RIMS1_MOUSE Loading...

Isoform 5 of Regulating synaptic membrane exocytosis protein 1 AlphaSync

Canonical isoform description: Rab effector involved in exocytosis¹. May act as scaffold protein that regulates neurotransmitter release at the active zone. Essential for maintaining normal probability of neurotransmitter release and for regulating release during short-term synaptic plasticity². Plays a role in dendrite formation by melanocytes (By similarity).

AlphaFold DB , UniProt , Accession Q99NE5-5 (canonical: Q99NE5), Species MOUSE (Mus musculus, Mouse), Gene Rims1, Length 1,350 aa.

						>RIMS1_MOUSE|Q99NE5-5|Rims1
MSSAVGPRGPRPPTVPPPMQELPDLSHLTEEERNIIMAVMDRQKEEEEKEEAMLKCVVRDMAKPAACKTPRNAESQPHQPPLNIFRCVCVPRKPSSEEGGPDRNWRLHQQFESYKEQVRKIGEEARRYQGEHKDDAPTCGICHKTKFADGCGHLCSYCRTKFCARCGGRVSLRSNNEDKVVMWVCNLCRKQQEILTKSGAWFFGSGPQQPSQDGTLSDTATGAGSEVPREKKARLQERSRSQTPLSTAAVSSQDTASHGAPLDRNKGAEPSQQALGPEQKQASRSRSEPPRERKKAPGLSEQNGKGGQKSERKRVPKSVVQPGEGTADERERKERRETRRLEKGRSQDYPDRLEKREDGRVAEDEKQRKEEEGVSTPEYTSCEDVELESESVSEKGDLDYWLDPATWHSRETSPISSHPVTWQPSKEGDRLIGRVILNKRTTMPKESGALLGLKVVGGKMTDLGRLGAFITKVKKGSLADVVGHLRAGDEVLEWNGKPLPGATNEEVYNIILESKSEPQVEIIVSRPIGDIPRIPESSHPPLESSSSSFESQKMERPSISVISPTSPGALKDAPQVLPGQLSVKLWYDKVGHQLIVNVLQATDLPPRVDGRPRNPYVKMYFLPDRSDKSKRRTKTVKKLLEPKWNQTFVYSHVHRRDFRERMLEITVWDQPRVQDEESEFLGEILIELETALLDDEPHWYKLQTHDESSLPLPQPSPFMPRRHIHGESSSKKLQRSQRISDSDISDYEVDDGIGVVPPVGYRASARESKATTLTVPEQQRTTHHRSRSVSPHRGDDQGRPRSRLPNVPLQRSLDEIHPTRRSRSPTRHHDASRSLADHRSRHAESQYSSEPDSELLMLPRAKRGRSAECLHMTSELQPSLDRARSASTNCLRPDTSLHSPERERTHRQGSPTQSPPADTSFGSRRGRQLPQVPVRSGSIEQASLVVEERTRQMKMKVHRFKQTTGSGSSQELDHEQYSKYNIHKDQYRSCDNASAKSSDSDVSDVSAISRASSTSRLSSTSFMSEQSERPRGRISSFTPKMQGRRMGTSGRAIIKSTSVSGEIYTLEHNDGSQSDTAVGTVGAGGKKRRSSLSAKVVAIVSRRSRSTSQLSQTESGHKKLKSTIQRSTETGMAAEMRKMVRQPSRESTDGSINSYSSEGNLIFPGVRVGPDSQFSDFLDGLGPAQLVGRQTLATPAMGDIQIGMEDKKGQLEVEVIRARSLTQKPGSKSTPAPYVKVYLLENGACIAKKKTRIARKTLDPLYQQSLVFDESPQGKVLQVIVWGDYGRMDHKCFMGVAQILLEELDLSSMVIGWYKLFPPSSLVDPTLTPLTRRASQSSLESSSGPPCIRS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	40.1	Very low	42.2	Very low	228 Å²	228	141.5 Å²	141.5	100%	1.123	84%	0.835	S	S	*	*				0	109.8	0	-49	-167.9	96.7	0	0	105.7
2	S	38.3	Very low	42.5	Very low	112 Å²	112	138.3 Å²	138.3	78%	0.783	82%	0.82	S	S	*	*				77.8	119.5	76.5	-56.1	0	0	0	0	110.4
3	S	39	Very low	43.2	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	82%	0.816	S	S	*	*			cis	-156.7	170.3	7.8	-65.1	0	0	0	0	112.8
4	A	40	Very low	43.2	Very low	88 Å²	88	136.1 Å²	136.1	73%	0.727	81%	0.814	S	S	*	*			trans	22.2	130.7	156.2	0	0	0	0	0	120.8
5	V	43.7	Very low	43.1	Very low	150 Å²	150	135.5 Å²	135.5	91%	0.909	81%	0.811	S	S	*	*			cis	73.5	107.8	39.9	-173.4	0	0	0	0	114.7
6	G	42.5	Very low	43.7	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	80%	0.8	S	S	*	*			trans	-168.3	135.9	167	0	0	0	0	0	110.1
7	P	46.1	Very low	44.1	Very low	118 Å²	118	131.8 Å²	131.8	77%	0.766	80%	0.795	S	S	*	*			trans	-127.6	158.5	-149.9	40	-24.9	0	0	0	118.7
8	R	37.9	Very low	44.6	Very low	252 Å²	252	131.5 Å²	131.5	95%	0.951	80%	0.797	S	S	*	*			trans	55.2	111.4	149.1	-70.7	-179.1	176.5	-133.9	-0	120.2
9	G	42.7	Very low	44.5	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	80%	0.798	S	S	*	*			trans	-128.4	148.1	137.6	0	0	0	0	0	109.5
10	P	49.2	Very low	44.9	Very low	132 Å²	132	135.3 Å²	135.3	86%	0.857	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70	138	179.9	-16.9	31.4	0	0	0	112.1	P12	P10-P12 WeakPolarHBondContact O-CD 3.48Å
11	R	45.1	Very low	45.5	Very low	227 Å²	227	137.8 Å²	137.8	86%	0.857	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-78.5	123.2	171.5	176.1	-176.3	-84.1	-124.8	2.2	109.2
12	P	45.5	Very low	46.7	Very low	102 Å²	102	133.3 Å²	133.3	66%	0.662	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-61.8	150.6	170.9	-21.1	33.5	0	0	0	111.6	P10	P10-P12 WeakPolarHBondContact O-CD 3.48Å
13	P	51.4	Low	48.3	Very low	118 Å²	118	131.1 Å²	131.1	77%	0.766	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-63.6	142.8	176.8	28	-34.6	0	0	0	111	V15	P13-V15 PolarHBondContact O-N 3.33Å
14	T	43.4	Very low	50.1	Low	128 Å²	128	131.1 Å²	131.1	79%	0.785	76%	0.756	S	S	*	*			trans	-64.6	108.2	174	-51.1	0	0	0	0	109.3
15	V	42.1	Very low	51.9	Low	127 Å²	127	128 Å²	128	77%	0.77	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-66.6	123.9	172	-178.8	0	0	0	0	107.8	P13	P13-V15 PolarHBondContact O-N 3.33Å
16	P	52.3	Low	53.5	Low	97 Å²	97	124.3 Å²	124.3	63%	0.63	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-64.1	154.2	172.7	28.7	-34.4	0	0	0	109.8
17	P	50.1	Low	55.4	Low	112 Å²	112	127.8 Å²	127.8	73%	0.727	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-55.6	142.5	175.1	26	-34.8	0	0	0	109.8	M19	P17-M19 PolarHBondContact O-N 3.06Å
18	P	52.7	Low	57	Low	126 Å²	126	123.9 Å²	123.9	82%	0.818	68%	0.678	S	S	*	*			trans	-60	115.4	-179.3	25.1	-33.4	0	0	0	108.9	Q20	P18-Q20 PolarHBondContact O-N 3.01Å
19	M	44.3	Very low	59.3	Low	169 Å²	169	115.6 Å²	115.6	83%	0.833	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-58.7	138	164	-78.2	-178.9	57.2	0	0	107.8	P17 E21	P17-M19 PolarHBondContact O-N 3.06Å; M19-E21 PolarHBondContact O-N 2.61Å; M19-E21 VanDerWaalsContact O-N 3.1Å
20	Q	51.8	Low	61.2	Low	169 Å²	169	119.3 Å²	119.3	79%	0.79	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-55.5	118.4	169	-67.8	165	-20.8	0	0	107.7	P18 L22	P18-Q20 PolarHBondContact O-N 3.01Å; Q20-L22 PolarHBondContact O-N 2.77Å
21	E	56.6	Low	63	Low	188 Å²	188	120.4 Å²	120.4	88%	0.879	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-60.5	122.8	173.5	-75.7	-177.4	121.5	0	0	108.3	M19	M19-E21 PolarHBondContact O-N 2.61Å; M19-E21 VanDerWaalsContact O-N 3.1Å
22	L	66.9	Low	64.9	Low	134 Å²	134	113.8 Å²	113.8	70%	0.702	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-57.6	132.9	171.6	-76.4	158.5	0	0	0	108	Q20 D24 M40	Q20-L22 PolarHBondContact O-N 2.77Å; L22-D24 PolarHBondContact O-N 3.18Å; L22-M40 HydrophobicContact CD2-CE 4.16Å; L22-M40 HydrophobicContact CD2-SD 4.48Å
23	P	71.8	Confident	66.9	Low	66 Å²	66	113.1 Å²	113.1	43%	0.429	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-58.8	140.3	177	25.9	-34	0	0	0	109.5	L25 M40	P23-L25 HydrophobicContact CG-CD2 4.3Å; P23-L25 WeakPolarHBondContact O-CG 3.47Å; P23-L25 PolarHBondContact O-N 3.37Å; P23-M40 HydrophobicContact CG-CE 4.25Å; P23-M40 HydrophobicContact CG-SD 3.68Å
24	D	75.1	Confident	68.6	Low	113 Å²	113	111.7 Å²	111.7	60%	0.604	60%	0.597	S	S	*	*			trans	-71.1	99.8	-176.6	180	23.6	0	0	0	111.8	L22 S26 H27	L22-D24 PolarHBondContact O-N 3.18Å; D24-S26 PolarHBondContact O-N 3.22Å; D24-S26 WeakPolarHBondContact OD1-CB 3.33Å; D24-S26 PolarHBondContact OD1-N 3.47Å; D24-S26 PolarHBondContact OD1-OG 3.1Å; D24-S26 VanDerWaalsContact OD1-OG 3.06Å; D24-S26 PolarHBondContact OD2-OG 3.39Å; D24-H27 PolarHBondContact O-CE1 3.46Å; D24-H27 PolarHBondContact O-ND1 3.36Å
25	L	78.5	Confident	70.6	Confident	23 Å²	23	110.8 Å²	110.8	12%	0.12	59%	0.586	C	S	.	*	G	3₁₀ helix	trans	-87.2	19.2	176	-49.6	-177.7	0	0	0	112.8	P23 H27 L28 R33 I36 M37	P23-L25 HydrophobicContact CG-CD2 4.3Å; P23-L25 WeakPolarHBondContact O-CG 3.47Å; P23-L25 PolarHBondContact O-N 3.37Å; L25-H27 PolarHBondContact O-N 2.99Å; L25-L28 HydrophobicContact CB-CD1 4.17Å; L25-L28 HydrophobicContact CD2-CD1 3.72Å; L25-L28 HydrophobicContact CG-CD1 4.5Å; L25-R33 HydrophobicContact CB-CB 4.39Å; L25-R33 HydrophobicContact CB-CG 3.84Å; L25-R33 HydrophobicContact CD1-CG 3.94Å; L25-R33 PolarHBondContact O-NE 3.38Å; L25-R33 PolarHBondContact O-NH2 3.19Å; L25-I36 HydrophobicContact CD1-CB 4.03Å; L25-I36 HydrophobicContact CD1-CG2 3.76Å; L25-I36 HydrophobicContact CD2-CD1 4.42Å; L25-I36 HydrophobicContact CD2-CG2 3.89Å; L25-M37 HydrophobicContact CD1-CG 3.91Å
26	S	77.6	Confident	72.7	Confident	72 Å²	72	107.5 Å²	107.5	50%	0.503	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-57.3	-36	175.5	64.5	0	0	0	0	113.2	D24 L28 R33	D24-S26 PolarHBondContact O-N 3.22Å; D24-S26 WeakPolarHBondContact OD1-CB 3.33Å; D24-S26 PolarHBondContact OD1-N 3.47Å; D24-S26 PolarHBondContact OD1-OG 3.1Å; D24-S26 VanDerWaalsContact OD1-OG 3.06Å; D24-S26 PolarHBondContact OD2-OG 3.39Å; S26-L28 VanDerWaalsContact C-N 3.33Å; S26-L28 PolarHBondContact O-N 3.5Å; S26-R33 PolarHBondContact O-NH2 3.46Å
27	H	82.1	Confident	74.3	Confident	143 Å²	143	106.8 Å²	106.8	66%	0.662	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-83.7	0.9	-171.4	67.7	-84	0	0	0	115.4	D24 L25	D24-H27 PolarHBondContact O-CE1 3.46Å; D24-H27 PolarHBondContact O-ND1 3.36Å; L25-H27 PolarHBondContact O-N 2.99Å
28	L	79.2	Confident	76.1	Confident	36 Å²	36	103.6 Å²	103.6	19%	0.188	54%	0.536	C	S	.	.	S	Bend	trans	-110.2	154.9	-175.3	-72.2	151.4	0	0	0	110.8	L25 S26 E32 I36	L25-L28 HydrophobicContact CB-CD1 4.17Å; L25-L28 HydrophobicContact CD2-CD1 3.72Å; L25-L28 HydrophobicContact CG-CD1 4.5Å; S26-L28 VanDerWaalsContact C-N 3.33Å; S26-L28 PolarHBondContact O-N 3.5Å; L28-E32 HydrophobicContact CB-CB 4.04Å; L28-E32 HydrophobicContact CD2-CB 4Å; L28-E32 HydrophobicContact CD2-CG 4.46Å; L28-I36 HydrophobicContact CD1-CD1 3.64Å; L28-I36 HydrophobicContact CD2-CD1 4.45Å
29	T	85.9	Confident	77.8	Confident	77 Å²	77	101.1 Å²	101.1	47%	0.472	52%	0.518	S	S	.	.			trans	-60.9	158.1	171	62	0	0	0	0	110.9	E31 E32 R33	T29-E31 PolarHBondContact O-N 3.37Å; T29-E32 WeakPolarHBondContact CB-OE2 3.34Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.49Å; T29-E32 PolarHBondContact N-OE2 2.91Å; T29-E32 PolarHBondContact O-N 3Å; T29-E32 WeakPolarHBondContact OG1-CB 2.98Å; T29-E32 VanDerWaalsContact OG1-CD 3.27Å; T29-E32 VanDerWaalsContact OG1-CG 3.22Å; T29-E32 WeakPolarHBondContact OG1-CG 3.35Å; T29-E32 PolarHBondContact OG1-N 3.02Å; T29-E32 PolarHBondContact OG1-OE2 3.46Å; T29-R33 WeakPolarHBondContact O-CB 3.26Å; T29-R33 PolarHBondContact O-N 3.47Å
30	E	84.2	Confident	79.8	Confident	146 Å²	146	96.4 Å²	96.4	68%	0.682	50%	0.495	S	S	*	.	H	α-helix	trans	-61.6	-31.9	179.3	-173.8	164.6	-166.3	0	0	112.1	N34	E30-N34 WeakPolarHBondContact O-CB 3.35Å; E30-N34 VanDerWaalsContact O-CG 3.27Å; E30-N34 PolarHBondContact O-N 2.94Å; E30-N34 PolarHBondContact O-ND2 3.23Å
31	E	86	Confident	81.5	Confident	156 Å²	156	93 Å²	93	73%	0.729	48%	0.483	S	S	*	.	H	α-helix	trans	-67.3	-49.5	174.3	-62.1	179.4	165.3	0	0	111.6	T29 R33 N34 I35	T29-E31 PolarHBondContact O-N 3.37Å; E31-R33 PolarHBondContact O-N 2.84Å; E31-N34 PolarHBondContact O-N 3.22Å; E31-I35 VanDerWaalsContact O-CG1 3.27Å; E31-I35 WeakPolarHBondContact O-CG1 3.42Å; E31-I35 PolarHBondContact O-N 2.99Å
32	E	86.2	Confident	83	Confident	87 Å²	87	91 Å²	91	41%	0.407	47%	0.467	S	S	.	.	H	α-helix	trans	-61.9	-41.9	175.4	-71.2	165.5	127.6	0	0	112.3	L28 T29 I35 I36	L28-E32 HydrophobicContact CB-CB 4.04Å; L28-E32 HydrophobicContact CD2-CB 4Å; L28-E32 HydrophobicContact CD2-CG 4.46Å; T29-E32 WeakPolarHBondContact CB-OE2 3.34Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.49Å; T29-E32 PolarHBondContact N-OE2 2.91Å; T29-E32 PolarHBondContact O-N 3Å; T29-E32 WeakPolarHBondContact OG1-CB 2.98Å; T29-E32 VanDerWaalsContact OG1-CD 3.27Å; T29-E32 VanDerWaalsContact OG1-CG 3.22Å; T29-E32 WeakPolarHBondContact OG1-CG 3.35Å; T29-E32 PolarHBondContact OG1-N 3.02Å; T29-E32 PolarHBondContact OG1-OE2 3.46Å; E32-I35 PolarHBondContact O-N 3.41Å; E32-I36 WeakPolarHBondContact O-CD1 3.46Å; E32-I36 WeakPolarHBondContact O-CG1 3.18Å; E32-I36 PolarHBondContact O-N 3.23Å
33	R	86	Confident	83.9	Confident	88 Å²	88	90.6 Å²	90.6	33%	0.332	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-48.7	175.5	-179.5	-178.9	-59.4	151.5	9.1	111	L25 S26 T29 E31 I35 I36 M37	L25-R33 HydrophobicContact CB-CB 4.39Å; L25-R33 HydrophobicContact CB-CG 3.84Å; L25-R33 HydrophobicContact CD1-CG 3.94Å; L25-R33 PolarHBondContact O-NE 3.38Å; L25-R33 PolarHBondContact O-NH2 3.19Å; S26-R33 PolarHBondContact O-NH2 3.46Å; T29-R33 WeakPolarHBondContact O-CB 3.26Å; T29-R33 PolarHBondContact O-N 3.47Å; E31-R33 PolarHBondContact O-N 2.84Å; R33-I35 VanDerWaalsContact C-N 3.33Å; R33-I35 PolarHBondContact O-N 2.86Å; R33-I36 PolarHBondContact O-N 3.25Å; R33-M37 HydrophobicContact CG-SD 4.08Å; R33-M37 WeakPolarHBondContact O-CB 3.4Å; R33-M37 WeakPolarHBondContact O-CG 3.34Å; R33-M37 PolarHBondContact O-N 3.43Å
34	N	87	Confident	84.6	Confident	88 Å²	88	93.7 Å²	93.7	47%	0.471	47%	0.468	S	S	.	.	H	α-helix	trans	-63.3	-38.5	178.1	-78.7	-46.1	0	0	0	111.9	E30 E31 A38	E30-N34 WeakPolarHBondContact O-CB 3.35Å; E30-N34 VanDerWaalsContact O-CG 3.27Å; E30-N34 PolarHBondContact O-N 2.94Å; E30-N34 PolarHBondContact O-ND2 3.23Å; E31-N34 PolarHBondContact O-N 3.22Å; N34-A38 WeakPolarHBondContact O-CB 3.42Å; N34-A38 PolarHBondContact O-N 2.88Å
35	I	86.1	Confident	85.3	Confident	109 Å²	109	93.2 Å²	93.2	56%	0.559	46%	0.462	S	S	*	.	H	α-helix	trans	-62.2	-47	174.2	-70.6	163.3	0	0	0	111.1	E31 E32 R33 A38 V39	E31-I35 VanDerWaalsContact O-CG1 3.27Å; E31-I35 WeakPolarHBondContact O-CG1 3.42Å; E31-I35 PolarHBondContact O-N 2.99Å; E32-I35 PolarHBondContact O-N 3.41Å; R33-I35 VanDerWaalsContact C-N 3.33Å; R33-I35 PolarHBondContact O-N 2.86Å; I35-A38 CarbonylContact O-C 3.6Å; I35-A38 PolarHBondContact O-N 3.45Å; I35-V39 WeakPolarHBondContact O-CG2 3.38Å; I35-V39 PolarHBondContact O-N 2.94Å
36	I	85.7	Confident	85.4	Confident	59 Å²	59	98.2 Å²	98.2	30%	0.303	49%	0.485	S	S	.	.	H	α-helix	trans	-69	-41.7	-177.6	-68.3	160.2	0	0	0	111.1	L25 L28 E32 R33 V39 M40	L25-I36 HydrophobicContact CD1-CB 4.03Å; L25-I36 HydrophobicContact CD1-CG2 3.76Å; L25-I36 HydrophobicContact CD2-CD1 4.42Å; L25-I36 HydrophobicContact CD2-CG2 3.89Å; L28-I36 HydrophobicContact CD1-CD1 3.64Å; L28-I36 HydrophobicContact CD2-CD1 4.45Å; E32-I36 WeakPolarHBondContact O-CD1 3.46Å; E32-I36 WeakPolarHBondContact O-CG1 3.18Å; E32-I36 PolarHBondContact O-N 3.23Å; R33-I36 PolarHBondContact O-N 3.25Å; I36-V39 PolarHBondContact O-N 2.94Å; I36-V39 VanDerWaalsContact O-N 3.13Å; I36-M40 PolarHBondContact O-N 2.91Å
37	M	86.3	Confident	85.7	Confident	82 Å²	82	100.4 Å²	100.4	40%	0.404	49%	0.487	S	S	.	.	H	α-helix	trans	-59.2	-47.1	171.6	-71.5	-178.7	64.5	0	0	111.3	L25 R33 V39 M40 D41	L25-M37 HydrophobicContact CD1-CG 3.91Å; R33-M37 HydrophobicContact CG-SD 4.08Å; R33-M37 WeakPolarHBondContact O-CB 3.4Å; R33-M37 WeakPolarHBondContact O-CG 3.34Å; R33-M37 PolarHBondContact O-N 3.43Å; M37-V39 PolarHBondContact O-N 3.46Å; M37-V39 VanDerWaalsContact O-N 3.11Å; M37-M40 PolarHBondContact O-N 2.85Å; M37-M40 VanDerWaalsContact O-N 3.09Å; M37-D41 PolarHBondContact O-N 3.17Å
38	A	88.9	Confident	85.8	Confident	45 Å²	45	99.7 Å²	99.7	37%	0.372	48%	0.484	S	S	.	.	H	α-helix	trans	-69.7	-4.6	177	0	0	0	0	0	114.8	N34 I35 R42	N34-A38 WeakPolarHBondContact O-CB 3.42Å; N34-A38 PolarHBondContact O-N 2.88Å; I35-A38 CarbonylContact O-C 3.6Å; I35-A38 PolarHBondContact O-N 3.45Å; A38-R42 PolarHBondContact O-NE 2.88Å; A38-R42 VanDerWaalsContact O-NE 3.11Å; A38-R42 PolarHBondContact O-NH2 3.34Å
39	V	88	Confident	86.2	Confident	73 Å²	73	102.8 Å²	102.8	44%	0.442	50%	0.496	S	S	.	.	H	α-helix	trans	-93.8	-45.6	165.6	168.6	0	0	0	0	110.2	I35 I36 M37 R42 Q43	I35-V39 WeakPolarHBondContact O-CG2 3.38Å; I35-V39 PolarHBondContact O-N 2.94Å; I36-V39 PolarHBondContact O-N 2.94Å; I36-V39 VanDerWaalsContact O-N 3.13Å; M37-V39 PolarHBondContact O-N 3.46Å; M37-V39 VanDerWaalsContact O-N 3.11Å; V39-R42 WeakPolarHBondContact O-CB 3.05Å; V39-R42 PolarHBondContact O-N 3.14Å; V39-Q43 PolarHBondContact O-N 3.33Å
40	M	86	Confident	85.8	Confident	70 Å²	70	105.2 Å²	105.2	35%	0.345	50%	0.502	S	S	.	.	H	α-helix	trans	-60.8	-44.7	176.7	-71.4	-168.9	70.1	0	0	112.7	L22 P23 I36 M37 R42 Q43 K44	L22-M40 HydrophobicContact CD2-CE 4.16Å; L22-M40 HydrophobicContact CD2-SD 4.48Å; P23-M40 HydrophobicContact CG-CE 4.25Å; P23-M40 HydrophobicContact CG-SD 3.68Å; I36-M40 PolarHBondContact O-N 2.91Å; M37-M40 PolarHBondContact O-N 2.85Å; M37-M40 VanDerWaalsContact O-N 3.09Å; M40-R42 PolarHBondContact O-N 3.49Å; M40-Q43 PolarHBondContact O-N 3.06Å; M40-K44 WeakPolarHBondContact O-CB 3.22Å; M40-K44 PolarHBondContact O-N 2.92Å
41	D	87.7	Confident	85.6	Confident	99 Å²	99	102.9 Å²	102.9	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-61.7	-34.7	176.2	-75.5	-34.7	0	0	0	111.7	M37 E45	M37-D41 PolarHBondContact O-N 3.17Å; D41-E45 WeakPolarHBondContact O-CB 3.14Å; D41-E45 PolarHBondContact O-N 3.38Å
42	R	87.8	Confident	85.5	Confident	144 Å²	144	97.6 Å²	97.6	54%	0.543	48%	0.475	S	S	.	.	H	α-helix	trans	-74.1	-42.8	179.6	-144.4	-177.9	-48.1	166.2	10.3	111.9	A38 V39 M40 K44 E45 E46	A38-R42 PolarHBondContact O-NE 2.88Å; A38-R42 VanDerWaalsContact O-NE 3.11Å; A38-R42 PolarHBondContact O-NH2 3.34Å; V39-R42 WeakPolarHBondContact O-CB 3.05Å; V39-R42 PolarHBondContact O-N 3.14Å; M40-R42 PolarHBondContact O-N 3.49Å; R42-K44 VanDerWaalsContact C-N 3.29Å; R42-K44 PolarHBondContact O-N 2.88Å; R42-E45 PolarHBondContact O-N 3.47Å; R42-E46 PolarHBondContact O-N 2.92Å
43	Q	86.4	Confident	84.8	Confident	126 Å²	126	99.1 Å²	99.1	59%	0.589	48%	0.483	S	S	*	.	H	α-helix	trans	-60.2	-41.6	172.6	-175.8	-175.8	-36.1	0	0	110.7	V39 M40 E46 E47	V39-Q43 PolarHBondContact O-N 3.33Å; M40-Q43 PolarHBondContact O-N 3.06Å; Q43-E46 PolarHBondContact O-N 3.34Å; Q43-E47 WeakPolarHBondContact O-CB 3.47Å; Q43-E47 PolarHBondContact O-N 2.85Å
44	K	86.8	Confident	84.2	Confident	131 Å²	131	100.2 Å²	100.2	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-65.7	-39.7	174.3	-176.9	-177.4	174	-171.3	0	112.5	M40 R42 E46 E47 E48	M40-K44 WeakPolarHBondContact O-CB 3.22Å; M40-K44 PolarHBondContact O-N 2.92Å; R42-K44 VanDerWaalsContact C-N 3.29Å; R42-K44 PolarHBondContact O-N 2.88Å; K44-E46 VanDerWaalsContact C-N 3.31Å; K44-E46 PolarHBondContact O-N 3.17Å; K44-E47 PolarHBondContact O-N 3.22Å; K44-E48 WeakPolarHBondContact O-CB 3.45Å; K44-E48 PolarHBondContact O-N 3.11Å
45	E	88.2	Confident	83.7	Confident	104 Å²	104	101.5 Å²	101.5	49%	0.486	50%	0.496	S	S	.	.	H	α-helix	trans	-66.1	-32.7	174.9	-155.4	-155.6	154.7	0	0	111.9	D41 R42 K49	D41-E45 WeakPolarHBondContact O-CB 3.14Å; D41-E45 PolarHBondContact O-N 3.38Å; R42-E45 PolarHBondContact O-N 3.47Å; E45-K49 WeakPolarHBondContact O-CB 3.41Å; E45-K49 VanDerWaalsContact O-CD 3.22Å; E45-K49 WeakPolarHBondContact O-CD 3.12Å; E45-K49 WeakPolarHBondContact O-CG 3.37Å; E45-K49 PolarHBondContact O-N 2.9Å; E45-K49 VanDerWaalsContact O-N 3.17Å; E45-K49 WeakPolarHBondContact OE1-CE 3.18Å; E45-K49 IonicContact OE1-NZ 2.66Å; E45-K49 PolarHBondContact OE1-NZ 3.35Å; E45-K49 IonicContact OE2-NZ 3.42Å; E45-K49 PolarHBondContact OE2-NZ 2.94Å
46	E	81.9	Confident	82.9	Confident	127 Å²	127	99.6 Å²	99.6	59%	0.593	49%	0.492	S	S	*	.	H	α-helix	trans	-72.6	-44	171.6	-71.9	-172.6	140	0	0	112	R42 Q43 K44 E48 K49 E50	R42-E46 PolarHBondContact O-N 2.92Å; Q43-E46 PolarHBondContact O-N 3.34Å; K44-E46 VanDerWaalsContact C-N 3.31Å; K44-E46 PolarHBondContact O-N 3.17Å; E46-E48 PolarHBondContact O-N 3.09Å; E46-K49 WeakPolarHBondContact O-CB 3.48Å; E46-K49 PolarHBondContact O-N 2.86Å; E46-K49 VanDerWaalsContact O-N 3.14Å; E46-E50 PolarHBondContact O-N 3.35Å
47	E	83.1	Confident	82	Confident	118 Å²	118	101 Å²	101	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-61.3	-41.3	175.8	-170.7	171.6	-170.9	0	0	111.8	Q43 K44 E50 E51	Q43-E47 WeakPolarHBondContact O-CB 3.47Å; Q43-E47 PolarHBondContact O-N 2.85Å; K44-E47 PolarHBondContact O-N 3.22Å; E47-E50 PolarHBondContact O-N 3.38Å; E47-E51 WeakPolarHBondContact O-CB 3.32Å; E47-E51 PolarHBondContact O-N 3.42Å
48	E	85.3	Confident	81.1	Confident	129 Å²	129	101.7 Å²	101.7	60%	0.603	51%	0.512	S	S	*	.	H	α-helix	trans	-66.8	-35.3	174	-172.7	171.4	-179	0	0	112.2	K44 E46 A52	K44-E48 WeakPolarHBondContact O-CB 3.45Å; K44-E48 PolarHBondContact O-N 3.11Å; E46-E48 PolarHBondContact O-N 3.09Å; E48-A52 WeakPolarHBondContact O-CB 3.38Å; E48-A52 PolarHBondContact O-N 2.66Å
49	K	85.7	Confident	80.1	Confident	100 Å²	100	107.5 Å²	107.5	44%	0.435	52%	0.524	S	S	.	.	H	α-helix	trans	-67	-40.9	172.6	-75.2	162.4	-167.5	158.6	0	112.1	E45 E46 A52 M53	E45-K49 WeakPolarHBondContact O-CB 3.41Å; E45-K49 VanDerWaalsContact O-CD 3.22Å; E45-K49 WeakPolarHBondContact O-CD 3.12Å; E45-K49 WeakPolarHBondContact O-CG 3.37Å; E45-K49 PolarHBondContact O-N 2.9Å; E45-K49 VanDerWaalsContact O-N 3.17Å; E45-K49 WeakPolarHBondContact OE1-CE 3.18Å; E45-K49 IonicContact OE1-NZ 2.66Å; E45-K49 PolarHBondContact OE1-NZ 3.35Å; E45-K49 IonicContact OE2-NZ 3.42Å; E45-K49 PolarHBondContact OE2-NZ 2.94Å; E46-K49 WeakPolarHBondContact O-CB 3.48Å; E46-K49 PolarHBondContact O-N 2.86Å; E46-K49 VanDerWaalsContact O-N 3.14Å; K49-A52 PolarHBondContact O-N 3.42Å; K49-M53 WeakPolarHBondContact O-CG 3.44Å; K49-M53 PolarHBondContact O-N 2.8Å
50	E	78.1	Confident	78.8	Confident	128 Å²	128	109 Å²	109	60%	0.598	53%	0.529	S	S	*	.	H	α-helix	trans	-64.3	-45.5	174.4	-70	-154	142.5	0	0	111.2	E46 E47 A52 M53 L54	E46-E50 PolarHBondContact O-N 3.35Å; E47-E50 PolarHBondContact O-N 3.38Å; E50-A52 VanDerWaalsContact C-N 3.33Å; E50-A52 PolarHBondContact O-N 3.11Å; E50-M53 HydrophobicContact CG-CE 4.4Å; E50-M53 PolarHBondContact O-N 2.94Å; E50-L54 WeakPolarHBondContact O-CB 3.44Å; E50-L54 WeakPolarHBondContact O-CG 3.47Å; E50-L54 PolarHBondContact O-N 3.34Å
51	E	81	Confident	77.3	Confident	97 Å²	97	112.5 Å²	112.5	45%	0.453	55%	0.546	S	S	.	.	H	α-helix	trans	-64.6	-37	177.2	-151.9	-148.3	171.4	0	0	111.8	E47 L54 K55	E47-E51 WeakPolarHBondContact O-CB 3.32Å; E47-E51 PolarHBondContact O-N 3.42Å; E51-L54 PolarHBondContact O-N 3.47Å; E51-K55 WeakPolarHBondContact O-CB 3.49Å; E51-K55 VanDerWaalsContact O-CG 3.26Å; E51-K55 WeakPolarHBondContact O-CG 3.4Å; E51-K55 PolarHBondContact O-N 2.99Å; E51-K55 WeakPolarHBondContact OE1-CE 3.35Å; E51-K55 IonicContact OE1-NZ 2.77Å; E51-K55 PolarHBondContact OE1-NZ 3.33Å; E51-K55 IonicContact OE2-NZ 2.61Å; E51-K55 PolarHBondContact OE2-NZ 3.29Å
52	A	82.3	Confident	75.8	Confident	46 Å²	46	111.5 Å²	111.5	38%	0.38	55%	0.552	S	S	.	*	H	α-helix	trans	-65.9	-40.2	173.7	0	0	0	0	0	112.5	E48 K49 E50 C56	E48-A52 WeakPolarHBondContact O-CB 3.38Å; E48-A52 PolarHBondContact O-N 2.66Å; K49-A52 PolarHBondContact O-N 3.42Å; E50-A52 VanDerWaalsContact C-N 3.33Å; E50-A52 PolarHBondContact O-N 3.11Å; A52-C56 PolarHBondContact O-N 2.85Å; A52-C56 PolarHBondContact O-SG 2.85Å
53	M	72.2	Confident	73.8	Confident	119 Å²	119	112.4 Å²	112.4	59%	0.586	56%	0.56	S	S	*	*	H	α-helix	trans	-64.6	-44.2	172.6	-75.5	-169.1	-67.8	0	0	111.6	K49 E50 C56 V57	K49-M53 WeakPolarHBondContact O-CG 3.44Å; K49-M53 PolarHBondContact O-N 2.8Å; E50-M53 HydrophobicContact CG-CE 4.4Å; E50-M53 PolarHBondContact O-N 2.94Å; M53-C56 PolarHBondContact O-N 3.27Å; M53-V57 WeakPolarHBondContact O-CG2 3.5Å; M53-V57 PolarHBondContact O-N 3.24Å
54	L	72.9	Confident	71.6	Confident	110 Å²	110	112.3 Å²	112.3	58%	0.576	57%	0.571	S	S	*	*	H	α-helix	trans	-58.5	-48.3	174.3	-82.7	157.9	0	0	0	111.6	E50 E51 C56 V57 V58	E50-L54 WeakPolarHBondContact O-CB 3.44Å; E50-L54 WeakPolarHBondContact O-CG 3.47Å; E50-L54 PolarHBondContact O-N 3.34Å; E51-L54 PolarHBondContact O-N 3.47Å; L54-C56 VanDerWaalsContact C-N 3.31Å; L54-C56 PolarHBondContact O-N 3.29Å; L54-V57 PolarHBondContact O-N 2.94Å; L54-V58 WeakPolarHBondContact O-CB 3.37Å; L54-V58 WeakPolarHBondContact O-CG2 3.22Å; L54-V58 PolarHBondContact O-N 3.24Å
55	K	77.4	Confident	69.4	Low	116 Å²	116	111 Å²	111	50%	0.504	58%	0.584	S	S	.	*	H	α-helix	trans	-57.8	-40.5	174.7	-77.2	165.4	177.5	165	0	112.1	E51 R59	E51-K55 WeakPolarHBondContact O-CB 3.49Å; E51-K55 VanDerWaalsContact O-CG 3.26Å; E51-K55 WeakPolarHBondContact O-CG 3.4Å; E51-K55 PolarHBondContact O-N 2.99Å; E51-K55 WeakPolarHBondContact OE1-CE 3.35Å; E51-K55 IonicContact OE1-NZ 2.77Å; E51-K55 PolarHBondContact OE1-NZ 3.33Å; E51-K55 IonicContact OE2-NZ 2.61Å; E51-K55 PolarHBondContact OE2-NZ 3.29Å; K55-R59 WeakPolarHBondContact O-CB 3.44Å; K55-R59 PolarHBondContact O-N 2.86Å
56	C	69.9	Low	67	Low	68 Å²	68	110.9 Å²	110.9	46%	0.459	60%	0.601	S	S	.	*	H	α-helix	trans	-65.2	-48.1	175.4	-69.5	0	0	0	0	112.3	A52 M53 L54 V58 R59 D60	A52-C56 PolarHBondContact O-N 2.85Å; A52-C56 PolarHBondContact O-SG 2.85Å; M53-C56 PolarHBondContact O-N 3.27Å; L54-C56 VanDerWaalsContact C-N 3.31Å; L54-C56 PolarHBondContact O-N 3.29Å; C56-V58 PolarHBondContact O-N 3.15Å; C56-R59 PolarHBondContact O-N 2.66Å; C56-D60 PolarHBondContact O-N 2.89Å
57	V	64.9	Low	64.5	Low	89 Å²	89	111 Å²	111	54%	0.539	61%	0.614	S	S	.	*	H	α-helix	trans	-60.8	-44.9	178.6	172.1	0	0	0	0	111.3	M53 L54 R59 D60 M61	M53-V57 WeakPolarHBondContact O-CG2 3.5Å; M53-V57 PolarHBondContact O-N 3.24Å; L54-V57 PolarHBondContact O-N 2.94Å; V57-R59 PolarHBondContact O-N 3.13Å; V57-D60 PolarHBondContact O-N 3.41Å; V57-M61 HydrophobicContact CG1-SD 4.41Å; V57-M61 WeakPolarHBondContact O-CG 3.32Å; V57-M61 PolarHBondContact O-N 2.9Å
58	V	69.4	Low	62.4	Low	97 Å²	97	115.4 Å²	115.4	59%	0.588	63%	0.631	S	S	*	*	H	α-helix	trans	-62	-41.8	176.6	170.9	0	0	0	0	111.4	L54 C56 D60 M61 A62	L54-V58 WeakPolarHBondContact O-CB 3.37Å; L54-V58 WeakPolarHBondContact O-CG2 3.22Å; L54-V58 PolarHBondContact O-N 3.24Å; C56-V58 PolarHBondContact O-N 3.15Å; V58-D60 PolarHBondContact O-N 2.87Å; V58-M61 PolarHBondContact O-N 2.92Å; V58-A62 PolarHBondContact O-N 3.13Å
59	R	65.9	Low	60	Low	167 Å²	167	116 Å²	116	63%	0.63	64%	0.644	S	S	*	*	H	α-helix	trans	-66.3	-37.5	179	-164.9	-170.2	71.2	172.9	-2.5	112.7	K55 C56 V57 A62	K55-R59 WeakPolarHBondContact O-CB 3.44Å; K55-R59 PolarHBondContact O-N 2.86Å; C56-R59 PolarHBondContact O-N 2.66Å; V57-R59 PolarHBondContact O-N 3.13Å; R59-A62 PolarHBondContact O-N 2.94Å
60	D	62.5	Low	57.9	Low	103 Å²	103	117 Å²	117	55%	0.551	66%	0.661	S	S	*	*	H	α-helix	trans	-77.5	-27.3	179	-71.7	-8.2	0	0	0	112.1	C56 V57 V58 A62	C56-D60 PolarHBondContact O-N 2.89Å; V57-D60 PolarHBondContact O-N 3.41Å; V58-D60 PolarHBondContact O-N 2.87Å; D60-A62 VanDerWaalsContact C-N 3.29Å; D60-A62 PolarHBondContact O-N 3.04Å
61	M	53	Low	55.9	Low	144 Å²	144	122.9 Å²	122.9	71%	0.709	68%	0.678	S	S	*	*	H	α-helix	trans	-67.4	-24.9	168	-74.3	-172.9	127.2	0	0	113.7	V57 V58 K63	V57-M61 HydrophobicContact CG1-SD 4.41Å; V57-M61 WeakPolarHBondContact O-CG 3.32Å; V57-M61 PolarHBondContact O-N 2.9Å; V58-M61 PolarHBondContact O-N 2.92Å; M61-K63 VanDerWaalsContact C-N 3.3Å; M61-K63 PolarHBondContact O-N 2.92Å
62	A	57.4	Low	53.6	Low	79 Å²	79	125.6 Å²	125.6	65%	0.653	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	3.4	-175.8	0	0	0	0	0	114.9	V58 R59 D60 P64	V58-A62 PolarHBondContact O-N 3.13Å; R59-A62 PolarHBondContact O-N 2.94Å; D60-A62 VanDerWaalsContact C-N 3.29Å; D60-A62 PolarHBondContact O-N 3.04Å; A62-P64 WeakPolarHBondContact O-CD 3.27Å
63	K	44.6	Very low	51.5	Low	162 Å²	162	128.4 Å²	128.4	70%	0.704	72%	0.718	S	S	*	*			trans	-110.5	106.3	-166.7	-131.3	172.9	-172.4	174.4	0	113.2	M61	M61-K63 VanDerWaalsContact C-N 3.3Å; M61-K63 PolarHBondContact O-N 2.92Å
64	P	41.4	Very low	49.8	Very low	125 Å²	125	131 Å²	131	81%	0.812	73%	0.729	S	S	*	*			trans	-71.8	130.7	176.3	28.8	-33.6	0	0	0	111.4	A62	A62-P64 WeakPolarHBondContact O-CD 3.27Å
65	A	39.4	Very low	48.1	Very low	103 Å²	103	131 Å²	131	85%	0.851	74%	0.738	S	S	*	*			trans	-83	123	-176.3	0	0	0	0	0	112.7
66	A	38.8	Very low	46.2	Very low	101 Å²	101	134 Å²	134	84%	0.835	75%	0.754	S	S	*	*			trans	-112	118	173.4	0	0	0	0	0	111
67	C	30.2	Very low	44.8	Very low	129 Å²	129	135 Å²	135	87%	0.872	76%	0.76	S	S	*	*			trans	-84.5	132.4	-177.6	-61.9	0	0	0	0	112.6
68	K	38.7	Very low	43.4	Very low	211 Å²	211	139.5 Å²	139.5	92%	0.917	77%	0.774	S	S	*	*			trans	-140	145.3	161.1	-72.7	-169.5	177.3	179.4	0	111.4
69	T	35.3	Very low	41.8	Very low	141 Å²	141	143.3 Å²	143.3	87%	0.865	79%	0.786	S	S	*	*			trans	-114	146	-173.4	-3.5	0	0	0	0	111.8
70	P	41.1	Very low	40.8	Very low	123 Å²	123	140.2 Å²	140.2	80%	0.799	79%	0.787	S	S	*	*			trans	-103.1	165.5	161.8	34.7	-27.1	0	0	0	113.1
71	R	36.5	Very low	39.8	Very low	250 Å²	250	140.2 Å²	140.2	94%	0.943	79%	0.793	S	S	*	*			trans	-106.3	172.6	-174.8	-85.8	178.9	166	176.6	-5	113.5
72	N	32.5	Very low	38.8	Very low	155 Å²	155	140.7 Å²	140.7	83%	0.829	80%	0.798	S	S	*	*			trans	-61.3	145.6	-179.6	-61.3	-10.8	0	0	0	114.8
73	A	38.3	Very low	37.6	Very low	104 Å²	104	143 Å²	143	86%	0.86	80%	0.799	S	S	*	*			trans	-137.5	160.2	151.6	0	0	0	0	0	107.6
74	E	35	Very low	36.9	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	80%	0.804	S	S	*	*			trans	-141.2	-177.4	-157.7	-154.9	158.4	106.5	0	0	114.5
75	S	37.3	Very low	36.3	Very low	109 Å²	109	145.7 Å²	145.7	76%	0.762	80%	0.804	S	S	*	*			trans	75.1	156.4	-175.9	80.6	0	0	0	0	116.4
76	Q	38.8	Very low	36.1	Very low	180 Å²	180	151.7 Å²	151.7	84%	0.841	81%	0.805	S	S	*	*			cis	-149.5	167.1	-45	-105.1	-132.4	14.9	0	0	108.8
77	P	39.3	Very low	35.5	Very low	89 Å²	89	152.2 Å²	152.2	58%	0.578	80%	0.801	S	S	*	*			trans	-106.6	171.9	-155.6	40.6	-36.5	0	0	0	116
78	H	35.9	Very low	35.6	Very low	183 Å²	183	152 Å²	152	85%	0.847	80%	0.796	S	S	*	*				-174.4	179.2	120.8	-93.4	-56.6	0	0	0	112.7
79	Q	35.7	Very low	35.1	Very low	177 Å²	177	147.6 Å²	147.6	83%	0.827	79%	0.79	S	S	*	*			trans	-155.8	173	-160.7	-119.6	-163	16	0	0	110.8
80	P	46.4	Very low	34.9	Very low	102 Å²	102	146.6 Å²	146.6	66%	0.662	78%	0.783	S	S	*	*			cis	-114	-99.5	-23.7	17.7	7.3	0	0	0	110.1
81	P	40.6	Very low	34.5	Very low	103 Å²	103	146.3 Å²	146.3	67%	0.669	78%	0.782	S	S	*	*				-130.1	176.1	-53.4	39.9	-23.6	0	0	0	116.9
82	L	32.1	Very low	34.4	Very low	155 Å²	155	146.2 Å²	146.2	81%	0.812	78%	0.781	S	S	*	*			trans	84.6	125.4	158.5	-59.2	-173.2	0	0	0	122.4
83	N	31.1	Very low	34.3	Very low	128 Å²	128	147.9 Å²	147.9	68%	0.684	78%	0.781	S	S	*	*			trans	74.9	118.5	149.3	-74.8	4.1	0	0	0	122.9
84	I	29.9	Very low	33.9	Very low	156 Å²	156	147.8 Å²	147.8	80%	0.8	77%	0.772	S	S	*	*			trans	65	75	144.9	-48	168.7	0	0	0	115.9
85	F	30.3	Very low	33.8	Very low	186 Å²	186	144.9 Å²	144.9	82%	0.816	77%	0.771	S	S	*	*			trans	-123.3	132.9	153.7	-74.8	-103.1	0	0	0	106.9
86	R	34	Very low	33.6	Very low	229 Å²	229	144.5 Å²	144.5	86%	0.864	77%	0.768	S	S	*	*				73.6	137.9	51.4	-164.7	175.8	-173	166.5	3.1	111.5
87	C	26	Very low	33.2	Very low	113 Å²	113	143.5 Å²	143.5	76%	0.764	76%	0.763	S	S	*	*			trans	-47.9	135.1	-176	-177.4	0	0	0	0	113.9
88	V	32.1	Very low	32.9	Very low	125 Å²	125	145.6 Å²	145.6	76%	0.758	77%	0.765	S	S	*	*			trans	-162	140.8	133.2	134.4	0	0	0	0	109.2	V90	V88-V90 HydrophobicContact CG1-CG2 4.16Å
89	C	28.5	Very low	32.9	Very low	117 Å²	117	140.3 Å²	140.3	79%	0.791	76%	0.76	S	S	*	*			trans	-72.7	127.9	173.9	-58.5	0	0	0	0	110.6
90	V	32	Very low	33.1	Very low	120 Å²	120	133.1 Å²	133.1	73%	0.727	73%	0.734	S	S	*	*			trans	-123.4	113.3	167.6	-176.8	0	0	0	0	108.4	V88 R92	V88-V90 HydrophobicContact CG1-CG2 4.16Å; V90-R92 PolarHBondContact O-N 3.26Å; V90-R92 VanDerWaalsContact O-N 3.15Å
91	P	31.8	Very low	33.2	Very low	118 Å²	118	133.1 Å²	133.1	77%	0.766	73%	0.734	S	S	*	*			trans	-73.3	109.4	-172.8	28.3	-33.9	0	0	0	111.1	K93	P91-K93 PolarHBondContact O-N 3.48Å
92	R	34	Very low	33.9	Very low	247 Å²	247	134 Å²	134	93%	0.932	73%	0.732	S	S	*	*			trans	-72.3	110.9	161.4	-80.2	-171.1	166.8	-164.8	-4.4	108.2	V90	V90-R92 PolarHBondContact O-N 3.26Å; V90-R92 VanDerWaalsContact O-N 3.15Å
93	K	31.8	Very low	35.1	Very low	190 Å²	190	132.1 Å²	132.1	83%	0.826	72%	0.715	S	S	*	*			trans	-41.1	137.8	-175.4	-65.5	-178.5	175.3	-176.5	0	112.8	P91 S95	P91-K93 PolarHBondContact O-N 3.48Å; K93-S95 PolarHBondContact O-N 2.64Å; K93-S95 VanDerWaalsContact O-N 3.09Å
94	P	30.3	Very low	36.7	Very low	103 Å²	103	128.6 Å²	128.6	67%	0.669	70%	0.696	S	S	*	*			trans	-66.4	109.9	174.5	28.1	-33.5	0	0	0	110	S96	P94-S96 PolarHBondContact O-N 2.89Å
95	S	32.6	Very low	38.6	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	69%	0.687	S	S	*	*			trans	-80.6	65.2	174.4	62.3	0	0	0	0	111.4	K93 E97	K93-S95 PolarHBondContact O-N 2.64Å; K93-S95 VanDerWaalsContact O-N 3.09Å; S95-E97 PolarHBondContact O-N 3.37Å
96	S	32	Very low	40.8	Very low	101 Å²	101	128.1 Å²	128.1	71%	0.706	68%	0.679	S	S	*	*	S	Bend	trans	45.3	64.8	150.6	67.7	0	0	0	0	118.5	P94	P94-S96 PolarHBondContact O-N 2.89Å
97	E	31.6	Very low	42.7	Very low	158 Å²	158	119 Å²	119	74%	0.738	65%	0.647	S	S	*	*				-124.9	66.1	129.2	-83.1	-143.6	113.4	0	0	108.5	S95 G99 R103	S95-E97 PolarHBondContact O-N 3.37Å; E97-G99 PolarHBondContact O-N 3.49Å; E97-R103 VanDerWaalsContact CD-NH2 3.32Å; E97-R103 IonicContact OE1-CZ 3.93Å; E97-R103 IonicContact OE1-NH1 2.65Å; E97-R103 PolarHBondContact OE1-NH1 2.8Å; E97-R103 VanDerWaalsContact OE1-NH1 3.11Å; E97-R103 IonicContact OE1-NH2 3.24Å; E97-R103 PolarHBondContact OE1-NH2 3.35Å
98	E	32.9	Very low	45.2	Very low	134 Å²	134	117.2 Å²	117.2	63%	0.626	63%	0.627	S	S	*	*			trans	-64.6	125.6	166.2	-66.3	-158.8	158.1	0	0	109.2	G100 R103	E98-G100 PolarHBondContact O-N 3.17Å; E98-R103 PolarHBondContact O-NE 3.01Å
99	G	35.4	Very low	47.6	Very low	71 Å²	71	116.6 Å²	116.6	73%	0.732	62%	0.616	S	S	*	*			trans	-83.3	20.3	167.7	0	0	0	0	0	112.7	E97	E97-G99 PolarHBondContact O-N 3.49Å
100	G	39.7	Very low	49.9	Very low	27 Å²	27	116.2 Å²	116.2	28%	0.278	60%	0.603	S	S	.	*	S	Bend	trans	-71.5	-177.7	-177	0	0	0	0	0	113.9	E98 D102 R103	E98-G100 PolarHBondContact O-N 3.17Å; G100-D102 PolarHBondContact O-N 3.26Å; G100-R103 PolarHBondContact O-N 3.03Å
101	P	47.7	Very low	52.3	Low	101 Å²	101	111 Å²	111	66%	0.656	57%	0.57	S	S	*	*	H	α-helix	trans	-56.6	-24.4	-173.8	22	-33.7	0	0	0	113.7	R103 N104 W105	P101-R103 VanDerWaalsContact C-N 3.26Å; P101-R103 PolarHBondContact O-N 2.82Å; P101-N104 CarbonylContact O-C 3.51Å; P101-N104 WeakPolarHBondContact O-CA 3.42Å; P101-N104 WeakPolarHBondContact O-CB 3.38Å; P101-N104 PolarHBondContact O-N 2.94Å; P101-W105 PolarHBondContact O-N 2.98Å
102	D	56.4	Low	54.8	Low	121 Å²	121	109.7 Å²	109.7	65%	0.647	55%	0.554	S	S	*	*	H	α-helix	trans	-58	-32.5	176.3	-156.7	22.1	0	0	0	113.2	G100 R106	G100-D102 PolarHBondContact O-N 3.26Å; D102-R106 VanDerWaalsContact O-CB 3.25Å; D102-R106 WeakPolarHBondContact O-CB 3.25Å; D102-R106 PolarHBondContact O-N 3.39Å
103	R	58.1	Low	57.2	Low	117 Å²	117	101.6 Å²	101.6	44%	0.442	54%	0.535	S	S	.	.	H	α-helix	trans	-68.3	-38.7	170.8	-70.9	-163	-177.5	-135.8	-24.6	112.3	E97 E98 G100 P101 L107	E97-R103 VanDerWaalsContact CD-NH2 3.32Å; E97-R103 IonicContact OE1-CZ 3.93Å; E97-R103 IonicContact OE1-NH1 2.65Å; E97-R103 PolarHBondContact OE1-NH1 2.8Å; E97-R103 VanDerWaalsContact OE1-NH1 3.11Å; E97-R103 IonicContact OE1-NH2 3.24Å; E97-R103 PolarHBondContact OE1-NH2 3.35Å; E98-R103 PolarHBondContact O-NE 3.01Å; G100-R103 PolarHBondContact O-N 3.03Å; P101-R103 VanDerWaalsContact C-N 3.26Å; P101-R103 PolarHBondContact O-N 2.82Å; R103-L107 WeakPolarHBondContact O-CG 3.31Å; R103-L107 PolarHBondContact O-N 2.63Å; R103-L107 VanDerWaalsContact O-N 3.08Å
104	N	62.8	Low	59.6	Low	54 Å²	54	95.2 Å²	95.2	29%	0.289	51%	0.506	S	S	.	.	H	α-helix	trans	-71.3	-43.8	-179.7	-167.9	10.1	0	0	0	111	P101 R106 L107 H108 S198	P101-N104 CarbonylContact O-C 3.51Å; P101-N104 WeakPolarHBondContact O-CA 3.42Å; P101-N104 WeakPolarHBondContact O-CB 3.38Å; P101-N104 PolarHBondContact O-N 2.94Å; N104-R106 PolarHBondContact O-N 3.09Å; N104-L107 PolarHBondContact O-N 2.68Å; N104-H108 PolarHBondContact O-N 3.46Å; N104-H108 PolarHBondContact O-ND1 3.3Å; N104-H108 PolarHBondContact OD1-CE1 3.21Å; N104-H108 PolarHBondContact OD1-ND1 3.39Å; N104-S198 WeakPolarHBondContact OD1-CB 3.43Å
105	W	71.5	Confident	62.1	Low	162 Å²	162	94 Å²	94	61%	0.614	49%	0.49	S	S	*	.	H	α-helix	trans	-55.6	-49.2	170.7	173.6	-108.5	0	0	0	111.6	P101 L107 H108 Q109	P101-W105 PolarHBondContact O-N 2.98Å; W105-L107 VanDerWaalsContact C-N 3.31Å; W105-L107 PolarHBondContact O-N 2.96Å; W105-H108 PolarHBondContact O-N 3.4Å; W105-Q109 WeakPolarHBondContact O-CB 3.3Å; W105-Q109 PolarHBondContact O-N 3.28Å
106	R	76.6	Confident	64.6	Low	170 Å²	170	92.7 Å²	92.7	64%	0.642	47%	0.472	S	S	*	.	H	α-helix	trans	-65.5	-31.5	-179.8	-159.5	172	-166.8	172.7	4.8	113.2	D102 N104 Q110	D102-R106 VanDerWaalsContact O-CB 3.25Å; D102-R106 WeakPolarHBondContact O-CB 3.25Å; D102-R106 PolarHBondContact O-N 3.39Å; N104-R106 PolarHBondContact O-N 3.09Å; R106-Q110 WeakPolarHBondContact O-CB 3.46Å; R106-Q110 WeakPolarHBondContact O-CG 3.26Å; R106-Q110 PolarHBondContact O-N 3.18Å; R106-Q110 VanDerWaalsContact O-N 3.09Å
107	L	74	Confident	66.8	Low	37 Å²	37	93.1 Å²	93.1	19%	0.194	46%	0.463	C	S	.	.	H	α-helix	trans	-69.8	-42.7	171.4	-77.1	169.1	0	0	0	112.2	R103 N104 W105 Q110 F111 I194 K197	R103-L107 WeakPolarHBondContact O-CG 3.31Å; R103-L107 PolarHBondContact O-N 2.63Å; R103-L107 VanDerWaalsContact O-N 3.08Å; N104-L107 PolarHBondContact O-N 2.68Å; W105-L107 VanDerWaalsContact C-N 3.31Å; W105-L107 PolarHBondContact O-N 2.96Å; L107-Q110 CarbonylContact O-C 3.52Å; L107-Q110 PolarHBondContact O-N 2.74Å; L107-F111 PolarHBondContact O-N 2.69Å; L107-I194 HydrophobicContact CB-CG1 4.45Å; L107-I194 HydrophobicContact CB-CG2 4.49Å; L107-K197 HydrophobicContact CD1-CB 3.86Å; L107-K197 HydrophobicContact CD1-CD 4.26Å; L107-K197 HydrophobicContact CD2-CD 4.39Å
108	H	78.1	Confident	69.1	Low	75 Å²	75	86.6 Å²	86.6	35%	0.347	43%	0.434	S	S	.	.	H	α-helix	trans	-65.3	-41.1	174.4	-79.6	83.8	0	0	0	112.3	N104 W105 Q110 F111 E112	N104-H108 PolarHBondContact O-N 3.46Å; N104-H108 PolarHBondContact O-ND1 3.3Å; N104-H108 PolarHBondContact OD1-CE1 3.21Å; N104-H108 PolarHBondContact OD1-ND1 3.39Å; W105-H108 PolarHBondContact O-N 3.4Å; H108-Q110 VanDerWaalsContact C-N 3.3Å; H108-Q110 PolarHBondContact O-N 3.41Å; H108-F111 WeakPolarHBondContact O-CA 3.22Å; H108-F111 VanDerWaalsContact O-CB 3.24Å; H108-F111 WeakPolarHBondContact O-CB 3.1Å; H108-F111 PolarHBondContact O-N 2.78Å; H108-E112 PolarHBondContact O-N 3.28Å
109	Q	81.9	Confident	71.4	Confident	113 Å²	113	86.4 Å²	86.4	53%	0.528	43%	0.427	S	S	.	.	H	α-helix	trans	-62.6	-37.9	174.4	-165.9	179	53.1	0	0	111.6	W105 F111 S113	W105-Q109 WeakPolarHBondContact O-CB 3.3Å; W105-Q109 PolarHBondContact O-N 3.28Å; Q109-F111 PolarHBondContact O-N 2.85Å; Q109-S113 WeakPolarHBondContact O-CB 3.45Å; Q109-S113 PolarHBondContact O-N 2.73Å
110	Q	77.8	Confident	73.5	Confident	108 Å²	108	89.3 Å²	89.3	51%	0.505	42%	0.42	S	S	.	.	H	α-helix	trans	-69.2	-14.4	170	-76.9	-176.4	-6.6	0	0	114	R106 L107 H108 Y114 K190	R106-Q110 WeakPolarHBondContact O-CB 3.46Å; R106-Q110 WeakPolarHBondContact O-CG 3.26Å; R106-Q110 PolarHBondContact O-N 3.18Å; R106-Q110 VanDerWaalsContact O-N 3.09Å; L107-Q110 CarbonylContact O-C 3.52Å; L107-Q110 PolarHBondContact O-N 2.74Å; H108-Q110 VanDerWaalsContact C-N 3.3Å; H108-Q110 PolarHBondContact O-N 3.41Å; Q110-Y114 WeakPolarHBondContact O-CB 3.27Å; Q110-K190 PolarHBondContact O-NZ 2.99Å
111	F	82.2	Confident	75.2	Confident	10 Å²	10	90.4 Å²	90.4	4%	0.044	42%	0.419	C	S	.	.	H	α-helix	trans	-86.5	-52.7	174.4	-168.7	-125	0	0	0	111.7	L107 H108 Q109 S113 Y114 K115 K190 Q191 I194	L107-F111 PolarHBondContact O-N 2.69Å; H108-F111 WeakPolarHBondContact O-CA 3.22Å; H108-F111 VanDerWaalsContact O-CB 3.24Å; H108-F111 WeakPolarHBondContact O-CB 3.1Å; H108-F111 PolarHBondContact O-N 2.78Å; Q109-F111 PolarHBondContact O-N 2.85Å; F111-S113 VanDerWaalsContact C-N 3.33Å; F111-S113 PolarHBondContact O-N 3.06Å; F111-Y114 CarbonylContact O-C 3.57Å; F111-Y114 WeakPolarHBondContact O-CA 3.5Å; F111-Y114 WeakPolarHBondContact O-CB 3.06Å; F111-Y114 PolarHBondContact O-N 2.75Å; F111-K115 HydrophobicContact CD1-CD 4.17Å; F111-K115 HydrophobicContact CE1-CD 4Å; F111-K115 HydrophobicContact CZ-CD 4.46Å; F111-K115 PolarHBondContact O-N 3.49Å; F111-K190 HydrophobicContact CD2-CB 4.34Å; F111-K190 HydrophobicContact CD2-CD 4.19Å; F111-K190 HydrophobicContact CD2-CG 4.17Å; F111-K190 HydrophobicContact CE2-CB 4.29Å; F111-Q191 HydrophobicContact CE1-CB 4.4Å; F111-Q191 HydrophobicContact CE1-CG 4.19Å; F111-Q191 HydrophobicContact CE2-CB 3.92Å; F111-Q191 HydrophobicContact CZ-CB 3.64Å; F111-Q191 HydrophobicContact CZ-CG 3.88Å; F111-I194 HydrophobicContact CB-CD1 3.42Å; F111-I194 VanDerWaalsContact CB-CD1 3.42Å; F111-I194 HydrophobicContact CD1-CD1 4.3Å; F111-I194 HydrophobicContact CD2-CD1 3.44Å; F111-I194 VanDerWaalsContact CD2-CD1 3.44Å; F111-I194 HydrophobicContact CE2-CD1 4.3Å; F111-I194 HydrophobicContact CG-CD1 3.46Å; F111-I194 VanDerWaalsContact CG-CD1 3.46Å
112	E	84.6	Confident	76.3	Confident	91 Å²	91	85.7 Å²	85.7	43%	0.425	39%	0.388	S	S	.	.	H	α-helix	trans	-64.2	-39.1	177.9	-59.4	-49	126.2	0	0	111	H108 Y114 K115 E116	H108-E112 PolarHBondContact O-N 3.28Å; E112-Y114 PolarHBondContact O-N 2.67Å; E112-K115 PolarHBondContact O-N 2.84Å; E112-K115 WeakPolarHBondContact OE1-CD 3.25Å; E112-K115 IonicContact OE1-NZ 3.87Å; E112-K115 PolarHBondContact OE1-NZ 3.1Å; E112-K115 WeakPolarHBondContact OE2-CD 3.04Å; E112-K115 IonicContact OE2-NZ 2.67Å; E112-K115 PolarHBondContact OE2-NZ 3Å; E112-E116 VanDerWaalsContact O-CB 3.25Å; E112-E116 WeakPolarHBondContact O-CB 3.45Å; E112-E116 PolarHBondContact O-N 3.45Å
113	S	83.7	Confident	77.2	Confident	77 Å²	77	81.9 Å²	81.9	54%	0.538	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-29.8	170.5	176	0	0	0	0	113.2	Q109 F111 Q117	Q109-S113 WeakPolarHBondContact O-CB 3.45Å; Q109-S113 PolarHBondContact O-N 2.73Å; F111-S113 VanDerWaalsContact C-N 3.33Å; F111-S113 PolarHBondContact O-N 3.06Å; S113-Q117 WeakPolarHBondContact O-CB 3.13Å; S113-Q117 PolarHBondContact O-N 2.78Å
114	Y	81	Confident	77.9	Confident	56 Å²	56	79.8 Å²	79.8	22%	0.22	36%	0.362	C	S	.	.	H	α-helix	trans	-83.3	-39.5	178.6	-178.4	-113.5	0	0	0	112.4	Q110 F111 E112 E116 Q117 V118 N186 L187 K190	Q110-Y114 WeakPolarHBondContact O-CB 3.27Å; F111-Y114 CarbonylContact O-C 3.57Å; F111-Y114 WeakPolarHBondContact O-CA 3.5Å; F111-Y114 WeakPolarHBondContact O-CB 3.06Å; F111-Y114 PolarHBondContact O-N 2.75Å; E112-Y114 PolarHBondContact O-N 2.67Å; Y114-E116 VanDerWaalsContact C-N 3.3Å; Y114-E116 PolarHBondContact O-N 3.24Å; Y114-Q117 PolarHBondContact O-N 2.67Å; Y114-V118 HydrophobicContact CE1-CG2 4.41Å; Y114-V118 HydrophobicContact CE2-CG2 4.34Å; Y114-V118 WeakPolarHBondContact O-CB 3.32Å; Y114-V118 WeakPolarHBondContact O-CG2 3.01Å; Y114-V118 PolarHBondContact O-N 3.13Å; Y114-N186 HydrophobicContact CE1-CB 4.44Å; Y114-L187 HydrophobicContact CD1-CD1 4.28Å; Y114-L187 HydrophobicContact CE1-CD1 3.91Å; Y114-K190 HydrophobicContact CD1-CD 3.77Å; Y114-K190 HydrophobicContact CE1-CD 4.33Å; Y114-K190 HydrophobicContact CG-CD 4.22Å
115	K	83.2	Confident	77.9	Confident	78 Å²	78	77.5 Å²	77.5	34%	0.339	35%	0.35	S	S	.	.	H	α-helix	trans	-54.8	-47.6	166.4	-81.5	164.1	151.8	-178.5	0	110.8	F111 E112 V118 R119 L187	F111-K115 HydrophobicContact CD1-CD 4.17Å; F111-K115 HydrophobicContact CE1-CD 4Å; F111-K115 HydrophobicContact CZ-CD 4.46Å; F111-K115 PolarHBondContact O-N 3.49Å; E112-K115 PolarHBondContact O-N 2.84Å; E112-K115 WeakPolarHBondContact OE1-CD 3.25Å; E112-K115 IonicContact OE1-NZ 3.87Å; E112-K115 PolarHBondContact OE1-NZ 3.1Å; E112-K115 WeakPolarHBondContact OE2-CD 3.04Å; E112-K115 IonicContact OE2-NZ 2.67Å; E112-K115 PolarHBondContact OE2-NZ 3Å; K115-V118 CarbonylContact O-C 3.47Å; K115-V118 WeakPolarHBondContact O-CB 3.45Å; K115-V118 PolarHBondContact O-N 2.89Å; K115-R119 PolarHBondContact O-N 3.4Å; K115-L187 HydrophobicContact CG-CD2 4.21Å
116	E	84.7	Confident	77.6	Confident	85 Å²	85	77.5 Å²	77.5	40%	0.397	35%	0.35	S	S	.	.	H	α-helix	trans	-67	-40.1	-179.5	178.2	55.5	-162.4	0	0	111.8	E112 Y114 V118 R119 K120	E112-E116 VanDerWaalsContact O-CB 3.25Å; E112-E116 WeakPolarHBondContact O-CB 3.45Å; E112-E116 PolarHBondContact O-N 3.45Å; Y114-E116 VanDerWaalsContact C-N 3.3Å; Y114-E116 PolarHBondContact O-N 3.24Å; E116-V118 VanDerWaalsContact C-N 3.31Å; E116-V118 PolarHBondContact O-N 2.95Å; E116-R119 VanDerWaalsContact CD-NH2 3.28Å; E116-R119 PolarHBondContact O-N 3.32Å; E116-R119 IonicContact OE1-CZ 2.79Å; E116-R119 IonicContact OE1-NE 3.06Å; E116-R119 IonicContact OE1-NH2 3.34Å; E116-R119 PolarHBondContact OE1-NH2 3.36Å; E116-R119 IonicContact OE2-CZ 2.78Å; E116-R119 IonicContact OE2-NE 3.51Å; E116-R119 PolarHBondContact OE2-NE 2.97Å; E116-R119 IonicContact OE2-NH2 3.28Å; E116-R119 PolarHBondContact OE2-NH2 2.95Å; E116-K120 WeakPolarHBondContact O-CB 3.35Å; E116-K120 PolarHBondContact O-N 2.95Å
117	Q	79.4	Confident	77	Confident	111 Å²	111	77.7 Å²	77.7	52%	0.519	35%	0.351	S	S	.	.	H	α-helix	trans	-61.4	-40.3	171.4	-171.7	-179.9	11.8	0	0	111.8	S113 Y114 K120 I121	S113-Q117 WeakPolarHBondContact O-CB 3.13Å; S113-Q117 PolarHBondContact O-N 2.78Å; Y114-Q117 PolarHBondContact O-N 2.67Å; Q117-K120 PolarHBondContact O-N 3.06Å; Q117-I121 HydrophobicContact CG-CD1 4.03Å; Q117-I121 WeakPolarHBondContact O-CB 3.14Å; Q117-I121 WeakPolarHBondContact O-CD1 3.38Å; Q117-I121 WeakPolarHBondContact O-CG1 3.31Å; Q117-I121 PolarHBondContact O-N 3.35Å
118	V	78.8	Confident	76.3	Confident	21 Å²	21	85.1 Å²	85.1	13%	0.127	38%	0.378	C	S	.	.	H	α-helix	trans	-65.6	-44.4	175	163.2	0	0	0	0	111.4	Y114 K115 E116 I121 G122 I141 L187	Y114-V118 HydrophobicContact CE1-CG2 4.41Å; Y114-V118 HydrophobicContact CE2-CG2 4.34Å; Y114-V118 WeakPolarHBondContact O-CB 3.32Å; Y114-V118 WeakPolarHBondContact O-CG2 3.01Å; Y114-V118 PolarHBondContact O-N 3.13Å; K115-V118 CarbonylContact O-C 3.47Å; K115-V118 WeakPolarHBondContact O-CB 3.45Å; K115-V118 PolarHBondContact O-N 2.89Å; E116-V118 VanDerWaalsContact C-N 3.31Å; E116-V118 PolarHBondContact O-N 2.95Å; V118-I121 PolarHBondContact O-N 3.08Å; V118-G122 PolarHBondContact O-N 3.07Å; V118-I141 HydrophobicContact CG1-CG2 3.87Å; V118-I141 WeakPolarHBondContact CG1-O 3.37Å; V118-I141 HydrophobicContact CG2-CG2 4.17Å; V118-L187 HydrophobicContact CB-CD1 4.38Å; V118-L187 HydrophobicContact CG1-CD1 4.18Å; V118-L187 HydrophobicContact CG2-CD1 4Å
119	R	81.2	Confident	75	Confident	129 Å²	129	85.9 Å²	85.9	49%	0.487	38%	0.381	S	S	.	.	H	α-helix	trans	-58.3	-48.9	173.1	-174.5	-177.3	71.3	107.4	-10.7	111	K115 E116 I121 G122 E123	K115-R119 PolarHBondContact O-N 3.4Å; E116-R119 VanDerWaalsContact CD-NH2 3.28Å; E116-R119 PolarHBondContact O-N 3.32Å; E116-R119 IonicContact OE1-CZ 2.79Å; E116-R119 IonicContact OE1-NE 3.06Å; E116-R119 IonicContact OE1-NH2 3.34Å; E116-R119 PolarHBondContact OE1-NH2 3.36Å; E116-R119 IonicContact OE2-CZ 2.78Å; E116-R119 IonicContact OE2-NE 3.51Å; E116-R119 PolarHBondContact OE2-NE 2.97Å; E116-R119 IonicContact OE2-NH2 3.28Å; E116-R119 PolarHBondContact OE2-NH2 2.95Å; R119-I121 VanDerWaalsContact C-N 3.35Å; R119-I121 PolarHBondContact O-N 3.28Å; R119-G122 CarbonylContact O-C 3.55Å; R119-G122 WeakPolarHBondContact O-CA 3.24Å; R119-G122 PolarHBondContact O-N 3.09Å; R119-G122 VanDerWaalsContact O-N 3.09Å; R119-E123 IonicContact CZ-OE1 3.94Å; R119-E123 IonicContact NE-OE1 2.77Å; R119-E123 IonicContact NH1-OE1 3.76Å; R119-E123 PolarHBondContact NH1-OE1 2.93Å; R119-E123 PolarHBondContact O-N 2.98Å
120	K	80.2	Confident	73.4	Confident	133 Å²	133	83.3 Å²	83.3	58%	0.578	39%	0.385	S	S	*	.	H	α-helix	trans	-61.5	-40.4	178.8	-172.8	171.1	-178.6	174.3	0	112.1	E116 Q117 E123 E124	E116-K120 WeakPolarHBondContact O-CB 3.35Å; E116-K120 PolarHBondContact O-N 2.95Å; Q117-K120 PolarHBondContact O-N 3.06Å; K120-E123 PolarHBondContact O-N 2.69Å; K120-E124 WeakPolarHBondContact O-CB 3.2Å; K120-E124 PolarHBondContact O-N 3.34Å
121	I	75	Confident	71.7	Confident	50 Å²	50	87.6 Å²	87.6	26%	0.256	41%	0.405	S	S	.	.	H	α-helix	trans	-64.7	-38.8	173.2	-72.8	166.3	0	0	0	111.3	Q117 V118 R119 A125 C142 K144	Q117-I121 HydrophobicContact CG-CD1 4.03Å; Q117-I121 WeakPolarHBondContact O-CB 3.14Å; Q117-I121 WeakPolarHBondContact O-CD1 3.38Å; Q117-I121 WeakPolarHBondContact O-CG1 3.31Å; Q117-I121 PolarHBondContact O-N 3.35Å; V118-I121 PolarHBondContact O-N 3.08Å; R119-I121 VanDerWaalsContact C-N 3.35Å; R119-I121 PolarHBondContact O-N 3.28Å; I121-A125 VanDerWaalsContact O-CB 3.24Å; I121-A125 WeakPolarHBondContact O-CB 3.18Å; I121-A125 PolarHBondContact O-N 3.46Å; I121-C142 WeakPolarHBondContact CG2-O 3.32Å; I121-K144 HydrophobicContact CG2-CD 4.34Å
122	G	72.3	Confident	70.3	Confident	2 Å²	2	94.6 Å²	94.6	2%	0.021	44%	0.438	C	S	.	.	H	α-helix	trans	-71.9	-29.7	176.8	0	0	0	0	0	114.6	V118 R119 R126	V118-G122 PolarHBondContact O-N 3.07Å; R119-G122 CarbonylContact O-C 3.55Å; R119-G122 WeakPolarHBondContact O-CA 3.24Å; R119-G122 PolarHBondContact O-N 3.09Å; R119-G122 VanDerWaalsContact O-N 3.09Å; G122-R126 WeakPolarHBondContact O-CG 3.27Å; G122-R126 PolarHBondContact O-N 3.02Å; G122-R126 PolarHBondContact O-NE 2.68Å
123	E	75.2	Confident	68.3	Low	41 Å²	41	100.2 Å²	100.2	19%	0.192	46%	0.461	C	S	.	.	H	α-helix	trans	-77.3	-42.2	169.3	-72.1	178.4	-158.4	0	0	112.1	R119 K120 A125 R126 R127	R119-E123 IonicContact CZ-OE1 3.94Å; R119-E123 IonicContact NE-OE1 2.77Å; R119-E123 IonicContact NH1-OE1 3.76Å; R119-E123 PolarHBondContact NH1-OE1 2.93Å; R119-E123 PolarHBondContact O-N 2.98Å; K120-E123 PolarHBondContact O-N 2.69Å; E123-A125 VanDerWaalsContact C-N 3.32Å; E123-A125 PolarHBondContact O-N 3.21Å; E123-R126 CarbonylContact O-C 3.35Å; E123-R126 WeakPolarHBondContact O-CA 3.01Å; E123-R126 PolarHBondContact O-N 3.38Å; E123-R127 WeakPolarHBondContact O-CG 3.37Å; E123-R127 PolarHBondContact O-N 3.11Å; E123-R127 IonicContact OE2-CZ 2.63Å; E123-R127 IonicContact OE2-NH1 3.48Å; E123-R127 PolarHBondContact OE2-NH1 3.24Å; E123-R127 IonicContact OE2-NH2 2.69Å; E123-R127 PolarHBondContact OE2-NH2 2.83Å
124	E	71.2	Confident	66.7	Low	73 Å²	73	100.3 Å²	100.3	34%	0.341	46%	0.455	S	S	.	.	H	α-helix	trans	-59.2	-44.1	174.3	-178.8	-175.8	-107.8	0	0	110.8	K120 R126 R127 Y128 K144	K120-E124 WeakPolarHBondContact O-CB 3.2Å; K120-E124 PolarHBondContact O-N 3.34Å; E124-R126 PolarHBondContact O-N 3.33Å; E124-R127 PolarHBondContact O-N 2.69Å; E124-R127 VanDerWaalsContact O-N 3.13Å; E124-Y128 HydrophobicContact CG-CD2 3.79Å; E124-Y128 HydrophobicContact CG-CE2 3.83Å; E124-Y128 WeakPolarHBondContact O-CD2 3.12Å; E124-Y128 PolarHBondContact O-N 3.42Å; E124-K144 IonicContact OE2-NZ 3.61Å; E124-K144 PolarHBondContact OE2-NZ 2.79Å
125	A	64.4	Low	65.5	Low	5 Å²	5	105.5 Å²	105.5	4%	0.041	49%	0.487	C	S	.	.	H	α-helix	trans	-61.2	-26.8	173.7	0	0	0	0	0	113.7	I121 E123 Q129 H143 K144	I121-A125 VanDerWaalsContact O-CB 3.24Å; I121-A125 WeakPolarHBondContact O-CB 3.18Å; I121-A125 PolarHBondContact O-N 3.46Å; E123-A125 VanDerWaalsContact C-N 3.32Å; E123-A125 PolarHBondContact O-N 3.21Å; A125-Q129 WeakPolarHBondContact O-CB 3.16Å; A125-Q129 PolarHBondContact O-N 2.78Å; A125-Q129 PolarHBondContact O-NE2 3.45Å; A125-H143 HydrophobicContact CB-CB 3.8Å; A125-K144 HydrophobicContact CB-CG 3.85Å
126	R	64.6	Low	64.5	Low	163 Å²	163	103.6 Å²	103.6	62%	0.615	49%	0.486	S	S	*	.	H	α-helix	trans	-85.9	-29.2	173.2	-76.1	-174.8	-74.4	176.5	1.9	113.2	G122 E123 E124 Q129	G122-R126 WeakPolarHBondContact O-CG 3.27Å; G122-R126 PolarHBondContact O-N 3.02Å; G122-R126 PolarHBondContact O-NE 2.68Å; E123-R126 CarbonylContact O-C 3.35Å; E123-R126 WeakPolarHBondContact O-CA 3.01Å; E123-R126 PolarHBondContact O-N 3.38Å; E124-R126 PolarHBondContact O-N 3.33Å; R126-Q129 CarbonylContact O-C 3.55Å
127	R	63.7	Low	64	Low	173 Å²	173	102.4 Å²	102.4	65%	0.653	49%	0.486	S	S	*	.	H	α-helix	trans	-72.1	-32.1	171.9	-69.3	-178.6	-171.5	101.8	9.9	112.3	E123 E124	E123-R127 WeakPolarHBondContact O-CG 3.37Å; E123-R127 PolarHBondContact O-N 3.11Å; E123-R127 IonicContact OE2-CZ 2.63Å; E123-R127 IonicContact OE2-NH1 3.48Å; E123-R127 PolarHBondContact OE2-NH1 3.24Å; E123-R127 IonicContact OE2-NH2 2.69Å; E123-R127 PolarHBondContact OE2-NH2 2.83Å; E124-R127 PolarHBondContact O-N 2.69Å; E124-R127 VanDerWaalsContact O-N 3.13Å
128	Y	58.4	Low	64.3	Low	194 Å²	194	99.5 Å²	99.5	76%	0.761	48%	0.475	S	S	*	.	S	Bend	trans	-84.8	-15.2	173	-80.2	-76.3	0	0	0	114.3	E124	E124-Y128 HydrophobicContact CG-CD2 3.79Å; E124-Y128 HydrophobicContact CG-CE2 3.83Å; E124-Y128 WeakPolarHBondContact O-CD2 3.12Å; E124-Y128 PolarHBondContact O-N 3.42Å
129	Q	51.5	Low	64.8	Low	90 Å²	90	98.5 Å²	98.5	42%	0.421	47%	0.469	S	S	.	.	S	Bend	trans	-103	70.6	167.9	-77.8	173.8	88.8	0	0	109.5	A125 R126	A125-Q129 WeakPolarHBondContact O-CB 3.16Å; A125-Q129 PolarHBondContact O-N 2.78Å; A125-Q129 PolarHBondContact O-NE2 3.45Å; R126-Q129 CarbonylContact O-C 3.55Å
130	G	47.8	Very low	65	Low	59 Å²	59	93.8 Å²	93.8	61%	0.608	46%	0.46	S	S	*	.			trans	-62.4	134.2	169.4	0	0	0	0	0	111.2	H132	G130-H132 PolarHBondContact O-N 3.24Å; G130-H132 VanDerWaalsContact O-N 3.12Å
131	E	43.5	Very low	65.3	Low	199 Å²	199	87.9 Å²	87.9	93%	0.93	44%	0.435	S	S	*	.	S	Bend	trans	38.4	53.9	160.9	-58.8	-137.3	88	0	0	118.1
132	H	51.1	Low	65.9	Low	156 Å²	156	86.6 Å²	86.6	72%	0.722	43%	0.43	S	S	*	.			trans	-133.7	114.9	160.4	-122.8	-95.8	0	0	0	112.5	G130 D134	G130-H132 PolarHBondContact O-N 3.24Å; G130-H132 VanDerWaalsContact O-N 3.12Å; H132-D134 VanDerWaalsContact C-N 3.28Å; H132-D134 IonicContact CE1-OD1 2.78Å; H132-D134 IonicContact CG-OD1 2.75Å; H132-D134 IonicContact ND1-OD1 3.06Å; H132-D134 PolarHBondContact ND1-OD1 2.99Å; H132-D134 PolarHBondContact O-N 2.78Å
133	K	44.4	Very low	66.5	Low	209 Å²	209	88.9 Å²	88.9	91%	0.909	44%	0.44	S	S	*	.			trans	-79.9	71.5	176.4	-68.9	-178.6	179.3	176.2	0	110.6
134	D	49.4	Very low	66.9	Low	79 Å²	79	92.7 Å²	92.7	42%	0.422	46%	0.457	S	S	.	.			trans	-95.7	113.2	170.9	-53.9	-19.3	0	0	0	109.8	H132 A136 K146	H132-D134 VanDerWaalsContact C-N 3.28Å; H132-D134 IonicContact CE1-OD1 2.78Å; H132-D134 IonicContact CG-OD1 2.75Å; H132-D134 IonicContact ND1-OD1 3.06Å; H132-D134 PolarHBondContact ND1-OD1 2.99Å; H132-D134 PolarHBondContact O-N 2.78Å; D134-A136 PolarHBondContact O-N 2.99Å; D134-K146 IonicContact OD2-NZ 3.17Å; D134-K146 PolarHBondContact OD2-NZ 2.82Å
135	D	56	Low	67.5	Low	165 Å²	165	91.9 Å²	91.9	88%	0.882	46%	0.456	S	S	*	.			trans	-67.8	16.7	177.5	-68.8	-58.6	0	0	0	114.8	P137	D135-P137 VanDerWaalsContact O-CD 3.24Å; D135-P137 WeakPolarHBondContact O-CD 3.3Å
136	A	61.1	Low	68.5	Low	39 Å²	39	96 Å²	96	32%	0.322	47%	0.473	S	S	.	.			trans	-66.8	111.4	176.1	0	0	0	0	0	110.1	D134 T138 K146	D134-A136 PolarHBondContact O-N 2.99Å; A136-T138 PolarHBondContact O-N 2.82Å; A136-K146 HydrophobicContact CB-CB 4.41Å; A136-K146 HydrophobicContact CB-CD 4.11Å; A136-K146 HydrophobicContact CB-CG 4.37Å
137	P	76	Confident	69.3	Low	60 Å²	60	88.5 Å²	88.5	39%	0.39	45%	0.445	S	S	.	.			trans	-62.3	125.9	-173.4	22.9	-31.5	0	0	0	110.2	D135 F147	D135-P137 VanDerWaalsContact O-CD 3.24Å; D135-P137 WeakPolarHBondContact O-CD 3.3Å; P137-F147 HydrophobicContact CB-CD2 4.33Å; P137-F147 HydrophobicContact CG-CB 4.37Å; P137-F147 WeakPolarHBondContact O-CB 3.36Å; P137-F147 WeakPolarHBondContact O-CD2 3.45Å; P137-F147 WeakPolarHBondContact O-CG 3.18Å; P137-F147 PolarHBondContact O-N 3.13Å
138	T	83.9	Confident	69.6	Low	50 Å²	50	83.5 Å²	83.5	31%	0.307	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-96	159.6	179.9	49.7	0	0	0	0	112.3	A136 G140 T145 K146 F147	A136-T138 PolarHBondContact O-N 2.82Å; T138-G140 PolarHBondContact O-N 2.58Å; T138-G140 VanDerWaalsContact O-N 3.16Å; T138-T145 CarbonylContact C-O 3.25Å; T138-T145 WeakPolarHBondContact CA-O 3.4Å; T138-K146 HydrophobicContact CG2-CB 4.48Å; T138-K146 HydrophobicContact CG2-CG 3.78Å; T138-F147 VanDerWaalsContact C-CE2 3.44Å; T138-F147 WeakPolarHBondContact O-CE2 3.11Å
139	C	89.3	Confident	69.7	Low	0 Å²	0	82.6 Å²	82.6	0%	0	45%	0.449	C	S	.	.			trans	-62.7	110.5	169.2	174.4	0	0	0	0	110.4	I141 C142 H143 T145 F147 C163 C166	C139-I141 PolarHBondContact O-N 3.44Å; C139-C142 VanDerWaalsContact CB-SG 3.57Å; C139-C142 PolarHBondContact SG-SG 2.61Å; C139-H143 VanDerWaalsContact O-CA 3.22Å; C139-H143 WeakPolarHBondContact O-CA 3.04Å; C139-H143 PolarHBondContact O-N 3.45Å; C139-T145 PolarHBondContact N-O 2.72Å; C139-F147 HydrophobicContact CB-CE1 4.34Å; C139-F147 HydrophobicContact CB-CE2 4.33Å; C139-F147 HydrophobicContact CB-CZ 3.72Å; C139-C163 HydrophobicContact CB-CB 4.1Å; C139-C163 PolarHBondContact SG-N 3.17Å; C139-C166 VanDerWaalsContact SG-SG 3.69Å
