A0A096MK67_RAT Loading...

Follistatin-like 5

AlphaFold DB , UniProt , Accession A0A096MK67, Species RAT (Rattus norvegicus, Rat), Gene Fstl5, Length 847 aa.

						>A0A096MK67_RAT|A0A096MK67|Fstl5
MFKCWSAVLILGFIFLASEGRPTKESGYGLKYYQPLTRLRHKQEKSQESSRIKEFLIHDGPFGSCENKYCGLGRHCVISRETRHAECTCMDLCKQHYKPVCGSDGEFYENHCEVHRAACLKKQKITIVHNEDCFFKGDNCMTTEYSKMKSMLLDLQNQKYITQENENPNSDDISRKKTLVDQMFKYFDADSNGLVDINELTQVIKQEELNKDLSDCTLYDLLKYDDFNADKHLALEEFYRAFQVIQLSLPEDQRVSITAATVGQSAVLSCAVVGTLRPPIIWKRNNIVLNNLDLEDINDFGDDGSLYITKVTTVHMGNYTCYADGYEDVHQTHIFQVNVPPVIRVYPESQAREPGVTASLRCHAEGIPDPQLGWLKNGIDITPKLSKQLTLQANGSEVHISNVRYEDTGAYTCIARNEAGVDEDISSLFVEDSARKTLANILWREEGLGIGNMFYVFYDDGVKVIQPTECEFQRHIKPSEKLLGFQDEVCPKDEEDEVQRCVWASAVNVKDKFIYVAQPTLDRILIVDVQSQKVVQAVSTDPVPVKLHYDKSHDQVWVLSWGSMEKTSPTLQVITLASGNVPHHTIHTQPVGKQFDRVDDFFIPTPTLIITHMRFGFILHKDESALHKIDLETMSYIKTISLKDSKCIPLSLAYSHLGGYYFISCKPDITGAIPPQLVVDSVTDSIIGSNSDVTGTPYVSPDGHYLVSVNDVKGLVRVQYITIRGEILDAFDIHTNLHISDLAFQPSFTEAHQYNIYGSSSQQTDVLFVELSTGKVKMIKSLKEPLKTEDWPWSPKNRHIQGSGLFGQYLMTPSKDSLFILDGRLNKLNCEITEVQKGNTVVWVGDA
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	32.7	Very low	232 Å²	232	157 Å²	157	100%	1.143	82%	0.817	S	S	*	*				0	113.1	0	-79.2	174.9	161.7	0	0	105.8
2	F	37	Very low	32	Very low	206 Å²	206	149.3 Å²	149.3	90%	0.904	80%	0.804	S	S	*	*			cis	-139	142	35.2	-98.9	-101.8	0	0	0	111.1
3	K	35.4	Very low	31.6	Very low	194 Å²	194	152.9 Å²	152.9	84%	0.843	81%	0.809	S	S	*	*			trans	-85.7	150.4	161.4	-91.2	178.8	169.8	178.5	0	108.9
4	C	33.3	Very low	31	Very low	119 Å²	119	153.2 Å²	153.2	80%	0.804	81%	0.808	S	S	*	*			trans	131	143.5	146.9	-80.6	0	0	0	0	111.5
5	W	33.5	Very low	30.6	Very low	232 Å²	232	155.7 Å²	155.7	88%	0.879	81%	0.81	S	S	*	*			cis	-176.6	140.7	-25.1	-131.1	27.1	0	0	0	103
6	S	34.3	Very low	30.4	Very low	101 Å²	101	156.1 Å²	156.1	71%	0.706	81%	0.813	S	S	*	*			trans	65.3	145.5	147.7	-41.7	0	0	0	0	118.1
7	A	32.7	Very low	30.1	Very low	84 Å²	84	153.5 Å²	153.5	69%	0.694	82%	0.819	S	S	*	*			cis	-179.3	149.9	-5.7	0	0	0	0	0	105.6
8	V	31.4	Very low	29.9	Very low	125 Å²	125	150.9 Å²	150.9	76%	0.758	82%	0.815	S	S	*	*			trans	87	103.2	136.7	167.8	0	0	0	0	120.1
9	L	29.9	Very low	29.5	Very low	145 Å²	145	153.6 Å²	153.6	76%	0.759	82%	0.822	S	S	*	*				91.2	128	118.1	-81.1	178.3	0	0	0	123.2
10	I	29.8	Very low	29.2	Very low	127 Å²	127	149.7 Å²	149.7	65%	0.651	82%	0.82	S	S	*	*			trans	103	97.5	136.8	-66.8	157.7	0	0	0	117.9
11	L	26.9	Very low	28.8	Very low	162 Å²	162	154.6 Å²	154.6	85%	0.848	83%	0.826	S	S	*	*				47.2	127.7	123.9	-70.7	140	0	0	0	119.7
12	G	25	Very low	28.4	Very low	64 Å²	64	149 Å²	149	66%	0.66	81%	0.807	S	S	*	*			trans	153.1	92.4	136.1	0	0	0	0	0	116.7
13	F	26.3	Very low	27.8	Very low	197 Å²	197	145.5 Å²	145.5	86%	0.864	80%	0.803	S	S	*	*			trans	63.8	96	144.4	-70	-81.5	0	0	0	120.7
14	I	22.8	Very low	27.3	Very low	157 Å²	157	146.2 Å²	146.2	81%	0.805	81%	0.806	S	S	*	*			trans	-16.8	120.6	134.1	-59.1	163.2	0	0	0	113.8
15	F	25.6	Very low	27	Very low	191 Å²	191	149.8 Å²	149.8	84%	0.838	81%	0.811	S	S	*	*			trans	-157.9	144.6	139.9	-106.4	-73.2	0	0	0	110.9
16	L	28.1	Very low	26.6	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	81%	0.809	S	S	*	*			trans	89.1	82.4	166.1	-58.6	161.8	0	0	0	116.8
17	A	24.6	Very low	26.4	Very low	111 Å²	111	143 Å²	143	92%	0.917	81%	0.81	S	S	*	*			trans	-75.9	122.6	149.8	0	0	0	0	0	109.3
18	S	25.6	Very low	26.1	Very low	108 Å²	108	150.3 Å²	150.3	76%	0.755	82%	0.821	S	S	*	*			trans	-109.3	129.3	165.5	56.7	0	0	0	0	109.5
19	E	23.3	Very low	25.9	Very low	202 Å²	202	147.7 Å²	147.7	94%	0.944	82%	0.819	S	S	*	*			trans	39.7	102.3	148.3	-64.9	-178.3	161.3	0	0	118.9
20	G	24.3	Very low	25.7	Very low	75 Å²	75	147.2 Å²	147.2	77%	0.773	82%	0.817	S	S	*	*			trans	-133.4	108.6	164.6	0	0	0	0	0	110.6
21	R	20.6	Very low	25.5	Very low	252 Å²	252	151.1 Å²	151.1	95%	0.951	83%	0.829	S	S	*	*			trans	-69	132.6	174.1	-167.6	-175.7	-160.3	-179.3	6	110.4
22	P	26.7	Very low	25.5	Very low	115 Å²	115	152 Å²	152	75%	0.747	82%	0.822	S	S	*	*			trans	-121.1	124.8	156.1	24.8	-6.1	0	0	0	112.9
23	T	24.7	Very low	25.6	Very low	132 Å²	132	157 Å²	157	81%	0.81	82%	0.822	S	S	*	*			trans	2.9	135.2	147.3	45.2	0	0	0	0	121.4
24	K	23.8	Very low	25.6	Very low	210 Å²	210	156.1 Å²	156.1	91%	0.913	82%	0.821	S	S	*	*			trans	-53.2	127.6	163.5	-68.2	172	169.6	-179.7	0	112.2
25	E	27.6	Very low	25.9	Very low	193 Å²	193	154 Å²	154	90%	0.902	82%	0.817	S	S	*	*			trans	-121.4	129.8	151.9	-84.9	-176.7	167.7	0	0	109.6
26	S	25.1	Very low	25.9	Very low	120 Å²	120	153.1 Å²	153.1	84%	0.839	82%	0.821	S	S	*	*			trans	-78.5	106.6	178.6	44	0	0	0	0	110.1
27	G	28.8	Very low	25.8	Very low	71 Å²	71	151.6 Å²	151.6	73%	0.732	82%	0.818	S	S	*	*			trans	-111.3	126.9	167.2	0	0	0	0	0	110.1	G29	G27-G29 PolarHBondContact O-N 3.16Å
28	Y	26.8	Very low	25.9	Very low	238 Å²	238	158 Å²	158	93%	0.933	82%	0.818	S	S	*	*			trans	-58.2	103	174.9	-75.6	-102	0	0	0	110.1
29	G	26.8	Very low	25.9	Very low	69 Å²	69	161 Å²	161	71%	0.711	83%	0.826	S	S	*	*			trans	-84.2	120.2	174	0	0	0	0	0	110.8	G27 K31	G27-G29 PolarHBondContact O-N 3.16Å; G29-K31 PolarHBondContact O-N 3.19Å
30	L	27.4	Very low	26	Very low	135 Å²	135	163 Å²	163	71%	0.707	82%	0.824	S	S	*	*			trans	-44.6	127.2	163.4	-117.1	78.3	0	0	0	109.5	Y32	L30-Y32 HydrophobicContact CB-CD2 4.29Å; L30-Y32 HydrophobicContact CB-CE2 3.87Å; L30-Y32 WeakPolarHBondContact O-CD2 3.47Å; L30-Y32 PolarHBondContact O-N 3.02Å
31	K	24.6	Very low	26.2	Very low	210 Å²	210	168.4 Å²	168.4	91%	0.913	83%	0.829	S	S	*	*			trans	-69.4	99.3	170.5	-81.7	179.8	178.5	171.7	0	108.4	G29	G29-K31 PolarHBondContact O-N 3.19Å
32	Y	28.2	Very low	26.3	Very low	181 Å²	181	165.5 Å²	165.5	71%	0.71	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.1	126.6	175.9	-77	-86.1	0	0	0	111.2	L30 Q34	L30-Y32 HydrophobicContact CB-CD2 4.29Å; L30-Y32 HydrophobicContact CB-CE2 3.87Å; L30-Y32 WeakPolarHBondContact O-CD2 3.47Å; L30-Y32 PolarHBondContact O-N 3.02Å; Y32-Q34 PolarHBondContact O-N 2.99Å
33	Y	26.9	Very low	26.2	Very low	168 Å²	168	168.5 Å²	168.5	66%	0.659	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-54.4	126.4	174.8	-155.1	-102.9	0	0	0	110.9
34	Q	24.7	Very low	26.3	Very low	179 Å²	179	170.3 Å²	170.3	84%	0.836	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-92.7	117.3	172.3	-77.6	-178	-37.2	0	0	109.3	Y32	Y32-Q34 PolarHBondContact O-N 2.99Å
35	P	29.2	Very low	26.3	Very low	112 Å²	112	170.1 Å²	170.1	73%	0.727	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-75.8	135	175.5	-5.6	21.7	0	0	0	110.9	T37	P35-T37 PolarHBondContact O-N 2.77Å
36	L	27.2	Very low	26.4	Very low	173 Å²	173	166.5 Å²	166.5	91%	0.906	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-66.2	127.5	172.1	-77.8	156.7	0	0	0	110.5
37	T	26.1	Very low	26.3	Very low	130 Å²	130	169.7 Å²	169.7	80%	0.798	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-55.9	127	175.7	39.5	0	0	0	0	114.3	P35	P35-T37 PolarHBondContact O-N 2.77Å
38	R	25.4	Very low	26.2	Very low	244 Å²	244	175.4 Å²	175.4	92%	0.921	83%	0.831	S	S	*	*			trans	166.2	142	148.6	-93.8	165.3	-173.4	-158.9	3.2	106.6
39	L	26.2	Very low	26.2	Very low	173 Å²	173	169.1 Å²	169.1	91%	0.906	82%	0.822	S	S	*	*			cis	-125.3	127.3	32.2	-72.6	135.8	0	0	0	111.2
40	R	25.4	Very low	26.1	Very low	244 Å²	244	170.4 Å²	170.4	92%	0.921	82%	0.82	S	S	*	*			trans	-90.8	123.4	162.4	-92.8	-178.3	173.2	172.6	-1.5	108.2	K42	R40-K42 PolarHBondContact O-N 2.62Å
41	H	27.3	Very low	26	Very low	187 Å²	187	175.1 Å²	175.1	87%	0.866	83%	0.828	S	S	*	*			trans	-59.3	122.1	148.2	-83.8	-77.9	0	0	0	107.2	Q43	H41-Q43 VanDerWaalsContact C-N 3.3Å; H41-Q43 PolarHBondContact O-N 3.12Å
42	K	23.2	Very low	26.3	Very low	191 Å²	191	173.4 Å²	173.4	83%	0.83	83%	0.827	S	S	*	*			trans	-62.7	88.8	-179.5	-159	-175.9	-174.1	-169.7	0	108.2	R40 E44	R40-K42 PolarHBondContact O-N 2.62Å; K42-E44 PolarHBondContact O-N 3.1Å; K42-E44 VanDerWaalsContact O-N 3.12Å
43	Q	25.4	Very low	26.1	Very low	178 Å²	178	173.7 Å²	173.7	83%	0.832	83%	0.832	S	S	*	*			trans	-65.5	107.7	161.1	-91.1	-179.7	-18.9	0	0	106.5	H41 K45	H41-Q43 VanDerWaalsContact C-N 3.3Å; H41-Q43 PolarHBondContact O-N 3.12Å; Q43-K45 PolarHBondContact O-N 2.95Å
44	E	26.8	Very low	25.9	Very low	170 Å²	170	173.4 Å²	173.4	79%	0.794	84%	0.837	S	S	*	*			trans	-57.4	128.6	167.6	-73	-175.7	149.2	0	0	109	K42 S46	K42-E44 PolarHBondContact O-N 3.1Å; K42-E44 VanDerWaalsContact O-N 3.12Å; E44-S46 PolarHBondContact O-N 3.43Å; E44-S46 VanDerWaalsContact O-N 3.13Å
45	K	23.5	Very low	26	Very low	207 Å²	207	173.4 Å²	173.4	90%	0.9	83%	0.834	S	S	*	*			trans	-63.9	109.8	-178.2	-71.9	176.1	175.1	177.7	0	109.5	Q43	Q43-K45 PolarHBondContact O-N 2.95Å
46	S	29.1	Very low	25.8	Very low	116 Å²	116	176 Å²	176	81%	0.811	84%	0.841	S	S	*	*			trans	-78.8	121.5	153.5	51.6	0	0	0	0	108.8	E44 E48	E44-S46 PolarHBondContact O-N 3.43Å; E44-S46 VanDerWaalsContact O-N 3.13Å; S46-E48 PolarHBondContact O-N 2.89Å
47	Q	23	Very low	25.9	Very low	188 Å²	188	174.2 Å²	174.2	88%	0.879	83%	0.831	S	S	*	*			trans	-72.1	113.8	165.4	-76.4	172.5	-48.8	0	0	108
48	E	27.9	Very low	26	Very low	191 Å²	191	177 Å²	177	89%	0.893	84%	0.835	S	S	*	*			trans	-165	116.6	141	-112.5	169.1	-174	0	0	113.3	S46	S46-E48 PolarHBondContact O-N 2.89Å
49	S	26.9	Very low	26.3	Very low	105 Å²	105	171.7 Å²	171.7	73%	0.734	82%	0.824	S	S	*	*			trans	59.9	102.9	143.5	-140.5	0	0	0	0	123
50	S	24.8	Very low	26.7	Very low	96 Å²	96	166 Å²	166	67%	0.671	81%	0.808	S	S	*	*				72.7	114	114.3	-56.6	0	0	0	0	122.7
51	R	24.6	Very low	27.8	Very low	235 Å²	235	159.5 Å²	159.5	89%	0.887	80%	0.798	S	S	*	*			trans	66.2	103.6	134.2	-64.9	-177.9	-178.7	-175	1.2	118.3
52	I	30.7	Very low	28.6	Very low	174 Å²	174	159.5 Å²	159.5	89%	0.892	80%	0.795	S	S	*	*				-148.6	129.6	121.5	-86.2	133.9	0	0	0	107.5
53	K	23.3	Very low	29.9	Very low	186 Å²	186	151.4 Å²	151.4	81%	0.809	77%	0.766	S	S	*	*			trans	-85.1	162.2	172.3	-88.4	178.9	169.4	-177.7	0	109.7
54	E	22.9	Very low	32.2	Very low	163 Å²	163	145.3 Å²	145.3	76%	0.762	74%	0.743	S	S	*	*			trans	78.2	129	162.2	-82.1	168.6	-164.7	0	0	115.1
55	F	27.1	Very low	34.7	Very low	178 Å²	178	139.3 Å²	139.3	78%	0.781	72%	0.72	S	S	*	*			cis	-148.2	148.4	23.8	-107.8	-92.8	0	0	0	110.4	I57	F55-I57 PolarHBondContact O-N 3.09Å
56	L	25.7	Very low	37.1	Very low	166 Å²	166	137.4 Å²	137.4	87%	0.869	71%	0.714	S	S	*	*			trans	-72.5	112.5	170.6	-76.4	149.2	0	0	0	110.5
57	I	29.6	Very low	38.9	Very low	137 Å²	137	138.9 Å²	138.9	70%	0.703	71%	0.713	S	S	*	*			trans	-129.6	118.1	160	-60.2	178.8	0	0	0	106.7	F55 D59	F55-I57 PolarHBondContact O-N 3.09Å; I57-D59 PolarHBondContact O-N 3.25Å
58	H	26.5	Very low	41.1	Very low	189 Å²	189	134.5 Å²	134.5	88%	0.875	69%	0.691	S	S	*	*			trans	-71.3	99.8	175.7	-84.5	-62.6	0	0	0	109.5
59	D	33.5	Very low	43.1	Very low	131 Å²	131	129.1 Å²	129.1	70%	0.701	66%	0.663	S	S	*	*			trans	-89.3	134.6	169	-84	-31.8	0	0	0	110.4	I57	I57-D59 PolarHBondContact O-N 3.25Å
60	G	33.7	Very low	45.6	Very low	55 Å²	55	124.9 Å²	124.9	57%	0.567	63%	0.633	S	S	*	*			trans	-67.5	175.5	-178	0	0	0	0	0	114.7	F62	G60-F62 PolarHBondContact O-N 3.39Å
61	P	48.3	Very low	47.8	Very low	107 Å²	107	121.2 Å²	121.2	70%	0.695	61%	0.61	S	S	*	*	S	Bend	trans	-75.6	4.5	-162.1	-0.7	14.5	0	0	0	115.8
62	F	43.7	Very low	50.2	Low	186 Å²	186	111.6 Å²	111.6	82%	0.816	58%	0.576	S	S	*	*	S	Bend	trans	-106.1	76.1	178.6	-64.9	-78.5	0	0	0	109.4	G60	G60-F62 PolarHBondContact O-N 3.39Å
63	G	51.8	Low	52.6	Low	21 Å²	21	103.6 Å²	103.6	22%	0.216	54%	0.537	C	S	.	.	S	Bend	trans	172.6	-10.9	179.3	0	0	0	0	0	116.6
64	S	71.9	Confident	55.7	Low	51 Å²	51	99.9 Å²	99.9	36%	0.357	52%	0.518	S	S	.	.			trans	-92.6	148	-177.8	80	0	0	0	0	112.8	E66	S64-E66 PolarHBondContact O-N 3.46Å; S64-E66 VanDerWaalsContact OG-CB 3.24Å; S64-E66 WeakPolarHBondContact OG-CB 3.35Å; S64-E66 PolarHBondContact OG-N 3.25Å
65	C	80.2	Confident	58.7	Low	44 Å²	44	95.1 Å²	95.1	30%	0.297	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-72.1	5.6	169.7	-77.1	0	0	0	0	113.7	N67 K68 C76 V77	C65-N67 VanDerWaalsContact C-N 3.28Å; C65-N67 PolarHBondContact O-N 3.45Å; C65-K68 PolarHBondContact O-N 2.79Å; C65-C76 WeakPolarHBondContact CA-SG 3.17Å; C65-C76 HydrophobicContact CB-CB 3.59Å; C65-C76 WeakPolarHBondContact CB-SG 3.17Å; C65-C76 WeakPolarHBondContact SG-CB 3.42Å; C65-C76 PolarHBondContact SG-O 3.28Å; C65-C76 CovalentContact SG-SG 2.04Å; C65-C76 PolarHBondContact SG-SG 2.8Å; C65-V77 PolarHBondContact SG-N 3.43Å
66	E	73.2	Confident	61.5	Low	167 Å²	167	88.1 Å²	88.1	78%	0.78	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-67.1	-29.1	-168.5	-155.9	161.3	-160	0	0	112.7	S64	S64-E66 PolarHBondContact O-N 3.46Å; S64-E66 VanDerWaalsContact OG-CB 3.24Å; S64-E66 WeakPolarHBondContact OG-CB 3.35Å; S64-E66 PolarHBondContact OG-N 3.25Å
67	N	67.8	Low	64.5	Low	147 Å²	147	82.5 Å²	82.5	79%	0.786	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-121.2	8.6	178.4	-63.1	-30.2	0	0	0	113.8	C65	C65-N67 VanDerWaalsContact C-N 3.28Å; C65-N67 PolarHBondContact O-N 3.45Å
68	K	70	Confident	67.3	Low	95 Å²	95	80.5 Å²	80.5	41%	0.413	43%	0.43	S	S	.	.			trans	-99.5	105	-176.5	-173.4	166.7	-175.5	155.9	0	111	C65 A85 C87	C65-K68 PolarHBondContact O-N 2.79Å; K68-A85 HydrophobicContact CB-CB 4.36Å; K68-A85 HydrophobicContact CD-CB 3.6Å; K68-A85 WeakPolarHBondContact CD-O 3.49Å; K68-A85 WeakPolarHBondContact CE-O 3.49Å; K68-A85 PolarHBondContact NZ-O 3.03Å; K68-C87 VanDerWaalsContact CE-SG 3.53Å
69	Y	69.9	Low	69.9	Low	78 Å²	78	72.2 Å²	72.2	31%	0.306	39%	0.394	S	S	.	.			trans	-77.8	135.7	169.7	-176	-104.2	0	0	0	110.8	G71 Y307 T309	Y69-G71 VanDerWaalsContact CE1-CA 3.4Å; Y69-G71 VanDerWaalsContact CE1-N 3.3Å; Y69-Y307 HydrophobicContact CE1-CD1 4.25Å; Y69-Y307 HydrophobicContact CE1-CG 4.4Å; Y69-Y307 AromaticContact CE2-CD1 3.88Å; Y69-Y307 HydrophobicContact CE2-CD1 3.88Å; Y69-Y307 AromaticContact CE2-CE1 3.99Å; Y69-Y307 HydrophobicContact CE2-CE1 3.99Å; Y69-Y307 AromaticContact CZ-CD1 3.65Å; Y69-T309 HydrophobicContact CD1-CG2 3.9Å; Y69-T309 HydrophobicContact CE1-CG2 4.44Å
70	C	78.3	Confident	72.1	Confident	17 Å²	17	77.9 Å²	77.9	12%	0.115	41%	0.405	C	S	.	.			trans	-110.6	4.5	-174.7	-75.2	0	0	0	0	115.6	R74 C76 C87	C70-R74 HydrophobicContact CB-CB 3.92Å; C70-R74 WeakPolarHBondContact O-CB 3.46Å; C70-R74 VanDerWaalsContact O-CD 3.27Å; C70-R74 WeakPolarHBondContact O-CD 3.49Å; C70-C76 WeakPolarHBondContact SG-CA 3.24Å; C70-C76 WeakPolarHBondContact SG-CB 3.35Å; C70-C76 PolarHBondContact SG-N 3.17Å; C70-C76 VanDerWaalsContact SG-N 3.41Å; C70-C87 WeakPolarHBondContact CA-SG 3.46Å; C70-C87 HydrophobicContact CB-CB 3.52Å; C70-C87 WeakPolarHBondContact CB-SG 3.34Å; C70-C87 WeakPolarHBondContact SG-CA 3.49Å; C70-C87 WeakPolarHBondContact SG-CB 3.46Å; C70-C87 CovalentContact SG-SG 2.03Å; C70-C87 PolarHBondContact SG-SG 3.22Å
71	G	70.9	Confident	74.4	Confident	18 Å²	18	84 Å²	84	19%	0.186	42%	0.419	C	S	.	.			trans	71.8	171.6	-173.3	0	0	0	0	0	112.9	Y69 R74	Y69-G71 VanDerWaalsContact CE1-CA 3.4Å; Y69-G71 VanDerWaalsContact CE1-N 3.3Å; G71-R74 PolarHBondContact O-N 3.03Å
72	L	75.5	Confident	76	Confident	34 Å²	34	82.5 Å²	82.5	18%	0.178	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	146	-177.8	-58.7	172.3	0	0	0	111.5	R74 H115 D299 F300	L72-R74 PolarHBondContact O-N 2.69Å; L72-H115 HydrophobicContact CB-CB 3.79Å; L72-D299 HydrophobicContact CD1-CB 3.92Å; L72-F300 WeakPolarHBondContact CD1-O 3.23Å
73	G	81.6	Confident	77.7	Confident	6 Å²	6	82.4 Å²	82.4	6%	0.062	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	9.1	-177.4	0	0	0	0	0	114.6	C89 M90	G73-C89 CarbonylContact O-C 3.54Å; G73-C89 WeakPolarHBondContact O-CA 3.46Å; G73-M90 PolarHBondContact O-N 2.86Å
74	R	87.1	Confident	79	Confident	108 Å²	108	86.9 Å²	86.9	41%	0.408	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.8	179.3	-64.7	179.3	-174.7	92.4	-1.9	111.1	C70 G71 L72 T88 C119	C70-R74 HydrophobicContact CB-CB 3.92Å; C70-R74 WeakPolarHBondContact O-CB 3.46Å; C70-R74 VanDerWaalsContact O-CD 3.27Å; C70-R74 WeakPolarHBondContact O-CD 3.49Å; G71-R74 PolarHBondContact O-N 3.03Å; L72-R74 PolarHBondContact O-N 2.69Å; R74-T88 CarbonylContact C-O 3.24Å; R74-T88 WeakPolarHBondContact CA-O 3.14Å; R74-T88 VanDerWaalsContact CB-O 3.31Å; R74-T88 WeakPolarHBondContact CB-O 3.44Å; R74-C119 HydrophobicContact CG-CB 4.27Å; R74-C119 WeakPolarHBondContact CG-SG 3.09Å; R74-C119 PolarHBondContact NE-SG 2.83Å
75	H	87.4	Confident	79.5	Confident	63 Å²	63	85.2 Å²	85.2	29%	0.292	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.2	170.6	62	61.6	0	0	0	110.8	V77 T88	H75-V77 WeakPolarHBondContact CE1-CG1 3.42Å; H75-V77 VanDerWaalsContact ND1-CG1 3.28Å; H75-V77 WeakPolarHBondContact ND1-CG1 3.42Å; H75-T88 PolarHBondContact CE1-OG1 2.94Å; H75-T88 PolarHBondContact N-O 3.27Å; H75-T88 PolarHBondContact ND1-OG1 3.32Å; H75-T88 PolarHBondContact O-N 2.94Å
76	C	85.6	Confident	79.8	Confident	30 Å²	30	87.6 Å²	87.6	20%	0.203	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	131.2	175.6	-175.8	0	0	0	0	110.6	C65 C70 E86	C65-C76 WeakPolarHBondContact CA-SG 3.17Å; C65-C76 HydrophobicContact CB-CB 3.59Å; C65-C76 WeakPolarHBondContact CB-SG 3.17Å; C65-C76 WeakPolarHBondContact SG-CB 3.42Å; C65-C76 PolarHBondContact SG-O 3.28Å; C65-C76 CovalentContact SG-SG 2.04Å; C65-C76 PolarHBondContact SG-SG 2.8Å; C70-C76 WeakPolarHBondContact SG-CA 3.24Å; C70-C76 WeakPolarHBondContact SG-CB 3.35Å; C70-C76 PolarHBondContact SG-N 3.17Å; C70-C76 VanDerWaalsContact SG-N 3.41Å; C76-E86 CarbonylContact C-O 3.55Å; C76-E86 WeakPolarHBondContact CA-O 3.45Å
77	V	88.8	Confident	80.4	Confident	48 Å²	48	81.7 Å²	81.7	29%	0.291	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	151.6	169.6	-63	0	0	0	0	109.7	C65 H75 S79 A85 E86 T88	C65-V77 PolarHBondContact SG-N 3.43Å; H75-V77 WeakPolarHBondContact CE1-CG1 3.42Å; H75-V77 VanDerWaalsContact ND1-CG1 3.28Å; H75-V77 WeakPolarHBondContact ND1-CG1 3.42Å; V77-S79 PolarHBondContact O-N 3.22Å; V77-A85 CarbonylContact O-C 3.51Å; V77-A85 WeakPolarHBondContact O-CA 3.11Å; V77-E86 PolarHBondContact N-O 2.93Å; V77-E86 PolarHBondContact O-N 3.23Å; V77-E86 VanDerWaalsContact O-O 3.13Å; V77-T88 HydrophobicContact CG2-CG2 3.6Å
78	I	86.6	Confident	81.5	Confident	95 Å²	95	76.9 Å²	76.9	49%	0.487	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.1	171.1	-58.1	175.6	0	0	0	107.2	R80	I78-R80 PolarHBondContact O-N 2.95Å
79	S	81.7	Confident	82.5	Confident	16 Å²	16	73.9 Å²	73.9	11%	0.112	36%	0.356	C	S	.	.			trans	-61.2	126.3	178.1	179.2	0	0	0	0	109.7	V77 E81 T82 R83 H84 E86	V77-S79 PolarHBondContact O-N 3.22Å; S79-E81 PolarHBondContact O-N 3.38Å; S79-T82 VanDerWaalsContact CB-OG1 3.3Å; S79-T82 WeakPolarHBondContact CB-OG1 3.24Å; S79-T82 PolarHBondContact OG-OG1 2.92Å; S79-R83 VanDerWaalsContact O-CA 3.24Å; S79-R83 WeakPolarHBondContact O-CA 3.19Å; S79-R83 PolarHBondContact O-N 2.93Å; S79-H84 WeakPolarHBondContact CB-O 3.29Å; S79-H84 PolarHBondContact N-O 2.86Å; S79-E86 WeakPolarHBondContact CB-OE2 3.27Å
80	R	80.6	Confident	83.4	Confident	249 Å²	249	72.6 Å²	72.6	94%	0.94	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-26.4	179.1	-68.2	-175.6	-179.7	-177.3	1.4	112.3	I78	I78-R80 PolarHBondContact O-N 2.95Å
81	E	81.3	Confident	83.9	Confident	183 Å²	183	77.6 Å²	77.6	86%	0.855	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-46.3	-176.9	-63.9	-177.5	177.5	0	0	111.8	S79	S79-E81 PolarHBondContact O-N 3.38Å
82	T	81.4	Confident	84.7	Confident	77 Å²	77	83.6 Å²	83.6	47%	0.472	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-12.7	-174.2	63.8	0	0	0	0	113.6	S79 H84	S79-T82 VanDerWaalsContact CB-OG1 3.3Å; S79-T82 WeakPolarHBondContact CB-OG1 3.24Å; S79-T82 PolarHBondContact OG-OG1 2.92Å; T82-H84 PolarHBondContact O-CE1 2.94Å; T82-H84 PolarHBondContact O-N 3.19Å; T82-H84 VanDerWaalsContact O-N 3.13Å; T82-H84 PolarHBondContact O-ND1 2.74Å; T82-H84 PolarHBondContact OG1-N 3.22Å
83	R	79.1	Confident	85.2	Confident	183 Å²	183	82.7 Å²	82.7	69%	0.691	40%	0.403	S	S	*	.			trans	55.6	14.5	-167.1	-63.5	-174.1	-176.4	169.1	1.2	114.6	S79	S79-R83 VanDerWaalsContact O-CA 3.24Å; S79-R83 WeakPolarHBondContact O-CA 3.19Å; S79-R83 PolarHBondContact O-N 2.93Å
84	H	80.4	Confident	85.1	Confident	116 Å²	116	91.1 Å²	91.1	54%	0.537	44%	0.438	S	S	.	.	S	Bend	trans	-96.9	148.3	175.2	-66.9	81.6	0	0	0	110.2	S79 T82 E86	S79-H84 WeakPolarHBondContact CB-O 3.29Å; S79-H84 PolarHBondContact N-O 2.86Å; T82-H84 PolarHBondContact O-CE1 2.94Å; T82-H84 PolarHBondContact O-N 3.19Å; T82-H84 VanDerWaalsContact O-N 3.13Å; T82-H84 PolarHBondContact O-ND1 2.74Å; T82-H84 PolarHBondContact OG1-N 3.22Å; H84-E86 PolarHBondContact O-N 3.32Å
85	A	82.5	Confident	84.6	Confident	15 Å²	15	95 Å²	95	12%	0.124	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	126.9	170.1	0	0	0	0	0	109.7	K68 V77	K68-A85 HydrophobicContact CB-CB 4.36Å; K68-A85 HydrophobicContact CD-CB 3.6Å; K68-A85 WeakPolarHBondContact CD-O 3.49Å; K68-A85 WeakPolarHBondContact CE-O 3.49Å; K68-A85 PolarHBondContact NZ-O 3.03Å; V77-A85 CarbonylContact O-C 3.51Å; V77-A85 WeakPolarHBondContact O-CA 3.11Å
86	E	86.2	Confident	83.6	Confident	95 Å²	95	98.4 Å²	98.4	44%	0.444	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	146.8	-176.7	-173.8	176.5	177.6	0	0	109.6	C76 V77 S79 H84	C76-E86 CarbonylContact C-O 3.55Å; C76-E86 WeakPolarHBondContact CA-O 3.45Å; V77-E86 PolarHBondContact N-O 2.93Å; V77-E86 PolarHBondContact O-N 3.23Å; V77-E86 VanDerWaalsContact O-O 3.13Å; S79-E86 WeakPolarHBondContact CB-OE2 3.27Å; H84-E86 PolarHBondContact O-N 3.32Å
87	C	86.3	Confident	82.7	Confident	43 Å²	43	104.2 Å²	104.2	29%	0.291	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	114.6	-178.9	-65.2	0	0	0	0	110.7	K68 C70	K68-C87 VanDerWaalsContact CE-SG 3.53Å; C70-C87 WeakPolarHBondContact CA-SG 3.46Å; C70-C87 HydrophobicContact CB-CB 3.52Å; C70-C87 WeakPolarHBondContact CB-SG 3.34Å; C70-C87 WeakPolarHBondContact SG-CA 3.49Å; C70-C87 WeakPolarHBondContact SG-CB 3.46Å; C70-C87 CovalentContact SG-SG 2.03Å; C70-C87 PolarHBondContact SG-SG 3.22Å
88	T	90.2	Very high	81.5	Confident	45 Å²	45	106.8 Å²	106.8	28%	0.276	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	153.5	178.7	55.8	0	0	0	0	110.6	R74 H75 V77	R74-T88 CarbonylContact C-O 3.24Å; R74-T88 WeakPolarHBondContact CA-O 3.14Å; R74-T88 VanDerWaalsContact CB-O 3.31Å; R74-T88 WeakPolarHBondContact CB-O 3.44Å; H75-T88 PolarHBondContact CE1-OG1 2.94Å; H75-T88 PolarHBondContact N-O 3.27Å; H75-T88 PolarHBondContact ND1-OG1 3.32Å; H75-T88 PolarHBondContact O-N 2.94Å; V77-T88 HydrophobicContact CG2-CG2 3.6Å
89	C	92	Very high	80.6	Confident	32 Å²	32	103.7 Å²	103.7	22%	0.216	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	146.7	172.7	-53.8	0	0	0	0	110.5	G73 C119 L120	G73-C89 CarbonylContact O-C 3.54Å; G73-C89 WeakPolarHBondContact O-CA 3.46Å; C89-C119 WeakPolarHBondContact CA-SG 3.35Å; C89-C119 HydrophobicContact CB-CB 3.83Å; C89-C119 WeakPolarHBondContact CB-SG 3.31Å; C89-C119 WeakPolarHBondContact SG-CB 3.33Å; C89-C119 PolarHBondContact SG-O 3.01Å; C89-C119 CovalentContact SG-SG 2.03Å; C89-C119 PolarHBondContact SG-SG 2.96Å; C89-L120 HydrophobicContact CB-CD2 3.98Å; C89-L120 HydrophobicContact CB-CG 4.32Å
90	M	88.8	Confident	80	Confident	52 Å²	52	103.5 Å²	103.5	26%	0.256	49%	0.487	S	S	.	.			trans	-64.7	134.9	176.6	-70.9	176.3	70.2	0	0	111.1	G73 C112 R116	G73-M90 PolarHBondContact O-N 2.86Å; M90-C112 VanDerWaalsContact CE-SG 3.58Å; M90-R116 VanDerWaalsContact O-CD 3.25Å; M90-R116 WeakPolarHBondContact O-CD 3.31Å; M90-R116 WeakPolarHBondContact O-CG 3.28Å; M90-R116 PolarHBondContact O-NE 2.99Å
91	D	88.1	Confident	79.6	Confident	121 Å²	121	91.8 Å²	91.8	65%	0.647	44%	0.443	S	S	*	.	S	Bend	trans	-69.4	-43.8	176.6	-69.3	-38.3	0	0	0	111.9	R116	D91-R116 VanDerWaalsContact O-CZ 3.28Å; D91-R116 PolarHBondContact O-NE 2.81Å; D91-R116 PolarHBondContact O-NH2 3.15Å
92	L	87.6	Confident	79.4	Confident	145 Å²	145	83.2 Å²	83.2	76%	0.759	40%	0.403	S	S	*	.			trans	-144.2	140.9	-174.7	-72.7	158.1	0	0	0	110.7
93	C	85.1	Confident	78.9	Confident	15 Å²	15	82.3 Å²	82.3	10%	0.101	40%	0.4	C	S	.	.			trans	-92.2	152.3	169.2	-69.4	0	0	0	0	111.4	C112 E113	C93-C112 VanDerWaalsContact CA-SG 3.56Å; C93-C112 HydrophobicContact CB-CB 3.64Å; C93-C112 WeakPolarHBondContact CB-SG 3.11Å; C93-C112 WeakPolarHBondContact SG-CB 3.32Å; C93-C112 PolarHBondContact SG-O 3.43Å; C93-C112 VanDerWaalsContact SG-O 3.36Å; C93-C112 CovalentContact SG-SG 2.04Å; C93-C112 PolarHBondContact SG-SG 2.87Å; C93-E113 HydrophobicContact CB-CG 4.17Å; C93-E113 VanDerWaalsContact CB-OE1 3.31Å; C93-E113 WeakPolarHBondContact CB-OE1 3.27Å; C93-E113 PolarHBondContact SG-N 3.24Å
94	K	79.6	Confident	79	Confident	182 Å²	182	76.2 Å²	76.2	79%	0.791	38%	0.382	S	S	*	.			trans	-66.8	136.4	171.4	-70.7	-175.7	-179.7	-179.7	0	109.1	H96	K94-H96 PolarHBondContact O-N 3Å
95	Q	76.7	Confident	78.6	Confident	191 Å²	191	72.6 Å²	72.6	89%	0.893	38%	0.376	S	S	*	.			trans	-72.6	102.5	176.6	-67.9	-171.1	-24.9	0	0	110.1
96	H	66.7	Low	78.5	Confident	133 Å²	133	76.8 Å²	76.8	62%	0.616	39%	0.393	S	S	*	.			trans	-143.5	140	164.3	-179.9	-81.4	0	0	0	107.2	K94 K98 N110	K94-H96 PolarHBondContact O-N 3Å; H96-K98 PolarHBondContact O-N 3.41Å; H96-N110 WeakPolarHBondContact O-CB 3.49Å; H96-N110 PolarHBondContact O-ND2 2.81Å
97	Y	66.8	Low	78	Confident	152 Å²	152	75.9 Å²	75.9	60%	0.596	39%	0.387	S	S	*	.			trans	-94	100.9	-176.3	-166.4	-108.9	0	0	0	109.7	P99 F107	Y97-P99 HydrophobicContact CD1-CG 4.42Å; Y97-P99 HydrophobicContact CE1-CG 3.91Å; Y97-F107 HydrophobicContact CE2-CZ 4.42Å
98	K	63.9	Low	77.7	Confident	102 Å²	102	75 Å²	75	44%	0.443	38%	0.378	S	S	.	.			trans	-139.3	73.8	172.1	-171	-172.4	175.1	-157.9	0	107.9	H96 E109 N110 H111	H96-K98 PolarHBondContact O-N 3.41Å; K98-E109 CarbonylContact C-O 3.58Å; K98-E109 VanDerWaalsContact C-O 3.31Å; K98-E109 PolarHBondContact N-O 2.94Å; K98-N110 WeakPolarHBondContact O-CA 3.35Å; K98-H111 PolarHBondContact NZ-NE2 2.79Å
99	P	67.9	Low	76.9	Confident	30 Å²	30	78 Å²	78	20%	0.195	39%	0.389	C	S	.	.			trans	-68.1	147.1	-164	28.1	-37.7	0	0	0	113	Y97 F107 Y108 F134	Y97-P99 HydrophobicContact CD1-CG 4.42Å; Y97-P99 HydrophobicContact CE1-CG 3.91Å; P99-F107 HydrophobicContact CB-CE1 4.48Å; P99-F107 HydrophobicContact CB-CE2 3.49Å; P99-F107 VanDerWaalsContact CB-CE2 3.49Å; P99-F107 HydrophobicContact CB-CZ 3.44Å; P99-F107 VanDerWaalsContact CB-CZ 3.44Å; P99-F107 HydrophobicContact CG-CE2 4.49Å; P99-F107 HydrophobicContact CG-CZ 4.46Å; P99-Y108 VanDerWaalsContact CA-O 3.27Å; P99-Y108 WeakPolarHBondContact CA-O 3.43Å; P99-F134 HydrophobicContact CB-CE1 3.72Å; P99-F134 HydrophobicContact CB-CZ 4.4Å; P99-F134 HydrophobicContact CG-CE1 3.64Å; P99-F134 HydrophobicContact CG-CZ 4.44Å
100	V	68.6	Low	76.2	Confident	13 Å²	13	77.1 Å²	77.1	8%	0.079	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	147.9	-177.1	-73.5	0	0	0	0	109.8	Y108 V114 I127	V100-Y108 PolarHBondContact N-O 2.9Å; V100-Y108 PolarHBondContact O-N 3.46Å; V100-V114 HydrophobicContact CB-CG2 4.38Å; V100-V114 HydrophobicContact CG2-CG2 3.22Å; V100-I127 HydrophobicContact CB-CG1 4.39Å; V100-I127 HydrophobicContact CB-CG2 3.97Å; V100-I127 HydrophobicContact CG1-CD1 4.29Å; V100-I127 HydrophobicContact CG1-CG2 3.98Å
101	C	72.8	Confident	75.6	Confident	3 Å²	3	75.8 Å²	75.8	2%	0.02	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.3	173.6	-167	0	0	0	0	108.2	E106 V128 N130 C133	C101-E106 WeakPolarHBondContact CA-O 3.21Å; C101-V128 WeakPolarHBondContact CB-O 3.37Å; C101-V128 PolarHBondContact O-N 3.34Å; C101-N130 HydrophobicContact CB-CB 4.38Å; C101-C133 HydrophobicContact CB-CB 3.63Å; C101-C133 WeakPolarHBondContact CB-SG 3.45Å; C101-C133 WeakPolarHBondContact SG-CB 3.03Å; C101-C133 CovalentContact SG-SG 2.07Å; C101-C133 PolarHBondContact SG-SG 3.18Å
102	G	77.5	Confident	75.4	Confident	2 Å²	2	71.1 Å²	71.1	2%	0.021	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	159.6	175.5	0	0	0	0	0	111.8	D104 G105 E106 T126	G102-D104 WeakPolarHBondContact CA-OD1 3.48Å; G102-D104 PolarHBondContact O-N 3.13Å; G102-D104 VanDerWaalsContact O-N 3.15Å; G102-G105 WeakPolarHBondContact O-CA 3.04Å; G102-G105 PolarHBondContact O-N 2.83Å; G102-E106 PolarHBondContact N-O 2.91Å; G102-T126 CarbonylContact C-O 3.59Å
103	S	70.5	Confident	75.4	Confident	59 Å²	59	66.4 Å²	66.4	41%	0.413	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.6	170.4	61.1	0	0	0	0	113.4	I125 T126 V128	S103-I125 WeakPolarHBondContact OG-CA 3.27Å; S103-T126 WeakPolarHBondContact CB-O 3.34Å; S103-T126 WeakPolarHBondContact CB-OG1 3.36Å; S103-T126 PolarHBondContact N-O 3.31Å; S103-T126 PolarHBondContact OG-N 2.85Å; S103-V128 VanDerWaalsContact CA-CG2 3.5Å
104	D	80.3	Confident	75.4	Confident	55 Å²	55	65.7 Å²	65.7	29%	0.294	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.2	169	62.1	-17.6	0	0	0	113.2	G102 E106 Y108 K121 I125	G102-D104 WeakPolarHBondContact CA-OD1 3.48Å; G102-D104 PolarHBondContact O-N 3.13Å; G102-D104 VanDerWaalsContact O-N 3.15Å; D104-E106 PolarHBondContact O-N 3.26Å; D104-E106 PolarHBondContact OD1-N 3.39Å; D104-Y108 PolarHBondContact OD2-OH 3.27Å; D104-K121 IonicContact OD2-NZ 3.65Å; D104-K121 PolarHBondContact OD2-NZ 2.89Å; D104-I125 WeakPolarHBondContact OD1-CG2 3.3Å
105	G	73.6	Confident	75.7	Confident	40 Å²	40	57.7 Å²	57.7	41%	0.412	29%	0.286	S	S	.	.	S	Bend	trans	77.3	8.4	-179.4	0	0	0	0	0	114.1	G102	G102-G105 WeakPolarHBondContact O-CA 3.04Å; G102-G105 PolarHBondContact O-N 2.83Å
106	E	78.3	Confident	76.3	Confident	103 Å²	103	51.5 Å²	51.5	48%	0.481	26%	0.255	S	S	.	.			trans	-91.5	150.7	178.4	-70.5	-65	155	0	0	111.6	C101 G102 D104 Y108	C101-E106 WeakPolarHBondContact CA-O 3.21Å; G102-E106 PolarHBondContact N-O 2.91Å; D104-E106 PolarHBondContact O-N 3.26Å; D104-E106 PolarHBondContact OD1-N 3.39Å; E106-Y108 HydrophobicContact CB-CD2 4.47Å; E106-Y108 HydrophobicContact CB-CE2 3.7Å; E106-Y108 WeakPolarHBondContact O-CD2 3.47Å
107	F	77.1	Confident	77.4	Confident	76 Å²	76	45.8 Å²	45.8	33%	0.333	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	134.4	175.7	174.9	-89.6	0	0	0	110.3	Y97 P99 E109 F134	Y97-F107 HydrophobicContact CE2-CZ 4.42Å; P99-F107 HydrophobicContact CB-CE1 4.48Å; P99-F107 HydrophobicContact CB-CE2 3.49Å; P99-F107 VanDerWaalsContact CB-CE2 3.49Å; P99-F107 HydrophobicContact CB-CZ 3.44Å; P99-F107 VanDerWaalsContact CB-CZ 3.44Å; P99-F107 HydrophobicContact CG-CE2 4.49Å; P99-F107 HydrophobicContact CG-CZ 4.46Å; F107-E109 HydrophobicContact CE1-CG 4.45Å; F107-F134 HydrophobicContact CD2-CD1 4.43Å; F107-F134 HydrophobicContact CD2-CE1 4.4Å; F107-F134 AromaticContact CE2-CD1 3.8Å; F107-F134 HydrophobicContact CE2-CD1 3.8Å; F107-F134 AromaticContact CE2-CE1 3.72Å; F107-F134 HydrophobicContact CE2-CE1 3.72Å
108	Y	80.6	Confident	78.4	Confident	24 Å²	24	39.2 Å²	39.2	9%	0.094	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.7	176.7	-62	-90.4	0	0	0	110.3	P99 V100 D104 E106 N110 E113 V114 A117 K121	P99-Y108 VanDerWaalsContact CA-O 3.27Å; P99-Y108 WeakPolarHBondContact CA-O 3.43Å; V100-Y108 PolarHBondContact N-O 2.9Å; V100-Y108 PolarHBondContact O-N 3.46Å; D104-Y108 PolarHBondContact OD2-OH 3.27Å; E106-Y108 HydrophobicContact CB-CD2 4.47Å; E106-Y108 HydrophobicContact CB-CE2 3.7Å; E106-Y108 WeakPolarHBondContact O-CD2 3.47Å; Y108-N110 PolarHBondContact O-N 3.31Å; Y108-E113 HydrophobicContact CD1-CB 4.13Å; Y108-V114 VanDerWaalsContact CB-CG2 3.41Å; Y108-V114 HydrophobicContact CD1-CG2 4.2Å; Y108-V114 HydrophobicContact CD2-CB 4.35Å; Y108-V114 HydrophobicContact CD2-CG2 3.54Å; Y108-V114 HydrophobicContact CE2-CG2 4.32Å; Y108-V114 HydrophobicContact CG-CB 4.23Å; Y108-V114 HydrophobicContact CG-CG2 3.44Å; Y108-V114 VanDerWaalsContact CG-CG2 3.44Å; Y108-A117 HydrophobicContact CD1-CB 4.34Å; Y108-A117 HydrophobicContact CE1-CB 3.4Å; Y108-K121 PolarHBondContact OH-NZ 2.9Å
109	E	73.3	Confident	79.6	Confident	109 Å²	109	34.8 Å²	34.8	51%	0.509	19%	0.19	S	C	.	.	S	Bend	trans	-63.5	-27	-175.6	-61.9	-178.4	174.7	0	0	113.4	K98 F107	K98-E109 CarbonylContact C-O 3.58Å; K98-E109 VanDerWaalsContact C-O 3.31Å; K98-E109 PolarHBondContact N-O 2.94Å; F107-E109 HydrophobicContact CE1-CG 4.45Å
110	N	75.4	Confident	80.8	Confident	13 Å²	13	38.1 Å²	38.1	7%	0.07	21%	0.205	C	C	.	.	S	Bend	trans	-157.2	166.9	175.8	55.5	68.4	0	0	0	111.6	H96 K98 Y108 C112 E113 V114	H96-N110 WeakPolarHBondContact O-CB 3.49Å; H96-N110 PolarHBondContact O-ND2 2.81Å; K98-N110 WeakPolarHBondContact O-CA 3.35Å; Y108-N110 PolarHBondContact O-N 3.31Å; N110-C112 VanDerWaalsContact C-N 3.3Å; N110-C112 PolarHBondContact O-N 3.02Å; N110-C112 WeakPolarHBondContact OD1-CB 3.32Å; N110-C112 PolarHBondContact OD1-N 3.07Å; N110-E113 PolarHBondContact O-N 2.83Å; N110-E113 PolarHBondContact OD1-N 3.46Å; N110-V114 PolarHBondContact O-N 2.81Å
111	H	77.1	Confident	81.7	Confident	24 Å²	24	42.1 Å²	42.1	11%	0.111	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-39.2	178.3	-73.9	-119.5	0	0	0	113.1	K98 E113 V114 H115 I127 D302	K98-H111 PolarHBondContact NZ-NE2 2.79Å; H111-E113 VanDerWaalsContact C-N 3.27Å; H111-E113 PolarHBondContact O-N 2.85Å; H111-V114 WeakPolarHBondContact O-CB 3.38Å; H111-V114 PolarHBondContact O-N 3.26Å; H111-V114 VanDerWaalsContact O-N 3.11Å; H111-H115 PolarHBondContact O-CD2 3.33Å; H111-H115 PolarHBondContact O-N 3.37Å; H111-H115 VanDerWaalsContact O-N 3.1Å; H111-I127 VanDerWaalsContact CE1-CD1 3.42Å; H111-I127 WeakPolarHBondContact CE1-CD1 3.41Å; H111-I127 WeakPolarHBondContact ND1-CD1 3.29Å; H111-D302 HydrophobicContact CB-CB 4.16Å; H111-D302 WeakPolarHBondContact CB-OD1 3.07Å; H111-D302 WeakPolarHBondContact CB-OD2 3.43Å; H111-D302 IonicContact CG-OD1 3.5Å; H111-D302 IonicContact ND1-OD1 2.98Å
112	C	83.4	Confident	82.3	Confident	22 Å²	22	51 Å²	51	15%	0.149	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-41.9	177.8	176.9	0	0	0	0	111.4	M90 C93 N110 V114 H115 R116	M90-C112 VanDerWaalsContact CE-SG 3.58Å; C93-C112 VanDerWaalsContact CA-SG 3.56Å; C93-C112 HydrophobicContact CB-CB 3.64Å; C93-C112 WeakPolarHBondContact CB-SG 3.11Å; C93-C112 WeakPolarHBondContact SG-CB 3.32Å; C93-C112 PolarHBondContact SG-O 3.43Å; C93-C112 VanDerWaalsContact SG-O 3.36Å; C93-C112 CovalentContact SG-SG 2.04Å; C93-C112 PolarHBondContact SG-SG 2.87Å; N110-C112 VanDerWaalsContact C-N 3.3Å; N110-C112 PolarHBondContact O-N 3.02Å; N110-C112 WeakPolarHBondContact OD1-CB 3.32Å; N110-C112 PolarHBondContact OD1-N 3.07Å; C112-V114 VanDerWaalsContact C-N 3.34Å; C112-V114 PolarHBondContact O-N 2.99Å; C112-H115 PolarHBondContact O-N 2.88Å; C112-R116 WeakPolarHBondContact O-CB 3.18Å; C112-R116 PolarHBondContact O-N 3.29Å
113	E	88.1	Confident	82.4	Confident	46 Å²	46	56.9 Å²	56.9	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-36	177.7	-69.9	-62.4	166.4	0	0	112.6	C93 Y108 N110 H111 R116 A117	C93-E113 HydrophobicContact CB-CG 4.17Å; C93-E113 VanDerWaalsContact CB-OE1 3.31Å; C93-E113 WeakPolarHBondContact CB-OE1 3.27Å; C93-E113 PolarHBondContact SG-N 3.24Å; Y108-E113 HydrophobicContact CD1-CB 4.13Å; N110-E113 PolarHBondContact O-N 2.83Å; N110-E113 PolarHBondContact OD1-N 3.46Å; H111-E113 VanDerWaalsContact C-N 3.27Å; H111-E113 PolarHBondContact O-N 2.85Å; E113-R116 IonicContact OE2-NH1 3.43Å; E113-R116 PolarHBondContact OE2-NH1 2.96Å; E113-A117 WeakPolarHBondContact O-CB 3.42Å; E113-A117 PolarHBondContact O-N 2.86Å
114	V	84.5	Confident	82.6	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-53.7	173.3	-177.8	0	0	0	0	110.7	V100 Y108 N110 H111 C112 R116 A117 A118 I125 I127	V100-V114 HydrophobicContact CB-CG2 4.38Å; V100-V114 HydrophobicContact CG2-CG2 3.22Å; Y108-V114 VanDerWaalsContact CB-CG2 3.41Å; Y108-V114 HydrophobicContact CD1-CG2 4.2Å; Y108-V114 HydrophobicContact CD2-CB 4.35Å; Y108-V114 HydrophobicContact CD2-CG2 3.54Å; Y108-V114 HydrophobicContact CE2-CG2 4.32Å; Y108-V114 HydrophobicContact CG-CB 4.23Å; Y108-V114 HydrophobicContact CG-CG2 3.44Å; Y108-V114 VanDerWaalsContact CG-CG2 3.44Å; N110-V114 PolarHBondContact O-N 2.81Å; H111-V114 WeakPolarHBondContact O-CB 3.38Å; H111-V114 PolarHBondContact O-N 3.26Å; H111-V114 VanDerWaalsContact O-N 3.11Å; C112-V114 VanDerWaalsContact C-N 3.34Å; C112-V114 PolarHBondContact O-N 2.99Å; V114-R116 VanDerWaalsContact C-N 3.32Å; V114-R116 PolarHBondContact O-N 2.8Å; V114-A117 PolarHBondContact O-N 2.69Å; V114-A118 WeakPolarHBondContact O-CB 3.3Å; V114-A118 PolarHBondContact O-N 2.81Å; V114-I125 HydrophobicContact CG1-CB 4.16Å; V114-I125 HydrophobicContact CG1-CG2 3.83Å; V114-I127 HydrophobicContact CG1-CG1 4.42Å
115	H	86.8	Confident	82.4	Confident	14 Å²	14	58.8 Å²	58.8	7%	0.065	29%	0.285	C	S	.	.	H	α-helix	trans	-68.3	-35.2	-175.7	-63.3	-66.8	0	0	0	111.8	L72 H111 C112 A118 C119 D299 D302	L72-H115 HydrophobicContact CB-CB 3.79Å; H111-H115 PolarHBondContact O-CD2 3.33Å; H111-H115 PolarHBondContact O-N 3.37Å; H111-H115 VanDerWaalsContact O-N 3.1Å; C112-H115 PolarHBondContact O-N 2.88Å; H115-A118 PolarHBondContact O-N 2.81Å; H115-C119 WeakPolarHBondContact O-CB 3.4Å; H115-C119 PolarHBondContact O-N 3.04Å; H115-D299 IonicContact CE1-OD2 3.83Å; H115-D299 PolarHBondContact CE1-OD2 3.31Å; H115-D299 IonicContact ND1-OD2 2.74Å; H115-D299 PolarHBondContact ND1-OD2 2.86Å; H115-D302 IonicContact CD2-OD1 3.57Å; H115-D302 IonicContact NE2-OD1 2.79Å
116	R	89	Confident	82.2	Confident	61 Å²	61	60.2 Å²	60.2	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-46.2	172.2	179	177.1	173.6	-89.4	-3.5	110.9	M90 D91 C112 E113 V114 C119 L120	M90-R116 VanDerWaalsContact O-CD 3.25Å; M90-R116 WeakPolarHBondContact O-CD 3.31Å; M90-R116 WeakPolarHBondContact O-CG 3.28Å; M90-R116 PolarHBondContact O-NE 2.99Å; D91-R116 VanDerWaalsContact O-CZ 3.28Å; D91-R116 PolarHBondContact O-NE 2.81Å; D91-R116 PolarHBondContact O-NH2 3.15Å; C112-R116 WeakPolarHBondContact O-CB 3.18Å; C112-R116 PolarHBondContact O-N 3.29Å; E113-R116 IonicContact OE2-NH1 3.43Å; E113-R116 PolarHBondContact OE2-NH1 2.96Å; V114-R116 VanDerWaalsContact C-N 3.32Å; V114-R116 PolarHBondContact O-N 2.8Å; R116-C119 WeakPolarHBondContact O-CB 3.26Å; R116-C119 PolarHBondContact O-N 3.31Å; R116-L120 HydrophobicContact CG-CD1 4.06Å; R116-L120 VanDerWaalsContact O-CG 3.31Å; R116-L120 WeakPolarHBondContact O-CG 3.35Å; R116-L120 PolarHBondContact O-N 3.4Å
117	A	89.8	Confident	81.6	Confident	14 Å²	14	58.4 Å²	58.4	12%	0.116	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-41.7	176.1	0	0	0	0	0	112.2	Y108 E113 V114 C119 L120 K121 I125	Y108-A117 HydrophobicContact CD1-CB 4.34Å; Y108-A117 HydrophobicContact CE1-CB 3.4Å; E113-A117 WeakPolarHBondContact O-CB 3.42Å; E113-A117 PolarHBondContact O-N 2.86Å; V114-A117 PolarHBondContact O-N 2.69Å; A117-C119 VanDerWaalsContact C-N 3.3Å; A117-C119 PolarHBondContact O-N 3.38Å; A117-L120 PolarHBondContact O-N 2.58Å; A117-K121 VanDerWaalsContact O-CB 3.31Å; A117-K121 WeakPolarHBondContact O-CB 3.37Å; A117-K121 WeakPolarHBondContact O-CG 3.19Å; A117-K121 PolarHBondContact O-N 3.01Å; A117-I125 HydrophobicContact CB-CD1 4.24Å
118	A	88.3	Confident	80.7	Confident	14 Å²	14	57.8 Å²	57.8	12%	0.116	28%	0.281	C	S	.	.	H	α-helix	trans	-57.5	-44.1	173.7	0	0	0	0	0	111.5	V114 H115 K122 Q123 I125	V114-A118 WeakPolarHBondContact O-CB 3.3Å; V114-A118 PolarHBondContact O-N 2.81Å; H115-A118 PolarHBondContact O-N 2.81Å; A118-K122 WeakPolarHBondContact O-CA 3.42Å; A118-K122 PolarHBondContact O-N 2.86Å; A118-Q123 CarbonylContact C-O 3.59Å; A118-Q123 VanDerWaalsContact CA-O 3.23Å; A118-Q123 WeakPolarHBondContact CA-O 3.49Å; A118-Q123 VanDerWaalsContact CB-O 3.27Å; A118-Q123 WeakPolarHBondContact CB-O 3.45Å; A118-Q123 PolarHBondContact O-N 2.88Å; A118-Q123 VanDerWaalsContact O-N 3.09Å; A118-Q123 VanDerWaalsContact O-O 3.08Å; A118-I125 HydrophobicContact CB-CB 4.02Å; A118-I125 HydrophobicContact CB-CD1 4.01Å; A118-I125 HydrophobicContact CB-CG1 3.9Å
119	C	88.9	Confident	79.3	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.061	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-49.6	175.3	-172.9	0	0	0	0	112.4	R74 C89 H115 R116 A117 K122	R74-C119 HydrophobicContact CG-CB 4.27Å; R74-C119 WeakPolarHBondContact CG-SG 3.09Å; R74-C119 PolarHBondContact NE-SG 2.83Å; C89-C119 WeakPolarHBondContact CA-SG 3.35Å; C89-C119 HydrophobicContact CB-CB 3.83Å; C89-C119 WeakPolarHBondContact CB-SG 3.31Å; C89-C119 WeakPolarHBondContact SG-CB 3.33Å; C89-C119 PolarHBondContact SG-O 3.01Å; C89-C119 CovalentContact SG-SG 2.03Å; C89-C119 PolarHBondContact SG-SG 2.96Å; H115-C119 WeakPolarHBondContact O-CB 3.4Å; H115-C119 PolarHBondContact O-N 3.04Å; R116-C119 WeakPolarHBondContact O-CB 3.26Å; R116-C119 PolarHBondContact O-N 3.31Å; A117-C119 VanDerWaalsContact C-N 3.3Å; A117-C119 PolarHBondContact O-N 3.38Å; C119-K122 PolarHBondContact O-N 2.97Å; C119-K122 VanDerWaalsContact O-N 3.15Å
120	L	92.1	Very high	78.3	Confident	100 Å²	100	62.3 Å²	62.3	52%	0.524	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-41.6	-178.6	-69.9	171.2	0	0	0	112.2	C89 R116 A117 K122	C89-L120 HydrophobicContact CB-CD2 3.98Å; C89-L120 HydrophobicContact CB-CG 4.32Å; R116-L120 HydrophobicContact CG-CD1 4.06Å; R116-L120 VanDerWaalsContact O-CG 3.31Å; R116-L120 WeakPolarHBondContact O-CG 3.35Å; R116-L120 PolarHBondContact O-N 3.4Å; A117-L120 PolarHBondContact O-N 2.58Å; L120-K122 PolarHBondContact O-N 2.9Å
121	K	89.3	Confident	77.2	Confident	96 Å²	96	64.5 Å²	64.5	42%	0.417	32%	0.315	S	S	.	.	H	α-helix	trans	-75	-12.2	176.5	-66.5	-177.6	-169.6	173.6	0	112.7	D104 Y108 A117 Q123 I125	D104-K121 IonicContact OD2-NZ 3.65Å; D104-K121 PolarHBondContact OD2-NZ 2.89Å; Y108-K121 PolarHBondContact OH-NZ 2.9Å; A117-K121 VanDerWaalsContact O-CB 3.31Å; A117-K121 WeakPolarHBondContact O-CB 3.37Å; A117-K121 WeakPolarHBondContact O-CG 3.19Å; A117-K121 PolarHBondContact O-N 3.01Å; K121-Q123 HydrophobicContact CB-CB 4.29Å; K121-Q123 PolarHBondContact O-N 2.87Å; K121-I125 HydrophobicContact CD-CD1 4.18Å
122	K	84.4	Confident	76.1	Confident	191 Å²	191	67.6 Å²	67.6	83%	0.83	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	38.1	-170.4	-57.9	-177.3	179.3	-177.4	0	112.4	A118 C119 L120	A118-K122 WeakPolarHBondContact O-CA 3.42Å; A118-K122 PolarHBondContact O-N 2.86Å; C119-K122 PolarHBondContact O-N 2.97Å; C119-K122 VanDerWaalsContact O-N 3.15Å; L120-K122 PolarHBondContact O-N 2.9Å
123	Q	80.3	Confident	75.2	Confident	124 Å²	124	67.3 Å²	67.3	58%	0.579	33%	0.331	S	S	*	.	S	Bend	trans	-131.3	140.8	-179.3	-72.6	176.6	2.1	0	0	109.1	A118 K121 I125	A118-Q123 CarbonylContact C-O 3.59Å; A118-Q123 VanDerWaalsContact CA-O 3.23Å; A118-Q123 WeakPolarHBondContact CA-O 3.49Å; A118-Q123 VanDerWaalsContact CB-O 3.27Å; A118-Q123 WeakPolarHBondContact CB-O 3.45Å; A118-Q123 PolarHBondContact O-N 2.88Å; A118-Q123 VanDerWaalsContact O-N 3.09Å; A118-Q123 VanDerWaalsContact O-O 3.08Å; K121-Q123 HydrophobicContact CB-CB 4.29Å; K121-Q123 PolarHBondContact O-N 2.87Å; Q123-I125 PolarHBondContact O-N 3.35Å
124	K	74.3	Confident	73.8	Confident	146 Å²	146	69.9 Å²	69.9	64%	0.635	34%	0.341	S	S	*	.			trans	-72	117.8	174.3	-171	170.9	-175	171.8	0	108.5	T126 D293	K124-T126 HydrophobicContact CG-CG2 4.26Å; K124-D293 IonicContact NZ-OD1 3.44Å
125	I	76.1	Confident	72.5	Confident	8 Å²	8	71.3 Å²	71.3	4%	0.041	35%	0.347	C	S	.	.			trans	-114	110.9	172.7	-51	172.8	0	0	0	106.1	S103 D104 V114 A117 A118 K121 Q123	S103-I125 WeakPolarHBondContact OG-CA 3.27Å; D104-I125 WeakPolarHBondContact OD1-CG2 3.3Å; V114-I125 HydrophobicContact CG1-CB 4.16Å; V114-I125 HydrophobicContact CG1-CG2 3.83Å; A117-I125 HydrophobicContact CB-CD1 4.24Å; A118-I125 HydrophobicContact CB-CB 4.02Å; A118-I125 HydrophobicContact CB-CD1 4.01Å; A118-I125 HydrophobicContact CB-CG1 3.9Å; K121-I125 HydrophobicContact CD-CD1 4.18Å; Q123-I125 PolarHBondContact O-N 3.35Å
126	T	69.6	Low	71	Confident	70 Å²	70	79.2 Å²	79.2	43%	0.429	38%	0.382	S	S	.	.			trans	-91.9	149.4	175.5	56.4	0	0	0	0	109.2	G102 S103 K124 V128	G102-T126 CarbonylContact C-O 3.59Å; S103-T126 WeakPolarHBondContact CB-O 3.34Å; S103-T126 WeakPolarHBondContact CB-OG1 3.36Å; S103-T126 PolarHBondContact N-O 3.31Å; S103-T126 PolarHBondContact OG-N 2.85Å; K124-T126 HydrophobicContact CG-CG2 4.26Å; T126-V128 PolarHBondContact O-N 3.44Å
127	I	64.7	Low	69.6	Low	66 Å²	66	80.3 Å²	80.3	34%	0.338	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.3	174.8	-63.6	165.2	0	0	0	108.4	V100 H111 V114	V100-I127 HydrophobicContact CB-CG1 4.39Å; V100-I127 HydrophobicContact CB-CG2 3.97Å; V100-I127 HydrophobicContact CG1-CD1 4.29Å; V100-I127 HydrophobicContact CG1-CG2 3.98Å; H111-I127 VanDerWaalsContact CE1-CD1 3.42Å; H111-I127 WeakPolarHBondContact CE1-CD1 3.41Å; H111-I127 WeakPolarHBondContact ND1-CD1 3.29Å; V114-I127 HydrophobicContact CG1-CG1 4.42Å
128	V	59.4	Low	68.2	Low	62 Å²	62	82.8 Å²	82.8	38%	0.376	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.3	175.5	-176.7	0	0	0	0	107.9	C101 S103 T126 N130	C101-V128 WeakPolarHBondContact CB-O 3.37Å; C101-V128 PolarHBondContact O-N 3.34Å; S103-V128 VanDerWaalsContact CA-CG2 3.5Å; T126-V128 PolarHBondContact O-N 3.44Å; V128-N130 VanDerWaalsContact C-N 3.34Å; V128-N130 HydrophobicContact CG1-CB 4.42Å; V128-N130 PolarHBondContact O-N 2.79Å
129	H	51.5	Low	67.3	Low	160 Å²	160	89 Å²	89	74%	0.741	45%	0.454	S	S	*	.			trans	-80.5	83.3	174.4	-152.4	-72.6	0	0	0	109
130	N	51.5	Low	66.8	Low	69 Å²	69	88.7 Å²	88.7	37%	0.369	45%	0.452	S	S	.	.			trans	-115.6	111.1	176.9	-169.2	9.7	0	0	0	110.4	C101 V128 D132 C133	C101-N130 HydrophobicContact CB-CB 4.38Å; V128-N130 VanDerWaalsContact C-N 3.34Å; V128-N130 HydrophobicContact CG1-CB 4.42Å; V128-N130 PolarHBondContact O-N 2.79Å; N130-D132 VanDerWaalsContact C-N 3.28Å; N130-D132 PolarHBondContact O-N 2.73Å; N130-D132 PolarHBondContact OD1-N 2.84Å; N130-C133 WeakPolarHBondContact O-CB 3.49Å; N130-C133 PolarHBondContact O-N 3.34Å
131	E	51.8	Low	66	Low	59 Å²	59	88.6 Å²	88.6	28%	0.276	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-64.5	-31.3	-178	-65.8	-174.6	164.4	0	0	111.9	C133 F134 F135 T142 Q243	E131-C133 PolarHBondContact O-N 2.01Å; E131-C133 VanDerWaalsContact O-N 3.1Å; E131-F134 WeakPolarHBondContact O-CB 3.25Å; E131-F134 WeakPolarHBondContact O-CD2 3.33Å; E131-F134 PolarHBondContact O-N 2.9Å; E131-F135 HydrophobicContact CB-CE2 4.39Å; E131-F135 WeakPolarHBondContact O-CD2 3.38Å; E131-F135 WeakPolarHBondContact O-CE2 3.38Å; E131-T142 HydrophobicContact CB-CG2 3.59Å; E131-Q243 PolarHBondContact OE1-NE2 2.55Å
132	D	54.6	Low	65.1	Low	89 Å²	89	84.4 Å²	84.4	48%	0.476	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-63.4	-21.7	-177.6	-68.2	-26.9	0	0	0	114.3	N130 F134 T142	N130-D132 VanDerWaalsContact C-N 3.28Å; N130-D132 PolarHBondContact O-N 2.73Å; N130-D132 PolarHBondContact OD1-N 2.84Å; D132-F134 PolarHBondContact O-N 2.81Å; D132-T142 WeakPolarHBondContact OD1-CB 3.46Å; D132-T142 PolarHBondContact OD1-OG1 3.34Å
133	C	63.4	Low	64.7	Low	16 Å²	16	79.4 Å²	79.4	11%	0.108	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-59.6	-27.1	174.4	-109.8	0	0	0	0	111.8	C101 N130 E131	C101-C133 HydrophobicContact CB-CB 3.63Å; C101-C133 WeakPolarHBondContact CB-SG 3.45Å; C101-C133 WeakPolarHBondContact SG-CB 3.03Å; C101-C133 CovalentContact SG-SG 2.07Å; C101-C133 PolarHBondContact SG-SG 3.18Å; N130-C133 WeakPolarHBondContact O-CB 3.49Å; N130-C133 PolarHBondContact O-N 3.34Å; E131-C133 PolarHBondContact O-N 2.01Å; E131-C133 VanDerWaalsContact O-N 3.1Å
134	F	59.2	Low	64.8	Low	99 Å²	99	75.7 Å²	75.7	43%	0.434	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-90.5	-18.5	-172.4	-63.4	-86.6	0	0	0	114.9	P99 F107 E131 D132	P99-F134 HydrophobicContact CB-CE1 3.72Å; P99-F134 HydrophobicContact CB-CZ 4.4Å; P99-F134 HydrophobicContact CG-CE1 3.64Å; P99-F134 HydrophobicContact CG-CZ 4.44Å; F107-F134 HydrophobicContact CD2-CD1 4.43Å; F107-F134 HydrophobicContact CD2-CE1 4.4Å; F107-F134 AromaticContact CE2-CD1 3.8Å; F107-F134 HydrophobicContact CE2-CD1 3.8Å; F107-F134 AromaticContact CE2-CE1 3.72Å; F107-F134 HydrophobicContact CE2-CE1 3.72Å; E131-F134 WeakPolarHBondContact O-CB 3.25Å; E131-F134 WeakPolarHBondContact O-CD2 3.33Å; E131-F134 PolarHBondContact O-N 2.9Å; D132-F134 PolarHBondContact O-N 2.81Å
135	F	58.4	Low	65.2	Low	31 Å²	31	69 Å²	69	14%	0.136	37%	0.372	C	S	.	.			trans	-105	12	-167.2	-66	-90.5	0	0	0	115.5	E131 G137 T142 Y145 Y224	E131-F135 HydrophobicContact CB-CE2 4.39Å; E131-F135 WeakPolarHBondContact O-CD2 3.38Å; E131-F135 WeakPolarHBondContact O-CE2 3.38Å; F135-G137 PolarHBondContact O-N 3.35Å; F135-T142 HydrophobicContact CD2-CG2 3.82Å; F135-T142 WeakPolarHBondContact CD2-OG1 3.46Å; F135-T142 HydrophobicContact CE2-CG2 3.57Å; F135-T142 WeakPolarHBondContact CG-OG1 2.98Å; F135-T142 HydrophobicContact CZ-CG2 4.25Å; F135-Y145 HydrophobicContact CE1-CD1 4.24Å; F135-Y145 HydrophobicContact CZ-CD1 4.15Å; F135-Y224 HydrophobicContact CD1-CE1 4.49Å; F135-Y224 HydrophobicContact CE1-CD1 4.48Å; F135-Y224 HydrophobicContact CE1-CD2 4.36Å; F135-Y224 HydrophobicContact CE1-CE1 4.41Å; F135-Y224 HydrophobicContact CE1-CE2 4.25Å; F135-Y224 HydrophobicContact CE1-CG 4.48Å
136	K	54.2	Low	65.4	Low	180 Å²	180	70.6 Å²	70.6	78%	0.783	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	102.8	-177.7	-79.1	-177.2	179.5	169.6	0	111.9
137	G	59.8	Low	66.1	Low	83 Å²	83	73 Å²	73	86%	0.856	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.4	2.3	166.5	0	0	0	0	0	117.2	F135	F135-G137 PolarHBondContact O-N 3.35Å
138	D	61.3	Low	67.1	Low	66 Å²	66	70 Å²	70	35%	0.353	37%	0.373	S	S	.	.			trans	-103.7	157.2	-179.1	-102.2	-41.1	0	0	0	113.2	K223 Y224	D138-K223 IonicContact OD1-NZ 3.45Å; D138-K223 PolarHBondContact OD1-NZ 3.25Å; D138-K223 IonicContact OD2-NZ 3.92Å; D138-K223 PolarHBondContact OD2-NZ 3.35Å; D138-Y224 WeakPolarHBondContact CB-OH 3.35Å; D138-Y224 PolarHBondContact OD2-OH 2.75Å
139	N	69.5	Low	68.5	Low	145 Å²	145	68.1 Å²	68.1	78%	0.775	36%	0.36	S	S	*	.	S	Bend	trans	-71	-39	175.2	-71.1	-13.7	0	0	0	112.1	M141	N139-M141 PolarHBondContact O-N 3.03Å
140	C	76.7	Confident	70.1	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.02	34%	0.344	C	S	.	.	S	Bend	trans	-81.7	96.6	175.5	174.9	0	0	0	0	109.1	D215 C216 Y224	C140-D215 WeakPolarHBondContact CA-O 3.39Å; C140-D215 WeakPolarHBondContact CB-O 3Å; C140-C216 VanDerWaalsContact CA-SG 3.51Å; C140-C216 HydrophobicContact CB-CB 3.98Å; C140-C216 WeakPolarHBondContact CB-SG 3.36Å; C140-C216 WeakPolarHBondContact SG-CB 3.49Å; C140-C216 CovalentContact SG-SG 2.03Å; C140-C216 PolarHBondContact SG-SG 3.26Å; C140-Y224 HydrophobicContact CB-CE2 4.21Å; C140-Y224 PolarHBondContact O-OH 3.04Å
141	M	76.6	Confident	71.7	Confident	98 Å²	98	63.1 Å²	63.1	48%	0.483	34%	0.341	S	S	.	.			trans	-74.8	156.6	178.5	-62.1	-65.6	-67.6	0	0	111.7	N139 T143 E144 Y145	N139-M141 PolarHBondContact O-N 3.03Å; M141-T143 PolarHBondContact O-N 3.07Å; M141-T143 VanDerWaalsContact O-N 3.11Å; M141-E144 PolarHBondContact O-N 2.83Å; M141-Y145 PolarHBondContact O-N 2.75Å
142	T	70.3	Confident	73.4	Confident	8 Å²	8	60.8 Å²	60.8	5%	0.049	33%	0.331	C	S	.	.	H	α-helix	trans	-45.3	-46.5	177.9	-35.6	0	0	0	0	113.1	E131 D132 F135 E144 Y145 S146	E131-T142 HydrophobicContact CB-CG2 3.59Å; D132-T142 WeakPolarHBondContact OD1-CB 3.46Å; D132-T142 PolarHBondContact OD1-OG1 3.34Å; F135-T142 HydrophobicContact CD2-CG2 3.82Å; F135-T142 WeakPolarHBondContact CD2-OG1 3.46Å; F135-T142 HydrophobicContact CE2-CG2 3.57Å; F135-T142 WeakPolarHBondContact CG-OG1 2.98Å; F135-T142 HydrophobicContact CZ-CG2 4.25Å; T142-E144 PolarHBondContact O-N 3.4Å; T142-Y145 PolarHBondContact O-N 3.22Å; T142-S146 WeakPolarHBondContact O-CB 3.38Å; T142-S146 PolarHBondContact O-N 3.09Å; T142-S146 PolarHBondContact O-OG 2.96Å
143	T	75.1	Confident	74.8	Confident	86 Å²	86	57.9 Å²	57.9	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-39.8	-175.6	52.6	0	0	0	0	112.3	M141 K147	M141-T143 PolarHBondContact O-N 3.07Å; M141-T143 VanDerWaalsContact O-N 3.11Å; T143-K147 VanDerWaalsContact O-CG 3.24Å; T143-K147 WeakPolarHBondContact O-CG 3.28Å; T143-K147 PolarHBondContact O-N 3.35Å; T143-K147 VanDerWaalsContact O-N 3.1Å
144	E	82.6	Confident	75.8	Confident	46 Å²	46	61.1 Å²	61.1	22%	0.215	33%	0.332	C	S	.	.	H	α-helix	trans	-74.9	-35.6	177.9	-61.6	-50.4	132.1	0	0	110.8	M141 T142 K147 M148 D215 C216	M141-E144 PolarHBondContact O-N 2.83Å; T142-E144 PolarHBondContact O-N 3.4Å; E144-K147 PolarHBondContact O-N 2.87Å; E144-K147 IonicContact OE1-NZ 2.76Å; E144-K147 PolarHBondContact OE1-NZ 3.07Å; E144-K147 WeakPolarHBondContact OE2-CD 3.16Å; E144-K147 IonicContact OE2-NZ 2.7Å; E144-K147 PolarHBondContact OE2-NZ 2.86Å; E144-M148 PolarHBondContact O-N 3.01Å; E144-D215 HydrophobicContact CG-CB 4.34Å; E144-C216 VanDerWaalsContact CB-SG 3.53Å
145	Y	83.9	Confident	76.9	Confident	5 Å²	5	58.6 Å²	58.6	2%	0.02	32%	0.322	C	S	.	.	H	α-helix	trans	-63.6	-46.2	174.6	-169.5	-123.4	0	0	0	111.8	F135 M141 T142 K147 M148 K149 C216 D220 L221 Y224 D225	F135-Y145 HydrophobicContact CE1-CD1 4.24Å; F135-Y145 HydrophobicContact CZ-CD1 4.15Å; M141-Y145 PolarHBondContact O-N 2.75Å; T142-Y145 PolarHBondContact O-N 3.22Å; Y145-K147 PolarHBondContact O-N 3.26Å; Y145-M148 HydrophobicContact CD2-CE 3.7Å; Y145-M148 HydrophobicContact CE2-CE 3.42Å; Y145-M148 VanDerWaalsContact CE2-CE 3.42Å; Y145-M148 WeakPolarHBondContact O-CB 3.49Å; Y145-M148 PolarHBondContact O-N 2.98Å; Y145-K149 HydrophobicContact CD1-CD 4.29Å; Y145-K149 HydrophobicContact CE1-CD 3.78Å; Y145-K149 WeakPolarHBondContact O-CG 3.26Å; Y145-K149 PolarHBondContact O-N 2.79Å; Y145-C216 PolarHBondContact N-SG 3.2Å; Y145-D220 HydrophobicContact CD2-CB 4.4Å; Y145-D220 HydrophobicContact CE2-CB 4.16Å; Y145-L221 WeakPolarHBondContact OH-CA 3.31Å; Y145-L221 WeakPolarHBondContact OH-CD1 3.41Å; Y145-Y224 HydrophobicContact CD1-CD2 4.33Å; Y145-Y224 AromaticContact CD2-CD2 3.95Å; Y145-Y224 HydrophobicContact CD2-CD2 3.95Å; Y145-Y224 HydrophobicContact CD2-CE2 4.25Å; Y145-Y224 HydrophobicContact CE1-CD2 4.14Å; Y145-Y224 AromaticContact CE2-CD2 3.77Å; Y145-Y224 HydrophobicContact CE2-CD2 3.77Å; Y145-Y224 HydrophobicContact CE2-CE2 4.46Å; Y145-Y224 HydrophobicContact CG-CD2 4.25Å; Y145-Y224 AromaticContact CZ-CD2 3.87Å; Y145-D225 PolarHBondContact OH-OD2 2.85Å
146	S	80.5	Confident	78.1	Confident	42 Å²	42	58 Å²	58	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-65.6	-35.9	176.5	-69.9	0	0	0	0	112.7	T142 K149 S150	T142-S146 WeakPolarHBondContact O-CB 3.38Å; T142-S146 PolarHBondContact O-N 3.09Å; T142-S146 PolarHBondContact O-OG 2.96Å; S146-K149 PolarHBondContact O-N 2.86Å; S146-S150 WeakPolarHBondContact O-CB 3.46Å; S146-S150 PolarHBondContact O-N 2.74Å
147	K	83.3	Confident	79.4	Confident	121 Å²	121	51.1 Å²	51.1	53%	0.526	29%	0.292	S	S	.	.	H	α-helix	trans	-62.9	-45.3	170.9	-76.1	170.6	-173.1	171.9	0	112.1	T143 E144 Y145 K149 S150 M151	T143-K147 VanDerWaalsContact O-CG 3.24Å; T143-K147 WeakPolarHBondContact O-CG 3.28Å; T143-K147 PolarHBondContact O-N 3.35Å; T143-K147 VanDerWaalsContact O-N 3.1Å; E144-K147 PolarHBondContact O-N 2.87Å; E144-K147 IonicContact OE1-NZ 2.76Å; E144-K147 PolarHBondContact OE1-NZ 3.07Å; E144-K147 WeakPolarHBondContact OE2-CD 3.16Å; E144-K147 IonicContact OE2-NZ 2.7Å; E144-K147 PolarHBondContact OE2-NZ 2.86Å; Y145-K147 PolarHBondContact O-N 3.26Å; K147-K149 VanDerWaalsContact C-N 3.33Å; K147-K149 PolarHBondContact O-N 2.92Å; K147-S150 PolarHBondContact O-N 3.41Å; K147-M151 WeakPolarHBondContact O-CB 3.21Å; K147-M151 PolarHBondContact O-N 2.84Å
148	M	86.6	Confident	80.5	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-58	-47.1	176.4	-176.8	-172.5	76.7	0	0	110.8	E144 Y145 S150 M151 L152 L213 C216 T217	E144-M148 PolarHBondContact O-N 3.01Å; Y145-M148 HydrophobicContact CD2-CE 3.7Å; Y145-M148 HydrophobicContact CE2-CE 3.42Å; Y145-M148 VanDerWaalsContact CE2-CE 3.42Å; Y145-M148 WeakPolarHBondContact O-CB 3.49Å; Y145-M148 PolarHBondContact O-N 2.98Å; M148-S150 PolarHBondContact O-N 2.86Å; M148-M151 WeakPolarHBondContact O-CB 3.38Å; M148-M151 PolarHBondContact O-N 2.86Å; M148-L152 HydrophobicContact CG-CD1 4.46Å; M148-L152 WeakPolarHBondContact O-CG 3.3Å; M148-L152 PolarHBondContact O-N 2.93Å; M148-L213 HydrophobicContact CB-CD2 3.73Å; M148-L213 HydrophobicContact CG-CD1 4.13Å; M148-L213 HydrophobicContact CG-CD2 3.69Å; M148-C216 HydrophobicContact CB-CB 4.46Å; M148-C216 HydrophobicContact SD-CB 3.99Å; M148-T217 VanDerWaalsContact SD-C 3.56Å; M148-T217 VanDerWaalsContact SD-O 3.35Å
149	K	88	Confident	81.2	Confident	23 Å²	23	54 Å²	54	10%	0.1	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-40.9	177.5	-68	-170.4	-63.7	-178.8	0	112.8	Y145 S146 K147 L152 L153 A241 F242	Y145-K149 HydrophobicContact CD1-CD 4.29Å; Y145-K149 HydrophobicContact CE1-CD 3.78Å; Y145-K149 WeakPolarHBondContact O-CG 3.26Å; Y145-K149 PolarHBondContact O-N 2.79Å; S146-K149 PolarHBondContact O-N 2.86Å; K147-K149 VanDerWaalsContact C-N 3.33Å; K147-K149 PolarHBondContact O-N 2.92Å; K149-L152 PolarHBondContact O-N 2.04Å; K149-L153 PolarHBondContact O-N 2.8Å; K149-L153 VanDerWaalsContact O-N 3.11Å; K149-A241 WeakPolarHBondContact CD-O 3.33Å; K149-A241 WeakPolarHBondContact CE-O 3.44Å; K149-A241 PolarHBondContact NZ-O 2.81Å; K149-F242 HydrophobicContact CB-CD1 4.26Å; K149-F242 HydrophobicContact CB-CE1 4.01Å; K149-F242 HydrophobicContact CG-CE1 4.18Å
150	S	84.4	Confident	81.2	Confident	60 Å²	60	49.2 Å²	49.2	42%	0.42	25%	0.251	S	S	.	.	H	α-helix	trans	-62.3	-43.6	174.5	-168.8	0	0	0	0	111.8	S146 K147 M148 L152 L153 D154	S146-S150 WeakPolarHBondContact O-CB 3.46Å; S146-S150 PolarHBondContact O-N 2.74Å; K147-S150 PolarHBondContact O-N 3.41Å; M148-S150 PolarHBondContact O-N 2.86Å; S150-L152 VanDerWaalsContact C-N 3.35Å; S150-L152 PolarHBondContact O-N 3.3Å; S150-L153 PolarHBondContact O-N 2.8Å; S150-D154 PolarHBondContact O-N 3.05Å
151	M	85.1	Confident	80.5	Confident	63 Å²	63	54 Å²	54	31%	0.31	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-43	177.1	-179.1	-175.5	177.8	0	0	111.8	K147 M148 D154 L155 L209 L213	K147-M151 WeakPolarHBondContact O-CB 3.21Å; K147-M151 PolarHBondContact O-N 2.84Å; M148-M151 WeakPolarHBondContact O-CB 3.38Å; M148-M151 PolarHBondContact O-N 2.86Å; M151-D154 PolarHBondContact O-N 3.05Å; M151-L155 HydrophobicContact CE-CD1 4.28Å; M151-L155 HydrophobicContact CG-CD1 4.28Å; M151-L155 WeakPolarHBondContact O-CB 3.45Å; M151-L155 WeakPolarHBondContact O-CG 3.19Å; M151-L155 PolarHBondContact O-N 2.81Å; M151-L209 HydrophobicContact CE-CD2 4.16Å; M151-L213 HydrophobicContact SD-CD2 4.27Å; M151-L213 HydrophobicContact SD-CG 4.4Å
152	L	87.1	Confident	79.8	Confident	10 Å²	10	55 Å²	55	5%	0.052	29%	0.287	C	S	.	.	H	α-helix	trans	-61.5	-43.3	176.2	-69.4	171.9	0	0	0	111.9	M148 K149 S150 Q156 M183 F187 L209 L218 F242	M148-L152 HydrophobicContact CG-CD1 4.46Å; M148-L152 WeakPolarHBondContact O-CG 3.3Å; M148-L152 PolarHBondContact O-N 2.93Å; K149-L152 PolarHBondContact O-N 2.04Å; S150-L152 VanDerWaalsContact C-N 3.35Å; S150-L152 PolarHBondContact O-N 3.3Å; L152-Q156 PolarHBondContact O-N 3.01Å; L152-Q156 VanDerWaalsContact O-N 3.12Å; L152-M183 HydrophobicContact CB-SD 3.93Å; L152-F187 HydrophobicContact CD2-CZ 4.34Å; L152-L209 HydrophobicContact CD2-CD1 4.24Å; L152-L209 HydrophobicContact CD2-CD2 4.29Å; L152-L218 HydrophobicContact CD1-CD1 3.57Å; L152-L218 HydrophobicContact CD2-CD1 4.01Å; L152-L218 HydrophobicContact CG-CD1 4.42Å; L152-F242 HydrophobicContact CB-CE1 4.2Å; L152-F242 HydrophobicContact CB-CZ 4.5Å; L152-F242 HydrophobicContact CD1-CE1 4.31Å; L152-F242 HydrophobicContact CD1-CZ 4.05Å
153	L	85.4	Confident	79.1	Confident	28 Å²	28	61.3 Å²	61.3	15%	0.147	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-41.1	175.3	-73.4	173.1	0	0	0	112.3	K149 S150 Q156 N157 V180 M183 F242	K149-L153 PolarHBondContact O-N 2.8Å; K149-L153 VanDerWaalsContact O-N 3.11Å; S150-L153 PolarHBondContact O-N 2.8Å; L153-Q156 PolarHBondContact O-N 3.39Å; L153-N157 WeakPolarHBondContact O-CB 3.49Å; L153-N157 PolarHBondContact O-N 2.99Å; L153-V180 HydrophobicContact CD2-CG2 3.62Å; L153-M183 HydrophobicContact CD2-CE 3.99Å; L153-F242 HydrophobicContact CD1-CD1 4.03Å; L153-F242 HydrophobicContact CD2-CD1 4.01Å; L153-F242 HydrophobicContact CG-CD1 3.82Å; L153-F242 HydrophobicContact CG-CE1 4.28Å
154	D	83.8	Confident	78.1	Confident	85 Å²	85	63.3 Å²	63.3	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-65.9	-43.9	178.7	-75.4	-29.2	0	0	0	112.1	S150 M151 Q156 N157 Q158	S150-D154 PolarHBondContact O-N 3.05Å; M151-D154 PolarHBondContact O-N 3.05Å; D154-Q156 VanDerWaalsContact C-N 3.26Å; D154-Q156 PolarHBondContact O-N 3.33Å; D154-N157 PolarHBondContact O-N 2.93Å; D154-Q158 WeakPolarHBondContact O-CG 3.4Å; D154-Q158 PolarHBondContact O-N 3.33Å
155	L	83	Confident	76.6	Confident	46 Å²	46	69.1 Å²	69.1	24%	0.241	35%	0.352	C	S	.	.	H	α-helix	trans	-57.1	-42.3	173.6	-76.7	171	0	0	0	111	M151 K159 L209	M151-L155 HydrophobicContact CE-CD1 4.28Å; M151-L155 HydrophobicContact CG-CD1 4.28Å; M151-L155 WeakPolarHBondContact O-CB 3.45Å; M151-L155 WeakPolarHBondContact O-CG 3.19Å; M151-L155 PolarHBondContact O-N 2.81Å; L155-K159 PolarHBondContact O-N 3.02Å; L155-L209 HydrophobicContact CD1-CD2 4.1Å
156	Q	83.3	Confident	74.9	Confident	18 Å²	18	77.4 Å²	77.4	8%	0.084	39%	0.391	C	S	.	.	H	α-helix	trans	-71.2	-38.6	177.8	-166.5	61.3	17.6	0	0	112.5	L152 L153 D154 Q158 K159 Y160 L179 M183	L152-Q156 PolarHBondContact O-N 3.01Å; L152-Q156 VanDerWaalsContact O-N 3.12Å; L153-Q156 PolarHBondContact O-N 3.39Å; D154-Q156 VanDerWaalsContact C-N 3.26Å; D154-Q156 PolarHBondContact O-N 3.33Å; Q156-Q158 VanDerWaalsContact C-N 3.32Å; Q156-Q158 PolarHBondContact O-N 2.83Å; Q156-K159 WeakPolarHBondContact O-CB 3.37Å; Q156-K159 PolarHBondContact O-N 3.18Å; Q156-K159 VanDerWaalsContact O-N 3.16Å; Q156-Y160 PolarHBondContact O-N 3.14Å; Q156-L179 HydrophobicContact CG-CD2 4.31Å; Q156-M183 HydrophobicContact CG-CB 4.2Å
157	N	82.2	Confident	73.4	Confident	35 Å²	35	81.7 Å²	81.7	19%	0.187	41%	0.411	C	S	.	.	H	α-helix	trans	-62.9	-38.1	176.9	-170.8	35.4	0	0	0	112	L153 D154 K159 Y160 I161 R175 L179	L153-N157 WeakPolarHBondContact O-CB 3.49Å; L153-N157 PolarHBondContact O-N 2.99Å; D154-N157 PolarHBondContact O-N 2.93Å; N157-K159 VanDerWaalsContact C-N 3.32Å; N157-K159 PolarHBondContact O-N 3.44Å; N157-Y160 PolarHBondContact O-N 2.93Å; N157-I161 WeakPolarHBondContact O-CG1 3.24Å; N157-I161 PolarHBondContact O-N 3.07Å; N157-R175 PolarHBondContact OD1-NH2 2.92Å; N157-L179 HydrophobicContact CB-CD1 3.91Å; N157-L179 HydrophobicContact CB-CD2 4.19Å
