-174	-179.7	-168.4	173.4	-167.4	0	112.9	N917 S918 F922	N917-K920 HydrophobicContact CB-CB 4.36Å; N917-K920 VanDerWaalsContact O-CB 3.25Å; N917-K920 WeakPolarHBondContact O-CB 3.39Å; N917-K920 PolarHBondContact O-N 3.06Å; N917-K920 VanDerWaalsContact O-N 3.17Å; S918-K920 VanDerWaalsContact C-N 3.29Å; S918-K920 PolarHBondContact O-N 3.2Å; K920-F922 VanDerWaalsContact C-N 3.31Å
921	G	86.7	Confident	88.9	Confident	9 Å²	9	49.8 Å²	49.8	9%	0.093	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	-9.5	178.6	0	0	0	0	0	114.4	G919	G919-G921 PolarHBondContact O-N 2.92Å
922	F	91.1	Very high	89.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-46.9	160.4	178.7	-107.9	0	0	0	109.6	I703 V712 F714 F859 M883 V885 K886 L890 V915 G919 K920	I703-F922 HydrophobicContact CB-CZ 4.49Å; I703-F922 HydrophobicContact CG1-CE1 4.23Å; V712-F922 HydrophobicContact CB-CE1 4.43Å; V712-F922 HydrophobicContact CB-CE2 4.26Å; V712-F922 HydrophobicContact CB-CZ 3.87Å; V712-F922 HydrophobicContact CG1-CD1 4.37Å; V712-F922 HydrophobicContact CG1-CD2 4.25Å; V712-F922 HydrophobicContact CG1-CE1 3.92Å; V712-F922 HydrophobicContact CG1-CE2 3.8Å; V712-F922 HydrophobicContact CG1-CZ 3.62Å; V712-F922 HydrophobicContact CG2-CE2 4.37Å; V712-F922 HydrophobicContact CG2-CZ 4.36Å; F714-F922 HydrophobicContact CD1-CD1 4.02Å; F714-F922 HydrophobicContact CD1-CE1 4.11Å; F714-F922 HydrophobicContact CE1-CD1 4.04Å; F714-F922 AromaticContact CE1-CE1 3.93Å; F714-F922 HydrophobicContact CE1-CE1 3.93Å; F859-F922 HydrophobicContact CD1-CE1 4.5Å; F859-F922 HydrophobicContact CD1-CZ 4.24Å; F859-F922 HydrophobicContact CE1-CD1 4.13Å; F859-F922 HydrophobicContact CE1-CD2 4.5Å; F859-F922 AromaticContact CE1-CE1 3.66Å; F859-F922 HydrophobicContact CE1-CE1 3.66Å; F859-F922 HydrophobicContact CE1-CE2 4.06Å; F859-F922 AromaticContact CE1-CZ 3.61Å; F859-F922 HydrophobicContact CE1-CZ 3.61Å; F859-F922 HydrophobicContact CE2-CD1 4.36Å; F859-F922 AromaticContact CE2-CE1 3.88Å; F859-F922 HydrophobicContact CE2-CE1 3.88Å; F859-F922 AromaticContact CZ-CD1 3.58Å; F859-F922 HydrophobicContact CZ-CD1 3.58Å; F859-F922 AromaticContact CZ-CE1 3.3Å; F859-F922 HydrophobicContact CZ-CE1 3.3Å; F859-F922 HydrophobicContact CZ-CE2 4.46Å; F859-F922 HydrophobicContact CZ-CG 4.28Å; F859-F922 AromaticContact CZ-CZ 3.79Å; F859-F922 HydrophobicContact CZ-CZ 3.79Å; M883-F922 HydrophobicContact SD-CD2 4.46Å; V885-F922 HydrophobicContact CG1-CD2 4.21Å; V885-F922 HydrophobicContact CG2-CD2 4.01Å; V885-F922 HydrophobicContact CG2-CE2 4.39Å; K886-F922 PolarHBondContact NZ-O 2.76Å; L890-F922 HydrophobicContact CD1-CB 3.91Å; V915-F922 HydrophobicContact CG1-CB 4.03Å; V915-F922 HydrophobicContact CG2-CB 4.14Å; V915-F922 HydrophobicContact CG2-CG 4.2Å; G919-F922 WeakPolarHBondContact O-CB 3.35Å; G919-F922 PolarHBondContact O-N 3.3Å; K920-F922 VanDerWaalsContact C-N 3.31Å
