A0A087Y6P0_POEFO Loading...

Phosphatidylserine decarboxylase proenzyme, mitochondrial

Catalyzes the formation of phosphatidylethanolamine (PtdEtn) from phosphatidylserine (PtdSer). Plays a central role in phospholipid metabolism and in the interorganelle trafficking of phosphatidylserine. May be involved in lipid droplet biogenesis at the endoplasmic reticulum membrane.

AlphaFold DB , UniProt , Accession A0A087Y6P0, Species POEFO (Poecilia formosa, Amazon molly), Gene PISD, Length 370 aa.

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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	A	38.2	Very low	38	Very low	146 Å²	146	157.2 Å²	157.2	100%	1.207	88%	0.883	S	S	*	*				0	119.1	0	0	0	0	0	0	107.5
2	M	36.1	Very low	39	Very low	190 Å²	190	154.7 Å²	154.7	94%	0.936	88%	0.878	S	S	*	*				57.7	135.5	83.9	-81	-172.5	171.8	0	0	113.2
3	C	32.4	Very low	38.7	Very low	128 Å²	128	150.8 Å²	150.8	87%	0.865	88%	0.877	S	S	*	*			cis	-161.1	178.5	-13.6	-152	0	0	0	0	109
4	R	42	Very low	38.3	Very low	234 Å²	234	157.5 Å²	157.5	88%	0.883	88%	0.88	S	S	*	*			trans	-97.7	162	-177.7	-80.9	-178.1	165.5	-178.3	-3.8	114.2
5	R	37.3	Very low	38.9	Very low	233 Å²	233	155.1 Å²	155.1	88%	0.879	87%	0.874	S	S	*	*			trans	76.3	165.1	157.3	-76.7	-176.3	174.6	-176.5	-0.6	118.2
6	P	47.8	Very low	38.6	Very low	123 Å²	123	151.8 Å²	151.8	80%	0.799	87%	0.873	S	S	*	*			cis	-137.4	-165	-42.8	40.6	-22.8	0	0	0	112.9
7	A	42.2	Very low	38.3	Very low	93 Å²	93	156.9 Å²	156.9	77%	0.769	87%	0.874	S	S	*	*			trans	-91.8	162.1	-178.7	0	0	0	0	0	115.4
8	Q	33.7	Very low	38	Very low	200 Å²	200	153.2 Å²	153.2	94%	0.935	86%	0.861	S	S	*	*			trans	-162.3	150.1	154.2	-114.4	168.4	6.6	0	0	113.5
9	L	37.6	Very low	37.6	Very low	164 Å²	164	158.5 Å²	158.5	86%	0.859	87%	0.866	S	S	*	*			trans	-100.4	160.6	172.4	-87.1	159.7	0	0	0	110.5
10	P	38.7	Very low	37.3	Very low	125 Å²	125	158.7 Å²	158.7	81%	0.812	87%	0.865	S	S	*	*				-142.6	169.3	120.9	36.7	-22.5	0	0	0	115.3
11	A	32.8	Very low	37	Very low	93 Å²	93	162.9 Å²	162.9	77%	0.769	87%	0.868	S	S	*	*			trans	-131.5	-171.1	170.6	0	0	0	0	0	108.2
12	P	49	Very low	37	Very low	127 Å²	127	162.2 Å²	162.2	83%	0.825	85%	0.849	S	S	*	*			cis	-125.6	175.8	-32.6	36.2	-21.1	0	0	0	112.5
13	A	34.9	Very low	37.2	Very low	105 Å²	105	158.8 Å²	158.8	87%	0.868	84%	0.841	S	S	*	*			trans	-146.8	139.8	158.8	0	0	0	0	0	112.9
14	R	34.3	Very low	37.2	Very low	244 Å²	244	164.4 Å²	164.4	92%	0.921	84%	0.844	S	S	*	*			trans	-140.5	170	173.7	-83.8	-174.9	168.7	-173.1	-1.5	107.1
15	P	46.9	Very low	36.9	Very low	121 Å²	121	161 Å²	161	79%	0.786	84%	0.843	S	S	*	*			cis	-131.1	170.8	-49	38.3	-23.4	0	0	0	111.4
16	A	34.7	Very low	36.8	Very low	103 Å²	103	155 Å²	155	85%	0.851	84%	0.843	S	S	*	*			trans	-133.9	149.6	165.9	0	0	0	0	0	111.4
17	R	32.3	Very low	36	Very low	238 Å²	238	156.4 Å²	156.4	90%	0.898	84%	0.843	S	S	*	*			trans	-95.2	145.4	-162.1	-72	177.6	171.3	-174.9	-3.1	114.4
18	S	32.7	Very low	35.6	Very low	91 Å²	91	162 Å²	162	64%	0.636	84%	0.844	S	S	*	*			trans	7.2	139.9	148.7	61.4	0	0	0	0	120.3
19	W	30.5	Very low	35.5	Very low	253 Å²	253	159.6 Å²	159.6	96%	0.958	83%	0.832	S	S	*	*				-152	129.2	119.5	-87.6	103	0	0	0	110.5
20	L	31.9	Very low	35.3	Very low	163 Å²	163	162.6 Å²	162.6	85%	0.853	83%	0.832	S	S	*	*			trans	-79	139.7	175.3	-77.5	149.1	0	0	0	110.6
21	R	31.5	Very low	34.8	Very low	246 Å²	246	164.5 Å²	164.5	93%	0.928	84%	0.835	S	S	*	*			trans	-113.5	129	167.6	-77.9	-169.4	173.9	-155.4	-0.1	110.9
22	V	38.2	Very low	34.6	Very low	132 Å²	132	165.9 Å²	165.9	80%	0.8	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-103.2	133.2	176.3	-179.8	0	0	0	0	109.2
23	P	39.1	Very low	33.7	Very low	119 Å²	119	165 Å²	165	77%	0.773	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-77.7	134.1	169.8	-11.5	28.3	0	0	0	111.7
24	R	32.8	Very low	33.4	Very low	245 Å²	245	168.7 Å²	168.7	93%	0.925	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-86.2	155.3	174.2	-83.6	178.7	164.1	177	-5.4	111.9
25	L	35.7	Very low	33.1	Very low	164 Å²	164	162.8 Å²	162.8	86%	0.859	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-58.1	151.8	169.4	-73.3	87.6	0	0	0	112.6
26	A	35.7	Very low	32.3	Very low	106 Å²	106	162.6 Å²	162.6	88%	0.876	84%	0.844	S	S	*	*			trans	-118.3	139.1	157.5	0	0	0	0	0	109.5
27	L	31	Very low	32	Very low	152 Å²	152	161.4 Å²	161.4	80%	0.796	84%	0.842	S	S	*	*			trans	-147.7	148.9	-175.6	-176.7	134.4	0	0	0	109.3
28	R	34.3	Very low	31.9	Very low	212 Å²	212	157.1 Å²	157.1	80%	0.8	84%	0.842	S	S	*	*			trans	106.7	140.4	-170.2	-68.8	169.9	-177.3	-143.7	2.1	111.1
29	H	31.8	Very low	31.8	Very low	148 Å²	148	158.5 Å²	158.5	69%	0.685	85%	0.85	S	S	*	*			cis	-143.3	178.5	-1.4	-99.1	-48.8	0	0	0	107.4
30	R	32.1	Very low	31.7	Very low	227 Å²	227	158 Å²	158	86%	0.857	85%	0.848	S	S	*	*			cis	-148.8	-179.7	9.5	-136.6	171.5	-157.7	-160.9	6.4	108.8
31	L	29.6	Very low	32.1	Very low	166 Å²	166	155.9 Å²	155.9	87%	0.869	84%	0.844	S	S	*	*			trans	-121.8	134.4	168.2	-77.4	156.4	0	0	0	109
32	S	27.9	Very low	32.1	Very low	122 Å²	122	148.7 Å²	148.7	85%	0.853	84%	0.837	S	S	*	*			trans	170.5	95.1	146.2	55.2	0	0	0	0	113.1
33	A	29	Very low	32	Very low	108 Å²	108	147 Å²	147	89%	0.893	83%	0.829	S	S	*	*			trans	-160.8	77	158.4	0	0	0	0	0	109.1
34	L	30.1	Very low	31.6	Very low	182 Å²	182	153.9 Å²	153.9	95%	0.953	84%	0.839	S	S	*	*			trans	-103.1	136.1	167.2	-88.7	165.9	0	0	0	108.9
35	S	27.3	Very low	32	Very low	120 Å²	120	149.1 Å²	149.1	84%	0.839	83%	0.828	S	S	*	*			trans	120.1	89.6	158.3	-163	0	0	0	0	115.9
36	S	29.1	Very low	32.2	Very low	118 Å²	118	149.3 Å²	149.3	83%	0.825	82%	0.824	S	S	*	*			trans	-168.5	113.2	132.8	49.6	0	0	0	0	107.3
37	G	30.3	Very low	32.6	Very low	78 Å²	78	154.8 Å²	154.8	80%	0.804	82%	0.822	S	S	*	*			trans	-90.6	135.9	-169.7	0	0	0	0	0	113.8
38	V	29	Very low	32.9	Very low	148 Å²	148	153.4 Å²	153.4	90%	0.897	82%	0.822	S	S	*	*			trans	-133.1	116.9	153.7	179.9	0	0	0	0	107.2
39	C	30.6	Very low	33.4	Very low	119 Å²	119	149.2 Å²	149.2	80%	0.804	81%	0.814	S	S	*	*			trans	-85.3	133.3	-175.9	-77.2	0	0	0	0	112.8
40	R	29.6	Very low	33.7	Very low	244 Å²	244	146.7 Å²	146.7	92%	0.921	82%	0.819	S	S	*	*			trans	142.3	157.7	145.3	-81.4	168.3	-176.4	-150.4	1.6	111.3
41	P	38.7	Very low	34.1	Very low	117 Å²	117	142.3 Å²	142.3	76%	0.76	81%	0.806	S	S	*	*			cis	-126.9	-173.7	3.1	37.6	-20.1	0	0	0	115.3
42	A	32.4	Very low	34.5	Very low	95 Å²	95	137.5 Å²	137.5	79%	0.785	78%	0.781	S	S	*	*			trans	77.2	149.4	170.2	0	0	0	0	0	116.7
43	P	34.9	Very low	34.9	Very low	98 Å²	98	133.4 Å²	133.4	64%	0.636	76%	0.758	S	S	*	*			cis	-121.1	154.7	14.2	39.9	-27.2	0	0	0	116.1
44	W	31.9	Very low	35.5	Very low	262 Å²	262	134.3 Å²	134.3	99%	0.992	74%	0.742	S	S	*	*			trans	-122.8	93.1	157.7	-92.4	56.2	0	0	0	109.3
45	H	41.2	Very low	35.9	Very low	146 Å²	146	129.8 Å²	129.8	68%	0.676	72%	0.718	S	S	*	*			trans	-94.5	152.7	150.6	-59.4	-70.8	0	0	0	106.6
46	H	39.4	Very low	36.3	Very low	167 Å²	167	129.1 Å²	129.1	77%	0.773	71%	0.705	S	S	*	*			cis	-156.4	171.7	34.5	-73	-93	0	0	0	113.1
47	R	43.9	Very low	36.7	Very low	221 Å²	221	127.9 Å²	127.9	83%	0.834	70%	0.696	S	S	*	*			trans	82.2	89.8	158.2	-51.5	-164.1	164.3	170.3	-5.4	116
48	P	37.7	Very low	37.3	Very low	124 Å²	124	129 Å²	129	81%	0.805	69%	0.688	S	S	*	*	S	Bend		-133	56	101.3	39.7	-32.1	0	0	0	113.4
49	I	45.9	Very low	37.5	Very low	124 Å²	124	129.2 Å²	129.2	64%	0.636	68%	0.683	S	S	*	*			trans	-105.2	-13	-174.5	-61.4	176.5	0	0	0	113.1	F51 L52 G53	I49-F51 PolarHBondContact O-N 3.45Å; I49-L52 PolarHBondContact O-N 2.75Å; I49-G53 PolarHBondContact O-N 2.71Å; I49-G53 VanDerWaalsContact O-N 3.14Å
50	A	37.4	Very low	37.7	Very low	94 Å²	94	127.9 Å²	127.9	78%	0.777	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-25.4	178.8	0	0	0	0	0	113.9
51	F	40.2	Very low	38.1	Very low	136 Å²	136	123.5 Å²	123.5	60%	0.596	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-30.4	179.5	-154.9	-109.5	0	0	0	112.9	I49 W86	I49-F51 PolarHBondContact O-N 3.45Å; F51-W86 AromaticContact CE1-CH2 3.7Å; F51-W86 HydrophobicContact CE1-CH2 3.7Å; F51-W86 HydrophobicContact CE1-CZ3 4.09Å; F51-W86 HydrophobicContact CE2-CH2 4.42Å; F51-W86 AromaticContact CE2-CZ3 3.96Å; F51-W86 HydrophobicContact CE2-CZ3 3.96Å; F51-W86 AromaticContact CZ-CH2 3.46Å; F51-W86 HydrophobicContact CZ-CH2 3.46Å; F51-W86 VanDerWaalsContact CZ-CH2 3.46Å; F51-W86 AromaticContact CZ-CZ3 3.38Å; F51-W86 HydrophobicContact CZ-CZ3 3.38Å
52	L	38.2	Very low	38.1	Very low	64 Å²	64	129.4 Å²	129.4	34%	0.335	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.6	-29.1	176.1	-126.2	75.8	0	0	0	112.5	I49 F54 L55 L56	I49-L52 PolarHBondContact O-N 2.75Å; L52-F54 VanDerWaalsContact C-N 3.26Å; L52-F54 PolarHBondContact O-N 2.96Å; L52-L55 PolarHBondContact O-N 3.38Å; L52-L56 HydrophobicContact CD2-CD1 3.93Å; L52-L56 HydrophobicContact CG-CD1 4.16Å; L52-L56 PolarHBondContact O-N 3.21Å
53	G	35.2	Very low	39.3	Very low	37 Å²	37	129.6 Å²	129.6	38%	0.381	68%	0.676	S	S	.	*	H	α-helix	trans	-59.5	-30.1	-176.7	0	0	0	0	0	114.8	I49 L55 S57	I49-G53 PolarHBondContact O-N 2.71Å; I49-G53 VanDerWaalsContact O-N 3.14Å; G53-L55 VanDerWaalsContact C-N 3.34Å; G53-S57 WeakPolarHBondContact O-CB 3.12Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 2.73Å; G53-S57 VanDerWaalsContact O-OG 3.14Å
54	F	43.5	Very low	40	Very low	126 Å²	126	132.9 Å²	132.9	55%	0.553	69%	0.687	S	S	*	*	H	α-helix	trans	-77.3	-18.2	178	-165.1	-101.4	0	0	0	113.6	L52 F77	L52-F54 VanDerWaalsContact C-N 3.26Å; L52-F54 PolarHBondContact O-N 2.96Å; F54-F77 HydrophobicContact CE2-CZ 4.14Å; F54-F77 HydrophobicContact CZ-CE1 4.05Å; F54-F77 HydrophobicContact CZ-CE2 4.48Å; F54-F77 AromaticContact CZ-CZ 3.65Å; F54-F77 HydrophobicContact CZ-CZ 3.65Å
55	L	37.2	Very low	40.4	Very low	87 Å²	87	124.9 Å²	124.9	46%	0.455	68%	0.677	S	S	.	*	H	α-helix	trans	-98.4	-11.6	-179.3	-80.5	163.4	0	0	0	113.9	L52 G53 F110	L52-L55 PolarHBondContact O-N 3.38Å; G53-L55 VanDerWaalsContact C-N 3.34Å; L55-F110 HydrophobicContact CD1-CZ 4.48Å
56	L	35.5	Very low	40.9	Very low	107 Å²	107	124.2 Å²	124.2	56%	0.56	68%	0.678	S	S	*	*	H	α-helix	trans	-124.6	-3.2	-172.6	-78.1	165.6	0	0	0	115.7	L52 V58	L52-L56 HydrophobicContact CD2-CD1 3.93Å; L52-L56 HydrophobicContact CG-CD1 4.16Å; L52-L56 PolarHBondContact O-N 3.21Å; L56-V58 VanDerWaalsContact C-N 3.31Å; L56-V58 PolarHBondContact O-N 3.22Å; L56-V58 VanDerWaalsContact O-N 3.11Å
57	S	38.8	Very low	41.9	Very low	91 Å²	91	121.1 Å²	121.1	64%	0.636	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	36.1	-175.1	63.3	0	0	0	0	116.2	G53	G53-S57 WeakPolarHBondContact O-CB 3.12Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 2.73Å; G53-S57 VanDerWaalsContact O-OG 3.14Å
58	V	42.3	Very low	42.9	Very low	103 Å²	103	116.3 Å²	116.3	62%	0.624	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.9	9.1	175.5	-153.8	0	0	0	0	113.8	L56	L56-V58 VanDerWaalsContact C-N 3.31Å; L56-V58 PolarHBondContact O-N 3.22Å; L56-V58 VanDerWaalsContact O-N 3.11Å
59	N	33.7	Very low	44.5	Very low	151 Å²	151	114.7 Å²	114.7	81%	0.807	64%	0.64	S	S	*	*	S	Bend	trans	-99.2	5.9	-178.8	-90.4	-10.2	0	0	0	115.5
60	A	35	Very low	45.8	Very low	92 Å²	92	113.4 Å²	113.4	76%	0.76	63%	0.631	S	S	*	*			trans	-126.3	84.4	174.8	0	0	0	0	0	110.9
61	L	37.2	Very low	47.5	Very low	152 Å²	152	109.5 Å²	109.5	80%	0.796	60%	0.598	S	S	*	*			trans	-170.9	111.8	155.1	-102.3	158.8	0	0	0	109.7
62	R	37.9	Very low	49.1	Very low	240 Å²	240	105.5 Å²	105.5	91%	0.906	59%	0.59	S	S	*	*			trans	-82.7	172.4	176.1	-96.5	-172.1	-178.1	-168.2	2	111.1
63	P	58.9	Low	51	Low	100 Å²	100	108.4 Å²	108.4	65%	0.649	61%	0.605	S	S	*	*			trans	-97.6	175	-138.3	38.5	-39.5	0	0	0	116.7
64	L	48.1	Very low	53.1	Low	166 Å²	166	109 Å²	109	87%	0.869	60%	0.596	S	S	*	*			trans	104.4	138.9	162.7	-60.9	167	0	0	0	117.4
65	A	41.7	Very low	54.8	Low	95 Å²	95	108.8 Å²	108.8	79%	0.785	59%	0.592	S	S	*	*	S	Bend	trans	63	127.8	174.2	0	0	0	0	0	119.3
66	N	50.8	Low	56.8	Low	132 Å²	132	109.7 Å²	109.7	71%	0.706	60%	0.601	S	S	*	*			trans	47.5	83.5	170.7	-76.3	2.5	0	0	0	118.7
67	R	61.1	Low	59	Low	102 Å²	102	108.1 Å²	108.1	39%	0.385	59%	0.59	S	S	.	*			trans	-95.2	-6.6	167.3	-75.2	176.9	169.2	-159.5	-3.4	114.5	Q70 V71 W250	R67-Q70 WeakPolarHBondContact O-CA 3.36Å; R67-Q70 WeakPolarHBondContact O-CB 3.3Å; R67-Q70 PolarHBondContact O-N 2.82Å; R67-V71 WeakPolarHBondContact O-CG2 3.32Å; R67-V71 PolarHBondContact O-N 3.22Å; R67-W250 HydrophobicContact CB-CE3 4.33Å; R67-W250 HydrophobicContact CG-CE3 4.34Å
68	D	63.7	Low	61	Low	120 Å²	120	107.1 Å²	107.1	64%	0.642	58%	0.581	S	S	*	*	H	α-helix	trans	-54.8	-45.1	-176.6	-61.9	-33	0	0	0	115.2	Q70 V71 A72	D68-Q70 VanDerWaalsContact C-N 3.3Å; D68-Q70 PolarHBondContact O-N 3.09Å; D68-V71 PolarHBondContact O-N 3.06Å; D68-A72 WeakPolarHBondContact O-CB 3.48Å; D68-A72 PolarHBondContact O-N 2.81Å
69	P	71.8	Confident	62.9	Low	89 Å²	89	102.7 Å²	102.7	58%	0.578	55%	0.554	S	S	*	*	H	α-helix	trans	-66.5	-30.8	175.3	25.3	-34	0	0	0	112.8	L73	P69-L73 WeakPolarHBondContact O-CB 3.5Å; P69-L73 PolarHBondContact O-N 3.4Å
70	Q	72.9	Confident	65.1	Low	98 Å²	98	96.3 Å²	96.3	46%	0.458	52%	0.519	S	S	.	.	H	α-helix	trans	-70.7	-40	175.4	-58.3	178.6	-8.7	0	0	111.1	R67 D68 L73 Y74 W250	R67-Q70 WeakPolarHBondContact O-CA 3.36Å; R67-Q70 WeakPolarHBondContact O-CB 3.3Å; R67-Q70 PolarHBondContact O-N 2.82Å; D68-Q70 VanDerWaalsContact C-N 3.3Å; D68-Q70 PolarHBondContact O-N 3.09Å; Q70-L73 PolarHBondContact O-N 3.25Å; Q70-Y74 VanDerWaalsContact O-CB 3.31Å; Q70-Y74 WeakPolarHBondContact O-CB 3.44Å; Q70-Y74 PolarHBondContact O-N 2.86Å; Q70-W250 HydrophobicContact CB-CZ3 3.8Å
71	V	73.8	Confident	67.3	Low	11 Å²	11	96.8 Å²	96.8	7%	0.067	51%	0.508	C	S	.	.	H	α-helix	trans	-67.9	-38	174.6	173.8	0	0	0	0	111	R67 D68 Y74 R75 W250 V251	R67-V71 WeakPolarHBondContact O-CG2 3.32Å; R67-V71 PolarHBondContact O-N 3.22Å; D68-V71 PolarHBondContact O-N 3.06Å; V71-Y74 PolarHBondContact O-N 3.13Å; V71-R75 HydrophobicContact CG1-CG 4.5Å; V71-R75 WeakPolarHBondContact O-CB 3.45Å; V71-R75 VanDerWaalsContact O-CG 3.24Å; V71-R75 WeakPolarHBondContact O-CG 3.16Å; V71-R75 PolarHBondContact O-N 3.05Å; V71-W250 HydrophobicContact CG2-CD2 4.24Å; V71-W250 HydrophobicContact CG2-CE3 4.07Å; V71-V251 HydrophobicContact CG1-CG2 4.37Å; V71-V251 HydrophobicContact CG2-CG2 4.46Å
72	A	74.9	Confident	69.5	Low	53 Å²	53	91.5 Å²	91.5	44%	0.438	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-48.1	173.7	0	0	0	0	0	111.7	D68 Y74 R75 T76	D68-A72 WeakPolarHBondContact O-CB 3.48Å; D68-A72 PolarHBondContact O-N 2.81Å; A72-Y74 VanDerWaalsContact C-N 3.34Å; A72-Y74 PolarHBondContact O-N 2.71Å; A72-R75 WeakPolarHBondContact O-CB 3.2Å; A72-R75 PolarHBondContact O-N 3.16Å; A72-T76 PolarHBondContact O-N 2.83Å; A72-T76 VanDerWaalsContact O-N 3.17Å
73	L	77.8	Confident	71.6	Confident	125 Å²	125	80.1 Å²	80.1	65%	0.654	44%	0.439	S	S	*	.	H	α-helix	trans	-63	-38.1	174.7	-178.6	62.4	0	0	0	112.4	P69 Q70 R75 T76 F77	P69-L73 WeakPolarHBondContact O-CB 3.5Å; P69-L73 PolarHBondContact O-N 3.4Å; Q70-L73 PolarHBondContact O-N 3.25Å; L73-R75 VanDerWaalsContact C-N 3.31Å; L73-R75 PolarHBondContact O-N 2.77Å; L73-T76 PolarHBondContact O-N 3.23Å; L73-T76 PolarHBondContact O-OG1 3.33Å; L73-F77 PolarHBondContact O-N 3.28Å
74	Y	79.3	Confident	72.7	Confident	49 Å²	49	78.8 Å²	78.8	19%	0.192	42%	0.421	C	S	.	.	H	α-helix	trans	-67.3	-33.5	175.7	-173.2	-121.1	0	0	0	112.3	Q70 V71 A72 T76 F77 M241 S242 V247 V251	Q70-Y74 VanDerWaalsContact O-CB 3.31Å; Q70-Y74 WeakPolarHBondContact O-CB 3.44Å; Q70-Y74 PolarHBondContact O-N 2.86Å; V71-Y74 PolarHBondContact O-N 3.13Å; A72-Y74 VanDerWaalsContact C-N 3.34Å; A72-Y74 PolarHBondContact O-N 2.71Å; Y74-T76 VanDerWaalsContact C-N 3.35Å; Y74-F77 WeakPolarHBondContact O-CB 3.04Å; Y74-F77 PolarHBondContact O-N 3.45Å; Y74-M241 HydrophobicContact CD1-CG 4.17Å; Y74-M241 HydrophobicContact CD1-SD 4.01Å; Y74-M241 HydrophobicContact CE1-CB 3.75Å; Y74-M241 HydrophobicContact CE1-CG 3.64Å; Y74-M241 HydrophobicContact CE1-SD 3.99Å; Y74-S242 PolarHBondContact OH-N 3.49Å; Y74-V247 HydrophobicContact CE1-CG1 3.86Å; Y74-V251 HydrophobicContact CD1-CG2 4.32Å
75	R	78.6	Confident	74.4	Confident	121 Å²	121	73.6 Å²	73.6	46%	0.457	40%	0.402	S	S	.	.	H	α-helix	trans	-70.4	-24.4	174.4	-75.9	170.1	174.2	-172.7	-0.8	113.6	V71 A72 L73 M241 L257	V71-R75 HydrophobicContact CG1-CG 4.5Å; V71-R75 WeakPolarHBondContact O-CB 3.45Å; V71-R75 VanDerWaalsContact O-CG 3.24Å; V71-R75 WeakPolarHBondContact O-CG 3.16Å; V71-R75 PolarHBondContact O-N 3.05Å; A72-R75 WeakPolarHBondContact O-CB 3.2Å; A72-R75 PolarHBondContact O-N 3.16Å; L73-R75 VanDerWaalsContact C-N 3.31Å; L73-R75 PolarHBondContact O-N 2.77Å; R75-M241 HydrophobicContact CG-SD 4.11Å; R75-L257 VanDerWaalsContact NH2-CD1 3.29Å
76	T	79.6	Confident	76.4	Confident	106 Å²	106	71.1 Å²	71.1	65%	0.65	37%	0.373	S	S	*	.	H	α-helix	trans	-83.9	-14.8	173.4	59.9	0	0	0	0	113.3	A72 L73 Y74	A72-T76 PolarHBondContact O-N 2.83Å; A72-T76 VanDerWaalsContact O-N 3.17Å; L73-T76 PolarHBondContact O-N 3.23Å; L73-T76 PolarHBondContact O-OG1 3.33Å; Y74-T76 VanDerWaalsContact C-N 3.35Å
77	F	81.4	Confident	77.9	Confident	75 Å²	75	66.2 Å²	66.2	33%	0.329	35%	0.353	S	S	.	.	S	Bend	trans	-60.2	132	175.2	-171.5	-99.7	0	0	0	110.8	F54 L73 Y74 T79 V82	F54-F77 HydrophobicContact CE2-CZ 4.14Å; F54-F77 HydrophobicContact CZ-CE1 4.05Å; F54-F77 HydrophobicContact CZ-CE2 4.48Å; F54-F77 AromaticContact CZ-CZ 3.65Å; F54-F77 HydrophobicContact CZ-CZ 3.65Å; L73-F77 PolarHBondContact O-N 3.28Å; Y74-F77 WeakPolarHBondContact O-CB 3.04Å; Y74-F77 PolarHBondContact O-N 3.45Å; F77-T79 HydrophobicContact CD1-CG2 3.83Å; F77-T79 PolarHBondContact O-N 3.29Å; F77-V82 HydrophobicContact CE1-CB 4.42Å; F77-V82 HydrophobicContact CE1-CG2 3.8Å; F77-V82 HydrophobicContact CZ-CG2 3.87Å
78	P	80.8	Confident	79.1	Confident	70 Å²	70	71.1 Å²	71.1	46%	0.455	37%	0.372	S	S	.	.			trans	-78.5	58.1	-172.4	33.9	-38.2	0	0	0	112.4	R80 L81 V82	P78-R80 VanDerWaalsContact C-N 3.26Å; P78-R80 PolarHBondContact O-N 2.73Å; P78-R80 VanDerWaalsContact O-N 3.13Å; P78-L81 HydrophobicContact CB-CB 4.1Å; P78-L81 WeakPolarHBondContact O-CB 2.88Å; P78-L81 PolarHBondContact O-N 3.08Å; P78-V82 PolarHBondContact O-N 2.84Å; P78-V82 VanDerWaalsContact O-N 3.09Å
79	T	81.3	Confident	80.1	Confident	9 Å²	9	69.6 Å²	69.6	6%	0.055	36%	0.363	C	S	.	.	H	α-helix	trans	-47.7	-41.7	-176.9	49	0	0	0	0	113.7	F77 S83 L240 M241	F77-T79 HydrophobicContact CD1-CG2 3.83Å; F77-T79 PolarHBondContact O-N 3.29Å; T79-S83 VanDerWaalsContact O-CB 3.29Å; T79-S83 WeakPolarHBondContact O-CB 3.24Å; T79-S83 PolarHBondContact O-N 2.85Å; T79-S83 PolarHBondContact O-OG 3.2Å; T79-L240 WeakPolarHBondContact CB-O 3.46Å; T79-L240 WeakPolarHBondContact CG2-O 3.44Å; T79-L240 PolarHBondContact OG1-N 2.96Å; T79-M241 HydrophobicContact CG2-CG 4.44Å
80	R	80	Confident	80.7	Confident	17 Å²	17	65.8 Å²	65.8	6%	0.064	34%	0.338	C	S	.	.	H	α-helix	trans	-66.9	-40.8	176.4	-63.8	178.9	76.3	73.4	-1.4	112.8	P78 S83 R84 G238 L240 E259 N296 A297 Y300	P78-R80 VanDerWaalsContact C-N 3.26Å; P78-R80 PolarHBondContact O-N 2.73Å; P78-R80 VanDerWaalsContact O-N 3.13Å; R80-S83 PolarHBondContact O-N 3.43Å; R80-R84 WeakPolarHBondContact O-CB 3.41Å; R80-R84 VanDerWaalsContact O-CG 3.31Å; R80-R84 WeakPolarHBondContact O-CG 3.22Å; R80-R84 PolarHBondContact O-N 3.04Å; R80-G238 WeakPolarHBondContact CD-O 3.4Å; R80-G238 PolarHBondContact NH1-O 3.36Å; R80-L240 HydrophobicContact CG-CD1 4.2Å; R80-L240 HydrophobicContact CG-CG 4.22Å; R80-E259 IonicContact CZ-OE2 3.42Å; R80-E259 IonicContact NH1-OE2 2.68Å; R80-E259 PolarHBondContact NH1-OE2 3.41Å; R80-E259 IonicContact NH2-OE1 3.93Å; R80-E259 IonicContact NH2-OE2 3.28Å; R80-E259 PolarHBondContact NH2-OE2 2.55Å; R80-N296 VanDerWaalsContact NH2-CA 3.27Å; R80-A297 VanDerWaalsContact NH2-N 3.19Å; R80-A297 PolarHBondContact NH2-O 2.86Å; R80-Y300 VanDerWaalsContact CD-CE1 3.44Å
81	L	81.4	Confident	81.3	Confident	103 Å²	103	63.2 Å²	63.2	54%	0.539	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-46.4	177.8	-178.3	63.3	0	0	0	110.5	P78 R84 A85	P78-L81 HydrophobicContact CB-CB 4.1Å; P78-L81 WeakPolarHBondContact O-CB 2.88Å; P78-L81 PolarHBondContact O-N 3.08Å; L81-R84 PolarHBondContact O-N 3.48Å; L81-A85 WeakPolarHBondContact O-CB 3.46Å; L81-A85 PolarHBondContact O-N 2.66Å
82	V	83.6	Confident	82	Confident	41 Å²	41	68 Å²	68	25%	0.248	36%	0.363	C	S	.	.	H	α-helix	trans	-60.9	-46.8	175.7	177	0	0	0	0	110.7	F77 P78 R84 A85 W86	F77-V82 HydrophobicContact CE1-CB 4.42Å; F77-V82 HydrophobicContact CE1-CG2 3.8Å; F77-V82 HydrophobicContact CZ-CG2 3.87Å; P78-V82 PolarHBondContact O-N 2.84Å; P78-V82 VanDerWaalsContact O-N 3.09Å; V82-R84 VanDerWaalsContact C-N 3.32Å; V82-R84 PolarHBondContact O-N 3.07Å; V82-A85 PolarHBondContact O-N 2.91Å; V82-W86 VanDerWaalsContact O-CB 3.25Å; V82-W86 WeakPolarHBondContact O-CB 3.34Å; V82-W86 PolarHBondContact O-N 2.72Å
83	S	81.6	Confident	82.9	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-33.3	179.9	-53.9	0	0	0	0	112.8	T79 R80 G87 N281	T79-S83 VanDerWaalsContact O-CB 3.29Å; T79-S83 WeakPolarHBondContact O-CB 3.24Å; T79-S83 PolarHBondContact O-N 2.85Å; T79-S83 PolarHBondContact O-OG 3.2Å; R80-S83 PolarHBondContact O-N 3.43Å; S83-G87 PolarHBondContact O-N 2.85Å; S83-N281 PolarHBondContact OG-N 2.86Å
84	R	83.8	Confident	83.6	Confident	72 Å²	72	65.8 Å²	65.8	27%	0.272	34%	0.344	S	S	.	.	H	α-helix	trans	-71.6	-41.3	171.9	-71.3	-173.3	-53.5	-118.5	9	112.8	R80 L81 V82 W86 G87 R88 N296	R80-R84 WeakPolarHBondContact O-CB 3.41Å; R80-R84 VanDerWaalsContact O-CG 3.31Å; R80-R84 WeakPolarHBondContact O-CG 3.22Å; R80-R84 PolarHBondContact O-N 3.04Å; L81-R84 PolarHBondContact O-N 3.48Å; V82-R84 VanDerWaalsContact C-N 3.32Å; V82-R84 PolarHBondContact O-N 3.07Å; R84-W86 VanDerWaalsContact C-N 3.34Å; R84-G87 PolarHBondContact O-N 2.88Å; R84-R88 WeakPolarHBondContact O-CG 3.4Å; R84-R88 PolarHBondContact O-N 2.94Å; R84-N296 WeakPolarHBondContact CG-ND2 3.21Å; R84-N296 WeakPolarHBondContact CG-OD1 3.12Å
85	A	83.6	Confident	84.3	Confident	57 Å²	57	66.4 Å²	66.4	47%	0.471	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-43.6	175.5	0	0	0	0	0	111	L81 V82 R88 L89	L81-A85 WeakPolarHBondContact O-CB 3.46Å; L81-A85 PolarHBondContact O-N 2.66Å; V82-A85 PolarHBondContact O-N 2.91Å; A85-R88 PolarHBondContact O-N 3.12Å; A85-L89 WeakPolarHBondContact O-CB 3.34Å; A85-L89 PolarHBondContact O-N 2.81Å
86	W	83.8	Confident	85	Confident	43 Å²	43	64.7 Å²	64.7	16%	0.163	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-45	174.3	-169.2	-105.5	0	0	0	112.3	F51 V82 R84 R88 L89 N90 N281	F51-W86 AromaticContact CE1-CH2 3.7Å; F51-W86 HydrophobicContact CE1-CH2 3.7Å; F51-W86 HydrophobicContact CE1-CZ3 4.09Å; F51-W86 HydrophobicContact CE2-CH2 4.42Å; F51-W86 AromaticContact CE2-CZ3 3.96Å; F51-W86 HydrophobicContact CE2-CZ3 3.96Å; F51-W86 AromaticContact CZ-CH2 3.46Å; F51-W86 HydrophobicContact CZ-CH2 3.46Å; F51-W86 VanDerWaalsContact CZ-CH2 3.46Å; F51-W86 AromaticContact CZ-CZ3 3.38Å; F51-W86 HydrophobicContact CZ-CZ3 3.38Å; V82-W86 VanDerWaalsContact O-CB 3.25Å; V82-W86 WeakPolarHBondContact O-CB 3.34Å; V82-W86 PolarHBondContact O-N 2.72Å; R84-W86 VanDerWaalsContact C-N 3.34Å; W86-R88 VanDerWaalsContact C-N 3.32Å; W86-R88 PolarHBondContact O-N 2.87Å; W86-L89 HydrophobicContact CE3-CD2 4.18Å; W86-L89 HydrophobicContact CZ3-CD2 4.12Å; W86-L89 PolarHBondContact O-N 2.82Å; W86-N90 PolarHBondContact NE1-ND2 3.04Å; W86-N90 WeakPolarHBondContact O-CB 3.31Å; W86-N90 PolarHBondContact O-N 3.48Å; W86-N90 PolarHBondContact O-ND2 2.85Å; W86-N90 VanDerWaalsContact O-ND2 3.17Å; W86-N281 VanDerWaalsContact CD1-CB 3.44Å; W86-N281 HydrophobicContact CG-CB 4.09Å
87	G	82.2	Confident	85.7	Confident	29 Å²	29	68.6 Å²	68.6	30%	0.299	36%	0.36	S	S	.	.	H	α-helix	trans	-60.1	-38.9	174.3	0	0	0	0	0	113.3	S83 R84 G91	S83-G87 PolarHBondContact O-N 2.85Å; R84-G87 PolarHBondContact O-N 2.88Å; G87-G91 PolarHBondContact O-N 2.93Å
88	R	84.6	Confident	86.2	Confident	206 Å²	206	67.4 Å²	67.4	78%	0.777	36%	0.356	S	S	*	.	H	α-helix	trans	-65.3	-49.3	172.6	-74.6	176.8	177.5	-173.4	-2.8	111.7	R84 A85 W86 N90 G91 L92	R84-R88 WeakPolarHBondContact O-CG 3.4Å; R84-R88 PolarHBondContact O-N 2.94Å; A85-R88 PolarHBondContact O-N 3.12Å; W86-R88 VanDerWaalsContact C-N 3.32Å; W86-R88 PolarHBondContact O-N 2.87Å; R88-N90 VanDerWaalsContact C-N 3.3Å; R88-N90 PolarHBondContact O-N 3.4Å; R88-G91 PolarHBondContact O-N 2.82Å; R88-G91 VanDerWaalsContact O-N 3.08Å; R88-L92 PolarHBondContact O-N 2.99Å
89	L	85.8	Confident	86.9	Confident	88 Å²	88	65.8 Å²	65.8	46%	0.461	34%	0.341	S	S	.	.	H	α-helix	trans	-55.6	-45.2	177.9	-173.6	105.9	0	0	0	111.6	A85 W86 G91 L92	A85-L89 WeakPolarHBondContact O-CB 3.34Å; A85-L89 PolarHBondContact O-N 2.81Å; W86-L89 HydrophobicContact CE3-CD2 4.18Å; W86-L89 HydrophobicContact CZ3-CD2 4.12Å; W86-L89 PolarHBondContact O-N 2.82Å; L89-G91 PolarHBondContact O-N 2.89Å; L89-L92 WeakPolarHBondContact O-CB 3.28Å; L89-L92 PolarHBondContact O-N 3.09Å; L89-L92 VanDerWaalsContact O-N 3.15Å
90	N	84	Confident	87.4	Confident	9 Å²	9	70.9 Å²	70.9	5%	0.048	36%	0.363	C	S	.	.	H	α-helix	trans	-74.2	-12.2	-179.5	-63.5	-24.2	0	0	0	114.1	W86 R88 N127 L128 G129 L337	W86-N90 PolarHBondContact NE1-ND2 3.04Å; W86-N90 WeakPolarHBondContact O-CB 3.31Å; W86-N90 PolarHBondContact O-N 3.48Å; W86-N90 PolarHBondContact O-ND2 2.85Å; W86-N90 VanDerWaalsContact O-ND2 3.17Å; R88-N90 VanDerWaalsContact C-N 3.3Å; R88-N90 PolarHBondContact O-N 3.4Å; N90-N127 VanDerWaalsContact O-CB 3.28Å; N90-N127 WeakPolarHBondContact O-CB 3.43Å; N90-N127 PolarHBondContact O-OD1 2.87Å; N90-N127 VanDerWaalsContact O-OD1 3.08Å; N90-L128 HydrophobicContact CB-CB 4.2Å; N90-L128 PolarHBondContact O-N 3.31Å; N90-L128 WeakPolarHBondContact OD1-CD2 3.43Å; N90-G129 PolarHBondContact O-N 2.76Å; N90-L337 WeakPolarHBondContact ND2-CD1 3.28Å
91	G	85	Confident	88.1	Confident	44 Å²	44	73.6 Å²	73.6	45%	0.454	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-1.4	171	0	0	0	0	0	113.7	G87 R88 L89	G87-G91 PolarHBondContact O-N 2.93Å; R88-G91 PolarHBondContact O-N 2.82Å; R88-G91 VanDerWaalsContact O-N 3.08Å; L89-G91 PolarHBondContact O-N 2.89Å
92	L	89.5	Confident	88.7	Confident	112 Å²	112	71.5 Å²	71.5	59%	0.586	37%	0.371	S	S	*	.	S	Bend	trans	-79.4	125.9	173.7	-61.9	178.3	0	0	0	110	R88 L89 L94 N127	R88-L92 PolarHBondContact O-N 2.99Å; L89-L92 WeakPolarHBondContact O-CB 3.28Å; L89-L92 PolarHBondContact O-N 3.09Å; L89-L92 VanDerWaalsContact O-N 3.15Å; L92-L94 PolarHBondContact O-N 3.24Å; L92-N127 WeakPolarHBondContact O-CB 3.48Å