140	G	86.2	Confident	70.3	Confident	29 Å²	29	79.8 Å²	79.8	30%	0.299	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	30.7	-179.9	0	0	0	0	0	115.3	T138 T160 K161	T138-G140 PolarHBondContact O-N 2.58Å; T138-G140 VanDerWaalsContact O-N 3.16Å; G140-T160 WeakPolarHBondContact O-CG2 3.44Å; G140-K161 PolarHBondContact N-O 2.9Å
141	I	87.1	Confident	71.3	Confident	9 Å²	9	81.2 Å²	81.2	5%	0.046	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.9	-61	172.6	-65.9	-176.1	0	0	0	108.9	V118 C139 F162 C166 C185	V118-I141 HydrophobicContact CG1-CG2 3.87Å; V118-I141 WeakPolarHBondContact CG1-O 3.37Å; V118-I141 HydrophobicContact CG2-CG2 4.17Å; C139-I141 PolarHBondContact O-N 3.44Å; I141-F162 HydrophobicContact CD1-CB 4.18Å; I141-C166 HydrophobicContact CB-CB 4.03Å; I141-C166 HydrophobicContact CD1-CB 4.32Å; I141-C166 HydrophobicContact CG2-CB 4.02Å; I141-C185 HydrophobicContact CD1-CB 3.52Å
142	C	87.3	Confident	73.2	Confident	23 Å²	23	72.3 Å²	72.3	16%	0.155	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-22.8	179.1	69	0	0	0	0	114	I121 C139 K144	I121-C142 WeakPolarHBondContact CG2-O 3.32Å; C139-C142 VanDerWaalsContact CB-SG 3.57Å; C139-C142 PolarHBondContact SG-SG 2.61Å; C142-K144 WeakPolarHBondContact O-CG 3.41Å; C142-K144 PolarHBondContact O-N 3.1Å
143	H	85.3	Confident	75	Confident	50 Å²	50	67 Å²	67	23%	0.231	38%	0.381	C	S	.	.	S	Bend	trans	52.3	-8.8	-170	-63.3	-89.6	0	0	0	116.7	A125 C139	A125-H143 HydrophobicContact CB-CB 3.8Å; C139-H143 VanDerWaalsContact O-CA 3.22Å; C139-H143 WeakPolarHBondContact O-CA 3.04Å; C139-H143 PolarHBondContact O-N 3.45Å
144	K	83.6	Confident	77.2	Confident	122 Å²	122	62.2 Å²	62.2	53%	0.53	37%	0.365	S	S	.	.			trans	-80.7	-14	179	-67.8	174	-178.1	-177.1	0	113.5	I121 E124 A125 C142	I121-K144 HydrophobicContact CG2-CD 4.34Å; E124-K144 IonicContact OE2-NZ 3.61Å; E124-K144 PolarHBondContact OE2-NZ 2.79Å; A125-K144 HydrophobicContact CB-CG 3.85Å; C142-K144 WeakPolarHBondContact O-CG 3.41Å; C142-K144 PolarHBondContact O-N 3.1Å
145	T	83.5	Confident	79.2	Confident	55 Å²	55	58.5 Å²	58.5	34%	0.337	35%	0.345	S	S	.	.			trans	-106.2	108.2	175.8	-53.1	0	0	0	0	110.4	T138 C139 F147 C163	T138-T145 CarbonylContact C-O 3.25Å; T138-T145 WeakPolarHBondContact CA-O 3.4Å; C139-T145 PolarHBondContact N-O 2.72Å; T145-F147 HydrophobicContact CG2-CE1 4.49Å; T145-C163 HydrophobicContact CG2-CB 3.8Å
146	K	84.5	Confident	80.8	Confident	91 Å²	91	53.8 Å²	53.8	40%	0.396	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-72.3	138.4	162.4	-69.7	-176.4	173.7	-178.8	0	108.9	D134 A136 T138	D134-K146 IonicContact OD2-NZ 3.17Å; D134-K146 PolarHBondContact OD2-NZ 2.82Å; A136-K146 HydrophobicContact CB-CB 4.41Å; A136-K146 HydrophobicContact CB-CD 4.11Å; A136-K146 HydrophobicContact CB-CG 4.37Å; T138-K146 HydrophobicContact CG2-CB 4.48Å; T138-K146 HydrophobicContact CG2-CG 3.78Å
147	F	82.5	Confident	82.2	Confident	7 Å²	7	57.2 Å²	57.2	3%	0.031	33%	0.33	C	S	.	.			trans	-97.3	115.9	173.2	-54.1	-60.9	0	0	0	110.2	P137 T138 C139 T145 K161 F162 C163	P137-F147 HydrophobicContact CB-CD2 4.33Å; P137-F147 HydrophobicContact CG-CB 4.37Å; P137-F147 WeakPolarHBondContact O-CB 3.36Å; P137-F147 WeakPolarHBondContact O-CD2 3.45Å; P137-F147 WeakPolarHBondContact O-CG 3.18Å; P137-F147 PolarHBondContact O-N 3.13Å; T138-F147 VanDerWaalsContact C-CE2 3.44Å; T138-F147 WeakPolarHBondContact O-CE2 3.11Å; C139-F147 HydrophobicContact CB-CE1 4.34Å; C139-F147 HydrophobicContact CB-CE2 4.33Å; C139-F147 HydrophobicContact CB-CZ 3.72Å; T145-F147 HydrophobicContact CG2-CE1 4.49Å; F147-K161 HydrophobicContact CD2-CD 4.04Å; F147-K161 HydrophobicContact CD2-CG 4.27Å; F147-K161 HydrophobicContact CE2-CB 4.21Å; F147-K161 HydrophobicContact CE2-CD 3.93Å; F147-K161 HydrophobicContact CE2-CG 3.66Å; F147-K161 HydrophobicContact CZ-CG 4.22Å; F147-F162 VanDerWaalsContact CZ-C 3.49Å; F147-C163 HydrophobicContact CE1-CB 3.8Å; F147-C163 HydrophobicContact CZ-CB 4.36Å
148	A	68.6	Low	82.9	Confident	68 Å²	68	57.1 Å²	57.1	56%	0.562	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-65.5	138.3	162.3	0	0	0	0	0	109.9	G150 C151	A148-G150 PolarHBondContact O-N 2.83Å; A148-C151 WeakPolarHBondContact O-CB 3.17Å; A148-C151 PolarHBondContact O-N 3.45Å; A148-C151 PolarHBondContact O-SG 3.44Å
149	D	61.8	Low	83.2	Confident	175 Å²	175	64.8 Å²	64.8	94%	0.936	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	44.2	35.4	170.2	-51.6	-33.3	0	0	0	115.3
150	G	63.1	Low	83.2	Confident	31 Å²	31	67.2 Å²	67.2	32%	0.32	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	79.5	11.8	174.8	0	0	0	0	0	116.8	A148 G152 K161	A148-G150 PolarHBondContact O-N 2.83Å; G150-G152 PolarHBondContact O-N 3.03Å; G150-K161 WeakPolarHBondContact O-CE 3.26Å; G150-K161 PolarHBondContact O-NZ 3.02Å
151	C	69.6	Low	83.3	Confident	88 Å²	88	68.8 Å²	68.8	60%	0.595	37%	0.367	S	S	*	.			trans	-66.9	34.7	-173.7	69.6	0	0	0	0	118.3	A148	A148-C151 WeakPolarHBondContact O-CB 3.17Å; A148-C151 PolarHBondContact O-N 3.45Å; A148-C151 PolarHBondContact O-SG 3.44Å
152	G	82.3	Confident	83.6	Confident	12 Å²	12	68.3 Å²	68.3	12%	0.124	37%	0.365	C	S	.	.			trans	-110.8	148.4	175.5	0	0	0	0	0	113.3	G150 K161	G150-G152 PolarHBondContact O-N 3.03Å; G152-K161 WeakPolarHBondContact O-CE 3.22Å
153	H	88.8	Confident	83.7	Confident	44 Å²	44	67.7 Å²	67.7	20%	0.204	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	138.5	-177.5	-57.4	-65.3	0	0	0	111.3	K161 F162 W183	H153-K161 CarbonylContact O-C 3.55Å; H153-K161 WeakPolarHBondContact O-CA 3.42Å; H153-F162 HydrophobicContact CB-CD2 4.43Å; H153-F162 HydrophobicContact CB-CE1 4.23Å; H153-F162 HydrophobicContact CB-CE2 3.96Å; H153-F162 HydrophobicContact CB-CZ 3.88Å; H153-F162 PolarHBondContact N-O 3.44Å; H153-F162 WeakPolarHBondContact O-CD1 3.47Å; H153-F162 PolarHBondContact O-N 3.39Å; H153-W183 HydrophobicContact CB-CB 4.38Å; H153-W183 HydrophobicContact CB-CD2 3.76Å; H153-W183 HydrophobicContact CB-CE3 3.75Å; H153-W183 HydrophobicContact CB-CG 4.06Å; H153-W183 HydrophobicContact CB-CZ3 4.28Å; H153-W183 AromaticContact CD2-CE3 3.88Å; H153-W183 AromaticContact CD2-CH2 3.56Å; H153-W183 AromaticContact CD2-CZ3 3.47Å; H153-W183 VanDerWaalsContact CD2-CZ3 3.47Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.33Å; H153-W183 AromaticContact CE1-CE2 3.82Å; H153-W183 AromaticContact CE1-CH2 3.47Å; H153-W183 VanDerWaalsContact CE1-CH2 3.47Å; H153-W183 WeakPolarHBondContact CE1-CH2 3.48Å; H153-W183 AromaticContact CE1-CZ2 3.3Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.33Å; H153-W183 AromaticContact CG-CD2 3.66Å; H153-W183 AromaticContact CG-CE2 3.78Å; H153-W183 AromaticContact CG-CE3 3.6Å; H153-W183 AromaticContact CG-CH2 3.79Å; H153-W183 AromaticContact CG-CZ2 3.86Å; H153-W183 AromaticContact CG-CZ3 3.67Å; H153-W183 AromaticContact ND1-CD2 3.76Å; H153-W183 AromaticContact ND1-CE2 3.39Å; H153-W183 AromaticContact ND1-CH2 3.73Å; H153-W183 AromaticContact ND1-CZ2 3.39Å; H153-W183 WeakPolarHBondContact ND1-CZ2 3.49Å; H153-W183 AromaticContact ND1-NE1 3.88Å; H153-W183 AromaticContact NE2-CH2 3.36Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.45Å; H153-W183 AromaticContact NE2-CZ2 3.73Å; H153-W183 AromaticContact NE2-CZ3 3.8Å
154	L	90.7	Very high	83.8	Confident	109 Å²	109	69 Å²	69	57%	0.571	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	135.6	176.3	-62.9	171.7	0	0	0	110.1	S156 R159 K161 W183	L154-S156 PolarHBondContact O-N 2.91Å; L154-R159 WeakPolarHBondContact CD2-O 3.36Å; L154-K161 HydrophobicContact CD2-CB 3.8Å; L154-K161 HydrophobicContact CD2-CD 4.31Å; L154-K161 HydrophobicContact CD2-CG 3.92Å; L154-W183 WeakPolarHBondContact O-CB 3.4Å
155	C	92.5	Very high	84.1	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.014	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-76	123.9	175.5	-175	0	0	0	0	111.5	Y157 C158 R159 T160 F162 W183 C185	C155-Y157 PolarHBondContact O-N 2.83Å; C155-Y157 VanDerWaalsContact O-N 3.07Å; C155-C158 VanDerWaalsContact CB-SG 3.52Å; C155-R159 WeakPolarHBondContact O-CA 3.44Å; C155-R159 PolarHBondContact O-N 3.09Å; C155-T160 PolarHBondContact N-O 2.79Å; C155-F162 HydrophobicContact CB-CD1 4.07Å; C155-F162 HydrophobicContact CB-CE1 3.83Å; C155-W183 CarbonylContact C-O 3.48Å; C155-W183 WeakPolarHBondContact CA-O 3.33Å; C155-C185 HydrophobicContact CB-CB 3.96Å; C155-C185 PolarHBondContact SG-N 3.24Å; C155-C185 VanDerWaalsContact SG-SG 3.69Å
156	S	89.7	Confident	84.4	Confident	66 Å²	66	72.2 Å²	72.2	46%	0.462	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.6	-179.8	-59.6	0	0	0	0	114.3	L154 W183	L154-S156 PolarHBondContact O-N 2.91Å; S156-W183 PolarHBondContact N-O 3.43Å; S156-W183 PolarHBondContact OG-O 2.83Å
157	Y	90.5	Very high	84.7	Confident	110 Å²	110	68.2 Å²	68.2	43%	0.431	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-73.6	173.2	-57.4	-67.6	0	0	0	112.6	C155 R159 M182 V184 C188 Q192	C155-Y157 PolarHBondContact O-N 2.83Å; C155-Y157 VanDerWaalsContact O-N 3.07Å; Y157-R159 PolarHBondContact O-N 3.32Å; Y157-M182 HydrophobicContact CE1-CE 4.18Å; Y157-M182 HydrophobicContact CE2-CE 3.77Å; Y157-M182 VanDerWaalsContact OH-CE 3.31Å; Y157-M182 WeakPolarHBondContact OH-CE 3.22Å; Y157-V184 HydrophobicContact CD2-CG1 3.99Å; Y157-V184 HydrophobicContact CD2-CG2 4.25Å; Y157-V184 HydrophobicContact CE2-CG1 4.03Å; Y157-V184 HydrophobicContact CE2-CG2 3.81Å; Y157-C188 HydrophobicContact CD2-CB 3.99Å; Y157-C188 HydrophobicContact CG-CB 4.46Å; Y157-Q192 VanDerWaalsContact CE2-OE1 3.3Å; Y157-Q192 PolarHBondContact OH-NE2 2.84Å
158	C	90.7	Very high	85	Confident	58 Å²	58	68.7 Å²	68.7	39%	0.392	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.7	-174.5	62.2	0	0	0	0	116.1	C155 T160 C188	C155-C158 VanDerWaalsContact CB-SG 3.52Å; C158-T160 PolarHBondContact O-N 3.47Å; C158-T160 PolarHBondContact SG-OG1 3.32Å; C158-T160 VanDerWaalsContact SG-OG1 3.37Å; C158-C188 PolarHBondContact SG-SG 2.83Å
159	R	90.4	Very high	86	Confident	211 Å²	211	72.6 Å²	72.6	80%	0.796	38%	0.376	S	S	*	.			trans	57.7	-5.2	-176.5	-59.1	-175.3	-178.2	176.1	1.9	116.8	L154 C155 Y157	L154-R159 WeakPolarHBondContact CD2-O 3.36Å; C155-R159 WeakPolarHBondContact O-CA 3.44Å; C155-R159 PolarHBondContact O-N 3.09Å; Y157-R159 PolarHBondContact O-N 3.32Å
160	T	88	Confident	87	Confident	52 Å²	52	66.7 Å²	66.7	32%	0.319	35%	0.347	S	S	.	.			trans	-54.7	137.4	174.8	-45.4	0	0	0	0	111.9	G140 C155 C158	G140-T160 WeakPolarHBondContact O-CG2 3.44Å; C155-T160 PolarHBondContact N-O 2.79Å; C158-T160 PolarHBondContact O-N 3.47Å; C158-T160 PolarHBondContact SG-OG1 3.32Å; C158-T160 VanDerWaalsContact SG-OG1 3.37Å
161	K	89.7	Confident	87.7	Confident	61 Å²	61	69 Å²	69	27%	0.265	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	122	177.9	-160.4	173.5	-175.7	166.2	0	111	G140 F147 G150 G152 H153 L154	G140-K161 PolarHBondContact N-O 2.9Å; F147-K161 HydrophobicContact CD2-CD 4.04Å; F147-K161 HydrophobicContact CD2-CG 4.27Å; F147-K161 HydrophobicContact CE2-CB 4.21Å; F147-K161 HydrophobicContact CE2-CD 3.93Å; F147-K161 HydrophobicContact CE2-CG 3.66Å; F147-K161 HydrophobicContact CZ-CG 4.22Å; G150-K161 WeakPolarHBondContact O-CE 3.26Å; G150-K161 PolarHBondContact O-NZ 3.02Å; G152-K161 WeakPolarHBondContact O-CE 3.22Å; H153-K161 CarbonylContact O-C 3.55Å; H153-K161 WeakPolarHBondContact O-CA 3.42Å; L154-K161 HydrophobicContact CD2-CB 3.8Å; L154-K161 HydrophobicContact CD2-CD 4.31Å; L154-K161 HydrophobicContact CD2-CG 3.92Å
162	F	91.3	Very high	87.6	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	151.1	-171.9	68.9	-94.9	0	0	0	113.1	I141 F147 H153 C155 C166 G167 W183 C185	I141-F162 HydrophobicContact CD1-CB 4.18Å; F147-F162 VanDerWaalsContact CZ-C 3.49Å; H153-F162 HydrophobicContact CB-CD2 4.43Å; H153-F162 HydrophobicContact CB-CE1 4.23Å; H153-F162 HydrophobicContact CB-CE2 3.96Å; H153-F162 HydrophobicContact CB-CZ 3.88Å; H153-F162 PolarHBondContact N-O 3.44Å; H153-F162 WeakPolarHBondContact O-CD1 3.47Å; H153-F162 PolarHBondContact O-N 3.39Å; C155-F162 HydrophobicContact CB-CD1 4.07Å; C155-F162 HydrophobicContact CB-CE1 3.83Å; F162-C166 HydrophobicContact CB-CB 4.02Å; F162-C166 HydrophobicContact CD2-CB 4.48Å; F162-G167 VanDerWaalsContact CE2-C 3.44Å; F162-W183 HydrophobicContact CE1-CB 4.43Å; F162-W183 HydrophobicContact CE2-CE3 4.06Å; F162-W183 HydrophobicContact CZ-CB 4.04Å; F162-W183 AromaticContact CZ-CE3 3.94Å; F162-W183 HydrophobicContact CZ-CE3 3.94Å; F162-C185 HydrophobicContact CD1-CB 3.61Å; F162-C185 HydrophobicContact CE1-CB 3.89Å; F162-C185 HydrophobicContact CG-CB 4.04Å
163	C	90.5	Very high	86.2	Confident	10 Å²	10	80.5 Å²	80.5	7%	0.068	39%	0.391	C	S	.	.			trans	-83.5	161.2	175.1	68.2	0	0	0	0	111.5	C139 T145 F147 R165 C166	C139-C163 HydrophobicContact CB-CB 4.1Å; C139-C163 PolarHBondContact SG-N 3.17Å; T145-C163 HydrophobicContact CG2-CB 3.8Å; F147-C163 HydrophobicContact CE1-CB 3.8Å; F147-C163 HydrophobicContact CZ-CB 4.36Å; C163-R165 PolarHBondContact O-N 3.2Å; C163-C166 PolarHBondContact O-N 2.91Å
164	A	87.5	Confident	84.6	Confident	78 Å²	78	81.3 Å²	81.3	65%	0.645	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-15.1	-176.5	0	0	0	0	0	116.3
165	R	88.9	Confident	82.7	Confident	231 Å²	231	83.9 Å²	83.9	87%	0.872	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.1	170.8	-67.8	-176.8	173.8	179.7	-3.1	114.7	C163 N186	C163-R165 PolarHBondContact O-N 3.2Å; R165-N186 PolarHBondContact O-ND2 2.84Å
166	C	91.3	Very high	80.7	Confident	12 Å²	12	90.1 Å²	90.1	8%	0.081	45%	0.449	C	S	.	.	S	Bend	trans	-110.7	10.9	-173.4	-67.5	0	0	0	0	113.7	C139 I141 F162 C163 C185 N186	C139-C166 VanDerWaalsContact SG-SG 3.69Å; I141-C166 HydrophobicContact CB-CB 4.03Å; I141-C166 HydrophobicContact CD1-CB 4.32Å; I141-C166 HydrophobicContact CG2-CB 4.02Å; F162-C166 HydrophobicContact CB-CB 4.02Å; F162-C166 HydrophobicContact CD2-CB 4.48Å; C163-C166 PolarHBondContact O-N 2.91Å; C166-C185 WeakPolarHBondContact O-CA 3.35Å; C166-N186 VanDerWaalsContact C-CG 3.46Å; C166-N186 PolarHBondContact O-N 2.84Å
167	G	90.6	Very high	79.1	Confident	7 Å²	7	96.3 Å²	96.3	7%	0.072	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.9	179.1	178.8	0	0	0	0	0	111.2	F162 V184 N186	F162-G167 VanDerWaalsContact CE2-C 3.44Å; G167-V184 CarbonylContact C-O 3.59Å; G167-V184 WeakPolarHBondContact CA-O 3.44Å; G167-N186 WeakPolarHBondContact CA-OD1 3.46Å; G167-N186 PolarHBondContact N-OD1 2.98Å
168	G	89.4	Confident	77.4	Confident	17 Å²	17	97.4 Å²	97.4	18%	0.175	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	179.7	-176	0	0	0	0	0	114.8	V184	G168-V184 PolarHBondContact N-O 3.36Å; G168-V184 PolarHBondContact O-N 3.36Å
169	R	88.3	Confident	76	Confident	150 Å²	150	101 Å²	101	57%	0.566	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	138.8	173.4	-67.5	-173.2	-82.6	175.3	1	110.3	V181 W183	R169-V181 HydrophobicContact CB-CG1 3.87Å; R169-V181 HydrophobicContact CG-CG1 4.03Å; R169-W183 HydrophobicContact CG-CD2 3.96Å; R169-W183 HydrophobicContact CG-CE3 4Å; R169-W183 HydrophobicContact CG-CH2 3.47Å; R169-W183 VanDerWaalsContact CG-CH2 3.47Å; R169-W183 HydrophobicContact CG-CZ2 3.36Å; R169-W183 HydrophobicContact CG-CZ3 3.79Å
170	V	83.2	Confident	75.1	Confident	52 Å²	52	94.6 Å²	94.6	32%	0.315	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	125.2	172.3	-179.5	0	0	0	0	107.6	V181 M182 V184	V170-V181 WeakPolarHBondContact O-CA 3.22Å; V170-M182 HydrophobicContact CB-CG 3.9Å; V170-M182 HydrophobicContact CG1-CG 4.41Å; V170-M182 PolarHBondContact N-O 3.29Å; V170-M182 WeakPolarHBondContact O-CG 3.24Å; V170-M182 PolarHBondContact O-N 2.93Å; V170-V184 HydrophobicContact CB-CG2 4.28Å; V170-V184 HydrophobicContact CG2-CB 4.11Å; V170-V184 HydrophobicContact CG2-CG2 3.76Å
171	S	77.7	Confident	74.5	Confident	79 Å²	79	95.5 Å²	95.5	55%	0.552	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.6	177.3	-56.8	0	0	0	0	110.4
172	L	67.4	Low	74.4	Confident	89 Å²	89	93.9 Å²	93.9	47%	0.466	48%	0.477	S	S	.	.			trans	-81.3	140.5	167.9	-60.8	176.1	0	0	0	109.3	V180 M182	L172-V180 PolarHBondContact N-O 3.29Å; L172-M182 HydrophobicContact CD1-SD 4.01Å; L172-M182 HydrophobicContact CD2-SD 4.11Å; L172-M182 HydrophobicContact CG-SD 4.06Å
173	R	54.1	Low	74.4	Confident	252 Å²	252	97.2 Å²	97.2	95%	0.951	49%	0.489	S	S	*	.			trans	-98.8	92.1	171.8	-70.9	-172.3	-180	-167	0.7	109.6
174	S	54.9	Low	74.5	Confident	61 Å²	61	96.8 Å²	96.8	43%	0.427	49%	0.487	S	S	.	.			trans	-72.7	152.6	165.7	2.1	0	0	0	0	110.5	N176 D178	S174-N176 PolarHBondContact O-N 2.96Å; S174-N176 VanDerWaalsContact O-N 3.14Å; S174-D178 PolarHBondContact OG-O 3.22Å
175	N	51	Low	74.8	Confident	163 Å²	163	93.1 Å²	93.1	87%	0.872	46%	0.456	S	S	*	.	S	Bend	trans	-84.8	34.5	174.3	-154.8	23.6	0	0	0	112.6
176	N	50.1	Low	75	Confident	133 Å²	133	84.2 Å²	84.2	71%	0.711	43%	0.426	S	S	*	.	S	Bend	trans	-153.2	153.5	176.4	-89.7	-50	0	0	0	106.8	S174 D178	S174-N176 PolarHBondContact O-N 2.96Å; S174-N176 VanDerWaalsContact O-N 3.14Å; N176-D178 PolarHBondContact O-N 2.74Å
177	E	55.7	Low	75	Confident	196 Å²	196	85.6 Å²	85.6	92%	0.916	43%	0.432	S	S	*	.	S	Bend	trans	-67.8	-11.6	-153.4	-58.8	-172.2	101.8	0	0	116.5	K179	E177-K179 PolarHBondContact O-N 2.89Å
178	D	55.4	Low	75	Confident	133 Å²	133	85.7 Å²	85.7	71%	0.711	43%	0.432	S	S	*	.			trans	-72.1	104.1	175.4	-71.3	-52.2	0	0	0	112.8	S174 N176 V180	S174-D178 PolarHBondContact OG-O 3.22Å; N176-D178 PolarHBondContact O-N 2.74Å; D178-V180 PolarHBondContact O-N 2.9Å
179	K	60	Low	75	Confident	133 Å²	133	91.8 Å²	91.8	58%	0.578	45%	0.449	S	S	*	.			trans	-70.3	82.3	169.3	-65.9	172.9	-173.9	156.7	0	111	E177 V181 D743	E177-K179 PolarHBondContact O-N 2.89Å; K179-V181 PolarHBondContact O-N 3.35Å; K179-V181 VanDerWaalsContact O-N 3.11Å; K179-D743 IonicContact NZ-OD1 2.71Å; K179-D743 PolarHBondContact NZ-OD1 2.79Å; K179-D743 IonicContact NZ-OD2 3.25Å
180	V	71.3	Confident	75	Confident	78 Å²	78	87.2 Å²	87.2	47%	0.473	43%	0.433	S	S	.	.			trans	-63.5	114.7	178.5	-177.7	0	0	0	0	111	L172 D178	L172-V180 PolarHBondContact N-O 3.29Å; D178-V180 PolarHBondContact O-N 2.9Å
181	V	76.5	Confident	75.1	Confident	71 Å²	71	89.1 Å²	89.1	43%	0.43	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121	176.1	-177.2	0	0	0	0	110.3	R169 V170 K179	R169-V181 HydrophobicContact CB-CG1 3.87Å; R169-V181 HydrophobicContact CG-CG1 4.03Å; V170-V181 WeakPolarHBondContact O-CA 3.22Å; K179-V181 PolarHBondContact O-N 3.35Å; K179-V181 VanDerWaalsContact O-N 3.11Å
182	M	88.2	Confident	75.4	Confident	27 Å²	27	88.8 Å²	88.8	13%	0.133	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	153.2	175	68.5	-171.8	-56.6	0	0	111.6	Y157 V170 L172 V184	Y157-M182 HydrophobicContact CE1-CE 4.18Å; Y157-M182 HydrophobicContact CE2-CE 3.77Å; Y157-M182 VanDerWaalsContact OH-CE 3.31Å; Y157-M182 WeakPolarHBondContact OH-CE 3.22Å; V170-M182 HydrophobicContact CB-CG 3.9Å; V170-M182 HydrophobicContact CG1-CG 4.41Å; V170-M182 PolarHBondContact N-O 3.29Å; V170-M182 WeakPolarHBondContact O-CG 3.24Å; V170-M182 PolarHBondContact O-N 2.93Å; L172-M182 HydrophobicContact CD1-SD 4.01Å; L172-M182 HydrophobicContact CD2-SD 4.11Å; L172-M182 HydrophobicContact CG-SD 4.06Å; M182-V184 HydrophobicContact CE-CG2 4.3Å; M182-V184 HydrophobicContact CG-CG2 4.12Å
183	W	90.8	Very high	76.2	Confident	69 Å²	69	88.9 Å²	88.9	26%	0.261	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.9	178.6	-79.8	95.9	0	0	0	109.8	H153 L154 C155 S156 F162 R169	H153-W183 HydrophobicContact CB-CB 4.38Å; H153-W183 HydrophobicContact CB-CD2 3.76Å; H153-W183 HydrophobicContact CB-CE3 3.75Å; H153-W183 HydrophobicContact CB-CG 4.06Å; H153-W183 HydrophobicContact CB-CZ3 4.28Å; H153-W183 AromaticContact CD2-CE3 3.88Å; H153-W183 AromaticContact CD2-CH2 3.56Å; H153-W183 AromaticContact CD2-CZ3 3.47Å; H153-W183 VanDerWaalsContact CD2-CZ3 3.47Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.33Å; H153-W183 AromaticContact CE1-CE2 3.82Å; H153-W183 AromaticContact CE1-CH2 3.47Å; H153-W183 VanDerWaalsContact CE1-CH2 3.47Å; H153-W183 WeakPolarHBondContact CE1-CH2 3.48Å; H153-W183 AromaticContact CE1-CZ2 3.3Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.33Å; H153-W183 AromaticContact CG-CD2 3.66Å; H153-W183 AromaticContact CG-CE2 3.78Å; H153-W183 AromaticContact CG-CE3 3.6Å; H153-W183 AromaticContact CG-CH2 3.79Å; H153-W183 AromaticContact CG-CZ2 3.86Å; H153-W183 AromaticContact CG-CZ3 3.67Å; H153-W183 AromaticContact ND1-CD2 3.76Å; H153-W183 AromaticContact ND1-CE2 3.39Å; H153-W183 AromaticContact ND1-CH2 3.73Å; H153-W183 AromaticContact ND1-CZ2 3.39Å; H153-W183 WeakPolarHBondContact ND1-CZ2 3.49Å; H153-W183 AromaticContact ND1-NE1 3.88Å; H153-W183 AromaticContact NE2-CH2 3.36Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.45Å; H153-W183 AromaticContact NE2-CZ2 3.73Å; H153-W183 AromaticContact NE2-CZ3 3.8Å; L154-W183 WeakPolarHBondContact O-CB 3.4Å; C155-W183 CarbonylContact C-O 3.48Å; C155-W183 WeakPolarHBondContact CA-O 3.33Å; S156-W183 PolarHBondContact N-O 3.43Å; S156-W183 PolarHBondContact OG-O 2.83Å; F162-W183 HydrophobicContact CE1-CB 4.43Å; F162-W183 HydrophobicContact CE2-CE3 4.06Å; F162-W183 HydrophobicContact CZ-CB 4.04Å; F162-W183 AromaticContact CZ-CE3 3.94Å; F162-W183 HydrophobicContact CZ-CE3 3.94Å; R169-W183 HydrophobicContact CG-CD2 3.96Å; R169-W183 HydrophobicContact CG-CE3 4Å; R169-W183 HydrophobicContact CG-CH2 3.47Å; R169-W183 VanDerWaalsContact CG-CH2 3.47Å; R169-W183 HydrophobicContact CG-CZ2 3.36Å; R169-W183 HydrophobicContact CG-CZ3 3.79Å
184	V	93.2	Very high	77.4	Confident	2 Å²	2	77.2 Å²	77.2	1%	0.012	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.7	-174.5	-174.5	0	0	0	0	110.1	Y157 G167 G168 V170 M182 C188 R189	Y157-V184 HydrophobicContact CD2-CG1 3.99Å; Y157-V184 HydrophobicContact CD2-CG2 4.25Å; Y157-V184 HydrophobicContact CE2-CG1 4.03Å; Y157-V184 HydrophobicContact CE2-CG2 3.81Å; G167-V184 CarbonylContact C-O 3.59Å; G167-V184 WeakPolarHBondContact CA-O 3.44Å; G168-V184 PolarHBondContact N-O 3.36Å; G168-V184 PolarHBondContact O-N 3.36Å; V170-V184 HydrophobicContact CB-CG2 4.28Å; V170-V184 HydrophobicContact CG2-CB 4.11Å; V170-V184 HydrophobicContact CG2-CG2 3.76Å; M182-V184 HydrophobicContact CE-CG2 4.3Å; M182-V184 HydrophobicContact CG-CG2 4.12Å; V184-C188 HydrophobicContact CG1-CB 4.06Å; V184-R189 HydrophobicContact CG1-CB 3.95Å
185	C	93.9	Very high	78.4	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.007	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	158.6	177.6	80.3	0	0	0	0	112.2	I141 C155 F162 C166 L187 C188 R189	I141-C185 HydrophobicContact CD1-CB 3.52Å; C155-C185 HydrophobicContact CB-CB 3.96Å; C155-C185 PolarHBondContact SG-N 3.24Å; C155-C185 VanDerWaalsContact SG-SG 3.69Å; F162-C185 HydrophobicContact CD1-CB 3.61Å; F162-C185 HydrophobicContact CE1-CB 3.89Å; F162-C185 HydrophobicContact CG-CB 4.04Å; C166-C185 WeakPolarHBondContact O-CA 3.35Å; C185-L187 VanDerWaalsContact C-N 3.25Å; C185-L187 PolarHBondContact O-N 3.27Å; C185-C188 PolarHBondContact O-N 3.35Å; C185-C188 PolarHBondContact SG-N 3.3Å; C185-C188 VanDerWaalsContact SG-N 3.43Å; C185-R189 WeakPolarHBondContact O-CB 3.4Å; C185-R189 PolarHBondContact O-N 3.3Å
186	N	91.8	Very high	79.7	Confident	44 Å²	44	74.2 Å²	74.2	24%	0.235	37%	0.366	C	S	.	.	H	α-helix	trans	-62.3	-30.2	-177	-71.8	-12.8	0	0	0	113.1	Y114 R165 C166 G167 K190	Y114-N186 HydrophobicContact CE1-CB 4.44Å; R165-N186 PolarHBondContact O-ND2 2.84Å; C166-N186 VanDerWaalsContact C-CG 3.46Å; C166-N186 PolarHBondContact O-N 2.84Å; G167-N186 WeakPolarHBondContact CA-OD1 3.46Å; G167-N186 PolarHBondContact N-OD1 2.98Å; N186-K190 VanDerWaalsContact O-CB 3.24Å; N186-K190 WeakPolarHBondContact O-CB 3.25Å; N186-K190 PolarHBondContact O-N 3.47Å
187	L	90.8	Very high	81	Confident	40 Å²	40	73.8 Å²	73.8	21%	0.209	36%	0.358	C	S	.	.	H	α-helix	trans	-62.8	-57	172.2	-101	71.7	0	0	0	110.9	Y114 K115 V118 C185 R189 K190 Q191	Y114-L187 HydrophobicContact CD1-CD1 4.28Å; Y114-L187 HydrophobicContact CE1-CD1 3.91Å; K115-L187 HydrophobicContact CG-CD2 4.21Å; V118-L187 HydrophobicContact CB-CD1 4.38Å; V118-L187 HydrophobicContact CG1-CD1 4.18Å; V118-L187 HydrophobicContact CG2-CD1 4Å; C185-L187 VanDerWaalsContact C-N 3.25Å; C185-L187 PolarHBondContact O-N 3.27Å; L187-R189 PolarHBondContact O-N 3.14Å; L187-K190 PolarHBondContact O-N 2.88Å; L187-Q191 WeakPolarHBondContact O-CB 3.27Å; L187-Q191 PolarHBondContact O-N 3.07Å
188	C	91.3	Very high	82	Confident	9 Å²	9	65.9 Å²	65.9	6%	0.061	32%	0.324	C	S	.	.	H	α-helix	trans	-65.9	-36.4	-178.9	-66.2	0	0	0	0	112.5	Y157 C158 V184 C185 K190 Q191 Q192	Y157-C188 HydrophobicContact CD2-CB 3.99Å; Y157-C188 HydrophobicContact CG-CB 4.46Å; C158-C188 PolarHBondContact SG-SG 2.83Å; V184-C188 HydrophobicContact CG1-CB 4.06Å; C185-C188 PolarHBondContact O-N 3.35Å; C185-C188 PolarHBondContact SG-N 3.3Å; C185-C188 VanDerWaalsContact SG-N 3.43Å; C188-K190 PolarHBondContact O-N 2.85Å; C188-Q191 PolarHBondContact O-N 2.87Å; C188-Q192 WeakPolarHBondContact O-CB 3.26Å; C188-Q192 WeakPolarHBondContact O-CG 3.44Å; C188-Q192 PolarHBondContact O-N 3.26Å
189	R	90	Very high	82.4	Confident	146 Å²	146	60.7 Å²	60.7	55%	0.551	30%	0.301	S	S	*	.	H	α-helix	trans	-61	-44	174.5	-171.3	177.2	-178.7	-179.5	1.2	111.4	V184 C185 L187 E193	V184-R189 HydrophobicContact CG1-CB 3.95Å; C185-R189 WeakPolarHBondContact O-CB 3.4Å; C185-R189 PolarHBondContact O-N 3.3Å; L187-R189 PolarHBondContact O-N 3.14Å; R189-E193 WeakPolarHBondContact O-CB 3.49Å; R189-E193 PolarHBondContact O-N 3.5Å
190	K	86.7	Confident	82.8	Confident	53 Å²	53	56 Å²	56	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-69.4	-38.5	176.3	-163.6	176.5	-170.7	-176.8	0	111.6	Q110 F111 Y114 N186 L187 C188 E193 I194	Q110-K190 PolarHBondContact O-NZ 2.99Å; F111-K190 HydrophobicContact CD2-CB 4.34Å; F111-K190 HydrophobicContact CD2-CD 4.19Å; F111-K190 HydrophobicContact CD2-CG 4.17Å; F111-K190 HydrophobicContact CE2-CB 4.29Å; Y114-K190 HydrophobicContact CD1-CD 3.77Å; Y114-K190 HydrophobicContact CE1-CD 4.33Å; Y114-K190 HydrophobicContact CG-CD 4.22Å; N186-K190 VanDerWaalsContact O-CB 3.24Å; N186-K190 WeakPolarHBondContact O-CB 3.25Å; N186-K190 PolarHBondContact O-N 3.47Å; L187-K190 PolarHBondContact O-N 2.88Å; C188-K190 PolarHBondContact O-N 2.85Å; K190-E193 WeakPolarHBondContact O-CB 3.44Å; K190-E193 PolarHBondContact O-N 2.99Å; K190-I194 HydrophobicContact CG-CD1 4.11Å; K190-I194 VanDerWaalsContact O-CD1 3.26Å; K190-I194 WeakPolarHBondContact O-CD1 3.33Å; K190-I194 WeakPolarHBondContact O-CG1 3.42Å; K190-I194 PolarHBondContact O-N 2.84Å
191	Q	85.3	Confident	82.5	Confident	93 Å²	93	59.6 Å²	59.6	44%	0.435	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-45.6	174.7	-166.2	175.6	-3.9	0	0	111.6	F111 L187 C188 I194 L195	F111-Q191 HydrophobicContact CE1-CB 4.4Å; F111-Q191 HydrophobicContact CE1-CG 4.19Å; F111-Q191 HydrophobicContact CE2-CB 3.92Å; F111-Q191 HydrophobicContact CZ-CB 3.64Å; F111-Q191 HydrophobicContact CZ-CG 3.88Å; L187-Q191 WeakPolarHBondContact O-CB 3.27Å; L187-Q191 PolarHBondContact O-N 3.07Å; C188-Q191 PolarHBondContact O-N 2.87Å; Q191-I194 PolarHBondContact O-N 2.84Å; Q191-L195 WeakPolarHBondContact O-CG 3.31Å; Q191-L195 PolarHBondContact O-N 3.32Å
192	Q	85	Confident	81.2	Confident	71 Å²	71	62.6 Å²	62.6	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-61.8	-43.6	172.2	-72.9	-175.9	-63.6	0	0	111.8	Y157 C188 I194 L195 T196	Y157-Q192 VanDerWaalsContact CE2-OE1 3.3Å; Y157-Q192 PolarHBondContact OH-NE2 2.84Å; C188-Q192 WeakPolarHBondContact O-CB 3.26Å; C188-Q192 WeakPolarHBondContact O-CG 3.44Å; C188-Q192 PolarHBondContact O-N 3.26Å; Q192-I194 VanDerWaalsContact C-N 3.27Å; Q192-I194 PolarHBondContact O-N 2.96Å; Q192-L195 PolarHBondContact O-N 2.84Å; Q192-T196 WeakPolarHBondContact O-CB 3.49Å; Q192-T196 PolarHBondContact O-N 3.16Å; Q192-T196 PolarHBondContact O-OG1 2.97Å
193	E	84.3	Confident	79.8	Confident	91 Å²	91	69.4 Å²	69.4	43%	0.425	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-37.2	176.6	-168.9	-176.1	176.2	0	0	112.3	R189 K190 K197	R189-E193 WeakPolarHBondContact O-CB 3.49Å; R189-E193 PolarHBondContact O-N 3.5Å; K190-E193 WeakPolarHBondContact O-CB 3.44Å; K190-E193 PolarHBondContact O-N 2.99Å; E193-K197 HydrophobicContact CG-CD 4.05Å; E193-K197 VanDerWaalsContact O-CB 3.24Å; E193-K197 WeakPolarHBondContact O-CB 3.28Å; E193-K197 VanDerWaalsContact O-CG 3.22Å; E193-K197 WeakPolarHBondContact O-CG 3.38Å; E193-K197 PolarHBondContact O-N 2.89Å; E193-K197 WeakPolarHBondContact OE1-CE 3.43Å; E193-K197 IonicContact OE1-NZ 3.34Å; E193-K197 PolarHBondContact OE1-NZ 3.36Å
194	I	78.5	Confident	77.4	Confident	7 Å²	7	69 Å²	69	4%	0.036	35%	0.347	C	S	.	.	H	α-helix	trans	-70.4	-46	175.1	-66.6	153.9	0	0	0	111.1	L107 F111 K190 Q191 Q192 T196 K197 S198	L107-I194 HydrophobicContact CB-CG1 4.45Å; L107-I194 HydrophobicContact CB-CG2 4.49Å; F111-I194 HydrophobicContact CB-CD1 3.42Å; F111-I194 VanDerWaalsContact CB-CD1 3.42Å; F111-I194 HydrophobicContact CD1-CD1 4.3Å; F111-I194 HydrophobicContact CD2-CD1 3.44Å; F111-I194 VanDerWaalsContact CD2-CD1 3.44Å; F111-I194 HydrophobicContact CE2-CD1 4.3Å; F111-I194 HydrophobicContact CG-CD1 3.46Å; F111-I194 VanDerWaalsContact CG-CD1 3.46Å; K190-I194 HydrophobicContact CG-CD1 4.11Å; K190-I194 VanDerWaalsContact O-CD1 3.26Å; K190-I194 WeakPolarHBondContact O-CD1 3.33Å; K190-I194 WeakPolarHBondContact O-CG1 3.42Å; K190-I194 PolarHBondContact O-N 2.84Å; Q191-I194 PolarHBondContact O-N 2.84Å; Q192-I194 VanDerWaalsContact C-N 3.27Å; Q192-I194 PolarHBondContact O-N 2.96Å; I194-T196 PolarHBondContact O-N 3.4Å; I194-K197 PolarHBondContact O-N 3.5Å; I194-S198 WeakPolarHBondContact O-CB 3.41Å; I194-S198 PolarHBondContact O-N 3.04Å; I194-S198 PolarHBondContact O-OG 3.46Å
195	L	77.5	Confident	74.5	Confident	65 Å²	65	74.4 Å²	74.4	34%	0.34	39%	0.385	S	S	.	.	H	α-helix	trans	-54.8	-53.7	173.7	-71.6	171.7	0	0	0	109.9	Q191 Q192 K197 S198 G199 A200 W201	Q191-L195 WeakPolarHBondContact O-CG 3.31Å; Q191-L195 PolarHBondContact O-N 3.32Å; Q192-L195 PolarHBondContact O-N 2.84Å; L195-K197 PolarHBondContact O-N 2.92Å; L195-S198 PolarHBondContact O-N 2.82Å; L195-S198 PolarHBondContact O-OG 3.05Å; L195-G199 PolarHBondContact O-N 3.4Å; L195-A200 HydrophobicContact CD2-CB 3.9Å; L195-A200 PolarHBondContact O-N 2.94Å; L195-W201 HydrophobicContact CB-CB 4.28Å
196	T	78.2	Confident	71.5	Confident	96 Å²	96	77.1 Å²	77.1	59%	0.589	41%	0.412	S	S	*	.	H	α-helix	trans	-59.3	-40	178.8	-57.3	0	0	0	0	113.2	Q192 I194	Q192-T196 WeakPolarHBondContact O-CB 3.49Å; Q192-T196 PolarHBondContact O-N 3.16Å; Q192-T196 PolarHBondContact O-OG1 2.97Å; I194-T196 PolarHBondContact O-N 3.4Å
197	K	75.9	Confident	68.9	Low	125 Å²	125	81.5 Å²	81.5	54%	0.543	44%	0.443	S	S	.	.	H	α-helix	trans	-77.7	-27.7	179.2	-76.8	175.5	175.3	175.3	0	114.5	L107 E193 I194 L195	L107-K197 HydrophobicContact CD1-CB 3.86Å; L107-K197 HydrophobicContact CD1-CD 4.26Å; L107-K197 HydrophobicContact CD2-CD 4.39Å; E193-K197 HydrophobicContact CG-CD 4.05Å; E193-K197 VanDerWaalsContact O-CB 3.24Å; E193-K197 WeakPolarHBondContact O-CB 3.28Å; E193-K197 VanDerWaalsContact O-CG 3.22Å; E193-K197 WeakPolarHBondContact O-CG 3.38Å; E193-K197 PolarHBondContact O-N 2.89Å; E193-K197 WeakPolarHBondContact OE1-CE 3.43Å; E193-K197 IonicContact OE1-NZ 3.34Å; E193-K197 PolarHBondContact OE1-NZ 3.36Å; I194-K197 PolarHBondContact O-N 3.5Å; L195-K197 PolarHBondContact O-N 2.92Å
198	S	77.8	Confident	66	Low	30 Å²	30	88.6 Å²	88.6	21%	0.21	48%	0.475	C	S	.	.	H	α-helix	trans	-86.3	-19.5	178.1	59.5	0	0	0	0	113.2	N104 I194 L195 A200	N104-S198 WeakPolarHBondContact OD1-CB 3.43Å; I194-S198 WeakPolarHBondContact O-CB 3.41Å; I194-S198 PolarHBondContact O-N 3.04Å; I194-S198 PolarHBondContact O-OG 3.46Å; L195-S198 PolarHBondContact O-N 2.82Å; L195-S198 PolarHBondContact O-OG 3.05Å; S198-A200 PolarHBondContact O-N 3.31Å; S198-A200 VanDerWaalsContact OG-CB 3.31Å; S198-A200 WeakPolarHBondContact OG-CB 3.34Å; S198-A200 PolarHBondContact OG-N 3.05Å
199	G	63.9	Low	63	Low	23 Å²	23	96.5 Å²	96.5	24%	0.237	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	-1.7	-168.8	0	0	0	0	0	113.6	L195 W201 F202	L195-G199 PolarHBondContact O-N 3.4Å; G199-W201 PolarHBondContact O-N 3.06Å; G199-W201 VanDerWaalsContact O-N 3.07Å; G199-F202 WeakPolarHBondContact O-CB 3.13Å; G199-F202 PolarHBondContact O-N 2.82Å
200	A	69.1	Low	60.3	Low	35 Å²	35	95.3 Å²	95.3	29%	0.289	52%	0.522	S	S	.	.	H	α-helix	trans	-62.3	-21.3	-174.1	0	0	0	0	0	114.3	L195 S198 F202 F203 G204	L195-A200 HydrophobicContact CD2-CB 3.9Å; L195-A200 PolarHBondContact O-N 2.94Å; S198-A200 PolarHBondContact O-N 3.31Å; S198-A200 VanDerWaalsContact OG-CB 3.31Å; S198-A200 WeakPolarHBondContact OG-CB 3.34Å; S198-A200 PolarHBondContact OG-N 3.05Å; A200-F202 PolarHBondContact O-N 2.88Å; A200-F203 PolarHBondContact O-N 2.82Å; A200-G204 PolarHBondContact O-N 2.94Å
201	W	63.3	Low	57.6	Low	154 Å²	154	97.7 Å²	97.7	58%	0.583	55%	0.546	S	S	*	.	H	α-helix	trans	-66.3	-22	171	68.9	-79.2	0	0	0	113.9	L195 G199	L195-W201 HydrophobicContact CB-CB 4.28Å; G199-W201 PolarHBondContact O-N 3.06Å; G199-W201 VanDerWaalsContact O-N 3.07Å
202	F	50.1	Low	55.3	Low	133 Å²	133	102.4 Å²	102.4	58%	0.583	57%	0.568	S	S	*	*	H	α-helix	trans	-76.4	-27.6	178	-162.6	-96.3	0	0	0	111.8	G199 A200	G199-F202 WeakPolarHBondContact O-CB 3.13Å; G199-F202 PolarHBondContact O-N 2.82Å; A200-F202 PolarHBondContact O-N 2.88Å
203	F	58.9	Low	52.8	Low	171 Å²	171	106.6 Å²	106.6	75%	0.75	59%	0.593	S	S	*	*	H	α-helix	trans	-100.6	-15.8	177.7	-53.9	-78.8	0	0	0	112.8	A200 S205	A200-F203 PolarHBondContact O-N 2.82Å; F203-S205 VanDerWaalsContact C-N 3.26Å; F203-S205 PolarHBondContact O-N 2.97Å
204	G	40.8	Very low	50.3	Low	60 Å²	60	105.2 Å²	105.2	62%	0.619	60%	0.602	S	S	*	*			trans	-81.7	43.6	-172.5	0	0	0	0	0	115.8	A200 G206	A200-G204 PolarHBondContact O-N 2.94Å; G204-G206 PolarHBondContact O-N 3.12Å
205	S	32.3	Very low	48.2	Very low	116 Å²	116	110.8 Å²	110.8	81%	0.811	64%	0.637	S	S	*	*			trans	-94.3	69.3	-176	-67.3	0	0	0	0	113.1	F203	F203-S205 VanDerWaalsContact C-N 3.26Å; F203-S205 PolarHBondContact O-N 2.97Å
206	G	30.1	Very low	46.3	Very low	57 Å²	57	115.5 Å²	115.5	59%	0.588	66%	0.662	S	S	*	*			trans	158.6	125	167.9	0	0	0	0	0	115.8	G204 Q208	G204-G206 PolarHBondContact O-N 3.12Å; G206-Q208 VanDerWaalsContact C-N 3.34Å; G206-Q208 PolarHBondContact O-N 3.31Å; G206-Q208 VanDerWaalsContact O-N 3.13Å
207	P	36.5	Very low	44.2	Very low	136 Å²	136	115.2 Å²	115.2	88%	0.883	66%	0.664	S	S	*	*			trans	-79.2	84.2	162.5	33	-31.1	0	0	0	109.4	Q209	P207-Q209 PolarHBondContact O-N 2.93Å; P207-Q209 VanDerWaalsContact O-N 3.1Å
208	Q	30.5	Very low	42.2	Very low	190 Å²	190	115.6 Å²	115.6	89%	0.888	67%	0.672	S	S	*	*			trans	-70.3	102.9	176.2	-165.4	176	21.7	0	0	109.6	G206	G206-Q208 VanDerWaalsContact C-N 3.34Å; G206-Q208 PolarHBondContact O-N 3.31Å; G206-Q208 VanDerWaalsContact O-N 3.13Å
209	Q	29.2	Very low	40.1	Very low	175 Å²	175	120.2 Å²	120.2	82%	0.818	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-71	146.3	165.1	-83.1	-162.8	-98.1	0	0	109.9	P207 S211	P207-Q209 PolarHBondContact O-N 2.93Å; P207-Q209 VanDerWaalsContact O-N 3.1Å; Q209-S211 PolarHBondContact O-N 3.24Å
210	P	32.6	Very low	38.8	Very low	120 Å²	120	123.2 Å²	123.2	78%	0.779	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-69.2	123.1	170.7	29.4	-33.1	0	0	0	109.8
211	S	30.9	Very low	37.1	Very low	104 Å²	104	128.5 Å²	128.5	73%	0.727	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-77.3	132.9	167.4	50.7	0	0	0	0	110.4	Q209	Q209-S211 PolarHBondContact O-N 3.24Å
212	Q	36.3	Very low	35.7	Very low	192 Å²	192	124.2 Å²	124.2	90%	0.897	75%	0.754	S	S	*	*			trans	-133.8	131.4	154.9	-73.1	-167.1	-19.8	0	0	108.3
213	D	31.4	Very low	35	Very low	159 Å²	159	123.3 Å²	123.3	85%	0.85	77%	0.771	S	S	*	*			trans	-84.6	166.7	-173.6	-54	-85.5	0	0	0	113.1
214	G	33.3	Very low	33.9	Very low	61 Å²	61	118.5 Å²	118.5	63%	0.629	77%	0.77	S	S	*	*			trans	125.7	74.5	173.8	0	0	0	0	0	112.6
215	T	34.4	Very low	33.6	Very low	125 Å²	125	120.2 Å²	120.2	77%	0.767	77%	0.773	S	S	*	*				63.5	136.9	78.6	71.2	0	0	0	0	115.7
216	L	36.5	Very low	33.7	Very low	164 Å²	164	122.9 Å²	122.9	86%	0.859	77%	0.772	S	S	*	*			trans	73.9	147.2	170.9	-48.2	-177.3	0	0	0	116
217	S	34.2	Very low	34	Very low	90 Å²	90	126.2 Å²	126.2	63%	0.629	78%	0.781	S	S	*	*			cis	-165.8	157.2	-35.1	-132.4	0	0	0	0	111
218	D	34.8	Very low	34.2	Very low	133 Å²	133	125.1 Å²	125.1	71%	0.711	77%	0.774	S	S	*	*			trans	57.8	110.1	144.7	-66.1	-57.8	0	0	0	123.9
219	T	34	Very low	34.5	Very low	126 Å²	126	126.6 Å²	126.6	77%	0.773	77%	0.771	S	S	*	*				95.9	143.5	113.2	-68.1	0	0	0	0	122
220	A	34.7	Very low	34.8	Very low	87 Å²	87	123.9 Å²	123.9	72%	0.719	76%	0.758	S	S	*	*			trans	82	152	163.7	0	0	0	0	0	120.3
221	T	34.1	Very low	35.2	Very low	145 Å²	145	127.7 Å²	127.7	89%	0.89	76%	0.763	S	S	*	*			cis	-168.7	145.5	-28.2	-85.7	0	0	0	0	108.8
222	G	34.6	Very low	35.5	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	77%	0.767	S	S	*	*			trans	132.8	110.9	166.3	0	0	0	0	0	112.6
223	A	35.7	Very low	35.6	Very low	113 Å²	113	127 Å²	127	93%	0.934	76%	0.761	S	S	*	*				83.5	121.9	63.9	0	0	0	0	0	112.7
224	G	35.5	Very low	35.8	Very low	71 Å²	71	130.6 Å²	130.6	73%	0.732	76%	0.763	S	S	*	*			cis	178.6	-179	-6.1	0	0	0	0	0	112.9
225	S	33.4	Very low	36.2	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	77%	0.765	S	S	*	*			trans	55.1	145.9	161.9	-137.8	0	0	0	0	118.1
226	E	35.9	Very low	36.4	Very low	172 Å²	172	135 Å²	135	80%	0.804	76%	0.762	S	S	*	*			cis	-137.4	126.2	23.5	-46.9	-121.3	101.6	0	0	109.3
227	V	36.1	Very low	36.5	Very low	126 Å²	126	133 Å²	133	76%	0.764	75%	0.749	S	S	*	*				90.3	134.4	80.7	169.4	0	0	0	0	114.1
228	P	40.4	Very low	36.8	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	76%	0.755	S	S	*	*			trans	-122.3	-171.9	-163.9	44.1	-30.4	0	0	0	114.4
229	R	37.3	Very low	36.8	Very low	221 Å²	221	137.2 Å²	137.2	83%	0.834	76%	0.757	S	S	*	*			trans	167.9	163.8	151.7	-99	178.5	135.7	149.6	4.6	112.1
230	E	34.7	Very low	37	Very low	117 Å²	117	142.9 Å²	142.9	55%	0.547	76%	0.764	S	S	.	*			cis	-163.6	174.5	-33.3	-127.5	-167.3	122.8	0	0	109.4
231	K	40.9	Very low	37.1	Very low	201 Å²	201	143.3 Å²	143.3	87%	0.874	76%	0.762	S	S	*	*			trans	87.1	104.3	-179.7	-60.9	-177.1	176	177.1	0	116
232	K	37.2	Very low	37.2	Very low	185 Å²	185	144.6 Å²	144.6	80%	0.804	76%	0.757	S	S	*	*			cis	91.4	96.7	14.3	-157.4	-173.9	-170.1	171.3	0	116
233	A	38.7	Very low	37.2	Very low	95 Å²	95	147.8 Å²	147.8	79%	0.785	76%	0.764	S	S	*	*			trans	-160.9	126.3	152.8	0	0	0	0	0	112.2
234	R	36.2	Very low	37.3	Very low	235 Å²	235	147.3 Å²	147.3	89%	0.887	75%	0.752	S	S	*	*			trans	36.9	132	142.2	-86.4	-177.7	171.3	-166.8	-4.6	120.3
235	L	40.6	Very low	37.3	Very low	128 Å²	128	151.5 Å²	151.5	67%	0.67	76%	0.757	S	S	*	*			cis	-147	141.3	14.3	-85.8	158.6	0	0	0	108.2
236	Q	39.9	Very low	37.3	Very low	150 Å²	150	151.4 Å²	151.4	70%	0.701	76%	0.756	S	S	*	*				67.6	122.1	77.6	-165.2	169.9	1.5	0	0	112.8
237	E	37.4	Very low	37.2	Very low	124 Å²	124	149.6 Å²	149.6	58%	0.579	76%	0.757	S	S	*	*			cis	-151.4	-171.5	6.9	-138.3	173.1	130.7	0	0	115.6
238	R	40.1	Very low	37.2	Very low	204 Å²	204	148.2 Å²	148.2	77%	0.77	76%	0.759	S	S	*	*			trans	-30.3	144.5	177.5	-70.1	132.7	100.6	179.9	3	117.4
239	S	36.3	Very low	37	Very low	107 Å²	107	147.2 Å²	147.2	75%	0.748	76%	0.76	S	S	*	*			cis	94.8	124.2	35.9	-68.1	0	0	0	0	115.5
240	R	38.3	Very low	37	Very low	245 Å²	245	143.1 Å²	143.1	93%	0.925	76%	0.759	S	S	*	*			trans	69.8	144.2	169.9	-62.9	174.8	174.9	162.2	-3.6	115.7
241	S	35.4	Very low	37.1	Very low	95 Å²	95	142.4 Å²	142.4	66%	0.664	77%	0.767	S	S	*	*			cis	-167.8	163.2	-12.4	41.8	0	0	0	0	111.5
242	Q	37.6	Very low	37	Very low	172 Å²	172	137.1 Å²	137.1	80%	0.804	76%	0.755	S	S	*	*			trans	69.8	103.5	160	-78.6	172.7	-24.2	0	0	120.2
243	T	34.4	Very low	37.1	Very low	132 Å²	132	136.1 Å²	136.1	81%	0.81	75%	0.754	S	S	*	*				60.8	158.5	126.5	36.2	0	0	0	0	121.4
244	P	37.8	Very low	36.8	Very low	104 Å²	104	137.3 Å²	137.3	68%	0.675	75%	0.747	S	S	*	*			trans	-122.9	-162.9	-138.9	43.8	-31	0	0	0	115.5
245	L	35.5	Very low	36.8	Very low	159 Å²	159	132 Å²	132	83%	0.832	74%	0.741	S	S	*	*			trans	81.1	150.5	176.8	-54.7	148.5	0	0	0	114.1
246	S	32.8	Very low	36.5	Very low	94 Å²	94	129.9 Å²	129.9	66%	0.657	74%	0.741	S	S	*	*			cis	-168.5	145.4	-29.8	-108	0	0	0	0	111.1
247	T	33.9	Very low	36.2	Very low	134 Å²	134	127.3 Å²	127.3	82%	0.822	74%	0.74	S	S	*	*			trans	63.2	152.4	151.8	-33.4	0	0	0	0	120.9
248	A	36	Very low	36.1	Very low	97 Å²	97	130.5 Å²	130.5	80%	0.802	75%	0.754	S	S	*	*			trans	67.1	131.6	155.4	0	0	0	0	0	120.5
249	A	36	Very low	35.8	Very low	92 Å²	92	124.7 Å²	124.7	76%	0.76	76%	0.758	S	S	*	*			trans	-99	149.6	-174.8	0	0	0	0	0	113.2
250	V	37.2	Very low	35.6	Very low	135 Å²	135	124 Å²	124	82%	0.818	76%	0.759	S	S	*	*			trans	80	115.2	136.4	168.2	0	0	0	0	120.4
251	S	37.3	Very low	35.6	Very low	103 Å²	103	117.8 Å²	117.8	72%	0.72	75%	0.75	S	S	*	*			trans	76.8	137.5	140.2	-178.2	0	0	0	0	120.4
252	S	39	Very low	35.4	Very low	89 Å²	89	120.5 Å²	120.5	62%	0.622	76%	0.756	S	S	*	*			cis	-169.8	143.8	-14.9	-82.9	0	0	0	0	109.8
253	Q	38.2	Very low	35	Very low	165 Å²	165	118.1 Å²	118.1	77%	0.771	75%	0.749	S	S	*	*			trans	58.8	174.9	154	-63.5	-173.1	-84.1	0	0	117.6
254	D	34	Very low	34.8	Very low	120 Å²	120	121 Å²	121	64%	0.642	75%	0.746	S	S	*	*			cis	-161	151.1	-45.1	-87.5	-20.2	0	0	0	106.2
255	T	34.9	Very low	34.5	Very low	124 Å²	124	122.1 Å²	122.1	76%	0.761	75%	0.745	S	S	*	*			cis	-155.7	162.9	-8.3	15.8	0	0	0	0	111
256	A	34.6	Very low	34.2	Very low	83 Å²	83	124 Å²	124	69%	0.686	75%	0.747	S	S	*	*			trans	53.6	102.4	147.1	0	0	0	0	0	122.8
257	S	32.6	Very low	34	Very low	96 Å²	96	123 Å²	123	67%	0.671	75%	0.752	S	S	*	*				88.3	148.3	112.6	79.5	0	0	0	0	123.4
258	H	35.7	Very low	33.8	Very low	190 Å²	190	121.2 Å²	121.2	88%	0.88	75%	0.751	S	S	*	*			trans	64.1	138	159.5	-61.5	-66.1	0	0	0	120.9
259	G	34.3	Very low	34	Very low	82 Å²	82	124.7 Å²	124.7	85%	0.845	75%	0.75	S	S	*	*			trans	132.9	97.7	163.1	0	0	0	0	0	115
260	A	31.4	Very low	33.9	Very low	94 Å²	94	124.9 Å²	124.9	78%	0.777	74%	0.744	S	S	*	*			trans	-134.6	174.1	170.8	0	0	0	0	0	109
261	P	39.7	Very low	33.4	Very low	113 Å²	113	122.1 Å²	122.1	73%	0.734	73%	0.731	S	S	*	*			cis	-116.1	-130	-45.6	33.8	-15.9	0	0	0	107.8
262	L	31.1	Very low	32.9	Very low	152 Å²	152	125.5 Å²	125.5	80%	0.796	74%	0.735	S	S	*	*			trans	70.4	142.9	170.2	-67.4	166.9	0	0	0	115.4
263	D	28.2	Very low	32.4	Very low	122 Å²	122	130.6 Å²	130.6	65%	0.652	75%	0.749	S	S	*	*			cis	-162.2	173	-13.7	-168.9	12.7	0	0	0	109.2
264	R	30	Very low	31.9	Very low	194 Å²	194	126.5 Å²	126.5	73%	0.732	74%	0.743	S	S	*	*			trans	74.6	134	140.5	-99.9	165.1	175.8	-153.5	-4.7	122.7
265	N	31.1	Very low	32	Very low	126 Å²	126	129.1 Å²	129.1	67%	0.674	76%	0.756	S	S	*	*			trans	77.9	124.5	145.4	-64.8	-29	0	0	0	118
266	K	30.3	Very low	31.8	Very low	199 Å²	199	126.7 Å²	126.7	87%	0.865	76%	0.756	S	S	*	*			cis	83.4	101.7	35.6	-171.8	-172.3	178.5	-179.5	0	112.5
267	G	28.8	Very low	31.9	Very low	73 Å²	73	128.3 Å²	128.3	75%	0.753	76%	0.759	S	S	*	*			trans	134.4	142.6	172.9	0	0	0	0	0	110.7
268	A	29.1	Very low	31.7	Very low	97 Å²	97	131 Å²	131	80%	0.802	76%	0.761	S	S	*	*			cis	-160.9	153.5	-16.8	0	0	0	0	0	109.6
269	E	40	Very low	31.6	Very low	169 Å²	169	128.1 Å²	128.1	79%	0.79	75%	0.748	S	S	*	*			trans	-50.8	156.4	145.2	-110.1	-112.2	113.1	0	0	109.6
270	P	34	Very low	31.6	Very low	97 Å²	97	130.7 Å²	130.7	63%	0.63	74%	0.736	S	S	*	*			cis	-153.9	-166.1	44.1	42	-20	0	0	0	117.3
271	S	26.4	Very low	31.6	Very low	77 Å²	77	134.5 Å²	134.5	54%	0.538	74%	0.738	S	S	.	*			trans	84.4	114.4	143.9	-71.9	0	0	0	0	117.6
272	Q	28.2	Very low	31.1	Very low	173 Å²	173	132.7 Å²	132.7	81%	0.808	73%	0.733	S	S	*	*				72	107.2	68.3	-70.2	176.2	25.2	0	0	114
273	Q	28.1	Very low	30.9	Very low	196 Å²	196	130 Å²	130	92%	0.916	73%	0.727	S	S	*	*			trans	174.6	153.3	132.1	-94.2	157.3	48	0	0	108.9
274	A	27.2	Very low	31	Very low	79 Å²	79	135.2 Å²	135.2	65%	0.653	74%	0.737	S	S	*	*			cis	-172.4	177.8	-26.8	0	0	0	0	0	108
275	L	36.8	Very low	30.9	Very low	175 Å²	175	131.2 Å²	131.2	92%	0.916	74%	0.739	S	S	*	*			trans	79.8	122.2	166.2	-51.7	168.3	0	0	0	117.9
276	G	29.6	Very low	30.8	Very low	73 Å²	73	136.5 Å²	136.5	75%	0.753	75%	0.75	S	S	*	*			trans	-99.8	-141.3	153.2	0	0	0	0	0	109.7
277	P	37.6	Very low	30.6	Very low	117 Å²	117	131.8 Å²	131.8	76%	0.76	74%	0.742	S	S	*	*			cis	-133	-165.9	4	43.1	-25.9	0	0	0	114
278	E	28	Very low	30.8	Very low	153 Å²	153	136.9 Å²	136.9	72%	0.715	75%	0.746	S	S	*	*			trans	67.4	157.8	164.1	-71.2	-160.5	99.7	0	0	117.3
279	Q	34.1	Very low	31.7	Very low	130 Å²	130	136.9 Å²	136.9	61%	0.607	74%	0.738	S	S	*	*			cis	-144.3	146.9	5	-141.7	174.7	51	0	0	114.9
280	K	32.7	Very low	31.6	Very low	135 Å²	135	133.9 Å²	133.9	59%	0.587	73%	0.733	S	S	*	*			trans	30.4	128.7	145.6	-74.3	167.9	-166.6	142.7	0	122.3
281	Q	32.8	Very low	31.8	Very low	174 Å²	174	139.4 Å²	139.4	81%	0.813	74%	0.741	S	S	*	*				67.7	171.6	127.4	-64.6	171	-38.2	0	0	118.9
282	A	28.9	Very low	32	Very low	76 Å²	76	142.2 Å²	142.2	63%	0.628	75%	0.746	S	S	*	*			cis	-164.5	150	-47.8	0	0	0	0	0	110.4
283	S	27.9	Very low	32.4	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	75%	0.749	S	S	*	*			trans	53.4	125.7	145.2	65.5	0	0	0	0	122.2
284	R	28.6	Very low	32.8	Very low	230 Å²	230	144.1 Å²	144.1	87%	0.868	74%	0.742	S	S	*	*			trans	78.3	124.7	138.9	-65.6	164.7	-178.9	-176	1.2	120.6
285	S	28.4	Very low	33.2	Very low	111 Å²	111	149.8 Å²	149.8	78%	0.776	75%	0.752	S	S	*	*			trans	78.9	113	133.4	-60.7	0	0	0	0	122.8
286	R	28.7	Very low	32.9	Very low	237 Å²	237	145.5 Å²	145.5	89%	0.894	74%	0.742	S	S	*	*				75.1	135	125.1	-155.2	-169.2	-173.6	-167.8	0.8	120.4
287	S	27.4	Very low	33.4	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	75%	0.747	S	S	*	*			trans	76.7	134.9	155.2	27.1	0	0	0	0	122.3
288	E	33.1	Very low	33.1	Very low	179 Å²	179	145.7 Å²	145.7	84%	0.836	74%	0.741	S	S	*	*			trans	-2.3	174.4	136	-84	-173.7	96.4	0	0	122.4
289	P	47.9	Very low	33.3	Very low	98 Å²	98	146.7 Å²	146.7	64%	0.636	75%	0.75	S	S	*	*			cis	-130.7	-153.3	-21.1	31.2	-7.9	0	0	0	111.1
290	P	38.2	Very low	33.1	Very low	105 Å²	105	144.9 Å²	144.9	68%	0.682	75%	0.752	S	S	*	*				-157.5	139.7	91.1	37.9	-16.8	0	0	0	119.8
291	R	37.1	Very low	33	Very low	213 Å²	213	146 Å²	146	80%	0.804	76%	0.76	S	S	*	*			trans	64.3	159.5	132.8	-61.7	-179.8	-171.8	-114.3	13.8	122.5
292	E	30.6	Very low	32.9	Very low	136 Å²	136	144.7 Å²	144.7	64%	0.636	75%	0.753	S	S	*	*			cis	-169.8	127.9	-29.9	-107.4	-176.8	106.4	0	0	111.2
293	R	36.8	Very low	32.9	Very low	234 Å²	234	147.8 Å²	147.8	88%	0.883	76%	0.759	S	S	*	*			trans	178.1	111.5	141.4	-105.9	171.8	150.2	132	-7.1	109.3
294	K	36.6	Very low	33	Very low	175 Å²	175	146.3 Å²	146.3	76%	0.761	76%	0.759	S	S	*	*				63.6	129.8	95.4	-69.8	178.5	178.4	170.1	0	113.6
295	K	34.9	Very low	33	Very low	198 Å²	198	145.6 Å²	145.6	86%	0.861	76%	0.762	S	S	*	*			cis	-158	156.8	9.5	-137.1	-178.9	179.4	-169.8	0	112
296	A	32	Very low	33.1	Very low	85 Å²	85	144.2 Å²	144.2	70%	0.702	77%	0.766	S	S	*	*			trans	-87.4	-172.8	163.3	0	0	0	0	0	110
297	P	38.4	Very low	33.1	Very low	132 Å²	132	136.3 Å²	136.3	86%	0.857	76%	0.758	S	S	*	*			cis	-122.7	-167.1	2.7	42.1	-24.3	0	0	0	112.4
298	G	32.9	Very low	33.4	Very low	62 Å²	62	139.4 Å²	139.4	64%	0.639	76%	0.761	S	S	*	*			cis	139.9	167.5	-4.1	0	0	0	0	0	111.5
299	L	31.4	Very low	33.3	Very low	174 Å²	174	138.6 Å²	138.6	91%	0.911	76%	0.755	S	S	*	*			trans	67.2	158.4	178.4	-55.3	177.6	0	0	0	114.7
300	S	30.6	Very low	32.5	Very low	93 Å²	93	138.1 Å²	138.1	65%	0.65	75%	0.754	S	S	*	*			cis	-163.1	145	-16	42.2	0	0	0	0	110.9
301	E	29.1	Very low	32.3	Very low	159 Å²	159	139 Å²	139	74%	0.743	75%	0.749	S	S	*	*			trans	51.8	152.9	140.3	-77.5	-168.3	69.6	0	0	125.6
302	Q	31.5	Very low	32.4	Very low	146 Å²	146	139.5 Å²	139.5	68%	0.682	75%	0.751	S	S	*	*			trans	77.5	134.4	144.3	-82.7	174	55.4	0	0	122.1
303	N	28.1	Very low	32.6	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	75%	0.754	S	S	*	*			trans	50.2	129.1	146.9	-61.2	-48.5	0	0	0	119.8
304	G	30.3	Very low	32.7	Very low	64 Å²	64	141.2 Å²	141.2	66%	0.66	76%	0.756	S	S	*	*			cis	125.6	155.6	2.5	0	0	0	0	0	113.1
305	K	29.3	Very low	32.8	Very low	215 Å²	215	139.2 Å²	139.2	94%	0.935	76%	0.758	S	S	*	*			trans	71.5	146.1	176.8	-53.3	175.4	179.8	174.1	0	117
306	G	29.5	Very low	32.9	Very low	83 Å²	83	135 Å²	135	86%	0.856	75%	0.751	S	S	*	*			trans	88	120.2	165.5	0	0	0	0	0	115.5
307	G	30	Very low	32.9	Very low	70 Å²	70	139.7 Å²	139.7	72%	0.722	76%	0.755	S	S	*	*			cis	125.2	149.1	-11.9	0	0	0	0	0	114.6
308	Q	33.3	Very low	32.7	Very low	165 Å²	165	138.2 Å²	138.2	77%	0.771	75%	0.748	S	S	*	*			trans	72.6	154.4	178.4	-47.1	-167	18.6	0	0	114.3
309	K	30.6	Very low	32.7	Very low	163 Å²	163	141.9 Å²	141.9	71%	0.709	76%	0.758	S	S	*	*			cis	-160.2	155.9	2	-138	166.4	-170.4	150.7	0	112.3
310	S	32.1	Very low	32.9	Very low	87 Å²	87	139.3 Å²	139.3	61%	0.608	75%	0.749	S	S	*	*			trans	54	158.9	149.3	-72.7	0	0	0	0	120.6
311	E	34.2	Very low	33.1	Very low	124 Å²	124	143.3 Å²	143.3	58%	0.579	76%	0.757	S	S	*	*			cis	-162.6	150	-25.4	-110.7	172.3	95.8	0	0	106	K313	E311-K313 WeakPolarHBondContact OE1-CE 3.38Å; E311-K313 IonicContact OE1-NZ 3.11Å; E311-K313 PolarHBondContact OE1-NZ 3.43Å
312	R	39	Very low	33.6	Very low	223 Å²	223	141.3 Å²	141.3	84%	0.842	76%	0.758	S	S	*	*				-157.3	137.3	59.6	-78.4	-179.8	169.9	179.3	-4	108.1
313	K	35.1	Very low	33.8	Very low	163 Å²	163	137.7 Å²	137.7	71%	0.709	76%	0.76	S	S	*	*				51.9	126.5	89.5	-66.2	165.3	175.5	161.1	0	112.9	E311	E311-K313 WeakPolarHBondContact OE1-CE 3.38Å; E311-K313 IonicContact OE1-NZ 3.11Å; E311-K313 PolarHBondContact OE1-NZ 3.43Å
314	R	38.9	Very low	34.1	Very low	243 Å²	243	140.7 Å²	140.7	92%	0.917	77%	0.769	S	S	*	*			cis	-135.4	146.3	23.2	-66.4	179.3	178.8	151.1	-0.6	115.3
315	V	38.1	Very low	34.4	Very low	134 Å²	134	140.4 Å²	140.4	81%	0.812	77%	0.766	S	S	*	*			trans	-114.5	159.3	162.1	-175.4	0	0	0	0	102.6
316	P	37.2	Very low	34.8	Very low	109 Å²	109	137.3 Å²	137.3	71%	0.708	77%	0.766	S	S	*	*				-163.2	167.5	68.3	45.7	-22.1	0	0	0	122
317	K	32.6	Very low	35.1	Very low	184 Å²	184	137 Å²	137	80%	0.8	76%	0.756	S	S	*	*			trans	42.5	118.9	135.2	-66.1	179.7	176.1	-175	0	119.5
318	S	32.5	Very low	35.4	Very low	101 Å²	101	140.6 Å²	140.6	71%	0.706	76%	0.758	S	S	*	*				77	119.3	56.7	78.8	0	0	0	0	115.6
319	V	33.5	Very low	35.5	Very low	139 Å²	139	139 Å²	139	84%	0.842	75%	0.751	S	S	*	*			trans	-167.7	138.9	162.2	126.4	0	0	0	0	110.7
320	V	35.3	Very low	35.8	Very low	119 Å²	119	140 Å²	140	72%	0.721	75%	0.75	S	S	*	*			trans	40.5	119	148.5	179.7	0	0	0	0	119
321	Q	34.8	Very low	35.9	Very low	177 Å²	177	142 Å²	142	83%	0.827	75%	0.75	S	S	*	*				63	158.8	63.4	-78.3	-149.1	96.5	0	0	115.9
322	P	39.2	Very low	35.7	Very low	117 Å²	117	147.2 Å²	147.2	76%	0.76	76%	0.764	S	S	*	*			cis	-126.6	-173.3	-33.8	37.5	-20.6	0	0	0	112.2
323	G	36.2	Very low	35.3	Very low	70 Å²	70	143.6 Å²	143.6	72%	0.722	75%	0.754	S	S	*	*			trans	176.6	123	170.9	0	0	0	0	0	114.4
324	E	34.3	Very low	35.2	Very low	204 Å²	204	142.2 Å²	142.2	95%	0.953	75%	0.751	S	S	*	*			trans	-58	161.8	-170.2	-62.7	146.7	121.4	0	0	116.7
325	G	36.7	Very low	34.8	Very low	58 Å²	58	140.7 Å²	140.7	60%	0.598	75%	0.745	S	S	*	*			cis	167.3	173.9	-4.5	0	0	0	0	0	113.3
326	T	36.9	Very low	34.4	Very low	150 Å²	150	143.9 Å²	143.9	92%	0.92	74%	0.742	S	S	*	*			trans	61.8	142.7	164.9	57.9	0	0	0	0	119.2
327	A	36.8	Very low	34.3	Very low	78 Å²	78	147.9 Å²	147.9	65%	0.645	75%	0.751	S	S	*	*			cis	-154.4	152.3	-7.7	0	0	0	0	0	111.1
328	D	35.6	Very low	34.3	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	74%	0.74	S	S	*	*			trans	33.9	147.9	130.8	-54.8	-51.9	0	0	0	122.1
329	E	36.4	Very low	34.2	Very low	133 Å²	133	149.1 Å²	149.1	62%	0.621	75%	0.746	S	S	*	*			cis	-155.9	-169.4	0.4	-128.6	-166.9	160.2	0	0	113
330	R	35.8	Very low	34.1	Very low	184 Å²	184	152.6 Å²	152.6	69%	0.694	74%	0.744	S	S	*	*			trans	-9.7	165.5	156.3	-62.5	-176.7	-144.5	178.1	15.7	120.4
331	E	34	Very low	33.9	Very low	129 Å²	129	153.7 Å²	153.7	60%	0.603	75%	0.745	S	S	*	*			cis	-149.2	156.3	4.3	-134.4	165	114.9	0	0	107.2
332	R	30.6	Very low	33.8	Very low	232 Å²	232	151.6 Å²	151.6	88%	0.875	74%	0.735	S	S	*	*			cis	57.2	148.6	49.1	-105.7	-177.9	177	167.3	0.1	114.6
333	K	31.1	Very low	33.4	Very low	147 Å²	147	154.1 Å²	154.1	64%	0.639	73%	0.734	S	S	*	*			trans	59.4	165.6	-172.2	-75.7	158.9	144.6	-97.3	0	113.8
334	E	33.8	Very low	33.4	Very low	135 Å²	135	154.4 Å²	154.4	63%	0.631	74%	0.737	S	S	*	*			cis	-137	135.8	-19.3	-130.5	135.4	-172.3	0	0	106.2
335	R	30.3	Very low	33.1	Very low	211 Å²	211	156.1 Å²	156.1	80%	0.796	74%	0.735	S	S	*	*				56.5	78	56	-156.5	-171.1	-169.4	-127	9.6	114.7
336	R	29.8	Very low	33	Very low	200 Å²	200	157.7 Å²	157.7	76%	0.755	74%	0.737	S	S	*	*			trans	67.4	79.5	133	-171.2	-139.1	-147.8	-172.9	8.1	117
337	E	34.2	Very low	32.9	Very low	193 Å²	193	158 Å²	158	90%	0.902	73%	0.728	S	S	*	*			trans	-131.2	121.9	147.9	-126.2	153.1	-151	0	0	109.1
338	T	32.4	Very low	32.8	Very low	92 Å²	92	159.9 Å²	159.9	56%	0.564	73%	0.727	S	S	*	*			cis	92.8	82.6	35	-49.8	0	0	0	0	113.8
339	R	29.9	Very low	32.7	Very low	219 Å²	219	162.8 Å²	162.8	83%	0.826	73%	0.729	S	S	*	*			trans	70.4	158.6	145.8	-63.1	174.1	167.3	175.7	-5.5	119.8
340	R	32.4	Very low	32.7	Very low	212 Å²	212	161 Å²	161	80%	0.8	73%	0.728	S	S	*	*			trans	76.8	126.9	158.4	-78.3	168.3	175.3	-164.8	-6.5	114.8
341	L	31.4	Very low	32.3	Very low	142 Å²	142	157.5 Å²	157.5	74%	0.743	72%	0.724	S	S	*	*				66.2	135.5	75.9	-87.7	85	0	0	0	111.3
342	E	33	Very low	32.2	Very low	134 Å²	134	160.3 Å²	160.3	63%	0.626	73%	0.729	S	S	*	*			cis	-158.4	149.4	-0.1	-138.5	-171.6	148.8	0	0	110.4
343	K	29.6	Very low	32.3	Very low	170 Å²	170	155.7 Å²	155.7	74%	0.739	72%	0.721	S	S	*	*				42.3	111.2	128.4	175.8	-174.3	173.9	-178.8	0	120.7
344	G	35.8	Very low	32.3	Very low	76 Å²	76	154.5 Å²	154.5	78%	0.784	72%	0.717	S	S	*	*			trans	-159.7	120.3	148.4	0	0	0	0	0	107.4
345	R	29.4	Very low	32.2	Very low	239 Å²	239	154.2 Å²	154.2	90%	0.902	71%	0.714	S	S	*	*			cis	89.2	78.4	26.5	-157.5	-167.9	-158.8	-130.6	5.5	114.7
346	S	34.9	Very low	32.2	Very low	91 Å²	91	153.3 Å²	153.3	64%	0.636	71%	0.711	S	S	*	*			trans	-152.2	133	143.4	-102.4	0	0	0	0	107
347	Q	33.8	Very low	32.3	Very low	157 Å²	157	150.1 Å²	150.1	73%	0.734	70%	0.704	S	S	*	*				65.1	141.5	100.8	-61.5	-176.3	-91.6	0	0	114.5
348	D	34.5	Very low	32.2	Very low	117 Å²	117	146.9 Å²	146.9	63%	0.626	69%	0.693	S	S	*	*			cis	-161.8	165.9	-13.9	-91.6	-32.1	0	0	0	105.4
349	Y	32.9	Very low	32.5	Very low	205 Å²	205	145.5 Å²	145.5	80%	0.804	70%	0.697	S	S	*	*			cis	-148.2	-179	8	-144	-136.9	0	0	0	108.7
350	P	36.3	Very low	32.4	Very low	95 Å²	95	145.3 Å²	145.3	62%	0.617	70%	0.696	S	S	*	*			trans	-105.8	-145.6	-175.6	42.8	-34.3	0	0	0	113.3
351	D	28.9	Very low	32.5	Very low	112 Å²	112	141.2 Å²	141.2	60%	0.599	69%	0.694	S	S	*	*			trans	75.9	119	173.9	-78.8	14	0	0	0	116
352	R	31.5	Very low	32.4	Very low	188 Å²	188	138.7 Å²	138.7	71%	0.709	69%	0.694	S	S	*	*				75.1	159.4	90.8	-67.8	155.6	91	-170.4	4.2	112.1
353	L	32.8	Very low	32.6	Very low	135 Å²	135	141 Å²	141	71%	0.707	71%	0.705	S	S	*	*			cis	-107.7	166.3	5.4	-91.5	88.6	0	0	0	110.2
354	E	30	Very low	32.8	Very low	121 Å²	121	140 Å²	140	57%	0.565	71%	0.708	S	S	*	*				53.4	145.7	59	-75.1	-162.6	141.3	0	0	111.9
355	K	31.8	Very low	32.6	Very low	129 Å²	129	142.2 Å²	142.2	56%	0.561	70%	0.698	S	S	*	*			cis	-165.4	150.9	7.9	-126.7	166.7	179.9	136.1	0	108.7
356	R	30.2	Very low	32.7	Very low	192 Å²	192	137.9 Å²	137.9	73%	0.725	69%	0.685	S	S	*	*			trans	60.7	-177.8	142.9	-75.8	163.7	166.1	-138.5	3.9	116.3