923	I	92	Very high	89.3	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.015	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-76.2	147.6	163.3	72.1	178.6	0	0	0	110.7	F714 L855 Q858 F859 G919 Y930	F714-I923 HydrophobicContact CE1-CG2 4.4Å; F714-I923 HydrophobicContact CE2-CG2 4.27Å; F714-I923 HydrophobicContact CZ-CG2 3.98Å; L855-I923 HydrophobicContact CD2-CD1 3.86Å; Q858-I923 VanDerWaalsContact OE1-CA 3.25Å; F859-I923 HydrophobicContact CE2-CG2 4.33Å; F859-I923 HydrophobicContact CZ-CG2 4.25Å; G919-I923 PolarHBondContact O-N 3.34Å; I923-Y930 HydrophobicContact CD1-CE2 4.31Å
924	D	89.6	Confident	89.3	Confident	62 Å²	62	55.3 Å²	55.3	33%	0.332	30%	0.297	S	S	.	.	S	Bend	trans	-67.3	140.1	170	-56.8	-47.3	0	0	0	110.3	H853 Q858 K886 Y930	H853-D924 IonicContact CE1-OD2 2.72Å; H853-D924 PolarHBondContact CE1-OD2 3.22Å; Q858-D924 PolarHBondContact OE1-OD2 3.23Å; Q858-D924 VanDerWaalsContact OE1-OD2 3.05Å; K886-D924 WeakPolarHBondContact CD-OD1 3.4Å; K886-D924 WeakPolarHBondContact CE-OD1 3.32Å; K886-D924 IonicContact NZ-OD1 4Å; K886-D924 PolarHBondContact NZ-OD1 3.06Å; K886-D924 IonicContact NZ-OD2 3.5Å; K886-D924 PolarHBondContact NZ-OD2 3.04Å; D924-Y930 VanDerWaalsContact O-CE2 3.27Å; D924-Y930 WeakPolarHBondContact O-CE2 3.38Å; D924-Y930 PolarHBondContact O-OH 2.82Å
925	G	88	Confident	89.4	Confident	53 Å²	53	54.1 Å²	54.1	55%	0.546	29%	0.292	S	S	.	.	S	Bend	trans	65.5	-131.4	-178.8	0	0	0	0	0	114.1
926	R	89.3	Confident	89.5	Confident	173 Å²	173	55.7 Å²	55.7	65%	0.653	30%	0.3	S	S	*	.			trans	-134.1	155.2	175.5	-56.5	-178.3	-175.4	-168.1	4.2	109.4	G928 D929 Y930	R926-G928 PolarHBondContact O-N 2.9Å; R926-D929 PolarHBondContact N-OD2 3.01Å; R926-D929 WeakPolarHBondContact O-CB 3.44Å; R926-D929 PolarHBondContact O-N 2.79Å; R926-Y930 WeakPolarHBondContact O-CD2 3.14Å
927	Y	86.6	Confident	89.7	Confident	71 Å²	71	53.7 Å²	53.7	28%	0.278	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-56.7	-29.1	179.9	84.9	-102.7	0	0	0	113.9	I716 D717 D929 Y930 I931	I716-Y927 HydrophobicContact CG2-CD2 3.85Å; I716-Y927 HydrophobicContact CG2-CG 3.97Å; D717-Y927 PolarHBondContact O-OH 2.94Å; D717-Y927 VanDerWaalsContact O-OH 3.06Å; Y927-D929 PolarHBondContact O-N 2.89Å; Y927-Y930 PolarHBondContact O-N 2.84Å; Y927-I931 HydrophobicContact CE2-CD1 4.37Å
928	G	89.1	Confident	90	Very high	35 Å²	35	49.1 Å²	49.1	36%	0.361	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-64.4	-25.3	178.8	0	0	0	0	0	113.7	R926 Y930 I931	R926-G928 PolarHBondContact O-N 2.9Å; G928-Y930 PolarHBondContact O-N 3.12Å; G928-I931 WeakPolarHBondContact O-CG1 3.19Å; G928-I931 PolarHBondContact O-N 2.84Å
929	D	90.8	Very high	90.2	Very high	83 Å²	83	49.1 Å²	49.1	44%	0.444	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-74.7	-14	-178.9	-46.3	-27.8	0	0	0	111.2	R926 Y927	R926-D929 PolarHBondContact N-OD2 3.01Å; R926-D929 WeakPolarHBondContact O-CB 3.44Å; R926-D929 PolarHBondContact O-N 2.79Å; Y927-D929 PolarHBondContact O-N 2.89Å