158	Q	81.5	Confident	71.8	Confident	136 Å²	136	81.3 Å²	81.3	64%	0.636	42%	0.42	S	S	*	.	H	α-helix	trans	-61.1	-39.1	173.6	-73.1	178.8	7	0	0	112.5	D154 Q156 T162	D154-Q158 WeakPolarHBondContact O-CG 3.4Å; D154-Q158 PolarHBondContact O-N 3.33Å; Q156-Q158 VanDerWaalsContact C-N 3.32Å; Q156-Q158 PolarHBondContact O-N 2.83Å; Q158-T162 PolarHBondContact O-OG1 3.46Å
159	K	77	Confident	69.9	Low	73 Å²	73	88.6 Å²	88.6	32%	0.317	46%	0.459	S	S	.	.	H	α-helix	trans	-70.6	-31.2	175.3	-67	175.8	-176.1	174.3	0	113.1	L155 Q156 N157 T162 E207	L155-K159 PolarHBondContact O-N 3.02Å; Q156-K159 WeakPolarHBondContact O-CB 3.37Å; Q156-K159 PolarHBondContact O-N 3.18Å; Q156-K159 VanDerWaalsContact O-N 3.16Å; N157-K159 VanDerWaalsContact C-N 3.32Å; N157-K159 PolarHBondContact O-N 3.44Å; K159-T162 PolarHBondContact O-OG1 2.84Å; K159-E207 IonicContact NZ-OE1 2.71Å; K159-E207 PolarHBondContact NZ-OE1 2.78Å; K159-E207 IonicContact NZ-OE2 3.14Å
160	Y	67.9	Low	68.2	Low	45 Å²	45	90.6 Å²	90.6	18%	0.176	48%	0.476	C	S	.	.	H	α-helix	trans	-78.2	-42.5	-179.7	-176.1	-111.3	0	0	0	113	Q156 N157 T162 Q163 E164 T178 L179 Q182	Q156-Y160 PolarHBondContact O-N 3.14Å; N157-Y160 PolarHBondContact O-N 2.93Å; Y160-T162 PolarHBondContact O-N 3.14Å; Y160-T162 VanDerWaalsContact O-N 3.12Å; Y160-Q163 PolarHBondContact O-N 3.36Å; Y160-E164 VanDerWaalsContact CZ-OE2 3.31Å; Y160-E164 PolarHBondContact OH-OE2 3.32Å; Y160-T178 HydrophobicContact CE2-CG2 4.11Å; Y160-L179 HydrophobicContact CD1-CD2 4.17Å; Y160-L179 HydrophobicContact CG-CD2 4.02Å; Y160-Q182 VanDerWaalsContact CE2-NE2 3.3Å
161	I	63.3	Low	67.1	Low	104 Å²	104	92.3 Å²	92.3	53%	0.533	48%	0.481	S	S	.	.	H	α-helix	trans	-58.7	-27.4	177.2	-69	166.7	0	0	0	111.7	N157 Q163	N157-I161 WeakPolarHBondContact O-CG1 3.24Å; N157-I161 PolarHBondContact O-N 3.07Å; I161-Q163 PolarHBondContact O-N 2.74Å
162	T	60.8	Low	66.4	Low	119 Å²	119	95 Å²	95	73%	0.73	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.3	175.7	20	0	0	0	0	113.9	Q158 K159 Y160	Q158-T162 PolarHBondContact O-OG1 3.46Å; K159-T162 PolarHBondContact O-OG1 2.84Å; Y160-T162 PolarHBondContact O-N 3.14Å; Y160-T162 VanDerWaalsContact O-N 3.12Å
163	Q	57.3	Low	65.6	Low	140 Å²	140	96.8 Å²	96.8	65%	0.654	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-24.7	-170.9	-65.7	-177.5	1.4	0	0	115.7	Y160 I161	Y160-Q163 PolarHBondContact O-N 3.36Å; I161-Q163 PolarHBondContact O-N 2.74Å
164	E	52.6	Low	65	Low	128 Å²	128	98.6 Å²	98.6	60%	0.598	52%	0.52	S	S	*	.			trans	-135.8	142.3	-176.4	-73.3	-172.6	154.5	0	0	114.8	Y160	Y160-E164 VanDerWaalsContact CZ-OE2 3.31Å; Y160-E164 PolarHBondContact OH-OE2 3.32Å
165	N	52.5	Low	64.9	Low	168 Å²	168	99 Å²	99	90%	0.898	52%	0.516	S	S	*	.			trans	-75.5	135.4	173.3	-88.4	-23.7	0	0	0	110.9
166	E	47.8	Very low	64.9	Low	180 Å²	180	99.1 Å²	99.1	84%	0.841	51%	0.514	S	S	*	.			trans	-43.7	129.2	-171.7	-63.5	-176.9	158.1	0	0	115.8
167	N	47.5	Very low	64.9	Low	132 Å²	132	101 Å²	101	71%	0.706	52%	0.522	S	S	*	.			trans	-113.8	96.4	150.4	-152.7	14.4	0	0	0	107.5	N169	N167-N169 PolarHBondContact O-N 2.67Å
168	P	50.4	Low	65.1	Low	113 Å²	113	101.8 Å²	101.8	73%	0.734	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	2.5	-167.6	25	-33	0	0	0	115.1
169	N	47.4	Very low	65.4	Low	154 Å²	154	95.9 Å²	95.9	82%	0.824	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	15.1	-171.1	-127	38.4	0	0	0	114.1	N167	N167-N169 PolarHBondContact O-N 2.67Å
170	S	51.1	Low	66	Low	66 Å²	66	92.4 Å²	92.4	46%	0.462	49%	0.486	S	S	.	.			trans	-77.4	130.7	173.7	65.6	0	0	0	0	110.9
171	D	61.9	Low	67	Low	96 Å²	96	92.1 Å²	92.1	51%	0.513	49%	0.487	S	S	.	.			trans	-50.1	135.9	169.9	176.7	26.9	0	0	0	111.6	I173 S174 R175	D171-I173 PolarHBondContact O-N 3.02Å; D171-I173 VanDerWaalsContact O-N 3.16Å; D171-S174 WeakPolarHBondContact O-CB 3.3Å; D171-S174 PolarHBondContact O-N 3.06Å; D171-R175 PolarHBondContact O-N 3.35Å; D171-R175 VanDerWaalsContact O-N 3.14Å
172	D	71.4	Confident	68.3	Low	120 Å²	120	89.5 Å²	89.5	64%	0.642	47%	0.473	S	S	*	.	H	α-helix	trans	-55.9	-35.3	-174.3	-174.6	52.4	0	0	0	111.5	R175 K176	D172-R175 PolarHBondContact O-N 2.87Å; D172-K176 WeakPolarHBondContact O-CB 3.32Å; D172-K176 PolarHBondContact O-N 3.42Å
173	I	70	Confident	69.7	Low	47 Å²	47	84 Å²	84	24%	0.241	44%	0.439	C	S	.	.	H	α-helix	trans	-70.5	-39	179.3	-55.6	-174.5	0	0	0	111.5	D171 R175 K176 K177 Y326	D171-I173 PolarHBondContact O-N 3.02Å; D171-I173 VanDerWaalsContact O-N 3.16Å; I173-R175 VanDerWaalsContact C-N 3.31Å; I173-R175 PolarHBondContact O-N 3.4Å; I173-K176 PolarHBondContact O-N 2.79Å; I173-K177 VanDerWaalsContact O-CB 3.31Å; I173-K177 WeakPolarHBondContact O-CB 3.42Å; I173-K177 PolarHBondContact O-N 3.47Å; I173-Y326 HydrophobicContact CD1-CD1 4.16Å; I173-Y326 HydrophobicContact CD1-CE1 3.22Å; I173-Y326 WeakPolarHBondContact CD1-OH 3.24Å
174	S	73.2	Confident	71.3	Confident	65 Å²	65	77.8 Å²	77.8	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-64.6	-39.3	175.8	-66.1	0	0	0	0	111	D171 T178	D171-S174 WeakPolarHBondContact O-CB 3.3Å; D171-S174 PolarHBondContact O-N 3.06Å; S174-T178 PolarHBondContact O-N 3.05Å; S174-T178 PolarHBondContact O-OG1 2.94Å; S174-T178 VanDerWaalsContact O-OG1 3.06Å
175	R	80.1	Confident	73.2	Confident	94 Å²	94	79.1 Å²	79.1	36%	0.355	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-48.4	173.7	-176.5	-179.7	178.6	170.7	2.3	111.3	N157 D171 D172 I173 K177 T178 L179	N157-R175 PolarHBondContact OD1-NH2 2.92Å; D171-R175 PolarHBondContact O-N 3.35Å; D171-R175 VanDerWaalsContact O-N 3.14Å; D172-R175 PolarHBondContact O-N 2.87Å; I173-R175 VanDerWaalsContact C-N 3.31Å; I173-R175 PolarHBondContact O-N 3.4Å; R175-K177 VanDerWaalsContact C-N 3.29Å; R175-K177 PolarHBondContact O-N 2.96Å; R175-T178 PolarHBondContact O-N 2.85Å; R175-T178 VanDerWaalsContact O-N 3.16Å; R175-L179 HydrophobicContact CG-CD1 4.46Å; R175-L179 WeakPolarHBondContact O-CG 3.34Å; R175-L179 PolarHBondContact O-N 3.49Å
176	K	83.5	Confident	74.9	Confident	48 Å²	48	74.4 Å²	74.4	21%	0.209	38%	0.383	C	S	.	.	H	α-helix	trans	-58.2	-42.2	177.4	-167	-179.1	-174.8	-168.6	0	111.4	D172 I173 L179 V180 F242 Q243 V244	D172-K176 WeakPolarHBondContact O-CB 3.32Å; D172-K176 PolarHBondContact O-N 3.42Å; I173-K176 PolarHBondContact O-N 2.79Å; K176-L179 PolarHBondContact O-N 2.71Å; K176-V180 WeakPolarHBondContact O-CB 3.44Å; K176-V180 VanDerWaalsContact O-CG2 3.26Å; K176-V180 WeakPolarHBondContact O-CG2 3.36Å; K176-V180 PolarHBondContact O-N 2.89Å; K176-F242 WeakPolarHBondContact CE-O 3.05Å; K176-F242 PolarHBondContact NZ-O 2.76Å; K176-Q243 PolarHBondContact NZ-O 2.92Å; K176-V244 HydrophobicContact CG-CG2 4.45Å
177	K	84.2	Confident	77	Confident	59 Å²	59	66.1 Å²	66.1	26%	0.257	35%	0.345	S	S	.	.	H	α-helix	trans	-59.1	-49.4	173.8	179.6	172.7	178.1	169.9	0	111.8	I173 R175 L179 V180 D181 Y239 V244	I173-K177 VanDerWaalsContact O-CB 3.31Å; I173-K177 WeakPolarHBondContact O-CB 3.42Å; I173-K177 PolarHBondContact O-N 3.47Å; R175-K177 VanDerWaalsContact C-N 3.29Å; R175-K177 PolarHBondContact O-N 2.96Å; K177-L179 VanDerWaalsContact C-N 3.29Å; K177-L179 PolarHBondContact O-N 2.93Å; K177-V180 CarbonylContact O-C 3.6Å; K177-V180 PolarHBondContact O-N 2.77Å; K177-V180 VanDerWaalsContact O-N 3.14Å; K177-D181 WeakPolarHBondContact O-CB 2.96Å; K177-D181 VanDerWaalsContact O-CG 3.3Å; K177-D181 PolarHBondContact O-N 3.32Å; K177-Y239 WeakPolarHBondContact CE-OH 3.39Å; K177-Y239 HydrophobicContact CG-CE1 4.33Å; K177-V244 HydrophobicContact CB-CG1 3.87Å; K177-V244 HydrophobicContact CG-CG1 4.1Å
178	T	85.6	Confident	79.2	Confident	50 Å²	50	60.3 Å²	60.3	31%	0.307	31%	0.314	S	S	.	.	H	α-helix	trans	-58.7	-41.8	177.4	-59	0	0	0	0	111.9	Y160 S174 R175 D181 Q182	Y160-T178 HydrophobicContact CE2-CG2 4.11Å; S174-T178 PolarHBondContact O-N 3.05Å; S174-T178 PolarHBondContact O-OG1 2.94Å; S174-T178 VanDerWaalsContact O-OG1 3.06Å; R175-T178 PolarHBondContact O-N 2.85Å; R175-T178 VanDerWaalsContact O-N 3.16Å; T178-D181 PolarHBondContact O-N 3.13Å; T178-Q182 WeakPolarHBondContact O-CB 3.43Å; T178-Q182 VanDerWaalsContact O-CG 3.28Å; T178-Q182 WeakPolarHBondContact O-CG 3.19Å; T178-Q182 PolarHBondContact O-N 2.93Å
179	L	88.8	Confident	81.1	Confident	12 Å²	12	57.7 Å²	57.7	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-44.5	175.7	-67.6	175.1	0	0	0	111.6	Q156 N157 Y160 R175 K176 K177 Q182 M183	Q156-L179 HydrophobicContact CG-CD2 4.31Å; N157-L179 HydrophobicContact CB-CD1 3.91Å; N157-L179 HydrophobicContact CB-CD2 4.19Å; Y160-L179 HydrophobicContact CD1-CD2 4.17Å; Y160-L179 HydrophobicContact CG-CD2 4.02Å; R175-L179 HydrophobicContact CG-CD1 4.46Å; R175-L179 WeakPolarHBondContact O-CG 3.34Å; R175-L179 PolarHBondContact O-N 3.49Å; K176-L179 PolarHBondContact O-N 2.71Å; K177-L179 VanDerWaalsContact C-N 3.29Å; K177-L179 PolarHBondContact O-N 2.93Å; L179-Q182 PolarHBondContact O-N 3.04Å; L179-M183 VanDerWaalsContact O-CB 3.31Å; L179-M183 WeakPolarHBondContact O-CB 3.41Å; L179-M183 PolarHBondContact O-N 3.1Å
180	V	89	Confident	83.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68.9	-38.5	179.4	175.4	0	0	0	0	111.8	L153 K176 K177 Q182 M183 F184 F238 Y239 F242 V244	L153-V180 HydrophobicContact CD2-CG2 3.62Å; K176-V180 WeakPolarHBondContact O-CB 3.44Å; K176-V180 VanDerWaalsContact O-CG2 3.26Å; K176-V180 WeakPolarHBondContact O-CG2 3.36Å; K176-V180 PolarHBondContact O-N 2.89Å; K177-V180 CarbonylContact O-C 3.6Å; K177-V180 PolarHBondContact O-N 2.77Å; K177-V180 VanDerWaalsContact O-N 3.14Å; V180-Q182 VanDerWaalsContact C-N 3.33Å; V180-Q182 PolarHBondContact O-N 3.23Å; V180-M183 HydrophobicContact CG2-CE 4.17Å; V180-M183 PolarHBondContact O-N 3Å; V180-F184 WeakPolarHBondContact O-CB 3.46Å; V180-F184 PolarHBondContact O-N 2.94Å; V180-F238 HydrophobicContact CG1-CD1 3.5Å; V180-F238 VanDerWaalsContact CG1-CD1 3.5Å; V180-F238 HydrophobicContact CG1-CE1 3.93Å; V180-Y239 HydrophobicContact CG1-CD1 3.76Å; V180-Y239 HydrophobicContact CG1-CE1 4.11Å; V180-F242 HydrophobicContact CG1-CB 4.32Å; V180-F242 HydrophobicContact CG1-CD2 4.23Å; V180-F242 HydrophobicContact CG2-CB 3.65Å; V180-F242 HydrophobicContact CG2-CD2 4.46Å; V180-F242 HydrophobicContact CG2-CG 4.04Å; V180-V244 HydrophobicContact CB-CG2 3.85Å; V180-V244 HydrophobicContact CG1-CG2 4Å; V180-V244 HydrophobicContact CG2-CG2 3.59Å
181	D	89.6	Confident	85.1	Confident	40 Å²	40	56.8 Å²	56.8	21%	0.214	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-42.1	173.6	-75	-20.3	0	0	0	111.7	K177 T178 K185 Y239	K177-D181 WeakPolarHBondContact O-CB 2.96Å; K177-D181 VanDerWaalsContact O-CG 3.3Å; K177-D181 PolarHBondContact O-N 3.32Å; T178-D181 PolarHBondContact O-N 3.13Å; D181-K185 WeakPolarHBondContact O-CB 3.32Å; D181-K185 VanDerWaalsContact O-CG 3.28Å; D181-K185 WeakPolarHBondContact O-CG 3.26Å; D181-K185 PolarHBondContact O-N 2.96Å; D181-Y239 WeakPolarHBondContact OD1-CE1 3.45Å; D181-Y239 VanDerWaalsContact OD1-CZ 3.24Å; D181-Y239 PolarHBondContact OD1-OH 3.1Å
182	Q	89	Confident	86.5	Confident	48 Å²	48	56.1 Å²	56.1	22%	0.224	30%	0.296	C	S	.	.	H	α-helix	trans	-70.1	-39.4	176.6	-72	176.8	-2.9	0	0	112	Y160 T178 L179 V180 K185 Y186	Y160-Q182 VanDerWaalsContact CE2-NE2 3.3Å; T178-Q182 WeakPolarHBondContact O-CB 3.43Å; T178-Q182 VanDerWaalsContact O-CG 3.28Å; T178-Q182 WeakPolarHBondContact O-CG 3.19Å; T178-Q182 PolarHBondContact O-N 2.93Å; L179-Q182 PolarHBondContact O-N 3.04Å; V180-Q182 VanDerWaalsContact C-N 3.33Å; V180-Q182 PolarHBondContact O-N 3.23Å; Q182-K185 PolarHBondContact O-N 2.99Å; Q182-Y186 WeakPolarHBondContact O-CB 3.42Å; Q182-Y186 PolarHBondContact O-N 2.86Å
183	M	90.7	Very high	87.5	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-42.9	176.1	-172.1	170.1	52.7	0	0	110.8	L152 L153 Q156 L179 V180 Y186 F187 F238 F242	L152-M183 HydrophobicContact CB-SD 3.93Å; L153-M183 HydrophobicContact CD2-CE 3.99Å; Q156-M183 HydrophobicContact CG-CB 4.2Å; L179-M183 VanDerWaalsContact O-CB 3.31Å; L179-M183 WeakPolarHBondContact O-CB 3.41Å; L179-M183 PolarHBondContact O-N 3.1Å; V180-M183 HydrophobicContact CG2-CE 4.17Å; V180-M183 PolarHBondContact O-N 3Å; M183-Y186 WeakPolarHBondContact O-CB 3.32Å; M183-Y186 PolarHBondContact O-N 3.08Å; M183-Y186 VanDerWaalsContact O-N 3.16Å; M183-F187 HydrophobicContact CG-CD2 4.01Å; M183-F187 HydrophobicContact CG-CE2 3.62Å; M183-F187 HydrophobicContact CG-CZ 4.06Å; M183-F187 WeakPolarHBondContact O-CD2 3.17Å; M183-F187 PolarHBondContact O-N 3.11Å; M183-F187 HydrophobicContact SD-CE2 4.49Å; M183-F187 HydrophobicContact SD-CZ 4.44Å; M183-F238 HydrophobicContact CB-CE1 4.1Å; M183-F238 HydrophobicContact CB-CZ 4.44Å; M183-F238 HydrophobicContact CE-CE1 3.6Å; M183-F238 HydrophobicContact CE-CZ 3.91Å; M183-F238 HydrophobicContact CG-CE1 4.05Å; M183-F238 HydrophobicContact CG-CZ 3.92Å; M183-F238 HydrophobicContact SD-CZ 4.42Å; M183-F242 HydrophobicContact CE-CD1 3.71Å; M183-F242 HydrophobicContact CE-CD2 3.56Å; M183-F242 HydrophobicContact CE-CE1 3.42Å; M183-F242 VanDerWaalsContact CE-CE1 3.42Å; M183-F242 HydrophobicContact CE-CE2 3.31Å; M183-F242 HydrophobicContact CE-CG 3.79Å; M183-F242 HydrophobicContact CE-CZ 3.22Å; M183-F242 HydrophobicContact SD-CE1 4.22Å; M183-F242 HydrophobicContact SD-CE2 4.44Å; M183-F242 HydrophobicContact SD-CZ 3.95Å
184	F	92	Very high	88.6	Confident	11 Å²	11	52.6 Å²	52.6	5%	0.048	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-50.1	174.7	-173.1	-93.9	0	0	0	111.1	V180 Y186 F187 D188 G193 V195 L233 L235 F238	V180-F184 WeakPolarHBondContact O-CB 3.46Å; V180-F184 PolarHBondContact O-N 2.94Å; F184-Y186 PolarHBondContact O-N 2.84Å; F184-F187 PolarHBondContact O-N 2.85Å; F184-D188 HydrophobicContact CD1-CB 4.47Å; F184-D188 HydrophobicContact CE1-CB 4.22Å; F184-D188 WeakPolarHBondContact O-CB 3.49Å; F184-D188 PolarHBondContact O-N 3.33Å; F184-G193 WeakPolarHBondContact CZ-O 3.41Å; F184-V195 HydrophobicContact CD2-CG2 3.98Å; F184-V195 HydrophobicContact CE2-CG2 3.69Å; F184-V195 HydrophobicContact CZ-CG2 4.16Å; F184-L233 WeakPolarHBondContact CE2-O 3.36Å; F184-L235 HydrophobicContact CB-CD1 3.89Å; F184-L235 HydrophobicContact CD1-CB 4.46Å; F184-L235 HydrophobicContact CD1-CD1 3.83Å; F184-L235 HydrophobicContact CD2-CD1 3.99Å; F184-L235 HydrophobicContact CE1-CB 4.17Å; F184-L235 HydrophobicContact CE1-CD1 4.38Å; F184-L235 HydrophobicContact CE2-CB 4.23Å; F184-L235 HydrophobicContact CG-CD1 3.6Å; F184-L235 HydrophobicContact CZ-CB 4.04Å; F184-F238 HydrophobicContact CB-CD1 3.79Å; F184-F238 HydrophobicContact CB-CE1 3.86Å; F184-F238 HydrophobicContact CB-CG 4.45Å; F184-F238 HydrophobicContact CD2-CB 3.66Å; F184-F238 AromaticContact CD2-CD1 3.76Å; F184-F238 HydrophobicContact CD2-CD1 3.76Å; F184-F238 AromaticContact CD2-CD2 3.91Å; F184-F238 HydrophobicContact CD2-CD2 3.91Å; F184-F238 HydrophobicContact CD2-CE1 4.31Å; F184-F238 HydrophobicContact CD2-CE2 4.43Å; F184-F238 AromaticContact CD2-CG 3.54Å; F184-F238 HydrophobicContact CD2-CG 3.54Å; F184-F238 HydrophobicContact CE2-CB 4.09Å; F184-F238 HydrophobicContact CE2-CD2 4.49Å; F184-F238 HydrophobicContact CE2-CG 4.31Å; F184-F238 HydrophobicContact CG-CD1 4.27Å; F184-F238 HydrophobicContact CG-CG 4.47Å
185	K	91.2	Very high	89.5	Confident	156 Å²	156	49.5 Å²	49.5	68%	0.678	26%	0.264	S	S	*	.	H	α-helix	trans	-59.8	-28.6	175.3	-75.4	174.6	-177.5	175.4	0	113.9	D181 Q182	D181-K185 WeakPolarHBondContact O-CB 3.32Å; D181-K185 VanDerWaalsContact O-CG 3.28Å; D181-K185 WeakPolarHBondContact O-CG 3.26Å; D181-K185 PolarHBondContact O-N 2.96Å; Q182-K185 PolarHBondContact O-N 2.99Å
186	Y	89.6	Confident	90.1	Very high	68 Å²	68	46.6 Å²	46.6	27%	0.267	26%	0.255	S	S	.	.	H	α-helix	trans	-78	-34.4	176.3	174.3	-114.9	0	0	0	111.7	Q182 M183 F184 V203 Q206 E207	Q182-Y186 WeakPolarHBondContact O-CB 3.42Å; Q182-Y186 PolarHBondContact O-N 2.86Å; M183-Y186 WeakPolarHBondContact O-CB 3.32Å; M183-Y186 PolarHBondContact O-N 3.08Å; M183-Y186 VanDerWaalsContact O-N 3.16Å; F184-Y186 PolarHBondContact O-N 2.84Å; Y186-V203 HydrophobicContact CE1-CG1 4.15Å; Y186-V203 HydrophobicContact CE1-CG2 4.3Å; Y186-Q206 PolarHBondContact OH-OE1 2.73Å; Y186-E207 HydrophobicContact CE1-CG 4.47Å
187	F	91.8	Very high	90.4	Very high	6 Å²	6	48.4 Å²	48.4	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-77.4	-39.8	179.3	-78.5	-143.1	0	0	0	111.2	L152 M183 F184 A189 V195 E199 L200 V203 L218 L221 F238	L152-F187 HydrophobicContact CD2-CZ 4.34Å; M183-F187 HydrophobicContact CG-CD2 4.01Å; M183-F187 HydrophobicContact CG-CE2 3.62Å; M183-F187 HydrophobicContact CG-CZ 4.06Å; M183-F187 WeakPolarHBondContact O-CD2 3.17Å; M183-F187 PolarHBondContact O-N 3.11Å; M183-F187 HydrophobicContact SD-CE2 4.49Å; M183-F187 HydrophobicContact SD-CZ 4.44Å; F184-F187 PolarHBondContact O-N 2.85Å; F187-A189 VanDerWaalsContact C-N 3.32Å; F187-A189 PolarHBondContact O-N 3.38Å; F187-V195 HydrophobicContact CB-CG1 3.99Å; F187-V195 HydrophobicContact CB-CG2 3.79Å; F187-V195 HydrophobicContact CD1-CG1 4.36Å; F187-E199 WeakPolarHBondContact O-CB 3.46Å; F187-L200 HydrophobicContact CD1-CD2 3.64Å; F187-L200 HydrophobicContact CE1-CD2 3.96Å; F187-V203 HydrophobicContact CB-CG2 4.46Å; F187-V203 HydrophobicContact CD1-CG2 4.46Å; F187-V203 HydrophobicContact CD2-CG1 4.25Å; F187-V203 HydrophobicContact CD2-CG2 3.89Å; F187-V203 HydrophobicContact CE1-CG1 4.43Å; F187-V203 HydrophobicContact CE2-CG1 3.75Å; F187-V203 HydrophobicContact CE2-CG2 4.24Å; F187-V203 HydrophobicContact CG-CG2 4.01Å; F187-V203 HydrophobicContact CZ-CG1 3.85Å; F187-L218 HydrophobicContact CE1-CD1 3.93Å; F187-L218 HydrophobicContact CE1-CD2 3.84Å; F187-L218 HydrophobicContact CE1-CG 4.23Å; F187-L218 HydrophobicContact CZ-CD1 4.18Å; F187-L218 HydrophobicContact CZ-CD2 4.21Å; F187-L221 HydrophobicContact CE1-CD2 4.33Å; F187-F238 HydrophobicContact CD1-CE2 4Å; F187-F238 HydrophobicContact CD1-CZ 4.05Å; F187-F238 HydrophobicContact CE1-CE2 4.38Å; F187-F238 HydrophobicContact CE1-CZ 4.29Å; F187-F238 HydrophobicContact CG-CZ 4.36Å
188	D	93.1	Very high	90.7	Very high	11 Å²	11	50.3 Å²	50.3	6%	0.059	28%	0.279	C	S	.	.			trans	-75.8	77.9	174.2	177.9	10.5	0	0	0	110.3	F184 D190 S191 N192 G193 V195	F184-D188 HydrophobicContact CD1-CB 4.47Å; F184-D188 HydrophobicContact CE1-CB 4.22Å; F184-D188 WeakPolarHBondContact O-CB 3.49Å; F184-D188 PolarHBondContact O-N 3.33Å; D188-D190 VanDerWaalsContact C-N 3.33Å; D188-D190 PolarHBondContact O-N 2.59Å; D188-S191 PolarHBondContact O-N 2.94Å; D188-S191 WeakPolarHBondContact OD1-CA 3.43Å; D188-S191 PolarHBondContact OD1-N 3.35Å; D188-S191 WeakPolarHBondContact OD2-CA 3.22Å; D188-N192 PolarHBondContact OD1-N 3.04Å; D188-G193 VanDerWaalsContact OD2-CA 3.22Å; D188-G193 WeakPolarHBondContact OD2-CA 3.5Å; D188-G193 PolarHBondContact OD2-N 2.83Å; D188-V195 HydrophobicContact CB-CG2 4.17Å
189	A	89.5	Confident	91.1	Very high	58 Å²	58	48.3 Å²	48.3	48%	0.479	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-27	-170.7	0	0	0	0	0	112.7	F187 E199	F187-A189 VanDerWaalsContact C-N 3.32Å; F187-A189 PolarHBondContact O-N 3.38Å; A189-E199 HydrophobicContact CB-CG 4.38Å; A189-E199 PolarHBondContact N-OE1 2.95Å
190	D	91.4	Very high	91.1	Very high	101 Å²	101	47.8 Å²	47.8	54%	0.54	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.6	175.3	77.9	5.2	0	0	0	113.6	D188 N192 E199	D188-D190 VanDerWaalsContact C-N 3.33Å; D188-D190 PolarHBondContact O-N 2.59Å; D190-N192 VanDerWaalsContact C-N 3.27Å; D190-N192 PolarHBondContact O-N 3.48Å; D190-N192 WeakPolarHBondContact OD1-CB 3.34Å; D190-N192 PolarHBondContact OD1-N 2.81Å; D190-N192 PolarHBondContact OD1-ND2 2.97Å; D190-N192 PolarHBondContact OD2-ND2 3.29Å; D190-E199 PolarHBondContact N-OE1 2.91Å
191	S	91.2	Very high	91.1	Very high	99 Å²	99	49.5 Å²	49.5	69%	0.692	27%	0.274	S	S	*	.			trans	59.6	33.6	178.8	-57.4	0	0	0	0	113.5	D188 G193	D188-S191 PolarHBondContact O-N 2.94Å; D188-S191 WeakPolarHBondContact OD1-CA 3.43Å; D188-S191 PolarHBondContact OD1-N 3.35Å; D188-S191 WeakPolarHBondContact OD2-CA 3.22Å; S191-G193 VanDerWaalsContact C-N 3.31Å
192	N	92.2	Very high	90.9	Very high	83 Å²	83	52 Å²	52	44%	0.444	29%	0.285	S	S	.	.	S	Bend	trans	-83	-8.6	177.5	74	30.3	0	0	0	112.9	D188 D190 L194	D188-N192 PolarHBondContact OD1-N 3.04Å; D190-N192 VanDerWaalsContact C-N 3.27Å; D190-N192 PolarHBondContact O-N 3.48Å; D190-N192 WeakPolarHBondContact OD1-CB 3.34Å; D190-N192 PolarHBondContact OD1-N 2.81Å; D190-N192 PolarHBondContact OD1-ND2 2.97Å; D190-N192 PolarHBondContact OD2-ND2 3.29Å; N192-L194 WeakPolarHBondContact OD1-CA 3.43Å; N192-L194 VanDerWaalsContact OD1-CB 3.25Å; N192-L194 WeakPolarHBondContact OD1-CB 3.43Å; N192-L194 PolarHBondContact OD1-N 3.02Å; N192-L194 PolarHBondContact OD1-O 3.37Å; N192-L194 VanDerWaalsContact OD1-O 3.06Å
193	G	91.6	Very high	90.8	Very high	35 Å²	35	50 Å²	50	36%	0.361	28%	0.276	S	S	.	.	S	Bend	trans	89.8	10.9	-179.4	0	0	0	0	0	115.1	F184 D188 S191	F184-G193 WeakPolarHBondContact CZ-O 3.41Å; D188-G193 VanDerWaalsContact OD2-CA 3.22Å; D188-G193 WeakPolarHBondContact OD2-CA 3.5Å; D188-G193 PolarHBondContact OD2-N 2.83Å; S191-G193 VanDerWaalsContact C-N 3.31Å
194	L	93.5	Very high	90.5	Very high	58 Å²	58	50.4 Å²	50.4	30%	0.304	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	142.6	-177.9	-60	172.7	0	0	0	109.3	N192 H232 A234	N192-L194 WeakPolarHBondContact OD1-CA 3.43Å; N192-L194 VanDerWaalsContact OD1-CB 3.25Å; N192-L194 WeakPolarHBondContact OD1-CB 3.43Å; N192-L194 PolarHBondContact OD1-N 3.02Å; N192-L194 PolarHBondContact OD1-O 3.37Å; N192-L194 VanDerWaalsContact OD1-O 3.06Å; L194-H232 HydrophobicContact CB-CB 3.99Å; L194-H232 HydrophobicContact CD1-CB 4.42Å; L194-H232 HydrophobicContact CD2-CB 4.4Å; L194-A234 HydrophobicContact CD2-CB 4.03Å
195	V	92.7	Very high	90.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	116.5	175.7	179.3	0	0	0	0	110.8	F184 F187 D188 E199 L200 H232 L233	F184-V195 HydrophobicContact CD2-CG2 3.98Å; F184-V195 HydrophobicContact CE2-CG2 3.69Å; F184-V195 HydrophobicContact CZ-CG2 4.16Å; F187-V195 HydrophobicContact CB-CG1 3.99Å; F187-V195 HydrophobicContact CB-CG2 3.79Å; F187-V195 HydrophobicContact CD1-CG1 4.36Å; D188-V195 HydrophobicContact CB-CG2 4.17Å; V195-E199 VanDerWaalsContact CA-OE2 3.29Å; V195-E199 WeakPolarHBondContact CA-OE2 3.48Å; V195-E199 HydrophobicContact CG1-CB 4.42Å; V195-L200 HydrophobicContact CG1-CD2 3.58Å; V195-L200 HydrophobicContact CG1-CG 3.9Å; V195-H232 WeakPolarHBondContact O-CA 3.34Å; V195-L233 HydrophobicContact CB-CB 4.25Å; V195-L233 PolarHBondContact N-O 2.99Å; V195-L233 PolarHBondContact O-N 2.92Å
196	D	92.2	Very high	89.6	Confident	32 Å²	32	56.1 Å²	56.1	17%	0.171	30%	0.304	C	S	.	.			trans	-99.3	172.5	179.9	91.5	1.5	0	0	0	113.8	N198 E199 L200	D196-N198 VanDerWaalsContact C-N 3.29Å; D196-N198 PolarHBondContact O-N 2.88Å; D196-N198 VanDerWaalsContact OD1-CA 3.27Å; D196-N198 WeakPolarHBondContact OD1-CA 3.34Å; D196-N198 VanDerWaalsContact OD1-CB 3.22Å; D196-N198 WeakPolarHBondContact OD1-CB 3.2Å; D196-N198 PolarHBondContact OD1-N 3.48Å; D196-N198 PolarHBondContact OD2-ND2 2.77Å; D196-E199 PolarHBondContact N-OE2 3.17Å; D196-E199 PolarHBondContact O-N 3.34Å; D196-E199 WeakPolarHBondContact OD1-CG 3.38Å; D196-E199 PolarHBondContact OD1-N 3.06Å; D196-L200 WeakPolarHBondContact O-CG 3.41Å; D196-L200 PolarHBondContact O-N 2.9Å
197	I	90.2	Very high	88.8	Confident	87 Å²	87	55.3 Å²	55.3	45%	0.446	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-30.9	179.1	-166	165.1	0	0	0	113.9	T201 Y219 L222	I197-T201 WeakPolarHBondContact O-CB 3.42Å; I197-T201 PolarHBondContact O-N 2.82Å; I197-T201 PolarHBondContact O-OG1 2.96Å; I197-Y219 HydrophobicContact CD1-CD1 4.1Å; I197-Y219 HydrophobicContact CD1-CE1 4.26Å; I197-Y219 HydrophobicContact CG1-CD1 3.76Å; I197-Y219 HydrophobicContact CG1-CE1 3.72Å; I197-L222 HydrophobicContact CB-CD2 4.21Å
198	N	91.1	Very high	87.8	Confident	99 Å²	99	60.8 Å²	60.8	53%	0.529	33%	0.329	S	S	.	.	H	α-helix	trans	-71.7	-39.6	179.8	-56.6	-59.6	0	0	0	110.5	D196 T201 Q202	D196-N198 VanDerWaalsContact C-N 3.29Å; D196-N198 PolarHBondContact O-N 2.88Å; D196-N198 VanDerWaalsContact OD1-CA 3.27Å; D196-N198 WeakPolarHBondContact OD1-CA 3.34Å; D196-N198 VanDerWaalsContact OD1-CB 3.22Å; D196-N198 WeakPolarHBondContact OD1-CB 3.2Å; D196-N198 PolarHBondContact OD1-N 3.48Å; D196-N198 PolarHBondContact OD2-ND2 2.77Å; N198-T201 VanDerWaalsContact O-CB 3.3Å; N198-T201 WeakPolarHBondContact O-CB 3.38Å; N198-T201 PolarHBondContact O-N 3.25Å; N198-Q202 WeakPolarHBondContact O-CG 3.33Å; N198-Q202 PolarHBondContact O-N 2.58Å
199	E	92.6	Very high	86.4	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.037	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-45.9	175	-72	177.1	134.7	0	0	111.6	F187 A189 D190 V195 D196 T201 Q202 V203	F187-E199 WeakPolarHBondContact O-CB 3.46Å; A189-E199 HydrophobicContact CB-CG 4.38Å; A189-E199 PolarHBondContact N-OE1 2.95Å; D190-E199 PolarHBondContact N-OE1 2.91Å; V195-E199 VanDerWaalsContact CA-OE2 3.29Å; V195-E199 WeakPolarHBondContact CA-OE2 3.48Å; V195-E199 HydrophobicContact CG1-CB 4.42Å; D196-E199 PolarHBondContact N-OE2 3.17Å; D196-E199 PolarHBondContact O-N 3.34Å; D196-E199 WeakPolarHBondContact OD1-CG 3.38Å; D196-E199 PolarHBondContact OD1-N 3.06Å; E199-T201 PolarHBondContact O-N 2.81Å; E199-Q202 WeakPolarHBondContact O-CA 3.22Å; E199-Q202 WeakPolarHBondContact O-CB 3.46Å; E199-Q202 PolarHBondContact O-N 2.84Å; E199-V203 PolarHBondContact O-N 3.34Å
200	L	89.9	Confident	84.8	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-57.2	-39.6	170.9	-64.2	178.9	0	0	0	111.4	F187 V195 D196 Q202 V203 I204 L218 L222	F187-L200 HydrophobicContact CD1-CD2 3.64Å; F187-L200 HydrophobicContact CE1-CD2 3.96Å; V195-L200 HydrophobicContact CG1-CD2 3.58Å; V195-L200 HydrophobicContact CG1-CG 3.9Å; D196-L200 WeakPolarHBondContact O-CG 3.41Å; D196-L200 PolarHBondContact O-N 2.9Å; L200-Q202 VanDerWaalsContact C-N 3.29Å; L200-Q202 PolarHBondContact O-N 2.96Å; L200-V203 PolarHBondContact O-N 3.28Å; L200-I204 VanDerWaalsContact O-CG1 3.24Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 2.92Å; L200-L218 HydrophobicContact CB-CD2 4.15Å; L200-L218 HydrophobicContact CD2-CD2 3.73Å; L200-L218 HydrophobicContact CD2-CG 3.94Å; L200-L222 HydrophobicContact CD1-CB 3.93Å
201	T	87.7	Confident	83.1	Confident	36 Å²	36	66.6 Å²	66.6	22%	0.221	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-34.1	175.1	-55.1	0	0	0	0	112.2	I197 N198 E199 K205 Y219	I197-T201 WeakPolarHBondContact O-CB 3.42Å; I197-T201 PolarHBondContact O-N 2.82Å; I197-T201 PolarHBondContact O-OG1 2.96Å; N198-T201 VanDerWaalsContact O-CB 3.3Å; N198-T201 WeakPolarHBondContact O-CB 3.38Å; N198-T201 PolarHBondContact O-N 3.25Å; E199-T201 PolarHBondContact O-N 2.81Å; T201-K205 WeakPolarHBondContact O-CG 3.45Å; T201-K205 PolarHBondContact O-N 3.17Å; T201-Y219 PolarHBondContact OG1-OH 2.67Å
202	Q	86.8	Confident	81.4	Confident	94 Å²	94	68.5 Å²	68.5	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-69.8	-43.9	175.4	-68.3	179	27.8	0	0	111.4	N198 E199 L200 K205 Q206	N198-Q202 WeakPolarHBondContact O-CG 3.33Å; N198-Q202 PolarHBondContact O-N 2.58Å; E199-Q202 WeakPolarHBondContact O-CA 3.22Å; E199-Q202 WeakPolarHBondContact O-CB 3.46Å; E199-Q202 PolarHBondContact O-N 2.84Å; L200-Q202 VanDerWaalsContact C-N 3.29Å; L200-Q202 PolarHBondContact O-N 2.96Å; Q202-K205 WeakPolarHBondContact O-CB 3.21Å; Q202-K205 PolarHBondContact O-N 2.74Å; Q202-Q206 WeakPolarHBondContact O-CG 3.34Å; Q202-Q206 PolarHBondContact O-N 2.62Å
203	V	85.7	Confident	79.7	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.03	34%	0.337	C	S	.	.	H	α-helix	trans	-60.7	-46.3	176.9	175.6	0	0	0	0	111.1	Y186 F187 E199 L200 K205 Q206 E207 L209 L218	Y186-V203 HydrophobicContact CE1-CG1 4.15Å; Y186-V203 HydrophobicContact CE1-CG2 4.3Å; F187-V203 HydrophobicContact CB-CG2 4.46Å; F187-V203 HydrophobicContact CD1-CG2 4.46Å; F187-V203 HydrophobicContact CD2-CG1 4.25Å; F187-V203 HydrophobicContact CD2-CG2 3.89Å; F187-V203 HydrophobicContact CE1-CG1 4.43Å; F187-V203 HydrophobicContact CE2-CG1 3.75Å; F187-V203 HydrophobicContact CE2-CG2 4.24Å; F187-V203 HydrophobicContact CG-CG2 4.01Å; F187-V203 HydrophobicContact CZ-CG1 3.85Å; E199-V203 PolarHBondContact O-N 3.34Å; L200-V203 PolarHBondContact O-N 3.28Å; V203-K205 PolarHBondContact O-N 3Å; V203-Q206 PolarHBondContact O-N 3.22Å; V203-Q206 VanDerWaalsContact O-N 3.11Å; V203-E207 HydrophobicContact CG1-CG 4.21Å; V203-E207 PolarHBondContact O-N 3.43Å; V203-L209 HydrophobicContact CG1-CD1 4.31Å; V203-L218 HydrophobicContact CB-CD2 3.94Å; V203-L218 HydrophobicContact CG1-CD2 3.8Å
204	I	84.4	Confident	78.4	Confident	11 Å²	11	69.8 Å²	69.8	6%	0.056	35%	0.353	C	S	.	.	H	α-helix	trans	-55.7	-39.2	176.4	-67.2	164.6	0	0	0	111.5	L200 E208 N210 L218 Y219	L200-I204 VanDerWaalsContact O-CG1 3.24Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 2.92Å; I204-E208 PolarHBondContact O-N 3.2Å; I204-N210 VanDerWaalsContact CG2-OD1 3.3Å; I204-N210 WeakPolarHBondContact CG2-OD1 3.5Å; I204-L218 HydrophobicContact CD1-CB 3.88Å; I204-L218 HydrophobicContact CG1-CB 3.74Å; I204-L218 HydrophobicContact CG1-CD2 3.97Å; I204-Y219 HydrophobicContact CD1-CD2 4.25Å; I204-Y219 HydrophobicContact CD1-CE1 4.16Å; I204-Y219 HydrophobicContact CD1-CE2 3.71Å
205	K	83	Confident	77.5	Confident	162 Å²	162	71.3 Å²	71.3	70%	0.704	36%	0.361	S	S	*	.	H	α-helix	trans	-71.8	-35.6	178.8	-74.1	173.1	-177.5	171.6	0	113	T201 Q202 V203	T201-K205 WeakPolarHBondContact O-CG 3.45Å; T201-K205 PolarHBondContact O-N 3.17Å; Q202-K205 WeakPolarHBondContact O-CB 3.21Å; Q202-K205 PolarHBondContact O-N 2.74Å; V203-K205 PolarHBondContact O-N 3Å
206	Q	80.8	Confident	77	Confident	125 Å²	125	71.4 Å²	71.4	58%	0.584	36%	0.362	S	S	*	.	H	α-helix	trans	-79.5	-39.6	-176.2	-73.6	-176.3	7	0	0	112.9	Y186 Q202 V203	Y186-Q206 PolarHBondContact OH-OE1 2.73Å; Q202-Q206 WeakPolarHBondContact O-CG 3.34Å; Q202-Q206 PolarHBondContact O-N 2.62Å; V203-Q206 PolarHBondContact O-N 3.22Å; V203-Q206 VanDerWaalsContact O-N 3.11Å
207	E	73.4	Confident	76.6	Confident	52 Å²	52	72.7 Å²	72.7	24%	0.243	37%	0.371	C	S	.	.	S	Bend	trans	-87.9	-2.2	-177	-67.3	-70	150.9	0	0	113.6	K159 Y186 V203 L209	K159-E207 IonicContact NZ-OE1 2.71Å; K159-E207 PolarHBondContact NZ-OE1 2.78Å; K159-E207 IonicContact NZ-OE2 3.14Å; Y186-E207 HydrophobicContact CE1-CG 4.47Å; V203-E207 HydrophobicContact CG1-CG 4.21Å; V203-E207 PolarHBondContact O-N 3.43Å; E207-L209 HydrophobicContact CB-CD1 3.58Å; E207-L209 HydrophobicContact CB-CG 3.59Å; E207-L209 HydrophobicContact CG-CD1 4.12Å; E207-L209 PolarHBondContact O-N 2.86Å; E207-L209 VanDerWaalsContact O-N 3.09Å
208	E	70.3	Confident	76.4	Confident	121 Å²	121	68.8 Å²	68.8	57%	0.565	35%	0.351	S	S	*	.			trans	52.3	26.9	-172.7	-57.6	-165.1	171.2	0	0	114.5	I204 N210 K211	I204-E208 PolarHBondContact O-N 3.2Å; E208-N210 PolarHBondContact O-N 3.22Å; E208-K211 PolarHBondContact O-N 2.67Å; E208-K211 IonicContact OE2-NZ 2.67Å; E208-K211 PolarHBondContact OE2-NZ 3.18Å
209	L	64.1	Low	76.1	Confident	12 Å²	12	68.3 Å²	68.3	6%	0.063	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-57.5	-16.4	-173.3	-77.8	156.1	0	0	0	115.1	M151 L152 L155 V203 E207 K211 L213	M151-L209 HydrophobicContact CE-CD2 4.16Å; L152-L209 HydrophobicContact CD2-CD1 4.24Å; L152-L209 HydrophobicContact CD2-CD2 4.29Å; L155-L209 HydrophobicContact CD1-CD2 4.1Å; V203-L209 HydrophobicContact CG1-CD1 4.31Å; E207-L209 HydrophobicContact CB-CD1 3.58Å; E207-L209 HydrophobicContact CB-CG 3.59Å; E207-L209 HydrophobicContact CG-CD1 4.12Å; E207-L209 PolarHBondContact O-N 2.86Å; E207-L209 VanDerWaalsContact O-N 3.09Å; L209-K211 PolarHBondContact O-N 2.92Å; L209-K211 VanDerWaalsContact O-N 3.16Å; L209-L213 HydrophobicContact CB-CD1 4.42Å; L209-L213 HydrophobicContact CD2-CD1 4.22Å
210	N	56.4	Low	75.8	Confident	129 Å²	129	68.8 Å²	68.8	69%	0.69	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-68.8	-6.8	179.1	-77.4	-14.3	0	0	0	114.7	I204 E208	I204-N210 VanDerWaalsContact CG2-OD1 3.3Å; I204-N210 WeakPolarHBondContact CG2-OD1 3.5Å; E208-N210 PolarHBondContact O-N 3.22Å
211	K	56	Low	75.7	Confident	151 Å²	151	68.8 Å²	68.8	66%	0.657	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-89.2	-24.3	-174.2	-75.3	178	-176.7	162.6	0	115.2	E208 L209	E208-K211 PolarHBondContact O-N 2.67Å; E208-K211 IonicContact OE2-NZ 2.67Å; E208-K211 PolarHBondContact OE2-NZ 3.18Å; L209-K211 PolarHBondContact O-N 2.92Å; L209-K211 VanDerWaalsContact O-N 3.16Å
212	D	54.3	Low	75.6	Confident	138 Å²	138	68.1 Å²	68.1	74%	0.738	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128	3	-167.9	-74.3	-34.9	0	0	0	116.1
213	L	57.4	Low	75.3	Confident	46 Å²	46	68.7 Å²	68.7	24%	0.241	34%	0.341	C	S	.	.			trans	-106.4	104.4	179.6	-71.3	156	0	0	0	110.4	M148 M151 L209 C216	M148-L213 HydrophobicContact CB-CD2 3.73Å; M148-L213 HydrophobicContact CG-CD1 4.13Å; M148-L213 HydrophobicContact CG-CD2 3.69Å; M151-L213 HydrophobicContact SD-CD2 4.27Å; M151-L213 HydrophobicContact SD-CG 4.4Å; L209-L213 HydrophobicContact CB-CD1 4.42Å; L209-L213 HydrophobicContact CD2-CD1 4.22Å; L213-C216 WeakPolarHBondContact CB-O 3.48Å
214	S	63.2	Low	75.1	Confident	99 Å²	99	70.7 Å²	70.7	69%	0.692	35%	0.349	S	S	*	.	S	Bend	trans	-80	-21.3	-169.8	42.3	0	0	0	0	115.9
215	D	75.4	Confident	75	Confident	90 Å²	90	70.8 Å²	70.8	48%	0.481	35%	0.349	S	S	.	.	S	Bend	trans	-136.9	-11.2	-177	-64	-56.7	0	0	0	115.7	C140 E144	C140-D215 WeakPolarHBondContact CA-O 3.39Å; C140-D215 WeakPolarHBondContact CB-O 3Å; E144-D215 HydrophobicContact CG-CB 4.34Å
216	C	81.4	Confident	74.8	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.02	32%	0.323	C	S	.	.			trans	-124.3	143.9	180	-62.6	0	0	0	0	111.2	C140 E144 Y145 M148 L213	C140-C216 VanDerWaalsContact CA-SG 3.51Å; C140-C216 HydrophobicContact CB-CB 3.98Å; C140-C216 WeakPolarHBondContact CB-SG 3.36Å; C140-C216 WeakPolarHBondContact SG-CB 3.49Å; C140-C216 CovalentContact SG-SG 2.03Å; C140-C216 PolarHBondContact SG-SG 3.26Å; E144-C216 VanDerWaalsContact CB-SG 3.53Å; Y145-C216 PolarHBondContact N-SG 3.2Å; M148-C216 HydrophobicContact CB-CB 4.46Å; M148-C216 HydrophobicContact SD-CB 3.99Å; L213-C216 WeakPolarHBondContact CB-O 3.48Å
217	T	84.1	Confident	74.2	Confident	59 Å²	59	63.7 Å²	63.7	36%	0.362	32%	0.318	S	S	.	.			trans	-119.8	161.2	179	65.8	0	0	0	0	110.6	M148 Y219 D220	M148-T217 VanDerWaalsContact SD-C 3.56Å; M148-T217 VanDerWaalsContact SD-O 3.35Å; T217-Y219 PolarHBondContact O-N 2.84Å; T217-Y219 VanDerWaalsContact O-N 3.12Å; T217-D220 PolarHBondContact N-OD2 2.9Å; T217-D220 VanDerWaalsContact O-CB 3.24Å; T217-D220 WeakPolarHBondContact O-CB 3.26Å; T217-D220 PolarHBondContact O-N 2.81Å; T217-D220 PolarHBondContact OG1-OD2 3.42Å
218	L	86.2	Confident	74.3	Confident	5 Å²	5	65.5 Å²	65.5	3%	0.026	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.9	176.7	-158.1	70.1	0	0	0	112.7	L152 F187 L200 V203 I204 D220 L221	L152-L218 HydrophobicContact CD1-CD1 3.57Å; L152-L218 HydrophobicContact CD2-CD1 4.01Å; L152-L218 HydrophobicContact CG-CD1 4.42Å; F187-L218 HydrophobicContact CE1-CD1 3.93Å; F187-L218 HydrophobicContact CE1-CD2 3.84Å; F187-L218 HydrophobicContact CE1-CG 4.23Å; F187-L218 HydrophobicContact CZ-CD1 4.18Å; F187-L218 HydrophobicContact CZ-CD2 4.21Å; L200-L218 HydrophobicContact CB-CD2 4.15Å; L200-L218 HydrophobicContact CD2-CD2 3.73Å; L200-L218 HydrophobicContact CD2-CG 3.94Å; V203-L218 HydrophobicContact CB-CD2 3.94Å; V203-L218 HydrophobicContact CG1-CD2 3.8Å; I204-L218 HydrophobicContact CD1-CB 3.88Å; I204-L218 HydrophobicContact CG1-CB 3.74Å; I204-L218 HydrophobicContact CG1-CD2 3.97Å; L218-D220 PolarHBondContact O-N 2.83Å; L218-L221 WeakPolarHBondContact O-CB 3.28Å; L218-L221 PolarHBondContact O-N 3.21Å; L218-L221 VanDerWaalsContact O-N 3.12Å
219	Y	85.5	Confident	74.7	Confident	88 Å²	88	63.4 Å²	63.4	35%	0.345	33%	0.333	S	S	.	.	H	α-helix	trans	-63.4	-25.6	172.4	-56.6	-65.2	0	0	0	112.8	I197 T201 I204 T217 L221 L222 K223	I197-Y219 HydrophobicContact CD1-CD1 4.1Å; I197-Y219 HydrophobicContact CD1-CE1 4.26Å; I197-Y219 HydrophobicContact CG1-CD1 3.76Å; I197-Y219 HydrophobicContact CG1-CE1 3.72Å; T201-Y219 PolarHBondContact OG1-OH 2.67Å; I204-Y219 HydrophobicContact CD1-CD2 4.25Å; I204-Y219 HydrophobicContact CD1-CE1 4.16Å; I204-Y219 HydrophobicContact CD1-CE2 3.71Å; T217-Y219 PolarHBondContact O-N 2.84Å; T217-Y219 VanDerWaalsContact O-N 3.12Å; Y219-L221 PolarHBondContact O-N 2.68Å; Y219-L222 PolarHBondContact O-N 2.9Å; Y219-K223 PolarHBondContact O-N 2.99Å
220	D	85.9	Confident	75.6	Confident	19 Å²	19	66 Å²	66	10%	0.102	35%	0.347	C	S	.	.	H	α-helix	trans	-67.2	-20.2	176.6	-64.3	-63	0	0	0	111.9	Y145 T217 L218 K223 Y224	Y145-D220 HydrophobicContact CD2-CB 4.4Å; Y145-D220 HydrophobicContact CE2-CB 4.16Å; T217-D220 PolarHBondContact N-OD2 2.9Å; T217-D220 VanDerWaalsContact O-CB 3.24Å; T217-D220 WeakPolarHBondContact O-CB 3.26Å; T217-D220 PolarHBondContact O-N 2.81Å; T217-D220 PolarHBondContact OG1-OD2 3.42Å; L218-D220 PolarHBondContact O-N 2.83Å; D220-K223 PolarHBondContact O-N 3.08Å; D220-Y224 HydrophobicContact CB-CD2 3.87Å; D220-Y224 HydrophobicContact CB-CE2 3.75Å; D220-Y224 WeakPolarHBondContact O-CB 3.42Å; D220-Y224 WeakPolarHBondContact O-CD2 3.46Å; D220-Y224 PolarHBondContact O-N 2.87Å
221	L	87.6	Confident	77.1	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-50.3	170.6	-164.7	71.7	0	0	0	111.2	Y145 F187 L218 Y219 K223 D225 L233 F238 A241 F242	Y145-L221 WeakPolarHBondContact OH-CA 3.31Å; Y145-L221 WeakPolarHBondContact OH-CD1 3.41Å; F187-L221 HydrophobicContact CE1-CD2 4.33Å; L218-L221 WeakPolarHBondContact O-CB 3.28Å; L218-L221 PolarHBondContact O-N 3.21Å; L218-L221 VanDerWaalsContact O-N 3.12Å; Y219-L221 PolarHBondContact O-N 2.68Å; L221-K223 VanDerWaalsContact C-N 3.31Å; L221-K223 PolarHBondContact O-N 2.85Å; L221-D225 WeakPolarHBondContact O-CB 3.4Å; L221-D225 PolarHBondContact O-N 2.85Å; L221-L233 HydrophobicContact CB-CD1 4.24Å; L221-L233 HydrophobicContact CD2-CD1 3.73Å; L221-L233 HydrophobicContact CG-CD1 3.63Å; L221-F238 HydrophobicContact CD2-CD2 4.19Å; L221-F238 HydrophobicContact CD2-CE2 3.64Å; L221-A241 HydrophobicContact CD1-CB 3.71Å; L221-F242 HydrophobicContact CD1-CE2 4.11Å; L221-F242 HydrophobicContact CD1-CZ 4.14Å; L221-F242 HydrophobicContact CD2-CE2 4.29Å; L221-F242 HydrophobicContact CD2-CZ 4.45Å
222	L	86.2	Confident	78.8	Confident	21 Å²	21	62.9 Å²	62.9	11%	0.11	33%	0.328	C	S	.	.	H	α-helix	trans	-67	-34.8	175	-175.1	67.1	0	0	0	111.3	I197 L200 Y219 D226 L233	I197-L222 HydrophobicContact CB-CD2 4.21Å; L200-L222 HydrophobicContact CD1-CB 3.93Å; Y219-L222 PolarHBondContact O-N 2.9Å; L222-D226 HydrophobicContact CD1-CB 4.01Å; L222-D226 WeakPolarHBondContact O-CB 2.98Å; L222-D226 PolarHBondContact O-N 3.49Å; L222-L233 HydrophobicContact CD1-CD2 4.21Å; L222-L233 HydrophobicContact CD1-CG 3.79Å
223	K	80.6	Confident	80.5	Confident	106 Å²	106	56.3 Å²	56.3	46%	0.461	29%	0.293	S	S	.	.	H	α-helix	trans	-66.9	-41.2	-180	-170.5	-167.9	174.8	-159.9	0	113.2	D138 Y219 D220 L221	D138-K223 IonicContact OD1-NZ 3.45Å; D138-K223 PolarHBondContact OD1-NZ 3.25Å; D138-K223 IonicContact OD2-NZ 3.92Å; D138-K223 PolarHBondContact OD2-NZ 3.35Å; Y219-K223 PolarHBondContact O-N 2.99Å; D220-K223 PolarHBondContact O-N 3.08Å; L221-K223 VanDerWaalsContact C-N 3.31Å; L221-K223 PolarHBondContact O-N 2.85Å
224	Y	80.8	Confident	82	Confident	47 Å²	47	54.9 Å²	54.9	18%	0.184	29%	0.288	C	S	.	.	H	α-helix	trans	-98.8	-24.9	-172.9	-64.5	-49.8	0	0	0	114.1	F135 D138 C140 Y145 D220	F135-Y224 HydrophobicContact CD1-CE1 4.49Å; F135-Y224 HydrophobicContact CE1-CD1 4.48Å; F135-Y224 HydrophobicContact CE1-CD2 4.36Å; F135-Y224 HydrophobicContact CE1-CE1 4.41Å; F135-Y224 HydrophobicContact CE1-CE2 4.25Å; F135-Y224 HydrophobicContact CE1-CG 4.48Å; D138-Y224 WeakPolarHBondContact CB-OH 3.35Å; D138-Y224 PolarHBondContact OD2-OH 2.75Å; C140-Y224 HydrophobicContact CB-CE2 4.21Å; C140-Y224 PolarHBondContact O-OH 3.04Å; Y145-Y224 HydrophobicContact CD1-CD2 4.33Å; Y145-Y224 AromaticContact CD2-CD2 3.95Å; Y145-Y224 HydrophobicContact CD2-CD2 3.95Å; Y145-Y224 HydrophobicContact CD2-CE2 4.25Å; Y145-Y224 HydrophobicContact CE1-CD2 4.14Å; Y145-Y224 AromaticContact CE2-CD2 3.77Å; Y145-Y224 HydrophobicContact CE2-CD2 3.77Å; Y145-Y224 HydrophobicContact CE2-CE2 4.46Å; Y145-Y224 HydrophobicContact CG-CD2 4.25Å; Y145-Y224 AromaticContact CZ-CD2 3.87Å; D220-Y224 HydrophobicContact CB-CD2 3.87Å; D220-Y224 HydrophobicContact CB-CE2 3.75Å; D220-Y224 WeakPolarHBondContact O-CB 3.42Å; D220-Y224 WeakPolarHBondContact O-CD2 3.46Å; D220-Y224 PolarHBondContact O-N 2.87Å
225	D	83.5	Confident	83.2	Confident	13 Å²	13	52.5 Å²	52.5	7%	0.07	27%	0.267	C	S	.	.	H	α-helix	trans	-113.4	-0.7	-174	-65.8	-67.6	0	0	0	114.9	Y145 L221 F227 L233 E237 A241	Y145-D225 PolarHBondContact OH-OD2 2.85Å; L221-D225 WeakPolarHBondContact O-CB 3.4Å; L221-D225 PolarHBondContact O-N 2.85Å; D225-F227 VanDerWaalsContact O-CD2 3.28Å; D225-F227 WeakPolarHBondContact O-CD2 3.33Å; D225-F227 PolarHBondContact O-N 2.91Å; D225-F227 VanDerWaalsContact O-N 3.16Å; D225-L233 VanDerWaalsContact C-CD2 3.48Å; D225-L233 HydrophobicContact CB-CD2 4.08Å; D225-E237 WeakPolarHBondContact O-CB 3.39Å; D225-A241 HydrophobicContact CB-CB 3.71Å; D225-A241 VanDerWaalsContact CG-CA 3.46Å; D225-A241 WeakPolarHBondContact OD1-CA 3.4Å; D225-A241 WeakPolarHBondContact OD2-CB 3.03Å
226	D	78.2	Confident	83.5	Confident	28 Å²	28	53.7 Å²	53.7	15%	0.15	27%	0.27	C	S	.	.			trans	-77.9	90.4	164.9	177.9	2	0	0	0	109.5	L222 N228 A229 D230 K231 L233	L222-D226 HydrophobicContact CD1-CB 4.01Å; L222-D226 WeakPolarHBondContact O-CB 2.98Å; L222-D226 PolarHBondContact O-N 3.49Å; D226-N228 PolarHBondContact OD1-OD1 3.28Å; D226-N228 VanDerWaalsContact OD1-OD1 3.07Å; D226-A229 WeakPolarHBondContact OD1-CA 3.3Å; D226-A229 PolarHBondContact OD1-N 3.12Å; D226-A229 WeakPolarHBondContact OD2-CA 3.47Å; D226-D230 PolarHBondContact OD1-N 3.46Å; D226-D230 PolarHBondContact OD2-N 2.82Å; D226-K231 WeakPolarHBondContact OD2-CA 3.27Å; D226-K231 PolarHBondContact OD2-N 3.49Å; D226-L233 HydrophobicContact CB-CD2 4.2Å
227	F	68.3	Low	83.6	Confident	111 Å²	111	54.3 Å²	54.3	49%	0.487	27%	0.272	S	S	.	.	S	Bend	trans	-81.9	-26.5	-174	-85.3	-87.3	0	0	0	112.9	D225 E237 R240	D225-F227 VanDerWaalsContact O-CD2 3.28Å; D225-F227 WeakPolarHBondContact O-CD2 3.33Å; D225-F227 PolarHBondContact O-N 2.91Å; D225-F227 VanDerWaalsContact O-N 3.16Å; F227-E237 PolarHBondContact N-OE1 3.1Å; F227-E237 VanDerWaalsContact N-OE1 3.15Å; F227-R240 HydrophobicContact CD2-CG 4.39Å; F227-R240 HydrophobicContact CE2-CG 3.87Å; F227-R240 VanDerWaalsContact CG-NH1 3.28Å; F227-R240 VanDerWaalsContact CZ-NH1 3.3Å
228	N	74.5	Confident	83.8	Confident	90 Å²	90	51.5 Å²	51.5	48%	0.481	26%	0.255	S	S	.	.	S	Bend	trans	-89.3	-8.3	179.8	76.1	21.9	0	0	0	112.4	D226 D230 E237	D226-N228 PolarHBondContact OD1-OD1 3.28Å; D226-N228 VanDerWaalsContact OD1-OD1 3.07Å; N228-D230 VanDerWaalsContact C-N 3.3Å; N228-D230 PolarHBondContact ND2-OD2 3.12Å; N228-D230 PolarHBondContact O-N 2.91Å; N228-D230 WeakPolarHBondContact OD1-CA 3.24Å; N228-D230 WeakPolarHBondContact OD1-CB 3.37Å; N228-D230 PolarHBondContact OD1-N 3.4Å; N228-D230 PolarHBondContact OD1-OD1 3.31Å; N228-D230 PolarHBondContact OD1-OD2 2.84Å; N228-E237 PolarHBondContact N-OE1 2.79Å
229	A	78.2	Confident	83.7	Confident	77 Å²	77	52.2 Å²	52.2	64%	0.636	26%	0.257	S	S	*	.			trans	61	30.6	-179.3	0	0	0	0	0	114.2	D226 K231	D226-A229 WeakPolarHBondContact OD1-CA 3.3Å; D226-A229 PolarHBondContact OD1-N 3.12Å; D226-A229 WeakPolarHBondContact OD2-CA 3.47Å; A229-K231 VanDerWaalsContact C-N 3.29Å
230	D	84.2	Confident	83.4	Confident	66 Å²	66	52.4 Å²	52.4	35%	0.353	26%	0.257	S	S	.	.	S	Bend	trans	-85.1	-1.4	178.7	76.3	18.4	0	0	0	113.6	D226 N228 H232	D226-D230 PolarHBondContact OD1-N 3.46Å; D226-D230 PolarHBondContact OD2-N 2.82Å; N228-D230 VanDerWaalsContact C-N 3.3Å; N228-D230 PolarHBondContact ND2-OD2 3.12Å; N228-D230 PolarHBondContact O-N 2.91Å; N228-D230 WeakPolarHBondContact OD1-CA 3.24Å; N228-D230 WeakPolarHBondContact OD1-CB 3.37Å; N228-D230 PolarHBondContact OD1-N 3.4Å; N228-D230 PolarHBondContact OD1-OD1 3.31Å; N228-D230 PolarHBondContact OD1-OD2 2.84Å; D230-H232 VanDerWaalsContact C-N 3.28Å; D230-H232 PolarHBondContact O-CE1 3.29Å; D230-H232 PolarHBondContact O-ND1 3.02Å; D230-H232 WeakPolarHBondContact OD1-CA 3.49Å; D230-H232 WeakPolarHBondContact OD1-CB 3.46Å; D230-H232 IonicContact OD1-CG 2.6Å; D230-H232 PolarHBondContact OD1-N 2.99Å; D230-H232 IonicContact OD1-ND1 2.76Å
231	K	87.5	Confident	83.3	Confident	155 Å²	155	51.5 Å²	51.5	67%	0.674	25%	0.253	S	S	*	.	S	Bend	trans	70.4	17.3	-178.2	-50.9	177.5	180	177.4	0	114.8	D226 A229	D226-K231 WeakPolarHBondContact OD2-CA 3.27Å; D226-K231 PolarHBondContact OD2-N 3.49Å; A229-K231 VanDerWaalsContact C-N 3.29Å
232	H	91.1	Very high	83.3	Confident	60 Å²	60	51.7 Å²	51.7	28%	0.278	25%	0.254	S	S	.	.	S	Bend	trans	-128.4	157.3	171.8	-51.9	76	0	0	0	109.3	L194 V195 D230	L194-H232 HydrophobicContact CB-CB 3.99Å; L194-H232 HydrophobicContact CD1-CB 4.42Å; L194-H232 HydrophobicContact CD2-CB 4.4Å; V195-H232 WeakPolarHBondContact O-CA 3.34Å; D230-H232 VanDerWaalsContact C-N 3.28Å; D230-H232 PolarHBondContact O-CE1 3.29Å; D230-H232 PolarHBondContact O-ND1 3.02Å; D230-H232 WeakPolarHBondContact OD1-CA 3.49Å; D230-H232 WeakPolarHBondContact OD1-CB 3.46Å; D230-H232 IonicContact OD1-CG 2.6Å; D230-H232 PolarHBondContact OD1-N 2.99Å; D230-H232 IonicContact OD1-ND1 2.76Å
233	L	90.4	Very high	82.8	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	113.3	167.6	-63.9	169.3	0	0	0	108.7	F184 V195 L221 L222 D225 D226 E237 F238	F184-L233 WeakPolarHBondContact CE2-O 3.36Å; V195-L233 HydrophobicContact CB-CB 4.25Å; V195-L233 PolarHBondContact N-O 2.99Å; V195-L233 PolarHBondContact O-N 2.92Å; L221-L233 HydrophobicContact CB-CD1 4.24Å; L221-L233 HydrophobicContact CD2-CD1 3.73Å; L221-L233 HydrophobicContact CG-CD1 3.63Å; L222-L233 HydrophobicContact CD1-CD2 4.21Å; L222-L233 HydrophobicContact CD1-CG 3.79Å; D225-L233 VanDerWaalsContact C-CD2 3.48Å; D225-L233 HydrophobicContact CB-CD2 4.08Å; D226-L233 HydrophobicContact CB-CD2 4.2Å; L233-E237 WeakPolarHBondContact CA-OE2 3.32Å; L233-E237 HydrophobicContact CD2-CB 4.17Å; L233-F238 HydrophobicContact CD1-CD2 4.37Å
234	A	89.3	Confident	82.8	Confident	16 Å²	16	50 Å²	50	13%	0.132	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	163.8	166.6	0	0	0	0	0	111.1	L194 E236 E237 F238	L194-A234 HydrophobicContact CD2-CB 4.03Å; A234-E236 PolarHBondContact O-N 3.37Å; A234-E237 PolarHBondContact N-OE2 3.03Å; A234-E237 WeakPolarHBondContact O-CB 3.38Å; A234-E237 PolarHBondContact O-N 2.87Å; A234-E237 VanDerWaalsContact O-N 3.07Å; A234-F238 PolarHBondContact O-N 2.95Å
235	L	88.4	Confident	82.7	Confident	48 Å²	48	49.1 Å²	49.1	25%	0.251	25%	0.245	S	C	.	.	H	α-helix	trans	-57.2	-35.5	178.1	-179.3	61.9	0	0	0	112	F184 F238 Y239	F184-L235 HydrophobicContact CB-CD1 3.89Å; F184-L235 HydrophobicContact CD1-CB 4.46Å; F184-L235 HydrophobicContact CD1-CD1 3.83Å; F184-L235 HydrophobicContact CD2-CD1 3.99Å; F184-L235 HydrophobicContact CE1-CB 4.17Å; F184-L235 HydrophobicContact CE1-CD1 4.38Å; F184-L235 HydrophobicContact CE2-CB 4.23Å; F184-L235 HydrophobicContact CG-CD1 3.6Å; F184-L235 HydrophobicContact CZ-CB 4.04Å; L235-F238 WeakPolarHBondContact O-CB 2.99Å; L235-F238 PolarHBondContact O-N 3.04Å; L235-Y239 HydrophobicContact CD1-CD1 4.37Å; L235-Y239 HydrophobicContact CD1-CE1 3.82Å; L235-Y239 HydrophobicContact CD1-CE2 4.36Å; L235-Y239 HydrophobicContact CD2-CE2 4.19Å; L235-Y239 HydrophobicContact CG-CD2 4.38Å; L235-Y239 HydrophobicContact CG-CE1 4.24Å; L235-Y239 HydrophobicContact CG-CE2 3.86Å; L235-Y239 PolarHBondContact O-N 3.28Å
236	E	81.4	Confident	82.4	Confident	115 Å²	115	53 Å²	53	54%	0.537	26%	0.263	S	S	.	.	H	α-helix	trans	-68.1	-36.6	177.4	-62.3	80.8	-176.5	0	0	113	A234 R240	A234-E236 PolarHBondContact O-N 3.37Å; E236-R240 PolarHBondContact O-N 2.79Å
237	E	84.4	Confident	82.8	Confident	16 Å²	16	53 Å²	53	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-70.7	-37	174.2	-73.7	168.5	149.7	0	0	110.7	D225 F227 N228 L233 A234 R240 A241	D225-E237 WeakPolarHBondContact O-CB 3.39Å; F227-E237 PolarHBondContact N-OE1 3.1Å; F227-E237 VanDerWaalsContact N-OE1 3.15Å; N228-E237 PolarHBondContact N-OE1 2.79Å; L233-E237 WeakPolarHBondContact CA-OE2 3.32Å; L233-E237 HydrophobicContact CD2-CB 4.17Å; A234-E237 PolarHBondContact N-OE2 3.03Å; A234-E237 WeakPolarHBondContact O-CB 3.38Å; A234-E237 PolarHBondContact O-N 2.87Å; A234-E237 VanDerWaalsContact O-N 3.07Å; E237-R240 CarbonylContact O-C 3.56Å; E237-R240 WeakPolarHBondContact O-CA 3.48Å; E237-R240 WeakPolarHBondContact O-CB 3.27Å; E237-R240 PolarHBondContact O-N 2.86Å; E237-R240 VanDerWaalsContact O-N 3.11Å; E237-A241 PolarHBondContact O-N 2.91Å
238	F	87.2	Confident	83.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-44.4	174	-150.6	-106.3	0	0	0	111.9	V180 M183 F184 F187 L221 L233 A234 L235 R240 A241 F242	V180-F238 HydrophobicContact CG1-CD1 3.5Å; V180-F238 VanDerWaalsContact CG1-CD1 3.5Å; V180-F238 HydrophobicContact CG1-CE1 3.93Å; M183-F238 HydrophobicContact CB-CE1 4.1Å; M183-F238 HydrophobicContact CB-CZ 4.44Å; M183-F238 HydrophobicContact CE-CE1 3.6Å; M183-F238 HydrophobicContact CE-CZ 3.91Å; M183-F238 HydrophobicContact CG-CE1 4.05Å; M183-F238 HydrophobicContact CG-CZ 3.92Å; M183-F238 HydrophobicContact SD-CZ 4.42Å; F184-F238 HydrophobicContact CB-CD1 3.79Å; F184-F238 HydrophobicContact CB-CE1 3.86Å; F184-F238 HydrophobicContact CB-CG 4.45Å; F184-F238 HydrophobicContact CD2-CB 3.66Å; F184-F238 AromaticContact CD2-CD1 3.76Å; F184-F238 HydrophobicContact CD2-CD1 3.76Å; F184-F238 AromaticContact CD2-CD2 3.91Å; F184-F238 HydrophobicContact CD2-CD2 3.91Å; F184-F238 HydrophobicContact CD2-CE1 4.31Å; F184-F238 HydrophobicContact CD2-CE2 4.43Å; F184-F238 AromaticContact CD2-CG 3.54Å; F184-F238 HydrophobicContact CD2-CG 3.54Å; F184-F238 HydrophobicContact CE2-CB 4.09Å; F184-F238 HydrophobicContact CE2-CD2 4.49Å; F184-F238 HydrophobicContact CE2-CG 4.31Å; F184-F238 HydrophobicContact CG-CD1 4.27Å; F184-F238 HydrophobicContact CG-CG 4.47Å; F187-F238 HydrophobicContact CD1-CE2 4Å; F187-F238 HydrophobicContact CD1-CZ 4.05Å; F187-F238 HydrophobicContact CE1-CE2 4.38Å; F187-F238 HydrophobicContact CE1-CZ 4.29Å; F187-F238 HydrophobicContact CG-CZ 4.36Å; L221-F238 HydrophobicContact CD2-CD2 4.19Å; L221-F238 HydrophobicContact CD2-CE2 3.64Å; L233-F238 HydrophobicContact CD1-CD2 4.37Å; A234-F238 PolarHBondContact O-N 2.95Å; L235-F238 WeakPolarHBondContact O-CB 2.99Å; L235-F238 PolarHBondContact O-N 3.04Å; F238-R240 PolarHBondContact O-N 2.91Å; F238-A241 WeakPolarHBondContact O-CB 3.49Å; F238-A241 PolarHBondContact O-N 3.16Å; F238-F242 AromaticContact CD1-CD2 3.86Å; F238-F242 HydrophobicContact CD1-CD2 3.86Å; F238-F242 AromaticContact CD1-CE2 3.96Å; F238-F242 HydrophobicContact CD1-CE2 3.96Å; F238-F242 HydrophobicContact CD2-CE2 4.1Å; F238-F242 AromaticContact CE1-CD2 3.84Å; F238-F242 HydrophobicContact CE1-CD2 3.84Å; F238-F242 AromaticContact CE1-CE2 3.59Å; F238-F242 HydrophobicContact CE1-CE2 3.59Å; F238-F242 AromaticContact CE2-CE2 3.76Å; F238-F242 HydrophobicContact CE2-CE2 3.76Å; F238-F242 HydrophobicContact CG-CD2 4.22Å; F238-F242 HydrophobicContact CG-CE2 4.19Å; F238-F242 HydrophobicContact CZ-CD2 4.2Å; F238-F242 AromaticContact CZ-CE2 3.48Å; F238-F242 HydrophobicContact CZ-CE2 3.48Å; F238-F242 VanDerWaalsContact CZ-CE2 3.48Å; F238-F242 HydrophobicContact CZ-CZ 4.26Å; F238-F242 VanDerWaalsContact O-CD2 3.28Å; F238-F242 WeakPolarHBondContact O-CD2 3.31Å; F238-F242 PolarHBondContact O-N 2.87Å
239	Y	85.6	Confident	84.7	Confident	20 Å²	20	47.2 Å²	47.2	8%	0.078	24%	0.241	C	C	.	.	H	α-helix	trans	-56.9	-39.6	169.4	-72.7	-23.9	0	0	0	111.6	K177 V180 D181 L235 Q243 V244	K177-Y239 WeakPolarHBondContact CE-OH 3.39Å; K177-Y239 HydrophobicContact CG-CE1 4.33Å; V180-Y239 HydrophobicContact CG1-CD1 3.76Å; V180-Y239 HydrophobicContact CG1-CE1 4.11Å; D181-Y239 WeakPolarHBondContact OD1-CE1 3.45Å; D181-Y239 VanDerWaalsContact OD1-CZ 3.24Å; D181-Y239 PolarHBondContact OD1-OH 3.1Å; L235-Y239 HydrophobicContact CD1-CD1 4.37Å; L235-Y239 HydrophobicContact CD1-CE1 3.82Å; L235-Y239 HydrophobicContact CD1-CE2 4.36Å; L235-Y239 HydrophobicContact CD2-CE2 4.19Å; L235-Y239 HydrophobicContact CG-CD2 4.38Å; L235-Y239 HydrophobicContact CG-CE1 4.24Å; L235-Y239 HydrophobicContact CG-CE2 3.86Å; L235-Y239 PolarHBondContact O-N 3.28Å; Y239-Q243 CarbonylContact O-C 3.54Å; Y239-Q243 WeakPolarHBondContact O-CA 3.48Å; Y239-Q243 PolarHBondContact O-N 3.47Å; Y239-V244 HydrophobicContact CD1-CB 3.73Å; Y239-V244 HydrophobicContact CD1-CG1 3.8Å; Y239-V244 HydrophobicContact CD1-CG2 4.02Å; Y239-V244 HydrophobicContact CE1-CG1 4.21Å; Y239-V244 HydrophobicContact CG-CB 4Å; Y239-V244 HydrophobicContact CG-CG1 4.15Å; Y239-V244 PolarHBondContact O-N 3.29Å
240	R	78.6	Confident	85.4	Confident	92 Å²	92	46 Å²	46	35%	0.347	23%	0.227	S	C	.	.	H	α-helix	trans	-64.7	-47.2	176.2	167.3	173.2	-72.6	-158.5	-4.6	112.3	F227 E236 E237 F238 F242 Q243 L276	F227-R240 HydrophobicContact CD2-CG 4.39Å; F227-R240 HydrophobicContact CE2-CG 3.87Å; F227-R240 VanDerWaalsContact CG-NH1 3.28Å; F227-R240 VanDerWaalsContact CZ-NH1 3.3Å; E236-R240 PolarHBondContact O-N 2.79Å; E237-R240 CarbonylContact O-C 3.56Å; E237-R240 WeakPolarHBondContact O-CA 3.48Å; E237-R240 WeakPolarHBondContact O-CB 3.27Å; E237-R240 PolarHBondContact O-N 2.86Å; E237-R240 VanDerWaalsContact O-N 3.11Å; F238-R240 PolarHBondContact O-N 2.91Å; R240-F242 VanDerWaalsContact C-N 3.29Å; R240-F242 PolarHBondContact O-N 2.91Å; R240-Q243 PolarHBondContact O-N 3.26Å; R240-L276 VanDerWaalsContact CA-CD1 3.44Å; R240-L276 HydrophobicContact CB-CD1 3.8Å; R240-L276 HydrophobicContact CB-CD2 4.42Å; R240-L276 HydrophobicContact CB-CG 3.96Å; R240-L276 HydrophobicContact CG-CD1 3.78Å; R240-L276 HydrophobicContact CG-CD2 3.85Å; R240-L276 HydrophobicContact CG-CG 3.92Å
241	A	83.5	Confident	85.8	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-53.8	-47.2	178.2	0	0	0	0	0	112	K149 L221 D225 E237 F238 Q243	K149-A241 WeakPolarHBondContact CD-O 3.33Å; K149-A241 WeakPolarHBondContact CE-O 3.44Å; K149-A241 PolarHBondContact NZ-O 2.81Å; L221-A241 HydrophobicContact CD1-CB 3.71Å; D225-A241 HydrophobicContact CB-CB 3.71Å; D225-A241 VanDerWaalsContact CG-CA 3.46Å; D225-A241 WeakPolarHBondContact OD1-CA 3.4Å; D225-A241 WeakPolarHBondContact OD2-CB 3.03Å; E237-A241 PolarHBondContact O-N 2.91Å; F238-A241 WeakPolarHBondContact O-CB 3.49Å; F238-A241 PolarHBondContact O-N 3.16Å; A241-Q243 VanDerWaalsContact C-N 3.34Å
242	F	86.9	Confident	86.2	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.022	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	10.2	-178.6	-66.3	-77.1	0	0	0	113.9	K149 L152 L153 K176 V180 M183 L221 F238 R240 V244	K149-F242 HydrophobicContact CB-CD1 4.26Å; K149-F242 HydrophobicContact CB-CE1 4.01Å; K149-F242 HydrophobicContact CG-CE1 4.18Å; L152-F242 HydrophobicContact CB-CE1 4.2Å; L152-F242 HydrophobicContact CB-CZ 4.5Å; L152-F242 HydrophobicContact CD1-CE1 4.31Å; L152-F242 HydrophobicContact CD1-CZ 4.05Å; L153-F242 HydrophobicContact CD1-CD1 4.03Å; L153-F242 HydrophobicContact CD2-CD1 4.01Å; L153-F242 HydrophobicContact CG-CD1 3.82Å; L153-F242 HydrophobicContact CG-CE1 4.28Å; K176-F242 WeakPolarHBondContact CE-O 3.05Å; K176-F242 PolarHBondContact NZ-O 2.76Å; V180-F242 HydrophobicContact CG1-CB 4.32Å; V180-F242 HydrophobicContact CG1-CD2 4.23Å; V180-F242 HydrophobicContact CG2-CB 3.65Å; V180-F242 HydrophobicContact CG2-CD2 4.46Å; V180-F242 HydrophobicContact CG2-CG 4.04Å; M183-F242 HydrophobicContact CE-CD1 3.71Å; M183-F242 HydrophobicContact CE-CD2 3.56Å; M183-F242 HydrophobicContact CE-CE1 3.42Å; M183-F242 VanDerWaalsContact CE-CE1 3.42Å; M183-F242 HydrophobicContact CE-CE2 3.31Å; M183-F242 HydrophobicContact CE-CG 3.79Å; M183-F242 HydrophobicContact CE-CZ 3.22Å; M183-F242 HydrophobicContact SD-CE1 4.22Å; M183-F242 HydrophobicContact SD-CE2 4.44Å; M183-F242 HydrophobicContact SD-CZ 3.95Å; L221-F242 HydrophobicContact CD1-CE2 4.11Å; L221-F242 HydrophobicContact CD1-CZ 4.14Å; L221-F242 HydrophobicContact CD2-CE2 4.29Å; L221-F242 HydrophobicContact CD2-CZ 4.45Å; F238-F242 AromaticContact CD1-CD2 3.86Å; F238-F242 HydrophobicContact CD1-CD2 3.86Å; F238-F242 AromaticContact CD1-CE2 3.96Å; F238-F242 HydrophobicContact CD1-CE2 3.96Å; F238-F242 HydrophobicContact CD2-CE2 4.1Å; F238-F242 AromaticContact CE1-CD2 3.84Å; F238-F242 HydrophobicContact CE1-CD2 3.84Å; F238-F242 AromaticContact CE1-CE2 3.59Å; F238-F242 HydrophobicContact CE1-CE2 3.59Å; F238-F242 AromaticContact CE2-CE2 3.76Å; F238-F242 HydrophobicContact CE2-CE2 3.76Å; F238-F242 HydrophobicContact CG-CD2 4.22Å; F238-F242 HydrophobicContact CG-CE2 4.19Å; F238-F242 HydrophobicContact CZ-CD2 4.2Å; F238-F242 AromaticContact CZ-CE2 3.48Å; F238-F242 HydrophobicContact CZ-CE2 3.48Å; F238-F242 VanDerWaalsContact CZ-CE2 3.48Å; F238-F242 HydrophobicContact CZ-CZ 4.26Å; F238-F242 VanDerWaalsContact O-CD2 3.28Å; F238-F242 WeakPolarHBondContact O-CD2 3.31Å; F238-F242 PolarHBondContact O-N 2.87Å; R240-F242 VanDerWaalsContact C-N 3.29Å; R240-F242 PolarHBondContact O-N 2.91Å; F242-V244 VanDerWaalsContact C-N 3.28Å; F242-V244 HydrophobicContact CB-CG2 4.38Å; F242-V244 PolarHBondContact O-N 2.98Å
243	Q	77.4	Confident	86.4	Confident	90 Å²	90	48.8 Å²	48.8	42%	0.421	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	46.6	-179.8	-57.3	170	-24.6	0	0	112.2	E131 K176 Y239 R240 A241 I245	E131-Q243 PolarHBondContact OE1-NE2 2.55Å; K176-Q243 PolarHBondContact NZ-O 2.92Å; Y239-Q243 CarbonylContact O-C 3.54Å; Y239-Q243 WeakPolarHBondContact O-CA 3.48Å; Y239-Q243 PolarHBondContact O-N 3.47Å; R240-Q243 PolarHBondContact O-N 3.26Å; A241-Q243 VanDerWaalsContact C-N 3.34Å; Q243-I245 PolarHBondContact O-N 2.79Å
244	V	80.4	Confident	86.7	Confident	1 Å²	1	54 Å²	54	1%	0.006	26%	0.264	C	S	.	.			trans	-86.2	99	167.7	-179.3	0	0	0	0	107.2	K176 K177 V180 Y239 F242	K176-V244 HydrophobicContact CG-CG2 4.45Å; K177-V244 HydrophobicContact CB-CG1 3.87Å; K177-V244 HydrophobicContact CG-CG1 4.1Å; V180-V244 HydrophobicContact CB-CG2 3.85Å; V180-V244 HydrophobicContact CG1-CG2 4Å; V180-V244 HydrophobicContact CG2-CG2 3.59Å; Y239-V244 HydrophobicContact CD1-CB 3.73Å; Y239-V244 HydrophobicContact CD1-CG1 3.8Å; Y239-V244 HydrophobicContact CD1-CG2 4.02Å; Y239-V244 HydrophobicContact CE1-CG1 4.21Å; Y239-V244 HydrophobicContact CG-CB 4Å; Y239-V244 HydrophobicContact CG-CG1 4.15Å; Y239-V244 PolarHBondContact O-N 3.29Å; F242-V244 VanDerWaalsContact C-N 3.28Å; F242-V244 HydrophobicContact CB-CG2 4.38Å; F242-V244 PolarHBondContact O-N 2.98Å
245	I	77.5	Confident	87.1	Confident	28 Å²	28	57.3 Å²	57.3	14%	0.144	28%	0.283	C	S	.	.			trans	-89.6	120.4	-179.7	-54.7	-171.4	0	0	0	107.9	Q243 L247 L276 P278 Y326	Q243-I245 PolarHBondContact O-N 2.79Å; I245-L247 HydrophobicContact CG2-CD2 3.71Å; I245-L247 HydrophobicContact CG2-CG 3.86Å; I245-L276 HydrophobicContact CG1-CB 4.5Å; I245-P278 HydrophobicContact CD1-CG 3.78Å; I245-P278 HydrophobicContact CG2-CG 4.47Å; I245-Y326 HydrophobicContact CB-CE1 4.23Å; I245-Y326 HydrophobicContact CB-CE2 4.48Å; I245-Y326 WeakPolarHBondContact CB-OH 3.47Å; I245-Y326 HydrophobicContact CD1-CE2 4Å; I245-Y326 WeakPolarHBondContact CD1-OH 3.33Å; I245-Y326 HydrophobicContact CG2-CE1 4.2Å; I245-Y326 HydrophobicContact CG2-CE2 4.25Å
246	Q	77.3	Confident	87.4	Confident	96 Å²	96	56.4 Å²	56.4	45%	0.449	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	106.7	173.5	-175.5	170.7	-20	0	0	109.1	G274	Q246-G274 WeakPolarHBondContact O-CA 3.47Å
247	L	86	Confident	88	Confident	28 Å²	28	55.7 Å²	55.7	15%	0.147	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	148	174.6	-56.1	-176	0	0	0	110.3	I245 V272 V273 R277 A323 Y326	I245-L247 HydrophobicContact CG2-CD2 3.71Å; I245-L247 HydrophobicContact CG2-CG 3.86Å; L247-V272 HydrophobicContact CB-CG1 4.3Å; L247-V272 HydrophobicContact CD1-CG1 4.24Å; L247-V272 HydrophobicContact CD2-CG1 4.46Å; L247-V273 CarbonylContact C-O 3.53Å; L247-V273 WeakPolarHBondContact CA-O 3.45Å; L247-R277 HydrophobicContact CD2-CB 3.92Å; L247-R277 HydrophobicContact CD2-CG 3.81Å; L247-A323 HydrophobicContact CD1-CB 3.59Å; L247-Y326 VanDerWaalsContact CD1-CB 3.48Å; L247-Y326 HydrophobicContact CD1-CD1 3.61Å; L247-Y326 HydrophobicContact CD1-CD2 3.93Å; L247-Y326 HydrophobicContact CD1-CE1 4.33Å; L247-Y326 HydrophobicContact CD1-CG 3.39Å; L247-Y326 HydrophobicContact CG-CD1 4.27Å; L247-Y326 HydrophobicContact CG-CG 4.46Å
248	S	89.1	Confident	88.4	Confident	59 Å²	59	56.6 Å²	56.6	41%	0.413	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.7	174.1	62.5	0	0	0	0	109.9	V273	S248-V273 PolarHBondContact N-O 2.93Å; S248-V273 PolarHBondContact O-N 2.79Å; S248-V273 VanDerWaalsContact OG-CG2 3.27Å; S248-V273 WeakPolarHBondContact OG-CG2 3.27Å; S248-V273 PolarHBondContact OG-O 2.83Å
249	L	93.7	Very high	88.8	Confident	19 Å²	19	59.3 Å²	59.3	10%	0.099	31%	0.308	C	S	.	.			trans	-143.2	112.9	172.4	176.4	61.7	0	0	0	107	Q253 R254 A271 V272 V329 H330 Q331	L249-Q253 HydrophobicContact CD1-CB 3.96Å; L249-R254 HydrophobicContact CD2-CG 3.92Å; L249-R254 HydrophobicContact CG-CG 4.15Å; L249-A271 HydrophobicContact CD1-CB 3.84Å; L249-V272 HydrophobicContact CB-CG2 4.44Å; L249-V272 HydrophobicContact CD1-CG2 4.43Å; L249-V272 HydrophobicContact CD2-CG2 4.18Å; L249-V329 HydrophobicContact CB-CG1 3.73Å; L249-V329 HydrophobicContact CD2-CG1 4.46Å; L249-H330 WeakPolarHBondContact CD2-O 3.42Å; L249-Q331 HydrophobicContact CD1-CB 4.23Å; L249-Q331 HydrophobicContact CD2-CB 3.97Å
250	P	93.5	Very high	89.2	Confident	52 Å²	52	58.8 Å²	58.8	34%	0.338	31%	0.308	S	S	.	.			trans	-57.1	142	174.8	-25.6	35.3	0	0	0	111.8	D252 Q253 R254	P250-D252 WeakPolarHBondContact CB-OD1 3.31Å; P250-D252 PolarHBondContact O-N 2.82Å; P250-Q253 HydrophobicContact CB-CB 4.29Å; P250-Q253 HydrophobicContact CB-CG 4.12Å; P250-Q253 HydrophobicContact CG-CG 4.38Å; P250-Q253 WeakPolarHBondContact O-CA 3.23Å; P250-Q253 PolarHBondContact O-N 3.18Å; P250-R254 PolarHBondContact O-N 2.93Å