357	E	33.2	Very low	32.6	Very low	133 Å²	133	139.3 Å²	139.3	62%	0.621	68%	0.682	S	S	*	*			cis	-134.6	-178.7	4.5	-146.6	99.6	-150.7	0	0	111.5
358	D	32	Very low	32.9	Very low	126 Å²	126	141.5 Å²	141.5	67%	0.674	68%	0.684	S	S	*	*			trans	-46.8	165.1	165.5	-68.2	-109.3	0	0	0	113.8	R360	D358-R360 IonicContact OD1-NH2 3.33Å; D358-R360 PolarHBondContact OD1-NH2 2.88Å
359	G	37.8	Very low	33.1	Very low	62 Å²	62	143.1 Å²	143.1	64%	0.639	69%	0.685	S	S	*	*			cis	-156.4	178.5	9.9	0	0	0	0	0	110.5
360	R	27.6	Very low	33.4	Very low	216 Å²	216	139.9 Å²	139.9	82%	0.815	68%	0.677	S	S	*	*				69.6	139	61.1	-151	-167.1	-50	-127.9	4	112.1	D358	D358-R360 IonicContact OD1-NH2 3.33Å; D358-R360 PolarHBondContact OD1-NH2 2.88Å
361	V	34.8	Very low	33.3	Very low	125 Å²	125	142.3 Å²	142.3	76%	0.758	68%	0.68	S	S	*	*			trans	72.7	117.6	-164.7	-168.3	0	0	0	0	110.2
362	A	30.2	Very low	33.5	Very low	89 Å²	89	145.7 Å²	145.7	74%	0.736	69%	0.693	S	S	*	*			cis	85.7	76.7	27.8	0	0	0	0	0	114.9
363	E	37	Very low	33.6	Very low	182 Å²	182	140 Å²	140	85%	0.85	69%	0.692	S	S	*	*			trans	-159	113.4	158.2	-99.8	152.9	-160.3	0	0	103.2
364	D	34.3	Very low	33.7	Very low	149 Å²	149	140 Å²	140	80%	0.797	70%	0.697	S	S	*	*			cis	83.9	146.2	45.7	-151.5	2.7	0	0	0	113
365	E	29.8	Very low	33.8	Very low	123 Å²	123	139.5 Å²	139.5	58%	0.575	71%	0.707	S	S	*	*			trans	60	125.6	166.1	-69.3	-111.9	87.4	0	0	121.5
366	K	31.8	Very low	33.8	Very low	149 Å²	149	139.6 Å²	139.6	65%	0.648	72%	0.719	S	S	*	*			trans	69.4	161.2	137	-69.7	177.5	163.4	93.6	0	117.2
367	Q	33.5	Very low	34.2	Very low	120 Å²	120	135.4 Å²	135.4	56%	0.561	72%	0.717	S	S	*	*			cis	-151.2	132.8	-7.1	-125.9	171.8	27.5	0	0	105.9
368	R	39.7	Very low	34.1	Very low	204 Å²	204	137.5 Å²	137.5	77%	0.77	73%	0.726	S	S	*	*				165	150	85.4	-103.5	146.6	-161.8	-107.8	-2.5	107
369	K	39.7	Very low	34.2	Very low	150 Å²	150	141.3 Å²	141.3	65%	0.652	73%	0.733	S	S	*	*			cis	-160.9	126.7	-0	-171.1	176.8	168.2	-175.8	0	109.1
370	E	38.1	Very low	33.9	Very low	137 Å²	137	143.2 Å²	143.2	64%	0.64	73%	0.732	S	S	*	*			trans	49.3	149.7	149.2	-63	152.1	-140.7	0	0	120.3
371	E	35.5	Very low	34	Very low	146 Å²	146	137.2 Å²	137.2	68%	0.682	72%	0.723	S	S	*	*			cis	-154.3	153	-15.2	-113.7	161.2	162.4	0	0	106.9
372	E	33.2	Very low	34.1	Very low	184 Å²	184	135.8 Å²	135.8	86%	0.86	72%	0.718	S	S	*	*				30.8	130.2	102	-51.7	-154.8	119.7	0	0	115.8
373	G	33.6	Very low	34.2	Very low	67 Å²	67	139 Å²	139	69%	0.691	72%	0.718	S	S	*	*			cis	174.7	-143.2	1.8	0	0	0	0	0	110.3
374	V	33	Very low	34.1	Very low	136 Å²	136	136.2 Å²	136.2	82%	0.824	71%	0.708	S	S	*	*			trans	57.2	89.1	156.1	-172.2	0	0	0	0	117.2
375	S	32.9	Very low	34.4	Very low	110 Å²	110	135 Å²	135	77%	0.769	71%	0.706	S	S	*	*				73.8	156.6	121.1	-54.5	0	0	0	0	122.6
376	T	32.4	Very low	35.2	Very low	131 Å²	131	135.1 Å²	135.1	80%	0.804	71%	0.707	S	S	*	*			trans	-58.7	160.2	158.8	49.8	0	0	0	0	112
377	P	38.9	Very low	35.6	Very low	105 Å²	105	136.2 Å²	136.2	68%	0.682	72%	0.719	S	S	*	*			cis	-143.1	-173.7	27.6	43.8	-24.3	0	0	0	116.9
378	E	29.7	Very low	35.7	Very low	177 Å²	177	138 Å²	138	83%	0.827	73%	0.727	S	S	*	*			trans	30.2	152.5	140.8	-66.3	176.6	131.1	0	0	124.9
379	Y	34.2	Very low	35.5	Very low	205 Å²	205	133.2 Å²	133.2	80%	0.804	73%	0.725	S	S	*	*			trans	86.1	126.7	152.5	-126	-125.4	0	0	0	119.2
380	T	32.3	Very low	35.3	Very low	103 Å²	103	133.9 Å²	133.9	63%	0.632	73%	0.73	S	S	*	*			trans	28.6	152	140.4	60.9	0	0	0	0	121.7
381	S	29.8	Very low	34.9	Very low	90 Å²	90	132.1 Å²	132.1	63%	0.629	73%	0.733	S	S	*	*			cis	-177.6	-163	-8.2	-172.8	0	0	0	0	105.5
382	C	36	Very low	34.9	Very low	95 Å²	95	131.1 Å²	131.1	64%	0.642	74%	0.737	S	S	*	*			trans	77.7	125	164.8	-55.3	0	0	0	0	114.7
383	E	31.6	Very low	35	Very low	156 Å²	156	127 Å²	127	73%	0.729	73%	0.729	S	S	*	*				79.6	135.8	50.6	-63	139.6	-151.4	0	0	110.2
384	D	36.3	Very low	34.9	Very low	123 Å²	123	130.3 Å²	130.3	66%	0.658	73%	0.726	S	S	*	*			cis	-150.5	-133.6	1.1	-142.1	-51.4	0	0	0	112.4
385	V	40.9	Very low	34.8	Very low	124 Å²	124	132.4 Å²	132.4	75%	0.752	72%	0.724	S	S	*	*			trans	87.5	83.9	178.5	-168.5	0	0	0	0	112.7
386	E	45.1	Very low	34.9	Very low	126 Å²	126	130 Å²	130	59%	0.589	72%	0.717	S	S	*	*				81.6	153.4	57.6	-60.5	171.1	134.5	0	0	114	E388	E386-E388 HydrophobicContact CB-CG 4.19Å; E386-E388 HydrophobicContact CG-CG 4.47Å
387	L	41.8	Very low	34.9	Very low	172 Å²	172	131.2 Å²	131.2	90%	0.901	72%	0.719	S	S	*	*			trans	96.5	60.7	-145.3	-67.1	169.9	0	0	0	110.4
388	E	35	Very low	34.6	Very low	157 Å²	157	132.6 Å²	132.6	73%	0.734	72%	0.719	S	S	*	*			cis	57	109.6	49.7	-69.7	-134	108.6	0	0	113.9	E386	E386-E388 HydrophobicContact CB-CG 4.19Å; E386-E388 HydrophobicContact CG-CG 4.47Å
389	S	36.1	Very low	34.6	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	71%	0.71	S	S	*	*			trans	141.7	108.3	160.9	-81.3	0	0	0	0	108
390	E	35	Very low	34.5	Very low	164 Å²	164	129.4 Å²	129.4	77%	0.766	71%	0.709	S	S	*	*			cis	-155.6	165	0.5	-116.3	129	-119.7	0	0	111.3
391	S	30.2	Very low	34.6	Very low	100 Å²	100	135.4 Å²	135.4	70%	0.699	72%	0.72	S	S	*	*			trans	-44.6	158.2	157.3	48.4	0	0	0	0	113.1
392	V	34.3	Very low	34.7	Very low	126 Å²	126	136.6 Å²	136.6	76%	0.764	72%	0.719	S	S	*	*			cis	-143.7	130.2	49.8	-163.8	0	0	0	0	107.7
393	S	35.3	Very low	34.3	Very low	98 Å²	98	136.8 Å²	136.8	69%	0.685	71%	0.713	S	S	*	*				39.9	152.3	89.1	-83.4	0	0	0	0	114.3
394	E	31	Very low	34.5	Very low	135 Å²	135	134.5 Å²	134.5	63%	0.631	71%	0.712	S	S	*	*			cis	165.4	159.9	-8.4	-173.1	-163.8	112.3	0	0	103.7
395	K	32.4	Very low	34.1	Very low	180 Å²	180	133.4 Å²	133.4	78%	0.783	72%	0.72	S	S	*	*			trans	66.9	168.6	174.3	-63.4	-176.7	173.7	79.4	0	116.5
396	G	33.5	Very low	33.8	Very low	61 Å²	61	132.5 Å²	132.5	63%	0.629	72%	0.715	S	S	*	*			trans	88.5	116.9	-163.5	0	0	0	0	0	109.8
397	D	34	Very low	33.2	Very low	156 Å²	156	134 Å²	134	83%	0.834	72%	0.715	S	S	*	*			cis	54.8	140.2	40	-53.8	-53.5	0	0	0	112.7
398	L	31.6	Very low	32.6	Very low	133 Å²	133	134.5 Å²	134.5	70%	0.696	71%	0.713	S	S	*	*			cis	-175.7	139.2	-14.5	166.2	64.5	0	0	0	106
399	D	31	Very low	32.3	Very low	120 Å²	120	132.2 Å²	132.2	64%	0.642	71%	0.714	S	S	*	*			trans	61	179.3	169	-73.5	-24.2	0	0	0	119.3
400	Y	32.2	Very low	32	Very low	196 Å²	196	136.4 Å²	136.4	77%	0.769	71%	0.714	S	S	*	*			trans	80.6	85.6	162.2	-58.2	-68.1	0	0	0	121.3
401	W	33	Very low	31.6	Very low	228 Å²	228	135.1 Å²	135.1	86%	0.864	71%	0.708	S	S	*	*			trans	-35.9	152	144.7	-70.3	76.9	0	0	0	117.5
402	L	32	Very low	31.6	Very low	116 Å²	116	137.3 Å²	137.3	61%	0.607	72%	0.717	S	S	*	*			trans	71.4	151.6	161.5	-63	158.4	0	0	0	114.9	P800	L402-P800 HydrophobicContact CD1-CB 3.91Å; L402-P800 HydrophobicContact CD1-CG 3.96Å
403	D	28.9	Very low	31.3	Very low	99 Å²	99	136.6 Å²	136.6	53%	0.529	72%	0.718	S	S	.	*			cis	-133.2	175	21.9	-113.1	-23.8	0	0	0	113.3
404	P	35.3	Very low	31.4	Very low	107 Å²	107	137.5 Å²	137.5	70%	0.695	72%	0.721	S	S	*	*			trans	-95.1	178.1	-179.8	38.8	-35.4	0	0	0	114.5
405	A	28	Very low	31.6	Very low	100 Å²	100	136.6 Å²	136.6	83%	0.826	72%	0.72	S	S	*	*			trans	73.7	70.8	167.4	0	0	0	0	0	117.4
406	T	35.1	Very low	31.7	Very low	105 Å²	105	132.2 Å²	132.2	64%	0.644	71%	0.712	S	S	*	*			trans	-129.9	127.3	169.2	23	0	0	0	0	112.6
407	W	32.2	Very low	32.3	Very low	158 Å²	158	134.3 Å²	134.3	60%	0.598	72%	0.717	S	S	*	*			trans	60.5	79.6	163.4	-59.9	99.4	0	0	0	120.1	D795	W407-D795 VanDerWaalsContact CZ2-OD2 3.23Å; W407-D795 WeakPolarHBondContact CZ2-OD2 3.47Å; W407-D795 VanDerWaalsContact NE1-CG 3.33Å; W407-D795 PolarHBondContact NE1-OD1 2.92Å; W407-D795 PolarHBondContact NE1-OD2 3.11Å
408	H	28.9	Very low	33.4	Very low	183 Å²	183	133 Å²	133	85%	0.847	71%	0.706	S	S	*	*			trans	-61.5	131.7	152.7	-73	-84.7	0	0	0	112
409	S	29.1	Very low	35.5	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	69%	0.692	S	S	*	*			trans	-146.7	98.3	146.9	-82.4	0	0	0	0	110.6
410	R	28.4	Very low	38.2	Very low	190 Å²	190	125.3 Å²	125.3	72%	0.717	67%	0.669	S	S	*	*	S	Bend	trans	38.1	122	131.7	-81.9	-167.2	174.1	-118.7	4.5	117.9
411	E	28	Very low	40.9	Very low	138 Å²	138	117.5 Å²	117.5	65%	0.645	64%	0.642	S	S	*	*	S	Bend	cis	-141.2	145.1	13	-57.5	-163.9	147.2	0	0	113.4
412	T	29.1	Very low	43.6	Very low	146 Å²	146	109.7 Å²	109.7	90%	0.896	61%	0.612	S	S	*	*			trans	58	68.7	171.9	33.3	0	0	0	0	117.6
413	S	28.9	Very low	46.2	Very low	111 Å²	111	108.4 Å²	108.4	78%	0.776	60%	0.603	S	S	*	*			trans	-69.6	171.1	159	-35.2	0	0	0	0	111.1
414	P	36.6	Very low	49	Very low	117 Å²	117	108.1 Å²	108.1	76%	0.76	61%	0.607	S	S	*	*				-115.4	155.8	-125.2	39	-29.4	0	0	0	116.3	S416	P414-S416 PolarHBondContact O-N 2.8Å
415	I	35.1	Very low	51.4	Low	116 Å²	116	103.6 Å²	103.6	60%	0.595	58%	0.578	S	S	*	*			trans	-75.5	115.9	167.5	-61.3	177.6	0	0	0	108.8	T421 Q423	I415-T421 HydrophobicContact CG2-CG2 4.13Å; I415-Q423 VanDerWaalsContact CD1-NE2 3.28Å
416	S	34.7	Very low	53.9	Low	88 Å²	88	108.1 Å²	108.1	62%	0.615	58%	0.579	S	S	*	*			trans	-78.8	147.5	-172.3	55.1	0	0	0	0	114.5	P414 H418	P414-S416 PolarHBondContact O-N 2.8Å; S416-H418 PolarHBondContact O-N 2.8Å
417	S	46	Very low	56	Low	105 Å²	105	109.1 Å²	109.1	73%	0.734	58%	0.576	S	S	*	*	S	Bend	trans	69.9	0.9	152.1	78.3	0	0	0	0	120.5
418	H	57.4	Low	58.1	Low	129 Å²	129	103.7 Å²	103.7	60%	0.597	57%	0.57	S	S	*	*			trans	-111.8	129.3	176.9	-70.3	-7.1	0	0	0	112.2	S416 V420 T421	S416-H418 PolarHBondContact O-N 2.8Å; H418-V420 PolarHBondContact O-N 3.37Å; H418-T421 HydrophobicContact CB-CG2 4.43Å
419	P	75.9	Confident	60.7	Low	65 Å²	65	98.5 Å²	98.5	42%	0.422	55%	0.548	S	S	.	.	S	Bend	trans	-75	-9.3	-178.2	32.3	-36.6	0	0	0	113.1	V435 I436 V482	P419-V435 CarbonylContact O-C 3.59Å; P419-V435 WeakPolarHBondContact O-CA 3.24Å; P419-I436 PolarHBondContact O-N 3.48Å; P419-V482 HydrophobicContact CB-CG1 4.14Å; P419-V482 HydrophobicContact CG-CG1 4.16Å
420	V	87.3	Confident	63.5	Low	25 Å²	25	96.4 Å²	96.4	15%	0.152	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	132.5	173.7	173.9	0	0	0	0	109	H418 W422 R434 V435 V482	H418-V420 PolarHBondContact O-N 3.37Å; V420-W422 VanDerWaalsContact CG1-NE1 3.27Å; V420-R434 WeakPolarHBondContact CA-O 3.33Å; V420-V435 HydrophobicContact CG1-CG2 4.25Å; V420-V435 HydrophobicContact CG2-CB 4.41Å; V420-V435 HydrophobicContact CG2-CG1 4.08Å; V420-V435 HydrophobicContact CG2-CG2 4.09Å; V420-V482 WeakPolarHBondContact CG2-O 3.14Å
421	T	89.7	Confident	66.5	Low	32 Å²	32	88.4 Å²	88.4	20%	0.196	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.6	171.2	60.9	0	0	0	0	109.7	I415 H418 G433 R434	I415-T421 HydrophobicContact CG2-CG2 4.13Å; H418-T421 HydrophobicContact CB-CG2 4.43Å; T421-G433 CarbonylContact O-C 3.57Å; T421-G433 WeakPolarHBondContact O-CA 3.45Å; T421-R434 PolarHBondContact N-O 3.29Å; T421-R434 PolarHBondContact O-N 2.96Å
422	W	89.2	Confident	69.5	Low	65 Å²	65	84.4 Å²	84.4	25%	0.246	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	135.3	174.2	-66.9	92.9	0	0	0	110.4	V420 L431 I432 G433 V524 R526	V420-W422 VanDerWaalsContact CG1-NE1 3.27Å; W422-L431 HydrophobicContact CB-CD2 4.29Å; W422-L431 HydrophobicContact CE3-CB 3.99Å; W422-L431 HydrophobicContact CZ3-CB 4.5Å; W422-I432 WeakPolarHBondContact CA-O 3.47Å; W422-G433 VanDerWaalsContact CZ3-CA 3.46Å; W422-V524 HydrophobicContact CH2-CG2 3.46Å; W422-V524 VanDerWaalsContact CH2-CG2 3.46Å; W422-V524 HydrophobicContact CZ2-CG2 4.33Å; W422-V524 HydrophobicContact CZ3-CG2 3.91Å; W422-R526 HydrophobicContact CH2-CG 4.46Å; W422-R526 VanDerWaalsContact CZ2-CZ 3.5Å; W422-R526 VanDerWaalsContact CZ2-NH1 3.3Å; W422-R526 HydrophobicContact CZ3-CG 3.95Å
423	Q	87.4	Confident	72.6	Confident	88 Å²	88	77.4 Å²	77.4	41%	0.411	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.3	178.8	-66.5	-178.1	-17.1	0	0	109.8	I415 L431 I432	I415-Q423 VanDerWaalsContact CD1-NE2 3.28Å; Q423-L431 CarbonylContact O-C 3.5Å; Q423-L431 WeakPolarHBondContact O-CA 3.45Å; Q423-I432 PolarHBondContact N-O 3.03Å; Q423-I432 PolarHBondContact O-N 3.24Å
424	P	87.2	Confident	75.7	Confident	94 Å²	94	78.2 Å²	78.2	61%	0.61	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.6	146.2	168.5	-23.2	34.8	0	0	0	112	I528	P424-I528 HydrophobicContact CB-CD1 4.25Å
425	S	84.7	Confident	78.4	Confident	11 Å²	11	72.7 Å²	72.7	8%	0.077	38%	0.384	C	S	.	.			trans	-62	156.2	164.8	51.6	0	0	0	0	111	E427 G428 D429 R430	S425-E427 PolarHBondContact O-N 3.43Å; S425-G428 PolarHBondContact O-N 3.45Å; S425-G428 PolarHBondContact OG-N 3.43Å; S425-D429 PolarHBondContact OG-N 3.44Å; S425-D429 PolarHBondContact OG-OD1 3.21Å; S425-R430 WeakPolarHBondContact CB-O 3.22Å; S425-R430 PolarHBondContact N-O 2.85Å; S425-R430 PolarHBondContact OG-N 2.85Å; S425-R430 PolarHBondContact OG-O 3.25Å
426	K	80.6	Confident	81.2	Confident	196 Å²	196	70.2 Å²	70.2	85%	0.852	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.5	174	63.3	-176.1	-177.3	-171.9	0	112.4
427	E	79.4	Confident	83.8	Confident	125 Å²	125	66 Å²	66	58%	0.584	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-17.2	172.8	-62.6	82	-178.3	0	0	113.5	S425 D429	S425-E427 PolarHBondContact O-N 3.43Å; E427-D429 PolarHBondContact O-N 2.85Å
428	G	77.2	Confident	85.9	Confident	45 Å²	45	63.9 Å²	63.9	46%	0.464	32%	0.323	S	S	.	.	S	Bend	trans	72.4	7.9	-177.4	0	0	0	0	0	115.5	S425 I528	S425-G428 PolarHBondContact O-N 3.45Å; S425-G428 PolarHBondContact OG-N 3.43Å; G428-I528 VanDerWaalsContact O-CD1 3.3Å; G428-I528 WeakPolarHBondContact O-CD1 3.37Å
429	D	83.8	Confident	87.2	Confident	74 Å²	74	61 Å²	61	40%	0.396	31%	0.309	S	S	.	.	S	Bend	trans	-93.2	-26.3	-177.6	80.3	-42.5	0	0	0	113.5	S425 E427 I528	S425-D429 PolarHBondContact OG-N 3.44Å; S425-D429 PolarHBondContact OG-OD1 3.21Å; E427-D429 PolarHBondContact O-N 2.85Å; D429-I528 WeakPolarHBondContact O-CB 3.24Å; D429-I528 PolarHBondContact O-N 2.97Å
430	R	87.5	Confident	87.4	Confident	64 Å²	64	67.1 Å²	67.1	24%	0.242	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154	-173.1	-72.7	155.9	-169.4	-103.8	-5.7	112.9	S425 E490 R526 I528	S425-R430 WeakPolarHBondContact CB-O 3.22Å; S425-R430 PolarHBondContact N-O 2.85Å; S425-R430 PolarHBondContact OG-N 2.85Å; S425-R430 PolarHBondContact OG-O 3.25Å; R430-E490 IonicContact NH1-OE2 2.74Å; R430-E490 PolarHBondContact NH1-OE2 2.93Å; R430-R526 CarbonylContact C-O 3.59Å; R430-R526 WeakPolarHBondContact CA-O 3.46Å; R430-R526 WeakPolarHBondContact CB-O 3.45Å; R430-I528 VanDerWaalsContact O-CD1 3.28Å; R430-I528 WeakPolarHBondContact O-CD1 3.41Å
431	L	90.5	Very high	87	Confident	22 Å²	22	68.9 Å²	68.9	12%	0.115	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124.7	165.8	-80.1	142.3	0	0	0	109.1	W422 Q423 S525 R526 I528 I531	W422-L431 HydrophobicContact CB-CD2 4.29Å; W422-L431 HydrophobicContact CE3-CB 3.99Å; W422-L431 HydrophobicContact CZ3-CB 4.5Å; Q423-L431 CarbonylContact O-C 3.5Å; Q423-L431 WeakPolarHBondContact O-CA 3.45Å; L431-S525 VanDerWaalsContact O-CA 3.27Å; L431-S525 WeakPolarHBondContact O-CA 3.47Å; L431-R526 HydrophobicContact CB-CG 4.21Å; L431-R526 PolarHBondContact N-O 3.11Å; L431-R526 PolarHBondContact O-N 2.84Å; L431-I528 HydrophobicContact CB-CG1 4.46Å; L431-I528 HydrophobicContact CD1-CG1 3.7Å; L431-I528 HydrophobicContact CG-CD1 4.25Å; L431-I528 HydrophobicContact CG-CG1 3.59Å; L431-I531 HydrophobicContact CD1-CB 4.41Å; L431-I531 HydrophobicContact CD1-CD1 3.53Å; L431-I531 HydrophobicContact CD1-CG1 3.89Å
432	I	92.4	Very high	85.8	Confident	54 Å²	54	74 Å²	74	28%	0.277	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	119.4	173.8	-57.6	176	0	0	0	107.7	W422 Q423 L492 I523 V524	W422-I432 WeakPolarHBondContact CA-O 3.47Å; Q423-I432 PolarHBondContact N-O 3.03Å; Q423-I432 PolarHBondContact O-N 3.24Å; I432-L492 HydrophobicContact CG2-CD1 4.48Å; I432-I523 HydrophobicContact CG2-CG2 3.54Å; I432-V524 CarbonylContact C-O 3.49Å; I432-V524 VanDerWaalsContact CA-O 3.31Å; I432-V524 WeakPolarHBondContact CA-O 3.33Å
433	G	92.9	Very high	84.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.7	178	0	0	0	0	0	110.8	T421 W422 I523 V524	T421-G433 CarbonylContact O-C 3.57Å; T421-G433 WeakPolarHBondContact O-CA 3.45Å; W422-G433 VanDerWaalsContact CZ3-CA 3.46Å; G433-I523 CarbonylContact O-C 3.53Å; G433-I523 VanDerWaalsContact O-CA 3.32Å; G433-I523 WeakPolarHBondContact O-CA 3.48Å; G433-V524 PolarHBondContact N-O 2.86Å; G433-V524 WeakPolarHBondContact O-CG2 3.22Å; G433-V524 PolarHBondContact O-N 2.78Å
434	R	94.6	Very high	83	Confident	128 Å²	128	72.8 Å²	72.8	48%	0.483	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.8	164.1	-56.4	-165.4	177.8	-170.5	-1.8	108.8	V420 T421 I523	V420-R434 WeakPolarHBondContact CA-O 3.33Å; T421-R434 PolarHBondContact N-O 3.29Å; T421-R434 PolarHBondContact O-N 2.96Å; R434-I523 HydrophobicContact CG-CD1 3.99Å; R434-I523 HydrophobicContact CG-CG1 4.02Å; R434-I523 HydrophobicContact CG-CG2 4.41Å
435	V	94	Very high	81.7	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	117.2	-168.3	175.8	0	0	0	0	110.4	P419 V420 L437 L485 E521 I522	P419-V435 CarbonylContact O-C 3.59Å; P419-V435 WeakPolarHBondContact O-CA 3.24Å; V420-V435 HydrophobicContact CG1-CG2 4.25Å; V420-V435 HydrophobicContact CG2-CB 4.41Å; V420-V435 HydrophobicContact CG2-CG1 4.08Å; V420-V435 HydrophobicContact CG2-CG2 4.09Å; V435-L437 HydrophobicContact CG1-CD2 3.72Å; V435-L437 HydrophobicContact CG1-CG 3.92Å; V435-L485 HydrophobicContact CB-CD2 4.42Å; V435-L485 HydrophobicContact CG1-CD1 4.3Å; V435-L485 HydrophobicContact CG1-CD2 4.4Å; V435-L485 HydrophobicContact CG1-CG 4.32Å; V435-L485 HydrophobicContact CG2-CD2 3.89Å; V435-E521 CarbonylContact O-C 3.53Å; V435-E521 WeakPolarHBondContact O-CA 3.4Å; V435-I522 PolarHBondContact N-O 3.08Å; V435-I522 PolarHBondContact O-N 3.27Å
436	I	92.9	Very high	80.3	Confident	64 Å²	64	83.4 Å²	83.4	33%	0.328	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	104.9	-178.5	-56.1	175	0	0	0	109.5	P419 E521	P419-I436 PolarHBondContact O-N 3.48Å; I436-E521 HydrophobicContact CG1-CB 4.41Å; I436-E521 HydrophobicContact CG1-CG 4.15Å
437	L	90.2	Very high	79.1	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	101.1	179.6	-56.3	-177	0	0	0	111.3	V435 K439 L451 L453 A479 V482 L485 Q519 V520 I522	V435-L437 HydrophobicContact CG1-CD2 3.72Å; V435-L437 HydrophobicContact CG1-CG 3.92Å; L437-K439 PolarHBondContact O-N 2.9Å; L437-L451 HydrophobicContact CB-CD2 3.68Å; L437-L451 HydrophobicContact CD1-CB 4.35Å; L437-L451 HydrophobicContact CD1-CD1 4.45Å; L437-L451 HydrophobicContact CD1-CD2 4.05Å; L437-L453 HydrophobicContact CD1-CD2 4.06Å; L437-A479 HydrophobicContact CD1-CB 4.13Å; L437-V482 HydrophobicContact CD2-CB 4.27Å; L437-V482 HydrophobicContact CD2-CG1 4.36Å; L437-L485 HydrophobicContact CD1-CD1 4.27Å; L437-Q519 CarbonylContact O-C 3.53Å; L437-Q519 WeakPolarHBondContact O-CA 3.44Å; L437-V520 PolarHBondContact N-O 3.01Å; L437-V520 PolarHBondContact O-N 2.86Å; L437-I522 HydrophobicContact CD1-CD1 4.01Å
438	N	88.4	Confident	77.5	Confident	60 Å²	60	70.2 Å²	70.2	32%	0.321	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.5	172.8	-176.4	-9.8	0	0	0	110.8	R440 T441 P518	N438-R440 PolarHBondContact O-N 2.6Å; N438-R440 VanDerWaalsContact OD1-CB 3.32Å; N438-R440 WeakPolarHBondContact OD1-CB 3.38Å; N438-R440 PolarHBondContact OD1-N 3.01Å; N438-T441 WeakPolarHBondContact O-CB 3.42Å; N438-T441 PolarHBondContact O-N 3.44Å; N438-T441 PolarHBondContact O-OG1 2.85Å; N438-P518 PolarHBondContact OD1-O 3.35Å
439	K	86.2	Confident	76.3	Confident	70 Å²	70	73.5 Å²	73.5	30%	0.304	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.6	179.8	-60	176.6	-169.7	145.7	0	113.4	L437 T441 L451 S514 K515 E517 P518	L437-K439 PolarHBondContact O-N 2.9Å; K439-T441 VanDerWaalsContact C-N 3.33Å; K439-L451 HydrophobicContact CG-CD2 3.85Å; K439-S514 PolarHBondContact NZ-O 3.12Å; K439-K515 VanDerWaalsContact NZ-C 3.35Å; K439-K515 PolarHBondContact NZ-O 2.97Å; K439-E517 WeakPolarHBondContact CD-O 3.46Å; K439-E517 WeakPolarHBondContact CE-O 3.39Å; K439-E517 PolarHBondContact NZ-O 2.73Å; K439-P518 WeakPolarHBondContact CB-O 3.43Å; K439-P518 PolarHBondContact N-O 3.16Å
440	R	80.4	Confident	75.7	Confident	193 Å²	193	76 Å²	76	73%	0.728	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-9.3	176.2	-57.9	-178.7	175.8	168.6	0.5	112.7	N438 T442 P518	N438-R440 PolarHBondContact O-N 2.6Å; N438-R440 VanDerWaalsContact OD1-CB 3.32Å; N438-R440 WeakPolarHBondContact OD1-CB 3.38Å; N438-R440 PolarHBondContact OD1-N 3.01Å; R440-T442 PolarHBondContact O-N 2.97Å; R440-P518 HydrophobicContact CG-CB 4.37Å
441	T	78	Confident	75.6	Confident	62 Å²	62	74 Å²	74	38%	0.38	39%	0.388	S	S	.	.	S	Bend	trans	-63.3	123.2	177.3	-64.5	0	0	0	0	110.8	N438 K439 M443 L478	N438-T441 WeakPolarHBondContact O-CB 3.42Å; N438-T441 PolarHBondContact O-N 3.44Å; N438-T441 PolarHBondContact O-OG1 2.85Å; K439-T441 VanDerWaalsContact C-N 3.33Å; T441-M443 HydrophobicContact CG2-SD 4.47Å; T441-M443 PolarHBondContact O-N 2.83Å; T441-L478 HydrophobicContact CG2-CD2 4.05Å
442	T	64.4	Low	75.4	Confident	138 Å²	138	73.6 Å²	73.6	85%	0.847	39%	0.389	S	S	*	.			trans	-74.1	89	-177.7	51.7	0	0	0	0	111.3	R440	R440-T442 PolarHBondContact O-N 2.97Å
443	M	60.9	Low	75.4	Confident	42 Å²	42	72.5 Å²	72.5	21%	0.207	38%	0.384	C	S	.	.			trans	-70.4	160.9	173.1	-69.2	-57.7	-73.7	0	0	112.6	T441 G476 L478 V481	T441-M443 HydrophobicContact CG2-SD 4.47Å; T441-M443 PolarHBondContact O-N 2.83Å; M443-G476 VanDerWaalsContact CE-O 3.26Å; M443-G476 WeakPolarHBondContact CE-O 3.48Å; M443-L478 HydrophobicContact CG-CD2 3.62Å; M443-L478 HydrophobicContact CG-CG 3.72Å; M443-L478 HydrophobicContact SD-CD2 3.53Å; M443-L478 VanDerWaalsContact SD-CD2 3.53Å; M443-L478 HydrophobicContact SD-CG 4.12Å; M443-V481 HydrophobicContact CE-CB 3.79Å; M443-V481 HydrophobicContact CE-CG1 4.13Å; M443-V481 HydrophobicContact CE-CG2 3.91Å
444	P	57.9	Low	75.4	Confident	87 Å²	87	78.2 Å²	78.2	57%	0.565	41%	0.409	S	S	*	.			trans	-48.4	147.7	163.4	-27.3	36.5	0	0	0	112.1	E446 S447	P444-E446 PolarHBondContact O-N 2.88Å; P444-S447 WeakPolarHBondContact O-CB 3.5Å; P444-S447 PolarHBondContact O-N 2.97Å; P444-S447 VanDerWaalsContact O-N 3.11Å; P444-S447 PolarHBondContact O-OG 2.75Å
445	K	58.5	Low	75.3	Confident	194 Å²	194	73.1 Å²	73.1	84%	0.843	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-7.5	-164.4	-134.6	172.3	-171.8	173.5	0	115.1
446	E	55.9	Low	75.2	Confident	134 Å²	134	75.4 Å²	75.4	63%	0.626	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-16.4	-176.9	-65.6	159.4	-116.6	0	0	112.9	P444 G448	P444-E446 PolarHBondContact O-N 2.88Å; E446-G448 VanDerWaalsContact C-N 3.3Å; E446-G448 PolarHBondContact O-N 2.87Å
447	S	56	Low	75	Confident	13 Å²	13	72.6 Å²	72.6	9%	0.091	39%	0.392	C	S	.	.	S	Bend	trans	-70.1	-23.6	-174.1	-55.3	0	0	0	0	114.3	P444 G476	P444-S447 WeakPolarHBondContact O-CB 3.5Å; P444-S447 PolarHBondContact O-N 2.97Å; P444-S447 VanDerWaalsContact O-N 3.11Å; P444-S447 PolarHBondContact O-OG 2.75Å; S447-G476 VanDerWaalsContact CB-O 3.25Å; S447-G476 WeakPolarHBondContact CB-O 3.43Å; S447-G476 PolarHBondContact OG-O 2.78Å
448	G	44.7	Very low	74.8	Confident	31 Å²	31	74 Å²	74	32%	0.32	41%	0.407	S	S	.	.			trans	74.6	154.3	-172.9	0	0	0	0	0	113.8	E446 L450	E446-G448 VanDerWaalsContact C-N 3.3Å; E446-G448 PolarHBondContact O-N 2.87Å; G448-L450 PolarHBondContact O-N 2.9Å
449	A	52.3	Low	74.6	Confident	113 Å²	113	76.8 Å²	76.8	93%	0.934	42%	0.416	S	S	*	.	S	Bend	trans	-78.6	37.7	-177	0	0	0	0	0	113.9
450	L	70.7	Confident	74.5	Confident	126 Å²	126	79 Å²	79	66%	0.66	43%	0.429	S	S	*	.	S	Bend	trans	-131.6	150.5	-177.6	-66	173.1	0	0	0	109.4	G448 G452	G448-L450 PolarHBondContact O-N 2.9Å; L450-G452 PolarHBondContact O-N 3.35Å
451	L	85.3	Confident	74.6	Confident	23 Å²	23	70.4 Å²	70.4	12%	0.12	40%	0.398	C	S	.	.			trans	-54.1	-29.4	175.8	-62.1	-179.1	0	0	0	112.7	L437 K439 L453 S477 L478 A479 W494 V520	L437-L451 HydrophobicContact CB-CD2 3.68Å; L437-L451 HydrophobicContact CD1-CB 4.35Å; L437-L451 HydrophobicContact CD1-CD1 4.45Å; L437-L451 HydrophobicContact CD1-CD2 4.05Å; K439-L451 HydrophobicContact CG-CD2 3.85Å; L451-L453 HydrophobicContact CB-CD2 4.16Å; L451-L453 HydrophobicContact CB-CG 4.27Å; L451-L453 HydrophobicContact CD1-CD2 4.4Å; L451-S477 PolarHBondContact O-OG 2.82Å; L451-L478 HydrophobicContact CD2-CD1 4.19Å; L451-A479 WeakPolarHBondContact O-CB 3.34Å; L451-A479 PolarHBondContact O-N 3.49Å; L451-W494 HydrophobicContact CD1-CH2 4.18Å; L451-V520 HydrophobicContact CD1-CB 4.21Å; L451-V520 HydrophobicContact CD1-CG2 4.1Å
452	G	87.7	Confident	74.6	Confident	13 Å²	13	75 Å²	75	13%	0.134	42%	0.42	C	S	.	.			trans	88.6	-4.9	172.8	0	0	0	0	0	115.5	L450 K474	L450-G452 PolarHBondContact O-N 3.35Å; G452-K474 PolarHBondContact O-N 2.82Å
453	L	91.5	Very high	75.1	Confident	31 Å²	31	74.3 Å²	74.3	16%	0.162	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	155.6	172.3	66.2	91	0	0	0	112.4	L437 L451 V455 K472 A479 L485 W494 I522	L437-L453 HydrophobicContact CD1-CD2 4.06Å; L451-L453 HydrophobicContact CB-CD2 4.16Å; L451-L453 HydrophobicContact CB-CG 4.27Å; L451-L453 HydrophobicContact CD1-CD2 4.4Å; L453-V455 HydrophobicContact CD1-CG2 3.47Å; L453-V455 VanDerWaalsContact CD1-CG2 3.47Å; L453-K472 CarbonylContact C-O 3.58Å; L453-K472 WeakPolarHBondContact CA-O 3.46Å; L453-A479 HydrophobicContact CB-CB 3.88Å; L453-A479 HydrophobicContact CD2-CB 4.01Å; L453-A479 HydrophobicContact CG-CB 4.41Å; L453-L485 HydrophobicContact CD2-CD1 3.87Å; L453-W494 HydrophobicContact CD1-CH2 4.01Å; L453-W494 HydrophobicContact CD1-CZ3 3.88Å; L453-W494 HydrophobicContact CD2-CZ3 4.34Å; L453-I522 HydrophobicContact CD2-CD1 3.59Å
454	K	92.9	Very high	76	Confident	121 Å²	121	74.9 Å²	74.9	53%	0.526	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	107	167.9	-175.4	-166	171.5	-168.6	0	110.9	T471 K472	K454-T471 PolarHBondContact O-N 3.37Å; K454-T471 PolarHBondContact O-OG1 2.88Å; K454-K472 HydrophobicContact CB-CB 4.32Å; K454-K472 PolarHBondContact N-O 3.16Å
455	V	93.4	Very high	77.4	Confident	20 Å²	20	75 Å²	75	12%	0.121	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	151.6	170.7	-163.9	0	0	0	0	110.8	L453 A468 F469 V491 W494 V507 I511	L453-V455 HydrophobicContact CD1-CG2 3.47Å; L453-V455 VanDerWaalsContact CD1-CG2 3.47Å; V455-A468 HydrophobicContact CG1-CB 3.82Å; V455-F469 CarbonylContact C-O 3.56Å; V455-F469 VanDerWaalsContact CA-O 3.3Å; V455-F469 WeakPolarHBondContact CA-O 3.41Å; V455-V491 HydrophobicContact CG1-CG2 4.1Å; V455-V491 HydrophobicContact CG2-CG2 4.37Å; V455-W494 HydrophobicContact CG2-CZ3 4.03Å; V455-V507 HydrophobicContact CG1-CG1 4.1Å; V455-I511 HydrophobicContact CB-CD1 3.65Å; V455-I511 HydrophobicContact CG1-CD1 4.2Å; V455-I511 HydrophobicContact CG2-CD1 3.77Å
456	V	91.4	Very high	78.8	Confident	49 Å²	49	68.2 Å²	68.2	30%	0.297	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	119.6	162.5	173.8	0	0	0	0	108.5	A468 F469 T471	V456-A468 WeakPolarHBondContact O-CA 3.25Å; V456-F469 PolarHBondContact N-O 2.95Å; V456-F469 PolarHBondContact O-N 2.96Å; V456-T471 HydrophobicContact CB-CG2 3.82Å; V456-T471 HydrophobicContact CG2-CG2 3.56Å
457	G	89.4	Confident	80.5	Confident	4 Å²	4	61.9 Å²	61.9	4%	0.041	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	169.8	173.6	0	0	0	0	0	113.5	K459 N504	G457-K459 VanDerWaalsContact C-N 3.28Å; G457-K459 PolarHBondContact O-N 3.41Å; G457-N504 PolarHBondContact O-ND2 2.8Å
458	G	84.2	Confident	82.3	Confident	31 Å²	31	61.2 Å²	61.2	32%	0.32	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.7	17.3	175.2	0	0	0	0	0	115.7	G467 A502	G458-G467 PolarHBondContact N-O 3.35Å; G458-A502 PolarHBondContact N-O 3.14Å
459	K	84.3	Confident	84.7	Confident	117 Å²	117	61 Å²	61	51%	0.509	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.7	170.6	-174	-165.5	166.6	-156.6	0	108.8	G457 T461 L466 G467 F469	G457-K459 VanDerWaalsContact C-N 3.28Å; G457-K459 PolarHBondContact O-N 3.41Å; K459-T461 PolarHBondContact O-N 2.82Å; K459-L466 CarbonylContact O-C 3.55Å; K459-G467 PolarHBondContact N-O 2.83Å; K459-G467 PolarHBondContact O-N 2.94Å; K459-F469 HydrophobicContact CB-CD2 3.82Å; K459-F469 HydrophobicContact CB-CE2 3.97Å; K459-F469 HydrophobicContact CD-CD2 3.68Å; K459-F469 HydrophobicContact CD-CE2 3.79Å; K459-F469 HydrophobicContact CD-CG 4.2Å; K459-F469 HydrophobicContact CD-CZ 4.39Å; K459-F469 HydrophobicContact CG-CD2 4.27Å; K459-F469 HydrophobicContact CG-CE2 4.21Å
460	M	84	Confident	86.7	Confident	118 Å²	118	55.7 Å²	55.7	58%	0.581	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	131	172.2	-153.5	68.8	78.2	0	0	110.7	L466	M460-L466 HydrophobicContact CE-CD2 4.32Å; M460-L466 HydrophobicContact SD-CD2 4.12Å
461	T	83	Confident	87.7	Confident	11 Å²	11	52.6 Å²	52.6	7%	0.067	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-83.6	165.4	168	62.4	0	0	0	0	110.4	K459 L463 G464 R465 F469 E490	K459-T461 PolarHBondContact O-N 2.82Å; T461-L463 PolarHBondContact O-N 3.15Å; T461-L463 PolarHBondContact OG1-N 2.87Å; T461-G464 PolarHBondContact O-N 3.05Å; T461-R465 WeakPolarHBondContact CB-O 3.3Å; T461-R465 HydrophobicContact CG2-CG 3.87Å; T461-R465 WeakPolarHBondContact CG2-O 3.35Å; T461-R465 PolarHBondContact N-O 3.14Å; T461-R465 WeakPolarHBondContact OG1-CG 3.35Å; T461-R465 PolarHBondContact OG1-N 2.88Å; T461-R465 PolarHBondContact OG1-O 2.97Å; T461-F469 HydrophobicContact CG2-CE2 4.1Å; T461-F469 HydrophobicContact CG2-CZ 3.91Å; T461-E490 WeakPolarHBondContact CG2-OE1 3.29Å
462	D	77.7	Confident	88.1	Confident	159 Å²	159	58.5 Å²	58.5	85%	0.85	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.6	175	-41.7	-69.6	0	0	0	112.5	G464	D462-G464 VanDerWaalsContact C-N 3.29Å
463	L	76.3	Confident	88.4	Confident	124 Å²	124	59.6 Å²	59.6	65%	0.649	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	5.3	174.1	-58.8	177.7	0	0	0	113.4	T461 R465	T461-L463 PolarHBondContact O-N 3.15Å; T461-L463 PolarHBondContact OG1-N 2.87Å; L463-R465 PolarHBondContact O-N 2.79Å; L463-R465 VanDerWaalsContact O-N 3.17Å
464	G	79.1	Confident	88.3	Confident	54 Å²	54	63.7 Å²	63.7	56%	0.557	33%	0.333	S	S	*	.	S	Bend	trans	72.5	2.1	179.2	0	0	0	0	0	115.6	T461 D462	T461-G464 PolarHBondContact O-N 3.05Å; D462-G464 VanDerWaalsContact C-N 3.29Å
465	R	86.8	Confident	88	Confident	89 Å²	89	67.3 Å²	67.3	34%	0.336	35%	0.348	S	S	.	.	S	Bend	trans	-84.2	153	167.9	67.1	172.2	-171	-138.9	0.7	110.9	T461 L463 E490	T461-R465 WeakPolarHBondContact CB-O 3.3Å; T461-R465 HydrophobicContact CG2-CG 3.87Å; T461-R465 WeakPolarHBondContact CG2-O 3.35Å; T461-R465 PolarHBondContact N-O 3.14Å; T461-R465 WeakPolarHBondContact OG1-CG 3.35Å; T461-R465 PolarHBondContact OG1-N 2.88Å; T461-R465 PolarHBondContact OG1-O 2.97Å; L463-R465 PolarHBondContact O-N 2.79Å; L463-R465 VanDerWaalsContact O-N 3.17Å; R465-E490 IonicContact CZ-OE1 3.87Å; R465-E490 IonicContact NE-OE1 2.74Å; R465-E490 PolarHBondContact NE-OE1 2.89Å; R465-E490 IonicContact NH2-OE1 2.66Å; R465-E490 PolarHBondContact NH2-OE1 3.33Å; R465-E490 IonicContact NH2-OE2 3.86Å; R465-E490 PolarHBondContact NH2-OE2 2.85Å
466	L	89.1	Confident	87.6	Confident	52 Å²	52	67.6 Å²	67.6	27%	0.272	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	148.1	161.9	-60	-178	0	0	0	109.8	K459 M460 G501	K459-L466 CarbonylContact O-C 3.55Å; M460-L466 HydrophobicContact CE-CD2 4.32Å; M460-L466 HydrophobicContact SD-CD2 4.12Å; L466-G501 PolarHBondContact O-N 3.06Å
467	G	90.2	Very high	87.5	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	160.1	176.2	0	0	0	0	0	112.2	G458 K459	G458-G467 PolarHBondContact N-O 3.35Å; K459-G467 PolarHBondContact N-O 2.83Å; K459-G467 PolarHBondContact O-N 2.94Å
468	A	94.5	Very high	87.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.4	173.6	0	0	0	0	0	109.7	V455 V456 E490 V491 L499 V507	V455-A468 HydrophobicContact CG1-CB 3.82Å; V456-A468 WeakPolarHBondContact O-CA 3.25Å; A468-E490 CarbonylContact O-C 3.58Å; A468-E490 WeakPolarHBondContact O-CA 3.33Å; A468-V491 HydrophobicContact CB-CB 4.16Å; A468-V491 PolarHBondContact O-N 2.88Å; A468-L499 HydrophobicContact CB-CB 3.77Å; A468-L499 HydrophobicContact CB-CD1 3.64Å; A468-L499 HydrophobicContact CB-CG 4.37Å; A468-V507 HydrophobicContact CB-CG1 4.1Å; A468-V507 HydrophobicContact CB-CG2 4.02Å
469	F	94.4	Very high	87.8	Confident	25 Å²	25	64.1 Å²	64.1	11%	0.11	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.2	-175.4	-69.3	-95.8	0	0	0	112	V455 V456 K459 T461 T471 D489 E490	V455-F469 CarbonylContact C-O 3.56Å; V455-F469 VanDerWaalsContact CA-O 3.3Å; V455-F469 WeakPolarHBondContact CA-O 3.41Å; V456-F469 PolarHBondContact N-O 2.95Å; V456-F469 PolarHBondContact O-N 2.96Å; K459-F469 HydrophobicContact CB-CD2 3.82Å; K459-F469 HydrophobicContact CB-CE2 3.97Å; K459-F469 HydrophobicContact CD-CD2 3.68Å; K459-F469 HydrophobicContact CD-CE2 3.79Å; K459-F469 HydrophobicContact CD-CG 4.2Å; K459-F469 HydrophobicContact CD-CZ 4.39Å; K459-F469 HydrophobicContact CG-CD2 4.27Å; K459-F469 HydrophobicContact CG-CE2 4.21Å; T461-F469 HydrophobicContact CG2-CE2 4.1Å; T461-F469 HydrophobicContact CG2-CZ 3.91Å; F469-T471 PolarHBondContact O-N 3.03Å; F469-D489 WeakPolarHBondContact CA-O 3.44Å; F469-E490 HydrophobicContact CD1-CB 4.1Å; F469-E490 HydrophobicContact CD1-CG 4.5Å; F469-E490 HydrophobicContact CE1-CB 3.86Å; F469-E490 HydrophobicContact CE1-CG 4.1Å; F469-E490 HydrophobicContact CZ-CB 4.44Å; F469-E490 HydrophobicContact CZ-CG 4.18Å
470	I	94.5	Very high	88.1	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	112.7	169.7	-56.6	-171.9	0	0	0	108.3	V473 L485 R486 A487 G488 D489 V491 V524	I470-V473 HydrophobicContact CG2-CG2 3.53Å; I470-L485 HydrophobicContact CD1-CB 3.95Å; I470-L485 HydrophobicContact CD1-CD1 3.95Å; I470-L485 HydrophobicContact CD1-CD2 4.09Å; I470-L485 HydrophobicContact CD1-CG 4.22Å; I470-R486 WeakPolarHBondContact CB-O 3.35Å; I470-R486 WeakPolarHBondContact CG2-O 3.13Å; I470-A487 CarbonylContact O-C 3.55Å; I470-A487 WeakPolarHBondContact O-CA 3.42Å; I470-G488 PolarHBondContact O-N 2.75Å; I470-D489 HydrophobicContact CB-CB 4.3Å; I470-D489 HydrophobicContact CD1-CB 4.03Å; I470-D489 HydrophobicContact CG1-CB 4.17Å; I470-D489 PolarHBondContact N-O 3.21Å; I470-V491 HydrophobicContact CD1-CG2 4.27Å; I470-V491 HydrophobicContact CG1-CG2 3.69Å; I470-V524 HydrophobicContact CD1-CG1 4.13Å
471	T	93	Very high	88.3	Confident	61 Å²	61	59.2 Å²	59.2	37%	0.374	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-23.8	-176.7	59.1	0	0	0	0	113.8	K454 V456 F469	K454-T471 PolarHBondContact O-N 3.37Å; K454-T471 PolarHBondContact O-OG1 2.88Å; V456-T471 HydrophobicContact CB-CG2 3.82Å; V456-T471 HydrophobicContact CG2-CG2 3.56Å; F469-T471 PolarHBondContact O-N 3.03Å
472	K	92.7	Very high	88.5	Confident	148 Å²	148	60.4 Å²	60.4	64%	0.643	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.6	147.7	173.5	-64.7	-164.6	176.1	-164.6	0	110.1	L453 K454	L453-K472 CarbonylContact C-O 3.58Å; L453-K472 WeakPolarHBondContact CA-O 3.46Å; K454-K472 HydrophobicContact CB-CB 4.32Å; K454-K472 PolarHBondContact N-O 3.16Å
473	V	93.1	Very high	88.9	Confident	36 Å²	36	52.9 Å²	52.9	22%	0.218	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.4	165.2	-178.6	0	0	0	0	107.5	I470 A479 D480 L485	I470-V473 HydrophobicContact CG2-CG2 3.53Å; V473-A479 HydrophobicContact CG1-CB 3.93Å; V473-D480 HydrophobicContact CG1-CB 3.89Å; V473-L485 HydrophobicContact CG2-CB 4.36Å
474	K	89.5	Confident	89.6	Confident	116 Å²	116	52 Å²	52	50%	0.504	27%	0.271	S	S	.	.			trans	-77.9	121.7	173.4	-78.6	-170.1	173.2	-167.2	0	109.6	G452 G476 S477 D480	G452-K474 PolarHBondContact O-N 2.82Å; K474-G476 PolarHBondContact O-N 3.48Å; K474-S477 VanDerWaalsContact O-CB 3.25Å; K474-S477 WeakPolarHBondContact O-CB 3.44Å; K474-S477 PolarHBondContact O-N 2.87Å; K474-S477 VanDerWaalsContact O-N 3.1Å; K474-S477 PolarHBondContact O-OG 3Å; K474-D480 WeakPolarHBondContact O-CB 3.48Å
475	K	87.9	Confident	90.3	Very high	197 Å²	197	49.7 Å²	49.7	86%	0.857	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	134.6	170.7	-168.2	169.7	-175.5	173	0	110.2	S477 D480	K475-S477 VanDerWaalsContact C-N 3.35Å; K475-D480 WeakPolarHBondContact CA-OD2 3.45Å
476	G	84.1	Confident	90.5	Very high	26 Å²	26	51.4 Å²	51.4	27%	0.268	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	-0.3	-175.9	0	0	0	0	0	115.8	M443 S447 K474 D480	M443-G476 VanDerWaalsContact CE-O 3.26Å; M443-G476 WeakPolarHBondContact CE-O 3.48Å; S447-G476 VanDerWaalsContact CB-O 3.25Å; S447-G476 WeakPolarHBondContact CB-O 3.43Å; S447-G476 PolarHBondContact OG-O 2.78Å; K474-G476 PolarHBondContact O-N 3.48Å; G476-D480 PolarHBondContact N-OD2 3.26Å
477	S	89.1	Confident	90.7	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.007	27%	0.265	C	S	.	.	S	Bend	trans	-84.5	171.7	178.7	69.3	0	0	0	0	113.7	L451 K474 K475 A479 D480 V481	L451-S477 PolarHBondContact O-OG 2.82Å; K474-S477 VanDerWaalsContact O-CB 3.25Å; K474-S477 WeakPolarHBondContact O-CB 3.44Å; K474-S477 PolarHBondContact O-N 2.87Å; K474-S477 VanDerWaalsContact O-N 3.1Å; K474-S477 PolarHBondContact O-OG 3Å; K475-S477 VanDerWaalsContact C-N 3.35Å; S477-A479 VanDerWaalsContact C-N 3.29Å; S477-A479 PolarHBondContact O-N 3.33Å; S477-D480 PolarHBondContact O-N 2.85Å; S477-D480 VanDerWaalsContact O-N 3.12Å; S477-V481 PolarHBondContact O-N 3.44Å
478	L	89.1	Confident	90.7	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-55.6	-42.4	176.3	-77.1	167.3	0	0	0	112.3	T441 M443 L451 D480 V482 G483	T441-L478 HydrophobicContact CG2-CD2 4.05Å; M443-L478 HydrophobicContact CG-CD2 3.62Å; M443-L478 HydrophobicContact CG-CG 3.72Å; M443-L478 HydrophobicContact SD-CD2 3.53Å; M443-L478 VanDerWaalsContact SD-CD2 3.53Å; M443-L478 HydrophobicContact SD-CG 4.12Å; L451-L478 HydrophobicContact CD2-CD1 4.19Å; L478-D480 VanDerWaalsContact C-N 3.26Å; L478-D480 PolarHBondContact O-N 3.07Å; L478-V482 HydrophobicContact CD2-CG2 3.94Å; L478-V482 WeakPolarHBondContact O-CA 3.48Å; L478-V482 WeakPolarHBondContact O-CB 3.44Å; L478-V482 PolarHBondContact O-N 2.78Å; L478-G483 PolarHBondContact O-N 2.84Å
479	A	92.1	Very high	90.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-29.9	178.5	0	0	0	0	0	113.9	L437 L451 L453 V473 S477 G483 H484 L485	L437-A479 HydrophobicContact CD1-CB 4.13Å; L451-A479 WeakPolarHBondContact O-CB 3.34Å; L451-A479 PolarHBondContact O-N 3.49Å; L453-A479 HydrophobicContact CB-CB 3.88Å; L453-A479 HydrophobicContact CD2-CB 4.01Å; L453-A479 HydrophobicContact CG-CB 4.41Å; V473-A479 HydrophobicContact CG1-CB 3.93Å; S477-A479 VanDerWaalsContact C-N 3.29Å; S477-A479 PolarHBondContact O-N 3.33Å; A479-G483 CarbonylContact O-C 3.44Å; A479-G483 WeakPolarHBondContact O-CA 3.2Å; A479-H484 PolarHBondContact O-N 2.84Å; A479-H484 VanDerWaalsContact O-N 3.07Å; A479-L485 HydrophobicContact CB-CB 4.45Å; A479-L485 HydrophobicContact CB-CD1 4.07Å; A479-L485 WeakPolarHBondContact O-CB 3.31Å; A479-L485 PolarHBondContact O-N 3.5Å
480	D	90.7	Very high	90.7	Very high	54 Å²	54	54 Å²	54	29%	0.289	29%	0.29	S	S	.	.	H	α-helix	trans	-83.4	-58.3	179.3	-175.2	55	0	0	0	110.8	V473 K474 K475 G476 S477 L478 H484	V473-D480 HydrophobicContact CG1-CB 3.89Å; K474-D480 WeakPolarHBondContact O-CB 3.48Å; K475-D480 WeakPolarHBondContact CA-OD2 3.45Å; G476-D480 PolarHBondContact N-OD2 3.26Å; S477-D480 PolarHBondContact O-N 2.85Å; S477-D480 VanDerWaalsContact O-N 3.12Å; L478-D480 VanDerWaalsContact C-N 3.26Å; L478-D480 PolarHBondContact O-N 3.07Å; D480-H484 WeakPolarHBondContact O-CA 3.28Å; D480-H484 PolarHBondContact O-N 2.91Å; D480-H484 PolarHBondContact O-ND1 2.91Å; D480-H484 VanDerWaalsContact O-ND1 3.08Å
481	V	86.9	Confident	90.7	Very high	77 Å²	77	54 Å²	54	47%	0.467	29%	0.289	S	S	.	.	H	α-helix	trans	-78.4	-38.8	-169.9	179.9	0	0	0	0	112.8	M443 S477 H484	M443-V481 HydrophobicContact CE-CB 3.79Å; M443-V481 HydrophobicContact CE-CG1 4.13Å; M443-V481 HydrophobicContact CE-CG2 3.91Å; S477-V481 PolarHBondContact O-N 3.44Å; V481-H484 PolarHBondContact O-CE1 3.3Å
482	V	87.2	Confident	90.8	Very high	37 Å²	37	52.6 Å²	52.6	22%	0.224	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-42	178.1	-177.1	0	0	0	0	110.7	P419 V420 L437 L478	P419-V482 HydrophobicContact CB-CG1 4.14Å; P419-V482 HydrophobicContact CG-CG1 4.16Å; V420-V482 WeakPolarHBondContact CG2-O 3.14Å; L437-V482 HydrophobicContact CD2-CB 4.27Å; L437-V482 HydrophobicContact CD2-CG1 4.36Å; L478-V482 HydrophobicContact CD2-CG2 3.94Å; L478-V482 WeakPolarHBondContact O-CA 3.48Å; L478-V482 WeakPolarHBondContact O-CB 3.44Å; L478-V482 PolarHBondContact O-N 2.78Å
483	G	86.8	Confident	90.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-22	-172	0	0	0	0	0	116.6	L478 A479 L485	L478-G483 PolarHBondContact O-N 2.84Å; A479-G483 CarbonylContact O-C 3.44Å; A479-G483 WeakPolarHBondContact O-CA 3.2Å; G483-L485 PolarHBondContact O-N 3.33Å; G483-L485 VanDerWaalsContact O-N 3.09Å
484	H	90.5	Very high	90.9	Very high	107 Å²	107	47.6 Å²	47.6	50%	0.495	26%	0.256	S	S	.	.			trans	49.5	32.4	-172.4	-51.4	-32.3	0	0	0	113.6	A479 D480 V481 R526	A479-H484 PolarHBondContact O-N 2.84Å; A479-H484 VanDerWaalsContact O-N 3.07Å; D480-H484 WeakPolarHBondContact O-CA 3.28Å; D480-H484 PolarHBondContact O-N 2.91Å; D480-H484 PolarHBondContact O-ND1 2.91Å; D480-H484 VanDerWaalsContact O-ND1 3.08Å; V481-H484 PolarHBondContact O-CE1 3.3Å; H484-R526 PolarHBondContact O-NH2 2.92Å
485	L	93.6	Very high	91.1	Very high	4 Å²	4	44 Å²	44	2%	0.021	24%	0.242	C	C	.	.			trans	-76.5	141.2	177.5	-64	177.9	0	0	0	109.7	V435 L437 L453 I470 V473 A479 G483 I522 V524	V435-L485 HydrophobicContact CB-CD2 4.42Å; V435-L485 HydrophobicContact CG1-CD1 4.3Å; V435-L485 HydrophobicContact CG1-CD2 4.4Å; V435-L485 HydrophobicContact CG1-CG 4.32Å; V435-L485 HydrophobicContact CG2-CD2 3.89Å; L437-L485 HydrophobicContact CD1-CD1 4.27Å; L453-L485 HydrophobicContact CD2-CD1 3.87Å; I470-L485 HydrophobicContact CD1-CB 3.95Å; I470-L485 HydrophobicContact CD1-CD1 3.95Å; I470-L485 HydrophobicContact CD1-CD2 4.09Å; I470-L485 HydrophobicContact CD1-CG 4.22Å; V473-L485 HydrophobicContact CG2-CB 4.36Å; A479-L485 HydrophobicContact CB-CB 4.45Å; A479-L485 HydrophobicContact CB-CD1 4.07Å; A479-L485 WeakPolarHBondContact O-CB 3.31Å; A479-L485 PolarHBondContact O-N 3.5Å; G483-L485 PolarHBondContact O-N 3.33Å; G483-L485 VanDerWaalsContact O-N 3.09Å; L485-I522 HydrophobicContact CD1-CD1 4.16Å; L485-V524 HydrophobicContact CD2-CB 4.44Å; L485-V524 HydrophobicContact CD2-CG1 3.85Å; L485-V524 HydrophobicContact CD2-CG2 3.76Å
486	R	91.9	Very high	91.3	Very high	125 Å²	125	37.1 Å²	37.1	47%	0.472	23%	0.227	S	C	.	.			trans	-119.6	154.5	-176.9	-66.9	-176.8	-180	-151.5	2.4	110.5	I470 G488 D489	I470-R486 WeakPolarHBondContact CB-O 3.35Å; I470-R486 WeakPolarHBondContact CG2-O 3.13Å; R486-G488 PolarHBondContact O-N 2.86Å; R486-D489 PolarHBondContact N-OD2 2.96Å; R486-D489 PolarHBondContact O-N 3.25Å
487	A	91.9	Very high	91.7	Very high	67 Å²	67	40.2 Å²	40.2	55%	0.554	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	124.8	167.2	0	0	0	0	0	108.6	I470	I470-A487 CarbonylContact O-C 3.55Å; I470-A487 WeakPolarHBondContact O-CA 3.42Å
488	G	90.9	Very high	91.9	Very high	55 Å²	55	44.5 Å²	44.5	57%	0.567	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.8	-28.6	-170.9	0	0	0	0	0	113.6	I470 R486 E490	I470-G488 PolarHBondContact O-N 2.75Å; R486-G488 PolarHBondContact O-N 2.86Å; G488-E490 PolarHBondContact O-N 2.86Å
489	D	94.2	Very high	92	Very high	4 Å²	4	44 Å²	44	2%	0.021	26%	0.258	C	S	.	.			trans	-55.4	127.6	179.2	-70.3	-18.5	0	0	0	111.6	F469 I470 R486 V524 R526	F469-D489 WeakPolarHBondContact CA-O 3.44Å; I470-D489 HydrophobicContact CB-CB 4.3Å; I470-D489 HydrophobicContact CD1-CB 4.03Å; I470-D489 HydrophobicContact CG1-CB 4.17Å; I470-D489 PolarHBondContact N-O 3.21Å; R486-D489 PolarHBondContact N-OD2 2.96Å; R486-D489 PolarHBondContact O-N 3.25Å; D489-V524 HydrophobicContact CB-CB 4.17Å; D489-V524 HydrophobicContact CB-CG1 4.3Å; D489-R526 VanDerWaalsContact CG-NH2 3.32Å; D489-R526 IonicContact OD1-CZ 3.9Å; D489-R526 IonicContact OD1-NE 3.78Å; D489-R526 PolarHBondContact OD1-NE 2.89Å; D489-R526 IonicContact OD1-NH2 2.76Å; D489-R526 PolarHBondContact OD1-NH2 3.39Å; D489-R526 IonicContact OD2-CZ 3.09Å; D489-R526 IonicContact OD2-NE 2.8Å; D489-R526 IonicContact OD2-NH2 3.69Å; D489-R526 PolarHBondContact OD2-NH2 2.8Å
490	E	94.1	Very high	92	Very high	7 Å²	7	46 Å²	46	3%	0.033	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	116.5	170.9	-175.1	-178	177.9	0	0	108.6	R430 T461 R465 A468 F469 G488 L492 V524 S525	R430-E490 IonicContact NH1-OE2 2.74Å; R430-E490 PolarHBondContact NH1-OE2 2.93Å; T461-E490 WeakPolarHBondContact CG2-OE1 3.29Å; R465-E490 IonicContact CZ-OE1 3.87Å; R465-E490 IonicContact NE-OE1 2.74Å; R465-E490 PolarHBondContact NE-OE1 2.89Å; R465-E490 IonicContact NH2-OE1 2.66Å; R465-E490 PolarHBondContact NH2-OE1 3.33Å; R465-E490 IonicContact NH2-OE2 3.86Å; R465-E490 PolarHBondContact NH2-OE2 2.85Å; A468-E490 CarbonylContact O-C 3.58Å; A468-E490 WeakPolarHBondContact O-CA 3.33Å; F469-E490 HydrophobicContact CD1-CB 4.1Å; F469-E490 HydrophobicContact CD1-CG 4.5Å; F469-E490 HydrophobicContact CE1-CB 3.86Å; F469-E490 HydrophobicContact CE1-CG 4.1Å; F469-E490 HydrophobicContact CZ-CB 4.44Å; F469-E490 HydrophobicContact CZ-CG 4.18Å; G488-E490 PolarHBondContact O-N 2.86Å; E490-L492 HydrophobicContact CG-CD2 4.34Å; E490-L492 PolarHBondContact O-N 3.2Å; E490-V524 CarbonylContact O-C 3.54Å; E490-V524 VanDerWaalsContact O-CA 3.28Å; E490-V524 WeakPolarHBondContact O-CA 3.5Å; E490-S525 PolarHBondContact N-O 2.89Å; E490-S525 PolarHBondContact O-N 2.98Å
491	V	95.3	Very high	91.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	115.8	176.5	-170.9	0	0	0	0	108.8	V455 A468 I470 E493 L499 I522 V524	V455-V491 HydrophobicContact CG1-CG2 4.1Å; V455-V491 HydrophobicContact CG2-CG2 4.37Å; A468-V491 HydrophobicContact CB-CB 4.16Å; A468-V491 PolarHBondContact O-N 2.88Å; I470-V491 HydrophobicContact CD1-CG2 4.27Å; I470-V491 HydrophobicContact CG1-CG2 3.69Å; V491-E493 WeakPolarHBondContact CG1-O 3.43Å; V491-L499 HydrophobicContact CB-CD1 4.04Å; V491-L499 HydrophobicContact CG1-CD1 3.64Å; V491-L499 HydrophobicContact CG1-CG 4.45Å; V491-I522 HydrophobicContact CG1-CG2 3.7Å; V491-V524 HydrophobicContact CG2-CG1 4.19Å
492	L	94	Very high	92	Very high	33 Å²	33	42.5 Å²	42.5	17%	0.173	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-42.9	177.9	-60.1	-175.4	0	0	0	111.6	I432 E490 P498 L499 P500 I523	I432-L492 HydrophobicContact CG2-CD1 4.48Å; E490-L492 HydrophobicContact CG-CD2 4.34Å; E490-L492 PolarHBondContact O-N 3.2Å; L492-P498 WeakPolarHBondContact O-CA 3.4Å; L492-L499 PolarHBondContact O-N 3.27Å; L492-P500 HydrophobicContact CD2-CG 3.89Å; L492-P500 WeakPolarHBondContact O-CD 3.45Å; L492-I523 HydrophobicContact CB-CG2 4.32Å; L492-I523 HydrophobicContact CD1-CG2 4.49Å; L492-I523 PolarHBondContact N-O 2.61Å
493	E	95.2	Very high	92.2	Very high	73 Å²	73	43 Å²	43	34%	0.341	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	152.9	179.3	-59.6	176.1	-148.6	0	0	111.6	V491 K497 I522 I523	V491-E493 WeakPolarHBondContact CG1-O 3.43Å; E493-K497 CarbonylContact C-O 3.5Å; E493-K497 VanDerWaalsContact CA-O 3.32Å; E493-K497 WeakPolarHBondContact CA-O 3.34Å; E493-I522 WeakPolarHBondContact O-CA 3.4Å; E493-I523 HydrophobicContact CB-CB 3.95Å; E493-I523 HydrophobicContact CB-CD1 4.28Å; E493-I523 HydrophobicContact CB-CG1 4.04Å; E493-I523 HydrophobicContact CG-CB 4.44Å; E493-I523 HydrophobicContact CG-CD1 4.39Å; E493-I523 PolarHBondContact N-O 2.83Å; E493-I523 VanDerWaalsContact N-O 3.11Å; E493-I523 PolarHBondContact O-N 3.01Å
494	W	94.9	Very high	92.4	Very high	6 Å²	6	47 Å²	47	2%	0.023	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	111.7	177.2	-179.2	-76.1	0	0	0	108.8	L451 L453 V455 G496 K497 L499 I510 I511 S514 V520 I522	L451-W494 HydrophobicContact CD1-CH2 4.18Å; L453-W494 HydrophobicContact CD1-CH2 4.01Å; L453-W494 HydrophobicContact CD1-CZ3 3.88Å; L453-W494 HydrophobicContact CD2-CZ3 4.34Å; V455-W494 HydrophobicContact CG2-CZ3 4.03Å; W494-G496 VanDerWaalsContact C-N 3.28Å; W494-G496 PolarHBondContact O-N 3.48Å; W494-K497 PolarHBondContact N-O 2.95Å; W494-K497 WeakPolarHBondContact O-CB 3.37Å; W494-K497 PolarHBondContact O-N 2.93Å; W494-L499 HydrophobicContact CB-CD1 4.03Å; W494-L499 HydrophobicContact CB-CD2 4.38Å; W494-L499 HydrophobicContact CB-CG 4.3Å; W494-I510 HydrophobicContact CB-CG2 4.05Å; W494-I510 VanDerWaalsContact CD1-CG2 3.41Å; W494-I510 HydrophobicContact CG-CG2 3.95Å; W494-I510 PolarHBondContact NE1-O 3.04Å; W494-I511 HydrophobicContact CD2-CG1 4.01Å; W494-I511 HydrophobicContact CE3-CG1 4.31Å; W494-I511 HydrophobicContact CH2-CG1 4.15Å; W494-I511 HydrophobicContact CH2-CG2 4.31Å; W494-I511 HydrophobicContact CZ2-CB 4.18Å; W494-I511 HydrophobicContact CZ2-CG1 3.8Å; W494-I511 HydrophobicContact CZ2-CG2 3.94Å; W494-I511 HydrophobicContact CZ3-CG1 4.38Å; W494-S514 PolarHBondContact NE1-OG 3.37Å; W494-V520 HydrophobicContact CD2-CG1 4.06Å; W494-V520 HydrophobicContact CE3-CG1 4.47Å; W494-V520 HydrophobicContact CH2-CG1 4.2Å; W494-V520 HydrophobicContact CZ2-CG1 3.77Å; W494-I522 HydrophobicContact CE3-CD1 3.96Å; W494-I522 HydrophobicContact CE3-CG1 3.87Å; W494-I522 HydrophobicContact CE3-CG2 4.14Å; W494-I522 HydrophobicContact CH2-CD1 4.2Å; W494-I522 HydrophobicContact CZ3-CD1 3.56Å; W494-I522 HydrophobicContact CZ3-CG1 4Å
495	N	92.8	Very high	92.5	Very high	39 Å²	39	47.9 Å²	47.9	21%	0.209	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	48	48.2	-169.2	-69.2	2	0	0	0	112.7	K497 S514 E517 V520 E521	N495-K497 PolarHBondContact O-N 3.09Å; N495-K497 VanDerWaalsContact O-N 3.15Å; N495-S514 WeakPolarHBondContact ND2-CB 3.22Å; N495-E517 PolarHBondContact ND2-OE1 2.84Å; N495-E517 PolarHBondContact ND2-OE2 2.76Å; N495-V520 VanDerWaalsContact OD1-CA 3.26Å; N495-V520 WeakPolarHBondContact OD1-CA 3.39Å; N495-V520 WeakPolarHBondContact OD1-CG1 3.31Å; N495-E521 PolarHBondContact N-O 2.73Å; N495-E521 PolarHBondContact OD1-N 2.73Å; N495-E521 PolarHBondContact OD1-O 3.44Å
496	G	91	Very high	92.5	Very high	54 Å²	54	52.3 Å²	52.3	56%	0.557	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	1.3	-178	0	0	0	0	0	115.4	W494	W494-G496 VanDerWaalsContact C-N 3.28Å; W494-G496 PolarHBondContact O-N 3.48Å
497	K	93.1	Very high	92.6	Very high	90 Å²	90	46.5 Å²	46.5	39%	0.391	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	120.1	173.3	-59	-169.4	177.2	-169.1	0	109.6	E493 W494 N495 I510 E513	E493-K497 CarbonylContact C-O 3.5Å; E493-K497 VanDerWaalsContact CA-O 3.32Å; E493-K497 WeakPolarHBondContact CA-O 3.34Å; W494-K497 PolarHBondContact N-O 2.95Å; W494-K497 WeakPolarHBondContact O-CB 3.37Å; W494-K497 PolarHBondContact O-N 2.93Å; N495-K497 PolarHBondContact O-N 3.09Å; N495-K497 VanDerWaalsContact O-N 3.15Å; K497-I510 HydrophobicContact CB-CD1 4.14Å; K497-I510 HydrophobicContact CB-CG1 4.49Å; K497-I510 HydrophobicContact CB-CG2 4.13Å; K497-I510 HydrophobicContact CD-CD1 4.3Å; K497-I510 HydrophobicContact CD-CG1 3.86Å; K497-I510 HydrophobicContact CD-CG2 4.08Å; K497-E513 IonicContact NZ-OE2 3.41Å; K497-E513 PolarHBondContact NZ-OE2 2.91Å
498	P	92.8	Very high	92.6	Very high	91 Å²	91	50 Å²	50	59%	0.591	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	138.4	178.7	28.6	-34.4	0	0	0	111.3	L492	L492-P498 WeakPolarHBondContact O-CA 3.4Å
499	L	92.9	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.283	C	S	.	.			trans	-106.1	-20	177.9	-53.4	-168.4	0	0	0	115.7	A468 V491 L492 W494 G501 A502 V507 I510	A468-L499 HydrophobicContact CB-CB 3.77Å; A468-L499 HydrophobicContact CB-CD1 3.64Å; A468-L499 HydrophobicContact CB-CG 4.37Å; V491-L499 HydrophobicContact CB-CD1 4.04Å; V491-L499 HydrophobicContact CG1-CD1 3.64Å; V491-L499 HydrophobicContact CG1-CG 4.45Å; L492-L499 PolarHBondContact O-N 3.27Å; W494-L499 HydrophobicContact CB-CD1 4.03Å; W494-L499 HydrophobicContact CB-CD2 4.38Å; W494-L499 HydrophobicContact CB-CG 4.3Å; L499-G501 PolarHBondContact O-N 2.88Å; L499-A502 VanDerWaalsContact O-CB 3.24Å; L499-A502 WeakPolarHBondContact O-CB 3.12Å; L499-A502 PolarHBondContact O-N 2.81Å; L499-V507 HydrophobicContact CB-CG2 4.41Å; L499-V507 HydrophobicContact CD1-CG1 4.31Å; L499-V507 HydrophobicContact CD1-CG2 4.45Å; L499-V507 HydrophobicContact CD2-CG2 4.28Å; L499-I510 HydrophobicContact CD2-CB 4.43Å; L499-I510 HydrophobicContact CD2-CD1 3.57Å; L499-I510 HydrophobicContact CD2-CG2 4.07Å
500	P	91	Very high	92.6	Very high	44 Å²	44	52 Å²	52	29%	0.286	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	126.3	167.6	-30.4	37.7	0	0	0	111.7	L492	L492-P500 HydrophobicContact CD2-CG 3.89Å; L492-P500 WeakPolarHBondContact O-CD 3.45Å
501	G	88.7	Confident	92.5	Very high	45 Å²	45	53.7 Å²	53.7	46%	0.464	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	-19.8	-172	0	0	0	0	0	114.7	L466 L499	L466-G501 PolarHBondContact O-N 3.06Å; L499-G501 PolarHBondContact O-N 2.88Å
502	A	89.7	Confident	92.3	Very high	11 Å²	11	57.2 Å²	57.2	9%	0.091	32%	0.315	C	S	.	.			trans	-73.3	142.1	-174.3	0	0	0	0	0	113.6	G458 L499 E506 V507	G458-A502 PolarHBondContact N-O 3.14Å; L499-A502 VanDerWaalsContact O-CB 3.24Å; L499-A502 WeakPolarHBondContact O-CB 3.12Å; L499-A502 PolarHBondContact O-N 2.81Å; A502-E506 HydrophobicContact CB-CB 4.13Å; A502-V507 HydrophobicContact CB-CG2 3.75Å
503	T	90.8	Very high	92.1	Very high	49 Å²	49	60.5 Å²	60.5	30%	0.301	33%	0.33	S	S	.	.			trans	-68.2	172.3	174.2	59.4	0	0	0	0	112.6	E505 E506 V507	T503-E505 VanDerWaalsContact C-N 3.29Å; T503-E506 VanDerWaalsContact CB-OE2 3.3Å; T503-E506 WeakPolarHBondContact CB-OE2 3.48Å; T503-E506 WeakPolarHBondContact CG2-OE2 3.39Å; T503-E506 PolarHBondContact N-OE2 3.34Å; T503-E506 WeakPolarHBondContact OG1-CB 3.37Å; T503-E506 VanDerWaalsContact OG1-CD 3.23Å; T503-E506 VanDerWaalsContact OG1-CG 3.24Å; T503-E506 WeakPolarHBondContact OG1-CG 3.16Å; T503-E506 PolarHBondContact OG1-N 2.68Å; T503-E506 VanDerWaalsContact OG1-N 3.15Å; T503-E506 PolarHBondContact OG1-OE2 3.19Å; T503-V507 VanDerWaalsContact O-CG2 3.29Å; T503-V507 WeakPolarHBondContact O-CG2 3.19Å; T503-V507 PolarHBondContact O-N 2.83Å; T503-V507 VanDerWaalsContact O-N 3.16Å
504	N	91.9	Very high	91.8	Very high	82 Å²	82	57.2 Å²	57.2	44%	0.439	32%	0.315	S	S	.	.	H	α-helix	trans	-66.4	-37.5	176.5	-166.4	-102.8	0	0	0	111.2	G457 Y508	G457-N504 PolarHBondContact O-ND2 2.8Å; N504-Y508 VanDerWaalsContact O-CB 3.3Å; N504-Y508 WeakPolarHBondContact O-CB 3.29Å; N504-Y508 PolarHBondContact O-N 2.81Å
505	E	92.7	Very high	91.4	Very high	127 Å²	127	63 Å²	63	59%	0.593	34%	0.34	S	S	*	.	H	α-helix	trans	-65.4	-47	176.9	-66.1	80.9	175	0	0	112.1	T503 Y508 N509	T503-E505 VanDerWaalsContact C-N 3.29Å; E505-Y508 WeakPolarHBondContact O-CB 3.48Å; E505-Y508 PolarHBondContact O-N 2.92Å; E505-N509 WeakPolarHBondContact O-CB 3.35Å; E505-N509 PolarHBondContact O-N 3.21Å; E505-N509 PolarHBondContact O-ND2 2.65Å
506	E	92.6	Very high	91	Very high	96 Å²	96	66.4 Å²	66.4	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-64.2	-45.8	177.7	-73	160.3	139.8	0	0	111.8	A502 T503 Y508 N509 I510	A502-E506 HydrophobicContact CB-CB 4.13Å; T503-E506 VanDerWaalsContact CB-OE2 3.3Å; T503-E506 WeakPolarHBondContact CB-OE2 3.48Å; T503-E506 WeakPolarHBondContact CG2-OE2 3.39Å; T503-E506 PolarHBondContact N-OE2 3.34Å; T503-E506 WeakPolarHBondContact OG1-CB 3.37Å; T503-E506 VanDerWaalsContact OG1-CD 3.23Å; T503-E506 VanDerWaalsContact OG1-CG 3.24Å; T503-E506 WeakPolarHBondContact OG1-CG 3.16Å; T503-E506 PolarHBondContact OG1-N 2.68Å; T503-E506 VanDerWaalsContact OG1-N 3.15Å; T503-E506 PolarHBondContact OG1-OE2 3.19Å; E506-Y508 VanDerWaalsContact C-N 3.28Å; E506-Y508 PolarHBondContact O-N 2.9Å; E506-N509 PolarHBondContact O-N 2.85Å; E506-I510 WeakPolarHBondContact O-CB 3.37Å; E506-I510 VanDerWaalsContact O-CG1 3.28Å; E506-I510 WeakPolarHBondContact O-CG1 3.42Å; E506-I510 PolarHBondContact O-N 2.94Å