930	Y	92.9	Very high	89.9	Confident	7 Å²	7	57.2 Å²	57.2	3%	0.027	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-100.3	13.4	176.4	-55.7	-93.1	0	0	0	113.4	S725 H853 L855 Q858 I923 D924 R926 Y927 G928 L939	S725-Y930 PolarHBondContact N-O 2.91Å; H853-Y930 AromaticContact NE2-CE1 3.99Å; L855-Y930 HydrophobicContact CD1-CG 4.47Å; L855-Y930 HydrophobicContact CD2-CD1 4.29Å; L855-Y930 HydrophobicContact CD2-CD2 3.44Å; L855-Y930 VanDerWaalsContact CD2-CD2 3.44Å; L855-Y930 HydrophobicContact CD2-CE2 3.82Å; L855-Y930 HydrophobicContact CD2-CG 3.7Å; L855-Y930 HydrophobicContact CG-CD1 3.97Å; L855-Y930 HydrophobicContact CG-CD2 3.94Å; L855-Y930 HydrophobicContact CG-CG 3.62Å; Q858-Y930 PolarHBondContact NE2-OH 3.37Å; I923-Y930 HydrophobicContact CD1-CE2 4.31Å; D924-Y930 VanDerWaalsContact O-CE2 3.27Å; D924-Y930 WeakPolarHBondContact O-CE2 3.38Å; D924-Y930 PolarHBondContact O-OH 2.82Å; R926-Y930 WeakPolarHBondContact O-CD2 3.14Å; Y927-Y930 PolarHBondContact O-N 2.84Å; G928-Y930 PolarHBondContact O-N 3.12Å; Y930-L939 HydrophobicContact CD1-CD1 4.29Å; Y930-L939 HydrophobicContact CD1-CD2 3.74Å; Y930-L939 HydrophobicContact CE1-CD2 3.92Å
931	I	92.7	Very high	88.7	Confident	62 Å²	62	57.8 Å²	57.8	32%	0.318	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	119.3	177.6	-62.3	172.6	0	0	0	109.9	I723 L724 Y927 G928	I723-I931 CarbonylContact O-C 3.54Å; I723-I931 WeakPolarHBondContact O-CA 3.32Å; L724-I931 HydrophobicContact CD2-CG1 4.25Å; Y927-I931 HydrophobicContact CE2-CD1 4.37Å; G928-I931 WeakPolarHBondContact O-CG1 3.19Å; G928-I931 PolarHBondContact O-N 2.84Å
932	M	93.7	Very high	86.8	Confident	17 Å²	17	65.9 Å²	65.9	8%	0.084	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	150.7	-175.4	-55.6	-49.8	-63	0	0	112.8	I723 F938 L939	I723-M932 HydrophobicContact CB-CB 4.37Å; I723-M932 HydrophobicContact CG2-CB 4.09Å; I723-M932 PolarHBondContact O-N 2.9Å; M932-F938 WeakPolarHBondContact CE-O 3.37Å; M932-L939 HydrophobicContact SD-CD1 3.8Å
933	P	91	Very high	86.6	Confident	116 Å²	116	69.2 Å²	69.2	75%	0.753	39%	0.385	S	S	*	.	S	Bend	trans	-79.5	-26.8	175.7	32	-34.6	0	0	0	113.7
934	D	92.6	Very high	86.3	Confident	71 Å²	71	72.6 Å²	72.6	38%	0.38	40%	0.404	S	S	.	.	S	Bend	trans	-142.5	153.3	174.4	174.8	-104.1	0	0	0	112	N936 S937	D934-N936 PolarHBondContact O-N 2.78Å; D934-N936 WeakPolarHBondContact OD1-CB 3.42Å; D934-N936 PolarHBondContact OD1-N 2.7Å; D934-S937 WeakPolarHBondContact O-CB 3.3Å; D934-S937 PolarHBondContact O-N 3.21Å; D934-S937 VanDerWaalsContact O-N 3.14Å; D934-S937 PolarHBondContact O-OG 3.22Å
935	L	90.7	Very high	86.1	Confident	11 Å²	11	73.2 Å²	73.2	6%	0.058	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.7	-179.5	-84.2	169.7	0	0	0	114.9	I723 N737 Q739 I757 K770	I723-L935 HydrophobicContact CD1-CG 4.15Å; I723-L935 HydrophobicContact CG2-CD2 3.9Å; I723-L935 HydrophobicContact CG2-CG 4.4Å; N737-L935 HydrophobicContact CB-CD2 4.33Å; N737-L935 WeakPolarHBondContact CB-O 3.39Å; N737-L935 PolarHBondContact ND2-O 2.94Å; Q739-L935 HydrophobicContact CB-CD2 4.18Å; I757-L935 HydrophobicContact CG2-CD1 3.83Å; K770-L935 HydrophobicContact CD-CD1 4.24Å