93	D	93.2	Very high	89.2	Confident	95 Å²	95	69.6 Å²	69.6	51%	0.508	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-65.6	120.9	177.6	-78.6	4.2	0	0	0	110.8	K126 N127	D93-K126 CarbonylContact C-O 3.54Å; D93-K126 WeakPolarHBondContact CA-O 3.37Å; D93-K126 WeakPolarHBondContact OD1-CB 3.34Å; D93-N127 PolarHBondContact OD1-ND2 2.8Å
94	L	92.6	Very high	89.8	Confident	36 Å²	36	71.9 Å²	71.9	19%	0.188	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-77.4	136.2	177.5	-62.7	174.2	0	0	0	109.3	L92 R99 I102 Y103 K126	L92-L94 PolarHBondContact O-N 3.24Å; L94-R99 HydrophobicContact CB-CG 3.94Å; L94-R99 PolarHBondContact O-NE 3.32Å; L94-R99 PolarHBondContact O-NH2 2.81Å; L94-I102 HydrophobicContact CD1-CB 4.46Å; L94-I102 HydrophobicContact CD1-CD1 3.98Å; L94-I102 HydrophobicContact CD1-CG2 4.23Å; L94-I102 HydrophobicContact CD2-CD1 3.96Å; L94-Y103 HydrophobicContact CD1-CE1 3.8Å; L94-K126 PolarHBondContact N-O 2.77Å
95	P	93.8	Very high	90.3	Very high	62 Å²	62	73.1 Å²	73.1	40%	0.403	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-52.3	142.9	165.5	-27.6	36.3	0	0	0	111.2	W97 L98 R99	P95-W97 HydrophobicContact CB-CG 4.44Å; P95-W97 PolarHBondContact O-N 2.85Å; P95-W97 VanDerWaalsContact O-N 3.15Å; P95-L98 HydrophobicContact CB-CD1 4.23Å; P95-L98 HydrophobicContact CG-CD1 3.93Å; P95-L98 WeakPolarHBondContact O-CA 3.42Å; P95-L98 WeakPolarHBondContact O-CB 3.49Å; P95-L98 PolarHBondContact O-N 2.84Å; P95-R99 PolarHBondContact O-N 2.8Å
96	T	92.7	Very high	90.7	Very high	85 Å²	85	71.6 Å²	71.6	52%	0.521	37%	0.369	S	S	.	.	H	α-helix	trans	-55.9	-37.1	-173	45.3	0	0	0	0	113.4	L98 R99	T96-L98 VanDerWaalsContact C-N 3.3Å; T96-L98 PolarHBondContact O-N 3.22Å; T96-R99 PolarHBondContact O-N 3.48Å
97	W	94.3	Very high	91.2	Very high	188 Å²	188	71.3 Å²	71.3	71%	0.712	37%	0.371	S	S	*	.	H	α-helix	trans	-68.1	-22.6	176.1	66.7	-92.6	0	0	0	114.3	P95 P101	P95-W97 HydrophobicContact CB-CG 4.44Å; P95-W97 PolarHBondContact O-N 2.85Å; P95-W97 VanDerWaalsContact O-N 3.15Å; W97-P101 VanDerWaalsContact O-CD 3.24Å; W97-P101 WeakPolarHBondContact O-CD 3.3Å; W97-P101 WeakPolarHBondContact O-CG 3.41Å
98	L	93.6	Very high	91.8	Very high	49 Å²	49	79.4 Å²	79.4	26%	0.257	39%	0.392	S	S	.	.	H	α-helix	trans	-87.2	-24.2	175.7	-85.4	160.5	0	0	0	113.2	P95 T96 P101 I102	P95-L98 HydrophobicContact CB-CD1 4.23Å; P95-L98 HydrophobicContact CG-CD1 3.93Å; P95-L98 WeakPolarHBondContact O-CA 3.42Å; P95-L98 WeakPolarHBondContact O-CB 3.49Å; P95-L98 PolarHBondContact O-N 2.84Å; T96-L98 VanDerWaalsContact C-N 3.3Å; T96-L98 PolarHBondContact O-N 3.22Å; L98-P101 WeakPolarHBondContact O-CD 3.26Å; L98-P101 WeakPolarHBondContact O-CG 3.32Å; L98-I102 HydrophobicContact CB-CD1 4.07Å; L98-I102 HydrophobicContact CD2-CD1 4.03Å; L98-I102 WeakPolarHBondContact O-CB 3.37Å; L98-I102 VanDerWaalsContact O-CG1 3.29Å; L98-I102 WeakPolarHBondContact O-CG1 3.41Å; L98-I102 PolarHBondContact O-N 2.76Å; L98-I102 VanDerWaalsContact O-N 3.11Å
99	R	93.8	Very high	92.1	Very high	36 Å²	36	71.8 Å²	71.8	14%	0.136	37%	0.369	C	S	.	.	H	α-helix	trans	-56.6	-58.7	-177.5	-70.5	174.3	-166.9	-170	-1.2	111.7	L94 P95 T96 I102 Y103 H123 Y125	L94-R99 HydrophobicContact CB-CG 3.94Å; L94-R99 PolarHBondContact O-NE 3.32Å; L94-R99 PolarHBondContact O-NH2 2.81Å; P95-R99 PolarHBondContact O-N 2.8Å; T96-R99 PolarHBondContact O-N 3.48Å; R99-I102 PolarHBondContact O-N 2.92Å; R99-Y103 HydrophobicContact CB-CD2 3.97Å; R99-Y103 HydrophobicContact CB-CE2 3.6Å; R99-Y103 HydrophobicContact CG-CE2 3.86Å; R99-Y103 WeakPolarHBondContact O-CB 3.34Å; R99-Y103 WeakPolarHBondContact O-CD2 3.34Å; R99-Y103 VanDerWaalsContact O-CG 3.22Å; R99-Y103 PolarHBondContact O-N 2.8Å; R99-H123 VanDerWaalsContact CD-O 3.28Å; R99-H123 WeakPolarHBondContact CD-O 3.37Å; R99-H123 PolarHBondContact NH1-O 3.01Å; R99-Y125 VanDerWaalsContact CD-O 3.23Å; R99-Y125 WeakPolarHBondContact CD-O 3.28Å
100	K	93.7	Very high	92.4	Very high	117 Å²	117	70.5 Å²	70.5	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-55	-54.8	-178.6	-171.2	171.6	-176.7	176	0	112.9	I102 S104 L122	K100-I102 PolarHBondContact O-N 2.87Å; K100-S104 WeakPolarHBondContact O-CB 3.17Å; K100-S104 PolarHBondContact O-N 2.88Å; K100-S104 PolarHBondContact O-OG 2.87Å; K100-L122 HydrophobicContact CG-CD1 4.42Å
101	P	94.8	Very high	92.7	Very high	74 Å²	74	73.1 Å²	73.1	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-64.4	-39.9	-179.2	23.4	-32.9	0	0	0	113.6	W97 L98 L105	W97-P101 VanDerWaalsContact O-CD 3.24Å; W97-P101 WeakPolarHBondContact O-CD 3.3Å; W97-P101 WeakPolarHBondContact O-CG 3.41Å; L98-P101 WeakPolarHBondContact O-CD 3.26Å; L98-P101 WeakPolarHBondContact O-CG 3.32Å; P101-L105 WeakPolarHBondContact O-CB 3.41Å; P101-L105 PolarHBondContact O-N 3.13Å
102	I	93.4	Very high	93.1	Very high	59 Å²	59	71.4 Å²	71.4	30%	0.303	37%	0.369	S	S	.	.	H	α-helix	trans	-66.1	-48.4	179	-68.9	174.1	0	0	0	110.9	L94 L98 R99 K100 L105 Y106	L94-I102 HydrophobicContact CD1-CB 4.46Å; L94-I102 HydrophobicContact CD1-CD1 3.98Å; L94-I102 HydrophobicContact CD1-CG2 4.23Å; L94-I102 HydrophobicContact CD2-CD1 3.96Å; L98-I102 HydrophobicContact CB-CD1 4.07Å; L98-I102 HydrophobicContact CD2-CD1 4.03Å; L98-I102 WeakPolarHBondContact O-CB 3.37Å; L98-I102 VanDerWaalsContact O-CG1 3.29Å; L98-I102 WeakPolarHBondContact O-CG1 3.41Å; L98-I102 PolarHBondContact O-N 2.76Å; L98-I102 VanDerWaalsContact O-N 3.11Å; R99-I102 PolarHBondContact O-N 2.92Å; K100-I102 PolarHBondContact O-N 2.87Å; I102-L105 PolarHBondContact O-N 3.09Å; I102-Y106 PolarHBondContact O-N 3.48Å
103	Y	94.6	Very high	93.3	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-70.3	-36.9	-179.6	-56.6	-35.4	0	0	0	111.6	L94 R99 L105 Y106 I107 L122 Y125 N127 L128 F131	L94-Y103 HydrophobicContact CD1-CE1 3.8Å; R99-Y103 HydrophobicContact CB-CD2 3.97Å; R99-Y103 HydrophobicContact CB-CE2 3.6Å; R99-Y103 HydrophobicContact CG-CE2 3.86Å; R99-Y103 WeakPolarHBondContact O-CB 3.34Å; R99-Y103 WeakPolarHBondContact O-CD2 3.34Å; R99-Y103 VanDerWaalsContact O-CG 3.22Å; R99-Y103 PolarHBondContact O-N 2.8Å; Y103-L105 PolarHBondContact O-N 3.37Å; Y103-Y106 WeakPolarHBondContact O-CB 3.06Å; Y103-Y106 PolarHBondContact O-N 3.35Å; Y103-I107 WeakPolarHBondContact O-CB 3.21Å; Y103-I107 WeakPolarHBondContact O-CD1 3.17Å; Y103-I107 WeakPolarHBondContact O-CG1 3.44Å; Y103-I107 PolarHBondContact O-N 3.1Å; Y103-L122 HydrophobicContact CD2-CB 4.11Å; Y103-L122 WeakPolarHBondContact CD2-O 3.5Å; Y103-L122 VanDerWaalsContact CE2-O 3.29Å; Y103-L122 WeakPolarHBondContact CE2-O 3.18Å; Y103-Y125 WeakPolarHBondContact CE2-O 3.27Å; Y103-Y125 PolarHBondContact OH-O 3.31Å; Y103-N127 VanDerWaalsContact OH-CA 3.24Å; Y103-N127 WeakPolarHBondContact OH-CA 3.39Å; Y103-N127 PolarHBondContact OH-N 2.87Å; Y103-N127 PolarHBondContact OH-O 3.4Å; Y103-L128 HydrophobicContact CD1-CD1 3.84Å; Y103-L128 HydrophobicContact CE1-CB 4.42Å; Y103-L128 HydrophobicContact CE1-CD1 3.83Å; Y103-F131 HydrophobicContact CD1-CB 4.01Å; Y103-F131 HydrophobicContact CD1-CD1 4.18Å; Y103-F131 HydrophobicContact CD1-CD2 4.15Å; Y103-F131 AromaticContact CD1-CG 3.82Å; Y103-F131 HydrophobicContact CD1-CG 3.82Å; Y103-F131 HydrophobicContact CD2-CD2 4.3Å; Y103-F131 HydrophobicContact CE1-CB 3.79Å; Y103-F131 HydrophobicContact CE1-CG 4.14Å; Y103-F131 AromaticContact CG-CD2 3.97Å; Y103-F131 HydrophobicContact CG-CD2 3.97Å; Y103-F131 HydrophobicContact CG-CE2 4.41Å; Y103-F131 HydrophobicContact CG-CG 4.13Å
104	S	94.1	Very high	93.4	Very high	48 Å²	48	65.6 Å²	65.6	34%	0.336	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-40.9	172.4	-66.3	0	0	0	0	112.6	K100 Y106 I107 W108	K100-S104 WeakPolarHBondContact O-CB 3.17Å; K100-S104 PolarHBondContact O-N 2.88Å; K100-S104 PolarHBondContact O-OG 2.87Å; S104-Y106 VanDerWaalsContact C-N 3.34Å; S104-I107 PolarHBondContact O-N 2.9Å; S104-W108 WeakPolarHBondContact O-CB 3.04Å; S104-W108 PolarHBondContact O-N 2.58Å
105	L	93.9	Very high	93.5	Very high	99 Å²	99	70.4 Å²	70.4	52%	0.518	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-41.3	173.4	177.9	62.7	0	0	0	111.5	P101 I102 Y103 W108 T109	P101-L105 WeakPolarHBondContact O-CB 3.41Å; P101-L105 PolarHBondContact O-N 3.13Å; I102-L105 PolarHBondContact O-N 3.09Å; Y103-L105 PolarHBondContact O-N 3.37Å; L105-W108 HydrophobicContact CD1-CE3 4.17Å; L105-T109 VanDerWaalsContact O-CB 3.31Å; L105-T109 WeakPolarHBondContact O-CB 3.16Å; L105-T109 PolarHBondContact O-N 3.18Å; L105-T109 PolarHBondContact O-OG1 3.29Å
106	Y	91.4	Very high	93.5	Very high	25 Å²	25	68.7 Å²	68.7	10%	0.098	35%	0.347	C	S	.	.	H	α-helix	trans	-63.7	-47.5	176.3	-166.5	-78.1	0	0	0	111.9	I102 Y103 S104 W108 T109 F110 V112 L128 F131 F132 P216	I102-Y106 PolarHBondContact O-N 3.48Å; Y103-Y106 WeakPolarHBondContact O-CB 3.06Å; Y103-Y106 PolarHBondContact O-N 3.35Å; S104-Y106 VanDerWaalsContact C-N 3.34Å; Y106-W108 VanDerWaalsContact C-N 3.33Å; Y106-W108 PolarHBondContact O-N 2.92Å; Y106-T109 PolarHBondContact O-N 2.85Å; Y106-F110 AromaticContact CD1-CD2 3.67Å; Y106-F110 HydrophobicContact CD1-CD2 3.67Å; Y106-F110 HydrophobicContact CD1-CE2 4.43Å; Y106-F110 AromaticContact CD2-CD2 3.8Å; Y106-F110 HydrophobicContact CD2-CD2 3.8Å; Y106-F110 AromaticContact CD2-CE2 3.73Å; Y106-F110 HydrophobicContact CD2-CE2 3.73Å; Y106-F110 HydrophobicContact CE1-CB 4.25Å; Y106-F110 AromaticContact CE1-CD2 3.51Å; Y106-F110 HydrophobicContact CE1-CD2 3.51Å; Y106-F110 HydrophobicContact CE1-CE2 4.24Å; Y106-F110 HydrophobicContact CE1-CG 4.19Å; Y106-F110 AromaticContact CE2-CD2 3.65Å; Y106-F110 HydrophobicContact CE2-CD2 3.65Å; Y106-F110 AromaticContact CE2-CE2 3.5Å; Y106-F110 HydrophobicContact CE2-CE2 3.5Å; Y106-F110 AromaticContact CG-CD2 3.81Å; Y106-F110 HydrophobicContact CG-CD2 3.81Å; Y106-F110 HydrophobicContact CG-CE2 4.2Å; Y106-F110 AromaticContact CZ-CD2 3.49Å; Y106-F110 VanDerWaalsContact CZ-CD2 3.49Å; Y106-F110 AromaticContact CZ-CE2 3.78Å; Y106-F110 WeakPolarHBondContact O-CD2 2.97Å; Y106-F110 PolarHBondContact O-N 2.87Å; Y106-V112 HydrophobicContact CD1-CG2 3.98Å; Y106-V112 HydrophobicContact CE1-CG2 4.02Å; Y106-L128 HydrophobicContact CD2-CD1 4Å; Y106-L128 HydrophobicContact CD2-CD2 4.41Å; Y106-L128 HydrophobicContact CE2-CD1 4.4Å; Y106-L128 HydrophobicContact CE2-CD2 4.43Å; Y106-L128 HydrophobicContact CG-CD1 4.43Å; Y106-F131 HydrophobicContact CD1-CD1 4.4Å; Y106-F131 AromaticContact CD1-CE1 3.63Å; Y106-F131 HydrophobicContact CD1-CE1 3.63Å; Y106-F131 HydrophobicContact CE1-CE1 4.14Å; Y106-F131 HydrophobicContact CG-CE1 4.21Å; Y106-F132 WeakPolarHBondContact OH-CD2 3.39Å; Y106-F132 WeakPolarHBondContact OH-CE2 3.42Å; Y106-P216 PolarHBondContact OH-O 2.92Å
107	I	94.3	Very high	93.6	Very high	37 Å²	37	64.7 Å²	64.7	19%	0.19	32%	0.322	C	S	.	.	H	α-helix	trans	-56.2	-48.3	177.8	-72.2	159.1	0	0	0	110.6	Y103 S104 G111 V112 M114 L122 F131	Y103-I107 WeakPolarHBondContact O-CB 3.21Å; Y103-I107 WeakPolarHBondContact O-CD1 3.17Å; Y103-I107 WeakPolarHBondContact O-CG1 3.44Å; Y103-I107 PolarHBondContact O-N 3.1Å; S104-I107 PolarHBondContact O-N 2.9Å; I107-G111 WeakPolarHBondContact O-CA 3.44Å; I107-G111 PolarHBondContact O-N 2.99Å; I107-V112 HydrophobicContact CB-CB 4.33Å; I107-V112 HydrophobicContact CG1-CB 3.99Å; I107-V112 HydrophobicContact CG1-CG1 4.29Å; I107-V112 HydrophobicContact CG2-CB 4.4Å; I107-V112 PolarHBondContact O-N 2.82Å; I107-M114 HydrophobicContact CD1-CG 3.55Å; I107-M114 HydrophobicContact CD1-SD 4.11Å; I107-M114 HydrophobicContact CG1-CG 4.03Å; I107-M114 HydrophobicContact CG1-SD 4.41Å; I107-L122 HydrophobicContact CD1-CD1 3.88Å; I107-L122 HydrophobicContact CD1-CD2 3.73Å; I107-L122 HydrophobicContact CD1-CG 4.47Å; I107-F131 HydrophobicContact CD1-CE2 4.21Å; I107-F131 HydrophobicContact CD1-CZ 4.04Å; I107-F131 HydrophobicContact CG1-CE2 4.37Å; I107-F131 HydrophobicContact CG1-CZ 3.7Å
108	W	94.6	Very high	93.6	Very high	199 Å²	199	58.3 Å²	58.3	75%	0.754	31%	0.309	S	S	*	.	H	α-helix	trans	-64.6	-43.6	177.2	176.3	81.8	0	0	0	112.6	S104 L105 Y106 F110	S104-W108 WeakPolarHBondContact O-CB 3.04Å; S104-W108 PolarHBondContact O-N 2.58Å; L105-W108 HydrophobicContact CD1-CE3 4.17Å; Y106-W108 VanDerWaalsContact C-N 3.33Å; Y106-W108 PolarHBondContact O-N 2.92Å; W108-F110 PolarHBondContact O-N 3.21Å
109	T	92	Very high	93.6	Very high	46 Å²	46	58.8 Å²	58.8	28%	0.282	31%	0.314	S	S	.	.	H	α-helix	trans	-66.5	-37.1	-177.5	-56.7	0	0	0	0	112.6	L105 Y106	L105-T109 VanDerWaalsContact O-CB 3.31Å; L105-T109 WeakPolarHBondContact O-CB 3.16Å; L105-T109 PolarHBondContact O-N 3.18Å; L105-T109 PolarHBondContact O-OG1 3.29Å; Y106-T109 PolarHBondContact O-N 2.85Å
110	F	90.4	Very high	93.6	Very high	61 Å²	61	61.8 Å²	61.8	27%	0.268	33%	0.329	S	S	.	.	H	α-helix	trans	-112.9	-1.3	-172.1	-60.4	-67.4	0	0	0	114.8	L55 Y106 W108 V112 P216	L55-F110 HydrophobicContact CD1-CZ 4.48Å; Y106-F110 AromaticContact CD1-CD2 3.67Å; Y106-F110 HydrophobicContact CD1-CD2 3.67Å; Y106-F110 HydrophobicContact CD1-CE2 4.43Å; Y106-F110 AromaticContact CD2-CD2 3.8Å; Y106-F110 HydrophobicContact CD2-CD2 3.8Å; Y106-F110 AromaticContact CD2-CE2 3.73Å; Y106-F110 HydrophobicContact CD2-CE2 3.73Å; Y106-F110 HydrophobicContact CE1-CB 4.25Å; Y106-F110 AromaticContact CE1-CD2 3.51Å; Y106-F110 HydrophobicContact CE1-CD2 3.51Å; Y106-F110 HydrophobicContact CE1-CE2 4.24Å; Y106-F110 HydrophobicContact CE1-CG 4.19Å; Y106-F110 AromaticContact CE2-CD2 3.65Å; Y106-F110 HydrophobicContact CE2-CD2 3.65Å; Y106-F110 AromaticContact CE2-CE2 3.5Å; Y106-F110 HydrophobicContact CE2-CE2 3.5Å; Y106-F110 AromaticContact CG-CD2 3.81Å; Y106-F110 HydrophobicContact CG-CD2 3.81Å; Y106-F110 HydrophobicContact CG-CE2 4.2Å; Y106-F110 AromaticContact CZ-CD2 3.49Å; Y106-F110 VanDerWaalsContact CZ-CD2 3.49Å; Y106-F110 AromaticContact CZ-CE2 3.78Å; Y106-F110 WeakPolarHBondContact O-CD2 2.97Å; Y106-F110 PolarHBondContact O-N 2.87Å; W108-F110 PolarHBondContact O-N 3.21Å; F110-V112 HydrophobicContact CB-CG2 4.49Å; F110-P216 HydrophobicContact CD1-CB 3.73Å; F110-P216 HydrophobicContact CD1-CG 4.09Å; F110-P216 HydrophobicContact CD2-CB 4.48Å; F110-P216 HydrophobicContact CE1-CB 3.94Å; F110-P216 HydrophobicContact CE1-CG 4.02Å; F110-P216 HydrophobicContact CG-CB 4.02Å; F110-P216 HydrophobicContact CZ-CB 4.39Å
111	G	92.3	Very high	93.6	Very high	64 Å²	64	59.3 Å²	59.3	66%	0.66	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	36.7	177.7	0	0	0	0	0	113.7	I107 N113	I107-G111 WeakPolarHBondContact O-CA 3.44Å; I107-G111 PolarHBondContact O-N 2.99Å; G111-N113 PolarHBondContact O-N 3.27Å
112	V	93.2	Very high	93.6	Very high	8 Å²	8	56.7 Å²	56.7	5%	0.048	30%	0.304	C	S	.	.			trans	-67.4	120.7	-179.2	174.1	0	0	0	0	110.3	Y106 I107 F110 M114 F131	Y106-V112 HydrophobicContact CD1-CG2 3.98Å; Y106-V112 HydrophobicContact CE1-CG2 4.02Å; I107-V112 HydrophobicContact CB-CB 4.33Å; I107-V112 HydrophobicContact CG1-CB 3.99Å; I107-V112 HydrophobicContact CG1-CG1 4.29Å; I107-V112 HydrophobicContact CG2-CB 4.4Å; I107-V112 PolarHBondContact O-N 2.82Å; F110-V112 HydrophobicContact CB-CG2 4.49Å; V112-M114 HydrophobicContact CG1-CG 4.32Å; V112-M114 HydrophobicContact CG1-SD 3.82Å; V112-M114 PolarHBondContact O-N 2.83Å; V112-F131 HydrophobicContact CG1-CZ 4.21Å
113	N	93.6	Very high	93.5	Very high	60 Å²	60	57.3 Å²	57.3	32%	0.321	31%	0.305	S	S	.	.			trans	-79.2	107.3	169.2	-168.5	1.5	0	0	0	110.7	G111 Q115 E116	G111-N113 PolarHBondContact O-N 3.27Å; N113-Q115 WeakPolarHBondContact OD1-CB 3.49Å; N113-Q115 PolarHBondContact OD1-N 3.34Å; N113-Q115 VanDerWaalsContact OD1-N 3.07Å; N113-E116 HydrophobicContact CB-CG 4.5Å; N113-E116 WeakPolarHBondContact ND2-CG 3.46Å; N113-E116 PolarHBondContact ND2-OE1 3.08Å
114	M	93.8	Very high	93.5	Very high	24 Å²	24	63.2 Å²	63.2	12%	0.118	33%	0.332	C	S	.	.	S	Bend	trans	-79	-21.9	176.4	-73.3	-55.7	-57.9	0	0	113.8	I107 V112 E116 A117 L122 Y125 F131	I107-M114 HydrophobicContact CD1-CG 3.55Å; I107-M114 HydrophobicContact CD1-SD 4.11Å; I107-M114 HydrophobicContact CG1-CG 4.03Å; I107-M114 HydrophobicContact CG1-SD 4.41Å; V112-M114 HydrophobicContact CG1-CG 4.32Å; V112-M114 HydrophobicContact CG1-SD 3.82Å; V112-M114 PolarHBondContact O-N 2.83Å; M114-E116 PolarHBondContact O-N 3.01Å; M114-E116 VanDerWaalsContact O-N 3.15Å; M114-A117 HydrophobicContact CE-CB 3.78Å; M114-A117 VanDerWaalsContact O-CB 3.29Å; M114-A117 WeakPolarHBondContact O-CB 3.49Å; M114-A117 PolarHBondContact O-N 2.77Å; M114-A117 HydrophobicContact SD-CB 4.46Å; M114-L122 HydrophobicContact CE-CD2 3.88Å; M114-L122 HydrophobicContact CG-CD2 4.48Å; M114-L122 HydrophobicContact SD-CD2 4.32Å; M114-Y125 HydrophobicContact CE-CE2 4.06Å; M114-F131 HydrophobicContact CE-CE2 4.16Å; M114-F131 HydrophobicContact SD-CE2 3.6Å; M114-F131 VanDerWaalsContact SD-CE2 3.6Å; M114-F131 HydrophobicContact SD-CZ 3.91Å
115	Q	94.6	Very high	93.4	Very high	138 Å²	138	61.5 Å²	61.5	65%	0.645	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.5	179.3	-59	171.7	0.9	0	0	112.3	N113 K137	N113-Q115 WeakPolarHBondContact OD1-CB 3.49Å; N113-Q115 PolarHBondContact OD1-N 3.34Å; N113-Q115 VanDerWaalsContact OD1-N 3.07Å; Q115-K137 WeakPolarHBondContact O-CE 3.46Å; Q115-K137 PolarHBondContact O-NZ 3.31Å
116	E	94.6	Very high	93.4	Very high	26 Å²	26	61.9 Å²	61.9	12%	0.121	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-14.9	176.4	-70.6	176.7	-144.2	0	0	112.9	N113 M114 L136 K137 V140 R141 R362	N113-E116 HydrophobicContact CB-CG 4.5Å; N113-E116 WeakPolarHBondContact ND2-CG 3.46Å; N113-E116 PolarHBondContact ND2-OE1 3.08Å; M114-E116 PolarHBondContact O-N 3.01Å; M114-E116 VanDerWaalsContact O-N 3.15Å; E116-L136 HydrophobicContact CB-CD2 4.31Å; E116-L136 CarbonylContact O-C 3.54Å; E116-L136 VanDerWaalsContact O-CA 3.26Å; E116-L136 WeakPolarHBondContact O-CA 3.15Å; E116-K137 PolarHBondContact O-N 3.29Å; E116-V140 HydrophobicContact CB-CG2 4.08Å; E116-V140 HydrophobicContact CG-CB 4.31Å; E116-V140 HydrophobicContact CG-CG1 4.26Å; E116-V140 HydrophobicContact CG-CG2 4.36Å; E116-R141 IonicContact OE2-CZ 3.35Å; E116-R141 IonicContact OE2-NH1 3.18Å; E116-R141 PolarHBondContact OE2-NH1 3.34Å; E116-R141 IonicContact OE2-NH2 3.17Å; E116-R141 PolarHBondContact OE2-NH2 3.5Å; E116-R362 IonicContact OE1-NH2 2.78Å; E116-R362 PolarHBondContact OE1-NH2 3.3Å
117	A	94.6	Very high	93.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-73.5	144.4	-179.4	0	0	0	0	0	111.7	M114 V119 K137	M114-A117 HydrophobicContact CE-CB 3.78Å; M114-A117 VanDerWaalsContact O-CB 3.29Å; M114-A117 WeakPolarHBondContact O-CB 3.49Å; M114-A117 PolarHBondContact O-N 2.77Å; M114-A117 HydrophobicContact SD-CB 4.46Å; A117-V119 PolarHBondContact O-N 3.16Å; A117-K137 VanDerWaalsContact O-CE 3.22Å; A117-K137 WeakPolarHBondContact O-CE 3.19Å; A117-K137 WeakPolarHBondContact O-CG 3.46Å
118	A	94.3	Very high	93.1	Very high	54 Å²	54	61.1 Å²	61.1	45%	0.446	31%	0.314	S	S	.	.	S	Bend	trans	-66.1	-26.7	176.3	0	0	0	0	0	112.7	R135	A118-R135 HydrophobicContact CB-CB 4.04Å; A118-R135 WeakPolarHBondContact CB-O 3.26Å; A118-R135 PolarHBondContact N-O 2.76Å
119	V	94.6	Very high	92.8	Very high	60 Å²	60	52 Å²	52	36%	0.364	28%	0.283	S	S	.	.			trans	-125.6	110	174.1	-179	0	0	0	0	107.7	A117 H124 Y125	A117-V119 PolarHBondContact O-N 3.16Å; V119-H124 HydrophobicContact CG1-CB 3.69Å; V119-Y125 WeakPolarHBondContact O-CE2 3.47Å; V119-Y125 PolarHBondContact O-OH 3.43Å
120	E	93.8	Very high	92.7	Very high	98 Å²	98	53.2 Å²	53.2	46%	0.458	29%	0.285	S	S	.	.			trans	-83	-27.3	-178.1	-59.2	-168.3	-143.9	0	0	112.5	L122 K137	E120-L122 PolarHBondContact O-N 3.08Å; E120-K137 WeakPolarHBondContact OE1-CE 3.36Å; E120-K137 IonicContact OE1-NZ 3.5Å; E120-K137 PolarHBondContact OE1-NZ 2.81Å
121	D	93.8	Very high	92.8	Very high	65 Å²	65	50.3 Å²	50.3	35%	0.348	27%	0.272	S	S	.	.			trans	-73.6	118.2	-178.5	176	36.3	0	0	0	112.5	H123 H124	D121-H123 PolarHBondContact O-N 2.83Å; D121-H123 IonicContact OD1-CE1 2.66Å; D121-H123 IonicContact OD1-CG 3.18Å; D121-H123 PolarHBondContact OD1-N 3.33Å; D121-H123 IonicContact OD1-ND1 2.75Å; D121-H123 PolarHBondContact OD1-ND1 2.81Å; D121-H123 WeakPolarHBondContact OD2-CB 3.4Å; D121-H123 IonicContact OD2-ND1 3.74Å; D121-H124 PolarHBondContact O-N 3.36Å; D121-H124 IonicContact OD2-CE1 3.31Å; D121-H124 PolarHBondContact OD2-CE1 3.14Å; D121-H124 VanDerWaalsContact OD2-CE1 3.31Å; D121-H124 IonicContact OD2-CG 3.99Å; D121-H124 IonicContact OD2-ND1 2.75Å; D121-H124 PolarHBondContact OD2-ND1 2.75Å
122	L	93.4	Very high	92.5	Very high	20 Å²	20	47.3 Å²	47.3	11%	0.105	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.2	-178.2	-59.7	-175.4	0	0	0	113.6	K100 Y103 I107 M114 E120 H124 F131	K100-L122 HydrophobicContact CG-CD1 4.42Å; Y103-L122 HydrophobicContact CD2-CB 4.11Å; Y103-L122 WeakPolarHBondContact CD2-O 3.5Å; Y103-L122 VanDerWaalsContact CE2-O 3.29Å; Y103-L122 WeakPolarHBondContact CE2-O 3.18Å; I107-L122 HydrophobicContact CD1-CD1 3.88Å; I107-L122 HydrophobicContact CD1-CD2 3.73Å; I107-L122 HydrophobicContact CD1-CG 4.47Å; M114-L122 HydrophobicContact CE-CD2 3.88Å; M114-L122 HydrophobicContact CG-CD2 4.48Å; M114-L122 HydrophobicContact SD-CD2 4.32Å; E120-L122 PolarHBondContact O-N 3.08Å; L122-H124 VanDerWaalsContact C-N 3.33Å; L122-F131 HydrophobicContact CD2-CD2 4.43Å; L122-F131 HydrophobicContact CD2-CE2 3.88Å
123	H	92.5	Very high	92.2	Very high	72 Å²	72	50.4 Å²	50.4	33%	0.333	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.3	178.8	-54	90.9	0	0	0	113.4	R99 D121	R99-H123 VanDerWaalsContact CD-O 3.28Å; R99-H123 WeakPolarHBondContact CD-O 3.37Å; R99-H123 PolarHBondContact NH1-O 3.01Å; D121-H123 PolarHBondContact O-N 2.83Å; D121-H123 IonicContact OD1-CE1 2.66Å; D121-H123 IonicContact OD1-CG 3.18Å; D121-H123 PolarHBondContact OD1-N 3.33Å; D121-H123 IonicContact OD1-ND1 2.75Å; D121-H123 PolarHBondContact OD1-ND1 2.81Å; D121-H123 WeakPolarHBondContact OD2-CB 3.4Å; D121-H123 IonicContact OD2-ND1 3.74Å
124	H	93	Very high	92.1	Very high	123 Å²	123	48 Å²	48	57%	0.569	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-33.5	-178.8	-77.6	69.1	0	0	0	112.7	V119 D121 L122 K126	V119-H124 HydrophobicContact CG1-CB 3.69Å; D121-H124 PolarHBondContact O-N 3.36Å; D121-H124 IonicContact OD2-CE1 3.31Å; D121-H124 PolarHBondContact OD2-CE1 3.14Å; D121-H124 VanDerWaalsContact OD2-CE1 3.31Å; D121-H124 IonicContact OD2-CG 3.99Å; D121-H124 IonicContact OD2-ND1 2.75Å; D121-H124 PolarHBondContact OD2-ND1 2.75Å; L122-H124 VanDerWaalsContact C-N 3.33Å; H124-K126 PolarHBondContact O-N 3.05Å
125	Y	93.5	Very high	92.1	Very high	13 Å²	13	52.1 Å²	52.1	5%	0.051	25%	0.252	C	S	.	.			trans	-70.8	112.8	177	-60.4	-76.4	0	0	0	111.2	R99 Y103 M114 V119 N127 E130 F131 R134	R99-Y125 VanDerWaalsContact CD-O 3.23Å; R99-Y125 WeakPolarHBondContact CD-O 3.28Å; Y103-Y125 WeakPolarHBondContact CE2-O 3.27Å; Y103-Y125 PolarHBondContact OH-O 3.31Å; M114-Y125 HydrophobicContact CE-CE2 4.06Å; V119-Y125 WeakPolarHBondContact O-CE2 3.47Å; V119-Y125 PolarHBondContact O-OH 3.43Å; Y125-N127 PolarHBondContact O-N 2.86Å; Y125-E130 HydrophobicContact CD1-CB 4.46Å; Y125-E130 HydrophobicContact CD1-CG 4.11Å; Y125-F131 VanDerWaalsContact CD1-CA 3.45Å; Y125-F131 HydrophobicContact CD1-CB 4.15Å; Y125-F131 AromaticContact CD2-CD2 3.85Å; Y125-F131 HydrophobicContact CD2-CD2 3.85Å; Y125-F131 HydrophobicContact CE2-CD2 4.07Å; Y125-F131 HydrophobicContact CG-CB 4.03Å; Y125-F131 HydrophobicContact CG-CD2 4.08Å; Y125-R134 HydrophobicContact CE1-CB 3.84Å; Y125-R134 WeakPolarHBondContact OH-CB 3.48Å
126	K	93.5	Very high	92.1	Very high	106 Å²	106	46.5 Å²	46.5	46%	0.461	23%	0.227	S	C	.	.			trans	-67.6	-39.4	-175.7	-59.3	178.9	-176.9	-179.8	0	112.4	D93 L94 H124 E130	D93-K126 CarbonylContact C-O 3.54Å; D93-K126 WeakPolarHBondContact CA-O 3.37Å; D93-K126 WeakPolarHBondContact OD1-CB 3.34Å; L94-K126 PolarHBondContact N-O 2.77Å; H124-K126 PolarHBondContact O-N 3.05Å; K126-E130 WeakPolarHBondContact CB-OE2 3.48Å; K126-E130 WeakPolarHBondContact CG-OE2 3.15Å; K126-E130 PolarHBondContact N-OE2 2.95Å
127	N	92	Very high	92.1	Very high	22 Å²	22	48.7 Å²	48.7	12%	0.118	24%	0.236	C	C	.	.	S	Bend	trans	-146.3	167.7	-175	58.4	61.5	0	0	0	112.1	N90 L92 D93 Y103 Y125 G129 E130 F131	N90-N127 VanDerWaalsContact O-CB 3.28Å; N90-N127 WeakPolarHBondContact O-CB 3.43Å; N90-N127 PolarHBondContact O-OD1 2.87Å; N90-N127 VanDerWaalsContact O-OD1 3.08Å; L92-N127 WeakPolarHBondContact O-CB 3.48Å; D93-N127 PolarHBondContact OD1-ND2 2.8Å; Y103-N127 VanDerWaalsContact OH-CA 3.24Å; Y103-N127 WeakPolarHBondContact OH-CA 3.39Å; Y103-N127 PolarHBondContact OH-N 2.87Å; Y103-N127 PolarHBondContact OH-O 3.4Å; Y125-N127 PolarHBondContact O-N 2.86Å; N127-G129 VanDerWaalsContact C-N 3.25Å; N127-G129 PolarHBondContact O-N 3Å; N127-G129 PolarHBondContact OD1-N 2.89Å; N127-E130 PolarHBondContact O-N 2.96Å; N127-E130 VanDerWaalsContact O-N 3.12Å; N127-E130 PolarHBondContact OD1-N 2.97Å; N127-F131 PolarHBondContact O-N 3.45Å; N127-F131 VanDerWaalsContact O-N 3.12Å
128	L	87.9	Confident	91.8	Very high	24 Å²	24	54.9 Å²	54.9	13%	0.126	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-29.4	-175.1	-168	65.8	0	0	0	112.6	N90 Y103 Y106 E130 F131 F132	N90-L128 HydrophobicContact CB-CB 4.2Å; N90-L128 PolarHBondContact O-N 3.31Å; N90-L128 WeakPolarHBondContact OD1-CD2 3.43Å; Y103-L128 HydrophobicContact CD1-CD1 3.84Å; Y103-L128 HydrophobicContact CE1-CB 4.42Å; Y103-L128 HydrophobicContact CE1-CD1 3.83Å; Y106-L128 HydrophobicContact CD2-CD1 4Å; Y106-L128 HydrophobicContact CD2-CD2 4.41Å; Y106-L128 HydrophobicContact CE2-CD1 4.4Å; Y106-L128 HydrophobicContact CE2-CD2 4.43Å; Y106-L128 HydrophobicContact CG-CD1 4.43Å; L128-E130 VanDerWaalsContact C-N 3.31Å; L128-E130 PolarHBondContact O-N 3.08Å; L128-F131 HydrophobicContact CD1-CD1 4.03Å; L128-F131 PolarHBondContact O-N 2.79Å; L128-F132 WeakPolarHBondContact O-CB 3.49Å; L128-F132 PolarHBondContact O-N 2.87Å
129	G	87.8	Confident	91.7	Very high	9 Å²	9	56.7 Å²	56.7	9%	0.093	29%	0.291	C	S	.	.	H	α-helix	trans	-69.7	-25.8	175.8	0	0	0	0	0	113.7	N90 N127 R133	N90-G129 PolarHBondContact O-N 2.76Å; N127-G129 VanDerWaalsContact C-N 3.25Å; N127-G129 PolarHBondContact O-N 3Å; N127-G129 PolarHBondContact OD1-N 2.89Å; G129-R133 PolarHBondContact O-NE 2.76Å; G129-R133 PolarHBondContact O-NH2 2.89Å