507	V	93.7	Very high	90.7	Very high	3 Å²	3	67.4 Å²	67.4	2%	0.018	36%	0.357	C	S	.	.	H	α-helix	trans	-61.9	-37.8	175.3	173.5	0	0	0	0	111.2	V455 A468 L499 A502 T503 I511	V455-V507 HydrophobicContact CG1-CG1 4.1Å; A468-V507 HydrophobicContact CB-CG1 4.1Å; A468-V507 HydrophobicContact CB-CG2 4.02Å; L499-V507 HydrophobicContact CB-CG2 4.41Å; L499-V507 HydrophobicContact CD1-CG1 4.31Å; L499-V507 HydrophobicContact CD1-CG2 4.45Å; L499-V507 HydrophobicContact CD2-CG2 4.28Å; A502-V507 HydrophobicContact CB-CG2 3.75Å; T503-V507 VanDerWaalsContact O-CG2 3.29Å; T503-V507 WeakPolarHBondContact O-CG2 3.19Å; T503-V507 PolarHBondContact O-N 2.83Å; T503-V507 VanDerWaalsContact O-N 3.16Å; V507-I511 HydrophobicContact CG1-CD1 3.76Å; V507-I511 WeakPolarHBondContact O-CB 3.31Å; V507-I511 WeakPolarHBondContact O-CD1 3.47Å; V507-I511 WeakPolarHBondContact O-CG1 3.46Å; V507-I511 PolarHBondContact O-N 3.32Å; V507-I511 VanDerWaalsContact O-N 3.16Å
508	Y	91.6	Very high	90.4	Very high	140 Å²	140	65.8 Å²	65.8	55%	0.549	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-44.7	174	179.8	-93.2	0	0	0	112.1	N504 E505 E506 I511 L512	N504-Y508 VanDerWaalsContact O-CB 3.3Å; N504-Y508 WeakPolarHBondContact O-CB 3.29Å; N504-Y508 PolarHBondContact O-N 2.81Å; E505-Y508 WeakPolarHBondContact O-CB 3.48Å; E505-Y508 PolarHBondContact O-N 2.92Å; E506-Y508 VanDerWaalsContact C-N 3.28Å; E506-Y508 PolarHBondContact O-N 2.9Å; Y508-I511 PolarHBondContact O-N 3.48Å; Y508-L512 HydrophobicContact CE1-CD2 3.92Å; Y508-L512 VanDerWaalsContact O-CB 3.24Å; Y508-L512 WeakPolarHBondContact O-CB 3.39Å; Y508-L512 PolarHBondContact O-N 3.28Å
509	N	92.3	Very high	90.2	Very high	78 Å²	78	66.3 Å²	66.3	42%	0.417	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-45	179.7	-69.1	-19.9	0	0	0	111.7	E505 E506 I511 L512 E513	E505-N509 WeakPolarHBondContact O-CB 3.35Å; E505-N509 PolarHBondContact O-N 3.21Å; E505-N509 PolarHBondContact O-ND2 2.65Å; E506-N509 PolarHBondContact O-N 2.85Å; N509-I511 VanDerWaalsContact C-N 3.32Å; N509-I511 PolarHBondContact O-N 3.18Å; N509-L512 WeakPolarHBondContact O-CA 3.41Å; N509-L512 WeakPolarHBondContact O-CB 3.35Å; N509-L512 PolarHBondContact O-N 2.99Å; N509-E513 WeakPolarHBondContact O-CG 3.46Å; N509-E513 PolarHBondContact O-N 3.23Å
510	I	92.9	Very high	90.2	Very high	24 Å²	24	66.3 Å²	66.3	12%	0.123	35%	0.35	C	S	.	.	H	α-helix	trans	-60.5	-40.6	177.4	-69	166.9	0	0	0	111.6	W494 K497 L499 E506 S514	W494-I510 HydrophobicContact CB-CG2 4.05Å; W494-I510 VanDerWaalsContact CD1-CG2 3.41Å; W494-I510 HydrophobicContact CG-CG2 3.95Å; W494-I510 PolarHBondContact NE1-O 3.04Å; K497-I510 HydrophobicContact CB-CD1 4.14Å; K497-I510 HydrophobicContact CB-CG1 4.49Å; K497-I510 HydrophobicContact CB-CG2 4.13Å; K497-I510 HydrophobicContact CD-CD1 4.3Å; K497-I510 HydrophobicContact CD-CG1 3.86Å; K497-I510 HydrophobicContact CD-CG2 4.08Å; L499-I510 HydrophobicContact CD2-CB 4.43Å; L499-I510 HydrophobicContact CD2-CD1 3.57Å; L499-I510 HydrophobicContact CD2-CG2 4.07Å; E506-I510 WeakPolarHBondContact O-CB 3.37Å; E506-I510 VanDerWaalsContact O-CG1 3.28Å; E506-I510 WeakPolarHBondContact O-CG1 3.42Å; E506-I510 PolarHBondContact O-N 2.94Å; I510-S514 PolarHBondContact O-N 2.84Å
511	I	91.9	Very high	90.3	Very high	43 Å²	43	67.6 Å²	67.6	22%	0.221	35%	0.352	C	S	.	.	H	α-helix	trans	-73.8	-26.2	175.5	-65.1	169.2	0	0	0	112	V455 W494 V507 Y508 N509	V455-I511 HydrophobicContact CB-CD1 3.65Å; V455-I511 HydrophobicContact CG1-CD1 4.2Å; V455-I511 HydrophobicContact CG2-CD1 3.77Å; W494-I511 HydrophobicContact CD2-CG1 4.01Å; W494-I511 HydrophobicContact CE3-CG1 4.31Å; W494-I511 HydrophobicContact CH2-CG1 4.15Å; W494-I511 HydrophobicContact CH2-CG2 4.31Å; W494-I511 HydrophobicContact CZ2-CB 4.18Å; W494-I511 HydrophobicContact CZ2-CG1 3.8Å; W494-I511 HydrophobicContact CZ2-CG2 3.94Å; W494-I511 HydrophobicContact CZ3-CG1 4.38Å; V507-I511 HydrophobicContact CG1-CD1 3.76Å; V507-I511 WeakPolarHBondContact O-CB 3.31Å; V507-I511 WeakPolarHBondContact O-CD1 3.47Å; V507-I511 WeakPolarHBondContact O-CG1 3.46Å; V507-I511 PolarHBondContact O-N 3.32Å; V507-I511 VanDerWaalsContact O-N 3.16Å; Y508-I511 PolarHBondContact O-N 3.48Å; N509-I511 VanDerWaalsContact C-N 3.32Å; N509-I511 PolarHBondContact O-N 3.18Å
512	L	91.1	Very high	90.6	Very high	73 Å²	73	65.5 Å²	65.5	38%	0.382	33%	0.33	S	S	.	.	H	α-helix	trans	-75	-44.3	176.8	179.3	61.5	0	0	0	111.8	Y508 N509 K515	Y508-L512 HydrophobicContact CE1-CD2 3.92Å; Y508-L512 VanDerWaalsContact O-CB 3.24Å; Y508-L512 WeakPolarHBondContact O-CB 3.39Å; Y508-L512 PolarHBondContact O-N 3.28Å; N509-L512 WeakPolarHBondContact O-CA 3.41Å; N509-L512 WeakPolarHBondContact O-CB 3.35Å; N509-L512 PolarHBondContact O-N 2.99Å; L512-K515 HydrophobicContact CD1-CD 3.95Å; L512-K515 WeakPolarHBondContact O-CB 3.35Å; L512-K515 WeakPolarHBondContact O-CG 3.35Å; L512-K515 PolarHBondContact O-N 2.98Å
513	E	89.9	Confident	90.9	Very high	103 Å²	103	65.4 Å²	65.4	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-59.7	-50.7	176.7	-72.6	167.9	-177.6	0	0	111.5	K497 N509 K515 S516	K497-E513 IonicContact NZ-OE2 3.41Å; K497-E513 PolarHBondContact NZ-OE2 2.91Å; N509-E513 WeakPolarHBondContact O-CG 3.46Å; N509-E513 PolarHBondContact O-N 3.23Å; E513-K515 PolarHBondContact O-N 2.73Å; E513-S516 PolarHBondContact O-N 3.4Å; E513-S516 PolarHBondContact O-OG 3.34Å
514	S	89.7	Confident	91.1	Very high	4 Å²	4	63.1 Å²	63.1	3%	0.028	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-67.4	-4.6	-176.6	85.7	0	0	0	0	114.2	K439 W494 N495 I510 S516 E517	K439-S514 PolarHBondContact NZ-O 3.12Å; W494-S514 PolarHBondContact NE1-OG 3.37Å; N495-S514 WeakPolarHBondContact ND2-CB 3.22Å; I510-S514 PolarHBondContact O-N 2.84Å; S514-S516 PolarHBondContact O-N 2.8Å; S514-E517 WeakPolarHBondContact CA-OE1 3.27Å; S514-E517 WeakPolarHBondContact CB-OE1 3.18Å; S514-E517 PolarHBondContact O-N 2.88Å
515	K	85.9	Confident	91.1	Very high	127 Å²	127	59.4 Å²	59.4	55%	0.552	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-55.9	-37.1	175.4	-72.4	-175.2	-172.2	168	0	112.5	K439 L512 E513	K439-K515 VanDerWaalsContact NZ-C 3.35Å; K439-K515 PolarHBondContact NZ-O 2.97Å; L512-K515 HydrophobicContact CD1-CD 3.95Å; L512-K515 WeakPolarHBondContact O-CB 3.35Å; L512-K515 WeakPolarHBondContact O-CG 3.35Å; L512-K515 PolarHBondContact O-N 2.98Å; E513-K515 PolarHBondContact O-N 2.73Å
516	S	84	Confident	91.1	Very high	110 Å²	110	54.1 Å²	54.1	77%	0.769	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-70.3	-27.4	-178.6	60	0	0	0	0	114.1	E513 S514	E513-S516 PolarHBondContact O-N 3.4Å; E513-S516 PolarHBondContact O-OG 3.34Å; S514-S516 PolarHBondContact O-N 2.8Å
517	E	85.8	Confident	90.8	Very high	76 Å²	76	53 Å²	53	36%	0.355	27%	0.27	S	S	.	.	S	Bend	trans	-71.1	144.5	-175.8	-64.4	178.2	-115.6	0	0	112.3	K439 N495 S514 Q519	K439-E517 WeakPolarHBondContact CD-O 3.46Å; K439-E517 WeakPolarHBondContact CE-O 3.39Å; K439-E517 PolarHBondContact NZ-O 2.73Å; N495-E517 PolarHBondContact ND2-OE1 2.84Å; N495-E517 PolarHBondContact ND2-OE2 2.76Å; S514-E517 WeakPolarHBondContact CA-OE1 3.27Å; S514-E517 WeakPolarHBondContact CB-OE1 3.18Å; S514-E517 PolarHBondContact O-N 2.88Å; E517-Q519 VanDerWaalsContact C-N 3.27Å; E517-Q519 WeakPolarHBondContact CB-O 3.19Å; E517-Q519 PolarHBondContact O-N 3.13Å
518	P	85.8	Confident	89.8	Confident	55 Å²	55	55.2 Å²	55.2	36%	0.357	28%	0.282	S	S	.	.	S	Bend	trans	-72.4	-22.3	-179.3	30.6	-35.8	0	0	0	113.2	N438 K439 R440	N438-P518 PolarHBondContact OD1-O 3.35Å; K439-P518 WeakPolarHBondContact CB-O 3.43Å; K439-P518 PolarHBondContact N-O 3.16Å; R440-P518 HydrophobicContact CG-CB 4.37Å
519	Q	89.1	Confident	88.5	Confident	102 Å²	102	51.9 Å²	51.9	48%	0.477	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	161.1	177.7	67.5	-168.4	27.4	0	0	109.8	L437 E517	L437-Q519 CarbonylContact O-C 3.53Å; L437-Q519 WeakPolarHBondContact O-CA 3.44Å; E517-Q519 VanDerWaalsContact C-N 3.27Å; E517-Q519 WeakPolarHBondContact CB-O 3.19Å; E517-Q519 PolarHBondContact O-N 3.13Å
520	V	92.5	Very high	86.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	124.2	169.8	178.7	0	0	0	0	107.9	L437 L451 W494 N495 I522	L437-V520 PolarHBondContact N-O 3.01Å; L437-V520 PolarHBondContact O-N 2.86Å; L451-V520 HydrophobicContact CD1-CB 4.21Å; L451-V520 HydrophobicContact CD1-CG2 4.1Å; W494-V520 HydrophobicContact CD2-CG1 4.06Å; W494-V520 HydrophobicContact CE3-CG1 4.47Å; W494-V520 HydrophobicContact CH2-CG1 4.2Å; W494-V520 HydrophobicContact CZ2-CG1 3.77Å; N495-V520 VanDerWaalsContact OD1-CA 3.26Å; N495-V520 WeakPolarHBondContact OD1-CA 3.39Å; N495-V520 WeakPolarHBondContact OD1-CG1 3.31Å; V520-I522 HydrophobicContact CG1-CD1 4.23Å; V520-I522 HydrophobicContact CG1-CG1 3.75Å
521	E	94.7	Very high	84.5	Confident	72 Å²	72	55.1 Å²	55.1	34%	0.336	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	131.5	168.7	-176.2	169.9	-169	0	0	109.1	V435 I436 N495	V435-E521 CarbonylContact O-C 3.53Å; V435-E521 WeakPolarHBondContact O-CA 3.4Å; I436-E521 HydrophobicContact CG1-CB 4.41Å; I436-E521 HydrophobicContact CG1-CG 4.15Å; N495-E521 PolarHBondContact N-O 2.73Å; N495-E521 PolarHBondContact OD1-N 2.73Å; N495-E521 PolarHBondContact OD1-O 3.44Å
522	I	95	Very high	82.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127	-177.8	-48.3	175	0	0	0	107.1	V435 L437 L453 L485 V491 E493 W494 V520 V524	V435-I522 PolarHBondContact N-O 3.08Å; V435-I522 PolarHBondContact O-N 3.27Å; L437-I522 HydrophobicContact CD1-CD1 4.01Å; L453-I522 HydrophobicContact CD2-CD1 3.59Å; L485-I522 HydrophobicContact CD1-CD1 4.16Å; V491-I522 HydrophobicContact CG1-CG2 3.7Å; E493-I522 WeakPolarHBondContact O-CA 3.4Å; W494-I522 HydrophobicContact CE3-CD1 3.96Å; W494-I522 HydrophobicContact CE3-CG1 3.87Å; W494-I522 HydrophobicContact CE3-CG2 4.14Å; W494-I522 HydrophobicContact CH2-CD1 4.2Å; W494-I522 HydrophobicContact CZ3-CD1 3.56Å; W494-I522 HydrophobicContact CZ3-CG1 4Å; V520-I522 HydrophobicContact CG1-CD1 4.23Å; V520-I522 HydrophobicContact CG1-CG1 3.75Å; I522-V524 HydrophobicContact CG2-CG1 3.84Å
523	I	95.2	Very high	79.5	Confident	10 Å²	10	64.1 Å²	64.1	5%	0.051	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.9	167.9	-50.9	-169	0	0	0	107.8	I432 G433 R434 L492 E493	I432-I523 HydrophobicContact CG2-CG2 3.54Å; G433-I523 CarbonylContact O-C 3.53Å; G433-I523 VanDerWaalsContact O-CA 3.32Å; G433-I523 WeakPolarHBondContact O-CA 3.48Å; R434-I523 HydrophobicContact CG-CD1 3.99Å; R434-I523 HydrophobicContact CG-CG1 4.02Å; R434-I523 HydrophobicContact CG-CG2 4.41Å; L492-I523 HydrophobicContact CB-CG2 4.32Å; L492-I523 HydrophobicContact CD1-CG2 4.49Å; L492-I523 PolarHBondContact N-O 2.61Å; E493-I523 HydrophobicContact CB-CB 3.95Å; E493-I523 HydrophobicContact CB-CD1 4.28Å; E493-I523 HydrophobicContact CB-CG1 4.04Å; E493-I523 HydrophobicContact CG-CB 4.44Å; E493-I523 HydrophobicContact CG-CD1 4.39Å; E493-I523 PolarHBondContact N-O 2.83Å; E493-I523 VanDerWaalsContact N-O 3.11Å; E493-I523 PolarHBondContact O-N 3.01Å
524	V	94.7	Very high	77	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	160.5	179.3	-66.2	0	0	0	0	111.4	W422 I432 G433 I470 L485 D489 E490 V491 I522	W422-V524 HydrophobicContact CH2-CG2 3.46Å; W422-V524 VanDerWaalsContact CH2-CG2 3.46Å; W422-V524 HydrophobicContact CZ2-CG2 4.33Å; W422-V524 HydrophobicContact CZ3-CG2 3.91Å; I432-V524 CarbonylContact C-O 3.49Å; I432-V524 VanDerWaalsContact CA-O 3.31Å; I432-V524 WeakPolarHBondContact CA-O 3.33Å; G433-V524 PolarHBondContact N-O 2.86Å; G433-V524 WeakPolarHBondContact O-CG2 3.22Å; G433-V524 PolarHBondContact O-N 2.78Å; I470-V524 HydrophobicContact CD1-CG1 4.13Å; L485-V524 HydrophobicContact CD2-CB 4.44Å; L485-V524 HydrophobicContact CD2-CG1 3.85Å; L485-V524 HydrophobicContact CD2-CG2 3.76Å; D489-V524 HydrophobicContact CB-CB 4.17Å; D489-V524 HydrophobicContact CB-CG1 4.3Å; E490-V524 CarbonylContact O-C 3.54Å; E490-V524 VanDerWaalsContact O-CA 3.28Å; E490-V524 WeakPolarHBondContact O-CA 3.5Å; V491-V524 HydrophobicContact CG2-CG1 4.19Å; I522-V524 HydrophobicContact CG2-CG1 3.84Å
525	S	92.9	Very high	74.6	Confident	4 Å²	4	71.8 Å²	71.8	3%	0.028	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.6	165.9	71	0	0	0	0	112.9	L431 E490	L431-S525 VanDerWaalsContact O-CA 3.27Å; L431-S525 WeakPolarHBondContact O-CA 3.47Å; E490-S525 PolarHBondContact N-O 2.89Å; E490-S525 PolarHBondContact O-N 2.98Å
526	R	91.6	Very high	72.2	Confident	17 Å²	17	74.8 Å²	74.8	6%	0.064	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.4	174	60.9	175	64.1	141.5	0.4	109.8	W422 R430 L431 H484 D489	W422-R526 HydrophobicContact CH2-CG 4.46Å; W422-R526 VanDerWaalsContact CZ2-CZ 3.5Å; W422-R526 VanDerWaalsContact CZ2-NH1 3.3Å; W422-R526 HydrophobicContact CZ3-CG 3.95Å; R430-R526 CarbonylContact C-O 3.59Å; R430-R526 WeakPolarHBondContact CA-O 3.46Å; R430-R526 WeakPolarHBondContact CB-O 3.45Å; L431-R526 HydrophobicContact CB-CG 4.21Å; L431-R526 PolarHBondContact N-O 3.11Å; L431-R526 PolarHBondContact O-N 2.84Å; H484-R526 PolarHBondContact O-NH2 2.92Å; D489-R526 VanDerWaalsContact CG-NH2 3.32Å; D489-R526 IonicContact OD1-CZ 3.9Å; D489-R526 IonicContact OD1-NE 3.78Å; D489-R526 PolarHBondContact OD1-NE 2.89Å; D489-R526 IonicContact OD1-NH2 2.76Å; D489-R526 PolarHBondContact OD1-NH2 3.39Å; D489-R526 IonicContact OD2-CZ 3.09Å; D489-R526 IonicContact OD2-NE 2.8Å; D489-R526 IonicContact OD2-NH2 3.69Å; D489-R526 PolarHBondContact OD2-NH2 2.8Å
527	P	85.8	Confident	69.9	Low	71 Å²	71	73.8 Å²	73.8	46%	0.461	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	154.4	177.6	27.5	-35.4	0	0	0	112.4	G529	P527-G529 PolarHBondContact O-N 3.27Å
528	I	74	Confident	67.2	Low	51 Å²	51	75.5 Å²	75.5	26%	0.262	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-74.7	-3.3	-178.8	-94.1	167.1	0	0	0	114.4	P424 G428 D429 R430 L431 D530	P424-I528 HydrophobicContact CB-CD1 4.25Å; G428-I528 VanDerWaalsContact O-CD1 3.3Å; G428-I528 WeakPolarHBondContact O-CD1 3.37Å; D429-I528 WeakPolarHBondContact O-CB 3.24Å; D429-I528 PolarHBondContact O-N 2.97Å; R430-I528 VanDerWaalsContact O-CD1 3.28Å; R430-I528 WeakPolarHBondContact O-CD1 3.41Å; L431-I528 HydrophobicContact CB-CG1 4.46Å; L431-I528 HydrophobicContact CD1-CG1 3.7Å; L431-I528 HydrophobicContact CG-CD1 4.25Å; L431-I528 HydrophobicContact CG-CG1 3.59Å; I528-D530 VanDerWaalsContact C-N 3.3Å; I528-D530 PolarHBondContact O-N 2.8Å
529	G	63.2	Low	64.7	Low	70 Å²	70	81.1 Å²	81.1	72%	0.722	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-67.9	-22	178.2	0	0	0	0	0	115.5	P527	P527-G529 PolarHBondContact O-N 3.27Å
530	D	53.5	Low	62.2	Low	92 Å²	92	81.3 Å²	81.3	49%	0.492	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-100.9	17.8	-162.4	-54	-28.5	0	0	0	114.7	I528	I528-D530 VanDerWaalsContact C-N 3.3Å; I528-D530 PolarHBondContact O-N 2.8Å
531	I	48.2	Very low	59.4	Low	77 Å²	77	87.4 Å²	87.4	40%	0.395	49%	0.492	S	S	.	.	S	Bend	trans	-130.7	123.2	176.7	-61.1	-164.5	0	0	0	110.8	L431 R533	L431-I531 HydrophobicContact CD1-CB 4.41Å; L431-I531 HydrophobicContact CD1-CD1 3.53Å; L431-I531 HydrophobicContact CD1-CG1 3.89Å; I531-R533 PolarHBondContact O-N 3.27Å
532	P	42.3	Very low	56.7	Low	81 Å²	81	91 Å²	91	53%	0.526	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-59.5	123.3	167.1	-22.1	33.5	0	0	0	110.5	I534	P532-I534 PolarHBondContact O-N 3.06Å
533	R	36.1	Very low	53.7	Low	224 Å²	224	99 Å²	99	85%	0.845	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-62.2	122.4	173.6	-75.4	-170.9	175.1	95.9	1.1	109.2	I531 P535	I531-R533 PolarHBondContact O-N 3.27Å; R533-P535 VanDerWaalsContact O-CD 3.28Å; R533-P535 WeakPolarHBondContact O-CD 3Å
534	I	37.3	Very low	50.9	Low	153 Å²	153	103.9 Å²	103.9	79%	0.785	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-63.3	120.2	163.1	-59.3	172.3	0	0	0	106.5	P532 E536	P532-I534 PolarHBondContact O-N 3.06Å; I534-E536 PolarHBondContact O-N 3.19Å
535	P	38.4	Very low	48	Very low	115 Å²	115	108.9 Å²	108.9	75%	0.747	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-64.8	126.3	169.4	-16.9	31.9	0	0	0	108.2	R533 S537	R533-P535 VanDerWaalsContact O-CD 3.28Å; R533-P535 WeakPolarHBondContact O-CD 3Å; P535-S537 PolarHBondContact O-N 2.81Å
536	E	37	Very low	45.2	Very low	190 Å²	190	114.1 Å²	114.1	89%	0.888	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.7	132.7	-176.5	-67.7	-172	143.7	0	0	111.1	I534 S538	I534-E536 PolarHBondContact O-N 3.19Å; E536-S538 PolarHBondContact O-N 3.12Å
537	S	35	Very low	42.5	Very low	90 Å²	90	118.4 Å²	118.4	63%	0.629	69%	0.689	S	S	*	*			trans	-73.7	100	-169.7	55.1	0	0	0	0	112.1	P535 H539	P535-S537 PolarHBondContact O-N 2.81Å; S537-H539 PolarHBondContact O-N 3.5Å
538	S	28.2	Very low	40.3	Very low	111 Å²	111	120.4 Å²	120.4	78%	0.776	71%	0.705	S	S	*	*			trans	41.6	73.1	139.8	63.1	0	0	0	0	116.5	E536	E536-S538 PolarHBondContact O-N 3.12Å
539	H	33.6	Very low	38.4	Very low	173 Å²	173	126 Å²	126	80%	0.801	73%	0.728	S	S	*	*			trans	-105.1	126.1	157.6	-73.2	-73.1	0	0	0	109.4	S537	S537-H539 PolarHBondContact O-N 3.5Å
540	P	37	Very low	37.3	Very low	106 Å²	106	128.7 Å²	128.7	69%	0.688	72%	0.721	S	S	*	*			trans	-75.3	140.8	-179.3	30.8	-34.1	0	0	0	111
541	P	33.9	Very low	36.6	Very low	128 Å²	128	128.2 Å²	128.2	83%	0.831	73%	0.725	S	S	*	*			trans	-74.5	132.5	174.1	31	-33.3	0	0	0	110.3
542	L	37.5	Very low	36.2	Very low	149 Å²	149	133 Å²	133	78%	0.78	75%	0.746	S	S	*	*			trans	-128.3	122.1	169.1	-72.8	176.7	0	0	0	110.4
543	E	33.1	Very low	35.9	Very low	167 Å²	167	137.1 Å²	137.1	78%	0.78	76%	0.755	S	S	*	*			trans	47.7	101.3	140.7	-55.3	-60	89.1	0	0	119
544	S	34.9	Very low	36.1	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	75%	0.75	S	S	*	*				-177.6	113.8	115.5	-80.7	0	0	0	0	114.9
545	S	35.1	Very low	36.1	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	75%	0.746	S	S	*	*			trans	68.9	119.1	132.8	-53.8	0	0	0	0	123.1
546	S	34.5	Very low	36	Very low	114 Å²	114	138 Å²	138	80%	0.797	75%	0.749	S	S	*	*			trans	66.4	142.7	139.1	53	0	0	0	0	121
547	S	35	Very low	36.1	Very low	107 Å²	107	134 Å²	134	75%	0.748	74%	0.739	S	S	*	*			cis	-172.9	152.2	-8.6	50.1	0	0	0	0	111.7
548	S	37.8	Very low	35.9	Very low	112 Å²	112	135 Å²	135	78%	0.783	75%	0.746	S	S	*	*			trans	49.7	140.2	151.2	-125.3	0	0	0	0	119.9
549	F	35.2	Very low	36.3	Very low	170 Å²	170	138.1 Å²	138.1	75%	0.746	75%	0.752	S	S	*	*			cis	-163.7	173.4	32.8	-176.2	-122.6	0	0	0	112.2
550	E	39.2	Very low	36.2	Very low	125 Å²	125	134.7 Å²	134.7	58%	0.584	75%	0.748	S	S	*	*			trans	-43.3	174.6	170.4	-71.4	-153.3	66.5	0	0	119.3
551	S	40.5	Very low	36.1	Very low	82 Å²	82	135.3 Å²	135.3	57%	0.573	75%	0.749	S	S	*	*			cis	179.2	177.1	-20.9	-83.3	0	0	0	0	108.6
552	Q	38.8	Very low	36	Very low	177 Å²	177	136.1 Å²	136.1	83%	0.827	75%	0.745	S	S	*	*			trans	76.3	152	157.8	-51.9	-167	38.6	0	0	118.3
553	K	36.7	Very low	35.5	Very low	168 Å²	168	134.2 Å²	134.2	73%	0.73	74%	0.744	S	S	*	*			cis	-169.4	159.9	-30.1	-166.6	-179.3	176.7	-177.9	0	109.4
554	M	39.2	Very low	35.6	Very low	148 Å²	148	132.2 Å²	132.2	73%	0.729	75%	0.746	S	S	*	*			trans	77.7	128.6	172	-54.7	-169.6	175.9	0	0	115.4
555	E	37.1	Very low	35.5	Very low	148 Å²	148	133 Å²	133	69%	0.692	75%	0.746	S	S	*	*				65.9	126.8	70	-110.8	-168.4	109.5	0	0	111.8
556	R	36	Very low	35.4	Very low	216 Å²	216	133.3 Å²	133.3	82%	0.815	75%	0.748	S	S	*	*			cis	-146.8	-178.3	36.2	-101.4	-165.7	172.9	179.5	-4	114.3
557	P	40.1	Very low	35.6	Very low	106 Å²	106	134.8 Å²	134.8	69%	0.688	76%	0.755	S	S	*	*			trans	-120.6	179.4	-146.2	44.4	-35.2	0	0	0	117.8
558	S	30.8	Very low	35.5	Very low	110 Å²	110	133 Å²	133	77%	0.769	75%	0.753	S	S	*	*			trans	60.5	101.4	151.1	60.8	0	0	0	0	119.7
559	I	35.6	Very low	35.4	Very low	176 Å²	176	132.5 Å²	132.5	90%	0.903	76%	0.756	S	S	*	*			trans	-129.6	155.4	142	-102.6	174.7	0	0	0	108
560	S	32.6	Very low	35.5	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	76%	0.763	S	S	*	*			trans	-115.4	173.7	-173.6	53.3	0	0	0	0	112.7
561	V	34	Very low	35.4	Very low	118 Å²	118	135.1 Å²	135.1	72%	0.715	77%	0.772	S	S	*	*			trans	81.5	105	163.6	-172.7	0	0	0	0	117.8
562	I	33.3	Very low	35.5	Very low	146 Å²	146	139.5 Å²	139.5	75%	0.749	79%	0.789	S	S	*	*			trans	68.5	108.5	150.3	-57.4	166.4	0	0	0	119.6
563	S	26.9	Very low	35.8	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	78%	0.781	S	S	*	*				-172.7	97.4	125.4	-81.1	0	0	0	0	111.5	T565	S563-T565 PolarHBondContact O-N 3.03Å
564	P	35.1	Very low	36.4	Very low	125 Å²	125	131.4 Å²	131.4	81%	0.812	78%	0.776	S	S	*	*			trans	-94.3	91.4	-176.1	34.5	-31.3	0	0	0	112.3
565	T	32.8	Very low	37	Very low	128 Å²	128	130.6 Å²	130.6	79%	0.785	77%	0.77	S	S	*	*			trans	-135.8	28.7	-174.5	-32	0	0	0	0	114.7	S563	S563-T565 PolarHBondContact O-N 3.03Å
566	S	32	Very low	37.9	Very low	113 Å²	113	127.6 Å²	127.6	79%	0.79	76%	0.762	S	S	*	*			trans	-162.3	105.6	169.2	44.7	0	0	0	0	113.4
567	P	38.3	Very low	39.7	Very low	145 Å²	145	119.5 Å²	119.5	94%	0.942	73%	0.734	S	S	*	*			trans	-96.7	103.8	172.7	33.5	-28.2	0	0	0	111.5
568	G	34.6	Very low	41.5	Very low	69 Å²	69	118 Å²	118	71%	0.711	72%	0.724	S	S	*	*			trans	-125.5	148.7	177.7	0	0	0	0	0	113.3
569	A	34.8	Very low	44.3	Very low	101 Å²	101	112.9 Å²	112.9	84%	0.835	69%	0.69	S	S	*	*	S	Bend	trans	52.7	77.6	165.2	0	0	0	0	0	118.4
570	L	37.7	Very low	47.1	Very low	172 Å²	172	107.4 Å²	107.4	90%	0.901	66%	0.66	S	S	*	*			trans	-178.8	109.7	131.9	-99.1	169.8	0	0	0	109.1
571	K	37	Very low	50.1	Low	179 Å²	179	102.5 Å²	102.5	78%	0.778	63%	0.626	S	S	*	*			trans	-147.9	79	-179.6	-79	-170.8	173.5	-177.8	0	111.5
572	D	42.9	Very low	53.1	Low	174 Å²	174	97.1 Å²	97.1	93%	0.93	59%	0.593	S	S	*	*			trans	-147.4	23.1	170.7	-95.1	-40.8	0	0	0	112.7
573	A	44.6	Very low	56.2	Low	79 Å²	79	90.1 Å²	90.1	65%	0.653	56%	0.558	S	S	*	*	S	Bend	trans	-107	141.2	166.1	0	0	0	0	0	108.9	Q575	A573-Q575 PolarHBondContact O-N 3.03Å
574	P	49.1	Very low	59.5	Low	95 Å²	95	87.2 Å²	87.2	62%	0.617	53%	0.531	S	S	*	.			trans	-52.5	129.1	171.8	-26	34.5	0	0	0	110.3	V576	P574-V576 PolarHBondContact O-N 2.64Å
575	Q	52.2	Low	62.4	Low	132 Å²	132	81.4 Å²	81.4	62%	0.617	49%	0.493	S	S	*	.			trans	-73.7	87.3	174.5	-75.9	-178.4	53.3	0	0	108.6	A573 L577 T704	A573-Q575 PolarHBondContact O-N 3.03Å; Q575-L577 PolarHBondContact O-N 3.14Å; Q575-T704 PolarHBondContact O-OG1 3.08Å
576	V	56.3	Low	65.3	Low	84 Å²	84	79.7 Å²	79.7	51%	0.509	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-55.2	117.4	168.5	178.1	0	0	0	0	107.5	P574 K701	P574-V576 PolarHBondContact O-N 2.64Å; V576-K701 HydrophobicContact CG1-CB 4.05Å; V576-K701 HydrophobicContact CG1-CD 4.14Å
577	L	72.3	Confident	68.4	Low	46 Å²	46	76.2 Å²	76.2	24%	0.241	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-72.8	150.2	175.2	-68.8	176.4	0	0	0	109.1	Q575 G579 L681 L702 Q703 T704	Q575-L577 PolarHBondContact O-N 3.14Å; L577-G579 PolarHBondContact O-N 3.21Å; L577-L681 WeakPolarHBondContact CD1-O 3.38Å; L577-L702 HydrophobicContact CB-CB 4.23Å; L577-L702 PolarHBondContact N-O 2.88Å; L577-Q703 WeakPolarHBondContact CD1-O 3.24Å; L577-T704 HydrophobicContact CD1-CG2 4.07Å; L577-T704 HydrophobicContact CD2-CG2 3.77Å; L577-T704 HydrophobicContact CG-CG2 3.91Å
578	P	78.9	Confident	71	Confident	74 Å²	74	70.9 Å²	70.9	48%	0.481	41%	0.406	S	S	.	.	S	Bend	trans	-57.1	129.4	164.1	27.8	-34.9	0	0	0	108.5	D603 P605	P578-D603 CarbonylContact C-O 3.25Å; P578-D603 VanDerWaalsContact C-O 3.25Å; P578-P605 HydrophobicContact CG-CB 3.99Å; P578-P605 HydrophobicContact CG-CG 4.39Å; P578-P605 WeakPolarHBondContact O-CD 3.03Å
579	G	89.3	Confident	73.8	Confident	4 Å²	4	75.5 Å²	75.5	4%	0.041	41%	0.406	C	S	.	.			trans	130.2	141.8	-179.6	0	0	0	0	0	113.8	L577 T602 D603 L702	L577-G579 PolarHBondContact O-N 3.21Å; G579-T602 VanDerWaalsContact CA-O 3.27Å; G579-T602 WeakPolarHBondContact CA-O 3.29Å; G579-D603 WeakPolarHBondContact CA-O 3.44Å; G579-D603 PolarHBondContact N-O 3.42Å; G579-L702 PolarHBondContact O-N 2.9Å
580	Q	94.2	Very high	76.5	Confident	60 Å²	60	77.1 Å²	77.1	28%	0.28	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.5	174.4	-52.8	-172.6	52.3	0	0	109.7	A601 T602 W699 Y700 K701	Q580-A601 CarbonylContact O-C 3.53Å; Q580-A601 WeakPolarHBondContact O-CA 3.22Å; Q580-A601 VanDerWaalsContact O-CB 3.31Å; Q580-A601 WeakPolarHBondContact O-CB 3.33Å; Q580-T602 PolarHBondContact N-O 3.34Å; Q580-T602 PolarHBondContact O-N 2.88Å; Q580-W699 HydrophobicContact CB-CE3 3.8Å; Q580-W699 HydrophobicContact CB-CZ3 4.2Å; Q580-Y700 CarbonylContact C-O 3.6Å; Q580-Y700 WeakPolarHBondContact CA-O 3.41Å; Q580-K701 HydrophobicContact CG-CG 4.27Å
581	L	96.2	Very high	79	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.3	177.5	-171	71.9	0	0	0	109.7	V583 V598 A601 V617 W644 I665 V667 I684 Y700 L702	L581-V583 HydrophobicContact CB-CG2 4.48Å; L581-V583 HydrophobicContact CD2-CG2 3.62Å; L581-V583 HydrophobicContact CG-CG2 3.75Å; L581-V598 HydrophobicContact CD1-CG1 4.34Å; L581-A601 HydrophobicContact CD1-CB 3.91Å; L581-V617 HydrophobicContact CD1-CG2 4.27Å; L581-W644 HydrophobicContact CD1-CE3 4.31Å; L581-W644 HydrophobicContact CD1-CH2 4.26Å; L581-W644 HydrophobicContact CD1-CZ3 3.51Å; L581-I665 HydrophobicContact CD2-CG2 3.53Å; L581-V667 HydrophobicContact CD2-CG2 4.44Å; L581-I684 HydrophobicContact CB-CD1 3.48Å; L581-I684 VanDerWaalsContact CB-CD1 3.48Å; L581-I684 HydrophobicContact CD2-CD1 3.72Å; L581-I684 HydrophobicContact CG-CD1 4.22Å; L581-Y700 PolarHBondContact N-O 3.01Å; L581-Y700 PolarHBondContact O-N 3.06Å; L581-L702 HydrophobicContact CB-CD2 4.47Å
582	S	97.1	Very high	81.8	Confident	4 Å²	4	65.9 Å²	65.9	3%	0.028	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.6	171.5	-176.6	0	0	0	0	109.9	L599 Q600 H698	S582-L599 WeakPolarHBondContact O-CB 3.42Å; S582-L599 PolarHBondContact O-N 3.45Å; S582-L599 VanDerWaalsContact O-N 3.07Å; S582-Q600 PolarHBondContact N-O 2.87Å; S582-H698 CarbonylContact C-O 3.57Å; S582-H698 WeakPolarHBondContact CA-O 3.44Å
583	V	97.2	Very high	84.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.8	-179	-171.7	0	0	0	0	109.1	L581 L585 V596 N597 I665 H698 Y700	L581-V583 HydrophobicContact CB-CG2 4.48Å; L581-V583 HydrophobicContact CD2-CG2 3.62Å; L581-V583 HydrophobicContact CG-CG2 3.75Å; V583-L585 HydrophobicContact CG1-CD2 3.78Å; V583-L585 HydrophobicContact CG1-CG 4.14Å; V583-V596 HydrophobicContact CG1-CG1 3.81Å; V583-N597 WeakPolarHBondContact CA-O 3.36Å; V583-I665 HydrophobicContact CG1-CD1 4.13Å; V583-I665 HydrophobicContact CG2-CD1 4.08Å; V583-H698 PolarHBondContact N-O 2.91Å; V583-H698 PolarHBondContact O-N 2.74Å; V583-Y700 HydrophobicContact CB-CD2 4.12Å; V583-Y700 HydrophobicContact CB-CE2 4.05Å; V583-Y700 HydrophobicContact CG2-CD2 4.24Å
584	K	96.1	Very high	86.7	Confident	48 Å²	48	56.5 Å²	56.5	21%	0.209	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.4	176	163.7	167.6	152.2	119.9	0	108.6	N597 L599 D695 E696 P697	K584-N597 HydrophobicContact CB-CB 3.91Å; K584-N597 HydrophobicContact CG-CB 4.26Å; K584-N597 PolarHBondContact N-O 2.67Å; K584-N597 WeakPolarHBondContact O-CB 3.16Å; K584-N597 PolarHBondContact O-N 3.15Å; K584-L599 HydrophobicContact CB-CD1 3.99Å; K584-D695 WeakPolarHBondContact CD-O 3.38Å; K584-D695 WeakPolarHBondContact CE-O 3.46Å; K584-D695 WeakPolarHBondContact CE-OD1 3.24Å; K584-D695 VanDerWaalsContact CE-OD2 3.27Å; K584-D695 WeakPolarHBondContact CE-OD2 3.4Å; K584-D695 WeakPolarHBondContact CG-O 3.42Å; K584-D695 PolarHBondContact NZ-O 3.44Å; K584-D695 IonicContact NZ-OD1 3.39Å; K584-D695 PolarHBondContact NZ-OD1 3.47Å; K584-D695 IonicContact NZ-OD2 3.3Å; K584-D695 PolarHBondContact NZ-OD2 3.13Å; K584-E696 WeakPolarHBondContact CA-O 3.18Å; K584-P697 HydrophobicContact CB-CB 4.31Å
585	L	96.6	Very high	88.9	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.8	-172.2	-60.3	175.6	0	0	0	110.7	V583 V596 L663 I686 A691 L693 D695	V583-L585 HydrophobicContact CG1-CD2 3.78Å; V583-L585 HydrophobicContact CG1-CG 4.14Å; L585-V596 HydrophobicContact CD2-CB 4.06Å; L585-V596 HydrophobicContact CD2-CG1 3.7Å; L585-V596 HydrophobicContact CD2-CG2 3.78Å; L585-L663 HydrophobicContact CD2-CD2 3.83Å; L585-I686 HydrophobicContact CD1-CD1 4.08Å; L585-I686 HydrophobicContact CD1-CG2 4.21Å; L585-A691 HydrophobicContact CD1-CB 4.35Å; L585-L693 HydrophobicContact CB-CD2 3.72Å; L585-L693 HydrophobicContact CD1-CD2 4.35Å; L585-L693 CarbonylContact O-C 3.59Å; L585-L693 WeakPolarHBondContact O-CA 3.26Å; L585-D695 WeakPolarHBondContact O-CA 3.35Å; L585-D695 PolarHBondContact O-N 3.49Å
586	W	94.8	Very high	91.1	Very high	93 Å²	93	46.1 Å²	46.1	35%	0.352	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	162.4	168.7	67.9	-84.7	0	0	0	112.1	D588 I595 D695	W586-D588 HydrophobicContact CE3-CB 4.46Å; W586-D588 HydrophobicContact CH2-CB 4.36Å; W586-D588 HydrophobicContact CZ3-CB 3.75Å; W586-I595 HydrophobicContact CD2-CB 4.03Å; W586-I595 HydrophobicContact CD2-CD1 3.9Å; W586-I595 HydrophobicContact CD2-CG1 4.18Å; W586-I595 HydrophobicContact CE3-CD1 3.89Å; W586-I595 HydrophobicContact CG-CB 4.18Å; W586-I595 HydrophobicContact CH2-CD1 3.72Å; W586-I595 HydrophobicContact CH2-CG1 4.09Å; W586-I595 HydrophobicContact CZ2-CB 4.06Å; W586-I595 HydrophobicContact CZ2-CD1 3.74Å; W586-I595 HydrophobicContact CZ2-CG1 3.6Å; W586-I595 HydrophobicContact CZ2-CG2 4.25Å; W586-I595 HydrophobicContact CZ3-CD1 3.8Å; W586-I595 PolarHBondContact N-O 3.22Å; W586-I595 VanDerWaalsContact NE1-CG2 3.34Å; W586-I595 PolarHBondContact O-N 3.19Å; W586-D695 HydrophobicContact CB-CB 3.93Å; W586-D695 HydrophobicContact CG-CB 4.27Å
587	Y	95.6	Very high	93	Very high	40 Å²	40	43 Å²	43	16%	0.157	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	116.2	-176	172.8	-113.8	0	0	0	112.3	K589 Q593 V653 R655 F658	Y587-K589 HydrophobicContact CD1-CB 4.33Å; Y587-K589 HydrophobicContact CE1-CB 3.91Å; Y587-K589 HydrophobicContact CE1-CG 4.27Å; Y587-K589 PolarHBondContact O-N 2.9Å; Y587-Q593 WeakPolarHBondContact CD2-O 3.35Å; Y587-V653 VanDerWaalsContact CE2-O 3.29Å; Y587-V653 WeakPolarHBondContact CE2-O 3.4Å; Y587-V653 PolarHBondContact OH-O 2.88Å; Y587-R655 HydrophobicContact CE1-CB 4.03Å; Y587-R655 PolarHBondContact OH-N 2.7Å; Y587-F658 HydrophobicContact CD1-CZ 4.15Å; Y587-F658 HydrophobicContact CD2-CE1 4.23Å; Y587-F658 AromaticContact CD2-CZ 3.55Å; Y587-F658 HydrophobicContact CD2-CZ 3.55Å; Y587-F658 HydrophobicContact CE1-CZ 4.4Å; Y587-F658 HydrophobicContact CE2-CE1 4.12Å; Y587-F658 AromaticContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CG-CE2 4.38Å; Y587-F658 AromaticContact CG-CZ 3.72Å; Y587-F658 HydrophobicContact CG-CZ 3.72Å
588	D	94.4	Very high	94.2	Very high	32 Å²	32	40.8 Å²	40.8	17%	0.171	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	101.2	168.2	173.8	13.1	0	0	0	109.9	W586 V590 G591 H592 Q593 I595	W586-D588 HydrophobicContact CE3-CB 4.46Å; W586-D588 HydrophobicContact CH2-CB 4.36Å; W586-D588 HydrophobicContact CZ3-CB 3.75Å; D588-V590 PolarHBondContact O-N 2.83Å; D588-V590 WeakPolarHBondContact OD1-CA 3.49Å; D588-V590 WeakPolarHBondContact OD1-CB 3.48Å; D588-V590 PolarHBondContact OD1-N 3.18Å; D588-G591 PolarHBondContact OD1-N 2.99Å; D588-G591 WeakPolarHBondContact OD2-CA 3.43Å; D588-G591 PolarHBondContact OD2-N 3.14Å; D588-H592 VanDerWaalsContact O-CA 3.32Å; D588-H592 WeakPolarHBondContact O-CA 3.31Å; D588-H592 PolarHBondContact O-N 3.37Å; D588-Q593 HydrophobicContact CB-CB 4.06Å; D588-Q593 HydrophobicContact CB-CG 4.4Å; D588-Q593 PolarHBondContact N-O 3.45Å; D588-Q593 PolarHBondContact O-N 3.03Å; D588-Q593 VanDerWaalsContact O-N 3.08Å; D588-Q593 PolarHBondContact OD2-NE2 3.09Å; D588-I595 HydrophobicContact CB-CD1 3.92Å
589	K	91.7	Very high	95.1	Very high	167 Å²	167	39 Å²	39	73%	0.726	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.9	175.9	-172.9	179.4	176.3	-174.8	0	113.1	Y587 H592	Y587-K589 HydrophobicContact CD1-CB 4.33Å; Y587-K589 HydrophobicContact CE1-CB 3.91Å; Y587-K589 HydrophobicContact CE1-CG 4.27Å; Y587-K589 PolarHBondContact O-N 2.9Å; K589-H592 PolarHBondContact O-CE1 3.14Å; K589-H592 VanDerWaalsContact O-CE1 3.27Å; K589-H592 PolarHBondContact O-ND1 3.29Å
590	V	92.5	Very high	95.4	Very high	135 Å²	135	40.8 Å²	40.8	82%	0.818	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-50.6	-173.9	-177.5	0	0	0	0	111	D588 H592	D588-V590 PolarHBondContact O-N 2.83Å; D588-V590 WeakPolarHBondContact OD1-CA 3.49Å; D588-V590 WeakPolarHBondContact OD1-CB 3.48Å; D588-V590 PolarHBondContact OD1-N 3.18Å; V590-H592 VanDerWaalsContact C-N 3.32Å
591	G	91	Very high	95.5	Very high	40 Å²	40	38 Å²	38	41%	0.412	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-5.3	175.8	0	0	0	0	0	114.8	D588 Q593	D588-G591 PolarHBondContact OD1-N 2.99Å; D588-G591 WeakPolarHBondContact OD2-CA 3.43Å; D588-G591 PolarHBondContact OD2-N 3.14Å; G591-Q593 VanDerWaalsContact O-CG 3.3Å; G591-Q593 WeakPolarHBondContact O-CG 3.5Å
592	H	94.7	Very high	95.4	Very high	74 Å²	74	39.3 Å²	39.3	34%	0.343	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	58.9	-174	-58.1	-13.9	0	0	0	111.3	D588 K589 V590 S651 H652 V653 H654	D588-H592 VanDerWaalsContact O-CA 3.32Å; D588-H592 WeakPolarHBondContact O-CA 3.31Å; D588-H592 PolarHBondContact O-N 3.37Å; K589-H592 PolarHBondContact O-CE1 3.14Å; K589-H592 VanDerWaalsContact O-CE1 3.27Å; K589-H592 PolarHBondContact O-ND1 3.29Å; V590-H592 VanDerWaalsContact C-N 3.32Å; H592-S651 CarbonylContact O-C 3.5Å; H592-H652 PolarHBondContact O-N 3.33Å; H592-V653 CarbonylContact C-O 3.47Å; H592-V653 VanDerWaalsContact C-O 3.25Å; H592-V653 WeakPolarHBondContact CA-O 3.42Å; H592-V653 WeakPolarHBondContact CB-O 3.49Å; H592-V653 PolarHBondContact O-N 2.88Å; H592-H654 AromaticContact CD2-CD2 3.44Å; H592-H654 PolarHBondContact CD2-CD2 2.68Å; H592-H654 VanDerWaalsContact CD2-CD2 3.44Å; H592-H654 AromaticContact CD2-NE2 3.49Å; H592-H654 PolarHBondContact CD2-NE2 2.81Å; H592-H654 AromaticContact NE2-CD2 3.97Å
593	Q	95.2	Very high	95.2	Very high	57 Å²	57	43.5 Å²	43.5	27%	0.266	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132.8	-174.2	-39.5	-175.7	85.1	0	0	111.2	Y587 D588 G591 I595 V649 Y650 S651	Y587-Q593 WeakPolarHBondContact CD2-O 3.35Å; D588-Q593 HydrophobicContact CB-CB 4.06Å; D588-Q593 HydrophobicContact CB-CG 4.4Å; D588-Q593 PolarHBondContact N-O 3.45Å; D588-Q593 PolarHBondContact O-N 3.03Å; D588-Q593 VanDerWaalsContact O-N 3.08Å; D588-Q593 PolarHBondContact OD2-NE2 3.09Å; G591-Q593 VanDerWaalsContact O-CG 3.3Å; G591-Q593 WeakPolarHBondContact O-CG 3.5Å; Q593-I595 HydrophobicContact CB-CD1 3.94Å; Q593-I595 WeakPolarHBondContact O-CD1 3.24Å; Q593-V649 HydrophobicContact CB-CG1 3.93Å; Q593-V649 HydrophobicContact CG-CG1 4.5Å; Q593-Y650 CarbonylContact C-O 3.48Å; Q593-Y650 VanDerWaalsContact CA-O 3.25Å; Q593-Y650 WeakPolarHBondContact CA-O 3.48Å; Q593-S651 PolarHBondContact OE1-OG 2.83Å
594	L	95.2	Very high	95	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.9	163.8	178.4	70.5	0	0	0	108.7	V596 F621 Y650 V653 L688 L693	L594-V596 HydrophobicContact CD2-CG2 4.33Å; L594-V596 HydrophobicContact CG-CG2 4.24Å; L594-F621 HydrophobicContact CD2-CD2 4.19Å; L594-F621 HydrophobicContact CD2-CE2 3.67Å; L594-Y650 HydrophobicContact CD2-CD2 4.35Å; L594-Y650 PolarHBondContact N-O 3.42Å; L594-Y650 PolarHBondContact O-N 2.84Å; L594-V653 HydrophobicContact CB-CB 4.42Å; L594-V653 HydrophobicContact CB-CG1 4Å; L594-L688 HydrophobicContact CD2-CD1 4.34Å; L594-L688 HydrophobicContact CD2-CD2 3.68Å; L594-L693 HydrophobicContact CD1-CD2 3.96Å
595	I	96.3	Very high	94.5	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.041	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.9	177.7	-59.7	77.7	0	0	0	108.6	W586 D588 Q593 T647 V649	W586-I595 HydrophobicContact CD2-CB 4.03Å; W586-I595 HydrophobicContact CD2-CD1 3.9Å; W586-I595 HydrophobicContact CD2-CG1 4.18Å; W586-I595 HydrophobicContact CE3-CD1 3.89Å; W586-I595 HydrophobicContact CG-CB 4.18Å; W586-I595 HydrophobicContact CH2-CD1 3.72Å; W586-I595 HydrophobicContact CH2-CG1 4.09Å; W586-I595 HydrophobicContact CZ2-CB 4.06Å; W586-I595 HydrophobicContact CZ2-CD1 3.74Å; W586-I595 HydrophobicContact CZ2-CG1 3.6Å; W586-I595 HydrophobicContact CZ2-CG2 4.25Å; W586-I595 HydrophobicContact CZ3-CD1 3.8Å; W586-I595 PolarHBondContact N-O 3.22Å; W586-I595 VanDerWaalsContact NE1-CG2 3.34Å; W586-I595 PolarHBondContact O-N 3.19Å; D588-I595 HydrophobicContact CB-CD1 3.92Å; Q593-I595 HydrophobicContact CB-CD1 3.94Å; Q593-I595 WeakPolarHBondContact O-CD1 3.24Å; I595-T647 HydrophobicContact CG2-CG2 3.64Å; I595-V649 HydrophobicContact CG1-CG1 4.36Å; I595-V649 HydrophobicContact CG1-CG2 4.2Å
596	V	97.1	Very high	94	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.3	-177.5	-175.8	0	0	0	0	109.8	V583 L585 L594 V598 M619 T647 F648 Y650 L663	V583-V596 HydrophobicContact CG1-CG1 3.81Å; L585-V596 HydrophobicContact CD2-CB 4.06Å; L585-V596 HydrophobicContact CD2-CG1 3.7Å; L585-V596 HydrophobicContact CD2-CG2 3.78Å; L594-V596 HydrophobicContact CD2-CG2 4.33Å; L594-V596 HydrophobicContact CG-CG2 4.24Å; V596-V598 HydrophobicContact CG1-CG2 4.24Å; V596-M619 HydrophobicContact CB-CE 3.76Å; V596-M619 HydrophobicContact CG1-CE 3.52Å; V596-M619 HydrophobicContact CG2-CE 4Å; V596-T647 CarbonylContact O-C 3.5Å; V596-T647 WeakPolarHBondContact O-CA 3.37Å; V596-F648 PolarHBondContact N-O 2.64Å; V596-F648 PolarHBondContact O-N 2.83Å; V596-Y650 HydrophobicContact CG2-CD2 4.33Å; V596-Y650 HydrophobicContact CG2-CE2 4.16Å; V596-L663 HydrophobicContact CB-CD2 4.45Å; V596-L663 HydrophobicContact CG1-CD2 4.01Å; V596-L663 HydrophobicContact CG2-CD1 4.4Å; V596-L663 HydrophobicContact CG2-CD2 3.59Å
597	N	96.9	Very high	93.6	Very high	19 Å²	19	43.9 Å²	43.9	10%	0.102	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	106.3	173.9	-69.9	-44.6	0	0	0	109.4	V583 K584 L599 T647	V583-N597 WeakPolarHBondContact CA-O 3.36Å; K584-N597 HydrophobicContact CB-CB 3.91Å; K584-N597 HydrophobicContact CG-CB 4.26Å; K584-N597 PolarHBondContact N-O 2.67Å; K584-N597 WeakPolarHBondContact O-CB 3.16Å; K584-N597 PolarHBondContact O-N 3.15Å; N597-L599 HydrophobicContact CB-CD2 4.05Å; N597-L599 PolarHBondContact O-N 2.96Å; N597-T647 VanDerWaalsContact OD1-CB 3.27Å; N597-T647 WeakPolarHBondContact OD1-CB 3.3Å; N597-T647 VanDerWaalsContact OD1-CG2 3.27Å; N597-T647 WeakPolarHBondContact OD1-CG2 3.36Å; N597-T647 PolarHBondContact OD1-OG1 2.96Å
598	V	97.4	Very high	93	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	106.1	172.2	-177.5	0	0	0	0	108	L581 V596 V617 M619 T633 W644 N645 Q646 F648	L581-V598 HydrophobicContact CD1-CG1 4.34Å; V596-V598 HydrophobicContact CG1-CG2 4.24Å; V598-V617 HydrophobicContact CG1-CB 4.33Å; V598-V617 HydrophobicContact CG1-CG1 4.45Å; V598-V617 HydrophobicContact CG1-CG2 3.95Å; V598-M619 HydrophobicContact CG2-SD 4.06Å; V598-T633 HydrophobicContact CB-CG2 4.01Å; V598-T633 HydrophobicContact CG1-CG2 3.91Å; V598-T633 HydrophobicContact CG2-CG2 4.46Å; V598-W644 HydrophobicContact CG1-CD2 4.49Å; V598-W644 HydrophobicContact CG1-CE3 3.97Å; V598-N645 PolarHBondContact O-N 3.25Å; V598-Q646 PolarHBondContact N-O 3.28Å; V598-Q646 PolarHBondContact O-N 3.15Å; V598-F648 HydrophobicContact CB-CE2 4.43Å; V598-F648 HydrophobicContact CG2-CD2 4.19Å; V598-F648 HydrophobicContact CG2-CE2 4.01Å
599	L	96.7	Very high	92.4	Very high	37 Å²	37	51 Å²	51	19%	0.194	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-70.9	-168.4	-59.7	178.9	0	0	0	111.6	S582 K584 N597 W644 N645 P697	S582-L599 WeakPolarHBondContact O-CB 3.42Å; S582-L599 PolarHBondContact O-N 3.45Å; S582-L599 VanDerWaalsContact O-N 3.07Å; K584-L599 HydrophobicContact CB-CD1 3.99Å; N597-L599 HydrophobicContact CB-CD2 4.05Å; N597-L599 PolarHBondContact O-N 2.96Å; L599-W644 PolarHBondContact O-N 3.36Å; L599-N645 PolarHBondContact O-N 2.63Å; L599-N645 PolarHBondContact O-OD1 2.63Å; L599-P697 HydrophobicContact CD1-CB 3.57Å
600	Q	96.7	Very high	91.8	Very high	41 Å²	41	46.2 Å²	46.2	19%	0.192	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	161.4	-174	61.8	-178.8	12	0	0	111.7	S582 P642 K643 W699	S582-Q600 PolarHBondContact N-O 2.87Å; Q600-P642 CarbonylContact C-O 3.48Å; Q600-P642 WeakPolarHBondContact CA-O 3.23Å; Q600-P642 WeakPolarHBondContact CB-O 3.5Å; Q600-K643 HydrophobicContact CB-CB 4.29Å; Q600-K643 HydrophobicContact CB-CD 4.49Å; Q600-K643 HydrophobicContact CB-CG 3.93Å; Q600-K643 VanDerWaalsContact OE1-CE 3.23Å; Q600-W699 HydrophobicContact CG-CH2 3.9Å; Q600-W699 VanDerWaalsContact NE2-CH2 3.29Å; Q600-W699 VanDerWaalsContact NE2-CZ2 3.26Å
601	A	96.5	Very high	91.3	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.008	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	157.6	162.9	0	0	0	0	0	111.1	Q580 L581 L604 E641 P642 W644	Q580-A601 CarbonylContact O-C 3.53Å; Q580-A601 WeakPolarHBondContact O-CA 3.22Å; Q580-A601 VanDerWaalsContact O-CB 3.31Å; Q580-A601 WeakPolarHBondContact O-CB 3.33Å; L581-A601 HydrophobicContact CD1-CB 3.91Å; A601-L604 HydrophobicContact CB-CD1 4.07Å; A601-L604 HydrophobicContact CB-CD2 4.04Å; A601-L604 HydrophobicContact CB-CG 4.07Å; A601-E641 CarbonylContact O-C 3.56Å; A601-E641 VanDerWaalsContact O-CA 3.23Å; A601-E641 WeakPolarHBondContact O-CA 3.48Å; A601-P642 HydrophobicContact CB-CG 3.91Å; A601-P642 PolarHBondContact N-O 3.37Å; A601-W644 HydrophobicContact CB-CH2 4.01Å; A601-W644 HydrophobicContact CB-CZ3 3.81Å
602	T	94.8	Very high	90.9	Very high	27 Å²	27	46.5 Å²	46.5	17%	0.166	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	170.1	170.6	52.5	0	0	0	0	109.8	G579 Q580 L604 E641 W699	G579-T602 VanDerWaalsContact CA-O 3.27Å; G579-T602 WeakPolarHBondContact CA-O 3.29Å; Q580-T602 PolarHBondContact N-O 3.34Å; Q580-T602 PolarHBondContact O-N 2.88Å; T602-L604 PolarHBondContact O-N 3.19Å; T602-E641 HydrophobicContact CG2-CG 4.46Å; T602-W699 HydrophobicContact CG2-CH2 3.74Å; T602-W699 HydrophobicContact CG2-CZ3 4.15Å; T602-W699 WeakPolarHBondContact OG1-CZ3 3.48Å
603	D	92.2	Very high	90.6	Very high	93 Å²	93	43.3 Å²	43.3	50%	0.497	25%	0.249	S	C	.	.	S	Bend	trans	55.1	18.1	172.8	-51.9	-40.7	0	0	0	116.5	P578 G579	P578-D603 CarbonylContact C-O 3.25Å; P578-D603 VanDerWaalsContact C-O 3.25Å; G579-D603 WeakPolarHBondContact CA-O 3.44Å; G579-D603 PolarHBondContact N-O 3.42Å
604	L	92.3	Very high	90.6	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-61.1	137.1	-179	-63.3	-176.9	0	0	0	111.1	A601 T602 P615 L640 P642 V667 L681 L702	A601-L604 HydrophobicContact CB-CD1 4.07Å; A601-L604 HydrophobicContact CB-CD2 4.04Å; A601-L604 HydrophobicContact CB-CG 4.07Å; T602-L604 PolarHBondContact O-N 3.19Å; L604-P615 HydrophobicContact CD1-CB 3.78Å; L604-P615 HydrophobicContact CD1-CG 4Å; L604-L640 WeakPolarHBondContact CB-O 3.48Å; L604-L640 WeakPolarHBondContact CD1-O 3.3Å; L604-L640 VanDerWaalsContact CG-O 3.31Å; L604-L640 WeakPolarHBondContact CG-O 3.47Å; L604-P642 HydrophobicContact CD1-CG 3.83Å; L604-V667 HydrophobicContact CD1-CG1 4.48Å; L604-V667 HydrophobicContact CD2-CG1 4.32Å; L604-L681 HydrophobicContact CD1-CD1 4.22Å; L604-L702 HydrophobicContact CD2-CD1 3.56Å
605	P	86.8	Confident	90.6	Very high	30 Å²	30	41.2 Å²	41.2	20%	0.195	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-63	134.3	-174.2	22.7	-31.4	0	0	0	110.7	P578 R613 L681	P578-P605 HydrophobicContact CG-CB 3.99Å; P578-P605 HydrophobicContact CG-CG 4.39Å; P578-P605 WeakPolarHBondContact O-CD 3.03Å; P605-R613 PolarHBondContact O-NE 3.21Å; P605-L681 HydrophobicContact CG-CD2 4.31Å
606	P	85.2	Confident	90.6	Very high	91 Å²	91	41.1 Å²	41.1	59%	0.591	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-61.8	163.6	172	27.8	-34.5	0	0	0	110.8	R613 L640	P606-R613 PolarHBondContact O-NH2 2.66Å; P606-R613 VanDerWaalsContact O-NH2 3.17Å; P606-L640 HydrophobicContact CB-CD1 4.44Å
607	R	86.8	Confident	90.7	Very high	27 Å²	27	41.2 Å²	41.2	10%	0.102	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-73.9	143.6	169.2	-70.7	-169.5	172.2	-144.2	-10.1	110.4	D609 G610 R611 D669	R607-D609 WeakPolarHBondContact CB-OD1 3.31Å; R607-D609 WeakPolarHBondContact CD-OD1 3.23Å; R607-D609 IonicContact NH1-OD2 2.65Å; R607-D609 PolarHBondContact O-N 3.03Å; R607-G610 PolarHBondContact O-N 2.87Å; R607-R611 WeakPolarHBondContact CB-O 3.5Å; R607-R611 VanDerWaalsContact CD-O 3.23Å; R607-R611 WeakPolarHBondContact CD-O 3.2Å; R607-R611 VanDerWaalsContact CG-O 3.27Å; R607-R611 WeakPolarHBondContact CG-O 3.43Å; R607-D669 IonicContact CZ-OD2 3.84Å; R607-D669 IonicContact NE-OD2 3.78Å; R607-D669 PolarHBondContact NE-OD2 3.23Å; R607-D669 VanDerWaalsContact NH2-CG 3.33Å; R607-D669 IonicContact NH2-OD1 2.68Å; R607-D669 IonicContact NH2-OD2 3.95Å; R607-D669 PolarHBondContact NH2-OD2 2.89Å
608	V	82.1	Confident	90.6	Very high	158 Å²	158	42.3 Å²	42.3	96%	0.958	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-23	168.5	-62.7	0	0	0	0	113.3	G610	V608-G610 VanDerWaalsContact C-N 3.29Å
609	D	81.6	Confident	90.6	Very high	63 Å²	63	42.3 Å²	42.3	34%	0.337	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	4.3	175	73.4	4.1	0	0	0	113.8	R607 R611	R607-D609 WeakPolarHBondContact CB-OD1 3.31Å; R607-D609 WeakPolarHBondContact CD-OD1 3.23Å; R607-D609 IonicContact NH1-OD2 2.65Å; R607-D609 PolarHBondContact O-N 3.03Å; D609-R611 HydrophobicContact CB-CG 4.32Å; D609-R611 VanDerWaalsContact CG-CG 3.45Å; D609-R611 PolarHBondContact O-N 3.38Å; D609-R611 VanDerWaalsContact O-N 3.09Å; D609-R611 WeakPolarHBondContact OD1-CA 3.38Å; D609-R611 WeakPolarHBondContact OD1-CB 3.49Å; D609-R611 VanDerWaalsContact OD1-CG 3.25Å; D609-R611 WeakPolarHBondContact OD1-CG 3.17Å; D609-R611 PolarHBondContact OD1-N 3.4Å; D609-R611 WeakPolarHBondContact OD2-CD 3.25Å; D609-R611 IonicContact OD2-CZ 3.16Å; D609-R611 VanDerWaalsContact OD2-CZ 3.25Å; D609-R611 IonicContact OD2-NE 2.73Å; D609-R611 PolarHBondContact OD2-NE 3.34Å; D609-R611 IonicContact OD2-NH1 2.73Å; D609-R611 PolarHBondContact OD2-NH1 3.11Å
610	G	79.6	Confident	90.5	Very high	67 Å²	67	42.4 Å²	42.4	69%	0.691	24%	0.241	S	C	*	.			trans	67.2	1	-177.1	0	0	0	0	0	114.9	R607 V608	R607-G610 PolarHBondContact O-N 2.87Å; V608-G610 VanDerWaalsContact C-N 3.29Å
611	R	81.9	Confident	90.4	Very high	122 Å²	122	41 Å²	41	46%	0.46	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-82.6	133.8	-178	-54	179.3	-165.6	141.7	-12.9	109.1	R607 D609 R613	R607-R611 WeakPolarHBondContact CB-O 3.5Å; R607-R611 VanDerWaalsContact CD-O 3.23Å; R607-R611 WeakPolarHBondContact CD-O 3.2Å; R607-R611 VanDerWaalsContact CG-O 3.27Å; R607-R611 WeakPolarHBondContact CG-O 3.43Å; D609-R611 HydrophobicContact CB-CG 4.32Å; D609-R611 VanDerWaalsContact CG-CG 3.45Å; D609-R611 PolarHBondContact O-N 3.38Å; D609-R611 VanDerWaalsContact O-N 3.09Å; D609-R611 WeakPolarHBondContact OD1-CA 3.38Å; D609-R611 WeakPolarHBondContact OD1-CB 3.49Å; D609-R611 VanDerWaalsContact OD1-CG 3.25Å; D609-R611 WeakPolarHBondContact OD1-CG 3.17Å; D609-R611 PolarHBondContact OD1-N 3.4Å; D609-R611 WeakPolarHBondContact OD2-CD 3.25Å; D609-R611 IonicContact OD2-CZ 3.16Å; D609-R611 VanDerWaalsContact OD2-CZ 3.25Å; D609-R611 IonicContact OD2-NE 2.73Å; D609-R611 PolarHBondContact OD2-NE 3.34Å; D609-R611 IonicContact OD2-NH1 2.73Å; D609-R611 PolarHBondContact OD2-NH1 3.11Å; R611-R613 PolarHBondContact O-N 2.91Å
612	P	82.4	Confident	90.2	Very high	59 Å²	59	41.3 Å²	41.3	38%	0.383	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-63.4	135.2	-179.3	17.5	-30	0	0	0	114	K638 R672	P612-K638 HydrophobicContact CB-CB 4.02Å; P612-K638 HydrophobicContact CB-CG 4.46Å; P612-K638 HydrophobicContact CG-CB 4.13Å; P612-K638 HydrophobicContact CG-CD 4.41Å; P612-K638 HydrophobicContact CG-CG 4.17Å; P612-R672 VanDerWaalsContact N-NH2 3.14Å; P612-R672 PolarHBondContact O-NH2 3.12Å
613	R	90	Very high	90	Very high	7 Å²	7	45 Å²	45	3%	0.026	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-56.6	152	179.7	-63.7	-70.6	-174.7	-173.8	2.4	113	P605 P606 R611 P615 K638 L639 L640 D669 E679	P605-R613 PolarHBondContact O-NE 3.21Å; P606-R613 PolarHBondContact O-NH2 2.66Å; P606-R613 VanDerWaalsContact O-NH2 3.17Å; R611-R613 PolarHBondContact O-N 2.91Å; R613-P615 VanDerWaalsContact C-CD 3.49Å; R613-K638 CarbonylContact O-C 3.51Å; R613-K638 WeakPolarHBondContact O-CA 3.44Å; R613-K638 PolarHBondContact O-N 3.04Å; R613-L639 PolarHBondContact O-N 2.92Å; R613-L640 HydrophobicContact CB-CD2 4Å; R613-L640 HydrophobicContact CG-CD2 3.46Å; R613-L640 VanDerWaalsContact CG-CD2 3.46Å; R613-D669 VanDerWaalsContact CD-CG 3.49Å; R613-D669 WeakPolarHBondContact CD-OD2 3.29Å; R613-D669 IonicContact CZ-OD2 3.41Å; R613-D669 IonicContact NE-OD2 2.73Å; R613-D669 IonicContact NH1-OD2 3.2Å; R613-D669 PolarHBondContact NH1-OD2 2.81Å; R613-E679 IonicContact CZ-OE1 3.81Å; R613-E679 VanDerWaalsContact CZ-OE1 3.26Å; R613-E679 IonicContact CZ-OE2 2.9Å; R613-E679 IonicContact NH1-OE1 2.68Å; R613-E679 PolarHBondContact NH1-OE1 3.49Å; R613-E679 IonicContact NH1-OE2 2.84Å; R613-E679 PolarHBondContact NH1-OE2 3.31Å; R613-E679 IonicContact NH2-OE1 2.76Å; R613-E679 PolarHBondContact NH2-OE1 2.99Å; R613-E679 IonicContact NH2-OE2 3.74Å
614	N	93.6	Very high	89.8	Confident	13 Å²	13	43.2 Å²	43.2	7%	0.07	25%	0.251	C	S	.	.			trans	-119.2	73.6	164.6	-47.5	-65.6	0	0	0	110.5	T635 V636 K637 K638 D669 Q670	N614-T635 HydrophobicContact CB-CG2 3.87Å; N614-T635 VanDerWaalsContact O-CG2 3.26Å; N614-T635 WeakPolarHBondContact O-CG2 3.4Å; N614-V636 CarbonylContact C-O 3.49Å; N614-V636 WeakPolarHBondContact CA-O 3.36Å; N614-K637 WeakPolarHBondContact OD1-CA 3.24Å; N614-K638 PolarHBondContact OD1-N 2.93Å; N614-K638 VanDerWaalsContact OD1-N 3.13Å; N614-D669 PolarHBondContact N-OD1 3.37Å; N614-Q670 HydrophobicContact CB-CB 4.4Å; N614-Q670 WeakPolarHBondContact CB-O 3.3Å; N614-Q670 PolarHBondContact ND2-O 2.82Å; N614-Q670 PolarHBondContact O-N 2.79Å
615	P	95.9	Very high	89.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	148.6	-171.3	31.4	-38.7	0	0	0	114	L604 R613 V636 L639 P642 W644 W668 L681	L604-P615 HydrophobicContact CD1-CB 3.78Å; L604-P615 HydrophobicContact CD1-CG 4Å; R613-P615 VanDerWaalsContact C-CD 3.49Å; P615-V636 WeakPolarHBondContact CD-O 3.47Å; P615-V636 PolarHBondContact O-N 3.35Å; P615-L639 VanDerWaalsContact CD-O 3.27Å; P615-L639 WeakPolarHBondContact CD-O 3.39Å; P615-L639 WeakPolarHBondContact CG-O 3.3Å; P615-P642 HydrophobicContact CB-CG 4.08Å; P615-P642 HydrophobicContact CG-CB 3.58Å; P615-P642 HydrophobicContact CG-CG 3.48Å; P615-P642 VanDerWaalsContact CG-CG 3.48Å; P615-W644 HydrophobicContact CB-CZ2 4.08Å; P615-W644 HydrophobicContact CG-CZ2 4.44Å; P615-W668 CarbonylContact C-O 3.59Å; P615-W668 VanDerWaalsContact CA-O 3.26Å; P615-W668 WeakPolarHBondContact CA-O 3.43Å; P615-L681 HydrophobicContact CB-CD1 4.29Å
616	Y	97	Very high	89.6	Confident	6 Å²	6	49.5 Å²	49.5	2%	0.024	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	162.5	170.1	70.2	-90.1	0	0	0	110.1	K618 R632 T635 W668 Q670 S678	Y616-K618 HydrophobicContact CD2-CG 4.47Å; Y616-K618 HydrophobicContact CE2-CD 3.82Å; Y616-K618 HydrophobicContact CE2-CG 3.91Å; Y616-K618 WeakPolarHBondContact OH-CE 3.17Å; Y616-K618 PolarHBondContact OH-NZ 3.11Å; Y616-R632 VanDerWaalsContact CD1-NH2 3.26Å; Y616-R632 HydrophobicContact CD2-CG 3.89Å; Y616-R632 VanDerWaalsContact CE1-NH2 3.29Å; Y616-R632 HydrophobicContact CE2-CG 4.3Å; Y616-R632 VanDerWaalsContact CG-NH2 3.32Å; Y616-T635 HydrophobicContact CD1-CG2 4.37Å; Y616-W668 HydrophobicContact CD1-CB 4.06Å; Y616-W668 VanDerWaalsContact CD1-O 3.28Å; Y616-W668 WeakPolarHBondContact CD1-O 3.47Å; Y616-W668 HydrophobicContact CD2-CB 4.16Å; Y616-W668 HydrophobicContact CE1-CB 3.57Å; Y616-W668 HydrophobicContact CE2-CB 3.7Å; Y616-W668 HydrophobicContact CE2-CG 4.07Å; Y616-W668 HydrophobicContact CG-CB 4.36Å; Y616-W668 PolarHBondContact N-O 2.97Å; Y616-W668 PolarHBondContact O-N 3.15Å; Y616-Q670 HydrophobicContact CD1-CB 3.84Å; Y616-Q670 HydrophobicContact CE1-CB 3.76Å; Y616-S678 WeakPolarHBondContact OH-CB 3.45Å; Y616-S678 PolarHBondContact OH-OG 2.94Å
617	V	97.5	Very high	89.7	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.5	178.3	-179.3	0	0	0	0	109.6	L581 V598 R632 T633 W644 I665 T666 V667	L581-V617 HydrophobicContact CD1-CG2 4.27Å; V598-V617 HydrophobicContact CG1-CB 4.33Å; V598-V617 HydrophobicContact CG1-CG1 4.45Å; V598-V617 HydrophobicContact CG1-CG2 3.95Å; V617-R632 CarbonylContact O-C 3.15Å; V617-R632 VanDerWaalsContact O-CA 3.23Å; V617-R632 WeakPolarHBondContact O-CA 3.34Å; V617-R632 VanDerWaalsContact O-CG 3.23Å; V617-R632 WeakPolarHBondContact O-CG 3.48Å; V617-T633 HydrophobicContact CB-CG2 3.98Å; V617-T633 PolarHBondContact N-OG1 2.85Å; V617-T633 PolarHBondContact O-N 2.65Å; V617-W644 HydrophobicContact CG2-CD2 4.33Å; V617-W644 HydrophobicContact CG2-CE3 4.15Å; V617-W644 HydrophobicContact CG2-CH2 3.57Å; V617-W644 HydrophobicContact CG2-CZ2 3.79Å; V617-W644 HydrophobicContact CG2-CZ3 3.78Å; V617-I665 HydrophobicContact CG1-CG2 3.4Å; V617-T666 CarbonylContact C-O 3.47Å; V617-T666 WeakPolarHBondContact CA-O 3.26Å; V617-V667 HydrophobicContact CG2-CG2 4.35Å
618	K	96.2	Very high	89.7	Confident	42 Å²	42	58 Å²	58	18%	0.183	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	147.9	162	-79.3	147.1	170.8	162.4	0	107.4	Y616 R631 R632 T666 W668	Y616-K618 HydrophobicContact CD2-CG 4.47Å; Y616-K618 HydrophobicContact CE2-CD 3.82Å; Y616-K618 HydrophobicContact CE2-CG 3.91Å; Y616-K618 WeakPolarHBondContact OH-CE 3.17Å; Y616-K618 PolarHBondContact OH-NZ 3.11Å; K618-R631 WeakPolarHBondContact CA-O 3.34Å; K618-R632 HydrophobicContact CG-CG 4.26Å; K618-T666 PolarHBondContact N-O 2.67Å; K618-T666 PolarHBondContact O-N 3.28Å; K618-T666 PolarHBondContact O-OG1 3.37Å; K618-W668 HydrophobicContact CD-CD2 4.16Å; K618-W668 HydrophobicContact CD-CG 4.06Å; K618-W668 HydrophobicContact CD-CZ2 4.38Å; K618-W668 VanDerWaalsContact NZ-CE2 3.34Å
619	M	96.2	Very high	90.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	149.7	178.8	58	-164.8	-70.2	0	0	111.1	V596 V598 K630 R631 F648 Y650 L663 E664 I665	V596-M619 HydrophobicContact CB-CE 3.76Å; V596-M619 HydrophobicContact CG1-CE 3.52Å; V596-M619 HydrophobicContact CG2-CE 4Å; V598-M619 HydrophobicContact CG2-SD 4.06Å; M619-K630 CarbonylContact O-C 3.59Å; M619-K630 WeakPolarHBondContact O-CA 3.1Å; M619-R631 HydrophobicContact CG-CB 3.59Å; M619-R631 HydrophobicContact CG-CG 4.34Å; M619-R631 PolarHBondContact N-O 3.33Å; M619-R631 PolarHBondContact O-N 2.61Å; M619-R631 HydrophobicContact SD-CB 3.92Å; M619-F648 HydrophobicContact CE-CD2 4.21Å; M619-F648 HydrophobicContact SD-CD2 3.46Å; M619-F648 WeakPolarHBondContact SD-CD2 3.49Å; M619-F648 HydrophobicContact SD-CE2 3.76Å; M619-F648 HydrophobicContact SD-CG 4.08Å; M619-Y650 HydrophobicContact CE-CE2 4.01Å; M619-L663 HydrophobicContact CE-CD1 3.92Å; M619-E664 CarbonylContact C-O 3.48Å; M619-E664 WeakPolarHBondContact CA-O 3.25Å; M619-E664 WeakPolarHBondContact CB-O 3.25Å; M619-I665 HydrophobicContact CB-CG1 4.34Å
620	Y	95.8	Very high	90.8	Very high	38 Å²	38	51.1 Å²	51.1	15%	0.149	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	152.1	-179.6	-62.3	-92.4	0	0	0	110.7	R625 K630 E664	Y620-R625 HydrophobicContact CD1-CB 4.47Å; Y620-K630 HydrophobicContact CD1-CB 3.88Å; Y620-K630 HydrophobicContact CD1-CG 4.08Å; Y620-K630 HydrophobicContact CE1-CB 3.69Å; Y620-K630 HydrophobicContact CE1-CD 3.7Å; Y620-K630 HydrophobicContact CE1-CG 3.5Å; Y620-K630 VanDerWaalsContact OH-CE 3.24Å; Y620-K630 WeakPolarHBondContact OH-CE 3.3Å; Y620-K630 PolarHBondContact OH-NZ 2.69Å; Y620-E664 WeakPolarHBondContact CD2-OE2 3.45Å; Y620-E664 PolarHBondContact N-O 3.4Å; Y620-E664 PolarHBondContact O-N 2.76Å