251	E	93.7	Very high	89.9	Confident	128 Å²	128	56 Å²	56	60%	0.598	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-57	-37.8	-178.8	-67.7	-57.9	127.9	0	0	112.8	Q253 R254	E251-Q253 PolarHBondContact O-N 3.43Å; E251-R254 PolarHBondContact O-N 3.5Å; E251-R254 IonicContact OE1-CZ 3.79Å; E251-R254 IonicContact OE1-NE 3.93Å; E251-R254 PolarHBondContact OE1-NE 3.46Å; E251-R254 IonicContact OE1-NH2 2.83Å; E251-R254 PolarHBondContact OE1-NH2 3.4Å; E251-R254 WeakPolarHBondContact OE2-CD 3.27Å; E251-R254 IonicContact OE2-CZ 2.97Å; E251-R254 VanDerWaalsContact OE2-CZ 3.27Å; E251-R254 IonicContact OE2-NE 3.5Å; E251-R254 PolarHBondContact OE2-NE 2.86Å; E251-R254 IonicContact OE2-NH2 2.85Å; E251-R254 PolarHBondContact OE2-NH2 3.21Å
252	D	95.6	Very high	90.4	Very high	133 Å²	133	58.5 Å²	58.5	71%	0.711	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-70.6	-13.7	177.6	63.3	-56.9	0	0	0	113.5	P250	P250-D252 WeakPolarHBondContact CB-OD1 3.31Å; P250-D252 PolarHBondContact O-N 2.82Å
253	Q	95.4	Very high	90.4	Very high	78 Å²	78	60.5 Å²	60.5	36%	0.364	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-103.4	-4.7	178.4	-64.3	-176	-11.1	0	0	113.1	L249 P250 E251 V255 A271 Q331	L249-Q253 HydrophobicContact CD1-CB 3.96Å; P250-Q253 HydrophobicContact CB-CB 4.29Å; P250-Q253 HydrophobicContact CB-CG 4.12Å; P250-Q253 HydrophobicContact CG-CG 4.38Å; P250-Q253 WeakPolarHBondContact O-CA 3.23Å; P250-Q253 PolarHBondContact O-N 3.18Å; E251-Q253 PolarHBondContact O-N 3.43Å; Q253-V255 PolarHBondContact O-N 3.39Å; Q253-A271 HydrophobicContact CB-CB 4.16Å; Q253-Q331 VanDerWaalsContact O-CG 3.26Å; Q253-Q331 WeakPolarHBondContact O-CG 3.31Å; Q253-Q331 PolarHBondContact O-NE2 3.46Å
254	R	96.3	Very high	90.8	Very high	110 Å²	110	61.2 Å²	61.2	42%	0.415	34%	0.342	S	S	.	.	S	Bend	trans	-59.2	-29.6	176.9	-72.9	-175.7	177.5	-142.6	10.3	113	L249 P250 E251 Q331 T332	L249-R254 HydrophobicContact CD2-CG 3.92Å; L249-R254 HydrophobicContact CG-CG 4.15Å; P250-R254 PolarHBondContact O-N 2.93Å; E251-R254 PolarHBondContact O-N 3.5Å; E251-R254 IonicContact OE1-CZ 3.79Å; E251-R254 IonicContact OE1-NE 3.93Å; E251-R254 PolarHBondContact OE1-NE 3.46Å; E251-R254 IonicContact OE1-NH2 2.83Å; E251-R254 PolarHBondContact OE1-NH2 3.4Å; E251-R254 WeakPolarHBondContact OE2-CD 3.27Å; E251-R254 IonicContact OE2-CZ 2.97Å; E251-R254 VanDerWaalsContact OE2-CZ 3.27Å; E251-R254 IonicContact OE2-NE 3.5Å; E251-R254 PolarHBondContact OE2-NE 2.86Å; E251-R254 IonicContact OE2-NH2 2.85Å; E251-R254 PolarHBondContact OE2-NH2 3.21Å; R254-Q331 CarbonylContact O-C 3.46Å; R254-Q331 WeakPolarHBondContact O-CA 3.29Å; R254-T332 PolarHBondContact O-N 2.83Å
255	V	96.4	Very high	91	Very high	86 Å²	86	64 Å²	64	52%	0.521	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.5	172.6	-178	0	0	0	0	108.7	Q253 T332 I334	Q253-V255 PolarHBondContact O-N 3.39Å; V255-T332 CarbonylContact C-O 3.51Å; V255-T332 VanDerWaalsContact CA-O 3.3Å; V255-T332 WeakPolarHBondContact CA-O 3.45Å; V255-I334 HydrophobicContact CG1-CD1 3.8Å; V255-I334 HydrophobicContact CG1-CG1 4.16Å
256	S	95.4	Very high	91.6	Very high	29 Å²	29	63 Å²	63	20%	0.203	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	150.8	173.9	67.4	0	0	0	0	110.6	T332 H333 I334	S256-T332 PolarHBondContact N-O 2.92Å; S256-H333 CarbonylContact O-C 3.57Å; S256-H333 WeakPolarHBondContact O-CA 3.46Å; S256-H333 PolarHBondContact OG-CE1 2.88Å; S256-H333 PolarHBondContact OG-ND1 2.99Å; S256-I334 PolarHBondContact O-N 2.87Å
257	I	94.5	Very high	92.1	Very high	100 Å²	100	61.5 Å²	61.5	51%	0.513	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.7	176.3	-58.2	173.5	0	0	0	107	I334 Q336	I257-I334 WeakPolarHBondContact CA-O 3.5Å; I257-I334 HydrophobicContact CG1-CB 4.29Å; I257-I334 HydrophobicContact CG1-CD1 4.33Å; I257-Q336 HydrophobicContact CG2-CG 4.41Å
258	T	93.2	Very high	92.5	Very high	34 Å²	34	60.1 Å²	60.1	21%	0.209	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.8	176.2	-60.6	0	0	0	0	108.3	L268 I334 F335 Q336	T258-L268 HydrophobicContact CG2-CD2 3.64Å; T258-I334 PolarHBondContact N-O 3.12Å; T258-F335 HydrophobicContact CG2-CD2 4.05Å; T258-F335 HydrophobicContact CG2-CE2 4.16Å; T258-F335 WeakPolarHBondContact O-CA 3.45Å; T258-F335 WeakPolarHBondContact O-CD2 3.29Å; T258-Q336 PolarHBondContact O-N 3.11Å
259	A	94.4	Very high	92.5	Very high	58 Å²	58	60.3 Å²	60.3	48%	0.479	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.8	177.9	0	0	0	0	0	110.4	Q336	A259-Q336 WeakPolarHBondContact CA-O 3.25Å; A259-Q336 HydrophobicContact CB-CB 4.3Å
260	A	94.2	Very high	92.5	Very high	9 Å²	9	60.1 Å²	60.1	7%	0.074	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	153.2	173.5	0	0	0	0	0	110.5	A266 V311 F335 Q336 V337 N338	A260-A266 HydrophobicContact CB-CB 3.92Å; A260-V311 HydrophobicContact CB-CG1 4.33Å; A260-V311 HydrophobicContact CB-CG2 4.13Å; A260-F335 HydrophobicContact CB-CE2 3.88Å; A260-F335 HydrophobicContact CB-CZ 3.88Å; A260-Q336 PolarHBondContact N-O 2.76Å; A260-V337 CarbonylContact O-C 3.5Å; A260-V337 VanDerWaalsContact O-CA 3.32Å; A260-V337 WeakPolarHBondContact O-CA 3.48Å; A260-N338 PolarHBondContact O-N 3.47Å
261	T	93.8	Very high	92.5	Very high	33 Å²	33	58.6 Å²	58.6	20%	0.202	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	144.7	175	-54.4	0	0	0	0	110.3	G263 Q264 N338 A419	T261-G263 PolarHBondContact O-N 2.83Å; T261-Q264 VanDerWaalsContact O-CB 3.29Å; T261-Q264 WeakPolarHBondContact O-CB 3.43Å; T261-Q264 PolarHBondContact O-N 2.9Å; T261-Q264 VanDerWaalsContact O-N 3.11Å; T261-N338 CarbonylContact C-O 3.58Å; T261-N338 VanDerWaalsContact CA-O 3.29Å; T261-N338 WeakPolarHBondContact CA-O 3.42Å; T261-A419 HydrophobicContact CG2-CB 4.06Å
262	V	92.9	Very high	92.4	Very high	52 Å²	52	52.5 Å²	52.5	32%	0.315	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	138.8	175	68.3	0	0	0	0	112.1	Q264 V337 N338 V339	V262-Q264 PolarHBondContact O-N 2.87Å; V262-V337 HydrophobicContact CB-CG1 4.36Å; V262-N338 PolarHBondContact N-O 3.3Å; V262-V339 HydrophobicContact CB-CG2 4.3Å; V262-V339 HydrophobicContact CG1-CG1 4.18Å; V262-V339 HydrophobicContact CG1-CG2 4.41Å
263	G	87.1	Confident	92.1	Very high	48 Å²	48	50 Å²	50	50%	0.495	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-13.2	-178.4	0	0	0	0	0	115.4	T261 V311	T261-G263 PolarHBondContact O-N 2.83Å; G263-V311 PolarHBondContact N-O 3.26Å
264	Q	87	Confident	91.4	Very high	104 Å²	104	47.9 Å²	47.9	49%	0.486	30%	0.3	S	S	.	.	S	Bend	trans	-79.4	169.3	172.6	-61.4	-176.9	-32.8	0	0	111.4	T261 V262 V311	T261-Q264 VanDerWaalsContact O-CB 3.29Å; T261-Q264 WeakPolarHBondContact O-CB 3.43Å; T261-Q264 PolarHBondContact O-N 2.9Å; T261-Q264 VanDerWaalsContact O-N 3.11Å; V262-Q264 PolarHBondContact O-N 2.87Å; Q264-V311 WeakPolarHBondContact O-CB 3.36Å; Q264-V311 VanDerWaalsContact O-CG2 3.23Å; Q264-V311 WeakPolarHBondContact O-CG2 3.41Å; Q264-V311 PolarHBondContact O-N 3.37Å
265	S	84	Confident	90.3	Very high	59 Å²	59	46 Å²	46	41%	0.413	30%	0.301	S	S	.	.			trans	-91.4	148.8	166.2	-49.6	0	0	0	0	110.5	I308 T309	S265-I308 CarbonylContact C-O 3.57Å; S265-I308 WeakPolarHBondContact CA-O 3.4Å; S265-I308 WeakPolarHBondContact CB-O 3.41Å; S265-T309 WeakPolarHBondContact CB-O 3.32Å; S265-T309 PolarHBondContact OG-O 3Å
266	A	89.2	Confident	89.2	Confident	8 Å²	8	44.6 Å²	44.6	7%	0.066	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.6	175.1	0	0	0	0	0	111.2	A260 I308 V311 F335	A260-A266 HydrophobicContact CB-CB 3.92Å; A266-I308 HydrophobicContact CB-CB 4.42Å; A266-I308 PolarHBondContact N-O 3.37Å; A266-I308 PolarHBondContact O-N 3.12Å; A266-V311 HydrophobicContact CB-CG2 3.63Å; A266-F335 HydrophobicContact CB-CE2 3.72Å; A266-F335 HydrophobicContact CB-CZ 3.61Å
267	V	89.1	Confident	88.4	Confident	64 Å²	64	46.6 Å²	46.6	39%	0.388	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.1	177.5	-172.7	0	0	0	0	108.2	L306 Y307	V267-L306 WeakPolarHBondContact CA-O 3.44Å; V267-Y307 HydrophobicContact CB-CD1 4.36Å; V267-Y307 HydrophobicContact CB-CE1 4.25Å; V267-Y307 HydrophobicContact CG1-CD1 4.11Å; V267-Y307 HydrophobicContact CG1-CE1 3.72Å; V267-Y307 HydrophobicContact CG1-CE2 4.33Å; V267-Y307 HydrophobicContact CG2-CD1 3.52Å; V267-Y307 HydrophobicContact CG2-CE1 3.48Å; V267-Y307 VanDerWaalsContact CG2-CE1 3.48Å; V267-Y307 HydrophobicContact CG2-CG 4.49Å
268	L	93	Very high	87.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	113	172.6	-47.9	-175	0	0	0	108.3	T258 W282 S305 L306 Y319 H333 F335	T258-L268 HydrophobicContact CG2-CD2 3.64Å; L268-W282 HydrophobicContact CB-CH2 3.45Å; L268-W282 VanDerWaalsContact CB-CH2 3.45Å; L268-W282 HydrophobicContact CB-CZ2 4.13Å; L268-W282 HydrophobicContact CB-CZ3 3.89Å; L268-W282 HydrophobicContact CD1-CZ3 4.12Å; L268-W282 WeakPolarHBondContact O-CH2 3.34Å; L268-W282 WeakPolarHBondContact O-CZ2 3.46Å; L268-S305 CarbonylContact O-C 3.56Å; L268-S305 WeakPolarHBondContact O-CA 3.4Å; L268-S305 WeakPolarHBondContact O-CB 3.46Å; L268-L306 HydrophobicContact CB-CB 4.17Å; L268-L306 HydrophobicContact CD1-CD2 3.96Å; L268-L306 PolarHBondContact N-O 2.85Å; L268-L306 PolarHBondContact O-N 3.17Å; L268-Y319 HydrophobicContact CD1-CD1 4.41Å; L268-Y319 HydrophobicContact CD1-CD2 3.97Å; L268-Y319 HydrophobicContact CD1-CG 3.85Å; L268-H333 HydrophobicContact CD1-CB 4.15Å; L268-F335 HydrophobicContact CD2-CD2 3.89Å; L268-F335 HydrophobicContact CD2-CE2 4.35Å; L268-F335 HydrophobicContact CD2-CG 4.48Å
269	S	90.9	Very high	87	Confident	63 Å²	63	44.7 Å²	44.7	44%	0.441	29%	0.289	S	S	.	.			trans	-100.5	128.8	-179.3	-60.9	0	0	0	0	111.3	S305 Q331 H333	S269-S305 WeakPolarHBondContact CA-OG 3.21Å; S269-S305 WeakPolarHBondContact CB-OG 3.34Å; S269-S305 PolarHBondContact OG-OG 2.81Å; S269-Q331 PolarHBondContact O-OE1 3.41Å; S269-H333 PolarHBondContact O-CE1 2.84Å; S269-H333 VanDerWaalsContact O-CE1 3.23Å; S269-H333 PolarHBondContact O-NE2 3.06Å; S269-H333 VanDerWaalsContact O-NE2 3.09Å
270	C	92.1	Very high	86.7	Confident	15 Å²	15	42.2 Å²	42.2	10%	0.101	27%	0.267	C	S	.	.			trans	-78.9	124.4	179.4	-159.9	0	0	0	0	111.1	V272 I280 W282 C321	C270-V272 VanDerWaalsContact C-N 3.28Å; C270-V272 PolarHBondContact O-N 3.46Å; C270-I280 HydrophobicContact CB-CD1 4.25Å; C270-I280 HydrophobicContact CB-CG1 4.13Å; C270-I280 HydrophobicContact CB-CG2 3.9Å; C270-W282 HydrophobicContact CB-CZ2 4.1Å; C270-C321 WeakPolarHBondContact CA-SG 3.2Å; C270-C321 HydrophobicContact CB-CB 3.78Å; C270-C321 WeakPolarHBondContact CB-SG 3.24Å; C270-C321 WeakPolarHBondContact SG-CB 3.3Å; C270-C321 CovalentContact SG-SG 2.04Å; C270-C321 PolarHBondContact SG-SG 2.91Å
271	A	94.2	Very high	86.4	Confident	20 Å²	20	42.9 Å²	42.9	17%	0.165	27%	0.269	C	S	.	.			trans	-82.4	-1.2	-178.9	0	0	0	0	0	114	L249 Q253 V273	L249-A271 HydrophobicContact CD1-CB 3.84Å; Q253-A271 HydrophobicContact CB-CB 4.16Å; A271-V273 PolarHBondContact O-N 2.89Å
272	V	91.3	Very high	86.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	26%	0.26	C	S	.	.			trans	-65.8	116.7	172.2	179.6	0	0	0	0	108.5	L247 L249 C270 R277 I280 A323 V329	L247-V272 HydrophobicContact CB-CG1 4.3Å; L247-V272 HydrophobicContact CD1-CG1 4.24Å; L247-V272 HydrophobicContact CD2-CG1 4.46Å; L249-V272 HydrophobicContact CB-CG2 4.44Å; L249-V272 HydrophobicContact CD1-CG2 4.43Å; L249-V272 HydrophobicContact CD2-CG2 4.18Å; C270-V272 VanDerWaalsContact C-N 3.28Å; C270-V272 PolarHBondContact O-N 3.46Å; V272-R277 WeakPolarHBondContact O-CD 3.28Å; V272-R277 PolarHBondContact O-NH1 3.44Å; V272-I280 HydrophobicContact CB-CD1 4.46Å; V272-A323 HydrophobicContact CG1-CB 4.48Å; V272-V329 HydrophobicContact CG1-CG1 4.42Å; V272-V329 HydrophobicContact CG2-CG1 4.45Å
273	V	88.7	Confident	86.3	Confident	81 Å²	81	41.2 Å²	41.2	49%	0.491	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151	-179.9	-62.1	0	0	0	0	110.8	L247 S248 A271	L247-V273 CarbonylContact C-O 3.53Å; L247-V273 WeakPolarHBondContact CA-O 3.45Å; S248-V273 PolarHBondContact N-O 2.93Å; S248-V273 PolarHBondContact O-N 2.79Å; S248-V273 VanDerWaalsContact OG-CG2 3.27Å; S248-V273 WeakPolarHBondContact OG-CG2 3.27Å; S248-V273 PolarHBondContact OG-O 2.83Å; A271-V273 PolarHBondContact O-N 2.89Å
274	G	82.2	Confident	86.7	Confident	32 Å²	32	39 Å²	39	33%	0.33	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	175.7	155.6	179.5	0	0	0	0	0	112.6	Q246 R277	Q246-G274 WeakPolarHBondContact O-CA 3.47Å; G274-R277 WeakPolarHBondContact O-CB 3.4Å; G274-R277 PolarHBondContact O-N 2.92Å
275	T	73.5	Confident	86.9	Confident	70 Å²	70	36.2 Å²	36.2	43%	0.429	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	136.7	167.5	48.5	0	0	0	0	108.7	R277	T275-R277 PolarHBondContact O-N 3.33Å; T275-R277 VanDerWaalsContact O-N 3.13Å
276	L	72.4	Confident	87.1	Confident	58 Å²	58	39.4 Å²	39.4	30%	0.304	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	26.1	-173.7	-74.9	-168.9	0	0	0	115.1	R240 I245 P278	R240-L276 VanDerWaalsContact CA-CD1 3.44Å; R240-L276 HydrophobicContact CB-CD1 3.8Å; R240-L276 HydrophobicContact CB-CD2 4.42Å; R240-L276 HydrophobicContact CB-CG 3.96Å; R240-L276 HydrophobicContact CG-CD1 3.78Å; R240-L276 HydrophobicContact CG-CD2 3.85Å; R240-L276 HydrophobicContact CG-CG 3.92Å; I245-L276 HydrophobicContact CG1-CB 4.5Å; L276-P278 VanDerWaalsContact O-CD 3.27Å; L276-P278 WeakPolarHBondContact O-CD 3.4Å; L276-P278 VanDerWaalsContact O-N 3.11Å
277	R	78.7	Confident	87.2	Confident	70 Å²	70	41.7 Å²	41.7	26%	0.264	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-51	122.1	178.3	179.9	-175.5	64.4	129.1	11	110.9	L247 V272 G274 T275 I280 D303 A323	L247-R277 HydrophobicContact CD2-CB 3.92Å; L247-R277 HydrophobicContact CD2-CG 3.81Å; V272-R277 WeakPolarHBondContact O-CD 3.28Å; V272-R277 PolarHBondContact O-NH1 3.44Å; G274-R277 WeakPolarHBondContact O-CB 3.4Å; G274-R277 PolarHBondContact O-N 2.92Å; T275-R277 PolarHBondContact O-N 3.33Å; T275-R277 VanDerWaalsContact O-N 3.13Å; R277-I280 VanDerWaalsContact NH1-CD1 3.32Å; R277-D303 PolarHBondContact NH1-O 2.97Å; R277-D303 PolarHBondContact NH2-O 3.4Å; R277-A323 HydrophobicContact CG-CB 4.19Å
278	P	78.7	Confident	87.3	Confident	20 Å²	20	40.5 Å²	40.5	13%	0.13	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-58.4	166.9	174.6	-25.6	33.9	0	0	0	112.9	I245 L276 A323 D324 Y326	I245-P278 HydrophobicContact CD1-CG 3.78Å; I245-P278 HydrophobicContact CG2-CG 4.47Å; L276-P278 VanDerWaalsContact O-CD 3.27Å; L276-P278 WeakPolarHBondContact O-CD 3.4Å; L276-P278 VanDerWaalsContact O-N 3.11Å; P278-A323 HydrophobicContact CB-CB 4.2Å; P278-A323 HydrophobicContact CG-CB 4.31Å; P278-D324 HydrophobicContact CB-CB 4.12Å; P278-D324 WeakPolarHBondContact CB-O 3.1Å; P278-Y326 HydrophobicContact CG-CD2 3.92Å; P278-Y326 HydrophobicContact CG-CE2 3.74Å
279	P	80.3	Confident	87.1	Confident	75 Å²	75	40.7 Å²	40.7	49%	0.487	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-52.4	143.2	172.9	-24.9	34.9	0	0	0	111.9	D324	P279-D324 PolarHBondContact O-N 2.59Å
280	I	86.9	Confident	86.8	Confident	6 Å²	6	39.4 Å²	39.4	3%	0.031	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	128	177.1	-64.6	-58.3	0	0	0	110.1	C270 V272 R277 N290 C321 Y322 A323	C270-I280 HydrophobicContact CB-CD1 4.25Å; C270-I280 HydrophobicContact CB-CG1 4.13Å; C270-I280 HydrophobicContact CB-CG2 3.9Å; V272-I280 HydrophobicContact CB-CD1 4.46Å; R277-I280 VanDerWaalsContact NH1-CD1 3.32Å; I280-N290 PolarHBondContact O-ND2 3.18Å; I280-C321 HydrophobicContact CG2-CB 3.8Å; I280-Y322 CarbonylContact C-O 3.31Å; I280-Y322 WeakPolarHBondContact CA-O 3.22Å; I280-A323 HydrophobicContact CD1-CB 4.23Å
281	I	87.6	Confident	86.1	Confident	23 Å²	23	45.4 Å²	45.4	12%	0.118	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.1	171.7	-53.1	-57.6	0	0	0	108.5	V288 C321 Y322 D324	I281-V288 HydrophobicContact CG2-CB 4.37Å; I281-V288 HydrophobicContact CG2-CG1 3.62Å; I281-V288 HydrophobicContact CG2-CG2 3.91Å; I281-C321 VanDerWaalsContact O-CA 3.26Å; I281-C321 WeakPolarHBondContact O-CA 2.87Å; I281-Y322 HydrophobicContact CB-CD2 4.18Å; I281-Y322 HydrophobicContact CB-CE1 4.14Å; I281-Y322 HydrophobicContact CB-CE2 3.78Å; I281-Y322 HydrophobicContact CG1-CE2 4.12Å; I281-Y322 HydrophobicContact CG2-CE1 4Å; I281-Y322 HydrophobicContact CG2-CE2 4.08Å; I281-Y322 PolarHBondContact N-O 3.03Å; I281-Y322 PolarHBondContact O-N 3Å; I281-D324 HydrophobicContact CD1-CB 4.16Å; I281-D324 HydrophobicContact CG1-CB 3.87Å
282	W	93.1	Very high	85.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.8	174.4	-73.9	82.9	0	0	0	110.5	L268 C270 V288 L289 N290 F300 G304 L306 T320 C321 H333	L268-W282 HydrophobicContact CB-CH2 3.45Å; L268-W282 VanDerWaalsContact CB-CH2 3.45Å; L268-W282 HydrophobicContact CB-CZ2 4.13Å; L268-W282 HydrophobicContact CB-CZ3 3.89Å; L268-W282 HydrophobicContact CD1-CZ3 4.12Å; L268-W282 WeakPolarHBondContact O-CH2 3.34Å; L268-W282 WeakPolarHBondContact O-CZ2 3.46Å; C270-W282 HydrophobicContact CB-CZ2 4.1Å; W282-V288 CarbonylContact O-C 3.5Å; W282-V288 WeakPolarHBondContact O-CA 3.28Å; W282-L289 HydrophobicContact CB-CB 4.37Å; W282-L289 HydrophobicContact CB-CD1 4.43Å; W282-L289 PolarHBondContact O-N 2.85Å; W282-N290 PolarHBondContact N-OD1 3.03Å; W282-N290 PolarHBondContact O-OD1 3.47Å; W282-F300 HydrophobicContact CB-CE1 3.81Å; W282-F300 AromaticContact CD1-CD1 3.17Å; W282-F300 AromaticContact CD1-CE1 3.12Å; W282-F300 HydrophobicContact CG-CD1 4.11Å; W282-F300 AromaticContact CG-CE1 3.65Å; W282-F300 HydrophobicContact CG-CE1 3.65Å; W282-F300 AromaticContact NE1-CD1 3.63Å; W282-F300 AromaticContact NE1-CE1 3.98Å; W282-G304 PolarHBondContact NE1-O 3.29Å; W282-L306 HydrophobicContact CB-CD1 4.37Å; W282-L306 HydrophobicContact CD2-CB 3.84Å; W282-L306 HydrophobicContact CD2-CD2 4.44Å; W282-L306 HydrophobicContact CE3-CB 4.27Å; W282-L306 HydrophobicContact CE3-CD2 4.3Å; W282-L306 HydrophobicContact CG-CB 4.24Å; W282-L306 HydrophobicContact CG-CD1 4.21Å; W282-L306 HydrophobicContact CH2-CB 4.47Å; W282-L306 HydrophobicContact CZ2-CB 4.08Å; W282-T320 CarbonylContact C-O 3.56Å; W282-T320 WeakPolarHBondContact CA-O 3.34Å; W282-C321 HydrophobicContact CD2-CB 3.71Å; W282-C321 HydrophobicContact CE3-CB 3.72Å; W282-C321 HydrophobicContact CG-CB 4.41Å; W282-C321 HydrophobicContact CH2-CB 3.73Å; W282-C321 HydrophobicContact CZ2-CB 3.71Å; W282-C321 HydrophobicContact CZ3-CB 3.74Å; W282-H333 AromaticContact CH2-CD2 3.61Å; W282-H333 AromaticContact CH2-NE2 3.77Å; W282-H333 AromaticContact CZ3-CD2 3.74Å
283	K	93.3	Very high	84.6	Confident	50 Å²	50	54.2 Å²	54.2	22%	0.217	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137	-177.3	-156.7	-169.8	-151.4	-161.3	0	109.9	N286 I287 Y319 T320 Y322	K283-N286 VanDerWaalsContact CE-CA 3.42Å; K283-N286 VanDerWaalsContact CE-O 3.3Å; K283-N286 WeakPolarHBondContact CE-O 3.4Å; K283-N286 PolarHBondContact NZ-OD1 3.37Å; K283-I287 CarbonylContact C-O 3.58Å; K283-I287 VanDerWaalsContact CA-O 3.24Å; K283-I287 WeakPolarHBondContact CA-O 3.43Å; K283-Y319 CarbonylContact O-C 3.55Å; K283-Y319 WeakPolarHBondContact O-CA 3.26Å; K283-T320 PolarHBondContact N-O 2.98Å; K283-T320 PolarHBondContact O-N 2.81Å; K283-Y322 HydrophobicContact CB-CE1 4.33Å
284	R	93.7	Very high	84	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	129.5	168.2	177.2	-176.4	172	87.2	2	108	N286 I287 L289 H315 M316 Y319 G658 D680	R284-N286 PolarHBondContact O-N 2.83Å; R284-N286 VanDerWaalsContact O-N 3.14Å; R284-I287 PolarHBondContact N-O 3.4Å; R284-I287 PolarHBondContact O-N 3.04Å; R284-L289 HydrophobicContact CB-CD1 4.11Å; R284-L289 HydrophobicContact CB-CD2 4.02Å; R284-L289 HydrophobicContact CB-CG 4.25Å; R284-H315 PolarHBondContact NH1-O 3.35Å; R284-M316 PolarHBondContact NH1-O 2.95Å; R284-M316 PolarHBondContact NH2-O 3.43Å; R284-Y319 HydrophobicContact CB-CD1 4.27Å; R284-Y319 HydrophobicContact CB-CE1 4.32Å; R284-Y319 HydrophobicContact CG-CE1 4.46Å; R284-Y319 PolarHBondContact NH1-OH 3.17Å; R284-G658 PolarHBondContact NH2-O 3.41Å; R284-D680 IonicContact CZ-OD1 3.85Å; R284-D680 IonicContact NE-OD1 3.62Å; R284-D680 PolarHBondContact NE-OD1 2.69Å; R284-D680 IonicContact NE-OD2 2.76Å; R284-D680 PolarHBondContact NE-OD2 3.21Å; R284-D680 IonicContact NH2-OD1 3.62Å; R284-D680 PolarHBondContact NH2-OD1 2.97Å
285	N	91	Very high	83.5	Confident	45 Å²	45	56.2 Å²	56.2	24%	0.241	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	45	178.6	-60.9	-29.2	0	0	0	113.1	I287 D680 I687	N285-I287 PolarHBondContact O-N 2.93Å; N285-D680 PolarHBondContact ND2-OD1 2.88Å; N285-D680 VanDerWaalsContact ND2-OD1 3.09Å; N285-I687 HydrophobicContact CB-CD1 4.45Å; N285-I687 HydrophobicContact CB-CG1 4.15Å; N285-I687 WeakPolarHBondContact ND2-CD1 3.31Å
286	N	90	Very high	83.4	Confident	126 Å²	126	55.6 Å²	55.6	67%	0.674	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	6.3	-175.6	-65.1	-43.9	0	0	0	117.8	K283 R284	K283-N286 VanDerWaalsContact CE-CA 3.42Å; K283-N286 VanDerWaalsContact CE-O 3.3Å; K283-N286 WeakPolarHBondContact CE-O 3.4Å; K283-N286 PolarHBondContact NZ-OD1 3.37Å; R284-N286 PolarHBondContact O-N 2.83Å; R284-N286 VanDerWaalsContact O-N 3.14Å
287	I	91.4	Very high	83.4	Confident	57 Å²	57	53.6 Å²	53.6	29%	0.292	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.9	175.5	-58.5	-54.9	0	0	0	110.8	K283 R284 N285 L289 L292 T683 S685	K283-I287 CarbonylContact C-O 3.58Å; K283-I287 VanDerWaalsContact CA-O 3.24Å; K283-I287 WeakPolarHBondContact CA-O 3.43Å; R284-I287 PolarHBondContact N-O 3.4Å; R284-I287 PolarHBondContact O-N 3.04Å; N285-I287 PolarHBondContact O-N 2.93Å; I287-L289 PolarHBondContact O-N 2.02Å; I287-L292 HydrophobicContact CG2-CD1 3.88Å; I287-T683 HydrophobicContact CB-CG2 4.37Å; I287-T683 HydrophobicContact CG2-CG2 4.33Å; I287-S685 VanDerWaalsContact CG1-OG 3.29Å; I287-S685 WeakPolarHBondContact CG1-OG 3.33Å
288	V	90.1	Very high	82.6	Confident	39 Å²	39	53.4 Å²	53.4	24%	0.236	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	118.5	172.8	173.6	0	0	0	0	109.5	I281 W282 N290	I281-V288 HydrophobicContact CG2-CB 4.37Å; I281-V288 HydrophobicContact CG2-CG1 3.62Å; I281-V288 HydrophobicContact CG2-CG2 3.91Å; W282-V288 CarbonylContact O-C 3.5Å; W282-V288 WeakPolarHBondContact O-CA 3.28Å; V288-N290 HydrophobicContact CG1-CB 4.02Å
289	L	90.1	Very high	81.6	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-75.5	-28.2	-178.8	-60.5	-176.2	0	0	0	112.3	W282 R284 I287 N291 L292 L294 L306 Y319 T683	W282-L289 HydrophobicContact CB-CB 4.37Å; W282-L289 HydrophobicContact CB-CD1 4.43Å; W282-L289 PolarHBondContact O-N 2.85Å; R284-L289 HydrophobicContact CB-CD1 4.11Å; R284-L289 HydrophobicContact CB-CD2 4.02Å; R284-L289 HydrophobicContact CB-CG 4.25Å; I287-L289 PolarHBondContact O-N 2.02Å; L289-N291 PolarHBondContact O-N 3.33Å; L289-L292 HydrophobicContact CD2-CD1 4.13Å; L289-L292 PolarHBondContact O-N 3.13Å; L289-L294 HydrophobicContact CD2-CD1 4.22Å; L289-L306 HydrophobicContact CD1-CD1 4.39Å; L289-L306 HydrophobicContact CD1-CD2 4.22Å; L289-Y319 HydrophobicContact CD1-CD1 3.67Å; L289-Y319 HydrophobicContact CD1-CE1 3.73Å; L289-T683 HydrophobicContact CD2-CG2 3.53Å
290	N	83.7	Confident	80.6	Confident	35 Å²	35	54 Å²	54	19%	0.187	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58.6	-27.1	-174.4	-59.6	55.4	0	0	0	114.5	I280 W282 V288 F300	I280-N290 PolarHBondContact O-ND2 3.18Å; W282-N290 PolarHBondContact N-OD1 3.03Å; W282-N290 PolarHBondContact O-OD1 3.47Å; V288-N290 HydrophobicContact CG1-CB 4.02Å; N290-F300 VanDerWaalsContact CA-CE2 3.42Å; N290-F300 HydrophobicContact CB-CD2 4.44Å; N290-F300 HydrophobicContact CB-CE2 3.56Å; N290-F300 HydrophobicContact CB-CZ 3.67Å; N290-F300 WeakPolarHBondContact ND2-CD2 3.34Å; N290-F300 WeakPolarHBondContact ND2-CE2 3.45Å; N290-F300 VanDerWaalsContact ND2-CZ 3.33Å; N290-F300 WeakPolarHBondContact ND2-CZ 3.35Å; N290-F300 VanDerWaalsContact OD1-CZ 3.27Å; N290-F300 WeakPolarHBondContact OD1-CZ 3.48Å
291	N	76.8	Confident	79.1	Confident	141 Å²	141	54 Å²	54	75%	0.754	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-94.5	-3.4	-177.9	-61.3	-21.3	0	0	0	112.8	L289	L289-N291 PolarHBondContact O-N 3.33Å
292	L	79.2	Confident	77.6	Confident	59 Å²	59	56.4 Å²	56.4	31%	0.309	30%	0.295	S	S	.	.	S	Bend	trans	-93.2	141.6	-179.1	-59.9	-179.3	0	0	0	110.5	I287 L289 L294 T683	I287-L292 HydrophobicContact CG2-CD1 3.88Å; L289-L292 HydrophobicContact CD2-CD1 4.13Å; L289-L292 PolarHBondContact O-N 3.13Å; L292-L294 HydrophobicContact CB-CD1 4.14Å; L292-L294 HydrophobicContact CB-CD2 4.14Å; L292-L294 HydrophobicContact CB-CG 3.76Å; L292-L294 HydrophobicContact CD1-CD1 4.27Å; L292-L294 HydrophobicContact CD1-CD2 4.45Å; L292-L294 PolarHBondContact O-N 2.87Å; L292-T683 HydrophobicContact CD1-CG2 3.98Å
293	D	74.3	Confident	76.5	Confident	146 Å²	146	59.7 Å²	59.7	78%	0.781	31%	0.313	S	S	*	.			trans	-93.1	83.9	172	-156.1	40.5	0	0	0	108.5	K124	K124-D293 IonicContact NZ-OD1 3.44Å
294	L	78	Confident	75.8	Confident	30 Å²	30	57.7 Å²	57.7	16%	0.157	31%	0.306	C	S	.	.			trans	-101.1	122.9	-178.4	-59.9	177.6	0	0	0	108.9	L289 L292 D296 I297 V682	L289-L294 HydrophobicContact CD2-CD1 4.22Å; L292-L294 HydrophobicContact CB-CD1 4.14Å; L292-L294 HydrophobicContact CB-CD2 4.14Å; L292-L294 HydrophobicContact CB-CG 3.76Å; L292-L294 HydrophobicContact CD1-CD1 4.27Å; L292-L294 HydrophobicContact CD1-CD2 4.45Å; L292-L294 PolarHBondContact O-N 2.87Å; L294-D296 PolarHBondContact O-N 3.31Å; L294-I297 HydrophobicContact CB-CB 3.93Å; L294-I297 HydrophobicContact CD1-CB 4.16Å; L294-I297 HydrophobicContact CD1-CD1 3.98Å; L294-I297 HydrophobicContact CD1-CG1 4.44Å; L294-I297 CarbonylContact O-C 3.55Å; L294-V682 HydrophobicContact CD1-CG1 4.18Å; L294-V682 WeakPolarHBondContact CD2-O 3.37Å
295	E	70.7	Confident	75.3	Confident	125 Å²	125	57.7 Å²	57.7	58%	0.584	31%	0.306	S	S	*	.	S	Bend	trans	-64.5	-42.6	-175.1	-67.7	179.8	-168.4	0	0	113.4	N298 R614	E295-N298 PolarHBondContact O-ND2 3.39Å; E295-R614 IonicContact OE1-CZ 3.84Å; E295-R614 IonicContact OE1-NH2 2.73Å; E295-R614 PolarHBondContact OE1-NH2 3.07Å; E295-R614 IonicContact OE2-CZ 3.9Å; E295-R614 IonicContact OE2-NH1 3.07Å; E295-R614 PolarHBondContact OE2-NH1 2.86Å; E295-R614 IonicContact OE2-NH2 3.93Å; E295-R614 PolarHBondContact OE2-NH2 3.32Å
296	D	71.5	Confident	75.2	Confident	57 Å²	57	55.5 Å²	55.5	31%	0.305	30%	0.295	S	S	.	.	S	Bend	trans	-84.4	-19.8	-175.4	-69.2	-36	0	0	0	113	L294 T309	L294-D296 PolarHBondContact O-N 3.31Å; D296-T309 PolarHBondContact O-N 3.13Å; D296-T309 PolarHBondContact O-OG1 2.6Å; D296-T309 VanDerWaalsContact O-OG1 3.11Å
297	I	71.7	Confident	75	Confident	16 Å²	16	51.6 Å²	51.6	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	99.7	-179.5	-57.4	-173.5	0	0	0	108.1	L294 L306 Y307 I308 V682	L294-I297 HydrophobicContact CB-CB 3.93Å; L294-I297 HydrophobicContact CD1-CB 4.16Å; L294-I297 HydrophobicContact CD1-CD1 3.98Å; L294-I297 HydrophobicContact CD1-CG1 4.44Å; L294-I297 CarbonylContact O-C 3.55Å; I297-L306 HydrophobicContact CG2-CD1 3.51Å; I297-L306 HydrophobicContact CG2-CD2 4.41Å; I297-L306 HydrophobicContact CG2-CG 3.99Å; I297-Y307 CarbonylContact C-O 3.57Å; I297-Y307 WeakPolarHBondContact CA-O 3.28Å; I297-I308 HydrophobicContact CG1-CG1 4.41Å; I297-V682 HydrophobicContact CD1-CG1 3.68Å
298	N	63.1	Low	74.8	Confident	66 Å²	66	48.9 Å²	48.9	35%	0.353	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	158.9	-175.7	-76.7	-72	0	0	0	112.4	E295 Y307 T309	E295-N298 PolarHBondContact O-ND2 3.39Å; N298-Y307 PolarHBondContact N-O 2.9Å; N298-Y307 PolarHBondContact O-N 3.5Å; N298-T309 HydrophobicContact CB-CG2 4.25Å; N298-T309 WeakPolarHBondContact ND2-CG2 3.34Å
299	D	57.5	Low	74.4	Confident	72 Å²	72	48.8 Å²	48.8	39%	0.385	26%	0.257	S	S	.	.			trans	-26.4	141.6	-172.9	-159.4	6.5	0	0	0	117.6	L72 H115 G301 Y307	L72-D299 HydrophobicContact CD1-CB 3.92Å; H115-D299 IonicContact CE1-OD2 3.83Å; H115-D299 PolarHBondContact CE1-OD2 3.31Å; H115-D299 IonicContact ND1-OD2 2.74Å; H115-D299 PolarHBondContact ND1-OD2 2.86Å; D299-G301 PolarHBondContact O-N 2.85Å; D299-Y307 VanDerWaalsContact O-CD2 3.28Å; D299-Y307 WeakPolarHBondContact O-CD2 3.43Å
300	F	59.8	Low	74.1	Confident	36 Å²	36	54.5 Å²	54.5	16%	0.158	28%	0.281	C	S	.	.			trans	-64.7	118.3	176.2	-47.3	-83.3	0	0	0	108.1	L72 W282 N290 S305 L306	L72-F300 WeakPolarHBondContact CD1-O 3.23Å; W282-F300 HydrophobicContact CB-CE1 3.81Å; W282-F300 AromaticContact CD1-CD1 3.17Å; W282-F300 AromaticContact CD1-CE1 3.12Å; W282-F300 HydrophobicContact CG-CD1 4.11Å; W282-F300 AromaticContact CG-CE1 3.65Å; W282-F300 HydrophobicContact CG-CE1 3.65Å; W282-F300 AromaticContact NE1-CD1 3.63Å; W282-F300 AromaticContact NE1-CE1 3.98Å; N290-F300 VanDerWaalsContact CA-CE2 3.42Å; N290-F300 HydrophobicContact CB-CD2 4.44Å; N290-F300 HydrophobicContact CB-CE2 3.56Å; N290-F300 HydrophobicContact CB-CZ 3.67Å; N290-F300 WeakPolarHBondContact ND2-CD2 3.34Å; N290-F300 WeakPolarHBondContact ND2-CE2 3.45Å; N290-F300 VanDerWaalsContact ND2-CZ 3.33Å; N290-F300 WeakPolarHBondContact ND2-CZ 3.35Å; N290-F300 VanDerWaalsContact OD1-CZ 3.27Å; N290-F300 WeakPolarHBondContact OD1-CZ 3.48Å; F300-S305 WeakPolarHBondContact CA-O 3.21Å; F300-L306 HydrophobicContact CD1-CD1 4.25Å; F300-L306 HydrophobicContact CE1-CD1 3.51Å; F300-L306 HydrophobicContact CZ-CD1 4.13Å
301	G	55.2	Low	74.4	Confident	7 Å²	7	52.9 Å²	52.9	7%	0.072	27%	0.272	C	S	.	.			trans	-53.3	172	177.9	0	0	0	0	0	112.4	D299 D303 G304 S305	D299-G301 PolarHBondContact O-N 2.85Å; G301-D303 WeakPolarHBondContact CA-OD1 3.23Å; G301-D303 PolarHBondContact O-N 2.88Å; G301-G304 WeakPolarHBondContact O-CA 3.47Å; G301-G304 PolarHBondContact O-N 2.79Å; G301-S305 PolarHBondContact N-O 2.82Å
302	D	56	Low	75.1	Confident	73 Å²	73	48 Å²	48	39%	0.39	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-20.6	172.3	-59.7	-2.2	0	0	0	113.4	H111 H115	H111-D302 HydrophobicContact CB-CB 4.16Å; H111-D302 WeakPolarHBondContact CB-OD1 3.07Å; H111-D302 WeakPolarHBondContact CB-OD2 3.43Å; H111-D302 IonicContact CG-OD1 3.5Å; H111-D302 IonicContact ND1-OD1 2.98Å; H115-D302 IonicContact CD2-OD1 3.57Å; H115-D302 IonicContact NE2-OD1 2.79Å
303	D	69.8	Low	75.7	Confident	68 Å²	68	45.3 Å²	45.3	36%	0.364	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-13.8	176.6	65.3	-14.7	0	0	0	114.4	R277 G301 S305	R277-D303 PolarHBondContact NH1-O 2.97Å; R277-D303 PolarHBondContact NH2-O 3.4Å; G301-D303 WeakPolarHBondContact CA-OD1 3.23Å; G301-D303 PolarHBondContact O-N 2.88Å; D303-S305 WeakPolarHBondContact OD1-CB 3.34Å; D303-S305 PolarHBondContact OD1-N 2.83Å; D303-S305 PolarHBondContact OD1-OG 3.47Å; D303-S305 WeakPolarHBondContact OD2-CB 3.39Å; D303-S305 PolarHBondContact OD2-OG 3.02Å
304	G	77.3	Confident	76.5	Confident	8 Å²	8	39.8 Å²	39.8	8%	0.082	21%	0.206	C	C	.	.			trans	87.2	16.4	-175.1	0	0	0	0	0	114.3	W282 G301	W282-G304 PolarHBondContact NE1-O 3.29Å; G301-G304 WeakPolarHBondContact O-CA 3.47Å; G301-G304 PolarHBondContact O-N 2.79Å
305	S	84.8	Confident	77.2	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.007	20%	0.199	C	C	.	.			trans	-77.4	139.8	-178.6	-69	0	0	0	0	113.1	L268 S269 F300 G301 D303 Y307	L268-S305 CarbonylContact O-C 3.56Å; L268-S305 WeakPolarHBondContact O-CA 3.4Å; L268-S305 WeakPolarHBondContact O-CB 3.46Å; S269-S305 WeakPolarHBondContact CA-OG 3.21Å; S269-S305 WeakPolarHBondContact CB-OG 3.34Å; S269-S305 PolarHBondContact OG-OG 2.81Å; F300-S305 WeakPolarHBondContact CA-O 3.21Å; G301-S305 PolarHBondContact N-O 2.82Å; D303-S305 WeakPolarHBondContact OD1-CB 3.34Å; D303-S305 PolarHBondContact OD1-N 2.83Å; D303-S305 PolarHBondContact OD1-OG 3.47Å; D303-S305 WeakPolarHBondContact OD2-CB 3.39Å; D303-S305 PolarHBondContact OD2-OG 3.02Å; S305-Y307 WeakPolarHBondContact O-CD2 3.31Å; S305-Y307 VanDerWaalsContact O-CE2 3.28Å; S305-Y307 WeakPolarHBondContact O-CE2 3.38Å
306	L	89.1	Confident	78.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	124.9	174.8	-171.8	77.9	0	0	0	110.8	V267 L268 W282 L289 I297 F300 Y319	V267-L306 WeakPolarHBondContact CA-O 3.44Å; L268-L306 HydrophobicContact CB-CB 4.17Å; L268-L306 HydrophobicContact CD1-CD2 3.96Å; L268-L306 PolarHBondContact N-O 2.85Å; L268-L306 PolarHBondContact O-N 3.17Å; W282-L306 HydrophobicContact CB-CD1 4.37Å; W282-L306 HydrophobicContact CD2-CB 3.84Å; W282-L306 HydrophobicContact CD2-CD2 4.44Å; W282-L306 HydrophobicContact CE3-CB 4.27Å; W282-L306 HydrophobicContact CE3-CD2 4.3Å; W282-L306 HydrophobicContact CG-CB 4.24Å; W282-L306 HydrophobicContact CG-CD1 4.21Å; W282-L306 HydrophobicContact CH2-CB 4.47Å; W282-L306 HydrophobicContact CZ2-CB 4.08Å; L289-L306 HydrophobicContact CD1-CD1 4.39Å; L289-L306 HydrophobicContact CD1-CD2 4.22Å; I297-L306 HydrophobicContact CG2-CD1 3.51Å; I297-L306 HydrophobicContact CG2-CD2 4.41Å; I297-L306 HydrophobicContact CG2-CG 3.99Å; F300-L306 HydrophobicContact CD1-CD1 4.25Å; F300-L306 HydrophobicContact CE1-CD1 3.51Å; F300-L306 HydrophobicContact CZ-CD1 4.13Å; L306-Y319 HydrophobicContact CD2-CD1 3.63Å; L306-Y319 HydrophobicContact CD2-CE1 3.9Å; L306-Y319 HydrophobicContact CD2-CG 4.4Å
307	Y	84.6	Confident	79.3	Confident	43 Å²	43	30.1 Å²	30.1	17%	0.169	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.2	179.2	-67.9	-98.5	0	0	0	111.5	Y69 V267 I297 N298 D299 S305	Y69-Y307 HydrophobicContact CE1-CD1 4.25Å; Y69-Y307 HydrophobicContact CE1-CG 4.4Å; Y69-Y307 AromaticContact CE2-CD1 3.88Å; Y69-Y307 HydrophobicContact CE2-CD1 3.88Å; Y69-Y307 AromaticContact CE2-CE1 3.99Å; Y69-Y307 HydrophobicContact CE2-CE1 3.99Å; Y69-Y307 AromaticContact CZ-CD1 3.65Å; V267-Y307 HydrophobicContact CB-CD1 4.36Å; V267-Y307 HydrophobicContact CB-CE1 4.25Å; V267-Y307 HydrophobicContact CG1-CD1 4.11Å; V267-Y307 HydrophobicContact CG1-CE1 3.72Å; V267-Y307 HydrophobicContact CG1-CE2 4.33Å; V267-Y307 HydrophobicContact CG2-CD1 3.52Å; V267-Y307 HydrophobicContact CG2-CE1 3.48Å; V267-Y307 VanDerWaalsContact CG2-CE1 3.48Å; V267-Y307 HydrophobicContact CG2-CG 4.49Å; I297-Y307 CarbonylContact C-O 3.57Å; I297-Y307 WeakPolarHBondContact CA-O 3.28Å; N298-Y307 PolarHBondContact N-O 2.9Å; N298-Y307 PolarHBondContact O-N 3.5Å; D299-Y307 VanDerWaalsContact O-CD2 3.28Å; D299-Y307 WeakPolarHBondContact O-CD2 3.43Å; S305-Y307 WeakPolarHBondContact O-CD2 3.31Å; S305-Y307 VanDerWaalsContact O-CE2 3.28Å; S305-Y307 WeakPolarHBondContact O-CE2 3.38Å
308	I	87.2	Confident	80.3	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	110.9	171.8	-54.2	174.7	0	0	0	107	S265 A266 I297 V311 H315 F335	S265-I308 CarbonylContact C-O 3.57Å; S265-I308 WeakPolarHBondContact CA-O 3.4Å; S265-I308 WeakPolarHBondContact CB-O 3.41Å; A266-I308 HydrophobicContact CB-CB 4.42Å; A266-I308 PolarHBondContact N-O 3.37Å; A266-I308 PolarHBondContact O-N 3.12Å; I297-I308 HydrophobicContact CG1-CG1 4.41Å; I308-V311 HydrophobicContact CB-CG2 4.23Å; I308-V311 HydrophobicContact CG2-CG2 3.83Å; I308-H315 HydrophobicContact CD1-CB 4.29Å; I308-H315 WeakPolarHBondContact CG2-ND1 3.24Å; I308-F335 HydrophobicContact CD1-CD1 3.99Å; I308-F335 HydrophobicContact CD1-CE1 3.58Å; I308-F335 HydrophobicContact CD1-CZ 4.05Å
309	T	82.4	Confident	81.8	Confident	37 Å²	37	29.9 Å²	29.9	23%	0.227	16%	0.158	C	C	.	.	S	Bend	trans	-74.1	-38.9	-171.1	58.2	0	0	0	0	112.6	Y69 S265 D296 N298	Y69-T309 HydrophobicContact CD1-CG2 3.9Å; Y69-T309 HydrophobicContact CE1-CG2 4.44Å; S265-T309 WeakPolarHBondContact CB-O 3.32Å; S265-T309 PolarHBondContact OG-O 3Å; D296-T309 PolarHBondContact O-N 3.13Å; D296-T309 PolarHBondContact O-OG1 2.6Å; D296-T309 VanDerWaalsContact O-OG1 3.11Å; N298-T309 HydrophobicContact CB-CG2 4.25Å; N298-T309 WeakPolarHBondContact ND2-CG2 3.34Å
310	K	83	Confident	83.7	Confident	125 Å²	125	28 Å²	28	54%	0.543	15%	0.149	S	C	.	.	S	Bend	trans	-134.2	100.7	176.7	-174.1	-179.1	179.3	-175.4	0	109.5	H315	K310-H315 PolarHBondContact O-CE1 3.39Å; K310-H315 VanDerWaalsContact O-CE1 3.25Å
311	V	91	Very high	85.3	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.141	C	C	.	.			trans	-68.3	133.4	-179.6	174.8	0	0	0	0	110.2	A260 G263 Q264 A266 I308 F335 V337	A260-V311 HydrophobicContact CB-CG1 4.33Å; A260-V311 HydrophobicContact CB-CG2 4.13Å; G263-V311 PolarHBondContact N-O 3.26Å; Q264-V311 WeakPolarHBondContact O-CB 3.36Å; Q264-V311 VanDerWaalsContact O-CG2 3.23Å; Q264-V311 WeakPolarHBondContact O-CG2 3.41Å; Q264-V311 PolarHBondContact O-N 3.37Å; A266-V311 HydrophobicContact CB-CG2 3.63Å; I308-V311 HydrophobicContact CB-CG2 4.23Å; I308-V311 HydrophobicContact CG2-CG2 3.83Å; V311-F335 HydrophobicContact CG1-CE1 4Å; V311-F335 HydrophobicContact CG1-CZ 3.85Å; V311-F335 HydrophobicContact CG2-CE1 4.33Å; V311-F335 HydrophobicContact CG2-CZ 3.79Å; V311-V337 HydrophobicContact CG1-CB 4.14Å; V311-V337 HydrophobicContact CG1-CG1 3.6Å; V311-V337 HydrophobicContact CG1-CG2 3.47Å; V311-V337 VanDerWaalsContact CG1-CG2 3.47Å
312	T	91.2	Very high	87.1	Confident	39 Å²	39	26.7 Å²	26.7	24%	0.239	14%	0.141	C	C	.	.			trans	-137.1	165.5	171.5	65.4	0	0	0	0	107.8	V314 H315	T312-V314 PolarHBondContact O-N 3.4Å; T312-V314 VanDerWaalsContact O-N 3.15Å; T312-V314 WeakPolarHBondContact OG1-CG2 3.45Å; T312-H315 PolarHBondContact N-ND1 2.52Å; T312-H315 WeakPolarHBondContact O-CB 3.25Å; T312-H315 PolarHBondContact O-N 3.15Å; T312-H315 VanDerWaalsContact O-N 3.07Å
313	T	92	Very high	88.7	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.012	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-63	-22.6	-175.1	59.2	0	0	0	0	113.2	H315 M316 V337 V339 I367 I610 H656	T313-H315 PolarHBondContact O-N 2.91Å; T313-M316 HydrophobicContact CG2-CE 4.07Å; T313-M316 VanDerWaalsContact O-CB 3.25Å; T313-M316 WeakPolarHBondContact O-CB 3.4Å; T313-M316 WeakPolarHBondContact O-CG 3.47Å; T313-M316 PolarHBondContact O-N 2.92Å; T313-M316 VanDerWaalsContact O-N 3.07Å; T313-V337 HydrophobicContact CG2-CG1 4.38Å; T313-V339 HydrophobicContact CG2-CG2 3.63Å; T313-I367 HydrophobicContact CG2-CD1 3.88Å; T313-I610 HydrophobicContact CG2-CD1 3.74Å; T313-I610 WeakPolarHBondContact OG1-CD1 3.48Å; T313-H656 CarbonylContact C-O 3.54Å; T313-H656 WeakPolarHBondContact CB-O 3.01Å; T313-H656 PolarHBondContact OG1-O 3.23Å
314	V	90.9	Very high	89.4	Confident	31 Å²	31	24.4 Å²	24.4	19%	0.188	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-64.2	-23.8	176.7	-42.5	0	0	0	0	112.6	T312 M316 Y654 V682	T312-V314 PolarHBondContact O-N 3.4Å; T312-V314 VanDerWaalsContact O-N 3.15Å; T312-V314 WeakPolarHBondContact OG1-CG2 3.45Å; V314-M316 VanDerWaalsContact C-N 3.26Å; V314-M316 PolarHBondContact O-N 2.79Å; V314-Y654 WeakPolarHBondContact CG1-OH 3.04Å; V314-V682 HydrophobicContact CB-CG2 4.43Å; V314-V682 HydrophobicContact CG2-CG2 3.96Å; V314-V682 VanDerWaalsContact O-CG2 3.29Å; V314-V682 WeakPolarHBondContact O-CG2 3.3Å
315	H	92.2	Very high	89.5	Confident	5 Å²	5	27 Å²	27	2%	0.023	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-75.7	-13.4	177.6	-61.7	134.9	0	0	0	112.7	R284 I308 K310 T312 T313 Y319 F335	R284-H315 PolarHBondContact NH1-O 3.35Å; I308-H315 HydrophobicContact CD1-CB 4.29Å; I308-H315 WeakPolarHBondContact CG2-ND1 3.24Å; K310-H315 PolarHBondContact O-CE1 3.39Å; K310-H315 VanDerWaalsContact O-CE1 3.25Å; T312-H315 PolarHBondContact N-ND1 2.52Å; T312-H315 WeakPolarHBondContact O-CB 3.25Å; T312-H315 PolarHBondContact O-N 3.15Å; T312-H315 VanDerWaalsContact O-N 3.07Å; T313-H315 PolarHBondContact O-N 2.91Å; H315-Y319 WeakPolarHBondContact O-CE2 3.44Å; H315-Y319 PolarHBondContact O-OH 3.44Å; H315-F335 HydrophobicContact CB-CD1 4.09Å; H315-F335 HydrophobicContact CB-CE1 3.83Å; H315-F335 WeakPolarHBondContact O-CD1 3.44Å
316	M	93.2	Very high	89.6	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.164	C	C	.	.			trans	-55.1	148.3	179.1	-70.6	172	170.1	0	0	112.5	R284 T313 V314 F335 V337 I367 L657	R284-M316 PolarHBondContact NH1-O 2.95Å; R284-M316 PolarHBondContact NH2-O 3.43Å; T313-M316 HydrophobicContact CG2-CE 4.07Å; T313-M316 VanDerWaalsContact O-CB 3.25Å; T313-M316 WeakPolarHBondContact O-CB 3.4Å; T313-M316 WeakPolarHBondContact O-CG 3.47Å; T313-M316 PolarHBondContact O-N 2.92Å; T313-M316 VanDerWaalsContact O-N 3.07Å; V314-M316 VanDerWaalsContact C-N 3.26Å; V314-M316 PolarHBondContact O-N 2.79Å; M316-F335 WeakPolarHBondContact CA-O 3.24Å; M316-V337 HydrophobicContact CE-CB 3.64Å; M316-V337 WeakPolarHBondContact CE-O 3.03Å; M316-V337 HydrophobicContact CG-CB 3.76Å; M316-V337 HydrophobicContact CG-CG2 3.68Å; M316-I367 HydrophobicContact CE-CD1 3.62Å; M316-I367 HydrophobicContact CE-CG2 3.91Å; M316-L657 HydrophobicContact SD-CD2 4.42Å
317	G	92.7	Very high	89.6	Confident	3 Å²	3	34.8 Å²	34.8	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	124.3	-161.7	172.6	0	0	0	0	0	113.2	F335	G317-F335 PolarHBondContact N-O 3.17Å; G317-F335 PolarHBondContact O-N 3.27Å
318	N	94.3	Very high	89.7	Confident	77 Å²	77	39.8 Å²	39.8	41%	0.412	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.1	-170.3	-65.1	-17.6	0	0	0	112.1	T332 H333	N318-T332 HydrophobicContact CB-CG2 4.06Å; N318-H333 CarbonylContact C-O 3.47Å; N318-H333 WeakPolarHBondContact CA-O 3.36Å
319	Y	94.7	Very high	89.9	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.2	173.5	-65.5	-99.7	0	0	0	108.9	L268 K283 R284 L289 L306 H315 T332 H333 F335	L268-Y319 HydrophobicContact CD1-CD1 4.41Å; L268-Y319 HydrophobicContact CD1-CD2 3.97Å; L268-Y319 HydrophobicContact CD1-CG 3.85Å; K283-Y319 CarbonylContact O-C 3.55Å; K283-Y319 WeakPolarHBondContact O-CA 3.26Å; R284-Y319 HydrophobicContact CB-CD1 4.27Å; R284-Y319 HydrophobicContact CB-CE1 4.32Å; R284-Y319 HydrophobicContact CG-CE1 4.46Å; R284-Y319 PolarHBondContact NH1-OH 3.17Å; L289-Y319 HydrophobicContact CD1-CD1 3.67Å; L289-Y319 HydrophobicContact CD1-CE1 3.73Å; L306-Y319 HydrophobicContact CD2-CD1 3.63Å; L306-Y319 HydrophobicContact CD2-CE1 3.9Å; L306-Y319 HydrophobicContact CD2-CG 4.4Å; H315-Y319 WeakPolarHBondContact O-CE2 3.44Å; H315-Y319 PolarHBondContact O-OH 3.44Å; Y319-T332 CarbonylContact O-C 3.57Å; Y319-T332 WeakPolarHBondContact O-CA 2.97Å; Y319-H333 PolarHBondContact N-O 3.03Å; Y319-H333 PolarHBondContact O-N 3.18Å; Y319-F335 HydrophobicContact CD2-CB 3.94Å; Y319-F335 HydrophobicContact CE2-CB 3.87Å; Y319-F335 HydrophobicContact CE2-CD1 4.29Å; Y319-F335 HydrophobicContact CE2-CG 4.48Å
320	T	95.8	Very high	90.5	Very high	33 Å²	33	43.9 Å²	43.9	20%	0.202	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.6	179.8	-56.9	0	0	0	0	109.5	W282 K283 H330 Q331 T332	W282-T320 CarbonylContact C-O 3.56Å; W282-T320 WeakPolarHBondContact CA-O 3.34Å; K283-T320 PolarHBondContact N-O 2.98Å; K283-T320 PolarHBondContact O-N 2.81Å; T320-H330 HydrophobicContact CG2-CB 3.78Å; T320-Q331 CarbonylContact C-O 3.54Å; T320-Q331 VanDerWaalsContact CA-O 3.29Å; T320-Q331 WeakPolarHBondContact CA-O 3.01Å; T320-T332 PolarHBondContact OG1-OG1 2.8Å
321	C	95.1	Very high	91.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.2	173.8	73.9	0	0	0	0	111	C270 I280 I281 W282 H330 Q331	C270-C321 WeakPolarHBondContact CA-SG 3.2Å; C270-C321 HydrophobicContact CB-CB 3.78Å; C270-C321 WeakPolarHBondContact CB-SG 3.24Å; C270-C321 WeakPolarHBondContact SG-CB 3.3Å; C270-C321 CovalentContact SG-SG 2.04Å; C270-C321 PolarHBondContact SG-SG 2.91Å; I280-C321 HydrophobicContact CG2-CB 3.8Å; I281-C321 VanDerWaalsContact O-CA 3.26Å; I281-C321 WeakPolarHBondContact O-CA 2.87Å; W282-C321 HydrophobicContact CD2-CB 3.71Å; W282-C321 HydrophobicContact CE3-CB 3.72Å; W282-C321 HydrophobicContact CG-CB 4.41Å; W282-C321 HydrophobicContact CH2-CB 3.73Å; W282-C321 HydrophobicContact CZ2-CB 3.71Å; W282-C321 HydrophobicContact CZ3-CB 3.74Å; C321-H330 CarbonylContact O-C 3.4Å; C321-H330 VanDerWaalsContact O-CA 3.27Å; C321-H330 WeakPolarHBondContact O-CA 3.23Å; C321-H330 WeakPolarHBondContact O-CB 3.36Å; C321-Q331 PolarHBondContact N-O 3.22Å; C321-Q331 PolarHBondContact O-N 2.91Å
322	Y	92.9	Very high	91.5	Very high	15 Å²	15	39.5 Å²	39.5	6%	0.059	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	162.8	174.7	57.6	-85.9	0	0	0	109.7	I280 I281 K283 E327	I280-Y322 CarbonylContact C-O 3.31Å; I280-Y322 WeakPolarHBondContact CA-O 3.22Å; I281-Y322 HydrophobicContact CB-CD2 4.18Å; I281-Y322 HydrophobicContact CB-CE1 4.14Å; I281-Y322 HydrophobicContact CB-CE2 3.78Å; I281-Y322 HydrophobicContact CG1-CE2 4.12Å; I281-Y322 HydrophobicContact CG2-CE1 4Å; I281-Y322 HydrophobicContact CG2-CE2 4.08Å; I281-Y322 PolarHBondContact N-O 3.03Å; I281-Y322 PolarHBondContact O-N 3Å; K283-Y322 HydrophobicContact CB-CE1 4.33Å; Y322-E327 HydrophobicContact CD2-CB 4.32Å; Y322-E327 HydrophobicContact CD2-CG 3.92Å; Y322-E327 HydrophobicContact CE2-CB 4.39Å; Y322-E327 HydrophobicContact CE2-CG 3.6Å; Y322-E327 PolarHBondContact OH-OE1 3.06Å
323	A	89.3	Confident	91.7	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	139.3	172.9	0	0	0	0	0	110.1	L247 V272 R277 P278 I280 G325 Y326	L247-A323 HydrophobicContact CD1-CB 3.59Å; V272-A323 HydrophobicContact CG1-CB 4.48Å; R277-A323 HydrophobicContact CG-CB 4.19Å; P278-A323 HydrophobicContact CB-CB 4.2Å; P278-A323 HydrophobicContact CG-CB 4.31Å; I280-A323 HydrophobicContact CD1-CB 4.23Å; A323-G325 PolarHBondContact O-N 2.88Å; A323-Y326 WeakPolarHBondContact O-CA 3.43Å; A323-Y326 WeakPolarHBondContact O-CB 3.45Å; A323-Y326 PolarHBondContact O-N 2.87Å
324	D	82.9	Confident	91.8	Very high	92 Å²	92	39.1 Å²	39.1	49%	0.492	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	124.5	-178.2	-171.8	20.2	0	0	0	112.5	P278 P279 I281 Y326	P278-D324 HydrophobicContact CB-CB 4.12Å; P278-D324 WeakPolarHBondContact CB-O 3.1Å; P279-D324 PolarHBondContact O-N 2.59Å; I281-D324 HydrophobicContact CD1-CB 4.16Å; I281-D324 HydrophobicContact CG1-CB 3.87Å; D324-Y326 VanDerWaalsContact O-CD2 3.27Å; D324-Y326 WeakPolarHBondContact O-CD2 3.5Å
325	G	79.5	Confident	92	Very high	62 Å²	62	37.7 Å²	37.7	64%	0.639	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.8	-3.6	-172.9	0	0	0	0	0	116.3	A323	A323-G325 PolarHBondContact O-N 2.88Å
326	Y	87.3	Confident	92.2	Very high	50 Å²	50	39 Å²	39	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	55	-174.9	-63.2	-101.6	0	0	0	112	I173 I245 L247 P278 A323 D324 D328 V329	I173-Y326 HydrophobicContact CD1-CD1 4.16Å; I173-Y326 HydrophobicContact CD1-CE1 3.22Å; I173-Y326 WeakPolarHBondContact CD1-OH 3.24Å; I245-Y326 HydrophobicContact CB-CE1 4.23Å; I245-Y326 HydrophobicContact CB-CE2 4.48Å; I245-Y326 WeakPolarHBondContact CB-OH 3.47Å; I245-Y326 HydrophobicContact CD1-CE2 4Å; I245-Y326 WeakPolarHBondContact CD1-OH 3.33Å; I245-Y326 HydrophobicContact CG2-CE1 4.2Å; I245-Y326 HydrophobicContact CG2-CE2 4.25Å; L247-Y326 VanDerWaalsContact CD1-CB 3.48Å; L247-Y326 HydrophobicContact CD1-CD1 3.61Å; L247-Y326 HydrophobicContact CD1-CD2 3.93Å; L247-Y326 HydrophobicContact CD1-CE1 4.33Å; L247-Y326 HydrophobicContact CD1-CG 3.39Å; L247-Y326 HydrophobicContact CG-CD1 4.27Å; L247-Y326 HydrophobicContact CG-CG 4.46Å; P278-Y326 HydrophobicContact CG-CD2 3.92Å; P278-Y326 HydrophobicContact CG-CE2 3.74Å; A323-Y326 WeakPolarHBondContact O-CA 3.43Å; A323-Y326 WeakPolarHBondContact O-CB 3.45Å; A323-Y326 PolarHBondContact O-N 2.87Å; D324-Y326 VanDerWaalsContact O-CD2 3.27Å; D324-Y326 WeakPolarHBondContact O-CD2 3.5Å; Y326-D328 PolarHBondContact O-N 3.4Å; Y326-V329 PolarHBondContact O-N 2.74Å
327	E	88.7	Confident	92.3	Very high	115 Å²	115	39 Å²	39	54%	0.537	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	-26.2	-174.3	-49.7	-162.5	160.5	0	0	113.7	Y322 V329 H330	Y322-E327 HydrophobicContact CD2-CB 4.32Å; Y322-E327 HydrophobicContact CD2-CG 3.92Å; Y322-E327 HydrophobicContact CE2-CB 4.39Å; Y322-E327 HydrophobicContact CE2-CG 3.6Å; Y322-E327 PolarHBondContact OH-OE1 3.06Å; E327-V329 PolarHBondContact O-N 3.13Å; E327-H330 PolarHBondContact O-ND1 3.35Å
328	D	87.7	Confident	92.4	Very high	149 Å²	149	39.7 Å²	39.7	80%	0.797	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	-25	179.8	-68	-31.8	0	0	0	112.8	Y326	Y326-D328 PolarHBondContact O-N 3.4Å
329	V	91	Very high	92.6	Very high	46 Å²	46	36.3 Å²	36.3	28%	0.279	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	84	175.9	-172.6	0	0	0	0	108.9	L249 V272 Y326 E327	L249-V329 HydrophobicContact CB-CG1 3.73Å; L249-V329 HydrophobicContact CD2-CG1 4.46Å; V272-V329 HydrophobicContact CG1-CG1 4.42Å; V272-V329 HydrophobicContact CG2-CG1 4.45Å; Y326-V329 PolarHBondContact O-N 2.74Å; E327-V329 PolarHBondContact O-N 3.13Å
330	H	95.9	Very high	92.7	Very high	76 Å²	76	38.5 Å²	38.5	35%	0.352	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	148.9	-176.4	63.2	-93.2	0	0	0	113	L249 T320 C321 E327	L249-H330 WeakPolarHBondContact CD2-O 3.42Å; T320-H330 HydrophobicContact CG2-CB 3.78Å; C321-H330 CarbonylContact O-C 3.4Å; C321-H330 VanDerWaalsContact O-CA 3.27Å; C321-H330 WeakPolarHBondContact O-CA 3.23Å; C321-H330 WeakPolarHBondContact O-CB 3.36Å; E327-H330 PolarHBondContact O-ND1 3.35Å
331	Q	96.9	Very high	92.8	Very high	7 Å²	7	37.2 Å²	37.2	3%	0.033	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.4	170.2	168.7	-178.6	54.3	0	0	109.7	L249 Q253 R254 S269 T320 C321 H333	L249-Q331 HydrophobicContact CD1-CB 4.23Å; L249-Q331 HydrophobicContact CD2-CB 3.97Å; Q253-Q331 VanDerWaalsContact O-CG 3.26Å; Q253-Q331 WeakPolarHBondContact O-CG 3.31Å; Q253-Q331 PolarHBondContact O-NE2 3.46Å; R254-Q331 CarbonylContact O-C 3.46Å; R254-Q331 WeakPolarHBondContact O-CA 3.29Å; S269-Q331 PolarHBondContact O-OE1 3.41Å; T320-Q331 CarbonylContact C-O 3.54Å; T320-Q331 VanDerWaalsContact CA-O 3.29Å; T320-Q331 WeakPolarHBondContact CA-O 3.01Å; C321-Q331 PolarHBondContact N-O 3.22Å; C321-Q331 PolarHBondContact O-N 2.91Å; Q331-H333 VanDerWaalsContact CD-NE2 3.31Å; Q331-H333 PolarHBondContact OE1-NE2 3.07Å
332	T	96.9	Very high	92.9	Very high	27 Å²	27	38.9 Å²	38.9	17%	0.166	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	124	172.5	-61.4	0	0	0	0	111	R254 V255 S256 N318 Y319 T320	R254-T332 PolarHBondContact O-N 2.83Å; V255-T332 CarbonylContact C-O 3.51Å; V255-T332 VanDerWaalsContact CA-O 3.3Å; V255-T332 WeakPolarHBondContact CA-O 3.45Å; S256-T332 PolarHBondContact N-O 2.92Å; N318-T332 HydrophobicContact CB-CG2 4.06Å; Y319-T332 CarbonylContact O-C 3.57Å; Y319-T332 WeakPolarHBondContact O-CA 2.97Å; T320-T332 PolarHBondContact OG1-OG1 2.8Å
333	H	95.9	Very high	93	Very high	7 Å²	7	38.2 Å²	38.2	3%	0.032	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.8	170.7	-75	-106	0	0	0	109.5	S256 L268 S269 W282 N318 Y319 Q331 F335	S256-H333 CarbonylContact O-C 3.57Å; S256-H333 WeakPolarHBondContact O-CA 3.46Å; S256-H333 PolarHBondContact OG-CE1 2.88Å; S256-H333 PolarHBondContact OG-ND1 2.99Å; L268-H333 HydrophobicContact CD1-CB 4.15Å; S269-H333 PolarHBondContact O-CE1 2.84Å; S269-H333 VanDerWaalsContact O-CE1 3.23Å; S269-H333 PolarHBondContact O-NE2 3.06Å; S269-H333 VanDerWaalsContact O-NE2 3.09Å; W282-H333 AromaticContact CH2-CD2 3.61Å; W282-H333 AromaticContact CH2-NE2 3.77Å; W282-H333 AromaticContact CZ3-CD2 3.74Å; N318-H333 CarbonylContact C-O 3.47Å; N318-H333 WeakPolarHBondContact CA-O 3.36Å; Y319-H333 PolarHBondContact N-O 3.03Å; Y319-H333 PolarHBondContact O-N 3.18Å; Q331-H333 VanDerWaalsContact CD-NE2 3.31Å; Q331-H333 PolarHBondContact OE1-NE2 3.07Å; H333-F335 PolarHBondContact O-N 3.29Å
334	I	95	Very high	93.2	Very high	26 Å²	26	43.4 Å²	43.4	13%	0.133	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	101.2	167.6	-55.6	176	0	0	0	106.5	V255 S256 I257 T258 Q336	V255-I334 HydrophobicContact CG1-CD1 3.8Å; V255-I334 HydrophobicContact CG1-CG1 4.16Å; S256-I334 PolarHBondContact O-N 2.87Å; I257-I334 WeakPolarHBondContact CA-O 3.5Å; I257-I334 HydrophobicContact CG1-CB 4.29Å; I257-I334 HydrophobicContact CG1-CD1 4.33Å; T258-I334 PolarHBondContact N-O 3.12Å; I334-Q336 HydrophobicContact CG2-CG 4.43Å
335	F	95	Very high	93.8	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118.2	-178.7	-171.1	-126.5	0	0	0	111	T258 A260 A266 L268 I308 V311 H315 M316 G317 Y319 H333 V337	T258-F335 HydrophobicContact CG2-CD2 4.05Å; T258-F335 HydrophobicContact CG2-CE2 4.16Å; T258-F335 WeakPolarHBondContact O-CA 3.45Å; T258-F335 WeakPolarHBondContact O-CD2 3.29Å; A260-F335 HydrophobicContact CB-CE2 3.88Å; A260-F335 HydrophobicContact CB-CZ 3.88Å; A266-F335 HydrophobicContact CB-CE2 3.72Å; A266-F335 HydrophobicContact CB-CZ 3.61Å; L268-F335 HydrophobicContact CD2-CD2 3.89Å; L268-F335 HydrophobicContact CD2-CE2 4.35Å; L268-F335 HydrophobicContact CD2-CG 4.48Å; I308-F335 HydrophobicContact CD1-CD1 3.99Å; I308-F335 HydrophobicContact CD1-CE1 3.58Å; I308-F335 HydrophobicContact CD1-CZ 4.05Å; V311-F335 HydrophobicContact CG1-CE1 4Å; V311-F335 HydrophobicContact CG1-CZ 3.85Å; V311-F335 HydrophobicContact CG2-CE1 4.33Å; V311-F335 HydrophobicContact CG2-CZ 3.79Å; H315-F335 HydrophobicContact CB-CD1 4.09Å; H315-F335 HydrophobicContact CB-CE1 3.83Å; H315-F335 WeakPolarHBondContact O-CD1 3.44Å; M316-F335 WeakPolarHBondContact CA-O 3.24Å; G317-F335 PolarHBondContact N-O 3.17Å; G317-F335 PolarHBondContact O-N 3.27Å; Y319-F335 HydrophobicContact CD2-CB 3.94Å; Y319-F335 HydrophobicContact CE2-CB 3.87Å; Y319-F335 HydrophobicContact CE2-CD1 4.29Å; Y319-F335 HydrophobicContact CE2-CG 4.48Å; H333-F335 PolarHBondContact O-N 3.29Å; F335-V337 HydrophobicContact CD1-CG2 4.15Å; F335-V337 HydrophobicContact CE1-CG2 3.7Å; F335-V337 HydrophobicContact CZ-CG2 4.15Å
336	Q	94.8	Very high	94.4	Very high	33 Å²	33	39.2 Å²	39.2	15%	0.154	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.7	179.7	-66.2	178.7	-14.9	0	0	109.8	I257 T258 A259 A260 I334	I257-Q336 HydrophobicContact CG2-CG 4.41Å; T258-Q336 PolarHBondContact O-N 3.11Å; A259-Q336 WeakPolarHBondContact CA-O 3.25Å; A259-Q336 HydrophobicContact CB-CB 4.3Å; A260-Q336 PolarHBondContact N-O 2.76Å; I334-Q336 HydrophobicContact CG2-CG 4.43Å
337	V	95.4	Very high	94.5	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	113.9	179.5	179.6	0	0	0	0	109.4	A260 V262 V311 T313 M316 F335 I367	A260-V337 CarbonylContact O-C 3.5Å; A260-V337 VanDerWaalsContact O-CA 3.32Å; A260-V337 WeakPolarHBondContact O-CA 3.48Å; V262-V337 HydrophobicContact CB-CG1 4.36Å; V311-V337 HydrophobicContact CG1-CB 4.14Å; V311-V337 HydrophobicContact CG1-CG1 3.6Å; V311-V337 HydrophobicContact CG1-CG2 3.47Å; V311-V337 VanDerWaalsContact CG1-CG2 3.47Å; T313-V337 HydrophobicContact CG2-CG1 4.38Å; M316-V337 HydrophobicContact CE-CB 3.64Å; M316-V337 WeakPolarHBondContact CE-O 3.03Å; M316-V337 HydrophobicContact CG-CB 3.76Å; M316-V337 HydrophobicContact CG-CG2 3.68Å; F335-V337 HydrophobicContact CD1-CG2 4.15Å; F335-V337 HydrophobicContact CE1-CG2 3.7Å; F335-V337 HydrophobicContact CZ-CG2 4.15Å; V337-I367 WeakPolarHBondContact O-CG2 3.24Å
338	N	96.7	Very high	94.6	Very high	17 Å²	17	39.2 Å²	39.2	9%	0.091	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.5	177.1	-61.3	-12.2	0	0	0	109.3	A260 T261 V262 I367 E418 A419	A260-N338 PolarHBondContact O-N 3.47Å; T261-N338 CarbonylContact C-O 3.58Å; T261-N338 VanDerWaalsContact CA-O 3.29Å; T261-N338 WeakPolarHBondContact CA-O 3.42Å; V262-N338 PolarHBondContact N-O 3.3Å; N338-I367 CarbonylContact C-O 3.54Å; N338-I367 WeakPolarHBondContact CA-O 3.21Å; N338-E418 VanDerWaalsContact CG-OE1 3.29Å; N338-E418 VanDerWaalsContact ND2-CD 3.26Å; N338-E418 PolarHBondContact ND2-OE1 3.41Å; N338-E418 PolarHBondContact OD1-OE1 3.42Å; N338-A419 HydrophobicContact CB-CB 3.9Å
339	V	96.9	Very high	94.6	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.03	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.9	-179.4	-176.1	0	0	0	0	107.6	V262 T313 I367 N417 I609	V262-V339 HydrophobicContact CB-CG2 4.3Å; V262-V339 HydrophobicContact CG1-CG1 4.18Å; V262-V339 HydrophobicContact CG1-CG2 4.41Å; T313-V339 HydrophobicContact CG2-CG2 3.63Å; V339-I367 HydrophobicContact CB-CB 3.98Å; V339-I367 HydrophobicContact CB-CD1 4.47Å; V339-I367 HydrophobicContact CB-CG1 4.07Å; V339-I367 HydrophobicContact CG2-CB 4Å; V339-I367 HydrophobicContact CG2-CD1 3.83Å; V339-I367 HydrophobicContact CG2-CG1 3.96Å; V339-I367 PolarHBondContact N-O 3.43Å; V339-I367 PolarHBondContact O-N 3.16Å; V339-N417 PolarHBondContact O-ND2 2.91Å; V339-I609 HydrophobicContact CG1-CB 3.83Å; V339-I609 HydrophobicContact CG1-CD1 4.41Å; V339-I609 HydrophobicContact CG1-CG2 3.87Å
340	P	97.4	Very high	94.4	Very high	46 Å²	46	34 Å²	34	30%	0.299	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	153.5	177.8	28.2	-35.1	0	0	0	110.2	A419	P340-A419 HydrophobicContact CB-CB 4.26Å
341	P	97.9	Very high	94	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.039	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	143.7	-177.4	-19	33.9	0	0	0	111.1	E365 P370 A415 N417 G420 D422	P341-E365 CarbonylContact C-O 3.54Å; P341-E365 VanDerWaalsContact CA-O 3.28Å; P341-E365 WeakPolarHBondContact CA-O 3.47Å; P341-P370 HydrophobicContact CB-CB 3.93Å; P341-P370 HydrophobicContact CB-CG 4.22Å; P341-P370 HydrophobicContact CG-CB 3.87Å; P341-A415 HydrophobicContact CB-CB 3.67Å; P341-A415 HydrophobicContact CG-CB 4.37Å; P341-N417 WeakPolarHBondContact CD-OD1 3.39Å; P341-N417 HydrophobicContact CG-CB 4.4Å; P341-G420 WeakPolarHBondContact CD-O 3.48Å; P341-D422 HydrophobicContact CB-CB 4.25Å; P341-D422 VanDerWaalsContact O-CB 3.28Å; P341-D422 WeakPolarHBondContact O-CB 3.29Å
342	V	96.8	Very high	93.5	Very high	35 Å²	35	36.8 Å²	36.8	21%	0.212	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	119.7	166.7	178.5	0	0	0	0	107.2	A364 E365 L608 I609	V342-A364 WeakPolarHBondContact O-CA 3.33Å; V342-E365 PolarHBondContact N-O 3.44Å; V342-E365 PolarHBondContact O-N 2.58Å; V342-E365 VanDerWaalsContact O-N 3.08Å; V342-L608 HydrophobicContact CG1-CB 4.33Å; V342-I609 HydrophobicContact CB-CG2 4.22Å; V342-I609 HydrophobicContact CG2-CG2 3.98Å
343	I	95.1	Very high	93.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	147.9	-172.7	-159.4	174.2	0	0	0	111.7	C362 H363 A364 C413 A415 D422 D424	I343-C362 VanDerWaalsContact CD1-SG 3.52Å; I343-C362 VanDerWaalsContact CG1-SG 3.59Å; I343-H363 WeakPolarHBondContact CA-O 3.43Å; I343-A364 HydrophobicContact CB-CB 4.42Å; I343-A364 HydrophobicContact CG1-CB 4.13Å; I343-C413 HydrophobicContact CD1-CB 3.73Å; I343-C413 WeakPolarHBondContact CD1-O 3.42Å; I343-A415 HydrophobicContact CB-CB 4.45Å; I343-A415 HydrophobicContact CD1-CB 3.92Å; I343-A415 HydrophobicContact CG1-CB 4.37Å; I343-D422 HydrophobicContact CB-CB 4.5Å; I343-D422 HydrophobicContact CG2-CB 4.2Å; I343-D422 WeakPolarHBondContact CG2-OD2 3.48Å; I343-D422 PolarHBondContact N-OD2 2.96Å; I343-D424 HydrophobicContact CG2-CB 3.45Å; I343-D424 VanDerWaalsContact CG2-CB 3.45Å
344	R	94.7	Very high	93	Very high	108 Å²	108	40.2 Å²	40.2	41%	0.408	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.2	166.1	-66.5	-68.2	177.9	-100.3	2.7	109	C362 H363 L608 L805 F806	R344-C362 WeakPolarHBondContact O-CA 3.47Å; R344-H363 PolarHBondContact N-O 3.5Å; R344-H363 PolarHBondContact O-N 2.87Å; R344-L608 HydrophobicContact CG-CD2 4.1Å; R344-L805 HydrophobicContact CB-CD2 4.37Å; R344-F806 HydrophobicContact CB-CE2 3.67Å; R344-F806 HydrophobicContact CB-CZ 3.77Å; R344-F806 VanDerWaalsContact O-CZ 3.3Å; R344-F806 WeakPolarHBondContact O-CZ 3.2Å
345	V	94.4	Very high	92.9	Very high	8 Å²	8	41.3 Å²	41.3	5%	0.048	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	149.3	171.1	-59.5	0	0	0	0	111.5	R361 C362 C413 D424	V345-R361 CarbonylContact C-O 3.54Å; V345-R361 VanDerWaalsContact CA-O 3.25Å; V345-R361 WeakPolarHBondContact CA-O 3.4Å; V345-C362 HydrophobicContact CG1-CB 4.32Å; V345-C413 HydrophobicContact CG1-CB 3.9Å; V345-D424 HydrophobicContact CG1-CB 3.99Å; V345-D424 HydrophobicContact CG2-CB 4.38Å; V345-D424 WeakPolarHBondContact CG2-OD2 3.49Å; V345-D424 PolarHBondContact N-OD2 3.4Å
346	Y	91.9	Very high	92.7	Very high	59 Å²	59	44 Å²	44	23%	0.231	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	137.3	174.1	-178.9	-86.5	0	0	0	112.2	R361 N452 F806	Y346-R361 PolarHBondContact N-O 3.11Å; Y346-R361 PolarHBondContact O-N 3.35Å; Y346-N452 PolarHBondContact OH-ND2 3.33Å; Y346-F806 VanDerWaalsContact CB-CD2 3.41Å; Y346-F806 HydrophobicContact CD1-CB 3.98Å; Y346-F806 HydrophobicContact CD1-CG 4.45Å; Y346-F806 HydrophobicContact CG-CB 3.83Å; Y346-F806 HydrophobicContact CG-CD2 4.15Å; Y346-F806 AromaticContact CG-CG 3.97Å; Y346-F806 HydrophobicContact CG-CG 3.97Å
347	P	90.4	Very high	92.6	Very high	23 Å²	23	45.6 Å²	45.6	15%	0.149	25%	0.253	C	S	.	.			cis	-71.8	154.7	-9.5	31.3	-35	0	0	0	111.1	S349 Q350 S426	P347-S349 VanDerWaalsContact C-N 3.25Å; P347-S349 PolarHBondContact O-N 2.82Å; P347-Q350 HydrophobicContact CG-CB 3.84Å; P347-Q350 HydrophobicContact CG-CG 4.04Å; P347-Q350 VanDerWaalsContact CG-NE2 3.28Å; P347-S426 WeakPolarHBondContact O-CB 3.21Å; P347-S426 PolarHBondContact O-OG 2.73Å
348	E	89.1	Confident	92.5	Very high	142 Å²	142	45.6 Å²	45.6	66%	0.664	25%	0.253	S	S	*	.	S	Bend	trans	-61.9	-36.6	173.6	-64.8	-175.1	170.8	0	0	111.8	S426 S427	E348-S426 CarbonylContact O-C 3.59Å; E348-S426 WeakPolarHBondContact O-CA 3.43Å; E348-S427 PolarHBondContact O-N 3.12Å
349	S	87.9	Confident	92.3	Very high	70 Å²	70	46 Å²	46	49%	0.49	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	142.3	176.6	-177.5	0	0	0	0	110.7	P347 S427 F429	P347-S349 VanDerWaalsContact C-N 3.25Å; P347-S349 PolarHBondContact O-N 2.82Å; S349-S427 CarbonylContact C-O 3.55Å; S349-S427 VanDerWaalsContact CA-O 3.3Å; S349-S427 WeakPolarHBondContact CA-O 3.3Å; S349-F429 WeakPolarHBondContact OG-CE2 3.42Å
350	Q	87.3	Confident	92.2	Very high	16 Å²	16	45.8 Å²	45.8	8%	0.075	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	146.7	173	66.4	-178.4	-63.8	0	0	112.6	P347 R352 S359 S427 L428 F429	P347-Q350 HydrophobicContact CG-CB 3.84Å; P347-Q350 HydrophobicContact CG-CG 4.04Å; P347-Q350 VanDerWaalsContact CG-NE2 3.28Å; Q350-R352 HydrophobicContact CG-CG 4.47Å; Q350-S359 PolarHBondContact NE2-O 2.81Å; Q350-S427 PolarHBondContact N-O 2.81Å; Q350-L428 HydrophobicContact CG-CD1 3.68Å; Q350-F429 PolarHBondContact O-N 2.88Å