130	E	89.7	Confident	91.7	Very high	70 Å²	70	55.7 Å²	55.7	33%	0.327	29%	0.285	S	S	.	.	H	α-helix	trans	-78.4	-47.3	170.9	-164.7	-177.6	-175.3	0	0	111.2	Y125 K126 N127 L128 F132 R133 R134	Y125-E130 HydrophobicContact CD1-CB 4.46Å; Y125-E130 HydrophobicContact CD1-CG 4.11Å; K126-E130 WeakPolarHBondContact CB-OE2 3.48Å; K126-E130 WeakPolarHBondContact CG-OE2 3.15Å; K126-E130 PolarHBondContact N-OE2 2.95Å; N127-E130 PolarHBondContact O-N 2.96Å; N127-E130 VanDerWaalsContact O-N 3.12Å; N127-E130 PolarHBondContact OD1-N 2.97Å; L128-E130 VanDerWaalsContact C-N 3.31Å; L128-E130 PolarHBondContact O-N 3.08Å; E130-F132 VanDerWaalsContact C-N 3.29Å; E130-F132 PolarHBondContact O-N 2.97Å; E130-R133 CarbonylContact O-C 3.57Å; E130-R133 PolarHBondContact O-N 3.07Å; E130-R133 VanDerWaalsContact O-N 3.13Å; E130-R134 PolarHBondContact O-N 2.89Å; E130-R134 VanDerWaalsContact O-N 3.14Å
131	F	91.3	Very high	91.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-56	-43.2	175	175.7	-94.6	0	0	0	112.4	Y103 Y106 I107 V112 M114 L122 Y125 N127 L128 R133 R134	Y103-F131 HydrophobicContact CD1-CB 4.01Å; Y103-F131 HydrophobicContact CD1-CD1 4.18Å; Y103-F131 HydrophobicContact CD1-CD2 4.15Å; Y103-F131 AromaticContact CD1-CG 3.82Å; Y103-F131 HydrophobicContact CD1-CG 3.82Å; Y103-F131 HydrophobicContact CD2-CD2 4.3Å; Y103-F131 HydrophobicContact CE1-CB 3.79Å; Y103-F131 HydrophobicContact CE1-CG 4.14Å; Y103-F131 AromaticContact CG-CD2 3.97Å; Y103-F131 HydrophobicContact CG-CD2 3.97Å; Y103-F131 HydrophobicContact CG-CE2 4.41Å; Y103-F131 HydrophobicContact CG-CG 4.13Å; Y106-F131 HydrophobicContact CD1-CD1 4.4Å; Y106-F131 AromaticContact CD1-CE1 3.63Å; Y106-F131 HydrophobicContact CD1-CE1 3.63Å; Y106-F131 HydrophobicContact CE1-CE1 4.14Å; Y106-F131 HydrophobicContact CG-CE1 4.21Å; I107-F131 HydrophobicContact CD1-CE2 4.21Å; I107-F131 HydrophobicContact CD1-CZ 4.04Å; I107-F131 HydrophobicContact CG1-CE2 4.37Å; I107-F131 HydrophobicContact CG1-CZ 3.7Å; V112-F131 HydrophobicContact CG1-CZ 4.21Å; M114-F131 HydrophobicContact CE-CE2 4.16Å; M114-F131 HydrophobicContact SD-CE2 3.6Å; M114-F131 VanDerWaalsContact SD-CE2 3.6Å; M114-F131 HydrophobicContact SD-CZ 3.91Å; L122-F131 HydrophobicContact CD2-CD2 4.43Å; L122-F131 HydrophobicContact CD2-CE2 3.88Å; Y125-F131 VanDerWaalsContact CD1-CA 3.45Å; Y125-F131 HydrophobicContact CD1-CB 4.15Å; Y125-F131 AromaticContact CD2-CD2 3.85Å; Y125-F131 HydrophobicContact CD2-CD2 3.85Å; Y125-F131 HydrophobicContact CE2-CD2 4.07Å; Y125-F131 HydrophobicContact CG-CB 4.03Å; Y125-F131 HydrophobicContact CG-CD2 4.08Å; N127-F131 PolarHBondContact O-N 3.45Å; N127-F131 VanDerWaalsContact O-N 3.12Å; L128-F131 HydrophobicContact CD1-CD1 4.03Å; L128-F131 PolarHBondContact O-N 2.79Å; F131-R133 VanDerWaalsContact C-N 3.31Å; F131-R133 PolarHBondContact O-N 3.26Å; F131-R134 VanDerWaalsContact O-CB 3.3Å; F131-R134 WeakPolarHBondContact O-CB 3.19Å; F131-R134 WeakPolarHBondContact O-CG 3.32Å; F131-R134 PolarHBondContact O-N 3.46Å
132	F	87.4	Confident	91.9	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-38	178.4	-171.3	-90.3	0	0	0	112.7	Y106 L128 E130 R134 H220 N336 L337 G338	Y106-F132 WeakPolarHBondContact OH-CD2 3.39Å; Y106-F132 WeakPolarHBondContact OH-CE2 3.42Å; L128-F132 WeakPolarHBondContact O-CB 3.49Å; L128-F132 PolarHBondContact O-N 2.87Å; E130-F132 VanDerWaalsContact C-N 3.29Å; E130-F132 PolarHBondContact O-N 2.97Å; F132-R134 VanDerWaalsContact C-N 3.31Å; F132-R134 PolarHBondContact O-N 3.37Å; F132-H220 HydrophobicContact CD1-CB 4.16Å; F132-H220 HydrophobicContact CE1-CB 3.36Å; F132-H220 AromaticContact CE1-CD2 3.3Å; F132-H220 WeakPolarHBondContact CE1-CD2 3.35Å; F132-H220 AromaticContact CE1-CG 3.17Å; F132-H220 AromaticContact CE1-ND1 3.83Å; F132-H220 AromaticContact CE2-CD2 3.6Å; F132-H220 HydrophobicContact CZ-CB 3.96Å; F132-H220 AromaticContact CZ-CD2 2.96Å; F132-H220 WeakPolarHBondContact CZ-CD2 3.31Å; F132-H220 AromaticContact CZ-CG 3.2Å; F132-H220 AromaticContact CZ-ND1 3.54Å; F132-N336 WeakPolarHBondContact CD1-O 3.4Å; F132-L337 HydrophobicContact CD1-CG 4.48Å; F132-L337 HydrophobicContact CD2-CG 4.22Å; F132-L337 HydrophobicContact CE1-CB 4.41Å; F132-L337 HydrophobicContact CE1-CG 4.39Å; F132-L337 HydrophobicContact CE2-CD2 4.28Å; F132-L337 HydrophobicContact CE2-CG 4.1Å; F132-L337 HydrophobicContact CG-CG 4.39Å; F132-L337 HydrophobicContact CZ-CB 4.33Å; F132-L337 HydrophobicContact CZ-CG 4.17Å; F132-G338 VanDerWaalsContact CZ-N 3.35Å
133	R	87.1	Confident	92	Very high	72 Å²	72	55.5 Å²	55.5	27%	0.272	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	25	177.9	-63.7	178.7	-65.8	141.8	6.7	112.9	G129 E130 F131 R135 E334 N336	G129-R133 PolarHBondContact O-NE 2.76Å; G129-R133 PolarHBondContact O-NH2 2.89Å; E130-R133 CarbonylContact O-C 3.57Å; E130-R133 PolarHBondContact O-N 3.07Å; E130-R133 VanDerWaalsContact O-N 3.13Å; F131-R133 VanDerWaalsContact C-N 3.31Å; F131-R133 PolarHBondContact O-N 3.26Å; R133-R135 PolarHBondContact O-N 2.84Å; R133-E334 WeakPolarHBondContact CD-OE1 3.38Å; R133-E334 IonicContact CZ-OE1 3.66Å; R133-E334 IonicContact NH1-OE1 2.75Å; R133-E334 PolarHBondContact NH1-OE1 3.18Å; R133-N336 WeakPolarHBondContact CD-OD1 3.27Å
134	R	91.8	Very high	92.2	Very high	10 Å²	10	54.1 Å²	54.1	4%	0.038	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-47.2	132.3	172.9	64.6	-167.5	-168.8	-69.8	-4.1	110.6	Y125 E130 F131 F132 G217 D218 Y219	Y125-R134 HydrophobicContact CE1-CB 3.84Å; Y125-R134 WeakPolarHBondContact OH-CB 3.48Å; E130-R134 PolarHBondContact O-N 2.89Å; E130-R134 VanDerWaalsContact O-N 3.14Å; F131-R134 VanDerWaalsContact O-CB 3.3Å; F131-R134 WeakPolarHBondContact O-CB 3.19Å; F131-R134 WeakPolarHBondContact O-CG 3.32Å; F131-R134 PolarHBondContact O-N 3.46Å; F132-R134 VanDerWaalsContact C-N 3.31Å; F132-R134 PolarHBondContact O-N 3.37Å; R134-G217 PolarHBondContact NH2-O 3.14Å; R134-D218 PolarHBondContact NH1-O 3.04Å; R134-D218 VanDerWaalsContact NH1-O 3.11Å; R134-D218 PolarHBondContact NH2-O 2.87Å; R134-Y219 WeakPolarHBondContact O-CE2 3.34Å
135	R	93	Very high	92.2	Very high	111 Å²	111	52.8 Å²	52.8	42%	0.419	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-72	149.5	167.5	-64.2	-63.7	179.4	-169.4	-7.2	109.3	A118 R133 C221 Y288 E334	A118-R135 HydrophobicContact CB-CB 4.04Å; A118-R135 WeakPolarHBondContact CB-O 3.26Å; A118-R135 PolarHBondContact N-O 2.76Å; R133-R135 PolarHBondContact O-N 2.84Å; R135-C221 PolarHBondContact NH1-SG 3.43Å; R135-Y288 PolarHBondContact NH1-OH 3.25Å; R135-Y288 PolarHBondContact NH2-OH 2.68Å; R135-E334 IonicContact NH2-OE2 2.8Å; R135-E334 PolarHBondContact NH2-OE2 3.46Å
136	L	94.9	Very high	92.1	Very high	20 Å²	20	57 Å²	57	11%	0.105	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-92.8	159.9	170.2	-58.2	-174.2	0	0	0	110.7	E116 V140 R141 Y219	E116-L136 HydrophobicContact CB-CD2 4.31Å; E116-L136 CarbonylContact O-C 3.54Å; E116-L136 VanDerWaalsContact O-CA 3.26Å; E116-L136 WeakPolarHBondContact O-CA 3.15Å; L136-V140 HydrophobicContact CB-CG2 3.81Å; L136-V140 HydrophobicContact CD1-CG2 4.25Å; L136-R141 HydrophobicContact CD1-CG 3.88Å; L136-Y219 HydrophobicContact CD1-CD1 3.78Å; L136-Y219 HydrophobicContact CD1-CD2 4.07Å; L136-Y219 HydrophobicContact CD1-CE1 4.25Å; L136-Y219 HydrophobicContact CD1-CG 3.67Å; L136-Y219 HydrophobicContact CD2-CD2 4.19Å; L136-Y219 HydrophobicContact CD2-CG 4.46Å; L136-Y219 HydrophobicContact CG-CD1 4.26Å; L136-Y219 HydrophobicContact CG-CD2 3.71Å; L136-Y219 HydrophobicContact CG-CE1 4.46Å; L136-Y219 HydrophobicContact CG-CE2 3.95Å; L136-Y219 HydrophobicContact CG-CG 3.87Å
137	K	95.1	Very high	92.1	Very high	72 Å²	72	52.3 Å²	52.3	31%	0.313	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-62.9	136	169.7	-66.1	171	179.8	169	0	109.5	Q115 E116 A117 E120 A139 V140	Q115-K137 WeakPolarHBondContact O-CE 3.46Å; Q115-K137 PolarHBondContact O-NZ 3.31Å; E116-K137 PolarHBondContact O-N 3.29Å; A117-K137 VanDerWaalsContact O-CE 3.22Å; A117-K137 WeakPolarHBondContact O-CE 3.19Å; A117-K137 WeakPolarHBondContact O-CG 3.46Å; E120-K137 WeakPolarHBondContact OE1-CE 3.36Å; E120-K137 IonicContact OE1-NZ 3.5Å; E120-K137 PolarHBondContact OE1-NZ 2.81Å; K137-A139 PolarHBondContact O-N 2.73Å; K137-A139 VanDerWaalsContact O-N 3.09Å; K137-V140 HydrophobicContact CB-CG1 4.12Å; K137-V140 HydrophobicContact CB-CG2 4.32Å; K137-V140 WeakPolarHBondContact O-CG2 3.22Å; K137-V140 PolarHBondContact O-N 2.8Å; K137-V140 VanDerWaalsContact O-N 3.08Å
138	P	87.9	Confident	92	Very high	130 Å²	130	52.7 Å²	52.7	84%	0.844	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-54.3	-35.7	-176.2	-29.4	35.8	0	0	0	114.7	V140	P138-V140 VanDerWaalsContact C-N 3.34Å; P138-V140 PolarHBondContact O-N 2.73Å
139	A	91.2	Very high	92.5	Very high	91 Å²	91	51.6 Å²	51.6	75%	0.752	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-74.3	-13.9	-177.7	0	0	0	0	0	115.2	K137	K137-A139 PolarHBondContact O-N 2.73Å; K137-A139 VanDerWaalsContact O-N 3.09Å
140	V	95.1	Very high	92.9	Very high	40 Å²	40	51.1 Å²	51.1	24%	0.242	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-86.9	-4.5	-173.9	-58.7	0	0	0	0	114.4	E116 L136 K137 P138	E116-V140 HydrophobicContact CB-CG2 4.08Å; E116-V140 HydrophobicContact CG-CB 4.31Å; E116-V140 HydrophobicContact CG-CG1 4.26Å; E116-V140 HydrophobicContact CG-CG2 4.36Å; L136-V140 HydrophobicContact CB-CG2 3.81Å; L136-V140 HydrophobicContact CD1-CG2 4.25Å; K137-V140 HydrophobicContact CB-CG1 4.12Å; K137-V140 HydrophobicContact CB-CG2 4.32Å; K137-V140 WeakPolarHBondContact O-CG2 3.22Å; K137-V140 PolarHBondContact O-N 2.8Å; K137-V140 VanDerWaalsContact O-N 3.08Å; P138-V140 VanDerWaalsContact C-N 3.34Å; P138-V140 PolarHBondContact O-N 2.73Å
141	R	95.1	Very high	93.3	Very high	24 Å²	24	47.9 Å²	47.9	9%	0.091	30%	0.297	C	S	.	.	S	Bend	trans	-132.1	68.8	174.6	-64.9	-63.8	178.6	-80.3	-3.6	110.6	E116 L136 V143 D154 M363	E116-R141 IonicContact OE2-CZ 3.35Å; E116-R141 IonicContact OE2-NH1 3.18Å; E116-R141 PolarHBondContact OE2-NH1 3.34Å; E116-R141 IonicContact OE2-NH2 3.17Å; E116-R141 PolarHBondContact OE2-NH2 3.5Å; L136-R141 HydrophobicContact CD1-CG 3.88Å; R141-V143 PolarHBondContact O-N 3.34Å; R141-D154 IonicContact CZ-OD1 3.62Å; R141-D154 IonicContact CZ-OD2 3.7Å; R141-D154 IonicContact NE-OD1 3.67Å; R141-D154 PolarHBondContact NE-OD1 2.78Å; R141-D154 IonicContact NE-OD2 2.81Å; R141-D154 PolarHBondContact NE-OD2 3.37Å; R141-D154 IonicContact NH2-OD1 2.71Å; R141-D154 IonicContact NH2-OD2 3.59Å; R141-D154 PolarHBondContact NH2-OD2 2.81Å; R141-M363 HydrophobicContact CB-CE 3.61Å; R141-M363 WeakPolarHBondContact CD-O 3.25Å; R141-M363 HydrophobicContact CG-CE 4.17Å
142	P	95.6	Very high	93.6	Very high	101 Å²	101	47.9 Å²	47.9	66%	0.656	30%	0.297	S	S	*	.			trans	-64.1	133.4	172.4	29.3	-34.3	0	0	0	109.8
143	V	96.9	Very high	94	Very high	54 Å²	54	47.8 Å²	47.8	33%	0.327	30%	0.297	S	S	.	.			trans	-84.8	127	178.6	179.2	0	0	0	0	108.7	R141 A145 T150 K328	R141-V143 PolarHBondContact O-N 3.34Å; V143-A145 PolarHBondContact O-N 2.78Å; V143-T150 HydrophobicContact CG1-CG2 4.35Å; V143-K328 HydrophobicContact CG1-CD 4.14Å; V143-K328 HydrophobicContact CG1-CG 3.8Å
144	C	95.4	Very high	94.5	Very high	43 Å²	43	44.8 Å²	44.8	29%	0.291	29%	0.287	S	S	.	.			trans	-61.6	112.8	178.2	-176.9	0	0	0	0	110.4	T150 K328 G364	C144-T150 HydrophobicContact CB-CG2 3.92Å; C144-K328 PolarHBondContact O-NZ 2.94Å; C144-G364 WeakPolarHBondContact CB-O 3.42Å; C144-G364 PolarHBondContact N-O 2.89Å
145	A	93.1	Very high	94.6	Very high	94 Å²	94	44.5 Å²	44.5	78%	0.777	29%	0.287	S	S	*	.	S	Bend	trans	-66.8	-43	179.3	0	0	0	0	0	111.6	V143 K328	V143-A145 PolarHBondContact O-N 2.78Å; A145-K328 PolarHBondContact O-NZ 2.79Å; A145-K328 VanDerWaalsContact O-NZ 3.13Å
146	A	91.6	Very high	94.8	Very high	103 Å²	103	45.2 Å²	45.2	85%	0.851	29%	0.289	S	S	*	.	S	Bend	trans	-71.5	-28.2	-171.8	0	0	0	0	0	115
147	S	93.5	Very high	94.8	Very high	7 Å²	7	44.2 Å²	44.2	5%	0.049	28%	0.284	C	S	.	.			trans	-87.3	137.9	177.4	-179.3	0	0	0	0	111.5	L149 K328 G368	S147-L149 PolarHBondContact O-N 3.35Å; S147-L149 PolarHBondContact OG-N 2.71Å; S147-L149 PolarHBondContact OG-O 3.18Å; S147-K328 PolarHBondContact O-NZ 3.27Å; S147-G368 PolarHBondContact OG-O 3.34Å
148	C	91.5	Very high	94.7	Very high	30 Å²	30	41.7 Å²	41.7	20%	0.203	27%	0.274	C	S	.	.	S	Bend	trans	-69.6	-20.6	172.3	59.2	0	0	0	0	113.1	A226	C148-A226 WeakPolarHBondContact O-CB 3.3Å
149	L	96.4	Very high	94.9	Very high	0 Å²	0	37 Å²	37	0%	0	24%	0.24	C	C	.	.			trans	-138.5	118.8	-174.5	-170.8	73.9	0	0	0	111.7	S147 P225 A226 W267 F272 F345 F351 L367	S147-L149 PolarHBondContact O-N 3.35Å; S147-L149 PolarHBondContact OG-N 2.71Å; S147-L149 PolarHBondContact OG-O 3.18Å; L149-P225 HydrophobicContact CD1-CB 3.96Å; L149-P225 HydrophobicContact CD1-CG 4.32Å; L149-A226 HydrophobicContact CD1-CB 4.13Å; L149-W267 HydrophobicContact CB-CH2 4.48Å; L149-W267 HydrophobicContact CB-CZ3 4.37Å; L149-W267 HydrophobicContact CD1-CH2 4.39Å; L149-W267 HydrophobicContact CD1-CZ3 4.14Å; L149-F272 HydrophobicContact CD1-CE2 3.76Å; L149-F272 HydrophobicContact CD1-CZ 3.9Å; L149-F345 HydrophobicContact CD2-CD1 3.98Å; L149-F345 HydrophobicContact CD2-CD2 4.21Å; L149-F345 HydrophobicContact CD2-CE1 3.48Å; L149-F345 VanDerWaalsContact CD2-CE1 3.48Å; L149-F345 HydrophobicContact CD2-CE2 3.72Å; L149-F345 HydrophobicContact CD2-CG 4.32Å; L149-F345 HydrophobicContact CD2-CZ 3.32Å; L149-F351 HydrophobicContact CD2-CZ 4.12Å; L149-L367 HydrophobicContact CD2-CB 4.25Å; L149-L367 HydrophobicContact CD2-CD1 4.08Å; L149-L367 HydrophobicContact CG-CB 4.41Å; L149-L367 HydrophobicContact CG-CD1 4.09Å; L149-L367 PolarHBondContact O-N 3.01Å
150	T	97.7	Very high	95.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-115.7	161.8	-176.6	56	0	0	0	0	112.3	V143 C144 P225 K328 G364 E365 L367	V143-T150 HydrophobicContact CG1-CG2 4.35Å; C144-T150 HydrophobicContact CB-CG2 3.92Å; T150-P225 PolarHBondContact N-O 2.79Å; T150-P225 WeakPolarHBondContact O-CA 3.26Å; T150-P225 WeakPolarHBondContact O-CB 3.5Å; T150-P225 PolarHBondContact OG1-O 2.94Å; T150-K328 HydrophobicContact CG2-CD 4.05Å; T150-G364 WeakPolarHBondContact CG2-O 3.38Å; T150-E365 CarbonylContact C-O 3.58Å; T150-E365 WeakPolarHBondContact CA-O 3.46Å; T150-E365 WeakPolarHBondContact CB-O 3.27Å; T150-L367 WeakPolarHBondContact O-CD1 3.38Å
151	S	97.9	Very high	95.1	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	21%	0.21	C	C	.	.			trans	-65.4	129.3	177.7	-171.9	0	0	0	0	110.2	A153 R362 M363 G364 E365	S151-A153 VanDerWaalsContact C-N 3.26Å; S151-A153 PolarHBondContact O-N 3.21Å; S151-A153 PolarHBondContact OG-O 2.96Å; S151-R362 VanDerWaalsContact CB-O 3.27Å; S151-R362 WeakPolarHBondContact CB-O 3.49Å; S151-M363 WeakPolarHBondContact O-CA 3.47Å; S151-G364 PolarHBondContact O-N 2.85Å; S151-E365 PolarHBondContact N-O 2.87Å
152	P	97.6	Very high	95.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-76	-15.3	-180	32.5	-35.9	0	0	0	112.3	F222 H223 P225 L274 I341 L343	P152-F222 CarbonylContact O-C 3.4Å; P152-F222 VanDerWaalsContact O-CA 3.26Å; P152-F222 WeakPolarHBondContact O-CA 3.14Å; P152-H223 WeakPolarHBondContact CA-O 3.38Å; P152-H223 VanDerWaalsContact CB-O 3.22Å; P152-H223 WeakPolarHBondContact CB-O 3.37Å; P152-H223 PolarHBondContact O-N 2.65Å; P152-P225 HydrophobicContact CB-CB 4.33Å; P152-L274 HydrophobicContact CB-CD1 4.18Å; P152-I341 HydrophobicContact CB-CG2 4.39Å; P152-I341 HydrophobicContact CG-CB 4.4Å; P152-I341 HydrophobicContact CG-CG2 3.66Å; P152-L343 HydrophobicContact CG-CD1 4.03Å; P152-L343 HydrophobicContact CG-CD2 4.13Å; P152-L343 HydrophobicContact CG-CG 4.14Å
153	A	96.4	Very high	95	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-152.6	164.1	-173.7	0	0	0	0	0	111.9	S151 L214 F222 I341 R362 M363	S151-A153 VanDerWaalsContact C-N 3.26Å; S151-A153 PolarHBondContact O-N 3.21Å; S151-A153 PolarHBondContact OG-O 2.96Å; A153-L214 HydrophobicContact CB-CD1 4.36Å; A153-L214 HydrophobicContact CB-CD2 3.95Å; A153-L214 HydrophobicContact CB-CG 4.21Å; A153-F222 HydrophobicContact CB-CB 4.41Å; A153-I341 HydrophobicContact CB-CG1 4.47Å; A153-R362 CarbonylContact O-C 3.57Å; A153-M363 PolarHBondContact O-N 3.23Å
154	D	96	Very high	94.6	Very high	10 Å²	10	37.2 Å²	37.2	5%	0.053	21%	0.211	C	C	.	.	S	Bend	trans	-75.5	141.5	162.7	-69.8	-0.6	0	0	0	110	R141 L214 D218 Y219 I361 R362 M363	R141-D154 IonicContact CZ-OD1 3.62Å; R141-D154 IonicContact CZ-OD2 3.7Å; R141-D154 IonicContact NE-OD1 3.67Å; R141-D154 PolarHBondContact NE-OD1 2.78Å; R141-D154 IonicContact NE-OD2 2.81Å; R141-D154 PolarHBondContact NE-OD2 3.37Å; R141-D154 IonicContact NH2-OD1 2.71Å; R141-D154 IonicContact NH2-OD2 3.59Å; R141-D154 PolarHBondContact NH2-OD2 2.81Å; D154-L214 WeakPolarHBondContact O-CG 3.09Å; D154-D218 HydrophobicContact CB-CB 4.23Å; D154-Y219 VanDerWaalsContact OD2-CB 3.24Å; D154-Y219 WeakPolarHBondContact OD2-CB 3.48Å; D154-I361 WeakPolarHBondContact CA-O 3.31Å; D154-R362 VanDerWaalsContact OD1-CA 3.3Å; D154-R362 WeakPolarHBondContact OD1-CA 3.41Å; D154-M363 PolarHBondContact OD1-N 3.14Å
155	G	95.6	Very high	94.1	Very high	4 Å²	4	42 Å²	42	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.5	-142.4	171.1	0	0	0	0	0	114.1	Y213 R360 I361	G155-Y213 CarbonylContact C-O 3.59Å; G155-Y213 VanDerWaalsContact CA-O 3.26Å; G155-Y213 WeakPolarHBondContact CA-O 3.11Å; G155-R360 WeakPolarHBondContact O-CA 3.29Å; G155-I361 PolarHBondContact N-O 3.22Å; G155-I361 PolarHBondContact O-N 3.06Å
156	R	95.5	Very high	93.7	Very high	125 Å²	125	38.3 Å²	38.3	47%	0.472	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130.1	-177	-161.5	175.4	-158.6	175.7	3.8	111.5	L158 Y213 G358 Q359	R156-L158 PolarHBondContact O-N 2.97Å; R156-Y213 PolarHBondContact N-O 2.88Å; R156-Y213 PolarHBondContact O-N 2.89Å; R156-G358 VanDerWaalsContact CZ-O 3.29Å; R156-G358 PolarHBondContact NE-O 3.11Å; R156-G358 PolarHBondContact NH2-O 3.14Å; R156-Q359 WeakPolarHBondContact CA-O 3.37Å; R156-Q359 WeakPolarHBondContact CG-O 3.35Å
157	I	95.8	Very high	93.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	116.9	173	-55.9	-58.2	0	0	0	109	F160 V210 V212 L355 G358 Q359 I361	I157-F160 HydrophobicContact CG2-CD1 3.55Å; I157-F160 HydrophobicContact CG2-CE1 4.19Å; I157-V210 HydrophobicContact CD1-CG1 4.06Å; I157-V212 HydrophobicContact CD1-CG2 4.13Å; I157-L355 HydrophobicContact CD1-CD1 4.28Å; I157-L355 HydrophobicContact CD1-CD2 4.22Å; I157-L355 HydrophobicContact CG1-CD2 4.19Å; I157-G358 WeakPolarHBondContact O-CA 3.43Å; I157-G358 PolarHBondContact O-N 3.5Å; I157-Q359 HydrophobicContact CG1-CB 4.38Å; I157-Q359 PolarHBondContact N-O 3.38Å; I157-I361 HydrophobicContact CD1-CB 4.41Å; I157-I361 HydrophobicContact CD1-CD1 4.2Å; I157-I361 HydrophobicContact CD1-CG2 3.84Å; I157-I361 HydrophobicContact CG1-CG2 4.32Å
158	L	92.1	Very high	93.1	Very high	19 Å²	19	36.4 Å²	36.4	10%	0.099	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-44.6	173.7	-62.8	-166.9	0	0	0	111.7	R156 V171 V211 Y213 P245 F255	R156-L158 PolarHBondContact O-N 2.97Å; L158-V171 HydrophobicContact CD1-CG1 4.48Å; L158-V211 HydrophobicContact CB-CB 4.16Å; L158-V211 HydrophobicContact CB-CG1 3.87Å; L158-V211 HydrophobicContact CD1-CG1 3.98Å; L158-V211 HydrophobicContact CG-CG1 4.2Å; L158-V211 PolarHBondContact N-O 3.11Å; L158-Y213 HydrophobicContact CD2-CD1 4.49Å; L158-Y213 HydrophobicContact CD2-CG 4.34Å; L158-P245 HydrophobicContact CD2-CB 4.15Å; L158-P245 HydrophobicContact CD2-CG 3.79Å; L158-F255 HydrophobicContact CD1-CZ 4.35Å
159	H	93.2	Very high	92.6	Very high	30 Å²	30	38.1 Å²	38.1	14%	0.139	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	155.4	177.8	-156.3	-90.5	0	0	0	110.3	E169 H209 V211	H159-E169 VanDerWaalsContact CE1-CB 3.46Å; H159-E169 WeakPolarHBondContact CE1-CB 3.19Å; H159-E169 IonicContact CE1-OE1 2.65Å; H159-E169 WeakPolarHBondContact ND1-CB 3.39Å; H159-E169 IonicContact NE2-OE1 3.32Å; H159-E169 IonicContact NE2-OE2 3.19Å; H159-H209 AromaticContact CE1-NE2 3.9Å; H159-H209 AromaticContact CG-CE1 3.93Å; H159-H209 AromaticContact ND1-CE1 3.19Å; H159-H209 PolarHBondContact ND1-CE1 2.68Å; H159-H209 AromaticContact ND1-NE2 3.18Å; H159-H209 PolarHBondContact ND1-NE2 2.66Å; H159-H209 VanDerWaalsContact ND1-NE2 3.18Å; H159-V211 HydrophobicContact CB-CB 4.47Å; H159-V211 HydrophobicContact CB-CG2 4.31Å; H159-V211 PolarHBondContact O-N 3.15Å
160	F	95.6	Very high	91.8	Very high	41 Å²	41	38.1 Å²	38.1	18%	0.18	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	161.4	168.2	62.1	-85.4	0	0	0	108.9	I157 H209 V210 F353 L355 P357	I157-F160 HydrophobicContact CG2-CD1 3.55Å; I157-F160 HydrophobicContact CG2-CE1 4.19Å; F160-H209 CarbonylContact C-O 3.48Å; F160-H209 WeakPolarHBondContact CA-O 3.27Å; F160-V210 HydrophobicContact CB-CB 4.47Å; F160-V210 HydrophobicContact CB-CG1 4.47Å; F160-V210 HydrophobicContact CB-CG2 3.98Å; F160-F353 HydrophobicContact CB-CD1 4.39Å; F160-F353 HydrophobicContact CB-CE1 4.24Å; F160-F353 HydrophobicContact CB-CZ 4.27Å; F160-F353 HydrophobicContact CD2-CB 3.66Å; F160-F353 HydrophobicContact CD2-CD1 4Å; F160-F353 AromaticContact CD2-CD2 3.52Å; F160-F353 HydrophobicContact CD2-CD2 3.52Å; F160-F353 HydrophobicContact CD2-CE2 4.06Å; F160-F353 AromaticContact CD2-CG 3.46Å; F160-F353 HydrophobicContact CD2-CG 3.46Å; F160-F353 VanDerWaalsContact CD2-CG 3.46Å; F160-F353 HydrophobicContact CE2-CB 3.66Å; F160-F353 HydrophobicContact CE2-CD2 4.15Å; F160-F353 AromaticContact CE2-CG 3.99Å; F160-F353 HydrophobicContact CE2-CG 3.99Å; F160-F353 HydrophobicContact CG-CD1 4.46Å; F160-F353 HydrophobicContact CG-CG 4.33Å; F160-L355 HydrophobicContact CB-CD1 4.23Å; F160-L355 HydrophobicContact CD1-CB 3.89Å; F160-L355 HydrophobicContact CD1-CD1 4.26Å; F160-L355 HydrophobicContact CD2-CB 4.37Å; F160-L355 HydrophobicContact CE1-CB 3.66Å; F160-L355 HydrophobicContact CE2-CB 4.17Å; F160-L355 HydrophobicContact CG-CB 4.24Å; F160-L355 HydrophobicContact CG-CD1 4.08Å; F160-L355 HydrophobicContact CZ-CB 3.82Å; F160-L355 WeakPolarHBondContact CZ-O 3.24Å; F160-P357 HydrophobicContact CE1-CG 3.97Å
161	G	95.1	Very high	90.6	Very high	17 Å²	17	38.5 Å²	38.5	18%	0.175	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.1	-172.9	175	0	0	0	0	0	113.3	F208 H209	G161-F208 CarbonylContact O-C 3.45Å; G161-F208 WeakPolarHBondContact O-CA 3.44Å; G161-H209 PolarHBondContact N-O 2.84Å; G161-H209 PolarHBondContact O-CD2 3.18Å; G161-H209 VanDerWaalsContact O-CD2 3.31Å; G161-H209 PolarHBondContact O-N 2.75Å
162	R	94.9	Very high	89.3	Confident	130 Å²	130	47.8 Å²	47.8	49%	0.491	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.4	171.8	-175.8	173.4	175.8	162.8	3	109.9	A206 F208	R162-A206 HydrophobicContact CG-CB 4.25Å; R162-F208 HydrophobicContact CB-CD1 4.03Å; R162-F208 HydrophobicContact CB-CE1 4.03Å; R162-F208 HydrophobicContact CG-CE1 4.43Å
163	V	93.6	Very high	88	Confident	1 Å²	1	51 Å²	51	1%	0.006	26%	0.256	C	S	.	.			trans	-71	133.2	171.7	-177.6	0	0	0	0	108.7	Q167 V168 L178 Q196 L207 H209 L344	V163-Q167 WeakPolarHBondContact CG1-O 3.35Å; V163-V168 HydrophobicContact CG1-CG2 4.17Å; V163-V168 HydrophobicContact CG2-CG2 4.25Å; V163-L178 HydrophobicContact CG1-CD2 4.3Å; V163-Q196 PolarHBondContact O-NE2 2.81Å; V163-L207 HydrophobicContact CB-CB 4.19Å; V163-L207 HydrophobicContact CB-CD2 4.06Å; V163-L207 HydrophobicContact CB-CG 4.18Å; V163-L207 HydrophobicContact CG1-CD2 4.12Å; V163-L207 HydrophobicContact CG2-CB 4.39Å; V163-L207 HydrophobicContact CG2-CD2 4Å; V163-L207 HydrophobicContact CG2-CG 3.93Å; V163-L207 PolarHBondContact N-O 3.2Å; V163-H209 HydrophobicContact CG2-CB 4.05Å; V163-L344 HydrophobicContact CG2-CD2 3.86Å
164	Q	88.1	Confident	87.1	Confident	126 Å²	126	52.1 Å²	52.1	59%	0.589	26%	0.262	S	S	*	.	B	Isolated β-bridge	trans	-130	140.2	-178.4	-60.2	-178	19.6	0	0	109.5	S166 Q167	Q164-S166 PolarHBondContact O-N 2.88Å; Q164-S166 VanDerWaalsContact O-N 3.15Å; Q164-Q167 WeakPolarHBondContact O-CB 3.46Å; Q164-Q167 PolarHBondContact O-N 2.81Å
165	N	84.1	Confident	86.7	Confident	145 Å²	145	54.7 Å²	54.7	78%	0.775	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	33.7	176.7	-53.6	-41.3	0	0	0	114	Q167	N165-Q167 PolarHBondContact O-N 3.19Å; N165-Q167 VanDerWaalsContact O-N 3.17Å
166	S	85.4	Confident	86.3	Confident	15 Å²	15	54.6 Å²	54.6	11%	0.105	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	27.3	-171.7	-57.2	0	0	0	0	114.4	Q164 L178 Q196	Q164-S166 PolarHBondContact O-N 2.88Å; Q164-S166 VanDerWaalsContact O-N 3.15Å; S166-L178 VanDerWaalsContact O-CB 3.27Å; S166-L178 WeakPolarHBondContact O-CB 3.26Å; S166-L178 PolarHBondContact O-N 2.91Å; S166-Q196 VanDerWaalsContact OG-CB 3.27Å; S166-Q196 WeakPolarHBondContact OG-CB 3.49Å; S166-Q196 PolarHBondContact OG-N 3.18Å
167	Q	87.2	Confident	86.2	Confident	71 Å²	71	49.5 Å²	49.5	33%	0.332	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.6	176.1	-67.2	-70.3	-49.6	0	0	110.8	V163 Q164 N165 T175 Y176	V163-Q167 WeakPolarHBondContact CG1-O 3.35Å; Q164-Q167 WeakPolarHBondContact O-CB 3.46Å; Q164-Q167 PolarHBondContact O-N 2.81Å; N165-Q167 PolarHBondContact O-N 3.19Å; N165-Q167 VanDerWaalsContact O-N 3.17Å; Q167-T175 HydrophobicContact CB-CG2 4.38Å; Q167-T175 PolarHBondContact OE1-OG1 3.46Å; Q167-Y176 WeakPolarHBondContact CA-O 3.38Å; Q167-Y176 PolarHBondContact OE1-O 3.31Å
168	V	84.8	Confident	86	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134.4	177.8	-173.7	0	0	0	0	109.2	V163 T175 Y176 L178 H209 L344	V163-V168 HydrophobicContact CG1-CG2 4.17Å; V163-V168 HydrophobicContact CG2-CG2 4.25Å; V168-T175 CarbonylContact O-C 3.48Å; V168-T175 WeakPolarHBondContact O-CA 3.37Å; V168-Y176 HydrophobicContact CB-CD1 4.47Å; V168-Y176 HydrophobicContact CB-CD2 4.2Å; V168-Y176 HydrophobicContact CB-CE1 4Å; V168-Y176 HydrophobicContact CB-CE2 3.7Å; V168-Y176 HydrophobicContact CG1-CE1 4Å; V168-Y176 HydrophobicContact CG1-CE2 4.12Å; V168-Y176 WeakPolarHBondContact CG1-OH 3.1Å; V168-Y176 HydrophobicContact CG2-CE2 4.15Å; V168-Y176 PolarHBondContact N-O 2.82Å; V168-Y176 WeakPolarHBondContact O-CD1 3.09Å; V168-Y176 PolarHBondContact O-N 2.86Å; V168-L178 HydrophobicContact CG2-CB 4.27Å; V168-L178 HydrophobicContact CG2-CD1 3.78Å; V168-H209 HydrophobicContact CG1-CB 4.08Å; V168-H209 VanDerWaalsContact CG1-ND1 3.34Å; V168-H209 WeakPolarHBondContact CG1-ND1 3.08Å; V168-L344 HydrophobicContact CG2-CD2 4.05Å
169	E	82.4	Confident	86	Confident	65 Å²	65	52.7 Å²	52.7	30%	0.304	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.1	175.5	-83	-163.9	-108.7	0	0	111.6	H159 G173 T175 H209	H159-E169 VanDerWaalsContact CE1-CB 3.46Å; H159-E169 WeakPolarHBondContact CE1-CB 3.19Å; H159-E169 IonicContact CE1-OE1 2.65Å; H159-E169 WeakPolarHBondContact ND1-CB 3.39Å; H159-E169 IonicContact NE2-OE1 3.32Å; H159-E169 IonicContact NE2-OE2 3.19Å; E169-G173 PolarHBondContact OE2-N 2.85Å; E169-T175 HydrophobicContact CG-CG2 3.82Å; E169-H209 PolarHBondContact O-CE1 3.06Å