621	F	94	Very high	91.6	Very high	11 Å²	11	51.2 Å²	51.2	5%	0.048	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	85.6	-179.7	-171.1	-109	0	0	0	109.7	L594 D624 Y650 V653 R661 L688	L594-F621 HydrophobicContact CD2-CD2 4.19Å; L594-F621 HydrophobicContact CD2-CE2 3.67Å; F621-D624 CarbonylContact C-O 3.54Å; F621-D624 PolarHBondContact O-N 3.34Å; F621-D624 VanDerWaalsContact O-O 3.14Å; F621-Y650 HydrophobicContact CB-CD1 4.16Å; F621-Y650 HydrophobicContact CB-CE1 4Å; F621-Y650 HydrophobicContact CB-CE2 4.37Å; F621-Y650 HydrophobicContact CB-CG 4.44Å; F621-Y650 HydrophobicContact CD2-CD2 4.05Å; F621-Y650 HydrophobicContact CD2-CE2 4.33Å; F621-Y650 HydrophobicContact CD2-CG 4.29Å; F621-Y650 HydrophobicContact CG-CD1 4.47Å; F621-Y650 HydrophobicContact CG-CD2 4.48Å; F621-Y650 HydrophobicContact CG-CG 4.34Å; F621-V653 HydrophobicContact CD1-CG2 4.4Å; F621-V653 HydrophobicContact CE1-CG1 4.44Å; F621-V653 HydrophobicContact CE1-CG2 3.53Å; F621-V653 HydrophobicContact CE2-CG1 4.28Å; F621-V653 HydrophobicContact CE2-CG2 4.14Å; F621-V653 HydrophobicContact CZ-CB 4.13Å; F621-V653 HydrophobicContact CZ-CG1 3.61Å; F621-V653 HydrophobicContact CZ-CG2 3.39Å; F621-R661 HydrophobicContact CZ-CB 4.5Å; F621-L688 HydrophobicContact CD2-CD1 4.37Å; F621-L688 HydrophobicContact CE2-CD1 3.39Å; F621-L688 HydrophobicContact CZ-CD1 3.8Å
622	L	92.8	Very high	92.3	Very high	9 Å²	9	50.4 Å²	50.4	5%	0.047	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	149.3	-171.3	-58.7	-172.3	0	0	0	111.8	D624 R625 R661 M662 E664 L685 L710	L622-D624 VanDerWaalsContact C-N 3.33Å; L622-R625 HydrophobicContact CD2-CG 3.47Å; L622-R625 VanDerWaalsContact CD2-CG 3.47Å; L622-R661 WeakPolarHBondContact O-CA 3.25Å; L622-R661 VanDerWaalsContact O-CB 3.31Å; L622-R661 WeakPolarHBondContact O-CB 3.47Å; L622-R661 WeakPolarHBondContact O-CG 3.28Å; L622-M662 HydrophobicContact CB-CB 4.31Å; L622-M662 WeakPolarHBondContact CB-O 3.44Å; L622-M662 HydrophobicContact CD1-CB 4.36Å; L622-M662 PolarHBondContact N-O 2.86Å; L622-E664 HydrophobicContact CD1-CB 3.95Å; L622-E664 HydrophobicContact CD2-CB 4.23Å; L622-E664 HydrophobicContact CG-CB 3.9Å; L622-L685 HydrophobicContact CD1-CD2 3.98Å; L622-L710 HydrophobicContact CD1-CD2 3.82Å
623	P	91	Very high	93	Very high	103 Å²	103	47.9 Å²	47.9	67%	0.669	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	cis	-79.6	0.1	4.7	32.7	-37	0	0	0	115.2	R625	P623-R625 PolarHBondContact O-N 2.84Å
624	D	87	Confident	93.3	Very high	57 Å²	57	55.3 Å²	55.3	31%	0.305	26%	0.259	S	S	.	.	B	Isolated β-bridge	trans	-73.9	110.6	176	-174.6	8.9	0	0	0	110.2	F621 L622 S626 S629	F621-D624 CarbonylContact C-O 3.54Å; F621-D624 PolarHBondContact O-N 3.34Å; F621-D624 VanDerWaalsContact O-O 3.14Å; L622-D624 VanDerWaalsContact C-N 3.33Å; D624-S626 VanDerWaalsContact CG-OG 3.29Å; D624-S626 WeakPolarHBondContact OD1-CA 3.35Å; D624-S626 WeakPolarHBondContact OD1-CB 3.5Å; D624-S626 PolarHBondContact OD1-N 3.4Å; D624-S626 PolarHBondContact OD1-OG 3.25Å; D624-S626 PolarHBondContact OD2-OG 2.9Å; D624-S626 VanDerWaalsContact OD2-OG 3.14Å; D624-S629 VanDerWaalsContact C-OG 3.3Å; D624-S629 VanDerWaalsContact O-CB 3.23Å; D624-S629 WeakPolarHBondContact O-CB 3.3Å; D624-S629 PolarHBondContact O-OG 2.67Å
625	R	88.7	Confident	93.4	Very high	118 Å²	118	56.4 Å²	56.4	45%	0.445	27%	0.266	S	S	.	.			trans	-102.4	18	168.9	-77.4	-172.9	170.3	169.9	-0.2	112.8	Y620 L622 P623 E664	Y620-R625 HydrophobicContact CD1-CB 4.47Å; L622-R625 HydrophobicContact CD2-CG 3.47Å; L622-R625 VanDerWaalsContact CD2-CG 3.47Å; P623-R625 PolarHBondContact O-N 2.84Å; R625-E664 IonicContact CZ-OE1 3.6Å; R625-E664 VanDerWaalsContact CZ-OE1 3.24Å; R625-E664 IonicContact NE-OE1 2.94Å; R625-E664 PolarHBondContact NE-OE1 2.75Å; R625-E664 IonicContact NE-OE2 2.6Å; R625-E664 IonicContact NH2-OE1 2.8Å; R625-E664 PolarHBondContact NH2-OE1 2.88Å
626	S	86.8	Confident	93.3	Very high	47 Å²	47	57.7 Å²	57.7	33%	0.329	27%	0.274	S	S	.	.	S	Bend	trans	-73.7	167.6	175.8	77.5	0	0	0	0	112.8	D624 K628 S629 K630	D624-S626 VanDerWaalsContact CG-OG 3.29Å; D624-S626 WeakPolarHBondContact OD1-CA 3.35Å; D624-S626 WeakPolarHBondContact OD1-CB 3.5Å; D624-S626 PolarHBondContact OD1-N 3.4Å; D624-S626 PolarHBondContact OD1-OG 3.25Å; D624-S626 PolarHBondContact OD2-OG 2.9Å; D624-S626 VanDerWaalsContact OD2-OG 3.14Å; S626-K628 PolarHBondContact O-N 3.26Å; S626-K628 WeakPolarHBondContact OG-CB 3.18Å; S626-K628 PolarHBondContact OG-N 3.32Å; S626-S629 PolarHBondContact O-N 2.83Å; S626-S629 PolarHBondContact O-OG 3.24Å; S626-K630 PolarHBondContact O-N 2.69Å
627	D	86.2	Confident	93.1	Very high	124 Å²	124	64 Å²	64	66%	0.663	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-5.9	174.2	-64.7	-61.7	0	0	0	113.7	K630	D627-K630 HydrophobicContact CB-CD 4.43Å; D627-K630 WeakPolarHBondContact OD1-CD 3.42Å; D627-K630 WeakPolarHBondContact OD1-CE 3.29Å; D627-K630 IonicContact OD1-NZ 2.72Å; D627-K630 PolarHBondContact OD1-NZ 3.44Å
628	K	87.9	Confident	92.7	Very high	172 Å²	172	70.4 Å²	70.4	75%	0.748	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-40.8	172.2	-65.4	-177.8	178.8	178.4	0	113.1	S626 K630 R631	S626-K628 PolarHBondContact O-N 3.26Å; S626-K628 WeakPolarHBondContact OG-CB 3.18Å; S626-K628 PolarHBondContact OG-N 3.32Å; K628-K630 VanDerWaalsContact C-N 3.31Å; K628-R631 PolarHBondContact O-NH1 3.32Å
629	S	91.4	Very high	92.4	Very high	4 Å²	4	72.5 Å²	72.5	3%	0.028	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.2	178.3	64.7	0	0	0	0	112.8	D624 S626 Y650	D624-S629 VanDerWaalsContact C-OG 3.3Å; D624-S629 VanDerWaalsContact O-CB 3.23Å; D624-S629 WeakPolarHBondContact O-CB 3.3Å; D624-S629 PolarHBondContact O-OG 2.67Å; S626-S629 PolarHBondContact O-N 2.83Å; S626-S629 PolarHBondContact O-OG 3.24Å; S629-Y650 WeakPolarHBondContact O-CE1 3.29Å; S629-Y650 PolarHBondContact O-OH 2.97Å; S629-Y650 VanDerWaalsContact O-OH 3.13Å
630	K	95.2	Very high	92.1	Very high	73 Å²	73	75.8 Å²	75.8	32%	0.317	36%	0.359	S	S	.	.			trans	-74.1	137.9	-178.5	-166.3	174.3	-166.4	157.9	0	112.3	M619 Y620 S626 D627 K628	M619-K630 CarbonylContact O-C 3.59Å; M619-K630 WeakPolarHBondContact O-CA 3.1Å; Y620-K630 HydrophobicContact CD1-CB 3.88Å; Y620-K630 HydrophobicContact CD1-CG 4.08Å; Y620-K630 HydrophobicContact CE1-CB 3.69Å; Y620-K630 HydrophobicContact CE1-CD 3.7Å; Y620-K630 HydrophobicContact CE1-CG 3.5Å; Y620-K630 VanDerWaalsContact OH-CE 3.24Å; Y620-K630 WeakPolarHBondContact OH-CE 3.3Å; Y620-K630 PolarHBondContact OH-NZ 2.69Å; S626-K630 PolarHBondContact O-N 2.69Å; D627-K630 HydrophobicContact CB-CD 4.43Å; D627-K630 WeakPolarHBondContact OD1-CD 3.42Å; D627-K630 WeakPolarHBondContact OD1-CE 3.29Å; D627-K630 IonicContact OD1-NZ 2.72Å; D627-K630 PolarHBondContact OD1-NZ 3.44Å; K628-K630 VanDerWaalsContact C-N 3.31Å
631	R	96.3	Very high	92	Very high	68 Å²	68	79.5 Å²	79.5	26%	0.257	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	162.5	163.9	-50.2	-75.8	-178.7	-91	-1.6	110	K618 M619 K628 F648 V649 Y650	K618-R631 WeakPolarHBondContact CA-O 3.34Å; M619-R631 HydrophobicContact CG-CB 3.59Å; M619-R631 HydrophobicContact CG-CG 4.34Å; M619-R631 PolarHBondContact N-O 3.33Å; M619-R631 PolarHBondContact O-N 2.61Å; M619-R631 HydrophobicContact SD-CB 3.92Å; K628-R631 PolarHBondContact O-NH1 3.32Å; R631-F648 HydrophobicContact CB-CB 4.43Å; R631-F648 HydrophobicContact CB-CD1 3.61Å; R631-F648 HydrophobicContact CB-CD2 4.49Å; R631-F648 HydrophobicContact CB-CE1 3.86Å; R631-F648 HydrophobicContact CB-CG 3.93Å; R631-F648 HydrophobicContact CB-CZ 4.4Å; R631-F648 HydrophobicContact CG-CB 4.04Å; R631-F648 HydrophobicContact CG-CD1 3.9Å; R631-F648 HydrophobicContact CG-CG 4.07Å; R631-V649 PolarHBondContact NE-O 3.48Å; R631-V649 PolarHBondContact NH2-O 2.84Å; R631-Y650 HydrophobicContact CG-CE1 3.85Å; R631-Y650 WeakPolarHBondContact CG-OH 3.37Å
632	R	96.5	Very high	92.1	Very high	106 Å²	106	79 Å²	79	40%	0.4	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	136.9	179.2	-167.7	-166.9	173.1	-168.7	-4.2	111.1	Y616 V617 K618 T635 F648	Y616-R632 VanDerWaalsContact CD1-NH2 3.26Å; Y616-R632 HydrophobicContact CD2-CG 3.89Å; Y616-R632 VanDerWaalsContact CE1-NH2 3.29Å; Y616-R632 HydrophobicContact CE2-CG 4.3Å; Y616-R632 VanDerWaalsContact CG-NH2 3.32Å; V617-R632 CarbonylContact O-C 3.15Å; V617-R632 VanDerWaalsContact O-CA 3.23Å; V617-R632 WeakPolarHBondContact O-CA 3.34Å; V617-R632 VanDerWaalsContact O-CG 3.23Å; V617-R632 WeakPolarHBondContact O-CG 3.48Å; K618-R632 HydrophobicContact CG-CG 4.26Å; R632-T635 PolarHBondContact NH2-OG1 3.16Å; R632-F648 WeakPolarHBondContact O-CZ 3.35Å
633	T	97.4	Very high	92.3	Very high	5 Å²	5	84.7 Å²	84.7	3%	0.031	40%	0.4	C	S	.	.			trans	-79.3	160.8	171.6	63.7	0	0	0	0	112.7	V598 V617 W644 Q646 F648	V598-T633 HydrophobicContact CB-CG2 4.01Å; V598-T633 HydrophobicContact CG1-CG2 3.91Å; V598-T633 HydrophobicContact CG2-CG2 4.46Å; V617-T633 HydrophobicContact CB-CG2 3.98Å; V617-T633 PolarHBondContact N-OG1 2.85Å; V617-T633 PolarHBondContact O-N 2.65Å; T633-W644 VanDerWaalsContact CB-CD1 3.49Å; T633-W644 HydrophobicContact CG2-CB 4.17Å; T633-W644 HydrophobicContact CG2-CG 4.04Å; T633-W644 VanDerWaalsContact OG1-CD1 3.26Å; T633-W644 PolarHBondContact OG1-NE1 3.1Å; T633-W644 VanDerWaalsContact OG1-NE1 3.16Å; T633-Q646 VanDerWaalsContact CA-OE1 3.3Å; T633-Q646 HydrophobicContact CG2-CB 4.31Å; T633-F648 HydrophobicContact CG2-CE2 3.71Å; T633-F648 HydrophobicContact CG2-CZ 3.78Å
634	K	95.8	Very high	92.5	Very high	164 Å²	164	81 Å²	81	71%	0.713	37%	0.373	S	S	*	.			trans	-60.3	136.7	168.3	-66.6	171.1	-176.4	168.4	0	110.4	V636 W644	K634-V636 PolarHBondContact O-N 3.39Å; K634-W644 PolarHBondContact O-NE1 2.92Å
635	T	95.2	Very high	92.9	Very high	35 Å²	35	83.6 Å²	83.6	22%	0.215	39%	0.387	C	S	.	.			trans	-68.6	114.1	174.9	-48.9	0	0	0	0	111.2	N614 Y616 R632 Q670	N614-T635 HydrophobicContact CB-CG2 3.87Å; N614-T635 VanDerWaalsContact O-CG2 3.26Å; N614-T635 WeakPolarHBondContact O-CG2 3.4Å; Y616-T635 HydrophobicContact CD1-CG2 4.37Å; R632-T635 PolarHBondContact NH2-OG1 3.16Å; T635-Q670 HydrophobicContact CG2-CB 3.71Å; T635-Q670 PolarHBondContact OG1-OE1 3.34Å
636	V	94.3	Very high	93.3	Very high	27 Å²	27	80 Å²	80	16%	0.164	38%	0.375	C	S	.	.			trans	-80.8	135.5	171.6	175.2	0	0	0	0	107.7	N614 P615 K634 L639 P642 W644	N614-V636 CarbonylContact C-O 3.49Å; N614-V636 WeakPolarHBondContact CA-O 3.36Å; P615-V636 WeakPolarHBondContact CD-O 3.47Å; P615-V636 PolarHBondContact O-N 3.35Å; K634-V636 PolarHBondContact O-N 3.39Å; V636-L639 HydrophobicContact CG1-CB 4.22Å; V636-L639 HydrophobicContact CG1-CD1 3.79Å; V636-L639 HydrophobicContact CG1-CG 4.36Å; V636-P642 HydrophobicContact CB-CB 3.82Å; V636-P642 HydrophobicContact CG1-CB 3.88Å; V636-P642 HydrophobicContact CG2-CB 4.08Å; V636-W644 HydrophobicContact CG2-CG 4.35Å
637	K	92.2	Very high	93.8	Very high	139 Å²	139	81.7 Å²	81.7	60%	0.604	38%	0.383	S	S	*	.			trans	-105.6	133.6	-171.1	-66	177.4	-177	172.5	0	111.5	N614	N614-K637 WeakPolarHBondContact OD1-CA 3.24Å
638	K	89.9	Confident	94.3	Very high	136 Å²	136	76.7 Å²	76.7	59%	0.591	36%	0.356	S	S	*	.	S	Bend	trans	58.7	39.4	173.9	-55.2	-177	-179.5	179.8	0	116	P612 R613 N614	P612-K638 HydrophobicContact CB-CB 4.02Å; P612-K638 HydrophobicContact CB-CG 4.46Å; P612-K638 HydrophobicContact CG-CB 4.13Å; P612-K638 HydrophobicContact CG-CD 4.41Å; P612-K638 HydrophobicContact CG-CG 4.17Å; R613-K638 CarbonylContact O-C 3.51Å; R613-K638 WeakPolarHBondContact O-CA 3.44Å; R613-K638 PolarHBondContact O-N 3.04Å; N614-K638 PolarHBondContact OD1-N 2.93Å; N614-K638 VanDerWaalsContact OD1-N 3.13Å
639	L	90.3	Very high	94.7	Very high	86 Å²	86	71 Å²	71	45%	0.45	34%	0.335	S	S	.	.			trans	-132.6	142.1	176	-69	176.4	0	0	0	111.3	R613 P615 V636	R613-L639 PolarHBondContact O-N 2.92Å; P615-L639 VanDerWaalsContact CD-O 3.27Å; P615-L639 WeakPolarHBondContact CD-O 3.39Å; P615-L639 WeakPolarHBondContact CG-O 3.3Å; V636-L639 HydrophobicContact CG1-CB 4.22Å; V636-L639 HydrophobicContact CG1-CD1 3.79Å; V636-L639 HydrophobicContact CG1-CG 4.36Å
640	L	90.2	Very high	94.8	Very high	69 Å²	69	71.2 Å²	71.2	36%	0.361	34%	0.335	S	S	.	.	S	Bend	trans	-88.3	-20.8	166.3	-56.7	-178.2	0	0	0	111.7	L604 P606 R613 P642	L604-L640 WeakPolarHBondContact CB-O 3.48Å; L604-L640 WeakPolarHBondContact CD1-O 3.3Å; L604-L640 VanDerWaalsContact CG-O 3.31Å; L604-L640 WeakPolarHBondContact CG-O 3.47Å; P606-L640 HydrophobicContact CB-CD1 4.44Å; R613-L640 HydrophobicContact CB-CD2 4Å; R613-L640 HydrophobicContact CG-CD2 3.46Å; R613-L640 VanDerWaalsContact CG-CD2 3.46Å; L640-P642 WeakPolarHBondContact O-CD 3.48Å
641	E	93.5	Very high	94.7	Very high	117 Å²	117	70.7 Å²	70.7	55%	0.547	34%	0.341	S	S	.	.	S	Bend	trans	-111.8	71.6	174	-58	-174.3	137.1	0	0	110.9	A601 T602	A601-E641 CarbonylContact O-C 3.56Å; A601-E641 VanDerWaalsContact O-CA 3.23Å; A601-E641 WeakPolarHBondContact O-CA 3.48Å; T602-E641 HydrophobicContact CG2-CG 4.46Å
642	P	95.2	Very high	94.4	Very high	0 Å²	0	74.8 Å²	74.8	0%	0	36%	0.362	C	S	.	.			trans	-71.5	138.6	-179.5	31.4	-37.7	0	0	0	111.8	Q600 A601 L604 P615 V636 L640 W644	Q600-P642 CarbonylContact C-O 3.48Å; Q600-P642 WeakPolarHBondContact CA-O 3.23Å; Q600-P642 WeakPolarHBondContact CB-O 3.5Å; A601-P642 HydrophobicContact CB-CG 3.91Å; A601-P642 PolarHBondContact N-O 3.37Å; L604-P642 HydrophobicContact CD1-CG 3.83Å; P615-P642 HydrophobicContact CB-CG 4.08Å; P615-P642 HydrophobicContact CG-CB 3.58Å; P615-P642 HydrophobicContact CG-CG 3.48Å; P615-P642 VanDerWaalsContact CG-CG 3.48Å; V636-P642 HydrophobicContact CB-CB 3.82Å; V636-P642 HydrophobicContact CG1-CB 3.88Å; V636-P642 HydrophobicContact CG2-CB 4.08Å; L640-P642 WeakPolarHBondContact O-CD 3.48Å; P642-W644 HydrophobicContact CB-CD2 4.39Å; P642-W644 HydrophobicContact CB-CH2 3.92Å; P642-W644 HydrophobicContact CB-CZ2 3.73Å; P642-W644 HydrophobicContact CB-CZ3 4.29Å; P642-W644 HydrophobicContact CG-CE3 4.39Å; P642-W644 HydrophobicContact CG-CH2 3.25Å; P642-W644 HydrophobicContact CG-CZ2 3.54Å; P642-W644 HydrophobicContact CG-CZ3 3.71Å
643	K	96.3	Very high	94.2	Very high	129 Å²	129	70 Å²	70	56%	0.561	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	120	167.5	-48.2	-159.8	-176	-140.9	0	108.7	Q600	Q600-K643 HydrophobicContact CB-CB 4.29Å; Q600-K643 HydrophobicContact CB-CD 4.49Å; Q600-K643 HydrophobicContact CB-CG 3.93Å; Q600-K643 VanDerWaalsContact OE1-CE 3.23Å
644	W	96.6	Very high	93.9	Very high	25 Å²	25	72.3 Å²	72.3	10%	0.095	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-41.5	-179.4	-66.5	-73.2	0	0	0	112.1	L581 V598 L599 A601 P615 V617 T633 K634 V636 P642 Q646 V667	L581-W644 HydrophobicContact CD1-CE3 4.31Å; L581-W644 HydrophobicContact CD1-CH2 4.26Å; L581-W644 HydrophobicContact CD1-CZ3 3.51Å; V598-W644 HydrophobicContact CG1-CD2 4.49Å; V598-W644 HydrophobicContact CG1-CE3 3.97Å; L599-W644 PolarHBondContact O-N 3.36Å; A601-W644 HydrophobicContact CB-CH2 4.01Å; A601-W644 HydrophobicContact CB-CZ3 3.81Å; P615-W644 HydrophobicContact CB-CZ2 4.08Å; P615-W644 HydrophobicContact CG-CZ2 4.44Å; V617-W644 HydrophobicContact CG2-CD2 4.33Å; V617-W644 HydrophobicContact CG2-CE3 4.15Å; V617-W644 HydrophobicContact CG2-CH2 3.57Å; V617-W644 HydrophobicContact CG2-CZ2 3.79Å; V617-W644 HydrophobicContact CG2-CZ3 3.78Å; T633-W644 VanDerWaalsContact CB-CD1 3.49Å; T633-W644 HydrophobicContact CG2-CB 4.17Å; T633-W644 HydrophobicContact CG2-CG 4.04Å; T633-W644 VanDerWaalsContact OG1-CD1 3.26Å; T633-W644 PolarHBondContact OG1-NE1 3.1Å; T633-W644 VanDerWaalsContact OG1-NE1 3.16Å; K634-W644 PolarHBondContact O-NE1 2.92Å; V636-W644 HydrophobicContact CG2-CG 4.35Å; P642-W644 HydrophobicContact CB-CD2 4.39Å; P642-W644 HydrophobicContact CB-CH2 3.92Å; P642-W644 HydrophobicContact CB-CZ2 3.73Å; P642-W644 HydrophobicContact CB-CZ3 4.29Å; P642-W644 HydrophobicContact CG-CE3 4.39Å; P642-W644 HydrophobicContact CG-CH2 3.25Å; P642-W644 HydrophobicContact CG-CZ2 3.54Å; P642-W644 HydrophobicContact CG-CZ3 3.71Å; W644-Q646 HydrophobicContact CB-CB 4.4Å; W644-Q646 PolarHBondContact O-N 3.16Å; W644-V667 HydrophobicContact CH2-CG1 4.37Å
645	N	95.7	Very high	93.6	Very high	112 Å²	112	70.4 Å²	70.4	60%	0.599	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	42.7	51.4	-175	-64.2	-9.7	0	0	0	112.1	V598 L599	V598-N645 PolarHBondContact O-N 3.25Å; L599-N645 PolarHBondContact O-N 2.63Å; L599-N645 PolarHBondContact O-OD1 2.63Å
646	Q	96.7	Very high	93.4	Very high	43 Å²	43	77.3 Å²	77.3	20%	0.201	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	116.4	-171.1	-170.3	172.8	-18.8	0	0	111.5	V598 T633 W644 F648	V598-Q646 PolarHBondContact N-O 3.28Å; V598-Q646 PolarHBondContact O-N 3.15Å; T633-Q646 VanDerWaalsContact CA-OE1 3.3Å; T633-Q646 HydrophobicContact CG2-CB 4.31Å; W644-Q646 HydrophobicContact CB-CB 4.4Å; W644-Q646 PolarHBondContact O-N 3.16Å; Q646-F648 HydrophobicContact CB-CE2 4.34Å; Q646-F648 HydrophobicContact CB-CZ 4.36Å; Q646-F648 HydrophobicContact CG-CE1 4.13Å; Q646-F648 HydrophobicContact CG-CE2 4.05Å; Q646-F648 HydrophobicContact CG-CZ 3.69Å; Q646-F648 VanDerWaalsContact NE2-CZ 3.27Å
647	T	96.9	Very high	93.2	Very high	81 Å²	81	77.1 Å²	77.1	50%	0.497	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	141.6	174.9	-49.1	0	0	0	0	111.7	I595 V596 N597	I595-T647 HydrophobicContact CG2-CG2 3.64Å; V596-T647 CarbonylContact O-C 3.5Å; V596-T647 WeakPolarHBondContact O-CA 3.37Å; N597-T647 VanDerWaalsContact OD1-CB 3.27Å; N597-T647 WeakPolarHBondContact OD1-CB 3.3Å; N597-T647 VanDerWaalsContact OD1-CG2 3.27Å; N597-T647 WeakPolarHBondContact OD1-CG2 3.36Å; N597-T647 PolarHBondContact OD1-OG1 2.96Å
648	F	96.9	Very high	93.2	Very high	20 Å²	20	70.6 Å²	70.6	9%	0.088	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	149.7	168.5	-56.3	-78.1	0	0	0	110.3	V596 V598 M619 R631 R632 T633 Q646	V596-F648 PolarHBondContact N-O 2.64Å; V596-F648 PolarHBondContact O-N 2.83Å; V598-F648 HydrophobicContact CB-CE2 4.43Å; V598-F648 HydrophobicContact CG2-CD2 4.19Å; V598-F648 HydrophobicContact CG2-CE2 4.01Å; M619-F648 HydrophobicContact CE-CD2 4.21Å; M619-F648 HydrophobicContact SD-CD2 3.46Å; M619-F648 WeakPolarHBondContact SD-CD2 3.49Å; M619-F648 HydrophobicContact SD-CE2 3.76Å; M619-F648 HydrophobicContact SD-CG 4.08Å; R631-F648 HydrophobicContact CB-CB 4.43Å; R631-F648 HydrophobicContact CB-CD1 3.61Å; R631-F648 HydrophobicContact CB-CD2 4.49Å; R631-F648 HydrophobicContact CB-CE1 3.86Å; R631-F648 HydrophobicContact CB-CG 3.93Å; R631-F648 HydrophobicContact CB-CZ 4.4Å; R631-F648 HydrophobicContact CG-CB 4.04Å; R631-F648 HydrophobicContact CG-CD1 3.9Å; R631-F648 HydrophobicContact CG-CG 4.07Å; R632-F648 WeakPolarHBondContact O-CZ 3.35Å; T633-F648 HydrophobicContact CG2-CE2 3.71Å; T633-F648 HydrophobicContact CG2-CZ 3.78Å; Q646-F648 HydrophobicContact CB-CE2 4.34Å; Q646-F648 HydrophobicContact CB-CZ 4.36Å; Q646-F648 HydrophobicContact CG-CE1 4.13Å; Q646-F648 HydrophobicContact CG-CE2 4.05Å; Q646-F648 HydrophobicContact CG-CZ 3.69Å; Q646-F648 VanDerWaalsContact NE2-CZ 3.27Å
649	V	95.8	Very high	93.2	Very high	53 Å²	53	72.9 Å²	72.9	32%	0.321	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140	179.5	-172.4	0	0	0	0	110.3	Q593 I595 R631	Q593-V649 HydrophobicContact CB-CG1 3.93Å; Q593-V649 HydrophobicContact CG-CG1 4.5Å; I595-V649 HydrophobicContact CG1-CG1 4.36Å; I595-V649 HydrophobicContact CG1-CG2 4.2Å; R631-V649 PolarHBondContact NE-O 3.48Å; R631-V649 PolarHBondContact NH2-O 2.84Å
650	Y	94.8	Very high	93.1	Very high	8 Å²	8	76.5 Å²	76.5	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	103.5	169.2	-62.7	-65.9	0	0	0	109.3	Q593 L594 V596 M619 F621 S629 R631 V653 L663	Q593-Y650 CarbonylContact C-O 3.48Å; Q593-Y650 VanDerWaalsContact CA-O 3.25Å; Q593-Y650 WeakPolarHBondContact CA-O 3.48Å; L594-Y650 HydrophobicContact CD2-CD2 4.35Å; L594-Y650 PolarHBondContact N-O 3.42Å; L594-Y650 PolarHBondContact O-N 2.84Å; V596-Y650 HydrophobicContact CG2-CD2 4.33Å; V596-Y650 HydrophobicContact CG2-CE2 4.16Å; M619-Y650 HydrophobicContact CE-CE2 4.01Å; F621-Y650 HydrophobicContact CB-CD1 4.16Å; F621-Y650 HydrophobicContact CB-CE1 4Å; F621-Y650 HydrophobicContact CB-CE2 4.37Å; F621-Y650 HydrophobicContact CB-CG 4.44Å; F621-Y650 HydrophobicContact CD2-CD2 4.05Å; F621-Y650 HydrophobicContact CD2-CE2 4.33Å; F621-Y650 HydrophobicContact CD2-CG 4.29Å; F621-Y650 HydrophobicContact CG-CD1 4.47Å; F621-Y650 HydrophobicContact CG-CD2 4.48Å; F621-Y650 HydrophobicContact CG-CG 4.34Å; S629-Y650 WeakPolarHBondContact O-CE1 3.29Å; S629-Y650 PolarHBondContact O-OH 2.97Å; S629-Y650 VanDerWaalsContact O-OH 3.13Å; R631-Y650 HydrophobicContact CG-CE1 3.85Å; R631-Y650 WeakPolarHBondContact CG-OH 3.37Å; Y650-V653 VanDerWaalsContact O-CG2 3.31Å; Y650-V653 WeakPolarHBondContact O-CG2 3.45Å; Y650-L663 HydrophobicContact CE2-CD1 3.71Å
651	S	92.8	Very high	93.1	Very high	61 Å²	61	76.7 Å²	76.7	43%	0.427	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	161.7	177	-44.8	0	0	0	0	111.9	H592 Q593 V653	H592-S651 CarbonylContact O-C 3.5Å; Q593-S651 PolarHBondContact OE1-OG 2.83Å; S651-V653 PolarHBondContact O-N 2.74Å
652	H	89.4	Confident	93.1	Very high	154 Å²	154	72.3 Å²	72.3	71%	0.713	33%	0.33	S	S	*	.	S	Bend	trans	64.9	20.9	-176.1	-44.1	-80	0	0	0	114.8	H592 H654	H592-H652 PolarHBondContact O-N 3.33Å; H652-H654 PolarHBondContact O-CE1 3.14Å; H652-H654 PolarHBondContact O-ND1 3.25Å
653	V	92.1	Very high	93.1	Very high	5 Å²	5	72.3 Å²	72.3	3%	0.03	33%	0.33	C	S	.	.			trans	-89.6	112.1	177.3	171.4	0	0	0	0	108.2	Y587 H592 L594 F621 Y650 S651 F658	Y587-V653 VanDerWaalsContact CE2-O 3.29Å; Y587-V653 WeakPolarHBondContact CE2-O 3.4Å; Y587-V653 PolarHBondContact OH-O 2.88Å; H592-V653 CarbonylContact C-O 3.47Å; H592-V653 VanDerWaalsContact C-O 3.25Å; H592-V653 WeakPolarHBondContact CA-O 3.42Å; H592-V653 WeakPolarHBondContact CB-O 3.49Å; H592-V653 PolarHBondContact O-N 2.88Å; L594-V653 HydrophobicContact CB-CB 4.42Å; L594-V653 HydrophobicContact CB-CG1 4Å; F621-V653 HydrophobicContact CD1-CG2 4.4Å; F621-V653 HydrophobicContact CE1-CG1 4.44Å; F621-V653 HydrophobicContact CE1-CG2 3.53Å; F621-V653 HydrophobicContact CE2-CG1 4.28Å; F621-V653 HydrophobicContact CE2-CG2 4.14Å; F621-V653 HydrophobicContact CZ-CB 4.13Å; F621-V653 HydrophobicContact CZ-CG1 3.61Å; F621-V653 HydrophobicContact CZ-CG2 3.39Å; Y650-V653 VanDerWaalsContact O-CG2 3.31Å; Y650-V653 WeakPolarHBondContact O-CG2 3.45Å; S651-V653 PolarHBondContact O-N 2.74Å; V653-F658 HydrophobicContact CG1-CD1 4.42Å; V653-F658 HydrophobicContact CG1-CE1 3.68Å; V653-F658 HydrophobicContact CG1-CZ 4.46Å
654	H	92.1	Very high	93	Very high	54 Å²	54	66.6 Å²	66.6	25%	0.25	31%	0.306	C	S	.	.			trans	-99.9	147.3	-177.5	-57.9	73	0	0	0	110.8	H592 H652 R656 D657 F658	H592-H654 AromaticContact CD2-CD2 3.44Å; H592-H654 PolarHBondContact CD2-CD2 2.68Å; H592-H654 VanDerWaalsContact CD2-CD2 3.44Å; H592-H654 AromaticContact CD2-NE2 3.49Å; H592-H654 PolarHBondContact CD2-NE2 2.81Å; H592-H654 AromaticContact NE2-CD2 3.97Å; H652-H654 PolarHBondContact O-CE1 3.14Å; H652-H654 PolarHBondContact O-ND1 3.25Å; H654-R656 HydrophobicContact CB-CG 4.06Å; H654-R656 PolarHBondContact O-N 2.79Å; H654-D657 WeakPolarHBondContact CB-OD2 3.24Å; H654-D657 IonicContact CG-OD2 3.08Å; H654-D657 PolarHBondContact N-OD2 3.27Å; H654-D657 IonicContact ND1-OD2 3.24Å; H654-D657 VanDerWaalsContact O-CB 3.27Å; H654-D657 WeakPolarHBondContact O-CB 3.35Å; H654-D657 PolarHBondContact O-N 3.33Å; H654-F658 VanDerWaalsContact O-CD1 3.22Å; H654-F658 WeakPolarHBondContact O-CD1 3.28Å; H654-F658 WeakPolarHBondContact O-CE1 3.32Å
655	R	89	Confident	93	Very high	125 Å²	125	65.4 Å²	65.4	47%	0.472	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-58.1	-23.4	-179.5	-166.2	55.7	168.8	102.5	-13.8	114.7	Y587 D657 F658	Y587-R655 HydrophobicContact CE1-CB 4.03Å; Y587-R655 PolarHBondContact OH-N 2.7Å; R655-D657 VanDerWaalsContact C-N 3.33Å; R655-F658 VanDerWaalsContact CD-CD2 3.44Å; R655-F658 VanDerWaalsContact NH1-CD2 3.28Å
656	R	90.5	Very high	92.9	Very high	179 Å²	179	60.4 Å²	60.4	68%	0.675	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-67.9	-31.2	172.4	75.5	-171.3	171.5	-163.6	-11.2	112.6	H654 F658	H654-R656 HydrophobicContact CB-CG 4.06Å; H654-R656 PolarHBondContact O-N 2.79Å; R656-F658 PolarHBondContact O-N 3.06Å
657	D	90	Very high	92.9	Very high	23 Å²	23	58.3 Å²	58.3	12%	0.123	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-75.4	-12.3	-172.4	-47.4	-20.9	0	0	0	111.5	H654 R655 R659 E660 R661	H654-D657 WeakPolarHBondContact CB-OD2 3.24Å; H654-D657 IonicContact CG-OD2 3.08Å; H654-D657 PolarHBondContact N-OD2 3.27Å; H654-D657 IonicContact ND1-OD2 3.24Å; H654-D657 VanDerWaalsContact O-CB 3.27Å; H654-D657 WeakPolarHBondContact O-CB 3.35Å; H654-D657 PolarHBondContact O-N 3.33Å; R655-D657 VanDerWaalsContact C-N 3.33Å; D657-R659 PolarHBondContact O-N 3.02Å; D657-E660 PolarHBondContact O-N 2.97Å; D657-R661 WeakPolarHBondContact O-CB 3.21Å; D657-R661 VanDerWaalsContact O-CG 3.25Å; D657-R661 WeakPolarHBondContact O-CG 3.14Å; D657-R661 PolarHBondContact O-N 3.46Å
658	F	91.9	Very high	92.8	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.009	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-68.5	-20.1	-170.2	-74.3	30.8	0	0	0	113.3	Y587 V653 H654 R655 R656 E660 L688 E689 L693	Y587-F658 HydrophobicContact CD1-CZ 4.15Å; Y587-F658 HydrophobicContact CD2-CE1 4.23Å; Y587-F658 AromaticContact CD2-CZ 3.55Å; Y587-F658 HydrophobicContact CD2-CZ 3.55Å; Y587-F658 HydrophobicContact CE1-CZ 4.4Å; Y587-F658 HydrophobicContact CE2-CE1 4.12Å; Y587-F658 AromaticContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CG-CE2 4.38Å; Y587-F658 AromaticContact CG-CZ 3.72Å; Y587-F658 HydrophobicContact CG-CZ 3.72Å; V653-F658 HydrophobicContact CG1-CD1 4.42Å; V653-F658 HydrophobicContact CG1-CE1 3.68Å; V653-F658 HydrophobicContact CG1-CZ 4.46Å; H654-F658 VanDerWaalsContact O-CD1 3.22Å; H654-F658 WeakPolarHBondContact O-CD1 3.28Å; H654-F658 WeakPolarHBondContact O-CE1 3.32Å; R655-F658 VanDerWaalsContact CD-CD2 3.44Å; R655-F658 VanDerWaalsContact NH1-CD2 3.28Å; R656-F658 PolarHBondContact O-N 3.06Å; F658-E660 VanDerWaalsContact C-N 3.32Å; F658-L688 HydrophobicContact CB-CB 3.79Å; F658-L688 HydrophobicContact CD1-CB 4.45Å; F658-L688 HydrophobicContact CD2-CB 3.93Å; F658-L688 WeakPolarHBondContact CD2-O 3.37Å; F658-L688 HydrophobicContact CG-CB 3.8Å; F658-E689 PolarHBondContact O-N 3.41Å; F658-L693 HydrophobicContact CD2-CD1 4.2Å; F658-L693 HydrophobicContact CE2-CD1 3.52Å; F658-L693 HydrophobicContact CZ-CD1 4.5Å
659	R	89.9	Confident	92.7	Very high	184 Å²	184	56.3 Å²	56.3	69%	0.694	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-75.8	-21.7	179.2	-37.6	-164.2	108.3	163.3	10	113.2	D657 E689	D657-R659 PolarHBondContact O-N 3.02Å; R659-E689 VanDerWaalsContact CB-OE2 3.32Å; R659-E689 WeakPolarHBondContact CB-OE2 3.5Å; R659-E689 VanDerWaalsContact CG-OE2 3.25Å; R659-E689 WeakPolarHBondContact CG-OE2 3.39Å; R659-E689 IonicContact CZ-OE1 2.61Å; R659-E689 VanDerWaalsContact NE-CD 3.32Å; R659-E689 IonicContact NE-OE1 3.38Å; R659-E689 PolarHBondContact NE-OE1 2.76Å; R659-E689 IonicContact NE-OE2 2.69Å; R659-E689 PolarHBondContact NE-OE2 2.96Å; R659-E689 VanDerWaalsContact NE-OE2 3.08Å; R659-E689 IonicContact NH2-OE1 2.7Å; R659-E689 PolarHBondContact NH2-OE1 3.41Å
660	E	88.7	Confident	92.5	Very high	162 Å²	162	57.3 Å²	57.3	76%	0.757	25%	0.249	S	C	*	.	S	Bend	trans	-119.8	12	-171.8	-63.5	175.9	-168	0	0	111.5	D657 F658	D657-E660 PolarHBondContact O-N 2.97Å; F658-E660 VanDerWaalsContact C-N 3.32Å
661	R	89.6	Confident	92	Very high	74 Å²	74	57.7 Å²	57.7	28%	0.279	25%	0.253	S	S	.	.			trans	-139.6	143.1	-172.5	-66.8	-169.2	-170.4	-111.2	11.1	112.5	F621 L622 D657 L688	F621-R661 HydrophobicContact CZ-CB 4.5Å; L622-R661 WeakPolarHBondContact O-CA 3.25Å; L622-R661 VanDerWaalsContact O-CB 3.31Å; L622-R661 WeakPolarHBondContact O-CB 3.47Å; L622-R661 WeakPolarHBondContact O-CG 3.28Å; D657-R661 WeakPolarHBondContact O-CB 3.21Å; D657-R661 VanDerWaalsContact O-CG 3.25Å; D657-R661 WeakPolarHBondContact O-CG 3.14Å; D657-R661 PolarHBondContact O-N 3.46Å; R661-L688 HydrophobicContact CB-CD1 3.75Å; R661-L688 WeakPolarHBondContact O-CG 3.44Å; R661-L688 PolarHBondContact O-N 3.38Å
662	M	93.4	Very high	91.3	Very high	24 Å²	24	60.4 Å²	60.4	12%	0.118	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.7	-179.5	-55.4	170.1	83.8	0	0	109.4	L622 L685 I686 E687 P711	L622-M662 HydrophobicContact CB-CB 4.31Å; L622-M662 WeakPolarHBondContact CB-O 3.44Å; L622-M662 HydrophobicContact CD1-CB 4.36Å; L622-M662 PolarHBondContact N-O 2.86Å; M662-L685 HydrophobicContact CE-CB 3.99Å; M662-I686 CarbonylContact C-O 3.36Å; M662-I686 VanDerWaalsContact CA-O 3.27Å; M662-I686 WeakPolarHBondContact CA-O 3.3Å; M662-E687 HydrophobicContact CE-CG 3.79Å; M662-E687 HydrophobicContact CG-CG 4.36Å; M662-P711 HydrophobicContact CE-CG 4.23Å; M662-P711 HydrophobicContact SD-CG 3.93Å
663	L	95.2	Very high	90.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	111.4	170.8	-177.9	65.5	0	0	0	109.1	L585 V596 M619 Y650 I665 I686 L688	L585-L663 HydrophobicContact CD2-CD2 3.83Å; V596-L663 HydrophobicContact CB-CD2 4.45Å; V596-L663 HydrophobicContact CG1-CD2 4.01Å; V596-L663 HydrophobicContact CG2-CD1 4.4Å; V596-L663 HydrophobicContact CG2-CD2 3.59Å; M619-L663 HydrophobicContact CE-CD1 3.92Å; Y650-L663 HydrophobicContact CE2-CD1 3.71Å; L663-I665 HydrophobicContact CD2-CD1 3.89Å; L663-I665 HydrophobicContact CD2-CG1 4.29Å; L663-I665 HydrophobicContact CG-CD1 4.09Å; L663-I665 HydrophobicContact CG-CG1 3.92Å; L663-I686 HydrophobicContact CB-CB 4.35Å; L663-I686 PolarHBondContact N-O 3.19Å; L663-I686 PolarHBondContact O-N 2.57Å; L663-L688 HydrophobicContact CB-CD2 4.24Å
664	E	95.2	Very high	89.6	Confident	9 Å²	9	62 Å²	62	4%	0.042	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	126.2	175.9	176.4	-178.9	-76.7	0	0	109.1	M619 Y620 L622 R625 T666 L685	M619-E664 CarbonylContact C-O 3.48Å; M619-E664 WeakPolarHBondContact CA-O 3.25Å; M619-E664 WeakPolarHBondContact CB-O 3.25Å; Y620-E664 WeakPolarHBondContact CD2-OE2 3.45Å; Y620-E664 PolarHBondContact N-O 3.4Å; Y620-E664 PolarHBondContact O-N 2.76Å; L622-E664 HydrophobicContact CD1-CB 3.95Å; L622-E664 HydrophobicContact CD2-CB 4.23Å; L622-E664 HydrophobicContact CG-CB 3.9Å; R625-E664 IonicContact CZ-OE1 3.6Å; R625-E664 VanDerWaalsContact CZ-OE1 3.24Å; R625-E664 IonicContact NE-OE1 2.94Å; R625-E664 PolarHBondContact NE-OE1 2.75Å; R625-E664 IonicContact NE-OE2 2.6Å; R625-E664 IonicContact NH2-OE1 2.8Å; R625-E664 PolarHBondContact NH2-OE1 2.88Å; E664-T666 HydrophobicContact CG-CG2 4.23Å; E664-L685 HydrophobicContact CB-CD2 3.91Å; E664-L685 HydrophobicContact CG-CD2 4.07Å
665	I	95.9	Very high	88.8	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	115.4	-178.7	-48.3	-179	0	0	0	108.8	L581 V583 V617 M619 L663 E683 I684 I686	L581-I665 HydrophobicContact CD2-CG2 3.53Å; V583-I665 HydrophobicContact CG1-CD1 4.13Å; V583-I665 HydrophobicContact CG2-CD1 4.08Å; V617-I665 HydrophobicContact CG1-CG2 3.4Å; M619-I665 HydrophobicContact CB-CG1 4.34Å; L663-I665 HydrophobicContact CD2-CD1 3.89Å; L663-I665 HydrophobicContact CD2-CG1 4.29Å; L663-I665 HydrophobicContact CG-CD1 4.09Å; L663-I665 HydrophobicContact CG-CG1 3.92Å; I665-E683 CarbonylContact O-C 3.28Å; I665-E683 WeakPolarHBondContact O-CA 3.03Å; I665-I684 HydrophobicContact CB-CB 4.44Å; I665-I684 PolarHBondContact N-O 3.23Å; I665-I684 PolarHBondContact O-N 2.85Å; I665-I686 HydrophobicContact CD1-CD1 3.85Å
666	T	95	Very high	88.3	Confident	7 Å²	7	63 Å²	63	4%	0.043	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.7	-175.1	57.7	0	0	0	0	110.6	V617 K618 E664 W668 F680 E683	V617-T666 CarbonylContact C-O 3.47Å; V617-T666 WeakPolarHBondContact CA-O 3.26Å; K618-T666 PolarHBondContact N-O 2.67Å; K618-T666 PolarHBondContact O-N 3.28Å; K618-T666 PolarHBondContact O-OG1 3.37Å; E664-T666 HydrophobicContact CG-CG2 4.23Å; T666-W668 VanDerWaalsContact CB-NE1 3.31Å; T666-W668 PolarHBondContact OG1-NE1 3.01Å; T666-F680 HydrophobicContact CG2-CE2 4.23Å; T666-E683 HydrophobicContact CG2-CB 3.82Å
667	V	95.9	Very high	87.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.8	-179.2	-167.4	0	0	0	0	109.7	L581 L604 V617 W644 L681 G682 L702	L581-V667 HydrophobicContact CD2-CG2 4.44Å; L604-V667 HydrophobicContact CD1-CG1 4.48Å; L604-V667 HydrophobicContact CD2-CG1 4.32Å; V617-V667 HydrophobicContact CG2-CG2 4.35Å; W644-V667 HydrophobicContact CH2-CG1 4.37Å; V667-L681 HydrophobicContact CB-CB 4.26Å; V667-L681 HydrophobicContact CG1-CB 4.25Å; V667-L681 HydrophobicContact CG1-CD1 4.2Å; V667-L681 PolarHBondContact O-N 3.18Å; V667-G682 PolarHBondContact N-O 2.94Å; V667-L702 HydrophobicContact CB-CD1 4.44Å; V667-L702 HydrophobicContact CG2-CD1 4.26Å; V667-L702 HydrophobicContact CG2-CD2 3.69Å
668	W	95.3	Very high	87.9	Confident	59 Å²	59	64 Å²	64	22%	0.223	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	142.1	-171	-64.4	76.7	0	0	0	111.3	P615 Y616 K618 T666 S678 E679 F680	P615-W668 CarbonylContact C-O 3.59Å; P615-W668 VanDerWaalsContact CA-O 3.26Å; P615-W668 WeakPolarHBondContact CA-O 3.43Å; Y616-W668 HydrophobicContact CD1-CB 4.06Å; Y616-W668 VanDerWaalsContact CD1-O 3.28Å; Y616-W668 WeakPolarHBondContact CD1-O 3.47Å; Y616-W668 HydrophobicContact CD2-CB 4.16Å; Y616-W668 HydrophobicContact CE1-CB 3.57Å; Y616-W668 HydrophobicContact CE2-CB 3.7Å; Y616-W668 HydrophobicContact CE2-CG 4.07Å; Y616-W668 HydrophobicContact CG-CB 4.36Å; Y616-W668 PolarHBondContact N-O 2.97Å; Y616-W668 PolarHBondContact O-N 3.15Å; K618-W668 HydrophobicContact CD-CD2 4.16Å; K618-W668 HydrophobicContact CD-CG 4.06Å; K618-W668 HydrophobicContact CD-CZ2 4.38Å; K618-W668 VanDerWaalsContact NZ-CE2 3.34Å; T666-W668 VanDerWaalsContact CB-NE1 3.31Å; T666-W668 PolarHBondContact OG1-NE1 3.01Å; W668-S678 WeakPolarHBondContact CZ3-O 3.33Å; W668-E679 CarbonylContact C-O 3.47Å; W668-E679 WeakPolarHBondContact CA-O 3.4Å; W668-F680 HydrophobicContact CD2-CD2 4.44Å; W668-F680 HydrophobicContact CE3-CB 4.18Å; W668-F680 HydrophobicContact CH2-CB 4.38Å; W668-F680 HydrophobicContact CH2-CD2 4.41Å; W668-F680 HydrophobicContact CZ2-CD2 4.02Å; W668-F680 HydrophobicContact CZ3-CB 4.09Å
669	D	94.2	Very high	87.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.7	170.3	-178.8	14.4	0	0	0	110.6	R607 R613 N614 P671 S678 E679 L681	R607-D669 IonicContact CZ-OD2 3.84Å; R607-D669 IonicContact NE-OD2 3.78Å; R607-D669 PolarHBondContact NE-OD2 3.23Å; R607-D669 VanDerWaalsContact NH2-CG 3.33Å; R607-D669 IonicContact NH2-OD1 2.68Å; R607-D669 IonicContact NH2-OD2 3.95Å; R607-D669 PolarHBondContact NH2-OD2 2.89Å; R613-D669 VanDerWaalsContact CD-CG 3.49Å; R613-D669 WeakPolarHBondContact CD-OD2 3.29Å; R613-D669 IonicContact CZ-OD2 3.41Å; R613-D669 IonicContact NE-OD2 2.73Å; R613-D669 IonicContact NH1-OD2 3.2Å; R613-D669 PolarHBondContact NH1-OD2 2.81Å; N614-D669 PolarHBondContact N-OD1 3.37Å; D669-P671 WeakPolarHBondContact O-CD 3.3Å; D669-S678 WeakPolarHBondContact O-CA 3.03Å; D669-E679 HydrophobicContact CB-CB 4.29Å; D669-E679 PolarHBondContact N-O 2.79Å; D669-E679 PolarHBondContact O-N 2.95Å; D669-L681 HydrophobicContact CB-CD1 4.11Å; D669-L681 HydrophobicContact CB-CD2 4.1Å; D669-L681 HydrophobicContact CB-CG 4.19Å
670	Q	92.7	Very high	88	Confident	73 Å²	73	61.8 Å²	61.8	34%	0.341	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-84.2	120.4	173.3	-169.1	168.4	-20.2	0	0	110.8	N614 Y616 T635	N614-Q670 HydrophobicContact CB-CB 4.4Å; N614-Q670 WeakPolarHBondContact CB-O 3.3Å; N614-Q670 PolarHBondContact ND2-O 2.82Å; N614-Q670 PolarHBondContact O-N 2.79Å; Y616-Q670 HydrophobicContact CD1-CB 3.84Å; Y616-Q670 HydrophobicContact CE1-CB 3.76Å; T635-Q670 HydrophobicContact CG2-CB 3.71Å; T635-Q670 PolarHBondContact OG1-OE1 3.34Å
671	P	84.3	Confident	88.1	Confident	17 Å²	17	54.2 Å²	54.2	11%	0.11	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-60.8	166	174.3	23.8	-34.8	0	0	0	113.7	D669 E676 E677	D669-P671 WeakPolarHBondContact O-CD 3.3Å; P671-E676 HydrophobicContact CB-CB 3.36Å; P671-E676 HydrophobicContact CB-CG 4.27Å; P671-E676 WeakPolarHBondContact CB-OE2 3.33Å; P671-E676 HydrophobicContact CG-CB 3.62Å; P671-E676 VanDerWaalsContact CG-O 3.24Å; P671-E676 WeakPolarHBondContact CG-O 3.44Å; P671-E677 WeakPolarHBondContact CD-O 3.49Å; P671-E677 WeakPolarHBondContact CG-O 3.44Å
672	R	76.1	Confident	88.2	Confident	118 Å²	118	50.7 Å²	50.7	45%	0.445	24%	0.244	S	C	.	.	S	Bend	trans	-92.9	-25.8	179.8	-60.1	179.3	-170.9	168	4.4	112.1	P612	P612-R672 VanDerWaalsContact N-NH2 3.14Å; P612-R672 PolarHBondContact O-NH2 3.12Å
673	V	79.5	Confident	88.2	Confident	72 Å²	72	50 Å²	50	44%	0.436	24%	0.241	S	C	.	.	S	Bend	trans	-88.5	138.1	170	-170.2	0	0	0	0	107.5	D675 E676	V673-D675 HydrophobicContact CG1-CB 4.36Å; V673-D675 PolarHBondContact O-N 3.07Å; V673-E676 HydrophobicContact CB-CB 4.34Å; V673-E676 HydrophobicContact CB-CG 3.87Å; V673-E676 HydrophobicContact CG2-CG 4.36Å; V673-E676 PolarHBondContact O-N 3.34Å
674	Q	68.2	Low	88.2	Confident	121 Å²	121	50.2 Å²	50.2	57%	0.565	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-15.9	-177	-175.2	164.1	1.5	0	0	113.1
675	D	74.6	Confident	88.1	Confident	121 Å²	121	51.8 Å²	51.8	65%	0.647	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-5.1	179.3	-46.4	-84.1	0	0	0	113.4	V673 Q1125	V673-D675 HydrophobicContact CG1-CB 4.36Å; V673-D675 PolarHBondContact O-N 3.07Å; D675-Q1125 PolarHBondContact OD1-NE2 2.97Å; D675-Q1125 PolarHBondContact OD2-NE2 2.89Å
676	E	77.7	Confident	88	Confident	79 Å²	79	52.2 Å²	52.2	37%	0.369	25%	0.252	S	S	.	.	S	Bend	trans	-81.5	147.4	169.3	-77.2	168.4	172.3	0	0	109.6	P671 V673	P671-E676 HydrophobicContact CB-CB 3.36Å; P671-E676 HydrophobicContact CB-CG 4.27Å; P671-E676 WeakPolarHBondContact CB-OE2 3.33Å; P671-E676 HydrophobicContact CG-CB 3.62Å; P671-E676 VanDerWaalsContact CG-O 3.24Å; P671-E676 WeakPolarHBondContact CG-O 3.44Å; V673-E676 HydrophobicContact CB-CB 4.34Å; V673-E676 HydrophobicContact CB-CG 3.87Å; V673-E676 HydrophobicContact CG2-CG 4.36Å; V673-E676 PolarHBondContact O-N 3.34Å
677	E	83.1	Confident	87.9	Confident	182 Å²	182	56.1 Å²	56.1	85%	0.85	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-82.9	158.7	174.9	-61.5	-168	155.6	0	0	112	P671 E679	P671-E677 WeakPolarHBondContact CD-O 3.49Å; P671-E677 WeakPolarHBondContact CG-O 3.44Å; E677-E679 PolarHBondContact O-N 2.88Å
678	S	90.5	Very high	87.8	Confident	39 Å²	39	56.1 Å²	56.1	27%	0.273	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-74.3	123.6	175.5	-61.9	0	0	0	0	110.7	Y616 W668 D669	Y616-S678 WeakPolarHBondContact OH-CB 3.45Å; Y616-S678 PolarHBondContact OH-OG 2.94Å; W668-S678 WeakPolarHBondContact CZ3-O 3.33Å; D669-S678 WeakPolarHBondContact O-CA 3.03Å
679	E	90.4	Very high	87.6	Confident	83 Å²	83	57.3 Å²	57.3	39%	0.388	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	133.8	176	-164.8	-174.4	138.1	0	0	109.4	R613 W668 D669 E677	R613-E679 IonicContact CZ-OE1 3.81Å; R613-E679 VanDerWaalsContact CZ-OE1 3.26Å; R613-E679 IonicContact CZ-OE2 2.9Å; R613-E679 IonicContact NH1-OE1 2.68Å; R613-E679 PolarHBondContact NH1-OE1 3.49Å; R613-E679 IonicContact NH1-OE2 2.84Å; R613-E679 PolarHBondContact NH1-OE2 3.31Å; R613-E679 IonicContact NH2-OE1 2.76Å; R613-E679 PolarHBondContact NH2-OE1 2.99Å; R613-E679 IonicContact NH2-OE2 3.74Å; W668-E679 CarbonylContact C-O 3.47Å; W668-E679 WeakPolarHBondContact CA-O 3.4Å; D669-E679 HydrophobicContact CB-CB 4.29Å; D669-E679 PolarHBondContact N-O 2.79Å; D669-E679 PolarHBondContact O-N 2.95Å; E677-E679 PolarHBondContact O-N 2.88Å
680	F	92.4	Very high	87.5	Confident	57 Å²	57	61.9 Å²	61.9	25%	0.25	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	135.8	175.7	172.7	-95.8	0	0	0	109.9	T666 W668 E683 H705	T666-F680 HydrophobicContact CG2-CE2 4.23Å; W668-F680 HydrophobicContact CD2-CD2 4.44Å; W668-F680 HydrophobicContact CE3-CB 4.18Å; W668-F680 HydrophobicContact CH2-CB 4.38Å; W668-F680 HydrophobicContact CH2-CD2 4.41Å; W668-F680 HydrophobicContact CZ2-CD2 4.02Å; W668-F680 HydrophobicContact CZ3-CB 4.09Å; F680-E683 HydrophobicContact CE2-CB 4.06Å; F680-E683 HydrophobicContact CZ-CB 3.81Å; F680-E683 HydrophobicContact CZ-CG 4.13Å; F680-H705 HydrophobicContact CE1-CB 3.8Å; F680-H705 HydrophobicContact CE2-CB 4.27Å; F680-H705 HydrophobicContact CZ-CB 3.61Å
681	L	91.6	Very high	87.3	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-12.9	-178.6	-59.2	-175.6	0	0	0	113.8	L577 L604 P605 P615 V667 D669	L577-L681 WeakPolarHBondContact CD1-O 3.38Å; L604-L681 HydrophobicContact CD1-CD1 4.22Å; P605-L681 HydrophobicContact CG-CD2 4.31Å; P615-L681 HydrophobicContact CB-CD1 4.29Å; V667-L681 HydrophobicContact CB-CB 4.26Å; V667-L681 HydrophobicContact CG1-CB 4.25Å; V667-L681 HydrophobicContact CG1-CD1 4.2Å; V667-L681 PolarHBondContact O-N 3.18Å; D669-L681 HydrophobicContact CB-CD1 4.11Å; D669-L681 HydrophobicContact CB-CD2 4.1Å; D669-L681 HydrophobicContact CB-CG 4.19Å
682	G	91.6	Very high	87.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.3	164.4	-179.9	0	0	0	0	0	113.6	V667 Q703	V667-G682 PolarHBondContact N-O 2.94Å; G682-Q703 CarbonylContact C-O 3.49Å; G682-Q703 VanDerWaalsContact CA-O 3.27Å; G682-Q703 WeakPolarHBondContact CA-O 3.23Å
683	E	93.9	Very high	88.4	Confident	10 Å²	10	58.9 Å²	58.9	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	164.6	-179.8	71.3	179.8	-167.4	0	0	114.3	I665 T666 F680 Q703 H705 D706	I665-E683 CarbonylContact O-C 3.28Å; I665-E683 WeakPolarHBondContact O-CA 3.03Å; T666-E683 HydrophobicContact CG2-CB 3.82Å; F680-E683 HydrophobicContact CE2-CB 4.06Å; F680-E683 HydrophobicContact CZ-CB 3.81Å; F680-E683 HydrophobicContact CZ-CG 4.13Å; E683-Q703 PolarHBondContact N-O 2.89Å; E683-Q703 PolarHBondContact O-N 2.96Å; E683-H705 WeakPolarHBondContact OE1-CA 3.49Å; E683-H705 IonicContact OE2-CD2 3.34Å; E683-H705 PolarHBondContact OE2-CD2 3.03Å; E683-H705 IonicContact OE2-CG 2.67Å; E683-D706 PolarHBondContact OE1-N 3.27Å
684	I	93.3	Very high	88.9	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	129	174.5	-64.1	149.5	0	0	0	106.8	L581 I665 I686 Y700 L702	L581-I684 HydrophobicContact CB-CD1 3.48Å; L581-I684 VanDerWaalsContact CB-CD1 3.48Å; L581-I684 HydrophobicContact CD2-CD1 3.72Å; L581-I684 HydrophobicContact CG-CD1 4.22Å; I665-I684 HydrophobicContact CB-CB 4.44Å; I665-I684 PolarHBondContact N-O 3.23Å; I665-I684 PolarHBondContact O-N 2.85Å; I684-I686 HydrophobicContact CG2-CD1 4.1Å; I684-I686 HydrophobicContact CG2-CG1 3.63Å; I684-Y700 HydrophobicContact CG2-CD1 3.88Å; I684-Y700 HydrophobicContact CG2-CG 3.92Å; I684-L702 HydrophobicContact CD1-CD2 3.73Å; I684-L702 HydrophobicContact CG1-CD2 4.04Å
685	L	93.7	Very high	90.1	Very high	42 Å²	42	56.2 Å²	56.2	22%	0.22	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.1	168.2	-71.4	167.7	0	0	0	108.2	L622 M662 E664 S709	L622-L685 HydrophobicContact CD1-CD2 3.98Å; M662-L685 HydrophobicContact CE-CB 3.99Å; E664-L685 HydrophobicContact CB-CD2 3.91Å; E664-L685 HydrophobicContact CG-CD2 4.07Å; L685-S709 VanDerWaalsContact CD1-OG 3.29Å; L685-S709 WeakPolarHBondContact CD1-OG 3.29Å
686	I	93.9	Very high	91	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	111.6	179.3	-45.7	-179.7	0	0	0	109	L585 M662 L663 I665 I684 A691 Y700	L585-I686 HydrophobicContact CD1-CD1 4.08Å; L585-I686 HydrophobicContact CD1-CG2 4.21Å; M662-I686 CarbonylContact C-O 3.36Å; M662-I686 VanDerWaalsContact CA-O 3.27Å; M662-I686 WeakPolarHBondContact CA-O 3.3Å; L663-I686 HydrophobicContact CB-CB 4.35Å; L663-I686 PolarHBondContact N-O 3.19Å; L663-I686 PolarHBondContact O-N 2.57Å; I665-I686 HydrophobicContact CD1-CD1 3.85Å; I684-I686 HydrophobicContact CG2-CD1 4.1Å; I684-I686 HydrophobicContact CG2-CG1 3.63Å; I686-A691 HydrophobicContact CG2-CB 3.86Å; I686-Y700 HydrophobicContact CD1-CD1 4.19Å; I686-Y700 HydrophobicContact CD1-CD2 4.33Å; I686-Y700 HydrophobicContact CD1-CE1 3.8Å; I686-Y700 HydrophobicContact CD1-CE2 3.96Å; I686-Y700 HydrophobicContact CD1-CG 4.45Å; I686-Y700 HydrophobicContact CG1-CD1 4.28Å; I686-Y700 HydrophobicContact CG1-CE1 4Å; I686-Y700 HydrophobicContact CG2-CE1 4.35Å
687	E	93.5	Very high	91.8	Very high	89 Å²	89	54.7 Å²	54.7	42%	0.416	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	130.8	170.3	-68.2	174.1	170.6	0	0	110.6	M662 T690 A691	M662-E687 HydrophobicContact CE-CG 3.79Å; M662-E687 HydrophobicContact CG-CG 4.36Å; E687-T690 VanDerWaalsContact CB-OG1 3.31Å; E687-T690 WeakPolarHBondContact CB-OG1 3.37Å; E687-T690 PolarHBondContact OE2-OG1 2.89Å; E687-A691 VanDerWaalsContact O-CB 3.28Å; E687-A691 WeakPolarHBondContact O-CB 3.39Å; E687-A691 PolarHBondContact O-N 3.02Å
688	L	93.6	Very high	92.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-21.5	-175.3	-60.3	174.4	0	0	0	113.2	L594 F621 F658 R661 L663	L594-L688 HydrophobicContact CD2-CD1 4.34Å; L594-L688 HydrophobicContact CD2-CD2 3.68Å; F621-L688 HydrophobicContact CD2-CD1 4.37Å; F621-L688 HydrophobicContact CE2-CD1 3.39Å; F621-L688 HydrophobicContact CZ-CD1 3.8Å; F658-L688 HydrophobicContact CB-CB 3.79Å; F658-L688 HydrophobicContact CD1-CB 4.45Å; F658-L688 HydrophobicContact CD2-CB 3.93Å; F658-L688 WeakPolarHBondContact CD2-O 3.37Å; F658-L688 HydrophobicContact CG-CB 3.8Å; R661-L688 HydrophobicContact CB-CD1 3.75Å; R661-L688 WeakPolarHBondContact O-CG 3.44Å; R661-L688 PolarHBondContact O-N 3.38Å; L663-L688 HydrophobicContact CB-CD2 4.24Å
689	E	91.5	Very high	92.6	Very high	84 Å²	84	51.8 Å²	51.8	39%	0.393	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-33.9	175	-176.7	153.1	-150.4	0	0	112.4	F658 R659	F658-E689 PolarHBondContact O-N 3.41Å; R659-E689 VanDerWaalsContact CB-OE2 3.32Å; R659-E689 WeakPolarHBondContact CB-OE2 3.5Å; R659-E689 VanDerWaalsContact CG-OE2 3.25Å; R659-E689 WeakPolarHBondContact CG-OE2 3.39Å; R659-E689 IonicContact CZ-OE1 2.61Å; R659-E689 VanDerWaalsContact NE-CD 3.32Å; R659-E689 IonicContact NE-OE1 3.38Å; R659-E689 PolarHBondContact NE-OE1 2.76Å; R659-E689 IonicContact NE-OE2 2.69Å; R659-E689 PolarHBondContact NE-OE2 2.96Å; R659-E689 VanDerWaalsContact NE-OE2 3.08Å; R659-E689 IonicContact NH2-OE1 2.7Å; R659-E689 PolarHBondContact NH2-OE1 3.41Å
690	T	90.6	Very high	92.8	Very high	97 Å²	97	50.1 Å²	50.1	60%	0.595	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-9.9	-178.2	57.7	0	0	0	0	114.2	E687	E687-T690 VanDerWaalsContact CB-OG1 3.31Å; E687-T690 WeakPolarHBondContact CB-OG1 3.37Å; E687-T690 PolarHBondContact OE2-OG1 2.89Å
691	A	90.1	Very high	92.8	Very high	16 Å²	16	53.4 Å²	53.4	13%	0.132	27%	0.265	C	S	.	.			trans	-56.3	140.7	176.7	0	0	0	0	0	113.7	L585 I686 E687 L693	L585-A691 HydrophobicContact CD1-CB 4.35Å; I686-A691 HydrophobicContact CG2-CB 3.86Å; E687-A691 VanDerWaalsContact O-CB 3.28Å; E687-A691 WeakPolarHBondContact O-CB 3.39Å; E687-A691 PolarHBondContact O-N 3.02Å; A691-L693 HydrophobicContact CB-CD2 4Å; A691-L693 HydrophobicContact CB-CG 4.09Å
692	L	90.1	Very high	92.9	Very high	88 Å²	88	53.2 Å²	53.2	46%	0.461	26%	0.264	S	S	.	.			trans	-75.9	123.1	163.5	-61.2	174.5	0	0	0	108.3	H698	L692-H698 VanDerWaalsContact CD1-NE2 3.27Å; L692-H698 WeakPolarHBondContact CD1-NE2 3.37Å
693	L	92.1	Very high	92.7	Very high	40 Å²	40	57.5 Å²	57.5	21%	0.209	28%	0.284	C	S	.	.			trans	-128.6	35.7	-170.6	-61.9	175.2	0	0	0	110.8	L585 L594 F658 A691	L585-L693 HydrophobicContact CB-CD2 3.72Å; L585-L693 HydrophobicContact CD1-CD2 4.35Å; L585-L693 CarbonylContact O-C 3.59Å; L585-L693 WeakPolarHBondContact O-CA 3.26Å; L594-L693 HydrophobicContact CD1-CD2 3.96Å; F658-L693 HydrophobicContact CD2-CD1 4.2Å; F658-L693 HydrophobicContact CE2-CD1 3.52Å; F658-L693 HydrophobicContact CZ-CD1 4.5Å; A691-L693 HydrophobicContact CB-CD2 4Å; A691-L693 HydrophobicContact CB-CG 4.09Å
694	D	90.6	Very high	92	Very high	83 Å²	83	60 Å²	60	44%	0.444	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-0.4	-172.1	46.9	18.6	0	0	0	113.8	E696 H698	D694-E696 VanDerWaalsContact C-N 3.31Å; D694-E696 PolarHBondContact OD1-N 3.48Å; D694-H698 IonicContact OD1-CE1 3.37Å; D694-H698 PolarHBondContact OD1-CE1 2.96Å; D694-H698 IonicContact OD1-ND1 3.22Å; D694-H698 IonicContact OD2-CE1 2.67Å; D694-H698 PolarHBondContact OD2-CE1 3.05Å; D694-H698 VanDerWaalsContact OD2-CE1 3.3Å; D694-H698 IonicContact OD2-NE2 4Å
695	D	93.1	Very high	90.9	Very high	54 Å²	54	64.1 Å²	64.1	29%	0.289	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.8	26.5	-166.9	-158	45.6	0	0	0	113.8	K584 L585 W586	K584-D695 WeakPolarHBondContact CD-O 3.38Å; K584-D695 WeakPolarHBondContact CE-O 3.46Å; K584-D695 WeakPolarHBondContact CE-OD1 3.24Å; K584-D695 VanDerWaalsContact CE-OD2 3.27Å; K584-D695 WeakPolarHBondContact CE-OD2 3.4Å; K584-D695 WeakPolarHBondContact CG-O 3.42Å; K584-D695 PolarHBondContact NZ-O 3.44Å; K584-D695 IonicContact NZ-OD1 3.39Å; K584-D695 PolarHBondContact NZ-OD1 3.47Å; K584-D695 IonicContact NZ-OD2 3.3Å; K584-D695 PolarHBondContact NZ-OD2 3.13Å; L585-D695 WeakPolarHBondContact O-CA 3.35Å; L585-D695 PolarHBondContact O-N 3.49Å; W586-D695 HydrophobicContact CB-CB 3.93Å; W586-D695 HydrophobicContact CG-CB 4.27Å
696	E	93.6	Very high	89.1	Confident	111 Å²	111	65.8 Å²	65.8	52%	0.519	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	153.5	173.7	-72	-58.4	148.5	0	0	113.8	K584 D694 H698	K584-E696 WeakPolarHBondContact CA-O 3.18Å; D694-E696 VanDerWaalsContact C-N 3.31Å; D694-E696 PolarHBondContact OD1-N 3.48Å; E696-H698 PolarHBondContact O-N 2.9Å; E696-H698 PolarHBondContact O-ND1 3.27Å
697	P	94.8	Very high	86.9	Confident	57 Å²	57	72 Å²	72	37%	0.37	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	100.9	-171.7	34.1	-34	0	0	0	112.8	K584 L599	K584-P697 HydrophobicContact CB-CB 4.31Å; L599-P697 HydrophobicContact CD1-CB 3.57Å
698	H	94.6	Very high	84.5	Confident	49 Å²	49	70.7 Å²	70.7	23%	0.227	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.9	-176.8	-73.5	86.7	0	0	0	112.6	S582 V583 L692 D694 E696 Y700	S582-H698 CarbonylContact C-O 3.57Å; S582-H698 WeakPolarHBondContact CA-O 3.44Å; V583-H698 PolarHBondContact N-O 2.91Å; V583-H698 PolarHBondContact O-N 2.74Å; L692-H698 VanDerWaalsContact CD1-NE2 3.27Å; L692-H698 WeakPolarHBondContact CD1-NE2 3.37Å; D694-H698 IonicContact OD1-CE1 3.37Å; D694-H698 PolarHBondContact OD1-CE1 2.96Å; D694-H698 IonicContact OD1-ND1 3.22Å; D694-H698 IonicContact OD2-CE1 2.67Å; D694-H698 PolarHBondContact OD2-CE1 3.05Å; D694-H698 VanDerWaalsContact OD2-CE1 3.3Å; D694-H698 IonicContact OD2-NE2 4Å; E696-H698 PolarHBondContact O-N 2.9Å; E696-H698 PolarHBondContact O-ND1 3.27Å; H698-Y700 HydrophobicContact CB-CD2 4.39Å; H698-Y700 HydrophobicContact CB-CE2 3.57Å; H698-Y700 WeakPolarHBondContact O-CD2 3.35Å
699	W	95	Very high	82.2	Confident	112 Å²	112	73 Å²	73	42%	0.424	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	119.9	177.8	-73.2	101.6	0	0	0	111.4	Q580 Q600 T602	Q580-W699 HydrophobicContact CB-CE3 3.8Å; Q580-W699 HydrophobicContact CB-CZ3 4.2Å; Q600-W699 HydrophobicContact CG-CH2 3.9Å; Q600-W699 VanDerWaalsContact NE2-CH2 3.29Å; Q600-W699 VanDerWaalsContact NE2-CZ2 3.26Å; T602-W699 HydrophobicContact CG2-CH2 3.74Å; T602-W699 HydrophobicContact CG2-CZ3 4.15Å; T602-W699 WeakPolarHBondContact OG1-CZ3 3.48Å
700	Y	94.5	Very high	80	Confident	48 Å²	48	72.7 Å²	72.7	19%	0.188	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.6	177.3	-62.3	-93.1	0	0	0	109.4	Q580 L581 V583 I684 I686 H698	Q580-Y700 CarbonylContact C-O 3.6Å; Q580-Y700 WeakPolarHBondContact CA-O 3.41Å; L581-Y700 PolarHBondContact N-O 3.01Å; L581-Y700 PolarHBondContact O-N 3.06Å; V583-Y700 HydrophobicContact CB-CD2 4.12Å; V583-Y700 HydrophobicContact CB-CE2 4.05Å; V583-Y700 HydrophobicContact CG2-CD2 4.24Å; I684-Y700 HydrophobicContact CG2-CD1 3.88Å; I684-Y700 HydrophobicContact CG2-CG 3.92Å; I686-Y700 HydrophobicContact CD1-CD1 4.19Å; I686-Y700 HydrophobicContact CD1-CD2 4.33Å; I686-Y700 HydrophobicContact CD1-CE1 3.8Å; I686-Y700 HydrophobicContact CD1-CE2 3.96Å; I686-Y700 HydrophobicContact CD1-CG 4.45Å; I686-Y700 HydrophobicContact CG1-CD1 4.28Å; I686-Y700 HydrophobicContact CG1-CE1 4Å; I686-Y700 HydrophobicContact CG2-CE1 4.35Å; H698-Y700 HydrophobicContact CB-CD2 4.39Å; H698-Y700 HydrophobicContact CB-CE2 3.57Å; H698-Y700 WeakPolarHBondContact O-CD2 3.35Å
701	K	93.6	Very high	77.5	Confident	126 Å²	126	71.7 Å²	71.7	55%	0.548	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	140.9	177.2	-61.7	-177.5	-179.9	179.1	0	110.3	V576 Q580	V576-K701 HydrophobicContact CG1-CB 4.05Å; V576-K701 HydrophobicContact CG1-CD 4.14Å; Q580-K701 HydrophobicContact CG-CG 4.27Å
702	L	92.6	Very high	75	Confident	0 Å²	0	78 Å²	78	0%	0	40%	0.401	C	S	.	.			trans	-73.2	136.6	176.9	-64.9	-173.7	0	0	0	111.3	L577 G579 L581 L604 V667 I684	L577-L702 HydrophobicContact CB-CB 4.23Å; L577-L702 PolarHBondContact N-O 2.88Å; G579-L702 PolarHBondContact O-N 2.9Å; L581-L702 HydrophobicContact CB-CD2 4.47Å; L604-L702 HydrophobicContact CD2-CD1 3.56Å; V667-L702 HydrophobicContact CB-CD1 4.44Å; V667-L702 HydrophobicContact CG2-CD1 4.26Å; V667-L702 HydrophobicContact CG2-CD2 3.69Å; I684-L702 HydrophobicContact CD1-CD2 3.73Å; I684-L702 HydrophobicContact CG1-CD2 4.04Å
703	Q	88	Confident	72.5	Confident	89 Å²	89	79.6 Å²	79.6	42%	0.416	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-115.1	161.2	178.6	-55.5	-170.9	48	0	0	110.5	L577 G682 E683	L577-Q703 WeakPolarHBondContact CD1-O 3.24Å; G682-Q703 CarbonylContact C-O 3.49Å; G682-Q703 VanDerWaalsContact CA-O 3.27Å; G682-Q703 WeakPolarHBondContact CA-O 3.23Å; E683-Q703 PolarHBondContact N-O 2.89Å; E683-Q703 PolarHBondContact O-N 2.96Å
704	T	79.3	Confident	69.9	Low	64 Å²	64	84.6 Å²	84.6	39%	0.393	44%	0.438	S	S	.	.			trans	-70.2	148.5	169.8	28.5	0	0	0	0	110.1	Q575 L577 D706	Q575-T704 PolarHBondContact O-OG1 3.08Å; L577-T704 HydrophobicContact CD1-CG2 4.07Å; L577-T704 HydrophobicContact CD2-CG2 3.77Å; L577-T704 HydrophobicContact CG-CG2 3.91Å; T704-D706 PolarHBondContact O-N 2.95Å; T704-D706 VanDerWaalsContact O-N 3.16Å
705	H	69.5	Low	67.2	Low	89 Å²	89	86.2 Å²	86.2	41%	0.412	45%	0.453	S	S	.	.			trans	-73.1	104.8	-178	179.1	-84	0	0	0	111.1	F680 E683 E707	F680-H705 HydrophobicContact CE1-CB 3.8Å; F680-H705 HydrophobicContact CE2-CB 4.27Å; F680-H705 HydrophobicContact CZ-CB 3.61Å; E683-H705 WeakPolarHBondContact OE1-CA 3.49Å; E683-H705 IonicContact OE2-CD2 3.34Å; E683-H705 PolarHBondContact OE2-CD2 3.03Å; E683-H705 IonicContact OE2-CG 2.67Å; H705-E707 VanDerWaalsContact CE1-CG 3.43Å; H705-E707 WeakPolarHBondContact CE1-CG 3.24Å; H705-E707 IonicContact CE1-OE1 3.26Å
706	D	56.8	Low	64.2	Low	77 Å²	77	87.7 Å²	87.7	41%	0.412	47%	0.468	S	S	.	.			trans	-109.7	103.5	-178.6	-178.2	-0.2	0	0	0	110.4	E683 T704 S708 S709	E683-D706 PolarHBondContact OE1-N 3.27Å; T704-D706 PolarHBondContact O-N 2.95Å; T704-D706 VanDerWaalsContact O-N 3.16Å; D706-S708 PolarHBondContact O-N 3.37Å; D706-S708 VanDerWaalsContact O-N 3.1Å; D706-S708 WeakPolarHBondContact OD1-CA 3.04Å; D706-S708 WeakPolarHBondContact OD1-CB 3.17Å; D706-S708 PolarHBondContact OD1-N 2.83Å; D706-S708 PolarHBondContact OD1-OG 2.84Å; D706-S708 PolarHBondContact OD2-OG 2.93Å; D706-S709 WeakPolarHBondContact O-CB 3.31Å; D706-S709 PolarHBondContact O-N 2.87Å; D706-S709 PolarHBondContact O-OG 2.81Å
707	E	48.2	Very low	62.1	Low	138 Å²	138	87.3 Å²	87.3	65%	0.645	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.1	177	-66.6	-158.4	128.1	0	0	114	H705	H705-E707 VanDerWaalsContact CE1-CG 3.43Å; H705-E707 WeakPolarHBondContact CE1-CG 3.24Å; H705-E707 IonicContact CE1-OE1 3.26Å
708	S	43.4	Very low	59.7	Low	63 Å²	63	93.3 Å²	93.3	44%	0.441	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-8.6	173.9	76.5	0	0	0	0	114.3	D706 L710	D706-S708 PolarHBondContact O-N 3.37Å; D706-S708 VanDerWaalsContact O-N 3.1Å; D706-S708 WeakPolarHBondContact OD1-CA 3.04Å; D706-S708 WeakPolarHBondContact OD1-CB 3.17Å; D706-S708 PolarHBondContact OD1-N 2.83Å; D706-S708 PolarHBondContact OD1-OG 2.84Å; D706-S708 PolarHBondContact OD2-OG 2.93Å; S708-L710 PolarHBondContact O-N 3.47Å