351	A	86.9	Confident	92.1	Very high	44 Å²	44	45.4 Å²	45.4	36%	0.364	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121	171.9	0	0	0	0	0	110.9	F429 K436	A351-F429 CarbonylContact C-O 3.53Å; A351-F429 VanDerWaalsContact CA-O 3.31Å; A351-F429 WeakPolarHBondContact CA-O 3.28Å; A351-F429 HydrophobicContact CB-CB 4.39Å; A351-K436 WeakPolarHBondContact O-CE 3.2Å; A351-K436 PolarHBondContact O-NZ 3.45Å; A351-K436 VanDerWaalsContact O-NZ 3.15Å
352	R	87.7	Confident	92	Very high	97 Å²	97	45.4 Å²	45.4	37%	0.366	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	150.6	-178.9	-65.9	-67.2	177.7	-177.2	-4.2	110.8	Q350 A358 V403 L428 F429 V430 E431	Q350-R352 HydrophobicContact CG-CG 4.47Å; R352-A358 HydrophobicContact CG-CB 4.14Å; R352-V403 HydrophobicContact CB-CG1 4.3Å; R352-L428 HydrophobicContact CB-CD1 4.22Å; R352-L428 HydrophobicContact CG-CD1 3.97Å; R352-F429 PolarHBondContact N-O 3.25Å; R352-V430 VanDerWaalsContact O-CA 3.29Å; R352-V430 WeakPolarHBondContact O-CA 3.46Å; R352-E431 PolarHBondContact O-N 2.82Å
353	E	89.1	Confident	91.9	Very high	58 Å²	58	44.8 Å²	44.8	27%	0.271	24%	0.243	S	C	.	.			trans	-83.5	150	173.3	-77.1	170.8	172	0	0	109.3	G355 V356 S433 K436	E353-G355 PolarHBondContact O-N 2.95Å; E353-V356 HydrophobicContact CB-CG2 3.98Å; E353-V356 PolarHBondContact O-N 3.16Å; E353-S433 VanDerWaalsContact CD-OG 3.29Å; E353-S433 WeakPolarHBondContact OE1-CA 3.37Å; E353-S433 WeakPolarHBondContact OE1-CB 3.35Å; E353-S433 PolarHBondContact OE1-OG 3.07Å; E353-K436 HydrophobicContact CG-CD 3.96Å
354	P	92.4	Very high	91.9	Very high	48 Å²	48	44.7 Å²	44.7	31%	0.312	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	137.5	168.7	-22.1	31.3	0	0	0	110.8	V403 Y405 V430	P354-V403 CarbonylContact C-O 3.55Å; P354-V403 VanDerWaalsContact CA-O 3.27Å; P354-V403 WeakPolarHBondContact CA-O 3.49Å; P354-Y405 HydrophobicContact CG-CD2 4.48Å; P354-Y405 HydrophobicContact CG-CE1 4.22Å; P354-Y405 HydrophobicContact CG-CE2 3.82Å; P354-V430 HydrophobicContact CB-CG1 4.47Å; P354-V430 HydrophobicContact CG-CG1 3.88Å
355	G	92.3	Very high	91.9	Very high	48 Å²	48	40.1 Å²	40.1	50%	0.495	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.8	-21.2	-178.3	0	0	0	0	0	115.3	E353 N402 V403	E353-G355 PolarHBondContact O-N 2.95Å; G355-N402 WeakPolarHBondContact CA-OD1 3.14Å; G355-N402 PolarHBondContact N-OD1 2.85Å; G355-V403 PolarHBondContact N-O 3.33Å
356	V	91.4	Very high	92	Very high	57 Å²	57	39.9 Å²	39.9	35%	0.345	23%	0.226	S	C	.	.	S	Bend	trans	-89.7	155.4	-176	-176.4	0	0	0	0	110.7	E353 V403	E353-V356 HydrophobicContact CB-CG2 3.98Å; E353-V356 PolarHBondContact O-N 3.16Å; V356-V403 WeakPolarHBondContact O-CB 3.39Å; V356-V403 WeakPolarHBondContact O-CG2 3.4Å; V356-V403 PolarHBondContact O-N 2.83Å
357	T	93.1	Very high	92.2	Very high	67 Å²	67	37.3 Å²	37.3	41%	0.411	22%	0.216	S	C	.	.			trans	-73.1	140.2	172.8	-53.3	0	0	0	0	112	H399 I400 S401	T357-H399 WeakPolarHBondContact CG2-CE1 3.35Å; T357-I400 CarbonylContact C-O 3.49Å; T357-I400 WeakPolarHBondContact CA-O 3.34Å; T357-I400 WeakPolarHBondContact CG2-O 3.32Å; T357-S401 PolarHBondContact OG1-O 2.76Å
358	A	92.9	Very high	92.4	Very high	1 Å²	1	38 Å²	38	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	148.6	165.1	0	0	0	0	0	111	R352 I400 V403 L428	R352-A358 HydrophobicContact CG-CB 4.14Å; A358-I400 HydrophobicContact CB-CB 4.38Å; A358-I400 PolarHBondContact N-O 2.81Å; A358-I400 PolarHBondContact O-N 3.15Å; A358-V403 HydrophobicContact CB-CG2 3.49Å; A358-V403 VanDerWaalsContact CB-CG2 3.49Å; A358-L428 HydrophobicContact CB-CD1 4.04Å; A358-L428 HydrophobicContact CB-CD2 4.24Å
359	S	93.3	Very high	92.7	Very high	26 Å²	26	34.4 Å²	34.4	18%	0.182	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.8	171.4	167.4	0	0	0	0	109.1	Q350 E397 V398	Q350-S359 PolarHBondContact NE2-O 2.81Å; S359-E397 WeakPolarHBondContact CB-OE1 3.33Å; S359-E397 WeakPolarHBondContact OG-CG 3.3Å; S359-E397 PolarHBondContact OG-OE1 2.81Å; S359-V398 WeakPolarHBondContact CA-O 3.34Å
360	L	95	Very high	93.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122.7	176	-47.2	161	0	0	0	106.1	W374 E397 V398 Y411 S426	L360-W374 HydrophobicContact CB-CH2 4.23Å; L360-E397 CarbonylContact O-C 3.56Å; L360-E397 WeakPolarHBondContact O-CA 2.99Å; L360-V398 HydrophobicContact CB-CB 4.23Å; L360-V398 HydrophobicContact CD1-CB 4.2Å; L360-V398 HydrophobicContact CD1-CG1 4.24Å; L360-V398 PolarHBondContact N-O 3.24Å; L360-V398 PolarHBondContact O-N 3.47Å; L360-Y411 HydrophobicContact CD1-CD1 3.69Å; L360-Y411 HydrophobicContact CD1-CD2 3.56Å; L360-Y411 HydrophobicContact CD1-CE1 4.22Å; L360-Y411 HydrophobicContact CD1-CE2 4.12Å; L360-Y411 HydrophobicContact CD1-CG 3.33Å; L360-S426 WeakPolarHBondContact CD2-OG 3.08Å
361	R	94	Very high	93.5	Very high	39 Å²	39	38.1 Å²	38.1	15%	0.147	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.8	-176.1	-65.8	179.1	-69.6	166.1	-0.6	109.9	V345 Y346 S396 E397 F806	V345-R361 CarbonylContact C-O 3.54Å; V345-R361 VanDerWaalsContact CA-O 3.25Å; V345-R361 WeakPolarHBondContact CA-O 3.4Å; Y346-R361 PolarHBondContact N-O 3.11Å; Y346-R361 PolarHBondContact O-N 3.35Å; R361-S396 CarbonylContact C-O 3.46Å; R361-S396 WeakPolarHBondContact CA-O 3.17Å; R361-E397 HydrophobicContact CG-CB 4.21Å; R361-E397 HydrophobicContact CG-CG 3.92Å; R361-F806 HydrophobicContact CB-CD1 3.91Å; R361-F806 HydrophobicContact CB-CE1 4.09Å; R361-F806 PolarHBondContact NH1-O 2.81Å; R361-F806 PolarHBondContact NH2-O 3.47Å
362	C	95.3	Very high	94	Very high	5 Å²	5	38 Å²	38	3%	0.034	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	126.9	-179	175.4	0	0	0	0	108.3	I343 R344 V345 W374 S396 C413	I343-C362 VanDerWaalsContact CD1-SG 3.52Å; I343-C362 VanDerWaalsContact CG1-SG 3.59Å; R344-C362 WeakPolarHBondContact O-CA 3.47Å; V345-C362 HydrophobicContact CG1-CB 4.32Å; C362-W374 HydrophobicContact CB-CH2 3.7Å; C362-W374 HydrophobicContact CB-CZ2 3.31Å; C362-S396 PolarHBondContact N-O 3.14Å; C362-S396 WeakPolarHBondContact O-CB 3.46Å; C362-C413 HydrophobicContact CB-CB 3.63Å; C362-C413 WeakPolarHBondContact CB-SG 3.33Å; C362-C413 WeakPolarHBondContact SG-CB 3.29Å; C362-C413 CovalentContact SG-SG 2.04Å; C362-C413 PolarHBondContact SG-SG 3.1Å
363	H	94.6	Very high	94.4	Very high	22 Å²	22	34.7 Å²	34.7	10%	0.102	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.6	173.1	-175.6	94.8	0	0	0	107.8	I343 R344 E365 L608 L805 F806	I343-H363 WeakPolarHBondContact CA-O 3.43Å; R344-H363 PolarHBondContact N-O 3.5Å; R344-H363 PolarHBondContact O-N 2.87Å; H363-E365 IonicContact CD2-OE1 3.63Å; H363-E365 IonicContact CE1-OE1 3.7Å; H363-E365 WeakPolarHBondContact NE2-CG 3.35Å; H363-E365 IonicContact NE2-OE1 3.61Å; H363-E365 PolarHBondContact NE2-OE1 3.27Å; H363-L608 WeakPolarHBondContact CD2-CD1 2.99Å; H363-L805 HydrophobicContact CB-CD2 3.96Å; H363-L805 HydrophobicContact CB-CG 4.21Å; H363-F806 HydrophobicContact CB-CE1 3.68Å; H363-F806 HydrophobicContact CB-CZ 3.62Å
364	A	95.4	Very high	94.8	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.5	178.7	0	0	0	0	0	109.7	V342 I343 P370 L372 A415 H752	V342-A364 WeakPolarHBondContact O-CA 3.33Å; I343-A364 HydrophobicContact CB-CB 4.42Å; I343-A364 HydrophobicContact CG1-CB 4.13Å; A364-P370 HydrophobicContact CB-CG 3.7Å; A364-L372 HydrophobicContact CB-CD2 3.78Å; A364-A415 HydrophobicContact CB-CB 3.59Å; A364-H752 PolarHBondContact O-CE1 3.1Å; A364-H752 PolarHBondContact O-ND1 3.25Å
365	E	95.5	Very high	95	Very high	12 Å²	12	31.8 Å²	31.8	6%	0.056	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	145.1	172.2	-75.5	173.1	-157.1	0	0	109.2	P341 V342 H363 L608 I609	P341-E365 CarbonylContact C-O 3.54Å; P341-E365 VanDerWaalsContact CA-O 3.28Å; P341-E365 WeakPolarHBondContact CA-O 3.47Å; V342-E365 PolarHBondContact N-O 3.44Å; V342-E365 PolarHBondContact O-N 2.58Å; V342-E365 VanDerWaalsContact O-N 3.08Å; H363-E365 IonicContact CD2-OE1 3.63Å; H363-E365 IonicContact CE1-OE1 3.7Å; H363-E365 WeakPolarHBondContact NE2-CG 3.35Å; H363-E365 IonicContact NE2-OE1 3.61Å; H363-E365 PolarHBondContact NE2-OE1 3.27Å; E365-L608 HydrophobicContact CB-CB 4.2Å; E365-L608 HydrophobicContact CB-CD1 4.44Å; E365-L608 HydrophobicContact CG-CB 4.44Å; E365-L608 HydrophobicContact CG-CD1 4.12Å; E365-L608 WeakPolarHBondContact OE2-CB 3.23Å; E365-L608 PolarHBondContact OE2-N 2.96Å; E365-I609 HydrophobicContact CB-CG1 4.34Å; E365-I609 HydrophobicContact CB-CG2 3.76Å; E365-I609 WeakPolarHBondContact O-CG2 3.06Å
366	G	96.4	Very high	95.3	Very high	3 Å²	3	31.1 Å²	31.1	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.4	163	-179.6	0	0	0	0	0	109.5	P368 D369	G366-P368 CarbonylContact C-O 3.52Å; G366-P368 VanDerWaalsContact C-O 3.24Å; G366-P368 CarbonylContact O-C 3.47Å; G366-P368 VanDerWaalsContact O-C 3.24Å; G366-D369 PolarHBondContact O-N 3.25Å
367	I	96.3	Very high	95.5	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.3	178.2	-53.7	-179.4	0	0	0	108.7	T313 M316 V337 N338 V339 N417 I609 L657 I723	T313-I367 HydrophobicContact CG2-CD1 3.88Å; M316-I367 HydrophobicContact CE-CD1 3.62Å; M316-I367 HydrophobicContact CE-CG2 3.91Å; V337-I367 WeakPolarHBondContact O-CG2 3.24Å; N338-I367 CarbonylContact C-O 3.54Å; N338-I367 WeakPolarHBondContact CA-O 3.21Å; V339-I367 HydrophobicContact CB-CB 3.98Å; V339-I367 HydrophobicContact CB-CD1 4.47Å; V339-I367 HydrophobicContact CB-CG1 4.07Å; V339-I367 HydrophobicContact CG2-CB 4Å; V339-I367 HydrophobicContact CG2-CD1 3.83Å; V339-I367 HydrophobicContact CG2-CG1 3.96Å; V339-I367 PolarHBondContact N-O 3.43Å; V339-I367 PolarHBondContact O-N 3.16Å; I367-N417 PolarHBondContact O-ND2 3.38Å; I367-I609 HydrophobicContact CD1-CD1 4.01Å; I367-I609 HydrophobicContact CG1-CD1 3.93Å; I367-L657 HydrophobicContact CD1-CD2 3.77Å; I367-I723 HydrophobicContact CG2-CB 4.25Å; I367-I723 HydrophobicContact CG2-CG2 4.07Å
368	P	95.1	Very high	95.6	Very high	39 Å²	39	32.7 Å²	32.7	25%	0.253	19%	0.189	S	C	.	.	S	Bend	cis	-60.4	165.4	-11.5	-21.1	33.9	0	0	0	113.3	G366 N417 E418 I723	G366-P368 CarbonylContact C-O 3.52Å; G366-P368 VanDerWaalsContact C-O 3.24Å; G366-P368 CarbonylContact O-C 3.47Å; G366-P368 VanDerWaalsContact O-C 3.24Å; P368-N417 WeakPolarHBondContact O-CB 2.98Å; P368-N417 PolarHBondContact O-ND2 3.02Å; P368-E418 WeakPolarHBondContact CD-OE1 3.29Å; P368-E418 HydrophobicContact CG-CG 4.49Å; P368-I723 HydrophobicContact CG-CD1 4.48Å
369	D	94.8	Very high	95.7	Very high	66 Å²	66	37.3 Å²	37.3	35%	0.353	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-50.5	129.3	179.3	-66.7	-30.5	0	0	0	111.5	G366 H704	G366-D369 PolarHBondContact O-N 3.25Å; D369-H704 IonicContact OD1-CE1 2.79Å
370	P	96.6	Very high	95.9	Very high	4 Å²	4	39.5 Å²	39.5	3%	0.026	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-75.8	145	-173.6	29.3	-34.3	0	0	0	112.6	P341 A364 A415 R416 H752	P341-P370 HydrophobicContact CB-CB 3.93Å; P341-P370 HydrophobicContact CB-CG 4.22Å; P341-P370 HydrophobicContact CG-CB 3.87Å; A364-P370 HydrophobicContact CB-CG 3.7Å; P370-A415 HydrophobicContact CB-CB 3.97Å; P370-A415 HydrophobicContact CG-CB 4.29Å; P370-R416 CarbonylContact C-O 3.57Å; P370-R416 WeakPolarHBondContact CA-O 3.21Å; P370-H752 PolarHBondContact O-NE2 3.32Å
371	Q	95.7	Very high	95.9	Very high	159 Å²	159	39.7 Å²	39.7	74%	0.743	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79	132.5	168.8	-65	178.5	1.4	0	0	109.8	A415 R416	Q371-A415 WeakPolarHBondContact O-CA 3.36Å; Q371-R416 PolarHBondContact N-O 3.44Å; Q371-R416 PolarHBondContact O-N 2.99Å
372	L	96.1	Very high	95.8	Very high	41 Å²	41	41.2 Å²	41.2	22%	0.215	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	144.8	179.7	-60.7	-178	0	0	0	112	A364 I414 A415	A364-L372 HydrophobicContact CB-CD2 3.78Å; L372-I414 CarbonylContact C-O 3.53Å; L372-I414 WeakPolarHBondContact CA-O 3.31Å; L372-A415 HydrophobicContact CD2-CB 3.94Å
373	G	96.4	Very high	95.6	Very high	29 Å²	29	46.2 Å²	46.2	30%	0.299	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	156.4	170.7	0	0	0	0	0	111	C413 I414	G373-C413 CarbonylContact O-C 3.48Å; G373-C413 WeakPolarHBondContact O-CA 3.49Å; G373-I414 PolarHBondContact N-O 3.45Å; G373-I414 PolarHBondContact O-N 3.05Å
374	W	97.9	Very high	95.3	Very high	3 Å²	3	51.2 Å²	51.2	1%	0.011	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	133.9	-177.5	-74.1	93.9	0	0	0	112	L360 C362 I381 L391 G395 V398 T412 C413	L360-W374 HydrophobicContact CB-CH2 4.23Å; C362-W374 HydrophobicContact CB-CH2 3.7Å; C362-W374 HydrophobicContact CB-CZ2 3.31Å; W374-I381 HydrophobicContact CB-CD1 3.53Å; W374-I381 HydrophobicContact CB-CG1 3.61Å; W374-I381 HydrophobicContact CG-CD1 4.26Å; W374-I381 PolarHBondContact O-N 2.76Å; W374-L391 HydrophobicContact CG-CD2 4.18Å; W374-G395 PolarHBondContact NE1-O 3.47Å; W374-V398 HydrophobicContact CB-CG2 4.37Å; W374-V398 HydrophobicContact CD2-CG2 3.36Å; W374-V398 HydrophobicContact CE3-CG2 3.7Å; W374-V398 HydrophobicContact CG-CG2 3.68Å; W374-V398 HydrophobicContact CH2-CG2 4.2Å; W374-V398 HydrophobicContact CZ2-CG2 3.91Å; W374-V398 HydrophobicContact CZ3-CG2 4.11Å; W374-T412 WeakPolarHBondContact CA-O 3.28Å; W374-C413 HydrophobicContact CD2-CB 4.14Å; W374-C413 HydrophobicContact CE3-CB 3.91Å; W374-C413 HydrophobicContact CH2-CB 3.74Å; W374-C413 HydrophobicContact CZ2-CB 3.95Å; W374-C413 HydrophobicContact CZ3-CB 3.7Å
375	L	97.7	Very high	95	Very high	42 Å²	42	54.5 Å²	54.5	22%	0.22	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.6	169.6	-50.8	-177.2	0	0	0	109.7	I379 D380 Y411 T412 I414	L375-I379 CarbonylContact C-O 3.6Å; L375-I379 WeakPolarHBondContact CA-O 3.42Å; L375-D380 HydrophobicContact CD2-CB 4.07Å; L375-Y411 CarbonylContact O-C 3.59Å; L375-Y411 VanDerWaalsContact O-CA 3.26Å; L375-Y411 WeakPolarHBondContact O-CA 3.46Å; L375-T412 PolarHBondContact N-O 3.2Å; L375-T412 PolarHBondContact O-N 3.31Å; L375-I414 HydrophobicContact CD1-CD1 3.5Å; L375-I414 HydrophobicContact CD2-CD1 4.41Å; L375-I414 HydrophobicContact CG-CD1 3.67Å
376	K	97.1	Very high	94.8	Very high	34 Å²	34	56.8 Å²	56.8	15%	0.148	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	119.4	165.3	178.9	-173.6	179	-176.4	0	108.7	G378 I379 I381 E406 D407 A410 Y411	K376-G378 PolarHBondContact O-N 3.33Å; K376-I379 PolarHBondContact N-O 3.26Å; K376-I379 PolarHBondContact O-N 2.69Å; K376-I381 HydrophobicContact CB-CG2 3.37Å; K376-E406 PolarHBondContact NZ-O 3.45Å; K376-D407 WeakPolarHBondContact CE-O 3.4Å; K376-D407 VanDerWaalsContact NZ-CA 3.31Å; K376-D407 IonicContact NZ-OD1 3.95Å; K376-A410 WeakPolarHBondContact CA-O 3.24Å; K376-Y411 HydrophobicContact CB-CD1 4.22Å; K376-Y411 HydrophobicContact CB-CE1 4.1Å; K376-Y411 HydrophobicContact CD-CE1 3.93Å; K376-Y411 HydrophobicContact CD-CE2 4.39Å; K376-Y411 WeakPolarHBondContact CD-OH 3.39Å; K376-Y411 WeakPolarHBondContact CE-OH 3.4Å; K376-Y411 HydrophobicContact CG-CD1 4.43Å; K376-Y411 HydrophobicContact CG-CE1 4.05Å; K376-Y411 HydrophobicContact CG-CE2 4.3Å
377	N	95.5	Very high	94.4	Very high	101 Å²	101	66.5 Å²	66.5	54%	0.54	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	40.7	-174.8	-56.2	-32.1	0	0	0	111.8	I379 G409 A410	N377-I379 VanDerWaalsContact C-N 3.33Å; N377-I379 PolarHBondContact O-N 2.84Å; N377-G409 WeakPolarHBondContact OD1-CA 2.98Å; N377-A410 PolarHBondContact N-O 3.27Å; N377-A410 PolarHBondContact OD1-N 3.23Å
378	G	95.1	Very high	94.2	Very high	56 Å²	56	67.7 Å²	67.7	58%	0.577	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	3.6	-178.9	0	0	0	0	0	116.1	K376	K376-G378 PolarHBondContact O-N 3.33Å
379	I	96.5	Very high	94.2	Very high	97 Å²	97	66.4 Å²	66.4	50%	0.497	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130.2	-179.7	-57.4	172.3	0	0	0	109.8	L375 K376 N377 I381	L375-I379 CarbonylContact C-O 3.6Å; L375-I379 WeakPolarHBondContact CA-O 3.42Å; K376-I379 PolarHBondContact N-O 3.26Å; K376-I379 PolarHBondContact O-N 2.69Å; N377-I379 VanDerWaalsContact C-N 3.33Å; N377-I379 PolarHBondContact O-N 2.84Å; I379-I381 PolarHBondContact O-N 2.83Å
380	D	96.3	Very high	94.3	Very high	73 Å²	73	65.4 Å²	65.4	39%	0.39	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	127.2	175.1	-175.2	-1.9	0	0	0	111.2	L375 T382 P383	L375-D380 HydrophobicContact CD2-CB 4.07Å; D380-T382 WeakPolarHBondContact OD1-CB 3.41Å; D380-T382 PolarHBondContact OD1-N 3.26Å; D380-T382 PolarHBondContact OD1-OG1 2.84Å; D380-P383 WeakPolarHBondContact O-CD 3.26Å
381	I	95.5	Very high	94.1	Very high	3 Å²	3	67.9 Å²	67.9	2%	0.015	37%	0.372	C	S	.	.	S	Bend	trans	-86.3	-15.7	179.5	59.7	160.6	0	0	0	112.9	W374 K376 I379 P383 K384 L385 L389 L391 V398	W374-I381 HydrophobicContact CB-CD1 3.53Å; W374-I381 HydrophobicContact CB-CG1 3.61Å; W374-I381 HydrophobicContact CG-CD1 4.26Å; W374-I381 PolarHBondContact O-N 2.76Å; K376-I381 HydrophobicContact CB-CG2 3.37Å; I379-I381 PolarHBondContact O-N 2.83Å; I381-P383 VanDerWaalsContact C-CD 3.47Å; I381-P383 VanDerWaalsContact C-N 3.34Å; I381-K384 CarbonylContact O-C 3.45Å; I381-K384 WeakPolarHBondContact O-CA 3.48Å; I381-K384 WeakPolarHBondContact O-CB 3.3Å; I381-K384 PolarHBondContact O-N 3.25Å; I381-L385 PolarHBondContact O-N 2.87Å; I381-L385 VanDerWaalsContact O-N 3.13Å; I381-L389 HydrophobicContact CD1-CD2 4Å; I381-L391 HydrophobicContact CD1-CD2 4.04Å; I381-V398 HydrophobicContact CD1-CG1 4.4Å; I381-V398 HydrophobicContact CD1-CG2 3.93Å
382	T	92.9	Very high	93.9	Very high	71 Å²	71	63.7 Å²	63.7	44%	0.436	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-53.1	-44.3	-178.4	-47.5	0	0	0	0	112.4	D380 K384 L385	D380-T382 WeakPolarHBondContact OD1-CB 3.41Å; D380-T382 PolarHBondContact OD1-N 3.26Å; D380-T382 PolarHBondContact OD1-OG1 2.84Å; T382-K384 PolarHBondContact O-N 3.02Å; T382-L385 HydrophobicContact CG2-CD1 4.09Å; T382-L385 WeakPolarHBondContact O-CD1 3.41Å; T382-L385 VanDerWaalsContact O-CG 3.27Å; T382-L385 WeakPolarHBondContact O-CG 3.42Å; T382-L385 PolarHBondContact O-N 2.78Å
383	P	90.6	Very high	93.5	Very high	110 Å²	110	62.3 Å²	62.3	71%	0.714	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-69.8	-15.7	176.1	-18.4	33.7	0	0	0	114.3	D380 I381	D380-P383 WeakPolarHBondContact O-CD 3.26Å; I381-P383 VanDerWaalsContact C-CD 3.47Å; I381-P383 VanDerWaalsContact C-N 3.34Å
384	K	87.2	Confident	93.1	Very high	128 Å²	128	67.7 Å²	67.7	56%	0.557	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-103.3	4.1	-177.7	-62.9	-178.1	-179.8	175.2	0	112.9	I381 T382 S386	I381-K384 CarbonylContact O-C 3.45Å; I381-K384 WeakPolarHBondContact O-CA 3.48Å; I381-K384 WeakPolarHBondContact O-CB 3.3Å; I381-K384 PolarHBondContact O-N 3.25Å; T382-K384 PolarHBondContact O-N 3.02Å; K384-S386 PolarHBondContact O-N 2.82Å
385	L	90.5	Very high	92.8	Very high	70 Å²	70	68.1 Å²	68.1	37%	0.366	37%	0.374	S	S	.	.			trans	-56.1	138.8	175.5	-65.3	171.8	0	0	0	110.2	I381 T382 L389 L391	I381-L385 PolarHBondContact O-N 2.87Å; I381-L385 VanDerWaalsContact O-N 3.13Å; T382-L385 HydrophobicContact CG2-CD1 4.09Å; T382-L385 WeakPolarHBondContact O-CD1 3.41Å; T382-L385 VanDerWaalsContact O-CG 3.27Å; T382-L385 WeakPolarHBondContact O-CG 3.42Å; T382-L385 PolarHBondContact O-N 2.78Å; L385-L389 HydrophobicContact CD2-CD2 3.56Å; L385-L391 HydrophobicContact CD1-CD1 4.16Å; L385-L391 HydrophobicContact CD1-CG 4.38Å; L385-L391 HydrophobicContact CD2-CD1 4.3Å; L385-L391 HydrophobicContact CD2-CG 3.8Å
386	S	90.4	Very high	92.6	Very high	60 Å²	60	67.1 Å²	67.1	42%	0.42	37%	0.37	S	S	.	.			trans	-148.1	-177.4	-173.9	67.9	0	0	0	0	110.1	K384 Q388 L389 T390	K384-S386 PolarHBondContact O-N 2.82Å; S386-Q388 PolarHBondContact O-N 3.32Å; S386-Q388 PolarHBondContact OG-N 2.78Å; S386-L389 PolarHBondContact N-O 3.2Å; S386-L389 CarbonylContact O-C 3.56Å; S386-L389 PolarHBondContact OG-N 3.42Å; S386-T390 VanDerWaalsContact O-CG2 3.27Å; S386-T390 WeakPolarHBondContact O-CG2 3.23Å
387	K	88.6	Confident	92.5	Very high	206 Å²	206	65.8 Å²	65.8	90%	0.896	37%	0.365	S	S	*	.	S	Bend	trans	-64.1	-24.8	170.8	-65.9	-174.6	179.5	-177.6	0	112.7
388	Q	91.7	Very high	92.5	Very high	29 Å²	29	61 Å²	61	14%	0.136	34%	0.339	C	S	.	.	S	Bend	trans	-84.7	-45.9	-178.6	179.8	-176.9	-39.1	0	0	111.5	S386 I400 S401 N402 R404 D407	S386-Q388 PolarHBondContact O-N 3.32Å; S386-Q388 PolarHBondContact OG-N 2.78Å; Q388-I400 HydrophobicContact CG-CG2 4.25Å; Q388-I400 CarbonylContact O-C 3.42Å; Q388-I400 WeakPolarHBondContact O-CA 3.5Å; Q388-S401 PolarHBondContact O-N 2.79Å; Q388-S401 PolarHBondContact O-OG 3.33Å; Q388-N402 HydrophobicContact CG-CB 4.5Å; Q388-N402 WeakPolarHBondContact CG-O 2.96Å; Q388-N402 PolarHBondContact NE2-O 2.91Å; Q388-R404 VanDerWaalsContact OE1-NE 3.16Å; Q388-D407 PolarHBondContact NE2-OD2 3.5Å
389	L	95.4	Very high	92.6	Very high	13 Å²	13	60.1 Å²	60.1	7%	0.068	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	112.5	-177.5	-172.6	162.3	0	0	0	109.3	I381 L385 S386 V398 H399 I400	I381-L389 HydrophobicContact CD1-CD2 4Å; L385-L389 HydrophobicContact CD2-CD2 3.56Å; S386-L389 PolarHBondContact N-O 3.2Å; S386-L389 CarbonylContact O-C 3.56Å; S386-L389 PolarHBondContact OG-N 3.42Å; L389-V398 HydrophobicContact CG-CG1 4.49Å; L389-H399 WeakPolarHBondContact CA-O 3.29Å; L389-I400 HydrophobicContact CD1-CG1 4.49Å; L389-I400 HydrophobicContact CG-CG1 4.23Å
390	T	95.8	Very high	92.6	Very high	44 Å²	44	55.6 Å²	55.6	27%	0.27	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	154.3	-177.3	57.3	0	0	0	0	111.5	S386 H399	S386-T390 VanDerWaalsContact O-CG2 3.27Å; S386-T390 WeakPolarHBondContact O-CG2 3.23Å; T390-H399 PolarHBondContact N-O 2.92Å; T390-H399 PolarHBondContact O-N 2.96Å
391	L	93.9	Very high	92.5	Very high	56 Å²	56	54.5 Å²	54.5	29%	0.293	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.7	164.7	-67.6	176.9	0	0	0	108.5	W374 I381 L385 E397 V398	W374-L391 HydrophobicContact CG-CD2 4.18Å; I381-L391 HydrophobicContact CD1-CD2 4.04Å; L385-L391 HydrophobicContact CD1-CD1 4.16Å; L385-L391 HydrophobicContact CD1-CG 4.38Å; L385-L391 HydrophobicContact CD2-CD1 4.3Å; L385-L391 HydrophobicContact CD2-CG 3.8Å; L391-E397 CarbonylContact C-O 3.47Å; L391-E397 WeakPolarHBondContact CA-O 3.33Å; L391-V398 HydrophobicContact CD2-CG2 3.75Å
392	Q	91.4	Very high	92.4	Very high	72 Å²	72	57.7 Å²	57.7	34%	0.336	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	169.5	177.6	-63.3	-173.6	-37.5	0	0	110.1	N394 G395 S396 E397 H399	Q392-N394 VanDerWaalsContact C-N 3.33Å; Q392-N394 PolarHBondContact O-N 2.74Å; Q392-G395 PolarHBondContact O-N 2.9Å; Q392-S396 PolarHBondContact O-N 2.81Å; Q392-E397 HydrophobicContact CB-CB 4.18Å; Q392-E397 HydrophobicContact CB-CG 4.48Å; Q392-E397 PolarHBondContact N-O 3.42Å; Q392-E397 PolarHBondContact O-N 3.26Å; Q392-H399 HydrophobicContact CG-CB 4Å
393	A	87.7	Confident	92.5	Very high	11 Å²	11	54.4 Å²	54.4	9%	0.091	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	50.1	47.5	176.5	0	0	0	0	0	114.2	G395 S396 T749 A751	A393-G395 PolarHBondContact O-N 2.84Å; A393-S396 WeakPolarHBondContact CB-OG 3.39Å; A393-S396 PolarHBondContact O-N 2.81Å; A393-S396 PolarHBondContact O-OG 2.77Å; A393-T749 WeakPolarHBondContact CA-O 3.39Å; A393-A751 WeakPolarHBondContact O-CB 3.2Å; A393-A751 PolarHBondContact O-N 2.77Å
394	N	87.8	Confident	92.7	Very high	143 Å²	143	54.7 Å²	54.7	77%	0.765	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	54.8	31.5	-175.8	-161.4	20.7	0	0	0	114.4	Q392 A751	Q392-N394 VanDerWaalsContact C-N 3.33Å; Q392-N394 PolarHBondContact O-N 2.74Å; N394-A751 HydrophobicContact CB-CB 4.25Å
395	G	90.8	Very high	93	Very high	12 Å²	12	54.5 Å²	54.5	12%	0.124	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	98.5	0.7	175.2	0	0	0	0	0	115.3	W374 Q392 A393	W374-G395 PolarHBondContact NE1-O 3.47Å; Q392-G395 PolarHBondContact O-N 2.9Å; A393-G395 PolarHBondContact O-N 2.84Å
396	S	93.3	Very high	93.1	Very high	20 Å²	20	57.2 Å²	57.2	14%	0.14	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-13.4	176.1	62.5	0	0	0	0	114.1	R361 C362 Q392 A393	R361-S396 CarbonylContact C-O 3.46Å; R361-S396 WeakPolarHBondContact CA-O 3.17Å; C362-S396 PolarHBondContact N-O 3.14Å; C362-S396 WeakPolarHBondContact O-CB 3.46Å; Q392-S396 PolarHBondContact O-N 2.81Å; A393-S396 WeakPolarHBondContact CB-OG 3.39Å; A393-S396 PolarHBondContact O-N 2.81Å; A393-S396 PolarHBondContact O-OG 2.77Å
397	E	95	Very high	93.3	Very high	6 Å²	6	54.9 Å²	54.9	3%	0.028	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	124.8	179.7	-179.7	170	177.6	0	0	111.8	S359 L360 R361 L391 Q392 R824	S359-E397 WeakPolarHBondContact CB-OE1 3.33Å; S359-E397 WeakPolarHBondContact OG-CG 3.3Å; S359-E397 PolarHBondContact OG-OE1 2.81Å; L360-E397 CarbonylContact O-C 3.56Å; L360-E397 WeakPolarHBondContact O-CA 2.99Å; R361-E397 HydrophobicContact CG-CB 4.21Å; R361-E397 HydrophobicContact CG-CG 3.92Å; L391-E397 CarbonylContact C-O 3.47Å; L391-E397 WeakPolarHBondContact CA-O 3.33Å; Q392-E397 HydrophobicContact CB-CB 4.18Å; Q392-E397 HydrophobicContact CB-CG 4.48Å; Q392-E397 PolarHBondContact N-O 3.42Å; Q392-E397 PolarHBondContact O-N 3.26Å; E397-R824 IonicContact OE1-CZ 2.61Å; E397-R824 IonicContact OE1-NH1 3.86Å; E397-R824 PolarHBondContact OE1-NH1 3.46Å; E397-R824 IonicContact OE1-NH2 3.88Å; E397-R824 PolarHBondContact OE1-NH2 2.6Å; E397-R824 IonicContact OE2-CZ 3.94Å; E397-R824 IonicContact OE2-NH1 3.64Å; E397-R824 IonicContact OE2-NH2 2.89Å; E397-R824 PolarHBondContact OE2-NH2 3.39Å
398	V	96.6	Very high	93.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	121	164.5	177.8	0	0	0	0	108.1	S359 L360 W374 I381 L389 L391 I400 Y411	S359-V398 WeakPolarHBondContact CA-O 3.34Å; L360-V398 HydrophobicContact CB-CB 4.23Å; L360-V398 HydrophobicContact CD1-CB 4.2Å; L360-V398 HydrophobicContact CD1-CG1 4.24Å; L360-V398 PolarHBondContact N-O 3.24Å; L360-V398 PolarHBondContact O-N 3.47Å; W374-V398 HydrophobicContact CB-CG2 4.37Å; W374-V398 HydrophobicContact CD2-CG2 3.36Å; W374-V398 HydrophobicContact CE3-CG2 3.7Å; W374-V398 HydrophobicContact CG-CG2 3.68Å; W374-V398 HydrophobicContact CH2-CG2 4.2Å; W374-V398 HydrophobicContact CZ2-CG2 3.91Å; W374-V398 HydrophobicContact CZ3-CG2 4.11Å; I381-V398 HydrophobicContact CD1-CG1 4.4Å; I381-V398 HydrophobicContact CD1-CG2 3.93Å; L389-V398 HydrophobicContact CG-CG1 4.49Å; L391-V398 HydrophobicContact CD2-CG2 3.75Å; V398-I400 HydrophobicContact CG1-CG1 4.27Å; V398-Y411 HydrophobicContact CG1-CD1 4.35Å; V398-Y411 HydrophobicContact CG1-CE1 4.28Å
399	H	95.9	Very high	93.8	Very high	39 Å²	39	46.6 Å²	46.6	18%	0.181	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.5	178.7	-175.7	86.6	0	0	0	111	T357 L389 T390 Q392	T357-H399 WeakPolarHBondContact CG2-CE1 3.35Å; L389-H399 WeakPolarHBondContact CA-O 3.29Å; T390-H399 PolarHBondContact N-O 2.92Å; T390-H399 PolarHBondContact O-N 2.96Å; Q392-H399 HydrophobicContact CG-CB 4Å
400	I	96.9	Very high	93.9	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	105.8	177.7	-52.2	176.3	0	0	0	108	T357 A358 Q388 L389 V398 V403 D407 Y411 L428	T357-I400 CarbonylContact C-O 3.49Å; T357-I400 WeakPolarHBondContact CA-O 3.34Å; T357-I400 WeakPolarHBondContact CG2-O 3.32Å; A358-I400 HydrophobicContact CB-CB 4.38Å; A358-I400 PolarHBondContact N-O 2.81Å; A358-I400 PolarHBondContact O-N 3.15Å; Q388-I400 HydrophobicContact CG-CG2 4.25Å; Q388-I400 CarbonylContact O-C 3.42Å; Q388-I400 WeakPolarHBondContact O-CA 3.5Å; L389-I400 HydrophobicContact CD1-CG1 4.49Å; L389-I400 HydrophobicContact CG-CG1 4.23Å; V398-I400 HydrophobicContact CG1-CG1 4.27Å; I400-V403 HydrophobicContact CB-CG2 4.08Å; I400-V403 HydrophobicContact CG2-CB 4.48Å; I400-V403 HydrophobicContact CG2-CG2 3.77Å; I400-D407 HydrophobicContact CD1-CB 4.28Å; I400-Y411 HydrophobicContact CD1-CE1 4.44Å; I400-L428 HydrophobicContact CD1-CD2 3.7Å
401	S	94.8	Very high	94	Very high	50 Å²	50	45.3 Å²	45.3	35%	0.35	24%	0.236	S	C	.	.	S	Bend	trans	-74	-28.1	-173	53.1	0	0	0	0	114.5	T357 Q388	T357-S401 PolarHBondContact OG1-O 2.76Å; Q388-S401 PolarHBondContact O-N 2.79Å; Q388-S401 PolarHBondContact O-OG 3.33Å
402	N	94.2	Very high	94.2	Very high	71 Å²	71	43.3 Å²	43.3	38%	0.38	23%	0.226	S	C	.	.	S	Bend	trans	-140.9	93.9	177.8	177.1	-2.7	0	0	0	108.3	G355 Q388	G355-N402 WeakPolarHBondContact CA-OD1 3.14Å; G355-N402 PolarHBondContact N-OD1 2.85Å; Q388-N402 HydrophobicContact CG-CB 4.5Å; Q388-N402 WeakPolarHBondContact CG-O 2.96Å; Q388-N402 PolarHBondContact NE2-O 2.91Å
403	V	94.4	Very high	94.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	21%	0.21	C	C	.	.			trans	-67.7	137.3	-176.4	172	0	0	0	0	111	R352 P354 G355 V356 A358 I400 D407 V430	R352-V403 HydrophobicContact CB-CG1 4.3Å; P354-V403 CarbonylContact C-O 3.55Å; P354-V403 VanDerWaalsContact CA-O 3.27Å; P354-V403 WeakPolarHBondContact CA-O 3.49Å; G355-V403 PolarHBondContact N-O 3.33Å; V356-V403 WeakPolarHBondContact O-CB 3.39Å; V356-V403 WeakPolarHBondContact O-CG2 3.4Å; V356-V403 PolarHBondContact O-N 2.83Å; A358-V403 HydrophobicContact CB-CG2 3.49Å; A358-V403 VanDerWaalsContact CB-CG2 3.49Å; I400-V403 HydrophobicContact CB-CG2 4.08Å; I400-V403 HydrophobicContact CG2-CB 4.48Å; I400-V403 HydrophobicContact CG2-CG2 3.77Å; V403-D407 HydrophobicContact CG1-CB 4.37Å; V403-V430 HydrophobicContact CG1-CB 4.03Å; V403-V430 HydrophobicContact CG1-CG1 3.7Å; V403-V430 HydrophobicContact CG1-CG2 3.14Å
404	R	94.3	Very high	95	Very high	117 Å²	117	39.7 Å²	39.7	44%	0.442	21%	0.207	S	C	.	.			trans	-124.5	162.8	176.9	-63.7	177.9	-177	178.8	1.8	111.2	Q388 E406 D407 V430	Q388-R404 VanDerWaalsContact OE1-NE 3.16Å; R404-E406 HydrophobicContact CB-CG 3.84Å; R404-E406 WeakPolarHBondContact CD-OE1 3.47Å; R404-E406 IonicContact CZ-OE1 3.96Å; R404-E406 IonicContact NH1-OE1 2.98Å; R404-E406 PolarHBondContact NH1-OE1 3.48Å; R404-E406 VanDerWaalsContact NH1-OE1 3.1Å; R404-E406 PolarHBondContact O-N 3.31Å; R404-E406 VanDerWaalsContact O-N 3.12Å; R404-D407 PolarHBondContact N-OD2 2.69Å; R404-D407 WeakPolarHBondContact O-CA 3.41Å; R404-D407 VanDerWaalsContact O-CB 3.24Å; R404-D407 WeakPolarHBondContact O-CB 3.22Å; R404-D407 PolarHBondContact O-N 2.89Å; R404-V430 WeakPolarHBondContact O-CG2 3.47Å
405	Y	93.9	Very high	95.5	Very high	124 Å²	124	32.9 Å²	32.9	49%	0.486	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-51.9	-38.6	175.9	-72	-67.8	0	0	0	113.8	P354 D407 T408 V430 D432	P354-Y405 HydrophobicContact CG-CD2 4.48Å; P354-Y405 HydrophobicContact CG-CE1 4.22Å; P354-Y405 HydrophobicContact CG-CE2 3.82Å; Y405-D407 PolarHBondContact O-N 2.82Å; Y405-T408 VanDerWaalsContact O-CB 3.24Å; Y405-T408 WeakPolarHBondContact O-CB 3.48Å; Y405-T408 PolarHBondContact O-N 2.84Å; Y405-T408 PolarHBondContact O-OG1 3.15Å; Y405-V430 HydrophobicContact CD1-CB 4.41Å; Y405-V430 HydrophobicContact CD1-CG1 4.25Å; Y405-V430 WeakPolarHBondContact CD1-O 3.02Å; Y405-V430 WeakPolarHBondContact CE1-O 3.38Å; Y405-D432 PolarHBondContact OH-OD1 2.97Å; Y405-D432 PolarHBondContact OH-OD2 2.88Å
406	E	93.3	Very high	95.8	Very high	127 Å²	127	38.8 Å²	38.8	59%	0.593	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-65.5	-18.1	175.7	64.7	-166.4	-179.3	0	0	114.1	K376 R404 T408	K376-E406 PolarHBondContact NZ-O 3.45Å; R404-E406 HydrophobicContact CB-CG 3.84Å; R404-E406 WeakPolarHBondContact CD-OE1 3.47Å; R404-E406 IonicContact CZ-OE1 3.96Å; R404-E406 IonicContact NH1-OE1 2.98Å; R404-E406 PolarHBondContact NH1-OE1 3.48Å; R404-E406 VanDerWaalsContact NH1-OE1 3.1Å; R404-E406 PolarHBondContact O-N 3.31Å; R404-E406 VanDerWaalsContact O-N 3.12Å; E406-T408 VanDerWaalsContact C-N 3.28Å
407	D	94.6	Very high	96	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.053	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-75.9	-16.9	175.3	-64.9	-37.5	0	0	0	113.1	K376 Q388 I400 V403 R404 Y405 G409 Y411 L428	K376-D407 WeakPolarHBondContact CE-O 3.4Å; K376-D407 VanDerWaalsContact NZ-CA 3.31Å; K376-D407 IonicContact NZ-OD1 3.95Å; Q388-D407 PolarHBondContact NE2-OD2 3.5Å; I400-D407 HydrophobicContact CD1-CB 4.28Å; V403-D407 HydrophobicContact CG1-CB 4.37Å; R404-D407 PolarHBondContact N-OD2 2.69Å; R404-D407 WeakPolarHBondContact O-CA 3.41Å; R404-D407 VanDerWaalsContact O-CB 3.24Å; R404-D407 WeakPolarHBondContact O-CB 3.22Å; R404-D407 PolarHBondContact O-N 2.89Å; Y405-D407 PolarHBondContact O-N 2.82Å; D407-G409 PolarHBondContact O-N 2.92Å; D407-Y411 WeakPolarHBondContact O-CE2 3.17Å; D407-Y411 PolarHBondContact O-OH 2.74Å; D407-L428 HydrophobicContact CB-CD2 4.25Å
408	T	95.1	Very high	96	Very high	49 Å²	49	45.2 Å²	45.2	30%	0.301	22%	0.218	S	C	.	.			trans	-54.2	132.6	173	-58.5	0	0	0	0	110.8	Y405 E406 L428 F429 V430	Y405-T408 VanDerWaalsContact O-CB 3.24Å; Y405-T408 WeakPolarHBondContact O-CB 3.48Å; Y405-T408 PolarHBondContact O-N 2.84Å; Y405-T408 PolarHBondContact O-OG1 3.15Å; E406-T408 VanDerWaalsContact C-N 3.28Å; T408-L428 VanDerWaalsContact CA-O 3.28Å; T408-L428 WeakPolarHBondContact CA-O 3.34Å; T408-L428 WeakPolarHBondContact CG2-O 3.06Å; T408-F429 HydrophobicContact CG2-CD1 4.37Å; T408-V430 WeakPolarHBondContact OG1-CB 3.47Å; T408-V430 WeakPolarHBondContact OG1-CG2 3.4Å; T408-V430 PolarHBondContact OG1-N 2.91Å
409	G	95.5	Very high	95.9	Very high	12 Å²	12	46 Å²	46	12%	0.124	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.7	175.3	177.3	0	0	0	0	0	113.7	N377 D407 L428	N377-G409 WeakPolarHBondContact OD1-CA 2.98Å; D407-G409 PolarHBondContact O-N 2.92Å; G409-L428 PolarHBondContact N-O 2.71Å; G409-L428 PolarHBondContact O-N 3.23Å
410	A	97.2	Very high	96	Very high	31 Å²	31	44.3 Å²	44.3	26%	0.256	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.3	171.7	0	0	0	0	0	109	K376 N377 I425	K376-A410 WeakPolarHBondContact CA-O 3.24Å; N377-A410 PolarHBondContact N-O 3.27Å; N377-A410 PolarHBondContact OD1-N 3.23Å; A410-I425 HydrophobicContact CB-CG2 3.83Å
411	Y	97.6	Very high	96	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	110.4	174.2	-69.8	-101.9	0	0	0	108.7	L360 L375 K376 V398 I400 D407 S426 L428	L360-Y411 HydrophobicContact CD1-CD1 3.69Å; L360-Y411 HydrophobicContact CD1-CD2 3.56Å; L360-Y411 HydrophobicContact CD1-CE1 4.22Å; L360-Y411 HydrophobicContact CD1-CE2 4.12Å; L360-Y411 HydrophobicContact CD1-CG 3.33Å; L375-Y411 CarbonylContact O-C 3.59Å; L375-Y411 VanDerWaalsContact O-CA 3.26Å; L375-Y411 WeakPolarHBondContact O-CA 3.46Å; K376-Y411 HydrophobicContact CB-CD1 4.22Å; K376-Y411 HydrophobicContact CB-CE1 4.1Å; K376-Y411 HydrophobicContact CD-CE1 3.93Å; K376-Y411 HydrophobicContact CD-CE2 4.39Å; K376-Y411 WeakPolarHBondContact CD-OH 3.39Å; K376-Y411 WeakPolarHBondContact CE-OH 3.4Å; K376-Y411 HydrophobicContact CG-CD1 4.43Å; K376-Y411 HydrophobicContact CG-CE1 4.05Å; K376-Y411 HydrophobicContact CG-CE2 4.3Å; V398-Y411 HydrophobicContact CG1-CD1 4.35Å; V398-Y411 HydrophobicContact CG1-CE1 4.28Å; I400-Y411 HydrophobicContact CD1-CE1 4.44Å; D407-Y411 WeakPolarHBondContact O-CE2 3.17Å; D407-Y411 PolarHBondContact O-OH 2.74Å; Y411-S426 PolarHBondContact N-O 3.36Å; Y411-S426 PolarHBondContact O-N 2.98Å; Y411-L428 HydrophobicContact CD2-CB 4.15Å; Y411-L428 HydrophobicContact CE2-CB 3.87Å; Y411-L428 HydrophobicContact CE2-CD2 4.06Å
412	T	98.1	Very high	96.2	Very high	13 Å²	13	47.5 Å²	47.5	8%	0.08	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117.2	179.9	-51.2	0	0	0	0	108.7	W374 L375 I414 E423 D424 I425	W374-T412 WeakPolarHBondContact CA-O 3.28Å; L375-T412 PolarHBondContact N-O 3.2Å; L375-T412 PolarHBondContact O-N 3.31Å; T412-I414 HydrophobicContact CG2-CG1 4.02Å; T412-E423 HydrophobicContact CG2-CB 3.89Å; T412-E423 HydrophobicContact CG2-CG 4.33Å; T412-D424 CarbonylContact C-O 3.46Å; T412-D424 WeakPolarHBondContact CA-O 3.47Å; T412-I425 HydrophobicContact CG2-CG1 4.16Å
413	C	97.9	Very high	96.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	136.9	165.1	-167.6	0	0	0	0	108.3	I343 V345 C362 G373 W374 E423 D424	I343-C413 HydrophobicContact CD1-CB 3.73Å; I343-C413 WeakPolarHBondContact CD1-O 3.42Å; V345-C413 HydrophobicContact CG1-CB 3.9Å; C362-C413 HydrophobicContact CB-CB 3.63Å; C362-C413 WeakPolarHBondContact CB-SG 3.33Å; C362-C413 WeakPolarHBondContact SG-CB 3.29Å; C362-C413 CovalentContact SG-SG 2.04Å; C362-C413 PolarHBondContact SG-SG 3.1Å; G373-C413 CarbonylContact O-C 3.48Å; G373-C413 WeakPolarHBondContact O-CA 3.49Å; W374-C413 HydrophobicContact CD2-CB 4.14Å; W374-C413 HydrophobicContact CE3-CB 3.91Å; W374-C413 HydrophobicContact CH2-CB 3.74Å; W374-C413 HydrophobicContact CZ2-CB 3.95Å; W374-C413 HydrophobicContact CZ3-CB 3.7Å; C413-E423 VanDerWaalsContact O-CA 3.24Å; C413-E423 WeakPolarHBondContact O-CA 3.16Å; C413-E423 WeakPolarHBondContact O-CB 3.44Å; C413-D424 PolarHBondContact N-O 3.42Å; C413-D424 PolarHBondContact O-N 2.92Å
414	I	98.1	Very high	96.5	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.041	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	125.4	179.2	-55	176.8	0	0	0	108	L372 G373 L375 T412 R416 V421 E423	L372-I414 CarbonylContact C-O 3.53Å; L372-I414 WeakPolarHBondContact CA-O 3.31Å; G373-I414 PolarHBondContact N-O 3.45Å; G373-I414 PolarHBondContact O-N 3.05Å; L375-I414 HydrophobicContact CD1-CD1 3.5Å; L375-I414 HydrophobicContact CD2-CD1 4.41Å; L375-I414 HydrophobicContact CG-CD1 3.67Å; T412-I414 HydrophobicContact CG2-CG1 4.02Å; I414-R416 HydrophobicContact CG2-CG 3.86Å; I414-V421 HydrophobicContact CG2-CG1 3.68Å; I414-E423 HydrophobicContact CG1-CB 4.04Å
415	A	97.9	Very high	96.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.2	175.7	0	0	0	0	0	109.5	P341 I343 A364 P370 Q371 L372 V421 D422	P341-A415 HydrophobicContact CB-CB 3.67Å; P341-A415 HydrophobicContact CG-CB 4.37Å; I343-A415 HydrophobicContact CB-CB 4.45Å; I343-A415 HydrophobicContact CD1-CB 3.92Å; I343-A415 HydrophobicContact CG1-CB 4.37Å; A364-A415 HydrophobicContact CB-CB 3.59Å; P370-A415 HydrophobicContact CB-CB 3.97Å; P370-A415 HydrophobicContact CG-CB 4.29Å; Q371-A415 WeakPolarHBondContact O-CA 3.36Å; L372-A415 HydrophobicContact CD2-CB 3.94Å; A415-V421 VanDerWaalsContact O-CA 3.31Å; A415-V421 WeakPolarHBondContact O-CA 3.48Å; A415-D422 PolarHBondContact N-O 3.17Å; A415-D422 PolarHBondContact O-N 3Å
416	R	97.9	Very high	96.7	Very high	136 Å²	136	44 Å²	44	51%	0.513	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	132.2	-176.2	-51.6	-170	176.5	-132	-4.7	111.8	P370 Q371 I414 V421	P370-R416 CarbonylContact C-O 3.57Å; P370-R416 WeakPolarHBondContact CA-O 3.21Å; Q371-R416 PolarHBondContact N-O 3.44Å; Q371-R416 PolarHBondContact O-N 2.99Å; I414-R416 HydrophobicContact CG2-CG 3.86Å; R416-V421 HydrophobicContact CB-CG2 4.1Å; R416-V421 HydrophobicContact CG-CB 4.35Å; R416-V421 HydrophobicContact CG-CG1 3.9Å; R416-V421 HydrophobicContact CG-CG2 3.77Å
417	N	96.9	Very high	96.7	Very high	28 Å²	28	39.5 Å²	39.5	15%	0.15	21%	0.21	C	C	.	.			trans	-138.5	-172.5	163.9	70.1	12.1	0	0	0	109.8	V339 P341 I367 P368 A419 G420	V339-N417 PolarHBondContact O-ND2 2.91Å; P341-N417 WeakPolarHBondContact CD-OD1 3.39Å; P341-N417 HydrophobicContact CG-CB 4.4Å; I367-N417 PolarHBondContact O-ND2 3.38Å; P368-N417 WeakPolarHBondContact O-CB 2.98Å; P368-N417 PolarHBondContact O-ND2 3.02Å; N417-A419 VanDerWaalsContact C-N 3.27Å; N417-A419 PolarHBondContact O-N 2.04Å; N417-A419 PolarHBondContact OD1-N 2.77Å; N417-G420 PolarHBondContact N-O 3.13Å; N417-G420 PolarHBondContact O-N 3.06Å; N417-G420 VanDerWaalsContact O-O 3.08Å; N417-G420 PolarHBondContact OD1-N 2.86Å; N417-G420 VanDerWaalsContact OD1-N 3.12Å
418	E	94.8	Very high	96.7	Very high	133 Å²	133	39 Å²	39	62%	0.621	21%	0.207	S	C	*	.	S	Bend	trans	-69	-20.4	-178.4	60.7	-178.1	175.4	0	0	114.6	N338 P368	N338-E418 VanDerWaalsContact CG-OE1 3.29Å; N338-E418 VanDerWaalsContact ND2-CD 3.26Å; N338-E418 PolarHBondContact ND2-OE1 3.41Å; N338-E418 PolarHBondContact OD1-OE1 3.42Å; P368-E418 WeakPolarHBondContact CD-OE1 3.29Å; P368-E418 HydrophobicContact CG-CG 4.49Å
419	A	95.3	Very high	96.6	Very high	15 Å²	15	41 Å²	41	12%	0.124	21%	0.212	C	C	.	.	S	Bend	trans	-84.7	-29.2	177.5	0	0	0	0	0	112.9	T261 N338 P340 N417	T261-A419 HydrophobicContact CG2-CB 4.06Å; N338-A419 HydrophobicContact CB-CB 3.9Å; P340-A419 HydrophobicContact CB-CB 4.26Å; N417-A419 VanDerWaalsContact C-N 3.27Å; N417-A419 PolarHBondContact O-N 2.04Å; N417-A419 PolarHBondContact OD1-N 2.77Å
420	G	96.8	Very high	96.4	Very high	5 Å²	5	40.9 Å²	40.9	5%	0.052	21%	0.209	C	C	.	.			trans	177.3	-170.2	-178.1	0	0	0	0	0	115.2	P341 N417	P341-G420 WeakPolarHBondContact CD-O 3.48Å; N417-G420 PolarHBondContact N-O 3.13Å; N417-G420 PolarHBondContact O-N 3.06Å; N417-G420 VanDerWaalsContact O-O 3.08Å; N417-G420 PolarHBondContact OD1-N 2.86Å; N417-G420 VanDerWaalsContact OD1-N 3.12Å
421	V	98	Very high	95.9	Very high	65 Å²	65	41.9 Å²	41.9	39%	0.394	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.2	179.1	176.8	0	0	0	0	108.1	I414 A415 R416	I414-V421 HydrophobicContact CG2-CG1 3.68Å; A415-V421 VanDerWaalsContact O-CA 3.31Å; A415-V421 WeakPolarHBondContact O-CA 3.48Å; R416-V421 HydrophobicContact CB-CG2 4.1Å; R416-V421 HydrophobicContact CG-CB 4.35Å; R416-V421 HydrophobicContact CG-CG1 3.9Å; R416-V421 HydrophobicContact CG-CG2 3.77Å
422	D	98.2	Very high	95.1	Very high	53 Å²	53	46.6 Å²	46.6	28%	0.283	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152.4	171.7	-164.6	18	0	0	0	109.5	P341 I343 A415	P341-D422 HydrophobicContact CB-CB 4.25Å; P341-D422 VanDerWaalsContact O-CB 3.28Å; P341-D422 WeakPolarHBondContact O-CB 3.29Å; I343-D422 HydrophobicContact CB-CB 4.5Å; I343-D422 HydrophobicContact CG2-CB 4.2Å; I343-D422 WeakPolarHBondContact CG2-OD2 3.48Å; I343-D422 PolarHBondContact N-OD2 2.96Å; A415-D422 PolarHBondContact N-O 3.17Å; A415-D422 PolarHBondContact O-N 3Å
423	E	97.7	Very high	93.6	Very high	113 Å²	113	48.9 Å²	48.9	53%	0.528	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	143.5	-179	69	-178.4	-160.7	0	0	111.7	T412 C413 I414	T412-E423 HydrophobicContact CG2-CB 3.89Å; T412-E423 HydrophobicContact CG2-CG 4.33Å; C413-E423 VanDerWaalsContact O-CA 3.24Å; C413-E423 WeakPolarHBondContact O-CA 3.16Å; C413-E423 WeakPolarHBondContact O-CB 3.44Å; I414-E423 HydrophobicContact CG1-CB 4.04Å
424	D	97.2	Very high	91.8	Very high	47 Å²	47	53.3 Å²	53.3	25%	0.251	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.8	177.8	-171.5	15	0	0	0	110.3	I343 V345 T412 C413	I343-D424 HydrophobicContact CG2-CB 3.45Å; I343-D424 VanDerWaalsContact CG2-CB 3.45Å; V345-D424 HydrophobicContact CG1-CB 3.99Å; V345-D424 HydrophobicContact CG2-CB 4.38Å; V345-D424 WeakPolarHBondContact CG2-OD2 3.49Å; V345-D424 PolarHBondContact N-OD2 3.4Å; T412-D424 CarbonylContact C-O 3.46Å; T412-D424 WeakPolarHBondContact CA-O 3.47Å; C413-D424 PolarHBondContact N-O 3.42Å; C413-D424 PolarHBondContact O-N 2.92Å
425	I	97.1	Very high	89.9	Confident	79 Å²	79	60.7 Å²	60.7	41%	0.405	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122.2	-160.8	-57.3	176.3	0	0	0	110.3	A410 T412	A410-I425 HydrophobicContact CB-CG2 3.83Å; T412-I425 HydrophobicContact CG2-CG1 4.16Å
426	S	95	Very high	87.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.4	168.1	-177.3	0	0	0	0	110.4	P347 E348 L360 Y411	P347-S426 WeakPolarHBondContact O-CB 3.21Å; P347-S426 PolarHBondContact O-OG 2.73Å; E348-S426 CarbonylContact O-C 3.59Å; E348-S426 WeakPolarHBondContact O-CA 3.43Å; L360-S426 WeakPolarHBondContact CD2-OG 3.08Å; Y411-S426 PolarHBondContact N-O 3.36Å; Y411-S426 PolarHBondContact O-N 2.98Å
427	S	94.2	Very high	85.9	Confident	33 Å²	33	60.2 Å²	60.2	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.5	-179.1	-63.1	0	0	0	0	111.6	E348 S349 Q350	E348-S427 PolarHBondContact O-N 3.12Å; S349-S427 CarbonylContact C-O 3.55Å; S349-S427 VanDerWaalsContact CA-O 3.3Å; S349-S427 WeakPolarHBondContact CA-O 3.3Å; Q350-S427 PolarHBondContact N-O 2.81Å
428	L	94.6	Very high	84	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.3	172.8	176.8	63.1	0	0	0	109.8	Q350 R352 A358 I400 D407 T408 G409 Y411 V430	Q350-L428 HydrophobicContact CG-CD1 3.68Å; R352-L428 HydrophobicContact CB-CD1 4.22Å; R352-L428 HydrophobicContact CG-CD1 3.97Å; A358-L428 HydrophobicContact CB-CD1 4.04Å; A358-L428 HydrophobicContact CB-CD2 4.24Å; I400-L428 HydrophobicContact CD1-CD2 3.7Å; D407-L428 HydrophobicContact CB-CD2 4.25Å; T408-L428 VanDerWaalsContact CA-O 3.28Å; T408-L428 WeakPolarHBondContact CA-O 3.34Å; T408-L428 WeakPolarHBondContact CG2-O 3.06Å; G409-L428 PolarHBondContact N-O 2.71Å; G409-L428 PolarHBondContact O-N 3.23Å; Y411-L428 HydrophobicContact CD2-CB 4.15Å; Y411-L428 HydrophobicContact CE2-CB 3.87Å; Y411-L428 HydrophobicContact CE2-CD2 4.06Å; L428-V430 HydrophobicContact CG-CG2 4.34Å
429	F	92	Very high	82.2	Confident	90 Å²	90	59.4 Å²	59.4	40%	0.395	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.1	172.3	-60.8	-81.6	0	0	0	110.3	S349 Q350 A351 R352 T408	S349-F429 WeakPolarHBondContact OG-CE2 3.42Å; Q350-F429 PolarHBondContact O-N 2.88Å; A351-F429 CarbonylContact C-O 3.53Å; A351-F429 VanDerWaalsContact CA-O 3.31Å; A351-F429 WeakPolarHBondContact CA-O 3.28Å; A351-F429 HydrophobicContact CB-CB 4.39Å; R352-F429 PolarHBondContact N-O 3.25Å; T408-F429 HydrophobicContact CG2-CD1 4.37Å
430	V	91.7	Very high	80.3	Confident	9 Å²	9	62.5 Å²	62.5	6%	0.055	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	111.2	177.4	-171.5	0	0	0	0	109.1	R352 P354 V403 R404 Y405 T408 L428	R352-V430 VanDerWaalsContact O-CA 3.29Å; R352-V430 WeakPolarHBondContact O-CA 3.46Å; P354-V430 HydrophobicContact CB-CG1 4.47Å; P354-V430 HydrophobicContact CG-CG1 3.88Å; V403-V430 HydrophobicContact CG1-CB 4.03Å; V403-V430 HydrophobicContact CG1-CG1 3.7Å; V403-V430 HydrophobicContact CG1-CG2 3.14Å; R404-V430 WeakPolarHBondContact O-CG2 3.47Å; Y405-V430 HydrophobicContact CD1-CB 4.41Å; Y405-V430 HydrophobicContact CD1-CG1 4.25Å; Y405-V430 WeakPolarHBondContact CD1-O 3.02Å; Y405-V430 WeakPolarHBondContact CE1-O 3.38Å; T408-V430 WeakPolarHBondContact OG1-CB 3.47Å; T408-V430 WeakPolarHBondContact OG1-CG2 3.4Å; T408-V430 PolarHBondContact OG1-N 2.91Å; L428-V430 HydrophobicContact CG-CG2 4.34Å
431	E	86.8	Confident	78.4	Confident	53 Å²	53	66.2 Å²	66.2	25%	0.248	36%	0.359	C	S	.	.			trans	-138.4	150.5	-173.2	-59.7	-164.6	141.7	0	0	111.7	R352 R435	R352-E431 PolarHBondContact O-N 2.82Å; E431-R435 IonicContact OE1-CZ 3.98Å; E431-R435 IonicContact OE1-NH1 3.1Å; E431-R435 PolarHBondContact OE1-NH1 2.8Å
432	D	80.6	Confident	76.1	Confident	98 Å²	98	66.6 Å²	66.6	52%	0.524	36%	0.358	S	S	.	.			trans	-73.4	152.3	174.1	-75.6	-26.8	0	0	0	112.6	Y405 A434 R435	Y405-D432 PolarHBondContact OH-OD1 2.97Å; Y405-D432 PolarHBondContact OH-OD2 2.88Å; D432-A434 PolarHBondContact O-N 2.95Å; D432-R435 PolarHBondContact O-N 3.14Å
433	S	66.3	Low	74	Confident	62 Å²	62	70.5 Å²	70.5	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-51.6	-31.5	-172	-42.2	0	0	0	0	115.7	E353 R435 K436 T437	E353-S433 VanDerWaalsContact CD-OG 3.29Å; E353-S433 WeakPolarHBondContact OE1-CA 3.37Å; E353-S433 WeakPolarHBondContact OE1-CB 3.35Å; E353-S433 PolarHBondContact OE1-OG 3.07Å; S433-R435 PolarHBondContact O-N 3.37Å; S433-R435 VanDerWaalsContact O-N 3.16Å; S433-K436 PolarHBondContact O-N 3.44Å; S433-K436 VanDerWaalsContact O-N 3.09Å; S433-T437 PolarHBondContact O-N 3.22Å; S433-T437 PolarHBondContact O-OG1 3.15Å
434	A	60.1	Low	71.8	Confident	92 Å²	92	74.5 Å²	74.5	76%	0.76	38%	0.379	S	S	*	.	H	α-helix	trans	-60.2	-28	-176.7	0	0	0	0	0	113.2	D432	D432-A434 PolarHBondContact O-N 2.95Å
435	R	58.7	Low	69.4	Low	163 Å²	163	79.5 Å²	79.5	62%	0.615	40%	0.401	S	S	*	.	H	α-helix	trans	-85.6	-35.5	174.9	-118.8	-179.1	-176.4	-175.4	1.3	112.7	E431 D432 S433 T437 L438 A439	E431-R435 IonicContact OE1-CZ 3.98Å; E431-R435 IonicContact OE1-NH1 3.1Å; E431-R435 PolarHBondContact OE1-NH1 2.8Å; D432-R435 PolarHBondContact O-N 3.14Å; S433-R435 PolarHBondContact O-N 3.37Å; S433-R435 VanDerWaalsContact O-N 3.16Å; R435-T437 VanDerWaalsContact C-N 3.33Å; R435-T437 PolarHBondContact O-N 3.33Å; R435-L438 PolarHBondContact O-N 3.01Å; R435-A439 WeakPolarHBondContact O-CB 3.46Å; R435-A439 PolarHBondContact O-N 3.21Å
436	K	54.1	Low	67.2	Low	39 Å²	39	81.5 Å²	81.5	17%	0.17	41%	0.409	C	S	.	.	H	α-helix	trans	-59.7	-38.6	178.5	-90.7	-173.8	172.7	-174.1	0	113.2	A351 E353 S433 A439 N440	A351-K436 WeakPolarHBondContact O-CE 3.2Å; A351-K436 PolarHBondContact O-NZ 3.45Å; A351-K436 VanDerWaalsContact O-NZ 3.15Å; E353-K436 HydrophobicContact CG-CD 3.96Å; S433-K436 PolarHBondContact O-N 3.44Å; S433-K436 VanDerWaalsContact O-N 3.09Å; K436-A439 PolarHBondContact O-N 3.39Å; K436-N440 VanDerWaalsContact O-CB 3.23Å; K436-N440 WeakPolarHBondContact O-CB 3.26Å; K436-N440 PolarHBondContact O-N 3.07Å; K436-N440 PolarHBondContact O-ND2 2.71Å
437	T	58.7	Low	65	Low	87 Å²	87	82.7 Å²	82.7	53%	0.534	42%	0.421	S	S	.	.	H	α-helix	trans	-63.2	-44.8	178.1	-47.8	0	0	0	0	111	S433 R435 I441	S433-T437 PolarHBondContact O-N 3.22Å; S433-T437 PolarHBondContact O-OG1 3.15Å; R435-T437 VanDerWaalsContact C-N 3.33Å; R435-T437 PolarHBondContact O-N 3.33Å; T437-I441 HydrophobicContact CG2-CD1 3.95Å; T437-I441 WeakPolarHBondContact O-CB 3.47Å; T437-I441 WeakPolarHBondContact O-CD1 3.3Å; T437-I441 WeakPolarHBondContact O-CG1 3.47Å; T437-I441 PolarHBondContact O-N 2.96Å
438	L	57.1	Low	62.7	Low	114 Å²	114	85.7 Å²	85.7	60%	0.597	43%	0.434	S	S	*	.	H	α-helix	trans	-64.6	-45.6	177.2	-164.8	82.9	0	0	0	111.2	R435 I441 L442	R435-L438 PolarHBondContact O-N 3.01Å; L438-I441 PolarHBondContact O-N 2.86Å; L438-L442 HydrophobicContact CD2-CD1 4.31Å; L438-L442 HydrophobicContact CG-CD1 4.05Å; L438-L442 WeakPolarHBondContact O-CB 3.47Å; L438-L442 PolarHBondContact O-N 3.03Å
439	A	55.3	Low	60.7	Low	31 Å²	31	88.6 Å²	88.6	26%	0.256	46%	0.463	S	S	.	.	H	α-helix	trans	-59.5	-53.6	176.9	0	0	0	0	0	110.6	R435 K436 I441 L442 W443	R435-A439 WeakPolarHBondContact O-CB 3.46Å; R435-A439 PolarHBondContact O-N 3.21Å; K436-A439 PolarHBondContact O-N 3.39Å; A439-I441 PolarHBondContact O-N 3.44Å; A439-L442 CarbonylContact O-C 3.53Å; A439-L442 WeakPolarHBondContact O-CA 3.47Å; A439-L442 WeakPolarHBondContact O-CB 3.48Å; A439-L442 PolarHBondContact O-N 2.97Å; A439-W443 VanDerWaalsContact O-CG 3.31Å; A439-W443 PolarHBondContact O-N 2.98Å
440	N	55.8	Low	59.1	Low	80 Å²	80	86.2 Å²	86.2	43%	0.428	46%	0.455	S	S	.	.	H	α-helix	trans	-62.3	-27.5	179.9	-70.2	-12.4	0	0	0	113.5	K436 R444	K436-N440 VanDerWaalsContact O-CB 3.23Å; K436-N440 WeakPolarHBondContact O-CB 3.26Å; K436-N440 PolarHBondContact O-N 3.07Å; K436-N440 PolarHBondContact O-ND2 2.71Å; N440-R444 WeakPolarHBondContact O-CB 3.2Å; N440-R444 VanDerWaalsContact O-CG 3.31Å; N440-R444 WeakPolarHBondContact O-CG 3.4Å; N440-R444 PolarHBondContact O-N 2.79Å
441	I	56.6	Low	58.1	Low	83 Å²	83	87.7 Å²	87.7	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-69.8	-49.7	170.4	-70.1	164.6	0	0	0	109.5	T437 L438 A439 R444 E445	T437-I441 HydrophobicContact CG2-CD1 3.95Å; T437-I441 WeakPolarHBondContact O-CB 3.47Å; T437-I441 WeakPolarHBondContact O-CD1 3.3Å; T437-I441 WeakPolarHBondContact O-CG1 3.47Å; T437-I441 PolarHBondContact O-N 2.96Å; L438-I441 PolarHBondContact O-N 2.86Å; A439-I441 PolarHBondContact O-N 3.44Å; I441-R444 PolarHBondContact O-N 2.94Å; I441-E445 WeakPolarHBondContact O-CG 3.35Å; I441-E445 PolarHBondContact O-N 3.02Å
442	L	50.7	Low	58	Low	73 Å²	73	86.8 Å²	86.8	38%	0.382	47%	0.468	S	S	.	.	H	α-helix	trans	-60.8	-46.5	176.6	-89.9	146.6	0	0	0	113.1	L438 A439 R444 E445 E446	L438-L442 HydrophobicContact CD2-CD1 4.31Å; L438-L442 HydrophobicContact CG-CD1 4.05Å; L438-L442 WeakPolarHBondContact O-CB 3.47Å; L438-L442 PolarHBondContact O-N 3.03Å; A439-L442 CarbonylContact O-C 3.53Å; A439-L442 WeakPolarHBondContact O-CA 3.47Å; A439-L442 WeakPolarHBondContact O-CB 3.48Å; A439-L442 PolarHBondContact O-N 2.97Å; L442-R444 PolarHBondContact O-N 2.73Å; L442-E445 CarbonylContact O-C 3.54Å; L442-E445 PolarHBondContact O-N 2.78Å; L442-E445 VanDerWaalsContact O-N 3.07Å; L442-E446 WeakPolarHBondContact O-CB 3.49Å; L442-E446 PolarHBondContact O-N 2.87Å
443	W	53.3	Low	58.6	Low	135 Å²	135	82.4 Å²	82.4	51%	0.511	45%	0.445	S	S	.	.	H	α-helix	trans	-60	-32.9	177.6	-65.7	114.5	0	0	0	112.1	A439 G447 L448	A439-W443 VanDerWaalsContact O-CG 3.31Å; A439-W443 PolarHBondContact O-N 2.98Å; W443-G447 PolarHBondContact O-N 2.86Å; W443-L448 HydrophobicContact CE3-CB 3.44Å; W443-L448 VanDerWaalsContact CE3-CB 3.44Å; W443-L448 HydrophobicContact CE3-CD1 3.57Å; W443-L448 HydrophobicContact CE3-CG 4.07Å; W443-L448 HydrophobicContact CZ3-CB 3.98Å; W443-L448 HydrophobicContact CZ3-CD1 3.68Å; W443-L448 HydrophobicContact CZ3-CD2 4.46Å; W443-L448 HydrophobicContact CZ3-CG 4.26Å; W443-L448 PolarHBondContact O-N 3.48Å
444	R	51.1	Low	60	Low	196 Å²	196	79.5 Å²	79.5	74%	0.74	42%	0.424	S	S	*	.	H	α-helix	trans	-75.8	-39.2	173	-76.4	-176.4	178.8	114.9	-4.6	112.3	N440 I441 L442 G447	N440-R444 WeakPolarHBondContact O-CB 3.2Å; N440-R444 VanDerWaalsContact O-CG 3.31Å; N440-R444 WeakPolarHBondContact O-CG 3.4Å; N440-R444 PolarHBondContact O-N 2.79Å; I441-R444 PolarHBondContact O-N 2.94Å; L442-R444 PolarHBondContact O-N 2.73Å; R444-G447 PolarHBondContact O-N 2.91Å
445	E	48.4	Very low	61.8	Low	152 Å²	152	75.1 Å²	75.1	71%	0.71	39%	0.388	S	S	*	.	H	α-helix	trans	-68.2	-33.5	176.2	-75.3	-176	168	0	0	112.7	I441 L442	I441-E445 WeakPolarHBondContact O-CG 3.35Å; I441-E445 PolarHBondContact O-N 3.02Å; L442-E445 CarbonylContact O-C 3.54Å; L442-E445 PolarHBondContact O-N 2.78Å; L442-E445 VanDerWaalsContact O-N 3.07Å
446	E	50.6	Low	63.6	Low	121 Å²	121	67.3 Å²	67.3	57%	0.565	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-2.8	178.5	-69.4	-177.9	166.7	0	0	113.6	L442 L448	L442-E446 WeakPolarHBondContact O-CB 3.49Å; L442-E446 PolarHBondContact O-N 2.87Å; E446-L448 HydrophobicContact CB-CD1 3.71Å; E446-L448 HydrophobicContact CB-CG 4.16Å; E446-L448 PolarHBondContact O-N 2.92Å; E446-L448 WeakPolarHBondContact OE2-CD1 3.3Å
447	G	48	Very low	65.7	Low	25 Å²	25	65.5 Å²	65.5	26%	0.258	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	13.5	179	0	0	0	0	0	114.9	W443 R444 G449 I450	W443-G447 PolarHBondContact O-N 2.86Å; R444-G447 PolarHBondContact O-N 2.91Å; G447-G449 VanDerWaalsContact C-N 3.26Å; G447-G449 PolarHBondContact O-N 2.91Å; G447-I450 WeakPolarHBondContact O-CD1 3.4Å; G447-I450 VanDerWaalsContact O-CG1 3.3Å; G447-I450 WeakPolarHBondContact O-CG1 3.5Å
448	L	46.6	Very low	67.5	Low	97 Å²	97	61.6 Å²	61.6	51%	0.508	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-7.3	-177.3	-72.7	157.4	0	0	0	113.4	W443 E446	W443-L448 HydrophobicContact CE3-CB 3.44Å; W443-L448 VanDerWaalsContact CE3-CB 3.44Å; W443-L448 HydrophobicContact CE3-CD1 3.57Å; W443-L448 HydrophobicContact CE3-CG 4.07Å; W443-L448 HydrophobicContact CZ3-CB 3.98Å; W443-L448 HydrophobicContact CZ3-CD1 3.68Å; W443-L448 HydrophobicContact CZ3-CD2 4.46Å; W443-L448 HydrophobicContact CZ3-CG 4.26Å; W443-L448 PolarHBondContact O-N 3.48Å; E446-L448 HydrophobicContact CB-CD1 3.71Å; E446-L448 HydrophobicContact CB-CG 4.16Å; E446-L448 PolarHBondContact O-N 2.92Å; E446-L448 WeakPolarHBondContact OE2-CD1 3.3Å
449	G	51.8	Low	69.4	Low	60 Å²	60	57.1 Å²	57.1	62%	0.619	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	15	175.8	0	0	0	0	0	115.6	G447	G447-G449 VanDerWaalsContact C-N 3.26Å; G447-G449 PolarHBondContact O-N 2.91Å
450	I	58.1	Low	71.3	Confident	41 Å²	41	59.1 Å²	59.1	21%	0.21	31%	0.309	C	S	.	.			trans	-90.9	-1	-170.8	-62	175.1	0	0	0	113.3	G447 V529 Q530	G447-I450 WeakPolarHBondContact O-CD1 3.4Å; G447-I450 VanDerWaalsContact O-CG1 3.3Å; G447-I450 WeakPolarHBondContact O-CG1 3.5Å; I450-V529 HydrophobicContact CG2-CG1 4.2Å; I450-V529 WeakPolarHBondContact CG2-O 3.29Å; I450-Q530 WeakPolarHBondContact CD1-O 3.16Å
451	G	70.8	Confident	73.2	Confident	39 Å²	39	55.3 Å²	55.3	40%	0.402	29%	0.289	S	S	.	.			trans	-78.5	146.7	178	0	0	0	0	0	114.1
452	N	86.4	Confident	75.1	Confident	34 Å²	34	51.4 Å²	51.4	18%	0.182	27%	0.269	C	S	.	.	S	Bend	trans	76.6	62.8	172.2	-56.8	-44.4	0	0	0	116.5	Y346 P467 W843 V844 G845 D846	Y346-N452 PolarHBondContact OH-ND2 3.33Å; N452-P467 WeakPolarHBondContact O-CD 3.32Å; N452-W843 VanDerWaalsContact C-CZ3 3.48Å; N452-W843 HydrophobicContact CB-CH2 3.5Å; N452-W843 VanDerWaalsContact CB-CH2 3.5Å; N452-W843 HydrophobicContact CB-CZ2 3.51Å; N452-W843 VanDerWaalsContact O-CH2 3.3Å; N452-W843 WeakPolarHBondContact O-CH2 3.14Å; N452-W843 WeakPolarHBondContact OD1-CZ2 3.21Å; N452-V844 CarbonylContact C-O 3.59Å; N452-V844 WeakPolarHBondContact CA-O 3.44Å; N452-V844 PolarHBondContact N-O 2.8Å; N452-V844 VanDerWaalsContact N-O 3.09Å; N452-G845 WeakPolarHBondContact OD1-CA 3.32Å; N452-D846 PolarHBondContact OD1-N 2.93Å
453	M	92.6	Very high	77.3	Confident	7 Å²	7	48.9 Å²	48.9	3%	0.034	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.8	-174.6	-60.5	-61	-68.9	0	0	111.9	Y455 V464 I465 Q466 Q473 W843 V844	M453-Y455 HydrophobicContact CB-CD2 4.45Å; M453-Y455 HydrophobicContact CB-CE2 4.09Å; M453-V464 HydrophobicContact CB-CG1 3.93Å; M453-V464 HydrophobicContact CE-CG1 3.69Å; M453-V464 HydrophobicContact CG-CG1 4.31Å; M453-I465 WeakPolarHBondContact CE-O 3.5Å; M453-Q466 HydrophobicContact CE-CB 3.73Å; M453-Q466 VanDerWaalsContact SD-CA 3.58Å; M453-Q466 HydrophobicContact SD-CB 3.68Å; M453-Q466 HydrophobicContact SD-CG 3.97Å; M453-Q473 HydrophobicContact CE-CB 3.63Å; M453-Q473 HydrophobicContact CE-CG 3.28Å; M453-Q473 HydrophobicContact SD-CG 4.34Å; M453-W843 VanDerWaalsContact C-CE3 3.49Å; M453-W843 VanDerWaalsContact O-CE3 3.28Å; M453-V844 PolarHBondContact N-O 3.36Å; M453-V844 PolarHBondContact O-N 3.29Å
454	F	95.7	Very high	79.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129.1	164.7	-74	-78.1	0	0	0	110	V464 I465 P467 Q801 M811 V841 V842 W843	F454-V464 CarbonylContact O-C 3.53Å; F454-V464 WeakPolarHBondContact O-CA 3.44Å; F454-I465 HydrophobicContact CB-CB 4.39Å; F454-I465 PolarHBondContact N-O 3.42Å; F454-I465 PolarHBondContact O-N 3.43Å; F454-P467 HydrophobicContact CD2-CB 4Å; F454-P467 HydrophobicContact CD2-CG 4.28Å; F454-P467 HydrophobicContact CE2-CB 3.88Å; F454-P467 HydrophobicContact CE2-CG 4.21Å; F454-Q801 HydrophobicContact CD1-CG 4.39Å; F454-Q801 HydrophobicContact CE1-CB 4.22Å; F454-Q801 HydrophobicContact CE1-CG 3.96Å; F454-M811 HydrophobicContact CB-CE 3.51Å; F454-M811 HydrophobicContact CB-SD 3.88Å; F454-M811 HydrophobicContact CD1-CB 3.85Å; F454-M811 HydrophobicContact CD1-CE 4.27Å; F454-M811 HydrophobicContact CD1-SD 4.15Å; F454-M811 HydrophobicContact CD2-CB 4.42Å; F454-M811 HydrophobicContact CD2-CE 3.63Å; F454-M811 HydrophobicContact CE1-CB 3.67Å; F454-M811 HydrophobicContact CE2-CB 4.26Å; F454-M811 HydrophobicContact CE2-CE 4.4Å; F454-M811 HydrophobicContact CG-CB 4.22Å; F454-M811 HydrophobicContact CG-CE 3.54Å; F454-M811 HydrophobicContact CG-SD 3.95Å; F454-M811 HydrophobicContact CZ-CB 3.89Å; F454-V841 HydrophobicContact CD1-CG1 3.82Å; F454-V842 WeakPolarHBondContact CA-O 3.42Å; F454-W843 HydrophobicContact CD1-CB 4.47Å; F454-W843 AromaticContact CD1-CE3 3.91Å; F454-W843 HydrophobicContact CD1-CE3 3.91Å; F454-W843 AromaticContact CD2-CE3 3.82Å; F454-W843 HydrophobicContact CD2-CE3 3.82Å; F454-W843 AromaticContact CD2-CZ3 3.76Å; F454-W843 HydrophobicContact CD2-CZ3 3.76Å; F454-W843 HydrophobicContact CE1-CB 4.3Å; F454-W843 AromaticContact CE1-CE3 3.86Å; F454-W843 HydrophobicContact CE1-CE3 3.86Å; F454-W843 AromaticContact CE2-CE3 3.77Å; F454-W843 HydrophobicContact CE2-CE3 3.77Å; F454-W843 AromaticContact CE2-CZ3 3.7Å; F454-W843 HydrophobicContact CE2-CZ3 3.7Å; F454-W843 AromaticContact CG-CE3 3.9Å; F454-W843 HydrophobicContact CG-CE3 3.9Å; F454-W843 HydrophobicContact CG-CZ3 4.26Å; F454-W843 AromaticContact CZ-CE3 3.79Å; F454-W843 HydrophobicContact CZ-CE3 3.79Å; F454-W843 HydrophobicContact CZ-CZ3 4.15Å
455	Y	97	Very high	81.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.7	168.2	-75.6	-109.4	0	0	0	108.4	M453 V462 V464 I514 V527 V841 V842 V844	M453-Y455 HydrophobicContact CB-CD2 4.45Å; M453-Y455 HydrophobicContact CB-CE2 4.09Å; Y455-V462 HydrophobicContact CD1-CG1 4.31Å; Y455-V464 HydrophobicContact CD1-CG1 4.44Å; Y455-V464 HydrophobicContact CD1-CG2 3.73Å; Y455-V464 HydrophobicContact CD2-CG1 4.23Å; Y455-V464 HydrophobicContact CE1-CB 4.47Å; Y455-V464 HydrophobicContact CE1-CG1 4.09Å; Y455-V464 HydrophobicContact CE1-CG2 3.53Å; Y455-V464 HydrophobicContact CE2-CG1 3.84Å; Y455-V464 HydrophobicContact CG-CG2 4.42Å; Y455-I514 HydrophobicContact CD1-CD1 3.34Å; Y455-I514 HydrophobicContact CD2-CD1 3.56Å; Y455-I514 HydrophobicContact CE1-CD1 3.72Å; Y455-I514 HydrophobicContact CE2-CD1 3.94Å; Y455-I514 HydrophobicContact CG-CD1 3.25Å; Y455-V527 HydrophobicContact CE1-CG1 4.44Å; Y455-V841 WeakPolarHBondContact O-CA 3.33Å; Y455-V842 PolarHBondContact N-O 3.44Å; Y455-V842 PolarHBondContact O-N 2.99Å; Y455-V844 HydrophobicContact CD2-CB 4.11Å; Y455-V844 HydrophobicContact CD2-CG2 3.72Å; Y455-V844 HydrophobicContact CE2-CB 3.9Å; Y455-V844 HydrophobicContact CE2-CG1 4.5Å; Y455-V844 HydrophobicContact CE2-CG2 3.82Å
456	V	97.8	Very high	83.2	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.5	-175.9	-175.2	0	0	0	0	109	V462 K463 I465 M811 L818 V835 V841	V456-V462 CarbonylContact O-C 3.59Å; V456-V462 WeakPolarHBondContact O-CA 3.33Å; V456-K463 PolarHBondContact N-O 2.85Å; V456-K463 PolarHBondContact O-N 2.9Å; V456-I465 HydrophobicContact CG2-CD1 3.79Å; V456-M811 HydrophobicContact CG2-CE 4.4Å; V456-M811 HydrophobicContact CG2-SD 3.48Å; V456-M811 WeakPolarHBondContact CG2-SD 3.25Å; V456-L818 HydrophobicContact CB-CD1 4.09Å; V456-L818 HydrophobicContact CG1-CD1 3.7Å; V456-L818 HydrophobicContact CG1-CD2 3.94Å; V456-L818 HydrophobicContact CG1-CG 4.4Å; V456-L818 HydrophobicContact CG2-CD1 3.73Å; V456-V835 HydrophobicContact CG1-CG1 4.17Å; V456-V841 HydrophobicContact CG1-CG2 4.13Å; V456-V841 HydrophobicContact CG2-CG1 4.25Å; V456-V841 HydrophobicContact CG2-CG2 4.23Å