936	N	91.5	Very high	86	Confident	35 Å²	35	74.4 Å²	74.4	19%	0.187	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	5.9	179.9	-63.5	8.5	0	0	0	112.9	S759 Y761 S768 K770 D934	S759-N936 PolarHBondContact OG-OD1 2.79Å; Y761-N936 HydrophobicContact CD1-CB 4.12Å; Y761-N936 HydrophobicContact CG-CB 4.14Å; S768-N936 VanDerWaalsContact CB-ND2 3.35Å; S768-N936 WeakPolarHBondContact CB-ND2 3.36Å; K770-N936 WeakPolarHBondContact CE-OD1 3.12Å; D934-N936 PolarHBondContact O-N 2.78Å; D934-N936 WeakPolarHBondContact OD1-CB 3.42Å; D934-N936 PolarHBondContact OD1-N 2.7Å
937	S	91.9	Very high	85.8	Confident	35 Å²	35	68.3 Å²	68.3	25%	0.245	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-76.3	132.4	-179.9	-62.1	0	0	0	0	112.3	V735 N737 D934	V735-S937 WeakPolarHBondContact CG1-O 3.42Å; N737-S937 PolarHBondContact ND2-O 3.22Å; D934-S937 WeakPolarHBondContact O-CB 3.3Å; D934-S937 PolarHBondContact O-N 3.21Å; D934-S937 VanDerWaalsContact O-N 3.14Å; D934-S937 PolarHBondContact O-OG 3.22Å
938	F	92.3	Very high	85.7	Confident	40 Å²	40	68.1 Å²	68.1	18%	0.175	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-68.3	145.2	164.3	-72.2	-97.7	0	0	0	110.6	T730 V735 Y761 Q763 M932 Q940	T730-F938 HydrophobicContact CG2-CD1 3.69Å; T730-F938 HydrophobicContact CG2-CE1 4.21Å; T730-F938 HydrophobicContact CG2-CG 4.39Å; V735-F938 HydrophobicContact CG2-CB 4.27Å; V735-F938 HydrophobicContact CG2-CD1 3.31Å; V735-F938 HydrophobicContact CG2-CD2 3.7Å; V735-F938 HydrophobicContact CG2-CE1 3.37Å; V735-F938 HydrophobicContact CG2-CE2 3.75Å; V735-F938 HydrophobicContact CG2-CG 3.48Å; V735-F938 VanDerWaalsContact CG2-CG 3.48Å; V735-F938 HydrophobicContact CG2-CZ 3.6Å; Y761-F938 HydrophobicContact CD1-CE2 4.36Å; Y761-F938 HydrophobicContact CE1-CE2 4.2Å; Q763-F938 HydrophobicContact CB-CE2 4.07Å; Q763-F938 HydrophobicContact CB-CZ 3.95Å; Q763-F938 HydrophobicContact CG-CE2 4.5Å; M932-F938 WeakPolarHBondContact CE-O 3.37Å; F938-Q940 PolarHBondContact O-N 3.38Å
939	L	89.4	Confident	85.5	Confident	19 Å²	19	70.4 Å²	70.4	10%	0.099	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-61.7	129.6	171.3	-173.5	64.4	0	0	0	109.4	S728 Y930 M932	S728-L939 PolarHBondContact OG-N 2.88Å; Y930-L939 HydrophobicContact CD1-CD1 4.29Å; Y930-L939 HydrophobicContact CD1-CD2 3.74Å; Y930-L939 HydrophobicContact CE1-CD2 3.92Å; M932-L939 HydrophobicContact SD-CD1 3.8Å
940	Q	78.8	Confident	85.1	Confident	170 Å²	170	69.5 Å²	69.5	79%	0.794	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-71.8	139.5	174.5	-66.1	-174.9	-5.3	0	0	109.2	F938 V942	F938-Q940 PolarHBondContact O-N 3.38Å; Q940-V942 PolarHBondContact O-N 3.25Å
941	T	61.7	Low	84.4	Confident	141 Å²	141	74.7 Å²	74.7	87%	0.865	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-64.8	124.2	-178.5	48.6	0	0	0	0	110.8
942	V	47	Very low	83.7	Confident	179 Å²	179	75.8 Å²	75.8	100%	1.085	43%	0.43	S	S	*	.			trans	-78.2	0	172.1	-174.6	0	0	0	0	110.3	Q940	Q940-V942 PolarHBondContact O-N 3.25Å

Retrieved 942 of 942 residues in 983.2 ms (Link to these results)

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