170	Q	78.8	Confident	85.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-47.5	174.9	179.4	170.8	-74.9	0	0	111.1	V174 Y176 A248 V251 F255	Q170-V174 HydrophobicContact CB-CG1 4.42Å; Q170-V174 WeakPolarHBondContact CB-O 3.48Å; Q170-V174 PolarHBondContact N-O 3.18Å; Q170-Y176 HydrophobicContact CB-CD1 3.91Å; Q170-Y176 HydrophobicContact CB-CE1 3.96Å; Q170-A248 HydrophobicContact CG-CB 4.44Å; Q170-A248 PolarHBondContact NE2-O 2.92Å; Q170-V251 PolarHBondContact NE2-O 2.87Å; Q170-F255 HydrophobicContact CB-CD2 4.49Å; Q170-F255 HydrophobicContact CB-CE2 4.21Å; Q170-F255 HydrophobicContact CG-CD1 4.5Å; Q170-F255 HydrophobicContact CG-CD2 3.99Å; Q170-F255 HydrophobicContact CG-CE1 4.16Å; Q170-F255 HydrophobicContact CG-CE2 3.63Å; Q170-F255 HydrophobicContact CG-CG 4.41Å; Q170-F255 HydrophobicContact CG-CZ 3.71Å
171	V	72.2	Confident	85.9	Confident	9 Å²	9	53.4 Å²	53.4	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	156.4	175.5	-72.6	0	0	0	0	106.3	L158 G173 V174 A248 R249	L158-V171 HydrophobicContact CD1-CG1 4.48Å; V171-G173 PolarHBondContact O-N 3.15Å; V171-V174 HydrophobicContact CG2-CB 3.98Å; V171-V174 HydrophobicContact CG2-CG2 4.09Å; V171-V174 PolarHBondContact O-N 3.34Å; V171-A248 HydrophobicContact CG1-CB 3.74Å; V171-A248 HydrophobicContact CG2-CB 4.35Å; V171-A248 VanDerWaalsContact CG2-O 3.29Å; V171-A248 WeakPolarHBondContact CG2-O 3.22Å; V171-R249 HydrophobicContact CB-CG 4.23Å; V171-R249 HydrophobicContact CG2-CB 4.39Å; V171-R249 HydrophobicContact CG2-CG 3.71Å
172	K	71.1	Confident	85.9	Confident	195 Å²	195	53 Å²	53	85%	0.848	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.2	110.9	-175.7	-174.2	171.4	-174	169.2	0	113.6
173	G	70	Confident	85.7	Confident	69 Å²	69	47 Å²	47	71%	0.711	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	11.9	176.8	0	0	0	0	0	116.2	E169 V171	E169-G173 PolarHBondContact OE2-N 2.85Å; V171-G173 PolarHBondContact O-N 3.15Å
174	V	78.7	Confident	85.4	Confident	22 Å²	22	49.7 Å²	49.7	13%	0.133	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	108.8	172.3	-178.2	0	0	0	0	108.6	Q170 V171 K252	Q170-V174 HydrophobicContact CB-CG1 4.42Å; Q170-V174 WeakPolarHBondContact CB-O 3.48Å; Q170-V174 PolarHBondContact N-O 3.18Å; V171-V174 HydrophobicContact CG2-CB 3.98Å; V171-V174 HydrophobicContact CG2-CG2 4.09Å; V171-V174 PolarHBondContact O-N 3.34Å; V174-K252 HydrophobicContact CG1-CG 4.43Å
175	T	86.4	Confident	85.1	Confident	65 Å²	65	46 Å²	46	40%	0.399	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	169	178.1	61.9	0	0	0	0	112.9	Q167 V168 E169	Q167-T175 HydrophobicContact CB-CG2 4.38Å; Q167-T175 PolarHBondContact OE1-OG1 3.46Å; V168-T175 CarbonylContact O-C 3.48Å; V168-T175 WeakPolarHBondContact O-CA 3.37Å; E169-T175 HydrophobicContact CG-CG2 3.82Å
176	Y	88.1	Confident	84.4	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	154.3	164.3	57.8	-88.2	0	0	0	110.8	Q167 V168 Q170 F181 F255 C256	Q167-Y176 WeakPolarHBondContact CA-O 3.38Å; Q167-Y176 PolarHBondContact OE1-O 3.31Å; V168-Y176 HydrophobicContact CB-CD1 4.47Å; V168-Y176 HydrophobicContact CB-CD2 4.2Å; V168-Y176 HydrophobicContact CB-CE1 4Å; V168-Y176 HydrophobicContact CB-CE2 3.7Å; V168-Y176 HydrophobicContact CG1-CE1 4Å; V168-Y176 HydrophobicContact CG1-CE2 4.12Å; V168-Y176 WeakPolarHBondContact CG1-OH 3.1Å; V168-Y176 HydrophobicContact CG2-CE2 4.15Å; V168-Y176 PolarHBondContact N-O 2.82Å; V168-Y176 WeakPolarHBondContact O-CD1 3.09Å; V168-Y176 PolarHBondContact O-N 2.86Å; Q170-Y176 HydrophobicContact CB-CD1 3.91Å; Q170-Y176 HydrophobicContact CB-CE1 3.96Å; Y176-F181 HydrophobicContact CD2-CB 3.8Å; Y176-F181 HydrophobicContact CD2-CD2 4.23Å; Y176-F181 HydrophobicContact CD2-CG 4.13Å; Y176-F181 HydrophobicContact CE2-CB 3.62Å; Y176-F181 HydrophobicContact CE2-CD1 4.06Å; Y176-F181 AromaticContact CE2-CD2 3.66Å; Y176-F181 HydrophobicContact CE2-CD2 3.66Å; Y176-F181 HydrophobicContact CE2-CE2 4.32Å; Y176-F181 AromaticContact CE2-CG 3.5Å; Y176-F181 HydrophobicContact CE2-CG 3.5Å; Y176-F255 AromaticContact CE1-CD2 3.69Å; Y176-F255 HydrophobicContact CE1-CD2 3.69Å; Y176-F255 HydrophobicContact CE1-CE2 4.35Å; Y176-F255 AromaticContact CZ-CD2 3.97Å; Y176-C256 VanDerWaalsContact CD2-SG 3.57Å
177	S	91.8	Very high	83.6	Confident	19 Å²	19	50.9 Å²	50.9	13%	0.133	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.2	175.8	164.5	0	0	0	0	111.3	E179 N180 F181	S177-E179 VanDerWaalsContact C-N 3.29Å; S177-E179 PolarHBondContact O-N 2.92Å; S177-E179 PolarHBondContact OG-N 2.84Å; S177-N180 PolarHBondContact O-N 2.86Å; S177-N180 PolarHBondContact OG-N 3.17Å; S177-F181 PolarHBondContact O-N 2.91Å; S177-F181 VanDerWaalsContact O-N 3.1Å
178	L	92.4	Very high	82.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-38.2	174.3	-176.3	65.2	0	0	0	111.6	V163 S166 V168 F181 L182 F195 Q196 L199 L207 L344	V163-L178 HydrophobicContact CG1-CD2 4.3Å; S166-L178 VanDerWaalsContact O-CB 3.27Å; S166-L178 WeakPolarHBondContact O-CB 3.26Å; S166-L178 PolarHBondContact O-N 2.91Å; V168-L178 HydrophobicContact CG2-CB 4.27Å; V168-L178 HydrophobicContact CG2-CD1 3.78Å; L178-F181 PolarHBondContact O-N 2.86Å; L178-L182 HydrophobicContact CD1-CD1 3.77Å; L178-L182 HydrophobicContact CD1-CG 4.14Å; L178-L182 HydrophobicContact CG-CD1 4.12Å; L178-L182 PolarHBondContact O-N 2.84Å; L178-F195 HydrophobicContact CB-CD1 4.24Å; L178-F195 HydrophobicContact CD2-CD1 3.97Å; L178-F195 HydrophobicContact CD2-CE1 4.31Å; L178-F195 HydrophobicContact CG-CD1 3.9Å; L178-F195 HydrophobicContact CG-CE1 3.94Å; L178-Q196 HydrophobicContact CD2-CB 4.37Å; L178-L199 HydrophobicContact CD2-CD1 3.69Å; L178-L199 HydrophobicContact CG-CD1 4.35Å; L178-L207 HydrophobicContact CD1-CD2 4.42Å; L178-L207 HydrophobicContact CD2-CD2 3.47Å; L178-L207 VanDerWaalsContact CD2-CD2 3.47Å; L178-L344 HydrophobicContact CD1-CD1 3.62Å; L178-L344 HydrophobicContact CD1-CD2 3.79Å; L178-L344 HydrophobicContact CD1-CG 4.34Å
179	E	92.1	Very high	81.4	Confident	86 Å²	86	56.3 Å²	56.3	40%	0.402	32%	0.319	S	S	.	.	H	α-helix	trans	-68.5	-40.7	174.8	-175.1	175.6	-161.5	0	0	111.5	S177 F181 G183 F195	S177-E179 VanDerWaalsContact C-N 3.29Å; S177-E179 PolarHBondContact O-N 2.92Å; S177-E179 PolarHBondContact OG-N 2.84Å; E179-F181 PolarHBondContact O-N 2.91Å; E179-G183 CarbonylContact O-C 3.6Å; E179-G183 WeakPolarHBondContact O-CA 3.3Å; E179-G183 PolarHBondContact O-N 2.84Å; E179-F195 HydrophobicContact CB-CB 4.32Å; E179-F195 HydrophobicContact CB-CD1 3.96Å; E179-F195 HydrophobicContact CB-CD2 3.92Å; E179-F195 HydrophobicContact CB-CE1 4.23Å; E179-F195 HydrophobicContact CB-CE2 4.2Å; E179-F195 HydrophobicContact CB-CG 3.8Å; E179-F195 HydrophobicContact CB-CZ 4.35Å; E179-F195 HydrophobicContact CG-CD2 3.82Å; E179-F195 HydrophobicContact CG-CE2 3.93Å; E179-F195 HydrophobicContact CG-CG 4.23Å; E179-F195 HydrophobicContact CG-CZ 4.42Å
180	N	91.5	Very high	80.6	Confident	85 Å²	85	59.7 Å²	59.7	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-27.2	173.6	-73.4	-5.7	0	0	0	112.1	S177 E253 R260	S177-N180 PolarHBondContact O-N 2.86Å; S177-N180 PolarHBondContact OG-N 3.17Å; N180-E253 PolarHBondContact ND2-OE1 3.42Å; N180-R260 PolarHBondContact O-NH2 2.6Å
181	F	95.2	Very high	80.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-87.2	-52.1	-177.5	-172.3	-109.3	0	0	0	113.2	Y176 S177 L178 E179 F236 F255 R260 T275 V277 V342 L344	Y176-F181 HydrophobicContact CD2-CB 3.8Å; Y176-F181 HydrophobicContact CD2-CD2 4.23Å; Y176-F181 HydrophobicContact CD2-CG 4.13Å; Y176-F181 HydrophobicContact CE2-CB 3.62Å; Y176-F181 HydrophobicContact CE2-CD1 4.06Å; Y176-F181 AromaticContact CE2-CD2 3.66Å; Y176-F181 HydrophobicContact CE2-CD2 3.66Å; Y176-F181 HydrophobicContact CE2-CE2 4.32Å; Y176-F181 AromaticContact CE2-CG 3.5Å; Y176-F181 HydrophobicContact CE2-CG 3.5Å; S177-F181 PolarHBondContact O-N 2.91Å; S177-F181 VanDerWaalsContact O-N 3.1Å; L178-F181 PolarHBondContact O-N 2.86Å; E179-F181 PolarHBondContact O-N 2.91Å; F181-F236 WeakPolarHBondContact O-CE2 3.24Å; F181-F255 HydrophobicContact CD2-CB 4.28Å; F181-F255 HydrophobicContact CE2-CB 3.85Å; F181-R260 VanDerWaalsContact O-CZ 3.27Å; F181-R260 PolarHBondContact O-NE 2.92Å; F181-R260 PolarHBondContact O-NH2 2.87Å; F181-T275 HydrophobicContact CE1-CG2 3.9Å; F181-T275 HydrophobicContact CE2-CG2 4.12Å; F181-T275 HydrophobicContact CZ-CG2 3.38Å; F181-V277 HydrophobicContact CE2-CG2 4.16Å; F181-V277 HydrophobicContact CZ-CG2 4.23Å; F181-V342 HydrophobicContact CE1-CB 4.09Å; F181-V342 HydrophobicContact CE1-CG1 3.94Å; F181-V342 HydrophobicContact CE2-CG2 4.45Å; F181-V342 HydrophobicContact CZ-CB 3.75Å; F181-V342 HydrophobicContact CZ-CG1 4Å; F181-V342 HydrophobicContact CZ-CG2 3.79Å; F181-L344 HydrophobicContact CD1-CD1 3.78Å; F181-L344 HydrophobicContact CE1-CD1 3.85Å
182	L	95.2	Very high	80.2	Confident	10 Å²	10	69.5 Å²	69.5	5%	0.052	41%	0.406	C	S	.	.	H	α-helix	trans	-81.6	-16.5	178.9	-62.7	-178.9	0	0	0	112.8	L178 F195 L199 R234 V262 F271 L344	L178-L182 HydrophobicContact CD1-CD1 3.77Å; L178-L182 HydrophobicContact CD1-CG 4.14Å; L178-L182 HydrophobicContact CG-CD1 4.12Å; L178-L182 PolarHBondContact O-N 2.84Å; L182-F195 HydrophobicContact CB-CE1 4.21Å; L182-F195 HydrophobicContact CB-CZ 4.18Å; L182-F195 HydrophobicContact CD1-CE1 4.16Å; L182-L199 HydrophobicContact CD1-CD1 3.89Å; L182-R234 WeakPolarHBondContact O-CD 3.01Å; L182-R234 PolarHBondContact O-NH1 3.1Å; L182-V262 HydrophobicContact CD2-CG1 3.63Å; L182-F271 HydrophobicContact CD1-CE1 4.24Å; L182-F271 HydrophobicContact CD1-CZ 3.8Å; L182-L344 HydrophobicContact CD1-CD1 4.28Å; L182-L344 HydrophobicContact CD2-CD1 3.95Å; L182-L344 HydrophobicContact CG-CD1 4.23Å
183	G	91.6	Very high	80.5	Confident	4 Å²	4	61.6 Å²	61.6	4%	0.041	38%	0.377	C	S	.	.			trans	82.6	174.2	-175.9	0	0	0	0	0	113.1	E179 F195 R234	E179-G183 CarbonylContact O-C 3.6Å; E179-G183 WeakPolarHBondContact O-CA 3.3Å; E179-G183 PolarHBondContact O-N 2.84Å; G183-F195 WeakPolarHBondContact O-CZ 3.43Å; G183-R234 VanDerWaalsContact C-NH1 3.3Å
184	P	87.4	Confident	81.2	Confident	57 Å²	57	60.4 Å²	60.4	37%	0.37	36%	0.358	S	S	.	.	S	Bend	trans	-61.7	150.6	-178.1	27.5	-35.7	0	0	0	111.6	R234 F305	P184-R234 PolarHBondContact O-NH1 3.22Å; P184-R234 PolarHBondContact O-NH2 3.47Å; P184-F305 HydrophobicContact CG-CE1 3.69Å; P184-F305 HydrophobicContact CG-CZ 3.81Å
185	P	80.4	Confident	81.5	Confident	47 Å²	47	60.4 Å²	60.4	31%	0.305	36%	0.356	S	S	.	.			trans	-63.3	139.7	178.1	28.6	-33.9	0	0	0	110.3	R187 F195	P185-R187 PolarHBondContact O-N 3.24Å; P185-R187 VanDerWaalsContact O-N 3.08Å; P185-F195 HydrophobicContact CB-CE2 4.46Å
186	S	70.8	Confident	81.5	Confident	85 Å²	85	58.1 Å²	58.1	59%	0.594	34%	0.341	S	S	*	.	S	Bend	trans	-65.1	-14.2	-176.6	-54	0	0	0	0	114.1
187	R	66.9	Low	81.4	Confident	179 Å²	179	62 Å²	62	68%	0.675	36%	0.362	S	S	*	.	S	Bend	trans	-128.4	126	165.3	-66	-177	-176	153.9	9.5	108.4	P185 S189	P185-R187 PolarHBondContact O-N 3.24Å; P185-R187 VanDerWaalsContact O-N 3.08Å; R187-S189 PolarHBondContact O-N 2.85Å
188	P	64.2	Low	81.2	Confident	125 Å²	125	66.3 Å²	66.3	81%	0.812	38%	0.375	S	S	*	.			trans	-66.5	121.9	169.8	27.2	-31.5	0	0	0	108.9
189	S	62.1	Low	81	Confident	59 Å²	59	67.9 Å²	67.9	41%	0.413	38%	0.383	S	S	.	.			trans	-96.5	136.3	169.3	-176.4	0	0	0	0	109.3	R187 D191	R187-S189 PolarHBondContact O-N 2.85Å; S189-D191 PolarHBondContact O-N 2.87Å; S189-D191 VanDerWaalsContact OG-CB 3.27Å; S189-D191 WeakPolarHBondContact OG-CB 3.45Å; S189-D191 PolarHBondContact OG-N 2.91Å
190	P	66.2	Low	80.9	Confident	137 Å²	137	65.7 Å²	65.7	89%	0.89	37%	0.374	S	S	*	.			trans	-73.2	-4.3	171.6	33	-36.3	0	0	0	113.2
191	D	70.3	Confident	80.8	Confident	86 Å²	86	65.3 Å²	65.3	46%	0.46	38%	0.378	S	S	.	.			trans	-65.8	132	-179.6	-165.5	-35.1	0	0	0	112.1	S189 A193 R198	S189-D191 PolarHBondContact O-N 2.87Å; S189-D191 VanDerWaalsContact OG-CB 3.27Å; S189-D191 WeakPolarHBondContact OG-CB 3.45Å; S189-D191 PolarHBondContact OG-N 2.91Å; D191-A193 PolarHBondContact O-N 2.73Å; D191-A193 VanDerWaalsContact OD1-CB 3.28Å; D191-A193 WeakPolarHBondContact OD1-CB 3.46Å; D191-A193 PolarHBondContact OD1-N 3.09Å; D191-R198 PolarHBondContact O-NH2 2.78Å
192	P	71.6	Confident	80.4	Confident	129 Å²	129	66.9 Å²	66.9	84%	0.838	39%	0.389	S	S	*	.			trans	-68	-7.9	173.9	29.3	-37.4	0	0	0	115.2
193	A	78.4	Confident	80	Confident	29 Å²	29	72.2 Å²	72.2	24%	0.24	42%	0.424	C	S	.	.			trans	-50.5	142.5	177	0	0	0	0	0	113	D191 D197 R198	D191-A193 PolarHBondContact O-N 2.73Å; D191-A193 VanDerWaalsContact OD1-CB 3.28Å; D191-A193 WeakPolarHBondContact OD1-CB 3.46Å; D191-A193 PolarHBondContact OD1-N 3.09Å; A193-D197 HydrophobicContact CB-CB 4.26Å; A193-R198 VanDerWaalsContact O-CZ 3.25Å; A193-R198 PolarHBondContact O-NE 3.38Å; A193-R198 PolarHBondContact O-NH2 3.2Å
194	S	83.4	Confident	79.9	Confident	43 Å²	43	78.1 Å²	78.1	30%	0.301	46%	0.455	S	S	.	.			trans	-68.3	162.5	-176.8	81.5	0	0	0	0	111.9	Q196 D197 R198	S194-Q196 PolarHBondContact O-N 3.34Å; S194-D197 WeakPolarHBondContact CA-OD2 3.42Å; S194-D197 WeakPolarHBondContact CB-OD2 3.34Å; S194-D197 PolarHBondContact N-OD2 2.96Å; S194-D197 PolarHBondContact O-N 2.85Å; S194-D197 VanDerWaalsContact O-N 3.1Å; S194-D197 PolarHBondContact OG-N 3.07Å; S194-D197 PolarHBondContact OG-OD1 2.95Å; S194-D197 PolarHBondContact OG-OD2 2.75Å; S194-R198 WeakPolarHBondContact O-CG 3.36Å; S194-R198 PolarHBondContact O-N 2.83Å
195	F	86	Confident	80.2	Confident	23 Å²	23	78.6 Å²	78.6	10%	0.101	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-34.5	178.7	-173.2	-95.5	0	0	0	112	L178 E179 L182 G183 P185 L199	L178-F195 HydrophobicContact CB-CD1 4.24Å; L178-F195 HydrophobicContact CD2-CD1 3.97Å; L178-F195 HydrophobicContact CD2-CE1 4.31Å; L178-F195 HydrophobicContact CG-CD1 3.9Å; L178-F195 HydrophobicContact CG-CE1 3.94Å; E179-F195 HydrophobicContact CB-CB 4.32Å; E179-F195 HydrophobicContact CB-CD1 3.96Å; E179-F195 HydrophobicContact CB-CD2 3.92Å; E179-F195 HydrophobicContact CB-CE1 4.23Å; E179-F195 HydrophobicContact CB-CE2 4.2Å; E179-F195 HydrophobicContact CB-CG 3.8Å; E179-F195 HydrophobicContact CB-CZ 4.35Å; E179-F195 HydrophobicContact CG-CD2 3.82Å; E179-F195 HydrophobicContact CG-CE2 3.93Å; E179-F195 HydrophobicContact CG-CG 4.23Å; E179-F195 HydrophobicContact CG-CZ 4.42Å; L182-F195 HydrophobicContact CB-CE1 4.21Å; L182-F195 HydrophobicContact CB-CZ 4.18Å; L182-F195 HydrophobicContact CD1-CE1 4.16Å; G183-F195 WeakPolarHBondContact O-CZ 3.43Å; P185-F195 HydrophobicContact CB-CE2 4.46Å; F195-L199 HydrophobicContact CD1-CD1 4.21Å; F195-L199 HydrophobicContact CE1-CD1 3.93Å; F195-L199 WeakPolarHBondContact O-CG 3.45Å
196	Q	86.3	Confident	80.9	Confident	17 Å²	17	76.3 Å²	76.3	8%	0.079	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-44.7	173.1	173.8	168.7	-3.1	0	0	112.5	V163 S166 L178 S194 R198 L199 L207	V163-Q196 PolarHBondContact O-NE2 2.81Å; S166-Q196 VanDerWaalsContact OG-CB 3.27Å; S166-Q196 WeakPolarHBondContact OG-CB 3.49Å; S166-Q196 PolarHBondContact OG-N 3.18Å; L178-Q196 HydrophobicContact CD2-CB 4.37Å; S194-Q196 PolarHBondContact O-N 3.34Å; Q196-R198 VanDerWaalsContact C-N 3.28Å; Q196-R198 PolarHBondContact O-N 3.36Å; Q196-L199 WeakPolarHBondContact O-CB 3.39Å; Q196-L199 PolarHBondContact O-N 2.72Å; Q196-L199 VanDerWaalsContact O-N 3.09Å; Q196-L207 HydrophobicContact CG-CB 4.43Å; Q196-L207 HydrophobicContact CG-CD2 4.34Å
197	D	86.2	Confident	82.1	Confident	83 Å²	83	72.3 Å²	72.3	44%	0.444	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-64.8	-35.4	-177.8	-51.2	-42.3	0	0	0	111.4	A193 S194 L199 L200	A193-D197 HydrophobicContact CB-CB 4.26Å; S194-D197 WeakPolarHBondContact CA-OD2 3.42Å; S194-D197 WeakPolarHBondContact CB-OD2 3.34Å; S194-D197 PolarHBondContact N-OD2 2.96Å; S194-D197 PolarHBondContact O-N 2.85Å; S194-D197 VanDerWaalsContact O-N 3.1Å; S194-D197 PolarHBondContact OG-N 3.07Å; S194-D197 PolarHBondContact OG-OD1 2.95Å; S194-D197 PolarHBondContact OG-OD2 2.75Å; D197-L199 PolarHBondContact O-N 3.31Å; D197-L200 PolarHBondContact O-N 3.3Å; D197-L200 VanDerWaalsContact O-N 3.13Å
198	R	86.3	Confident	83.5	Confident	108 Å²	108	64.2 Å²	64.2	41%	0.408	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-65.9	-15.1	175.6	-62.1	170.3	-153.9	-141.9	-4.5	114.2	D191 A193 S194 Q196	D191-R198 PolarHBondContact O-NH2 2.78Å; A193-R198 VanDerWaalsContact O-CZ 3.25Å; A193-R198 PolarHBondContact O-NE 3.38Å; A193-R198 PolarHBondContact O-NH2 3.2Å; S194-R198 WeakPolarHBondContact O-CG 3.36Å; S194-R198 PolarHBondContact O-N 2.83Å; Q196-R198 VanDerWaalsContact C-N 3.28Å; Q196-R198 PolarHBondContact O-N 3.36Å
199	L	88.6	Confident	85.1	Confident	33 Å²	33	58.4 Å²	58.4	17%	0.173	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-93.9	-16.9	175.7	-62.6	172.3	0	0	0	112.3	L178 L182 F195 Q196 D197 L207 F271	L178-L199 HydrophobicContact CD2-CD1 3.69Å; L178-L199 HydrophobicContact CG-CD1 4.35Å; L182-L199 HydrophobicContact CD1-CD1 3.89Å; F195-L199 HydrophobicContact CD1-CD1 4.21Å; F195-L199 HydrophobicContact CE1-CD1 3.93Å; F195-L199 WeakPolarHBondContact O-CG 3.45Å; Q196-L199 WeakPolarHBondContact O-CB 3.39Å; Q196-L199 PolarHBondContact O-N 2.72Å; Q196-L199 VanDerWaalsContact O-N 3.09Å; D197-L199 PolarHBondContact O-N 3.31Å; L199-L207 HydrophobicContact CD1-CD2 4.18Å; L199-F271 HydrophobicContact CB-CD1 4.35Å; L199-F271 HydrophobicContact CB-CG 4.26Å; L199-F271 HydrophobicContact CD1-CE1 4.26Å; L199-F271 HydrophobicContact CD1-CZ 4.44Å; L199-F271 HydrophobicContact CD2-CD2 3.98Å; L199-F271 HydrophobicContact CD2-CE2 3.83Å; L199-F271 HydrophobicContact CD2-CG 4.39Å; L199-F271 HydrophobicContact CD2-CZ 4.12Å; L199-F271 WeakPolarHBondContact O-CB 3.18Å
200	L	90.8	Very high	86.8	Confident	41 Å²	41	55.6 Å²	55.6	22%	0.215	32%	0.319	C	S	.	.			trans	-85.1	134.4	-179	-63.8	175.4	0	0	0	110.8	D197 L207 E346	D197-L200 PolarHBondContact O-N 3.3Å; D197-L200 VanDerWaalsContact O-N 3.13Å; L200-L207 HydrophobicContact CD2-CB 4.18Å; L200-E346 HydrophobicContact CD2-CB 4.36Å; L200-E346 HydrophobicContact CD2-CG 3.7Å
201	S	88.8	Confident	88.2	Confident	77 Å²	77	49.1 Å²	49.1	54%	0.538	28%	0.277	S	S	.	.	S	Bend	trans	-78.4	-22.6	172.2	68	0	0	0	0	113.7	R205 E346	S201-R205 VanDerWaalsContact OG-CD 3.24Å; S201-R205 WeakPolarHBondContact OG-CD 3.43Å; S201-R205 PolarHBondContact OG-NE 2.83Å; S201-E346 WeakPolarHBondContact CA-OE1 3.42Å; S201-E346 WeakPolarHBondContact CB-OE1 3.45Å; S201-E346 VanDerWaalsContact N-CD 3.32Å; S201-E346 PolarHBondContact N-OE1 2.88Å; S201-E346 PolarHBondContact N-OE2 2.74Å; S201-E346 PolarHBondContact OG-OE1 3.41Å; S201-E346 PolarHBondContact OG-OE2 3.47Å
202	S	88	Confident	89.4	Confident	32 Å²	32	45 Å²	45	22%	0.224	26%	0.255	C	S	.	.			trans	-152.1	146.7	179.3	170.3	0	0	0	0	111.8	D204 R205	S202-D204 PolarHBondContact O-N 2.77Å; S202-D204 PolarHBondContact OG-N 2.82Å; S202-R205 PolarHBondContact O-N 2.85Å
203	P	85.3	Confident	90.6	Very high	122 Å²	122	40 Å²	40	79%	0.792	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.3	174	27.5	-37.3	0	0	0	114.5	R205	P203-R205 PolarHBondContact O-N 3.25Å
204	D	89.6	Confident	91.3	Very high	129 Å²	129	38.7 Å²	38.7	69%	0.69	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-4	178.9	-55.8	-49.6	0	0	0	113.1	S202	S202-D204 PolarHBondContact O-N 2.77Å; S202-D204 PolarHBondContact OG-N 2.82Å
205	R	93.4	Very high	91.6	Very high	66 Å²	66	37.9 Å²	37.9	25%	0.249	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	157.7	-177.9	-63.2	171.1	-179.1	-83.9	-0.4	110.6	S201 S202 P203 H269 E346 A347	S201-R205 VanDerWaalsContact OG-CD 3.24Å; S201-R205 WeakPolarHBondContact OG-CD 3.43Å; S201-R205 PolarHBondContact OG-NE 2.83Å; S202-R205 PolarHBondContact O-N 2.85Å; P203-R205 PolarHBondContact O-N 3.25Å; R205-H269 VanDerWaalsContact NH1-CB 3.28Å; R205-H269 PolarHBondContact NH1-O 2.98Å; R205-E346 HydrophobicContact CB-CG 3.78Å; R205-E346 WeakPolarHBondContact CB-OE1 3.32Å; R205-E346 WeakPolarHBondContact CD-OE1 3.26Å; R205-E346 HydrophobicContact CG-CG 4.41Å; R205-A347 CarbonylContact C-O 3.6Å; R205-A347 WeakPolarHBondContact CA-O 3.46Å
206	A	95.4	Very high	91.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	146.7	176.9	0	0	0	0	0	110.6	R162 F208 E346 A347 A349	R162-A206 HydrophobicContact CG-CB 4.25Å; A206-F208 HydrophobicContact CB-CD2 4.29Å; A206-F208 HydrophobicContact CB-CE2 3.58Å; A206-F208 HydrophobicContact CB-CZ 3.8Å; A206-F208 WeakPolarHBondContact O-CD2 3.27Å; A206-F208 WeakPolarHBondContact O-CE2 3.47Å; A206-E346 WeakPolarHBondContact O-CA 3.35Å; A206-A347 PolarHBondContact N-O 3.34Å; A206-A347 PolarHBondContact O-N 2.92Å; A206-A349 HydrophobicContact CB-CB 4.35Å
207	L	96.4	Very high	91.9	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128	171.5	-171.3	71	0	0	0	108.9	V163 L178 Q196 L199 L200 F271	V163-L207 HydrophobicContact CB-CB 4.19Å; V163-L207 HydrophobicContact CB-CD2 4.06Å; V163-L207 HydrophobicContact CB-CG 4.18Å; V163-L207 HydrophobicContact CG1-CD2 4.12Å; V163-L207 HydrophobicContact CG2-CB 4.39Å; V163-L207 HydrophobicContact CG2-CD2 4Å; V163-L207 HydrophobicContact CG2-CG 3.93Å; V163-L207 PolarHBondContact N-O 3.2Å; L178-L207 HydrophobicContact CD1-CD2 4.42Å; L178-L207 HydrophobicContact CD2-CD2 3.47Å; L178-L207 VanDerWaalsContact CD2-CD2 3.47Å; Q196-L207 HydrophobicContact CG-CB 4.43Å; Q196-L207 HydrophobicContact CG-CD2 4.34Å; L199-L207 HydrophobicContact CD1-CD2 4.18Å; L200-L207 HydrophobicContact CD2-CB 4.18Å; L207-F271 HydrophobicContact CD1-CD1 3.8Å; L207-F271 HydrophobicContact CD1-CE1 4.24Å
208	F	97	Very high	92.2	Very high	9 Å²	9	35.3 Å²	35.3	4%	0.039	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	162	179.6	-63.7	-88	0	0	0	110.7	G161 R162 A206 L344 F345 A347 P348 F351 F353	G161-F208 CarbonylContact O-C 3.45Å; G161-F208 WeakPolarHBondContact O-CA 3.44Å; R162-F208 HydrophobicContact CB-CD1 4.03Å; R162-F208 HydrophobicContact CB-CE1 4.03Å; R162-F208 HydrophobicContact CG-CE1 4.43Å; A206-F208 HydrophobicContact CB-CD2 4.29Å; A206-F208 HydrophobicContact CB-CE2 3.58Å; A206-F208 HydrophobicContact CB-CZ 3.8Å; A206-F208 WeakPolarHBondContact O-CD2 3.27Å; A206-F208 WeakPolarHBondContact O-CE2 3.47Å; F208-L344 WeakPolarHBondContact O-CA 3.44Å; F208-F345 HydrophobicContact CB-CD1 4.46Å; F208-F345 HydrophobicContact CB-CD2 4.08Å; F208-F345 HydrophobicContact CB-CE1 4.01Å; F208-F345 HydrophobicContact CB-CE2 3.6Å; F208-F345 HydrophobicContact CB-CG 4.49Å; F208-F345 HydrophobicContact CB-CZ 3.56Å; F208-F345 HydrophobicContact CD2-CE2 4.15Å; F208-F345 HydrophobicContact CG-CE2 4.13Å; F208-F345 HydrophobicContact CG-CZ 4.39Å; F208-F345 PolarHBondContact N-O 2.82Å; F208-F345 PolarHBondContact O-N 3.25Å; F208-A347 HydrophobicContact CD2-CB 3.8Å; F208-A347 HydrophobicContact CE2-CB 3.79Å; F208-P348 WeakPolarHBondContact CE2-O 3.4Å; F208-F351 HydrophobicContact CD1-CD1 4.34Å; F208-F351 HydrophobicContact CE1-CD1 4.33Å; F208-F351 HydrophobicContact CE2-CB 3.93Å; F208-F351 HydrophobicContact CG-CD1 4.41Å; F208-F351 HydrophobicContact CZ-CB 3.87Å; F208-F351 HydrophobicContact CZ-CD1 4.42Å; F208-F353 HydrophobicContact CB-CE2 4.4Å; F208-F353 HydrophobicContact CB-CZ 4.06Å; F208-F353 AromaticContact CD1-CE2 3.81Å; F208-F353 HydrophobicContact CD1-CE2 3.81Å; F208-F353 HydrophobicContact CD1-CZ 4.3Å; F208-F353 HydrophobicContact CG-CE2 4.49Å
209	H	97.3	Very high	92.5	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.019	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.9	177.7	85.2	103.3	0	0	0	112.8	H159 F160 G161 V163 V168 E169 L343 L344	H159-H209 AromaticContact CE1-NE2 3.9Å; H159-H209 AromaticContact CG-CE1 3.93Å; H159-H209 AromaticContact ND1-CE1 3.19Å; H159-H209 PolarHBondContact ND1-CE1 2.68Å; H159-H209 AromaticContact ND1-NE2 3.18Å; H159-H209 PolarHBondContact ND1-NE2 2.66Å; H159-H209 VanDerWaalsContact ND1-NE2 3.18Å; F160-H209 CarbonylContact C-O 3.48Å; F160-H209 WeakPolarHBondContact CA-O 3.27Å; G161-H209 PolarHBondContact N-O 2.84Å; G161-H209 PolarHBondContact O-CD2 3.18Å; G161-H209 VanDerWaalsContact O-CD2 3.31Å; G161-H209 PolarHBondContact O-N 2.75Å; V163-H209 HydrophobicContact CG2-CB 4.05Å; V168-H209 HydrophobicContact CG1-CB 4.08Å; V168-H209 VanDerWaalsContact CG1-ND1 3.34Å; V168-H209 WeakPolarHBondContact CG1-ND1 3.08Å; E169-H209 PolarHBondContact O-CE1 3.06Å; H209-L343 CarbonylContact C-O 3.59Å; H209-L343 WeakPolarHBondContact CA-O 3.43Å; H209-L343 WeakPolarHBondContact CB-O 3.45Å; H209-L344 HydrophobicContact CB-CD2 3.61Å; H209-L344 HydrophobicContact CB-CG 4.33Å
210	V	97.1	Very high	92.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	135.6	170.6	-178.3	0	0	0	0	109.2	I157 F160 V212 V342 L343 F345 F353 L355 L367	I157-V210 HydrophobicContact CD1-CG1 4.06Å; F160-V210 HydrophobicContact CB-CB 4.47Å; F160-V210 HydrophobicContact CB-CG1 4.47Å; F160-V210 HydrophobicContact CB-CG2 3.98Å; V210-V212 HydrophobicContact CG1-CG2 3.91Å; V210-V342 WeakPolarHBondContact O-CA 3.39Å; V210-L343 HydrophobicContact CB-CB 4.39Å; V210-L343 PolarHBondContact N-O 3.49Å; V210-L343 PolarHBondContact O-N 3.35Å; V210-F345 HydrophobicContact CG2-CE1 4.19Å; V210-F353 HydrophobicContact CG2-CD1 4.23Å; V210-F353 HydrophobicContact CG2-CE1 3.32Å; V210-F353 HydrophobicContact CG2-CZ 3.89Å; V210-L355 HydrophobicContact CG1-CD1 4.37Å; V210-L355 HydrophobicContact CG2-CD1 4.37Å; V210-L367 HydrophobicContact CG2-CD1 4.33Å
211	V	96.3	Very high	92.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	109.7	178.3	-176.2	0	0	0	0	108.9	L158 H159 F255 T340 V342	L158-V211 HydrophobicContact CB-CB 4.16Å; L158-V211 HydrophobicContact CB-CG1 3.87Å; L158-V211 HydrophobicContact CD1-CG1 3.98Å; L158-V211 HydrophobicContact CG-CG1 4.2Å; L158-V211 PolarHBondContact N-O 3.11Å; H159-V211 HydrophobicContact CB-CB 4.47Å; H159-V211 HydrophobicContact CB-CG2 4.31Å; H159-V211 PolarHBondContact O-N 3.15Å; V211-F255 HydrophobicContact CG1-CE2 3.57Å; V211-F255 HydrophobicContact CG1-CZ 3.72Å; V211-F255 HydrophobicContact CG2-CE2 4.3Å; V211-T340 HydrophobicContact CG1-CG2 3.59Å; V211-V342 HydrophobicContact CG2-CG1 4.48Å