457	F	98	Very high	85.2	Confident	1 Å²	1	22.6 Å²	22.6	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	117.4	178.5	-56	-97.2	0	0	0	107.9	V462 W503 A506 I514 V516 V527 T840 V842	F457-V462 HydrophobicContact CD1-CB 4.27Å; F457-V462 HydrophobicContact CD1-CG1 3.84Å; F457-V462 HydrophobicContact CD1-CG2 3.48Å; F457-V462 VanDerWaalsContact CD1-CG2 3.48Å; F457-V462 HydrophobicContact CE1-CB 4.4Å; F457-V462 HydrophobicContact CE1-CG1 3.74Å; F457-V462 HydrophobicContact CE1-CG2 3.71Å; F457-V462 HydrophobicContact CG-CG1 4.3Å; F457-V462 HydrophobicContact CG-CG2 4.43Å; F457-V462 HydrophobicContact CZ-CG1 4.13Å; F457-W503 HydrophobicContact CB-CB 4.11Å; F457-W503 HydrophobicContact CB-CD2 3.82Å; F457-W503 HydrophobicContact CB-CG 3.61Å; F457-W503 HydrophobicContact CD1-CD2 4.26Å; F457-W503 HydrophobicContact CD1-CE3 4.28Å; F457-W503 HydrophobicContact CD1-CH2 4.36Å; F457-W503 HydrophobicContact CD1-CZ2 4.37Å; F457-W503 HydrophobicContact CD1-CZ3 4.31Å; F457-W503 HydrophobicContact CG-CD2 4.49Å; F457-A506 HydrophobicContact CD2-CB 4.12Å; F457-A506 HydrophobicContact CE2-CB 3.87Å; F457-A506 HydrophobicContact CZ-CB 4.49Å; F457-I514 HydrophobicContact CE2-CG2 4.04Å; F457-I514 HydrophobicContact CZ-CG2 3.73Å; F457-V516 HydrophobicContact CB-CG2 4.46Å; F457-V516 HydrophobicContact CD1-CB 4.04Å; F457-V516 HydrophobicContact CD1-CG1 3.94Å; F457-V516 HydrophobicContact CD1-CG2 3.69Å; F457-V516 HydrophobicContact CD2-CG2 4.37Å; F457-V516 HydrophobicContact CE1-CB 3.76Å; F457-V516 HydrophobicContact CE1-CG1 3.53Å; F457-V516 HydrophobicContact CE1-CG2 3.96Å; F457-V516 HydrophobicContact CG-CG2 3.93Å; F457-V516 HydrophobicContact CZ-CB 4.03Å; F457-V516 HydrophobicContact CZ-CG1 4.18Å; F457-V516 HydrophobicContact CZ-CG2 4.4Å; F457-V527 HydrophobicContact CE1-CG2 4.23Å; F457-V527 HydrophobicContact CZ-CG2 4.48Å; F457-T840 HydrophobicContact CB-CG2 4.04Å; F457-T840 HydrophobicContact CD2-CG2 3.9Å; F457-T840 HydrophobicContact CG-CG2 4.23Å; F457-T840 PolarHBondContact N-O 3.48Å; F457-V842 HydrophobicContact CE2-CG2 4.44Å
458	Y	96.9	Very high	87	Confident	5 Å²	5	25.6 Å²	25.6	2%	0.02	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	177.9	-169.4	80.4	-72.3	0	0	0	110.9	D460 G461 K463 H475 W503 V835 Q836	Y458-D460 HydrophobicContact CD2-CB 4.31Å; Y458-D460 HydrophobicContact CE2-CB 3.52Å; Y458-D460 PolarHBondContact O-N 2.87Å; Y458-D460 PolarHBondContact OH-O 3.42Å; Y458-D460 VanDerWaalsContact OH-O 3.13Å; Y458-D460 PolarHBondContact OH-OD2 3.06Å; Y458-G461 VanDerWaalsContact CD1-O 3.22Å; Y458-G461 WeakPolarHBondContact CD1-O 3.39Å; Y458-G461 PolarHBondContact N-O 2.97Å; Y458-G461 PolarHBondContact O-N 3.33Å; Y458-G461 VanDerWaalsContact O-N 3.08Å; Y458-G461 VanDerWaalsContact O-O 3.11Å; Y458-K463 HydrophobicContact CD1-CD 4.4Å; Y458-K463 HydrophobicContact CD1-CG 4.4Å; Y458-K463 HydrophobicContact CE1-CB 4.15Å; Y458-K463 HydrophobicContact CE1-CD 3.71Å; Y458-K463 HydrophobicContact CE1-CG 3.6Å; Y458-K463 HydrophobicContact CE2-CD 4.46Å; Y458-K463 VanDerWaalsContact OH-CE 3.26Å; Y458-K463 WeakPolarHBondContact OH-CE 3.4Å; Y458-H475 AromaticContact CZ-NE2 3.99Å; Y458-H475 PolarHBondContact OH-NE2 3.15Å; Y458-W503 VanDerWaalsContact N-CD1 3.34Å; Y458-W503 PolarHBondContact O-NE1 2.81Å; Y458-V835 HydrophobicContact CD1-CG1 4.48Å; Y458-V835 HydrophobicContact CD2-CB 4.45Å; Y458-V835 HydrophobicContact CD2-CG1 3.82Å; Y458-V835 HydrophobicContact CG-CG1 3.76Å; Y458-Q836 WeakPolarHBondContact CB-O 3.47Å
459	D	95.4	Very high	88.8	Confident	19 Å²	19	26.3 Å²	26.3	10%	0.102	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.8	-171.4	-80.5	-0.6	0	0	0	114.5	R500 C501 Q836 K837	D459-R500 CarbonylContact O-C 3.55Å; D459-R500 WeakPolarHBondContact O-CA 3.4Å; D459-C501 PolarHBondContact O-N 3.31Å; D459-Q836 HydrophobicContact CB-CB 4.28Å; D459-Q836 PolarHBondContact N-O 3.34Å; D459-Q836 VanDerWaalsContact N-O 3.12Å; D459-K837 WeakPolarHBondContact OD1-CB 3.16Å; D459-K837 WeakPolarHBondContact OD1-CD 3.34Å
460	D	95.7	Very high	90.6	Very high	74 Å²	74	24.9 Å²	24.9	40%	0.396	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	39.3	179.9	173.3	54.8	0	0	0	111.9	Y458 H475 P478	Y458-D460 HydrophobicContact CD2-CB 4.31Å; Y458-D460 HydrophobicContact CE2-CB 3.52Å; Y458-D460 PolarHBondContact O-N 2.87Å; Y458-D460 PolarHBondContact OH-O 3.42Å; Y458-D460 VanDerWaalsContact OH-O 3.13Å; Y458-D460 PolarHBondContact OH-OD2 3.06Å; D460-H475 PolarHBondContact O-NE2 2.85Å; D460-H475 IonicContact OD2-CE1 3.26Å; D460-H475 PolarHBondContact OD2-CE1 2.99Å; D460-H475 VanDerWaalsContact OD2-CE1 3.32Å; D460-H475 IonicContact OD2-NE2 2.75Å; D460-P478 WeakPolarHBondContact O-CD 3.43Å
461	G	96.3	Very high	91.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	102.7	-135.7	170.1	0	0	0	0	0	113.8	Y458 I476	Y458-G461 VanDerWaalsContact CD1-O 3.22Å; Y458-G461 WeakPolarHBondContact CD1-O 3.39Å; Y458-G461 PolarHBondContact N-O 2.97Å; Y458-G461 PolarHBondContact O-N 3.33Å; Y458-G461 VanDerWaalsContact O-N 3.08Å; Y458-G461 VanDerWaalsContact O-O 3.11Å; G461-I476 WeakPolarHBondContact CA-O 3.43Å
462	V	96.9	Very high	92.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.3	-176	-165.7	0	0	0	0	110.8	Y455 V456 F457 H475 I476 W503	Y455-V462 HydrophobicContact CD1-CG1 4.31Å; V456-V462 CarbonylContact O-C 3.59Å; V456-V462 WeakPolarHBondContact O-CA 3.33Å; F457-V462 HydrophobicContact CD1-CB 4.27Å; F457-V462 HydrophobicContact CD1-CG1 3.84Å; F457-V462 HydrophobicContact CD1-CG2 3.48Å; F457-V462 VanDerWaalsContact CD1-CG2 3.48Å; F457-V462 HydrophobicContact CE1-CB 4.4Å; F457-V462 HydrophobicContact CE1-CG1 3.74Å; F457-V462 HydrophobicContact CE1-CG2 3.71Å; F457-V462 HydrophobicContact CG-CG1 4.3Å; F457-V462 HydrophobicContact CG-CG2 4.43Å; F457-V462 HydrophobicContact CZ-CG1 4.13Å; V462-H475 CarbonylContact O-C 3.47Å; V462-H475 WeakPolarHBondContact O-CA 3.43Å; V462-I476 HydrophobicContact CB-CB 4.08Å; V462-I476 HydrophobicContact CB-CD1 4.33Å; V462-I476 HydrophobicContact CB-CG1 4.48Å; V462-I476 HydrophobicContact CG2-CB 4.44Å; V462-I476 PolarHBondContact N-O 2.03Å; V462-I476 PolarHBondContact O-N 3.41Å; V462-W503 HydrophobicContact CG2-CH2 4.35Å; V462-W503 HydrophobicContact CG2-CZ2 4.09Å
463	K	95.3	Very high	92.5	Very high	19 Å²	19	34.2 Å²	34.2	8%	0.083	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.8	174	-86.8	170.9	173.9	176.1	0	109.9	V456 Y458 I465 F472 E834 V835	V456-K463 PolarHBondContact N-O 2.85Å; V456-K463 PolarHBondContact O-N 2.9Å; Y458-K463 HydrophobicContact CD1-CD 4.4Å; Y458-K463 HydrophobicContact CD1-CG 4.4Å; Y458-K463 HydrophobicContact CE1-CB 4.15Å; Y458-K463 HydrophobicContact CE1-CD 3.71Å; Y458-K463 HydrophobicContact CE1-CG 3.6Å; Y458-K463 HydrophobicContact CE2-CD 4.46Å; Y458-K463 VanDerWaalsContact OH-CE 3.26Å; Y458-K463 WeakPolarHBondContact OH-CE 3.4Å; K463-I465 HydrophobicContact CB-CD1 4.38Å; K463-I465 HydrophobicContact CB-CG1 4.33Å; K463-F472 HydrophobicContact CD-CD1 4.29Å; K463-F472 HydrophobicContact CD-CE1 3.97Å; K463-E834 PolarHBondContact NZ-O 2.83Å; K463-V835 HydrophobicContact CD-CG2 3.95Å
464	V	94.3	Very high	92.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.4	175	-167.6	0	0	0	0	108.2	M453 F454 Y455 Q473 R474	M453-V464 HydrophobicContact CB-CG1 3.93Å; M453-V464 HydrophobicContact CE-CG1 3.69Å; M453-V464 HydrophobicContact CG-CG1 4.31Å; F454-V464 CarbonylContact O-C 3.53Å; F454-V464 WeakPolarHBondContact O-CA 3.44Å; Y455-V464 HydrophobicContact CD1-CG1 4.44Å; Y455-V464 HydrophobicContact CD1-CG2 3.73Å; Y455-V464 HydrophobicContact CD2-CG1 4.23Å; Y455-V464 HydrophobicContact CE1-CB 4.47Å; Y455-V464 HydrophobicContact CE1-CG1 4.09Å; Y455-V464 HydrophobicContact CE1-CG2 3.53Å; Y455-V464 HydrophobicContact CE2-CG1 3.84Å; Y455-V464 HydrophobicContact CG-CG2 4.42Å; V464-Q473 PolarHBondContact O-N 3.26Å; V464-R474 HydrophobicContact CB-CB 4.02Å; V464-R474 HydrophobicContact CG2-CB 3.91Å; V464-R474 HydrophobicContact CG2-CG 4.38Å; V464-R474 PolarHBondContact N-O 2.83Å
465	I	93.2	Very high	92.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.7	-163.8	-60.1	173.4	0	0	0	110.3	M453 F454 V456 K463 F472 M811 L818 I820 I832	M453-I465 WeakPolarHBondContact CE-O 3.5Å; F454-I465 HydrophobicContact CB-CB 4.39Å; F454-I465 PolarHBondContact N-O 3.42Å; F454-I465 PolarHBondContact O-N 3.43Å; V456-I465 HydrophobicContact CG2-CD1 3.79Å; K463-I465 HydrophobicContact CB-CD1 4.38Å; K463-I465 HydrophobicContact CB-CG1 4.33Å; I465-F472 HydrophobicContact CG1-CD1 4.25Å; I465-M811 HydrophobicContact CB-CE 4.37Å; I465-M811 HydrophobicContact CD1-CE 4.1Å; I465-M811 HydrophobicContact CG2-CE 4.15Å; I465-L818 HydrophobicContact CD1-CD1 3.55Å; I465-I820 HydrophobicContact CG2-CD1 3.94Å; I465-I832 HydrophobicContact CB-CD1 4.49Å; I465-I832 HydrophobicContact CD1-CD1 3.74Å; I465-I832 HydrophobicContact CG1-CD1 4.31Å; I465-I832 HydrophobicContact CG2-CD1 3.43Å; I465-I832 VanDerWaalsContact CG2-CD1 3.43Å
466	Q	90.4	Very high	92.2	Very high	48 Å²	48	40.2 Å²	40.2	22%	0.224	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.7	174.7	-171.9	179.2	-47	0	0	108.7	M453 T468 E469 C470 E471 Q473	M453-Q466 HydrophobicContact CE-CB 3.73Å; M453-Q466 VanDerWaalsContact SD-CA 3.58Å; M453-Q466 HydrophobicContact SD-CB 3.68Å; M453-Q466 HydrophobicContact SD-CG 3.97Å; Q466-T468 VanDerWaalsContact C-N 3.35Å; Q466-T468 PolarHBondContact O-N 3.32Å; Q466-E469 PolarHBondContact NE2-OE2 2.74Å; Q466-C470 WeakPolarHBondContact O-CA 3.48Å; Q466-C470 PolarHBondContact O-N 3.13Å; Q466-E471 PolarHBondContact N-O 2.78Å; Q466-E471 PolarHBondContact O-N 2.99Å; Q466-Q473 HydrophobicContact CB-CG 4.1Å
467	P	92.1	Very high	92.1	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.026	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-25.6	-167.3	28.8	-36.9	0	0	0	114.4	N452 F454 Y809 I820 N829 W843	N452-P467 WeakPolarHBondContact O-CD 3.32Å; F454-P467 HydrophobicContact CD2-CB 4Å; F454-P467 HydrophobicContact CD2-CG 4.28Å; F454-P467 HydrophobicContact CE2-CB 3.88Å; F454-P467 HydrophobicContact CE2-CG 4.21Å; P467-Y809 HydrophobicContact CB-CD1 4.43Å; P467-Y809 HydrophobicContact CB-CD2 3.62Å; P467-Y809 HydrophobicContact CB-CE2 4.26Å; P467-Y809 HydrophobicContact CB-CG 3.71Å; P467-Y809 HydrophobicContact CG-CD2 3.72Å; P467-Y809 HydrophobicContact CG-CE2 4.31Å; P467-Y809 HydrophobicContact CG-CG 4.28Å; P467-I820 HydrophobicContact CB-CD1 4.36Å; P467-I820 HydrophobicContact CB-CG2 4.26Å; P467-N829 PolarHBondContact O-ND2 3.02Å; P467-W843 HydrophobicContact CG-CH2 4.1Å; P467-W843 HydrophobicContact CG-CZ3 3.92Å
468	T	86.9	Confident	92	Very high	88 Å²	88	46 Å²	46	54%	0.54	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-45.1	-177.9	-53.1	0	0	0	0	112.6	Q466	Q466-T468 VanDerWaalsContact C-N 3.35Å; Q466-T468 PolarHBondContact O-N 3.32Å
469	E	83.7	Confident	91.8	Very high	112 Å²	112	48.4 Å²	48.4	52%	0.523	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-10.2	-178.6	-65.5	172.9	158.4	0	0	111.7	Q466 E471	Q466-E469 PolarHBondContact NE2-OE2 2.74Å; E469-E471 HydrophobicContact CB-CB 4.24Å; E469-E471 HydrophobicContact CB-CG 3.8Å; E469-E471 PolarHBondContact O-N 3.03Å
470	C	89.8	Confident	91.8	Very high	30 Å²	30	49.7 Å²	49.7	20%	0.203	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	32.2	-172.1	-56.5	0	0	0	0	112.8	Q466 N829 C830	Q466-C470 WeakPolarHBondContact O-CA 3.48Å; Q466-C470 PolarHBondContact O-N 3.13Å; C470-N829 PolarHBondContact SG-ND2 3.3Å; C470-C830 HydrophobicContact CB-CB 3.76Å; C470-C830 WeakPolarHBondContact CB-SG 3.2Å; C470-C830 WeakPolarHBondContact SG-CB 3.37Å; C470-C830 CovalentContact SG-SG 2.01Å; C470-C830 PolarHBondContact SG-SG 3.37Å
471	E	85.4	Confident	91.6	Very high	105 Å²	105	53.5 Å²	53.5	49%	0.491	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	147.6	-176.3	-71.4	-174.3	-178	0	0	111.8	Q466 E469	Q466-E471 PolarHBondContact N-O 2.78Å; Q466-E471 PolarHBondContact O-N 2.99Å; E469-E471 HydrophobicContact CB-CB 4.24Å; E469-E471 HydrophobicContact CB-CG 3.8Å; E469-E471 PolarHBondContact O-N 3.03Å
472	F	83.2	Confident	91.2	Very high	111 Å²	111	53.9 Å²	53.9	49%	0.487	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	116	171.4	-52.9	-64.3	0	0	0	109.4	K463 I465 I832	K463-F472 HydrophobicContact CD-CD1 4.29Å; K463-F472 HydrophobicContact CD-CE1 3.97Å; I465-F472 HydrophobicContact CG1-CD1 4.25Å; F472-I832 HydrophobicContact CE1-CG2 3.3Å; F472-I832 HydrophobicContact CZ-CG2 3.42Å; F472-I832 VanDerWaalsContact CZ-CG2 3.42Å
473	Q	85.4	Confident	90.3	Very high	94 Å²	94	58.5 Å²	58.5	44%	0.439	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-40.2	174.7	-72.7	-62.3	-23	0	0	111.4	M453 V464 Q466	M453-Q473 HydrophobicContact CE-CB 3.63Å; M453-Q473 HydrophobicContact CE-CG 3.28Å; M453-Q473 HydrophobicContact SD-CG 4.34Å; V464-Q473 PolarHBondContact O-N 3.26Å; Q466-Q473 HydrophobicContact CB-CG 4.1Å
474	R	91	Very high	89.5	Confident	83 Å²	83	61.8 Å²	61.8	31%	0.313	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	146	-176.9	-179.7	66.9	174.2	120.9	7.4	111.1	V464 I476 E480 Q532	V464-R474 HydrophobicContact CB-CB 4.02Å; V464-R474 HydrophobicContact CG2-CB 3.91Å; V464-R474 HydrophobicContact CG2-CG 4.38Å; V464-R474 PolarHBondContact N-O 2.83Å; R474-I476 HydrophobicContact CG-CG1 4.31Å; R474-E480 IonicContact CZ-OE2 3.4Å; R474-E480 IonicContact NH1-OE2 2.89Å; R474-E480 VanDerWaalsContact NH2-CD 3.31Å; R474-E480 IonicContact NH2-OE1 3.34Å; R474-E480 PolarHBondContact NH2-OE1 3.23Å; R474-E480 IonicContact NH2-OE2 2.92Å; R474-E480 PolarHBondContact NH2-OE2 2.89Å; R474-Q532 VanDerWaalsContact CB-OE1 3.25Å; R474-Q532 HydrophobicContact CG-CB 4.39Å
475	H	94.1	Very high	88.5	Confident	51 Å²	51	66.8 Å²	66.8	24%	0.236	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	112.9	169.5	177.1	-149.9	0	0	0	109.1	Y458 D460 V462	Y458-H475 AromaticContact CZ-NE2 3.99Å; Y458-H475 PolarHBondContact OH-NE2 3.15Å; D460-H475 PolarHBondContact O-NE2 2.85Å; D460-H475 IonicContact OD2-CE1 3.26Å; D460-H475 PolarHBondContact OD2-CE1 2.99Å; D460-H475 VanDerWaalsContact OD2-CE1 3.32Å; D460-H475 IonicContact OD2-NE2 2.75Å; V462-H475 CarbonylContact O-C 3.47Å; V462-H475 WeakPolarHBondContact O-CA 3.43Å
476	I	95.1	Very high	87.7	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	114	171.8	-54.8	174.5	0	0	0	106.6	G461 V462 R474 E480 V489 V527 Q532	G461-I476 WeakPolarHBondContact CA-O 3.43Å; V462-I476 HydrophobicContact CB-CB 4.08Å; V462-I476 HydrophobicContact CB-CD1 4.33Å; V462-I476 HydrophobicContact CB-CG1 4.48Å; V462-I476 HydrophobicContact CG2-CB 4.44Å; V462-I476 PolarHBondContact N-O 2.03Å; V462-I476 PolarHBondContact O-N 3.41Å; R474-I476 HydrophobicContact CG-CG1 4.31Å; I476-E480 HydrophobicContact CG2-CB 4.33Å; I476-V489 HydrophobicContact CG2-CG2 4.01Å; I476-V527 HydrophobicContact CD1-CG1 4.3Å; I476-Q532 WeakPolarHBondContact CD1-O 3.09Å
477	K	95.3	Very high	87.5	Confident	117 Å²	117	77.2 Å²	77.2	51%	0.509	40%	0.395	S	S	.	.			trans	-78.2	153.5	-173.8	-67.2	-174.4	179.1	-174.7	0	111.5	S479 E480	K477-S479 PolarHBondContact O-N 2.7Å; K477-E480 WeakPolarHBondContact O-CB 3.42Å; K477-E480 PolarHBondContact O-N 3.38Å
478	P	95.5	Very high	87.6	Confident	4 Å²	4	79.6 Å²	79.6	3%	0.026	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-39	172.5	-28.8	36.9	0	0	0	113.6	D460 E480 V489 C490 Q499	D460-P478 WeakPolarHBondContact O-CD 3.43Å; P478-E480 VanDerWaalsContact C-N 3.34Å; P478-E480 PolarHBondContact O-N 2.88Å; P478-V489 PolarHBondContact O-N 3.03Å; P478-C490 HydrophobicContact CB-CB 4.05Å; P478-C490 PolarHBondContact O-N 3.34Å; P478-Q499 HydrophobicContact CB-CG 3.73Å; P478-Q499 PolarHBondContact O-NE2 3.13Å
479	S	93.5	Very high	88	Confident	56 Å²	56	75.5 Å²	75.5	39%	0.392	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	3.8	-178.9	50	0	0	0	0	115.3	K477 K481 E488	K477-S479 PolarHBondContact O-N 2.7Å; S479-K481 PolarHBondContact O-N 2.55Å; S479-E488 WeakPolarHBondContact CA-OE2 3.4Å
480	E	94.5	Very high	88.6	Confident	47 Å²	47	70.2 Å²	70.2	22%	0.22	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-65.7	132.1	174.5	-166.6	162.6	151.4	0	0	109.3	R474 I476 K477 P478 E488 V489	R474-E480 IonicContact CZ-OE2 3.4Å; R474-E480 IonicContact NH1-OE2 2.89Å; R474-E480 VanDerWaalsContact NH2-CD 3.31Å; R474-E480 IonicContact NH2-OE1 3.34Å; R474-E480 PolarHBondContact NH2-OE1 3.23Å; R474-E480 IonicContact NH2-OE2 2.92Å; R474-E480 PolarHBondContact NH2-OE2 2.89Å; I476-E480 HydrophobicContact CG2-CB 4.33Å; K477-E480 WeakPolarHBondContact O-CB 3.42Å; K477-E480 PolarHBondContact O-N 3.38Å; P478-E480 VanDerWaalsContact C-N 3.34Å; P478-E480 PolarHBondContact O-N 2.88Å; E480-E488 CarbonylContact O-C 3.44Å; E480-E488 WeakPolarHBondContact O-CA 3.09Å; E480-V489 HydrophobicContact CB-CG2 4.06Å; E480-V489 WeakPolarHBondContact O-CG2 3Å; E480-V489 PolarHBondContact O-N 2.93Å
481	K	91.7	Very high	88.7	Confident	154 Å²	154	71 Å²	71	67%	0.67	36%	0.361	S	S	*	.	B	Isolated β-bridge	trans	-77.7	138.8	-177.4	-67.2	-168.3	175.5	-167.8	0	111.2	S479	S479-K481 PolarHBondContact O-N 2.55Å
482	L	88.7	Confident	88.8	Confident	7 Å²	7	71.3 Å²	71.3	4%	0.037	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-72.4	138.3	174.5	-58.9	-172.4	0	0	0	110.6	G484 F485 D487 V489 L525 V534 A537	L482-G484 PolarHBondContact O-N 2.9Å; L482-F485 HydrophobicContact CB-CB 4.07Å; L482-F485 HydrophobicContact CB-CD2 4.48Å; L482-F485 PolarHBondContact O-N 2.76Å; L482-D487 WeakPolarHBondContact CB-O 3.22Å; L482-D487 HydrophobicContact CD1-CB 4.01Å; L482-D487 HydrophobicContact CG-CB 4.5Å; L482-D487 WeakPolarHBondContact CG-O 3.31Å; L482-D487 PolarHBondContact N-O 2.98Å; L482-V489 HydrophobicContact CD2-CG2 3.86Å; L482-L525 HydrophobicContact CD1-CD2 4.14Å; L482-V534 HydrophobicContact CD2-CB 3.65Å; L482-V534 HydrophobicContact CD2-CG1 3.49Å; L482-V534 VanDerWaalsContact CD2-CG1 3.49Å; L482-V534 HydrophobicContact CD2-CG2 4.25Å; L482-A537 HydrophobicContact CD1-CB 4.04Å
483	L	78.3	Confident	88.7	Confident	98 Å²	98	71 Å²	71	51%	0.513	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	121	-178.7	-71.2	172.1	0	0	0	111.1	F485 V535	L483-F485 VanDerWaalsContact O-CD2 3.27Å; L483-F485 WeakPolarHBondContact O-CD2 3.32Å; L483-F485 PolarHBondContact O-N 2.67Å; L483-V535 HydrophobicContact CD1-CG1 4.35Å
484	G	76.8	Confident	88.5	Confident	88 Å²	88	76.3 Å²	76.3	91%	0.907	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-2.8	177.8	0	0	0	0	0	115.4	L482	L482-G484 PolarHBondContact O-N 2.9Å
485	F	74	Confident	88.1	Confident	105 Å²	105	81.4 Å²	81.4	46%	0.461	42%	0.416	S	S	.	.	S	Bend	trans	-115	160.5	176.4	-63.4	-87.9	0	0	0	110.6	L482 L483 D487	L482-F485 HydrophobicContact CB-CB 4.07Å; L482-F485 HydrophobicContact CB-CD2 4.48Å; L482-F485 PolarHBondContact O-N 2.76Å; L483-F485 VanDerWaalsContact O-CD2 3.27Å; L483-F485 WeakPolarHBondContact O-CD2 3.32Å; L483-F485 PolarHBondContact O-N 2.67Å; F485-D487 VanDerWaalsContact C-N 3.3Å
486	Q	76.9	Confident	87.4	Confident	189 Å²	189	82.8 Å²	82.8	88%	0.883	43%	0.425	S	S	*	.	S	Bend	trans	-82.9	-12.4	172.5	-68.5	-170.7	-6.6	0	0	112.6
487	D	86.2	Confident	86.7	Confident	78 Å²	78	91.5 Å²	91.5	42%	0.417	47%	0.466	S	S	.	.			trans	-75.4	156.2	-175.7	-61.6	-19.4	0	0	0	112.7	L482 F485 R523	L482-D487 WeakPolarHBondContact CB-O 3.22Å; L482-D487 HydrophobicContact CD1-CB 4.01Å; L482-D487 HydrophobicContact CG-CB 4.5Å; L482-D487 WeakPolarHBondContact CG-O 3.31Å; L482-D487 PolarHBondContact N-O 2.98Å; F485-D487 VanDerWaalsContact C-N 3.3Å; D487-R523 IonicContact OD2-NH1 3.27Å
488	E	93.8	Very high	86.3	Confident	55 Å²	55	89.7 Å²	89.7	26%	0.257	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-96.6	165.4	171.7	-60.3	-179.2	170.7	0	0	110.2	S479 E480 C490 Q499 R523	S479-E488 WeakPolarHBondContact CA-OE2 3.4Å; E480-E488 CarbonylContact O-C 3.44Å; E480-E488 WeakPolarHBondContact O-CA 3.09Å; E488-C490 PolarHBondContact O-N 2.95Å; E488-Q499 PolarHBondContact OE2-NE2 3.03Å; E488-R523 PolarHBondContact O-NH2 3.09Å
489	V	95.6	Very high	86.1	Confident	1 Å²	1	91.4 Å²	91.4	1%	0.006	47%	0.472	C	S	.	.	S	Bend	trans	-53.9	-44.4	175.2	174.3	0	0	0	0	110.6	I476 P478 E480 L482 W503 Q518 R523 L525 V534	I476-V489 HydrophobicContact CG2-CG2 4.01Å; P478-V489 PolarHBondContact O-N 3.03Å; E480-V489 HydrophobicContact CB-CG2 4.06Å; E480-V489 WeakPolarHBondContact O-CG2 3Å; E480-V489 PolarHBondContact O-N 2.93Å; L482-V489 HydrophobicContact CD2-CG2 3.86Å; V489-W503 HydrophobicContact CG1-CH2 3.87Å; V489-W503 HydrophobicContact CG1-CZ2 4.32Å; V489-Q518 PolarHBondContact O-NE2 2.81Å; V489-Q518 PolarHBondContact O-OE1 2.88Å; V489-R523 PolarHBondContact O-NH2 3.05Å; V489-L525 HydrophobicContact CG1-CD1 3.95Å; V489-V534 HydrophobicContact CG2-CG2 3.88Å
490	C	95.4	Very high	86.1	Confident	2 Å²	2	95.5 Å²	95.5	1%	0.014	48%	0.479	C	S	.	.	S	Bend	trans	-138.6	96.7	172.8	-50.1	0	0	0	0	108.6	P478 E488 Q499 C501 Q518	P478-C490 HydrophobicContact CB-CB 4.05Å; P478-C490 PolarHBondContact O-N 3.34Å; E488-C490 PolarHBondContact O-N 2.95Å; C490-Q499 VanDerWaalsContact O-CG 3.27Å; C490-Q499 WeakPolarHBondContact O-CG 3.28Å; C490-Q499 PolarHBondContact O-NE2 2.98Å; C490-C501 HydrophobicContact CB-CB 3.93Å; C490-C501 WeakPolarHBondContact CB-SG 3Å; C490-C501 VanDerWaalsContact SG-CA 3.55Å; C490-C501 WeakPolarHBondContact SG-CB 3.31Å; C490-C501 CovalentContact SG-SG 2.02Å; C490-C501 PolarHBondContact SG-SG 2.95Å; C490-Q518 PolarHBondContact SG-NE2 3.41Å; C490-Q518 VanDerWaalsContact SG-NE2 3.4Å
491	P	92.5	Very high	86.1	Confident	47 Å²	47	93.3 Å²	93.3	31%	0.305	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-53.6	148.2	-179.7	-25.1	34.9	0	0	0	112.4	L521	P491-L521 HydrophobicContact CG-CD1 4.49Å
492	K	88.4	Confident	86.4	Confident	111 Å²	111	88.5 Å²	88.5	48%	0.483	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-86.3	124.3	175.3	-171.9	178.8	-179	176.7	0	110	D496 E497 Q499	K492-D496 WeakPolarHBondContact CE-O 3.33Å; K492-E497 WeakPolarHBondContact CE-O 3.12Å; K492-E497 PolarHBondContact NZ-O 3.47Å; K492-Q499 HydrophobicContact CB-CB 4.05Å; K492-Q499 HydrophobicContact CB-CG 3.93Å; K492-Q499 HydrophobicContact CD-CB 4.3Å; K492-Q499 HydrophobicContact CG-CB 4.04Å; K492-Q499 HydrophobicContact CG-CG 4.46Å
493	D	80.9	Confident	86.8	Confident	104 Å²	104	88.6 Å²	88.6	56%	0.556	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-68.4	140.1	171.1	-71.3	-43.7	0	0	0	110.8	E495 D496	D493-E495 PolarHBondContact O-N 3.21Å; D493-D496 HydrophobicContact CB-CB 4.24Å; D493-D496 PolarHBondContact O-N 3.11Å; D493-D496 VanDerWaalsContact O-N 3.13Å
494	E	81.3	Confident	87.7	Confident	205 Å²	205	84.3 Å²	84.3	96%	0.958	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.2	-177.2	-67.1	-171.2	166.9	0	0	112.7
495	E	81.2	Confident	88.7	Confident	190 Å²	190	81.3 Å²	81.3	89%	0.888	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-19.8	-179.7	-61.6	-172.2	171.8	0	0	113.4	D493	D493-E495 PolarHBondContact O-N 3.21Å
496	D	79.9	Confident	89.9	Confident	81 Å²	81	77.1 Å²	77.1	43%	0.433	38%	0.381	S	S	.	.			trans	-92.4	132.8	-173.2	-84.8	-22	0	0	0	112.5	K492 D493 V498	K492-D496 WeakPolarHBondContact CE-O 3.33Å; D493-D496 HydrophobicContact CB-CB 4.24Å; D493-D496 PolarHBondContact O-N 3.11Å; D493-D496 VanDerWaalsContact O-N 3.13Å; D496-V498 VanDerWaalsContact C-N 3.3Å; D496-V498 PolarHBondContact O-N 2.93Å
497	E	81.7	Confident	90.9	Very high	182 Å²	182	69 Å²	69	85%	0.85	34%	0.344	S	S	*	.	S	Bend	trans	-68.5	-33.1	174.5	-68	-169.7	164.3	0	0	111.9	K492	K492-E497 WeakPolarHBondContact CE-O 3.12Å; K492-E497 PolarHBondContact NZ-O 3.47Å
498	V	85.9	Confident	91.4	Very high	79 Å²	79	67.1 Å²	67.1	48%	0.479	33%	0.334	S	S	.	.	S	Bend	trans	-119.6	123.6	-172.1	-176.4	0	0	0	0	109.8	D496 R500	D496-V498 VanDerWaalsContact C-N 3.3Å; D496-V498 PolarHBondContact O-N 2.93Å; V498-R500 HydrophobicContact CG1-CG 4.09Å; V498-R500 PolarHBondContact O-N 2.86Å
499	Q	90.6	Very high	91.5	Very high	40 Å²	40	64.5 Å²	64.5	19%	0.187	32%	0.322	C	S	.	.			trans	-68	118.9	172.5	-174.1	175.7	13	0	0	109.6	P478 E488 C490 K492	P478-Q499 HydrophobicContact CB-CG 3.73Å; P478-Q499 PolarHBondContact O-NE2 3.13Å; E488-Q499 PolarHBondContact OE2-NE2 3.03Å; C490-Q499 VanDerWaalsContact O-CG 3.27Å; C490-Q499 WeakPolarHBondContact O-CG 3.28Å; C490-Q499 PolarHBondContact O-NE2 2.98Å; K492-Q499 HydrophobicContact CB-CB 4.05Å; K492-Q499 HydrophobicContact CB-CG 3.93Å; K492-Q499 HydrophobicContact CD-CB 4.3Å; K492-Q499 HydrophobicContact CG-CB 4.04Å; K492-Q499 HydrophobicContact CG-CG 4.46Å
500	R	93.2	Very high	91.3	Very high	143 Å²	143	69.3 Å²	69.3	54%	0.54	34%	0.342	S	S	.	.			trans	-127.1	151.8	-177.7	-69.6	-179.5	176.9	167.9	-0.1	111.3	D459 V498	D459-R500 CarbonylContact O-C 3.55Å; D459-R500 WeakPolarHBondContact O-CA 3.4Å; V498-R500 HydrophobicContact CG1-CG 4.09Å; V498-R500 PolarHBondContact O-N 2.86Å
501	C	96.1	Very high	91.2	Very high	1 Å²	1	71.8 Å²	71.8	1%	0.007	36%	0.356	C	S	.	.			trans	-100.8	142.8	173.4	-62.3	0	0	0	0	111	D459 C490 W503	D459-C501 PolarHBondContact O-N 3.31Å; C490-C501 HydrophobicContact CB-CB 3.93Å; C490-C501 WeakPolarHBondContact CB-SG 3Å; C490-C501 VanDerWaalsContact SG-CA 3.55Å; C490-C501 WeakPolarHBondContact SG-CB 3.31Å; C490-C501 CovalentContact SG-SG 2.02Å; C490-C501 PolarHBondContact SG-SG 2.95Å; C501-W503 HydrophobicContact CB-CD2 4.39Å; C501-W503 VanDerWaalsContact CB-CE2 3.46Å; C501-W503 HydrophobicContact CB-CZ2 3.64Å
502	V	96.3	Very high	91.2	Very high	52 Å²	52	72.8 Å²	72.8	32%	0.315	36%	0.355	S	S	.	.			trans	-118.5	122.3	169.3	-176	0	0	0	0	108.3	P519 T520 W793	V502-P519 HydrophobicContact CG1-CG 3.86Å; V502-T520 HydrophobicContact CB-CG2 4.14Å; V502-T520 HydrophobicContact CG1-CG2 4.05Å; V502-T520 HydrophobicContact CG2-CG2 4.21Å; V502-W793 HydrophobicContact CG1-CZ2 3.64Å
503	W	97.6	Very high	91.6	Very high	10 Å²	10	68 Å²	68	4%	0.038	33%	0.334	C	S	.	.			trans	-122.8	146.2	-179	-47.5	106.1	0	0	0	109.6	F457 Y458 V462 V489 C501 V516 A517 Q518 L525 W791 W793	F457-W503 HydrophobicContact CB-CB 4.11Å; F457-W503 HydrophobicContact CB-CD2 3.82Å; F457-W503 HydrophobicContact CB-CG 3.61Å; F457-W503 HydrophobicContact CD1-CD2 4.26Å; F457-W503 HydrophobicContact CD1-CE3 4.28Å; F457-W503 HydrophobicContact CD1-CH2 4.36Å; F457-W503 HydrophobicContact CD1-CZ2 4.37Å; F457-W503 HydrophobicContact CD1-CZ3 4.31Å; F457-W503 HydrophobicContact CG-CD2 4.49Å; Y458-W503 VanDerWaalsContact N-CD1 3.34Å; Y458-W503 PolarHBondContact O-NE1 2.81Å; V462-W503 HydrophobicContact CG2-CH2 4.35Å; V462-W503 HydrophobicContact CG2-CZ2 4.09Å; V489-W503 HydrophobicContact CG1-CH2 3.87Å; V489-W503 HydrophobicContact CG1-CZ2 4.32Å; C501-W503 HydrophobicContact CB-CD2 4.39Å; C501-W503 VanDerWaalsContact CB-CE2 3.46Å; C501-W503 HydrophobicContact CB-CZ2 3.64Å; W503-V516 HydrophobicContact CD2-CG2 4.22Å; W503-V516 HydrophobicContact CE3-CB 4.49Å; W503-V516 HydrophobicContact CE3-CG1 4.19Å; W503-V516 HydrophobicContact CE3-CG2 3.46Å; W503-V516 VanDerWaalsContact CE3-CG2 3.46Å; W503-V516 HydrophobicContact CZ3-CG1 3.8Å; W503-V516 HydrophobicContact CZ3-CG2 3.96Å; W503-A517 WeakPolarHBondContact CA-O 3.11Å; W503-Q518 HydrophobicContact CE3-CG 3.53Å; W503-Q518 HydrophobicContact CH2-CG 4.32Å; W503-Q518 VanDerWaalsContact CH2-NE2 3.32Å; W503-Q518 HydrophobicContact CZ3-CG 3.37Å; W503-L525 HydrophobicContact CH2-CD1 3.98Å; W503-L525 HydrophobicContact CZ3-CD1 3.98Å; W503-W791 WeakPolarHBondContact O-CH2 3.36Å; W503-W793 PolarHBondContact O-NE1 2.79Å
504	A	97.6	Very high	92.4	Very high	8 Å²	8	63 Å²	63	7%	0.066	31%	0.308	C	S	.	.			trans	-114	-55.5	177	0	0	0	0	0	112.7	A517 P519 W793 T840	A504-A517 HydrophobicContact CB-CB 4.45Å; A504-A517 PolarHBondContact N-O 3.02Å; A504-A517 VanDerWaalsContact N-O 3.15Å; A504-P519 HydrophobicContact CB-CB 4.47Å; A504-P519 HydrophobicContact CB-CG 3.98Å; A504-W793 HydrophobicContact CB-CB 4.06Å; A504-W793 HydrophobicContact CB-CD2 4.13Å; A504-W793 HydrophobicContact CB-CG 3.82Å; A504-T840 PolarHBondContact O-OG1 3.11Å
505	S	98	Very high	93.2	Very high	25 Å²	25	53.3 Å²	53.3	18%	0.175	26%	0.262	C	S	.	.			trans	-149.8	150.5	-173.4	178.8	0	0	0	0	110.1	V516 A517 V545 L547	S505-V516 WeakPolarHBondContact O-CA 3.45Å; S505-A517 PolarHBondContact O-N 2.61Å; S505-V545 WeakPolarHBondContact CB-O 3.38Å; S505-L547 PolarHBondContact OG-N 2.84Å; S505-L547 VanDerWaalsContact OG-N 3.16Å
506	A	98.5	Very high	94	Very high	17 Å²	17	44.2 Å²	44.2	14%	0.14	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	149.3	176.2	0	0	0	0	0	111.2	F457 I514 Y515 V516 T840 V842	F457-A506 HydrophobicContact CD2-CB 4.12Å; F457-A506 HydrophobicContact CE2-CB 3.87Å; F457-A506 HydrophobicContact CZ-CB 4.49Å; A506-I514 HydrophobicContact CB-CG2 4.37Å; A506-Y515 CarbonylContact C-O 3.51Å; A506-Y515 WeakPolarHBondContact CA-O 3.41Å; A506-Y515 WeakPolarHBondContact CB-O 3.33Å; A506-V516 HydrophobicContact CB-CB 3.88Å; A506-V516 HydrophobicContact CB-CG2 3.92Å; A506-T840 HydrophobicContact CB-CG2 3.5Å; A506-T840 VanDerWaalsContact CB-CG2 3.5Å; A506-V842 HydrophobicContact CB-CG2 3.41Å; A506-V842 VanDerWaalsContact CB-CG2 3.41Å
507	V	97.8	Very high	94.9	Very high	19 Å²	19	40.4 Å²	40.4	12%	0.115	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.4	178.8	-67.1	0	0	0	0	111.2	V509 I514 Y515 L547 V556	V507-V509 HydrophobicContact CG2-CG2 4.45Å; V507-I514 WeakPolarHBondContact O-CA 3.13Å; V507-Y515 PolarHBondContact N-O 2.79Å; V507-Y515 PolarHBondContact O-N 2.92Å; V507-L547 HydrophobicContact CG1-CB 3.83Å; V507-L547 WeakPolarHBondContact CG1-O 3.38Å; V507-L547 HydrophobicContact CG2-CB 4Å; V507-L547 HydrophobicContact CG2-CD1 4.46Å; V507-V556 HydrophobicContact CG2-CG1 4.1Å; V507-V556 HydrophobicContact CG2-CG2 4.26Å
508	N	96.5	Very high	95.7	Very high	37 Å²	37	31.8 Å²	31.8	20%	0.198	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	129.1	170.5	176.9	3.7	0	0	0	109.9	D511 Y549 V842 W843	N508-D511 PolarHBondContact ND2-OD1 2.73Å; N508-D511 WeakPolarHBondContact OD1-CA 3.37Å; N508-D511 PolarHBondContact OD1-N 3.13Å; N508-Y549 WeakPolarHBondContact O-CD1 3.36Å; N508-V842 HydrophobicContact CB-CG1 3.56Å; N508-W843 PolarHBondContact ND2-O 3.26Å
509	V	96.6	Very high	96.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	98.1	178.1	178.8	0	0	0	0	109.1	V507 D511 K512 F513 Y515 Y549 V556 A577	V507-V509 HydrophobicContact CG2-CG2 4.45Å; V509-D511 PolarHBondContact O-N 2.88Å; V509-K512 PolarHBondContact O-N 3.32Å; V509-F513 HydrophobicContact CB-CB 4.39Å; V509-F513 PolarHBondContact N-O 3.4Å; V509-F513 PolarHBondContact O-N 3.48Å; V509-Y515 HydrophobicContact CB-CD2 4.24Å; V509-Y515 HydrophobicContact CB-CE2 4.13Å; V509-Y515 HydrophobicContact CG1-CE2 4.42Å; V509-Y515 HydrophobicContact CG2-CD2 3.48Å; V509-Y515 VanDerWaalsContact CG2-CD2 3.48Å; V509-Y515 HydrophobicContact CG2-CE2 3.67Å; V509-Y515 HydrophobicContact CG2-CG 4.4Å; V509-Y549 HydrophobicContact CB-CD2 4.44Å; V509-Y549 HydrophobicContact CB-CE2 4.38Å; V509-Y549 HydrophobicContact CG1-CD2 4.2Å; V509-Y549 HydrophobicContact CG1-CE1 4.43Å; V509-Y549 HydrophobicContact CG1-CE2 3.7Å; V509-Y549 HydrophobicContact CG2-CD2 3.81Å; V509-Y549 HydrophobicContact CG2-CE2 4.19Å; V509-Y549 HydrophobicContact CG2-CG 4.02Å; V509-V556 HydrophobicContact CG2-CG2 3.7Å; V509-A577 HydrophobicContact CG1-CB 3.96Å
510	K	92.5	Very high	96.5	Very high	102 Å²	102	30.3 Å²	30.3	44%	0.443	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	36.6	179.5	-57.6	-171.4	-176.3	157.7	0	114.8	K512 Y549 D554 S578	K510-K512 PolarHBondContact O-N 2.89Å; K510-Y549 VanDerWaalsContact CE-OH 3.24Å; K510-Y549 WeakPolarHBondContact CE-OH 3.47Å; K510-Y549 HydrophobicContact CG-CE1 4.29Å; K510-Y549 VanDerWaalsContact CG-OH 3.3Å; K510-Y549 WeakPolarHBondContact CG-OH 3.42Å; K510-D554 IonicContact NZ-OD1 2.9Å; K510-D554 IonicContact NZ-OD2 3.14Å; K510-S578 PolarHBondContact NZ-OG 3.3Å
511	D	91.5	Very high	96.6	Very high	55 Å²	55	26.6 Å²	26.6	29%	0.294	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	17.4	-178.6	-57	-65.9	0	0	0	114.1	N508 V509 V529 V844 G845	N508-D511 PolarHBondContact ND2-OD1 2.73Å; N508-D511 WeakPolarHBondContact OD1-CA 3.37Å; N508-D511 PolarHBondContact OD1-N 3.13Å; V509-D511 PolarHBondContact O-N 2.88Å; D511-V529 WeakPolarHBondContact O-CB 3.46Å; D511-V529 WeakPolarHBondContact O-CG1 3.48Å; D511-V844 HydrophobicContact CB-CG1 4.16Å; D511-G845 PolarHBondContact OD1-N 2.82Å
512	K	93	Very high	96.7	Very high	68 Å²	68	29.6 Å²	29.6	30%	0.296	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-47.1	-176	-177.4	-178.5	175.9	-170.5	0	111.4	V509 K510 V529 S578 N580	V509-K512 PolarHBondContact O-N 3.32Å; K510-K512 PolarHBondContact O-N 2.89Å; K512-V529 WeakPolarHBondContact O-CB 3.45Å; K512-V529 WeakPolarHBondContact O-CG2 3.35Å; K512-V529 PolarHBondContact O-N 3.22Å; K512-S578 WeakPolarHBondContact CD-O 3.44Å; K512-S578 PolarHBondContact NZ-O 2.97Å; K512-N580 VanDerWaalsContact CE-OD1 3.25Å; K512-N580 WeakPolarHBondContact CE-OD1 2.83Å; K512-N580 PolarHBondContact NZ-OD1 3.05Å
513	F	96.6	Very high	96.7	Very high	10 Å²	10	28 Å²	28	4%	0.044	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.5	177.7	-61.7	-60.5	0	0	0	110.6	V509 Y515 I526 V527 D528 V535	V509-F513 HydrophobicContact CB-CB 4.39Å; V509-F513 PolarHBondContact N-O 3.4Å; V509-F513 PolarHBondContact O-N 3.48Å; F513-Y515 HydrophobicContact CB-CD2 4.2Å; F513-Y515 HydrophobicContact CB-CE2 3.86Å; F513-I526 HydrophobicContact CB-CG2 3.99Å; F513-I526 HydrophobicContact CD1-CG2 3.89Å; F513-I526 HydrophobicContact CG-CG2 4.03Å; F513-V527 CarbonylContact C-O 3.56Å; F513-V527 VanDerWaalsContact CA-O 3.28Å; F513-V527 WeakPolarHBondContact CA-O 3.18Å; F513-D528 HydrophobicContact CD1-CB 4.18Å; F513-D528 HydrophobicContact CE1-CB 4.07Å; F513-D528 WeakPolarHBondContact CE1-OD2 3.38Å; F513-V535 HydrophobicContact CE1-CG2 4.3Å
514	I	97.9	Very high	96.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.7	165	-49.4	171.4	0	0	0	107.4	Y455 F457 A506 V507 I526 V527 V529 V842 V844	Y455-I514 HydrophobicContact CD1-CD1 3.34Å; Y455-I514 HydrophobicContact CD2-CD1 3.56Å; Y455-I514 HydrophobicContact CE1-CD1 3.72Å; Y455-I514 HydrophobicContact CE2-CD1 3.94Å; Y455-I514 HydrophobicContact CG-CD1 3.25Å; F457-I514 HydrophobicContact CE2-CG2 4.04Å; F457-I514 HydrophobicContact CZ-CG2 3.73Å; A506-I514 HydrophobicContact CB-CG2 4.37Å; V507-I514 WeakPolarHBondContact O-CA 3.13Å; I514-I526 WeakPolarHBondContact O-CA 3.28Å; I514-V527 HydrophobicContact CB-CB 4.19Å; I514-V527 PolarHBondContact N-O 3.15Å; I514-V527 PolarHBondContact O-N 2.87Å; I514-V529 HydrophobicContact CD1-CG2 4.33Å; I514-V529 HydrophobicContact CG1-CG2 3.93Å; I514-V842 HydrophobicContact CG2-CB 4.41Å; I514-V842 HydrophobicContact CG2-CG1 4.28Å; I514-V842 HydrophobicContact CG2-CG2 4.28Å; I514-V844 HydrophobicContact CD1-CG2 3.61Å; I514-V844 HydrophobicContact CG1-CG2 3.85Å
515	Y	98.7	Very high	96.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	129.8	172.8	-74.3	-120.2	0	0	0	107.6	A506 V507 V509 F513 I524 L525 I526 V556 I574 A577 H583	A506-Y515 CarbonylContact C-O 3.51Å; A506-Y515 WeakPolarHBondContact CA-O 3.41Å; A506-Y515 WeakPolarHBondContact CB-O 3.33Å; V507-Y515 PolarHBondContact N-O 2.79Å; V507-Y515 PolarHBondContact O-N 2.92Å; V509-Y515 HydrophobicContact CB-CD2 4.24Å; V509-Y515 HydrophobicContact CB-CE2 4.13Å; V509-Y515 HydrophobicContact CG1-CE2 4.42Å; V509-Y515 HydrophobicContact CG2-CD2 3.48Å; V509-Y515 VanDerWaalsContact CG2-CD2 3.48Å; V509-Y515 HydrophobicContact CG2-CE2 3.67Å; V509-Y515 HydrophobicContact CG2-CG 4.4Å; F513-Y515 HydrophobicContact CB-CD2 4.2Å; F513-Y515 HydrophobicContact CB-CE2 3.86Å; Y515-I524 HydrophobicContact CD1-CG2 3.89Å; Y515-I524 HydrophobicContact CG-CG2 4.39Å; Y515-L525 WeakPolarHBondContact CA-O 3.39Å; Y515-I526 HydrophobicContact CD1-CD1 4.05Å; Y515-I526 HydrophobicContact CD1-CG1 4.08Å; Y515-I526 HydrophobicContact CD2-CG2 4.46Å; Y515-I526 HydrophobicContact CE1-CD1 3.48Å; Y515-I526 VanDerWaalsContact CE1-CD1 3.48Å; Y515-I526 HydrophobicContact CE1-CG1 4.02Å; Y515-I526 HydrophobicContact CE2-CD1 4.42Å; Y515-I526 HydrophobicContact CE2-CG2 4.18Å; Y515-I526 HydrophobicContact CG-CG1 4.46Å; Y515-V556 HydrophobicContact CD1-CB 4.38Å; Y515-V556 HydrophobicContact CD1-CG1 4.26Å; Y515-V556 HydrophobicContact CD1-CG2 4.14Å; Y515-V556 HydrophobicContact CD2-CG2 4.27Å; Y515-V556 HydrophobicContact CE1-CG2 4.25Å; Y515-V556 HydrophobicContact CE2-CG2 4.39Å; Y515-V556 HydrophobicContact CG-CG2 4.14Å; Y515-I574 HydrophobicContact CD1-CD1 3.98Å; Y515-I574 HydrophobicContact CE1-CD1 3.71Å; Y515-I574 HydrophobicContact CE1-CG2 4.11Å; Y515-A577 HydrophobicContact CE2-CB 4.38Å; Y515-A577 VanDerWaalsContact OH-CA 3.25Å; Y515-A577 WeakPolarHBondContact OH-CA 3.27Å; Y515-A577 PolarHBondContact OH-O 2.87Å; Y515-H583 AromaticContact CZ-ND1 3.67Å; Y515-H583 PolarHBondContact OH-CE1 2.81Å; Y515-H583 PolarHBondContact OH-ND1 2.75Å
516	V	98.7	Very high	96.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.6	178.7	60.2	0	0	0	0	111.2	F457 W503 S505 A506 I524 L525 T840	F457-V516 HydrophobicContact CB-CG2 4.46Å; F457-V516 HydrophobicContact CD1-CB 4.04Å; F457-V516 HydrophobicContact CD1-CG1 3.94Å; F457-V516 HydrophobicContact CD1-CG2 3.69Å; F457-V516 HydrophobicContact CD2-CG2 4.37Å; F457-V516 HydrophobicContact CE1-CB 3.76Å; F457-V516 HydrophobicContact CE1-CG1 3.53Å; F457-V516 HydrophobicContact CE1-CG2 3.96Å; F457-V516 HydrophobicContact CG-CG2 3.93Å; F457-V516 HydrophobicContact CZ-CB 4.03Å; F457-V516 HydrophobicContact CZ-CG1 4.18Å; F457-V516 HydrophobicContact CZ-CG2 4.4Å; W503-V516 HydrophobicContact CD2-CG2 4.22Å; W503-V516 HydrophobicContact CE3-CB 4.49Å; W503-V516 HydrophobicContact CE3-CG1 4.19Å; W503-V516 HydrophobicContact CE3-CG2 3.46Å; W503-V516 VanDerWaalsContact CE3-CG2 3.46Å; W503-V516 HydrophobicContact CZ3-CG1 3.8Å; W503-V516 HydrophobicContact CZ3-CG2 3.96Å; S505-V516 WeakPolarHBondContact O-CA 3.45Å; A506-V516 HydrophobicContact CB-CB 3.88Å; A506-V516 HydrophobicContact CB-CG2 3.92Å; V516-I524 CarbonylContact O-C 3.6Å; V516-I524 VanDerWaalsContact O-CA 3.26Å; V516-I524 WeakPolarHBondContact O-CA 3.47Å; V516-L525 HydrophobicContact CG1-CB 3.83Å; V516-L525 PolarHBondContact N-O 2.87Å; V516-L525 PolarHBondContact O-N 2.75Å; V516-T840 HydrophobicContact CG2-CG2 4.37Å
517	A	98.7	Very high	96.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133	-179.2	0	0	0	0	0	112.3	W503 A504 S505 I524 P544 L547	W503-A517 WeakPolarHBondContact CA-O 3.11Å; A504-A517 HydrophobicContact CB-CB 4.45Å; A504-A517 PolarHBondContact N-O 3.02Å; A504-A517 VanDerWaalsContact N-O 3.15Å; S505-A517 PolarHBondContact O-N 2.61Å; A517-I524 HydrophobicContact CB-CG1 4.37Å; A517-P544 HydrophobicContact CB-CB 4.17Å; A517-P544 HydrophobicContact CB-CG 4.31Å; A517-L547 HydrophobicContact CB-CD1 4.11Å; A517-L547 HydrophobicContact CB-CD2 4.39Å; A517-L547 HydrophobicContact CB-CG 4.18Å
518	Q	98	Very high	96.3	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	93.2	169.7	-69.6	-172	-51	0	0	109.3	V489 C490 W503 T520 L521 D522 R523	V489-Q518 PolarHBondContact O-NE2 2.81Å; V489-Q518 PolarHBondContact O-OE1 2.88Å; C490-Q518 PolarHBondContact SG-NE2 3.41Å; C490-Q518 VanDerWaalsContact SG-NE2 3.4Å; W503-Q518 HydrophobicContact CE3-CG 3.53Å; W503-Q518 HydrophobicContact CH2-CG 4.32Å; W503-Q518 VanDerWaalsContact CH2-NE2 3.32Å; W503-Q518 HydrophobicContact CZ3-CG 3.37Å; Q518-T520 VanDerWaalsContact C-N 3.31Å; Q518-T520 PolarHBondContact O-N 3.09Å; Q518-L521 HydrophobicContact CB-CB 4.14Å; Q518-L521 HydrophobicContact CB-CD1 4.32Å; Q518-L521 PolarHBondContact O-N 2.89Å; Q518-L521 VanDerWaalsContact O-N 3.17Å; Q518-D522 PolarHBondContact O-N 2.89Å; Q518-R523 HydrophobicContact CB-CG 4.23Å; Q518-R523 PolarHBondContact N-O 2.95Å
519	P	97.6	Very high	96.1	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.013	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-64.7	-30.5	-170.2	25.6	-36.3	0	0	0	113.9	V502 A504 L521 V543 W793	V502-P519 HydrophobicContact CG1-CG 3.86Å; A504-P519 HydrophobicContact CB-CB 4.47Å; A504-P519 HydrophobicContact CB-CG 3.98Å; P519-L521 VanDerWaalsContact C-N 3.29Å; P519-V543 HydrophobicContact CB-CG1 4.05Å; P519-V543 WeakPolarHBondContact O-CA 3.33Å; P519-W793 HydrophobicContact CB-CE3 4.29Å; P519-W793 HydrophobicContact CB-CH2 3.84Å; P519-W793 HydrophobicContact CB-CZ2 4.3Å; P519-W793 HydrophobicContact CB-CZ3 3.82Å; P519-W793 HydrophobicContact CG-CD2 4.23Å; P519-W793 HydrophobicContact CG-CE3 4.26Å; P519-W793 HydrophobicContact CG-CH2 3.6Å; P519-W793 HydrophobicContact CG-CZ2 3.55Å; P519-W793 HydrophobicContact CG-CZ3 3.96Å
520	T	95.2	Very high	95.7	Very high	87 Å²	87	31 Å²	31	53%	0.534	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-81.4	-9.8	-179.6	54.8	0	0	0	0	113.6	V502 Q518	V502-T520 HydrophobicContact CB-CG2 4.14Å; V502-T520 HydrophobicContact CG1-CG2 4.05Å; V502-T520 HydrophobicContact CG2-CG2 4.21Å; Q518-T520 VanDerWaalsContact C-N 3.31Å; Q518-T520 PolarHBondContact O-N 3.09Å
521	L	95.7	Very high	95.6	Very high	64 Å²	64	28.7 Å²	28.7	34%	0.335	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-117.2	7.5	-178.1	-61.9	175.7	0	0	0	112.2	P491 Q518 P519 R523	P491-L521 HydrophobicContact CG-CD1 4.49Å; Q518-L521 HydrophobicContact CB-CB 4.14Å; Q518-L521 HydrophobicContact CB-CD1 4.32Å; Q518-L521 PolarHBondContact O-N 2.89Å; Q518-L521 VanDerWaalsContact O-N 3.17Å; P519-L521 VanDerWaalsContact C-N 3.29Å; L521-R523 HydrophobicContact CB-CG 3.96Å; L521-R523 PolarHBondContact O-N 3.23Å; L521-R523 VanDerWaalsContact O-N 3.1Å
522	D	97.1	Very high	95.5	Very high	64 Å²	64	27.5 Å²	27.5	34%	0.342	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	42.3	177.8	-54.3	-35.1	0	0	0	113.2	Q518 T540 P542 V543	Q518-D522 PolarHBondContact O-N 2.89Å; D522-T540 VanDerWaalsContact C-OG1 3.26Å; D522-T540 PolarHBondContact O-N 3.25Å; D522-T540 PolarHBondContact O-OG1 3.15Å; D522-P542 WeakPolarHBondContact OD1-CA 3.28Å; D522-V543 PolarHBondContact OD1-N 3.35Å
523	R	97.4	Very high	95.4	Very high	19 Å²	19	28.9 Å²	28.9	7%	0.072	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	161.6	-175.9	74.4	-174.4	-169.4	174.9	1.4	113.6	D487 E488 V489 Q518 L521 V538	D487-R523 IonicContact OD2-NH1 3.27Å; E488-R523 PolarHBondContact O-NH2 3.09Å; V489-R523 PolarHBondContact O-NH2 3.05Å; Q518-R523 HydrophobicContact CB-CG 4.23Å; Q518-R523 PolarHBondContact N-O 2.95Å; L521-R523 HydrophobicContact CB-CG 3.96Å; L521-R523 PolarHBondContact O-N 3.23Å; L521-R523 VanDerWaalsContact O-N 3.1Å; R523-V538 CarbonylContact C-O 3.59Å; R523-V538 VanDerWaalsContact CA-O 3.24Å; R523-V538 WeakPolarHBondContact CA-O 3.42Å; R523-V538 WeakPolarHBondContact CB-O 3.37Å
524	I	98.2	Very high	95.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.9	167.3	-68.7	163.7	0	0	0	108.5	Y515 V516 A517 A537 V538 T540 L547 V558 I574	Y515-I524 HydrophobicContact CD1-CG2 3.89Å; Y515-I524 HydrophobicContact CG-CG2 4.39Å; V516-I524 CarbonylContact O-C 3.6Å; V516-I524 VanDerWaalsContact O-CA 3.26Å; V516-I524 WeakPolarHBondContact O-CA 3.47Å; A517-I524 HydrophobicContact CB-CG1 4.37Å; I524-A537 CarbonylContact O-C 3.46Å; I524-A537 WeakPolarHBondContact O-CA 3.33Å; I524-V538 PolarHBondContact N-O 2.93Å; I524-V538 PolarHBondContact O-N 3.3Å; I524-T540 HydrophobicContact CB-CG2 4.38Å; I524-T540 HydrophobicContact CD1-CG2 3.59Å; I524-T540 HydrophobicContact CG1-CG2 3.71Å; I524-L547 HydrophobicContact CD1-CD2 3.58Å; I524-L547 HydrophobicContact CG1-CD2 4.17Å; I524-V558 HydrophobicContact CD1-CB 4.34Å; I524-V558 HydrophobicContact CD1-CG1 3.84Å; I524-V558 HydrophobicContact CD1-CG2 3.51Å; I524-I574 HydrophobicContact CD1-CD1 4.2Å
525	L	97.6	Very high	95.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	144.5	168	-61.1	-174.6	0	0	0	110.3	L482 V489 W503 Y515 V516 V534 A537	L482-L525 HydrophobicContact CD1-CD2 4.14Å; V489-L525 HydrophobicContact CG1-CD1 3.95Å; W503-L525 HydrophobicContact CH2-CD1 3.98Å; W503-L525 HydrophobicContact CZ3-CD1 3.98Å; Y515-L525 WeakPolarHBondContact CA-O 3.39Å; V516-L525 HydrophobicContact CG1-CB 3.83Å; V516-L525 PolarHBondContact N-O 2.87Å; V516-L525 PolarHBondContact O-N 2.75Å; L525-V534 HydrophobicContact CB-CG1 3.98Å; L525-V534 HydrophobicContact CD1-CG1 4.29Å; L525-V534 HydrophobicContact CD1-CG2 4.45Å; L525-V534 HydrophobicContact CD2-CG1 4.1Å; L525-V534 HydrophobicContact CG-CG1 4.36Å; L525-A537 HydrophobicContact CD2-CB 3.69Å
526	I	97.1	Very high	94.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	112.9	177.7	-51.7	-170.9	0	0	0	107.9	F513 I514 Y515 V534 V535 Q536 V538 H583	F513-I526 HydrophobicContact CB-CG2 3.99Å; F513-I526 HydrophobicContact CD1-CG2 3.89Å; F513-I526 HydrophobicContact CG-CG2 4.03Å; I514-I526 WeakPolarHBondContact O-CA 3.28Å; Y515-I526 HydrophobicContact CD1-CD1 4.05Å; Y515-I526 HydrophobicContact CD1-CG1 4.08Å; Y515-I526 HydrophobicContact CD2-CG2 4.46Å; Y515-I526 HydrophobicContact CE1-CD1 3.48Å; Y515-I526 VanDerWaalsContact CE1-CD1 3.48Å; Y515-I526 HydrophobicContact CE1-CG1 4.02Å; Y515-I526 HydrophobicContact CE2-CD1 4.42Å; Y515-I526 HydrophobicContact CE2-CG2 4.18Å; Y515-I526 HydrophobicContact CG-CG1 4.46Å; I526-V534 CarbonylContact O-C 3.5Å; I526-V534 WeakPolarHBondContact O-CA 3.21Å; I526-V535 HydrophobicContact CB-CG2 4.3Å; I526-V535 HydrophobicContact CG2-CG2 4.05Å; I526-V535 WeakPolarHBondContact O-CG2 3.45Å; I526-V535 PolarHBondContact O-N 3.02Å; I526-Q536 HydrophobicContact CB-CB 4.24Å; I526-Q536 HydrophobicContact CD1-CB 4.32Å; I526-Q536 HydrophobicContact CG1-CB 4.42Å; I526-Q536 PolarHBondContact N-O 3.34Å; I526-V538 HydrophobicContact CD1-CG2 3.66Å; I526-V538 HydrophobicContact CG1-CG2 4.26Å; I526-H583 HydrophobicContact CD1-CB 3.64Å; I526-H583 WeakPolarHBondContact CD1-ND1 3.21Å
527	V	95.6	Very high	94.8	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	121.6	176.9	-172	0	0	0	0	108.2	Y455 F457 I476 F513 I514 K533 V534	Y455-V527 HydrophobicContact CE1-CG1 4.44Å; F457-V527 HydrophobicContact CE1-CG2 4.23Å; F457-V527 HydrophobicContact CZ-CG2 4.48Å; I476-V527 HydrophobicContact CD1-CG1 4.3Å; F513-V527 CarbonylContact C-O 3.56Å; F513-V527 VanDerWaalsContact CA-O 3.28Å; F513-V527 WeakPolarHBondContact CA-O 3.18Å; I514-V527 HydrophobicContact CB-CB 4.19Å; I514-V527 PolarHBondContact N-O 3.15Å; I514-V527 PolarHBondContact O-N 2.87Å; V527-K533 WeakPolarHBondContact CA-O 3.46Å; V527-V534 HydrophobicContact CG2-CG2 4.31Å
528	D	93.1	Very high	94.6	Very high	27 Å²	27	34.3 Å²	34.3	14%	0.144	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.1	169.9	177.7	-83.7	0	0	0	109.1	F513 Q530 S531 Q532 K533 V535	F513-D528 HydrophobicContact CD1-CB 4.18Å; F513-D528 HydrophobicContact CE1-CB 4.07Å; F513-D528 WeakPolarHBondContact CE1-OD2 3.38Å; D528-Q530 PolarHBondContact OD1-N 2.94Å; D528-S531 WeakPolarHBondContact CB-OG 3.34Å; D528-S531 VanDerWaalsContact CG-OG 3.31Å; D528-S531 VanDerWaalsContact OD1-CB 3.28Å; D528-S531 WeakPolarHBondContact OD1-CB 3.36Å; D528-S531 PolarHBondContact OD1-N 3.1Å; D528-S531 PolarHBondContact OD1-OG 2.81Å; D528-Q532 VanDerWaalsContact O-CA 3.22Å; D528-Q532 WeakPolarHBondContact O-CA 3.2Å; D528-Q532 PolarHBondContact O-N 2.94Å; D528-K533 PolarHBondContact N-O 3.49Å; D528-K533 PolarHBondContact O-N 2.79Å; D528-V535 HydrophobicContact CB-CB 4.44Å; D528-V535 HydrophobicContact CB-CG1 3.48Å; D528-V535 VanDerWaalsContact CB-CG1 3.48Å; D528-V535 HydrophobicContact CB-CG2 4.07Å
529	V	92.3	Very high	94.6	Very high	9 Å²	9	38.9 Å²	38.9	6%	0.055	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-44.6	-174.1	167.3	0	0	0	0	110.7	I450 D511 K512 I514 Q532 V844	I450-V529 HydrophobicContact CG2-CG1 4.2Å; I450-V529 WeakPolarHBondContact CG2-O 3.29Å; D511-V529 WeakPolarHBondContact O-CB 3.46Å; D511-V529 WeakPolarHBondContact O-CG1 3.48Å; K512-V529 WeakPolarHBondContact O-CB 3.45Å; K512-V529 WeakPolarHBondContact O-CG2 3.35Å; K512-V529 PolarHBondContact O-N 3.22Å; I514-V529 HydrophobicContact CD1-CG2 4.33Å; I514-V529 HydrophobicContact CG1-CG2 3.93Å; V529-Q532 VanDerWaalsContact O-CG 3.26Å; V529-Q532 WeakPolarHBondContact O-CG 3.34Å; V529-Q532 PolarHBondContact O-N 2.8Å; V529-V844 HydrophobicContact CB-CG1 4.31Å; V529-V844 HydrophobicContact CG1-CG1 3.51Å; V529-V844 HydrophobicContact CG2-CG1 3.81Å; V529-V844 HydrophobicContact CG2-CG2 4.19Å
530	Q	88.2	Confident	94.6	Very high	141 Å²	141	39.5 Å²	39.5	66%	0.659	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-44.5	-174.5	-174	-179.7	10.2	0	0	112	I450 D528	I450-Q530 WeakPolarHBondContact CD1-O 3.16Å; D528-Q530 PolarHBondContact OD1-N 2.94Å
531	S	89	Confident	94.6	Very high	54 Å²	54	36.9 Å²	36.9	38%	0.378	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-11.3	179.3	65.7	0	0	0	0	113.5	D528 K533	D528-S531 WeakPolarHBondContact CB-OG 3.34Å; D528-S531 VanDerWaalsContact CG-OG 3.31Å; D528-S531 VanDerWaalsContact OD1-CB 3.28Å; D528-S531 WeakPolarHBondContact OD1-CB 3.36Å; D528-S531 PolarHBondContact OD1-N 3.1Å; D528-S531 PolarHBondContact OD1-OG 2.81Å; S531-K533 VanDerWaalsContact C-N 3.26Å; S531-K533 WeakPolarHBondContact O-CG 3.33Å; S531-K533 PolarHBondContact O-N 3.27Å
532	Q	90.2	Very high	94.7	Very high	30 Å²	30	36.5 Å²	36.5	14%	0.14	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	44.5	-175.4	-59.6	-174.1	-17.7	0	0	112.8	R474 I476 D528 V529	R474-Q532 VanDerWaalsContact CB-OE1 3.25Å; R474-Q532 HydrophobicContact CG-CB 4.39Å; I476-Q532 WeakPolarHBondContact CD1-O 3.09Å; D528-Q532 VanDerWaalsContact O-CA 3.22Å; D528-Q532 WeakPolarHBondContact O-CA 3.2Å; D528-Q532 PolarHBondContact O-N 2.94Å; V529-Q532 VanDerWaalsContact O-CG 3.26Å; V529-Q532 WeakPolarHBondContact O-CG 3.34Å; V529-Q532 PolarHBondContact O-N 2.8Å
533	K	91.3	Very high	94.7	Very high	97 Å²	97	34.2 Å²	34.2	42%	0.422	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.1	-177.7	-74.2	174.2	-173.6	179.2	0	111.1	V527 D528 S531 V535	V527-K533 WeakPolarHBondContact CA-O 3.46Å; D528-K533 PolarHBondContact N-O 3.49Å; D528-K533 PolarHBondContact O-N 2.79Å; S531-K533 VanDerWaalsContact C-N 3.26Å; S531-K533 WeakPolarHBondContact O-CG 3.33Å; S531-K533 PolarHBondContact O-N 3.27Å; K533-V535 PolarHBondContact O-N 2.77Å
534	V	94.4	Very high	94.8	Very high	8 Å²	8	33.3 Å²	33.3	5%	0.048	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	116.3	167.8	-172.4	0	0	0	0	108.7	L482 V489 L525 I526 V527	L482-V534 HydrophobicContact CD2-CB 3.65Å; L482-V534 HydrophobicContact CD2-CG1 3.49Å; L482-V534 VanDerWaalsContact CD2-CG1 3.49Å; L482-V534 HydrophobicContact CD2-CG2 4.25Å; V489-V534 HydrophobicContact CG2-CG2 3.88Å; L525-V534 HydrophobicContact CB-CG1 3.98Å; L525-V534 HydrophobicContact CD1-CG1 4.29Å; L525-V534 HydrophobicContact CD1-CG2 4.45Å; L525-V534 HydrophobicContact CD2-CG1 4.1Å; L525-V534 HydrophobicContact CG-CG1 4.36Å; I526-V534 CarbonylContact O-C 3.5Å; I526-V534 WeakPolarHBondContact O-CA 3.21Å; V527-V534 HydrophobicContact CG2-CG2 4.31Å
535	V	93.5	Very high	94.7	Very high	50 Å²	50	33.6 Å²	33.6	30%	0.303	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-24.5	-175.8	-68.6	0	0	0	0	113.1	L483 F513 I526 D528 K533	L483-V535 HydrophobicContact CD1-CG1 4.35Å; F513-V535 HydrophobicContact CE1-CG2 4.3Å; I526-V535 HydrophobicContact CB-CG2 4.3Å; I526-V535 HydrophobicContact CG2-CG2 4.05Å; I526-V535 WeakPolarHBondContact O-CG2 3.45Å; I526-V535 PolarHBondContact O-N 3.02Å; D528-V535 HydrophobicContact CB-CB 4.44Å; D528-V535 HydrophobicContact CB-CG1 3.48Å; D528-V535 VanDerWaalsContact CB-CG1 3.48Å; D528-V535 HydrophobicContact CB-CG2 4.07Å; K533-V535 PolarHBondContact O-N 2.77Å
536	Q	94.6	Very high	94.8	Very high	42 Å²	42	36.5 Å²	36.5	20%	0.196	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	147.3	-179	-171.2	174.2	-10.8	0	0	111.3	I526 V538 H583	I526-Q536 HydrophobicContact CB-CB 4.24Å; I526-Q536 HydrophobicContact CD1-CB 4.32Å; I526-Q536 HydrophobicContact CG1-CB 4.42Å; I526-Q536 PolarHBondContact N-O 3.34Å; Q536-V538 HydrophobicContact CG-CG2 4.08Å; Q536-H583 PolarHBondContact NE2-O 3.3Å; Q536-H583 VanDerWaalsContact OE1-N 3.13Å
537	A	95.4	Very high	94.8	Very high	19 Å²	19	36.9 Å²	36.9	16%	0.157	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.8	160.9	0	0	0	0	0	108.8	L482 I524 L525	L482-A537 HydrophobicContact CD1-CB 4.04Å; I524-A537 CarbonylContact O-C 3.46Å; I524-A537 WeakPolarHBondContact O-CA 3.33Å; L525-A537 HydrophobicContact CD2-CB 3.69Å
538	V	96.2	Very high	94.9	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118.6	179.7	-178.4	0	0	0	0	108.3	R523 I524 I526 Q536 I574 H583 T585	R523-V538 CarbonylContact C-O 3.59Å; R523-V538 VanDerWaalsContact CA-O 3.24Å; R523-V538 WeakPolarHBondContact CA-O 3.42Å; R523-V538 WeakPolarHBondContact CB-O 3.37Å; I524-V538 PolarHBondContact N-O 2.93Å; I524-V538 PolarHBondContact O-N 3.3Å; I526-V538 HydrophobicContact CD1-CG2 3.66Å; I526-V538 HydrophobicContact CG1-CG2 4.26Å; Q536-V538 HydrophobicContact CG-CG2 4.08Å; V538-I574 HydrophobicContact CG1-CD1 4.22Å; V538-H583 HydrophobicContact CG2-CB 3.99Å; V538-T585 HydrophobicContact CG1-CG2 4.12Å
539	S	96.7	Very high	95.2	Very high	96 Å²	96	38.7 Å²	38.7	67%	0.671	21%	0.21	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	139.6	173.5	-57.3	0	0	0	0	110.8	T585	S539-T585 PolarHBondContact O-OG1 2.83Å
540	T	97.5	Very high	95.4	Very high	16 Å²	16	38.3 Å²	38.3	10%	0.098	21%	0.208	C	C	.	.			trans	-125	174.2	177.1	65.8	0	0	0	0	110.3	D522 I524 P544 V558 T585	D522-T540 VanDerWaalsContact C-OG1 3.26Å; D522-T540 PolarHBondContact O-N 3.25Å; D522-T540 PolarHBondContact O-OG1 3.15Å; I524-T540 HydrophobicContact CB-CG2 4.38Å; I524-T540 HydrophobicContact CD1-CG2 3.59Å; I524-T540 HydrophobicContact CG1-CG2 3.71Å; T540-P544 HydrophobicContact CG2-CB 4.42Å; T540-P544 WeakPolarHBondContact OG1-CD 3.44Å; T540-P544 VanDerWaalsContact OG1-CG 3.26Å; T540-P544 WeakPolarHBondContact OG1-CG 3.49Å; T540-V558 HydrophobicContact CG2-CG1 4.38Å; T540-T585 HydrophobicContact CG2-CG2 4.08Å
541	D	96.1	Very high	95.7	Very high	31 Å²	31	37.7 Å²	37.7	17%	0.166	20%	0.203	C	C	.	.	S	Bend	trans	-62.6	157.4	161.8	-67.8	-21.9	0	0	0	111	S560 T570 Q572 H587	D541-S560 PolarHBondContact O-OG 3.08Å; D541-S560 VanDerWaalsContact O-OG 3.06Å; D541-T570 VanDerWaalsContact CB-OG1 3.28Å; D541-T570 WeakPolarHBondContact CB-OG1 3.43Å; D541-T570 WeakPolarHBondContact OD2-CB 3.1Å; D541-T570 WeakPolarHBondContact OD2-CG2 3.47Å; D541-T570 PolarHBondContact OD2-OG1 2.84Å; D541-Q572 PolarHBondContact OD1-NE2 3.29Å; D541-Q572 VanDerWaalsContact OD2-CD 3.24Å; D541-Q572 PolarHBondContact OD2-NE2 2.84Å; D541-Q572 VanDerWaalsContact OD2-NE2 3.15Å; D541-H587 IonicContact OD1-CE1 3.82Å; D541-H587 IonicContact OD1-NE2 3.47Å; D541-H587 IonicContact OD2-CE1 3.02Å; D541-H587 PolarHBondContact OD2-CE1 2.02Å; D541-H587 IonicContact OD2-ND1 3.5Å; D541-H587 IonicContact OD2-NE2 3.69Å
542	P	97.6	Very high	95.9	Very high	57 Å²	57	36.5 Å²	36.5	37%	0.37	20%	0.195	S	C	.	.	S	Bend	trans	-59.4	139.5	-171	-24.9	33.8	0	0	0	114.1	D522 S560 G562	D522-P542 WeakPolarHBondContact OD1-CA 3.28Å; P542-S560 WeakPolarHBondContact O-CB 3.25Å; P542-G562 WeakPolarHBondContact CB-O 3.45Å; P542-G562 WeakPolarHBondContact O-CA 3.5Å; P542-G562 PolarHBondContact O-N 2.82Å
543	V	97.5	Very high	96.2	Very high	16 Å²	16	36.8 Å²	36.8	10%	0.097	20%	0.196	C	C	.	.	S	Bend	trans	59.7	63.3	177.9	-161.4	0	0	0	0	113.1	P519 D522 V545 S560 W561 M564 W793	P519-V543 HydrophobicContact CB-CG1 4.05Å; P519-V543 WeakPolarHBondContact O-CA 3.33Å; D522-V543 PolarHBondContact OD1-N 3.35Å; V543-V545 HydrophobicContact CG1-CG1 3.93Å; V543-V545 PolarHBondContact O-N 3.5Å; V543-S560 VanDerWaalsContact O-CA 3.3Å; V543-S560 WeakPolarHBondContact O-CA 3.17Å; V543-W561 HydrophobicContact CB-CB 4.3Å; V543-W561 HydrophobicContact CG1-CB 4.34Å; V543-W561 HydrophobicContact CG1-CE3 4.36Å; V543-W561 PolarHBondContact O-N 2.03Å; V543-M564 HydrophobicContact CG1-SD 4.18Å; V543-W793 HydrophobicContact CG1-CZ3 4.1Å
544	P	98.1	Very high	96.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	121	170.2	29.8	-37.9	0	0	0	111	A517 T540 V558 S560	A517-P544 HydrophobicContact CB-CB 4.17Å; A517-P544 HydrophobicContact CB-CG 4.31Å; T540-P544 HydrophobicContact CG2-CB 4.42Å; T540-P544 WeakPolarHBondContact OG1-CD 3.44Å; T540-P544 VanDerWaalsContact OG1-CG 3.26Å; T540-P544 WeakPolarHBondContact OG1-CG 3.49Å; P544-V558 HydrophobicContact CB-CG1 4.05Å; P544-S560 WeakPolarHBondContact CA-OG 3.44Å
545	V	97.6	Very high	96.6	Very high	6 Å²	6	33.1 Å²	33.1	4%	0.036	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-29.4	-172.9	-63.5	0	0	0	0	115.4	S505 V543 L559 W561 W793	S505-V545 WeakPolarHBondContact CB-O 3.38Å; V543-V545 HydrophobicContact CG1-CG1 3.93Å; V543-V545 PolarHBondContact O-N 3.5Å; V545-L559 HydrophobicContact CG2-CG 4.47Å; V545-L559 WeakPolarHBondContact CG2-O 3.1Å; V545-L559 PolarHBondContact N-O 3.08Å; V545-W561 HydrophobicContact CB-CZ2 4.36Å; V545-W561 HydrophobicContact CG1-CD2 3.75Å; V545-W561 HydrophobicContact CG1-CE3 4.01Å; V545-W561 HydrophobicContact CG1-CG 4.16Å; V545-W561 HydrophobicContact CG1-CH2 4.4Å; V545-W561 HydrophobicContact CG1-CZ2 4.16Å; V545-W561 HydrophobicContact CG1-CZ3 4.33Å; V545-W561 HydrophobicContact CG2-CD2 4.08Å; V545-W561 HydrophobicContact CG2-CG 4.12Å; V545-W561 HydrophobicContact CG2-CZ2 4.01Å; V545-W793 HydrophobicContact CG1-CE3 3.78Å; V545-W793 HydrophobicContact CG1-CZ3 4.34Å
546	K	97.9	Very high	96.8	Very high	61 Å²	61	30.8 Å²	30.8	27%	0.265	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	125.4	-174.3	180	-178.3	179.1	-176.5	0	109.6	L559 D600 F601	K546-L559 HydrophobicContact CB-CB 4.19Å; K546-L559 HydrophobicContact CB-CD2 4.42Å; K546-L559 PolarHBondContact N-O 3.42Å; K546-L559 PolarHBondContact O-N 2.87Å; K546-D600 VanDerWaalsContact CD-OD1 3.3Å; K546-D600 WeakPolarHBondContact CD-OD1 3.26Å; K546-D600 WeakPolarHBondContact CE-OD1 3.5Å; K546-D600 IonicContact NZ-OD1 3.38Å; K546-D600 PolarHBondContact NZ-OD1 3.15Å; K546-D600 IonicContact NZ-OD2 2.9Å; K546-D600 PolarHBondContact NZ-OD2 2.83Å; K546-F601 HydrophobicContact CD-CE1 3.94Å; K546-F601 HydrophobicContact CD-CZ 4.43Å; K546-F601 HydrophobicContact CG-CE1 4.18Å; K546-F601 HydrophobicContact CG-CZ 4.46Å; K546-F601 PolarHBondContact NZ-O 3.02Å
547	L	98.5	Very high	97	Very high	9 Å²	9	28.9 Å²	28.9	5%	0.047	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143	173.3	-56.9	-176.8	0	0	0	109.5	S505 V507 A517 I524 V556 W557 V558	S505-L547 PolarHBondContact OG-N 2.84Å; S505-L547 VanDerWaalsContact OG-N 3.16Å; V507-L547 HydrophobicContact CG1-CB 3.83Å; V507-L547 WeakPolarHBondContact CG1-O 3.38Å; V507-L547 HydrophobicContact CG2-CB 4Å; V507-L547 HydrophobicContact CG2-CD1 4.46Å; A517-L547 HydrophobicContact CB-CD1 4.11Å; A517-L547 HydrophobicContact CB-CD2 4.39Å; A517-L547 HydrophobicContact CB-CG 4.18Å; I524-L547 HydrophobicContact CD1-CD2 3.58Å; I524-L547 HydrophobicContact CG1-CD2 4.17Å; L547-V556 HydrophobicContact CB-CG1 4.47Å; L547-V556 HydrophobicContact CD2-CG1 4.4Å; L547-W557 CarbonylContact C-O 3.46Å; L547-W557 VanDerWaalsContact CA-O 3.3Å; L547-W557 WeakPolarHBondContact CA-O 3.3Å; L547-V558 HydrophobicContact CD2-CB 4.17Å; L547-V558 HydrophobicContact CD2-CG1 3.93Å; L547-V558 HydrophobicContact CD2-CG2 3.81Å
548	H	98.1	Very high	97.1	Very high	37 Å²	37	28 Å²	28	17%	0.171	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	128.5	171.2	-174.4	88.2	0	0	0	110	V556 W557 F601 I603	H548-V556 CarbonylContact O-C 3.59Å; H548-V556 WeakPolarHBondContact O-CA 3.49Å; H548-W557 HydrophobicContact CB-CB 4.39Å; H548-W557 PolarHBondContact N-O 3.28Å; H548-W557 PolarHBondContact O-N 2.79Å; H548-F601 HydrophobicContact CB-CE2 3.55Å; H548-F601 HydrophobicContact CB-CZ 3.59Å; H548-I603 PolarHBondContact CE1-O 3.27Å
549	Y	97.8	Very high	97.2	Very high	28 Å²	28	27.9 Å²	27.9	11%	0.11	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	111	176.3	178.5	-127.3	0	0	0	110.5	N508 V509 K510 K551 D554 Q555 V556 A577	N508-Y549 WeakPolarHBondContact O-CD1 3.36Å; V509-Y549 HydrophobicContact CB-CD2 4.44Å; V509-Y549 HydrophobicContact CB-CE2 4.38Å; V509-Y549 HydrophobicContact CG1-CD2 4.2Å; V509-Y549 HydrophobicContact CG1-CE1 4.43Å; V509-Y549 HydrophobicContact CG1-CE2 3.7Å; V509-Y549 HydrophobicContact CG2-CD2 3.81Å; V509-Y549 HydrophobicContact CG2-CE2 4.19Å; V509-Y549 HydrophobicContact CG2-CG 4.02Å; K510-Y549 VanDerWaalsContact CE-OH 3.24Å; K510-Y549 WeakPolarHBondContact CE-OH 3.47Å; K510-Y549 HydrophobicContact CG-CE1 4.29Å; K510-Y549 VanDerWaalsContact CG-OH 3.3Å; K510-Y549 WeakPolarHBondContact CG-OH 3.42Å; Y549-K551 HydrophobicContact CD1-CB 4.14Å; Y549-K551 HydrophobicContact CE1-CB 3.63Å; Y549-K551 HydrophobicContact CE1-CG 3.94Å; Y549-K551 PolarHBondContact O-N 3.35Å; Y549-D554 PolarHBondContact OH-OD1 3.29Å; Y549-Q555 VanDerWaalsContact CD2-O 3.23Å; Y549-Q555 WeakPolarHBondContact CD2-O 3.31Å; Y549-V556 HydrophobicContact CD2-CG2 3.93Å; Y549-A577 HydrophobicContact CE2-CB 4.34Å
550	D	97	Very high	97.2	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	97.5	166.6	175.5	8	0	0	0	109.3	S552 H553 D554 Q555	D550-S552 PolarHBondContact O-N 2.9Å; D550-S552 WeakPolarHBondContact OD1-CA 3.36Å; D550-S552 WeakPolarHBondContact OD1-CB 3.46Å; D550-S552 PolarHBondContact OD1-N 3.47Å; D550-S552 PolarHBondContact OD1-OG 2.97Å; D550-H553 PolarHBondContact OD1-N 2.91Å; D550-H553 IonicContact OD1-ND1 2.67Å; D550-H553 IonicContact OD2-CE1 2.93Å; D550-H553 IonicContact OD2-CG 2.79Å; D550-H553 IonicContact OD2-ND1 3.5Å; D550-H553 PolarHBondContact OD2-ND1 3.5Å; D550-D554 WeakPolarHBondContact O-CA 3.22Å; D550-D554 PolarHBondContact O-N 2.78Å; D550-Q555 HydrophobicContact CB-CB 4.35Å; D550-Q555 PolarHBondContact N-O 3.37Å; D550-Q555 PolarHBondContact O-N 2.94Å
551	K	94.5	Very high	97.1	Very high	128 Å²	128	23.5 Å²	23.5	56%	0.557	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.4	177.5	-173.6	176.4	-178	176.6	0	113	Y549 P606	Y549-K551 HydrophobicContact CD1-CB 4.14Å; Y549-K551 HydrophobicContact CE1-CB 3.63Å; Y549-K551 HydrophobicContact CE1-CG 3.94Å; Y549-K551 PolarHBondContact O-N 3.35Å; K551-P606 HydrophobicContact CB-CG 3.98Å
552	S	93.9	Very high	97	Very high	29 Å²	29	22.8 Å²	22.8	20%	0.203	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-32.8	-176.9	65.1	0	0	0	0	113	D550 M613	D550-S552 PolarHBondContact O-N 2.9Å; D550-S552 WeakPolarHBondContact OD1-CA 3.36Å; D550-S552 WeakPolarHBondContact OD1-CB 3.46Å; D550-S552 PolarHBondContact OD1-N 3.47Å; D550-S552 PolarHBondContact OD1-OG 2.97Å; S552-M613 PolarHBondContact OG-N 3.48Å; S552-M613 PolarHBondContact OG-O 2.86Å