709	S	44	Very low	57	Low	48 Å²	48	98.6 Å²	98.6	34%	0.336	52%	0.522	S	S	.	.			trans	-73.3	-3.6	-178.4	68.2	0	0	0	0	115.2	L685 D706 P711	L685-S709 VanDerWaalsContact CD1-OG 3.29Å; L685-S709 WeakPolarHBondContact CD1-OG 3.29Å; D706-S709 WeakPolarHBondContact O-CB 3.31Å; D706-S709 PolarHBondContact O-N 2.87Å; D706-S709 PolarHBondContact O-OG 2.81Å; S709-P711 WeakPolarHBondContact O-CD 3.48Å
710	L	45	Very low	54.6	Low	77 Å²	77	98.5 Å²	98.5	40%	0.403	54%	0.536	S	S	.	.	S	Bend	trans	-69.7	116.3	171.7	-68.3	178	0	0	0	109.9	L622 S708 L712	L622-L710 HydrophobicContact CD1-CD2 3.82Å; S708-L710 PolarHBondContact O-N 3.47Å; L710-L712 PolarHBondContact O-N 2.75Å
711	P	38.3	Very low	51.9	Low	77 Å²	77	106.6 Å²	106.6	50%	0.5	57%	0.567	S	S	.	*			trans	-66.1	101.6	169	28.3	-32.8	0	0	0	108.5	M662 S709	M662-P711 HydrophobicContact CE-CG 4.23Å; M662-P711 HydrophobicContact SD-CG 3.93Å; S709-P711 WeakPolarHBondContact O-CD 3.48Å
712	L	37.4	Very low	49.2	Very low	149 Å²	149	112 Å²	112	78%	0.78	58%	0.584	S	S	*	*			trans	-54.4	130.9	161	-68.2	177.1	0	0	0	107.1	L710 Q714	L710-L712 PolarHBondContact O-N 2.75Å; L712-Q714 VanDerWaalsContact C-N 3.27Å; L712-Q714 PolarHBondContact O-N 3.18Å
713	P	37.3	Very low	46.4	Very low	121 Å²	121	119.3 Å²	119.3	79%	0.786	62%	0.617	S	S	*	*			trans	-66.3	91.1	177.3	26.3	-33.4	0	0	0	109.1	P715	P713-P715 VanDerWaalsContact O-CD 3.23Å; P713-P715 WeakPolarHBondContact O-CD 3.32Å; P713-P715 VanDerWaalsContact O-N 3.15Å
714	Q	39	Very low	43.9	Very low	144 Å²	144	122.4 Å²	122.4	67%	0.673	64%	0.635	S	S	*	*			trans	-55.5	113	174.9	-92.9	-98.6	-1	0	0	108.5	L712 S716	L712-Q714 VanDerWaalsContact C-N 3.27Å; L712-Q714 PolarHBondContact O-N 3.18Å; Q714-S716 PolarHBondContact O-N 3.05Å
715	P	33	Very low	41.9	Very low	117 Å²	117	127.8 Å²	127.8	76%	0.76	66%	0.656	S	S	*	*			trans	-68	101.9	170.1	28.7	-31.3	0	0	0	107	P713 P717	P713-P715 VanDerWaalsContact O-CD 3.23Å; P713-P715 WeakPolarHBondContact O-CD 3.32Å; P713-P715 VanDerWaalsContact O-N 3.15Å; P715-P717 WeakPolarHBondContact O-CD 3.48Å; P715-P717 VanDerWaalsContact O-N 3.14Å
716	S	31.2	Very low	40.2	Very low	86 Å²	86	126.4 Å²	126.4	60%	0.601	67%	0.665	S	S	*	*			trans	-47.3	118.9	-166.5	-55.4	0	0	0	0	112.1	Q714 F718	Q714-S716 PolarHBondContact O-N 3.05Å; S716-F718 PolarHBondContact O-N 3.2Å
717	P	48.1	Very low	39.2	Very low	103 Å²	103	132.1 Å²	132.1	67%	0.669	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-3.8	-176.6	-26.6	35.4	0	0	0	115.8	P715	P715-P717 WeakPolarHBondContact O-CD 3.48Å; P715-P717 VanDerWaalsContact O-N 3.14Å
718	F	44.1	Very low	38.5	Very low	183 Å²	183	130.8 Å²	130.8	80%	0.803	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	21.8	-168.6	-73.4	-83.5	0	0	0	114.7	S716 P720	S716-F718 PolarHBondContact O-N 3.2Å; F718-P720 WeakPolarHBondContact O-CD 3.43Å
719	M	39	Very low	37.8	Very low	159 Å²	159	130.9 Å²	130.9	78%	0.783	70%	0.696	S	S	*	*			trans	-95.1	106	166.7	-88.3	-72	111.1	0	0	110.8	R721	M719-R721 PolarHBondContact O-N 2.67Å
720	P	44.7	Very low	37.4	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	71%	0.705	S	S	*	*			trans	-71.5	124	-175.4	-17.7	32.6	0	0	0	112.1	F718 R722	F718-P720 WeakPolarHBondContact O-CD 3.43Å; P720-R722 PolarHBondContact O-N 2.97Å
721	R	36.7	Very low	37.1	Very low	219 Å²	219	132.4 Å²	132.4	83%	0.826	70%	0.703	S	S	*	*			trans	-61.8	103.8	167.3	-86.3	-174.3	174.2	153.8	-0.5	110.1	M719 H723	M719-R721 PolarHBondContact O-N 2.67Å; R721-H723 PolarHBondContact O-N 2.81Å
722	R	38	Very low	37.1	Very low	240 Å²	240	136.5 Å²	136.5	91%	0.906	71%	0.713	S	S	*	*			trans	-72.6	92.3	163.6	-71.3	-166.3	179.9	-162.6	1.3	109.8	P720	P720-R722 PolarHBondContact O-N 2.97Å
723	H	33.8	Very low	36.8	Very low	152 Å²	152	136.6 Å²	136.6	70%	0.704	71%	0.713	S	S	*	*			trans	-73.2	122.2	167.9	-87.8	-95.1	0	0	0	110.9	R721	R721-H723 PolarHBondContact O-N 2.81Å
724	I	35.8	Very low	36.5	Very low	154 Å²	154	139.8 Å²	139.8	79%	0.79	72%	0.717	S	S	*	*			trans	-146.4	111.7	164.7	-57.9	-179.5	0	0	0	103.2
725	H	37.1	Very low	36.3	Very low	178 Å²	178	144.8 Å²	144.8	82%	0.824	73%	0.73	S	S	*	*			cis	72	110.8	18.2	-158.6	78.1	0	0	0	114
726	G	33.7	Very low	36.2	Very low	59 Å²	59	144.1 Å²	144.1	61%	0.608	73%	0.728	S	S	*	*			cis	-101.3	-155.8	-5	0	0	0	0	0	114.2
727	E	34.5	Very low	36.1	Very low	198 Å²	198	147.8 Å²	147.8	93%	0.925	74%	0.736	S	S	*	*			cis	-143.5	179.5	6.3	-73.1	-168.8	88.7	0	0	113.6
728	S	34.9	Very low	35.2	Very low	110 Å²	110	153.8 Å²	153.8	77%	0.769	75%	0.745	S	S	*	*			trans	-66.3	164.3	175.7	-96.7	0	0	0	0	114.2
729	S	28.7	Very low	34.6	Very low	64 Å²	64	152.8 Å²	152.8	45%	0.448	75%	0.746	S	S	.	*			cis	-173.8	146.1	-6.1	158.4	0	0	0	0	111.5
730	S	35.2	Very low	34.2	Very low	75 Å²	75	149.6 Å²	149.6	52%	0.524	74%	0.739	S	S	.	*			trans	47.3	115.5	152.2	-55.3	0	0	0	0	119.9
731	K	39.5	Very low	33.4	Very low	83 Å²	83	151 Å²	151	36%	0.361	74%	0.741	S	S	.	*				-175.5	120	109	-99.8	157.9	-107.3	90.9	0	116.8	S1027 E1028 R1029	K731-S1027 PolarHBondContact NZ-OG 2.84Å; K731-E1028 WeakPolarHBondContact CD-O 3.34Å; K731-E1028 VanDerWaalsContact CE-O 3.29Å; K731-E1028 WeakPolarHBondContact CE-O 3.48Å; K731-R1029 HydrophobicContact CD-CB 3.64Å; K731-R1029 VanDerWaalsContact CE-CB 3.5Å
732	K	38.2	Very low	33.2	Very low	163 Å²	163	145.5 Å²	145.5	71%	0.709	74%	0.736	S	S	*	*			trans	55.5	99.9	130.9	-161.4	-175.8	-176.7	-171	0	119.8
733	L	30.9	Very low	32.9	Very low	151 Å²	151	139.1 Å²	139.1	79%	0.791	72%	0.72	S	S	*	*			trans	57	125.5	138.8	-51.6	173.5	0	0	0	117.6
734	Q	31.4	Very low	33	Very low	187 Å²	187	138 Å²	138	87%	0.874	72%	0.718	S	S	*	*			cis	-144	-179.2	21.4	-66	170.1	-112.5	0	0	111.5
735	R	33.9	Very low	32.8	Very low	250 Å²	250	135.1 Å²	135.1	94%	0.943	71%	0.712	S	S	*	*			trans	80	55.9	150.7	-154.5	179.7	-171.2	165.6	0.8	118.2
736	S	30.1	Very low	33	Very low	102 Å²	102	131.6 Å²	131.6	71%	0.713	70%	0.699	S	S	*	*			trans	-102.3	121	155.5	56.9	0	0	0	0	109
737	Q	30	Very low	33.4	Very low	163 Å²	163	135.3 Å²	135.3	76%	0.762	70%	0.696	S	S	*	*				98.1	127.5	78.5	-82.9	-178.9	-8.8	0	0	113.7
738	R	28.1	Very low	33.8	Very low	229 Å²	229	133.4 Å²	133.4	86%	0.864	69%	0.687	S	S	*	*			trans	45.2	96.6	143.4	-57.3	-179	-176.5	-179.5	1.2	119.3
739	I	32.7	Very low	34.3	Very low	163 Å²	163	134 Å²	134	84%	0.836	69%	0.686	S	S	*	*			trans	-138.3	110.7	141.6	-44	178.5	0	0	0	103.5
740	S	30.8	Very low	34.9	Very low	91 Å²	91	137.9 Å²	137.9	64%	0.636	70%	0.701	S	S	*	*				62.9	111.7	76.5	-91.2	0	0	0	0	114.9
741	D	27.8	Very low	35	Very low	140 Å²	140	141.6 Å²	141.6	75%	0.749	72%	0.715	S	S	*	*			trans	64.1	156.9	131.2	-52.8	-62.6	0	0	0	121.9
742	S	31.4	Very low	35	Very low	104 Å²	104	141 Å²	141	73%	0.727	73%	0.733	S	S	*	*			trans	66.1	88.3	157.5	-56.5	0	0	0	0	120.5
743	D	33	Very low	34.8	Very low	105 Å²	105	140.5 Å²	140.5	56%	0.561	74%	0.736	S	S	*	*				64	155.8	110.7	-78.5	-29	0	0	0	125.6	K179	K179-D743 IonicContact NZ-OD1 2.71Å; K179-D743 PolarHBondContact NZ-OD1 2.79Å; K179-D743 IonicContact NZ-OD2 3.25Å
744	I	35.2	Very low	35.1	Very low	128 Å²	128	136.2 Å²	136.2	66%	0.656	73%	0.729	S	S	*	*			trans	67	165.7	154.6	-139.3	149.6	0	0	0	121.5
745	S	32.4	Very low	35.3	Very low	95 Å²	95	134.2 Å²	134.2	66%	0.664	73%	0.729	S	S	*	*			trans	-114.7	156.2	-153	54.7	0	0	0	0	112.9
746	D	40.6	Very low	35.7	Very low	104 Å²	104	128.6 Å²	128.6	56%	0.556	72%	0.722	S	S	*	*			trans	-161.8	166.2	151.3	-141	-20.2	0	0	0	114.7
747	Y	41.3	Very low	36.6	Very low	137 Å²	137	129 Å²	129	54%	0.537	72%	0.722	S	S	.	*			trans	72.5	142.7	158.1	-64.1	-49.2	0	0	0	121.2
748	E	43.9	Very low	37.4	Very low	158 Å²	158	126.4 Å²	126.4	74%	0.738	72%	0.72	S	S	*	*			cis	-171.6	-163.2	-15.8	-153.2	172	-167.3	0	0	110.4
749	V	44.9	Very low	37.8	Very low	123 Å²	123	121.7 Å²	121.7	75%	0.745	72%	0.716	S	S	*	*			trans	87.4	136	159.9	-165.8	0	0	0	0	114.6
750	D	40.7	Very low	38	Very low	145 Å²	145	116.7 Å²	116.7	78%	0.775	71%	0.705	S	S	*	*			cis	-141.3	-167.2	25.1	-152.9	-94.9	0	0	0	114.5
751	D	39.2	Very low	38.2	Very low	152 Å²	152	122.2 Å²	122.2	81%	0.813	71%	0.713	S	S	*	*			trans	-102.2	173.6	-154.5	-83.1	-62.3	0	0	0	118.7
752	G	38.9	Very low	38.5	Very low	71 Å²	71	126.8 Å²	126.8	73%	0.732	72%	0.72	S	S	*	*			trans	-178.2	104.1	167.3	0	0	0	0	0	117.4
753	I	34.5	Very low	38.5	Very low	152 Å²	152	126.2 Å²	126.2	78%	0.779	72%	0.721	S	S	*	*			trans	-85.6	150.7	-173	-61.7	160.9	0	0	0	114.2	R1105	I753-R1105 PolarHBondContact O-NH2 2.91Å
754	G	36.5	Very low	38.6	Very low	62 Å²	62	127 Å²	127	64%	0.639	73%	0.734	S	S	*	*			trans	160.7	92.8	153.6	0	0	0	0	0	120.3
755	V	36.2	Very low	38.7	Very low	145 Å²	145	125.1 Å²	125.1	88%	0.879	74%	0.738	S	S	*	*			trans	44.8	155.2	139.3	-166.9	0	0	0	0	121.8
756	V	41.6	Very low	38.9	Very low	131 Å²	131	131.1 Å²	131.1	79%	0.794	75%	0.746	S	S	*	*			trans	-123.3	-166.5	-162.3	-134.4	0	0	0	0	114.2
757	P	48.9	Very low	38.8	Very low	110 Å²	110	132.7 Å²	132.7	71%	0.714	75%	0.751	S	S	*	*			trans	-107.2	-143	-143.5	40.2	-16.6	0	0	0	112.5
758	P	46.7	Very low	38.6	Very low	110 Å²	110	130.2 Å²	130.2	71%	0.714	75%	0.753	S	S	*	*				-148.2	-158.7	50.1	33	-5.1	0	0	0	116.2
759	V	37.5	Very low	38.4	Very low	130 Å²	130	132.1 Å²	132.1	79%	0.788	76%	0.759	S	S	*	*			trans	75.2	141	163.9	-162.7	0	0	0	0	117.9	Y761	V759-Y761 HydrophobicContact CG1-CD2 4.46Å
760	G	35.5	Very low	37.8	Very low	58 Å²	58	130.6 Å²	130.6	60%	0.598	76%	0.759	S	S	*	*			cis	160.7	161.9	-11.2	0	0	0	0	0	114.6
761	Y	35.7	Very low	37.8	Very low	207 Å²	207	130.1 Å²	130.1	81%	0.812	76%	0.762	S	S	*	*			trans	69.7	128.3	171.7	-58.7	-88.6	0	0	0	117.2	V759	V759-Y761 HydrophobicContact CG1-CD2 4.46Å
762	R	33.9	Very low	37.7	Very low	236 Å²	236	128.7 Å²	128.7	89%	0.891	76%	0.758	S	S	*	*				74.8	138.7	59.6	-74.3	-169.7	179.1	-160	2.6	113.1
763	A	32.4	Very low	37.7	Very low	91 Å²	91	133.5 Å²	133.5	75%	0.752	77%	0.767	S	S	*	*			cis	-152.5	150.8	0.4	0	0	0	0	0	110.8
764	S	33.6	Very low	37.6	Very low	121 Å²	121	132 Å²	132	85%	0.846	76%	0.764	S	S	*	*				74.9	118.8	93.7	-164.6	0	0	0	0	119.8
765	A	37	Very low	37.8	Very low	89 Å²	89	135.8 Å²	135.8	74%	0.736	78%	0.775	S	S	*	*			trans	-166.1	120.2	152.8	0	0	0	0	0	108.1
766	R	38.5	Very low	37.8	Very low	221 Å²	221	134.2 Å²	134.2	83%	0.834	77%	0.768	S	S	*	*				64.4	136	82.4	-78.9	-157.1	164.8	-179.9	-7	114.6
767	E	36.7	Very low	37.4	Very low	138 Å²	138	136.4 Å²	136.4	65%	0.645	77%	0.769	S	S	*	*			cis	-159.8	-167.6	-2.5	-131.2	-170.3	-109.2	0	0	109.1
768	S	37.8	Very low	37	Very low	85 Å²	85	140 Å²	140	59%	0.594	78%	0.777	S	S	*	*			cis	-158.9	-167.7	11.5	-160.3	0	0	0	0	111.3
769	K	39.7	Very low	36.3	Very low	198 Å²	198	142.6 Å²	142.6	86%	0.861	78%	0.779	S	S	*	*			trans	71.7	104.9	176	-54.3	-176.9	-177.9	-176.4	0	115.5
770	A	32.5	Very low	36.4	Very low	90 Å²	90	146.7 Å²	146.7	74%	0.744	78%	0.781	S	S	*	*			cis	95.8	93.6	9.4	0	0	0	0	0	118.3
771	T	40.8	Very low	36.1	Very low	136 Å²	136	149.7 Å²	149.7	83%	0.834	79%	0.787	S	S	*	*			trans	-159	96.2	148.8	43	0	0	0	0	105.7
772	T	36.6	Very low	36.1	Very low	121 Å²	121	145.9 Å²	145.9	74%	0.742	79%	0.786	S	S	*	*				64.8	98.5	70.2	-51	0	0	0	0	113.9
773	L	39.6	Very low	36	Very low	173 Å²	173	142.3 Å²	142.3	91%	0.906	78%	0.779	S	S	*	*				-153.5	152	124.4	-105.9	176.4	0	0	0	109.4
774	T	32.9	Very low	36.3	Very low	119 Å²	119	145.8 Å²	145.8	73%	0.73	78%	0.779	S	S	*	*			trans	-142.7	148.7	-164.2	-40.6	0	0	0	0	109.3
775	V	40.1	Very low	36.6	Very low	142 Å²	142	150.9 Å²	150.9	86%	0.861	78%	0.78	S	S	*	*			trans	-173.1	149.8	144.5	134.7	0	0	0	0	109.5
776	P	35.8	Very low	36.7	Very low	112 Å²	112	150.9 Å²	150.9	73%	0.727	78%	0.775	S	S	*	*			trans	-129.3	179.8	-149.1	42.8	-27.1	0	0	0	117.6
777	E	34.2	Very low	36.8	Very low	177 Å²	177	150.6 Å²	150.6	83%	0.827	77%	0.774	S	S	*	*			trans	-39.8	133.1	169.2	-172.7	179.8	137.5	0	0	118.6
778	Q	39.3	Very low	36.5	Very low	186 Å²	186	148.2 Å²	148.2	87%	0.869	77%	0.772	S	S	*	*			trans	-142.2	125.3	147.6	-73.1	-173.2	-24.8	0	0	106.1
779	Q	33.2	Very low	36.5	Very low	164 Å²	164	150.8 Å²	150.8	77%	0.766	78%	0.784	S	S	*	*			cis	85.8	133.8	40	-158.2	-170.5	22.8	0	0	113.8
780	R	37.9	Very low	36.2	Very low	217 Å²	217	145.2 Å²	145.2	82%	0.819	77%	0.77	S	S	*	*			trans	84.5	112.5	-175.5	-58.5	-173.5	172.2	-155.3	-4.8	113.9
781	T	29.9	Very low	36.6	Very low	120 Å²	120	145.2 Å²	145.2	74%	0.736	76%	0.762	S	S	*	*				57.5	117.5	64.2	73.4	0	0	0	0	111.6
782	T	35.3	Very low	36.2	Very low	127 Å²	127	146 Å²	146	78%	0.779	76%	0.756	S	S	*	*				-159.6	175.2	64.8	39.4	0	0	0	0	113.9
783	H	32.2	Very low	36.3	Very low	161 Å²	161	152.3 Å²	152.3	75%	0.745	77%	0.766	S	S	*	*			trans	-39.6	151.4	166.9	-52.8	-100.6	0	0	0	115.4
784	H	38.5	Very low	36.2	Very low	165 Å²	165	146.9 Å²	146.9	76%	0.764	75%	0.752	S	S	*	*				-173.2	131.7	105.6	-94.2	-48.1	0	0	0	114.7
785	R	40	Very low	36.2	Very low	228 Å²	228	146.1 Å²	146.1	86%	0.86	74%	0.744	S	S	*	*			trans	64.8	164.2	152.7	-64.6	178.3	178.1	-175.8	-0.3	115.5
786	S	38.5	Very low	36.1	Very low	89 Å²	89	145.6 Å²	145.6	62%	0.622	74%	0.736	S	S	*	*			cis	-174.8	155.7	-26.4	-89.5	0	0	0	0	105.4
787	R	41.8	Very low	36.1	Very low	215 Å²	215	148.2 Å²	148.2	81%	0.811	74%	0.739	S	S	*	*			cis	-159.3	157.5	-8.4	-114.1	167.1	-175.6	-116.3	1.5	108.2
788	S	30.6	Very low	36	Very low	87 Å²	87	142.1 Å²	142.1	61%	0.608	72%	0.723	S	S	*	*			trans	-16.3	155.6	141	59.2	0	0	0	0	116.7
789	V	37.3	Very low	35.7	Very low	140 Å²	140	143.2 Å²	143.2	85%	0.848	72%	0.719	S	S	*	*				-154.7	137.8	93.1	141.3	0	0	0	0	112.5
790	S	33.9	Very low	36	Very low	81 Å²	81	138.8 Å²	138.8	57%	0.566	71%	0.705	S	S	*	*			trans	-120.4	-171.9	163.9	-144.2	0	0	0	0	105.7
791	P	39.6	Very low	35.7	Very low	90 Å²	90	138.6 Å²	138.6	58%	0.584	70%	0.704	S	S	*	*			cis	-143.2	-160.3	-5.1	40.4	-18.1	0	0	0	114.1
792	H	32.4	Very low	35.7	Very low	151 Å²	151	136.9 Å²	136.9	70%	0.699	70%	0.697	S	S	*	*			trans	50.3	113.9	149.1	-54.9	-39.7	0	0	0	123.4
793	R	39.5	Very low	35.7	Very low	255 Å²	255	142.1 Å²	142.1	96%	0.962	70%	0.702	S	S	*	*				176.1	154	119.5	-92.5	-175.5	-168	-156	3.5	107
794	G	37.4	Very low	36.1	Very low	59 Å²	59	142.4 Å²	142.4	61%	0.608	71%	0.708	S	S	*	*			cis	-172.3	171.6	-5.8	0	0	0	0	0	108.2
795	D	33.9	Very low	36	Very low	103 Å²	103	140.2 Å²	140.2	55%	0.551	71%	0.709	S	S	*	*			trans	-75.9	163.9	-173.4	-74	-67.9	0	0	0	116.3	W407	W407-D795 VanDerWaalsContact CZ2-OD2 3.23Å; W407-D795 WeakPolarHBondContact CZ2-OD2 3.47Å; W407-D795 VanDerWaalsContact NE1-CG 3.33Å; W407-D795 PolarHBondContact NE1-OD1 2.92Å; W407-D795 PolarHBondContact NE1-OD2 3.11Å
796	D	36.6	Very low	35.5	Very low	131 Å²	131	136 Å²	136	70%	0.701	70%	0.703	S	S	*	*			trans	102.9	139.6	135.6	-145.8	10.3	0	0	0	119.9
797	Q	36.9	Very low	35.5	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	70%	0.703	S	S	*	*			trans	53.9	119.3	169.4	-38.8	-168.8	16.4	0	0	117.2
798	G	31.5	Very low	35.3	Very low	49 Å²	49	132.4 Å²	132.4	51%	0.505	70%	0.704	S	S	.	*			cis	94.3	102.2	8.6	0	0	0	0	0	113.4
799	R	33.8	Very low	35.4	Very low	208 Å²	208	134.1 Å²	134.1	79%	0.785	71%	0.706	S	S	*	*			trans	-171.8	132.2	144.9	-146.1	163.7	-161.9	-108.7	-0	113.9
800	P	38.2	Very low	35.1	Very low	71 Å²	71	133.9 Å²	133.9	46%	0.461	70%	0.695	S	S	.	*			trans	-98.1	155.7	177.3	37.3	-35.9	0	0	0	114.2	L402	L402-P800 HydrophobicContact CD1-CB 3.91Å; L402-P800 HydrophobicContact CD1-CG 3.96Å
801	R	31.4	Very low	35.1	Very low	213 Å²	213	139.5 Å²	139.5	80%	0.804	70%	0.704	S	S	*	*			trans	167.3	150.5	151.7	-97.6	160.2	-169.8	-154.6	1.7	108
802	S	30.5	Very low	34.7	Very low	84 Å²	84	139.6 Å²	139.6	59%	0.587	71%	0.707	S	S	*	*			cis	160.3	162.9	-9.4	57.1	0	0	0	0	105.8
803	R	34.3	Very low	35	Very low	237 Å²	237	139.2 Å²	139.2	89%	0.894	71%	0.709	S	S	*	*			trans	91.5	126.1	165.8	-56.7	170.2	-177.8	-113.4	-2.8	118.1
804	L	41	Very low	34.7	Very low	167 Å²	167	132.8 Å²	132.8	87%	0.874	69%	0.694	S	S	*	*			trans	-58.3	151.8	155.9	-53.3	159.8	0	0	0	110.2
805	P	36.7	Very low	34.7	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	70%	0.697	S	S	*	*				-136.1	143.9	91.8	13.3	9.7	0	0	0	113
806	N	29.4	Very low	35.2	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	71%	0.706	S	S	*	*				79	102.3	71	-162.8	46.8	0	0	0	115.3
807	V	38.1	Very low	35.5	Very low	102 Å²	102	139.8 Å²	139.8	62%	0.618	71%	0.706	S	S	*	*			trans	40.6	117.1	138.9	-179	0	0	0	0	118.3	L809	V807-L809 HydrophobicContact CG1-CB 3.81Å
808	P	39.1	Very low	35.7	Very low	127 Å²	127	136.4 Å²	136.4	83%	0.825	70%	0.699	S	S	*	*				-111.8	145.1	87.3	-10.8	29.8	0	0	0	112.9
809	L	31.5	Very low	35.9	Very low	124 Å²	124	139.9 Å²	139.9	65%	0.649	71%	0.71	S	S	*	*			cis	88.3	120.5	31.4	-170.2	76.2	0	0	0	113.6	V807	V807-L809 HydrophobicContact CG1-CB 3.81Å
810	Q	31.8	Very low	35.9	Very low	135 Å²	135	139.3 Å²	139.3	63%	0.631	71%	0.708	S	S	*	*			trans	68	160.7	165.2	-75.3	163.8	1.2	0	0	115.8
811	R	33.2	Very low	35.7	Very low	199 Å²	199	145.2 Å²	145.2	75%	0.751	72%	0.721	S	S	*	*			cis	-154.1	160.2	9	-141.8	156.5	-176.4	136.7	-10.5	112.4
812	S	31.7	Very low	35.7	Very low	91 Å²	91	139.8 Å²	139.8	64%	0.636	72%	0.716	S	S	*	*			trans	61.3	134.9	157.2	33.4	0	0	0	0	118
813	L	38.1	Very low	36	Very low	144 Å²	144	147.6 Å²	147.6	75%	0.754	73%	0.732	S	S	*	*				68.6	148.9	52.4	-59.2	167.2	0	0	0	111.5
814	D	34.3	Very low	35.8	Very low	120 Å²	120	141.5 Å²	141.5	64%	0.642	73%	0.726	S	S	*	*			cis	-123.7	152.5	18	-71.5	-81.3	0	0	0	112.1
815	E	37.2	Very low	35.7	Very low	142 Å²	142	138.5 Å²	138.5	66%	0.664	72%	0.717	S	S	*	*				47.7	143.4	94.5	-40.5	-164.6	142.7	0	0	114.2
816	I	43.1	Very low	35.4	Very low	147 Å²	147	138.3 Å²	138.3	75%	0.754	71%	0.714	S	S	*	*				-170	147.1	54.9	-73.9	179.5	0	0	0	105.8
817	H	43.6	Very low	35.6	Very low	150 Å²	150	141.5 Å²	141.5	69%	0.694	72%	0.715	S	S	*	*			cis	-152.9	166.5	-11.9	-128.4	-132.1	0	0	0	108.3
818	P	41.1	Very low	35.4	Very low	97 Å²	97	142.7 Å²	142.7	63%	0.63	71%	0.714	S	S	*	*			trans	-94.8	-155.1	-179	39.4	-36.5	0	0	0	113.2
819	T	35.6	Very low	35.2	Very low	122 Å²	122	143.5 Å²	143.5	75%	0.748	71%	0.706	S	S	*	*			trans	88.6	148	177.5	81.7	0	0	0	0	115
820	R	33.5	Very low	35.3	Very low	196 Å²	196	144 Å²	144	74%	0.74	71%	0.71	S	S	*	*			cis	-155.7	146.2	4.2	-137.6	165.6	-171.9	-136.8	9	112
821	R	35.6	Very low	35.3	Very low	195 Å²	195	141.4 Å²	141.4	74%	0.736	71%	0.711	S	S	*	*			trans	40.2	108.7	147.8	-68.6	169.5	-171.1	-142.8	-3.9	118.4
822	S	31.1	Very low	35.5	Very low	98 Å²	98	136.3 Å²	136.3	69%	0.685	71%	0.706	S	S	*	*				60.5	107.4	74.3	80.2	0	0	0	0	116.2
823	R	35.4	Very low	35.7	Very low	248 Å²	248	142.8 Å²	142.8	94%	0.936	72%	0.717	S	S	*	*				173.9	132.2	128.3	-98.2	166.8	-174.3	-124.8	-0.3	112.8
824	S	31.1	Very low	35.4	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	71%	0.714	S	S	*	*			trans	-78.1	-179.6	155.7	-12.4	0	0	0	0	110.1
825	P	39.3	Very low	35.3	Very low	104 Å²	104	142.3 Å²	142.3	68%	0.675	72%	0.722	S	S	*	*			cis	-135.8	-155.8	-11.1	34.2	-11.9	0	0	0	112.7
826	T	30.7	Very low	35.1	Very low	116 Å²	116	139.3 Å²	139.3	71%	0.712	72%	0.722	S	S	*	*			trans	80.9	132.1	143.6	37.2	0	0	0	0	123
827	R	32.8	Very low	34.6	Very low	204 Å²	204	138.6 Å²	138.6	77%	0.77	72%	0.719	S	S	*	*				106.1	123.7	125.9	-89.7	173.7	171.9	-150.5	-1.6	121.1
828	H	33.7	Very low	34.2	Very low	127 Å²	127	138.1 Å²	138.1	59%	0.588	72%	0.717	S	S	*	*			trans	76.5	127.2	135.5	-72.6	-52.2	0	0	0	122.3
829	H	35	Very low	33.8	Very low	145 Å²	145	144 Å²	144	67%	0.671	73%	0.727	S	S	*	*			trans	62.8	148.8	136.8	-67.4	-62.7	0	0	0	119.3
830	D	32.6	Very low	33.7	Very low	134 Å²	134	142.2 Å²	142.2	72%	0.717	72%	0.719	S	S	*	*			cis	-152.3	177.5	-0.5	-128.3	-21.4	0	0	0	113.9
831	A	32.2	Very low	33.8	Very low	80 Å²	80	144 Å²	144	66%	0.661	73%	0.725	S	S	*	*			trans	18.5	142.3	144.4	0	0	0	0	0	120.4
832	S	37.4	Very low	33.7	Very low	93 Å²	93	142.4 Å²	142.4	65%	0.65	73%	0.726	S	S	*	*			cis	-179.6	167.6	27.3	45	0	0	0	0	115
833	R	36.8	Very low	34.2	Very low	227 Å²	227	141.1 Å²	141.1	86%	0.857	72%	0.722	S	S	*	*			trans	70.8	107.2	148.8	-70.6	153	-164.8	-95.9	2.2	121.4
834	S	31.7	Very low	34	Very low	99 Å²	99	137 Å²	137	69%	0.692	71%	0.713	S	S	*	*				-15	166.5	126	58.3	0	0	0	0	118.7
835	L	32	Very low	34.1	Very low	154 Å²	154	136.4 Å²	136.4	81%	0.806	71%	0.709	S	S	*	*				179.3	145.7	53.3	-167.7	108.7	0	0	0	114
836	A	33.5	Very low	33.7	Very low	80 Å²	80	138.4 Å²	138.4	66%	0.661	71%	0.709	S	S	*	*			trans	56.1	173.8	153.7	0	0	0	0	0	120.2
837	D	32	Very low	33.9	Very low	132 Å²	132	142.4 Å²	142.4	71%	0.706	71%	0.713	S	S	*	*			cis	-157.2	172.1	-3.8	-144.8	-27.2	0	0	0	113.5
838	H	34.6	Very low	33.6	Very low	139 Å²	139	137.3 Å²	137.3	64%	0.644	71%	0.708	S	S	*	*			trans	65.5	122.1	152.7	-80.1	26.1	0	0	0	120.1
839	R	34	Very low	33.4	Very low	222 Å²	222	136.3 Å²	136.3	84%	0.838	72%	0.716	S	S	*	*				72.2	141.8	81.8	-81.5	-169.9	164.6	-170.9	-1.2	115.1
840	S	32.5	Very low	33.5	Very low	83 Å²	83	137.4 Å²	137.4	58%	0.58	72%	0.721	S	S	*	*			cis	-175.9	169.1	-8.6	61.8	0	0	0	0	112.9
841	R	36.6	Very low	33.7	Very low	233 Å²	233	136 Å²	136	88%	0.879	72%	0.719	S	S	*	*			trans	72.2	155.8	152.3	-75.9	176.8	-175.5	-157.3	-0	117.8
842	H	33.6	Very low	33.6	Very low	162 Å²	162	138.8 Å²	138.8	75%	0.75	72%	0.723	S	S	*	*			cis	-169.9	167.7	-19.2	-169.8	-96.6	0	0	0	109.3
843	A	39.6	Very low	33.5	Very low	72 Å²	72	138.9 Å²	138.9	60%	0.595	72%	0.724	S	S	*	*			trans	68.7	154.3	160.4	0	0	0	0	0	118.5
844	E	32.4	Very low	33.1	Very low	160 Å²	160	135.4 Å²	135.4	75%	0.748	72%	0.717	S	S	*	*			cis	-165.8	157.3	-19.1	-126.8	175.4	111.7	0	0	111.5
845	S	33.1	Very low	33.1	Very low	98 Å²	98	136.4 Å²	136.4	69%	0.685	71%	0.714	S	S	*	*			trans	68.7	163.5	155.4	88.3	0	0	0	0	117.2
846	Q	31.6	Very low	33.2	Very low	147 Å²	147	135.8 Å²	135.8	69%	0.687	71%	0.711	S	S	*	*			cis	-166.4	154	-13.9	-124.8	169.8	38.5	0	0	110.4
847	Y	33.4	Very low	33.1	Very low	199 Å²	199	139.4 Å²	139.4	78%	0.78	72%	0.716	S	S	*	*			trans	55.5	140.5	169.8	-59.9	-73.9	0	0	0	117.5
848	S	27	Very low	33.5	Very low	97 Å²	97	139.8 Å²	139.8	68%	0.678	72%	0.717	S	S	*	*			cis	108.7	112.2	16.8	-67	0	0	0	0	114.5
849	S	30.5	Very low	33.6	Very low	106 Å²	106	138.4 Å²	138.4	74%	0.741	72%	0.721	S	S	*	*			trans	71.4	158.8	145.9	55.4	0	0	0	0	122.2
850	E	35.9	Very low	33.5	Very low	169 Å²	169	139 Å²	139	79%	0.79	72%	0.723	S	S	*	*			trans	82.8	147.6	166.4	-58.5	-41.6	91.3	0	0	120.7
851	P	37.4	Very low	33.5	Very low	103 Å²	103	139.2 Å²	139.2	67%	0.669	73%	0.73	S	S	*	*			trans	-141.5	-158.6	-135.1	43.8	-22.9	0	0	0	115.4
852	D	31.1	Very low	33.6	Very low	140 Å²	140	137.6 Å²	137.6	75%	0.749	73%	0.729	S	S	*	*			trans	79.7	151.8	157.6	-139.3	-40.9	0	0	0	117.7
853	S	33.5	Very low	33.5	Very low	95 Å²	95	141.2 Å²	141.2	66%	0.664	74%	0.736	S	S	*	*			trans	54.9	143.8	155.7	-66.7	0	0	0	0	120.3
854	E	29.8	Very low	33.2	Very low	154 Å²	154	141.4 Å²	141.4	72%	0.72	75%	0.745	S	S	*	*			cis	-164.8	161	-29.2	-133.3	-158.7	139.6	0	0	106.5
855	L	30.6	Very low	33.2	Very low	119 Å²	119	145.4 Å²	145.4	62%	0.623	75%	0.753	S	S	*	*			trans	51.5	116.2	152.2	-61	171.2	0	0	0	121.8
856	L	33.7	Very low	32.9	Very low	142 Å²	142	146.4 Å²	146.4	74%	0.743	76%	0.761	S	S	*	*			trans	68	131.2	131.9	-53.9	174.3	0	0	0	118.3
857	M	32.5	Very low	32.8	Very low	155 Å²	155	142.5 Å²	142.5	76%	0.764	75%	0.753	S	S	*	*			cis	-153.2	146.7	39.9	-81.8	-67.1	-106.3	0	0	115.2
858	L	39.5	Very low	32.5	Very low	140 Å²	140	141.5 Å²	141.5	73%	0.733	76%	0.756	S	S	*	*			trans	-11.5	153.2	138	-63.8	176	0	0	0	117.5
859	P	38.3	Very low	32.6	Very low	111 Å²	111	141 Å²	141	72%	0.721	75%	0.751	S	S	*	*				-160.7	159.6	54.3	44	-21.9	0	0	0	122.8
860	R	31.6	Very low	32.6	Very low	233 Å²	233	142.4 Å²	142.4	88%	0.879	75%	0.75	S	S	*	*			trans	58.2	106.8	136	-74.5	-177.6	151.9	101.9	-1.8	123.4
861	A	32.5	Very low	32.4	Very low	88 Å²	88	141.2 Å²	141.2	73%	0.727	74%	0.744	S	S	*	*				89.1	160.6	105.4	0	0	0	0	0	122.3
862	K	38.8	Very low	32.1	Very low	199 Å²	199	143.3 Å²	143.3	87%	0.865	75%	0.747	S	S	*	*			trans	80.9	143.4	177.6	-62.1	174.8	-175.6	172.7	0	115.4
863	R	30.9	Very low	32.2	Very low	239 Å²	239	142.1 Å²	142.1	90%	0.902	74%	0.744	S	S	*	*			cis	-168	131.2	-24.5	-144.5	-175.5	-164.8	-172.5	4.5	110.5
864	G	32.9	Very low	32	Very low	76 Å²	76	141.9 Å²	141.9	78%	0.784	74%	0.743	S	S	*	*			trans	63.8	-170	167.7	0	0	0	0	0	115.1
865	R	32.6	Very low	32	Very low	243 Å²	243	141.6 Å²	141.6	92%	0.917	74%	0.741	S	S	*	*			cis	-178	142.6	-26.2	-129.6	-171.6	-171.8	-110.2	4.6	105.5
866	S	28	Very low	32.2	Very low	120 Å²	120	142.5 Å²	142.5	84%	0.839	75%	0.746	S	S	*	*			trans	65.6	166.6	170	-152.3	0	0	0	0	113.8
867	A	27.5	Very low	32	Very low	64 Å²	64	144 Å²	144	53%	0.529	75%	0.749	S	S	.	*				-160	176.4	-52.4	0	0	0	0	0	105.7
868	E	28.4	Very low	32.4	Very low	178 Å²	178	141.8 Å²	141.8	83%	0.832	75%	0.747	S	S	*	*			trans	63.2	176.4	158.2	-72.6	158.9	-145.5	0	0	113.4
869	C	28.3	Very low	31.9	Very low	86 Å²	86	140.1 Å²	140.1	58%	0.581	75%	0.747	S	S	*	*			cis	-148.2	134.7	-21.3	-123.9	0	0	0	0	108
870	L	31.3	Very low	31.6	Very low	137 Å²	137	142.3 Å²	142.3	72%	0.717	75%	0.751	S	S	*	*			trans	66.3	167.1	148.5	-50.8	177.7	0	0	0	115.9
871	H	31.3	Very low	31.6	Very low	144 Å²	144	136.2 Å²	136.2	67%	0.667	74%	0.737	S	S	*	*			cis	-151.9	164.6	-3.7	-122.5	164.5	0	0	0	109.5
872	M	30.3	Very low	31.5	Very low	147 Å²	147	142.2 Å²	142.2	72%	0.724	74%	0.74	S	S	*	*			trans	38.6	139.2	140.5	-59.6	-177.4	86.7	0	0	120.3
873	T	33.3	Very low	31.1	Very low	114 Å²	114	136.5 Å²	136.5	70%	0.699	73%	0.731	S	S	*	*			cis	-164.2	140.3	20.3	8.7	0	0	0	0	107.1
874	S	30.7	Very low	31.2	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	73%	0.73	S	S	*	*				88.5	144.7	67	-136.3	0	0	0	0	114.4
875	E	29.9	Very low	31.1	Very low	147 Å²	147	137.8 Å²	137.8	69%	0.687	73%	0.728	S	S	*	*			trans	66.4	147.8	173.2	-51.1	-32	98.6	0	0	117.6
876	L	33.6	Very low	30.9	Very low	139 Å²	139	131 Å²	131	73%	0.728	72%	0.724	S	S	*	*			cis	-147.2	150.6	-27.3	-89.8	168.5	0	0	0	105
877	Q	28.9	Very low	31	Very low	172 Å²	172	129.8 Å²	129.8	80%	0.804	72%	0.715	S	S	*	*				61.3	139	60.8	-85.8	-69.5	-62.8	0	0	116.7
878	P	41.7	Very low	31.1	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	73%	0.725	S	S	*	*			trans	-117.4	161	-165.8	42.3	-31.6	0	0	0	116.7
879	S	28.6	Very low	31.2	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	72%	0.722	S	S	*	*			trans	-153.9	138.5	164.3	54.5	0	0	0	0	108.7
880	L	33	Very low	31.2	Very low	157 Å²	157	131.1 Å²	131.1	82%	0.822	72%	0.724	S	S	*	*				53.1	139.2	76.8	-53.7	178.6	0	0	0	112.5
881	D	30.6	Very low	31.3	Very low	106 Å²	106	132.3 Å²	132.3	57%	0.567	73%	0.731	S	S	*	*			cis	-164.1	163.5	24.5	-156.2	-30.8	0	0	0	111.7
882	R	31.1	Very low	31.4	Very low	213 Å²	213	136.1 Å²	136.1	80%	0.804	74%	0.739	S	S	*	*			trans	54.2	167.6	158.3	-82.9	147	171.1	83.9	-4.3	120.3
883	A	31.3	Very low	32.1	Very low	80 Å²	80	134.1 Å²	134.1	66%	0.661	74%	0.737	S	S	*	*			cis	-170.9	143.2	-37.4	0	0	0	0	0	107.4
884	R	32.8	Very low	32.2	Very low	234 Å²	234	135.5 Å²	135.5	88%	0.883	74%	0.74	S	S	*	*				177.1	130.2	93.3	-93.6	173	170.4	152.9	-4.2	106.8
885	S	29.6	Very low	32.2	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	75%	0.747	S	S	*	*				75.5	120.4	80.3	-52.8	0	0	0	0	114.9
886	A	28.9	Very low	32.3	Very low	100 Å²	100	134.5 Å²	134.5	83%	0.826	74%	0.744	S	S	*	*			trans	66.7	149.5	165.2	0	0	0	0	0	116.8
887	S	29	Very low	32.4	Very low	94 Å²	94	134.6 Å²	134.6	66%	0.657	75%	0.745	S	S	*	*			cis	-164.1	-178.6	-12.7	50	0	0	0	0	109.6
888	T	30.4	Very low	32.8	Very low	119 Å²	119	134 Å²	134	73%	0.73	74%	0.741	S	S	*	*			trans	55.6	107.3	153.8	43.8	0	0	0	0	117.7
889	N	30.4	Very low	32.3	Very low	146 Å²	146	133.6 Å²	133.6	78%	0.781	74%	0.742	S	S	*	*				74.7	149.1	70.8	-166.1	30.5	0	0	0	113.7
890	C	29.5	Very low	33.1	Very low	91 Å²	91	133.7 Å²	133.7	62%	0.615	74%	0.739	S	S	*	*			trans	81.7	117.9	170.2	-59.4	0	0	0	0	120.1
891	L	33.6	Very low	32.9	Very low	163 Å²	163	132.8 Å²	132.8	85%	0.853	73%	0.731	S	S	*	*			trans	68.7	160.6	138.8	-57.7	169.9	0	0	0	119.4
892	R	32.1	Very low	32.9	Very low	224 Å²	224	136.3 Å²	136.3	85%	0.845	74%	0.736	S	S	*	*				-161.1	161.8	-50	-129.5	-143.6	171.8	175.5	-1.5	107.4
893	P	45.5	Very low	32.8	Very low	105 Å²	105	131.3 Å²	131.3	68%	0.682	72%	0.722	S	S	*	*			trans	-95.4	160.5	-179.3	37.6	-33.1	0	0	0	113.4
894	D	35	Very low	32.7	Very low	142 Å²	142	136.3 Å²	136.3	76%	0.759	72%	0.724	S	S	*	*			trans	-136.8	118.3	166.3	-95.6	-53.6	0	0	0	108.5
895	T	30.8	Very low	32.7	Very low	127 Å²	127	131.4 Å²	131.4	78%	0.779	72%	0.72	S	S	*	*				73.9	159.3	105.7	71.4	0	0	0	0	114.2
896	S	32.7	Very low	32.6	Very low	91 Å²	91	133.4 Å²	133.4	64%	0.636	72%	0.717	S	S	*	*			cis	-158.8	163.6	18.3	63.4	0	0	0	0	112.7
897	L	35.4	Very low	32.9	Very low	140 Å²	140	138.5 Å²	138.5	73%	0.733	72%	0.715	S	S	*	*			trans	67.5	152.7	160.6	-49.6	-175.5	0	0	0	117.9
898	H	36.3	Very low	32.9	Very low	159 Å²	159	141.6 Å²	141.6	74%	0.736	72%	0.719	S	S	*	*			cis	-149.9	160.9	-8.9	-121.2	-55.2	0	0	0	110.5
899	S	32.3	Very low	32.9	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	72%	0.724	S	S	*	*			trans	-134.3	-175.6	163.9	-44.9	0	0	0	0	107.4
900	P	44.8	Very low	33	Very low	105 Å²	105	138.3 Å²	138.3	68%	0.682	73%	0.725	S	S	*	*			cis	-141.9	-153	0.6	38.8	-15.2	0	0	0	114.2
901	E	28.3	Very low	33.3	Very low	139 Å²	139	139 Å²	139	65%	0.65	73%	0.728	S	S	*	*			trans	89	149.8	140.9	-107.2	-172.7	106	0	0	123.7
902	R	31.4	Very low	33	Very low	179 Å²	179	136.7 Å²	136.7	68%	0.675	72%	0.722	S	S	*	*			trans	73.2	147.3	149.8	-76.8	-177.5	-172.6	-113.5	3.9	120.6
903	E	28.3	Very low	32.9	Very low	108 Å²	108	134.2 Å²	134.2	51%	0.505	72%	0.72	S	S	.	*			cis	-163	165.9	-18.1	-136.2	-175.9	141.9	0	0	112.9
904	R	30.3	Very low	32.1	Very low	185 Å²	185	134.2 Å²	134.2	70%	0.698	72%	0.722	S	S	*	*			trans	60.3	130.3	144.8	-85.6	171.4	171.6	135	-6.8	123.6
905	T	31.7	Very low	32.8	Very low	132 Å²	132	133.1 Å²	133.1	81%	0.81	72%	0.722	S	S	*	*			trans	72.4	158.9	137.7	54	0	0	0	0	121.7
906	H	28.5	Very low	33.3	Very low	149 Å²	149	132.8 Å²	132.8	69%	0.69	72%	0.722	S	S	*	*			cis	165.5	106.9	-36.7	167.4	-66.3	0	0	0	109.3
907	R	34.2	Very low	33.3	Very low	208 Å²	208	132.9 Å²	132.9	79%	0.785	73%	0.729	S	S	*	*			trans	175.8	123.9	152.4	-99.7	159.2	-174.5	-92.7	-0.6	108.2
908	Q	29.2	Very low	33.2	Very low	158 Å²	158	133.2 Å²	133.2	74%	0.738	73%	0.731	S	S	*	*				67.2	118.9	79.2	-69.2	-176.3	-16	0	0	114.1
909	G	31	Very low	33.2	Very low	80 Å²	80	130.9 Å²	130.9	83%	0.825	73%	0.729	S	S	*	*			trans	164.7	70.3	176.6	0	0	0	0	0	115.5
910	S	32.4	Very low	33.4	Very low	117 Å²	117	129.8 Å²	129.8	82%	0.818	72%	0.721	S	S	*	*			trans	-92.2	-176.9	162.2	-41	0	0	0	0	109.4
911	P	36.3	Very low	33.1	Very low	104 Å²	104	134.4 Å²	134.4	68%	0.675	73%	0.731	S	S	*	*			cis	-141.3	179.2	-3.3	36.2	-14.3	0	0	0	116.7
912	T	26.9	Very low	33.6	Very low	116 Å²	116	131.4 Å²	131.4	71%	0.712	74%	0.737	S	S	*	*			trans	65.5	150.7	144.5	45	0	0	0	0	125
913	Q	28.7	Very low	34.1	Very low	172 Å²	172	127.6 Å²	127.6	80%	0.804	74%	0.738	S	S	*	*			trans	83.2	106.2	147.1	-81.2	179.8	73.7	0	0	123.1
914	S	29.2	Very low	34.8	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	75%	0.752	S	S	*	*				80.3	147.5	126.1	-51.1	0	0	0	0	122.5
915	P	50.4	Low	35.2	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	75%	0.753	S	S	*	*			trans	-104.5	-176.6	-178.7	44.1	-37.7	0	0	0	113.6
916	P	41.4	Very low	35.5	Very low	120 Å²	120	130 Å²	130	78%	0.779	75%	0.75	S	S	*	*				-158.6	173.7	94.4	42.4	-23.2	0	0	0	118.9
917	A	32	Very low	36	Very low	93 Å²	93	131.5 Å²	131.5	77%	0.769	75%	0.749	S	S	*	*			trans	53	147.2	142.8	0	0	0	0	0	124.5
918	D	33.3	Very low	36	Very low	147 Å²	147	127.9 Å²	127.9	79%	0.786	74%	0.741	S	S	*	*			cis	-146.9	-98.4	-34.5	-167.2	-108.6	0	0	0	111.7
919	T	37.6	Very low	36.3	Very low	111 Å²	111	127 Å²	127	68%	0.681	74%	0.741	S	S	*	*			cis	-156	78	-9	-40.6	0	0	0	0	114.2
920	S	35.4	Very low	36.6	Very low	80 Å²	80	127.8 Å²	127.8	56%	0.559	73%	0.732	S	S	*	*			trans	64.8	164.1	153	76.8	0	0	0	0	121.4
921	F	39.3	Very low	36.6	Very low	201 Å²	201	130.5 Å²	130.5	88%	0.882	73%	0.731	S	S	*	*			cis	-134.3	145.1	-2.9	-75.4	-82.6	0	0	0	109.8
922	G	38.7	Very low	36.4	Very low	77 Å²	77	131.4 Å²	131.4	79%	0.794	74%	0.735	S	S	*	*				120.1	149.5	87.4	0	0	0	0	0	110.7
923	S	41.9	Very low	36.9	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	74%	0.737	S	S	*	*			cis	-154.4	124	7.9	-167.9	0	0	0	0	113.2
924	R	41.5	Very low	37	Very low	213 Å²	213	130.1 Å²	130.1	80%	0.804	74%	0.74	S	S	*	*			trans	63.6	148.7	139.5	-64.5	174.8	-164.9	-123.5	1.1	121.6
925	R	38.9	Very low	36.9	Very low	190 Å²	190	135.8 Å²	135.8	72%	0.717	75%	0.746	S	S	*	*			cis	-171.2	138.1	-30.3	-116.1	169.4	-144.5	-130.1	3.3	105.7
926	G	39.2	Very low	35.7	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	75%	0.749	S	S	*	*				106.8	157.1	82.5	0	0	0	0	0	109.5
927	R	39.4	Very low	35	Very low	181 Å²	181	133.8 Å²	133.8	68%	0.683	75%	0.749	S	S	*	*			cis	-153.7	131.7	15.9	-94	-169.4	-170.9	-107.9	16.2	108.2
928	Q	33.6	Very low	34.9	Very low	132 Å²	132	134.1 Å²	134.1	62%	0.617	75%	0.746	S	S	*	*				80.2	151.6	96.1	-74.9	-170.9	-56.5	0	0	115.3
929	L	35.7	Very low	34.8	Very low	140 Å²	140	134.1 Å²	134.1	73%	0.733	74%	0.744	S	S	*	*			cis	-152	-165.6	4.6	-115.6	170.5	0	0	0	109.5
930	P	36.7	Very low	34.4	Very low	96 Å²	96	136.3 Å²	136.3	62%	0.623	75%	0.747	S	S	*	*			trans	-139	-168.1	-142	45.3	-23.1	0	0	0	118.2
931	Q	32.7	Very low	34.1	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.813	75%	0.754	S	S	*	*			trans	76.5	147.7	145.3	-91.3	-170.8	7.7	0	0	123.5
932	V	31.1	Very low	33.6	Very low	123 Å²	123	134.4 Å²	134.4	75%	0.745	75%	0.747	S	S	*	*			trans	73.3	140.6	157.4	171.6	0	0	0	0	117.8
933	P	39.3	Very low	33.2	Very low	116 Å²	116	135.4 Å²	135.4	75%	0.753	74%	0.742	S	S	*	*			trans	-106.8	133.6	-166.1	37.6	-28.6	0	0	0	115
934	V	29.6	Very low	32.9	Very low	145 Å²	145	137.8 Å²	137.8	88%	0.879	75%	0.746	S	S	*	*			trans	-138.1	156.7	171	-179.6	0	0	0	0	111.4
935	R	26.9	Very low	32.5	Very low	225 Å²	225	133.7 Å²	133.7	85%	0.849	75%	0.745	S	S	*	*			trans	-67.7	148.8	-175.7	-68.1	171.6	168.3	169.6	-5.3	115.4
936	S	25.3	Very low	32.4	Very low	120 Å²	120	130 Å²	130	84%	0.839	74%	0.743	S	S	*	*			trans	53.9	123	134.2	-56.7	0	0	0	0	122
937	G	27.7	Very low	32	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	74%	0.741	S	S	*	*			trans	103.6	154.7	146.2	0	0	0	0	0	115.6
938	S	29.1	Very low	31.7	Very low	101 Å²	101	133 Å²	133	71%	0.706	75%	0.745	S	S	*	*			cis	-166.8	164.8	-12.4	-152.2	0	0	0	0	110
939	I	30.6	Very low	31.4	Very low	146 Å²	146	136.6 Å²	136.6	75%	0.749	75%	0.753	S	S	*	*			trans	52.2	113.7	144.7	-77	167.4	0	0	0	116.1
940	E	29.3	Very low	31.1	Very low	157 Å²	157	135 Å²	135	73%	0.734	75%	0.749	S	S	*	*				-152.8	171.3	67.5	-77.7	-160.1	137.1	0	0	111.7
941	Q	29	Very low	31.1	Very low	152 Å²	152	141.4 Å²	141.4	71%	0.71	76%	0.761	S	S	*	*			cis	-155.6	146.3	13.1	-142.7	169	71	0	0	110.7
942	A	29.4	Very low	31	Very low	89 Å²	89	141.1 Å²	141.1	74%	0.736	76%	0.76	S	S	*	*			trans	57.6	143.8	154.4	0	0	0	0	0	120.4
943	S	29.8	Very low	31.1	Very low	99 Å²	99	143.7 Å²	143.7	69%	0.692	77%	0.765	S	S	*	*			cis	-163.8	150.3	-5.6	-118.7	0	0	0	0	112.7
944	L	36.3	Very low	31	Very low	148 Å²	148	146.9 Å²	146.9	78%	0.775	77%	0.768	S	S	*	*			trans	68.7	124.3	149.2	-62.7	170.9	0	0	0	118.5
945	V	31.9	Very low	31.4	Very low	127 Å²	127	147.9 Å²	147.9	77%	0.77	77%	0.765	S	S	*	*				86.6	132.4	59.9	154.2	0	0	0	0	111.1
946	V	38.1	Very low	31.9	Very low	111 Å²	111	145.8 Å²	145.8	67%	0.673	76%	0.762	S	S	*	*			cis	-148.6	-163.7	12.9	86.6	0	0	0	0	113.3
947	E	31.2	Very low	32.5	Very low	150 Å²	150	145.4 Å²	145.4	70%	0.701	75%	0.754	S	S	*	*			trans	-50.2	-174.8	155.9	-59.5	170.4	73.8	0	0	112.3
948	E	33.2	Very low	32.8	Very low	166 Å²	166	149.3 Å²	149.3	78%	0.776	75%	0.752	S	S	*	*				178.3	116	64	-166.7	-178.3	163.4	0	0	105.3
949	R	27.4	Very low	33.1	Very low	209 Å²	209	153 Å²	153	79%	0.789	75%	0.75	S	S	*	*				61.5	132.8	76.4	-147.5	-173	-177.1	128.7	1.3	114.8
950	T	29.4	Very low	33.1	Very low	105 Å²	105	152.9 Å²	152.9	64%	0.644	75%	0.745	S	S	*	*			trans	90.7	141.7	156.1	-37.7	0	0	0	0	119.9
951	R	35.3	Very low	33.4	Very low	231 Å²	231	152.7 Å²	152.7	87%	0.872	74%	0.742	S	S	*	*			trans	94.4	80.4	174.1	-57.9	-173.1	178.6	-148.5	-2	114.3
952	Q	31	Very low	33.7	Very low	169 Å²	169	152.1 Å²	152.1	79%	0.79	74%	0.739	S	S	*	*				52.6	106.1	52.4	-71.1	-159	28.6	0	0	116
953	M	32.7	Very low	34	Very low	176 Å²	176	153.2 Å²	153.2	87%	0.867	74%	0.737	S	S	*	*				-170.2	123.4	127.3	-95.2	167.9	-167.6	0	0	106.5
954	K	37.9	Very low	34.1	Very low	183 Å²	183	155.1 Å²	155.1	80%	0.796	74%	0.744	S	S	*	*				63.3	127.1	80.7	-74	-176.1	178.8	178.4	0	111.6
955	M	38.8	Very low	34	Very low	166 Å²	166	151.7 Å²	151.7	82%	0.818	74%	0.744	S	S	*	*			cis	-137.9	152.7	18.6	-71.2	-160.7	-103	0	0	111.8
956	K	35.7	Very low	33.8	Very low	181 Å²	181	151.9 Å²	151.9	79%	0.787	75%	0.751	S	S	*	*				63	130.7	76	-134.3	-169.7	177.6	-174.6	0	111.3
957	V	38.3	Very low	33.5	Very low	112 Å²	112	150 Å²	150	68%	0.679	75%	0.754	S	S	*	*				-167.6	130.1	60.4	162.2	0	0	0	0	113.5
958	H	35.3	Very low	33.3	Very low	157 Å²	157	148.4 Å²	148.4	73%	0.727	76%	0.76	S	S	*	*			trans	56	171	147.8	-78	-168.1	0	0	0	122.7
959	R	33.6	Very low	33.3	Very low	178 Å²	178	145 Å²	145	67%	0.672	75%	0.754	S	S	*	*			cis	177.2	160.6	-23.6	-177.6	173.8	-171.5	-152.3	13.4	107.1
960	F	31.7	Very low	33.4	Very low	145 Å²	145	141.6 Å²	141.6	64%	0.636	75%	0.748	S	S	*	*			cis	-117.9	-121.7	5.6	-138.5	166.4	0	0	0	113
961	K	36	Very low	33.5	Very low	153 Å²	153	143.7 Å²	143.7	67%	0.665	75%	0.75	S	S	*	*			cis	66	151.6	5.5	-56.6	-173	124.9	-159.3	0	118.1
962	Q	35.5	Very low	33.2	Very low	139 Å²	139	138.9 Å²	138.9	65%	0.65	74%	0.741	S	S	*	*			cis	-141.8	-160.3	-3.4	-130.4	168.9	-114.2	0	0	109.3
963	T	34.8	Very low	33.3	Very low	113 Å²	113	137.1 Å²	137.1	69%	0.693	74%	0.737	S	S	*	*			cis	-141.1	-115.3	19.4	-39.6	0	0	0	0	114.3
964	T	32.4	Very low	33.2	Very low	139 Å²	139	135.6 Å²	135.6	85%	0.853	73%	0.727	S	S	*	*			trans	-157.5	158.8	-166.5	44.8	0	0	0	0	111.1
965	G	33.6	Very low	33	Very low	75 Å²	75	133.3 Å²	133.3	77%	0.773	72%	0.719	S	S	*	*			trans	172.3	142.6	164.4	0	0	0	0	0	112.8
966	S	28.3	Very low	32.8	Very low	131 Å²	131	131.9 Å²	131.9	92%	0.916	71%	0.711	S	S	*	*			trans	-134.5	152.1	-170.5	-59.1	0	0	0	0	113.9
967	G	31.2	Very low	32.6	Very low	72 Å²	72	132.5 Å²	132.5	74%	0.742	71%	0.71	S	S	*	*			trans	81.7	168.6	167.8	0	0	0	0	0	116.2
968	S	28.2	Very low	32.4	Very low	116 Å²	116	131.5 Å²	131.5	81%	0.811	71%	0.708	S	S	*	*			cis	-178.6	149.3	-22.4	43.9	0	0	0	0	111.2
969	S	31.9	Very low	32.5	Very low	95 Å²	95	132 Å²	132	66%	0.664	71%	0.708	S	S	*	*			trans	73.2	135.6	164.3	-111.8	0	0	0	0	121.1
970	Q	30.8	Very low	32.6	Very low	138 Å²	138	133.3 Å²	133.3	65%	0.645	71%	0.714	S	S	*	*			trans	55.4	127.9	132.1	-69.8	178.1	-76.3	0	0	122.9
971	E	30.4	Very low	32.6	Very low	149 Å²	149	133.4 Å²	133.4	70%	0.696	72%	0.721	S	S	*	*				62.2	153.2	119	-61	165.7	-156	0	0	119.5
972	L	29.5	Very low	32.7	Very low	130 Å²	130	133.5 Å²	133.5	68%	0.681	73%	0.727	S	S	*	*			cis	-155.4	-176.2	-6.3	-122.6	167	0	0	0	108
973	D	32.1	Very low	32.8	Very low	131 Å²	131	134.4 Å²	134.4	70%	0.701	73%	0.731	S	S	*	*			trans	64.3	165.5	152.3	-70.1	-29.1	0	0	0	120.3
974	H	32.1	Very low	32.8	Very low	144 Å²	144	135.7 Å²	135.7	67%	0.667	73%	0.727	S	S	*	*			cis	-160.8	153.5	-42.2	-156.3	-104.7	0	0	0	108
975	E	33.7	Very low	33.1	Very low	135 Å²	135	133.7 Å²	133.7	63%	0.631	71%	0.711	S	S	*	*			trans	61.5	-178.7	156.1	-110.7	174.3	118.1	0	0	118.3
976	Q	33.8	Very low	33.2	Very low	136 Å²	136	137.8 Å²	137.8	64%	0.636	71%	0.71	S	S	*	*			cis	-143.8	143.6	-3.1	-106.4	-156.2	-4.8	0	0	111
977	Y	32.5	Very low	33.5	Very low	195 Å²	195	139.4 Å²	139.4	77%	0.765	70%	0.697	S	S	*	*			trans	57.1	158.5	142	-75.2	-119	0	0	0	121.7
978	S	33.8	Very low	33.9	Very low	91 Å²	91	145 Å²	145	64%	0.636	70%	0.696	S	S	*	*			cis	-173.8	167.1	-23	-175.9	0	0	0	0	111.4
979	K	37.2	Very low	34.3	Very low	167 Å²	167	143.8 Å²	143.8	73%	0.726	69%	0.688	S	S	*	*			trans	62.2	148.3	168.5	-80.3	175.8	172.1	176.1	0	117.3
980	Y	36.2	Very low	34.6	Very low	206 Å²	206	143.4 Å²	143.4	81%	0.808	68%	0.684	S	S	*	*			cis	-142.1	171.8	36.3	-107.5	-82.1	0	0	0	114.6
981	N	30.6	Very low	34.9	Very low	147 Å²	147	143.5 Å²	143.5	79%	0.786	69%	0.689	S	S	*	*			trans	-120.7	154.7	-175	-130.8	-19.4	0	0	0	111
982	I	39.3	Very low	35.2	Very low	154 Å²	154	143.6 Å²	143.6	79%	0.79	69%	0.694	S	S	*	*			trans	179.2	114.7	156.1	-99.8	151.6	0	0	0	108.1
983	H	35.6	Very low	35.6	Very low	159 Å²	159	141.5 Å²	141.5	74%	0.736	70%	0.696	S	S	*	*				69.6	138.2	96.4	-111	-140	0	0	0	114
984	K	36.8	Very low	35.8	Very low	139 Å²	139	140.8 Å²	140.8	60%	0.604	70%	0.701	S	S	*	*			cis	-170.1	159.5	1.7	-151.5	-157.7	170.3	-143.6	0	110.6
985	D	37.7	Very low	36.1	Very low	98 Å²	98	138 Å²	138	52%	0.524	70%	0.703	S	S	.	*			trans	60.3	161.9	154.7	-72.8	5.9	0	0	0	118.7
986	Q	36.4	Very low	36.2	Very low	160 Å²	160	141.5 Å²	141.5	75%	0.748	72%	0.716	S	S	*	*			cis	-165.8	171.3	-11.8	-106.9	179.9	73.7	0	0	106.5
987	Y	34.8	Very low	36.4	Very low	165 Å²	165	140.2 Å²	140.2	65%	0.647	72%	0.722	S	S	*	*			cis	179	145.8	-28.9	169.7	-121.7	0	0	0	110.1
988	R	39.5	Very low	36.8	Very low	191 Å²	191	136.5 Å²	136.5	72%	0.721	73%	0.725	S	S	*	*			trans	65.2	162	177.2	-73.2	-173.8	-167.1	-156.1	7	117.7
989	S	36.2	Very low	37	Very low	90 Å²	90	139.1 Å²	139.1	63%	0.629	73%	0.732	S	S	*	*			cis	-132	147.3	-1.5	-106.9	0	0	0	0	109.4
990	C	37.6	Very low	37.2	Very low	87 Å²	87	136.2 Å²	136.2	59%	0.588	73%	0.733	S	S	*	*			cis	73.6	133.6	45	118	0	0	0	0	112.7
991	D	37.6	Very low	37.4	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	73%	0.732	S	S	*	*			cis	-140.2	-162.3	-14.4	-70.4	-55	0	0	0	107.1
992	N	35.5	Very low	38	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	74%	0.735	S	S	*	*			cis	-158.2	-167.2	4.5	-142.8	-29.1	0	0	0	105.8
993	A	39.3	Very low	37.9	Very low	87 Å²	87	130.9 Å²	130.9	72%	0.719	73%	0.732	S	S	*	*			cis	-156.9	-142.8	-0.3	0	0	0	0	0	109.1
994	S	35	Very low	38	Very low	115 Å²	115	130 Å²	130	80%	0.804	73%	0.733	S	S	*	*				-160.1	177.6	-106.2	-166.2	0	0	0	0	111.7
995	A	38	Very low	38	Very low	87 Å²	87	129.9 Å²	129.9	72%	0.719	74%	0.744	S	S	*	*			trans	65.6	131.2	-173.8	0	0	0	0	0	115.6
996	K	37.8	Very low	37.8	Very low	207 Å²	207	129.9 Å²	129.9	90%	0.9	75%	0.752	S	S	*	*			cis	78.8	106.7	22.4	-63.5	-170.4	171	-173.9	0	117.6
997	S	36.5	Very low	37.9	Very low	109 Å²	109	126.9 Å²	126.9	76%	0.762	75%	0.754	S	S	*	*				176.2	133.8	128	56.5	0	0	0	0	113.2
998	S	41.9	Very low	38	Very low	118 Å²	118	126.6 Å²	126.6	83%	0.825	76%	0.762	S	S	*	*			trans	54.6	160.4	135.1	-61	0	0	0	0	123.1
999	D	38.2	Very low	37.6	Very low	146 Å²	146	122.7 Å²	122.7	78%	0.781	76%	0.764	S	S	*	*			cis	-170.5	-178.2	-34.9	-153.5	-9.5	0	0	0	109.1
1000	S	39.6	Very low	37.6	Very low	106 Å²	106	130 Å²	130	74%	0.741	78%	0.778	S	S	*	*			trans	82.5	123.7	159.8	67.5	0	0	0	0	120.7
1001	D	41.9	Very low	37.4	Very low	148 Å²	148	130 Å²	130	79%	0.791	78%	0.784	S	S	*	*			trans	-64	169.8	178.2	-51.1	-81.3	0	0	0	116.8
1002	V	43.6	Very low	37.1	Very low	140 Å²	140	128.7 Å²	128.7	85%	0.848	79%	0.786	S	S	*	*				-158.5	143.7	106.1	-94.9	0	0	0	0	113
1003	S	36	Very low	36.8	Very low	106 Å²	106	126.9 Å²	126.9	74%	0.741	79%	0.785	S	S	*	*			trans	-20.3	137.8	165.5	50.8	0	0	0	0	118.1
1004	D	38.3	Very low	36.4	Very low	141 Å²	141	128.8 Å²	128.8	75%	0.754	79%	0.788	S	S	*	*			cis	93.8	146.9	45.3	-170.6	32.9	0	0	0	113.9
1005	V	36.5	Very low	36.3	Very low	136 Å²	136	128.2 Å²	128.2	82%	0.824	78%	0.784	S	S	*	*			trans	157.5	118.8	155.8	156.9	0	0	0	0	109.1
1006	S	34.3	Very low	36.1	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	79%	0.79	S	S	*	*			trans	-110.3	144.5	178.8	-67.6	0	0	0	0	112.7
1007	A	38.5	Very low	35.9	Very low	96 Å²	96	132.3 Å²	132.3	79%	0.793	79%	0.786	S	S	*	*			trans	-158.1	95.9	160	0	0	0	0	0	109.1
1008	I	35.6	Very low	35.5	Very low	160 Å²	160	132 Å²	132	82%	0.821	78%	0.784	S	S	*	*				78	113.4	77.1	-63.8	163.7	0	0	0	113.1
1009	S	30.8	Very low	35	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	78%	0.779	S	S	*	*			trans	-65.3	162.1	178	-34.2	0	0	0	0	114.7
1010	R	36.4	Very low	34.6	Very low	243 Å²	243	130.8 Å²	130.8	92%	0.917	78%	0.781	S	S	*	*				-176.9	156.3	124.6	-104.9	162	172.9	170.3	-2	114.9
1011	A	34.3	Very low	34.2	Very low	88 Å²	88	130.7 Å²	130.7	73%	0.727	78%	0.78	S	S	*	*			trans	50.3	119.9	158.6	0	0	0	0	0	118.8
1012	S	30.5	Very low	33.8	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	78%	0.779	S	S	*	*			cis	90.9	129	49.3	-66.5	0	0	0	0	114.7
1013	S	28.9	Very low	33.6	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	77%	0.774	S	S	*	*			trans	88.1	149.8	154.7	-56	0	0	0	0	121.4
1014	T	32.6	Very low	33.5	Very low	128 Å²	128	131.5 Å²	131.5	79%	0.785	77%	0.767	S	S	*	*			trans	59.1	84.6	159.3	51.3	0	0	0	0	120.8
1015	S	31.6	Very low	33.5	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	76%	0.764	S	S	*	*				25.2	140.8	120.9	66.5	0	0	0	0	122.9
1016	R	33.6	Very low	33.5	Very low	228 Å²	228	131.2 Å²	131.2	86%	0.86	75%	0.752	S	S	*	*			trans	112.5	126.9	148	-65	-167	176.6	-147.6	-2.2	117.9
1017	L	33.3	Very low	33.6	Very low	152 Å²	152	129.8 Å²	129.8	80%	0.796	74%	0.742	S	S	*	*			trans	75.5	96.8	152.6	-62.3	165.5	0	0	0	121
1018	S	29.4	Very low	33.5	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	74%	0.744	S	S	*	*				46.6	121.4	118.8	-50	0	0	0	0	123.6
1019	S	30.5	Very low	33.6	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	73%	0.733	S	S	*	*			trans	82.4	130.4	134.2	-59.1	0	0	0	0	122.6
1020	T	30.6	Very low	33.9	Very low	136 Å²	136	133.7 Å²	133.7	83%	0.834	73%	0.732	S	S	*	*			trans	64.3	148.8	149	49	0	0	0	0	119.5
1021	S	30.7	Very low	33.8	Very low	103 Å²	103	134 Å²	134	72%	0.72	73%	0.733	S	S	*	*			cis	-170.4	138.7	-15.6	48.6	0	0	0	0	112.8
1022	F	34.1	Very low	33.8	Very low	174 Å²	174	133.3 Å²	133.3	76%	0.763	74%	0.735	S	S	*	*			trans	46.3	129.4	138.4	-158.6	-105.7	0	0	0	123.3
1023	M	38.1	Very low	34.1	Very low	153 Å²	153	138.9 Å²	138.9	75%	0.754	74%	0.739	S	S	*	*			trans	-178.8	175.3	134.2	-87.2	-98	56	0	0	110.9
1024	S	34.5	Very low	34.3	Very low	84 Å²	84	140.3 Å²	140.3	59%	0.587	74%	0.736	S	S	*	*			trans	-159	-163.8	-160	-59.5	0	0	0	0	116.3
1025	E	38.7	Very low	34.3	Very low	148 Å²	148	138.8 Å²	138.8	69%	0.692	73%	0.73	S	S	*	*			trans	78.8	150.7	171.9	-57.9	-55.1	89.8	0	0	118.7
1026	Q	36.5	Very low	34.2	Very low	124 Å²	124	139.3 Å²	139.3	58%	0.579	73%	0.734	S	S	*	*			cis	-159.9	-178.7	-18.8	-132.8	-169.8	88.6	0	0	108.9
1027	S	36.6	Very low	34.3	Very low	68 Å²	68	137.4 Å²	137.4	48%	0.476	73%	0.733	S	S	.	*			cis	-139.3	-125.2	-1	-154.7	0	0	0	0	112.3	K731	K731-S1027 PolarHBondContact NZ-OG 2.84Å
1028	E	36.3	Very low	34.5	Very low	178 Å²	178	136.6 Å²	136.6	83%	0.832	73%	0.734	S	S	*	*			cis	-137.9	174.6	-10	-86.1	-158.3	105.9	0	0	109.7	K731	K731-E1028 WeakPolarHBondContact CD-O 3.34Å; K731-E1028 VanDerWaalsContact CE-O 3.29Å; K731-E1028 WeakPolarHBondContact CE-O 3.48Å
1029	R	37	Very low	35	Very low	155 Å²	155	137.1 Å²	137.1	59%	0.585	74%	0.735	S	S	*	*			trans	175.9	140.4	173.3	173.3	-146.3	-76.7	167.5	-14.7	114.4	K731	K731-R1029 HydrophobicContact CD-CB 3.64Å; K731-R1029 VanDerWaalsContact CE-CB 3.5Å
1030	P	38.7	Very low	35.3	Very low	113 Å²	113	141.3 Å²	141.3	73%	0.734	74%	0.74	S	S	*	*			trans	-132.4	136.1	141.2	30.1	-12.9	0	0	0	113.6
1031	R	33.4	Very low	35.6	Very low	249 Å²	249	142.7 Å²	142.7	94%	0.94	74%	0.739	S	S	*	*				85.2	136.8	85.9	-73.1	-173.1	172.9	-176.4	-0	116.5
1032	G	33.8	Very low	35.9	Very low	75 Å²	75	145.8 Å²	145.8	77%	0.773	74%	0.742	S	S	*	*			trans	141.5	98.7	173.6	0	0	0	0	0	110.2
1033	R	37.2	Very low	35.8	Very low	229 Å²	229	141.1 Å²	141.1	86%	0.864	74%	0.744	S	S	*	*				77.2	110.8	66.4	-90.9	-160.2	172.5	-148.9	1.6	115.8
1034	I	33.3	Very low	35.6	Very low	142 Å²	142	145.7 Å²	145.7	73%	0.728	75%	0.752	S	S	*	*			trans	58.1	112.7	140.2	-50.7	167.4	0	0	0	118.2
1035	S	32.9	Very low	35.6	Very low	95 Å²	95	152 Å²	152	66%	0.664	76%	0.763	S	S	*	*				-167.5	145.1	118	-166.9	0	0	0	0	110.7
1036	S	29.8	Very low	35.3	Very low	114 Å²	114	152.8 Å²	152.8	80%	0.797	77%	0.769	S	S	*	*			trans	-120	116.2	175.6	54.3	0	0	0	0	109.7
1037	F	34.9	Very low	35.2	Very low	188 Å²	188	150 Å²	150	83%	0.825	77%	0.773	S	S	*	*			trans	-129.7	133.4	174.7	-95.4	-95.3	0	0	0	111
1038	T	37.2	Very low	35	Very low	135 Å²	135	153.2 Å²	153.2	83%	0.828	79%	0.79	S	S	*	*			trans	-131	145	158.3	59.2	0	0	0	0	107.3
1039	P	40.7	Very low	34.7	Very low	114 Å²	114	150.7 Å²	150.7	74%	0.74	79%	0.792	S	S	*	*			trans	-142	134.2	132.4	33	-17.8	0	0	0	115
1040	K	35.7	Very low	34.5	Very low	191 Å²	191	146.9 Å²	146.9	83%	0.83	80%	0.801	S	S	*	*			trans	14.3	128.4	140.3	-58	171.2	179.5	175	0	119.9
1041	M	38	Very low	34.2	Very low	164 Å²	164	152.8 Å²	152.8	81%	0.808	81%	0.809	S	S	*	*				-137.3	133.7	108.5	-62.8	-156.9	90.2	0	0	106.4
1042	Q	37	Very low	34.1	Very low	168 Å²	168	145.1 Å²	145.1	79%	0.785	80%	0.798	S	S	*	*				54.8	130.8	73.6	-62.5	169.7	-51.7	0	0	112.6
1043	G	31.6	Very low	34.3	Very low	77 Å²	77	148.5 Å²	148.5	79%	0.794	80%	0.797	S	S	*	*			cis	-178.2	172.4	-5.3	0	0	0	0	0	109
1044	R	34.2	Very low	34.4	Very low	249 Å²	249	144.1 Å²	144.1	94%	0.94	79%	0.79	S	S	*	*			cis	-139.7	152.8	2.7	-69	-178.9	172.4	-162.9	-1.3	111.6
1045	R	35.1	Very low	34.6	Very low	216 Å²	216	147 Å²	147	82%	0.815	80%	0.797	S	S	*	*			trans	3.9	148.6	146.3	-61.9	178.3	-176.9	-112.1	6.5	124
1046	M	32.4	Very low	34.6	Very low	165 Å²	165	147.9 Å²	147.9	81%	0.813	80%	0.803	S	S	*	*			trans	53.1	158	138.5	-78	65.6	179.9	0	0	122.1
1047	G	32.5	Very low	35.1	Very low	65 Å²	65	149.6 Å²	149.6	67%	0.67	81%	0.809	S	S	*	*			cis	127.6	66.2	-12.6	0	0	0	0	0	117.8
1048	T	33.6	Very low	35	Very low	136 Å²	136	146 Å²	146	83%	0.834	81%	0.807	S	S	*	*			trans	-144.5	140.5	168	45.8	0	0	0	0	109.4
1049	S	29.6	Very low	35.3	Very low	124 Å²	124	146.8 Å²	146.8	87%	0.867	81%	0.811	S	S	*	*			cis	89.3	126.5	8.5	-153.7	0	0	0	0	117.8
1050	G	32.5	Very low	35	Very low	75 Å²	75	147.1 Å²	147.1	77%	0.773	82%	0.816	S	S	*	*			trans	94.4	160.8	169.9	0	0	0	0	0	116.8
1051	R	32.7	Very low	35.1	Very low	238 Å²	238	141.7 Å²	141.7	90%	0.898	82%	0.815	S	S	*	*			cis	-170.8	115.8	-29.1	178.3	-177.3	-178	-157.9	2.2	109.7
1052	A	30.7	Very low	35	Very low	87 Å²	87	142.8 Å²	142.8	72%	0.719	82%	0.818	S	S	*	*			trans	57.5	147.6	161.2	0	0	0	0	0	120.3
1053	I	38.8	Very low	35.1	Very low	147 Å²	147	142.1 Å²	142.1	75%	0.754	82%	0.818	S	S	*	*				175.7	120.5	111.8	-90	166.2	0	0	0	111.3
1054	I	39	Very low	35.1	Very low	137 Å²	137	148.3 Å²	148.3	70%	0.703	82%	0.819	S	S	*	*			trans	14.3	123.6	145.5	-24.6	168.6	0	0	0	118.8
1055	K	37.7	Very low	35.5	Very low	203 Å²	203	142.6 Å²	142.6	88%	0.883	81%	0.812	S	S	*	*				180	159.1	113.3	-94.4	157.5	-171.2	176.3	0	114.2
1056	S	33.7	Very low	35.5	Very low	112 Å²	112	139.8 Å²	139.8	78%	0.783	81%	0.812	S	S	*	*			trans	-105.4	155.5	-168.4	-36	0	0	0	0	112.4
1057	T	38.7	Very low	35.7	Very low	151 Å²	151	139.5 Å²	139.5	93%	0.926	81%	0.809	S	S	*	*			trans	-143.7	140.1	148.9	43.1	0	0	0	0	110.5
1058	S	34.5	Very low	36.2	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	81%	0.809	S	S	*	*			trans	-129.8	151.6	-173.3	52.3	0	0	0	0	110.9
1059	V	43.1	Very low	36.5	Very low	152 Å²	152	143.5 Å²	143.5	92%	0.921	81%	0.805	S	S	*	*			trans	-138.1	134.5	157.4	-177.5	0	0	0	0	108.6
1060	S	33.2	Very low	36.9	Very low	121 Å²	121	145.5 Å²	145.5	85%	0.846	81%	0.806	S	S	*	*			trans	-114.2	168.8	174.7	53.6	0	0	0	0	110.7
1061	G	39.3	Very low	37.1	Very low	77 Å²	77	145 Å²	145	79%	0.794	80%	0.8	S	S	*	*			trans	-177.9	100.3	176.2	0	0	0	0	0	113.2
1062	E	35.3	Very low	37.6	Very low	186 Å²	186	138.2 Å²	138.2	87%	0.869	79%	0.789	S	S	*	*			trans	-96.1	174.6	164.8	-56.9	177.1	143.7	0	0	109.3
1063	I	37.9	Very low	38.2	Very low	154 Å²	154	142.5 Å²	142.5	79%	0.79	80%	0.795	S	S	*	*			trans	154.5	112.3	141.4	-80.2	159.5	0	0	0	114.6
1064	Y	33	Very low	38.3	Very low	207 Å²	207	140 Å²	140	81%	0.812	79%	0.791	S	S	*	*			trans	65.2	163.7	138.6	-79.6	-102.9	0	0	0	126.6
1065	T	41.3	Very low	38.4	Very low	130 Å²	130	139.8 Å²	139.8	80%	0.798	79%	0.791	S	S	*	*			trans	75.2	116.9	175.5	65.5	0	0	0	0	116.1
1066	L	35.3	Very low	38.6	Very low	156 Å²	156	136.4 Å²	136.4	82%	0.817	79%	0.787	S	S	*	*			cis	86.8	147.6	12.8	-152.4	70.9	0	0	0	116.8
1067	E	37.9	Very low	38.8	Very low	159 Å²	159	135 Å²	135	74%	0.743	78%	0.782	S	S	*	*			trans	87.6	144.1	170.7	-52.1	-147.6	116.7	0	0	117.7
1068	H	41.6	Very low	39	Very low	145 Å²	145	135.1 Å²	135.1	67%	0.671	78%	0.782	S	S	*	*			cis	-160.7	175.7	-20.2	-128.1	97.2	0	0	0	110.8
1069	N	40.1	Very low	39.1	Very low	141 Å²	141	132.8 Å²	132.8	75%	0.754	78%	0.777	S	S	*	*			trans	67.9	127.9	166.5	-58.2	-19.6	0	0	0	118.3
1070	D	38.5	Very low	38.9	Very low	165 Å²	165	132 Å²	132	88%	0.882	77%	0.772	S	S	*	*			cis	106.7	140.6	6.5	-159.4	28.5	0	0	0	117.2
1071	G	37.1	Very low	39.2	Very low	64 Å²	64	133.1 Å²	133.1	66%	0.66	77%	0.773	S	S	*	*			trans	78.7	156.1	174.3	0	0	0	0	0	118.1
1072	S	42.9	Very low	38.9	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	77%	0.768	S	S	*	*			cis	-171	143.3	-21.1	-167.7	0	0	0	0	110.9
1073	Q	42.5	Very low	39	Very low	178 Å²	178	129.2 Å²	129.2	83%	0.832	77%	0.772	S	S	*	*			trans	60.3	163.4	154.8	-76.3	169.3	13.7	0	0	119.7
1074	S	42.1	Very low	38.8	Very low	95 Å²	95	125.8 Å²	125.8	66%	0.664	78%	0.775	S	S	*	*			cis	178.9	157.1	-34.6	-100.6	0	0	0	0	107.8
1075	D	40.8	Very low	39.2	Very low	132 Å²	132	119.1 Å²	119.1	71%	0.706	77%	0.769	S	S	*	*			cis	-162.7	-170.4	-10.9	-135.4	-76.6	0	0	0	111.7
1076	T	41.5	Very low	39	Very low	131 Å²	131	122.9 Å²	122.9	80%	0.804	77%	0.774	S	S	*	*			trans	67.7	143.6	164.7	56.1	0	0	0	0	119.1
1077	A	39.2	Very low	39.1	Very low	83 Å²	83	122.2 Å²	122.2	69%	0.686	77%	0.765	S	S	*	*			cis	-161	166.8	-13.6	0	0	0	0	0	112.7
1078	V	42.1	Very low	39.3	Very low	153 Å²	153	124.8 Å²	124.8	93%	0.927	77%	0.768	S	S	*	*			trans	64.1	126.5	165.4	-158.8	0	0	0	0	118.1
1079	G	35.8	Very low	39.3	Very low	64 Å²	64	127.7 Å²	127.7	66%	0.66	77%	0.773	S	S	*	*			trans	150.6	30.4	162	0	0	0	0	0	121.5
1080	T	39.4	Very low	39.3	Very low	136 Å²	136	125.6 Å²	125.6	83%	0.834	77%	0.769	S	S	*	*			trans	13.5	121.9	152.3	51.2	0	0	0	0	118.9
1081	V	38.7	Very low	39.6	Very low	143 Å²	143	123.4 Å²	123.4	87%	0.867	77%	0.767	S	S	*	*			cis	-148	159.8	9.5	-173.3	0	0	0	0	109
1082	G	34.9	Very low	40	Very low	67 Å²	67	127.8 Å²	127.8	69%	0.691	77%	0.774	S	S	*	*			trans	-60.3	152.7	-170.7	0	0	0	0	0	117.1
1083	A	35.9	Very low	39.9	Very low	114 Å²	114	128.8 Å²	128.8	94%	0.942	78%	0.781	S	S	*	*			cis	89.2	140.5	42.9	0	0	0	0	0	113.2
1084	G	35.1	Very low	40	Very low	82 Å²	82	124.1 Å²	124.1	85%	0.845	77%	0.773	S	S	*	*			cis	178.9	179.9	-4	0	0	0	0	0	109.3
1085	G	39.4	Very low	40.1	Very low	67 Å²	67	129.1 Å²	129.1	69%	0.691	78%	0.783	S	S	*	*			cis	-111.5	-150.1	-9.1	0	0	0	0	0	112.4
1086	K	38	Very low	40.1	Very low	210 Å²	210	129.8 Å²	129.8	91%	0.913	79%	0.791	S	S	*	*			cis	80.2	137.5	8.3	-50	170.6	-176.7	174.4	0	116.7
1087	K	38.1	Very low	40	Very low	142 Å²	142	129.6 Å²	129.6	62%	0.617	79%	0.79	S	S	*	*			cis	-179.2	160.4	-33.4	-126.6	-176.5	175.8	-168.7	0	112.3	E1114	K1087-E1114 WeakPolarHBondContact CE-OE1 3.25Å; K1087-E1114 IonicContact NZ-OE1 2.68Å; K1087-E1114 PolarHBondContact NZ-OE1 3.38Å; K1087-E1114 IonicContact NZ-OE2 3.35Å
1088	R	40.8	Very low	40	Very low	212 Å²	212	129.7 Å²	129.7	80%	0.8	79%	0.791	S	S	*	*			trans	73	150.7	161.1	-65.3	166.3	169.5	179.7	-6	117.7
1089	R	42.8	Very low	39.9	Very low	206 Å²	206	130.7 Å²	130.7	78%	0.777	79%	0.789	S	S	*	*			cis	88.2	134.7	22.3	-153.2	-156.8	-161.8	-104.7	12.7	113.1
1090	S	40.6	Very low	40	Very low	98 Å²	98	134.2 Å²	134.2	69%	0.685	80%	0.797	S	S	*	*			cis	-117.7	-130.7	15.1	-46	0	0	0	0	112.9