212	V	96.4	Very high	93.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	118.3	179.5	-170.1	0	0	0	0	109.3	I157 V210 T340 I341 I361	I157-V212 HydrophobicContact CD1-CG2 4.13Å; V210-V212 HydrophobicContact CG1-CG2 3.91Å; V212-T340 CarbonylContact O-C 3.54Å; V212-T340 WeakPolarHBondContact O-CA 3.41Å; V212-T340 WeakPolarHBondContact O-CG2 3.48Å; V212-I341 PolarHBondContact N-O 2.95Å; V212-I341 PolarHBondContact O-N 3.24Å; V212-I361 HydrophobicContact CG1-CG2 4.21Å
213	Y	94.8	Very high	93.7	Very high	25 Å²	25	22.7 Å²	22.7	10%	0.098	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.6	175.1	167.6	-116.1	0	0	0	111.2	G155 R156 L158 A215 V243 P245 S339	G155-Y213 CarbonylContact C-O 3.59Å; G155-Y213 VanDerWaalsContact CA-O 3.26Å; G155-Y213 WeakPolarHBondContact CA-O 3.11Å; R156-Y213 PolarHBondContact N-O 2.88Å; R156-Y213 PolarHBondContact O-N 2.89Å; L158-Y213 HydrophobicContact CD2-CD1 4.49Å; L158-Y213 HydrophobicContact CD2-CG 4.34Å; Y213-A215 HydrophobicContact CE1-CB 3.88Å; Y213-V243 HydrophobicContact CD2-CG2 3.89Å; Y213-V243 HydrophobicContact CE2-CG2 3.86Å; Y213-P245 HydrophobicContact CD1-CG 4.33Å; Y213-S339 WeakPolarHBondContact CD2-O 3.24Å
214	L	93.7	Very high	94.3	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.			trans	-97	106.5	178.2	-58.8	79.6	0	0	0	108.7	A153 D154 H220 F335 S339 I341	A153-L214 HydrophobicContact CB-CD1 4.36Å; A153-L214 HydrophobicContact CB-CD2 3.95Å; A153-L214 HydrophobicContact CB-CG 4.21Å; D154-L214 WeakPolarHBondContact O-CG 3.09Å; L214-H220 WeakPolarHBondContact CA-NE2 3.31Å; L214-H220 WeakPolarHBondContact CB-CE1 3.37Å; L214-H220 WeakPolarHBondContact CB-NE2 3.44Å; L214-H220 WeakPolarHBondContact CD2-CE1 3.34Å; L214-H220 PolarHBondContact O-NE2 3.43Å; L214-F335 HydrophobicContact CD2-CD2 4.26Å; L214-F335 HydrophobicContact CD2-CE2 4.29Å; L214-S339 WeakPolarHBondContact CD1-O 3.46Å; L214-S339 PolarHBondContact N-O 2.87Å; L214-S339 PolarHBondContact O-N 2.82Å; L214-I341 HydrophobicContact CD1-CG1 4.08Å
215	A	90.9	Very high	94.7	Very high	26 Å²	26	10.8 Å²	10.8	22%	0.215	6%	0.057	C	C	.	.			trans	-74.8	157.2	176.1	0	0	0	0	0	110.8	Y213 G217 D218 H220	Y213-A215 HydrophobicContact CE1-CB 3.88Å; A215-G217 PolarHBondContact O-N 3.35Å; A215-D218 WeakPolarHBondContact CA-OD2 3.34Å; A215-D218 VanDerWaalsContact CB-OD2 3.31Å; A215-D218 WeakPolarHBondContact CB-OD2 3.36Å; A215-D218 PolarHBondContact N-OD2 3.47Å; A215-D218 WeakPolarHBondContact O-CB 3.39Å; A215-D218 PolarHBondContact O-N 3.13Å; A215-H220 PolarHBondContact N-NE2 2.91Å; A215-H220 PolarHBondContact O-NE2 3.02Å
216	P	88.5	Confident	94.9	Very high	36 Å²	36	7.7 Å²	7.7	23%	0.234	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20	-171	-24.9	34	0	0	0	116.4	Y106 F110	Y106-P216 PolarHBondContact OH-O 2.92Å; F110-P216 HydrophobicContact CD1-CB 3.73Å; F110-P216 HydrophobicContact CD1-CG 4.09Å; F110-P216 HydrophobicContact CD2-CB 4.48Å; F110-P216 HydrophobicContact CE1-CB 3.94Å; F110-P216 HydrophobicContact CE1-CG 4.02Å; F110-P216 HydrophobicContact CG-CB 4.02Å; F110-P216 HydrophobicContact CZ-CB 4.39Å
217	G	89.3	Confident	95.1	Very high	7 Å²	7	12.6 Å²	12.6	7%	0.072	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.3	177.2	0	0	0	0	0	114.6	R134 A215	R134-G217 PolarHBondContact NH2-O 3.14Å; A215-G217 PolarHBondContact O-N 3.35Å
218	D	92.5	Very high	95.1	Very high	26 Å²	26	13.2 Å²	13.2	14%	0.139	7%	0.073	C	C	.	.	S	Bend	trans	-76.3	-172.3	-170.5	-58.8	-27	0	0	0	111.3	R134 D154 A215 H220	R134-D218 PolarHBondContact NH1-O 3.04Å; R134-D218 VanDerWaalsContact NH1-O 3.11Å; R134-D218 PolarHBondContact NH2-O 2.87Å; D154-D218 HydrophobicContact CB-CB 4.23Å; A215-D218 WeakPolarHBondContact CA-OD2 3.34Å; A215-D218 VanDerWaalsContact CB-OD2 3.31Å; A215-D218 WeakPolarHBondContact CB-OD2 3.36Å; A215-D218 PolarHBondContact N-OD2 3.47Å; A215-D218 WeakPolarHBondContact O-CB 3.39Å; A215-D218 PolarHBondContact O-N 3.13Å; D218-H220 PolarHBondContact O-CD2 3.41Å; D218-H220 VanDerWaalsContact O-CD2 3.24Å
219	Y	93.1	Very high	95.1	Very high	13 Å²	13	16.9 Å²	16.9	5%	0.051	9%	0.087	C	C	.	.			trans	-95.6	125.5	172.1	173.4	-125.4	0	0	0	109.8	R134 L136 D154 C221 H223	R134-Y219 WeakPolarHBondContact O-CE2 3.34Å; L136-Y219 HydrophobicContact CD1-CD1 3.78Å; L136-Y219 HydrophobicContact CD1-CD2 4.07Å; L136-Y219 HydrophobicContact CD1-CE1 4.25Å; L136-Y219 HydrophobicContact CD1-CG 3.67Å; L136-Y219 HydrophobicContact CD2-CD2 4.19Å; L136-Y219 HydrophobicContact CD2-CG 4.46Å; L136-Y219 HydrophobicContact CG-CD1 4.26Å; L136-Y219 HydrophobicContact CG-CD2 3.71Å; L136-Y219 HydrophobicContact CG-CE1 4.46Å; L136-Y219 HydrophobicContact CG-CE2 3.95Å; L136-Y219 HydrophobicContact CG-CG 3.87Å; D154-Y219 VanDerWaalsContact OD2-CB 3.24Å; D154-Y219 WeakPolarHBondContact OD2-CB 3.48Å; Y219-C221 HydrophobicContact CE1-CB 3.8Å; Y219-C221 HydrophobicContact CE2-CB 3.87Å; Y219-C221 VanDerWaalsContact CE2-SG 3.52Å; Y219-C221 VanDerWaalsContact CZ-CB 3.4Å; Y219-C221 VanDerWaalsContact OH-CB 3.32Å; Y219-C221 WeakPolarHBondContact OH-CB 3.34Å; Y219-C221 PolarHBondContact OH-SG 2.87Å; Y219-H223 AromaticContact CE1-NE2 3.53Å; Y219-H223 AromaticContact CZ-NE2 3.87Å; Y219-H223 PolarHBondContact OH-NE2 3.4Å
220	H	92.6	Very high	95.1	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	9%	0.086	C	C	.	.			trans	-105.8	18.2	-167.7	-68.6	-82.1	0	0	0	115.4	F132 L214 A215 D218 E334 F335 G338 S339	F132-H220 HydrophobicContact CD1-CB 4.16Å; F132-H220 HydrophobicContact CE1-CB 3.36Å; F132-H220 AromaticContact CE1-CD2 3.3Å; F132-H220 WeakPolarHBondContact CE1-CD2 3.35Å; F132-H220 AromaticContact CE1-CG 3.17Å; F132-H220 AromaticContact CE1-ND1 3.83Å; F132-H220 AromaticContact CE2-CD2 3.6Å; F132-H220 HydrophobicContact CZ-CB 3.96Å; F132-H220 AromaticContact CZ-CD2 2.96Å; F132-H220 WeakPolarHBondContact CZ-CD2 3.31Å; F132-H220 AromaticContact CZ-CG 3.2Å; F132-H220 AromaticContact CZ-ND1 3.54Å; L214-H220 WeakPolarHBondContact CA-NE2 3.31Å; L214-H220 WeakPolarHBondContact CB-CE1 3.37Å; L214-H220 WeakPolarHBondContact CB-NE2 3.44Å; L214-H220 WeakPolarHBondContact CD2-CE1 3.34Å; L214-H220 PolarHBondContact O-NE2 3.43Å; A215-H220 PolarHBondContact N-NE2 2.91Å; A215-H220 PolarHBondContact O-NE2 3.02Å; D218-H220 PolarHBondContact O-CD2 3.41Å; D218-H220 VanDerWaalsContact O-CD2 3.24Å; H220-E334 WeakPolarHBondContact O-CA 3.29Å; H220-F335 PolarHBondContact O-N 3.21Å; H220-G338 VanDerWaalsContact NE2-CA 3.28Å; H220-G338 WeakPolarHBondContact NE2-CA 3.44Å; H220-S339 PolarHBondContact CE1-OG 3.3Å
221	C	94.3	Very high	95	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	150	158.6	-48.7	0	0	0	0	109.3	R135 Y219 G333 E334	R135-C221 PolarHBondContact NH1-SG 3.43Å; Y219-C221 HydrophobicContact CE1-CB 3.8Å; Y219-C221 HydrophobicContact CE2-CB 3.87Å; Y219-C221 VanDerWaalsContact CE2-SG 3.52Å; Y219-C221 VanDerWaalsContact CZ-CB 3.4Å; Y219-C221 VanDerWaalsContact OH-CB 3.32Å; Y219-C221 WeakPolarHBondContact OH-CB 3.34Å; Y219-C221 PolarHBondContact OH-SG 2.87Å; C221-G333 CarbonylContact C-O 3.51Å; C221-G333 VanDerWaalsContact CA-O 3.26Å; C221-G333 WeakPolarHBondContact CA-O 3.36Å; C221-G333 WeakPolarHBondContact CB-O 3.1Å; C221-E334 HydrophobicContact CB-CB 4.49Å
222	F	96.1	Very high	94.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.5	173.6	55.2	-87	0	0	0	110	P152 A153 L274 A276 I285 V332 G333 F335 I341	P152-F222 CarbonylContact O-C 3.4Å; P152-F222 VanDerWaalsContact O-CA 3.26Å; P152-F222 WeakPolarHBondContact O-CA 3.14Å; A153-F222 HydrophobicContact CB-CB 4.41Å; F222-L274 HydrophobicContact CD2-CD2 3.82Å; F222-L274 HydrophobicContact CE2-CD2 3.93Å; F222-A276 HydrophobicContact CE1-CB 4.3Å; F222-A276 HydrophobicContact CE2-CB 4.48Å; F222-A276 HydrophobicContact CZ-CB 3.97Å; F222-I285 HydrophobicContact CE1-CG2 4.5Å; F222-I285 HydrophobicContact CZ-CG2 4.35Å; F222-V332 HydrophobicContact CD2-CB 3.95Å; F222-V332 HydrophobicContact CD2-CG1 4.04Å; F222-V332 HydrophobicContact CE2-CB 4.1Å; F222-V332 HydrophobicContact CE2-CG1 3.75Å; F222-V332 PolarHBondContact O-N 3.37Å; F222-G333 VanDerWaalsContact CE1-C 3.41Å; F222-G333 PolarHBondContact N-O 3.41Å; F222-G333 PolarHBondContact O-N 3.22Å; F222-G333 VanDerWaalsContact O-N 3.08Å; F222-F335 AromaticContact CD1-CD2 3.65Å; F222-F335 HydrophobicContact CD1-CD2 3.65Å; F222-F335 AromaticContact CD1-CE2 3.32Å; F222-F335 HydrophobicContact CD1-CE2 3.32Å; F222-F335 HydrophobicContact CD1-CZ 4.09Å; F222-F335 AromaticContact CE1-CD2 3.85Å; F222-F335 HydrophobicContact CE1-CD2 3.85Å; F222-F335 AromaticContact CE1-CE2 3.61Å; F222-F335 HydrophobicContact CE1-CE2 3.61Å; F222-F335 HydrophobicContact CE1-CG 4.45Å; F222-F335 HydrophobicContact CE1-CZ 4Å; F222-F335 HydrophobicContact CG-CE2 4.27Å; F222-I341 HydrophobicContact CB-CD1 3.8Å; F222-I341 HydrophobicContact CB-CG1 4.12Å; F222-I341 HydrophobicContact CD1-CD1 4Å; F222-I341 HydrophobicContact CD2-CD1 3.95Å; F222-I341 HydrophobicContact CG-CD1 3.65Å; F222-I341 HydrophobicContact CG-CG1 4.48Å
223	H	97.9	Very high	95	Very high	13 Å²	13	22.2 Å²	22.2	6%	0.06	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	165	-166.8	-70.1	-113.1	0	0	0	109.9	P152 Y219 P225 G329 E330 M363	P152-H223 WeakPolarHBondContact CA-O 3.38Å; P152-H223 VanDerWaalsContact CB-O 3.22Å; P152-H223 WeakPolarHBondContact CB-O 3.37Å; P152-H223 PolarHBondContact O-N 2.65Å; Y219-H223 AromaticContact CE1-NE2 3.53Å; Y219-H223 AromaticContact CZ-NE2 3.87Å; Y219-H223 PolarHBondContact OH-NE2 3.4Å; H223-P225 WeakPolarHBondContact O-CD 3.33Å; H223-G329 PolarHBondContact ND1-O 3.08Å; H223-E330 CarbonylContact C-O 3.59Å; H223-E330 WeakPolarHBondContact CA-O 3.2Å; H223-E330 WeakPolarHBondContact CB-O 3.41Å; H223-M363 HydrophobicContact CB-CG 3.77Å; H223-M363 HydrophobicContact CB-SD 3.81Å
224	S	98.4	Very high	95.1	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.007	11%	0.11	C	C	.	.			trans	-72	122.3	178.8	-163.5	0	0	0	0	110	A226 W228 R327 G329 E330	S224-A226 VanDerWaalsContact C-N 3.31Å; S224-A226 PolarHBondContact O-N 2.81Å; S224-A226 PolarHBondContact OG-O 2.84Å; S224-W228 PolarHBondContact OG-NE1 3.41Å; S224-R327 WeakPolarHBondContact CB-O 3.28Å; S224-G329 PolarHBondContact O-N 3.15Å; S224-E330 PolarHBondContact N-O 3.17Å
225	P	98	Very high	95.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	-75.8	-20.7	-177.2	31.6	-37.6	0	0	0	113.1	L149 T150 P152 H223 F272 L274 L343	L149-P225 HydrophobicContact CD1-CB 3.96Å; L149-P225 HydrophobicContact CD1-CG 4.32Å; T150-P225 PolarHBondContact N-O 2.79Å; T150-P225 WeakPolarHBondContact O-CA 3.26Å; T150-P225 WeakPolarHBondContact O-CB 3.5Å; T150-P225 PolarHBondContact OG1-O 2.94Å; P152-P225 HydrophobicContact CB-CB 4.33Å; H223-P225 WeakPolarHBondContact O-CD 3.33Å; P225-F272 HydrophobicContact CB-CZ 4.42Å; P225-F272 HydrophobicContact CG-CE1 3.62Å; P225-F272 HydrophobicContact CG-CZ 3.37Å; P225-L274 HydrophobicContact CG-CD1 4.48Å; P225-L343 HydrophobicContact CB-CD1 3.98Å; P225-L343 HydrophobicContact CG-CD1 4.09Å; P225-L343 HydrophobicContact CG-CD2 4.07Å
226	A	97.9	Very high	95.5	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.008	11%	0.105	C	C	.	.	S	Bend	trans	-148	178.6	-178.9	0	0	0	0	0	110.1	C148 L149 S224 W267 K328	C148-A226 WeakPolarHBondContact O-CB 3.3Å; L149-A226 HydrophobicContact CD1-CB 4.13Å; S224-A226 VanDerWaalsContact C-N 3.31Å; S224-A226 PolarHBondContact O-N 2.81Å; S224-A226 PolarHBondContact OG-O 2.84Å; A226-W267 HydrophobicContact CB-CE3 3.75Å; A226-W267 HydrophobicContact CB-CZ3 4.12Å; A226-K328 PolarHBondContact O-N 2.92Å
227	D	97.8	Very high	95.7	Very high	103 Å²	103	20.1 Å²	20.1	55%	0.551	10%	0.096	S	C	*	.	S	Bend	trans	-79.6	120	163	-66	-28.3	0	0	0	108.8	L326 R327 K328	D227-L326 WeakPolarHBondContact CA-O 3.3Å; D227-R327 WeakPolarHBondContact OD1-CA 3.32Å; D227-K328 PolarHBondContact OD1-N 2.87Å
228	W	97.3	Very high	95.8	Very high	12 Å²	12	20.1 Å²	20.1	5%	0.045	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	174.3	-177.9	73.9	-61	0	0	0	111.8	S224 V230 L263 Q266 W267 F272 L274 L326	S224-W228 PolarHBondContact OG-NE1 3.41Å; W228-V230 HydrophobicContact CD2-CG2 4.38Å; W228-V230 HydrophobicContact CE3-CG2 4.24Å; W228-V230 HydrophobicContact CH2-CG2 3.72Å; W228-V230 HydrophobicContact CZ2-CG2 3.8Å; W228-V230 HydrophobicContact CZ3-CG2 3.93Å; W228-L263 HydrophobicContact CH2-CB 3.83Å; W228-Q266 CarbonylContact C-O 3.49Å; W228-Q266 WeakPolarHBondContact CA-O 3.45Å; W228-Q266 WeakPolarHBondContact CB-O 2.96Å; W228-W267 HydrophobicContact CB-CB 3.64Å; W228-F272 HydrophobicContact CD2-CB 4.49Å; W228-F272 AromaticContact CD2-CD1 3.59Å; W228-F272 HydrophobicContact CD2-CD1 3.59Å; W228-F272 HydrophobicContact CD2-CE1 4.25Å; W228-F272 HydrophobicContact CD2-CG 4.29Å; W228-F272 AromaticContact CE2-CD1 3.94Å; W228-F272 HydrophobicContact CE3-CB 3.9Å; W228-F272 AromaticContact CE3-CD1 3.54Å; W228-F272 HydrophobicContact CE3-CD1 3.54Å; W228-F272 HydrophobicContact CE3-CG 4.09Å; W228-F272 HydrophobicContact CG-CD1 4.1Å; W228-F272 HydrophobicContact CH2-CD1 4.11Å; W228-F272 HydrophobicContact CZ2-CD1 4.2Å; W228-F272 HydrophobicContact CZ2-CE1 4.43Å; W228-F272 HydrophobicContact CZ3-CB 4.41Å; W228-F272 AromaticContact CZ3-CD1 3.81Å; W228-F272 HydrophobicContact CZ3-CD1 3.81Å; W228-L274 HydrophobicContact CH2-CB 3.96Å; W228-L274 HydrophobicContact CZ2-CB 3.86Å; W228-L326 HydrophobicContact CZ2-CD1 3.97Å; W228-L326 PolarHBondContact N-O 3Å; W228-L326 VanDerWaalsContact N-O 3.08Å; W228-L326 PolarHBondContact O-N 3.25Å
229	R	96.6	Very high	95.6	Very high	87 Å²	87	20.1 Å²	20.1	33%	0.328	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	122.3	-177.6	-175	170.4	-72.7	-138.3	17.7	110	G265 Q266 G320 G322 V324	R229-G265 CarbonylContact O-C 3.6Å; R229-G265 VanDerWaalsContact O-CA 3.3Å; R229-G265 WeakPolarHBondContact O-CA 3.3Å; R229-Q266 PolarHBondContact N-O 3.06Å; R229-Q266 PolarHBondContact O-N 2.93Å; R229-G320 PolarHBondContact NH1-O 3.36Å; R229-G320 PolarHBondContact NH2-O 3.19Å; R229-G322 VanDerWaalsContact CD-O 3.26Å; R229-G322 WeakPolarHBondContact CD-O 3.36Å; R229-G322 PolarHBondContact NH1-O 2.82Å; R229-V324 CarbonylContact C-O 3.58Å; R229-V324 WeakPolarHBondContact CA-O 3.23Å
230	V	97.2	Very high	95.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	120.6	175.6	-165.3	0	0	0	0	109.3	W228 L263 F289 Y310 G323 V324 L326	W228-V230 HydrophobicContact CD2-CG2 4.38Å; W228-V230 HydrophobicContact CE3-CG2 4.24Å; W228-V230 HydrophobicContact CH2-CG2 3.72Å; W228-V230 HydrophobicContact CZ2-CG2 3.8Å; W228-V230 HydrophobicContact CZ3-CG2 3.93Å; V230-L263 HydrophobicContact CG1-CB 3.91Å; V230-L263 HydrophobicContact CG1-CD2 4.22Å; V230-F289 HydrophobicContact CB-CZ 4.39Å; V230-F289 HydrophobicContact CG1-CZ 4.38Å; V230-F289 HydrophobicContact CG2-CZ 4.06Å; V230-Y310 HydrophobicContact CB-CD2 4.39Å; V230-Y310 HydrophobicContact CG1-CD2 3.94Å; V230-Y310 HydrophobicContact CG1-CE2 3.86Å; V230-G323 CarbonylContact O-C 3.42Å; V230-G323 WeakPolarHBondContact O-CA 3.23Å; V230-V324 HydrophobicContact CB-CB 4.28Å; V230-V324 PolarHBondContact N-O 2.66Å; V230-V324 PolarHBondContact O-N 3.01Å; V230-L326 HydrophobicContact CG2-CD1 3.45Å; V230-L326 VanDerWaalsContact CG2-CD1 3.45Å; V230-L326 HydrophobicContact CG2-CG 4.19Å
231	E	95.1	Very high	95.2	Very high	66 Å²	66	19.6 Å²	19.6	31%	0.308	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-36.1	-177.4	-62.8	176.4	154.9	0	0	111.3	S264 G265 Q266 Y310 V311	E231-S264 PolarHBondContact N-O 2.86Å; E231-G265 WeakPolarHBondContact OE2-CA 3.24Å; E231-Q266 WeakPolarHBondContact OE1-CG 3.42Å; E231-Y310 PolarHBondContact O-N 3.44Å; E231-V311 HydrophobicContact CB-CG2 3.75Å; E231-V311 HydrophobicContact CG-CG2 3.89Å
232	L	95.5	Very high	94.8	Very high	37 Å²	37	21.2 Å²	21.2	19%	0.194	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133	-176.3	179.5	66.9	0	0	0	110.4	S264 D307	L232-S264 PolarHBondContact N-O 3.12Å; L232-S264 PolarHBondContact O-N 3.26Å; L232-D307 HydrophobicContact CD1-CB 4.01Å
233	R	96.9	Very high	94.3	Very high	13 Å²	13	21.3 Å²	21.3	5%	0.049	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.2	155.8	175.8	-91.2	-74.9	173.9	-5.4	109.2	V261 V262 L263 D290 Q306 D307 R308 Y310	R233-V261 HydrophobicContact CG-CG1 3.73Å; R233-V262 CarbonylContact C-O 3.58Å; R233-V262 WeakPolarHBondContact CA-O 3.07Å; R233-L263 HydrophobicContact CB-CD2 3.76Å; R233-L263 HydrophobicContact CG-CD2 3.79Å; R233-D290 IonicContact CZ-OD2 2.81Å; R233-D290 IonicContact NE-OD2 3.42Å; R233-D290 PolarHBondContact NE-OD2 3.36Å; R233-D290 IonicContact NH2-OD1 2.72Å; R233-D290 PolarHBondContact NH2-OD1 3.18Å; R233-D290 IonicContact NH2-OD2 3.71Å; R233-D290 PolarHBondContact NH2-OD2 3.37Å; R233-Q306 PolarHBondContact NH1-O 3.2Å; R233-D307 CarbonylContact O-C 3.33Å; R233-D307 WeakPolarHBondContact O-CA 3.29Å; R233-R308 HydrophobicContact CB-CB 4.45Å; R233-R308 PolarHBondContact N-O 2.81Å; R233-R308 PolarHBondContact O-N 3.47Å; R233-Y310 HydrophobicContact CB-CE2 3.67Å; R233-Y310 WeakPolarHBondContact CB-OH 3.22Å
234	R	97.3	Very high	93.7	Very high	12 Å²	12	23.9 Å²	23.9	5%	0.045	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.6	166.8	180	170.5	-69.5	169.3	-11.9	110.1	L182 G183 P184 F236 V262 F305 D307	L182-R234 WeakPolarHBondContact O-CD 3.01Å; L182-R234 PolarHBondContact O-NH1 3.1Å; G183-R234 VanDerWaalsContact C-NH1 3.3Å; P184-R234 PolarHBondContact O-NH1 3.22Å; P184-R234 PolarHBondContact O-NH2 3.47Å; R234-F236 HydrophobicContact CB-CE2 4.26Å; R234-F236 VanDerWaalsContact CD-CE2 3.47Å; R234-F236 HydrophobicContact CG-CD2 4.03Å; R234-F236 HydrophobicContact CG-CE1 4.41Å; R234-F236 HydrophobicContact CG-CE2 3.46Å; R234-F236 VanDerWaalsContact CG-CE2 3.46Å; R234-F236 HydrophobicContact CG-CZ 3.69Å; R234-V262 HydrophobicContact CB-CB 4.37Å; R234-V262 PolarHBondContact N-O 3.48Å; R234-V262 PolarHBondContact O-N 2.86Å; R234-F305 HydrophobicContact CG-CB 3.94Å; R234-F305 HydrophobicContact CG-CD2 4.03Å; R234-F305 HydrophobicContact CG-CG 4.26Å; R234-D307 VanDerWaalsContact CB-OD1 3.31Å; R234-D307 WeakPolarHBondContact CB-OD1 3.5Å; R234-D307 WeakPolarHBondContact CD-OD1 3.1Å; R234-D307 WeakPolarHBondContact CG-OD1 3.43Å; R234-D307 IonicContact CZ-OD1 3.97Å; R234-D307 IonicContact CZ-OD2 3.71Å; R234-D307 IonicContact NE-OD1 3.72Å; R234-D307 PolarHBondContact NE-OD1 2.87Å; R234-D307 IonicContact NE-OD2 3.8Å; R234-D307 PolarHBondContact NE-OD2 3.02Å; R234-D307 IonicContact NH2-OD1 3.16Å; R234-D307 IonicContact NH2-OD2 3.67Å; R234-D307 PolarHBondContact NH2-OD2 3Å
235	H	96.8	Very high	93	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.019	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.5	175.2	168.3	-133.9	0	0	0	110.1	P237 E259 R260 L293 R294 F305 Q306	H235-P237 WeakPolarHBondContact O-CD 3.27Å; H235-E259 IonicContact CD2-OE1 2.68Å; H235-E259 IonicContact CE1-OE1 3.5Å; H235-E259 IonicContact NE2-OE1 3.68Å; H235-E259 PolarHBondContact NE2-OE1 2.91Å; H235-R260 PolarHBondContact CD2-O 2.77Å; H235-L293 HydrophobicContact CB-CD1 4.13Å; H235-R294 PolarHBondContact CE1-O 3.44Å; H235-F305 CarbonylContact O-C 3.53Å; H235-F305 VanDerWaalsContact O-CA 3.22Å; H235-F305 WeakPolarHBondContact O-CA 3.01Å; H235-Q306 HydrophobicContact CB-CB 4.46Å; H235-Q306 PolarHBondContact N-O 2.83Å; H235-Q306 PolarHBondContact O-N 2.93Å
236	F	95.5	Very high	92.2	Very high	18 Å²	18	26.5 Å²	26.5	8%	0.079	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	106	171.7	-63.3	-93.1	0	0	0	108.7	F181 R234 E259 R260 V262 F305	F181-F236 WeakPolarHBondContact O-CE2 3.24Å; R234-F236 HydrophobicContact CB-CE2 4.26Å; R234-F236 VanDerWaalsContact CD-CE2 3.47Å; R234-F236 HydrophobicContact CG-CD2 4.03Å; R234-F236 HydrophobicContact CG-CE1 4.41Å; R234-F236 HydrophobicContact CG-CE2 3.46Å; R234-F236 VanDerWaalsContact CG-CE2 3.46Å; R234-F236 HydrophobicContact CG-CZ 3.69Å; F236-E259 CarbonylContact O-C 3.5Å; F236-E259 VanDerWaalsContact O-CA 3.23Å; F236-E259 WeakPolarHBondContact O-CA 3.43Å; F236-R260 HydrophobicContact CB-CG 3.92Å; F236-R260 HydrophobicContact CD2-CG 3.86Å; F236-R260 HydrophobicContact CG-CG 4.27Å; F236-R260 VanDerWaalsContact CG-CZ 3.48Å; F236-R260 PolarHBondContact N-O 2.88Å; F236-R260 PolarHBondContact O-N 3.41Å; F236-V262 HydrophobicContact CD2-CG2 4.04Å; F236-V262 HydrophobicContact CE2-CB 4.49Å; F236-V262 HydrophobicContact CE2-CG2 3.69Å; F236-F305 HydrophobicContact CD1-CB 3.71Å; F236-F305 HydrophobicContact CE1-CB 3.76Å; F236-F305 HydrophobicContact CE1-CD1 4.35Å; F236-F305 HydrophobicContact CE1-CG 4.28Å; F236-F305 HydrophobicContact CG-CB 4.31Å; F236-F305 HydrophobicContact CZ-CB 4.4Å
237	P	93.8	Very high	91.4	Very high	8 Å²	8	27 Å²	27	5%	0.052	15%	0.147	C	C	.	.			trans	-70.2	135.3	167.6	31.7	-38	0	0	0	110.6	H235 Y300 S304	H235-P237 WeakPolarHBondContact O-CD 3.27Å; P237-Y300 HydrophobicContact CB-CD2 3.55Å; P237-Y300 HydrophobicContact CB-CE2 4.43Å; P237-Y300 HydrophobicContact CB-CG 3.84Å; P237-Y300 HydrophobicContact CG-CD2 3.92Å; P237-Y300 HydrophobicContact CG-CG 4.41Å; P237-S304 WeakPolarHBondContact CD-O 3.18Å
238	G	91.3	Very high	90.6	Very high	8 Å²	8	22.1 Å²	22.1	8%	0.082	12%	0.121	C	C	.	.			trans	-159.3	-162.5	-172.5	0	0	0	0	0	113.4	R80	R80-G238 WeakPolarHBondContact CD-O 3.4Å; R80-G238 PolarHBondContact NH1-O 3.36Å
239	S	88.9	Confident	90	Very high	25 Å²	25	29.5 Å²	29.5	18%	0.175	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-68.1	170.6	173.9	-69.2	0	0	0	0	112.1	L257 N258 E259	S239-L257 PolarHBondContact N-O 3Å; S239-N258 CarbonylContact O-C 3.54Å; S239-N258 VanDerWaalsContact O-CA 3.23Å; S239-N258 WeakPolarHBondContact O-CA 3.44Å; S239-N258 PolarHBondContact O-OD1 3.21Å; S239-E259 PolarHBondContact O-N 3.26Å
240	L	88.1	Confident	89.1	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.016	14%	0.142	C	C	.	.			trans	-127	59.8	170.5	-73.1	177.8	0	0	0	108.9	T79 R80 E259 A279 T280	T79-L240 WeakPolarHBondContact CB-O 3.46Å; T79-L240 WeakPolarHBondContact CG2-O 3.44Å; T79-L240 PolarHBondContact OG1-N 2.96Å; R80-L240 HydrophobicContact CG-CD1 4.2Å; R80-L240 HydrophobicContact CG-CG 4.22Å; L240-E259 HydrophobicContact CD2-CB 4.02Å; L240-A279 WeakPolarHBondContact CB-O 3.33Å; L240-A279 CarbonylContact O-C 3.57Å; L240-T280 WeakPolarHBondContact O-CA 3.34Å; L240-T280 WeakPolarHBondContact O-CB 3.17Å; L240-T280 PolarHBondContact O-N 3.11Å; L240-T280 PolarHBondContact O-OG1 2.83Å
241	M	87.8	Confident	88.3	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.142	C	C	.	.			trans	-75.9	156.1	175.8	-71	178.7	-72.5	0	0	111	Y74 R75 T79 V243 V251 L254 L257 N258 A279 T280	Y74-M241 HydrophobicContact CD1-CG 4.17Å; Y74-M241 HydrophobicContact CD1-SD 4.01Å; Y74-M241 HydrophobicContact CE1-CB 3.75Å; Y74-M241 HydrophobicContact CE1-CG 3.64Å; Y74-M241 HydrophobicContact CE1-SD 3.99Å; R75-M241 HydrophobicContact CG-SD 4.11Å; T79-M241 HydrophobicContact CG2-CG 4.44Å; M241-V243 PolarHBondContact O-N 2.9Å; M241-V251 HydrophobicContact CE-CG1 4.25Å; M241-V251 HydrophobicContact SD-CG1 4.23Å; M241-L254 HydrophobicContact CB-CD1 3.53Å; M241-L254 HydrophobicContact CE-CD1 3.88Å; M241-L254 HydrophobicContact CG-CD1 4.47Å; M241-L254 HydrophobicContact SD-CD1 4.26Å; M241-L257 HydrophobicContact CE-CB 3.52Å; M241-L257 HydrophobicContact CE-CD1 3.91Å; M241-L257 HydrophobicContact CE-CG 4.35Å; M241-N258 WeakPolarHBondContact CB-OD1 3.32Å; M241-N258 PolarHBondContact N-OD1 2.94Å; M241-N258 PolarHBondContact O-ND2 2.88Å; M241-A279 WeakPolarHBondContact O-CA 3.4Å; M241-A279 WeakPolarHBondContact O-CB 3.49Å; M241-T280 PolarHBondContact O-N 2.8Å
242	S	87	Confident	87.8	Confident	33 Å²	33	32 Å²	32	23%	0.231	16%	0.16	C	C	.	.			trans	-69.9	129.9	-177.9	179.5	0	0	0	0	110.8	Y74 N244 V247 L254 T280	Y74-S242 PolarHBondContact OH-N 3.49Å; S242-N244 PolarHBondContact OG-N 2.99Å; S242-V247 VanDerWaalsContact O-CB 3.28Å; S242-V247 WeakPolarHBondContact O-CB 3.41Å; S242-V247 WeakPolarHBondContact O-CG1 3.28Å; S242-L254 WeakPolarHBondContact O-CD2 3.09Å; S242-T280 PolarHBondContact N-OG1 3.38Å
243	V	85.3	Confident	87.3	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.012	17%	0.165	C	C	.	.			trans	-93.8	7.9	178.1	-60	0	0	0	0	113.4	Y213 M241 L254 F255 A279 T340	Y213-V243 HydrophobicContact CD2-CG2 3.89Å; Y213-V243 HydrophobicContact CE2-CG2 3.86Å; M241-V243 PolarHBondContact O-N 2.9Å; V243-L254 HydrophobicContact CG1-CD2 4.38Å; V243-F255 HydrophobicContact CB-CE1 4.39Å; V243-F255 HydrophobicContact CG1-CD1 4.44Å; V243-F255 HydrophobicContact CG1-CE1 4.29Å; V243-A279 HydrophobicContact CB-CB 4.24Å; V243-A279 HydrophobicContact CG1-CB 3.82Å; V243-A279 HydrophobicContact CG2-CB 3.64Å; V243-T340 WeakPolarHBondContact CB-OG1 3.45Å; V243-T340 VanDerWaalsContact CG2-OG1 3.27Å; V243-T340 WeakPolarHBondContact CG2-OG1 3.13Å
244	N	85.9	Confident	86.9	Confident	67 Å²	67	32.8 Å²	32.8	36%	0.358	16%	0.163	S	C	.	.	S	Bend	trans	-52.1	138.2	172.5	177.7	-49.7	0	0	0	110.2	S242 G246 V247 A248	S242-N244 PolarHBondContact OG-N 2.99Å; N244-G246 PolarHBondContact O-N 3.48Å; N244-G246 PolarHBondContact OD1-N 2.8Å; N244-V247 CarbonylContact O-C 3.58Å; N244-V247 WeakPolarHBondContact O-CA 3.36Å; N244-V247 PolarHBondContact O-N 3.35Å; N244-A248 PolarHBondContact O-N 2.96Å
245	P	82.9	Confident	86.6	Confident	32 Å²	32	32.2 Å²	32.2	21%	0.208	16%	0.16	C	C	.	.	H	α-helix	trans	-51.8	-27.8	-179.9	-8.4	1	0	0	0	115.5	L158 Y213 R249	L158-P245 HydrophobicContact CD2-CB 4.15Å; L158-P245 HydrophobicContact CD2-CG 3.79Å; Y213-P245 HydrophobicContact CD1-CG 4.33Å; P245-R249 WeakPolarHBondContact O-CG 3.21Å; P245-R249 PolarHBondContact O-NE 2.97Å
246	G	82	Confident	86.4	Confident	25 Å²	25	33.1 Å²	33.1	26%	0.258	17%	0.167	S	C	.	.	H	α-helix	trans	-60.8	-43.5	169.4	0	0	0	0	0	112.6	N244	N244-G246 PolarHBondContact O-N 3.48Å; N244-G246 PolarHBondContact OD1-N 2.8Å
247	V	80.3	Confident	86.1	Confident	12 Å²	12	34.4 Å²	34.4	7%	0.073	17%	0.174	C	C	.	.	H	α-helix	trans	-86	-23.4	-177.5	-174.7	0	0	0	0	113	Y74 S242 N244 R249 W250 V251	Y74-V247 HydrophobicContact CE1-CG1 3.86Å; S242-V247 VanDerWaalsContact O-CB 3.28Å; S242-V247 WeakPolarHBondContact O-CB 3.41Å; S242-V247 WeakPolarHBondContact O-CG1 3.28Å; N244-V247 CarbonylContact O-C 3.58Å; N244-V247 WeakPolarHBondContact O-CA 3.36Å; N244-V247 PolarHBondContact O-N 3.35Å; V247-R249 VanDerWaalsContact C-N 3.31Å; V247-R249 PolarHBondContact O-N 2.99Å; V247-W250 VanDerWaalsContact CA-CD1 3.49Å; V247-W250 PolarHBondContact O-NE1 3.21Å; V247-V251 HydrophobicContact CG1-CG2 4.36Å