553	H	96	Very high	96.9	Very high	37 Å²	37	21.2 Å²	21.2	17%	0.171	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	2.6	177.2	-55.7	98.3	0	0	0	114.1	D550 Q555 H612 M613	D550-H553 PolarHBondContact OD1-N 2.91Å; D550-H553 IonicContact OD1-ND1 2.67Å; D550-H553 IonicContact OD2-CE1 2.93Å; D550-H553 IonicContact OD2-CG 2.79Å; D550-H553 IonicContact OD2-ND1 3.5Å; D550-H553 PolarHBondContact OD2-ND1 3.5Å; H553-Q555 HydrophobicContact CB-CG 3.86Å; H553-H612 AromaticContact NE2-NE2 3.62Å; H553-M613 PolarHBondContact CE1-O 3.44Å
554	D	96.6	Very high	96.6	Very high	19 Å²	19	25 Å²	25	10%	0.102	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	51.9	-174.5	-164.5	41.7	0	0	0	113.2	K510 Y549 D550 L576 A577 S578	K510-D554 IonicContact NZ-OD1 2.9Å; K510-D554 IonicContact NZ-OD2 3.14Å; Y549-D554 PolarHBondContact OH-OD1 3.29Å; D550-D554 WeakPolarHBondContact O-CA 3.22Å; D550-D554 PolarHBondContact O-N 2.78Å; D554-L576 PolarHBondContact O-N 2.85Å; D554-A577 PolarHBondContact O-N 2.78Å; D554-A577 PolarHBondContact OD2-N 2.7Å; D554-S578 WeakPolarHBondContact OD1-CB 3.38Å; D554-S578 PolarHBondContact OD1-N 3.32Å; D554-S578 PolarHBondContact OD1-OG 3.49Å; D554-S578 WeakPolarHBondContact OD2-CB 3.45Å; D554-S578 PolarHBondContact OD2-N 3.48Å; D554-S578 PolarHBondContact OD2-OG 2.8Å
555	Q	97.4	Very high	96.4	Very high	9 Å²	9	31.5 Å²	31.5	4%	0.042	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.1	-175.1	-64.1	171.9	7	0	0	111.7	Y549 D550 H553 V573 I574 T575 L631	Y549-Q555 VanDerWaalsContact CD2-O 3.23Å; Y549-Q555 WeakPolarHBondContact CD2-O 3.31Å; D550-Q555 HydrophobicContact CB-CB 4.35Å; D550-Q555 PolarHBondContact N-O 3.37Å; D550-Q555 PolarHBondContact O-N 2.94Å; H553-Q555 HydrophobicContact CB-CG 3.86Å; Q555-V573 HydrophobicContact CB-CG1 3.85Å; Q555-V573 HydrophobicContact CG-CG1 4.06Å; Q555-I574 CarbonylContact C-O 3.49Å; Q555-I574 VanDerWaalsContact CA-O 3.26Å; Q555-I574 WeakPolarHBondContact CA-O 3.45Å; Q555-T575 HydrophobicContact CG-CG2 4.43Å; Q555-L631 PolarHBondContact NE2-O 3.47Å; Q555-L631 PolarHBondContact OE1-O 3.07Å
556	V	98.5	Very high	96.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.6	167.1	175.7	0	0	0	0	109	V507 V509 Y515 L547 H548 Y549 V558 V573 I574 A577	V507-V556 HydrophobicContact CG2-CG1 4.1Å; V507-V556 HydrophobicContact CG2-CG2 4.26Å; V509-V556 HydrophobicContact CG2-CG2 3.7Å; Y515-V556 HydrophobicContact CD1-CB 4.38Å; Y515-V556 HydrophobicContact CD1-CG1 4.26Å; Y515-V556 HydrophobicContact CD1-CG2 4.14Å; Y515-V556 HydrophobicContact CD2-CG2 4.27Å; Y515-V556 HydrophobicContact CE1-CG2 4.25Å; Y515-V556 HydrophobicContact CE2-CG2 4.39Å; Y515-V556 HydrophobicContact CG-CG2 4.14Å; L547-V556 HydrophobicContact CB-CG1 4.47Å; L547-V556 HydrophobicContact CD2-CG1 4.4Å; H548-V556 CarbonylContact O-C 3.59Å; H548-V556 WeakPolarHBondContact O-CA 3.49Å; Y549-V556 HydrophobicContact CD2-CG2 3.93Å; V556-V558 HydrophobicContact CG1-CG2 4.38Å; V556-V573 CarbonylContact O-C 3.48Å; V556-V573 WeakPolarHBondContact O-CA 3.12Å; V556-I574 HydrophobicContact CB-CB 4.33Å; V556-I574 PolarHBondContact N-O 2.9Å; V556-I574 PolarHBondContact O-N 2.71Å; V556-A577 HydrophobicContact CG2-CB 3.71Å
557	W	98.1	Very high	95.6	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	134.6	175.9	-70.5	70.6	0	0	0	110	L547 H548 L571 V573 T588 F601 I603 I629 L631 M634	L547-W557 CarbonylContact C-O 3.46Å; L547-W557 VanDerWaalsContact CA-O 3.3Å; L547-W557 WeakPolarHBondContact CA-O 3.3Å; H548-W557 HydrophobicContact CB-CB 4.39Å; H548-W557 PolarHBondContact N-O 3.28Å; H548-W557 PolarHBondContact O-N 2.79Å; W557-L571 HydrophobicContact CE3-CD1 4.15Å; W557-L571 HydrophobicContact CE3-CD2 3.72Å; W557-L571 HydrophobicContact CE3-CG 3.85Å; W557-L571 HydrophobicContact CZ3-CD2 3.57Å; W557-L571 HydrophobicContact CZ3-CG 4.07Å; W557-V573 HydrophobicContact CD2-CG2 3.69Å; W557-V573 HydrophobicContact CE3-CG2 3.71Å; W557-V573 HydrophobicContact CG-CG2 4.28Å; W557-V573 HydrophobicContact CH2-CG2 4.05Å; W557-V573 HydrophobicContact CZ2-CG2 4.01Å; W557-V573 HydrophobicContact CZ3-CG2 3.91Å; W557-T588 HydrophobicContact CE3-CG2 4.43Å; W557-T588 HydrophobicContact CH2-CG2 4.13Å; W557-T588 HydrophobicContact CZ3-CG2 3.69Å; W557-F601 HydrophobicContact CB-CE2 3.77Å; W557-F601 HydrophobicContact CB-CZ 3.81Å; W557-F601 HydrophobicContact CG-CE2 4.43Å; W557-I603 HydrophobicContact CB-CD1 4.39Å; W557-I603 HydrophobicContact CD2-CD1 3.69Å; W557-I603 HydrophobicContact CE3-CD1 4.39Å; W557-I603 HydrophobicContact CG-CD1 3.64Å; W557-I603 HydrophobicContact CZ2-CD1 4.47Å; W557-I629 HydrophobicContact CH2-CD1 3.66Å; W557-I629 HydrophobicContact CH2-CG1 4.28Å; W557-I629 HydrophobicContact CZ3-CD1 3.94Å; W557-L631 HydrophobicContact CH2-CD2 3.97Å; W557-L631 HydrophobicContact CZ2-CD2 3.43Å; W557-L631 VanDerWaalsContact CZ2-CD2 3.43Å; W557-M634 HydrophobicContact CH2-CG 4.33Å; W557-M634 HydrophobicContact CZ2-CG 4.17Å
558	V	98.2	Very high	95.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	115	-172.4	-173.6	0	0	0	0	108.9	I524 T540 P544 L547 V556 L571 Q572	I524-V558 HydrophobicContact CD1-CB 4.34Å; I524-V558 HydrophobicContact CD1-CG1 3.84Å; I524-V558 HydrophobicContact CD1-CG2 3.51Å; T540-V558 HydrophobicContact CG2-CG1 4.38Å; P544-V558 HydrophobicContact CB-CG1 4.05Å; L547-V558 HydrophobicContact CD2-CB 4.17Å; L547-V558 HydrophobicContact CD2-CG1 3.93Å; L547-V558 HydrophobicContact CD2-CG2 3.81Å; V556-V558 HydrophobicContact CG1-CG2 4.38Å; V558-L571 WeakPolarHBondContact O-CA 3.43Å; V558-Q572 HydrophobicContact CB-CB 4.25Å; V558-Q572 PolarHBondContact N-O 2.93Å; V558-Q572 PolarHBondContact O-N 2.66Å
559	L	97.3	Very high	95	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120.7	169.4	173.5	67.4	0	0	0	109.5	V545 K546 L571 V598 F601	V545-L559 HydrophobicContact CG2-CG 4.47Å; V545-L559 WeakPolarHBondContact CG2-O 3.1Å; V545-L559 PolarHBondContact N-O 3.08Å; K546-L559 HydrophobicContact CB-CB 4.19Å; K546-L559 HydrophobicContact CB-CD2 4.42Å; K546-L559 PolarHBondContact N-O 3.42Å; K546-L559 PolarHBondContact O-N 2.87Å; L559-L571 HydrophobicContact CB-CD1 4.33Å; L559-V598 HydrophobicContact CD1-CB 4.39Å; L559-V598 HydrophobicContact CD1-CG1 3.65Å; L559-F601 HydrophobicContact CB-CD1 4.04Å; L559-F601 HydrophobicContact CB-CE1 3.74Å; L559-F601 HydrophobicContact CD2-CD1 4.41Å
560	S	96.8	Very high	94.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	145.5	174.2	-70.1	0	0	0	0	110.3	D541 P542 V543 P544 P569 T570	D541-S560 PolarHBondContact O-OG 3.08Å; D541-S560 VanDerWaalsContact O-OG 3.06Å; P542-S560 WeakPolarHBondContact O-CB 3.25Å; V543-S560 VanDerWaalsContact O-CA 3.3Å; V543-S560 WeakPolarHBondContact O-CA 3.17Å; P544-S560 WeakPolarHBondContact CA-OG 3.44Å; S560-P569 CarbonylContact O-C 3.58Å; S560-P569 WeakPolarHBondContact O-CA 3.05Å; S560-P569 WeakPolarHBondContact O-CB 3.25Å; S560-T570 PolarHBondContact N-O 3.27Å; S560-T570 PolarHBondContact O-N 2.84Å
561	W	95.7	Very high	94.7	Very high	20 Å²	20	36.9 Å²	36.9	8%	0.076	20%	0.195	C	C	.	.			trans	-90.5	-16.4	-179	-72.8	-8	0	0	0	114.3	V543 V545 S563 K566 S568 P792 W793	V543-W561 HydrophobicContact CB-CB 4.3Å; V543-W561 HydrophobicContact CG1-CB 4.34Å; V543-W561 HydrophobicContact CG1-CE3 4.36Å; V543-W561 PolarHBondContact O-N 2.03Å; V545-W561 HydrophobicContact CB-CZ2 4.36Å; V545-W561 HydrophobicContact CG1-CD2 3.75Å; V545-W561 HydrophobicContact CG1-CE3 4.01Å; V545-W561 HydrophobicContact CG1-CG 4.16Å; V545-W561 HydrophobicContact CG1-CH2 4.4Å; V545-W561 HydrophobicContact CG1-CZ2 4.16Å; V545-W561 HydrophobicContact CG1-CZ3 4.33Å; V545-W561 HydrophobicContact CG2-CD2 4.08Å; V545-W561 HydrophobicContact CG2-CG 4.12Å; V545-W561 HydrophobicContact CG2-CZ2 4.01Å; W561-S563 VanDerWaalsContact CB-O 3.28Å; W561-S563 WeakPolarHBondContact CB-O 3.42Å; W561-S563 PolarHBondContact O-N 2.82Å; W561-K566 HydrophobicContact CB-CG 4.2Å; W561-K566 HydrophobicContact CD2-CD 4.08Å; W561-K566 HydrophobicContact CD2-CG 3.74Å; W561-K566 VanDerWaalsContact CE2-CE 3.41Å; W561-K566 HydrophobicContact CE3-CG 4.01Å; W561-K566 HydrophobicContact CG-CD 4.29Å; W561-K566 HydrophobicContact CG-CG 3.83Å; W561-K566 HydrophobicContact CZ2-CD 4.47Å; W561-K566 VanDerWaalsContact CZ2-CE 3.43Å; W561-K566 WeakPolarHBondContact O-CA 3.38Å; W561-S568 CarbonylContact O-C 3.47Å; W561-P792 WeakPolarHBondContact CH2-O 3.42Å; W561-W793 HydrophobicContact CZ3-CE3 4.37Å
562	G	93.9	Very high	94.7	Very high	16 Å²	16	31 Å²	31	17%	0.165	17%	0.17	C	C	.	.	S	Bend	trans	74.2	-37.9	-173.6	0	0	0	0	0	113.7	P542	P542-G562 WeakPolarHBondContact CB-O 3.45Å; P542-G562 WeakPolarHBondContact O-CA 3.5Å; P542-G562 PolarHBondContact O-N 2.82Å
563	S	94.5	Very high	94.9	Very high	24 Å²	24	29.7 Å²	29.7	17%	0.168	16%	0.16	C	C	.	.	S	Bend	trans	-151.9	169.8	168.8	82	0	0	0	0	110.8	W561 E565 K566 T567	W561-S563 VanDerWaalsContact CB-O 3.28Å; W561-S563 WeakPolarHBondContact CB-O 3.42Å; W561-S563 PolarHBondContact O-N 2.82Å; S563-E565 WeakPolarHBondContact CB-OE2 3.27Å; S563-E565 PolarHBondContact O-N 2.6Å; S563-E565 PolarHBondContact OG-N 3.19Å; S563-E565 PolarHBondContact OG-OE2 2.98Å; S563-K566 PolarHBondContact O-N 2.88Å; S563-T567 WeakPolarHBondContact CB-OG1 3.18Å; S563-T567 WeakPolarHBondContact OG-CG2 3.22Å; S563-T567 PolarHBondContact OG-OG1 2.75Å
564	M	93.2	Very high	95	Very high	95 Å²	95	27.9 Å²	27.9	47%	0.468	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.7	175.6	-70.4	-59.4	-64.9	0	0	113	V543 K566 P792 W793	V543-M564 HydrophobicContact CG1-SD 4.18Å; M564-K566 VanDerWaalsContact C-N 3.28Å; M564-P792 HydrophobicContact CE-CB 4.24Å; M564-P792 HydrophobicContact CE-CG 4.2Å; M564-W793 HydrophobicContact CE-CH2 4.09Å; M564-W793 HydrophobicContact CE-CZ3 3.89Å; M564-W793 HydrophobicContact SD-CH2 3.92Å; M564-W793 HydrophobicContact SD-CZ3 3.66Å
565	E	91.9	Very high	95	Very high	137 Å²	137	28.8 Å²	28.8	64%	0.64	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	3.2	175.4	-52.4	73.3	-159.1	0	0	113.2	S563 T567	S563-E565 WeakPolarHBondContact CB-OE2 3.27Å; S563-E565 PolarHBondContact O-N 2.6Å; S563-E565 PolarHBondContact OG-N 3.19Å; S563-E565 PolarHBondContact OG-OE2 2.98Å; E565-T567 HydrophobicContact CB-CG2 4.09Å
566	K	91.3	Very high	94.9	Very high	76 Å²	76	33.3 Å²	33.3	33%	0.33	18%	0.182	S	C	.	.			trans	57	47.2	-178.1	-46.9	-171.1	-174.1	-169.5	0	113.2	W561 S563 M564 D599	W561-K566 HydrophobicContact CB-CG 4.2Å; W561-K566 HydrophobicContact CD2-CD 4.08Å; W561-K566 HydrophobicContact CD2-CG 3.74Å; W561-K566 VanDerWaalsContact CE2-CE 3.41Å; W561-K566 HydrophobicContact CE3-CG 4.01Å; W561-K566 HydrophobicContact CG-CD 4.29Å; W561-K566 HydrophobicContact CG-CG 3.83Å; W561-K566 HydrophobicContact CZ2-CD 4.47Å; W561-K566 VanDerWaalsContact CZ2-CE 3.43Å; W561-K566 WeakPolarHBondContact O-CA 3.38Å; S563-K566 PolarHBondContact O-N 2.88Å; M564-K566 VanDerWaalsContact C-N 3.28Å; K566-D599 IonicContact NZ-OD1 3.64Å
567	T	88.2	Confident	94.9	Very high	93 Å²	93	33.3 Å²	33.3	57%	0.571	18%	0.182	S	C	*	.	S	Bend	trans	-76.6	-30.5	-173.8	50	0	0	0	0	114.2	S563 E565	S563-T567 WeakPolarHBondContact CB-OG1 3.18Å; S563-T567 WeakPolarHBondContact OG-CG2 3.22Å; S563-T567 PolarHBondContact OG-OG1 2.75Å; E565-T567 HydrophobicContact CB-CG2 4.09Å
568	S	90.5	Very high	94.8	Very high	58 Å²	58	34 Å²	34	41%	0.406	19%	0.187	S	C	.	.	S	Bend	trans	-146.4	67.3	-178.4	62.6	0	0	0	0	110.6	W561	W561-S568 CarbonylContact O-C 3.47Å
569	P	93.3	Very high	94.6	Very high	7 Å²	7	35 Å²	35	5%	0.045	20%	0.197	C	C	.	.			trans	-63.7	150	179.2	28.3	-36	0	0	0	111.3	S560 F595 D596 V598	S560-P569 CarbonylContact O-C 3.58Å; S560-P569 WeakPolarHBondContact O-CA 3.05Å; S560-P569 WeakPolarHBondContact O-CB 3.25Å; P569-F595 CarbonylContact O-C 3.53Å; P569-D596 WeakPolarHBondContact CD-O 3.17Å; P569-D596 WeakPolarHBondContact CG-O 3.32Å; P569-V598 HydrophobicContact CB-CB 4.49Å; P569-V598 WeakPolarHBondContact CB-O 3.11Å; P569-V598 WeakPolarHBondContact CG-O 3.47Å
570	T	93.2	Very high	94.4	Very high	21 Å²	21	41.2 Å²	41.2	13%	0.129	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	157	179.2	61.7	0	0	0	0	110.9	D541 S560	D541-T570 VanDerWaalsContact CB-OG1 3.28Å; D541-T570 WeakPolarHBondContact CB-OG1 3.43Å; D541-T570 WeakPolarHBondContact OD2-CB 3.1Å; D541-T570 WeakPolarHBondContact OD2-CG2 3.47Å; D541-T570 PolarHBondContact OD2-OG1 2.84Å; S560-T570 PolarHBondContact N-O 3.27Å; S560-T570 PolarHBondContact O-N 2.84Å
571	L	94.8	Very high	94.2	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	118.3	175.4	-163.8	63.5	0	0	0	108.7	W557 V558 L559 T588 F601 I618	W557-L571 HydrophobicContact CE3-CD1 4.15Å; W557-L571 HydrophobicContact CE3-CD2 3.72Å; W557-L571 HydrophobicContact CE3-CG 3.85Å; W557-L571 HydrophobicContact CZ3-CD2 3.57Å; W557-L571 HydrophobicContact CZ3-CG 4.07Å; V558-L571 WeakPolarHBondContact O-CA 3.43Å; L559-L571 HydrophobicContact CB-CD1 4.33Å; L571-T588 HydrophobicContact CB-CG2 4.4Å; L571-T588 HydrophobicContact CD2-CG2 4.27Å; L571-T588 HydrophobicContact CG-CG2 4.18Å; L571-T588 PolarHBondContact O-N 2.98Å; L571-F601 HydrophobicContact CD1-CD1 3.72Å; L571-F601 HydrophobicContact CD1-CE1 4.02Å; L571-F601 HydrophobicContact CD1-CG 4.17Å; L571-I618 HydrophobicContact CD2-CD1 3.62Å; L571-I618 HydrophobicContact CD2-CG1 3.88Å
572	Q	95.7	Very high	94.1	Very high	5 Å²	5	48.7 Å²	48.7	2%	0.023	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	154.8	178	-63.5	-179	-48.2	0	0	109.9	D541 V558 T585 I586 H587	D541-Q572 PolarHBondContact OD1-NE2 3.29Å; D541-Q572 VanDerWaalsContact OD2-CD 3.24Å; D541-Q572 PolarHBondContact OD2-NE2 2.84Å; D541-Q572 VanDerWaalsContact OD2-NE2 3.15Å; V558-Q572 HydrophobicContact CB-CB 4.25Å; V558-Q572 PolarHBondContact N-O 2.93Å; V558-Q572 PolarHBondContact O-N 2.66Å; Q572-T585 HydrophobicContact CB-CG2 4.18Å; Q572-I586 CarbonylContact C-O 3.24Å; Q572-I586 VanDerWaalsContact CA-O 3.32Å; Q572-I586 WeakPolarHBondContact CA-O 3.2Å; Q572-H587 PolarHBondContact NE2-NE2 3.19Å
573	V	97.5	Very high	94.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.4	179.9	-176	0	0	0	0	109.4	Q555 V556 W557 T575 I586 T588 M634	Q555-V573 HydrophobicContact CB-CG1 3.85Å; Q555-V573 HydrophobicContact CG-CG1 4.06Å; V556-V573 CarbonylContact O-C 3.48Å; V556-V573 WeakPolarHBondContact O-CA 3.12Å; W557-V573 HydrophobicContact CD2-CG2 3.69Å; W557-V573 HydrophobicContact CE3-CG2 3.71Å; W557-V573 HydrophobicContact CG-CG2 4.28Å; W557-V573 HydrophobicContact CH2-CG2 4.05Å; W557-V573 HydrophobicContact CZ2-CG2 4.01Å; W557-V573 HydrophobicContact CZ3-CG2 3.91Å; V573-T575 HydrophobicContact CG1-CG2 4.24Å; V573-I586 PolarHBondContact N-O 2.89Å; V573-I586 PolarHBondContact O-N 2.81Å; V573-T588 HydrophobicContact CG2-CG2 3.7Å; V573-M634 HydrophobicContact CB-SD 3.88Å; V573-M634 HydrophobicContact CG1-SD 3.83Å; V573-M634 HydrophobicContact CG2-CG 4.46Å; V573-M634 HydrophobicContact CG2-SD 4.05Å
574	I	98.1	Very high	94.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.3	167	-56.8	175.2	0	0	0	107	Y515 I524 V538 Q555 V556 H583 T585	Y515-I574 HydrophobicContact CD1-CD1 3.98Å; Y515-I574 HydrophobicContact CE1-CD1 3.71Å; Y515-I574 HydrophobicContact CE1-CG2 4.11Å; I524-I574 HydrophobicContact CD1-CD1 4.2Å; V538-I574 HydrophobicContact CG1-CD1 4.22Å; Q555-I574 CarbonylContact C-O 3.49Å; Q555-I574 VanDerWaalsContact CA-O 3.26Å; Q555-I574 WeakPolarHBondContact CA-O 3.45Å; V556-I574 HydrophobicContact CB-CB 4.33Å; V556-I574 PolarHBondContact N-O 2.9Å; V556-I574 PolarHBondContact O-N 2.71Å; I574-H583 HydrophobicContact CG2-CB 3.96Å; I574-T585 HydrophobicContact CD1-CG2 4.17Å; I574-T585 HydrophobicContact CG1-CG2 3.84Å
575	T	96.5	Very high	94.4	Very high	38 Å²	38	49.3 Å²	49.3	23%	0.233	28%	0.277	C	S	.	.	S	Bend	trans	-91	159.5	-179.9	61.3	0	0	0	0	111.3	Q555 V573 A577 I586 M634	Q555-T575 HydrophobicContact CG-CG2 4.43Å; V573-T575 HydrophobicContact CG1-CG2 4.24Å; T575-A577 PolarHBondContact O-N 3.39Å; T575-I586 HydrophobicContact CG2-CD1 4.4Å; T575-M634 HydrophobicContact CG2-CE 3.83Å; T575-M634 HydrophobicContact CG2-SD 4.29Å
576	L	96	Very high	94.5	Very high	103 Å²	103	46 Å²	46	54%	0.539	26%	0.263	S	S	.	.	S	Bend	trans	53.1	40.8	-178.1	-56.2	173.2	0	0	0	111.7	D554 S578 G579 V581	D554-L576 PolarHBondContact O-N 2.85Å; L576-S578 PolarHBondContact O-N 3.34Å; L576-S578 VanDerWaalsContact O-N 3.12Å; L576-G579 WeakPolarHBondContact O-CA 3.28Å; L576-G579 PolarHBondContact O-N 3.2Å; L576-V581 HydrophobicContact CB-CG2 4.14Å; L576-V581 HydrophobicContact CD1-CG2 4.48Å
577	A	97.2	Very high	94.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.7	-167.7	0	0	0	0	0	113.3	V509 Y515 Y549 D554 V556 T575 H583	V509-A577 HydrophobicContact CG1-CB 3.96Å; Y515-A577 HydrophobicContact CE2-CB 4.38Å; Y515-A577 VanDerWaalsContact OH-CA 3.25Å; Y515-A577 WeakPolarHBondContact OH-CA 3.27Å; Y515-A577 PolarHBondContact OH-O 2.87Å; Y549-A577 HydrophobicContact CE2-CB 4.34Å; D554-A577 PolarHBondContact O-N 2.78Å; D554-A577 PolarHBondContact OD2-N 2.7Å; V556-A577 HydrophobicContact CG2-CB 3.71Å; T575-A577 PolarHBondContact O-N 3.39Å; A577-H583 PolarHBondContact O-CE1 3.14Å
578	S	96.5	Very high	94.4	Very high	16 Å²	16	42.7 Å²	42.7	11%	0.112	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.2	174.5	72.6	0	0	0	0	113.9	K510 K512 D554 L576	K510-S578 PolarHBondContact NZ-OG 3.3Å; K512-S578 WeakPolarHBondContact CD-O 3.44Å; K512-S578 PolarHBondContact NZ-O 2.97Å; D554-S578 WeakPolarHBondContact OD1-CB 3.38Å; D554-S578 PolarHBondContact OD1-N 3.32Å; D554-S578 PolarHBondContact OD1-OG 3.49Å; D554-S578 WeakPolarHBondContact OD2-CB 3.45Å; D554-S578 PolarHBondContact OD2-N 3.48Å; D554-S578 PolarHBondContact OD2-OG 2.8Å; L576-S578 PolarHBondContact O-N 3.34Å; L576-S578 VanDerWaalsContact O-N 3.12Å
579	G	95.4	Very high	94.1	Very high	21 Å²	21	45 Å²	45	22%	0.216	25%	0.247	C	C	.	.	S	Bend	trans	-73.9	154.4	-177.9	0	0	0	0	0	113.4	L576 V581 H583	L576-G579 WeakPolarHBondContact O-CA 3.28Å; L576-G579 PolarHBondContact O-N 3.2Å; G579-V581 PolarHBondContact O-N 3.44Å; G579-V581 VanDerWaalsContact O-N 3.11Å; G579-H583 PolarHBondContact O-NE2 2.84Å
580	N	92.1	Very high	93.5	Very high	135 Å²	135	47.7 Å²	47.7	72%	0.722	27%	0.265	S	S	*	.	S	Bend	trans	-84.5	44	172.4	-68.4	-21.6	0	0	0	111.6	K512	K512-N580 VanDerWaalsContact CE-OD1 3.25Å; K512-N580 WeakPolarHBondContact CE-OD1 2.83Å; K512-N580 PolarHBondContact NZ-OD1 3.05Å
581	V	93.2	Very high	92.6	Very high	67 Å²	67	46.9 Å²	46.9	41%	0.406	26%	0.26	S	S	.	.	S	Bend	trans	-107.7	156.3	177.9	-64.5	0	0	0	0	109.1	L576 G579 H583	L576-V581 HydrophobicContact CB-CG2 4.14Å; L576-V581 HydrophobicContact CD1-CG2 4.48Å; G579-V581 PolarHBondContact O-N 3.44Å; G579-V581 VanDerWaalsContact O-N 3.11Å; V581-H583 PolarHBondContact O-CD2 2.89Å; V581-H583 PolarHBondContact O-N 2.04Å; V581-H583 VanDerWaalsContact O-N 3.12Å; V581-H583 PolarHBondContact O-NE2 2.8Å
582	P	92.7	Very high	91.3	Very high	109 Å²	109	48.9 Å²	48.9	71%	0.708	28%	0.28	S	S	*	.			trans	-58.8	118.9	171.8	-22.9	33.9	0	0	0	110.5	H584	P582-H584 PolarHBondContact O-ND1 3.25Å
583	H	95.7	Very high	90	Very high	11 Å²	11	58 Å²	58	5%	0.051	32%	0.32	C	S	.	.			trans	-80.9	137.4	-178.3	-58.9	154.2	0	0	0	110.3	Y515 I526 Q536 V538 I574 A577 G579 V581	Y515-H583 AromaticContact CZ-ND1 3.67Å; Y515-H583 PolarHBondContact OH-CE1 2.81Å; Y515-H583 PolarHBondContact OH-ND1 2.75Å; I526-H583 HydrophobicContact CD1-CB 3.64Å; I526-H583 WeakPolarHBondContact CD1-ND1 3.21Å; Q536-H583 PolarHBondContact NE2-O 3.3Å; Q536-H583 VanDerWaalsContact OE1-N 3.13Å; V538-H583 HydrophobicContact CG2-CB 3.99Å; I574-H583 HydrophobicContact CG2-CB 3.96Å; A577-H583 PolarHBondContact O-CE1 3.14Å; G579-H583 PolarHBondContact O-NE2 2.84Å; V581-H583 PolarHBondContact O-CD2 2.89Å; V581-H583 PolarHBondContact O-N 2.04Å; V581-H583 VanDerWaalsContact O-N 3.12Å; V581-H583 PolarHBondContact O-NE2 2.8Å
584	H	96.1	Very high	88.8	Confident	105 Å²	105	61.2 Å²	61.2	49%	0.486	34%	0.335	S	S	.	.			trans	-150.2	153.5	178.3	62.3	-77.2	0	0	0	109.5	P582	P582-H584 PolarHBondContact O-ND1 3.25Å
585	T	96.7	Very high	87.6	Confident	32 Å²	32	64.6 Å²	64.6	20%	0.196	35%	0.35	C	S	.	.			trans	-82.8	144.7	176.5	45.6	0	0	0	0	111	V538 S539 T540 Q572 I574	V538-T585 HydrophobicContact CG1-CG2 4.12Å; S539-T585 PolarHBondContact O-OG1 2.83Å; T540-T585 HydrophobicContact CG2-CG2 4.08Å; Q572-T585 HydrophobicContact CB-CG2 4.18Å; I574-T585 HydrophobicContact CD1-CG2 4.17Å; I574-T585 HydrophobicContact CG1-CG2 3.84Å
586	I	94.3	Very high	86.7	Confident	68 Å²	68	66.9 Å²	66.9	35%	0.349	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.9	173.3	-55	172.1	0	0	0	107	Q572 V573 T575	Q572-I586 CarbonylContact C-O 3.24Å; Q572-I586 VanDerWaalsContact CA-O 3.32Å; Q572-I586 WeakPolarHBondContact CA-O 3.2Å; V573-I586 PolarHBondContact N-O 2.89Å; V573-I586 PolarHBondContact O-N 2.81Å; T575-I586 HydrophobicContact CG2-CD1 4.4Å
587	H	89.5	Confident	86.3	Confident	92 Å²	92	67.3 Å²	67.3	43%	0.426	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	141.6	174.4	-74.2	-98.4	0	0	0	111.3	D541 Q572	D541-H587 IonicContact OD1-CE1 3.82Å; D541-H587 IonicContact OD1-NE2 3.47Å; D541-H587 IonicContact OD2-CE1 3.02Å; D541-H587 PolarHBondContact OD2-CE1 2.02Å; D541-H587 IonicContact OD2-ND1 3.5Å; D541-H587 IonicContact OD2-NE2 3.69Å; Q572-H587 PolarHBondContact NE2-NE2 3.19Å
588	T	88.2	Confident	86.1	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.043	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-67.3	170.5	166.6	65.6	0	0	0	0	111	W557 L571 V573 F595	W557-T588 HydrophobicContact CE3-CG2 4.43Å; W557-T588 HydrophobicContact CH2-CG2 4.13Å; W557-T588 HydrophobicContact CZ3-CG2 3.69Å; L571-T588 HydrophobicContact CB-CG2 4.4Å; L571-T588 HydrophobicContact CD2-CG2 4.27Å; L571-T588 HydrophobicContact CG-CG2 4.18Å; L571-T588 PolarHBondContact O-N 2.98Å; V573-T588 HydrophobicContact CG2-CG2 3.7Å; T588-F595 WeakPolarHBondContact O-CE1 3.37Å; T588-F595 WeakPolarHBondContact O-CZ 3.47Å
589	Q	84.2	Confident	85.9	Confident	108 Å²	108	68.7 Å²	68.7	51%	0.505	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-68.9	152.1	168.7	-65.3	-177.2	-1.2	0	0	111	V591 F595	Q589-V591 PolarHBondContact O-N 2.89Å; Q589-F595 VanDerWaalsContact C-CE1 3.46Å
590	P	79.1	Confident	85.9	Confident	63 Å²	63	69.8 Å²	69.8	41%	0.409	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-64.2	128.3	176.7	-3.4	10.5	0	0	0	111	F595	P590-F595 VanDerWaalsContact CA-CE1 3.44Å; P590-F595 VanDerWaalsContact CA-CZ 3.48Å; P590-F595 HydrophobicContact CB-CD1 4.41Å; P590-F595 HydrophobicContact CB-CD2 3.98Å; P590-F595 HydrophobicContact CB-CE1 4.08Å; P590-F595 HydrophobicContact CB-CE2 3.62Å; P590-F595 HydrophobicContact CB-CG 4.38Å; P590-F595 HydrophobicContact CB-CZ 3.68Å; P590-F595 HydrophobicContact CG-CD2 4.24Å; P590-F595 HydrophobicContact CG-CE1 4.31Å; P590-F595 HydrophobicContact CG-CE2 3.42Å; P590-F595 VanDerWaalsContact CG-CE2 3.42Å; P590-F595 HydrophobicContact CG-CZ 3.47Å; P590-F595 VanDerWaalsContact CG-CZ 3.47Å
591	V	74.2	Confident	86.1	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.024	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-90.2	120.9	-179.5	174	0	0	0	0	108.9	Q589 K593 Q594 I618 H627 Y636	Q589-V591 PolarHBondContact O-N 2.89Å; V591-K593 PolarHBondContact O-N 3.48Å; V591-Q594 PolarHBondContact N-O 2.9Å; V591-Q594 PolarHBondContact O-N 2.9Å; V591-Q594 VanDerWaalsContact O-N 3.14Å; V591-I618 HydrophobicContact CB-CD1 4.49Å; V591-I618 HydrophobicContact CG2-CD1 3.45Å; V591-I618 VanDerWaalsContact CG2-CD1 3.45Å; V591-H627 HydrophobicContact CG1-CB 3.35Å; V591-Y636 HydrophobicContact CG1-CD2 3.86Å; V591-Y636 HydrophobicContact CG1-CE2 4.31Å
592	G	67.8	Low	86.4	Confident	42 Å²	42	62.1 Å²	62.1	43%	0.433	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	25.7	-172.8	0	0	0	0	0	113.8	Q594	G592-Q594 VanDerWaalsContact C-N 3.3Å; G592-Q594 PolarHBondContact O-N 2.93Å
593	K	69.6	Low	86.6	Confident	197 Å²	197	57.2 Å²	57.2	86%	0.857	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	13.2	-175.4	-49.7	177	179.7	177.8	0	115.2	V591	V591-K593 PolarHBondContact O-N 3.48Å
594	Q	72.5	Confident	86.6	Confident	68 Å²	68	56.8 Å²	56.8	32%	0.318	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-135.2	142	-175.7	-69.2	180	-26.4	0	0	110.3	V591 G592 R597	V591-Q594 PolarHBondContact N-O 2.9Å; V591-Q594 PolarHBondContact O-N 2.9Å; V591-Q594 VanDerWaalsContact O-N 3.14Å; G592-Q594 VanDerWaalsContact C-N 3.3Å; G592-Q594 PolarHBondContact O-N 2.93Å; Q594-R597 VanDerWaalsContact OE1-CD 3.26Å; Q594-R597 VanDerWaalsContact OE1-NE 3.09Å
595	F	73	Confident	86.4	Confident	70 Å²	70	56.9 Å²	56.9	31%	0.307	29%	0.291	S	S	.	.	S	Bend	trans	-106.1	-30.8	172.6	-72.6	-69.6	0	0	0	111.6	P569 T588 Q589 P590 R597 V598	P569-F595 CarbonylContact O-C 3.53Å; T588-F595 WeakPolarHBondContact O-CE1 3.37Å; T588-F595 WeakPolarHBondContact O-CZ 3.47Å; Q589-F595 VanDerWaalsContact C-CE1 3.46Å; P590-F595 VanDerWaalsContact CA-CE1 3.44Å; P590-F595 VanDerWaalsContact CA-CZ 3.48Å; P590-F595 HydrophobicContact CB-CD1 4.41Å; P590-F595 HydrophobicContact CB-CD2 3.98Å; P590-F595 HydrophobicContact CB-CE1 4.08Å; P590-F595 HydrophobicContact CB-CE2 3.62Å; P590-F595 HydrophobicContact CB-CG 4.38Å; P590-F595 HydrophobicContact CB-CZ 3.68Å; P590-F595 HydrophobicContact CG-CD2 4.24Å; P590-F595 HydrophobicContact CG-CE1 4.31Å; P590-F595 HydrophobicContact CG-CE2 3.42Å; P590-F595 VanDerWaalsContact CG-CE2 3.42Å; P590-F595 HydrophobicContact CG-CZ 3.47Å; P590-F595 VanDerWaalsContact CG-CZ 3.47Å; F595-R597 PolarHBondContact O-N 3.5Å; F595-V598 PolarHBondContact O-N 2.67Å
596	D	76.5	Confident	86.2	Confident	86 Å²	86	56.8 Å²	56.8	46%	0.46	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	8.1	-168.5	61.9	-44.4	0	0	0	115	P569	P569-D596 WeakPolarHBondContact CD-O 3.17Å; P569-D596 WeakPolarHBondContact CG-O 3.32Å
597	R	87.6	Confident	86	Confident	112 Å²	112	55 Å²	55	42%	0.423	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-3.5	-176.7	-65.1	-169.3	176.3	-176.7	-1.7	114.6	Q594 F595 D599 H620 K621	Q594-R597 VanDerWaalsContact OE1-CD 3.26Å; Q594-R597 VanDerWaalsContact OE1-NE 3.09Å; F595-R597 PolarHBondContact O-N 3.5Å; R597-D599 PolarHBondContact O-N 2.84Å; R597-D599 VanDerWaalsContact O-N 3.08Å; R597-H620 HydrophobicContact CB-CB 4.22Å; R597-H620 CarbonylContact O-C 3.48Å; R597-H620 WeakPolarHBondContact O-CA 2.99Å; R597-K621 PolarHBondContact O-N 3.07Å
598	V	92.3	Very high	86.1	Confident	8 Å²	8	52.4 Å²	52.4	5%	0.048	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	111.2	-179.6	-178.3	0	0	0	0	110	L559 P569 F595 I618	L559-V598 HydrophobicContact CD1-CB 4.39Å; L559-V598 HydrophobicContact CD1-CG1 3.65Å; P569-V598 HydrophobicContact CB-CB 4.49Å; P569-V598 WeakPolarHBondContact CB-O 3.11Å; P569-V598 WeakPolarHBondContact CG-O 3.47Å; F595-V598 PolarHBondContact O-N 2.67Å; V598-I618 HydrophobicContact CB-CG2 4.48Å; V598-I618 HydrophobicContact CG1-CG2 4.05Å; V598-I618 HydrophobicContact CG2-CG2 3.86Å
599	D	93.3	Very high	86.3	Confident	37 Å²	37	53.2 Å²	53.2	20%	0.198	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-41.8	175.4	-165.7	29.3	0	0	0	110	K566 R597 L619 K621 K666	K566-D599 IonicContact NZ-OD1 3.64Å; R597-D599 PolarHBondContact O-N 2.84Å; R597-D599 VanDerWaalsContact O-N 3.08Å; D599-L619 PolarHBondContact N-O 2.04Å; D599-K621 HydrophobicContact CB-CB 4.08Å; D599-K666 IonicContact OD2-NZ 3.88Å; D599-K666 PolarHBondContact OD2-NZ 3.43Å
600	D	95.7	Very high	86.6	Confident	44 Å²	44	49.2 Å²	49.2	24%	0.235	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	175.9	174.3	-157.9	6.7	0	0	0	112.1	K546 L619	K546-D600 VanDerWaalsContact CD-OD1 3.3Å; K546-D600 WeakPolarHBondContact CD-OD1 3.26Å; K546-D600 WeakPolarHBondContact CE-OD1 3.5Å; K546-D600 IonicContact NZ-OD1 3.38Å; K546-D600 PolarHBondContact NZ-OD1 3.15Å; K546-D600 IonicContact NZ-OD2 2.9Å; K546-D600 PolarHBondContact NZ-OD2 2.83Å; D600-L619 HydrophobicContact CB-CB 4.49Å; D600-L619 HydrophobicContact CB-CD1 4.26Å; D600-L619 PolarHBondContact N-O 3.28Å; D600-L619 WeakPolarHBondContact O-CA 3.38Å; D600-L619 WeakPolarHBondContact O-CB 3.15Å; D600-L619 PolarHBondContact O-N 2.91Å
601	F	96.7	Very high	87.1	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	157	171	71.8	-83	0	0	0	111.3	K546 H548 W557 L559 L571 I603 F617 I618	K546-F601 HydrophobicContact CD-CE1 3.94Å; K546-F601 HydrophobicContact CD-CZ 4.43Å; K546-F601 HydrophobicContact CG-CE1 4.18Å; K546-F601 HydrophobicContact CG-CZ 4.46Å; K546-F601 PolarHBondContact NZ-O 3.02Å; H548-F601 HydrophobicContact CB-CE2 3.55Å; H548-F601 HydrophobicContact CB-CZ 3.59Å; W557-F601 HydrophobicContact CB-CE2 3.77Å; W557-F601 HydrophobicContact CB-CZ 3.81Å; W557-F601 HydrophobicContact CG-CE2 4.43Å; L559-F601 HydrophobicContact CB-CD1 4.04Å; L559-F601 HydrophobicContact CB-CE1 3.74Å; L559-F601 HydrophobicContact CD2-CD1 4.41Å; L571-F601 HydrophobicContact CD1-CD1 3.72Å; L571-F601 HydrophobicContact CD1-CE1 4.02Å; L571-F601 HydrophobicContact CD1-CG 4.17Å; F601-I603 HydrophobicContact CD2-CD1 4.11Å; F601-I603 HydrophobicContact CD2-CG1 4.16Å; F601-I603 HydrophobicContact CE2-CD1 4.02Å; F601-I603 HydrophobicContact CE2-CG1 4.41Å; F601-F617 CarbonylContact C-O 3.59Å; F601-F617 VanDerWaalsContact CA-O 3.27Å; F601-F617 WeakPolarHBondContact CA-O 3.29Å; F601-I618 HydrophobicContact CB-CG1 4.36Å
602	F	97.9	Very high	87.9	Confident	37 Å²	37	55.7 Å²	55.7	16%	0.162	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	123.8	179.1	176.1	-104.5	0	0	0	110.6	P604 G616 F617 L652 Y661	F602-P604 HydrophobicContact CD1-CG 4.49Å; F602-P604 HydrophobicContact CE1-CB 4.5Å; F602-P604 HydrophobicContact CE1-CG 3.77Å; F602-P604 HydrophobicContact CZ-CB 4.5Å; F602-P604 HydrophobicContact CZ-CG 4.24Å; F602-G616 CarbonylContact O-C 3.02Å; F602-G616 WeakPolarHBondContact O-CA 3.46Å; F602-F617 HydrophobicContact CD1-CD2 4.32Å; F602-F617 PolarHBondContact N-O 3.22Å; F602-F617 PolarHBondContact O-N 3.32Å; F602-L652 HydrophobicContact CB-CB 4.24Å; F602-L652 HydrophobicContact CB-CD1 4.38Å; F602-L652 HydrophobicContact CD1-CB 3.74Å; F602-L652 HydrophobicContact CD1-CD2 4.02Å; F602-L652 HydrophobicContact CD1-CG 4.46Å; F602-L652 HydrophobicContact CD2-CB 3.85Å; F602-L652 HydrophobicContact CE1-CB 3.97Å; F602-L652 HydrophobicContact CE2-CB 4.09Å; F602-L652 WeakPolarHBondContact CE2-O 3.29Å; F602-L652 HydrophobicContact CG-CB 3.67Å; F602-L652 HydrophobicContact CG-CD2 4.43Å; F602-L652 HydrophobicContact CG-CG 4.48Å; F602-L652 HydrophobicContact CZ-CB 4.15Å; F602-Y661 HydrophobicContact CE1-CD1 4.06Å; F602-Y661 HydrophobicContact CE1-CE1 4.13Å
603	I	97.7	Very high	89.1	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.031	27%	0.272	C	S	.	.			trans	-123.5	123.1	171.3	-65.8	171.5	0	0	0	106.2	H548 W557 F601 L631	H548-I603 PolarHBondContact CE1-O 3.27Å; W557-I603 HydrophobicContact CB-CD1 4.39Å; W557-I603 HydrophobicContact CD2-CD1 3.69Å; W557-I603 HydrophobicContact CE3-CD1 4.39Å; W557-I603 HydrophobicContact CG-CD1 3.64Å; W557-I603 HydrophobicContact CZ2-CD1 4.47Å; F601-I603 HydrophobicContact CD2-CD1 4.11Å; F601-I603 HydrophobicContact CD2-CG1 4.16Å; F601-I603 HydrophobicContact CE2-CD1 4.02Å; F601-I603 HydrophobicContact CE2-CG1 4.41Å; I603-L631 HydrophobicContact CD1-CD2 3.73Å; I603-L631 HydrophobicContact CG1-CD1 4.33Å; I603-L631 HydrophobicContact CG1-CD2 3.9Å; I603-L631 HydrophobicContact CG2-CD1 3.78Å
604	P	96.2	Very high	90.1	Very high	3 Å²	3	48 Å²	48	2%	0.019	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-60.6	143.1	175.8	-22.1	32.9	0	0	0	111.4	F602 M613 Y654 Y661	F602-P604 HydrophobicContact CD1-CG 4.49Å; F602-P604 HydrophobicContact CE1-CB 4.5Å; F602-P604 HydrophobicContact CE1-CG 3.77Å; F602-P604 HydrophobicContact CZ-CB 4.5Å; F602-P604 HydrophobicContact CZ-CG 4.24Å; P604-M613 HydrophobicContact CB-CE 3.4Å; P604-M613 VanDerWaalsContact CB-CE 3.4Å; P604-M613 HydrophobicContact CB-CG 4.34Å; P604-M613 HydrophobicContact CB-SD 4.16Å; P604-M613 HydrophobicContact CG-CE 3.56Å; P604-Y654 HydrophobicContact CB-CD1 3.7Å; P604-Y654 HydrophobicContact CB-CE1 4.46Å; P604-Y654 HydrophobicContact CB-CG 4Å; P604-Y654 HydrophobicContact CG-CD1 4.17Å; P604-Y654 HydrophobicContact CG-CG 4.05Å; P604-Y661 HydrophobicContact CG-CE1 3.98Å
605	T	91.6	Very high	91.1	Very high	106 Å²	106	46.7 Å²	46.7	65%	0.65	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-82.3	131.4	177.2	-52	0	0	0	0	109.7
606	P	92	Very high	92.2	Very high	30 Å²	30	43.3 Å²	43.3	20%	0.195	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-67.4	155.6	175.6	26.2	-31.4	0	0	0	111.6	K551 I610	K551-P606 HydrophobicContact CB-CG 3.98Å; P606-I610 CarbonylContact C-O 3.53Å; P606-I610 VanDerWaalsContact CA-O 3.31Å; P606-I610 WeakPolarHBondContact CA-O 2.98Å; P606-I610 VanDerWaalsContact CB-O 3.24Å; P606-I610 WeakPolarHBondContact CB-O 3.44Å
607	T	91.3	Very high	93.2	Very high	32 Å²	32	39.3 Å²	39.3	20%	0.196	20%	0.2	C	C	.	.			trans	-116.7	-175.4	-178.7	76.7	0	0	0	0	110	I609 I610 P701	T607-I609 VanDerWaalsContact C-N 3.3Å; T607-I609 PolarHBondContact O-N 3.26Å; T607-I609 PolarHBondContact OG1-N 3.41Å; T607-I610 PolarHBondContact N-O 2.87Å; T607-I610 WeakPolarHBondContact OG1-CB 3.48Å; T607-I610 PolarHBondContact OG1-N 3.22Å; T607-P701 WeakPolarHBondContact CG2-O 3.47Å
608	L	90.6	Very high	93.6	Very high	36 Å²	36	34 Å²	34	19%	0.188	18%	0.18	C	C	.	.	S	Bend	trans	-67.1	-34.5	176.1	-69.6	173.5	0	0	0	112.2	V342 R344 H363 E365 L805	V342-L608 HydrophobicContact CG1-CB 4.33Å; R344-L608 HydrophobicContact CG-CD2 4.1Å; H363-L608 WeakPolarHBondContact CD2-CD1 2.99Å; E365-L608 HydrophobicContact CB-CB 4.2Å; E365-L608 HydrophobicContact CB-CD1 4.44Å; E365-L608 HydrophobicContact CG-CB 4.44Å; E365-L608 HydrophobicContact CG-CD1 4.12Å; E365-L608 WeakPolarHBondContact OE2-CB 3.23Å; E365-L608 PolarHBondContact OE2-N 2.96Å; L608-L805 HydrophobicContact CD1-CD2 3.83Å; L608-L805 HydrophobicContact CD2-CD2 4.42Å
609	I	92.4	Very high	93.8	Very high	25 Å²	25	33.9 Å²	33.9	13%	0.128	18%	0.179	C	C	.	.	S	Bend	trans	-97.8	-22	-178.9	53.5	165.4	0	0	0	114	V339 V342 E365 I367 T607	V339-I609 HydrophobicContact CG1-CB 3.83Å; V339-I609 HydrophobicContact CG1-CD1 4.41Å; V339-I609 HydrophobicContact CG1-CG2 3.87Å; V342-I609 HydrophobicContact CB-CG2 4.22Å; V342-I609 HydrophobicContact CG2-CG2 3.98Å; E365-I609 HydrophobicContact CB-CG1 4.34Å; E365-I609 HydrophobicContact CB-CG2 3.76Å; E365-I609 WeakPolarHBondContact O-CG2 3.06Å; I367-I609 HydrophobicContact CD1-CD1 4.01Å; I367-I609 HydrophobicContact CG1-CD1 3.93Å; T607-I609 VanDerWaalsContact C-N 3.3Å; T607-I609 PolarHBondContact O-N 3.26Å; T607-I609 PolarHBondContact OG1-N 3.41Å
610	I	91.7	Very high	93.8	Very high	23 Å²	23	32.3 Å²	32.3	12%	0.118	17%	0.17	C	C	.	.			trans	-110.9	90.2	176.3	-51	-57.1	0	0	0	109.3	T313 P606 T607 M613 H656	T313-I610 HydrophobicContact CG2-CD1 3.74Å; T313-I610 WeakPolarHBondContact OG1-CD1 3.48Å; P606-I610 CarbonylContact C-O 3.53Å; P606-I610 VanDerWaalsContact CA-O 3.31Å; P606-I610 WeakPolarHBondContact CA-O 2.98Å; P606-I610 VanDerWaalsContact CB-O 3.24Å; P606-I610 WeakPolarHBondContact CB-O 3.44Å; T607-I610 PolarHBondContact N-O 2.87Å; T607-I610 WeakPolarHBondContact OG1-CB 3.48Å; T607-I610 PolarHBondContact OG1-N 3.22Å; I610-M613 HydrophobicContact CG2-SD 3.8Å; I610-H656 HydrophobicContact CD1-CB 4.4Å; I610-H656 HydrophobicContact CG1-CB 3.94Å
611	T	89.3	Confident	93.6	Very high	104 Å²	104	35.5 Å²	35.5	64%	0.638	18%	0.182	S	C	*	.			trans	-92.8	-9	-172.7	63.9	0	0	0	0	114.4
612	H	90.8	Very high	93.4	Very high	100 Å²	100	40.4 Å²	40.4	46%	0.463	21%	0.209	S	C	.	.			trans	-131.3	117.1	-174.1	-177.9	-90.6	0	0	0	111.2	H553	H553-H612 AromaticContact NE2-NE2 3.62Å
613	M	92.5	Very high	93.2	Very high	10 Å²	10	41.4 Å²	41.4	5%	0.049	21%	0.214	C	C	.	.			trans	-110.6	106.4	177.9	-65.3	-51.2	-48.1	0	0	108.7	S552 H553 P604 I610 L631 Y654	S552-M613 PolarHBondContact OG-N 3.48Å; S552-M613 PolarHBondContact OG-O 2.86Å; H553-M613 PolarHBondContact CE1-O 3.44Å; P604-M613 HydrophobicContact CB-CE 3.4Å; P604-M613 VanDerWaalsContact CB-CE 3.4Å; P604-M613 HydrophobicContact CB-CG 4.34Å; P604-M613 HydrophobicContact CB-SD 4.16Å; P604-M613 HydrophobicContact CG-CE 3.56Å; I610-M613 HydrophobicContact CG2-SD 3.8Å; M613-L631 WeakPolarHBondContact O-CD1 3.27Å; M613-Y654 HydrophobicContact CE-CD1 4.16Å; M613-Y654 HydrophobicContact CE-CE1 3.75Å; M613-Y654 HydrophobicContact SD-CE1 4.42Å
614	R	90.9	Very high	93.1	Very high	66 Å²	66	42.4 Å²	42.4	25%	0.249	22%	0.221	C	C	.	.			trans	-75	-34.2	-174.7	-172.8	176.1	169.8	-174.1	-3	113.6	E295 D630 L631	E295-R614 IonicContact OE1-CZ 3.84Å; E295-R614 IonicContact OE1-NH2 2.73Å; E295-R614 PolarHBondContact OE1-NH2 3.07Å; E295-R614 IonicContact OE2-CZ 3.9Å; E295-R614 IonicContact OE2-NH1 3.07Å; E295-R614 PolarHBondContact OE2-NH1 2.86Å; E295-R614 IonicContact OE2-NH2 3.93Å; E295-R614 PolarHBondContact OE2-NH2 3.32Å; R614-D630 IonicContact NE-OD2 2.69Å; R614-D630 IonicContact NH2-OD2 3.76Å; R614-L631 PolarHBondContact O-N 3.09Å
615	F	94.2	Very high	93.1	Very high	41 Å²	41	42.4 Å²	42.4	18%	0.18	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144	-167.9	-54	-58.4	0	0	0	112.4	K628 I629 I637	F615-K628 HydrophobicContact CB-CG 4.33Å; F615-I629 WeakPolarHBondContact CA-O 3.06Å; F615-I637 HydrophobicContact CD1-CD1 3.27Å; F615-I637 HydrophobicContact CE1-CD1 3.16Å; F615-I637 HydrophobicContact CG-CD1 4.42Å; F615-I637 HydrophobicContact CZ-CD1 4.24Å
616	G	96.1	Very high	93.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	-179.3	166.3	0	0	0	0	0	111.5	F602 I629	F602-G616 CarbonylContact O-C 3.02Å; F602-G616 WeakPolarHBondContact O-CA 3.46Å; G616-I629 PolarHBondContact N-O 3.2Å; G616-I629 WeakPolarHBondContact O-CG2 3.35Å; G616-I629 PolarHBondContact O-N 3Å
617	F	97.5	Very high	93.5	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.9	175	-65.9	-70.8	0	0	0	112	F601 F602 L626 H627 K628 I640 L652 Y661	F601-F617 CarbonylContact C-O 3.59Å; F601-F617 VanDerWaalsContact CA-O 3.27Å; F601-F617 WeakPolarHBondContact CA-O 3.29Å; F602-F617 HydrophobicContact CD1-CD2 4.32Å; F602-F617 PolarHBondContact N-O 3.22Å; F602-F617 PolarHBondContact O-N 3.32Å; F617-L626 HydrophobicContact CD1-CB 3.73Å; F617-L626 HydrophobicContact CD1-CD1 4.25Å; F617-L626 HydrophobicContact CE1-CB 4.17Å; F617-L626 HydrophobicContact CE1-CD1 4.29Å; F617-L626 HydrophobicContact CG-CB 4.33Å; F617-L626 HydrophobicContact CG-CD1 4.39Å; F617-L626 HydrophobicContact CZ-CD1 4.47Å; F617-H627 CarbonylContact C-O 3.5Å; F617-H627 WeakPolarHBondContact CA-O 3.26Å; F617-K628 HydrophobicContact CD1-CB 4.12Å; F617-K628 HydrophobicContact CD1-CG 4.4Å; F617-K628 HydrophobicContact CE1-CB 3.81Å; F617-K628 HydrophobicContact CE1-CD 4.4Å; F617-K628 HydrophobicContact CE1-CG 3.85Å; F617-K628 HydrophobicContact CZ-CG 4.49Å; F617-I640 HydrophobicContact CE1-CD1 3.68Å; F617-I640 HydrophobicContact CZ-CD1 4.09Å; F617-L652 HydrophobicContact CD2-CD2 4.05Å; F617-Y661 HydrophobicContact CD2-CD1 4.47Å; F617-Y661 HydrophobicContact CD2-CE1 4.34Å; F617-Y661 AromaticContact CE2-CD1 3.83Å; F617-Y661 HydrophobicContact CE2-CD1 3.83Å; F617-Y661 AromaticContact CE2-CD2 3.78Å; F617-Y661 HydrophobicContact CE2-CD2 3.78Å; F617-Y661 AromaticContact CE2-CE1 3.66Å; F617-Y661 HydrophobicContact CE2-CE1 3.66Å; F617-Y661 AromaticContact CE2-CE2 3.59Å; F617-Y661 HydrophobicContact CE2-CE2 3.59Å; F617-Y661 AromaticContact CE2-CG 3.89Å; F617-Y661 HydrophobicContact CE2-CG 3.89Å; F617-Y661 AromaticContact CE2-CZ 3.54Å; F617-Y661 HydrophobicContact CZ-CD2 4.09Å; F617-Y661 AromaticContact CZ-CE2 3.84Å; F617-Y661 HydrophobicContact CZ-CE2 3.84Å
618	I	96	Very high	93.6	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.4	169.3	-67.8	165.8	0	0	0	108	L571 V591 V598 F601 H627 I629	L571-I618 HydrophobicContact CD2-CD1 3.62Å; L571-I618 HydrophobicContact CD2-CG1 3.88Å; V591-I618 HydrophobicContact CB-CD1 4.49Å; V591-I618 HydrophobicContact CG2-CD1 3.45Å; V591-I618 VanDerWaalsContact CG2-CD1 3.45Å; V598-I618 HydrophobicContact CB-CG2 4.48Å; V598-I618 HydrophobicContact CG1-CG2 4.05Å; V598-I618 HydrophobicContact CG2-CG2 3.86Å; F601-I618 HydrophobicContact CB-CG1 4.36Å; I618-H627 HydrophobicContact CB-CB 4.21Å; I618-H627 PolarHBondContact N-O 3.24Å; I618-H627 PolarHBondContact O-CD2 3.45Å; I618-H627 PolarHBondContact O-N 3.35Å; I618-H627 VanDerWaalsContact O-N 3.08Å; I618-I629 HydrophobicContact CD1-CB 4.33Å; I618-I629 HydrophobicContact CD1-CD1 3.71Å; I618-I629 HydrophobicContact CD1-CG2 4.36Å; I618-I629 HydrophobicContact CG1-CG2 4.39Å
619	L	95.5	Very high	93.8	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.1	-179.8	-46.9	-171.6	0	0	0	108.5	D599 D600 L626 P649 L652	D599-L619 PolarHBondContact N-O 2.04Å; D600-L619 HydrophobicContact CB-CB 4.49Å; D600-L619 HydrophobicContact CB-CD1 4.26Å; D600-L619 PolarHBondContact N-O 3.28Å; D600-L619 WeakPolarHBondContact O-CA 3.38Å; D600-L619 WeakPolarHBondContact O-CB 3.15Å; D600-L619 PolarHBondContact O-N 2.91Å; L619-L626 HydrophobicContact CD2-CD2 3.33Å; L619-P649 HydrophobicContact CD1-CB 4.37Å; L619-P649 HydrophobicContact CD2-CB 4.11Å; L619-P649 HydrophobicContact CD2-CG 3.95Å; L619-L652 HydrophobicContact CD1-CD1 3.74Å; L619-L652 HydrophobicContact CD2-CD1 3.79Å; L619-L652 HydrophobicContact CG-CD1 4.37Å
620	H	94	Very high	93.8	Very high	5 Å²	5	33 Å²	33	2%	0.023	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	148.1	174.6	-77.4	177.7	0	0	0	111.9	R597 D622 E623 H627	R597-H620 HydrophobicContact CB-CB 4.22Å; R597-H620 CarbonylContact O-C 3.48Å; R597-H620 WeakPolarHBondContact O-CA 2.99Å; H620-D622 PolarHBondContact O-N 3.36Å; H620-E623 HydrophobicContact CB-CB 3.78Å; H620-E623 HydrophobicContact CB-CG 4.48Å; H620-E623 VanDerWaalsContact CB-OE2 3.22Å; H620-E623 WeakPolarHBondContact CB-OE2 3.44Å; H620-E623 IonicContact CG-OE2 2.8Å; H620-E623 IonicContact ND1-OE2 3.89Å; H620-E623 PolarHBondContact ND1-OE2 3.32Å; H620-E623 PolarHBondContact O-N 2.85Å; H620-H627 AromaticContact CD2-CD2 3.9Å; H620-H627 AromaticContact CE1-CD2 3.83Å; H620-H627 AromaticContact CE1-NE2 3.64Å; H620-H627 AromaticContact CG-CD2 3.68Å; H620-H627 AromaticContact CG-NE2 3.48Å; H620-H627 AromaticContact ND1-CD2 3.63Å; H620-H627 AromaticContact ND1-CE1 3.81Å; H620-H627 AromaticContact ND1-NE2 3.12Å; H620-H627 PolarHBondContact ND1-NE2 3.05Å; H620-H627 VanDerWaalsContact ND1-NE2 3.12Å; H620-H627 AromaticContact NE2-CD2 4Å
621	K	91.8	Very high	94	Very high	111 Å²	111	31.9 Å²	31.9	48%	0.483	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	127.7	178.9	-170.3	-179.7	177.2	177.9	0	110.7	R597 D599 E623	R597-K621 PolarHBondContact O-N 3.07Å; D599-K621 HydrophobicContact CB-CB 4.08Å; K621-E623 PolarHBondContact O-N 3.44Å; K621-E623 VanDerWaalsContact O-N 3.09Å
622	D	91.4	Very high	94.1	Very high	107 Å²	107	32.9 Å²	32.9	57%	0.572	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	23.6	176.6	-52.8	-38	0	0	0	114.4	H620	H620-D622 PolarHBondContact O-N 3.36Å
623	E	93.7	Very high	94.2	Very high	58 Å²	58	31.9 Å²	31.9	27%	0.271	16%	0.157	S	C	.	.			trans	-106.3	127	-179.6	-169.4	167.7	177.6	0	0	111.1	H620 K621 A625 H627 P649	H620-E623 HydrophobicContact CB-CB 3.78Å; H620-E623 HydrophobicContact CB-CG 4.48Å; H620-E623 VanDerWaalsContact CB-OE2 3.22Å; H620-E623 WeakPolarHBondContact CB-OE2 3.44Å; H620-E623 IonicContact CG-OE2 2.8Å; H620-E623 IonicContact ND1-OE2 3.89Å; H620-E623 PolarHBondContact ND1-OE2 3.32Å; H620-E623 PolarHBondContact O-N 2.85Å; K621-E623 PolarHBondContact O-N 3.44Å; K621-E623 VanDerWaalsContact O-N 3.09Å; E623-A625 HydrophobicContact CG-CB 4.07Å; E623-A625 PolarHBondContact O-N 3.46Å; E623-H627 IonicContact OE1-CE1 3.54Å; E623-H627 PolarHBondContact OE1-CE1 3.11Å; E623-H627 IonicContact OE1-NE2 3.53Å; E623-H627 IonicContact OE2-CE1 2.83Å; E623-H627 IonicContact OE2-NE2 3.56Å; E623-H627 PolarHBondContact OE2-NE2 3.1Å; E623-P649 VanDerWaalsContact O-CD 3.31Å; E623-P649 WeakPolarHBondContact O-CD 3.03Å
624	S	95.5	Very high	94.1	Very high	26 Å²	26	33.2 Å²	33.2	18%	0.182	16%	0.164	C	C	.	.	S	Bend	trans	-82.6	63	174.7	-56.3	0	0	0	0	111.7	L642 K643 C647 I648	S624-L642 CarbonylContact O-C 3.58Å; S624-L642 WeakPolarHBondContact O-CA 3.04Å; S624-L642 PolarHBondContact O-N 3.09Å; S624-K643 PolarHBondContact O-N 3.18Å; S624-C647 WeakPolarHBondContact CA-O 3.43Å; S624-C647 VanDerWaalsContact CB-O 3.27Å; S624-C647 WeakPolarHBondContact CB-O 3.44Å; S624-C647 PolarHBondContact OG-O 2.8Å; S624-I648 WeakPolarHBondContact OG-CG1 3.27Å
625	A	95.6	Very high	94	Very high	4 Å²	4	31.4 Å²	31.4	3%	0.033	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	158.9	179.1	0	0	0	0	0	112.8	E623 T639 I640	E623-A625 HydrophobicContact CG-CB 4.07Å; E623-A625 PolarHBondContact O-N 3.46Å; A625-T639 HydrophobicContact CB-CG2 3.55Å; A625-I640 CarbonylContact C-O 3.53Å; A625-I640 WeakPolarHBondContact CA-O 3.45Å; A625-I640 WeakPolarHBondContact CB-O 3.46Å
626	L	96.5	Very high	93.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.5	164.8	-61.8	176.3	0	0	0	109.8	F617 L619 T639 I640 L642 P649 L652 I663	F617-L626 HydrophobicContact CD1-CB 3.73Å; F617-L626 HydrophobicContact CD1-CD1 4.25Å; F617-L626 HydrophobicContact CE1-CB 4.17Å; F617-L626 HydrophobicContact CE1-CD1 4.29Å; F617-L626 HydrophobicContact CG-CB 4.33Å; F617-L626 HydrophobicContact CG-CD1 4.39Å; F617-L626 HydrophobicContact CZ-CD1 4.47Å; L619-L626 HydrophobicContact CD2-CD2 3.33Å; L626-T639 CarbonylContact O-C 3.53Å; L626-T639 WeakPolarHBondContact O-CA 3.14Å; L626-I640 HydrophobicContact CB-CB 4.28Å; L626-I640 PolarHBondContact N-O 3Å; L626-I640 PolarHBondContact O-N 3.36Å; L626-L642 HydrophobicContact CG-CD1 4.15Å; L626-P649 HydrophobicContact CD2-CB 3.91Å; L626-P649 HydrophobicContact CD2-CG 3.89Å; L626-L652 HydrophobicContact CD1-CD2 4.13Å; L626-L652 HydrophobicContact CD2-CD1 4.29Å; L626-L652 HydrophobicContact CD2-CD2 4.03Å; L626-I663 HydrophobicContact CD1-CD1 3.57Å; L626-I663 HydrophobicContact CD1-CG1 4.38Å; L626-I663 HydrophobicContact CG-CD1 4.42Å
627	H	95.3	Very high	93.6	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.019	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	108.6	174.2	-56.1	-76.2	0	0	0	110	V591 F617 I618 H620 E623 Y636 T639	V591-H627 HydrophobicContact CG1-CB 3.35Å; F617-H627 CarbonylContact C-O 3.5Å; F617-H627 WeakPolarHBondContact CA-O 3.26Å; I618-H627 HydrophobicContact CB-CB 4.21Å; I618-H627 PolarHBondContact N-O 3.24Å; I618-H627 PolarHBondContact O-CD2 3.45Å; I618-H627 PolarHBondContact O-N 3.35Å; I618-H627 VanDerWaalsContact O-N 3.08Å; H620-H627 AromaticContact CD2-CD2 3.9Å; H620-H627 AromaticContact CE1-CD2 3.83Å; H620-H627 AromaticContact CE1-NE2 3.64Å; H620-H627 AromaticContact CG-CD2 3.68Å; H620-H627 AromaticContact CG-NE2 3.48Å; H620-H627 AromaticContact ND1-CD2 3.63Å; H620-H627 AromaticContact ND1-CE1 3.81Å; H620-H627 AromaticContact ND1-NE2 3.12Å; H620-H627 PolarHBondContact ND1-NE2 3.05Å; H620-H627 VanDerWaalsContact ND1-NE2 3.12Å; H620-H627 AromaticContact NE2-CD2 4Å; E623-H627 IonicContact OE1-CE1 3.54Å; E623-H627 PolarHBondContact OE1-CE1 3.11Å; E623-H627 IonicContact OE1-NE2 3.53Å; E623-H627 IonicContact OE2-CE1 2.83Å; E623-H627 IonicContact OE2-NE2 3.56Å; E623-H627 PolarHBondContact OE2-NE2 3.1Å; H627-Y636 HydrophobicContact CB-CE2 4.35Å; H627-T639 PolarHBondContact ND1-OG1 2.97Å
628	K	94.5	Very high	93.3	Very high	9 Å²	9	40.2 Å²	40.2	4%	0.039	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	129.1	-178.7	-164.8	176.5	178.5	162.7	0	109.7	F615 F617 I637 K638 D684	F615-K628 HydrophobicContact CB-CG 4.33Å; F617-K628 HydrophobicContact CD1-CB 4.12Å; F617-K628 HydrophobicContact CD1-CG 4.4Å; F617-K628 HydrophobicContact CE1-CB 3.81Å; F617-K628 HydrophobicContact CE1-CD 4.4Å; F617-K628 HydrophobicContact CE1-CG 3.85Å; F617-K628 HydrophobicContact CZ-CG 4.49Å; K628-I637 HydrophobicContact CB-CB 4.37Å; K628-I637 HydrophobicContact CD-CD1 4.4Å; K628-I637 HydrophobicContact CG-CB 4.48Å; K628-I637 HydrophobicContact CG-CD1 4.18Å; K628-I637 PolarHBondContact O-N 2.98Å; K628-K638 HydrophobicContact CB-CG 4.42Å; K628-K638 PolarHBondContact N-O 3.42Å; K628-D684 IonicContact NZ-OD1 2.95Å; K628-D684 PolarHBondContact NZ-OD1 3.14Å; K628-D684 IonicContact NZ-OD2 3.99Å; K628-D684 PolarHBondContact NZ-OD2 3.5Å
629	I	94.2	Very high	93.2	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138	178.3	-174.6	159.1	0	0	0	109.8	W557 F615 G616 I618 L631	W557-I629 HydrophobicContact CH2-CD1 3.66Å; W557-I629 HydrophobicContact CH2-CG1 4.28Å; W557-I629 HydrophobicContact CZ3-CD1 3.94Å; F615-I629 WeakPolarHBondContact CA-O 3.06Å; G616-I629 PolarHBondContact N-O 3.2Å; G616-I629 WeakPolarHBondContact O-CG2 3.35Å; G616-I629 PolarHBondContact O-N 3Å; I618-I629 HydrophobicContact CD1-CB 4.33Å; I618-I629 HydrophobicContact CD1-CD1 3.71Å; I618-I629 HydrophobicContact CD1-CG2 4.36Å; I618-I629 HydrophobicContact CG1-CG2 4.39Å; I629-L631 HydrophobicContact CG2-CD2 4.3Å
630	D	93.4	Very high	93.1	Very high	14 Å²	14	43 Å²	43	8%	0.075	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124.2	168.4	-163.3	-55.2	0	0	0	108.6	R614 E632 T633 M634 S635 I637	R614-D630 IonicContact NE-OD2 2.69Å; R614-D630 IonicContact NH2-OD2 3.76Å; D630-E632 WeakPolarHBondContact OD1-CB 3.49Å; D630-E632 PolarHBondContact OD1-N 2.71Å; D630-T633 WeakPolarHBondContact CB-OG1 3.48Å; D630-T633 PolarHBondContact OD1-N 3.02Å; D630-M634 WeakPolarHBondContact O-CA 3.35Å; D630-M634 PolarHBondContact O-N 3.38Å; D630-S635 PolarHBondContact N-O 3.28Å; D630-S635 PolarHBondContact O-N 3.12Å; D630-I637 HydrophobicContact CB-CD1 3.79Å; D630-I637 HydrophobicContact CB-CG1 3.99Å
631	L	95	Very high	93.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-23.4	-176.5	-62.4	175.4	0	0	0	112.5	Q555 W557 I603 M613 R614 I629	Q555-L631 PolarHBondContact NE2-O 3.47Å; Q555-L631 PolarHBondContact OE1-O 3.07Å; W557-L631 HydrophobicContact CH2-CD2 3.97Å; W557-L631 HydrophobicContact CZ2-CD2 3.43Å; W557-L631 VanDerWaalsContact CZ2-CD2 3.43Å; I603-L631 HydrophobicContact CD1-CD2 3.73Å; I603-L631 HydrophobicContact CG1-CD1 4.33Å; I603-L631 HydrophobicContact CG1-CD2 3.9Å; I603-L631 HydrophobicContact CG2-CD1 3.78Å; M613-L631 WeakPolarHBondContact O-CD1 3.27Å; R614-L631 PolarHBondContact O-N 3.09Å; I629-L631 HydrophobicContact CG2-CD2 4.3Å
632	E	92.3	Very high	93.4	Very high	124 Å²	124	40.4 Å²	40.4	58%	0.579	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-48.4	176.6	-173.6	175.9	-177.1	0	0	110.3	D630	D630-E632 WeakPolarHBondContact OD1-CB 3.49Å; D630-E632 PolarHBondContact OD1-N 2.71Å
633	T	91.8	Very high	93.5	Very high	79 Å²	79	42.1 Å²	42.1	49%	0.485	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.8	-177.7	60.5	0	0	0	0	114	D630 S635	D630-T633 WeakPolarHBondContact CB-OG1 3.48Å; D630-T633 PolarHBondContact OD1-N 3.02Å; T633-S635 PolarHBondContact O-N 3.44Å; T633-S635 VanDerWaalsContact O-N 3.13Å; T633-S635 PolarHBondContact OG1-OG 2.99Å
634	M	91.4	Very high	93.4	Very high	39 Å²	39	47 Å²	47	19%	0.192	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	30.7	-176.1	-62.4	166.5	-100.5	0	0	112.9	W557 V573 T575 D630	W557-M634 HydrophobicContact CH2-CG 4.33Å; W557-M634 HydrophobicContact CZ2-CG 4.17Å; V573-M634 HydrophobicContact CB-SD 3.88Å; V573-M634 HydrophobicContact CG1-SD 3.83Å; V573-M634 HydrophobicContact CG2-CG 4.46Å; V573-M634 HydrophobicContact CG2-SD 4.05Å; T575-M634 HydrophobicContact CG2-CE 3.83Å; T575-M634 HydrophobicContact CG2-SD 4.29Å; D630-M634 WeakPolarHBondContact O-CA 3.35Å; D630-M634 PolarHBondContact O-N 3.38Å
635	S	89.5	Confident	93.3	Very high	27 Å²	27	48 Å²	48	19%	0.189	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143.8	-172.8	65.5	0	0	0	0	112.3	D630 T633 I637	D630-S635 PolarHBondContact N-O 3.28Å; D630-S635 PolarHBondContact O-N 3.12Å; T633-S635 PolarHBondContact O-N 3.44Å; T633-S635 VanDerWaalsContact O-N 3.13Å; T633-S635 PolarHBondContact OG1-OG 2.99Å; S635-I637 PolarHBondContact O-N 3.27Å
636	Y	90.7	Very high	93.1	Very high	81 Å²	81	56.5 Å²	56.5	32%	0.318	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	133.3	172.7	168.8	-100.1	0	0	0	111.4	V591 H627 K638 T639	V591-Y636 HydrophobicContact CG1-CD2 3.86Å; V591-Y636 HydrophobicContact CG1-CE2 4.31Å; H627-Y636 HydrophobicContact CB-CE2 4.35Å; Y636-K638 WeakPolarHBondContact CE2-O 3.31Å; Y636-K638 VanDerWaalsContact CZ-C 3.42Å; Y636-K638 VanDerWaalsContact CZ-CA 3.41Å; Y636-K638 WeakPolarHBondContact OH-CA 3.45Å; Y636-T639 PolarHBondContact OH-N 3.07Å; Y636-T639 PolarHBondContact OH-OG1 2.91Å
637	I	89.7	Confident	93	Very high	67 Å²	67	56.5 Å²	56.5	34%	0.344	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-64.6	176.9	-58.3	178.6	0	0	0	110	F615 K628 D630 S635	F615-I637 HydrophobicContact CD1-CD1 3.27Å; F615-I637 HydrophobicContact CE1-CD1 3.16Å; F615-I637 HydrophobicContact CG-CD1 4.42Å; F615-I637 HydrophobicContact CZ-CD1 4.24Å; K628-I637 HydrophobicContact CB-CB 4.37Å; K628-I637 HydrophobicContact CD-CD1 4.4Å; K628-I637 HydrophobicContact CG-CB 4.48Å; K628-I637 HydrophobicContact CG-CD1 4.18Å; K628-I637 PolarHBondContact O-N 2.98Å; D630-I637 HydrophobicContact CB-CD1 3.79Å; D630-I637 HydrophobicContact CB-CG1 3.99Å; S635-I637 PolarHBondContact O-N 3.27Å
638	K	90.8	Very high	93	Very high	79 Å²	79	58.4 Å²	58.4	34%	0.343	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	169.6	-176.7	69	-178.3	-178.6	-173.1	0	111.9	K628 Y636 D684	K628-K638 HydrophobicContact CB-CG 4.42Å; K628-K638 PolarHBondContact N-O 3.42Å; Y636-K638 WeakPolarHBondContact CE2-O 3.31Å; Y636-K638 VanDerWaalsContact CZ-C 3.42Å; Y636-K638 VanDerWaalsContact CZ-CA 3.41Å; Y636-K638 WeakPolarHBondContact OH-CA 3.45Å; K638-D684 VanDerWaalsContact CE-CG 3.44Å; K638-D684 WeakPolarHBondContact CE-OD2 3.31Å; K638-D684 IonicContact NZ-OD2 3.58Å; K638-D684 PolarHBondContact NZ-OD2 2.79Å
639	T	93.9	Very high	93.2	Very high	55 Å²	55	58.1 Å²	58.1	34%	0.337	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.5	175.1	-59.5	0	0	0	0	109.8	A625 L626 H627 Y636	A625-T639 HydrophobicContact CB-CG2 3.55Å; L626-T639 CarbonylContact O-C 3.53Å; L626-T639 WeakPolarHBondContact O-CA 3.14Å; H627-T639 PolarHBondContact ND1-OG1 2.97Å; Y636-T639 PolarHBondContact OH-N 3.07Å; Y636-T639 PolarHBondContact OH-OG1 2.91Å
640	I	94.8	Very high	93.2	Very high	10 Å²	10	61.8 Å²	61.8	5%	0.051	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.6	172.2	-54.8	172.7	0	0	0	107.2	F617 A625 L626 L642 V679 D684	F617-I640 HydrophobicContact CE1-CD1 3.68Å; F617-I640 HydrophobicContact CZ-CD1 4.09Å; A625-I640 CarbonylContact C-O 3.53Å; A625-I640 WeakPolarHBondContact CA-O 3.45Å; A625-I640 WeakPolarHBondContact CB-O 3.46Å; L626-I640 HydrophobicContact CB-CB 4.28Å; L626-I640 PolarHBondContact N-O 3Å; L626-I640 PolarHBondContact O-N 3.36Å; I640-L642 HydrophobicContact CG2-CD2 4.47Å; I640-V679 HydrophobicContact CD1-CG1 4.49Å; I640-D684 HydrophobicContact CD1-CB 3.7Å; I640-D684 HydrophobicContact CG1-CB 4.08Å; I640-D684 WeakPolarHBondContact CG2-O 3.34Å
641	S	95.7	Very high	93.4	Very high	61 Å²	61	62.2 Å²	62.2	43%	0.427	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	130.3	-179.3	-165.7	0	0	0	0	111.2	K643	S641-K643 WeakPolarHBondContact OG-CG 3.34Å
642	L	96.1	Very high	93.5	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.323	C	S	.	.			trans	-108.6	16.6	173.2	-53.4	-179.3	0	0	0	112.1	S624 L626 I640 D644 S645 K646 C647 P649 I663 L677 I686	S624-L642 CarbonylContact O-C 3.58Å; S624-L642 WeakPolarHBondContact O-CA 3.04Å; S624-L642 PolarHBondContact O-N 3.09Å; L626-L642 HydrophobicContact CG-CD1 4.15Å; I640-L642 HydrophobicContact CG2-CD2 4.47Å; L642-D644 PolarHBondContact O-N 3.38Å; L642-S645 PolarHBondContact O-N 3.35Å; L642-K646 PolarHBondContact O-N 3.25Å; L642-K646 VanDerWaalsContact O-N 3.13Å; L642-C647 HydrophobicContact CB-CB 4.15Å; L642-C647 WeakPolarHBondContact CB-O 2.98Å; L642-C647 HydrophobicContact CD1-CB 4.34Å; L642-C647 PolarHBondContact O-N 2.88Å; L642-P649 HydrophobicContact CD1-CB 4.42Å; L642-P649 HydrophobicContact CD1-CG 4.37Å; L642-I663 HydrophobicContact CD1-CD1 4.3Å; L642-I663 HydrophobicContact CD2-CD1 4.36Å; L642-L677 HydrophobicContact CD2-CD1 4.33Å; L642-I686 HydrophobicContact CD2-CD1 3.67Å; L642-I686 HydrophobicContact CD2-CG1 3.94Å
643	K	93.5	Very high	93.8	Very high	144 Å²	144	57.3 Å²	57.3	63%	0.626	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-39.8	-173.8	-74.3	179.6	179.5	178.3	0	112.7	S624 S641 S645 K646	S624-K643 PolarHBondContact O-N 3.18Å; S641-K643 WeakPolarHBondContact OG-CG 3.34Å; K643-S645 PolarHBondContact O-N 2.78Å; K643-K646 PolarHBondContact O-N 2.79Å
644	D	92.1	Very high	94.1	Very high	160 Å²	160	55 Å²	55	86%	0.856	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-34.7	-179.2	-62.6	-23.6	0	0	0	111.4	L642 K646	L642-D644 PolarHBondContact O-N 3.38Å; D644-K646 VanDerWaalsContact C-N 3.34Å
645	S	91.9	Very high	94.3	Very high	47 Å²	47	53.1 Å²	53.1	33%	0.329	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-2.5	174.1	-50.4	0	0	0	0	113.8	L642 K643 C647	L642-S645 PolarHBondContact O-N 3.35Å; K643-S645 PolarHBondContact O-N 2.78Å; S645-C647 PolarHBondContact O-N 3.46Å; S645-C647 VanDerWaalsContact O-N 3.09Å
646	K	91.8	Very high	94.6	Very high	182 Å²	182	52.1 Å²	52.1	79%	0.791	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	33.7	-175.1	-57.8	178.2	-176.9	174.5	0	113.5	L642 K643 D644	L642-K646 PolarHBondContact O-N 3.25Å; L642-K646 VanDerWaalsContact O-N 3.13Å; K643-K646 PolarHBondContact O-N 2.79Å; D644-K646 VanDerWaalsContact C-N 3.34Å
647	C	94.7	Very high	94.7	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.007	25%	0.248	C	C	.	.			trans	-96.6	116.8	-175.5	176.4	0	0	0	0	110	S624 L642 S645 C665 L677	S624-C647 WeakPolarHBondContact CA-O 3.43Å; S624-C647 VanDerWaalsContact CB-O 3.27Å; S624-C647 WeakPolarHBondContact CB-O 3.44Å; S624-C647 PolarHBondContact OG-O 2.8Å; L642-C647 HydrophobicContact CB-CB 4.15Å; L642-C647 WeakPolarHBondContact CB-O 2.98Å; L642-C647 HydrophobicContact CD1-CB 4.34Å; L642-C647 PolarHBondContact O-N 2.88Å; S645-C647 PolarHBondContact O-N 3.46Å; S645-C647 VanDerWaalsContact O-N 3.09Å; C647-C665 HydrophobicContact CB-CB 3.9Å; C647-C665 WeakPolarHBondContact CB-SG 3.37Å; C647-C665 WeakPolarHBondContact SG-CB 3.31Å; C647-C665 CovalentContact SG-SG 2.02Å; C647-C665 PolarHBondContact SG-SG 3.06Å; C647-L677 HydrophobicContact CB-CD1 3.48Å; C647-L677 VanDerWaalsContact CB-CD1 3.48Å; C647-L677 HydrophobicContact CB-CG 4.39Å
648	I	96.3	Very high	94.7	Very high	43 Å²	43	45.1 Å²	45.1	22%	0.221	23%	0.232	C	C	.	.			trans	-92.3	113.5	164	-60.1	169.7	0	0	0	106.3	S624 L650 C665 K666	S624-I648 WeakPolarHBondContact OG-CG1 3.27Å; I648-L650 PolarHBondContact O-N 2.91Å; I648-C665 CarbonylContact O-C 3.58Å; I648-C665 VanDerWaalsContact O-CA 3.23Å; I648-C665 WeakPolarHBondContact O-CA 3.36Å; I648-K666 HydrophobicContact CB-CB 4.37Å; I648-K666 HydrophobicContact CB-CD 4.48Å; I648-K666 HydrophobicContact CB-CG 4.45Å; I648-K666 HydrophobicContact CG2-CD 3.85Å; I648-K666 HydrophobicContact CG2-CG 4.23Å; I648-K666 PolarHBondContact O-N 3.39Å
649	P	97.3	Very high	94.9	Very high	4 Å²	4	41.3 Å²	41.3	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	135.5	-173.5	27.7	-32.9	0	0	0	110.9	L619 E623 L626 L642 L652 I663	L619-P649 HydrophobicContact CD1-CB 4.37Å; L619-P649 HydrophobicContact CD2-CB 4.11Å; L619-P649 HydrophobicContact CD2-CG 3.95Å; E623-P649 VanDerWaalsContact O-CD 3.31Å; E623-P649 WeakPolarHBondContact O-CD 3.03Å; L626-P649 HydrophobicContact CD2-CB 3.91Å; L626-P649 HydrophobicContact CD2-CG 3.89Å; L642-P649 HydrophobicContact CD1-CB 4.42Å; L642-P649 HydrophobicContact CD1-CG 4.37Å; P649-L652 HydrophobicContact CB-CD1 4.45Å; P649-I663 HydrophobicContact CB-CG2 3.81Å
650	L	95.5	Very high	95	Very high	80 Å²	80	39.7 Å²	39.7	42%	0.419	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-44.4	177.9	177.2	63.4	0	0	0	111.5	I648 S664 K666	I648-L650 PolarHBondContact O-N 2.91Å; L650-S664 PolarHBondContact N-O 2.95Å; L650-K666 HydrophobicContact CB-CG 3.95Å; L650-K666 HydrophobicContact CD1-CG 4.19Å
651	S	96.5	Very high	95.1	Very high	23 Å²	23	39.6 Å²	39.6	16%	0.161	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	152.3	-179.2	58.4	0	0	0	0	110.4	S664	S651-S664 PolarHBondContact N-O 3.28Å; S651-S664 PolarHBondContact O-N 2.85Å; S651-S664 WeakPolarHBondContact OG-CB 3.36Å
652	L	98.2	Very high	95.3	Very high	14 Å²	14	36.7 Å²	36.7	7%	0.073	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	151.5	-177.8	-71.9	85.5	0	0	0	110.7	F602 F617 L619 L626 P649 F662 I663	F602-L652 HydrophobicContact CB-CB 4.24Å; F602-L652 HydrophobicContact CB-CD1 4.38Å; F602-L652 HydrophobicContact CD1-CB 3.74Å; F602-L652 HydrophobicContact CD1-CD2 4.02Å; F602-L652 HydrophobicContact CD1-CG 4.46Å; F602-L652 HydrophobicContact CD2-CB 3.85Å; F602-L652 HydrophobicContact CE1-CB 3.97Å; F602-L652 HydrophobicContact CE2-CB 4.09Å; F602-L652 WeakPolarHBondContact CE2-O 3.29Å; F602-L652 HydrophobicContact CG-CB 3.67Å; F602-L652 HydrophobicContact CG-CD2 4.43Å; F602-L652 HydrophobicContact CG-CG 4.48Å; F602-L652 HydrophobicContact CZ-CB 4.15Å; F617-L652 HydrophobicContact CD2-CD2 4.05Å; L619-L652 HydrophobicContact CD1-CD1 3.74Å; L619-L652 HydrophobicContact CD2-CD1 3.79Å; L619-L652 HydrophobicContact CG-CD1 4.37Å; L626-L652 HydrophobicContact CD1-CD2 4.13Å; L626-L652 HydrophobicContact CD2-CD1 4.29Å; L626-L652 HydrophobicContact CD2-CD2 4.03Å; P649-L652 HydrophobicContact CB-CD1 4.45Å; L652-F662 CarbonylContact C-O 3.47Å; L652-F662 WeakPolarHBondContact CA-O 3.42Å; L652-I663 HydrophobicContact CD2-CG1 4.13Å; L652-I663 HydrophobicContact CG-CG1 4.14Å; L652-I663 HydrophobicContact CG-CG2 4.49Å
653	A	98.1	Very high	95.4	Very high	7 Å²	7	36.7 Å²	36.7	6%	0.058	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	159.3	162.9	0	0	0	0	0	109.8	Y661 F662 P697 V699	A653-Y661 WeakPolarHBondContact O-CA 3.45Å; A653-F662 PolarHBondContact N-O 3.47Å; A653-F662 PolarHBondContact O-N 3.24Å; A653-P697 HydrophobicContact CB-CB 3.73Å; A653-P697 HydrophobicContact CB-CG 3.8Å; A653-V699 HydrophobicContact CB-CB 4.44Å; A653-V699 HydrophobicContact CB-CG2 3.75Å