1091	S	43	Very low	39.9	Very low	119 Å²	119	132.4 Å²	132.4	83%	0.832	79%	0.79	S	S	*	*			cis	-135.5	-146	5.3	68	0	0	0	0	113.6
1092	L	46.5	Very low	40.1	Very low	156 Å²	156	136.8 Å²	136.8	82%	0.817	79%	0.791	S	S	*	*			trans	-167.7	157.5	-147.5	-105	163.3	0	0	0	118.8
1093	S	40.6	Very low	40.3	Very low	116 Å²	116	145.6 Å²	145.6	81%	0.811	80%	0.804	S	S	*	*			trans	80.3	157.5	158.9	85.5	0	0	0	0	118.7
1094	A	44.7	Very low	40.2	Very low	81 Å²	81	145.4 Å²	145.4	67%	0.669	80%	0.796	S	S	*	*			cis	-154	146.8	6.8	0	0	0	0	0	116.4
1095	K	43.6	Very low	40.5	Very low	199 Å²	199	151.4 Å²	151.4	87%	0.865	79%	0.793	S	S	*	*			trans	34.2	135.5	143.1	-52.9	168.2	-174.9	170.5	0	122.9
1096	V	41.4	Very low	40.3	Very low	146 Å²	146	152.8 Å²	152.8	89%	0.885	79%	0.792	S	S	*	*				178.1	161.5	109.9	151.6	0	0	0	0	113.9
1097	V	39.2	Very low	40	Very low	128 Å²	128	148.8 Å²	148.8	78%	0.776	79%	0.785	S	S	*	*			trans	-64.7	133.9	-161	173.4	0	0	0	0	120.2
1098	A	39	Very low	39.8	Very low	85 Å²	85	147 Å²	147	70%	0.702	79%	0.791	S	S	*	*			trans	40.3	137.7	142	0	0	0	0	0	125.3
1099	I	40.4	Very low	39.7	Very low	173 Å²	173	145.2 Å²	145.2	89%	0.887	79%	0.791	S	S	*	*				-163	169.3	120.7	-101.9	161.3	0	0	0	110.5
1100	V	38.5	Very low	39.5	Very low	138 Å²	138	142.1 Å²	142.1	84%	0.836	79%	0.79	S	S	*	*			trans	-85.9	130.3	-167.3	175	0	0	0	0	114.2
1101	S	37.2	Very low	39.2	Very low	98 Å²	98	142 Å²	142	69%	0.685	79%	0.788	S	S	*	*			trans	-174.3	139.5	130.2	-156.4	0	0	0	0	115.4
1102	R	42.7	Very low	39.1	Very low	235 Å²	235	144.1 Å²	144.1	89%	0.887	79%	0.785	S	S	*	*			trans	23.4	145.6	151.2	-62	176.2	-179.5	-174.5	0.4	123.4
1103	R	39.3	Very low	38.6	Very low	252 Å²	252	141.3 Å²	141.3	95%	0.951	78%	0.775	S	S	*	*			trans	87	161.1	154.5	-111.3	171.2	-178.2	161.6	-1.5	117.8
1104	S	33.9	Very low	38.4	Very low	111 Å²	111	141.4 Å²	141.4	78%	0.776	76%	0.762	S	S	*	*			trans	-125	149.6	-152.3	-26.5	0	0	0	0	113.3
1105	R	41.3	Very low	37.9	Very low	208 Å²	208	142.8 Å²	142.8	79%	0.785	77%	0.767	S	S	*	*			trans	-178.3	154.9	136.7	-102.1	162.2	178.6	-157.1	-4.7	113	I753	I753-R1105 PolarHBondContact O-NH2 2.91Å
1106	S	34.3	Very low	37.5	Very low	96 Å²	96	136.7 Å²	136.7	67%	0.671	76%	0.76	S	S	*	*			trans	27.2	109.3	143.8	-52.5	0	0	0	0	119.5
1107	T	32.5	Very low	37.1	Very low	126 Å²	126	138.8 Å²	138.8	77%	0.773	76%	0.76	S	S	*	*				93.9	130.8	76.6	56.9	0	0	0	0	115.8
1108	S	34.1	Very low	37.1	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	76%	0.763	S	S	*	*			trans	56.8	126.7	154.9	60.4	0	0	0	0	121.5
1109	Q	37.8	Very low	36.7	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.813	77%	0.772	S	S	*	*				-171.1	136.5	127.1	-103	168.7	68.7	0	0	113.1
1110	L	38.8	Very low	36.4	Very low	141 Å²	141	147.4 Å²	147.4	74%	0.738	77%	0.772	S	S	*	*			trans	57.5	130.1	145.4	-53.6	168.9	0	0	0	119.5
1111	S	35.4	Very low	36.3	Very low	94 Å²	94	150 Å²	150	66%	0.657	77%	0.772	S	S	*	*			cis	75.4	152.1	46.9	94.2	0	0	0	0	113.5
1112	Q	39.7	Very low	36.2	Very low	164 Å²	164	150.3 Å²	150.3	77%	0.766	77%	0.774	S	S	*	*			cis	-163.8	-176.2	3.5	-143.1	-167.8	109.2	0	0	107.8
1113	T	37.1	Very low	35.7	Very low	97 Å²	97	146 Å²	146	60%	0.595	78%	0.775	S	S	*	*			cis	-157.3	178.3	2.9	-39.6	0	0	0	0	109.5
1114	E	35.3	Very low	35.5	Very low	119 Å²	119	141.8 Å²	141.8	56%	0.556	77%	0.769	S	S	*	*			trans	67.4	144.9	176.7	-71.8	-170.8	119.3	0	0	115.8	K1087	K1087-E1114 WeakPolarHBondContact CE-OE1 3.25Å; K1087-E1114 IonicContact NZ-OE1 2.68Å; K1087-E1114 PolarHBondContact NZ-OE1 3.38Å; K1087-E1114 IonicContact NZ-OE2 3.35Å
1115	S	34.8	Very low	35.9	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	75%	0.751	S	S	*	*			cis	-174	150	-19.9	54	0	0	0	0	111.1
1116	G	35.3	Very low	35.3	Very low	70 Å²	70	142.1 Å²	142.1	72%	0.722	76%	0.757	S	S	*	*			trans	138.8	78	156.7	0	0	0	0	0	121.3
1117	H	33.1	Very low	35.6	Very low	190 Å²	190	142.4 Å²	142.4	88%	0.88	76%	0.759	S	S	*	*			trans	53	140.5	153.2	-63.8	-80.5	0	0	0	124.2
1118	K	38	Very low	36	Very low	193 Å²	193	141.8 Å²	141.8	84%	0.839	76%	0.755	S	S	*	*			trans	76	81.5	157.9	-67	171.8	-177.5	174.9	0	120.3
1119	K	31.5	Very low	35.9	Very low	203 Å²	203	144.4 Å²	144.4	88%	0.883	76%	0.755	S	S	*	*			trans	68.4	155.4	145.8	-59.7	-175.4	175.5	-178.1	0	119.6
1120	L	34	Very low	36	Very low	171 Å²	171	142.1 Å²	142.1	90%	0.895	75%	0.754	S	S	*	*			trans	78	82.6	165.4	-53.7	177.6	0	0	0	120.3
1121	K	35.4	Very low	35.8	Very low	194 Å²	194	138.7 Å²	138.7	84%	0.843	75%	0.753	S	S	*	*			trans	-165.4	113.6	149.2	-135.1	152.7	-176.6	174.7	0	107.9
1122	S	36.5	Very low	35.7	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	76%	0.761	S	S	*	*				73.8	90.2	64	93.3	0	0	0	0	114.6
1123	T	31.9	Very low	35.4	Very low	145 Å²	145	139.8 Å²	139.8	89%	0.89	77%	0.768	S	S	*	*			trans	-111.1	158.7	166.2	-62.7	0	0	0	0	109.3
1124	I	34.3	Very low	35.3	Very low	163 Å²	163	140.1 Å²	140.1	84%	0.836	78%	0.78	S	S	*	*			trans	-102.1	110.4	-162.6	-60.4	166.1	0	0	0	111.3
1125	Q	42.6	Very low	35.5	Very low	85 Å²	85	140.9 Å²	140.9	40%	0.397	78%	0.784	S	S	.	*			trans	-95.2	139.5	160.8	-87.7	168.1	-38.5	0	0	110.4	D675 S1127	D675-Q1125 PolarHBondContact OD1-NE2 2.97Å; D675-Q1125 PolarHBondContact OD2-NE2 2.89Å; Q1125-S1127 PolarHBondContact O-N 2.76Å; Q1125-S1127 VanDerWaalsContact O-N 3.14Å; Q1125-S1127 PolarHBondContact O-OG 2.86Å
1126	R	29.5	Very low	35.8	Very low	241 Å²	241	145 Å²	145	91%	0.909	79%	0.794	S	S	*	*			trans	-65.7	108.7	170	-74.5	176.1	167.2	177.6	-5.4	108.5	T1128	R1126-T1128 PolarHBondContact O-N 3.25Å
1127	S	40.1	Very low	35.9	Very low	101 Å²	101	150.1 Å²	150.1	71%	0.706	79%	0.791	S	S	*	*			trans	-82.4	110	-168.5	-46.2	0	0	0	0	112.2	Q1125	Q1125-S1127 PolarHBondContact O-N 2.76Å; Q1125-S1127 VanDerWaalsContact O-N 3.14Å; Q1125-S1127 PolarHBondContact O-OG 2.86Å
1128	T	40.7	Very low	36.1	Very low	114 Å²	114	150.1 Å²	150.1	70%	0.699	79%	0.789	S	S	*	*			trans	-64.3	148.7	170.9	-45.6	0	0	0	0	111.7	R1126	R1126-T1128 PolarHBondContact O-N 3.25Å
1129	E	32.1	Very low	36	Very low	159 Å²	159	148.6 Å²	148.6	74%	0.743	79%	0.786	S	S	*	*			trans	-72.1	125.3	177.4	-173.3	179	113.2	0	0	112.3
1130	T	39.9	Very low	36.3	Very low	127 Å²	127	145 Å²	145	78%	0.779	78%	0.781	S	S	*	*			trans	-160	128.2	161	-61	0	0	0	0	108.5
1131	G	33.6	Very low	36.5	Very low	69 Å²	69	147.5 Å²	147.5	71%	0.711	78%	0.779	S	S	*	*			trans	-94.3	143.9	177.1	0	0	0	0	0	113.4
1132	M	34	Very low	36.6	Very low	171 Å²	171	146.5 Å²	146.5	84%	0.842	78%	0.777	S	S	*	*			trans	-154.4	134.5	156.1	-83.9	-162.8	169.9	0	0	109.8
1133	A	34.7	Very low	36.7	Very low	110 Å²	110	147 Å²	147	91%	0.909	78%	0.778	S	S	*	*			trans	-149.6	98.8	161	0	0	0	0	0	108.7
1134	A	34.6	Very low	37	Very low	103 Å²	103	145.6 Å²	145.6	85%	0.851	77%	0.774	S	S	*	*			trans	-141.9	108.9	172.5	0	0	0	0	0	108.2
1135	E	38.4	Very low	37.2	Very low	135 Å²	135	147.5 Å²	147.5	63%	0.631	77%	0.771	S	S	*	*			trans	-156.6	100.7	166.4	-167.9	166.4	-98.7	0	0	112.3	R1137	E1135-R1137 HydrophobicContact CG-CG 4.49Å; E1135-R1137 IonicContact OE1-CZ 2.69Å; E1135-R1137 VanDerWaalsContact OE1-CZ 3.22Å; E1135-R1137 IonicContact OE1-NH1 2.72Å; E1135-R1137 PolarHBondContact OE1-NH1 3.08Å; E1135-R1137 IonicContact OE1-NH2 3.95Å; E1135-R1137 PolarHBondContact OE1-NH2 3.32Å; E1135-R1137 IonicContact OE2-CZ 3.43Å; E1135-R1137 IonicContact OE2-NH1 3.33Å; E1135-R1137 PolarHBondContact OE2-NH1 3.09Å; E1135-R1137 IonicContact OE2-NH2 3.3Å; E1135-R1137 PolarHBondContact OE2-NH2 3.19Å
1136	M	42.2	Very low	37	Very low	198 Å²	198	149.9 Å²	149.9	98%	0.975	78%	0.781	S	S	*	*			trans	-132.3	151.3	141.3	-67.2	-162.2	-170	0	0	107.5
1137	R	37.6	Very low	37.4	Very low	176 Å²	176	143.1 Å²	143.1	66%	0.664	77%	0.771	S	S	*	*			trans	-118.2	160.7	-164	-68.9	-179.3	166.5	82	10.4	112.2	E1135	E1135-R1137 HydrophobicContact CG-CG 4.49Å; E1135-R1137 IonicContact OE1-CZ 2.69Å; E1135-R1137 VanDerWaalsContact OE1-CZ 3.22Å; E1135-R1137 IonicContact OE1-NH1 2.72Å; E1135-R1137 PolarHBondContact OE1-NH1 3.08Å; E1135-R1137 IonicContact OE1-NH2 3.95Å; E1135-R1137 PolarHBondContact OE1-NH2 3.32Å; E1135-R1137 IonicContact OE2-CZ 3.43Å; E1135-R1137 IonicContact OE2-NH1 3.33Å; E1135-R1137 PolarHBondContact OE2-NH1 3.09Å; E1135-R1137 IonicContact OE2-NH2 3.3Å; E1135-R1137 PolarHBondContact OE2-NH2 3.19Å
1138	K	37	Very low	37.4	Very low	191 Å²	191	144.3 Å²	144.3	83%	0.83	77%	0.774	S	S	*	*			trans	73.3	141.3	155	-84.6	-178	177.6	-173.5	0	115.2
1139	M	36	Very low	37.1	Very low	160 Å²	160	146.8 Å²	146.8	79%	0.788	78%	0.783	S	S	*	*			cis	-143.5	147.6	6.7	-66.4	-160.8	-71.7	0	0	114.2
1140	V	38	Very low	37.5	Very low	128 Å²	128	143.1 Å²	143.1	78%	0.776	79%	0.788	S	S	*	*			trans	49.9	120.9	133.6	-176.4	0	0	0	0	122
1141	R	36.6	Very low	37.3	Very low	224 Å²	224	142.3 Å²	142.3	85%	0.845	79%	0.788	S	S	*	*			trans	16.3	152	137	-79.3	177.8	170.4	167.9	-5.2	120.9
1142	Q	37.5	Very low	37.6	Very low	173 Å²	173	146.4 Å²	146.4	81%	0.808	79%	0.791	S	S	*	*			cis	-152.9	173.6	21.3	-129.4	175.9	-85	0	0	111.6
1143	P	39.5	Very low	37.4	Very low	115 Å²	115	145.2 Å²	145.2	75%	0.747	79%	0.789	S	S	*	*			trans	-116.6	161.5	-170.9	41.4	-30.6	0	0	0	116.9
1144	S	38.2	Very low	37.2	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	79%	0.785	S	S	*	*			trans	-176.7	156.9	161.8	51	0	0	0	0	109.9
1145	R	39.2	Very low	37	Very low	204 Å²	204	151.2 Å²	151.2	77%	0.77	79%	0.785	S	S	*	*			cis	-159.9	154.8	-29.3	-93.9	-164.7	92.1	161.4	0.6	106.2
1146	E	37.9	Very low	36.7	Very low	134 Å²	134	149 Å²	149	63%	0.626	79%	0.785	S	S	*	*			trans	30.4	149.7	149.2	-78.7	90.1	126.5	0	0	122.8
1147	S	37.8	Very low	36.1	Very low	99 Å²	99	145.6 Å²	145.6	69%	0.692	78%	0.781	S	S	*	*			cis	-174.9	176.8	-4.6	54.3	0	0	0	0	113.5
1148	T	40.4	Very low	35.7	Very low	126 Å²	126	146.8 Å²	146.8	77%	0.773	79%	0.794	S	S	*	*			trans	96.4	137.4	146.5	-46.5	0	0	0	0	120.5
1149	D	35	Very low	35.3	Very low	167 Å²	167	141 Å²	141	89%	0.893	79%	0.788	S	S	*	*			trans	-81.1	171.4	-170.9	-55.3	-89.7	0	0	0	117.7
1150	G	39	Very low	35.1	Very low	81 Å²	81	138.1 Å²	138.1	84%	0.835	78%	0.776	S	S	*	*			trans	-176.3	108.9	164.5	0	0	0	0	0	114.8
1151	S	35.9	Very low	34.9	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	79%	0.785	S	S	*	*			trans	-75	164.6	174.6	56.7	0	0	0	0	112.7
1152	I	40	Very low	34.9	Very low	154 Å²	154	133.8 Å²	133.8	79%	0.79	76%	0.763	S	S	*	*				-158	170.1	56	56.4	168.2	0	0	0	114.4
1153	N	30	Very low	34.8	Very low	146 Å²	146	134.4 Å²	134.4	78%	0.781	76%	0.764	S	S	*	*			trans	-70.5	152	179.8	-46.9	-17.9	0	0	0	114
1154	S	30.9	Very low	34.4	Very low	118 Å²	118	135.5 Å²	135.5	83%	0.825	77%	0.771	S	S	*	*				179.1	132.1	109.2	-78.7	0	0	0	0	116
1155	Y	30.4	Very low	34.3	Very low	221 Å²	221	134 Å²	134	87%	0.867	77%	0.773	S	S	*	*			trans	66.4	108.2	147.2	-134.1	-108	0	0	0	122.2
1156	S	31.6	Very low	34.3	Very low	88 Å²	88	129.3 Å²	129.3	62%	0.615	77%	0.767	S	S	*	*			trans	57.2	87.9	138.2	-53.3	0	0	0	0	120.3
1157	S	29.5	Very low	34.1	Very low	128 Å²	128	134.8 Å²	134.8	90%	0.895	78%	0.782	S	S	*	*			trans	-164.3	-180	133.9	35.5	0	0	0	0	111
1158	E	29.6	Very low	34.2	Very low	201 Å²	201	132 Å²	132	94%	0.939	76%	0.761	S	S	*	*			trans	-74.6	148.3	-164.6	-50.8	177.4	139.5	0	0	114.1
1159	G	28.5	Very low	34.1	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	75%	0.745	S	S	*	*			trans	110.5	144.7	153	0	0	0	0	0	118.5
1160	N	31.5	Very low	34.4	Very low	99 Å²	99	125.2 Å²	125.2	53%	0.529	74%	0.736	S	S	.	*			trans	51	111.2	152.4	-64.6	-5.5	0	0	0	120.7	I1162	N1160-I1162 HydrophobicContact CB-CD1 3.89Å; N1160-I1162 HydrophobicContact CB-CG1 4.12Å
1161	L	35.1	Very low	34.5	Very low	185 Å²	185	129 Å²	129	97%	0.969	74%	0.736	S	S	*	*			trans	-122.7	142.5	138	-76.8	179.7	0	0	0	109.9
1162	I	36	Very low	34.9	Very low	76 Å²	76	126.7 Å²	126.7	39%	0.39	72%	0.721	S	S	.	*			trans	-135.1	140.9	-151.8	-64.3	160.2	0	0	0	110.3	N1160 V1168	N1160-I1162 HydrophobicContact CB-CD1 3.89Å; N1160-I1162 HydrophobicContact CB-CG1 4.12Å; I1162-V1168 HydrophobicContact CB-CG2 4.46Å; I1162-V1168 HydrophobicContact CD1-CB 3.65Å; I1162-V1168 HydrophobicContact CD1-CG1 4.21Å; I1162-V1168 HydrophobicContact CD1-CG2 3.73Å; I1162-V1168 HydrophobicContact CG1-CB 4.3Å; I1162-V1168 HydrophobicContact CG1-CG2 3.88Å; I1162-V1168 HydrophobicContact CG2-CG2 3.68Å
1163	F	34.9	Very low	35.4	Very low	187 Å²	187	124.4 Å²	124.4	82%	0.82	71%	0.706	S	S	*	*			trans	-61.8	124.2	169.7	-68.6	-89.6	0	0	0	110.6	G1165	F1163-G1165 PolarHBondContact O-N 2.82Å
1164	P	31.5	Very low	35.9	Very low	138 Å²	138	125.7 Å²	125.7	90%	0.896	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	106.5	-174.9	25.9	-34.1	0	0	0	111.2
1165	G	35.2	Very low	36.5	Very low	81 Å²	81	122.8 Å²	122.8	84%	0.835	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	155.6	-21.5	177.7	0	0	0	0	0	115.7	F1163	F1163-G1165 PolarHBondContact O-N 2.82Å
1166	V	39	Very low	37.2	Very low	106 Å²	106	117.2 Å²	117.2	64%	0.642	67%	0.67	S	S	*	*	S	Bend	trans	-113.8	129.7	-179.2	-175.8	0	0	0	0	110.4	V1168	V1166-V1168 PolarHBondContact O-N 2.77Å
1167	R	34.1	Very low	38.1	Very low	250 Å²	250	120.3 Å²	120.3	94%	0.943	67%	0.673	S	S	*	*			trans	-71.3	113.7	170.5	-61.9	-174.7	-164.9	-107.3	6.1	108.5
1168	V	39.9	Very low	39.5	Very low	41 Å²	41	116.8 Å²	116.8	25%	0.248	64%	0.644	C	S	.	*			trans	-94.2	107.4	175.8	177.4	0	0	0	0	108.8	I1162 V1166	I1162-V1168 HydrophobicContact CB-CG2 4.46Å; I1162-V1168 HydrophobicContact CD1-CB 3.65Å; I1162-V1168 HydrophobicContact CD1-CG1 4.21Å; I1162-V1168 HydrophobicContact CD1-CG2 3.73Å; I1162-V1168 HydrophobicContact CG1-CB 4.3Å; I1162-V1168 HydrophobicContact CG1-CG2 3.88Å; I1162-V1168 HydrophobicContact CG2-CG2 3.68Å; V1166-V1168 PolarHBondContact O-N 2.77Å
1169	G	39	Very low	40.9	Very low	43 Å²	43	112.6 Å²	112.6	44%	0.443	63%	0.628	S	S	.	*			trans	-75.4	161.6	156.4	0	0	0	0	0	110.2
1170	P	40.6	Very low	43.1	Very low	107 Å²	107	111.5 Å²	111.5	70%	0.695	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	167.7	165.4	28.4	-34.6	0	0	0	111.3	S1172	P1170-S1172 VanDerWaalsContact C-N 3.32Å; P1170-S1172 PolarHBondContact O-N 2.76Å; P1170-S1172 VanDerWaalsContact O-N 3.11Å
1171	D	40.6	Very low	45.7	Very low	159 Å²	159	108.8 Å²	108.8	85%	0.85	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.2	-5.8	167.5	-46	-34.9	0	0	0	119.2
1172	S	46	Very low	48.3	Very low	64 Å²	64	100.1 Å²	100.1	45%	0.448	56%	0.558	S	S	.	*			trans	-97.3	-38.5	-172.6	-158.6	0	0	0	0	117.4	P1170 F1174 S1175	P1170-S1172 VanDerWaalsContact C-N 3.32Å; P1170-S1172 PolarHBondContact O-N 2.76Å; P1170-S1172 VanDerWaalsContact O-N 3.11Å; S1172-F1174 PolarHBondContact O-N 2.94Å; S1172-S1175 VanDerWaalsContact O-CB 3.29Å; S1172-S1175 WeakPolarHBondContact O-CB 3.19Å; S1172-S1175 PolarHBondContact O-N 3.36Å; S1172-S1175 VanDerWaalsContact O-N 3.09Å; S1172-S1175 PolarHBondContact O-OG 2.77Å
1173	Q	48.7	Very low	51	Low	105 Å²	105	99 Å²	99	49%	0.491	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	-19.3	-160.2	-81.8	-167	-4.7	0	0	117
1174	F	41	Very low	53.8	Low	173 Å²	173	90.4 Å²	90.4	76%	0.759	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-23.5	175.2	-138.1	-88.4	0	0	0	112	S1172 L1178	S1172-F1174 PolarHBondContact O-N 2.94Å; F1174-L1178 HydrophobicContact CD1-CD1 4.39Å
1175	S	44.1	Very low	56.8	Low	57 Å²	57	84.4 Å²	84.4	40%	0.399	48%	0.479	S	S	.	.	H	α-helix	trans	-66.9	-45.8	179.3	-52	0	0	0	0	110.9	S1172 F1177 L1178 D1179	S1172-S1175 VanDerWaalsContact O-CB 3.29Å; S1172-S1175 WeakPolarHBondContact O-CB 3.19Å; S1172-S1175 PolarHBondContact O-N 3.36Å; S1172-S1175 VanDerWaalsContact O-N 3.09Å; S1172-S1175 PolarHBondContact O-OG 2.77Å; S1175-F1177 PolarHBondContact O-N 2.8Å; S1175-L1178 CarbonylContact O-C 3.43Å; S1175-L1178 WeakPolarHBondContact O-CA 3.47Å; S1175-L1178 PolarHBondContact O-N 2.79Å; S1175-D1179 WeakPolarHBondContact O-CB 3.43Å; S1175-D1179 PolarHBondContact O-N 3.06Å
1176	D	45.4	Very low	59.4	Low	104 Å²	104	81.8 Å²	81.8	56%	0.556	45%	0.445	S	S	*	.	H	α-helix	trans	-54.5	-28.9	-178.2	-63.9	-44	0	0	0	114.2
1177	F	49.9	Very low	61.6	Low	154 Å²	154	77.6 Å²	77.6	68%	0.675	42%	0.42	S	S	*	.	H	α-helix	trans	-83.3	-28.1	177.2	-77.3	-86.1	0	0	0	113.7	S1175	S1175-F1177 PolarHBondContact O-N 2.8Å
1178	L	57.9	Low	63.7	Low	53 Å²	53	65.8 Å²	65.8	28%	0.277	38%	0.376	S	S	.	.	H	α-helix	trans	-83.7	-25.2	173.5	-63	174.6	0	0	0	111.4	F1174 S1175 L1181 L1192 L1330	F1174-L1178 HydrophobicContact CD1-CD1 4.39Å; S1175-L1178 CarbonylContact O-C 3.43Å; S1175-L1178 WeakPolarHBondContact O-CA 3.47Å; S1175-L1178 PolarHBondContact O-N 2.79Å; L1178-L1181 WeakPolarHBondContact O-CG 3.2Å; L1178-L1181 PolarHBondContact O-N 2.93Å; L1178-L1192 HydrophobicContact CD2-CD1 4.49Å; L1178-L1192 HydrophobicContact CD2-CD2 4.42Å; L1178-L1330 HydrophobicContact CD2-CD1 4.35Å
1179	D	59.8	Low	65.5	Low	113 Å²	113	71.3 Å²	71.3	60%	0.604	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	140.9	-168.1	-131.6	-33.4	0	0	0	113.6	S1175 L1181 K1315	S1175-D1179 WeakPolarHBondContact O-CB 3.43Å; S1175-D1179 PolarHBondContact O-N 3.06Å; D1179-L1181 VanDerWaalsContact C-N 3.31Å; D1179-L1181 PolarHBondContact O-N 2.82Å; D1179-K1315 PolarHBondContact O-NZ 3.24Å
1180	G	73.9	Confident	67	Low	47 Å²	47	76.6 Å²	76.6	49%	0.485	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	17.6	-173.4	0	0	0	0	0	115.7	K1315	G1180-K1315 WeakPolarHBondContact O-CE 3.24Å
1181	L	86.9	Confident	68.9	Low	41 Å²	41	71.8 Å²	71.8	22%	0.215	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-68.3	151.3	153.3	-75.1	174.9	0	0	0	110.2	L1178 D1179 V1187 L1192 K1315 F1317	L1178-L1181 WeakPolarHBondContact O-CG 3.2Å; L1178-L1181 PolarHBondContact O-N 2.93Å; D1179-L1181 VanDerWaalsContact C-N 3.31Å; D1179-L1181 PolarHBondContact O-N 2.82Å; L1181-V1187 HydrophobicContact CD1-CG2 4.38Å; L1181-V1187 HydrophobicContact CD2-CG2 3.66Å; L1181-L1192 HydrophobicContact CD1-CD2 4.16Å; L1181-K1315 HydrophobicContact CD2-CB 4.49Å; L1181-K1315 HydrophobicContact CD2-CD 4.05Å; L1181-F1317 HydrophobicContact CD2-CE2 4.24Å; L1181-F1317 HydrophobicContact CD2-CZ 4.29Å
1182	G	90.5	Very high	70.5	Confident	4 Å²	4	66.9 Å²	66.9	4%	0.041	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-75	159.8	179.5	0	0	0	0	0	113.7	A1184 Q1185 W1313	G1182-A1184 PolarHBondContact O-N 2.86Å; G1182-Q1185 WeakPolarHBondContact O-CB 3.23Å; G1182-Q1185 PolarHBondContact O-N 3.45Å; G1182-W1313 WeakPolarHBondContact CA-O 3.39Å; G1182-W1313 PolarHBondContact N-O 2.75Å
1183	P	93.1	Very high	71.8	Confident	53 Å²	53	68.3 Å²	68.3	34%	0.344	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	125.8	171.6	-26.9	34.2	0	0	0	111.7	Q1185 L1304 V1310 Y1314	P1183-Q1185 PolarHBondContact O-N 3.43Å; P1183-Q1185 VanDerWaalsContact O-N 3.09Å; P1183-L1304 HydrophobicContact CB-CD2 3.63Å; P1183-V1310 HydrophobicContact CB-CG1 4.34Å; P1183-V1310 HydrophobicContact CG-CG1 4.49Å; P1183-Y1314 WeakPolarHBondContact CD-OH 3.31Å; P1183-Y1314 VanDerWaalsContact O-CE1 3.27Å; P1183-Y1314 WeakPolarHBondContact O-CE1 3.42Å; P1183-Y1314 PolarHBondContact O-OH 3.01Å
1184	A	92.5	Very high	73.4	Confident	5 Å²	5	65.5 Å²	65.5	4%	0.041	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	24.3	-175.6	0	0	0	0	0	115.9	G1182 L1186 I1299 L1300 E1303 L1304	G1182-A1184 PolarHBondContact O-N 2.86Å; A1184-L1186 PolarHBondContact O-N 3.41Å; A1184-I1299 HydrophobicContact CB-CG2 4.17Å; A1184-I1299 WeakPolarHBondContact O-CA 3.39Å; A1184-L1300 HydrophobicContact CB-CB 4.5Å; A1184-L1300 WeakPolarHBondContact CB-O 3.29Å; A1184-L1300 PolarHBondContact O-N 2.84Å; A1184-E1303 HydrophobicContact CB-CB 3.45Å; A1184-E1303 VanDerWaalsContact CB-CB 3.45Å; A1184-E1303 HydrophobicContact CB-CG 4.38Å; A1184-L1304 HydrophobicContact CB-CD1 4.42Å; A1184-L1304 HydrophobicContact CB-CD2 3.58Å; A1184-L1304 HydrophobicContact CB-CG 3.81Å
1185	Q	94	Very high	75.5	Confident	12 Å²	12	62.5 Å²	62.5	6%	0.056	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	114.5	-178.5	-171.1	176.8	-11.9	0	0	111.5	G1182 P1183 V1187 Q1298 Y1314 K1315	G1182-Q1185 WeakPolarHBondContact O-CB 3.23Å; G1182-Q1185 PolarHBondContact O-N 3.45Å; P1183-Q1185 PolarHBondContact O-N 3.43Å; P1183-Q1185 VanDerWaalsContact O-N 3.09Å; Q1185-V1187 HydrophobicContact CG-CG2 4.02Å; Q1185-Q1298 CarbonylContact C-O 3.57Å; Q1185-Q1298 WeakPolarHBondContact CA-O 3.2Å; Q1185-Q1298 WeakPolarHBondContact CG-O 3.34Å; Q1185-Y1314 HydrophobicContact CB-CD1 3.92Å; Q1185-Y1314 HydrophobicContact CB-CE1 4.17Å; Q1185-Y1314 HydrophobicContact CG-CD1 4.01Å; Q1185-K1315 PolarHBondContact NE2-O 3.18Å; Q1185-K1315 VanDerWaalsContact OE1-N 3.09Å
1186	L	90.1	Very high	77.7	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.141	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.5	174	-62.2	179.2	0	0	0	110.7	A1184 V1276 Q1298 L1300	A1184-L1186 PolarHBondContact O-N 3.41Å; L1186-V1276 HydrophobicContact CD1-CG1 4Å; L1186-V1276 HydrophobicContact CD1-CG2 3.92Å; L1186-Q1298 HydrophobicContact CB-CB 3.94Å; L1186-Q1298 PolarHBondContact N-O 2.96Å; L1186-L1300 HydrophobicContact CD1-CB 4.14Å; L1186-L1300 HydrophobicContact CD2-CB 4.12Å; L1186-L1300 HydrophobicContact CG-CB 4.1Å
1187	V	85.9	Confident	80	Confident	18 Å²	18	58.6 Å²	58.6	11%	0.109	33%	0.331	C	S	.	.			trans	-141	116.4	178.2	-177.5	0	0	0	0	109.4	L1181 Q1185 T1191 L1192 F1317	L1181-V1187 HydrophobicContact CD1-CG2 4.38Å; L1181-V1187 HydrophobicContact CD2-CG2 3.66Å; Q1185-V1187 HydrophobicContact CG-CG2 4.02Å; V1187-T1191 HydrophobicContact CG1-CG2 3.78Å; V1187-L1192 HydrophobicContact CB-CD2 4.28Å; V1187-L1192 HydrophobicContact CG1-CD2 3.83Å; V1187-L1192 HydrophobicContact CG1-CG 4.34Å; V1187-F1317 HydrophobicContact CG1-CE2 4.1Å; V1187-F1317 HydrophobicContact CG1-CZ 4.35Å; V1187-F1317 HydrophobicContact CG2-CD2 4.33Å; V1187-F1317 HydrophobicContact CG2-CE2 3.69Å; V1187-F1317 HydrophobicContact CG2-CZ 4.46Å
1188	G	77.8	Confident	82.2	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.021	30%	0.301	C	S	.	.			trans	-62.2	141.1	176.1	0	0	0	0	0	111.7	Q1190 T1191 D1324	G1188-Q1190 VanDerWaalsContact C-N 3.27Å; G1188-Q1190 PolarHBondContact O-N 3.29Å; G1188-T1191 WeakPolarHBondContact O-CA 3.37Å; G1188-T1191 WeakPolarHBondContact O-CB 3.23Å; G1188-T1191 PolarHBondContact O-N 3.05Å; G1188-T1191 PolarHBondContact O-OG1 3.03Å; G1188-D1324 VanDerWaalsContact CA-O 3.3Å; G1188-D1324 WeakPolarHBondContact CA-O 3.3Å
1189	R	77.4	Confident	84.1	Confident	157 Å²	157	50.2 Å²	50.2	59%	0.592	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-51.8	-39	-166.2	-64	-177.3	179.3	-150.3	-5.8	114.7	T1191 L1192	R1189-T1191 PolarHBondContact O-N 3.44Å; R1189-L1192 PolarHBondContact O-N 2.65Å
1190	Q	71.3	Confident	85.9	Confident	153 Å²	153	44.9 Å²	44.9	72%	0.715	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-66.1	-20.7	178.7	-55.7	-177.1	37.1	0	0	113.2	G1188	G1188-Q1190 VanDerWaalsContact C-N 3.27Å; G1188-Q1190 PolarHBondContact O-N 3.29Å
1191	T	80.6	Confident	87	Confident	6 Å²	6	44 Å²	44	4%	0.037	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-81	-20.5	-178.4	-51.9	0	0	0	0	112.8	V1187 G1188 R1189 A1193 T1194 F1317 S1321	V1187-T1191 HydrophobicContact CG1-CG2 3.78Å; G1188-T1191 WeakPolarHBondContact O-CA 3.37Å; G1188-T1191 WeakPolarHBondContact O-CB 3.23Å; G1188-T1191 PolarHBondContact O-N 3.05Å; G1188-T1191 PolarHBondContact O-OG1 3.03Å; R1189-T1191 PolarHBondContact O-N 3.44Å; T1191-A1193 PolarHBondContact O-N 3.23Å; T1191-A1193 VanDerWaalsContact O-N 3.12Å; T1191-T1194 WeakPolarHBondContact O-CA 3.46Å; T1191-T1194 VanDerWaalsContact O-CB 3.25Å; T1191-T1194 WeakPolarHBondContact O-CB 3.07Å; T1191-T1194 PolarHBondContact O-N 2.83Å; T1191-F1317 HydrophobicContact CG2-CB 3.84Å; T1191-F1317 HydrophobicContact CG2-CD1 3.37Å; T1191-F1317 HydrophobicContact CG2-CD2 4.01Å; T1191-F1317 HydrophobicContact CG2-CE1 3.83Å; T1191-F1317 HydrophobicContact CG2-CE2 4.4Å; T1191-F1317 HydrophobicContact CG2-CG 3.47Å; T1191-F1317 VanDerWaalsContact CG2-CG 3.47Å; T1191-F1317 HydrophobicContact CG2-CZ 4.32Å; T1191-S1321 VanDerWaalsContact OG1-CA 3.24Å; T1191-S1321 WeakPolarHBondContact OG1-CA 3.13Å; T1191-S1321 VanDerWaalsContact OG1-CB 3.31Å; T1191-S1321 WeakPolarHBondContact OG1-CB 3.23Å
1192	L	73.2	Confident	87.6	Confident	57 Å²	57	42.1 Å²	42.1	30%	0.298	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-60.5	-26.3	-178.4	-63.5	171.6	0	0	0	112.9	L1178 L1181 V1187 R1189 L1330	L1178-L1192 HydrophobicContact CD2-CD1 4.49Å; L1178-L1192 HydrophobicContact CD2-CD2 4.42Å; L1181-L1192 HydrophobicContact CD1-CD2 4.16Å; V1187-L1192 HydrophobicContact CB-CD2 4.28Å; V1187-L1192 HydrophobicContact CG1-CD2 3.83Å; V1187-L1192 HydrophobicContact CG1-CG 4.34Å; R1189-L1192 PolarHBondContact O-N 2.65Å; L1192-L1330 HydrophobicContact CD1-CD1 3.92Å; L1192-L1330 HydrophobicContact CD2-CD1 4.48Å
1193	A	74.4	Confident	87.9	Confident	94 Å²	94	41.9 Å²	41.9	78%	0.777	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-90.3	-0.5	172.9	0	0	0	0	0	114.4	T1191	T1191-A1193 PolarHBondContact O-N 3.23Å; T1191-A1193 VanDerWaalsContact O-N 3.12Å
1194	T	81.7	Confident	88.1	Confident	45 Å²	45	39.4 Å²	39.4	28%	0.276	22%	0.221	S	C	.	.	S	Bend	trans	-91	127	-178.6	-60.4	0	0	0	0	110.4	T1191 A1196 P1318	T1191-T1194 WeakPolarHBondContact O-CA 3.46Å; T1191-T1194 VanDerWaalsContact O-CB 3.25Å; T1191-T1194 WeakPolarHBondContact O-CB 3.07Å; T1191-T1194 PolarHBondContact O-N 2.83Å; T1194-A1196 PolarHBondContact O-N 3.31Å; T1194-P1318 HydrophobicContact CG2-CG 3.96Å
1195	P	85.4	Confident	88.3	Confident	110 Å²	110	41 Å²	41	71%	0.714	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-57.6	134.8	174.9	-25.7	34.9	0	0	0	112.5
1196	A	90.5	Very high	88.4	Confident	43 Å²	43	42.7 Å²	42.7	36%	0.355	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-64.9	139.7	174.8	0	0	0	0	0	111	T1194 G1198 K1315 L1316 F1317	T1194-A1196 PolarHBondContact O-N 3.31Å; A1196-G1198 PolarHBondContact O-N 2.85Å; A1196-K1315 HydrophobicContact CB-CB 4.06Å; A1196-K1315 HydrophobicContact CB-CG 4.31Å; A1196-L1316 CarbonylContact C-O 3.54Å; A1196-L1316 VanDerWaalsContact CA-O 3.3Å; A1196-L1316 WeakPolarHBondContact CA-O 3.46Å; A1196-F1317 HydrophobicContact CB-CE1 4.4Å
1197	M	93.9	Very high	88.6	Confident	36 Å²	36	45.1 Å²	45.1	18%	0.177	25%	0.247	C	C	.	.	S	Bend	trans	-78.1	-0.2	177.1	-63.7	-173	67.3	0	0	113.4	L1221 T1222 F1293 L1316 P1318	M1197-L1221 CarbonylContact O-C 3.51Å; M1197-L1221 WeakPolarHBondContact O-CA 3.26Å; M1197-T1222 WeakPolarHBondContact CA-OG1 3.39Å; M1197-T1222 WeakPolarHBondContact O-CB 3.28Å; M1197-T1222 PolarHBondContact O-N 3.13Å; M1197-T1222 PolarHBondContact O-OG1 2.95Å; M1197-F1293 HydrophobicContact CE-CD1 4.45Å; M1197-F1293 HydrophobicContact SD-CE1 4.02Å; M1197-L1316 HydrophobicContact CB-CB 4.47Å; M1197-L1316 PolarHBondContact N-O 3.21Å; M1197-P1318 HydrophobicContact CG-CG 4.24Å; M1197-P1318 HydrophobicContact SD-CB 4.16Å; M1197-P1318 HydrophobicContact SD-CG 3.91Å
1198	G	95.5	Very high	88.8	Confident	5 Å²	5	54.5 Å²	54.5	5%	0.052	29%	0.286	C	S	.	.			trans	142.3	179.9	-173.8	0	0	0	0	0	109.9	A1196 R1219 S1220 L1316	A1196-G1198 PolarHBondContact O-N 2.85Å; G1198-R1219 WeakPolarHBondContact CA-O 3.32Å; G1198-S1220 WeakPolarHBondContact CA-O 3.31Å; G1198-L1316 VanDerWaalsContact O-CB 3.31Å; G1198-L1316 WeakPolarHBondContact O-CB 3.27Å; G1198-L1316 PolarHBondContact O-N 3.35Å
1199	D	97	Very high	89.4	Confident	27 Å²	27	56 Å²	56	14%	0.144	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	150.2	173.4	-48.7	-54.8	0	0	0	111	A1218 R1219 W1313 Y1314	D1199-A1218 CarbonylContact O-C 3.6Å; D1199-A1218 WeakPolarHBondContact O-CA 3.43Å; D1199-A1218 WeakPolarHBondContact O-CB 3.48Å; D1199-R1219 HydrophobicContact CB-CG 4Å; D1199-R1219 PolarHBondContact N-O 2.71Å; D1199-R1219 PolarHBondContact O-N 3.23Å; D1199-R1219 IonicContact OD2-CZ 2.77Å; D1199-R1219 IonicContact OD2-NE 3.67Å; D1199-R1219 PolarHBondContact OD2-NE 2.87Å; D1199-R1219 IonicContact OD2-NH2 3.5Å; D1199-R1219 PolarHBondContact OD2-NH2 3.16Å; D1199-W1313 HydrophobicContact CB-CE3 3.57Å; D1199-W1313 HydrophobicContact CB-CZ3 3.78Å; D1199-Y1314 WeakPolarHBondContact CA-O 3.36Å
1200	I	98.1	Very high	90.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.1	172	-167.9	163.3	0	0	0	111.5	I1202 V1215 R1217 A1218 V1235 V1279 V1281 W1313 Y1314 L1316	I1200-I1202 HydrophobicContact CD1-CD1 3.87Å; I1200-I1202 HydrophobicContact CG1-CD1 3.81Å; I1200-I1202 HydrophobicContact CG1-CG1 4.15Å; I1200-I1202 HydrophobicContact CG2-CG1 4.2Å; I1200-V1215 HydrophobicContact CD1-CG1 4.38Å; I1200-R1217 WeakPolarHBondContact CG1-O 3.43Å; I1200-A1218 HydrophobicContact CB-CB 4.25Å; I1200-A1218 HydrophobicContact CG1-CB 4.15Å; I1200-V1235 HydrophobicContact CD1-CB 4.41Å; I1200-V1235 HydrophobicContact CD1-CG1 3.89Å; I1200-V1235 HydrophobicContact CD1-CG2 3.58Å; I1200-V1279 HydrophobicContact CD1-CG1 3.81Å; I1200-V1279 HydrophobicContact CG2-CG1 4.36Å; I1200-V1281 HydrophobicContact CD1-CG2 4.02Å; I1200-W1313 VanDerWaalsContact C-CE3 3.46Å; I1200-Y1314 PolarHBondContact N-O 3.26Å; I1200-Y1314 PolarHBondContact O-N 2.82Å; I1200-L1316 HydrophobicContact CB-CD1 4.33Å; I1200-L1316 HydrophobicContact CB-CD2 4.28Å; I1200-L1316 HydrophobicContact CB-CG 4.4Å; I1200-L1316 HydrophobicContact CG2-CD2 3.72Å; I1200-L1316 HydrophobicContact CG2-CG 4.18Å
1201	Q	98.1	Very high	91.4	Very high	30 Å²	30	45 Å²	45	14%	0.14	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120	176.1	-161.1	-175.3	-13.8	0	0	109.3	I1216 R1217 I1311 G1312 W1313	Q1201-I1216 HydrophobicContact CB-CB 4.3Å; Q1201-I1216 HydrophobicContact CG-CB 4.48Å; Q1201-I1216 HydrophobicContact CG-CD1 4.16Å; Q1201-I1216 PolarHBondContact O-N 2.97Å; Q1201-I1216 VanDerWaalsContact O-N 3.14Å; Q1201-R1217 HydrophobicContact CB-CG 3.94Å; Q1201-R1217 PolarHBondContact N-O 3.26Å; Q1201-I1311 HydrophobicContact CG-CG2 4.07Å; Q1201-I1311 VanDerWaalsContact NE2-CG2 3.35Å; Q1201-G1312 WeakPolarHBondContact CA-O 3.27Å; Q1201-W1313 HydrophobicContact CB-CD2 3.9Å; Q1201-W1313 HydrophobicContact CB-CE3 3.77Å; Q1201-W1313 HydrophobicContact CB-CH2 4.04Å; Q1201-W1313 HydrophobicContact CB-CZ2 4.17Å; Q1201-W1313 HydrophobicContact CB-CZ3 3.83Å; Q1201-W1313 HydrophobicContact CG-CD2 4.11Å; Q1201-W1313 HydrophobicContact CG-CE3 4.48Å; Q1201-W1313 HydrophobicContact CG-CG 4.45Å
1202	I	98.2	Very high	92.2	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.1	-175	-58.5	-64.6	0	0	0	109.2	I1200 M1204 V1213 E1214 V1215 V1279 I1311 G1312 Y1314	I1200-I1202 HydrophobicContact CD1-CD1 3.87Å; I1200-I1202 HydrophobicContact CG1-CD1 3.81Å; I1200-I1202 HydrophobicContact CG1-CG1 4.15Å; I1200-I1202 HydrophobicContact CG2-CG1 4.2Å; I1202-M1204 HydrophobicContact CG2-CE 3.98Å; I1202-M1204 HydrophobicContact CG2-CG 4.05Å; I1202-M1204 HydrophobicContact CG2-SD 4.07Å; I1202-V1213 HydrophobicContact CG2-CG1 3.63Å; I1202-E1214 WeakPolarHBondContact CA-O 3.49Å; I1202-V1215 HydrophobicContact CD1-CB 4.29Å; I1202-V1215 HydrophobicContact CD1-CG1 4.11Å; I1202-V1215 HydrophobicContact CD1-CG2 4.05Å; I1202-V1279 HydrophobicContact CD1-CG1 4.06Å; I1202-V1279 HydrophobicContact CG1-CG1 4.42Å; I1202-I1311 WeakPolarHBondContact O-CA 3.27Å; I1202-G1312 PolarHBondContact N-O 2.93Å; I1202-G1312 PolarHBondContact O-N 3Å; I1202-Y1314 HydrophobicContact CB-CD2 4.03Å; I1202-Y1314 HydrophobicContact CB-CE2 3.98Å; I1202-Y1314 HydrophobicContact CG1-CD2 4.15Å
1203	G	97.3	Very high	93.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.7	162.8	0	0	0	0	0	110.8	V1213 E1214 V1310	G1203-V1213 CarbonylContact O-C 3.49Å; G1203-V1213 WeakPolarHBondContact O-CA 3.5Å; G1203-E1214 PolarHBondContact N-O 3.02Å; G1203-E1214 PolarHBondContact O-N 2.79Å; G1203-V1310 CarbonylContact C-O 3.52Å; G1203-V1310 WeakPolarHBondContact CA-O 3.27Å
1204	M	97.8	Very high	94.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.6	172.3	-71.5	146.5	-61.3	0	0	110.2	I1202 L1211 E1212 V1213 L1277 I1299 L1301 L1304 L1306 M1309 V1310 Y1314	I1202-M1204 HydrophobicContact CG2-CE 3.98Å; I1202-M1204 HydrophobicContact CG2-CG 4.05Å; I1202-M1204 HydrophobicContact CG2-SD 4.07Å; M1204-L1211 HydrophobicContact CB-CD1 4.21Å; M1204-L1211 HydrophobicContact CG-CD1 4.4Å; M1204-E1212 CarbonylContact C-O 3.58Å; M1204-E1212 WeakPolarHBondContact CA-O 3.28Å; M1204-V1213 HydrophobicContact CG-CG1 4.32Å; M1204-V1213 HydrophobicContact CG-CG2 4.29Å; M1204-L1277 HydrophobicContact CG-CD2 4.02Å; M1204-L1277 HydrophobicContact SD-CD2 3.65Å; M1204-I1299 HydrophobicContact CE-CD1 4.11Å; M1204-I1299 HydrophobicContact SD-CD1 3.86Å; M1204-I1299 HydrophobicContact SD-CG2 4.32Å; M1204-L1301 HydrophobicContact CG-CD2 4.44Å; M1204-L1301 HydrophobicContact SD-CD2 3.88Å; M1204-L1304 HydrophobicContact CE-CD1 4.01Å; M1204-L1304 HydrophobicContact SD-CD1 4.31Å; M1204-L1306 HydrophobicContact CB-CD2 3.61Å; M1204-M1309 CarbonylContact O-C 3.6Å; M1204-M1309 WeakPolarHBondContact O-CA 3.28Å; M1204-V1310 PolarHBondContact N-O 2.92Å; M1204-V1310 PolarHBondContact O-N 3.24Å; M1204-Y1314 HydrophobicContact CE-CE2 4.07Å; M1204-Y1314 VanDerWaalsContact CE-OH 3.31Å; M1204-Y1314 WeakPolarHBondContact CE-OH 3.48Å
1205	E	96.5	Very high	95.3	Very high	40 Å²	40	38.4 Å²	38.4	19%	0.187	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	142.9	-178.2	-167.3	179.5	166.6	0	0	109.6	K1207 E1212 M1309	E1205-K1207 HydrophobicContact CG-CG 4.36Å; E1205-K1207 WeakPolarHBondContact OE1-CE 3.49Å; E1205-K1207 IonicContact OE1-NZ 2.73Å; E1205-K1207 WeakPolarHBondContact OE2-CE 3.03Å; E1205-K1207 IonicContact OE2-NZ 3.53Å; E1205-K1207 PolarHBondContact OE2-NZ 3.19Å; E1205-E1212 PolarHBondContact N-O 2.77Å; E1205-E1212 PolarHBondContact O-N 2.86Å; E1205-M1309 HydrophobicContact CB-CB 4.18Å; E1205-M1309 HydrophobicContact CB-CG 4.43Å; E1205-M1309 HydrophobicContact CG-CB 4.33Å; E1205-M1309 WeakPolarHBondContact OE2-CE 3.45Å
1206	D	95.8	Very high	95.9	Very high	46 Å²	46	34.1 Å²	34.1	25%	0.246	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	108.3	171	-170.6	-27.2	0	0	0	110.1	K1208 G1209 Q1210 P1272 L1306	D1206-K1208 PolarHBondContact OD1-N 3.43Å; D1206-G1209 VanDerWaalsContact OD1-CA 3.22Å; D1206-G1209 WeakPolarHBondContact OD1-CA 3.4Å; D1206-G1209 PolarHBondContact OD1-N 3.19Å; D1206-Q1210 PolarHBondContact OD1-N 2.85Å; D1206-P1272 HydrophobicContact CB-CG 4.09Å; D1206-P1272 WeakPolarHBondContact OD2-CD 2.98Å; D1206-P1272 WeakPolarHBondContact OD2-CG 3.4Å; D1206-L1306 HydrophobicContact CB-CB 4.1Å; D1206-L1306 PolarHBondContact N-O 2.85Å
1207	K	93.2	Very high	96.2	Very high	78 Å²	78	37 Å²	37	34%	0.339	18%	0.178	S	C	.	.	S	Bend	trans	-100.9	86.7	175.2	-74.9	179.9	-179.5	142	0	110.5	E1205 Q1210 E1212	E1205-K1207 HydrophobicContact CG-CG 4.36Å; E1205-K1207 WeakPolarHBondContact OE1-CE 3.49Å; E1205-K1207 IonicContact OE1-NZ 2.73Å; E1205-K1207 WeakPolarHBondContact OE2-CE 3.03Å; E1205-K1207 IonicContact OE2-NZ 3.53Å; E1205-K1207 PolarHBondContact OE2-NZ 3.19Å; K1207-Q1210 PolarHBondContact N-O 2.89Å; K1207-Q1210 WeakPolarHBondContact O-CB 2.97Å; K1207-Q1210 PolarHBondContact O-N 2.88Å; K1207-E1212 VanDerWaalsContact CD-OE2 3.27Å; K1207-E1212 WeakPolarHBondContact CD-OE2 3.32Å; K1207-E1212 WeakPolarHBondContact CE-OE2 3.48Å; K1207-E1212 IonicContact NZ-OE1 3.05Å; K1207-E1212 IonicContact NZ-OE2 3.92Å; K1207-E1212 PolarHBondContact NZ-OE2 2.9Å
1208	K	91.8	Very high	96.5	Very high	215 Å²	215	35.4 Å²	35.4	94%	0.935	17%	0.17	S	C	*	.	S	Bend	trans	64.5	39.6	172	-46.1	177.3	-178.8	-176.9	0	113	D1206	D1206-K1208 PolarHBondContact OD1-N 3.43Å
1209	G	89.5	Confident	96.5	Very high	33 Å²	33	39.7 Å²	39.7	34%	0.34	18%	0.184	S	C	.	.	S	Bend	trans	91.2	3.8	-175.5	0	0	0	0	0	114.1	D1206 E1270 S1271	D1206-G1209 VanDerWaalsContact OD1-CA 3.22Å; D1206-G1209 WeakPolarHBondContact OD1-CA 3.4Å; D1206-G1209 PolarHBondContact OD1-N 3.19Å; G1209-E1270 CarbonylContact O-C 3.55Å; G1209-S1271 VanDerWaalsContact O-CA 3.26Å; G1209-S1271 WeakPolarHBondContact O-CA 3.32Å; G1209-S1271 PolarHBondContact O-N 2.8Å
1210	Q	94.2	Very high	96.5	Very high	81 Å²	81	42 Å²	42	38%	0.379	20%	0.203	S	C	.	.			trans	-112.9	116.5	177.6	-65.8	-167.8	-19.2	0	0	110.4	D1206 K1207 E1212 V1267 F1268	D1206-Q1210 PolarHBondContact OD1-N 2.85Å; K1207-Q1210 PolarHBondContact N-O 2.89Å; K1207-Q1210 WeakPolarHBondContact O-CB 2.97Å; K1207-Q1210 PolarHBondContact O-N 2.88Å; Q1210-E1212 PolarHBondContact O-N 2.83Å; Q1210-V1267 HydrophobicContact CB-CG1 4.1Å; Q1210-F1268 WeakPolarHBondContact CA-O 3.47Å; Q1210-F1268 VanDerWaalsContact CB-O 3.3Å; Q1210-F1268 WeakPolarHBondContact CB-O 3.01Å
1211	L	96.8	Very high	96.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	107.6	176	169.7	63	0	0	0	111.2	M1204 V1213 L1239 F1268 E1270 P1272 L1277 L1301 L1306	M1204-L1211 HydrophobicContact CB-CD1 4.21Å; M1204-L1211 HydrophobicContact CG-CD1 4.4Å; L1211-V1213 HydrophobicContact CD1-CG2 4.13Å; L1211-V1213 HydrophobicContact CD2-CG2 4.07Å; L1211-V1213 HydrophobicContact CG-CG2 3.81Å; L1211-L1239 HydrophobicContact CD2-CD1 3.86Å; L1211-F1268 HydrophobicContact CB-CB 4.18Å; L1211-F1268 PolarHBondContact N-O 2.62Å; L1211-F1268 WeakPolarHBondContact O-CB 3.43Å; L1211-F1268 PolarHBondContact O-N 2.68Å; L1211-E1270 PolarHBondContact N-O 3.17Å; L1211-P1272 HydrophobicContact CB-CB 4.45Å; L1211-P1272 HydrophobicContact CD1-CB 4.3Å; L1211-P1272 HydrophobicContact CD2-CB 4.48Å; L1211-L1277 HydrophobicContact CD2-CD1 4.06Å; L1211-L1301 HydrophobicContact CD1-CD2 4.44Å; L1211-L1301 HydrophobicContact CD2-CD1 3.56Å; L1211-L1301 HydrophobicContact CD2-CD2 4.36Å; L1211-L1306 HydrophobicContact CD1-CD1 4.34Å
1212	E	97	Very high	96.2	Very high	25 Å²	25	44 Å²	44	12%	0.117	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	123.4	166.8	-172.8	175.1	161.6	0	0	110.7	M1204 E1205 K1207 Q1210 S1265 V1267	M1204-E1212 CarbonylContact C-O 3.58Å; M1204-E1212 WeakPolarHBondContact CA-O 3.28Å; E1205-E1212 PolarHBondContact N-O 2.77Å; E1205-E1212 PolarHBondContact O-N 2.86Å; K1207-E1212 VanDerWaalsContact CD-OE2 3.27Å; K1207-E1212 WeakPolarHBondContact CD-OE2 3.32Å; K1207-E1212 WeakPolarHBondContact CE-OE2 3.48Å; K1207-E1212 IonicContact NZ-OE1 3.05Å; K1207-E1212 IonicContact NZ-OE2 3.92Å; K1207-E1212 PolarHBondContact NZ-OE2 2.9Å; Q1210-E1212 PolarHBondContact O-N 2.83Å; E1212-S1265 WeakPolarHBondContact OE1-CB 3.39Å; E1212-S1265 PolarHBondContact OE1-OG 2.93Å; E1212-V1267 HydrophobicContact CB-CG2 4.26Å; E1212-V1267 HydrophobicContact CG-CG2 3.94Å
1213	V	97.9	Very high	95.9	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	103.8	174.2	-174.3	0	0	0	0	109.9	I1202 G1203 M1204 L1211 V1215 V1237 L1266 F1268 L1277	I1202-V1213 HydrophobicContact CG2-CG1 3.63Å; G1203-V1213 CarbonylContact O-C 3.49Å; G1203-V1213 WeakPolarHBondContact O-CA 3.5Å; M1204-V1213 HydrophobicContact CG-CG1 4.32Å; M1204-V1213 HydrophobicContact CG-CG2 4.29Å; L1211-V1213 HydrophobicContact CD1-CG2 4.13Å; L1211-V1213 HydrophobicContact CD2-CG2 4.07Å; L1211-V1213 HydrophobicContact CG-CG2 3.81Å; V1213-V1215 PolarHBondContact O-N 2.73Å; V1213-V1237 HydrophobicContact CG1-CG1 4.41Å; V1213-V1237 HydrophobicContact CG1-CG2 4.39Å; V1213-L1266 HydrophobicContact CB-CB 4.47Å; V1213-L1266 PolarHBondContact N-O 3.07Å; V1213-L1266 PolarHBondContact O-N 2.8Å; V1213-F1268 HydrophobicContact CB-CE2 4.35Å; V1213-F1268 HydrophobicContact CG2-CD2 3.87Å; V1213-F1268 HydrophobicContact CG2-CE2 3.85Å; V1213-L1277 HydrophobicContact CG1-CD2 3.91Å; V1213-L1277 HydrophobicContact CG2-CD1 4.21Å; V1213-L1277 HydrophobicContact CG2-CD2 3.77Å
1214	E	97.9	Very high	95.5	Very high	38 Å²	38	51.4 Å²	51.4	18%	0.178	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	112.5	170	-159	-158.4	160.9	0	0	110.4	I1202 G1203 I1216 M1309	I1202-E1214 WeakPolarHBondContact CA-O 3.49Å; G1203-E1214 PolarHBondContact N-O 3.02Å; G1203-E1214 PolarHBondContact O-N 2.79Å; E1214-I1216 HydrophobicContact CB-CG1 4.36Å; E1214-I1216 HydrophobicContact CG-CG1 4.12Å; E1214-I1216 PolarHBondContact O-N 3.16Å; E1214-M1309 HydrophobicContact CB-CE 4.43Å
1215	V	98.4	Very high	94.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	102.2	166.5	-175.3	0	0	0	0	108	I1200 I1202 V1213 V1235 V1237 T1251 Y1262 Q1263 Q1264 L1266	I1200-V1215 HydrophobicContact CD1-CG1 4.38Å; I1202-V1215 HydrophobicContact CD1-CB 4.29Å; I1202-V1215 HydrophobicContact CD1-CG1 4.11Å; I1202-V1215 HydrophobicContact CD1-CG2 4.05Å; V1213-V1215 PolarHBondContact O-N 2.73Å; V1215-V1235 HydrophobicContact CG1-CB 3.94Å; V1215-V1235 HydrophobicContact CG1-CG1 4.09Å; V1215-V1235 HydrophobicContact CG1-CG2 3.8Å; V1215-V1235 HydrophobicContact CG2-CG1 4.24Å; V1215-V1237 HydrophobicContact CG2-CG2 3.99Å; V1215-T1251 HydrophobicContact CB-CG2 3.61Å; V1215-T1251 HydrophobicContact CG1-CG2 3.75Å; V1215-T1251 HydrophobicContact CG2-CG2 3.83Å; V1215-Y1262 HydrophobicContact CG1-CD2 3.73Å; V1215-Y1262 HydrophobicContact CG1-CE2 4.42Å; V1215-Y1262 HydrophobicContact CG1-CG 4.06Å; V1215-Y1262 VanDerWaalsContact O-CB 3.31Å; V1215-Y1262 WeakPolarHBondContact O-CB 3.41Å; V1215-Q1263 WeakPolarHBondContact O-CA 3.46Å; V1215-Q1263 PolarHBondContact O-N 3.01Å; V1215-Q1264 PolarHBondContact N-O 3.17Å; V1215-Q1264 PolarHBondContact O-N 2.84Å; V1215-L1266 HydrophobicContact CG2-CD1 3.88Å; V1215-L1266 HydrophobicContact CG2-CG 4.43Å
1216	I	98	Very high	94.1	Very high	20 Å²	20	57.7 Å²	57.7	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-63.9	-173.7	-53.4	179.6	0	0	0	110	Q1201 E1214 Y1262 Q1263 I1311	Q1201-I1216 HydrophobicContact CB-CB 4.3Å; Q1201-I1216 HydrophobicContact CG-CB 4.48Å; Q1201-I1216 HydrophobicContact CG-CD1 4.16Å; Q1201-I1216 PolarHBondContact O-N 2.97Å; Q1201-I1216 VanDerWaalsContact O-N 3.14Å; E1214-I1216 HydrophobicContact CB-CG1 4.36Å; E1214-I1216 HydrophobicContact CG-CG1 4.12Å; E1214-I1216 PolarHBondContact O-N 3.16Å; I1216-Y1262 PolarHBondContact O-N 2.98Å; I1216-Q1263 PolarHBondContact O-N 3.22Å; I1216-I1311 HydrophobicContact CD1-CD1 4.21Å; I1216-I1311 HydrophobicContact CD1-CG1 4.44Å; I1216-I1311 HydrophobicContact CD1-CG2 3.64Å
1217	R	98.2	Very high	93.5	Very high	104 Å²	104	56.9 Å²	56.9	39%	0.392	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	166.1	-176.9	59.5	175	168.6	162	-8.3	112.3	I1200 Q1201 P1260 L1261 W1313	I1200-R1217 WeakPolarHBondContact CG1-O 3.43Å; Q1201-R1217 HydrophobicContact CB-CG 3.94Å; Q1201-R1217 PolarHBondContact N-O 3.26Å; R1217-P1260 CarbonylContact C-O 3.59Å; R1217-P1260 WeakPolarHBondContact CA-O 3.08Å; R1217-P1260 VanDerWaalsContact CB-O 3.28Å; R1217-P1260 WeakPolarHBondContact CB-O 3.25Å; R1217-L1261 HydrophobicContact CB-CD1 4.09Å; R1217-W1313 HydrophobicContact CG-CH2 4.12Å; R1217-W1313 VanDerWaalsContact CZ-CZ2 3.46Å
1218	A	98.4	Very high	92.9	Very high	2 Å²	2	63.1 Å²	63.1	2%	0.017	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	162.4	159.9	0	0	0	0	0	110.8	D1199 I1200 L1221 D1259 P1260	D1199-A1218 CarbonylContact O-C 3.6Å; D1199-A1218 WeakPolarHBondContact O-CA 3.43Å; D1199-A1218 WeakPolarHBondContact O-CB 3.48Å; I1200-A1218 HydrophobicContact CB-CB 4.25Å; I1200-A1218 HydrophobicContact CG1-CB 4.15Å; A1218-L1221 HydrophobicContact CB-CD1 4.11Å; A1218-L1221 HydrophobicContact CB-CD2 4.04Å; A1218-L1221 HydrophobicContact CB-CG 4.13Å; A1218-D1259 CarbonylContact O-C 3.59Å; A1218-D1259 WeakPolarHBondContact O-CA 3.31Å; A1218-P1260 HydrophobicContact CB-CG 3.89Å; A1218-P1260 PolarHBondContact N-O 2.86Å; A1218-P1260 WeakPolarHBondContact O-CD 3.32Å
1219	R	97.3	Very high	92.7	Very high	94 Å²	94	55.2 Å²	55.2	36%	0.355	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	159.4	175.8	69.1	179.4	-177.8	-153	-5.5	111.3	G1198 D1199 L1221 D1259 W1313	G1198-R1219 WeakPolarHBondContact CA-O 3.32Å; D1199-R1219 HydrophobicContact CB-CG 4Å; D1199-R1219 PolarHBondContact N-O 2.71Å; D1199-R1219 PolarHBondContact O-N 3.23Å; D1199-R1219 IonicContact OD2-CZ 2.77Å; D1199-R1219 IonicContact OD2-NE 3.67Å; D1199-R1219 PolarHBondContact OD2-NE 2.87Å; D1199-R1219 IonicContact OD2-NH2 3.5Å; D1199-R1219 PolarHBondContact OD2-NH2 3.16Å; R1219-L1221 PolarHBondContact O-N 2.74Å; R1219-L1221 VanDerWaalsContact O-N 3.13Å; R1219-D1259 VanDerWaalsContact CA-OD1 3.25Å; R1219-D1259 WeakPolarHBondContact CA-OD1 3.27Å; R1219-W1313 HydrophobicContact CB-CH2 4.18Å; R1219-W1313 HydrophobicContact CB-CZ3 4.47Å; R1219-W1313 VanDerWaalsContact CD-CH2 3.5Å; R1219-W1313 HydrophobicContact CG-CH2 3.68Å; R1219-W1313 HydrophobicContact CG-CZ3 3.73Å
1220	S	95.7	Very high	92.9	Very high	77 Å²	77	56.1 Å²	56.1	54%	0.538	30%	0.304	S	S	.	.	S	Bend	trans	56.9	27.7	171.7	-51	0	0	0	0	114.3	G1198 T1222 D1259	G1198-S1220 WeakPolarHBondContact CA-O 3.31Å; S1220-T1222 PolarHBondContact O-N 2.89Å; S1220-D1259 PolarHBondContact N-OD1 3.33Å
1221	L	97.3	Very high	92.9	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.016	29%	0.286	C	S	.	.			trans	-64.1	131.5	-175.7	-66.3	175.6	0	0	0	111.7	M1197 A1218 R1219 Q1223 P1233 L1258 P1260 V1281 M1294 L1316	M1197-L1221 CarbonylContact O-C 3.51Å; M1197-L1221 WeakPolarHBondContact O-CA 3.26Å; A1218-L1221 HydrophobicContact CB-CD1 4.11Å; A1218-L1221 HydrophobicContact CB-CD2 4.04Å; A1218-L1221 HydrophobicContact CB-CG 4.13Å; R1219-L1221 PolarHBondContact O-N 2.74Å; R1219-L1221 VanDerWaalsContact O-N 3.13Å; L1221-Q1223 PolarHBondContact O-N 3.2Å; L1221-P1233 HydrophobicContact CD1-CB 4.19Å; L1221-P1233 HydrophobicContact CD1-CG 4.34Å; L1221-L1258 HydrophobicContact CB-CB 4.3Å; L1221-L1258 VanDerWaalsContact CB-O 3.23Å; L1221-L1258 WeakPolarHBondContact CB-O 3.34Å; L1221-L1258 WeakPolarHBondContact CD1-O 3.39Å; L1221-L1258 WeakPolarHBondContact CG-O 3.38Å; L1221-L1258 PolarHBondContact N-O 2.84Å; L1221-L1258 VanDerWaalsContact N-O 3.16Å; L1221-P1260 HydrophobicContact CD1-CG 3.81Å; L1221-V1281 HydrophobicContact CD1-CG1 3.88Å; L1221-V1281 HydrophobicContact CD2-CB 4.47Å; L1221-V1281 HydrophobicContact CD2-CG1 4.13Å; L1221-V1281 HydrophobicContact CD2-CG2 4.32Å; L1221-M1294 HydrophobicContact CB-CE 3.78Å; L1221-M1294 HydrophobicContact CD1-CE 4.44Å; L1221-L1316 HydrophobicContact CD2-CD1 3.49Å; L1221-L1316 VanDerWaalsContact CD2-CD1 3.49Å
1222	T	94.1	Very high	92.9	Very high	67 Å²	67	52.8 Å²	52.8	41%	0.411	29%	0.29	S	S	.	.			trans	-69.4	115.3	-177.4	-61.4	0	0	0	0	111.4	M1197 S1220 M1294	M1197-T1222 WeakPolarHBondContact CA-OG1 3.39Å; M1197-T1222 WeakPolarHBondContact O-CB 3.28Å; M1197-T1222 PolarHBondContact O-N 3.13Å; M1197-T1222 PolarHBondContact O-OG1 2.95Å; S1220-T1222 PolarHBondContact O-N 2.89Å; T1222-M1294 VanDerWaalsContact O-CE 3.29Å; T1222-M1294 WeakPolarHBondContact O-CE 3.42Å
1223	Q	91.6	Very high	93	Very high	64 Å²	64	51.6 Å²	51.6	30%	0.299	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-72.5	134.6	172.6	-175.2	172.2	-26	0	0	110.9	L1221 S1227 L1258 Y1285	L1221-Q1223 PolarHBondContact O-N 3.2Å; Q1223-S1227 VanDerWaalsContact CG-OG 3.28Å; Q1223-S1227 WeakPolarHBondContact CG-OG 3.22Å; Q1223-S1227 PolarHBondContact NE2-O 3.32Å; Q1223-S1227 PolarHBondContact NE2-OG 2.95Å; Q1223-L1258 HydrophobicContact CB-CD1 4.06Å; Q1223-L1258 HydrophobicContact CB-CD2 3.96Å; Q1223-Y1285 HydrophobicContact CG-CE1 4.33Å
1224	K	87.8	Confident	93	Very high	93 Å²	93	53.3 Å²	53.3	40%	0.404	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-56.9	125	178.9	179.2	170.7	-178.9	165.8	0	111	S1227 Y1285 D1289	K1224-S1227 VanDerWaalsContact O-CB 3.3Å; K1224-S1227 WeakPolarHBondContact O-CB 3.38Å; K1224-S1227 PolarHBondContact O-N 3.17Å; K1224-S1227 VanDerWaalsContact O-N 3.14Å; K1224-S1227 PolarHBondContact O-OG 2.89Å; K1224-Y1285 HydrophobicContact CB-CE1 4.44Å; K1224-Y1285 HydrophobicContact CB-CE2 4.15Å; K1224-Y1285 WeakPolarHBondContact CB-OH 3.25Å; K1224-Y1285 PolarHBondContact N-OH 3.36Å; K1224-D1289 IonicContact NZ-OD2 2.67Å; K1224-D1289 PolarHBondContact NZ-OD2 2.77Å
1225	P	86	Confident	93	Very high	94 Å²	94	51.5 Å²	51.5	61%	0.61	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	141	175.8	-29.2	36.2	0	0	0	112.9	S1227	P1225-S1227 PolarHBondContact O-N 3.02Å
1226	G	80	Confident	93	Very high	77 Å²	77	54 Å²	54	79%	0.794	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	-9.6	-177.8	0	0	0	0	0	116.1	K1228	G1226-K1228 PolarHBondContact O-N 2.83Å
1227	S	82.4	Confident	93	Very high	29 Å²	29	53 Å²	53	20%	0.203	29%	0.289	C	S	.	.			trans	-72.4	127.6	175.9	67.9	0	0	0	0	111.7	Q1223 K1224 P1225 Y1285	Q1223-S1227 VanDerWaalsContact CG-OG 3.28Å; Q1223-S1227 WeakPolarHBondContact CG-OG 3.22Å; Q1223-S1227 PolarHBondContact NE2-O 3.32Å; Q1223-S1227 PolarHBondContact NE2-OG 2.95Å; K1224-S1227 VanDerWaalsContact O-CB 3.3Å; K1224-S1227 WeakPolarHBondContact O-CB 3.38Å; K1224-S1227 PolarHBondContact O-N 3.17Å; K1224-S1227 VanDerWaalsContact O-N 3.14Å; K1224-S1227 PolarHBondContact O-OG 2.89Å; P1225-S1227 PolarHBondContact O-N 3.02Å; S1227-Y1285 WeakPolarHBondContact OG-CE1 3.43Å
1228	K	80.8	Confident	93	Very high	209 Å²	209	49.8 Å²	49.8	91%	0.909	28%	0.277	S	S	*	.	S	Bend	trans	-89.3	2.6	-178.5	-65	-172.4	179.4	-178.5	0	114.6	G1226	G1226-K1228 PolarHBondContact O-N 2.83Å
1229	S	88	Confident	92.9	Very high	49 Å²	49	49.7 Å²	49.7	34%	0.343	28%	0.276	S	S	.	.	S	Bend	trans	-140.2	140.7	-178.4	61.7	0	0	0	0	109.8	Y1285	S1229-Y1285 VanDerWaalsContact O-CD1 3.23Å; S1229-Y1285 WeakPolarHBondContact O-CD1 3.33Å; S1229-Y1285 VanDerWaalsContact O-CE1 3.22Å; S1229-Y1285 WeakPolarHBondContact O-CE1 3.27Å
1230	T	92.6	Very high	92.8	Very high	52 Å²	52	46 Å²	46	32%	0.319	26%	0.263	S	S	.	.			trans	-59.8	143.2	169.1	42.2	0	0	0	0	111.1	K1256 L1258	T1230-K1256 WeakPolarHBondContact O-CD 3.38Å; T1230-L1258 HydrophobicContact CG2-CG 4.43Å
1231	P	95.6	Very high	92.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.253	C	S	.	.			trans	-70.7	157.4	172.9	29.2	-31.9	0	0	0	110.7	P1233 K1256 T1257 L1258 D1284 Y1285 M1294	P1231-P1233 VanDerWaalsContact O-CD 3.31Å; P1231-P1233 WeakPolarHBondContact O-CD 3.19Å; P1231-K1256 CarbonylContact O-C 3.53Å; P1231-K1256 WeakPolarHBondContact O-CA 3.27Å; P1231-T1257 PolarHBondContact O-N 2.74Å; P1231-L1258 HydrophobicContact CG-CD2 3.97Å; P1231-D1284 CarbonylContact C-O 3.57Å; P1231-D1284 WeakPolarHBondContact CA-O 3.12Å; P1231-Y1285 HydrophobicContact CB-CD1 4.27Å; P1231-Y1285 HydrophobicContact CB-CD2 4.08Å; P1231-Y1285 HydrophobicContact CB-CE1 3.96Å; P1231-Y1285 HydrophobicContact CB-CE2 3.74Å; P1231-Y1285 HydrophobicContact CB-CG 4.32Å; P1231-Y1285 HydrophobicContact CG-CE1 4.14Å; P1231-Y1285 HydrophobicContact CG-CE2 4.26Å; P1231-M1294 HydrophobicContact CB-SD 4.12Å; P1231-M1294 HydrophobicContact CG-CE 3.62Å; P1231-M1294 HydrophobicContact CG-SD 3.71Å
1232	A	96.9	Very high	92.3	Very high	11 Å²	11	53.2 Å²	53.2	9%	0.091	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	99.4	159	0	0	0	0	0	107.6	I1253 A1254 K1256 D1284	A1232-I1253 HydrophobicContact CB-CG2 3.7Å; A1232-A1254 WeakPolarHBondContact CB-O 3.38Å; A1232-K1256 HydrophobicContact CB-CG 3.89Å; A1232-D1284 HydrophobicContact CB-CB 4.39Å; A1232-D1284 PolarHBondContact N-O 3.28Å; A1232-D1284 WeakPolarHBondContact O-CB 3.25Å; A1232-D1284 PolarHBondContact O-N 3.3Å
1233	P	97.9	Very high	91.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	154.5	-172.8	33.8	-37.7	0	0	0	112.4	L1221 P1231 A1254 T1257 P1260 Y1262 V1281 W1282 M1294	L1221-P1233 HydrophobicContact CD1-CB 4.19Å; L1221-P1233 HydrophobicContact CD1-CG 4.34Å; P1231-P1233 VanDerWaalsContact O-CD 3.31Å; P1231-P1233 WeakPolarHBondContact O-CD 3.19Å; P1233-A1254 HydrophobicContact CG-CB 4.29Å; P1233-A1254 WeakPolarHBondContact O-CB 3.35Å; P1233-A1254 PolarHBondContact O-N 3.41Å; P1233-T1257 WeakPolarHBondContact CD-O 3.09Å; P1233-P1260 HydrophobicContact CB-CG 4.35Å; P1233-P1260 HydrophobicContact CG-CB 3.61Å; P1233-P1260 HydrophobicContact CG-CG 3.61Å; P1233-Y1262 VanDerWaalsContact C-OH 3.3Å; P1233-Y1262 WeakPolarHBondContact CB-OH 3.4Å; P1233-Y1262 PolarHBondContact O-OH 2.92Å; P1233-V1281 HydrophobicContact CB-CG1 4.24Å; P1233-W1282 CarbonylContact C-O 3.57Å; P1233-W1282 WeakPolarHBondContact CA-O 3.17Å; P1233-M1294 HydrophobicContact CB-SD 4.4Å
1234	Y	98.1	Very high	91.7	Very high	37 Å²	37	52.5 Å²	52.5	15%	0.145	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	156.3	166.8	66.5	-89.8	0	0	0	110.1	I1253 Y1262 W1282	Y1234-I1253 HydrophobicContact CD1-CD1 4.45Å; Y1234-I1253 HydrophobicContact CD1-CG1 4.02Å; Y1234-I1253 HydrophobicContact CG-CG1 4.26Å; Y1234-Y1262 WeakPolarHBondContact CA-OH 3.27Å; Y1234-Y1262 PolarHBondContact N-OH 3.06Å; Y1234-W1282 HydrophobicContact CD1-CB 4.14Å; Y1234-W1282 HydrophobicContact CD2-CB 4.16Å; Y1234-W1282 HydrophobicContact CE1-CB 3.66Å; Y1234-W1282 HydrophobicContact CE2-CB 3.67Å; Y1234-W1282 AromaticContact CE2-CD1 3.8Å; Y1234-W1282 AromaticContact CE2-CG 3.9Å; Y1234-W1282 HydrophobicContact CE2-CG 3.9Å; Y1234-W1282 HydrophobicContact CG-CB 4.37Å; Y1234-W1282 AromaticContact CZ-CG 3.9Å; Y1234-W1282 PolarHBondContact N-O 2.72Å; Y1234-W1282 PolarHBondContact O-N 2.73Å
1235	V	98.4	Very high	92.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	138.8	179.4	-178.9	0	0	0	0	108.4	I1200 V1215 V1237 K1250 T1251 Y1262 V1279 V1281	I1200-V1235 HydrophobicContact CD1-CB 4.41Å; I1200-V1235 HydrophobicContact CD1-CG1 3.89Å; I1200-V1235 HydrophobicContact CD1-CG2 3.58Å; V1215-V1235 HydrophobicContact CG1-CB 3.94Å; V1215-V1235 HydrophobicContact CG1-CG1 4.09Å; V1215-V1235 HydrophobicContact CG1-CG2 3.8Å; V1215-V1235 HydrophobicContact CG2-CG1 4.24Å; V1235-V1237 HydrophobicContact CG1-CG2 4.13Å; V1235-K1250 CarbonylContact O-C 3.59Å; V1235-K1250 VanDerWaalsContact O-CA 3.28Å; V1235-K1250 WeakPolarHBondContact O-CA 3.43Å; V1235-K1250 WeakPolarHBondContact O-CB 3.42Å; V1235-T1251 HydrophobicContact CB-CG2 4.17Å; V1235-T1251 PolarHBondContact N-OG1 2.83Å; V1235-T1251 PolarHBondContact O-N 2.93Å; V1235-T1251 PolarHBondContact O-OG1 2.87Å; V1235-Y1262 HydrophobicContact CG2-CD2 4.07Å; V1235-Y1262 HydrophobicContact CG2-CE1 4.39Å; V1235-Y1262 HydrophobicContact CG2-CE2 3.43Å; V1235-Y1262 VanDerWaalsContact CG2-CE2 3.43Å; V1235-V1279 HydrophobicContact CG1-CG1 3.67Å; V1235-V1281 HydrophobicContact CG2-CG2 4.36Å
1236	K	98	Very high	92.5	Very high	52 Å²	52	49.3 Å²	49.3	23%	0.226	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119.7	168.8	-174.2	174.5	168.3	-155	0	109	Y1238 K1250 I1280	K1236-Y1238 HydrophobicContact CB-CE2 4.09Å; K1236-Y1238 HydrophobicContact CD-CE1 4.19Å; K1236-Y1238 HydrophobicContact CD-CE2 3.88Å; K1236-Y1238 WeakPolarHBondContact CD-OH 3.05Å; K1236-Y1238 VanDerWaalsContact CE-CE1 3.43Å; K1236-Y1238 WeakPolarHBondContact CE-OH 3.4Å; K1236-Y1238 HydrophobicContact CG-CD2 4.24Å; K1236-Y1238 HydrophobicContact CG-CE2 3.7Å; K1236-Y1238 VanDerWaalsContact NZ-CZ 3.25Å; K1236-Y1238 PolarHBondContact NZ-OH 3.23Å; K1236-K1250 HydrophobicContact CB-CB 4.21Å; K1236-K1250 HydrophobicContact CG-CB 4.17Å; K1236-I1280 PolarHBondContact N-O 2.83Å; K1236-I1280 PolarHBondContact O-N 3.07Å
1237	V	98.1	Very high	93.3	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.6	178.7	-176.8	0	0	0	0	107.7	V1213 V1215 V1235 K1248 K1249 L1266 F1268 L1277 V1279	V1213-V1237 HydrophobicContact CG1-CG1 4.41Å; V1213-V1237 HydrophobicContact CG1-CG2 4.39Å; V1215-V1237 HydrophobicContact CG2-CG2 3.99Å; V1235-V1237 HydrophobicContact CG1-CG2 4.13Å; V1237-K1248 CarbonylContact O-C 3.44Å; V1237-K1248 VanDerWaalsContact O-CA 3.25Å; V1237-K1248 WeakPolarHBondContact O-CA 3.36Å; V1237-K1249 PolarHBondContact N-O 2.94Å; V1237-K1249 PolarHBondContact O-N 2.8Å; V1237-K1249 VanDerWaalsContact O-O 3.09Å; V1237-L1266 HydrophobicContact CB-CD1 4.23Å; V1237-L1266 HydrophobicContact CG2-CD1 3.79Å; V1237-F1268 HydrophobicContact CB-CE2 4.29Å; V1237-F1268 HydrophobicContact CB-CZ 4.02Å; V1237-F1268 HydrophobicContact CG1-CE2 3.86Å; V1237-F1268 HydrophobicContact CG1-CZ 3.75Å; V1237-L1277 HydrophobicContact CG1-CD1 3.42Å; V1237-L1277 VanDerWaalsContact CG1-CD1 3.42Å; V1237-L1277 HydrophobicContact CG1-CD2 4Å; V1237-L1277 HydrophobicContact CG1-CG 3.68Å; V1237-V1279 HydrophobicContact CG1-CG2 4.44Å; V1237-V1279 HydrophobicContact CG2-CG1 4.46Å; V1237-V1279 HydrophobicContact CG2-CG2 4.43Å