248	A	81.3	Confident	86.1	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70.5	-21.7	171.6	0	0	0	0	0	113.8	Q170 V171 N244 L254	Q170-A248 HydrophobicContact CG-CB 4.44Å; Q170-A248 PolarHBondContact NE2-O 2.92Å; V171-A248 HydrophobicContact CG1-CB 3.74Å; V171-A248 HydrophobicContact CG2-CB 4.35Å; V171-A248 VanDerWaalsContact CG2-O 3.29Å; V171-A248 WeakPolarHBondContact CG2-O 3.22Å; N244-A248 PolarHBondContact O-N 2.96Å; A248-L254 HydrophobicContact CB-CD2 4.09Å
249	R	83.7	Confident	86.2	Confident	166 Å²	166	33.8 Å²	33.8	63%	0.626	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.5	-176.2	-76.1	179.6	-63.9	-173.7	5.5	116.4	V171 P245 V247	V171-R249 HydrophobicContact CB-CG 4.23Å; V171-R249 HydrophobicContact CG2-CB 4.39Å; V171-R249 HydrophobicContact CG2-CG 3.71Å; P245-R249 WeakPolarHBondContact O-CG 3.21Å; P245-R249 PolarHBondContact O-NE 2.97Å; V247-R249 VanDerWaalsContact C-N 3.31Å; V247-R249 PolarHBondContact O-N 2.99Å
250	W	78.4	Confident	86.5	Confident	53 Å²	53	32.8 Å²	32.8	20%	0.201	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.1	-23.5	-175.9	70.3	-38.5	0	0	0	113.2	R67 Q70 V71 V247	R67-W250 HydrophobicContact CB-CE3 4.33Å; R67-W250 HydrophobicContact CG-CE3 4.34Å; Q70-W250 HydrophobicContact CB-CZ3 3.8Å; V71-W250 HydrophobicContact CG2-CD2 4.24Å; V71-W250 HydrophobicContact CG2-CE3 4.07Å; V247-W250 VanDerWaalsContact CA-CD1 3.49Å; V247-W250 PolarHBondContact O-NE1 3.21Å
251	V	81.2	Confident	87	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	-91.4	102.3	170.5	-175.3	0	0	0	0	108.9	V71 Y74 Q170 M241 V247 L254 L257	V71-V251 HydrophobicContact CG1-CG2 4.37Å; V71-V251 HydrophobicContact CG2-CG2 4.46Å; Y74-V251 HydrophobicContact CD1-CG2 4.32Å; Q170-V251 PolarHBondContact NE2-O 2.87Å; M241-V251 HydrophobicContact CE-CG1 4.25Å; M241-V251 HydrophobicContact SD-CG1 4.23Å; V247-V251 HydrophobicContact CG1-CG2 4.36Å; V251-L254 HydrophobicContact CB-CB 4.14Å; V251-L254 HydrophobicContact CB-CD1 4.17Å; V251-L254 HydrophobicContact CG1-CB 4.02Å; V251-L254 HydrophobicContact CG1-CD1 3.94Å; V251-L257 HydrophobicContact CG1-CD1 4.02Å
252	K	83.3	Confident	87.5	Confident	154 Å²	154	32.7 Å²	32.7	67%	0.67	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	141.7	168.9	-65.3	-174.8	178.6	-177.5	0	110.2	V174 L254 L257	V174-K252 HydrophobicContact CG1-CG 4.43Å; K252-L254 PolarHBondContact O-N 2.85Å; K252-L257 WeakPolarHBondContact O-CD1 3.01Å
253	E	85.5	Confident	88	Confident	65 Å²	65	31.2 Å²	31.2	30%	0.304	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	31.6	-179.3	-53.2	-170.1	110.7	0	0	114.7	N180 F255 C256 L257	N180-E253 PolarHBondContact ND2-OE1 3.42Å; E253-F255 PolarHBondContact O-N 3.2Å; E253-F255 VanDerWaalsContact O-N 3.16Å; E253-C256 HydrophobicContact CB-CB 4.14Å; E253-C256 PolarHBondContact O-N 3.31Å; E253-L257 VanDerWaalsContact O-CG 3.3Å; E253-L257 WeakPolarHBondContact O-CG 3.47Å; E253-L257 PolarHBondContact O-N 2.75Å
254	L	88.7	Confident	88.6	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-50.8	-42.2	-178.9	176.4	62.4	0	0	0	112.3	M241 S242 V243 A248 V251 K252 L257 N258	M241-L254 HydrophobicContact CB-CD1 3.53Å; M241-L254 HydrophobicContact CE-CD1 3.88Å; M241-L254 HydrophobicContact CG-CD1 4.47Å; M241-L254 HydrophobicContact SD-CD1 4.26Å; S242-L254 WeakPolarHBondContact O-CD2 3.09Å; V243-L254 HydrophobicContact CG1-CD2 4.38Å; A248-L254 HydrophobicContact CB-CD2 4.09Å; V251-L254 HydrophobicContact CB-CB 4.14Å; V251-L254 HydrophobicContact CB-CD1 4.17Å; V251-L254 HydrophobicContact CG1-CB 4.02Å; V251-L254 HydrophobicContact CG1-CD1 3.94Å; K252-L254 PolarHBondContact O-N 2.85Å; L254-L257 PolarHBondContact O-N 3.04Å; L254-N258 WeakPolarHBondContact O-CB 2.92Å; L254-N258 PolarHBondContact O-N 2.75Å
255	F	91.6	Very high	89.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-71.5	-29.4	-179.8	-56.1	-21.8	0	0	0	113.1	L158 Q170 Y176 F181 V211 V243 E253 V277 T340 V342	L158-F255 HydrophobicContact CD1-CZ 4.35Å; Q170-F255 HydrophobicContact CB-CD2 4.49Å; Q170-F255 HydrophobicContact CB-CE2 4.21Å; Q170-F255 HydrophobicContact CG-CD1 4.5Å; Q170-F255 HydrophobicContact CG-CD2 3.99Å; Q170-F255 HydrophobicContact CG-CE1 4.16Å; Q170-F255 HydrophobicContact CG-CE2 3.63Å; Q170-F255 HydrophobicContact CG-CG 4.41Å; Q170-F255 HydrophobicContact CG-CZ 3.71Å; Y176-F255 AromaticContact CE1-CD2 3.69Å; Y176-F255 HydrophobicContact CE1-CD2 3.69Å; Y176-F255 HydrophobicContact CE1-CE2 4.35Å; Y176-F255 AromaticContact CZ-CD2 3.97Å; F181-F255 HydrophobicContact CD2-CB 4.28Å; F181-F255 HydrophobicContact CE2-CB 3.85Å; V211-F255 HydrophobicContact CG1-CE2 3.57Å; V211-F255 HydrophobicContact CG1-CZ 3.72Å; V211-F255 HydrophobicContact CG2-CE2 4.3Å; V243-F255 HydrophobicContact CB-CE1 4.39Å; V243-F255 HydrophobicContact CG1-CD1 4.44Å; V243-F255 HydrophobicContact CG1-CE1 4.29Å; E253-F255 PolarHBondContact O-N 3.2Å; E253-F255 VanDerWaalsContact O-N 3.16Å; F255-V277 HydrophobicContact CB-CG1 4.38Å; F255-V277 HydrophobicContact CB-CG2 4.47Å; F255-V277 HydrophobicContact CD1-CG1 4.25Å; F255-T340 HydrophobicContact CE1-CG2 4.23Å; F255-T340 HydrophobicContact CE2-CG2 4.4Å; F255-T340 HydrophobicContact CZ-CG2 3.97Å; F255-V342 HydrophobicContact CD2-CG2 4.07Å; F255-V342 HydrophobicContact CE2-CG2 4.3Å
256	C	91.6	Very high	89.7	Confident	23 Å²	23	31.1 Å²	31.1	16%	0.155	15%	0.147	C	C	.	.	H	α-helix	trans	-77.6	-28.9	174	-55.7	0	0	0	0	112.3	Y176 E253 R260	Y176-C256 VanDerWaalsContact CD2-SG 3.57Å; E253-C256 HydrophobicContact CB-CB 4.14Å; E253-C256 PolarHBondContact O-N 3.31Å; C256-R260 PolarHBondContact O-NH1 2.77Å
257	L	90.4	Very high	90.3	Very high	45 Å²	45	30.8 Å²	30.8	24%	0.236	14%	0.138	C	C	.	.	H	α-helix	trans	-80	-28.9	178.2	-66.4	167.6	0	0	0	113.2	R75 S239 M241 V251 K252 E253 L254	R75-L257 VanDerWaalsContact NH2-CD1 3.29Å; S239-L257 PolarHBondContact N-O 3Å; M241-L257 HydrophobicContact CE-CB 3.52Å; M241-L257 HydrophobicContact CE-CD1 3.91Å; M241-L257 HydrophobicContact CE-CG 4.35Å; V251-L257 HydrophobicContact CG1-CD1 4.02Å; K252-L257 WeakPolarHBondContact O-CD1 3.01Å; E253-L257 VanDerWaalsContact O-CG 3.3Å; E253-L257 WeakPolarHBondContact O-CG 3.47Å; E253-L257 PolarHBondContact O-N 2.75Å; L254-L257 PolarHBondContact O-N 3.04Å
258	N	92.5	Very high	91	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-78.9	153.8	178.9	-86.5	5	0	0	0	112.6	S239 M241 L254 R260 V277 G278	S239-N258 CarbonylContact O-C 3.54Å; S239-N258 VanDerWaalsContact O-CA 3.23Å; S239-N258 WeakPolarHBondContact O-CA 3.44Å; S239-N258 PolarHBondContact O-OD1 3.21Å; M241-N258 WeakPolarHBondContact CB-OD1 3.32Å; M241-N258 PolarHBondContact N-OD1 2.94Å; M241-N258 PolarHBondContact O-ND2 2.88Å; L254-N258 WeakPolarHBondContact O-CB 2.92Å; L254-N258 PolarHBondContact O-N 2.75Å; N258-R260 PolarHBondContact O-N 2.67Å; N258-V277 HydrophobicContact CB-CG1 3.98Å; N258-G278 PolarHBondContact ND2-O 2.88Å
259	E	94.3	Very high	91.7	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.014	17%	0.167	C	C	.	.			trans	-60.3	128	168.4	176.5	164	-149.9	0	0	110.2	R80 H235 F236 S239 L240 G278 T295 N296	R80-E259 IonicContact CZ-OE2 3.42Å; R80-E259 IonicContact NH1-OE2 2.68Å; R80-E259 PolarHBondContact NH1-OE2 3.41Å; R80-E259 IonicContact NH2-OE1 3.93Å; R80-E259 IonicContact NH2-OE2 3.28Å; R80-E259 PolarHBondContact NH2-OE2 2.55Å; H235-E259 IonicContact CD2-OE1 2.68Å; H235-E259 IonicContact CE1-OE1 3.5Å; H235-E259 IonicContact NE2-OE1 3.68Å; H235-E259 PolarHBondContact NE2-OE1 2.91Å; F236-E259 CarbonylContact O-C 3.5Å; F236-E259 VanDerWaalsContact O-CA 3.23Å; F236-E259 WeakPolarHBondContact O-CA 3.43Å; S239-E259 PolarHBondContact O-N 3.26Å; L240-E259 HydrophobicContact CD2-CB 4.02Å; E259-G278 WeakPolarHBondContact O-CA 3.38Å; E259-G278 PolarHBondContact O-N 2.89Å; E259-T295 VanDerWaalsContact OE1-CA 3.24Å; E259-T295 WeakPolarHBondContact OE1-CA 3.28Å; E259-T295 WeakPolarHBondContact OE1-CB 3.36Å; E259-N296 VanDerWaalsContact CD-N 3.27Å; E259-N296 PolarHBondContact OE1-N 3.01Å; E259-N296 VanDerWaalsContact OE2-CA 3.28Å; E259-N296 WeakPolarHBondContact OE2-CA 3.23Å; E259-N296 PolarHBondContact OE2-N 3.46Å
260	R	95.7	Very high	92.2	Very high	5 Å²	5	29.7 Å²	29.7	2%	0.019	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.4	-177.7	64.9	179.3	-178.2	-73.5	1.1	112.1	N180 F181 H235 F236 C256 N258 T275 A276 V277	N180-R260 PolarHBondContact O-NH2 2.6Å; F181-R260 VanDerWaalsContact O-CZ 3.27Å; F181-R260 PolarHBondContact O-NE 2.92Å; F181-R260 PolarHBondContact O-NH2 2.87Å; H235-R260 PolarHBondContact CD2-O 2.77Å; F236-R260 HydrophobicContact CB-CG 3.92Å; F236-R260 HydrophobicContact CD2-CG 3.86Å; F236-R260 HydrophobicContact CG-CG 4.27Å; F236-R260 VanDerWaalsContact CG-CZ 3.48Å; F236-R260 PolarHBondContact N-O 2.88Å; F236-R260 PolarHBondContact O-N 3.41Å; C256-R260 PolarHBondContact O-NH1 2.77Å; N258-R260 PolarHBondContact O-N 2.67Å; R260-T275 HydrophobicContact CB-CG2 4.07Å; R260-T275 HydrophobicContact CG-CG2 4.39Å; R260-A276 CarbonylContact C-O 3.53Å; R260-A276 WeakPolarHBondContact CA-O 3.23Å; R260-A276 WeakPolarHBondContact CB-O 3.22Å; R260-V277 HydrophobicContact CB-CB 4.44Å; R260-V277 HydrophobicContact CB-CG2 4.12Å
261	V	97.2	Very high	93.1	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	108.5	175.3	-179	0	0	0	0	107.2	R233 L263 T275 A276 I285 V287 L293 T295	R233-V261 HydrophobicContact CG-CG1 3.73Å; V261-L263 HydrophobicContact CG1-CD2 4.32Å; V261-T275 WeakPolarHBondContact O-CA 3.24Å; V261-A276 PolarHBondContact N-O 3.32Å; V261-A276 PolarHBondContact O-N 3.08Å; V261-I285 HydrophobicContact CG2-CB 4.42Å; V261-I285 HydrophobicContact CG2-CD1 4.09Å; V261-I285 HydrophobicContact CG2-CG2 4.33Å; V261-V287 HydrophobicContact CG1-CG2 4.22Å; V261-L293 HydrophobicContact CG1-CD1 4.41Å; V261-L293 HydrophobicContact CG1-CD2 4.01Å; V261-L293 HydrophobicContact CG2-CD1 3.98Å; V261-L293 HydrophobicContact CG2-CD2 4.04Å; V261-T295 HydrophobicContact CG2-CG2 3.73Å
262	V	97.9	Very high	93.9	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	121.9	175.4	179.8	0	0	0	0	107.4	L182 R233 R234 F236 S264 T275	L182-V262 HydrophobicContact CD2-CG1 3.63Å; R233-V262 CarbonylContact C-O 3.58Å; R233-V262 WeakPolarHBondContact CA-O 3.07Å; R234-V262 HydrophobicContact CB-CB 4.37Å; R234-V262 PolarHBondContact N-O 3.48Å; R234-V262 PolarHBondContact O-N 2.86Å; F236-V262 HydrophobicContact CD2-CG2 4.04Å; F236-V262 HydrophobicContact CE2-CB 4.49Å; F236-V262 HydrophobicContact CE2-CG2 3.69Å; V262-S264 WeakPolarHBondContact CG1-OG 3.44Å; V262-T275 HydrophobicContact CB-CG2 4.48Å; V262-T275 HydrophobicContact CG2-CG2 3.73Å
263	L	98.3	Very high	94.6	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.8	164.5	-57.4	177.8	0	0	0	107.1	W228 V230 R233 V261 S273 L274 V287 F289 V332	W228-L263 HydrophobicContact CH2-CB 3.83Å; V230-L263 HydrophobicContact CG1-CB 3.91Å; V230-L263 HydrophobicContact CG1-CD2 4.22Å; R233-L263 HydrophobicContact CB-CD2 3.76Å; R233-L263 HydrophobicContact CG-CD2 3.79Å; V261-L263 HydrophobicContact CG1-CD2 4.32Å; L263-S273 CarbonylContact O-C 3.49Å; L263-S273 WeakPolarHBondContact O-CA 3.46Å; L263-S273 WeakPolarHBondContact O-CB 3.37Å; L263-S273 PolarHBondContact O-OG 3.37Å; L263-L274 WeakPolarHBondContact CB-O 3.41Å; L263-L274 PolarHBondContact N-O 2.76Å; L263-L274 PolarHBondContact O-N 3.19Å; L263-V287 HydrophobicContact CD1-CG1 4.28Å; L263-V287 HydrophobicContact CD1-CG2 4.36Å; L263-F289 HydrophobicContact CD1-CZ 4Å; L263-F289 HydrophobicContact CD2-CZ 4.31Å; L263-V332 HydrophobicContact CD1-CG1 3.8Å
264	S	97.4	Very high	95.2	Very high	17 Å²	17	17.5 Å²	17.5	12%	0.119	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	150.3	-178.4	-62.5	0	0	0	0	111.3	E231 L232 V262 F272 S273	E231-S264 PolarHBondContact N-O 2.86Å; L232-S264 PolarHBondContact N-O 3.12Å; L232-S264 PolarHBondContact O-N 3.26Å; V262-S264 WeakPolarHBondContact CG1-OG 3.44Å; S264-F272 WeakPolarHBondContact CA-O 3.38Å; S264-S273 PolarHBondContact OG-OG 3.16Å
265	G	96	Very high	95.7	Very high	2 Å²	2	17.5 Å²	17.5	2%	0.021	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-138.5	174.6	0	0	0	0	0	110.7	R229 E231 F272	R229-G265 CarbonylContact O-C 3.6Å; R229-G265 VanDerWaalsContact O-CA 3.3Å; R229-G265 WeakPolarHBondContact O-CA 3.3Å; E231-G265 WeakPolarHBondContact OE2-CA 3.24Å; G265-F272 PolarHBondContact N-O 3.02Å; G265-F272 PolarHBondContact O-N 3.49Å
266	Q	95.8	Very high	95.9	Very high	80 Å²	80	17.6 Å²	17.6	37%	0.374	9%	0.09	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.9	-169.5	-56.1	-62.8	-39.9	0	0	112.7	W228 R229 E231 G270	W228-Q266 CarbonylContact C-O 3.49Å; W228-Q266 WeakPolarHBondContact CA-O 3.45Å; W228-Q266 WeakPolarHBondContact CB-O 2.96Å; R229-Q266 PolarHBondContact N-O 3.06Å; R229-Q266 PolarHBondContact O-N 2.93Å; E231-Q266 WeakPolarHBondContact OE1-CG 3.42Å; Q266-G270 CarbonylContact C-O 3.59Å; Q266-G270 VanDerWaalsContact CA-O 3.31Å; Q266-G270 WeakPolarHBondContact CA-O 3.41Å; Q266-G270 PolarHBondContact OE1-O 3.29Å; Q266-G270 VanDerWaalsContact OE1-O 3.04Å
267	W	96	Very high	96.1	Very high	17 Å²	17	16.5 Å²	16.5	6%	0.064	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	-176	166.4	80.4	-49.9	0	0	0	110.3	L149 A226 W228 H269 G270 F272 F345 E346 A347	L149-W267 HydrophobicContact CB-CH2 4.48Å; L149-W267 HydrophobicContact CB-CZ3 4.37Å; L149-W267 HydrophobicContact CD1-CH2 4.39Å; L149-W267 HydrophobicContact CD1-CZ3 4.14Å; A226-W267 HydrophobicContact CB-CE3 3.75Å; A226-W267 HydrophobicContact CB-CZ3 4.12Å; W228-W267 HydrophobicContact CB-CB 3.64Å; W267-H269 HydrophobicContact CD2-CB 4.45Å; W267-H269 AromaticContact CH2-CD2 3.66Å; W267-H269 HydrophobicContact CZ2-CB 3.92Å; W267-H269 AromaticContact CZ2-CD2 3.58Å; W267-H269 PolarHBondContact O-N 3.12Å; W267-G270 VanDerWaalsContact CD1-O 3.28Å; W267-G270 PolarHBondContact N-O 3.47Å; W267-G270 PolarHBondContact O-N 3.18Å; W267-F272 HydrophobicContact CB-CB 3.97Å; W267-F272 HydrophobicContact CB-CD2 3.97Å; W267-F272 HydrophobicContact CB-CG 4.14Å; W267-F272 AromaticContact CD1-CD2 3.57Å; W267-F272 AromaticContact CD2-CD2 3.62Å; W267-F272 HydrophobicContact CD2-CD2 3.62Å; W267-F272 HydrophobicContact CD2-CE2 4.05Å; W267-F272 AromaticContact CE2-CD2 3.81Å; W267-F272 HydrophobicContact CE3-CD2 4.27Å; W267-F272 HydrophobicContact CE3-CE2 4.28Å; W267-F272 HydrophobicContact CG-CB 4Å; W267-F272 AromaticContact CG-CD2 3.48Å; W267-F272 HydrophobicContact CG-CD2 3.48Å; W267-F272 VanDerWaalsContact CG-CD2 3.48Å; W267-F272 HydrophobicContact CG-CE2 4.34Å; W267-F272 HydrophobicContact CG-CG 4.07Å; W267-F272 AromaticContact NE1-CD2 3.78Å; W267-F345 HydrophobicContact CH2-CD2 4.2Å; W267-F345 HydrophobicContact CZ2-CB 4.21Å; W267-F345 AromaticContact CZ2-CD2 3.69Å; W267-F345 HydrophobicContact CZ2-CD2 3.69Å; W267-F345 HydrophobicContact CZ2-CG 4.31Å; W267-E346 VanDerWaalsContact CE2-O 3.23Å; W267-E346 WeakPolarHBondContact CZ2-O 3.43Å; W267-E346 PolarHBondContact NE1-O 3.36Å; W267-A347 HydrophobicContact CZ2-CB 4.21Å
268	Q	94.3	Very high	96.2	Very high	123 Å²	123	14.4 Å²	14.4	58%	0.575	7%	0.072	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-9.6	-176.6	66.7	170.8	34.2	0	0	116
269	H	95.3	Very high	95.9	Very high	22 Å²	22	14.5 Å²	14.5	10%	0.102	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	12.6	-179.1	-62.7	-27.9	0	0	0	114.7	R205 W267 E346 L370	R205-H269 VanDerWaalsContact NH1-CB 3.28Å; R205-H269 PolarHBondContact NH1-O 2.98Å; W267-H269 HydrophobicContact CD2-CB 4.45Å; W267-H269 AromaticContact CH2-CD2 3.66Å; W267-H269 HydrophobicContact CZ2-CB 3.92Å; W267-H269 AromaticContact CZ2-CD2 3.58Å; W267-H269 PolarHBondContact O-N 3.12Å; H269-E346 WeakPolarHBondContact CB-O 3.21Å; H269-E346 VanDerWaalsContact O-CD 3.28Å; H269-E346 VanDerWaalsContact O-CG 3.28Å; H269-E346 WeakPolarHBondContact O-CG 3.39Å; H269-L370 WeakPolarHBondContact NE2-CD1 3.39Å
270	G	95.4	Very high	95.1	Very high	10 Å²	10	15.6 Å²	15.6	10%	0.103	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.6	-131	179.3	0	0	0	0	0	111.8	Q266 W267 F272 E346	Q266-G270 CarbonylContact C-O 3.59Å; Q266-G270 VanDerWaalsContact CA-O 3.31Å; Q266-G270 WeakPolarHBondContact CA-O 3.41Å; Q266-G270 PolarHBondContact OE1-O 3.29Å; Q266-G270 VanDerWaalsContact OE1-O 3.04Å; W267-G270 VanDerWaalsContact CD1-O 3.28Å; W267-G270 PolarHBondContact N-O 3.47Å; W267-G270 PolarHBondContact O-N 3.18Å; G270-F272 PolarHBondContact O-N 2.89Å; G270-E346 WeakPolarHBondContact CA-OE2 3.31Å
271	F	96.5	Very high	93.9	Very high	16 Å²	16	16.1 Å²	16.1	7%	0.07	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	134.7	-174	174.6	-99.2	0	0	0	113.3	L182 L199 L207 L344 F345 E346	L182-F271 HydrophobicContact CD1-CE1 4.24Å; L182-F271 HydrophobicContact CD1-CZ 3.8Å; L199-F271 HydrophobicContact CB-CD1 4.35Å; L199-F271 HydrophobicContact CB-CG 4.26Å; L199-F271 HydrophobicContact CD1-CE1 4.26Å; L199-F271 HydrophobicContact CD1-CZ 4.44Å; L199-F271 HydrophobicContact CD2-CD2 3.98Å; L199-F271 HydrophobicContact CD2-CE2 3.83Å; L199-F271 HydrophobicContact CD2-CG 4.39Å; L199-F271 HydrophobicContact CD2-CZ 4.12Å; L199-F271 WeakPolarHBondContact O-CB 3.18Å; L207-F271 HydrophobicContact CD1-CD1 3.8Å; L207-F271 HydrophobicContact CD1-CE1 4.24Å; F271-L344 HydrophobicContact CE1-CB 4.31Å; F271-F345 WeakPolarHBondContact O-CA 3.29Å; F271-E346 HydrophobicContact CB-CB 4.23Å; F271-E346 PolarHBondContact N-OE2 3.2Å; F271-E346 PolarHBondContact O-N 3.2Å
272	F	97.9	Very high	92.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.8	171.9	-156.4	-89.7	0	0	0	111.8	L149 P225 W228 S264 G265 W267 G270 L343 F345	L149-F272 HydrophobicContact CD1-CE2 3.76Å; L149-F272 HydrophobicContact CD1-CZ 3.9Å; P225-F272 HydrophobicContact CB-CZ 4.42Å; P225-F272 HydrophobicContact CG-CE1 3.62Å; P225-F272 HydrophobicContact CG-CZ 3.37Å; W228-F272 HydrophobicContact CD2-CB 4.49Å; W228-F272 AromaticContact CD2-CD1 3.59Å; W228-F272 HydrophobicContact CD2-CD1 3.59Å; W228-F272 HydrophobicContact CD2-CE1 4.25Å; W228-F272 HydrophobicContact CD2-CG 4.29Å; W228-F272 AromaticContact CE2-CD1 3.94Å; W228-F272 HydrophobicContact CE3-CB 3.9Å; W228-F272 AromaticContact CE3-CD1 3.54Å; W228-F272 HydrophobicContact CE3-CD1 3.54Å; W228-F272 HydrophobicContact CE3-CG 4.09Å; W228-F272 HydrophobicContact CG-CD1 4.1Å; W228-F272 HydrophobicContact CH2-CD1 4.11Å; W228-F272 HydrophobicContact CZ2-CD1 4.2Å; W228-F272 HydrophobicContact CZ2-CE1 4.43Å; W228-F272 HydrophobicContact CZ3-CB 4.41Å; W228-F272 AromaticContact CZ3-CD1 3.81Å; W228-F272 HydrophobicContact CZ3-CD1 3.81Å; S264-F272 WeakPolarHBondContact CA-O 3.38Å; G265-F272 PolarHBondContact N-O 3.02Å; G265-F272 PolarHBondContact O-N 3.49Å; W267-F272 HydrophobicContact CB-CB 3.97Å; W267-F272 HydrophobicContact CB-CD2 3.97Å; W267-F272 HydrophobicContact CB-CG 4.14Å; W267-F272 AromaticContact CD1-CD2 3.57Å; W267-F272 AromaticContact CD2-CD2 3.62Å; W267-F272 HydrophobicContact CD2-CD2 3.62Å; W267-F272 HydrophobicContact CD2-CE2 4.05Å; W267-F272 AromaticContact CE2-CD2 3.81Å; W267-F272 HydrophobicContact CE3-CD2 4.27Å; W267-F272 HydrophobicContact CE3-CE2 4.28Å; W267-F272 HydrophobicContact CG-CB 4Å; W267-F272 AromaticContact CG-CD2 3.48Å; W267-F272 HydrophobicContact CG-CD2 3.48Å; W267-F272 VanDerWaalsContact CG-CD2 3.48Å; W267-F272 HydrophobicContact CG-CE2 4.34Å; W267-F272 HydrophobicContact CG-CG 4.07Å; W267-F272 AromaticContact NE1-CD2 3.78Å; G270-F272 PolarHBondContact O-N 2.89Å; F272-L343 HydrophobicContact CE1-CD2 4.4Å; F272-L343 HydrophobicContact CZ-CD2 4.43Å; F272-F345 HydrophobicContact CD2-CB 3.43Å; F272-F345 VanDerWaalsContact CD2-CB 3.43Å; F272-F345 HydrophobicContact CE2-CB 3.43Å; F272-F345 VanDerWaalsContact CE2-CB 3.43Å; F272-F345 HydrophobicContact CE2-CG 4.13Å; F272-F345 HydrophobicContact CG-CB 4.42Å; F272-F345 HydrophobicContact CZ-CB 4.39Å
273	S	98.2	Very high	90.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.7	171.8	-177.9	0	0	0	0	112.9	L263 S264 L343 L344	L263-S273 CarbonylContact O-C 3.49Å; L263-S273 WeakPolarHBondContact O-CA 3.46Å; L263-S273 WeakPolarHBondContact O-CB 3.37Å; L263-S273 PolarHBondContact O-OG 3.37Å; S264-S273 PolarHBondContact OG-OG 3.16Å; S273-L343 WeakPolarHBondContact O-CA 3.4Å; S273-L344 PolarHBondContact N-O 3.11Å; S273-L344 PolarHBondContact O-N 2.67Å
274	L	98.5	Very high	89.9	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	114.4	170.1	-175.1	157.4	0	0	0	107.9	P152 F222 P225 W228 L263 I341 L343	P152-L274 HydrophobicContact CB-CD1 4.18Å; F222-L274 HydrophobicContact CD2-CD2 3.82Å; F222-L274 HydrophobicContact CE2-CD2 3.93Å; P225-L274 HydrophobicContact CG-CD1 4.48Å; W228-L274 HydrophobicContact CH2-CB 3.96Å; W228-L274 HydrophobicContact CZ2-CB 3.86Å; L263-L274 WeakPolarHBondContact CB-O 3.41Å; L263-L274 PolarHBondContact N-O 2.76Å; L263-L274 PolarHBondContact O-N 3.19Å; L274-I341 HydrophobicContact CD2-CD1 4.1Å; L274-I341 HydrophobicContact CG-CG2 4.32Å; L274-L343 HydrophobicContact CB-CD2 3.96Å; L274-L343 HydrophobicContact CD1-CD2 4.02Å; L274-L343 HydrophobicContact CG-CD2 3.79Å
275	T	98.1	Very high	89.7	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.6	-179.9	-59.8	0	0	0	0	111.5	F181 R260 V261 V262 V277 I341 V342	F181-T275 HydrophobicContact CE1-CG2 3.9Å; F181-T275 HydrophobicContact CE2-CG2 4.12Å; F181-T275 HydrophobicContact CZ-CG2 3.38Å; R260-T275 HydrophobicContact CB-CG2 4.07Å; R260-T275 HydrophobicContact CG-CG2 4.39Å; V261-T275 WeakPolarHBondContact O-CA 3.24Å; V262-T275 HydrophobicContact CB-CG2 4.48Å; V262-T275 HydrophobicContact CG2-CG2 3.73Å; T275-V277 HydrophobicContact CG2-CG2 3.99Å; T275-I341 WeakPolarHBondContact O-CA 3.28Å; T275-V342 PolarHBondContact N-O 2.99Å; T275-V342 PolarHBondContact O-N 2.92Å
276	A	97	Very high	89.6	Confident	2 Å²	2	24 Å²	24	2%	0.017	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.3	170.6	0	0	0	0	0	110.2	F222 R260 V261 I285 F335 I341	F222-A276 HydrophobicContact CE1-CB 4.3Å; F222-A276 HydrophobicContact CE2-CB 4.48Å; F222-A276 HydrophobicContact CZ-CB 3.97Å; R260-A276 CarbonylContact C-O 3.53Å; R260-A276 WeakPolarHBondContact CA-O 3.23Å; R260-A276 WeakPolarHBondContact CB-O 3.22Å; V261-A276 PolarHBondContact N-O 3.32Å; V261-A276 PolarHBondContact O-N 3.08Å; A276-I285 HydrophobicContact CB-CD1 4.32Å; A276-I285 HydrophobicContact CB-CG2 3.69Å; A276-I285 WeakPolarHBondContact O-CD1 3.28Å; A276-F335 HydrophobicContact CB-CE1 3.76Å; A276-F335 HydrophobicContact CB-CZ 3.59Å; A276-I341 HydrophobicContact CB-CD1 4.17Å
277	V	95.5	Very high	89.6	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120.2	179.8	-174.6	0	0	0	0	109.8	F181 F255 N258 R260 T275 S339 T340 V342	F181-V277 HydrophobicContact CE2-CG2 4.16Å; F181-V277 HydrophobicContact CZ-CG2 4.23Å; F255-V277 HydrophobicContact CB-CG1 4.38Å; F255-V277 HydrophobicContact CB-CG2 4.47Å; F255-V277 HydrophobicContact CD1-CG1 4.25Å; N258-V277 HydrophobicContact CB-CG1 3.98Å; R260-V277 HydrophobicContact CB-CB 4.44Å; R260-V277 HydrophobicContact CB-CG2 4.12Å; T275-V277 HydrophobicContact CG2-CG2 3.99Å; V277-S339 WeakPolarHBondContact O-CB 3.48Å; V277-T340 PolarHBondContact N-O 3.34Å; V277-T340 PolarHBondContact O-N 3.38Å; V277-V342 HydrophobicContact CG2-CG2 4.13Å
278	G	91.8	Very high	89.6	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.109	C	C	.	.			trans	-73.5	164.3	175.5	0	0	0	0	0	112.4	N258 E259	N258-G278 PolarHBondContact ND2-O 2.88Å; E259-G278 WeakPolarHBondContact O-CA 3.38Å; E259-G278 PolarHBondContact O-N 2.89Å
279	A	86.3	Confident	89.6	Confident	3 Å²	3	19 Å²	19	3%	0.025	9%	0.094	C	C	.	.			trans	-148.1	-178.5	-177.6	0	0	0	0	0	111.8	L240 M241 V243 N281 V282	L240-A279 WeakPolarHBondContact CB-O 3.33Å; L240-A279 CarbonylContact O-C 3.57Å; M241-A279 WeakPolarHBondContact O-CA 3.4Å; M241-A279 WeakPolarHBondContact O-CB 3.49Å; V243-A279 HydrophobicContact CB-CB 4.24Å; V243-A279 HydrophobicContact CG1-CB 3.82Å; V243-A279 HydrophobicContact CG2-CB 3.64Å; A279-N281 PolarHBondContact O-N 2.96Å; A279-V282 HydrophobicContact CB-CG2 3.84Å; A279-V282 VanDerWaalsContact O-CB 3.31Å; A279-V282 WeakPolarHBondContact O-CB 3.29Å; A279-V282 VanDerWaalsContact O-CG2 3.23Å; A279-V282 WeakPolarHBondContact O-CG2 3.5Å; A279-V282 PolarHBondContact O-N 2.97Å
280	T	78.1	Confident	89.6	Confident	26 Å²	26	18.1 Å²	18.1	16%	0.16	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	139.5	173.6	-49.5	0	0	0	0	110.6	L240 M241 S242 V282	L240-T280 WeakPolarHBondContact O-CA 3.34Å; L240-T280 WeakPolarHBondContact O-CB 3.17Å; L240-T280 PolarHBondContact O-N 3.11Å; L240-T280 PolarHBondContact O-OG1 2.83Å; M241-T280 PolarHBondContact O-N 2.8Å; S242-T280 PolarHBondContact N-OG1 3.38Å; T280-V282 PolarHBondContact O-N 3.39Å
281	N	70.4	Confident	89.4	Confident	16 Å²	16	25.3 Å²	25.3	9%	0.086	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	-4.9	-177.4	-63.3	-16.9	0	0	0	115.4	S83 W86 A279 G283 L337	S83-N281 PolarHBondContact OG-N 2.86Å; W86-N281 VanDerWaalsContact CD1-CB 3.44Å; W86-N281 HydrophobicContact CG-CB 4.09Å; A279-N281 PolarHBondContact O-N 2.96Å; N281-G283 PolarHBondContact O-N 2.88Å; N281-G283 VanDerWaalsContact O-N 3.11Å; N281-L337 HydrophobicContact CB-CD2 4.13Å; N281-L337 WeakPolarHBondContact O-CB 3.39Å; N281-L337 WeakPolarHBondContact O-CD1 3.37Å
282	V	61.9	Low	89.2	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.018	15%	0.145	C	C	.	.			trans	-65	111.2	172.3	-174.8	0	0	0	0	109.6	A279 T280 F335 L337 G338	A279-V282 HydrophobicContact CB-CG2 3.84Å; A279-V282 VanDerWaalsContact O-CB 3.31Å; A279-V282 WeakPolarHBondContact O-CB 3.29Å; A279-V282 VanDerWaalsContact O-CG2 3.23Å; A279-V282 WeakPolarHBondContact O-CG2 3.5Å; A279-V282 PolarHBondContact O-N 2.97Å; T280-V282 PolarHBondContact O-N 3.39Å; V282-F335 HydrophobicContact CG1-CD1 4.4Å; V282-L337 VanDerWaalsContact CG2-O 3.29Å; V282-L337 WeakPolarHBondContact CG2-O 3.05Å; V282-G338 WeakPolarHBondContact CG2-O 3.43Å
283	G	62.9	Low	89	Confident	13 Å²	13	31 Å²	31	13%	0.134	15%	0.148	C	C	.	.			trans	-62.1	-46.7	-179.2	0	0	0	0	0	112.4	N281 N296	N281-G283 PolarHBondContact O-N 2.88Å; N281-G283 VanDerWaalsContact O-N 3.11Å; G283-N296 WeakPolarHBondContact O-CB 3.33Å; G283-N296 PolarHBondContact O-ND2 2.96Å
284	S	84.3	Confident	88.7	Confident	33 Å²	33	39 Å²	39	23%	0.231	18%	0.178	C	C	.	.			trans	-166.2	161.5	173.6	55.5	0	0	0	0	110	T295 N336	S284-T295 WeakPolarHBondContact CB-OG1 3.29Å; S284-N336 PolarHBondContact O-N 2.9Å; S284-N336 PolarHBondContact OG-ND2 2.89Å