654	Y	97.6	Very high	95.6	Very high	30 Å²	30	30 Å²	30	12%	0.118	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.9	-177.8	172.9	-107.7	0	0	0	110	V314 P604 M613 H656 Y660 Y661 V699	V314-Y654 WeakPolarHBondContact CG1-OH 3.04Å; P604-Y654 HydrophobicContact CB-CD1 3.7Å; P604-Y654 HydrophobicContact CB-CE1 4.46Å; P604-Y654 HydrophobicContact CB-CG 4Å; P604-Y654 HydrophobicContact CG-CD1 4.17Å; P604-Y654 HydrophobicContact CG-CG 4.05Å; M613-Y654 HydrophobicContact CE-CD1 4.16Å; M613-Y654 HydrophobicContact CE-CE1 3.75Å; M613-Y654 HydrophobicContact SD-CE1 4.42Å; Y654-H656 HydrophobicContact CE1-CB 3.9Å; Y654-Y660 WeakPolarHBondContact CA-O 3.38Å; Y654-Y660 WeakPolarHBondContact CD2-O 3.39Å; Y654-Y661 AromaticContact CD2-CD1 3.56Å; Y654-Y661 HydrophobicContact CD2-CD1 3.56Å; Y654-Y661 AromaticContact CD2-CE1 3.27Å; Y654-Y661 HydrophobicContact CD2-CE1 3.27Å; Y654-Y661 HydrophobicContact CD2-CE2 4.42Å; Y654-Y661 HydrophobicContact CD2-CG 4.24Å; Y654-Y661 AromaticContact CD2-CZ 3.76Å; Y654-Y661 HydrophobicContact CE2-CD1 4.49Å; Y654-Y661 AromaticContact CE2-CE1 3.97Å; Y654-Y661 HydrophobicContact CE2-CE1 3.97Å; Y654-Y661 HydrophobicContact CE2-CE2 4.5Å; Y654-Y661 AromaticContact CE2-CZ 3.97Å; Y654-Y661 HydrophobicContact CG-CD1 4.18Å; Y654-Y661 AromaticContact CG-CE1 3.87Å; Y654-Y661 HydrophobicContact CG-CE1 3.87Å; Y654-V699 WeakPolarHBondContact O-CG1 3.49Å
655	S	96.3	Very high	95.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.3	165.1	-176.4	0	0	0	0	109.8	L657 G659 Y660 G703	S655-L657 PolarHBondContact O-N 3.48Å; S655-L657 PolarHBondContact OG-N 3.5Å; S655-G659 CarbonylContact O-C 3.56Å; S655-G659 WeakPolarHBondContact O-CA 3.12Å; S655-G659 PolarHBondContact O-N 3.02Å; S655-Y660 PolarHBondContact N-O 3.29Å; S655-Y660 PolarHBondContact O-N 2.95Å; S655-G703 PolarHBondContact OG-O 2.85Å
656	H	94.1	Very high	95.8	Very high	7 Å²	7	22.7 Å²	22.7	3%	0.032	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-13.5	176.4	69.9	-90.1	0	0	0	112.3	T313 I610 Y654 G658 D702	T313-H656 CarbonylContact C-O 3.54Å; T313-H656 WeakPolarHBondContact CB-O 3.01Å; T313-H656 PolarHBondContact OG1-O 3.23Å; I610-H656 HydrophobicContact CD1-CB 4.4Å; I610-H656 HydrophobicContact CG1-CB 3.94Å; Y654-H656 HydrophobicContact CE1-CB 3.9Å; H656-G658 PolarHBondContact O-N 3.13Å; H656-D702 PolarHBondContact CE1-O 3.33Å
657	L	93.3	Very high	95.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	104	172.3	-58.5	-178.5	0	0	0	108.8	M316 I367 S655 G659 Y660 H704 I721	M316-L657 HydrophobicContact SD-CD2 4.42Å; I367-L657 HydrophobicContact CD1-CD2 3.77Å; S655-L657 PolarHBondContact O-N 3.48Å; S655-L657 PolarHBondContact OG-N 3.5Å; L657-G659 PolarHBondContact O-N 3.09Å; L657-Y660 WeakPolarHBondContact O-CD2 3.22Å; L657-Y660 WeakPolarHBondContact O-CE2 3.33Å; L657-H704 VanDerWaalsContact CD1-CD2 3.47Å; L657-H704 WeakPolarHBondContact CD1-CD2 3.4Å; L657-I721 HydrophobicContact CB-CG2 3.76Å; L657-I721 HydrophobicContact CD1-CG2 4.44Å
658	G	90.9	Very high	95.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	-12.3	-172.5	0	0	0	0	0	114.7	R284 H656	R284-G658 PolarHBondContact NH2-O 3.41Å; H656-G658 PolarHBondContact O-N 3.13Å
659	G	93.8	Very high	94.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	54	175.3	0	0	0	0	0	113	S655 L657 S681	S655-G659 CarbonylContact O-C 3.56Å; S655-G659 WeakPolarHBondContact O-CA 3.12Å; S655-G659 PolarHBondContact O-N 3.02Å; L657-G659 PolarHBondContact O-N 3.09Å; G659-S681 WeakPolarHBondContact CA-OG 3.42Å; G659-S681 WeakPolarHBondContact O-CB 3.49Å; G659-S681 PolarHBondContact O-N 3.27Å; G659-S681 PolarHBondContact O-OG 2.84Å
660	Y	96.2	Very high	94.4	Very high	21 Å²	21	33.1 Å²	33.1	8%	0.082	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.5	-175.2	-56.2	-52.8	0	0	0	112.7	Y654 S655 L657 F662 V678 I687 G725 I727	Y654-Y660 WeakPolarHBondContact CA-O 3.38Å; Y654-Y660 WeakPolarHBondContact CD2-O 3.39Å; S655-Y660 PolarHBondContact N-O 3.29Å; S655-Y660 PolarHBondContact O-N 2.95Å; L657-Y660 WeakPolarHBondContact O-CD2 3.22Å; L657-Y660 WeakPolarHBondContact O-CE2 3.33Å; Y660-F662 HydrophobicContact CD2-CZ 4.28Å; Y660-F662 HydrophobicContact CG-CZ 4.43Å; Y660-V678 HydrophobicContact CD1-CG1 3.85Å; Y660-V678 HydrophobicContact CG-CG1 4.03Å; Y660-I687 HydrophobicContact CD1-CD1 3.71Å; Y660-I687 HydrophobicContact CE1-CD1 3.57Å; Y660-G725 WeakPolarHBondContact CE2-O 3.27Å; Y660-G725 PolarHBondContact OH-O 2.81Å; Y660-I727 HydrophobicContact CD2-CD1 4.26Å; Y660-I727 HydrophobicContact CD2-CG1 4.49Å; Y660-I727 HydrophobicContact CE2-CD1 4.27Å; Y660-I727 HydrophobicContact CE2-CG1 4.31Å
661	Y	98.1	Very high	93.9	Very high	7 Å²	7	31.8 Å²	31.8	3%	0.027	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.2	161.2	-63.5	-72.7	0	0	0	109.6	F602 P604 F617 A653 Y654 V678 V679 S681	F602-Y661 HydrophobicContact CE1-CD1 4.06Å; F602-Y661 HydrophobicContact CE1-CE1 4.13Å; P604-Y661 HydrophobicContact CG-CE1 3.98Å; F617-Y661 HydrophobicContact CD2-CD1 4.47Å; F617-Y661 HydrophobicContact CD2-CE1 4.34Å; F617-Y661 AromaticContact CE2-CD1 3.83Å; F617-Y661 HydrophobicContact CE2-CD1 3.83Å; F617-Y661 AromaticContact CE2-CD2 3.78Å; F617-Y661 HydrophobicContact CE2-CD2 3.78Å; F617-Y661 AromaticContact CE2-CE1 3.66Å; F617-Y661 HydrophobicContact CE2-CE1 3.66Å; F617-Y661 AromaticContact CE2-CE2 3.59Å; F617-Y661 HydrophobicContact CE2-CE2 3.59Å; F617-Y661 AromaticContact CE2-CG 3.89Å; F617-Y661 HydrophobicContact CE2-CG 3.89Å; F617-Y661 AromaticContact CE2-CZ 3.54Å; F617-Y661 HydrophobicContact CZ-CD2 4.09Å; F617-Y661 AromaticContact CZ-CE2 3.84Å; F617-Y661 HydrophobicContact CZ-CE2 3.84Å; A653-Y661 WeakPolarHBondContact O-CA 3.45Å; Y654-Y661 AromaticContact CD2-CD1 3.56Å; Y654-Y661 HydrophobicContact CD2-CD1 3.56Å; Y654-Y661 AromaticContact CD2-CE1 3.27Å; Y654-Y661 HydrophobicContact CD2-CE1 3.27Å; Y654-Y661 HydrophobicContact CD2-CE2 4.42Å; Y654-Y661 HydrophobicContact CD2-CG 4.24Å; Y654-Y661 AromaticContact CD2-CZ 3.76Å; Y654-Y661 HydrophobicContact CE2-CD1 4.49Å; Y654-Y661 AromaticContact CE2-CE1 3.97Å; Y654-Y661 HydrophobicContact CE2-CE1 3.97Å; Y654-Y661 HydrophobicContact CE2-CE2 4.5Å; Y654-Y661 AromaticContact CE2-CZ 3.97Å; Y654-Y661 HydrophobicContact CG-CD1 4.18Å; Y654-Y661 AromaticContact CG-CE1 3.87Å; Y654-Y661 HydrophobicContact CG-CE1 3.87Å; Y661-V678 WeakPolarHBondContact O-CA 3.24Å; Y661-V679 PolarHBondContact N-O 2.88Å; Y661-V679 PolarHBondContact O-N 2.93Å; Y661-S681 VanDerWaalsContact CE2-CB 3.41Å
662	F	98.4	Very high	93.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	125.5	173.1	-61.2	-82	0	0	0	108.9	L652 A653 Y660 L677 V678 P697 V699 L706 I721 I727	L652-F662 CarbonylContact C-O 3.47Å; L652-F662 WeakPolarHBondContact CA-O 3.42Å; A653-F662 PolarHBondContact N-O 3.47Å; A653-F662 PolarHBondContact O-N 3.24Å; Y660-F662 HydrophobicContact CD2-CZ 4.28Å; Y660-F662 HydrophobicContact CG-CZ 4.43Å; F662-L677 WeakPolarHBondContact CA-O 3.21Å; F662-V678 HydrophobicContact CD1-CG2 4.08Å; F662-V678 HydrophobicContact CE1-CG1 4.29Å; F662-V678 HydrophobicContact CE1-CG2 4Å; F662-P697 HydrophobicContact CB-CB 4.05Å; F662-P697 HydrophobicContact CB-CG 4.14Å; F662-V699 HydrophobicContact CD2-CG2 4.29Å; F662-L706 HydrophobicContact CD1-CD2 3.53Å; F662-L706 HydrophobicContact CD2-CD1 4.09Å; F662-L706 HydrophobicContact CD2-CD2 4.11Å; F662-L706 HydrophobicContact CE1-CD2 3.43Å; F662-L706 VanDerWaalsContact CE1-CD2 3.43Å; F662-L706 HydrophobicContact CE2-CD2 4.02Å; F662-L706 HydrophobicContact CG-CD1 4.15Å; F662-L706 HydrophobicContact CG-CD2 3.88Å; F662-L706 HydrophobicContact CZ-CD2 3.7Å; F662-I721 HydrophobicContact CE2-CD1 3.8Å; F662-I721 HydrophobicContact CZ-CD1 3.76Å; F662-I727 HydrophobicContact CE1-CD1 3.76Å; F662-I727 HydrophobicContact CZ-CD1 3.87Å; F662-I727 HydrophobicContact CZ-CG1 4.33Å
663	I	98.4	Very high	92.9	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	117.9	-173.7	-52.7	166.3	0	0	0	108.7	L626 L642 P649 L652 Q676 L677 V679	L626-I663 HydrophobicContact CD1-CD1 3.57Å; L626-I663 HydrophobicContact CD1-CG1 4.38Å; L626-I663 HydrophobicContact CG-CD1 4.42Å; L642-I663 HydrophobicContact CD1-CD1 4.3Å; L642-I663 HydrophobicContact CD2-CD1 4.36Å; P649-I663 HydrophobicContact CB-CG2 3.81Å; L652-I663 HydrophobicContact CD2-CG1 4.13Å; L652-I663 HydrophobicContact CG-CG1 4.14Å; L652-I663 HydrophobicContact CG-CG2 4.49Å; I663-Q676 CarbonylContact O-C 3.56Å; I663-Q676 WeakPolarHBondContact O-CA 3.42Å; I663-Q676 WeakPolarHBondContact O-CB 3.22Å; I663-L677 HydrophobicContact CB-CB 4.33Å; I663-L677 HydrophobicContact CD1-CB 4.5Å; I663-L677 PolarHBondContact N-O 2.75Å; I663-L677 PolarHBondContact O-N 3.34Å; I663-V679 HydrophobicContact CD1-CB 4.28Å; I663-V679 HydrophobicContact CD1-CG2 3.45Å; I663-V679 VanDerWaalsContact CD1-CG2 3.45Å
664	S	97.4	Very high	92.7	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	134.7	163.5	-173.9	0	0	0	0	109.4	L650 S651 G695	L650-S664 PolarHBondContact N-O 2.95Å; S651-S664 PolarHBondContact N-O 3.28Å; S651-S664 PolarHBondContact O-N 2.85Å; S651-S664 WeakPolarHBondContact OG-CB 3.36Å; S664-G695 VanDerWaalsContact CB-O 3.25Å; S664-G695 WeakPolarHBondContact CB-O 3.42Å; S664-G695 PolarHBondContact OG-O 3.15Å
665	C	95.9	Very high	92.6	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.02	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	157.4	176.3	-40.1	0	0	0	0	111.4	C647 I648 P674	C647-C665 HydrophobicContact CB-CB 3.9Å; C647-C665 WeakPolarHBondContact CB-SG 3.37Å; C647-C665 WeakPolarHBondContact SG-CB 3.31Å; C647-C665 CovalentContact SG-SG 2.02Å; C647-C665 PolarHBondContact SG-SG 3.06Å; I648-C665 CarbonylContact O-C 3.58Å; I648-C665 VanDerWaalsContact O-CA 3.23Å; I648-C665 WeakPolarHBondContact O-CA 3.36Å; C665-P674 HydrophobicContact CB-CG 3.57Å
666	K	94	Very high	92.6	Very high	52 Å²	52	36.3 Å²	36.3	23%	0.226	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-61.9	147.7	168.8	-65.9	-172.3	-177	178.6	0	110.1	D599 I648 L650	D599-K666 IonicContact OD2-NZ 3.88Å; D599-K666 PolarHBondContact OD2-NZ 3.43Å; I648-K666 HydrophobicContact CB-CB 4.37Å; I648-K666 HydrophobicContact CB-CD 4.48Å; I648-K666 HydrophobicContact CB-CG 4.45Å; I648-K666 HydrophobicContact CG2-CD 3.85Å; I648-K666 HydrophobicContact CG2-CG 4.23Å; I648-K666 PolarHBondContact O-N 3.39Å; L650-K666 HydrophobicContact CB-CG 3.95Å; L650-K666 HydrophobicContact CD1-CG 4.19Å
667	P	92.2	Very high	92.8	Very high	70 Å²	70	36.3 Å²	36.3	46%	0.455	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-57.5	148.5	173.2	-16.3	26.3	0	0	0	111.4	A672 I673	P667-A672 WeakPolarHBondContact CA-O 3.4Å; P667-I673 HydrophobicContact CB-CG1 4.21Å; P667-I673 HydrophobicContact CG-CG1 4.08Å
668	D	86.2	Confident	93	Very high	81 Å²	81	36.7 Å²	36.7	43%	0.433	22%	0.222	S	C	.	.			trans	-73.6	-179.3	174.8	74.1	13.5	0	0	0	112.4	T670 G671 A672	D668-T670 VanDerWaalsContact CG-OG1 3.32Å; D668-T670 PolarHBondContact O-N 3.17Å; D668-T670 VanDerWaalsContact OD1-CA 3.27Å; D668-T670 WeakPolarHBondContact OD1-CA 3.24Å; D668-T670 WeakPolarHBondContact OD1-CB 3.42Å; D668-T670 PolarHBondContact OD1-N 2.6Å; D668-T670 PolarHBondContact OD1-OG1 2.9Å; D668-T670 PolarHBondContact OD2-OG1 2.81Å; D668-G671 WeakPolarHBondContact O-CA 3.47Å; D668-G671 PolarHBondContact O-N 2.83Å; D668-G671 PolarHBondContact OD1-N 3.31Å; D668-A672 PolarHBondContact N-O 3.41Å; D668-A672 PolarHBondContact OD1-N 2.85Å
669	I	84.8	Confident	93.3	Very high	181 Å²	181	36.7 Å²	36.7	93%	0.928	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.1	-179.7	-57.1	161.6	0	0	0	111.9	G671	I669-G671 VanDerWaalsContact C-N 3.27Å
670	T	86.4	Confident	93.4	Very high	117 Å²	117	36.7 Å²	36.7	72%	0.718	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-6.7	176	75.2	0	0	0	0	112.7	D668 A672	D668-T670 VanDerWaalsContact CG-OG1 3.32Å; D668-T670 PolarHBondContact O-N 3.17Å; D668-T670 VanDerWaalsContact OD1-CA 3.27Å; D668-T670 WeakPolarHBondContact OD1-CA 3.24Å; D668-T670 WeakPolarHBondContact OD1-CB 3.42Å; D668-T670 PolarHBondContact OD1-N 2.6Å; D668-T670 PolarHBondContact OD1-OG1 2.9Å; D668-T670 PolarHBondContact OD2-OG1 2.81Å; T670-A672 VanDerWaalsContact C-N 3.29Å; T670-A672 WeakPolarHBondContact OG1-CB 3.44Å; T670-A672 PolarHBondContact OG1-N 3.32Å
671	G	84.5	Confident	93.2	Very high	51 Å²	51	36.3 Å²	36.3	53%	0.526	22%	0.222	S	C	.	.	S	Bend	trans	82	4.5	-172.3	0	0	0	0	0	113.5	D668 I669	D668-G671 WeakPolarHBondContact O-CA 3.47Å; D668-G671 PolarHBondContact O-N 2.83Å; D668-G671 PolarHBondContact OD1-N 3.31Å; I669-G671 VanDerWaalsContact C-N 3.27Å
672	A	86.3	Confident	92.9	Very high	47 Å²	47	36.8 Å²	36.8	39%	0.388	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-76.1	130.1	177	0	0	0	0	0	110	P667 D668 T670 P674	P667-A672 WeakPolarHBondContact CA-O 3.4Å; D668-A672 PolarHBondContact N-O 3.41Å; D668-A672 PolarHBondContact OD1-N 2.85Å; T670-A672 VanDerWaalsContact C-N 3.29Å; T670-A672 WeakPolarHBondContact OG1-CB 3.44Å; T670-A672 PolarHBondContact OG1-N 3.32Å; A672-P674 WeakPolarHBondContact O-CD 3.27Å
673	I	88	Confident	92.6	Very high	37 Å²	37	37.2 Å²	37.2	19%	0.19	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-86.9	116.8	177.4	-57.5	172	0	0	0	107.7	P667 T694 V712	P667-I673 HydrophobicContact CB-CG1 4.21Å; P667-I673 HydrophobicContact CG-CG1 4.08Å; I673-T694 HydrophobicContact CG2-CG2 4.3Å; I673-T694 WeakPolarHBondContact O-CG2 3.36Å; I673-V712 HydrophobicContact CD1-CB 4.22Å; I673-V712 HydrophobicContact CD1-CG2 4.02Å
674	P	93.1	Very high	92.4	Very high	40 Å²	40	38 Å²	38	26%	0.26	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-69.9	156.2	177.3	32.8	-37.8	0	0	0	110.6	C665 A672	C665-P674 HydrophobicContact CB-CG 3.57Å; A672-P674 WeakPolarHBondContact O-CD 3.27Å
675	P	95.7	Very high	92.1	Very high	46 Å²	46	38.7 Å²	38.7	30%	0.299	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-55.2	150.6	173.3	-24.4	34.4	0	0	0	112.2	V693	P675-V693 CarbonylContact C-O 3.57Å; P675-V693 WeakPolarHBondContact CA-O 3.46Å
676	Q	97.5	Very high	92.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-58.7	146.2	172.2	-71.7	176.7	0.1	0	0	110.1	I663 S689 N690 V693 G695 S708	I663-Q676 CarbonylContact O-C 3.56Å; I663-Q676 WeakPolarHBondContact O-CA 3.42Å; I663-Q676 WeakPolarHBondContact O-CB 3.22Å; Q676-S689 CarbonylContact O-C 3.58Å; Q676-S689 WeakPolarHBondContact O-CA 3.23Å; Q676-N690 HydrophobicContact CB-CB 4.07Å; Q676-N690 PolarHBondContact O-N 2.97Å; Q676-N690 PolarHBondContact OE1-ND2 3.04Å; Q676-V693 PolarHBondContact N-O 2.95Å; Q676-G695 PolarHBondContact NE2-O 3.23Å; Q676-S708 PolarHBondContact NE2-OG 2.98Å; Q676-S708 PolarHBondContact OE1-OG 3.39Å
677	L	97.9	Very high	92.1	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.031	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	146.4	171.2	-60.2	179.8	0	0	0	110.4	L642 C647 F662 I663	L642-L677 HydrophobicContact CD2-CD1 4.33Å; C647-L677 HydrophobicContact CB-CD1 3.48Å; C647-L677 VanDerWaalsContact CB-CD1 3.48Å; C647-L677 HydrophobicContact CB-CG 4.39Å; F662-L677 WeakPolarHBondContact CA-O 3.21Å; I663-L677 HydrophobicContact CB-CB 4.33Å; I663-L677 HydrophobicContact CD1-CB 4.5Å; I663-L677 PolarHBondContact N-O 2.75Å; I663-L677 PolarHBondContact O-N 3.34Å
678	V	97.5	Very high	92.2	Very high	8 Å²	8	39.6 Å²	39.6	5%	0.048	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.1	170.6	-167.8	0	0	0	0	108.4	Y660 Y661 F662 I687 G688 N690	Y660-V678 HydrophobicContact CD1-CG1 3.85Å; Y660-V678 HydrophobicContact CG-CG1 4.03Å; Y661-V678 WeakPolarHBondContact O-CA 3.24Å; F662-V678 HydrophobicContact CD1-CG2 4.08Å; F662-V678 HydrophobicContact CE1-CG1 4.29Å; F662-V678 HydrophobicContact CE1-CG2 4Å; V678-I687 HydrophobicContact CB-CB 4.32Å; V678-I687 HydrophobicContact CG1-CD1 3.89Å; V678-I687 PolarHBondContact O-N 3.15Å; V678-G688 PolarHBondContact N-O 3.48Å; V678-N690 HydrophobicContact CG2-CB 3.7Å
679	V	96.9	Very high	92.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.2	175.7	173.7	0	0	0	0	109.3	I640 Y661 I663 S685 I686	I640-V679 HydrophobicContact CD1-CG1 4.49Å; Y661-V679 PolarHBondContact N-O 2.88Å; Y661-V679 PolarHBondContact O-N 2.93Å; I663-V679 HydrophobicContact CD1-CB 4.28Å; I663-V679 HydrophobicContact CD1-CG2 3.45Å; I663-V679 VanDerWaalsContact CD1-CG2 3.45Å; V679-S685 WeakPolarHBondContact CA-O 3.46Å; V679-I686 HydrophobicContact CG2-CG1 4.15Å
680	D	95.2	Very high	93.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128	175.8	-175.7	76.5	0	0	0	110.3	R284 N285 V682 T683 D684 S685 I687	R284-D680 IonicContact CZ-OD1 3.85Å; R284-D680 IonicContact NE-OD1 3.62Å; R284-D680 PolarHBondContact NE-OD1 2.69Å; R284-D680 IonicContact NE-OD2 2.76Å; R284-D680 PolarHBondContact NE-OD2 3.21Å; R284-D680 IonicContact NH2-OD1 3.62Å; R284-D680 PolarHBondContact NH2-OD1 2.97Å; N285-D680 PolarHBondContact ND2-OD1 2.88Å; N285-D680 VanDerWaalsContact ND2-OD1 3.09Å; D680-V682 VanDerWaalsContact C-N 3.33Å; D680-V682 PolarHBondContact O-N 3.35Å; D680-V682 WeakPolarHBondContact OD2-CB 3.12Å; D680-V682 PolarHBondContact OD2-N 3.35Å; D680-V682 VanDerWaalsContact OD2-N 3.13Å; D680-T683 WeakPolarHBondContact CB-OG1 3.49Å; D680-T683 PolarHBondContact OD2-N 3.25Å; D680-T683 PolarHBondContact OD2-OG1 3.13Å; D680-D684 WeakPolarHBondContact O-CA 3.27Å; D680-D684 PolarHBondContact O-N 3.29Å; D680-S685 PolarHBondContact N-O 2.94Å; D680-I687 HydrophobicContact CB-CD1 3.97Å; D680-I687 HydrophobicContact CB-CG1 3.97Å
681	S	93.4	Very high	93.6	Very high	14 Å²	14	28.8 Å²	28.8	10%	0.098	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-19.5	-177.9	62.1	0	0	0	0	114.6	G659 Y661	G659-S681 WeakPolarHBondContact CA-OG 3.42Å; G659-S681 WeakPolarHBondContact O-CB 3.49Å; G659-S681 PolarHBondContact O-N 3.27Å; G659-S681 PolarHBondContact O-OG 2.84Å; Y661-S681 VanDerWaalsContact CE2-CB 3.41Å
682	V	91.6	Very high	94.1	Very high	16 Å²	16	30.9 Å²	30.9	10%	0.097	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-51.2	-179.9	177	0	0	0	0	110.3	L294 I297 V314 D680	L294-V682 HydrophobicContact CD1-CG1 4.18Å; L294-V682 WeakPolarHBondContact CD2-O 3.37Å; I297-V682 HydrophobicContact CD1-CG1 3.68Å; V314-V682 HydrophobicContact CB-CG2 4.43Å; V314-V682 HydrophobicContact CG2-CG2 3.96Å; V314-V682 VanDerWaalsContact O-CG2 3.29Å; V314-V682 WeakPolarHBondContact O-CG2 3.3Å; D680-V682 VanDerWaalsContact C-N 3.33Å; D680-V682 PolarHBondContact O-N 3.35Å; D680-V682 WeakPolarHBondContact OD2-CB 3.12Å; D680-V682 PolarHBondContact OD2-N 3.35Å; D680-V682 VanDerWaalsContact OD2-N 3.13Å
683	T	92	Very high	94.6	Very high	10 Å²	10	28.7 Å²	28.7	6%	0.061	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-14.2	-177.6	61.3	0	0	0	0	113.3	I287 L289 L292 D680 S685	I287-T683 HydrophobicContact CB-CG2 4.37Å; I287-T683 HydrophobicContact CG2-CG2 4.33Å; L289-T683 HydrophobicContact CD2-CG2 3.53Å; L292-T683 HydrophobicContact CD1-CG2 3.98Å; D680-T683 WeakPolarHBondContact CB-OG1 3.49Å; D680-T683 PolarHBondContact OD2-N 3.25Å; D680-T683 PolarHBondContact OD2-OG1 3.13Å; T683-S685 PolarHBondContact O-N 3.23Å; T683-S685 PolarHBondContact OG1-N 2.66Å; T683-S685 PolarHBondContact OG1-OG 3.41Å
684	D	93	Very high	95	Very high	16 Å²	16	27.4 Å²	27.4	9%	0.086	17%	0.172	C	C	.	.			trans	56.1	28.8	-170.6	-62.2	-57	0	0	0	113	K628 K638 I640 D680	K628-D684 IonicContact NZ-OD1 2.95Å; K628-D684 PolarHBondContact NZ-OD1 3.14Å; K628-D684 IonicContact NZ-OD2 3.99Å; K628-D684 PolarHBondContact NZ-OD2 3.5Å; K638-D684 VanDerWaalsContact CE-CG 3.44Å; K638-D684 WeakPolarHBondContact CE-OD2 3.31Å; K638-D684 IonicContact NZ-OD2 3.58Å; K638-D684 PolarHBondContact NZ-OD2 2.79Å; I640-D684 HydrophobicContact CD1-CB 3.7Å; I640-D684 HydrophobicContact CG1-CB 4.08Å; I640-D684 WeakPolarHBondContact CG2-O 3.34Å; D680-D684 WeakPolarHBondContact O-CA 3.27Å; D680-D684 PolarHBondContact O-N 3.29Å
685	S	93	Very high	95.1	Very high	18 Å²	18	25.9 Å²	25.9	13%	0.126	16%	0.163	C	C	.	.			trans	-103.1	147.9	179.3	66	0	0	0	0	112.3	I287 V679 D680 T683 I687	I287-S685 VanDerWaalsContact CG1-OG 3.29Å; I287-S685 WeakPolarHBondContact CG1-OG 3.33Å; V679-S685 WeakPolarHBondContact CA-O 3.46Å; D680-S685 PolarHBondContact N-O 2.94Å; T683-S685 PolarHBondContact O-N 3.23Å; T683-S685 PolarHBondContact OG1-N 2.66Å; T683-S685 PolarHBondContact OG1-OG 3.41Å; S685-I687 PolarHBondContact O-N 2.87Å
686	I	95.3	Very high	95.1	Very high	49 Å²	49	25.8 Å²	25.8	25%	0.251	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	118	170.5	-53.9	171.5	0	0	0	108.5	L642 V679	L642-I686 HydrophobicContact CD2-CD1 3.67Å; L642-I686 HydrophobicContact CD2-CG1 3.94Å; V679-I686 HydrophobicContact CG2-CG1 4.15Å
687	I	94.4	Very high	95.1	Very high	66 Å²	66	26 Å²	26	34%	0.338	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-43.3	173.9	-56.5	-178.1	0	0	0	109.4	N285 Y660 V678 D680 S685	N285-I687 HydrophobicContact CB-CD1 4.45Å; N285-I687 HydrophobicContact CB-CG1 4.15Å; N285-I687 WeakPolarHBondContact ND2-CD1 3.31Å; Y660-I687 HydrophobicContact CD1-CD1 3.71Å; Y660-I687 HydrophobicContact CE1-CD1 3.57Å; V678-I687 HydrophobicContact CB-CB 4.32Å; V678-I687 HydrophobicContact CG1-CD1 3.89Å; V678-I687 PolarHBondContact O-N 3.15Å; D680-I687 HydrophobicContact CB-CD1 3.97Å; D680-I687 HydrophobicContact CB-CG1 3.97Å; S685-I687 PolarHBondContact O-N 2.87Å
688	G	94.5	Very high	95.2	Very high	28 Å²	28	27.4 Å²	27.4	29%	0.289	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	154.4	-166	-179.8	0	0	0	0	0	111.8	V678	V678-G688 PolarHBondContact N-O 3.48Å
689	S	95.9	Very high	95.2	Very high	73 Å²	73	28.3 Å²	28.3	51%	0.51	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	141.2	171.6	-58.1	0	0	0	0	111	Q676 S691	Q676-S689 CarbonylContact O-C 3.58Å; Q676-S689 WeakPolarHBondContact O-CA 3.23Å; S689-S691 VanDerWaalsContact C-N 3.27Å; S689-S691 PolarHBondContact O-N 3.01Å
690	N	96.5	Very high	95.2	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.032	18%	0.175	C	C	.	.			trans	-75.4	79.9	168.4	-176.7	11.1	0	0	0	109.4	Q676 V678 D692 V693 Q719	Q676-N690 HydrophobicContact CB-CB 4.07Å; Q676-N690 PolarHBondContact O-N 2.97Å; Q676-N690 PolarHBondContact OE1-ND2 3.04Å; V678-N690 HydrophobicContact CG2-CB 3.7Å; N690-D692 PolarHBondContact O-N 2.84Å; N690-V693 HydrophobicContact CB-CB 4.48Å; N690-V693 VanDerWaalsContact O-CB 3.31Å; N690-V693 WeakPolarHBondContact O-CB 3.27Å; N690-V693 WeakPolarHBondContact O-CG2 3.21Å; N690-V693 PolarHBondContact O-N 2.77Å; N690-Q719 PolarHBondContact ND2-OE1 2.81Å; N690-Q719 PolarHBondContact OD1-NE2 3.49Å; N690-Q719 VanDerWaalsContact OD1-NE2 3.1Å; N690-Q719 PolarHBondContact OD1-OE1 3.16Å
691	S	94.3	Very high	95.1	Very high	73 Å²	73	31 Å²	31	51%	0.51	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	-127.9	-176.9	-60.4	0	0	0	0	111.3	S689	S689-S691 VanDerWaalsContact C-N 3.27Å; S689-S691 PolarHBondContact O-N 3.01Å
692	D	94.3	Very high	95.1	Very high	95 Å²	95	31 Å²	31	51%	0.508	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	13.4	172.3	68.9	-39.6	0	0	0	112.7	N690 T694 R717	N690-D692 PolarHBondContact O-N 2.84Å; D692-T694 PolarHBondContact O-N 2.79Å; D692-R717 IonicContact OD1-CZ 3.8Å; D692-R717 IonicContact OD1-NH1 3.1Å; D692-R717 PolarHBondContact OD1-NH1 2.52Å; D692-R717 IonicContact OD2-CZ 2.58Å; D692-R717 IonicContact OD2-NH1 3.81Å; D692-R717 PolarHBondContact OD2-NH1 3Å; D692-R717 IonicContact OD2-NH2 3.96Å
693	V	97	Very high	95.3	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.006	19%	0.186	C	C	.	.			trans	-68.4	131.2	-175.6	-174	0	0	0	0	110.2	P675 Q676 N690 S708 R717	P675-V693 CarbonylContact C-O 3.57Å; P675-V693 WeakPolarHBondContact CA-O 3.46Å; Q676-V693 PolarHBondContact N-O 2.95Å; N690-V693 HydrophobicContact CB-CB 4.48Å; N690-V693 VanDerWaalsContact O-CB 3.31Å; N690-V693 WeakPolarHBondContact O-CB 3.27Å; N690-V693 WeakPolarHBondContact O-CG2 3.21Å; N690-V693 PolarHBondContact O-N 2.77Å; V693-S708 VanDerWaalsContact CG1-CB 3.46Å; V693-S708 WeakPolarHBondContact CG1-OG 3.27Å; V693-R717 HydrophobicContact CG1-CB 4.49Å; V693-R717 HydrophobicContact CG1-CG 4.4Å; V693-R717 VanDerWaalsContact CG2-CD 3.48Å; V693-R717 HydrophobicContact CG2-CG 4.32Å
694	T	95.9	Very high	95.5	Very high	11 Å²	11	30.1 Å²	30.1	7%	0.067	19%	0.185	C	C	.	.			trans	-133.4	158.4	-175.7	46.5	0	0	0	0	110.5	I673 D692 N710	I673-T694 HydrophobicContact CG2-CG2 4.3Å; I673-T694 WeakPolarHBondContact O-CG2 3.36Å; D692-T694 PolarHBondContact O-N 2.79Å; T694-N710 WeakPolarHBondContact CB-ND2 3.45Å; T694-N710 PolarHBondContact OG1-ND2 2.81Å
695	G	94.5	Very high	95.7	Very high	7 Å²	7	30 Å²	30	7%	0.072	18%	0.183	C	C	.	.	S	Bend	trans	95.3	-174.3	176.6	0	0	0	0	0	114.1	S664 Q676 P697 V709	S664-G695 VanDerWaalsContact CB-O 3.25Å; S664-G695 WeakPolarHBondContact CB-O 3.42Å; S664-G695 PolarHBondContact OG-O 3.15Å; Q676-G695 PolarHBondContact NE2-O 3.23Å; G695-P697 WeakPolarHBondContact O-CD 3.37Å; G695-V709 CarbonylContact C-O 3.58Å; G695-V709 VanDerWaalsContact CA-O 3.22Å; G695-V709 WeakPolarHBondContact CA-O 3.19Å
696	T	96.8	Very high	96	Very high	44 Å²	44	29.1 Å²	29.1	27%	0.27	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.2	-171.9	-62.3	0	0	0	0	111.4	Y698 S708 V709	T696-Y698 HydrophobicContact CG2-CD2 4.22Å; T696-Y698 HydrophobicContact CG2-CE2 3.5Å; T696-Y698 VanDerWaalsContact CG2-CE2 3.5Å; T696-Y698 WeakPolarHBondContact O-CD2 3.4Å; T696-S708 WeakPolarHBondContact O-CA 3.4Å; T696-V709 PolarHBondContact N-O 3.34Å; T696-V709 PolarHBondContact O-N 2.79Å
697	P	98.3	Very high	96.2	Very high	5 Å²	5	26.8 Å²	26.8	3%	0.032	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	145.1	178	32.8	-34.8	0	0	0	112.4	A653 F662 G695 L706 V707	A653-P697 HydrophobicContact CB-CB 3.73Å; A653-P697 HydrophobicContact CB-CG 3.8Å; F662-P697 HydrophobicContact CB-CB 4.05Å; F662-P697 HydrophobicContact CB-CG 4.14Å; G695-P697 WeakPolarHBondContact O-CD 3.37Å; P697-L706 HydrophobicContact CB-CD1 3.73Å; P697-V707 CarbonylContact C-O 3.5Å
698	Y	98.2	Very high	96.3	Very high	36 Å²	36	23.7 Å²	23.7	14%	0.141	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.1	171.9	-65.7	-97.4	0	0	0	108.1	T696 V707 V709 L742 K796	T696-Y698 HydrophobicContact CG2-CD2 4.22Å; T696-Y698 HydrophobicContact CG2-CE2 3.5Å; T696-Y698 VanDerWaalsContact CG2-CE2 3.5Å; T696-Y698 WeakPolarHBondContact O-CD2 3.4Å; Y698-V707 PolarHBondContact N-O 3.03Å; Y698-V707 PolarHBondContact O-N 2.82Å; Y698-V709 HydrophobicContact CD2-CG2 4.34Å; Y698-V709 HydrophobicContact CE2-CG2 4.19Å; Y698-L742 HydrophobicContact CD1-CB 4.01Å; Y698-L742 HydrophobicContact CD2-CB 4.4Å; Y698-L742 HydrophobicContact CD2-CD1 3.55Å; Y698-L742 HydrophobicContact CE1-CB 3.97Å; Y698-L742 HydrophobicContact CE2-CB 4.36Å; Y698-L742 HydrophobicContact CE2-CD1 3.76Å; Y698-L742 HydrophobicContact CE2-CG 4.43Å; Y698-L742 HydrophobicContact CG-CB 4.24Å; Y698-L742 HydrophobicContact CG-CD1 3.99Å; Y698-K796 WeakPolarHBondContact OH-CE 3.16Å; Y698-K796 PolarHBondContact OH-NZ 2.93Å
699	V	98	Very high	96.5	Very high	26 Å²	26	22.9 Å²	22.9	16%	0.158	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.5	178.8	172.9	0	0	0	0	109.3	A653 Y654 F662 Y705 L706 F744	A653-V699 HydrophobicContact CB-CB 4.44Å; A653-V699 HydrophobicContact CB-CG2 3.75Å; Y654-V699 WeakPolarHBondContact O-CG1 3.49Å; F662-V699 HydrophobicContact CD2-CG2 4.29Å; V699-Y705 CarbonylContact C-O 3.58Å; V699-Y705 VanDerWaalsContact CA-O 3.28Å; V699-Y705 WeakPolarHBondContact CA-O 3.49Å; V699-L706 HydrophobicContact CG2-CD1 3.74Å; V699-F744 VanDerWaalsContact C-CE2 3.44Å; V699-F744 VanDerWaalsContact C-CZ 3.5Å; V699-F744 VanDerWaalsContact O-CE2 3.22Å; V699-F744 WeakPolarHBondContact O-CE2 3.27Å
700	S	96.7	Very high	96.4	Very high	3 Å²	3	19.5 Å²	19.5	2%	0.021	12%	0.115	C	C	.	.			trans	-62.9	152.8	176.1	55.4	0	0	0	0	111	D702 G703 H704 Y705 F744	S700-D702 WeakPolarHBondContact CB-OD1 3.43Å; S700-D702 PolarHBondContact O-N 3.22Å; S700-D702 VanDerWaalsContact O-N 3.13Å; S700-D702 PolarHBondContact OG-OD1 3.34Å; S700-G703 WeakPolarHBondContact O-CA 3.27Å; S700-G703 PolarHBondContact O-N 3.16Å; S700-H704 PolarHBondContact OG-N 3.21Å; S700-Y705 PolarHBondContact N-O 3.41Å; S700-Y705 WeakPolarHBondContact OG-CB 3.48Å; S700-Y705 PolarHBondContact OG-N 3.11Å; S700-F744 VanDerWaalsContact N-CZ 3.34Å
701	P	94.3	Very high	96.2	Very high	55 Å²	55	21.7 Å²	21.7	36%	0.357	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.9	-177.4	-26.7	34.5	0	0	0	114.8	T607 G703 Y754	T607-P701 WeakPolarHBondContact CG2-O 3.47Å; P701-G703 VanDerWaalsContact C-N 3.31Å; P701-Y754 HydrophobicContact CB-CE1 4.35Å; P701-Y754 HydrophobicContact CG-CE1 3.8Å
702	D	93.7	Very high	96	Very high	12 Å²	12	24 Å²	24	6%	0.064	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-4.1	175.2	67.6	-17	0	0	0	114.1	H656 S700 H704 Y754	H656-D702 PolarHBondContact CE1-O 3.33Å; S700-D702 WeakPolarHBondContact CB-OD1 3.43Å; S700-D702 PolarHBondContact O-N 3.22Å; S700-D702 VanDerWaalsContact O-N 3.13Å; S700-D702 PolarHBondContact OG-OD1 3.34Å; D702-H704 VanDerWaalsContact C-N 3.3Å; D702-H704 PolarHBondContact O-N 3.07Å; D702-H704 PolarHBondContact OD1-N 2.91Å; D702-H704 IonicContact OD2-CG 2.66Å; D702-H704 IonicContact OD2-ND1 2.9Å; D702-H704 PolarHBondContact OD2-ND1 3.15Å; D702-H704 VanDerWaalsContact OD2-ND1 3.1Å; D702-Y754 HydrophobicContact CB-CE2 3.86Å; D702-Y754 VanDerWaalsContact CG-CE2 3.44Å
703	G	95.1	Very high	95.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.01	14%	0.141	C	C	.	.	S	Bend	trans	82	-6.9	176.5	0	0	0	0	0	116.1	S655 S700 P701	S655-G703 PolarHBondContact OG-O 2.85Å; S700-G703 WeakPolarHBondContact O-CA 3.27Å; S700-G703 PolarHBondContact O-N 3.16Å; P701-G703 VanDerWaalsContact C-N 3.31Å
704	H	96.2	Very high	95.7	Very high	7 Å²	7	26.4 Å²	26.4	3%	0.032	15%	0.148	C	C	.	.			trans	-79.2	-31.7	-172.9	-72	106.6	0	0	0	114.2	D369 L657 S700 D702 Y720 I721	D369-H704 IonicContact OD1-CE1 2.79Å; L657-H704 VanDerWaalsContact CD1-CD2 3.47Å; L657-H704 WeakPolarHBondContact CD1-CD2 3.4Å; S700-H704 PolarHBondContact OG-N 3.21Å; D702-H704 VanDerWaalsContact C-N 3.3Å; D702-H704 PolarHBondContact O-N 3.07Å; D702-H704 PolarHBondContact OD1-N 2.91Å; D702-H704 IonicContact OD2-CG 2.66Å; D702-H704 IonicContact OD2-ND1 2.9Å; D702-H704 PolarHBondContact OD2-ND1 3.15Å; D702-H704 VanDerWaalsContact OD2-ND1 3.1Å; H704-Y720 HydrophobicContact CB-CD2 4.42Å; H704-Y720 HydrophobicContact CB-CE2 3.88Å; H704-Y720 AromaticContact CD2-CZ 3.79Å; H704-Y720 PolarHBondContact CD2-OH 3.07Å; H704-Y720 CarbonylContact O-C 3.58Å; H704-Y720 VanDerWaalsContact O-CA 3.31Å; H704-Y720 WeakPolarHBondContact O-CA 3.08Å; H704-I721 PolarHBondContact CD2-O 2.9Å; H704-I721 VanDerWaalsContact CD2-O 3.23Å; H704-I721 PolarHBondContact O-N 3.14Å
705	Y	98.1	Very high	95.7	Very high	13 Å²	13	26.8 Å²	26.8	5%	0.051	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.4	-178.2	-68.1	-79	0	0	0	111.6	V699 S700 V718 Y720 Q753 L771	V699-Y705 CarbonylContact C-O 3.58Å; V699-Y705 VanDerWaalsContact CA-O 3.28Å; V699-Y705 WeakPolarHBondContact CA-O 3.49Å; S700-Y705 PolarHBondContact N-O 3.41Å; S700-Y705 WeakPolarHBondContact OG-CB 3.48Å; S700-Y705 PolarHBondContact OG-N 3.11Å; Y705-V718 HydrophobicContact CD1-CG1 4.07Å; Y705-Y720 HydrophobicContact CD1-CD2 4.27Å; Y705-Y720 AromaticContact CE1-CD2 3.88Å; Y705-Y720 HydrophobicContact CE1-CD2 3.88Å; Y705-Y720 HydrophobicContact CE1-CE2 4.45Å; Y705-Q753 PolarHBondContact OH-OE1 2.83Å; Y705-L771 HydrophobicContact CD1-CB 3.86Å; Y705-L771 HydrophobicContact CD1-CD1 4Å; Y705-L771 HydrophobicContact CD1-CG 4.44Å; Y705-L771 HydrophobicContact CD2-CB 4.36Å; Y705-L771 HydrophobicContact CD2-CD1 3.85Å; Y705-L771 HydrophobicContact CE1-CB 3.66Å; Y705-L771 HydrophobicContact CE2-CB 4.2Å; Y705-L771 HydrophobicContact CE2-CD1 4.44Å; Y705-L771 HydrophobicContact CG-CB 4.2Å; Y705-L771 HydrophobicContact CG-CD1 3.6Å; Y705-L771 HydrophobicContact CG-CG 4.49Å
706	L	98.4	Very high	95.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	111.4	167.2	172.4	63.9	0	0	0	109.1	F662 P697 V699 Q719 I721	F662-L706 HydrophobicContact CD1-CD2 3.53Å; F662-L706 HydrophobicContact CD2-CD1 4.09Å; F662-L706 HydrophobicContact CD2-CD2 4.11Å; F662-L706 HydrophobicContact CE1-CD2 3.43Å; F662-L706 VanDerWaalsContact CE1-CD2 3.43Å; F662-L706 HydrophobicContact CE2-CD2 4.02Å; F662-L706 HydrophobicContact CG-CD1 4.15Å; F662-L706 HydrophobicContact CG-CD2 3.88Å; F662-L706 HydrophobicContact CZ-CD2 3.7Å; P697-L706 HydrophobicContact CB-CD1 3.73Å; V699-L706 HydrophobicContact CG2-CD1 3.74Å; L706-Q719 HydrophobicContact CB-CB 4.26Å; L706-Q719 PolarHBondContact N-O 3.48Å; L706-Q719 PolarHBondContact O-N 3.35Å; L706-I721 HydrophobicContact CB-CD1 4.26Å
707	V	98.5	Very high	95.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.2	178.6	-178.4	0	0	0	0	108.7	P697 Y698 V716 V718 L742 F744 I756 L771	P697-V707 CarbonylContact C-O 3.5Å; Y698-V707 PolarHBondContact N-O 3.03Å; Y698-V707 PolarHBondContact O-N 2.82Å; V707-V716 HydrophobicContact CG1-CG1 3.6Å; V707-V718 HydrophobicContact CG2-CG2 4.35Å; V707-L742 HydrophobicContact CG1-CD1 3.88Å; V707-F744 HydrophobicContact CB-CZ 4.49Å; V707-F744 HydrophobicContact CG2-CE1 4.05Å; V707-F744 HydrophobicContact CG2-CZ 4.1Å; V707-I756 HydrophobicContact CG1-CD1 3.85Å; V707-I756 HydrophobicContact CG2-CD1 4.36Å; V707-I756 HydrophobicContact CG2-CG2 4.39Å; V707-L771 HydrophobicContact CG2-CD1 4.45Å; V707-L771 HydrophobicContact CG2-CD2 4.04Å
708	S	98.3	Very high	95.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.5	-178.7	-65.1	0	0	0	0	111.1	Q676 V693 T696 V716 R717	Q676-S708 PolarHBondContact NE2-OG 2.98Å; Q676-S708 PolarHBondContact OE1-OG 3.39Å; V693-S708 VanDerWaalsContact CG1-CB 3.46Å; V693-S708 WeakPolarHBondContact CG1-OG 3.27Å; T696-S708 WeakPolarHBondContact O-CA 3.4Å; S708-V716 WeakPolarHBondContact O-CA 3.37Å; S708-R717 PolarHBondContact N-O 2.97Å; S708-R717 PolarHBondContact O-N 3.33Å
709	V	97.2	Very high	95.9	Very high	11 Å²	11	24.1 Å²	24.1	7%	0.067	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	111.3	-176.4	-179.1	0	0	0	0	110.9	G695 T696 Y698 V716 I739 L742	G695-V709 CarbonylContact C-O 3.58Å; G695-V709 VanDerWaalsContact CA-O 3.22Å; G695-V709 WeakPolarHBondContact CA-O 3.19Å; T696-V709 PolarHBondContact N-O 3.34Å; T696-V709 PolarHBondContact O-N 2.79Å; Y698-V709 HydrophobicContact CD2-CG2 4.34Å; Y698-V709 HydrophobicContact CE2-CG2 4.19Å; V709-V716 HydrophobicContact CG2-CG1 4.43Å; V709-V716 HydrophobicContact CG2-CG2 4.29Å; V709-I739 HydrophobicContact CG1-CB 3.79Å; V709-I739 HydrophobicContact CG1-CG1 4.33Å; V709-I739 HydrophobicContact CG1-CG2 4.02Å; V709-I739 HydrophobicContact CG2-CG2 4.47Å; V709-L742 HydrophobicContact CG2-CD1 3.22Å; V709-L742 HydrophobicContact CG2-CG 4.23Å
710	N	95.2	Very high	95.9	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	91.7	167.1	-170.3	-32.2	0	0	0	110	T694 V712 K713 G714 L715	T694-N710 WeakPolarHBondContact CB-ND2 3.45Å; T694-N710 PolarHBondContact OG1-ND2 2.81Å; N710-V712 VanDerWaalsContact C-N 3.33Å; N710-V712 PolarHBondContact O-N 2.79Å; N710-V712 PolarHBondContact OD1-N 2.85Å; N710-K713 HydrophobicContact CB-CB 4.33Å; N710-K713 WeakPolarHBondContact ND2-CD 3.44Å; N710-K713 PolarHBondContact O-N 3.3Å; N710-K713 PolarHBondContact OD1-N 3.01Å; N710-G714 PolarHBondContact O-N 3.46Å; N710-L715 HydrophobicContact CB-CB 4.43Å; N710-L715 PolarHBondContact N-O 3.36Å; N710-L715 PolarHBondContact O-N 2.99Å
711	D	91.5	Very high	95.9	Very high	52 Å²	52	26.1 Å²	26.1	28%	0.278	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-40.4	-179.1	-168.4	66.6	0	0	0	113	K713 G714 H738 I739	D711-K713 VanDerWaalsContact C-N 3.28Å; D711-K713 PolarHBondContact O-N 2.77Å; D711-G714 PolarHBondContact O-N 3.06Å; D711-H738 WeakPolarHBondContact OD1-CA 3.44Å; D711-H738 IonicContact OD1-ND1 3.32Å; D711-H738 IonicContact OD2-CE1 3.82Å; D711-H738 IonicContact OD2-CG 3.32Å; D711-H738 IonicContact OD2-ND1 3.89Å; D711-H738 PolarHBondContact OD2-ND1 3.07Å; D711-I739 PolarHBondContact OD1-N 3.32Å
712	V	89.4	Confident	95.9	Very high	121 Å²	121	24.5 Å²	24.5	73%	0.733	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-36.9	-178.7	-179.5	0	0	0	0	111.5	I673 N710	I673-V712 HydrophobicContact CD1-CB 4.22Å; I673-V712 HydrophobicContact CD1-CG2 4.02Å; N710-V712 VanDerWaalsContact C-N 3.33Å; N710-V712 PolarHBondContact O-N 2.79Å; N710-V712 PolarHBondContact OD1-N 2.85Å
713	K	91.9	Very high	95.7	Very high	133 Å²	133	26.5 Å²	26.5	58%	0.578	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-6.9	176.4	-65.8	-175.2	-175.7	170.3	0	113.4	N710 D711 L715	N710-K713 HydrophobicContact CB-CB 4.33Å; N710-K713 WeakPolarHBondContact ND2-CD 3.44Å; N710-K713 PolarHBondContact O-N 3.3Å; N710-K713 PolarHBondContact OD1-N 3.01Å; D711-K713 VanDerWaalsContact C-N 3.28Å; D711-K713 PolarHBondContact O-N 2.77Å; K713-L715 VanDerWaalsContact C-N 3.25Å; K713-L715 HydrophobicContact CB-CB 4.16Å; K713-L715 PolarHBondContact O-N 3.42Å
714	G	93.3	Very high	95.4	Very high	14 Å²	14	31.6 Å²	31.6	14%	0.144	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	37.2	-171	0	0	0	0	0	112.7	N710 D711 H734 T735	N710-G714 PolarHBondContact O-N 3.46Å; D711-G714 PolarHBondContact O-N 3.06Å; G714-H734 WeakPolarHBondContact O-CA 3.18Å; G714-T735 CarbonylContact C-O 3.58Å; G714-T735 WeakPolarHBondContact CA-O 3.44Å; G714-T735 PolarHBondContact O-N 3Å
715	L	96.5	Very high	95.1	Very high	19 Å²	19	31.4 Å²	31.4	10%	0.099	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.8	-173.8	178.1	66	0	0	0	110.6	N710 K713 D732	N710-L715 HydrophobicContact CB-CB 4.43Å; N710-L715 PolarHBondContact N-O 3.36Å; N710-L715 PolarHBondContact O-N 2.99Å; K713-L715 VanDerWaalsContact C-N 3.25Å; K713-L715 HydrophobicContact CB-CB 4.16Å; K713-L715 PolarHBondContact O-N 3.42Å; L715-D732 HydrophobicContact CD1-CB 3.88Å
716	V	97.5	Very high	94.9	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	113	167.4	-178.8	0	0	0	0	107.7	V707 S708 V709 I733 T735 L767	V707-V716 HydrophobicContact CG1-CG1 3.6Å; S708-V716 WeakPolarHBondContact O-CA 3.37Å; V709-V716 HydrophobicContact CG2-CG1 4.43Å; V709-V716 HydrophobicContact CG2-CG2 4.29Å; V716-I733 HydrophobicContact CB-CB 4.24Å; V716-I733 PolarHBondContact N-O 2.95Å; V716-I733 PolarHBondContact O-N 2.5Å; V716-T735 HydrophobicContact CG2-CG2 4.3Å; V716-L767 HydrophobicContact CG2-CD2 4.48Å
717	R	97.7	Very high	94.7	Very high	33 Å²	33	37.6 Å²	37.6	13%	0.125	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	128.4	178.1	178.4	156.2	-68.9	164.4	0.5	110	D692 V693 S708 Q719 D732	D692-R717 IonicContact OD1-CZ 3.8Å; D692-R717 IonicContact OD1-NH1 3.1Å; D692-R717 PolarHBondContact OD1-NH1 2.52Å; D692-R717 IonicContact OD2-CZ 2.58Å; D692-R717 IonicContact OD2-NH1 3.81Å; D692-R717 PolarHBondContact OD2-NH1 3Å; D692-R717 IonicContact OD2-NH2 3.96Å; V693-R717 HydrophobicContact CG1-CB 4.49Å; V693-R717 HydrophobicContact CG1-CG 4.4Å; V693-R717 VanDerWaalsContact CG2-CD 3.48Å; V693-R717 HydrophobicContact CG2-CG 4.32Å; S708-R717 PolarHBondContact N-O 2.97Å; S708-R717 PolarHBondContact O-N 3.33Å; R717-Q719 HydrophobicContact CG-CG 4.39Å; R717-D732 WeakPolarHBondContact CB-OD1 3.48Å; R717-D732 VanDerWaalsContact CG-OD1 3.29Å; R717-D732 WeakPolarHBondContact CG-OD1 3.38Å; R717-D732 IonicContact CZ-OD1 3.42Å; R717-D732 IonicContact CZ-OD2 3.9Å; R717-D732 IonicContact NE-OD1 3.55Å; R717-D732 PolarHBondContact NE-OD1 3.48Å; R717-D732 IonicContact NE-OD2 3.64Å; R717-D732 PolarHBondContact NE-OD2 2.84Å; R717-D732 IonicContact NH2-OD1 3.65Å; R717-D732 IonicContact NH2-OD2 3.63Å; R717-D732 PolarHBondContact NH2-OD2 2.97Å
718	V	98.4	Very high	94.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.5	177.8	-175.8	0	0	0	0	108.9	Y705 V707 A730 F731 L771	Y705-V718 HydrophobicContact CD1-CG1 4.07Å; V707-V718 HydrophobicContact CG2-CG2 4.35Å; V718-A730 HydrophobicContact CB-CB 4.47Å; V718-A730 HydrophobicContact CG1-CB 4.21Å; V718-A730 WeakPolarHBondContact O-CA 3.5Å; V718-A730 VanDerWaalsContact O-CB 3.29Å; V718-A730 WeakPolarHBondContact O-CB 3.49Å; V718-A730 PolarHBondContact O-N 3.38Å; V718-F731 HydrophobicContact CB-CD2 4.22Å; V718-F731 HydrophobicContact CB-CE1 4.26Å; V718-F731 HydrophobicContact CB-CE2 3.86Å; V718-F731 HydrophobicContact CB-CZ 3.87Å; V718-F731 HydrophobicContact CG1-CE1 4.15Å; V718-F731 HydrophobicContact CG1-CE2 4.42Å; V718-F731 HydrophobicContact CG1-CZ 3.92Å; V718-F731 HydrophobicContact CG2-CD2 4.16Å; V718-F731 HydrophobicContact CG2-CE2 3.52Å; V718-F731 HydrophobicContact CG2-CZ 3.81Å; V718-F731 PolarHBondContact N-O 3.39Å; V718-F731 PolarHBondContact O-N 3.47Å; V718-L771 HydrophobicContact CG1-CD2 4.14Å; V718-L771 HydrophobicContact CG2-CD2 4.22Å
719	Q	98.5	Very high	94.5	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	152.5	173	-63.2	-180	-68	0	0	109.7	N690 L706 R717 I727 L728 D729	N690-Q719 PolarHBondContact ND2-OE1 2.81Å; N690-Q719 PolarHBondContact OD1-NE2 3.49Å; N690-Q719 VanDerWaalsContact OD1-NE2 3.1Å; N690-Q719 PolarHBondContact OD1-OE1 3.16Å; L706-Q719 HydrophobicContact CB-CB 4.26Å; L706-Q719 PolarHBondContact N-O 3.48Å; L706-Q719 PolarHBondContact O-N 3.35Å; R717-Q719 HydrophobicContact CG-CG 4.39Å; Q719-I727 HydrophobicContact CB-CG2 4.24Å; Q719-L728 CarbonylContact C-O 3.5Å; Q719-L728 WeakPolarHBondContact CA-O 3.39Å; Q719-L728 WeakPolarHBondContact CB-O 3.36Å; Q719-D729 PolarHBondContact NE2-OD1 3.45Å
720	Y	97.7	Very high	94.4	Very high	70 Å²	70	48 Å²	48	28%	0.275	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.1	177.2	-172.5	-91.8	0	0	0	110.1	H704 Y705 T722 L728	H704-Y720 HydrophobicContact CB-CD2 4.42Å; H704-Y720 HydrophobicContact CB-CE2 3.88Å; H704-Y720 AromaticContact CD2-CZ 3.79Å; H704-Y720 PolarHBondContact CD2-OH 3.07Å; H704-Y720 CarbonylContact O-C 3.58Å; H704-Y720 VanDerWaalsContact O-CA 3.31Å; H704-Y720 WeakPolarHBondContact O-CA 3.08Å; Y705-Y720 HydrophobicContact CD1-CD2 4.27Å; Y705-Y720 AromaticContact CE1-CD2 3.88Å; Y705-Y720 HydrophobicContact CE1-CD2 3.88Å; Y705-Y720 HydrophobicContact CE1-CE2 4.45Å; Y720-T722 HydrophobicContact CD1-CG2 4.16Å; Y720-T722 HydrophobicContact CE1-CG2 4.17Å; Y720-L728 PolarHBondContact N-O 3.06Å; Y720-L728 PolarHBondContact O-N 3.06Å
721	I	96.5	Very high	94.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.3	178.4	-52.9	177.6	0	0	0	107.7	L657 F662 H704 L706 E726 I727	L657-I721 HydrophobicContact CB-CG2 3.76Å; L657-I721 HydrophobicContact CD1-CG2 4.44Å; F662-I721 HydrophobicContact CE2-CD1 3.8Å; F662-I721 HydrophobicContact CZ-CD1 3.76Å; H704-I721 PolarHBondContact CD2-O 2.9Å; H704-I721 VanDerWaalsContact CD2-O 3.23Å; H704-I721 PolarHBondContact O-N 3.14Å; L706-I721 HydrophobicContact CB-CD1 4.26Å; I721-E726 CarbonylContact C-O 3.59Å; I721-E726 WeakPolarHBondContact CA-O 3.5Å; I721-I727 HydrophobicContact CG1-CG1 4.37Å
722	T	94	Very high	94.8	Very high	22 Å²	22	51 Å²	51	14%	0.135	26%	0.26	C	S	.	.			trans	-75.7	163.4	179.1	73.2	0	0	0	0	111.4	Y720 R724 G725 E726 L728	Y720-T722 HydrophobicContact CD1-CG2 4.16Å; Y720-T722 HydrophobicContact CE1-CG2 4.17Å; T722-R724 PolarHBondContact O-N 3.03Å; T722-R724 PolarHBondContact OG1-N 2.07Å; T722-G725 WeakPolarHBondContact O-CA 3.42Å; T722-G725 PolarHBondContact O-N 2.87Å; T722-E726 HydrophobicContact CG2-CB 4.16Å; T722-E726 PolarHBondContact N-O 3.46Å; T722-E726 WeakPolarHBondContact OG1-CB 3.28Å; T722-E726 PolarHBondContact OG1-N 3.23Å; T722-L728 HydrophobicContact CG2-CD1 3.69Å; T722-L728 HydrophobicContact CG2-CG 4.28Å
723	I	90.6	Very high	95.2	Very high	54 Å²	54	45.8 Å²	45.8	28%	0.277	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-11.7	170.8	63.5	168.3	0	0	0	113.9	I367 P368 G725	I367-I723 HydrophobicContact CG2-CB 4.25Å; I367-I723 HydrophobicContact CG2-CG2 4.07Å; P368-I723 HydrophobicContact CG-CD1 4.48Å; I723-G725 VanDerWaalsContact C-N 3.32Å
724	R	89	Confident	95.4	Very high	107 Å²	107	46.5 Å²	46.5	40%	0.404	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-3	171.7	-62.3	-177.4	-179.7	-176.9	-1.1	112.8	T722 E726	T722-R724 PolarHBondContact O-N 3.03Å; T722-R724 PolarHBondContact OG1-N 2.07Å; R724-E726 HydrophobicContact CB-CG 4.32Å
725	G	89.7	Confident	95.5	Very high	4 Å²	4	46.8 Å²	46.8	4%	0.041	23%	0.232	C	C	.	.			trans	76.4	19.4	-173.9	0	0	0	0	0	113.6	Y660 T722 I723	Y660-G725 WeakPolarHBondContact CE2-O 3.27Å; Y660-G725 PolarHBondContact OH-O 2.81Å; T722-G725 WeakPolarHBondContact O-CA 3.42Å; T722-G725 PolarHBondContact O-N 2.87Å; I723-G725 VanDerWaalsContact C-N 3.32Å
726	E	92.4	Very high	95.3	Very high	91 Å²	91	52.1 Å²	52.1	43%	0.425	26%	0.261	S	S	.	.			trans	-81.3	128.7	173.5	-62.4	170.4	-177	0	0	109.4	I721 T722 R724 L728	I721-E726 CarbonylContact C-O 3.59Å; I721-E726 WeakPolarHBondContact CA-O 3.5Å; T722-E726 HydrophobicContact CG2-CB 4.16Å; T722-E726 PolarHBondContact N-O 3.46Å; T722-E726 WeakPolarHBondContact OG1-CB 3.28Å; T722-E726 PolarHBondContact OG1-N 3.23Å; R724-E726 HydrophobicContact CB-CG 4.32Å; E726-L728 HydrophobicContact CB-CD2 4.42Å
727	I	95.9	Very high	95.2	Very high	52 Å²	52	52.2 Å²	52.2	27%	0.267	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.9	176.6	-56.8	160.1	0	0	0	107.9	Y660 F662 Q719 I721	Y660-I727 HydrophobicContact CD2-CD1 4.26Å; Y660-I727 HydrophobicContact CD2-CG1 4.49Å; Y660-I727 HydrophobicContact CE2-CD1 4.27Å; Y660-I727 HydrophobicContact CE2-CG1 4.31Å; F662-I727 HydrophobicContact CE1-CD1 3.76Å; F662-I727 HydrophobicContact CZ-CD1 3.87Å; F662-I727 HydrophobicContact CZ-CG1 4.33Å; Q719-I727 HydrophobicContact CB-CG2 4.24Å; I721-I727 HydrophobicContact CG1-CG1 4.37Å
728	L	96.9	Very high	95.1	Very high	80 Å²	80	53.6 Å²	53.6	42%	0.419	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138.1	-176.2	-55.1	178.2	0	0	0	110.2	Q719 Y720 T722 E726 A730	Q719-L728 CarbonylContact C-O 3.5Å; Q719-L728 WeakPolarHBondContact CA-O 3.39Å; Q719-L728 WeakPolarHBondContact CB-O 3.36Å; Y720-L728 PolarHBondContact N-O 3.06Å; Y720-L728 PolarHBondContact O-N 3.06Å; T722-L728 HydrophobicContact CG2-CD1 3.69Å; T722-L728 HydrophobicContact CG2-CG 4.28Å; E726-L728 HydrophobicContact CB-CD2 4.42Å; L728-A730 PolarHBondContact O-N 3.1Å
729	D	95.3	Very high	95	Very high	102 Å²	102	54.4 Å²	54.4	55%	0.545	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	129.6	171.9	-63.9	-38.5	0	0	0	110.1	Q719	Q719-D729 PolarHBondContact NE2-OD1 3.45Å
730	A	94.5	Very high	94.8	Very high	49 Å²	49	54.9 Å²	54.9	41%	0.405	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-66.7	179	0	0	0	0	0	110.9	V718 L728	V718-A730 HydrophobicContact CB-CB 4.47Å; V718-A730 HydrophobicContact CG1-CB 4.21Å; V718-A730 WeakPolarHBondContact O-CA 3.5Å; V718-A730 VanDerWaalsContact O-CB 3.29Å; V718-A730 WeakPolarHBondContact O-CB 3.49Å; V718-A730 PolarHBondContact O-N 3.38Å; L728-A730 PolarHBondContact O-N 3.1Å
731	F	97.5	Very high	94.8	Very high	51 Å²	51	51.8 Å²	51.8	22%	0.224	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	165.4	178	55.1	-92.8	0	0	0	112.3	V718 I733 V769 L771	V718-F731 HydrophobicContact CB-CD2 4.22Å; V718-F731 HydrophobicContact CB-CE1 4.26Å; V718-F731 HydrophobicContact CB-CE2 3.86Å; V718-F731 HydrophobicContact CB-CZ 3.87Å; V718-F731 HydrophobicContact CG1-CE1 4.15Å; V718-F731 HydrophobicContact CG1-CE2 4.42Å; V718-F731 HydrophobicContact CG1-CZ 3.92Å; V718-F731 HydrophobicContact CG2-CD2 4.16Å; V718-F731 HydrophobicContact CG2-CE2 3.52Å; V718-F731 HydrophobicContact CG2-CZ 3.81Å; V718-F731 PolarHBondContact N-O 3.39Å; V718-F731 PolarHBondContact O-N 3.47Å; F731-I733 HydrophobicContact CD2-CD1 4.24Å; F731-I733 HydrophobicContact CD2-CG1 4.06Å; F731-I733 HydrophobicContact CE2-CD1 3.75Å; F731-I733 HydrophobicContact CE2-CG1 4.09Å; F731-V769 HydrophobicContact CE2-CG1 4.18Å; F731-V769 HydrophobicContact CZ-CG1 4.37Å; F731-L771 WeakPolarHBondContact CE1-O 3.29Å
732	D	97.6	Very high	94.8	Very high	65 Å²	65	52.4 Å²	52.4	35%	0.348	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140.6	177.5	-77.4	-14.7	0	0	0	111.6	L715 R717	L715-D732 HydrophobicContact CD1-CB 3.88Å; R717-D732 WeakPolarHBondContact CB-OD1 3.48Å; R717-D732 VanDerWaalsContact CG-OD1 3.29Å; R717-D732 WeakPolarHBondContact CG-OD1 3.38Å; R717-D732 IonicContact CZ-OD1 3.42Å; R717-D732 IonicContact CZ-OD2 3.9Å; R717-D732 IonicContact NE-OD1 3.55Å; R717-D732 PolarHBondContact NE-OD1 3.48Å; R717-D732 IonicContact NE-OD2 3.64Å; R717-D732 PolarHBondContact NE-OD2 2.84Å; R717-D732 IonicContact NH2-OD1 3.65Å; R717-D732 IonicContact NH2-OD2 3.63Å; R717-D732 PolarHBondContact NH2-OD2 2.97Å
733	I	97.1	Very high	94.9	Very high	13 Å²	13	51.9 Å²	51.9	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.2	173.2	-62.6	166.8	0	0	0	108.7	V716 F731 V769 V776	V716-I733 HydrophobicContact CB-CB 4.24Å; V716-I733 PolarHBondContact N-O 2.95Å; V716-I733 PolarHBondContact O-N 2.5Å; F731-I733 HydrophobicContact CD2-CD1 4.24Å; F731-I733 HydrophobicContact CD2-CG1 4.06Å; F731-I733 HydrophobicContact CE2-CD1 3.75Å; F731-I733 HydrophobicContact CE2-CG1 4.09Å; I733-V769 HydrophobicContact CD1-CB 4.07Å; I733-V769 HydrophobicContact CD1-CG1 3.38Å; I733-V769 HydrophobicContact CD1-CG2 3.49Å; I733-V769 VanDerWaalsContact CD1-CG2 3.49Å; I733-V776 HydrophobicContact CD1-CG2 3.56Å; I733-V776 HydrophobicContact CG1-CG2 3.84Å; I733-V776 HydrophobicContact CG2-CG2 4.04Å
734	H	96.6	Very high	95.2	Very high	147 Å²	147	51.2 Å²	51.2	68%	0.681	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.7	172.3	-63.8	76	0	0	0	108.6	G714	G714-H734 WeakPolarHBondContact O-CA 3.18Å
735	T	94.9	Very high	95.6	Very high	21 Å²	21	46.4 Å²	46.4	13%	0.129	24%	0.243	C	C	.	.			trans	-135.7	143	-178.1	-176.4	0	0	0	0	110.1	G714 V716 L737 I739	G714-T735 CarbonylContact C-O 3.58Å; G714-T735 WeakPolarHBondContact CA-O 3.44Å; G714-T735 PolarHBondContact O-N 3Å; V716-T735 HydrophobicContact CG2-CG2 4.3Å; T735-L737 VanDerWaalsContact C-N 3.26Å; T735-L737 HydrophobicContact CG2-CB 4.43Å; T735-L737 WeakPolarHBondContact OG1-CB 3.49Å; T735-L737 PolarHBondContact OG1-N 2.91Å; T735-I739 HydrophobicContact CG2-CG1 4.49Å
736	N	93.8	Very high	95.8	Very high	131 Å²	131	47.4 Å²	47.4	70%	0.701	25%	0.249	S	C	*	.			trans	-89.2	4.5	169.1	68.2	-22.3	0	0	0	111.9	Q763	N736-Q763 PolarHBondContact O-NE2 2.97Å; N736-Q763 PolarHBondContact O-OE1 3.38Å
737	L	94.1	Very high	95.8	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	23%	0.233	C	C	.	.	S	Bend	trans	-73.1	125	170.8	-72.7	-178.4	0	0	0	109.9	T735 I739 Q763 D765 L767 M778	T735-L737 VanDerWaalsContact C-N 3.26Å; T735-L737 HydrophobicContact CG2-CB 4.43Å; T735-L737 WeakPolarHBondContact OG1-CB 3.49Å; T735-L737 PolarHBondContact OG1-N 2.91Å; L737-I739 HydrophobicContact CB-CD1 3.76Å; L737-I739 HydrophobicContact CB-CG1 4.48Å; L737-I739 HydrophobicContact CD1-CD1 4.17Å; L737-I739 PolarHBondContact O-N 3.06Å; L737-I739 VanDerWaalsContact O-N 3.14Å; L737-Q763 VanDerWaalsContact CA-OE1 3.26Å; L737-Q763 HydrophobicContact CD2-CB 3.79Å; L737-Q763 HydrophobicContact CD2-CG 4.32Å; L737-D765 HydrophobicContact CD2-CB 4.32Å; L737-L767 HydrophobicContact CD1-CB 3.75Å; L737-M778 HydrophobicContact CD1-CE 3.18Å; L737-M778 HydrophobicContact CD1-SD 3.96Å; L737-M778 HydrophobicContact CD2-CE 3.87Å; L737-M778 HydrophobicContact CG-CE 3.66Å
738	H	95.3	Very high	95.6	Very high	62 Å²	62	42.8 Å²	42.8	29%	0.287	23%	0.227	S	C	.	.			trans	-74.1	99.4	165.8	-73.5	-74.2	0	0	0	109	D711 S740 S760 S761 Q762	D711-H738 WeakPolarHBondContact OD1-CA 3.44Å; D711-H738 IonicContact OD1-ND1 3.32Å; D711-H738 IonicContact OD2-CE1 3.82Å; D711-H738 IonicContact OD2-CG 3.32Å; D711-H738 IonicContact OD2-ND1 3.89Å; D711-H738 PolarHBondContact OD2-ND1 3.07Å; H738-S740 PolarHBondContact O-N 3.33Å; H738-S760 CarbonylContact O-C 3.54Å; H738-S760 WeakPolarHBondContact O-CA 3.48Å; H738-S760 WeakPolarHBondContact O-CB 3.17Å; H738-S760 PolarHBondContact O-OG 2.78Å; H738-S761 VanDerWaalsContact CB-OG 3.29Å; H738-S761 WeakPolarHBondContact CB-OG 3.17Å; H738-S761 PolarHBondContact O-N 2.91Å; H738-S761 PolarHBondContact O-OG 3.36Å; H738-Q762 HydrophobicContact CB-CG 4.35Å; H738-Q762 VanDerWaalsContact CD2-CD 3.49Å; H738-Q762 PolarHBondContact CD2-NE2 2.83Å; H738-Q762 PolarHBondContact CD2-OE1 3.23Å
739	I	96.3	Very high	95.3	Very high	16 Å²	16	43 Å²	43	8%	0.082	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	118.6	-172.4	-59.4	-62.8	0	0	0	109.8	V709 D711 T735 L737 L742 S759 L767	V709-I739 HydrophobicContact CG1-CB 3.79Å; V709-I739 HydrophobicContact CG1-CG1 4.33Å; V709-I739 HydrophobicContact CG1-CG2 4.02Å; V709-I739 HydrophobicContact CG2-CG2 4.47Å; D711-I739 PolarHBondContact OD1-N 3.32Å; T735-I739 HydrophobicContact CG2-CG1 4.49Å; L737-I739 HydrophobicContact CB-CD1 3.76Å; L737-I739 HydrophobicContact CB-CG1 4.48Å; L737-I739 HydrophobicContact CD1-CD1 4.17Å; L737-I739 PolarHBondContact O-N 3.06Å; L737-I739 VanDerWaalsContact O-N 3.14Å; I739-L742 HydrophobicContact CG2-CG 4.2Å; I739-S759 CarbonylContact C-O 3.58Å; I739-S759 WeakPolarHBondContact CA-O 3.41Å; I739-L767 HydrophobicContact CD1-CB 4.13Å; I739-L767 HydrophobicContact CD1-CD2 4.06Å
740	S	95.4	Very high	95	Very high	12 Å²	12	41.7 Å²	41.7	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-46.6	178.2	-162.5	0	0	0	0	111.3	H738 S759 K796 N797 R798	H738-S740 PolarHBondContact O-N 3.33Å; S740-S759 PolarHBondContact N-O 3.38Å; S740-K796 WeakPolarHBondContact O-CG 3.5Å; S740-K796 WeakPolarHBondContact OG-CA 3.28Å; S740-N797 PolarHBondContact OG-N 2.96Å; S740-N797 PolarHBondContact OG-OD1 3.12Å; S740-R798 PolarHBondContact OG-N 2.94Å; S740-R798 VanDerWaalsContact OG-N 3.15Å
741	D	96.7	Very high	94.7	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.027	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	162.3	-174.8	-168.4	28.9	0	0	0	111.5	G758 S759 K796 H799 I800	D741-G758 CarbonylContact O-C 3.58Å; D741-G758 VanDerWaalsContact O-CA 3.3Å; D741-G758 WeakPolarHBondContact O-CA 3.14Å; D741-S759 WeakPolarHBondContact CB-OG 3.41Å; D741-S759 PolarHBondContact N-OG 3.03Å; D741-S759 VanDerWaalsContact N-OG 3.17Å; D741-S759 PolarHBondContact O-N 3.46Å; D741-S759 PolarHBondContact O-OG 3.48Å; D741-K796 HydrophobicContact CB-CD 4.01Å; D741-K796 WeakPolarHBondContact OD1-CD 3.25Å; D741-K796 WeakPolarHBondContact OD1-CE 2.98Å; D741-K796 IonicContact OD1-NZ 3.52Å; D741-K796 PolarHBondContact OD1-NZ 3.16Å; D741-H799 IonicContact OD2-CE1 3.02Å; D741-H799 PolarHBondContact OD2-CE1 2.9Å; D741-H799 IonicContact OD2-CG 3.75Å; D741-H799 IonicContact OD2-ND1 3.96Å; D741-H799 PolarHBondContact OD2-ND1 3.21Å; D741-I800 HydrophobicContact CB-CG2 4.11Å; D741-I800 PolarHBondContact OD2-N 2.72Å
742	L	96.9	Very high	94.4	Very high	13 Å²	13	39.5 Å²	39.5	7%	0.068	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	135	179.1	-81.7	172	0	0	0	111.1	Y698 V707 V709 I739 I756 Y757	Y698-L742 HydrophobicContact CD1-CB 4.01Å; Y698-L742 HydrophobicContact CD2-CB 4.4Å; Y698-L742 HydrophobicContact CD2-CD1 3.55Å; Y698-L742 HydrophobicContact CE1-CB 3.97Å; Y698-L742 HydrophobicContact CE2-CB 4.36Å; Y698-L742 HydrophobicContact CE2-CD1 3.76Å; Y698-L742 HydrophobicContact CE2-CG 4.43Å; Y698-L742 HydrophobicContact CG-CB 4.24Å; Y698-L742 HydrophobicContact CG-CD1 3.99Å; V707-L742 HydrophobicContact CG1-CD1 3.88Å; V709-L742 HydrophobicContact CG2-CD1 3.22Å; V709-L742 HydrophobicContact CG2-CG 4.23Å; I739-L742 HydrophobicContact CG2-CG 4.2Å; L742-I756 HydrophobicContact CD2-CB 4.27Å; L742-I756 HydrophobicContact CD2-CD1 4.05Å; L742-Y757 WeakPolarHBondContact CA-O 3.49Å
743	A	97.2	Very high	94.2	Very high	11 Å²	11	38.3 Å²	38.3	9%	0.091	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134	169	0	0	0	0	0	111	I756 Y757 I800 L810	A743-I756 WeakPolarHBondContact O-CA 3.31Å; A743-Y757 PolarHBondContact N-O 3.06Å; A743-Y757 PolarHBondContact O-N 2.98Å; A743-I800 HydrophobicContact CB-CB 4.49Å; A743-I800 HydrophobicContact CB-CG1 4.19Å; A743-I800 HydrophobicContact CB-CG2 3.79Å; A743-L810 HydrophobicContact CB-CD2 3.94Å
744	F	97.1	Very high	94.2	Very high	40 Å²	40	38 Å²	38	18%	0.175	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	145	166.9	-68.1	-84.8	0	0	0	110.5	V699 S700 V707 Y754 N755 I756 L771	V699-F744 VanDerWaalsContact C-CE2 3.44Å; V699-F744 VanDerWaalsContact C-CZ 3.5Å; V699-F744 VanDerWaalsContact O-CE2 3.22Å; V699-F744 WeakPolarHBondContact O-CE2 3.27Å; S700-F744 VanDerWaalsContact N-CZ 3.34Å; V707-F744 HydrophobicContact CB-CZ 4.49Å; V707-F744 HydrophobicContact CG2-CE1 4.05Å; V707-F744 HydrophobicContact CG2-CZ 4.1Å; F744-Y754 HydrophobicContact CB-CD1 4.12Å; F744-N755 CarbonylContact C-O 3.51Å; F744-N755 WeakPolarHBondContact CA-O 3.33Å; F744-I756 HydrophobicContact CD1-CG2 3.41Å; F744-I756 VanDerWaalsContact CD1-CG2 3.41Å; F744-I756 HydrophobicContact CE1-CG2 3.46Å; F744-I756 VanDerWaalsContact CE1-CG2 3.46Å; F744-I756 HydrophobicContact CG-CG2 4.16Å; F744-I756 HydrophobicContact CZ-CG2 4.24Å; F744-L771 HydrophobicContact CD1-CD1 4.21Å; F744-L771 HydrophobicContact CE1-CD1 3.93Å
745	Q	95.7	Very high	94.2	Very high	5 Å²	5	31.2 Å²	31.2	2%	0.023	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	133	170.5	-173	176.4	46.1	0	0	109.6	F748 Y754 N755 Y757 G807 Q808 G823	Q745-F748 HydrophobicContact CG-CE2 4.26Å; Q745-Y754 WeakPolarHBondContact O-CA 3.32Å; Q745-N755 PolarHBondContact N-O 3.46Å; Q745-N755 PolarHBondContact O-N 3.03Å; Q745-Y757 HydrophobicContact CB-CD2 4.36Å; Q745-Y757 HydrophobicContact CB-CE2 3.98Å; Q745-Y757 PolarHBondContact OE1-OH 2.91Å; Q745-G807 PolarHBondContact NE2-O 3.35Å; Q745-Q808 PolarHBondContact NE2-O 3.37Å; Q745-G823 VanDerWaalsContact OE1-CA 3.25Å
746	P	94.2	Very high	94.3	Very high	25 Å²	25	30.2 Å²	30.2	16%	0.162	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	141.3	171.3	-27.1	37.3	0	0	0	111.7	Y754 L805	P746-Y754 HydrophobicContact CB-CE1 4.38Å; P746-Y754 HydrophobicContact CG-CD1 4.37Å; P746-Y754 HydrophobicContact CG-CE1 3.8Å; P746-L805 HydrophobicContact CG-CD1 4.3Å; P746-L805 WeakPolarHBondContact CG-O 3.27Å
747	S	93.7	Very high	94.5	Very high	12 Å²	12	24 Å²	24	8%	0.084	13%	0.127	C	C	.	.			trans	-68.8	136.1	179.8	177.3	0	0	0	0	111.5	T749 E750 Q753	S747-T749 VanDerWaalsContact C-N 3.31Å; S747-T749 PolarHBondContact OG-N 2.83Å; S747-T749 VanDerWaalsContact OG-N 3.14Å; S747-T749 PolarHBondContact OG-OG1 2.82Å; S747-E750 WeakPolarHBondContact CB-O 3.13Å; S747-E750 PolarHBondContact OG-N 3.2Å; S747-E750 VanDerWaalsContact OG-N 3.14Å; S747-Q753 VanDerWaalsContact CB-O 3.32Å; S747-Q753 WeakPolarHBondContact CB-O 3.22Å; S747-Q753 PolarHBondContact N-O 3.47Å
748	F	91.3	Very high	94.7	Very high	35 Å²	35	23.9 Å²	23.9	15%	0.154	13%	0.127	C	C	.	.	S	Bend	trans	-85.9	-4.6	171.9	-66.5	-72.9	0	0	0	113.1	Q745 Q808 R824	Q745-F748 HydrophobicContact CG-CE2 4.26Å; F748-Q808 HydrophobicContact CZ-CB 4.29Å; F748-Q808 HydrophobicContact CZ-CG 4.41Å; F748-R824 HydrophobicContact CB-CG 4.49Å; F748-R824 HydrophobicContact CD1-CB 4.44Å; F748-R824 HydrophobicContact CD2-CB 4Å; F748-R824 HydrophobicContact CE2-CB 4.23Å; F748-R824 HydrophobicContact CG-CB 4.12Å; F748-R824 HydrophobicContact CG-CG 4.3Å
749	T	89.8	Confident	94.8	Very high	83 Å²	83	20.9 Å²	20.9	51%	0.509	11%	0.113	S	C	.	.	S	Bend	trans	-113.1	-27.2	-174.9	49.6	0	0	0	0	112.5	A393 S747	A393-T749 WeakPolarHBondContact CA-O 3.39Å; S747-T749 VanDerWaalsContact C-N 3.31Å; S747-T749 PolarHBondContact OG-N 2.83Å; S747-T749 VanDerWaalsContact OG-N 3.14Å; S747-T749 PolarHBondContact OG-OG1 2.82Å
750	E	88.9	Confident	94.8	Very high	75 Å²	75	20.1 Å²	20.1	35%	0.35	11%	0.109	S	C	.	.	S	Bend	trans	-136.4	131.7	-175.5	-63.8	-177.7	165	0	0	109.9	S747 Q753 S772	S747-E750 WeakPolarHBondContact CB-O 3.13Å; S747-E750 PolarHBondContact OG-N 3.2Å; S747-E750 VanDerWaalsContact OG-N 3.14Å; E750-Q753 HydrophobicContact CB-CB 3.9Å; E750-Q753 HydrophobicContact CB-CG 3.66Å; E750-S772 VanDerWaalsContact OE2-CB 3.23Å; E750-S772 WeakPolarHBondContact OE2-CB 3.35Å; E750-S772 PolarHBondContact OE2-OG 2.88Å
751	A	88.6	Confident	94.8	Very high	16 Å²	16	20.5 Å²	20.5	13%	0.132	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	149.4	172.5	0	0	0	0	0	110.7	A393 N394 Q753	A393-A751 WeakPolarHBondContact O-CB 3.2Å; A393-A751 PolarHBondContact O-N 2.77Å; N394-A751 HydrophobicContact CB-CB 4.25Å; A751-Q753 WeakPolarHBondContact O-CG 3.47Å; A751-Q753 PolarHBondContact O-N 3.28Å
752	H	91	Very high	94.7	Very high	39 Å²	39	26.1 Å²	26.1	18%	0.181	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	28.7	178.6	-46.5	-46.9	0	0	0	113.7	A364 P370	A364-H752 PolarHBondContact O-CE1 3.1Å; A364-H752 PolarHBondContact O-ND1 3.25Å; P370-H752 PolarHBondContact O-NE2 3.32Å
753	Q	94.1	Very high	94.7	Very high	40 Å²	40	28 Å²	28	19%	0.187	15%	0.146	C	C	.	.			trans	-129.2	153	180	-63.6	-60.7	-52.4	0	0	110.1	Y705 S747 E750 A751	Y705-Q753 PolarHBondContact OH-OE1 2.83Å; S747-Q753 VanDerWaalsContact CB-O 3.32Å; S747-Q753 WeakPolarHBondContact CB-O 3.22Å; S747-Q753 PolarHBondContact N-O 3.47Å; E750-Q753 HydrophobicContact CB-CB 3.9Å; E750-Q753 HydrophobicContact CB-CG 3.66Å; A751-Q753 WeakPolarHBondContact O-CG 3.47Å; A751-Q753 PolarHBondContact O-N 3.28Å
754	Y	96.1	Very high	94.6	Very high	5 Å²	5	29.8 Å²	29.8	2%	0.02	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.6	-178.4	-75.8	-91.5	0	0	0	111.9	P701 D702 F744 Q745 P746 L771	P701-Y754 HydrophobicContact CB-CE1 4.35Å; P701-Y754 HydrophobicContact CG-CE1 3.8Å; D702-Y754 HydrophobicContact CB-CE2 3.86Å; D702-Y754 VanDerWaalsContact CG-CE2 3.44Å; F744-Y754 HydrophobicContact CB-CD1 4.12Å; Q745-Y754 WeakPolarHBondContact O-CA 3.32Å; P746-Y754 HydrophobicContact CB-CE1 4.38Å; P746-Y754 HydrophobicContact CG-CD1 4.37Å; P746-Y754 HydrophobicContact CG-CE1 3.8Å; Y754-L771 WeakPolarHBondContact O-CB 3.22Å; Y754-L771 WeakPolarHBondContact O-CG 3.4Å; Y754-L771 PolarHBondContact O-N 3.15Å
755	N	97.1	Very high	94.6	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.027	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	160.6	166.2	-58.9	-42.5	0	0	0	109	F744 Q745 F768 V769 E770	F744-N755 CarbonylContact C-O 3.51Å; F744-N755 WeakPolarHBondContact CA-O 3.33Å; Q745-N755 PolarHBondContact N-O 3.46Å; Q745-N755 PolarHBondContact O-N 3.03Å; N755-F768 HydrophobicContact CB-CD2 4.49Å; N755-F768 HydrophobicContact CB-CE2 3.66Å; N755-F768 HydrophobicContact CB-CZ 4.25Å; N755-V769 CarbonylContact C-O 3.57Å; N755-V769 VanDerWaalsContact CA-O 3.31Å; N755-V769 WeakPolarHBondContact CA-O 3.49Å; N755-E770 VanDerWaalsContact OD1-CA 3.31Å; N755-E770 WeakPolarHBondContact OD1-CA 3.2Å
756	I	97.7	Very high	94.7	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147.5	171.1	57.6	169.6	0	0	0	111.7	V707 L742 A743 F744 F768 V769 L771	V707-I756 HydrophobicContact CG1-CD1 3.85Å; V707-I756 HydrophobicContact CG2-CD1 4.36Å; V707-I756 HydrophobicContact CG2-CG2 4.39Å; L742-I756 HydrophobicContact CD2-CB 4.27Å; L742-I756 HydrophobicContact CD2-CD1 4.05Å; A743-I756 WeakPolarHBondContact O-CA 3.31Å; F744-I756 HydrophobicContact CD1-CG2 3.41Å; F744-I756 VanDerWaalsContact CD1-CG2 3.41Å; F744-I756 HydrophobicContact CE1-CG2 3.46Å; F744-I756 VanDerWaalsContact CE1-CG2 3.46Å; F744-I756 HydrophobicContact CG-CG2 4.16Å; F744-I756 HydrophobicContact CZ-CG2 4.24Å; I756-F768 WeakPolarHBondContact O-CA 3.18Å; I756-V769 HydrophobicContact CD1-CB 3.94Å; I756-V769 HydrophobicContact CD1-CG2 3.93Å; I756-V769 HydrophobicContact CG1-CB 3.56Å; I756-V769 HydrophobicContact CG1-CG2 3.93Å; I756-V769 PolarHBondContact N-O 2.58Å; I756-V769 PolarHBondContact O-N 3.16Å; I756-L771 HydrophobicContact CD1-CD2 4.06Å; I756-L771 HydrophobicContact CG1-CD2 4.01Å; I756-L771 HydrophobicContact CG2-CD1 3.99Å; I756-L771 HydrophobicContact CG2-CD2 4.21Å; I756-L771 HydrophobicContact CG2-CG 4.3Å
757	Y	98.2	Very high	94.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.8	169.2	-64.6	-100.3	0	0	0	109.6	L742 A743 Q745 V766 L767 F768 I779 I800 L810 L821 G823 N826	L742-Y757 WeakPolarHBondContact CA-O 3.49Å; A743-Y757 PolarHBondContact N-O 3.06Å; A743-Y757 PolarHBondContact O-N 2.98Å; Q745-Y757 HydrophobicContact CB-CD2 4.36Å; Q745-Y757 HydrophobicContact CB-CE2 3.98Å; Q745-Y757 PolarHBondContact OE1-OH 2.91Å; Y757-V766 HydrophobicContact CD1-CG1 4.24Å; Y757-L767 CarbonylContact C-O 3.6Å; Y757-L767 WeakPolarHBondContact CA-O 3.42Å; Y757-F768 HydrophobicContact CD1-CB 4.34Å; Y757-F768 HydrophobicContact CD1-CD2 4.16Å; Y757-F768 HydrophobicContact CE1-CB 4.23Å; Y757-F768 AromaticContact CE1-CD2 3.54Å; Y757-F768 HydrophobicContact CE1-CD2 3.54Å; Y757-F768 HydrophobicContact CE1-CE2 4.37Å; Y757-F768 HydrophobicContact CE1-CG 4.3Å; Y757-F768 AromaticContact CE2-CD2 3.94Å; Y757-F768 HydrophobicContact CE2-CD2 3.94Å; Y757-F768 HydrophobicContact CE2-CE2 4.21Å; Y757-F768 AromaticContact CZ-CD2 3.4Å; Y757-F768 AromaticContact CZ-CE2 3.8Å; Y757-F768 WeakPolarHBondContact OH-CD2 3.49Å; Y757-F768 WeakPolarHBondContact OH-CE2 3.5Å; Y757-I779 HydrophobicContact CD1-CD1 3.88Å; Y757-I779 HydrophobicContact CE1-CD1 3.58Å; Y757-I800 VanDerWaalsContact CB-CD1 3.48Å; Y757-I800 HydrophobicContact CG-CD1 4.46Å; Y757-L810 HydrophobicContact CD1-CD1 4.44Å; Y757-L810 HydrophobicContact CD2-CD1 3.93Å; Y757-L810 HydrophobicContact CD2-CD2 3.56Å; Y757-L810 HydrophobicContact CD2-CG 4.43Å; Y757-L810 HydrophobicContact CE1-CD1 4.28Å; Y757-L810 HydrophobicContact CE2-CD1 3.77Å; Y757-L810 HydrophobicContact CE2-CD2 4.21Å; Y757-L810 HydrophobicContact CG-CD1 4.28Å; Y757-L810 HydrophobicContact CG-CD2 3.85Å; Y757-L821 HydrophobicContact CD1-CD1 4.3Å; Y757-G823 VanDerWaalsContact OH-CA 3.22Å; Y757-G823 WeakPolarHBondContact OH-CA 3.3Å; Y757-G823 PolarHBondContact OH-O 3.32Å; Y757-N826 PolarHBondContact OH-OD1 3.22Å
758	G	97.6	Very high	95.1	Very high	1 Å²	1	28 Å²	28	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.7	178.8	0	0	0	0	0	111.8	D741 V766 L767	D741-G758 CarbonylContact O-C 3.58Å; D741-G758 VanDerWaalsContact O-CA 3.3Å; D741-G758 WeakPolarHBondContact O-CA 3.14Å; G758-V766 CarbonylContact O-C 3.57Å; G758-V766 WeakPolarHBondContact O-CA 3.36Å; G758-L767 PolarHBondContact N-O 2.79Å; G758-L767 PolarHBondContact O-N 2.86Å
759	S	97.4	Very high	95.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	152.2	173.7	67.1	0	0	0	0	110.3	I739 S740 D741 R798	I739-S759 CarbonylContact C-O 3.58Å; I739-S759 WeakPolarHBondContact CA-O 3.41Å; S740-S759 PolarHBondContact N-O 3.38Å; D741-S759 WeakPolarHBondContact CB-OG 3.41Å; D741-S759 PolarHBondContact N-OG 3.03Å; D741-S759 VanDerWaalsContact N-OG 3.17Å; D741-S759 PolarHBondContact O-N 3.46Å; D741-S759 PolarHBondContact O-OG 3.48Å; S759-R798 WeakPolarHBondContact CB-O 3.4Å; S759-R798 PolarHBondContact OG-O 2.03Å
760	S	96.6	Very high	95.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	141.9	175.1	-179.1	0	0	0	0	113.4	H738 Q762 Q763 R798	H738-S760 CarbonylContact O-C 3.54Å; H738-S760 WeakPolarHBondContact O-CA 3.48Å; H738-S760 WeakPolarHBondContact O-CB 3.17Å; H738-S760 PolarHBondContact O-OG 2.78Å; S760-Q762 PolarHBondContact OG-N 3.31Å; S760-Q763 WeakPolarHBondContact OG-CB 3.05Å; S760-Q763 PolarHBondContact OG-N 3.29Å; S760-Q763 PolarHBondContact OG-OE1 3.14Å; S760-R798 WeakPolarHBondContact O-CD 3.4Å
761	S	95.4	Very high	96.1	Very high	20 Å²	20	20.5 Å²	20.5	14%	0.14	11%	0.105	C	C	.	.	S	Bend	trans	-79.9	-15.1	176.8	60.8	0	0	0	0	113.9	H738 P785 N797	H738-S761 VanDerWaalsContact CB-OG 3.29Å; H738-S761 WeakPolarHBondContact CB-OG 3.17Å; H738-S761 PolarHBondContact O-N 2.91Å; H738-S761 PolarHBondContact O-OG 3.36Å; S761-P785 WeakPolarHBondContact O-CG 3.44Å; S761-N797 WeakPolarHBondContact CA-OD1 3.38Å; S761-N797 WeakPolarHBondContact CB-OD1 3.39Å; S761-N797 PolarHBondContact O-ND2 2.8Å
762	Q	94.6	Very high	96.4	Very high	122 Å²	122	21.7 Å²	21.7	57%	0.57	11%	0.113	S	C	*	.	S	Bend	trans	-132.1	-29	-176.3	-61.9	177.9	32.4	0	0	112.9	H738 S760	H738-Q762 HydrophobicContact CB-CG 4.35Å; H738-Q762 VanDerWaalsContact CD2-CD 3.49Å; H738-Q762 PolarHBondContact CD2-NE2 2.83Å; H738-Q762 PolarHBondContact CD2-OE1 3.23Å; S760-Q762 PolarHBondContact OG-N 3.31Å
763	Q	96.1	Very high	96.5	Very high	52 Å²	52	23.7 Å²	23.7	24%	0.243	13%	0.128	C	C	.	.	S	Bend	trans	-103.8	163.1	-174.1	-66.4	140.2	-69.5	0	0	112	N736 L737 S760 R798	N736-Q763 PolarHBondContact O-NE2 2.97Å; N736-Q763 PolarHBondContact O-OE1 3.38Å; L737-Q763 VanDerWaalsContact CA-OE1 3.26Å; L737-Q763 HydrophobicContact CD2-CB 3.79Å; L737-Q763 HydrophobicContact CD2-CG 4.32Å; S760-Q763 WeakPolarHBondContact OG-CB 3.05Å; S760-Q763 PolarHBondContact OG-N 3.29Å; S760-Q763 PolarHBondContact OG-OE1 3.14Å; Q763-R798 PolarHBondContact O-NH1 2.91Å
764	T	96.3	Very high	96.6	Very high	50 Å²	50	22.7 Å²	22.7	31%	0.307	13%	0.128	S	C	.	.	S	Bend	trans	-71.8	-39.6	-179.8	52.6	0	0	0	0	112.3	L782 E784 R798	T764-L782 VanDerWaalsContact CB-O 3.31Å; T764-L782 WeakPolarHBondContact CB-O 3.35Å; T764-L782 WeakPolarHBondContact CG2-O 3.28Å; T764-L782 VanDerWaalsContact O-CB 3.27Å; T764-L782 WeakPolarHBondContact O-CB 3.35Å; T764-E784 HydrophobicContact CG2-CG 4.4Å; T764-R798 PolarHBondContact O-NH1 3.04Å; T764-R798 PolarHBondContact O-NH2 3.11Å; T764-R798 VanDerWaalsContact O-NH2 3.16Å
765	D	96.4	Very high	96.6	Very high	36 Å²	36	28.9 Å²	28.9	19%	0.193	16%	0.156	C	C	.	.			trans	-76.2	157.2	-165.7	-61.6	-8.1	0	0	0	113.2	L737 M778 I779	L737-D765 HydrophobicContact CD2-CB 4.32Å; D765-M778 HydrophobicContact CB-CE 3.44Å; D765-M778 VanDerWaalsContact CB-CE 3.44Å; D765-I779 WeakPolarHBondContact CA-O 3.12Å
766	V	97.7	Very high	96.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.4	173.5	171	0	0	0	0	109	Y757 G758 I779 L782 I800 T812 L821	Y757-V766 HydrophobicContact CD1-CG1 4.24Å; G758-V766 CarbonylContact O-C 3.57Å; G758-V766 WeakPolarHBondContact O-CA 3.36Å; V766-I779 HydrophobicContact CB-CB 4.25Å; V766-I779 PolarHBondContact N-O 3.25Å; V766-I779 PolarHBondContact O-N 2.84Å; V766-L782 HydrophobicContact CG2-CD2 3.71Å; V766-I800 HydrophobicContact CG1-CD1 4.22Å; V766-T812 HydrophobicContact CG2-CG2 4.24Å; V766-L821 HydrophobicContact CB-CD1 4.37Å; V766-L821 HydrophobicContact CG1-CD1 3.97Å; V766-L821 HydrophobicContact CG2-CD1 4.33Å
767	L	97.7	Very high	96.5	Very high	2 Å²	2	36 Å²	36	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	132.1	173.8	-174.1	65.2	0	0	0	109.3	V716 L737 I739 Y757 G758 V769 V776 M778	V716-L767 HydrophobicContact CG2-CD2 4.48Å; L737-L767 HydrophobicContact CD1-CB 3.75Å; I739-L767 HydrophobicContact CD1-CB 4.13Å; I739-L767 HydrophobicContact CD1-CD2 4.06Å; Y757-L767 CarbonylContact C-O 3.6Å; Y757-L767 WeakPolarHBondContact CA-O 3.42Å; G758-L767 PolarHBondContact N-O 2.79Å; G758-L767 PolarHBondContact O-N 2.86Å; L767-V769 HydrophobicContact CD1-CG2 4.45Å; L767-V769 HydrophobicContact CD2-CG2 4.08Å; L767-V769 HydrophobicContact CG-CG2 3.95Å; L767-V776 HydrophobicContact CD1-CG1 3.43Å; L767-V776 VanDerWaalsContact CD1-CG1 3.43Å; L767-M778 HydrophobicContact CD1-SD 3.81Å
768	F	97.8	Very high	96.4	Very high	7 Å²	7	38.8 Å²	38.8	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.9	166.6	164.7	-93.6	0	0	0	109	N755 I756 Y757 E770 V776 K777 I779 N826	N755-F768 HydrophobicContact CB-CD2 4.49Å; N755-F768 HydrophobicContact CB-CE2 3.66Å; N755-F768 HydrophobicContact CB-CZ 4.25Å; I756-F768 WeakPolarHBondContact O-CA 3.18Å; Y757-F768 HydrophobicContact CD1-CB 4.34Å; Y757-F768 HydrophobicContact CD1-CD2 4.16Å; Y757-F768 HydrophobicContact CE1-CB 4.23Å; Y757-F768 AromaticContact CE1-CD2 3.54Å; Y757-F768 HydrophobicContact CE1-CD2 3.54Å; Y757-F768 HydrophobicContact CE1-CE2 4.37Å; Y757-F768 HydrophobicContact CE1-CG 4.3Å; Y757-F768 AromaticContact CE2-CD2 3.94Å; Y757-F768 HydrophobicContact CE2-CD2 3.94Å; Y757-F768 HydrophobicContact CE2-CE2 4.21Å; Y757-F768 AromaticContact CZ-CD2 3.4Å; Y757-F768 AromaticContact CZ-CE2 3.8Å; Y757-F768 WeakPolarHBondContact OH-CD2 3.49Å; Y757-F768 WeakPolarHBondContact OH-CE2 3.5Å; F768-E770 HydrophobicContact CE1-CB 4.29Å; F768-E770 HydrophobicContact CZ-CB 4.26Å; F768-V776 CarbonylContact O-C 3.58Å; F768-V776 WeakPolarHBondContact O-CA 3.43Å; F768-K777 HydrophobicContact CB-CB 4.24Å; F768-K777 HydrophobicContact CD1-CB 3.76Å; F768-K777 HydrophobicContact CG-CB 4.44Å; F768-K777 PolarHBondContact N-O 3.36Å; F768-K777 PolarHBondContact O-N 3.12Å; F768-I779 HydrophobicContact CB-CD1 4.41Å; F768-N826 WeakPolarHBondContact CD2-OD1 3.44Å; F768-N826 WeakPolarHBondContact CE2-OD1 3.33Å; F768-N826 WeakPolarHBondContact CZ-OD1 3.41Å
769	V	97.6	Very high	96.4	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.6	174.5	-172.3	0	0	0	0	110	F731 I733 N755 I756 L767 L771 K775 V776	F731-V769 HydrophobicContact CE2-CG1 4.18Å; F731-V769 HydrophobicContact CZ-CG1 4.37Å; I733-V769 HydrophobicContact CD1-CB 4.07Å; I733-V769 HydrophobicContact CD1-CG1 3.38Å; I733-V769 HydrophobicContact CD1-CG2 3.49Å; I733-V769 VanDerWaalsContact CD1-CG2 3.49Å; N755-V769 CarbonylContact C-O 3.57Å; N755-V769 VanDerWaalsContact CA-O 3.31Å; N755-V769 WeakPolarHBondContact CA-O 3.49Å; I756-V769 HydrophobicContact CD1-CB 3.94Å; I756-V769 HydrophobicContact CD1-CG2 3.93Å; I756-V769 HydrophobicContact CG1-CB 3.56Å; I756-V769 HydrophobicContact CG1-CG2 3.93Å; I756-V769 PolarHBondContact N-O 2.58Å; I756-V769 PolarHBondContact O-N 3.16Å; L767-V769 HydrophobicContact CD1-CG2 4.45Å; L767-V769 HydrophobicContact CD2-CG2 4.08Å; L767-V769 HydrophobicContact CG-CG2 3.95Å; V769-L771 HydrophobicContact CG1-CD2 4.37Å; V769-K775 WeakPolarHBondContact CA-O 3.46Å; V769-V776 HydrophobicContact CG1-CG2 4.41Å; V769-V776 HydrophobicContact CG2-CG2 4.29Å
770	E	96.6	Very high	96.3	Very high	32 Å²	32	45.3 Å²	45.3	15%	0.15	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	110.6	166.8	-177.2	173	-105.5	0	0	108.9	N755 F768 S772 T773 G774 K775	N755-E770 VanDerWaalsContact OD1-CA 3.31Å; N755-E770 WeakPolarHBondContact OD1-CA 3.2Å; F768-E770 HydrophobicContact CE1-CB 4.29Å; F768-E770 HydrophobicContact CZ-CB 4.26Å; E770-S772 VanDerWaalsContact C-N 3.31Å; E770-S772 PolarHBondContact O-N 2.8Å; E770-T773 HydrophobicContact CG-CG2 4.34Å; E770-T773 PolarHBondContact O-N 3.23Å; E770-T773 VanDerWaalsContact OE2-CG2 3.29Å; E770-T773 WeakPolarHBondContact OE2-CG2 3.28Å; E770-T773 PolarHBondContact OE2-OG1 2.96Å; E770-G774 VanDerWaalsContact O-CA 3.32Å; E770-G774 WeakPolarHBondContact O-CA 3.26Å; E770-G774 PolarHBondContact O-N 2.91Å; E770-K775 HydrophobicContact CB-CB 4.23Å; E770-K775 PolarHBondContact N-O 3.23Å; E770-K775 PolarHBondContact O-N 3.02Å
771	L	97.1	Very high	96.2	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-24.8	-169.5	-61.7	176.4	0	0	0	113.3	Y705 V707 V718 F731 F744 Y754 I756 V769	Y705-L771 HydrophobicContact CD1-CB 3.86Å; Y705-L771 HydrophobicContact CD1-CD1 4Å; Y705-L771 HydrophobicContact CD1-CG 4.44Å; Y705-L771 HydrophobicContact CD2-CB 4.36Å; Y705-L771 HydrophobicContact CD2-CD1 3.85Å; Y705-L771 HydrophobicContact CE1-CB 3.66Å; Y705-L771 HydrophobicContact CE2-CB 4.2Å; Y705-L771 HydrophobicContact CE2-CD1 4.44Å; Y705-L771 HydrophobicContact CG-CB 4.2Å; Y705-L771 HydrophobicContact CG-CD1 3.6Å; Y705-L771 HydrophobicContact CG-CG 4.49Å; V707-L771 HydrophobicContact CG2-CD1 4.45Å; V707-L771 HydrophobicContact CG2-CD2 4.04Å; V718-L771 HydrophobicContact CG1-CD2 4.14Å; V718-L771 HydrophobicContact CG2-CD2 4.22Å; F731-L771 WeakPolarHBondContact CE1-O 3.29Å; F744-L771 HydrophobicContact CD1-CD1 4.21Å; F744-L771 HydrophobicContact CE1-CD1 3.93Å; Y754-L771 WeakPolarHBondContact O-CB 3.22Å; Y754-L771 WeakPolarHBondContact O-CG 3.4Å; Y754-L771 PolarHBondContact O-N 3.15Å; I756-L771 HydrophobicContact CD1-CD2 4.06Å; I756-L771 HydrophobicContact CG1-CD2 4.01Å; I756-L771 HydrophobicContact CG2-CD1 3.99Å; I756-L771 HydrophobicContact CG2-CD2 4.21Å; I756-L771 HydrophobicContact CG2-CG 4.3Å; V769-L771 HydrophobicContact CG1-CD2 4.37Å
772	S	94.4	Very high	96.2	Very high	42 Å²	42	49.4 Å²	49.4	29%	0.294	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-32.6	178.7	64.5	0	0	0	0	112.7	E750 E770	E750-S772 VanDerWaalsContact OE2-CB 3.23Å; E750-S772 WeakPolarHBondContact OE2-CB 3.35Å; E750-S772 PolarHBondContact OE2-OG 2.88Å; E770-S772 VanDerWaalsContact C-N 3.31Å; E770-S772 PolarHBondContact O-N 2.8Å
773	T	94.6	Very high	96.3	Very high	80 Å²	80	47 Å²	47	49%	0.491	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-16.1	-175.5	69.8	0	0	0	0	114.1	E770 K775	E770-T773 HydrophobicContact CG-CG2 4.34Å; E770-T773 PolarHBondContact O-N 3.23Å; E770-T773 VanDerWaalsContact OE2-CG2 3.29Å; E770-T773 WeakPolarHBondContact OE2-CG2 3.28Å; E770-T773 PolarHBondContact OE2-OG1 2.96Å; T773-K775 PolarHBondContact O-N 3.36Å; T773-K775 VanDerWaalsContact OG1-CB 3.24Å; T773-K775 WeakPolarHBondContact OG1-CB 2.97Å; T773-K775 PolarHBondContact OG1-N 2.89Å
774	G	95.3	Very high	96.3	Very high	19 Å²	19	51.4 Å²	51.4	20%	0.196	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	13	-170.7	0	0	0	0	0	114.1	E770 V776	E770-G774 VanDerWaalsContact O-CA 3.32Å; E770-G774 WeakPolarHBondContact O-CA 3.26Å; E770-G774 PolarHBondContact O-N 2.91Å; G774-V776 PolarHBondContact O-N 3.3Å
775	K	95.9	Very high	96.3	Very high	136 Å²	136	49.7 Å²	49.7	59%	0.591	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.9	-179.1	-177.4	179.9	178.6	-178	0	111.1	V769 E770 T773	V769-K775 WeakPolarHBondContact CA-O 3.46Å; E770-K775 HydrophobicContact CB-CB 4.23Å; E770-K775 PolarHBondContact N-O 3.23Å; E770-K775 PolarHBondContact O-N 3.02Å; T773-K775 PolarHBondContact O-N 3.36Å; T773-K775 VanDerWaalsContact OG1-CB 3.24Å; T773-K775 WeakPolarHBondContact OG1-CB 2.97Å; T773-K775 PolarHBondContact OG1-N 2.89Å
776	V	96.7	Very high	96.3	Very high	66 Å²	66	48.1 Å²	48.1	40%	0.4	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141.4	-178.2	-174.8	0	0	0	0	111.5	I733 L767 F768 V769 G774	I733-V776 HydrophobicContact CD1-CG2 3.56Å; I733-V776 HydrophobicContact CG1-CG2 3.84Å; I733-V776 HydrophobicContact CG2-CG2 4.04Å; L767-V776 HydrophobicContact CD1-CG1 3.43Å; L767-V776 VanDerWaalsContact CD1-CG1 3.43Å; F768-V776 CarbonylContact O-C 3.58Å; F768-V776 WeakPolarHBondContact O-CA 3.43Å; V769-V776 HydrophobicContact CG1-CG2 4.41Å; V769-V776 HydrophobicContact CG2-CG2 4.29Å; G774-V776 PolarHBondContact O-N 3.3Å
777	K	96.2	Very high	96.2	Very high	90 Å²	90	54 Å²	54	39%	0.391	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	150.7	171.1	-171.5	-176.3	177.7	-172.7	0	110.2	F768 N826	F768-K777 HydrophobicContact CB-CB 4.24Å; F768-K777 HydrophobicContact CD1-CB 3.76Å; F768-K777 HydrophobicContact CG-CB 4.44Å; F768-K777 PolarHBondContact N-O 3.36Å; F768-K777 PolarHBondContact O-N 3.12Å; K777-N826 HydrophobicContact CD-CB 4.3Å; K777-N826 WeakPolarHBondContact CE-O 3.36Å; K777-N826 PolarHBondContact NZ-O 3.22Å
778	M	96.5	Very high	95.9	Very high	58 Å²	58	57.4 Å²	57.4	29%	0.286	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.2	170.3	-60.7	-58.8	-63.5	0	0	109.9	L737 D765 L767	L737-M778 HydrophobicContact CD1-CE 3.18Å; L737-M778 HydrophobicContact CD1-SD 3.96Å; L737-M778 HydrophobicContact CD2-CE 3.87Å; L737-M778 HydrophobicContact CG-CE 3.66Å; D765-M778 HydrophobicContact CB-CE 3.44Å; D765-M778 VanDerWaalsContact CB-CE 3.44Å; L767-M778 HydrophobicContact CD1-SD 3.81Å
779	I	97	Very high	95.6	Very high	4 Å²	4	64 Å²	64	2%	0.021	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	119.2	170	-61.3	173.6	0	0	0	107.8	Y757 D765 V766 F768 L782 L821	Y757-I779 HydrophobicContact CD1-CD1 3.88Å; Y757-I779 HydrophobicContact CE1-CD1 3.58Å; D765-I779 WeakPolarHBondContact CA-O 3.12Å; V766-I779 HydrophobicContact CB-CB 4.25Å; V766-I779 PolarHBondContact N-O 3.25Å; V766-I779 PolarHBondContact O-N 2.84Å; F768-I779 HydrophobicContact CB-CD1 4.41Å; I779-L782 HydrophobicContact CG2-CD1 4.03Å; I779-L821 HydrophobicContact CD1-CD1 4.31Å; I779-L821 HydrophobicContact CG2-CD2 4.04Å
780	K	95.6	Very high	95.4	Very high	134 Å²	134	67.3 Å²	67.3	58%	0.583	35%	0.346	S	S	*	.			trans	-107	178.2	-172	-58.3	-171.9	175.8	-172.9	0	111.3	L782	K780-L782 WeakPolarHBondContact O-CD1 3.46Å
781	S	94.3	Very high	95.4	Very high	95 Å²	95	66.5 Å²	66.5	66%	0.664	34%	0.341	S	S	*	.			trans	72	27.3	176.1	-53.9	0	0	0	0	114.5	L828	S781-L828 WeakPolarHBondContact O-CD2 3.48Å
782	L	96.7	Very high	95.2	Very high	11 Å²	11	69.2 Å²	69.2	6%	0.058	36%	0.359	C	S	.	.			trans	-96.7	175	165.2	-68	76.2	0	0	0	109.7	T764 V766 I779 K780 T812 F819 L821	T764-L782 VanDerWaalsContact CB-O 3.31Å; T764-L782 WeakPolarHBondContact CB-O 3.35Å; T764-L782 WeakPolarHBondContact CG2-O 3.28Å; T764-L782 VanDerWaalsContact O-CB 3.27Å; T764-L782 WeakPolarHBondContact O-CB 3.35Å; V766-L782 HydrophobicContact CG2-CD2 3.71Å; I779-L782 HydrophobicContact CG2-CD1 4.03Å; K780-L782 WeakPolarHBondContact O-CD1 3.46Å; L782-T812 HydrophobicContact CD2-CG2 3.57Å; L782-F819 HydrophobicContact CB-CD1 4.13Å; L782-F819 HydrophobicContact CB-CD2 4.2Å; L782-F819 HydrophobicContact CB-CE1 4.2Å; L782-F819 HydrophobicContact CB-CE2 4.31Å; L782-F819 HydrophobicContact CB-CG 4.13Å; L782-F819 HydrophobicContact CB-CZ 4.31Å; L782-F819 HydrophobicContact CD2-CB 3.82Å; L782-F819 HydrophobicContact CD2-CD1 4.46Å; L782-F819 HydrophobicContact CD2-CD2 4.15Å; L782-F819 HydrophobicContact CD2-CG 3.86Å; L782-F819 HydrophobicContact CG-CB 3.98Å; L782-F819 HydrophobicContact CG-CD1 3.74Å; L782-F819 HydrophobicContact CG-CD2 4.12Å; L782-F819 HydrophobicContact CG-CE1 4.31Å; L782-F819 HydrophobicContact CG-CG 3.64Å; L782-L821 HydrophobicContact CD1-CD2 4.35Å; L782-L821 HydrophobicContact CD2-CD2 4.35Å
783	K	96.8	Very high	95.2	Very high	71 Å²	71	68.8 Å²	68.8	31%	0.309	35%	0.351	S	S	.	.			trans	-106	170.2	179.4	-71.8	176.7	-171.1	171.8	0	112.8	D816 S817 F819 E831	K783-D816 IonicContact NZ-OD1 3.03Å; K783-S817 PolarHBondContact NZ-OG 3.01Å; K783-F819 HydrophobicContact CB-CE2 4.05Å; K783-F819 HydrophobicContact CB-CZ 3.81Å; K783-F819 HydrophobicContact CD-CZ 4.03Å; K783-F819 HydrophobicContact CG-CE2 4.46Å; K783-F819 HydrophobicContact CG-CZ 3.74Å; K783-E831 WeakPolarHBondContact CE-OE1 3.5Å; K783-E831 IonicContact NZ-OE1 2.71Å; K783-E831 PolarHBondContact NZ-OE1 3.22Å
784	E	95.9	Very high	95.2	Very high	145 Å²	145	67 Å²	67	68%	0.678	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-60.2	134.9	179.2	-66.7	-179.1	176.2	0	0	111.7	T764 S814 K815	T764-E784 HydrophobicContact CG2-CG 4.4Å; E784-S814 VanDerWaalsContact O-CB 3.23Å; E784-S814 WeakPolarHBondContact O-CB 3.05Å; E784-K815 PolarHBondContact O-N 3.45Å
785	P	96.6	Very high	95	Very high	13 Å²	13	71.7 Å²	71.7	8%	0.084	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-62.6	165.6	174.5	22.9	-29.7	0	0	0	112.7	S761 R798	S761-P785 WeakPolarHBondContact O-CG 3.44Å; P785-R798 HydrophobicContact CB-CB 4.1Å; P785-R798 HydrophobicContact CB-CG 4.3Å
786	L	95.6	Very high	94.9	Very high	3 Å²	3	68.1 Å²	68.1	2%	0.016	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-60.2	139	165.1	-172.6	61.4	0	0	0	109.3	D790 W791 N797 K815 K837	L786-D790 HydrophobicContact CD1-CB 3.58Å; L786-D790 HydrophobicContact CD2-CB 4.26Å; L786-D790 HydrophobicContact CG-CB 3.77Å; L786-W791 HydrophobicContact CD2-CB 3.93Å; L786-W791 HydrophobicContact CD2-CE3 4.12Å; L786-N797 PolarHBondContact O-ND2 2.88Å; L786-K815 HydrophobicContact CD1-CG 4.18Å; L786-K837 HydrophobicContact CD1-CG 4.31Å; L786-K837 HydrophobicContact CD2-CB 4.38Å; L786-K837 HydrophobicContact CD2-CD 4.48Å; L786-K837 HydrophobicContact CD2-CG 4.13Å
787	K	94.9	Very high	94.8	Very high	124 Å²	124	65 Å²	65	54%	0.539	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-63.1	147.1	176.8	-64.7	-177.5	175.3	-174	0	110.1	E789 D790 W791	K787-E789 PolarHBondContact O-N 2.73Å; K787-D790 HydrophobicContact CB-CB 4.48Å; K787-D790 WeakPolarHBondContact O-CB 3.48Å; K787-D790 PolarHBondContact O-N 3.32Å; K787-W791 PolarHBondContact O-N 3.01Å
788	T	91.4	Very high	94.8	Very high	73 Å²	73	60.8 Å²	60.8	45%	0.448	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-58.2	-37.1	179.3	-51.2	0	0	0	0	111.7	D790 W791	T788-D790 PolarHBondContact O-N 2.71Å; T788-W791 CarbonylContact O-C 3.44Å; T788-W791 PolarHBondContact O-N 2.81Å; T788-W791 VanDerWaalsContact O-N 3.16Å
789	E	92.5	Very high	94.8	Very high	147 Å²	147	60.5 Å²	60.5	69%	0.687	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-63.4	-29.3	176.4	-46.8	92	-120.6	0	0	113.5	K787 W791	K787-E789 PolarHBondContact O-N 2.73Å; E789-W791 VanDerWaalsContact C-N 3.28Å
790	D	93.7	Very high	94.8	Very high	68 Å²	68	60.6 Å²	60.6	36%	0.364	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-83.9	-5.2	-179.8	-65.5	-37.8	0	0	0	112.3	L786 K787 T788	L786-D790 HydrophobicContact CD1-CB 3.58Å; L786-D790 HydrophobicContact CD2-CB 4.26Å; L786-D790 HydrophobicContact CG-CB 3.77Å; K787-D790 HydrophobicContact CB-CB 4.48Å; K787-D790 WeakPolarHBondContact O-CB 3.48Å; K787-D790 PolarHBondContact O-N 3.32Å; T788-D790 PolarHBondContact O-N 2.71Å
791	W	94.9	Very high	94.9	Very high	16 Å²	16	56.8 Å²	56.8	6%	0.061	30%	0.298	C	S	.	.			trans	-129.6	75	179.3	-169.5	-109.4	0	0	0	111.7	W503 L786 K787 T788 E789 W793 K796 N797 N839 T840	W503-W791 WeakPolarHBondContact O-CH2 3.36Å; L786-W791 HydrophobicContact CD2-CB 3.93Å; L786-W791 HydrophobicContact CD2-CE3 4.12Å; K787-W791 PolarHBondContact O-N 3.01Å; T788-W791 CarbonylContact O-C 3.44Å; T788-W791 PolarHBondContact O-N 2.81Å; T788-W791 VanDerWaalsContact O-N 3.16Å; E789-W791 VanDerWaalsContact C-N 3.28Å; W791-W793 VanDerWaalsContact C-N 3.29Å; W791-W793 AromaticContact CD2-CD1 3.97Å; W791-W793 AromaticContact CE3-CD1 3.72Å; W791-W793 AromaticContact CH2-CD1 3.58Å; W791-W793 HydrophobicContact CZ2-CB 4.49Å; W791-W793 AromaticContact CZ2-CD1 3.84Å; W791-W793 AromaticContact CZ3-CD1 3.52Å; W791-W793 AromaticContact CZ3-NE1 3.93Å; W791-W793 PolarHBondContact O-N 3.34Å; W791-K796 PolarHBondContact NE1-O 3.06Å; W791-N797 HydrophobicContact CB-CB 4.32Å; W791-N839 HydrophobicContact CD2-CB 3.93Å; W791-N839 HydrophobicContact CE3-CB 3.85Å; W791-N839 HydrophobicContact CH2-CB 3.59Å; W791-N839 HydrophobicContact CZ2-CB 3.66Å; W791-N839 HydrophobicContact CZ3-CB 3.68Å; W791-T840 WeakPolarHBondContact CH2-OG1 3.48Å
792	P	94.3	Very high	94.9	Very high	58 Å²	58	53 Å²	53	38%	0.377	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-21.2	-172.8	27.8	-34.4	0	0	0	113.7	W561 M564 S794	W561-P792 WeakPolarHBondContact CH2-O 3.42Å; M564-P792 HydrophobicContact CE-CB 4.24Å; M564-P792 HydrophobicContact CE-CG 4.2Å; P792-S794 PolarHBondContact O-N 3Å
793	W	94.7	Very high	94.8	Very high	33 Å²	33	52.8 Å²	52.8	13%	0.125	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-26.8	-166	-42.5	123.1	0	0	0	115.1	V502 W503 A504 P519 V543 V545 W561 M564 W791	V502-W793 HydrophobicContact CG1-CZ2 3.64Å; W503-W793 PolarHBondContact O-NE1 2.79Å; A504-W793 HydrophobicContact CB-CB 4.06Å; A504-W793 HydrophobicContact CB-CD2 4.13Å; A504-W793 HydrophobicContact CB-CG 3.82Å; P519-W793 HydrophobicContact CB-CE3 4.29Å; P519-W793 HydrophobicContact CB-CH2 3.84Å; P519-W793 HydrophobicContact CB-CZ2 4.3Å; P519-W793 HydrophobicContact CB-CZ3 3.82Å; P519-W793 HydrophobicContact CG-CD2 4.23Å; P519-W793 HydrophobicContact CG-CE3 4.26Å; P519-W793 HydrophobicContact CG-CH2 3.6Å; P519-W793 HydrophobicContact CG-CZ2 3.55Å; P519-W793 HydrophobicContact CG-CZ3 3.96Å; V543-W793 HydrophobicContact CG1-CZ3 4.1Å; V545-W793 HydrophobicContact CG1-CE3 3.78Å; V545-W793 HydrophobicContact CG1-CZ3 4.34Å; W561-W793 HydrophobicContact CZ3-CE3 4.37Å; M564-W793 HydrophobicContact CE-CH2 4.09Å; M564-W793 HydrophobicContact CE-CZ3 3.89Å; M564-W793 HydrophobicContact SD-CH2 3.92Å; M564-W793 HydrophobicContact SD-CZ3 3.66Å; W791-W793 VanDerWaalsContact C-N 3.29Å; W791-W793 AromaticContact CD2-CD1 3.97Å; W791-W793 AromaticContact CE3-CD1 3.72Å; W791-W793 AromaticContact CH2-CD1 3.58Å; W791-W793 HydrophobicContact CZ2-CB 4.49Å; W791-W793 AromaticContact CZ2-CD1 3.84Å; W791-W793 AromaticContact CZ3-CD1 3.52Å; W791-W793 AromaticContact CZ3-NE1 3.93Å; W791-W793 PolarHBondContact O-N 3.34Å
794	S	93.2	Very high	94.5	Very high	42 Å²	42	51.1 Å²	51.1	29%	0.294	28%	0.277	S	S	.	.			trans	-149.1	146.5	-175.4	171.5	0	0	0	0	110	P792 K796	P792-S794 PolarHBondContact O-N 3Å; S794-K796 PolarHBondContact O-N 3.11Å; S794-K796 VanDerWaalsContact O-N 3.14Å; S794-K796 PolarHBondContact OG-N 3.39Å; S794-K796 VanDerWaalsContact OG-N 3.1Å
795	P	90.9	Very high	94.2	Very high	118 Å²	118	45.7 Å²	45.7	77%	0.766	25%	0.253	S	S	*	.	S	Bend	trans	-61.3	-19.6	170.8	27.1	-35.3	0	0	0	112.6	N797	P795-N797 PolarHBondContact O-N 2.87Å
796	K	94	Very high	93.8	Very high	62 Å²	62	45.9 Å²	45.9	27%	0.27	25%	0.252	S	S	.	.			trans	-86.3	88.3	178.8	-51.6	-174.3	171.1	-172.5	0	110.1	Y698 S740 D741 W791 S794 R798	Y698-K796 WeakPolarHBondContact OH-CE 3.16Å; Y698-K796 PolarHBondContact OH-NZ 2.93Å; S740-K796 WeakPolarHBondContact O-CG 3.5Å; S740-K796 WeakPolarHBondContact OG-CA 3.28Å; D741-K796 HydrophobicContact CB-CD 4.01Å; D741-K796 WeakPolarHBondContact OD1-CD 3.25Å; D741-K796 WeakPolarHBondContact OD1-CE 2.98Å; D741-K796 IonicContact OD1-NZ 3.52Å; D741-K796 PolarHBondContact OD1-NZ 3.16Å; W791-K796 PolarHBondContact NE1-O 3.06Å; S794-K796 PolarHBondContact O-N 3.11Å; S794-K796 VanDerWaalsContact O-N 3.14Å; S794-K796 PolarHBondContact OG-N 3.39Å; S794-K796 VanDerWaalsContact OG-N 3.1Å; K796-R798 PolarHBondContact O-N 2.76Å
797	N	95.3	Very high	93.5	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.254	C	S	.	.	S	Bend	trans	-76.3	-3.9	175.6	71	-28.7	0	0	0	114.1	S740 S761 L786 W791 P795 N839	S740-N797 PolarHBondContact OG-N 2.96Å; S740-N797 PolarHBondContact OG-OD1 3.12Å; S761-N797 WeakPolarHBondContact CA-OD1 3.38Å; S761-N797 WeakPolarHBondContact CB-OD1 3.39Å; S761-N797 PolarHBondContact O-ND2 2.8Å; L786-N797 PolarHBondContact O-ND2 2.88Å; W791-N797 HydrophobicContact CB-CB 4.32Å; P795-N797 PolarHBondContact O-N 2.87Å; N797-N839 PolarHBondContact O-ND2 3.23Å
798	R	96.8	Very high	93.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-142.3	88.2	174.4	-164.6	-177.8	-166.7	-177.7	-3.2	110.5	S740 S759 S760 Q763 T764 P785 K796 P813	S740-R798 PolarHBondContact OG-N 2.94Å; S740-R798 VanDerWaalsContact OG-N 3.15Å; S759-R798 WeakPolarHBondContact CB-O 3.4Å; S759-R798 PolarHBondContact OG-O 2.03Å; S760-R798 WeakPolarHBondContact O-CD 3.4Å; Q763-R798 PolarHBondContact O-NH1 2.91Å; T764-R798 PolarHBondContact O-NH1 3.04Å; T764-R798 PolarHBondContact O-NH2 3.11Å; T764-R798 VanDerWaalsContact O-NH2 3.16Å; P785-R798 HydrophobicContact CB-CB 4.1Å; P785-R798 HydrophobicContact CB-CG 4.3Å; K796-R798 PolarHBondContact O-N 2.76Å; R798-P813 WeakPolarHBondContact CG-O 3.4Å; R798-P813 PolarHBondContact NE-O 3.48Å
799	H	95.7	Very high	93.6	Very high	53 Å²	53	40 Å²	40	25%	0.245	22%	0.222	C	C	.	.			trans	-65.3	149.9	177.2	-169.4	60.8	0	0	0	111.8	D741 Q801 T812 P813	D741-H799 IonicContact OD2-CE1 3.02Å; D741-H799 PolarHBondContact OD2-CE1 2.9Å; D741-H799 IonicContact OD2-CG 3.75Å; D741-H799 IonicContact OD2-ND1 3.96Å; D741-H799 PolarHBondContact OD2-ND1 3.21Å; H799-Q801 PolarHBondContact NE2-OE1 2.9Å; H799-T812 PolarHBondContact O-OG1 3.25Å; H799-P813 WeakPolarHBondContact O-CD 3.41Å
800	I	97.3	Very high	93.9	Very high	5 Å²	5	33 Å²	33	3%	0.026	19%	0.19	C	C	.	.			trans	-127.2	115.7	168.1	-174.1	160.7	0	0	0	110.3	D741 A743 Y757 V766 L810 M811 L821	D741-I800 HydrophobicContact CB-CG2 4.11Å; D741-I800 PolarHBondContact OD2-N 2.72Å; A743-I800 HydrophobicContact CB-CB 4.49Å; A743-I800 HydrophobicContact CB-CG1 4.19Å; A743-I800 HydrophobicContact CB-CG2 3.79Å; Y757-I800 VanDerWaalsContact CB-CD1 3.48Å; Y757-I800 HydrophobicContact CG-CD1 4.46Å; V766-I800 HydrophobicContact CG1-CD1 4.22Å; I800-L810 HydrophobicContact CD1-CD2 4.21Å; I800-L810 HydrophobicContact CG1-CB 4.31Å; I800-L810 HydrophobicContact CG1-CD2 4.18Å; I800-M811 WeakPolarHBondContact CA-O 3.31Å; I800-L821 HydrophobicContact CD1-CD1 4.33Å
801	Q	96.9	Very high	94.1	Very high	54 Å²	54	29.8 Å²	29.8	25%	0.252	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	118.6	-175.1	-173.7	56	53.4	0	0	110.7	F454 H799 L810 M811 V841 W843	F454-Q801 HydrophobicContact CD1-CG 4.39Å; F454-Q801 HydrophobicContact CE1-CB 4.22Å; F454-Q801 HydrophobicContact CE1-CG 3.96Å; H799-Q801 PolarHBondContact NE2-OE1 2.9Å; Q801-L810 CarbonylContact O-C 3.46Å; Q801-L810 VanDerWaalsContact O-CA 3.27Å; Q801-L810 WeakPolarHBondContact O-CA 3.5Å; Q801-M811 PolarHBondContact N-O 3.27Å; Q801-M811 PolarHBondContact O-N 3.21Å; Q801-V841 HydrophobicContact CB-CB 4.34Å; Q801-V841 HydrophobicContact CB-CG1 3.97Å; Q801-V841 HydrophobicContact CG-CG1 4.2Å; Q801-W843 HydrophobicContact CG-CB 4.33Å
802	G	95.6	Very high	94.2	Very high	17 Å²	17	29 Å²	29	18%	0.175	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	158.3	170.3	0	0	0	0	0	112.7	G804 W843	G802-G804 VanDerWaalsContact C-N 3.31Å; G802-G804 PolarHBondContact O-N 2.99Å; G802-W843 WeakPolarHBondContact O-CB 3.45Å
803	S	93.8	Very high	94.4	Very high	5 Å²	5	26.4 Å²	26.4	4%	0.035	15%	0.152	C	C	.	.			trans	-90.3	38.4	179.3	47.2	0	0	0	0	114.5	G807 Q808 Y809 W843	S803-G807 WeakPolarHBondContact O-CA 3.41Å; S803-G807 PolarHBondContact O-N 3.25Å; S803-G807 WeakPolarHBondContact OG-CA 3.22Å; S803-Q808 PolarHBondContact OG-N 3.12Å; S803-Y809 VanDerWaalsContact CB-O 3.3Å; S803-Y809 WeakPolarHBondContact CB-O 3.4Å; S803-Y809 PolarHBondContact N-O 3.31Å; S803-Y809 PolarHBondContact OG-N 3.34Å; S803-Y809 PolarHBondContact OG-O 2.88Å; S803-W843 VanDerWaalsContact C-CD1 3.48Å; S803-W843 VanDerWaalsContact C-NE1 3.31Å; S803-W843 VanDerWaalsContact CA-CD2 3.45Å; S803-W843 VanDerWaalsContact O-CE2 3.28Å; S803-W843 PolarHBondContact O-NE1 3.09Å; S803-W843 VanDerWaalsContact O-NE1 3.1Å
804	G	90.2	Very high	94.5	Very high	36 Å²	36	24.8 Å²	24.8	37%	0.371	15%	0.146	S	C	.	.			trans	75.2	-167.4	179.1	0	0	0	0	0	114.4	G802 G807	G802-G804 VanDerWaalsContact C-N 3.31Å; G802-G804 PolarHBondContact O-N 2.99Å; G804-G807 PolarHBondContact O-N 3.47Å; G804-G807 VanDerWaalsContact O-N 3.11Å
805	L	89.7	Confident	94.6	Very high	32 Å²	32	28.2 Å²	28.2	17%	0.168	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-48.6	-170.2	-174.6	65.3	0	0	0	113	R344 H363 L608 P746 G807 A847	R344-L805 HydrophobicContact CB-CD2 4.37Å; H363-L805 HydrophobicContact CB-CD2 3.96Å; H363-L805 HydrophobicContact CB-CG 4.21Å; L608-L805 HydrophobicContact CD1-CD2 3.83Å; L608-L805 HydrophobicContact CD2-CD2 4.42Å; P746-L805 HydrophobicContact CG-CD1 4.3Å; P746-L805 WeakPolarHBondContact CG-O 3.27Å; L805-G807 VanDerWaalsContact C-N 3.26Å; L805-A847 WeakPolarHBondContact CB-OXT 3.3Å; L805-A847 WeakPolarHBondContact CD2-OXT 3.47Å
806	F	89.7	Confident	94.8	Very high	17 Å²	17	25.8 Å²	25.8	8%	0.075	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	11.9	175.1	-61.3	-74.3	0	0	0	112.8	R344 Y346 R361 H363 Q808 A847	R344-F806 HydrophobicContact CB-CE2 3.67Å; R344-F806 HydrophobicContact CB-CZ 3.77Å; R344-F806 VanDerWaalsContact O-CZ 3.3Å; R344-F806 WeakPolarHBondContact O-CZ 3.2Å; Y346-F806 VanDerWaalsContact CB-CD2 3.41Å; Y346-F806 HydrophobicContact CD1-CB 3.98Å; Y346-F806 HydrophobicContact CD1-CG 4.45Å; Y346-F806 HydrophobicContact CG-CB 3.83Å; Y346-F806 HydrophobicContact CG-CD2 4.15Å; Y346-F806 AromaticContact CG-CG 3.97Å; Y346-F806 HydrophobicContact CG-CG 3.97Å; R361-F806 HydrophobicContact CB-CD1 3.91Å; R361-F806 HydrophobicContact CB-CE1 4.09Å; R361-F806 PolarHBondContact NH1-O 2.81Å; R361-F806 PolarHBondContact NH2-O 3.47Å; H363-F806 HydrophobicContact CB-CE1 3.68Å; H363-F806 HydrophobicContact CB-CZ 3.62Å; F806-Q808 PolarHBondContact O-N 2.92Å; F806-A847 WeakPolarHBondContact CD2-OXT 3.49Å; F806-A847 WeakPolarHBondContact CE2-OXT 3.38Å
807	G	89	Confident	94.9	Very high	6 Å²	6	22.9 Å²	22.9	6%	0.062	12%	0.124	C	C	.	.			trans	-67.9	121.9	-177.3	0	0	0	0	0	114	Q745 S803 G804 L805	Q745-G807 PolarHBondContact NE2-O 3.35Å; S803-G807 WeakPolarHBondContact O-CA 3.41Å; S803-G807 PolarHBondContact O-N 3.25Å; S803-G807 WeakPolarHBondContact OG-CA 3.22Å; G804-G807 PolarHBondContact O-N 3.47Å; G804-G807 VanDerWaalsContact O-N 3.11Å; L805-G807 VanDerWaalsContact C-N 3.26Å
808	Q	92.3	Very high	95	Very high	44 Å²	44	22.8 Å²	22.8	21%	0.206	12%	0.123	C	C	.	.			trans	-81.6	-29.7	171.4	-179	173.1	-17	0	0	112.8	Q745 F748 S803 F806 D822 G823 R824	Q745-Q808 PolarHBondContact NE2-O 3.37Å; F748-Q808 HydrophobicContact CZ-CB 4.29Å; F748-Q808 HydrophobicContact CZ-CG 4.41Å; S803-Q808 PolarHBondContact OG-N 3.12Å; F806-Q808 PolarHBondContact O-N 2.92Å; Q808-D822 PolarHBondContact NE2-OD1 3.1Å; Q808-D822 PolarHBondContact NE2-OD2 2.93Å; Q808-D822 VanDerWaalsContact NE2-OD2 3.07Å; Q808-G823 WeakPolarHBondContact O-CA 3.36Å; Q808-G823 PolarHBondContact O-N 3.49Å; Q808-R824 HydrophobicContact CG-CB 3.98Å
809	Y	96.3	Very high	95	Very high	27 Å²	27	22.8 Å²	22.8	11%	0.106	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	147.4	-166.4	-59.6	-74.8	0	0	0	112.1	P467 S803 I820 L821 D822	P467-Y809 HydrophobicContact CB-CD1 4.43Å; P467-Y809 HydrophobicContact CB-CD2 3.62Å; P467-Y809 HydrophobicContact CB-CE2 4.26Å; P467-Y809 HydrophobicContact CB-CG 3.71Å; P467-Y809 HydrophobicContact CG-CD2 3.72Å; P467-Y809 HydrophobicContact CG-CE2 4.31Å; P467-Y809 HydrophobicContact CG-CG 4.28Å; S803-Y809 VanDerWaalsContact CB-O 3.3Å; S803-Y809 WeakPolarHBondContact CB-O 3.4Å; S803-Y809 PolarHBondContact N-O 3.31Å; S803-Y809 PolarHBondContact OG-N 3.34Å; S803-Y809 PolarHBondContact OG-O 2.88Å; Y809-I820 HydrophobicContact CD1-CG2 3.7Å; Y809-I820 HydrophobicContact CG-CG2 4.1Å; Y809-L821 VanDerWaalsContact CA-O 3.26Å; Y809-L821 WeakPolarHBondContact CA-O 3.09Å; Y809-D822 HydrophobicContact CE1-CB 4.46Å
810	L	97.7	Very high	95.1	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	147.2	166.6	-54.5	95	0	0	0	108.8	A743 Y757 I800 Q801 I820 L821	A743-L810 HydrophobicContact CB-CD2 3.94Å; Y757-L810 HydrophobicContact CD1-CD1 4.44Å; Y757-L810 HydrophobicContact CD2-CD1 3.93Å; Y757-L810 HydrophobicContact CD2-CD2 3.56Å; Y757-L810 HydrophobicContact CD2-CG 4.43Å; Y757-L810 HydrophobicContact CE1-CD1 4.28Å; Y757-L810 HydrophobicContact CE2-CD1 3.77Å; Y757-L810 HydrophobicContact CE2-CD2 4.21Å; Y757-L810 HydrophobicContact CG-CD1 4.28Å; Y757-L810 HydrophobicContact CG-CD2 3.85Å; I800-L810 HydrophobicContact CD1-CD2 4.21Å; I800-L810 HydrophobicContact CG1-CB 4.31Å; I800-L810 HydrophobicContact CG1-CD2 4.18Å; Q801-L810 CarbonylContact O-C 3.46Å; Q801-L810 VanDerWaalsContact O-CA 3.27Å; Q801-L810 WeakPolarHBondContact O-CA 3.5Å; L810-I820 CarbonylContact O-C 3.51Å; L810-I820 WeakPolarHBondContact O-CA 3.49Å; L810-L821 HydrophobicContact CB-CB 4.34Å; L810-L821 HydrophobicContact CD1-CB 4.48Å; L810-L821 PolarHBondContact N-O 3.39Å; L810-L821 PolarHBondContact O-N 3.06Å
811	M	97.8	Very high	95.2	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	134.5	175.2	-174.7	170.1	-73.3	0	0	110.3	F454 V456 I465 I800 Q801 L818 F819 I820 V841	F454-M811 HydrophobicContact CB-CE 3.51Å; F454-M811 HydrophobicContact CB-SD 3.88Å; F454-M811 HydrophobicContact CD1-CB 3.85Å; F454-M811 HydrophobicContact CD1-CE 4.27Å; F454-M811 HydrophobicContact CD1-SD 4.15Å; F454-M811 HydrophobicContact CD2-CB 4.42Å; F454-M811 HydrophobicContact CD2-CE 3.63Å; F454-M811 HydrophobicContact CE1-CB 3.67Å; F454-M811 HydrophobicContact CE2-CB 4.26Å; F454-M811 HydrophobicContact CE2-CE 4.4Å; F454-M811 HydrophobicContact CG-CB 4.22Å; F454-M811 HydrophobicContact CG-CE 3.54Å; F454-M811 HydrophobicContact CG-SD 3.95Å; F454-M811 HydrophobicContact CZ-CB 3.89Å; V456-M811 HydrophobicContact CG2-CE 4.4Å; V456-M811 HydrophobicContact CG2-SD 3.48Å; V456-M811 WeakPolarHBondContact CG2-SD 3.25Å; I465-M811 HydrophobicContact CB-CE 4.37Å; I465-M811 HydrophobicContact CD1-CE 4.1Å; I465-M811 HydrophobicContact CG2-CE 4.15Å; I800-M811 WeakPolarHBondContact CA-O 3.31Å; Q801-M811 PolarHBondContact N-O 3.27Å; Q801-M811 PolarHBondContact O-N 3.21Å; M811-L818 HydrophobicContact SD-CD1 4.13Å; M811-F819 WeakPolarHBondContact CA-O 3.38Å; M811-I820 HydrophobicContact CE-CD1 3.89Å; M811-I820 HydrophobicContact CE-CG1 3.63Å; M811-V841 HydrophobicContact CB-CG1 4.3Å; M811-V841 HydrophobicContact CG-CG1 4.23Å; M811-V841 HydrophobicContact SD-CG1 3.73Å; M811-V841 HydrophobicContact SD-CG2 4.38Å
812	T	97.9	Very high	95.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	136.8	172.1	-171	0	0	0	0	110.5	V766 L782 H799 F819	V766-T812 HydrophobicContact CG2-CG2 4.24Å; L782-T812 HydrophobicContact CD2-CG2 3.57Å; H799-T812 PolarHBondContact O-OG1 3.25Å; T812-F819 HydrophobicContact CG2-CB 4.23Å; T812-F819 PolarHBondContact N-O 3.3Å; T812-F819 PolarHBondContact O-N 2.98Å
813	P	97.3	Very high	95.1	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.013	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	164.1	-177.1	35	-33.4	0	0	0	112.5	R798 H799 L818 G838	R798-P813 WeakPolarHBondContact CG-O 3.4Å; R798-P813 PolarHBondContact NE-O 3.48Å; H799-P813 WeakPolarHBondContact O-CD 3.41Å; P813-L818 HydrophobicContact CB-CD2 3.8Å; P813-G838 WeakPolarHBondContact CB-O 3.4Å
814	S	96.7	Very high	95	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.			trans	-116.7	-171.2	155.9	67.7	0	0	0	0	109.3	E784 D816 S817	E784-S814 VanDerWaalsContact O-CB 3.23Å; E784-S814 WeakPolarHBondContact O-CB 3.05Å; S814-D816 PolarHBondContact O-N 3.26Å; S814-D816 PolarHBondContact OG-N 2.95Å; S814-D816 PolarHBondContact OG-OD1 3.45Å; S814-S817 PolarHBondContact N-O 3.27Å; S814-S817 WeakPolarHBondContact OG-CA 3.4Å; S814-S817 WeakPolarHBondContact OG-CB 3.08Å; S814-S817 PolarHBondContact OG-N 3Å; S814-S817 PolarHBondContact OG-O 2.88Å; S814-S817 VanDerWaalsContact OG-O 3.1Å
815	K	95.5	Very high	95.2	Very high	114 Å²	114	23.2 Å²	23.2	50%	0.496	11%	0.11	S	C	.	.	S	Bend	trans	-55	-36.6	173.7	-177.9	178.1	177.4	179.6	0	114.1	E784 L786 K837	E784-K815 PolarHBondContact O-N 3.45Å; L786-K815 HydrophobicContact CD1-CG 4.18Å; K815-K837 PolarHBondContact O-N 2.71Å
816	D	95.4	Very high	95.5	Very high	66 Å²	66	23.4 Å²	23.4	35%	0.353	11%	0.111	S	C	.	.	S	Bend	trans	-136.8	0.4	-167.1	66.3	-3.1	0	0	0	115.2	K783 S814 E834 V835	K783-D816 IonicContact NZ-OD1 3.03Å; S814-D816 PolarHBondContact O-N 3.26Å; S814-D816 PolarHBondContact OG-N 2.95Å; S814-D816 PolarHBondContact OG-OD1 3.45Å; D816-E834 PolarHBondContact O-N 3.43Å; D816-V835 CarbonylContact C-O 3.59Å; D816-V835 WeakPolarHBondContact CA-O 3.35Å; D816-V835 CarbonylContact O-C 3.58Å; D816-V835 PolarHBondContact O-N 2.98Å
817	S	96.5	Very high	95.8	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.007	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	161.7	-173	-45.1	0	0	0	0	110.4	K783 S814 E831 I832 V835	K783-S817 PolarHBondContact NZ-OG 3.01Å; S814-S817 PolarHBondContact N-O 3.27Å; S814-S817 WeakPolarHBondContact OG-CA 3.4Å; S814-S817 WeakPolarHBondContact OG-CB 3.08Å; S814-S817 PolarHBondContact OG-N 3Å; S814-S817 PolarHBondContact OG-O 2.88Å; S814-S817 VanDerWaalsContact OG-O 3.1Å; S817-E831 PolarHBondContact OG-OE1 2.99Å; S817-I832 CarbonylContact C-O 3.58Å; S817-I832 VanDerWaalsContact CA-O 3.24Å; S817-I832 WeakPolarHBondContact CA-O 3.48Å; S817-I832 WeakPolarHBondContact CB-O 3.45Å; S817-V835 PolarHBondContact N-O 2.94Å
818	L	96.9	Very high	96.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	147.9	169.6	-54.6	167.3	0	0	0	109.8	V456 I465 M811 P813 E831 I832 V835	V456-L818 HydrophobicContact CB-CD1 4.09Å; V456-L818 HydrophobicContact CG1-CD1 3.7Å; V456-L818 HydrophobicContact CG1-CD2 3.94Å; V456-L818 HydrophobicContact CG1-CG 4.4Å; V456-L818 HydrophobicContact CG2-CD1 3.73Å; I465-L818 HydrophobicContact CD1-CD1 3.55Å; M811-L818 HydrophobicContact SD-CD1 4.13Å; P813-L818 HydrophobicContact CB-CD2 3.8Å; L818-E831 CarbonylContact O-C 3.56Å; L818-E831 WeakPolarHBondContact O-CA 3.35Å; L818-I832 HydrophobicContact CB-CB 4.21Å; L818-I832 PolarHBondContact N-O 3.16Å; L818-I832 PolarHBondContact O-N 3.44Å; L818-V835 HydrophobicContact CD1-CB 4.22Å; L818-V835 HydrophobicContact CD1-CG1 3.89Å; L818-V835 HydrophobicContact CD1-CG2 3.95Å; L818-V835 HydrophobicContact CD2-CG1 4.05Å; L818-V835 HydrophobicContact CG-CB 3.93Å; L818-V835 HydrophobicContact CG-CG1 3.79Å; L818-V835 HydrophobicContact CG-CG2 4.09Å
819	F	97.8	Very high	96.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.4	177.6	-61.9	-88.2	0	0	0	109.5	L782 K783 M811 T812 L828 E831	L782-F819 HydrophobicContact CB-CD1 4.13Å; L782-F819 HydrophobicContact CB-CD2 4.2Å; L782-F819 HydrophobicContact CB-CE1 4.2Å; L782-F819 HydrophobicContact CB-CE2 4.31Å; L782-F819 HydrophobicContact CB-CG 4.13Å; L782-F819 HydrophobicContact CB-CZ 4.31Å; L782-F819 HydrophobicContact CD2-CB 3.82Å; L782-F819 HydrophobicContact CD2-CD1 4.46Å; L782-F819 HydrophobicContact CD2-CD2 4.15Å; L782-F819 HydrophobicContact CD2-CG 3.86Å; L782-F819 HydrophobicContact CG-CB 3.98Å; L782-F819 HydrophobicContact CG-CD1 3.74Å; L782-F819 HydrophobicContact CG-CD2 4.12Å; L782-F819 HydrophobicContact CG-CE1 4.31Å; L782-F819 HydrophobicContact CG-CG 3.64Å; K783-F819 HydrophobicContact CB-CE2 4.05Å; K783-F819 HydrophobicContact CB-CZ 3.81Å; K783-F819 HydrophobicContact CD-CZ 4.03Å; K783-F819 HydrophobicContact CG-CE2 4.46Å; K783-F819 HydrophobicContact CG-CZ 3.74Å; M811-F819 WeakPolarHBondContact CA-O 3.38Å; T812-F819 HydrophobicContact CG2-CB 4.23Å; T812-F819 PolarHBondContact N-O 3.3Å; T812-F819 PolarHBondContact O-N 2.98Å; F819-L828 HydrophobicContact CB-CD1 3.9Å; F819-L828 HydrophobicContact CD1-CD1 3.73Å; F819-L828 HydrophobicContact CD1-CD2 4.28Å; F819-L828 HydrophobicContact CG-CD1 4.29Å; F819-E831 HydrophobicContact CD1-CB 4.04Å; F819-E831 HydrophobicContact CD1-CG 4.13Å; F819-E831 HydrophobicContact CE1-CB 3.8Å; F819-E831 HydrophobicContact CE1-CG 3.54Å; F819-E831 HydrophobicContact CZ-CG 3.89Å
820	I	97.6	Very high	96.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	123.1	170.5	-64	165.9	0	0	0	107.4	I465 P467 Y809 L810 M811 N829 C830 I832	I465-I820 HydrophobicContact CG2-CD1 3.94Å; P467-I820 HydrophobicContact CB-CD1 4.36Å; P467-I820 HydrophobicContact CB-CG2 4.26Å; Y809-I820 HydrophobicContact CD1-CG2 3.7Å; Y809-I820 HydrophobicContact CG-CG2 4.1Å; L810-I820 CarbonylContact O-C 3.51Å; L810-I820 WeakPolarHBondContact O-CA 3.49Å; M811-I820 HydrophobicContact CE-CD1 3.89Å; M811-I820 HydrophobicContact CE-CG1 3.63Å; I820-N829 HydrophobicContact CB-CB 4.46Å; I820-N829 HydrophobicContact CG2-CB 4.13Å; I820-N829 WeakPolarHBondContact O-CA 3.24Å; I820-N829 WeakPolarHBondContact O-CB 3.44Å; I820-N829 PolarHBondContact O-N 2.98Å; I820-C830 PolarHBondContact N-O 2.96Å; I820-C830 PolarHBondContact O-N 3.18Å; I820-I832 HydrophobicContact CD1-CD1 3.82Å
821	L	97.9	Very high	96.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	139.2	175.8	-50.7	-175	0	0	0	109.3	Y757 V766 I779 L782 I800 Y809 L810 L828	Y757-L821 HydrophobicContact CD1-CD1 4.3Å; V766-L821 HydrophobicContact CB-CD1 4.37Å; V766-L821 HydrophobicContact CG1-CD1 3.97Å; V766-L821 HydrophobicContact CG2-CD1 4.33Å; I779-L821 HydrophobicContact CD1-CD1 4.31Å; I779-L821 HydrophobicContact CG2-CD2 4.04Å; L782-L821 HydrophobicContact CD1-CD2 4.35Å; L782-L821 HydrophobicContact CD2-CD2 4.35Å; I800-L821 HydrophobicContact CD1-CD1 4.33Å; Y809-L821 VanDerWaalsContact CA-O 3.26Å; Y809-L821 WeakPolarHBondContact CA-O 3.09Å; L810-L821 HydrophobicContact CB-CB 4.34Å; L810-L821 HydrophobicContact CD1-CB 4.48Å; L810-L821 PolarHBondContact N-O 3.39Å; L810-L821 PolarHBondContact O-N 3.06Å; L821-L828 HydrophobicContact CD2-CD1 3.91Å
822	D	96.3	Very high	96.1	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.043	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	108.9	169.8	-176.2	-26	0	0	0	108.8	Q808 Y809 R824 L825 N826 K827 N829	Q808-D822 PolarHBondContact NE2-OD1 3.1Å; Q808-D822 PolarHBondContact NE2-OD2 2.93Å; Q808-D822 VanDerWaalsContact NE2-OD2 3.07Å; Y809-D822 HydrophobicContact CE1-CB 4.46Å; D822-R824 WeakPolarHBondContact OD1-CB 3.24Å; D822-R824 PolarHBondContact OD1-N 2.68Å; D822-L825 HydrophobicContact CB-CB 4.29Å; D822-L825 PolarHBondContact O-N 2.95Å; D822-L825 PolarHBondContact OD1-N 3.46Å; D822-L825 VanDerWaalsContact OD1-N 3.07Å; D822-L825 WeakPolarHBondContact OD2-CD1 3.48Å; D822-L825 WeakPolarHBondContact OD2-CG 3.24Å; D822-N826 WeakPolarHBondContact O-CA 3.46Å; D822-N826 PolarHBondContact O-N 3.34Å; D822-K827 PolarHBondContact N-O 2.84Å; D822-K827 PolarHBondContact O-N 3.25Å; D822-N829 HydrophobicContact CB-CB 4.19Å
823	G	95	Very high	95.9	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.01	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-26.7	-178.7	0	0	0	0	0	114.5	Q745 Y757 Q808 L825 N826	Q745-G823 VanDerWaalsContact OE1-CA 3.25Å; Y757-G823 VanDerWaalsContact OH-CA 3.22Å; Y757-G823 WeakPolarHBondContact OH-CA 3.3Å; Y757-G823 PolarHBondContact OH-O 3.32Å; Q808-G823 WeakPolarHBondContact O-CA 3.36Å; Q808-G823 PolarHBondContact O-N 3.49Å; G823-L825 VanDerWaalsContact C-N 3.33Å; G823-N826 PolarHBondContact O-OD1 2.89Å
824	R	92.6	Very high	95.6	Very high	79 Å²	79	44.7 Å²	44.7	30%	0.298	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-36	174.6	-179	171.1	-73.4	-144.1	-10.9	111.1	E397 F748 Q808 D822	E397-R824 IonicContact OE1-CZ 2.61Å; E397-R824 IonicContact OE1-NH1 3.86Å; E397-R824 PolarHBondContact OE1-NH1 3.46Å; E397-R824 IonicContact OE1-NH2 3.88Å; E397-R824 PolarHBondContact OE1-NH2 2.6Å; E397-R824 IonicContact OE2-CZ 3.94Å; E397-R824 IonicContact OE2-NH1 3.64Å; E397-R824 IonicContact OE2-NH2 2.89Å; E397-R824 PolarHBondContact OE2-NH2 3.39Å; F748-R824 HydrophobicContact CB-CG 4.49Å; F748-R824 HydrophobicContact CD1-CB 4.44Å; F748-R824 HydrophobicContact CD2-CB 4Å; F748-R824 HydrophobicContact CE2-CB 4.23Å; F748-R824 HydrophobicContact CG-CB 4.12Å; F748-R824 HydrophobicContact CG-CG 4.3Å; Q808-R824 HydrophobicContact CG-CB 3.98Å; D822-R824 WeakPolarHBondContact OD1-CB 3.24Å; D822-R824 PolarHBondContact OD1-N 2.68Å
825	L	94.3	Very high	95.5	Very high	90 Å²	90	44.7 Å²	44.7	47%	0.471	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-6.2	-180	-61.1	-176.8	0	0	0	113.7	D822 G823 K827	D822-L825 HydrophobicContact CB-CB 4.29Å; D822-L825 PolarHBondContact O-N 2.95Å; D822-L825 PolarHBondContact OD1-N 3.46Å; D822-L825 VanDerWaalsContact OD1-N 3.07Å; D822-L825 WeakPolarHBondContact OD2-CD1 3.48Å; D822-L825 WeakPolarHBondContact OD2-CG 3.24Å; G823-L825 VanDerWaalsContact C-N 3.33Å; L825-K827 VanDerWaalsContact C-N 3.31Å; L825-K827 HydrophobicContact CB-CD 3.96Å; L825-K827 HydrophobicContact CB-CG 3.79Å; L825-K827 HydrophobicContact CD1-CD 4.33Å; L825-K827 VanDerWaalsContact CD1-CE 3.41Å; L825-K827 PolarHBondContact O-N 3.12Å
826	N	94.4	Very high	95.4	Very high	37 Å²	37	44.4 Å²	44.4	20%	0.198	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	47.2	-176.8	-64.9	-47	0	0	0	112.6	Y757 F768 K777 D822 G823	Y757-N826 PolarHBondContact OH-OD1 3.22Å; F768-N826 WeakPolarHBondContact CD2-OD1 3.44Å; F768-N826 WeakPolarHBondContact CE2-OD1 3.33Å; F768-N826 WeakPolarHBondContact CZ-OD1 3.41Å; K777-N826 HydrophobicContact CD-CB 4.3Å; K777-N826 WeakPolarHBondContact CE-O 3.36Å; K777-N826 PolarHBondContact NZ-O 3.22Å; D822-N826 WeakPolarHBondContact O-CA 3.46Å; D822-N826 PolarHBondContact O-N 3.34Å; G823-N826 PolarHBondContact O-OD1 2.89Å
827	K	95.8	Very high	95.3	Very high	102 Å²	102	45.1 Å²	45.1	44%	0.443	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	167.1	-175.9	70.5	177.9	-170.1	-178.6	0	111.9	D822 L825 N829	D822-K827 PolarHBondContact N-O 2.84Å; D822-K827 PolarHBondContact O-N 3.25Å; L825-K827 VanDerWaalsContact C-N 3.31Å; L825-K827 HydrophobicContact CB-CD 3.96Å; L825-K827 HydrophobicContact CB-CG 3.79Å; L825-K827 HydrophobicContact CD1-CD 4.33Å; L825-K827 VanDerWaalsContact CD1-CE 3.41Å; L825-K827 PolarHBondContact O-N 3.12Å; K827-N829 PolarHBondContact O-N 3.38Å
828	L	96.7	Very high	95.2	Very high	44 Å²	44	45.1 Å²	45.1	23%	0.23	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	128.2	167.7	179.9	63.3	0	0	0	110.2	S781 F819 L821 C830	S781-L828 WeakPolarHBondContact O-CD2 3.48Å; F819-L828 HydrophobicContact CB-CD1 3.9Å; F819-L828 HydrophobicContact CD1-CD1 3.73Å; F819-L828 HydrophobicContact CD1-CD2 4.28Å; F819-L828 HydrophobicContact CG-CD1 4.29Å; L821-L828 HydrophobicContact CD2-CD1 3.91Å; L828-C830 WeakPolarHBondContact CD1-O 3.41Å
829	N	96.2	Very high	95.2	Very high	55 Å²	55	45.4 Å²	45.4	29%	0.294	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-55.5	173.2	-169.1	46.7	0	0	0	110.3	P467 C470 I820 D822 K827	P467-N829 PolarHBondContact O-ND2 3.02Å; C470-N829 PolarHBondContact SG-ND2 3.3Å; I820-N829 HydrophobicContact CB-CB 4.46Å; I820-N829 HydrophobicContact CG2-CB 4.13Å; I820-N829 WeakPolarHBondContact O-CA 3.24Å; I820-N829 WeakPolarHBondContact O-CB 3.44Å; I820-N829 PolarHBondContact O-N 2.98Å; D822-N829 HydrophobicContact CB-CB 4.19Å; K827-N829 PolarHBondContact O-N 3.38Å
830	C	96.2	Very high	95.2	Very high	24 Å²	24	45.7 Å²	45.7	16%	0.162	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	162.3	-178	62.3	0	0	0	0	112	C470 I820 L828	C470-C830 HydrophobicContact CB-CB 3.76Å; C470-C830 WeakPolarHBondContact CB-SG 3.2Å; C470-C830 WeakPolarHBondContact SG-CB 3.37Å; C470-C830 CovalentContact SG-SG 2.01Å; C470-C830 PolarHBondContact SG-SG 3.37Å; I820-C830 PolarHBondContact N-O 2.96Å; I820-C830 PolarHBondContact O-N 3.18Å; L828-C830 WeakPolarHBondContact CD1-O 3.41Å
831	E	96.2	Very high	95.1	Very high	77 Å²	77	46.1 Å²	46.1	36%	0.36	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.9	171.4	177.6	-174.4	155.9	0	0	109	K783 S817 L818 F819 T833	K783-E831 WeakPolarHBondContact CE-OE1 3.5Å; K783-E831 IonicContact NZ-OE1 2.71Å; K783-E831 PolarHBondContact NZ-OE1 3.22Å; S817-E831 PolarHBondContact OG-OE1 2.99Å; L818-E831 CarbonylContact O-C 3.56Å; L818-E831 WeakPolarHBondContact O-CA 3.35Å; F819-E831 HydrophobicContact CD1-CB 4.04Å; F819-E831 HydrophobicContact CD1-CG 4.13Å; F819-E831 HydrophobicContact CE1-CB 3.8Å; F819-E831 HydrophobicContact CE1-CG 3.54Å; F819-E831 HydrophobicContact CZ-CG 3.89Å; E831-T833 HydrophobicContact CG-CG2 4.27Å; E831-T833 WeakPolarHBondContact OE1-CG2 3.38Å
832	I	95	Very high	95.1	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	110.9	174.5	-62.3	-180	0	0	0	107.3	I465 F472 S817 L818 I820 V835	I465-I832 HydrophobicContact CB-CD1 4.49Å; I465-I832 HydrophobicContact CD1-CD1 3.74Å; I465-I832 HydrophobicContact CG1-CD1 4.31Å; I465-I832 HydrophobicContact CG2-CD1 3.43Å; I465-I832 VanDerWaalsContact CG2-CD1 3.43Å; F472-I832 HydrophobicContact CE1-CG2 3.3Å; F472-I832 HydrophobicContact CZ-CG2 3.42Å; F472-I832 VanDerWaalsContact CZ-CG2 3.42Å; S817-I832 CarbonylContact C-O 3.58Å; S817-I832 VanDerWaalsContact CA-O 3.24Å; S817-I832 WeakPolarHBondContact CA-O 3.48Å; S817-I832 WeakPolarHBondContact CB-O 3.45Å; L818-I832 HydrophobicContact CB-CB 4.21Å; L818-I832 PolarHBondContact N-O 3.16Å; L818-I832 PolarHBondContact O-N 3.44Å; I820-I832 HydrophobicContact CD1-CD1 3.82Å; I832-V835 HydrophobicContact CG2-CG2 4.08Å
833	T	93.9	Very high	95.1	Very high	73 Å²	73	47.1 Å²	47.1	45%	0.448	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	171.8	-176.7	55.1	0	0	0	0	112.3	E831 V835	E831-T833 HydrophobicContact CG-CG2 4.27Å; E831-T833 WeakPolarHBondContact OE1-CG2 3.38Å; T833-V835 PolarHBondContact O-N 2.95Å
834	E	90.6	Very high	95	Very high	161 Å²	161	47.2 Å²	47.2	75%	0.752	23%	0.229	S	C	*	.	S	Bend	trans	61	44.1	175.3	-53.8	179.3	175.5	0	0	112.5	K463 D816	K463-E834 PolarHBondContact NZ-O 2.83Å; D816-E834 PolarHBondContact O-N 3.43Å
835	V	94.4	Very high	94.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.			trans	-128.9	87.4	174.2	-173.6	0	0	0	0	108.5	V456 Y458 K463 D816 S817 L818 I832 T833	V456-V835 HydrophobicContact CG1-CG1 4.17Å; Y458-V835 HydrophobicContact CD1-CG1 4.48Å; Y458-V835 HydrophobicContact CD2-CB 4.45Å; Y458-V835 HydrophobicContact CD2-CG1 3.82Å; Y458-V835 HydrophobicContact CG-CG1 3.76Å; K463-V835 HydrophobicContact CD-CG2 3.95Å; D816-V835 CarbonylContact C-O 3.59Å; D816-V835 WeakPolarHBondContact CA-O 3.35Å; D816-V835 CarbonylContact O-C 3.58Å; D816-V835 PolarHBondContact O-N 2.98Å; S817-V835 PolarHBondContact N-O 2.94Å; L818-V835 HydrophobicContact CD1-CB 4.22Å; L818-V835 HydrophobicContact CD1-CG1 3.89Å; L818-V835 HydrophobicContact CD1-CG2 3.95Å; L818-V835 HydrophobicContact CD2-CG1 4.05Å; L818-V835 HydrophobicContact CG-CB 3.93Å; L818-V835 HydrophobicContact CG-CG1 3.79Å; L818-V835 HydrophobicContact CG-CG2 4.09Å; I832-V835 HydrophobicContact CG2-CG2 4.08Å; T833-V835 PolarHBondContact O-N 2.95Å
836	Q	94.4	Very high	93.4	Very high	109 Å²	109	43.7 Å²	43.7	51%	0.509	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	133	177.5	-65.7	-174.8	-15.6	0	0	110.8	Y458 D459 G838	Y458-Q836 WeakPolarHBondContact CB-O 3.47Å; D459-Q836 HydrophobicContact CB-CB 4.28Å; D459-Q836 PolarHBondContact N-O 3.34Å; D459-Q836 VanDerWaalsContact N-O 3.12Å; Q836-G838 VanDerWaalsContact C-N 3.29Å; Q836-G838 PolarHBondContact O-N 3.45Å
837	K	93.5	Very high	91.2	Very high	81 Å²	81	45 Å²	45	35%	0.352	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	39.7	179.7	-52.2	-167.2	-170.8	177.4	0	114.6	D459 L786 K815 N839	D459-K837 WeakPolarHBondContact OD1-CB 3.16Å; D459-K837 WeakPolarHBondContact OD1-CD 3.34Å; L786-K837 HydrophobicContact CD1-CG 4.31Å; L786-K837 HydrophobicContact CD2-CB 4.38Å; L786-K837 HydrophobicContact CD2-CD 4.48Å; L786-K837 HydrophobicContact CD2-CG 4.13Å; K815-K837 PolarHBondContact O-N 2.71Å; K837-N839 PolarHBondContact O-N 3.16Å
838	G	94.2	Very high	91	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.			trans	-73.4	40.8	176.2	0	0	0	0	0	114.5	P813 Q836 T840 V841	P813-G838 WeakPolarHBondContact CB-O 3.4Å; Q836-G838 VanDerWaalsContact C-N 3.29Å; Q836-G838 PolarHBondContact O-N 3.45Å; G838-T840 VanDerWaalsContact C-N 3.35Å; G838-V841 WeakPolarHBondContact O-CG2 3.32Å
839	N	95.5	Very high	90.7	Very high	7 Å²	7	42 Å²	42	4%	0.037	22%	0.223	C	C	.	.			trans	-78	-17.9	-173.1	-82.4	32.3	0	0	0	114	W791 N797 K837	W791-N839 HydrophobicContact CD2-CB 3.93Å; W791-N839 HydrophobicContact CE3-CB 3.85Å; W791-N839 HydrophobicContact CH2-CB 3.59Å; W791-N839 HydrophobicContact CZ2-CB 3.66Å; W791-N839 HydrophobicContact CZ3-CB 3.68Å; N797-N839 PolarHBondContact O-ND2 3.23Å; K837-N839 PolarHBondContact O-N 3.16Å
840	T	97.8	Very high	90.4	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.037	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	104.9	176.9	-57.5	0	0	0	0	109	F457 A504 A506 V516 W791 G838	F457-T840 HydrophobicContact CB-CG2 4.04Å; F457-T840 HydrophobicContact CD2-CG2 3.9Å; F457-T840 HydrophobicContact CG-CG2 4.23Å; F457-T840 PolarHBondContact N-O 3.48Å; A504-T840 PolarHBondContact O-OG1 3.11Å; A506-T840 HydrophobicContact CB-CG2 3.5Å; A506-T840 VanDerWaalsContact CB-CG2 3.5Å; V516-T840 HydrophobicContact CG2-CG2 4.37Å; W791-T840 WeakPolarHBondContact CH2-OG1 3.48Å; G838-T840 VanDerWaalsContact C-N 3.35Å
841	V	97.1	Very high	90.1	Very high	8 Å²	8	42.3 Å²	42.3	5%	0.048	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.4	-175.5	-178.2	0	0	0	0	110.1	F454 Y455 V456 Q801 M811 G838	F454-V841 HydrophobicContact CD1-CG1 3.82Å; Y455-V841 WeakPolarHBondContact O-CA 3.33Å; V456-V841 HydrophobicContact CG1-CG2 4.13Å; V456-V841 HydrophobicContact CG2-CG1 4.25Å; V456-V841 HydrophobicContact CG2-CG2 4.23Å; Q801-V841 HydrophobicContact CB-CB 4.34Å; Q801-V841 HydrophobicContact CB-CG1 3.97Å; Q801-V841 HydrophobicContact CG-CG1 4.2Å; M811-V841 HydrophobicContact CB-CG1 4.3Å; M811-V841 HydrophobicContact CG-CG1 4.23Å; M811-V841 HydrophobicContact SD-CG1 3.73Å; M811-V841 HydrophobicContact SD-CG2 4.38Å; G838-V841 WeakPolarHBondContact O-CG2 3.32Å
842	V	96.6	Very high	89.7	Confident	7 Å²	7	40.1 Å²	40.1	4%	0.042	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.5	177.4	175.6	0	0	0	0	109.7	F454 Y455 F457 A506 N508 I514 V844	F454-V842 WeakPolarHBondContact CA-O 3.42Å; Y455-V842 PolarHBondContact N-O 3.44Å; Y455-V842 PolarHBondContact O-N 2.99Å; F457-V842 HydrophobicContact CE2-CG2 4.44Å; A506-V842 HydrophobicContact CB-CG2 3.41Å; A506-V842 VanDerWaalsContact CB-CG2 3.41Å; N508-V842 HydrophobicContact CB-CG1 3.56Å; I514-V842 HydrophobicContact CG2-CB 4.41Å; I514-V842 HydrophobicContact CG2-CG1 4.28Å; I514-V842 HydrophobicContact CG2-CG2 4.28Å; V842-V844 HydrophobicContact CG1-CG2 4.34Å
843	W	95.9	Very high	89.3	Confident	23 Å²	23	42.4 Å²	42.4	9%	0.087	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.9	168.3	174.9	-105.5	0	0	0	110.6	N452 M453 F454 P467 N508 Q801 G802 S803	N452-W843 VanDerWaalsContact C-CZ3 3.48Å; N452-W843 HydrophobicContact CB-CH2 3.5Å; N452-W843 VanDerWaalsContact CB-CH2 3.5Å; N452-W843 HydrophobicContact CB-CZ2 3.51Å; N452-W843 VanDerWaalsContact O-CH2 3.3Å; N452-W843 WeakPolarHBondContact O-CH2 3.14Å; N452-W843 WeakPolarHBondContact OD1-CZ2 3.21Å; M453-W843 VanDerWaalsContact C-CE3 3.49Å; M453-W843 VanDerWaalsContact O-CE3 3.28Å; F454-W843 HydrophobicContact CD1-CB 4.47Å; F454-W843 AromaticContact CD1-CE3 3.91Å; F454-W843 HydrophobicContact CD1-CE3 3.91Å; F454-W843 AromaticContact CD2-CE3 3.82Å; F454-W843 HydrophobicContact CD2-CE3 3.82Å; F454-W843 AromaticContact CD2-CZ3 3.76Å; F454-W843 HydrophobicContact CD2-CZ3 3.76Å; F454-W843 HydrophobicContact CE1-CB 4.3Å; F454-W843 AromaticContact CE1-CE3 3.86Å; F454-W843 HydrophobicContact CE1-CE3 3.86Å; F454-W843 AromaticContact CE2-CE3 3.77Å; F454-W843 HydrophobicContact CE2-CE3 3.77Å; F454-W843 AromaticContact CE2-CZ3 3.7Å; F454-W843 HydrophobicContact CE2-CZ3 3.7Å; F454-W843 AromaticContact CG-CE3 3.9Å; F454-W843 HydrophobicContact CG-CE3 3.9Å; F454-W843 HydrophobicContact CG-CZ3 4.26Å; F454-W843 AromaticContact CZ-CE3 3.79Å; F454-W843 HydrophobicContact CZ-CE3 3.79Å; F454-W843 HydrophobicContact CZ-CZ3 4.15Å; P467-W843 HydrophobicContact CG-CH2 4.1Å; P467-W843 HydrophobicContact CG-CZ3 3.92Å; N508-W843 PolarHBondContact ND2-O 3.26Å; Q801-W843 HydrophobicContact CG-CB 4.33Å; G802-W843 WeakPolarHBondContact O-CB 3.45Å; S803-W843 VanDerWaalsContact C-CD1 3.48Å; S803-W843 VanDerWaalsContact C-NE1 3.31Å; S803-W843 VanDerWaalsContact CA-CD2 3.45Å; S803-W843 VanDerWaalsContact O-CE2 3.28Å; S803-W843 PolarHBondContact O-NE1 3.09Å; S803-W843 VanDerWaalsContact O-NE1 3.1Å
844	V	93.4	Very high	89	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.4	171.7	178	0	0	0	0	108.8	N452 M453 Y455 D511 I514 V529 V842	N452-V844 CarbonylContact C-O 3.59Å; N452-V844 WeakPolarHBondContact CA-O 3.44Å; N452-V844 PolarHBondContact N-O 2.8Å; N452-V844 VanDerWaalsContact N-O 3.09Å; M453-V844 PolarHBondContact N-O 3.36Å; M453-V844 PolarHBondContact O-N 3.29Å; Y455-V844 HydrophobicContact CD2-CB 4.11Å; Y455-V844 HydrophobicContact CD2-CG2 3.72Å; Y455-V844 HydrophobicContact CE2-CB 3.9Å; Y455-V844 HydrophobicContact CE2-CG1 4.5Å; Y455-V844 HydrophobicContact CE2-CG2 3.82Å; D511-V844 HydrophobicContact CB-CG1 4.16Å; I514-V844 HydrophobicContact CD1-CG2 3.61Å; I514-V844 HydrophobicContact CG1-CG2 3.85Å; V529-V844 HydrophobicContact CB-CG1 4.31Å; V529-V844 HydrophobicContact CG1-CG1 3.51Å; V529-V844 HydrophobicContact CG2-CG1 3.81Å; V529-V844 HydrophobicContact CG2-CG2 4.19Å; V842-V844 HydrophobicContact CG1-CG2 4.34Å
845	G	85.9	Confident	88.9	Confident	4 Å²	4	30.9 Å²	30.9	4%	0.041	17%	0.168	C	C	.	.	S	Bend	trans	163.2	155.1	-175.7	0	0	0	0	0	112.4	N452 D511 A847	N452-G845 WeakPolarHBondContact OD1-CA 3.32Å; D511-G845 PolarHBondContact OD1-N 2.82Å; G845-A847 PolarHBondContact O-N 2.7Å
846	D	67.3	Low	88.4	Confident	91 Å²	91	33.5 Å²	33.5	49%	0.487	18%	0.182	S	C	.	.			trans	-52	123.6	-173	-59.1	-34	0	0	0	111.1	N452	N452-D846 PolarHBondContact OD1-N 2.93Å
847	A	49.7	Very low	87.9	Confident	64 Å²	64	26.6 Å²	26.6	53%	0.529	15%	0.152	S	C	.	.			trans	-96.3	0	173.6	0	0	0	0	0	111.1	L805 F806 G845	L805-A847 WeakPolarHBondContact CB-OXT 3.3Å; L805-A847 WeakPolarHBondContact CD2-OXT 3.47Å; F806-A847 WeakPolarHBondContact CD2-OXT 3.49Å; F806-A847 WeakPolarHBondContact CE2-OXT 3.38Å; G845-A847 PolarHBondContact O-N 2.7Å

Retrieved 847 of 847 residues in 598 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).