285	I	93.4	Very high	88.4	Confident	7 Å²	7	39.9 Å²	39.9	4%	0.036	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	133.1	161.8	-50.3	170.9	0	0	0	107.3	F222 V261 A276 T295 F335	F222-I285 HydrophobicContact CE1-CG2 4.5Å; F222-I285 HydrophobicContact CZ-CG2 4.35Å; V261-I285 HydrophobicContact CG2-CB 4.42Å; V261-I285 HydrophobicContact CG2-CD1 4.09Å; V261-I285 HydrophobicContact CG2-CG2 4.33Å; A276-I285 HydrophobicContact CB-CD1 4.32Å; A276-I285 HydrophobicContact CB-CG2 3.69Å; A276-I285 WeakPolarHBondContact O-CD1 3.28Å; I285-T295 HydrophobicContact CB-CG2 4.1Å; I285-T295 PolarHBondContact N-OG1 3.18Å; I285-T295 PolarHBondContact O-OG1 3.03Å; I285-F335 HydrophobicContact CD1-CE1 4.31Å; I285-F335 HydrophobicContact CG1-CD1 3.93Å; I285-F335 HydrophobicContact CG1-CE1 3.99Å; I285-F335 HydrophobicContact CG2-CD1 4.37Å; I285-F335 HydrophobicContact CG2-CE1 4.24Å
286	R	93.6	Very high	88	Confident	132 Å²	132	40.5 Å²	40.5	50%	0.498	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.8	174.4	-178.6	-178.8	-173.5	-174.8	3.6	109.6	Y288 G333 E334	R286-Y288 HydrophobicContact CG-CD1 4.31Å; R286-G333 CarbonylContact O-C 3.51Å; R286-G333 WeakPolarHBondContact O-CA 3.4Å; R286-E334 HydrophobicContact CB-CG 3.95Å; R286-E334 PolarHBondContact N-O 2.87Å; R286-E334 IonicContact NH1-OE1 3.65Å; R286-E334 PolarHBondContact O-N 3.41Å
287	V	96.1	Very high	87.5	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.1	168.3	175.5	0	0	0	0	106.5	V261 L263 F289 D290 L293	V261-V287 HydrophobicContact CG1-CG2 4.22Å; L263-V287 HydrophobicContact CD1-CG1 4.28Å; L263-V287 HydrophobicContact CD1-CG2 4.36Å; V287-F289 HydrophobicContact CG1-CD1 3.88Å; V287-F289 HydrophobicContact CG1-CD2 4.01Å; V287-F289 HydrophobicContact CG1-CE1 3.55Å; V287-F289 HydrophobicContact CG1-CE2 3.7Å; V287-F289 HydrophobicContact CG1-CG 4.1Å; V287-F289 HydrophobicContact CG1-CZ 3.46Å; V287-F289 VanDerWaalsContact CG1-CZ 3.46Å; V287-F289 PolarHBondContact O-N 3.28Å; V287-D290 HydrophobicContact CB-CB 4.34Å; V287-D290 HydrophobicContact CG1-CB 4.29Å; V287-D290 PolarHBondContact O-N 2.73Å; V287-L293 HydrophobicContact CB-CD2 3.99Å; V287-L293 HydrophobicContact CG2-CD2 3.73Å
288	Y	96.1	Very high	86.9	Confident	54 Å²	54	46.6 Å²	46.6	21%	0.212	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-33.9	-165.6	-65.2	-39.5	0	0	0	113.8	R135 R286 P331 V332 E334	R135-Y288 PolarHBondContact NH1-OH 3.25Å; R135-Y288 PolarHBondContact NH2-OH 2.68Å; R286-Y288 HydrophobicContact CG-CD1 4.31Å; Y288-P331 HydrophobicContact CD2-CB 4Å; Y288-P331 HydrophobicContact CE2-CB 3.71Å; Y288-V332 PolarHBondContact N-O 3.27Å; Y288-E334 HydrophobicContact CE1-CB 4.35Å; Y288-E334 HydrophobicContact CE1-CG 3.83Å; Y288-E334 VanDerWaalsContact CE1-OE2 3.27Å; Y288-E334 WeakPolarHBondContact CE1-OE2 3.45Å; Y288-E334 PolarHBondContact OH-OE2 2.95Å
289	F	95.2	Very high	86.4	Confident	58 Å²	58	57.5 Å²	57.5	25%	0.254	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-11.8	177.6	57.9	-101.9	0	0	0	114.4	V230 L263 V287 Y310 V324 L326 V332	V230-F289 HydrophobicContact CB-CZ 4.39Å; V230-F289 HydrophobicContact CG1-CZ 4.38Å; V230-F289 HydrophobicContact CG2-CZ 4.06Å; L263-F289 HydrophobicContact CD1-CZ 4Å; L263-F289 HydrophobicContact CD2-CZ 4.31Å; V287-F289 HydrophobicContact CG1-CD1 3.88Å; V287-F289 HydrophobicContact CG1-CD2 4.01Å; V287-F289 HydrophobicContact CG1-CE1 3.55Å; V287-F289 HydrophobicContact CG1-CE2 3.7Å; V287-F289 HydrophobicContact CG1-CG 4.1Å; V287-F289 HydrophobicContact CG1-CZ 3.46Å; V287-F289 VanDerWaalsContact CG1-CZ 3.46Å; V287-F289 PolarHBondContact O-N 3.28Å; F289-Y310 HydrophobicContact CD2-CE1 4.33Å; F289-Y310 HydrophobicContact CE2-CE1 4.27Å; F289-Y310 AromaticContact CE2-CE2 3.93Å; F289-Y310 HydrophobicContact CE2-CE2 3.93Å; F289-Y310 AromaticContact CE2-CZ 3.72Å; F289-V324 HydrophobicContact CB-CG1 4.38Å; F289-V324 HydrophobicContact CD1-CG1 4.01Å; F289-V324 HydrophobicContact CD2-CB 4.42Å; F289-V324 HydrophobicContact CD2-CG1 4.21Å; F289-V324 HydrophobicContact CD2-CG2 3.89Å; F289-V324 HydrophobicContact CE1-CG1 4.3Å; F289-V324 HydrophobicContact CE2-CB 4.42Å; F289-V324 HydrophobicContact CE2-CG1 4.48Å; F289-V324 HydrophobicContact CE2-CG2 4.14Å; F289-V324 HydrophobicContact CG-CG1 3.95Å; F289-V324 HydrophobicContact CG-CG2 4.4Å; F289-L326 HydrophobicContact CD1-CD2 4.25Å; F289-L326 HydrophobicContact CE1-CD1 4.09Å; F289-L326 HydrophobicContact CE1-CD2 4.1Å; F289-V332 HydrophobicContact CE1-CG1 4.15Å
290	D	94.7	Very high	86.3	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.021	28%	0.284	C	S	.	.			trans	-109.9	86.1	179.5	-171.3	-1.1	0	0	0	111.5	R233 V287 E292 L293 R308 Y310	R233-D290 IonicContact CZ-OD2 2.81Å; R233-D290 IonicContact NE-OD2 3.42Å; R233-D290 PolarHBondContact NE-OD2 3.36Å; R233-D290 IonicContact NH2-OD1 2.72Å; R233-D290 PolarHBondContact NH2-OD1 3.18Å; R233-D290 IonicContact NH2-OD2 3.71Å; R233-D290 PolarHBondContact NH2-OD2 3.37Å; V287-D290 HydrophobicContact CB-CB 4.34Å; V287-D290 HydrophobicContact CG1-CB 4.29Å; V287-D290 PolarHBondContact O-N 2.73Å; D290-E292 VanDerWaalsContact C-N 3.26Å; D290-E292 PolarHBondContact O-N 2.92Å; D290-E292 PolarHBondContact OD1-N 3Å; D290-L293 HydrophobicContact CB-CB 4.28Å; D290-L293 WeakPolarHBondContact O-CB 3.32Å; D290-L293 PolarHBondContact O-N 3.43Å; D290-L293 PolarHBondContact OD1-N 2.88Å; D290-R308 IonicContact OD1-CZ 3.64Å; D290-R308 IonicContact OD1-NH1 2.8Å; D290-R308 PolarHBondContact OD1-NH1 3.38Å; D290-Y310 WeakPolarHBondContact CB-OH 3.45Å; D290-Y310 PolarHBondContact OD2-OH 2.73Å
291	Q	91.4	Very high	86.7	Confident	161 Å²	161	63.9 Å²	63.9	75%	0.752	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-16.2	-177.2	-58.2	-169.3	17.9	0	0	114.1	R294	Q291-R294 PolarHBondContact O-NH1 2.82Å; Q291-R294 PolarHBondContact O-NH2 3.47Å; Q291-R294 VanDerWaalsContact O-NH2 3.09Å
292	E	92.4	Very high	87.3	Confident	124 Å²	124	71.1 Å²	71.1	58%	0.579	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-15.7	178.2	-71.4	158.8	-121.6	0	0	112.7	D290 R294 R308	D290-E292 VanDerWaalsContact C-N 3.26Å; D290-E292 PolarHBondContact O-N 2.92Å; D290-E292 PolarHBondContact OD1-N 3Å; E292-R294 PolarHBondContact O-N 2.99Å; E292-R308 IonicContact OE1-CZ 2.73Å; E292-R308 IonicContact OE1-NH1 2.81Å; E292-R308 PolarHBondContact OE1-NH1 2.9Å; E292-R308 IonicContact OE1-NH2 3.5Å; E292-R308 PolarHBondContact OE1-NH2 2.9Å; E292-R308 IonicContact OE2-CZ 2.73Å; E292-R308 IonicContact OE2-NH1 3.31Å; E292-R308 PolarHBondContact OE2-NH1 3.49Å; E292-R308 IonicContact OE2-NH2 3.78Å
293	L	94.1	Very high	88.3	Confident	11 Å²	11	74.2 Å²	74.2	6%	0.058	37%	0.366	C	S	.	.			trans	-56.7	123.6	176.1	178.9	63	0	0	0	110.8	H235 V261 V287 D290 T295	H235-L293 HydrophobicContact CB-CD1 4.13Å; V261-L293 HydrophobicContact CG1-CD1 4.41Å; V261-L293 HydrophobicContact CG1-CD2 4.01Å; V261-L293 HydrophobicContact CG2-CD1 3.98Å; V261-L293 HydrophobicContact CG2-CD2 4.04Å; V287-L293 HydrophobicContact CB-CD2 3.99Å; V287-L293 HydrophobicContact CG2-CD2 3.73Å; D290-L293 HydrophobicContact CB-CB 4.28Å; D290-L293 WeakPolarHBondContact O-CB 3.32Å; D290-L293 PolarHBondContact O-N 3.43Å; D290-L293 PolarHBondContact OD1-N 2.88Å; L293-T295 HydrophobicContact CD1-CG2 3.98Å; L293-T295 HydrophobicContact CG-CG2 4.15Å
294	R	91.7	Very high	89.7	Confident	169 Å²	169	75.4 Å²	75.4	64%	0.638	37%	0.372	S	S	*	.			trans	-127.7	100.9	176.6	-65.5	-66.1	174.6	-91.3	-4.9	109.7	H235 Q291 E292	H235-R294 PolarHBondContact CE1-O 3.44Å; Q291-R294 PolarHBondContact O-NH1 2.82Å; Q291-R294 PolarHBondContact O-NH2 3.47Å; Q291-R294 VanDerWaalsContact O-NH2 3.09Å; E292-R294 PolarHBondContact O-N 2.99Å
295	T	91.8	Very high	90.2	Very high	18 Å²	18	77.6 Å²	77.6	11%	0.11	38%	0.378	C	S	.	.			trans	-95.6	166.5	174.9	57.3	0	0	0	0	111.5	E259 V261 S284 I285 L293 A297	E259-T295 VanDerWaalsContact OE1-CA 3.24Å; E259-T295 WeakPolarHBondContact OE1-CA 3.28Å; E259-T295 WeakPolarHBondContact OE1-CB 3.36Å; V261-T295 HydrophobicContact CG2-CG2 3.73Å; S284-T295 WeakPolarHBondContact CB-OG1 3.29Å; I285-T295 HydrophobicContact CB-CG2 4.1Å; I285-T295 PolarHBondContact N-OG1 3.18Å; I285-T295 PolarHBondContact O-OG1 3.03Å; L293-T295 HydrophobicContact CD1-CG2 3.98Å; L293-T295 HydrophobicContact CG-CG2 4.15Å; T295-A297 PolarHBondContact O-N 3.37Å
296	N	89	Confident	90.2	Very high	13 Å²	13	82.4 Å²	82.4	7%	0.07	40%	0.4	C	S	.	.	S	Bend	trans	56.6	27.4	-175.9	-158.3	6.2	0	0	0	114.4	R80 R84 E259 G283	R80-N296 VanDerWaalsContact NH2-CA 3.27Å; R84-N296 WeakPolarHBondContact CG-ND2 3.21Å; R84-N296 WeakPolarHBondContact CG-OD1 3.12Å; E259-N296 VanDerWaalsContact CD-N 3.27Å; E259-N296 PolarHBondContact OE1-N 3.01Å; E259-N296 VanDerWaalsContact OE2-CA 3.28Å; E259-N296 WeakPolarHBondContact OE2-CA 3.23Å; E259-N296 PolarHBondContact OE2-N 3.46Å; G283-N296 WeakPolarHBondContact O-CB 3.33Å; G283-N296 PolarHBondContact O-ND2 2.96Å
297	A	87.1	Confident	90.3	Very high	28 Å²	28	79.4 Å²	79.4	23%	0.231	39%	0.394	C	S	.	.			trans	-53.2	144.6	178.8	0	0	0	0	0	112.5	R80 T295 R299	R80-A297 VanDerWaalsContact NH2-N 3.19Å; R80-A297 PolarHBondContact NH2-O 2.86Å; T295-A297 PolarHBondContact O-N 3.37Å; A297-R299 PolarHBondContact O-N 2.85Å
298	P	82.1	Confident	90.2	Very high	102 Å²	102	82.6 Å²	82.6	66%	0.662	41%	0.406	S	S	*	.	S	Bend	trans	-66.5	-37.7	-175	25.3	-33.5	0	0	0	113
299	R	82	Confident	90.1	Very high	230 Å²	230	83.8 Å²	83.8	87%	0.868	42%	0.419	S	S	*	.	S	Bend	trans	-116.8	141.1	174	-62.1	178.3	-178.9	168.7	-0.1	108.2	A297	A297-R299 PolarHBondContact O-N 2.85Å
300	Y	84.4	Confident	89.9	Confident	84 Å²	84	82.9 Å²	82.9	33%	0.329	41%	0.414	S	S	.	.			trans	-156.2	158.2	173.4	73.7	-75.3	0	0	0	109.1	R80 P237 K302	R80-Y300 VanDerWaalsContact CD-CE1 3.44Å; P237-Y300 HydrophobicContact CB-CD2 3.55Å; P237-Y300 HydrophobicContact CB-CE2 4.43Å; P237-Y300 HydrophobicContact CB-CG 3.84Å; P237-Y300 HydrophobicContact CG-CD2 3.92Å; P237-Y300 HydrophobicContact CG-CG 4.41Å; Y300-K302 HydrophobicContact CE2-CB 4.22Å
301	S	85.5	Confident	89.6	Confident	78 Å²	78	83.5 Å²	83.5	55%	0.545	42%	0.418	S	S	.	.			trans	-91.9	129.8	168.6	-173.9	0	0	0	0	109.4	G303 S304	S301-G303 PolarHBondContact O-N 2.86Å; S301-S304 PolarHBondContact O-N 2.97Å; S301-S304 PolarHBondContact O-OG 3.23Å
302	K	82.8	Confident	88.9	Confident	168 Å²	168	78 Å²	78	73%	0.73	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	123.9	-179.6	-175.6	-176.3	175	-170.8	0	109	Y300 S304	Y300-K302 HydrophobicContact CE2-CB 4.22Å; K302-S304 VanDerWaalsContact C-N 3.34Å
303	G	84.1	Confident	87.4	Confident	69 Å²	69	78.8 Å²	78.8	71%	0.711	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	-3.3	-177.5	0	0	0	0	0	114.8	S301	S301-G303 PolarHBondContact O-N 2.86Å
304	S	92.3	Very high	85.6	Confident	38 Å²	38	81.4 Å²	81.4	27%	0.266	45%	0.446	S	S	.	.			trans	-71.6	159.5	164.3	67.8	0	0	0	0	111	P237 S301 K302	P237-S304 WeakPolarHBondContact CD-O 3.18Å; S301-S304 PolarHBondContact O-N 2.97Å; S301-S304 PolarHBondContact O-OG 3.23Å; K302-S304 VanDerWaalsContact C-N 3.34Å
305	F	94.5	Very high	83.9	Confident	78 Å²	78	76 Å²	76	34%	0.342	43%	0.429	S	S	.	.			trans	-133.2	164.2	166.1	59.3	-91.2	0	0	0	110.4	P184 R234 H235 F236 D307	P184-F305 HydrophobicContact CG-CE1 3.69Å; P184-F305 HydrophobicContact CG-CZ 3.81Å; R234-F305 HydrophobicContact CG-CB 3.94Å; R234-F305 HydrophobicContact CG-CD2 4.03Å; R234-F305 HydrophobicContact CG-CG 4.26Å; H235-F305 CarbonylContact O-C 3.53Å; H235-F305 VanDerWaalsContact O-CA 3.22Å; H235-F305 WeakPolarHBondContact O-CA 3.01Å; F236-F305 HydrophobicContact CD1-CB 3.71Å; F236-F305 HydrophobicContact CE1-CB 3.76Å; F236-F305 HydrophobicContact CE1-CD1 4.35Å; F236-F305 HydrophobicContact CE1-CG 4.28Å; F236-F305 HydrophobicContact CG-CB 4.31Å; F236-F305 HydrophobicContact CZ-CB 4.4Å; F305-D307 WeakPolarHBondContact CD2-OD1 3.49Å
306	Q	94.4	Very high	81.9	Confident	109 Å²	109	80.2 Å²	80.2	51%	0.509	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	112.7	178.4	-65.2	-179.4	8.1	0	0	110.5	R233 H235	R233-Q306 PolarHBondContact NH1-O 3.2Å; H235-Q306 HydrophobicContact CB-CB 4.46Å; H235-Q306 PolarHBondContact N-O 2.83Å; H235-Q306 PolarHBondContact O-N 2.93Å
307	D	94.8	Very high	80	Confident	69 Å²	69	85.9 Å²	85.9	37%	0.369	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	141.6	-179.8	-75.5	1.4	0	0	0	111.6	L232 R233 R234 F305	L232-D307 HydrophobicContact CD1-CB 4.01Å; R233-D307 CarbonylContact O-C 3.33Å; R233-D307 WeakPolarHBondContact O-CA 3.29Å; R234-D307 VanDerWaalsContact CB-OD1 3.31Å; R234-D307 WeakPolarHBondContact CB-OD1 3.5Å; R234-D307 WeakPolarHBondContact CD-OD1 3.1Å; R234-D307 WeakPolarHBondContact CG-OD1 3.43Å; R234-D307 IonicContact CZ-OD1 3.97Å; R234-D307 IonicContact CZ-OD2 3.71Å; R234-D307 IonicContact NE-OD1 3.72Å; R234-D307 PolarHBondContact NE-OD1 2.87Å; R234-D307 IonicContact NE-OD2 3.8Å; R234-D307 PolarHBondContact NE-OD2 3.02Å; R234-D307 IonicContact NH2-OD1 3.16Å; R234-D307 IonicContact NH2-OD2 3.67Å; R234-D307 PolarHBondContact NH2-OD2 3Å; F305-D307 WeakPolarHBondContact CD2-OD1 3.49Å
308	R	94.1	Very high	78.1	Confident	69 Å²	69	94 Å²	94	26%	0.26	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	113.8	167.8	180	178.9	-171.7	142.2	29.6	108.4	R233 D290 E292 Y310	R233-R308 HydrophobicContact CB-CB 4.45Å; R233-R308 PolarHBondContact N-O 2.81Å; R233-R308 PolarHBondContact O-N 3.47Å; D290-R308 IonicContact OD1-CZ 3.64Å; D290-R308 IonicContact OD1-NH1 2.8Å; D290-R308 PolarHBondContact OD1-NH1 3.38Å; E292-R308 IonicContact OE1-CZ 2.73Å; E292-R308 IonicContact OE1-NH1 2.81Å; E292-R308 PolarHBondContact OE1-NH1 2.9Å; E292-R308 IonicContact OE1-NH2 3.5Å; E292-R308 PolarHBondContact OE1-NH2 2.9Å; E292-R308 IonicContact OE2-CZ 2.73Å; E292-R308 IonicContact OE2-NH1 3.31Å; E292-R308 PolarHBondContact OE2-NH1 3.49Å; E292-R308 IonicContact OE2-NH2 3.78Å; R308-Y310 HydrophobicContact CG-CD1 4.47Å; R308-Y310 HydrophobicContact CG-CE1 3.99Å
309	T	93.4	Very high	76.3	Confident	80 Å²	80	93.4 Å²	93.4	49%	0.491	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	143.4	167.8	-178.5	0	0	0	0	110.2	V311	T309-V311 PolarHBondContact OG1-N 3.15Å; T309-V311 VanDerWaalsContact OG1-N 3.12Å; T309-V311 PolarHBondContact OG1-O 3.18Å
310	Y	91.9	Very high	74.9	Confident	38 Å²	38	85 Å²	85	15%	0.149	49%	0.492	C	S	.	.			trans	-108.4	-5.4	167.7	-54.8	-66.6	0	0	0	112.2	V230 E231 R233 F289 D290 R308 G323 V324	V230-Y310 HydrophobicContact CB-CD2 4.39Å; V230-Y310 HydrophobicContact CG1-CD2 3.94Å; V230-Y310 HydrophobicContact CG1-CE2 3.86Å; E231-Y310 PolarHBondContact O-N 3.44Å; R233-Y310 HydrophobicContact CB-CE2 3.67Å; R233-Y310 WeakPolarHBondContact CB-OH 3.22Å; F289-Y310 HydrophobicContact CD2-CE1 4.33Å; F289-Y310 HydrophobicContact CE2-CE1 4.27Å; F289-Y310 AromaticContact CE2-CE2 3.93Å; F289-Y310 HydrophobicContact CE2-CE2 3.93Å; F289-Y310 AromaticContact CE2-CZ 3.72Å; D290-Y310 WeakPolarHBondContact CB-OH 3.45Å; D290-Y310 PolarHBondContact OD2-OH 2.73Å; R308-Y310 HydrophobicContact CG-CD1 4.47Å; R308-Y310 HydrophobicContact CG-CE1 3.99Å; Y310-G323 WeakPolarHBondContact O-CA 3.31Å; Y310-G323 PolarHBondContact O-N 3.2Å; Y310-V324 HydrophobicContact CD1-CG2 4.06Å; Y310-V324 HydrophobicContact CD2-CG2 4.39Å; Y310-V324 HydrophobicContact CG-CG2 3.92Å
311	V	88.3	Confident	73.4	Confident	17 Å²	17	86.8 Å²	86.8	10%	0.103	50%	0.504	C	S	.	.	S	Bend	trans	-88.8	135.1	173	-172.8	0	0	0	0	108.8	E231 T309 D315 Q316	E231-V311 HydrophobicContact CB-CG2 3.75Å; E231-V311 HydrophobicContact CG-CG2 3.89Å; T309-V311 PolarHBondContact OG1-N 3.15Å; T309-V311 VanDerWaalsContact OG1-N 3.12Å; T309-V311 PolarHBondContact OG1-O 3.18Å; V311-D315 HydrophobicContact CG1-CB 3.93Å; V311-Q316 HydrophobicContact CG1-CG 3.97Å
312	A	75.6	Confident	72.8	Confident	45 Å²	45	84.2 Å²	84.2	37%	0.372	49%	0.49	S	S	.	.			trans	-70.9	154.5	-179.8	0	0	0	0	0	111.8	G314 D315	A312-G314 PolarHBondContact O-N 3.4Å; A312-D315 WeakPolarHBondContact CB-OD2 3.47Å; A312-D315 PolarHBondContact O-N 3.35Å
313	P	61.5	Low	73.1	Confident	142 Å²	142	77.4 Å²	77.4	92%	0.922	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	79.6	172	-13.8	30	0	0	0	111
314	G	57	Low	73.6	Confident	66 Å²	66	75.8 Å²	75.8	68%	0.68	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	163.3	-36.6	-178.6	0	0	0	0	0	113.2	A312 Q316	A312-G314 PolarHBondContact O-N 3.4Å; G314-Q316 PolarHBondContact O-N 3.24Å
315	D	55.6	Low	73.8	Confident	54 Å²	54	77 Å²	77	29%	0.289	46%	0.455	S	S	.	.			trans	-75	-7.9	-175.7	-58.1	-22	0	0	0	113.8	V311 A312 V317 E321	V311-D315 HydrophobicContact CG1-CB 3.93Å; A312-D315 WeakPolarHBondContact CB-OD2 3.47Å; A312-D315 PolarHBondContact O-N 3.35Å; D315-V317 PolarHBondContact O-N 2.88Å; D315-V317 VanDerWaalsContact O-N 3.14Å; D315-E321 WeakPolarHBondContact CB-O 3.43Å
316	Q	50.1	Low	73.9	Confident	107 Å²	107	73.5 Å²	73.5	50%	0.5	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	117.5	-178.5	-66.5	-167.4	1.6	0	0	110.9	V311 G314	V311-Q316 HydrophobicContact CG1-CG 3.97Å; G314-Q316 PolarHBondContact O-N 3.24Å
317	V	48.7	Very low	74.1	Confident	133 Å²	133	77.5 Å²	77.5	81%	0.806	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.2	-15.4	158	-174.3	0	0	0	0	117.6	D315	D315-V317 PolarHBondContact O-N 2.88Å; D315-V317 VanDerWaalsContact O-N 3.14Å
318	K	46.8	Very low	74.2	Confident	198 Å²	198	76.6 Å²	76.6	86%	0.861	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.2	-26.3	-173.5	-70.9	-166.5	177.2	-177.1	0	121.1
319	T	44	Very low	74.3	Confident	89 Å²	89	74 Å²	74	55%	0.546	44%	0.438	S	S	.	.	S	Bend	trans	-114.8	-13.6	-173.8	56.2	0	0	0	0	115.6	E321	T319-E321 WeakPolarHBondContact CB-OE2 3.34Å; T319-E321 PolarHBondContact O-N 2.84Å; T319-E321 PolarHBondContact OG1-OE2 2.93Å
320	G	52.5	Low	74.5	Confident	54 Å²	54	73.9 Å²	73.9	56%	0.557	43%	0.432	S	S	*	.			trans	67.6	25	-172.6	0	0	0	0	0	112.8	R229	R229-G320 PolarHBondContact NH1-O 3.36Å; R229-G320 PolarHBondContact NH2-O 3.19Å
321	E	53.2	Low	74.7	Confident	122 Å²	122	75 Å²	75	57%	0.57	44%	0.443	S	S	*	.			trans	-96	161.7	173.7	-65.6	169	135.6	0	0	110.2	D315 T319	D315-E321 WeakPolarHBondContact CB-O 3.43Å; T319-E321 WeakPolarHBondContact CB-OE2 3.34Å; T319-E321 PolarHBondContact O-N 2.84Å; T319-E321 PolarHBondContact OG1-OE2 2.93Å
322	G	73.7	Confident	75.2	Confident	24 Å²	24	74.1 Å²	74.1	25%	0.247	44%	0.438	C	S	.	.	S	Bend	trans	81.1	170.6	-172.8	0	0	0	0	0	114.9	R229	R229-G322 VanDerWaalsContact CD-O 3.26Å; R229-G322 WeakPolarHBondContact CD-O 3.36Å; R229-G322 PolarHBondContact NH1-O 2.82Å
323	G	88.6	Confident	76.1	Confident	24 Å²	24	72 Å²	72	25%	0.247	42%	0.421	C	S	.	.	S	Bend	trans	79.7	170.6	-174	0	0	0	0	0	114.6	V230 Y310	V230-G323 CarbonylContact O-C 3.42Å; V230-G323 WeakPolarHBondContact O-CA 3.23Å; Y310-G323 WeakPolarHBondContact O-CA 3.31Å; Y310-G323 PolarHBondContact O-N 3.2Å
324	V	94.8	Very high	77.7	Confident	36 Å²	36	65.4 Å²	65.4	22%	0.218	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	108.2	178.1	-175.8	0	0	0	0	109.6	R229 V230 F289 Y310 L326	R229-V324 CarbonylContact C-O 3.58Å; R229-V324 WeakPolarHBondContact CA-O 3.23Å; V230-V324 HydrophobicContact CB-CB 4.28Å; V230-V324 PolarHBondContact N-O 2.66Å; V230-V324 PolarHBondContact O-N 3.01Å; F289-V324 HydrophobicContact CB-CG1 4.38Å; F289-V324 HydrophobicContact CD1-CG1 4.01Å; F289-V324 HydrophobicContact CD2-CB 4.42Å; F289-V324 HydrophobicContact CD2-CG1 4.21Å; F289-V324 HydrophobicContact CD2-CG2 3.89Å; F289-V324 HydrophobicContact CE1-CG1 4.3Å; F289-V324 HydrophobicContact CE2-CB 4.42Å; F289-V324 HydrophobicContact CE2-CG1 4.48Å; F289-V324 HydrophobicContact CE2-CG2 4.14Å; F289-V324 HydrophobicContact CG-CG1 3.95Å; F289-V324 HydrophobicContact CG-CG2 4.4Å; Y310-V324 HydrophobicContact CD1-CG2 4.06Å; Y310-V324 HydrophobicContact CD2-CG2 4.39Å; Y310-V324 HydrophobicContact CG-CG2 3.92Å; V324-L326 HydrophobicContact CG1-CD2 4.27Å; V324-L326 HydrophobicContact CG1-CG 4.45Å
325	A	96.2	Very high	79.3	Confident	63 Å²	63	62.3 Å²	62.3	52%	0.521	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.3	172.2	0	0	0	0	0	110.5
326	L	97.4	Very high	80.3	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.4	177.8	-66.7	172.3	0	0	0	109.6	D227 W228 V230 F289 V324 V332	D227-L326 WeakPolarHBondContact CA-O 3.3Å; W228-L326 HydrophobicContact CZ2-CD1 3.97Å; W228-L326 PolarHBondContact N-O 3Å; W228-L326 VanDerWaalsContact N-O 3.08Å; W228-L326 PolarHBondContact O-N 3.25Å; V230-L326 HydrophobicContact CG2-CD1 3.45Å; V230-L326 VanDerWaalsContact CG2-CD1 3.45Å; V230-L326 HydrophobicContact CG2-CG 4.19Å; F289-L326 HydrophobicContact CD1-CD2 4.25Å; F289-L326 HydrophobicContact CE1-CD1 4.09Å; F289-L326 HydrophobicContact CE1-CD2 4.1Å; V324-L326 HydrophobicContact CG1-CD2 4.27Å; V324-L326 HydrophobicContact CG1-CG 4.45Å; L326-V332 HydrophobicContact CD1-CG1 4.45Å; L326-V332 HydrophobicContact CD1-CG2 3.83Å; L326-V332 HydrophobicContact CD2-CG2 4.36Å
327	R	97.4	Very high	81.2	Confident	193 Å²	193	57.4 Å²	57.4	73%	0.728	32%	0.323	S	S	*	.			trans	-90.1	147.9	177.2	-64.4	-177.3	179.4	-177.7	-0.2	112	S224 D227 G329 E330	S224-R327 WeakPolarHBondContact CB-O 3.28Å; D227-R327 WeakPolarHBondContact OD1-CA 3.32Å; R327-G329 PolarHBondContact O-N 3.33Å; R327-E330 HydrophobicContact CB-CB 4.42Å; R327-E330 PolarHBondContact N-OE2 3.46Å; R327-E330 WeakPolarHBondContact O-CB 3.4Å; R327-E330 PolarHBondContact O-N 3.23Å
328	K	97.6	Very high	81.9	Confident	50 Å²	50	51.7 Å²	51.7	22%	0.217	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	123.1	175.9	-171.9	174	54.3	162.7	0	110.9	V143 C144 A145 S147 T150 A226 D227	V143-K328 HydrophobicContact CG1-CD 4.14Å; V143-K328 HydrophobicContact CG1-CG 3.8Å; C144-K328 PolarHBondContact O-NZ 2.94Å; A145-K328 PolarHBondContact O-NZ 2.79Å; A145-K328 VanDerWaalsContact O-NZ 3.13Å; S147-K328 PolarHBondContact O-NZ 3.27Å; T150-K328 HydrophobicContact CG2-CD 4.05Å; A226-K328 PolarHBondContact O-N 2.92Å; D227-K328 PolarHBondContact OD1-N 2.87Å
329	G	96.8	Very high	83.6	Confident	14 Å²	14	42.3 Å²	42.3	14%	0.144	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	-9.5	-174.9	0	0	0	0	0	116.1	H223 S224 R327	H223-G329 PolarHBondContact ND1-O 3.08Å; S224-G329 PolarHBondContact O-N 3.15Å; R327-G329 PolarHBondContact O-N 3.33Å
330	E	96.8	Very high	86	Confident	78 Å²	78	38 Å²	38	36%	0.364	22%	0.224	S	C	.	.			trans	-64.6	138.1	-179.9	-171.7	176	169	0	0	111.6	H223 S224 R327 V332	H223-E330 CarbonylContact C-O 3.59Å; H223-E330 WeakPolarHBondContact CA-O 3.2Å; H223-E330 WeakPolarHBondContact CB-O 3.41Å; S224-E330 PolarHBondContact N-O 3.17Å; R327-E330 HydrophobicContact CB-CB 4.42Å; R327-E330 PolarHBondContact N-OE2 3.46Å; R327-E330 WeakPolarHBondContact O-CB 3.4Å; R327-E330 PolarHBondContact O-N 3.23Å; E330-V332 PolarHBondContact O-N 2.9Å
331	P	96.8	Very high	88.1	Confident	60 Å²	60	35.5 Å²	35.5	39%	0.39	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	122.3	177.8	-15.3	28.6	0	0	0	111.9	Y288	Y288-P331 HydrophobicContact CD2-CB 4Å; Y288-P331 HydrophobicContact CE2-CB 3.71Å
332	V	97.5	Very high	90.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-38.9	-178.6	176.9	0	0	0	0	111.4	F222 L263 Y288 F289 L326 E330	F222-V332 HydrophobicContact CD2-CB 3.95Å; F222-V332 HydrophobicContact CD2-CG1 4.04Å; F222-V332 HydrophobicContact CE2-CB 4.1Å; F222-V332 HydrophobicContact CE2-CG1 3.75Å; F222-V332 PolarHBondContact O-N 3.37Å; L263-V332 HydrophobicContact CD1-CG1 3.8Å; Y288-V332 PolarHBondContact N-O 3.27Å; F289-V332 HydrophobicContact CE1-CG1 4.15Å; L326-V332 HydrophobicContact CD1-CG1 4.45Å; L326-V332 HydrophobicContact CD1-CG2 3.83Å; L326-V332 HydrophobicContact CD2-CG2 4.36Å; E330-V332 PolarHBondContact O-N 2.9Å
333	G	95.4	Very high	91.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	-173.9	-177.1	0	0	0	0	0	114.7	C221 F222 R286	C221-G333 CarbonylContact C-O 3.51Å; C221-G333 VanDerWaalsContact CA-O 3.26Å; C221-G333 WeakPolarHBondContact CA-O 3.36Å; C221-G333 WeakPolarHBondContact CB-O 3.1Å; F222-G333 VanDerWaalsContact CE1-C 3.41Å; F222-G333 PolarHBondContact N-O 3.41Å; F222-G333 PolarHBondContact O-N 3.22Å; F222-G333 VanDerWaalsContact O-N 3.08Å; R286-G333 CarbonylContact O-C 3.51Å; R286-G333 WeakPolarHBondContact O-CA 3.4Å
334	E	94.1	Very high	91.8	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.019	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	153.5	179.7	62.6	-168	-149.1	0	0	112.2	R133 R135 H220 C221 R286 Y288	R133-E334 WeakPolarHBondContact CD-OE1 3.38Å; R133-E334 IonicContact CZ-OE1 3.66Å; R133-E334 IonicContact NH1-OE1 2.75Å; R133-E334 PolarHBondContact NH1-OE1 3.18Å; R135-E334 IonicContact NH2-OE2 2.8Å; R135-E334 PolarHBondContact NH2-OE2 3.46Å; H220-E334 WeakPolarHBondContact O-CA 3.29Å; C221-E334 HydrophobicContact CB-CB 4.49Å; R286-E334 HydrophobicContact CB-CG 3.95Å; R286-E334 PolarHBondContact N-O 2.87Å; R286-E334 IonicContact NH1-OE1 3.65Å; R286-E334 PolarHBondContact O-N 3.41Å; Y288-E334 HydrophobicContact CE1-CB 4.35Å; Y288-E334 HydrophobicContact CE1-CG 3.83Å; Y288-E334 VanDerWaalsContact CE1-OE2 3.27Å; Y288-E334 WeakPolarHBondContact CE1-OE2 3.45Å; Y288-E334 PolarHBondContact OH-OE2 2.95Å
335	F	91.1	Very high	92	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.6	165.9	-57.5	-91.4	0	0	0	109.9	L214 H220 F222 A276 V282 I285 L337 S339 I341	L214-F335 HydrophobicContact CD2-CD2 4.26Å; L214-F335 HydrophobicContact CD2-CE2 4.29Å; H220-F335 PolarHBondContact O-N 3.21Å; F222-F335 AromaticContact CD1-CD2 3.65Å; F222-F335 HydrophobicContact CD1-CD2 3.65Å; F222-F335 AromaticContact CD1-CE2 3.32Å; F222-F335 HydrophobicContact CD1-CE2 3.32Å; F222-F335 HydrophobicContact CD1-CZ 4.09Å; F222-F335 AromaticContact CE1-CD2 3.85Å; F222-F335 HydrophobicContact CE1-CD2 3.85Å; F222-F335 AromaticContact CE1-CE2 3.61Å; F222-F335 HydrophobicContact CE1-CE2 3.61Å; F222-F335 HydrophobicContact CE1-CG 4.45Å; F222-F335 HydrophobicContact CE1-CZ 4Å; F222-F335 HydrophobicContact CG-CE2 4.27Å; A276-F335 HydrophobicContact CB-CE1 3.76Å; A276-F335 HydrophobicContact CB-CZ 3.59Å; V282-F335 HydrophobicContact CG1-CD1 4.4Å; I285-F335 HydrophobicContact CD1-CE1 4.31Å; I285-F335 HydrophobicContact CG1-CD1 3.93Å; I285-F335 HydrophobicContact CG1-CE1 3.99Å; I285-F335 HydrophobicContact CG2-CD1 4.37Å; I285-F335 HydrophobicContact CG2-CE1 4.24Å; F335-L337 VanDerWaalsContact CB-O 3.24Å; F335-L337 WeakPolarHBondContact CB-O 3.41Å; F335-L337 PolarHBondContact O-N 2.68Å; F335-S339 WeakPolarHBondContact CD1-OG 3.46Å; F335-S339 WeakPolarHBondContact CD2-OG 3.22Å; F335-S339 WeakPolarHBondContact CE1-OG 3.05Å; F335-S339 WeakPolarHBondContact CE2-OG 3.35Å; F335-S339 WeakPolarHBondContact CG-OG 3.49Å; F335-S339 VanDerWaalsContact CZ-OG 3.28Å; F335-S339 WeakPolarHBondContact CZ-OG 3.39Å; F335-I341 HydrophobicContact CE2-CD1 3.77Å; F335-I341 HydrophobicContact CE2-CG1 4.11Å; F335-I341 HydrophobicContact CZ-CD1 3.73Å; F335-I341 HydrophobicContact CZ-CG1 4.29Å
336	N	76.5	Confident	92	Very high	40 Å²	40	22.7 Å²	22.7	21%	0.214	11%	0.111	C	C	.	.	S	Bend	trans	-73.4	-18.3	173.9	-70.5	7.6	0	0	0	112.9	F132 R133 S284	F132-N336 WeakPolarHBondContact CD1-O 3.4Å; R133-N336 WeakPolarHBondContact CD-OD1 3.27Å; S284-N336 PolarHBondContact O-N 2.9Å; S284-N336 PolarHBondContact OG-ND2 2.89Å
337	L	69.3	Low	92	Very high	19 Å²	19	22.5 Å²	22.5	10%	0.099	11%	0.11	C	C	.	.	S	Bend	trans	-155.2	168.1	170.5	-107.5	123.9	0	0	0	111	N90 F132 N281 V282 F335	N90-L337 WeakPolarHBondContact ND2-CD1 3.28Å; F132-L337 HydrophobicContact CD1-CG 4.48Å; F132-L337 HydrophobicContact CD2-CG 4.22Å; F132-L337 HydrophobicContact CE1-CB 4.41Å; F132-L337 HydrophobicContact CE1-CG 4.39Å; F132-L337 HydrophobicContact CE2-CD2 4.28Å; F132-L337 HydrophobicContact CE2-CG 4.1Å; F132-L337 HydrophobicContact CG-CG 4.39Å; F132-L337 HydrophobicContact CZ-CB 4.33Å; F132-L337 HydrophobicContact CZ-CG 4.17Å; N281-L337 HydrophobicContact CB-CD2 4.13Å; N281-L337 WeakPolarHBondContact O-CB 3.39Å; N281-L337 WeakPolarHBondContact O-CD1 3.37Å; V282-L337 VanDerWaalsContact CG2-O 3.29Å; V282-L337 WeakPolarHBondContact CG2-O 3.05Å; F335-L337 VanDerWaalsContact CB-O 3.24Å; F335-L337 WeakPolarHBondContact CB-O 3.41Å; F335-L337 PolarHBondContact O-N 2.68Å
338	G	63.3	Low	91.9	Very high	13 Å²	13	14.8 Å²	14.8	13%	0.134	9%	0.085	C	C	.	.			trans	-61.3	150	-162.9	0	0	0	0	0	117	F132 H220 V282	F132-G338 VanDerWaalsContact CZ-N 3.35Å; H220-G338 VanDerWaalsContact NE2-CA 3.28Å; H220-G338 WeakPolarHBondContact NE2-CA 3.44Å; V282-G338 WeakPolarHBondContact CG2-O 3.43Å
339	S	83.4	Confident	91.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	10%	0.095	C	C	.	.			trans	-158.7	-173.8	-152.7	58.5	0	0	0	0	113.2	Y213 L214 H220 V277 F335	Y213-S339 WeakPolarHBondContact CD2-O 3.24Å; L214-S339 WeakPolarHBondContact CD1-O 3.46Å; L214-S339 PolarHBondContact N-O 2.87Å; L214-S339 PolarHBondContact O-N 2.82Å; H220-S339 PolarHBondContact CE1-OG 3.3Å; V277-S339 WeakPolarHBondContact O-CB 3.48Å; F335-S339 WeakPolarHBondContact CD1-OG 3.46Å; F335-S339 WeakPolarHBondContact CD2-OG 3.22Å; F335-S339 WeakPolarHBondContact CE1-OG 3.05Å; F335-S339 WeakPolarHBondContact CE2-OG 3.35Å; F335-S339 WeakPolarHBondContact CG-OG 3.49Å; F335-S339 VanDerWaalsContact CZ-OG 3.28Å; F335-S339 WeakPolarHBondContact CZ-OG 3.39Å
340	T	94	Very high	91.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.4	172.1	-62.3	0	0	0	0	110.3	V211 V212 V243 F255 V277 V342	V211-T340 HydrophobicContact CG1-CG2 3.59Å; V212-T340 CarbonylContact O-C 3.54Å; V212-T340 WeakPolarHBondContact O-CA 3.41Å; V212-T340 WeakPolarHBondContact O-CG2 3.48Å; V243-T340 WeakPolarHBondContact CB-OG1 3.45Å; V243-T340 VanDerWaalsContact CG2-OG1 3.27Å; V243-T340 WeakPolarHBondContact CG2-OG1 3.13Å; F255-T340 HydrophobicContact CE1-CG2 4.23Å; F255-T340 HydrophobicContact CE2-CG2 4.4Å; F255-T340 HydrophobicContact CZ-CG2 3.97Å; V277-T340 PolarHBondContact N-O 3.34Å; V277-T340 PolarHBondContact O-N 3.38Å; T340-V342 HydrophobicContact CG2-CG2 4.18Å
341	I	96.9	Very high	91.6	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.3	162.9	-65	-72.8	0	0	0	108.4	P152 A153 V212 L214 F222 L274 T275 A276 F335 L343	P152-I341 HydrophobicContact CB-CG2 4.39Å; P152-I341 HydrophobicContact CG-CB 4.4Å; P152-I341 HydrophobicContact CG-CG2 3.66Å; A153-I341 HydrophobicContact CB-CG1 4.47Å; V212-I341 PolarHBondContact N-O 2.95Å; V212-I341 PolarHBondContact O-N 3.24Å; L214-I341 HydrophobicContact CD1-CG1 4.08Å; F222-I341 HydrophobicContact CB-CD1 3.8Å; F222-I341 HydrophobicContact CB-CG1 4.12Å; F222-I341 HydrophobicContact CD1-CD1 4Å; F222-I341 HydrophobicContact CD2-CD1 3.95Å; F222-I341 HydrophobicContact CG-CD1 3.65Å; F222-I341 HydrophobicContact CG-CG1 4.48Å; L274-I341 HydrophobicContact CD2-CD1 4.1Å; L274-I341 HydrophobicContact CG-CG2 4.32Å; T275-I341 WeakPolarHBondContact O-CA 3.28Å; A276-I341 HydrophobicContact CB-CD1 4.17Å; F335-I341 HydrophobicContact CE2-CD1 3.77Å; F335-I341 HydrophobicContact CE2-CG1 4.11Å; F335-I341 HydrophobicContact CZ-CD1 3.73Å; F335-I341 HydrophobicContact CZ-CG1 4.29Å; I341-L343 HydrophobicContact CG2-CD2 4.09Å; I341-L343 HydrophobicContact CG2-CG 4.37Å
342	V	97.6	Very high	91.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.3	167.6	-176	0	0	0	0	107.8	F181 V210 V211 F255 T275 V277 T340 L344	F181-V342 HydrophobicContact CE1-CB 4.09Å; F181-V342 HydrophobicContact CE1-CG1 3.94Å; F181-V342 HydrophobicContact CE2-CG2 4.45Å; F181-V342 HydrophobicContact CZ-CB 3.75Å; F181-V342 HydrophobicContact CZ-CG1 4Å; F181-V342 HydrophobicContact CZ-CG2 3.79Å; V210-V342 WeakPolarHBondContact O-CA 3.39Å; V211-V342 HydrophobicContact CG2-CG1 4.48Å; F255-V342 HydrophobicContact CD2-CG2 4.07Å; F255-V342 HydrophobicContact CE2-CG2 4.3Å; T275-V342 PolarHBondContact N-O 2.99Å; T275-V342 PolarHBondContact O-N 2.92Å; V277-V342 HydrophobicContact CG2-CG2 4.13Å; T340-V342 HydrophobicContact CG2-CG2 4.18Å; V342-L344 HydrophobicContact CG1-CD1 4.47Å; V342-L344 HydrophobicContact CG1-CG 4.38Å
343	L	98	Very high	91.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139.9	165.6	-62	-174.2	0	0	0	109.4	P152 H209 V210 P225 F272 S273 L274 I341 F345 L367	P152-L343 HydrophobicContact CG-CD1 4.03Å; P152-L343 HydrophobicContact CG-CD2 4.13Å; P152-L343 HydrophobicContact CG-CG 4.14Å; H209-L343 CarbonylContact C-O 3.59Å; H209-L343 WeakPolarHBondContact CA-O 3.43Å; H209-L343 WeakPolarHBondContact CB-O 3.45Å; V210-L343 HydrophobicContact CB-CB 4.39Å; V210-L343 PolarHBondContact N-O 3.49Å; V210-L343 PolarHBondContact O-N 3.35Å; P225-L343 HydrophobicContact CB-CD1 3.98Å; P225-L343 HydrophobicContact CG-CD1 4.09Å; P225-L343 HydrophobicContact CG-CD2 4.07Å; F272-L343 HydrophobicContact CE1-CD2 4.4Å; F272-L343 HydrophobicContact CZ-CD2 4.43Å; S273-L343 WeakPolarHBondContact O-CA 3.4Å; L274-L343 HydrophobicContact CB-CD2 3.96Å; L274-L343 HydrophobicContact CD1-CD2 4.02Å; L274-L343 HydrophobicContact CG-CD2 3.79Å; I341-L343 HydrophobicContact CG2-CD2 4.09Å; I341-L343 HydrophobicContact CG2-CG 4.37Å; L343-F345 HydrophobicContact CB-CD1 4.37Å; L343-L367 HydrophobicContact CD1-CD1 3.77Å
344	L	98	Very high	91.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	123.4	169.7	-78.4	157.4	0	0	0	107.1	V163 V168 L178 F181 L182 F208 H209 F271 S273 V342	V163-L344 HydrophobicContact CG2-CD2 3.86Å; V168-L344 HydrophobicContact CG2-CD2 4.05Å; L178-L344 HydrophobicContact CD1-CD1 3.62Å; L178-L344 HydrophobicContact CD1-CD2 3.79Å; L178-L344 HydrophobicContact CD1-CG 4.34Å; F181-L344 HydrophobicContact CD1-CD1 3.78Å; F181-L344 HydrophobicContact CE1-CD1 3.85Å; L182-L344 HydrophobicContact CD1-CD1 4.28Å; L182-L344 HydrophobicContact CD2-CD1 3.95Å; L182-L344 HydrophobicContact CG-CD1 4.23Å; F208-L344 WeakPolarHBondContact O-CA 3.44Å; H209-L344 HydrophobicContact CB-CD2 3.61Å; H209-L344 HydrophobicContact CB-CG 4.33Å; F271-L344 HydrophobicContact CE1-CB 4.31Å; S273-L344 PolarHBondContact N-O 3.11Å; S273-L344 PolarHBondContact O-N 2.67Å; V342-L344 HydrophobicContact CG1-CD1 4.47Å; V342-L344 HydrophobicContact CG1-CG 4.38Å
345	F	97.6	Very high	91.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	141.4	-172.8	61.9	-89.4	0	0	0	112.1	L149 F208 V210 W267 F271 F272 L343 A347 F351 F353	L149-F345 HydrophobicContact CD2-CD1 3.98Å; L149-F345 HydrophobicContact CD2-CD2 4.21Å; L149-F345 HydrophobicContact CD2-CE1 3.48Å; L149-F345 VanDerWaalsContact CD2-CE1 3.48Å; L149-F345 HydrophobicContact CD2-CE2 3.72Å; L149-F345 HydrophobicContact CD2-CG 4.32Å; L149-F345 HydrophobicContact CD2-CZ 3.32Å; F208-F345 HydrophobicContact CB-CD1 4.46Å; F208-F345 HydrophobicContact CB-CD2 4.08Å; F208-F345 HydrophobicContact CB-CE1 4.01Å; F208-F345 HydrophobicContact CB-CE2 3.6Å; F208-F345 HydrophobicContact CB-CG 4.49Å; F208-F345 HydrophobicContact CB-CZ 3.56Å; F208-F345 HydrophobicContact CD2-CE2 4.15Å; F208-F345 HydrophobicContact CG-CE2 4.13Å; F208-F345 HydrophobicContact CG-CZ 4.39Å; F208-F345 PolarHBondContact N-O 2.82Å; F208-F345 PolarHBondContact O-N 3.25Å; V210-F345 HydrophobicContact CG2-CE1 4.19Å; W267-F345 HydrophobicContact CH2-CD2 4.2Å; W267-F345 HydrophobicContact CZ2-CB 4.21Å; W267-F345 AromaticContact CZ2-CD2 3.69Å; W267-F345 HydrophobicContact CZ2-CD2 3.69Å; W267-F345 HydrophobicContact CZ2-CG 4.31Å; F271-F345 WeakPolarHBondContact O-CA 3.29Å; F272-F345 HydrophobicContact CD2-CB 3.43Å; F272-F345 VanDerWaalsContact CD2-CB 3.43Å; F272-F345 HydrophobicContact CE2-CB 3.43Å; F272-F345 VanDerWaalsContact CE2-CB 3.43Å; F272-F345 HydrophobicContact CE2-CG 4.13Å; F272-F345 HydrophobicContact CG-CB 4.42Å; F272-F345 HydrophobicContact CZ-CB 4.39Å; L343-F345 HydrophobicContact CB-CD1 4.37Å; F345-A347 HydrophobicContact CD2-CB 4.1Å; F345-A347 HydrophobicContact CE2-CB 4.13Å; F345-F351 HydrophobicContact CE2-CD1 4.17Å; F345-F351 AromaticContact CE2-CE1 3.9Å; F345-F351 HydrophobicContact CE2-CE1 3.9Å; F345-F351 HydrophobicContact CE2-CE2 4.43Å; F345-F351 HydrophobicContact CE2-CZ 4.04Å; F345-F351 HydrophobicContact CZ-CD1 4.38Å; F345-F351 AromaticContact CZ-CE1 3.77Å; F345-F351 HydrophobicContact CZ-CE1 3.77Å; F345-F351 HydrophobicContact CZ-CZ 4.01Å; F345-F353 HydrophobicContact CE1-CE1 4.37Å; F345-F353 HydrophobicContact CE1-CZ 4.34Å; F345-F353 AromaticContact CZ-CE1 3.91Å; F345-F353 HydrophobicContact CZ-CE1 3.91Å; F345-F353 AromaticContact CZ-CZ 3.84Å; F345-F353 HydrophobicContact CZ-CZ 3.84Å
346	E	96.9	Very high	91.6	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	128.9	172	-179.1	178.8	-176	0	0	109.9	L200 S201 R205 A206 W267 H269 G270 F271	L200-E346 HydrophobicContact CD2-CB 4.36Å; L200-E346 HydrophobicContact CD2-CG 3.7Å; S201-E346 WeakPolarHBondContact CA-OE1 3.42Å; S201-E346 WeakPolarHBondContact CB-OE1 3.45Å; S201-E346 VanDerWaalsContact N-CD 3.32Å; S201-E346 PolarHBondContact N-OE1 2.88Å; S201-E346 PolarHBondContact N-OE2 2.74Å; S201-E346 PolarHBondContact OG-OE1 3.41Å; S201-E346 PolarHBondContact OG-OE2 3.47Å; R205-E346 HydrophobicContact CB-CG 3.78Å; R205-E346 WeakPolarHBondContact CB-OE1 3.32Å; R205-E346 WeakPolarHBondContact CD-OE1 3.26Å; R205-E346 HydrophobicContact CG-CG 4.41Å; A206-E346 WeakPolarHBondContact O-CA 3.35Å; W267-E346 VanDerWaalsContact CE2-O 3.23Å; W267-E346 WeakPolarHBondContact CZ2-O 3.43Å; W267-E346 PolarHBondContact NE1-O 3.36Å; H269-E346 WeakPolarHBondContact CB-O 3.21Å; H269-E346 VanDerWaalsContact O-CD 3.28Å; H269-E346 VanDerWaalsContact O-CG 3.28Å; H269-E346 WeakPolarHBondContact O-CG 3.39Å; G270-E346 WeakPolarHBondContact CA-OE2 3.31Å; F271-E346 HydrophobicContact CB-CB 4.23Å; F271-E346 PolarHBondContact N-OE2 3.2Å; F271-E346 PolarHBondContact O-N 3.2Å
347	A	96.8	Very high	92.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	166	174.4	0	0	0	0	0	110.5	R205 A206 F208 W267 F345 F351	R205-A347 CarbonylContact C-O 3.6Å; R205-A347 WeakPolarHBondContact CA-O 3.46Å; A206-A347 PolarHBondContact N-O 3.34Å; A206-A347 PolarHBondContact O-N 2.92Å; F208-A347 HydrophobicContact CD2-CB 3.8Å; F208-A347 HydrophobicContact CE2-CB 3.79Å; W267-A347 HydrophobicContact CZ2-CB 4.21Å; F345-A347 HydrophobicContact CD2-CB 4.1Å; F345-A347 HydrophobicContact CE2-CB 4.13Å; A347-F351 HydrophobicContact CB-CB 3.91Å; A347-F351 HydrophobicContact CB-CD2 4.27Å; A347-F351 HydrophobicContact CB-CG 4.09Å
348	P	95.9	Very high	93.3	Very high	32 Å²	32	35 Å²	35	21%	0.208	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-46.1	143	163.5	-32	40.4	0	0	0	112.6	F208 D350 F351 L370	F208-P348 WeakPolarHBondContact CE2-O 3.4Å; P348-D350 WeakPolarHBondContact CB-OD1 3.38Å; P348-D350 PolarHBondContact O-N 3.38Å; P348-D350 VanDerWaalsContact O-N 3.16Å; P348-F351 VanDerWaalsContact O-CB 3.32Å; P348-F351 WeakPolarHBondContact O-CB 3.31Å; P348-F351 PolarHBondContact O-N 2.92Å; P348-L370 HydrophobicContact CB-CD2 4.15Å; P348-L370 HydrophobicContact CG-CD2 3.8Å
349	A	93.6	Very high	94.9	Very high	50 Å²	50	37.4 Å²	37.4	41%	0.413	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16	-170.6	0	0	0	0	0	114.6	A206	A206-A349 HydrophobicContact CB-CB 4.35Å
350	D	94.4	Very high	95.5	Very high	108 Å²	108	46.4 Å²	46.4	58%	0.578	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-4.2	174.9	52.8	-12.1	0	0	0	114.2	P348 T352	P348-D350 WeakPolarHBondContact CB-OD1 3.38Å; P348-D350 PolarHBondContact O-N 3.38Å; P348-D350 VanDerWaalsContact O-N 3.16Å; D350-T352 PolarHBondContact O-N 2.92Å
351	F	95.8	Very high	95.6	Very high	10 Å²	10	46.7 Å²	46.7	4%	0.044	25%	0.249	C	C	.	.			trans	-51.1	125.5	175.9	176.8	-87.3	0	0	0	112.1	L149 F208 F345 A347 P348 F353 T369 L370	L149-F351 HydrophobicContact CD2-CZ 4.12Å; F208-F351 HydrophobicContact CD1-CD1 4.34Å; F208-F351 HydrophobicContact CE1-CD1 4.33Å; F208-F351 HydrophobicContact CE2-CB 3.93Å; F208-F351 HydrophobicContact CG-CD1 4.41Å; F208-F351 HydrophobicContact CZ-CB 3.87Å; F208-F351 HydrophobicContact CZ-CD1 4.42Å; F345-F351 HydrophobicContact CE2-CD1 4.17Å; F345-F351 AromaticContact CE2-CE1 3.9Å; F345-F351 HydrophobicContact CE2-CE1 3.9Å; F345-F351 HydrophobicContact CE2-CE2 4.43Å; F345-F351 HydrophobicContact CE2-CZ 4.04Å; F345-F351 HydrophobicContact CZ-CD1 4.38Å; F345-F351 AromaticContact CZ-CE1 3.77Å; F345-F351 HydrophobicContact CZ-CE1 3.77Å; F345-F351 HydrophobicContact CZ-CZ 4.01Å; A347-F351 HydrophobicContact CB-CB 3.91Å; A347-F351 HydrophobicContact CB-CD2 4.27Å; A347-F351 HydrophobicContact CB-CG 4.09Å; P348-F351 VanDerWaalsContact O-CB 3.32Å; P348-F351 WeakPolarHBondContact O-CB 3.31Å; P348-F351 PolarHBondContact O-N 2.92Å; F351-F353 HydrophobicContact CD1-CE2 4.43Å; F351-F353 HydrophobicContact CD1-CZ 4.49Å; F351-F353 AromaticContact CE1-CD1 3.79Å; F351-F353 HydrophobicContact CE1-CD1 3.79Å; F351-F353 HydrophobicContact CE1-CD2 4.23Å; F351-F353 AromaticContact CE1-CE1 3.67Å; F351-F353 HydrophobicContact CE1-CE1 3.67Å; F351-F353 HydrophobicContact CE1-CE2 4.16Å; F351-F353 HydrophobicContact CE1-CG 4.08Å; F351-F353 AromaticContact CE1-CZ 3.9Å; F351-F353 HydrophobicContact CE1-CZ 3.9Å; F351-F353 HydrophobicContact CZ-CD1 4.46Å; F351-F353 HydrophobicContact CZ-CE1 4.4Å; F351-T369 VanDerWaalsContact CD2-O 3.3Å; F351-T369 WeakPolarHBondContact CD2-O 3.4Å; F351-L370 HydrophobicContact CB-CD2 4.3Å; F351-L370 HydrophobicContact CD2-CD2 3.91Å
352	T	95.5	Very high	95.6	Very high	72 Å²	72	52 Å²	52	44%	0.442	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.6	-176	44	0	0	0	0	111.4	D350 G368 T369	D350-T352 PolarHBondContact O-N 2.92Å; T352-G368 CarbonylContact O-C 3.51Å; T352-G368 WeakPolarHBondContact O-CA 3.47Å; T352-T369 PolarHBondContact N-O 3.29Å; T352-T369 PolarHBondContact O-N 2.92Å; T352-T369 PolarHBondContact OG1-O 3.17Å; T352-T369 PolarHBondContact OG1-OG1 3.47Å; T352-T369 VanDerWaalsContact OG1-OG1 3.09Å
353	F	96.4	Very high	95.6	Very high	42 Å²	42	52.6 Å²	52.6	18%	0.184	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	133	173.2	-73.3	-76.9	0	0	0	111.3	F160 F208 V210 F345 F351 L355 L367	F160-F353 HydrophobicContact CB-CD1 4.39Å; F160-F353 HydrophobicContact CB-CE1 4.24Å; F160-F353 HydrophobicContact CB-CZ 4.27Å; F160-F353 HydrophobicContact CD2-CB 3.66Å; F160-F353 HydrophobicContact CD2-CD1 4Å; F160-F353 AromaticContact CD2-CD2 3.52Å; F160-F353 HydrophobicContact CD2-CD2 3.52Å; F160-F353 HydrophobicContact CD2-CE2 4.06Å; F160-F353 AromaticContact CD2-CG 3.46Å; F160-F353 HydrophobicContact CD2-CG 3.46Å; F160-F353 VanDerWaalsContact CD2-CG 3.46Å; F160-F353 HydrophobicContact CE2-CB 3.66Å; F160-F353 HydrophobicContact CE2-CD2 4.15Å; F160-F353 AromaticContact CE2-CG 3.99Å; F160-F353 HydrophobicContact CE2-CG 3.99Å; F160-F353 HydrophobicContact CG-CD1 4.46Å; F160-F353 HydrophobicContact CG-CG 4.33Å; F208-F353 HydrophobicContact CB-CE2 4.4Å; F208-F353 HydrophobicContact CB-CZ 4.06Å; F208-F353 AromaticContact CD1-CE2 3.81Å; F208-F353 HydrophobicContact CD1-CE2 3.81Å; F208-F353 HydrophobicContact CD1-CZ 4.3Å; F208-F353 HydrophobicContact CG-CE2 4.49Å; V210-F353 HydrophobicContact CG2-CD1 4.23Å; V210-F353 HydrophobicContact CG2-CE1 3.32Å; V210-F353 HydrophobicContact CG2-CZ 3.89Å; F345-F353 HydrophobicContact CE1-CE1 4.37Å; F345-F353 HydrophobicContact CE1-CZ 4.34Å; F345-F353 AromaticContact CZ-CE1 3.91Å; F345-F353 HydrophobicContact CZ-CE1 3.91Å; F345-F353 AromaticContact CZ-CZ 3.84Å; F345-F353 HydrophobicContact CZ-CZ 3.84Å; F351-F353 HydrophobicContact CD1-CE2 4.43Å; F351-F353 HydrophobicContact CD1-CZ 4.49Å; F351-F353 AromaticContact CE1-CD1 3.79Å; F351-F353 HydrophobicContact CE1-CD1 3.79Å; F351-F353 HydrophobicContact CE1-CD2 4.23Å; F351-F353 AromaticContact CE1-CE1 3.67Å; F351-F353 HydrophobicContact CE1-CE1 3.67Å; F351-F353 HydrophobicContact CE1-CE2 4.16Å; F351-F353 HydrophobicContact CE1-CG 4.08Å; F351-F353 AromaticContact CE1-CZ 3.9Å; F351-F353 HydrophobicContact CE1-CZ 3.9Å; F351-F353 HydrophobicContact CZ-CD1 4.46Å; F351-F353 HydrophobicContact CZ-CE1 4.4Å; F353-L355 VanDerWaalsContact C-N 3.34Å; F353-L355 HydrophobicContact CB-CB 4.39Å; F353-L355 HydrophobicContact CB-CG 4.46Å; F353-L355 HydrophobicContact CD1-CD1 3.71Å; F353-L355 HydrophobicContact CD1-CG 4.41Å; F353-L355 HydrophobicContact CE1-CD1 4.36Å; F353-L355 HydrophobicContact CG-CD1 4.48Å; F353-L355 PolarHBondContact O-N 3.09Å; F353-L367 WeakPolarHBondContact CD1-O 3.43Å
354	D	93.2	Very high	95.5	Very high	120 Å²	120	52.6 Å²	52.6	64%	0.642	27%	0.272	S	S	*	.			trans	-98.5	58.5	167.9	-173.2	24.2	0	0	0	109.8	L367	D354-L367 PolarHBondContact N-O 2.98Å; D354-L367 VanDerWaalsContact N-O 3.16Å
355	L	95.7	Very high	95.5	Very high	15 Å²	15	56.2 Å²	56.2	8%	0.079	29%	0.289	C	S	.	.			trans	-135.8	153.8	-172.2	-62.2	176.3	0	0	0	112.1	I157 F160 V210 F353 I361 L367	I157-L355 HydrophobicContact CD1-CD1 4.28Å; I157-L355 HydrophobicContact CD1-CD2 4.22Å; I157-L355 HydrophobicContact CG1-CD2 4.19Å; F160-L355 HydrophobicContact CB-CD1 4.23Å; F160-L355 HydrophobicContact CD1-CB 3.89Å; F160-L355 HydrophobicContact CD1-CD1 4.26Å; F160-L355 HydrophobicContact CD2-CB 4.37Å; F160-L355 HydrophobicContact CE1-CB 3.66Å; F160-L355 HydrophobicContact CE2-CB 4.17Å; F160-L355 HydrophobicContact CG-CB 4.24Å; F160-L355 HydrophobicContact CG-CD1 4.08Å; F160-L355 HydrophobicContact CZ-CB 3.82Å; F160-L355 WeakPolarHBondContact CZ-O 3.24Å; V210-L355 HydrophobicContact CG1-CD1 4.37Å; V210-L355 HydrophobicContact CG2-CD1 4.37Å; F353-L355 VanDerWaalsContact C-N 3.34Å; F353-L355 HydrophobicContact CB-CB 4.39Å; F353-L355 HydrophobicContact CB-CG 4.46Å; F353-L355 HydrophobicContact CD1-CD1 3.71Å; F353-L355 HydrophobicContact CD1-CG 4.41Å; F353-L355 HydrophobicContact CE1-CD1 4.36Å; F353-L355 HydrophobicContact CG-CD1 4.48Å; F353-L355 PolarHBondContact O-N 3.09Å; L355-I361 HydrophobicContact CD2-CD1 3.76Å; L355-L367 HydrophobicContact CD1-CB 4.38Å; L355-L367 HydrophobicContact CD1-CD2 4.11Å; L355-L367 HydrophobicContact CD2-CD2 4.07Å; L355-L367 WeakPolarHBondContact CG-O 3.35Å
356	Q	94.6	Very high	95.5	Very high	143 Å²	143	57.8 Å²	57.8	67%	0.668	30%	0.302	S	S	*	.			trans	-126.2	140.4	170.5	-59.8	-174.5	3.8	0	0	111.3	G358 Q359	Q356-G358 PolarHBondContact O-N 2.91Å; Q356-Q359 HydrophobicContact CB-CB 4.3Å; Q356-Q359 WeakPolarHBondContact O-CB 3.33Å; Q356-Q359 PolarHBondContact O-N 3.13Å
357	P	91.2	Very high	95.4	Very high	103 Å²	103	57.7 Å²	57.7	67%	0.669	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	123.8	176.5	-24.4	35.2	0	0	0	111.3	F160	F160-P357 HydrophobicContact CE1-CG 3.97Å
358	G	91.5	Very high	95.3	Very high	25 Å²	25	57.8 Å²	57.8	26%	0.258	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	6	-174.8	0	0	0	0	0	115.2	R156 I157 Q356	R156-G358 VanDerWaalsContact CZ-O 3.29Å; R156-G358 PolarHBondContact NE-O 3.11Å; R156-G358 PolarHBondContact NH2-O 3.14Å; I157-G358 WeakPolarHBondContact O-CA 3.43Å; I157-G358 PolarHBondContact O-N 3.5Å; Q356-G358 PolarHBondContact O-N 2.91Å
359	Q	95.7	Very high	95	Very high	64 Å²	64	59.9 Å²	59.9	30%	0.299	32%	0.315	S	S	.	.			trans	-59.9	141.2	166.6	176.4	171.5	-11.8	0	0	110.7	R156 I157 Q356	R156-Q359 WeakPolarHBondContact CA-O 3.37Å; R156-Q359 WeakPolarHBondContact CG-O 3.35Å; I157-Q359 HydrophobicContact CG1-CB 4.38Å; I157-Q359 PolarHBondContact N-O 3.38Å; Q356-Q359 HydrophobicContact CB-CB 4.3Å; Q356-Q359 WeakPolarHBondContact O-CB 3.33Å; Q356-Q359 PolarHBondContact O-N 3.13Å
360	R	96.4	Very high	94.6	Very high	190 Å²	190	62.7 Å²	62.7	72%	0.717	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	138.2	164	-86.3	-172.8	161.6	-173.5	-8.9	108.9	G155	G155-R360 WeakPolarHBondContact O-CA 3.29Å
361	I	96.7	Very high	94.6	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.8	-178.9	-161.6	163.2	0	0	0	109.9	D154 G155 I157 V212 L355 E365 L367	D154-I361 WeakPolarHBondContact CA-O 3.31Å; G155-I361 PolarHBondContact N-O 3.22Å; G155-I361 PolarHBondContact O-N 3.06Å; I157-I361 HydrophobicContact CD1-CB 4.41Å; I157-I361 HydrophobicContact CD1-CD1 4.2Å; I157-I361 HydrophobicContact CD1-CG2 3.84Å; I157-I361 HydrophobicContact CG1-CG2 4.32Å; V212-I361 HydrophobicContact CG1-CG2 4.21Å; L355-I361 HydrophobicContact CD2-CD1 3.76Å; I361-E365 WeakPolarHBondContact CA-OE2 3.49Å; I361-E365 HydrophobicContact CD1-CB 4.46Å; I361-E365 HydrophobicContact CG1-CB 3.96Å; I361-E365 WeakPolarHBondContact CG1-OE2 3.46Å; I361-L367 HydrophobicContact CD1-CD2 3.41Å; I361-L367 VanDerWaalsContact CD1-CD2 3.41Å
362	R	97	Very high	94.5	Very high	112 Å²	112	63.1 Å²	63.1	42%	0.423	32%	0.323	S	S	.	.			trans	-114.2	152.6	175.9	-65	171.1	159.6	170	-10.8	111.1	E116 S151 A153 D154 G364 E365	E116-R362 IonicContact OE1-NH2 2.78Å; E116-R362 PolarHBondContact OE1-NH2 3.3Å; S151-R362 VanDerWaalsContact CB-O 3.27Å; S151-R362 WeakPolarHBondContact CB-O 3.49Å; A153-R362 CarbonylContact O-C 3.57Å; D154-R362 VanDerWaalsContact OD1-CA 3.3Å; D154-R362 WeakPolarHBondContact OD1-CA 3.41Å; R362-G364 PolarHBondContact O-N 3.29Å; R362-E365 HydrophobicContact CB-CG 4.09Å; R362-E365 WeakPolarHBondContact CD-OE1 3.41Å; R362-E365 PolarHBondContact N-OE2 3.39Å; R362-E365 WeakPolarHBondContact O-CB 3.24Å; R362-E365 PolarHBondContact O-N 3.49Å; R362-E365 VanDerWaalsContact O-N 3.14Å
363	M	96.8	Very high	94.4	Very high	12 Å²	12	62.6 Å²	62.6	6%	0.059	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	130.4	172.8	-171.4	-79.2	-72.1	0	0	110.2	R141 S151 A153 D154 H223	R141-M363 HydrophobicContact CB-CE 3.61Å; R141-M363 WeakPolarHBondContact CD-O 3.25Å; R141-M363 HydrophobicContact CG-CE 4.17Å; S151-M363 WeakPolarHBondContact O-CA 3.47Å; A153-M363 PolarHBondContact O-N 3.23Å; D154-M363 PolarHBondContact OD1-N 3.14Å; H223-M363 HydrophobicContact CB-CG 3.77Å; H223-M363 HydrophobicContact CB-SD 3.81Å
364	G	96.6	Very high	94.3	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-13.9	-178.8	0	0	0	0	0	115.8	C144 T150 S151 R362	C144-G364 WeakPolarHBondContact CB-O 3.42Å; C144-G364 PolarHBondContact N-O 2.89Å; T150-G364 WeakPolarHBondContact CG2-O 3.38Å; S151-G364 PolarHBondContact O-N 2.85Å; R362-G364 PolarHBondContact O-N 3.29Å
365	E	97.3	Very high	94.4	Very high	76 Å²	76	60.3 Å²	60.3	36%	0.355	31%	0.305	S	S	.	.	S	Bend	trans	-68	150.3	171.9	-68.7	175.3	171.4	0	0	110.8	T150 S151 I361 R362	T150-E365 CarbonylContact C-O 3.58Å; T150-E365 WeakPolarHBondContact CA-O 3.46Å; T150-E365 WeakPolarHBondContact CB-O 3.27Å; S151-E365 PolarHBondContact N-O 2.87Å; I361-E365 WeakPolarHBondContact CA-OE2 3.49Å; I361-E365 HydrophobicContact CD1-CB 4.46Å; I361-E365 HydrophobicContact CG1-CB 3.96Å; I361-E365 WeakPolarHBondContact CG1-OE2 3.46Å; R362-E365 HydrophobicContact CB-CG 4.09Å; R362-E365 WeakPolarHBondContact CD-OE1 3.41Å; R362-E365 PolarHBondContact N-OE2 3.39Å; R362-E365 WeakPolarHBondContact O-CB 3.24Å; R362-E365 PolarHBondContact O-N 3.49Å; R362-E365 VanDerWaalsContact O-N 3.14Å
366	A	97.1	Very high	94.3	Very high	33 Å²	33	63.3 Å²	63.3	27%	0.273	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-66.4	144.4	-179.4	0	0	0	0	0	111.9
367	L	96.4	Very high	94.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.295	C	S	.	.			trans	-98	-21.9	169.8	-62.7	-177.2	0	0	0	112.6	L149 T150 V210 L343 F353 D354 L355 I361	L149-L367 HydrophobicContact CD2-CB 4.25Å; L149-L367 HydrophobicContact CD2-CD1 4.08Å; L149-L367 HydrophobicContact CG-CB 4.41Å; L149-L367 HydrophobicContact CG-CD1 4.09Å; L149-L367 PolarHBondContact O-N 3.01Å; T150-L367 WeakPolarHBondContact O-CD1 3.38Å; V210-L367 HydrophobicContact CG2-CD1 4.33Å; L343-L367 HydrophobicContact CD1-CD1 3.77Å; F353-L367 WeakPolarHBondContact CD1-O 3.43Å; D354-L367 PolarHBondContact N-O 2.98Å; D354-L367 VanDerWaalsContact N-O 3.16Å; L355-L367 HydrophobicContact CD1-CB 4.38Å; L355-L367 HydrophobicContact CD1-CD2 4.11Å; L355-L367 HydrophobicContact CD2-CD2 4.07Å; L355-L367 WeakPolarHBondContact CG-O 3.35Å; I361-L367 HydrophobicContact CD1-CD2 3.41Å; I361-L367 VanDerWaalsContact CD1-CD2 3.41Å
368	G	93.6	Very high	94.5	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.1	-172.5	-175.8	0	0	0	0	0	113.2	S147 T352	S147-G368 PolarHBondContact OG-O 3.34Å; T352-G368 CarbonylContact O-C 3.51Å; T352-G368 WeakPolarHBondContact O-CA 3.47Å
369	T	90.8	Very high	94.8	Very high	77 Å²	77	56.6 Å²	56.6	47%	0.472	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.1	-175.9	42.9	0	0	0	0	110.8	F351 T352	F351-T369 VanDerWaalsContact CD2-O 3.3Å; F351-T369 WeakPolarHBondContact CD2-O 3.4Å; T352-T369 PolarHBondContact N-O 3.29Å; T352-T369 PolarHBondContact O-N 2.92Å; T352-T369 PolarHBondContact OG1-O 3.17Å; T352-T369 PolarHBondContact OG1-OG1 3.47Å; T352-T369 VanDerWaalsContact OG1-OG1 3.09Å
370	L	83.3	Confident	94.7	Very high	109 Å²	109	55.9 Å²	55.9	57%	0.571	26%	0.264	S	S	*	.			trans	-84.8	0	161.3	-60	167.6	0	0	0	107.5	H269 P348 F351	H269-L370 WeakPolarHBondContact NE2-CD1 3.39Å; P348-L370 HydrophobicContact CB-CD2 4.15Å; P348-L370 HydrophobicContact CG-CD2 3.8Å; F351-L370 HydrophobicContact CB-CD2 4.3Å; F351-L370 HydrophobicContact CD2-CD2 3.91Å

Retrieved 370 of 370 residues in 749 ms (Link to these results)

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