1238	Y	97.7	Very high	94	Very high	35 Å²	35	50.3 Å²	50.3	14%	0.137	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.5	176.1	-57.9	-107.9	0	0	0	107.6	K1236 A1247 K1248 Q1278 I1280	K1236-Y1238 HydrophobicContact CB-CE2 4.09Å; K1236-Y1238 HydrophobicContact CD-CE1 4.19Å; K1236-Y1238 HydrophobicContact CD-CE2 3.88Å; K1236-Y1238 WeakPolarHBondContact CD-OH 3.05Å; K1236-Y1238 VanDerWaalsContact CE-CE1 3.43Å; K1236-Y1238 WeakPolarHBondContact CE-OH 3.4Å; K1236-Y1238 HydrophobicContact CG-CD2 4.24Å; K1236-Y1238 HydrophobicContact CG-CE2 3.7Å; K1236-Y1238 VanDerWaalsContact NZ-CZ 3.25Å; K1236-Y1238 PolarHBondContact NZ-OH 3.23Å; Y1238-A1247 WeakPolarHBondContact CA-O 3.43Å; Y1238-K1248 HydrophobicContact CD1-CB 3.8Å; Y1238-K1248 HydrophobicContact CE1-CB 4.33Å; Y1238-K1248 HydrophobicContact CG-CB 4.26Å; Y1238-Q1278 PolarHBondContact N-O 3.17Å; Y1238-Q1278 PolarHBondContact O-N 3.46Å; Y1238-I1280 HydrophobicContact CD2-CD1 4.23Å; Y1238-I1280 HydrophobicContact CD2-CG1 4.31Å; Y1238-I1280 HydrophobicContact CE2-CB 4.34Å; Y1238-I1280 HydrophobicContact CE2-CD1 3.67Å; Y1238-I1280 HydrophobicContact CE2-CG1 3.99Å
1239	L	97	Very high	94.8	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.8	170.8	-172.9	59.7	0	0	0	107.6	L1211 I1246 A1247 F1268 E1270 K1275 L1277 L1301	L1211-L1239 HydrophobicContact CD2-CD1 3.86Å; L1239-I1246 HydrophobicContact CB-CG1 4.32Å; L1239-I1246 HydrophobicContact CD2-CD1 4.06Å; L1239-I1246 HydrophobicContact CD2-CG1 4.31Å; L1239-I1246 HydrophobicContact CG-CD1 4.2Å; L1239-I1246 HydrophobicContact CG-CG1 4.16Å; L1239-I1246 PolarHBondContact O-N 3.29Å; L1239-I1246 VanDerWaalsContact O-N 3.14Å; L1239-A1247 HydrophobicContact CB-CB 4.15Å; L1239-A1247 PolarHBondContact N-O 3.33Å; L1239-F1268 HydrophobicContact CB-CD1 4.09Å; L1239-F1268 HydrophobicContact CB-CE1 4.03Å; L1239-F1268 HydrophobicContact CD2-CB 4.39Å; L1239-F1268 HydrophobicContact CD2-CD1 4.15Å; L1239-F1268 HydrophobicContact CD2-CG 4.44Å; L1239-E1270 HydrophobicContact CD2-CB 3.79Å; L1239-E1270 HydrophobicContact CD2-CG 4.39Å; L1239-K1275 HydrophobicContact CD1-CB 3.78Å; L1239-K1275 HydrophobicContact CD1-CD 3.96Å; L1239-K1275 HydrophobicContact CD1-CG 4.43Å; L1239-K1275 HydrophobicContact CD2-CD 3.92Å; L1239-K1275 HydrophobicContact CG-CB 4.45Å; L1239-K1275 HydrophobicContact CG-CD 3.89Å; L1239-L1277 HydrophobicContact CB-CD1 4.5Å; L1239-L1277 HydrophobicContact CD1-CD1 3.97Å; L1239-L1301 HydrophobicContact CD1-CD1 3.56Å
1240	L	95.1	Very high	95.3	Very high	16 Å²	16	47.6 Å²	47.6	8%	0.084	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.9	-177.3	-49.1	179.7	0	0	0	110.2	A1244 C1245 K1275 V1276 Q1278	L1240-A1244 CarbonylContact C-O 3.4Å; L1240-A1244 VanDerWaalsContact CA-O 3.22Å; L1240-A1244 WeakPolarHBondContact CA-O 3.34Å; L1240-C1245 HydrophobicContact CD2-CB 3.64Å; L1240-K1275 CarbonylContact O-C 3.58Å; L1240-K1275 VanDerWaalsContact O-CA 3.26Å; L1240-K1275 WeakPolarHBondContact O-CA 3.43Å; L1240-K1275 VanDerWaalsContact O-CB 3.27Å; L1240-K1275 WeakPolarHBondContact O-CB 3.46Å; L1240-V1276 WeakPolarHBondContact CA-O 3.35Å; L1240-V1276 HydrophobicContact CB-CB 4.27Å; L1240-V1276 VanDerWaalsContact CB-O 3.29Å; L1240-V1276 WeakPolarHBondContact CB-O 3.05Å; L1240-V1276 HydrophobicContact CD1-CG1 4.36Å; L1240-V1276 PolarHBondContact N-O 3.24Å; L1240-V1276 PolarHBondContact O-N 2.89Å; L1240-Q1278 HydrophobicContact CD1-CB 3.87Å; L1240-Q1278 HydrophobicContact CG-CB 4.25Å
1241	E	93	Very high	95.5	Very high	68 Å²	68	45.4 Å²	45.4	32%	0.318	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.7	175.2	-171.6	162.1	-121	0	0	107.8	G1243 A1244 I1246 K1275	E1241-G1243 PolarHBondContact O-N 3.24Å; E1241-A1244 PolarHBondContact N-O 3.19Å; E1241-A1244 PolarHBondContact O-N 3.08Å; E1241-I1246 HydrophobicContact CB-CD1 4.19Å; E1241-I1246 HydrophobicContact CB-CG2 3.9Å; E1241-K1275 HydrophobicContact CB-CG 3.99Å; E1241-K1275 HydrophobicContact CG-CG 4.12Å; E1241-K1275 WeakPolarHBondContact OE1-CE 3.45Å; E1241-K1275 IonicContact OE1-NZ 3.52Å; E1241-K1275 PolarHBondContact OE1-NZ 2.8Å
1242	N	88.3	Confident	95.6	Very high	165 Å²	165	54.9 Å²	54.9	88%	0.882	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	29.4	-172.7	-60	-33.4	0	0	0	114	A1244	N1242-A1244 VanDerWaalsContact C-N 3.31Å; N1242-A1244 PolarHBondContact O-N 3Å
1243	G	84.9	Confident	95.6	Very high	67 Å²	67	58.9 Å²	58.9	69%	0.691	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	-11	-175.4	0	0	0	0	0	115.8	E1241	E1241-G1243 PolarHBondContact O-N 3.24Å
1244	A	90.2	Very high	95.5	Very high	49 Å²	49	59.8 Å²	59.8	41%	0.405	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	141	175.9	0	0	0	0	0	111.6	L1240 E1241 N1242 I1246	L1240-A1244 CarbonylContact C-O 3.4Å; L1240-A1244 VanDerWaalsContact CA-O 3.22Å; L1240-A1244 WeakPolarHBondContact CA-O 3.34Å; E1241-A1244 PolarHBondContact N-O 3.19Å; E1241-A1244 PolarHBondContact O-N 3.08Å; N1242-A1244 VanDerWaalsContact C-N 3.31Å; N1242-A1244 PolarHBondContact O-N 3Å; A1244-I1246 PolarHBondContact O-N 3.09Å
1245	C	94.5	Very high	95.4	Very high	52 Å²	52	67.6 Å²	67.6	35%	0.351	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	101.6	178.5	174.5	0	0	0	0	111.7	L1240 A1247	L1240-C1245 HydrophobicContact CD2-CB 3.64Å; C1245-A1247 PolarHBondContact SG-O 3.19Å; C1245-A1247 VanDerWaalsContact SG-O 3.35Å
1246	I	95.4	Very high	95.3	Very high	67 Å²	67	72.8 Å²	72.8	34%	0.344	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-52.8	174.7	64.4	177.3	0	0	0	110.6	L1239 E1241 A1244 E1270 K1275	L1239-I1246 HydrophobicContact CB-CG1 4.32Å; L1239-I1246 HydrophobicContact CD2-CD1 4.06Å; L1239-I1246 HydrophobicContact CD2-CG1 4.31Å; L1239-I1246 HydrophobicContact CG-CD1 4.2Å; L1239-I1246 HydrophobicContact CG-CG1 4.16Å; L1239-I1246 PolarHBondContact O-N 3.29Å; L1239-I1246 VanDerWaalsContact O-N 3.14Å; E1241-I1246 HydrophobicContact CB-CD1 4.19Å; E1241-I1246 HydrophobicContact CB-CG2 3.9Å; A1244-I1246 PolarHBondContact O-N 3.09Å; I1246-E1270 HydrophobicContact CD1-CB 4.28Å; I1246-E1270 HydrophobicContact CD1-CG 4.08Å; I1246-K1275 HydrophobicContact CD1-CD 3.88Å
1247	A	96.5	Very high	95.2	Very high	8 Å²	8	71.5 Å²	71.5	7%	0.066	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.6	-172	0	0	0	0	0	112.7	Y1238 L1239 C1245 F1268 E1270	Y1238-A1247 WeakPolarHBondContact CA-O 3.43Å; L1239-A1247 HydrophobicContact CB-CB 4.15Å; L1239-A1247 PolarHBondContact N-O 3.33Å; C1245-A1247 PolarHBondContact SG-O 3.19Å; C1245-A1247 VanDerWaalsContact SG-O 3.35Å; A1247-F1268 HydrophobicContact CB-CD1 3.67Å; A1247-F1268 HydrophobicContact CB-CE1 3.86Å; A1247-E1270 VanDerWaalsContact CB-OE1 3.27Å; A1247-E1270 WeakPolarHBondContact CB-OE1 3.34Å
1248	K	97.3	Very high	95.2	Very high	119 Å²	119	73.5 Å²	73.5	52%	0.517	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	127.1	174.7	58	-107.3	169.5	-160.7	0	113.1	V1237 Y1238	V1237-K1248 CarbonylContact O-C 3.44Å; V1237-K1248 VanDerWaalsContact O-CA 3.25Å; V1237-K1248 WeakPolarHBondContact O-CA 3.36Å; Y1238-K1248 HydrophobicContact CD1-CB 3.8Å; Y1238-K1248 HydrophobicContact CE1-CB 4.33Å; Y1238-K1248 HydrophobicContact CG-CB 4.26Å
1249	K	97.9	Very high	95.2	Very high	57 Å²	57	75.9 Å²	75.9	25%	0.248	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	157.4	179.3	-57.4	-173.1	-173.2	-166.9	0	109.3	V1237 L1266 V1267 F1268 D1269	V1237-K1249 PolarHBondContact N-O 2.94Å; V1237-K1249 PolarHBondContact O-N 2.8Å; V1237-K1249 VanDerWaalsContact O-O 3.09Å; K1249-L1266 HydrophobicContact CB-CB 4.19Å; K1249-L1266 HydrophobicContact CB-CD1 4.28Å; K1249-L1266 HydrophobicContact CB-CD2 4.3Å; K1249-V1267 WeakPolarHBondContact CD-O 3.43Å; K1249-V1267 VanDerWaalsContact CE-O 3.31Å; K1249-V1267 WeakPolarHBondContact CE-O 3.44Å; K1249-V1267 PolarHBondContact NZ-O 3.44Å; K1249-F1268 HydrophobicContact CB-CE1 4.2Å; K1249-F1268 HydrophobicContact CB-CE2 4.23Å; K1249-F1268 HydrophobicContact CB-CZ 3.79Å; K1249-F1268 HydrophobicContact CD-CD1 4.14Å; K1249-F1268 HydrophobicContact CD-CD2 4.46Å; K1249-F1268 HydrophobicContact CD-CE1 4.18Å; K1249-F1268 HydrophobicContact CD-CE2 4.49Å; K1249-F1268 HydrophobicContact CD-CG 4.29Å; K1249-F1268 HydrophobicContact CD-CZ 4.36Å; K1249-F1268 HydrophobicContact CG-CD1 4.25Å; K1249-F1268 HydrophobicContact CG-CE1 3.81Å; K1249-F1268 HydrophobicContact CG-CE2 4.44Å; K1249-F1268 HydrophobicContact CG-CZ 3.91Å; K1249-D1269 IonicContact NZ-OD2 3.55Å; K1249-D1269 PolarHBondContact NZ-OD2 2.85Å
1250	K	97.2	Very high	95.2	Very high	145 Å²	145	76 Å²	76	63%	0.63	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.8	-171.9	68.3	172.5	-175.4	173.9	0	112.4	V1235 K1236	V1235-K1250 CarbonylContact O-C 3.59Å; V1235-K1250 VanDerWaalsContact O-CA 3.28Å; V1235-K1250 WeakPolarHBondContact O-CA 3.43Å; V1235-K1250 WeakPolarHBondContact O-CB 3.42Å; K1236-K1250 HydrophobicContact CB-CB 4.21Å; K1236-K1250 HydrophobicContact CG-CB 4.17Å
1251	T	98.1	Very high	95.3	Very high	5 Å²	5	80.1 Å²	80.1	3%	0.031	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-75.4	164	172.3	61.6	0	0	0	0	112.1	V1215 V1235 Y1262 Q1264 L1266	V1215-T1251 HydrophobicContact CB-CG2 3.61Å; V1215-T1251 HydrophobicContact CG1-CG2 3.75Å; V1215-T1251 HydrophobicContact CG2-CG2 3.83Å; V1235-T1251 HydrophobicContact CB-CG2 4.17Å; V1235-T1251 PolarHBondContact N-OG1 2.83Å; V1235-T1251 PolarHBondContact O-N 2.93Å; V1235-T1251 PolarHBondContact O-OG1 2.87Å; T1251-Y1262 HydrophobicContact CG2-CD1 4.19Å; T1251-Y1262 HydrophobicContact CG2-CG 4.26Å; T1251-Y1262 WeakPolarHBondContact OG1-CD1 3.26Å; T1251-Y1262 WeakPolarHBondContact OG1-CE1 3.13Å; T1251-Q1264 HydrophobicContact CG2-CB 4.16Å; T1251-L1266 HydrophobicContact CG2-CD1 4.42Å
1252	R	96.9	Very high	95.6	Very high	200 Å²	200	77.4 Å²	77.4	76%	0.755	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-63.4	144.8	161.5	-60.7	172.8	-172.6	-166.3	3.3	109.3	A1254	R1252-A1254 PolarHBondContact O-N 2.84Å
1253	I	96.4	Very high	96	Very high	95 Å²	95	75.6 Å²	75.6	49%	0.487	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-65.1	128.3	177.1	-52.7	176.2	0	0	0	109.3	A1232 Y1234	A1232-I1253 HydrophobicContact CB-CG2 3.7Å; Y1234-I1253 HydrophobicContact CD1-CD1 4.45Å; Y1234-I1253 HydrophobicContact CD1-CG1 4.02Å; Y1234-I1253 HydrophobicContact CG-CG1 4.26Å
1254	A	96.7	Very high	96.5	Very high	18 Å²	18	74.5 Å²	74.5	15%	0.149	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-76	169.4	178.3	0	0	0	0	0	111.9	A1232 P1233 R1252 P1260 Y1262	A1232-A1254 WeakPolarHBondContact CB-O 3.38Å; P1233-A1254 HydrophobicContact CG-CB 4.29Å; P1233-A1254 WeakPolarHBondContact O-CB 3.35Å; P1233-A1254 PolarHBondContact O-N 3.41Å; R1252-A1254 PolarHBondContact O-N 2.84Å; A1254-P1260 HydrophobicContact CB-CB 3.74Å; A1254-Y1262 HydrophobicContact CB-CD1 4.39Å; A1254-Y1262 HydrophobicContact CB-CE1 3.82Å
1255	R	95.7	Very high	96.9	Very high	202 Å²	202	75.2 Å²	75.2	76%	0.762	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-57.4	160.9	165.7	66	-179.2	179.7	177.7	-0.2	110.8	T1257	R1255-T1257 HydrophobicContact CG-CG2 4.25Å; R1255-T1257 WeakPolarHBondContact O-CG2 3.43Å; R1255-T1257 PolarHBondContact O-N 2.76Å
1256	K	96	Very high	97	Very high	109 Å²	109	73.7 Å²	73.7	47%	0.474	35%	0.345	S	S	.	.	S	Bend	trans	-65.4	107.3	177.4	-71.2	-170.5	167.4	-144.7	0	111.7	T1230 P1231 A1232	T1230-K1256 WeakPolarHBondContact O-CD 3.38Å; P1231-K1256 CarbonylContact O-C 3.53Å; P1231-K1256 WeakPolarHBondContact O-CA 3.27Å; A1232-K1256 HydrophobicContact CB-CG 3.89Å
1257	T	96.4	Very high	97.1	Very high	24 Å²	24	73.1 Å²	73.1	15%	0.147	34%	0.344	C	S	.	.			trans	-164.4	160	-174	-169.9	0	0	0	0	111.1	P1231 P1233 R1255 D1259 P1260	P1231-T1257 PolarHBondContact O-N 2.74Å; P1233-T1257 WeakPolarHBondContact CD-O 3.09Å; R1255-T1257 HydrophobicContact CG-CG2 4.25Å; R1255-T1257 WeakPolarHBondContact O-CG2 3.43Å; R1255-T1257 PolarHBondContact O-N 2.76Å; T1257-D1259 WeakPolarHBondContact CG2-O 3.04Å; T1257-D1259 PolarHBondContact OG1-N 2.9Å; T1257-D1259 VanDerWaalsContact OG1-N 3.14Å; T1257-P1260 HydrophobicContact CG2-CB 3.82Å
1258	L	97.1	Very high	97.1	Very high	42 Å²	42	72.8 Å²	72.8	22%	0.22	34%	0.341	C	S	.	.	S	Bend	trans	-96.4	-7.5	168.5	-54.6	-179.6	0	0	0	112.3	L1221 Q1223 T1230 P1231 P1260 M1294	L1221-L1258 HydrophobicContact CB-CB 4.3Å; L1221-L1258 VanDerWaalsContact CB-O 3.23Å; L1221-L1258 WeakPolarHBondContact CB-O 3.34Å; L1221-L1258 WeakPolarHBondContact CD1-O 3.39Å; L1221-L1258 WeakPolarHBondContact CG-O 3.38Å; L1221-L1258 PolarHBondContact N-O 2.84Å; L1221-L1258 VanDerWaalsContact N-O 3.16Å; Q1223-L1258 HydrophobicContact CB-CD1 4.06Å; Q1223-L1258 HydrophobicContact CB-CD2 3.96Å; T1230-L1258 HydrophobicContact CG2-CG 4.43Å; P1231-L1258 HydrophobicContact CG-CD2 3.97Å; L1258-P1260 VanDerWaalsContact C-CD 3.45Å; L1258-P1260 WeakPolarHBondContact O-CD 3.43Å; L1258-M1294 HydrophobicContact CD2-CE 4.26Å
1259	D	97.8	Very high	97	Very high	86 Å²	86	72 Å²	72	46%	0.46	34%	0.343	S	S	.	.	S	Bend	trans	-125.2	73.7	179.4	-52.4	-84	0	0	0	109.7	A1218 R1219 S1220 T1257	A1218-D1259 CarbonylContact O-C 3.59Å; A1218-D1259 WeakPolarHBondContact O-CA 3.31Å; R1219-D1259 VanDerWaalsContact CA-OD1 3.25Å; R1219-D1259 WeakPolarHBondContact CA-OD1 3.27Å; S1220-D1259 PolarHBondContact N-OD1 3.33Å; T1257-D1259 WeakPolarHBondContact CG2-O 3.04Å; T1257-D1259 PolarHBondContact OG1-N 2.9Å; T1257-D1259 VanDerWaalsContact OG1-N 3.14Å
1260	P	97.8	Very high	96.8	Very high	2 Å²	2	72 Å²	72	1%	0.013	34%	0.344	C	S	.	.			trans	-81.5	131.5	-175.3	31.9	-36.7	0	0	0	112.6	R1217 A1218 L1221 P1233 A1254 T1257 L1258 Y1262	R1217-P1260 CarbonylContact C-O 3.59Å; R1217-P1260 WeakPolarHBondContact CA-O 3.08Å; R1217-P1260 VanDerWaalsContact CB-O 3.28Å; R1217-P1260 WeakPolarHBondContact CB-O 3.25Å; A1218-P1260 HydrophobicContact CB-CG 3.89Å; A1218-P1260 PolarHBondContact N-O 2.86Å; A1218-P1260 WeakPolarHBondContact O-CD 3.32Å; L1221-P1260 HydrophobicContact CD1-CG 3.81Å; P1233-P1260 HydrophobicContact CB-CG 4.35Å; P1233-P1260 HydrophobicContact CG-CB 3.61Å; P1233-P1260 HydrophobicContact CG-CG 3.61Å; A1254-P1260 HydrophobicContact CB-CB 3.74Å; T1257-P1260 HydrophobicContact CG2-CB 3.82Å; L1258-P1260 VanDerWaalsContact C-CD 3.45Å; L1258-P1260 WeakPolarHBondContact O-CD 3.43Å; P1260-Y1262 HydrophobicContact CB-CD2 4.44Å; P1260-Y1262 HydrophobicContact CB-CE1 4.26Å; P1260-Y1262 HydrophobicContact CB-CE2 3.73Å; P1260-Y1262 HydrophobicContact CG-CE2 3.54Å; P1260-Y1262 WeakPolarHBondContact CG-OH 3.2Å
1261	L	98	Very high	96.6	Very high	102 Å²	102	67 Å²	67	53%	0.534	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.3	165.3	-173.9	64.6	0	0	0	108.4	R1217 Q1263	R1217-L1261 HydrophobicContact CB-CD1 4.09Å; L1261-Q1263 HydrophobicContact CD1-CG 3.74Å; L1261-Q1263 HydrophobicContact CG-CG 4.12Å
1262	Y	97.8	Very high	96.4	Very high	12 Å²	12	67 Å²	67	5%	0.047	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-51.3	-179	-64	-74.1	0	0	0	112.3	V1215 I1216 P1233 Y1234 V1235 T1251 A1254 P1260 Q1264	V1215-Y1262 HydrophobicContact CG1-CD2 3.73Å; V1215-Y1262 HydrophobicContact CG1-CE2 4.42Å; V1215-Y1262 HydrophobicContact CG1-CG 4.06Å; V1215-Y1262 VanDerWaalsContact O-CB 3.31Å; V1215-Y1262 WeakPolarHBondContact O-CB 3.41Å; I1216-Y1262 PolarHBondContact O-N 2.98Å; P1233-Y1262 VanDerWaalsContact C-OH 3.3Å; P1233-Y1262 WeakPolarHBondContact CB-OH 3.4Å; P1233-Y1262 PolarHBondContact O-OH 2.92Å; Y1234-Y1262 WeakPolarHBondContact CA-OH 3.27Å; Y1234-Y1262 PolarHBondContact N-OH 3.06Å; V1235-Y1262 HydrophobicContact CG2-CD2 4.07Å; V1235-Y1262 HydrophobicContact CG2-CE1 4.39Å; V1235-Y1262 HydrophobicContact CG2-CE2 3.43Å; V1235-Y1262 VanDerWaalsContact CG2-CE2 3.43Å; T1251-Y1262 HydrophobicContact CG2-CD1 4.19Å; T1251-Y1262 HydrophobicContact CG2-CG 4.26Å; T1251-Y1262 WeakPolarHBondContact OG1-CD1 3.26Å; T1251-Y1262 WeakPolarHBondContact OG1-CE1 3.13Å; A1254-Y1262 HydrophobicContact CB-CD1 4.39Å; A1254-Y1262 HydrophobicContact CB-CE1 3.82Å; P1260-Y1262 HydrophobicContact CB-CD2 4.44Å; P1260-Y1262 HydrophobicContact CB-CE1 4.26Å; P1260-Y1262 HydrophobicContact CB-CE2 3.73Å; P1260-Y1262 HydrophobicContact CG-CE2 3.54Å; P1260-Y1262 WeakPolarHBondContact CG-OH 3.2Å; Y1262-Q1264 WeakPolarHBondContact O-CG 3.36Å; Y1262-Q1264 PolarHBondContact O-N 2.76Å; Y1262-Q1264 PolarHBondContact O-NE2 2.79Å
1263	Q	96.7	Very high	96.1	Very high	126 Å²	126	64.4 Å²	64.4	59%	0.589	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	44.1	60.7	-176.1	-61.5	-176.7	-86.3	0	0	112.2	V1215 I1216 L1261	V1215-Q1263 WeakPolarHBondContact O-CA 3.46Å; V1215-Q1263 PolarHBondContact O-N 3.01Å; I1216-Q1263 PolarHBondContact O-N 3.22Å; L1261-Q1263 HydrophobicContact CD1-CG 3.74Å; L1261-Q1263 HydrophobicContact CG-CG 4.12Å
1264	Q	96.9	Very high	95.8	Very high	44 Å²	44	61.7 Å²	61.7	21%	0.206	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	108.3	-171.6	-86.3	161.2	76.3	0	0	111.4	V1215 T1251 Y1262	V1215-Q1264 PolarHBondContact N-O 3.17Å; V1215-Q1264 PolarHBondContact O-N 2.84Å; T1251-Q1264 HydrophobicContact CG2-CB 4.16Å; Y1262-Q1264 WeakPolarHBondContact O-CG 3.36Å; Y1262-Q1264 PolarHBondContact O-N 2.76Å; Y1262-Q1264 PolarHBondContact O-NE2 2.79Å
1265	S	97	Very high	95.7	Very high	65 Å²	65	61.5 Å²	61.5	46%	0.455	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	131.3	163.9	-55.2	0	0	0	0	111.9	E1212	E1212-S1265 WeakPolarHBondContact OE1-CB 3.39Å; E1212-S1265 PolarHBondContact OE1-OG 2.93Å
1266	L	97.5	Very high	95.7	Very high	20 Å²	20	53 Å²	53	11%	0.105	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	90.2	169	-60.1	179.5	0	0	0	107.3	V1213 V1215 V1237 K1249 T1251 F1268	V1213-L1266 HydrophobicContact CB-CB 4.47Å; V1213-L1266 PolarHBondContact N-O 3.07Å; V1213-L1266 PolarHBondContact O-N 2.8Å; V1215-L1266 HydrophobicContact CG2-CD1 3.88Å; V1215-L1266 HydrophobicContact CG2-CG 4.43Å; V1237-L1266 HydrophobicContact CB-CD1 4.23Å; V1237-L1266 HydrophobicContact CG2-CD1 3.79Å; K1249-L1266 HydrophobicContact CB-CB 4.19Å; K1249-L1266 HydrophobicContact CB-CD1 4.28Å; K1249-L1266 HydrophobicContact CB-CD2 4.3Å; T1251-L1266 HydrophobicContact CG2-CD1 4.42Å; L1266-F1268 HydrophobicContact CB-CE2 4.2Å; L1266-F1268 VanDerWaalsContact O-CD2 3.3Å; L1266-F1268 WeakPolarHBondContact O-CD2 3.23Å; L1266-F1268 PolarHBondContact O-N 3.41Å
1267	V	97.1	Very high	95.8	Very high	55 Å²	55	47.9 Å²	47.9	33%	0.333	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	123.7	173.4	-177.1	0	0	0	0	108.8	Q1210 E1212 K1249	Q1210-V1267 HydrophobicContact CB-CG1 4.1Å; E1212-V1267 HydrophobicContact CB-CG2 4.26Å; E1212-V1267 HydrophobicContact CG-CG2 3.94Å; K1249-V1267 WeakPolarHBondContact CD-O 3.43Å; K1249-V1267 VanDerWaalsContact CE-O 3.31Å; K1249-V1267 WeakPolarHBondContact CE-O 3.44Å; K1249-V1267 PolarHBondContact NZ-O 3.44Å
1268	F	96.9	Very high	95.8	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.			trans	-93.6	145.2	168.2	-74.6	-95.4	0	0	0	108.9	Q1210 L1211 V1213 V1237 L1239 A1247 K1249 L1266 E1270	Q1210-F1268 WeakPolarHBondContact CA-O 3.47Å; Q1210-F1268 VanDerWaalsContact CB-O 3.3Å; Q1210-F1268 WeakPolarHBondContact CB-O 3.01Å; L1211-F1268 HydrophobicContact CB-CB 4.18Å; L1211-F1268 PolarHBondContact N-O 2.62Å; L1211-F1268 WeakPolarHBondContact O-CB 3.43Å; L1211-F1268 PolarHBondContact O-N 2.68Å; V1213-F1268 HydrophobicContact CB-CE2 4.35Å; V1213-F1268 HydrophobicContact CG2-CD2 3.87Å; V1213-F1268 HydrophobicContact CG2-CE2 3.85Å; V1237-F1268 HydrophobicContact CB-CE2 4.29Å; V1237-F1268 HydrophobicContact CB-CZ 4.02Å; V1237-F1268 HydrophobicContact CG1-CE2 3.86Å; V1237-F1268 HydrophobicContact CG1-CZ 3.75Å; L1239-F1268 HydrophobicContact CB-CD1 4.09Å; L1239-F1268 HydrophobicContact CB-CE1 4.03Å; L1239-F1268 HydrophobicContact CD2-CB 4.39Å; L1239-F1268 HydrophobicContact CD2-CD1 4.15Å; L1239-F1268 HydrophobicContact CD2-CG 4.44Å; A1247-F1268 HydrophobicContact CB-CD1 3.67Å; A1247-F1268 HydrophobicContact CB-CE1 3.86Å; K1249-F1268 HydrophobicContact CB-CE1 4.2Å; K1249-F1268 HydrophobicContact CB-CE2 4.23Å; K1249-F1268 HydrophobicContact CB-CZ 3.79Å; K1249-F1268 HydrophobicContact CD-CD1 4.14Å; K1249-F1268 HydrophobicContact CD-CD2 4.46Å; K1249-F1268 HydrophobicContact CD-CE1 4.18Å; K1249-F1268 HydrophobicContact CD-CE2 4.49Å; K1249-F1268 HydrophobicContact CD-CG 4.29Å; K1249-F1268 HydrophobicContact CD-CZ 4.36Å; K1249-F1268 HydrophobicContact CG-CD1 4.25Å; K1249-F1268 HydrophobicContact CG-CE1 3.81Å; K1249-F1268 HydrophobicContact CG-CE2 4.44Å; K1249-F1268 HydrophobicContact CG-CZ 3.91Å; L1266-F1268 HydrophobicContact CB-CE2 4.2Å; L1266-F1268 VanDerWaalsContact O-CD2 3.3Å; L1266-F1268 WeakPolarHBondContact O-CD2 3.23Å; L1266-F1268 PolarHBondContact O-N 3.41Å; F1268-E1270 WeakPolarHBondContact CB-OE2 3.12Å
1269	D	95.3	Very high	95.8	Very high	104 Å²	104	46 Å²	46	56%	0.556	25%	0.251	S	S	*	.	S	Bend	trans	-87.5	-5.8	-174.9	-53.8	-80.4	0	0	0	110.9	K1249	K1249-D1269 IonicContact NZ-OD2 3.55Å; K1249-D1269 PolarHBondContact NZ-OD2 2.85Å
1270	E	94.1	Very high	95.8	Very high	57 Å²	57	42.5 Å²	42.5	27%	0.266	23%	0.232	S	C	.	.	S	Bend	trans	-102.2	147.8	-177.9	-49.2	82.7	177.2	0	0	111.8	G1209 L1211 L1239 I1246 A1247 F1268	G1209-E1270 CarbonylContact O-C 3.55Å; L1211-E1270 PolarHBondContact N-O 3.17Å; L1239-E1270 HydrophobicContact CD2-CB 3.79Å; L1239-E1270 HydrophobicContact CD2-CG 4.39Å; I1246-E1270 HydrophobicContact CD1-CB 4.28Å; I1246-E1270 HydrophobicContact CD1-CG 4.08Å; A1247-E1270 VanDerWaalsContact CB-OE1 3.27Å; A1247-E1270 WeakPolarHBondContact CB-OE1 3.34Å; F1268-E1270 WeakPolarHBondContact CB-OE2 3.12Å
1271	S	92.9	Very high	95.8	Very high	39 Å²	39	42.4 Å²	42.4	27%	0.273	23%	0.232	S	C	.	.			trans	-73.2	151.3	177.5	68.9	0	0	0	0	112.2	G1209 Q1273 K1275	G1209-S1271 VanDerWaalsContact O-CA 3.26Å; G1209-S1271 WeakPolarHBondContact O-CA 3.32Å; G1209-S1271 PolarHBondContact O-N 2.8Å; S1271-Q1273 VanDerWaalsContact C-N 3.32Å; S1271-Q1273 PolarHBondContact O-N 3.09Å; S1271-K1275 WeakPolarHBondContact O-CD 3.27Å; S1271-K1275 WeakPolarHBondContact O-CE 3.5Å; S1271-K1275 PolarHBondContact O-NZ 2.99Å
1272	P	93.4	Very high	95.8	Very high	6 Å²	6	39 Å²	39	4%	0.039	21%	0.212	C	C	.	.			trans	-74.2	-16.4	-178.5	28.2	-34.3	0	0	0	115.1	D1206 L1211 G1274 K1275 L1301 L1306	D1206-P1272 HydrophobicContact CB-CG 4.09Å; D1206-P1272 WeakPolarHBondContact OD2-CD 2.98Å; D1206-P1272 WeakPolarHBondContact OD2-CG 3.4Å; L1211-P1272 HydrophobicContact CB-CB 4.45Å; L1211-P1272 HydrophobicContact CD1-CB 4.3Å; L1211-P1272 HydrophobicContact CD2-CB 4.48Å; P1272-G1274 PolarHBondContact O-N 3.43Å; P1272-K1275 PolarHBondContact O-N 3.22Å; P1272-L1301 HydrophobicContact CB-CB 4Å; P1272-L1301 HydrophobicContact CB-CD1 4.08Å; P1272-L1301 WeakPolarHBondContact O-CB 3.37Å; P1272-L1306 HydrophobicContact CB-CD1 3.46Å; P1272-L1306 VanDerWaalsContact CB-CD1 3.46Å; P1272-L1306 HydrophobicContact CG-CD1 3.72Å
1273	Q	90.9	Very high	95.7	Very high	145 Å²	145	38.4 Å²	38.4	68%	0.678	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	135.3	-173.6	-65.4	175.1	-11	0	0	111.9	S1271 K1275	S1271-Q1273 VanDerWaalsContact C-N 3.32Å; S1271-Q1273 PolarHBondContact O-N 3.09Å; Q1273-K1275 WeakPolarHBondContact O-CG 3.13Å; Q1273-K1275 PolarHBondContact O-N 3.38Å; Q1273-K1275 PolarHBondContact O-NZ 3.35Å
1274	G	90.4	Very high	95.6	Very high	37 Å²	37	34.4 Å²	34.4	38%	0.381	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	11.5	178.8	0	0	0	0	0	116.1	P1272	P1272-G1274 PolarHBondContact O-N 3.43Å
1275	K	95	Very high	95.5	Very high	14 Å²	14	33.6 Å²	33.6	6%	0.061	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	155.5	-169	-67.4	170.3	-163.5	52.3	0	114	L1239 L1240 E1241 I1246 S1271 P1272 Q1273 L1301	L1239-K1275 HydrophobicContact CD1-CB 3.78Å; L1239-K1275 HydrophobicContact CD1-CD 3.96Å; L1239-K1275 HydrophobicContact CD1-CG 4.43Å; L1239-K1275 HydrophobicContact CD2-CD 3.92Å; L1239-K1275 HydrophobicContact CG-CB 4.45Å; L1239-K1275 HydrophobicContact CG-CD 3.89Å; L1240-K1275 CarbonylContact O-C 3.58Å; L1240-K1275 VanDerWaalsContact O-CA 3.26Å; L1240-K1275 WeakPolarHBondContact O-CA 3.43Å; L1240-K1275 VanDerWaalsContact O-CB 3.27Å; L1240-K1275 WeakPolarHBondContact O-CB 3.46Å; E1241-K1275 HydrophobicContact CB-CG 3.99Å; E1241-K1275 HydrophobicContact CG-CG 4.12Å; E1241-K1275 WeakPolarHBondContact OE1-CE 3.45Å; E1241-K1275 IonicContact OE1-NZ 3.52Å; E1241-K1275 PolarHBondContact OE1-NZ 2.8Å; I1246-K1275 HydrophobicContact CD1-CD 3.88Å; S1271-K1275 WeakPolarHBondContact O-CD 3.27Å; S1271-K1275 WeakPolarHBondContact O-CE 3.5Å; S1271-K1275 PolarHBondContact O-NZ 2.99Å; P1272-K1275 PolarHBondContact O-N 3.22Å; Q1273-K1275 WeakPolarHBondContact O-CG 3.13Å; Q1273-K1275 PolarHBondContact O-N 3.38Å; Q1273-K1275 PolarHBondContact O-NZ 3.35Å; K1275-L1301 HydrophobicContact CB-CD1 4.1Å; K1275-L1301 WeakPolarHBondContact O-CB 3.31Å; K1275-L1301 PolarHBondContact O-N 3.02Å
1276	V	95.9	Very high	95	Very high	25 Å²	25	31.8 Å²	31.8	15%	0.152	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.6	176.2	172.9	0	0	0	0	109.5	L1186 L1240 Q1298 I1299 L1300	L1186-V1276 HydrophobicContact CD1-CG1 4Å; L1186-V1276 HydrophobicContact CD1-CG2 3.92Å; L1240-V1276 WeakPolarHBondContact CA-O 3.35Å; L1240-V1276 HydrophobicContact CB-CB 4.27Å; L1240-V1276 VanDerWaalsContact CB-O 3.29Å; L1240-V1276 WeakPolarHBondContact CB-O 3.05Å; L1240-V1276 HydrophobicContact CD1-CG1 4.36Å; L1240-V1276 PolarHBondContact N-O 3.24Å; L1240-V1276 PolarHBondContact O-N 2.89Å; V1276-Q1298 HydrophobicContact CG1-CB 4.13Å; V1276-Q1298 HydrophobicContact CG1-CG 4.29Å; V1276-I1299 CarbonylContact C-O 3.55Å; V1276-I1299 VanDerWaalsContact CA-O 3.3Å; V1276-I1299 WeakPolarHBondContact CA-O 3.27Å; V1276-L1300 HydrophobicContact CG2-CD1 3.7Å
1277	L	96.7	Very high	94.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	117.6	174.1	-157.8	70.3	0	0	0	109.9	M1204 L1211 V1213 V1237 L1239 V1279 Q1298 I1299 L1301	M1204-L1277 HydrophobicContact CG-CD2 4.02Å; M1204-L1277 HydrophobicContact SD-CD2 3.65Å; L1211-L1277 HydrophobicContact CD2-CD1 4.06Å; V1213-L1277 HydrophobicContact CG1-CD2 3.91Å; V1213-L1277 HydrophobicContact CG2-CD1 4.21Å; V1213-L1277 HydrophobicContact CG2-CD2 3.77Å; V1237-L1277 HydrophobicContact CG1-CD1 3.42Å; V1237-L1277 VanDerWaalsContact CG1-CD1 3.42Å; V1237-L1277 HydrophobicContact CG1-CD2 4Å; V1237-L1277 HydrophobicContact CG1-CG 3.68Å; L1239-L1277 HydrophobicContact CB-CD1 4.5Å; L1239-L1277 HydrophobicContact CD1-CD1 3.97Å; L1277-V1279 HydrophobicContact CD2-CG2 4.22Å; L1277-V1279 HydrophobicContact CG-CG2 4.28Å; L1277-Q1298 CarbonylContact O-C 3.55Å; L1277-Q1298 WeakPolarHBondContact O-CA 3.16Å; L1277-I1299 HydrophobicContact CB-CB 4.27Å; L1277-I1299 HydrophobicContact CD2-CD1 4.5Å; L1277-I1299 PolarHBondContact N-O 2.87Å; L1277-I1299 PolarHBondContact O-N 2.77Å; L1277-L1301 HydrophobicContact CB-CD1 4.16Å; L1277-L1301 HydrophobicContact CB-CD2 4.03Å; L1277-L1301 HydrophobicContact CB-CG 4.12Å; L1277-L1301 HydrophobicContact CD2-CD2 4.45Å
1278	Q	96.7	Very high	93.8	Very high	28 Å²	28	49.2 Å²	49.2	13%	0.131	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	115.7	174.3	-175.3	-178.4	81.1	0	0	110.2	Y1238 L1240 I1280 V1296 A1297 Q1298	Y1238-Q1278 PolarHBondContact N-O 3.17Å; Y1238-Q1278 PolarHBondContact O-N 3.46Å; L1240-Q1278 HydrophobicContact CD1-CB 3.87Å; L1240-Q1278 HydrophobicContact CG-CB 4.25Å; Q1278-I1280 HydrophobicContact CG-CD1 4.44Å; Q1278-I1280 HydrophobicContact CG-CG1 4.19Å; Q1278-V1296 HydrophobicContact CG-CG2 3.54Å; Q1278-A1297 WeakPolarHBondContact CA-O 3.16Å; Q1278-Q1298 HydrophobicContact CB-CG 4.12Å; Q1278-Q1298 HydrophobicContact CG-CG 3.97Å
1279	V	97.7	Very high	93.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115.3	-175.3	-177	0	0	0	0	108.9	I1200 I1202 V1235 V1237 L1277 V1296 A1297 I1299	I1200-V1279 HydrophobicContact CD1-CG1 3.81Å; I1200-V1279 HydrophobicContact CG2-CG1 4.36Å; I1202-V1279 HydrophobicContact CD1-CG1 4.06Å; I1202-V1279 HydrophobicContact CG1-CG1 4.42Å; V1235-V1279 HydrophobicContact CG1-CG1 3.67Å; V1237-V1279 HydrophobicContact CG1-CG2 4.44Å; V1237-V1279 HydrophobicContact CG2-CG1 4.46Å; V1237-V1279 HydrophobicContact CG2-CG2 4.43Å; L1277-V1279 HydrophobicContact CD2-CG2 4.22Å; L1277-V1279 HydrophobicContact CG-CG2 4.28Å; V1279-V1296 CarbonylContact O-C 3.55Å; V1279-V1296 WeakPolarHBondContact O-CA 3.4Å; V1279-A1297 PolarHBondContact N-O 2.93Å; V1279-A1297 PolarHBondContact O-N 3.16Å; V1279-I1299 HydrophobicContact CG2-CD1 4.34Å
1280	I	97.8	Very high	93	Very high	12 Å²	12	52 Å²	52	6%	0.062	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.9	-178.8	-50.8	-176.3	0	0	0	111.1	K1236 Y1238 Q1278 W1282 F1293 G1295 V1296	K1236-I1280 PolarHBondContact N-O 2.83Å; K1236-I1280 PolarHBondContact O-N 3.07Å; Y1238-I1280 HydrophobicContact CD2-CD1 4.23Å; Y1238-I1280 HydrophobicContact CD2-CG1 4.31Å; Y1238-I1280 HydrophobicContact CE2-CB 4.34Å; Y1238-I1280 HydrophobicContact CE2-CD1 3.67Å; Y1238-I1280 HydrophobicContact CE2-CG1 3.99Å; Q1278-I1280 HydrophobicContact CG-CD1 4.44Å; Q1278-I1280 HydrophobicContact CG-CG1 4.19Å; I1280-W1282 HydrophobicContact CD1-CZ2 4.27Å; I1280-W1282 HydrophobicContact CG2-CD2 4.21Å; I1280-W1282 VanDerWaalsContact CG2-CE2 3.48Å; I1280-W1282 HydrophobicContact CG2-CZ2 3.71Å; I1280-W1282 VanDerWaalsContact CG2-NE1 3.32Å; I1280-F1293 HydrophobicContact CG2-CD2 3.78Å; I1280-F1293 HydrophobicContact CG2-CE2 3.58Å; I1280-G1295 WeakPolarHBondContact CA-O 3.28Å; I1280-V1296 HydrophobicContact CD1-CG2 4.38Å; I1280-V1296 HydrophobicContact CG1-CB 4.13Å; I1280-V1296 HydrophobicContact CG1-CG2 3.75Å
1281	V	98.1	Very high	92.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.1	170.8	-168	0	0	0	0	110.2	I1200 L1221 P1233 V1235 M1294 G1295 L1316	I1200-V1281 HydrophobicContact CD1-CG2 4.02Å; L1221-V1281 HydrophobicContact CD1-CG1 3.88Å; L1221-V1281 HydrophobicContact CD2-CB 4.47Å; L1221-V1281 HydrophobicContact CD2-CG1 4.13Å; L1221-V1281 HydrophobicContact CD2-CG2 4.32Å; P1233-V1281 HydrophobicContact CB-CG1 4.24Å; V1235-V1281 HydrophobicContact CG2-CG2 4.36Å; V1281-M1294 HydrophobicContact CB-CB 4.06Å; V1281-M1294 HydrophobicContact CG1-CB 4.01Å; V1281-M1294 PolarHBondContact O-N 2.8Å; V1281-G1295 PolarHBondContact N-O 2.96Å; V1281-L1316 HydrophobicContact CB-CD1 4.49Å; V1281-L1316 HydrophobicContact CG2-CD1 3.6Å; V1281-L1316 HydrophobicContact CG2-CD2 4.03Å; V1281-L1316 HydrophobicContact CG2-CG 4.5Å
1282	W	97.3	Very high	92.8	Very high	29 Å²	29	53.4 Å²	53.4	11%	0.11	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.5	178.7	-62.6	92.5	0	0	0	110.3	P1233 Y1234 I1280 K1291 C1292 F1293	P1233-W1282 CarbonylContact C-O 3.57Å; P1233-W1282 WeakPolarHBondContact CA-O 3.17Å; Y1234-W1282 HydrophobicContact CD1-CB 4.14Å; Y1234-W1282 HydrophobicContact CD2-CB 4.16Å; Y1234-W1282 HydrophobicContact CE1-CB 3.66Å; Y1234-W1282 HydrophobicContact CE2-CB 3.67Å; Y1234-W1282 AromaticContact CE2-CD1 3.8Å; Y1234-W1282 AromaticContact CE2-CG 3.9Å; Y1234-W1282 HydrophobicContact CE2-CG 3.9Å; Y1234-W1282 HydrophobicContact CG-CB 4.37Å; Y1234-W1282 AromaticContact CZ-CG 3.9Å; Y1234-W1282 PolarHBondContact N-O 2.72Å; Y1234-W1282 PolarHBondContact O-N 2.73Å; I1280-W1282 HydrophobicContact CD1-CZ2 4.27Å; I1280-W1282 HydrophobicContact CG2-CD2 4.21Å; I1280-W1282 VanDerWaalsContact CG2-CE2 3.48Å; I1280-W1282 HydrophobicContact CG2-CZ2 3.71Å; I1280-W1282 VanDerWaalsContact CG2-NE1 3.32Å; W1282-K1291 HydrophobicContact CD2-CG 4.2Å; W1282-K1291 HydrophobicContact CE3-CD 4.27Å; W1282-K1291 HydrophobicContact CE3-CG 3.62Å; W1282-K1291 HydrophobicContact CZ3-CD 4.21Å; W1282-K1291 HydrophobicContact CZ3-CG 4.01Å; W1282-C1292 CarbonylContact C-O 3.54Å; W1282-C1292 VanDerWaalsContact CA-O 3.29Å; W1282-C1292 WeakPolarHBondContact CA-O 3.23Å; W1282-F1293 HydrophobicContact CE3-CB 4.36Å; W1282-F1293 HydrophobicContact CH2-CD2 4.08Å; W1282-F1293 HydrophobicContact CZ2-CD2 4.46Å; W1282-F1293 HydrophobicContact CZ3-CB 3.95Å; W1282-F1293 HydrophobicContact CZ3-CD2 4.24Å
1283	G	96	Very high	93	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.4	178.1	0	0	0	0	0	112.8	C1292 M1294	G1283-C1292 PolarHBondContact N-O 3.1Å; G1283-C1292 WeakPolarHBondContact O-CB 3.42Å; G1283-C1292 PolarHBondContact O-N 3.04Å; G1283-M1294 VanDerWaalsContact CA-SD 3.54Å
1284	D	95.2	Very high	93.2	Very high	43 Å²	43	48.6 Å²	48.6	23%	0.23	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	105.7	167.7	-179.4	3.8	0	0	0	110.1	P1231 A1232 G1286 H1290	P1231-D1284 CarbonylContact C-O 3.57Å; P1231-D1284 WeakPolarHBondContact CA-O 3.12Å; A1232-D1284 HydrophobicContact CB-CB 4.39Å; A1232-D1284 PolarHBondContact N-O 3.28Å; A1232-D1284 WeakPolarHBondContact O-CB 3.25Å; A1232-D1284 PolarHBondContact O-N 3.3Å; D1284-G1286 VanDerWaalsContact C-N 3.3Å; D1284-G1286 VanDerWaalsContact OD1-CA 3.25Å; D1284-G1286 WeakPolarHBondContact OD1-CA 3.48Å; D1284-G1286 PolarHBondContact OD1-N 2.87Å; D1284-H1290 WeakPolarHBondContact OD1-CA 3.14Å
1285	Y	93.3	Very high	93.5	Very high	26 Å²	26	46.8 Å²	46.8	10%	0.102	22%	0.219	C	C	.	.			trans	-85	-4.3	173.5	-71.6	-92.1	0	0	0	112.7	Q1223 K1224 S1227 S1229 P1231 D1289 C1292	Q1223-Y1285 HydrophobicContact CG-CE1 4.33Å; K1224-Y1285 HydrophobicContact CB-CE1 4.44Å; K1224-Y1285 HydrophobicContact CB-CE2 4.15Å; K1224-Y1285 WeakPolarHBondContact CB-OH 3.25Å; K1224-Y1285 PolarHBondContact N-OH 3.36Å; S1227-Y1285 WeakPolarHBondContact OG-CE1 3.43Å; S1229-Y1285 VanDerWaalsContact O-CD1 3.23Å; S1229-Y1285 WeakPolarHBondContact O-CD1 3.33Å; S1229-Y1285 VanDerWaalsContact O-CE1 3.22Å; S1229-Y1285 WeakPolarHBondContact O-CE1 3.27Å; P1231-Y1285 HydrophobicContact CB-CD1 4.27Å; P1231-Y1285 HydrophobicContact CB-CD2 4.08Å; P1231-Y1285 HydrophobicContact CB-CE1 3.96Å; P1231-Y1285 HydrophobicContact CB-CE2 3.74Å; P1231-Y1285 HydrophobicContact CB-CG 4.32Å; P1231-Y1285 HydrophobicContact CG-CE1 4.14Å; P1231-Y1285 HydrophobicContact CG-CE2 4.26Å; Y1285-D1289 WeakPolarHBondContact CB-O 3.48Å; Y1285-D1289 PolarHBondContact N-O 3.21Å; Y1285-C1292 HydrophobicContact CD2-CB 3.71Å; Y1285-C1292 HydrophobicContact CE2-CB 3.5Å
1286	G	88	Confident	93.5	Very high	28 Å²	28	46.1 Å²	46.1	29%	0.289	22%	0.216	S	C	.	.	S	Bend	trans	111.8	-172.4	-174.3	0	0	0	0	0	112.2	D1284 M1288 D1289 H1290	D1284-G1286 VanDerWaalsContact C-N 3.3Å; D1284-G1286 VanDerWaalsContact OD1-CA 3.25Å; D1284-G1286 WeakPolarHBondContact OD1-CA 3.48Å; D1284-G1286 PolarHBondContact OD1-N 2.87Å; G1286-M1288 PolarHBondContact O-N 3.33Å; G1286-D1289 CarbonylContact O-C 3.58Å; G1286-D1289 VanDerWaalsContact O-C 3.28Å; G1286-D1289 PolarHBondContact O-N 2.64Å; G1286-H1290 PolarHBondContact O-N 2.68Å
1287	R	85.4	Confident	93.5	Very high	251 Å²	251	45 Å²	45	95%	0.947	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-31.7	-168.9	-61	-174.8	-174	178.6	2.2	116.3
1288	M	82.4	Confident	93.5	Very high	190 Å²	190	46.1 Å²	46.1	94%	0.936	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-24.8	-177	-158.8	66.7	70.4	0	0	113.8	G1286	G1286-M1288 PolarHBondContact O-N 3.33Å
1289	D	86	Confident	93.4	Very high	41 Å²	41	44.8 Å²	44.8	22%	0.219	21%	0.208	C	C	.	.			trans	-154.5	70.9	-176.4	-171.4	0.5	0	0	0	109.6	K1224 Y1285 G1286 K1291 C1292	K1224-D1289 IonicContact NZ-OD2 2.67Å; K1224-D1289 PolarHBondContact NZ-OD2 2.77Å; Y1285-D1289 WeakPolarHBondContact CB-O 3.48Å; Y1285-D1289 PolarHBondContact N-O 3.21Å; G1286-D1289 CarbonylContact O-C 3.58Å; G1286-D1289 VanDerWaalsContact O-C 3.28Å; G1286-D1289 PolarHBondContact O-N 2.64Å; D1289-K1291 PolarHBondContact O-N 2.73Å; D1289-C1292 PolarHBondContact OD1-N 2.81Å
1290	H	89.1	Confident	93.3	Very high	120 Å²	120	46 Å²	46	56%	0.556	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	6.5	-175.4	61.6	-93.7	0	0	0	113.3	D1284 G1286	D1284-H1290 WeakPolarHBondContact OD1-CA 3.14Å; G1286-H1290 PolarHBondContact O-N 2.68Å
1291	K	91.5	Very high	93.1	Very high	110 Å²	110	45.6 Å²	45.6	48%	0.478	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-154.9	49.7	-172.5	-160.2	-158.9	169.8	-163.9	0	111.9	W1282 D1289	W1282-K1291 HydrophobicContact CD2-CG 4.2Å; W1282-K1291 HydrophobicContact CE3-CD 4.27Å; W1282-K1291 HydrophobicContact CE3-CG 3.62Å; W1282-K1291 HydrophobicContact CZ3-CD 4.21Å; W1282-K1291 HydrophobicContact CZ3-CG 4.01Å; D1289-K1291 PolarHBondContact O-N 2.73Å
1292	C	93.1	Very high	92.8	Very high	17 Å²	17	52.1 Å²	52.1	12%	0.115	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	135.7	170.6	-177.9	0	0	0	0	109.9	W1282 G1283 Y1285 D1289	W1282-C1292 CarbonylContact C-O 3.54Å; W1282-C1292 VanDerWaalsContact CA-O 3.29Å; W1282-C1292 WeakPolarHBondContact CA-O 3.23Å; G1283-C1292 PolarHBondContact N-O 3.1Å; G1283-C1292 WeakPolarHBondContact O-CB 3.42Å; G1283-C1292 PolarHBondContact O-N 3.04Å; Y1285-C1292 HydrophobicContact CD2-CB 3.71Å; Y1285-C1292 HydrophobicContact CE2-CB 3.5Å; D1289-C1292 PolarHBondContact OD1-N 2.81Å
1293	F	95.8	Very high	92.5	Very high	49 Å²	49	53.8 Å²	53.8	22%	0.215	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	138.8	169.7	179.7	-89.7	0	0	0	110.1	M1197 I1280 W1282 G1295 V1296 P1319	M1197-F1293 HydrophobicContact CE-CD1 4.45Å; M1197-F1293 HydrophobicContact SD-CE1 4.02Å; I1280-F1293 HydrophobicContact CG2-CD2 3.78Å; I1280-F1293 HydrophobicContact CG2-CE2 3.58Å; W1282-F1293 HydrophobicContact CE3-CB 4.36Å; W1282-F1293 HydrophobicContact CH2-CD2 4.08Å; W1282-F1293 HydrophobicContact CZ2-CD2 4.46Å; W1282-F1293 HydrophobicContact CZ3-CB 3.95Å; W1282-F1293 HydrophobicContact CZ3-CD2 4.24Å; F1293-G1295 VanDerWaalsContact CZ-CA 3.48Å; F1293-V1296 HydrophobicContact CE2-CB 4.18Å; F1293-V1296 HydrophobicContact CZ-CB 3.91Å; F1293-V1296 HydrophobicContact CZ-CG1 3.94Å; F1293-P1319 HydrophobicContact CD1-CG 4.06Å; F1293-P1319 HydrophobicContact CD2-CG 4.35Å; F1293-P1319 VanDerWaalsContact CE1-CD 3.48Å; F1293-P1319 HydrophobicContact CE1-CG 3.7Å; F1293-P1319 HydrophobicContact CE2-CG 4Å; F1293-P1319 HydrophobicContact CG-CG 4.37Å; F1293-P1319 HydrophobicContact CZ-CG 3.66Å
1294	M	95.5	Very high	92.3	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	10.2	179.9	-62.2	-167.9	77.8	0	0	113.9	L1221 T1222 P1231 P1233 L1258 V1281 G1283	L1221-M1294 HydrophobicContact CB-CE 3.78Å; L1221-M1294 HydrophobicContact CD1-CE 4.44Å; T1222-M1294 VanDerWaalsContact O-CE 3.29Å; T1222-M1294 WeakPolarHBondContact O-CE 3.42Å; P1231-M1294 HydrophobicContact CB-SD 4.12Å; P1231-M1294 HydrophobicContact CG-CE 3.62Å; P1231-M1294 HydrophobicContact CG-SD 3.71Å; P1233-M1294 HydrophobicContact CB-SD 4.4Å; L1258-M1294 HydrophobicContact CD2-CE 4.26Å; V1281-M1294 HydrophobicContact CB-CB 4.06Å; V1281-M1294 HydrophobicContact CG1-CB 4.01Å; V1281-M1294 PolarHBondContact O-N 2.8Å; G1283-M1294 VanDerWaalsContact CA-SD 3.54Å
1295	G	96.3	Very high	92.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.8	153.9	174.8	0	0	0	0	0	114	I1280 V1281 F1293 F1317	I1280-G1295 WeakPolarHBondContact CA-O 3.28Å; V1281-G1295 PolarHBondContact N-O 2.96Å; F1293-G1295 VanDerWaalsContact CZ-CA 3.48Å; G1295-F1317 CarbonylContact C-O 3.56Å; G1295-F1317 WeakPolarHBondContact CA-O 3.32Å
1296	V	96.6	Very high	92.2	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	144.1	175.7	62.7	0	0	0	0	111.7	Q1278 V1279 I1280 F1293 F1317 L1322	Q1278-V1296 HydrophobicContact CG-CG2 3.54Å; V1279-V1296 CarbonylContact O-C 3.55Å; V1279-V1296 WeakPolarHBondContact O-CA 3.4Å; I1280-V1296 HydrophobicContact CD1-CG2 4.38Å; I1280-V1296 HydrophobicContact CG1-CB 4.13Å; I1280-V1296 HydrophobicContact CG1-CG2 3.75Å; F1293-V1296 HydrophobicContact CE2-CB 4.18Å; F1293-V1296 HydrophobicContact CZ-CB 3.91Å; F1293-V1296 HydrophobicContact CZ-CG1 3.94Å; V1296-F1317 PolarHBondContact N-O 3.28Å; V1296-F1317 PolarHBondContact O-N 3.21Å; V1296-L1322 HydrophobicContact CG1-CD1 4.36Å; V1296-L1322 HydrophobicContact CG1-CD2 4.03Å; V1296-L1322 HydrophobicContact CG1-CG 4.19Å; V1296-L1322 HydrophobicContact CG2-CD2 4.16Å
1297	A	96.2	Very high	92.5	Very high	2 Å²	2	60.7 Å²	60.7	2%	0.017	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	151.5	160.2	0	0	0	0	0	109.8	Q1278 V1279 L1316	Q1278-A1297 WeakPolarHBondContact CA-O 3.16Å; V1279-A1297 PolarHBondContact N-O 2.93Å; V1279-A1297 PolarHBondContact O-N 3.16Å; A1297-L1316 HydrophobicContact CB-CD2 4.33Å
1298	Q	94.8	Very high	92.8	Very high	22 Å²	22	52 Å²	52	10%	0.103	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.8	168.3	-78.2	-176.7	-49.7	0	0	109.3	Q1185 L1186 V1276 L1277 Q1278 L1322	Q1185-Q1298 CarbonylContact C-O 3.57Å; Q1185-Q1298 WeakPolarHBondContact CA-O 3.2Å; Q1185-Q1298 WeakPolarHBondContact CG-O 3.34Å; L1186-Q1298 HydrophobicContact CB-CB 3.94Å; L1186-Q1298 PolarHBondContact N-O 2.96Å; V1276-Q1298 HydrophobicContact CG1-CB 4.13Å; V1276-Q1298 HydrophobicContact CG1-CG 4.29Å; L1277-Q1298 CarbonylContact O-C 3.55Å; L1277-Q1298 WeakPolarHBondContact O-CA 3.16Å; Q1278-Q1298 HydrophobicContact CB-CG 4.12Å; Q1278-Q1298 HydrophobicContact CG-CG 3.97Å; Q1298-L1322 HydrophobicContact CG-CD2 4.01Å
1299	I	95.6	Very high	93.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	125.4	-174.6	-47.6	173	0	0	0	107.5	A1184 M1204 V1276 L1277 V1279 L1301 L1304 Y1314	A1184-I1299 HydrophobicContact CB-CG2 4.17Å; A1184-I1299 WeakPolarHBondContact O-CA 3.39Å; M1204-I1299 HydrophobicContact CE-CD1 4.11Å; M1204-I1299 HydrophobicContact SD-CD1 3.86Å; M1204-I1299 HydrophobicContact SD-CG2 4.32Å; V1276-I1299 CarbonylContact C-O 3.55Å; V1276-I1299 VanDerWaalsContact CA-O 3.3Å; V1276-I1299 WeakPolarHBondContact CA-O 3.27Å; L1277-I1299 HydrophobicContact CB-CB 4.27Å; L1277-I1299 HydrophobicContact CD2-CD1 4.5Å; L1277-I1299 PolarHBondContact N-O 2.87Å; L1277-I1299 PolarHBondContact O-N 2.77Å; V1279-I1299 HydrophobicContact CG2-CD1 4.34Å; I1299-L1301 PolarHBondContact O-N 2.89Å; I1299-L1304 HydrophobicContact CG2-CD1 3.95Å; I1299-Y1314 HydrophobicContact CB-CE1 4.41Å; I1299-Y1314 HydrophobicContact CD1-CD1 3.73Å; I1299-Y1314 HydrophobicContact CD1-CD2 4.11Å; I1299-Y1314 HydrophobicContact CD1-CE1 3.5Å; I1299-Y1314 VanDerWaalsContact CD1-CE1 3.5Å; I1299-Y1314 HydrophobicContact CD1-CE2 3.89Å; I1299-Y1314 HydrophobicContact CD1-CG 4.05Å; I1299-Y1314 HydrophobicContact CG1-CD1 3.73Å; I1299-Y1314 HydrophobicContact CG1-CE1 3.57Å; I1299-Y1314 HydrophobicContact CG1-CG 4.46Å; I1299-Y1314 HydrophobicContact CG2-CE1 4.02Å
1300	L	94.6	Very high	93.8	Very high	27 Å²	27	45.4 Å²	45.4	14%	0.141	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.3	173.7	-176.9	57.4	0	0	0	109.1	A1184 L1186 V1276 E1302 E1303	A1184-L1300 HydrophobicContact CB-CB 4.5Å; A1184-L1300 WeakPolarHBondContact CB-O 3.29Å; A1184-L1300 PolarHBondContact O-N 2.84Å; L1186-L1300 HydrophobicContact CD1-CB 4.14Å; L1186-L1300 HydrophobicContact CD2-CB 4.12Å; L1186-L1300 HydrophobicContact CG-CB 4.1Å; V1276-L1300 HydrophobicContact CG2-CD1 3.7Å; L1300-E1302 VanDerWaalsContact C-N 3.28Å; L1300-E1302 HydrophobicContact CD1-CB 4.39Å; L1300-E1302 HydrophobicContact CG-CB 4.36Å; L1300-E1302 PolarHBondContact O-N 2.98Å; L1300-E1303 HydrophobicContact CD2-CG 4.18Å; L1300-E1303 PolarHBondContact O-N 2.84Å
1301	L	95.3	Very high	94.1	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-72.2	-25	-171.9	-65.3	166.7	0	0	0	112.7	M1204 L1211 L1239 P1272 K1275 L1277 I1299 E1303 L1304 L1306	M1204-L1301 HydrophobicContact CG-CD2 4.44Å; M1204-L1301 HydrophobicContact SD-CD2 3.88Å; L1211-L1301 HydrophobicContact CD1-CD2 4.44Å; L1211-L1301 HydrophobicContact CD2-CD1 3.56Å; L1211-L1301 HydrophobicContact CD2-CD2 4.36Å; L1239-L1301 HydrophobicContact CD1-CD1 3.56Å; P1272-L1301 HydrophobicContact CB-CB 4Å; P1272-L1301 HydrophobicContact CB-CD1 4.08Å; P1272-L1301 WeakPolarHBondContact O-CB 3.37Å; K1275-L1301 HydrophobicContact CB-CD1 4.1Å; K1275-L1301 WeakPolarHBondContact O-CB 3.31Å; K1275-L1301 PolarHBondContact O-N 3.02Å; L1277-L1301 HydrophobicContact CB-CD1 4.16Å; L1277-L1301 HydrophobicContact CB-CD2 4.03Å; L1277-L1301 HydrophobicContact CB-CG 4.12Å; L1277-L1301 HydrophobicContact CD2-CD2 4.45Å; I1299-L1301 PolarHBondContact O-N 2.89Å; L1301-E1303 VanDerWaalsContact C-N 3.26Å; L1301-E1303 PolarHBondContact O-N 2.96Å; L1301-L1304 PolarHBondContact O-N 3.28Å; L1301-L1304 VanDerWaalsContact O-N 3.16Å; L1301-L1306 HydrophobicContact CB-CD1 4.31Å; L1301-L1306 HydrophobicContact CD2-CD1 4.18Å
1302	E	91.5	Very high	94.3	Very high	137 Å²	137	38.7 Å²	38.7	64%	0.64	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-69.2	-18.9	177.5	-173.5	169.8	-150.3	0	0	113.8	L1300 L1304	L1300-E1302 VanDerWaalsContact C-N 3.28Å; L1300-E1302 HydrophobicContact CD1-CB 4.39Å; L1300-E1302 HydrophobicContact CG-CB 4.36Å; L1300-E1302 PolarHBondContact O-N 2.98Å; E1302-L1304 VanDerWaalsContact C-N 3.3Å
1303	E	90.7	Very high	94.5	Very high	64 Å²	64	40.9 Å²	40.9	30%	0.299	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-82	-4.7	172	-88.7	-177.4	-123.5	0	0	113.3	A1184 L1300 L1301 P1329 T1331	A1184-E1303 HydrophobicContact CB-CB 3.45Å; A1184-E1303 VanDerWaalsContact CB-CB 3.45Å; A1184-E1303 HydrophobicContact CB-CG 4.38Å; L1300-E1303 HydrophobicContact CD2-CG 4.18Å; L1300-E1303 PolarHBondContact O-N 2.84Å; L1301-E1303 VanDerWaalsContact C-N 3.26Å; L1301-E1303 PolarHBondContact O-N 2.96Å; E1303-P1329 WeakPolarHBondContact OE1-CB 3.28Å; E1303-P1329 WeakPolarHBondContact OE1-CG 3.27Å; E1303-T1331 WeakPolarHBondContact OE2-CB 3.22Å; E1303-T1331 PolarHBondContact OE2-OG1 3.3Å
1304	L	92.4	Very high	94.5	Very high	25 Å²	25	38.6 Å²	38.6	13%	0.131	21%	0.207	C	C	.	.	S	Bend	trans	-110.2	132.2	-173.4	-58.8	-176.6	0	0	0	112.1	P1183 A1184 M1204 I1299 L1301 E1302 L1306 V1310	P1183-L1304 HydrophobicContact CB-CD2 3.63Å; A1184-L1304 HydrophobicContact CB-CD1 4.42Å; A1184-L1304 HydrophobicContact CB-CD2 3.58Å; A1184-L1304 HydrophobicContact CB-CG 3.81Å; M1204-L1304 HydrophobicContact CE-CD1 4.01Å; M1204-L1304 HydrophobicContact SD-CD1 4.31Å; I1299-L1304 HydrophobicContact CG2-CD1 3.95Å; L1301-L1304 PolarHBondContact O-N 3.28Å; L1301-L1304 VanDerWaalsContact O-N 3.16Å; E1302-L1304 VanDerWaalsContact C-N 3.3Å; L1304-L1306 HydrophobicContact CB-CD1 4.46Å; L1304-L1306 HydrophobicContact CB-CD2 3.8Å; L1304-L1306 HydrophobicContact CB-CG 3.85Å; L1304-L1306 HydrophobicContact CD1-CD2 4.16Å; L1304-L1306 PolarHBondContact O-N 3.39Å; L1304-V1310 HydrophobicContact CD1-CG1 4.42Å; L1304-V1310 HydrophobicContact CD2-CG1 4.33Å
1305	D	91.9	Very high	94.5	Very high	114 Å²	114	40.9 Å²	40.9	61%	0.61	22%	0.217	S	C	*	.			trans	-75.4	91.3	164.8	-179.6	4.7	0	0	0	109.7	S1307 V1310	D1305-S1307 VanDerWaalsContact C-N 3.26Å; D1305-S1307 PolarHBondContact O-N 2.9Å; D1305-S1307 WeakPolarHBondContact OD1-CB 3.31Å; D1305-S1307 PolarHBondContact OD1-N 2.97Å; D1305-S1307 VanDerWaalsContact OD1-N 3.1Å; D1305-S1307 PolarHBondContact OD1-OG 3.04Å; D1305-S1307 PolarHBondContact OD2-OG 2.95Å; D1305-V1310 WeakPolarHBondContact O-CG2 3.46Å
1306	L	94.2	Very high	94.5	Very high	10 Å²	10	40.9 Å²	40.9	5%	0.052	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	11.9	-178.9	-61.1	174.2	0	0	0	113.3	M1204 D1206 L1211 P1272 L1301 L1304 S1308 V1310	M1204-L1306 HydrophobicContact CB-CD2 3.61Å; D1206-L1306 HydrophobicContact CB-CB 4.1Å; D1206-L1306 PolarHBondContact N-O 2.85Å; L1211-L1306 HydrophobicContact CD1-CD1 4.34Å; P1272-L1306 HydrophobicContact CB-CD1 3.46Å; P1272-L1306 VanDerWaalsContact CB-CD1 3.46Å; P1272-L1306 HydrophobicContact CG-CD1 3.72Å; L1301-L1306 HydrophobicContact CB-CD1 4.31Å; L1301-L1306 HydrophobicContact CD2-CD1 4.18Å; L1304-L1306 HydrophobicContact CB-CD1 4.46Å; L1304-L1306 HydrophobicContact CB-CD2 3.8Å; L1304-L1306 HydrophobicContact CB-CG 3.85Å; L1304-L1306 HydrophobicContact CD1-CD2 4.16Å; L1304-L1306 PolarHBondContact O-N 3.39Å; L1306-S1308 CarbonylContact C-O 3.6Å; L1306-S1308 PolarHBondContact O-N 3Å; L1306-S1308 VanDerWaalsContact O-N 3.17Å; L1306-V1310 HydrophobicContact CD2-CB 4.22Å; L1306-V1310 HydrophobicContact CD2-CG2 4.04Å
1307	S	92.9	Very high	94.4	Very high	92 Å²	92	41.4 Å²	41.4	64%	0.643	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-16	171.8	67.6	0	0	0	0	113.4	D1305	D1305-S1307 VanDerWaalsContact C-N 3.26Å; D1305-S1307 PolarHBondContact O-N 2.9Å; D1305-S1307 WeakPolarHBondContact OD1-CB 3.31Å; D1305-S1307 PolarHBondContact OD1-N 2.97Å; D1305-S1307 VanDerWaalsContact OD1-N 3.1Å; D1305-S1307 PolarHBondContact OD1-OG 3.04Å; D1305-S1307 PolarHBondContact OD2-OG 2.95Å
1308	S	91.6	Very high	94.2	Very high	70 Å²	70	42.8 Å²	42.8	49%	0.49	23%	0.229	S	C	.	.	S	Bend	trans	-140.8	170.3	170.3	66.6	0	0	0	0	110.2	L1306 V1310	L1306-S1308 CarbonylContact C-O 3.6Å; L1306-S1308 PolarHBondContact O-N 3Å; L1306-S1308 VanDerWaalsContact O-N 3.17Å; S1308-V1310 PolarHBondContact O-N 2.74Å
1309	M	94.2	Very high	93.7	Very high	59 Å²	59	45.2 Å²	45.2	29%	0.291	25%	0.246	S	C	.	.			trans	-72.7	103.6	-174.8	-171.2	178.4	-76.9	0	0	112.8	M1204 E1205 E1214 I1311	M1204-M1309 CarbonylContact O-C 3.6Å; M1204-M1309 WeakPolarHBondContact O-CA 3.28Å; E1205-M1309 HydrophobicContact CB-CB 4.18Å; E1205-M1309 HydrophobicContact CB-CG 4.43Å; E1205-M1309 HydrophobicContact CG-CB 4.33Å; E1205-M1309 WeakPolarHBondContact OE2-CE 3.45Å; E1214-M1309 HydrophobicContact CB-CE 4.43Å; M1309-I1311 HydrophobicContact CG-CD1 4.37Å; M1309-I1311 HydrophobicContact CG-CG1 3.86Å; M1309-I1311 PolarHBondContact O-N 2.84Å; M1309-I1311 HydrophobicContact SD-CD1 4Å; M1309-I1311 HydrophobicContact SD-CG1 4.03Å
1310	V	95.6	Very high	92.8	Very high	32 Å²	32	48.6 Å²	48.6	19%	0.194	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	107	172.9	-179.5	0	0	0	0	109.8	P1183 G1203 M1204 L1304 D1305 L1306 S1308	P1183-V1310 HydrophobicContact CB-CG1 4.34Å; P1183-V1310 HydrophobicContact CG-CG1 4.49Å; G1203-V1310 CarbonylContact C-O 3.52Å; G1203-V1310 WeakPolarHBondContact CA-O 3.27Å; M1204-V1310 PolarHBondContact N-O 2.92Å; M1204-V1310 PolarHBondContact O-N 3.24Å; L1304-V1310 HydrophobicContact CD1-CG1 4.42Å; L1304-V1310 HydrophobicContact CD2-CG1 4.33Å; D1305-V1310 WeakPolarHBondContact O-CG2 3.46Å; L1306-V1310 HydrophobicContact CD2-CB 4.22Å; L1306-V1310 HydrophobicContact CD2-CG2 4.04Å; S1308-V1310 PolarHBondContact O-N 2.74Å
1311	I	96.1	Very high	92	Very high	85 Å²	85	47.8 Å²	47.8	44%	0.436	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	114.4	177.9	-56.7	178.9	0	0	0	110.6	Q1201 I1202 I1216 M1309	Q1201-I1311 HydrophobicContact CG-CG2 4.07Å; Q1201-I1311 VanDerWaalsContact NE2-CG2 3.35Å; I1202-I1311 WeakPolarHBondContact O-CA 3.27Å; I1216-I1311 HydrophobicContact CD1-CD1 4.21Å; I1216-I1311 HydrophobicContact CD1-CG1 4.44Å; I1216-I1311 HydrophobicContact CD1-CG2 3.64Å; M1309-I1311 HydrophobicContact CG-CD1 4.37Å; M1309-I1311 HydrophobicContact CG-CG1 3.86Å; M1309-I1311 PolarHBondContact O-N 2.84Å; M1309-I1311 HydrophobicContact SD-CD1 4Å; M1309-I1311 HydrophobicContact SD-CG1 4.03Å
1312	G	95	Very high	90.9	Very high	5 Å²	5	50.5 Å²	50.5	5%	0.052	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	156.9	179.6	0	0	0	0	0	114	Q1201 I1202 Y1314	Q1201-G1312 WeakPolarHBondContact CA-O 3.27Å; I1202-G1312 PolarHBondContact N-O 2.93Å; I1202-G1312 PolarHBondContact O-N 3Å; G1312-Y1314 WeakPolarHBondContact O-CE2 3.35Å
1313	W	97	Very high	89.2	Confident	63 Å²	63	48.5 Å²	48.5	24%	0.239	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.1	161.3	-85.5	109.9	0	0	0	109.3	G1182 D1199 I1200 Q1201 R1217 R1219	G1182-W1313 WeakPolarHBondContact CA-O 3.39Å; G1182-W1313 PolarHBondContact N-O 2.75Å; D1199-W1313 HydrophobicContact CB-CE3 3.57Å; D1199-W1313 HydrophobicContact CB-CZ3 3.78Å; I1200-W1313 VanDerWaalsContact C-CE3 3.46Å; Q1201-W1313 HydrophobicContact CB-CD2 3.9Å; Q1201-W1313 HydrophobicContact CB-CE3 3.77Å; Q1201-W1313 HydrophobicContact CB-CH2 4.04Å; Q1201-W1313 HydrophobicContact CB-CZ2 4.17Å; Q1201-W1313 HydrophobicContact CB-CZ3 3.83Å; Q1201-W1313 HydrophobicContact CG-CD2 4.11Å; Q1201-W1313 HydrophobicContact CG-CE3 4.48Å; Q1201-W1313 HydrophobicContact CG-CG 4.45Å; R1217-W1313 HydrophobicContact CG-CH2 4.12Å; R1217-W1313 VanDerWaalsContact CZ-CZ2 3.46Å; R1219-W1313 HydrophobicContact CB-CH2 4.18Å; R1219-W1313 HydrophobicContact CB-CZ3 4.47Å; R1219-W1313 VanDerWaalsContact CD-CH2 3.5Å; R1219-W1313 HydrophobicContact CG-CH2 3.68Å; R1219-W1313 HydrophobicContact CG-CZ3 3.73Å
1314	Y	96.9	Very high	87.4	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.2	-175.9	-63.9	-86.3	0	0	0	110.2	P1183 Q1185 D1199 I1200 I1202 M1204 I1299 G1312 L1316	P1183-Y1314 WeakPolarHBondContact CD-OH 3.31Å; P1183-Y1314 VanDerWaalsContact O-CE1 3.27Å; P1183-Y1314 WeakPolarHBondContact O-CE1 3.42Å; P1183-Y1314 PolarHBondContact O-OH 3.01Å; Q1185-Y1314 HydrophobicContact CB-CD1 3.92Å; Q1185-Y1314 HydrophobicContact CB-CE1 4.17Å; Q1185-Y1314 HydrophobicContact CG-CD1 4.01Å; D1199-Y1314 WeakPolarHBondContact CA-O 3.36Å; I1200-Y1314 PolarHBondContact N-O 3.26Å; I1200-Y1314 PolarHBondContact O-N 2.82Å; I1202-Y1314 HydrophobicContact CB-CD2 4.03Å; I1202-Y1314 HydrophobicContact CB-CE2 3.98Å; I1202-Y1314 HydrophobicContact CG1-CD2 4.15Å; M1204-Y1314 HydrophobicContact CE-CE2 4.07Å; M1204-Y1314 VanDerWaalsContact CE-OH 3.31Å; M1204-Y1314 WeakPolarHBondContact CE-OH 3.48Å; I1299-Y1314 HydrophobicContact CB-CE1 4.41Å; I1299-Y1314 HydrophobicContact CD1-CD1 3.73Å; I1299-Y1314 HydrophobicContact CD1-CD2 4.11Å; I1299-Y1314 HydrophobicContact CD1-CE1 3.5Å; I1299-Y1314 VanDerWaalsContact CD1-CE1 3.5Å; I1299-Y1314 HydrophobicContact CD1-CE2 3.89Å; I1299-Y1314 HydrophobicContact CD1-CG 4.05Å; I1299-Y1314 HydrophobicContact CG1-CD1 3.73Å; I1299-Y1314 HydrophobicContact CG1-CE1 3.57Å; I1299-Y1314 HydrophobicContact CG1-CG 4.46Å; I1299-Y1314 HydrophobicContact CG2-CE1 4.02Å; G1312-Y1314 WeakPolarHBondContact O-CE2 3.35Å; Y1314-L1316 PolarHBondContact O-N 2.76Å
1315	K	95.2	Very high	85.6	Confident	48 Å²	48	51.2 Å²	51.2	21%	0.209	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	128.3	175	-72	177.5	-175.8	155.6	0	109.1	D1179 G1180 L1181 Q1185 A1196 F1317	D1179-K1315 PolarHBondContact O-NZ 3.24Å; G1180-K1315 WeakPolarHBondContact O-CE 3.24Å; L1181-K1315 HydrophobicContact CD2-CB 4.49Å; L1181-K1315 HydrophobicContact CD2-CD 4.05Å; Q1185-K1315 PolarHBondContact NE2-O 3.18Å; Q1185-K1315 VanDerWaalsContact OE1-N 3.09Å; A1196-K1315 HydrophobicContact CB-CB 4.06Å; A1196-K1315 HydrophobicContact CB-CG 4.31Å; K1315-F1317 HydrophobicContact CB-CE1 4.49Å; K1315-F1317 HydrophobicContact CB-CE2 3.72Å; K1315-F1317 HydrophobicContact CB-CZ 3.69Å; K1315-F1317 HydrophobicContact CD-CZ 4.21Å; K1315-F1317 WeakPolarHBondContact O-CD2 3.49Å; K1315-F1317 WeakPolarHBondContact O-CE2 3.39Å
1316	L	96.4	Very high	83.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.289	C	S	.	.			trans	-89.3	134.8	178.1	-65.2	168.5	0	0	0	110.4	A1196 M1197 G1198 I1200 L1221 V1281 A1297 Y1314	A1196-L1316 CarbonylContact C-O 3.54Å; A1196-L1316 VanDerWaalsContact CA-O 3.3Å; A1196-L1316 WeakPolarHBondContact CA-O 3.46Å; M1197-L1316 HydrophobicContact CB-CB 4.47Å; M1197-L1316 PolarHBondContact N-O 3.21Å; G1198-L1316 VanDerWaalsContact O-CB 3.31Å; G1198-L1316 WeakPolarHBondContact O-CB 3.27Å; G1198-L1316 PolarHBondContact O-N 3.35Å; I1200-L1316 HydrophobicContact CB-CD1 4.33Å; I1200-L1316 HydrophobicContact CB-CD2 4.28Å; I1200-L1316 HydrophobicContact CB-CG 4.4Å; I1200-L1316 HydrophobicContact CG2-CD2 3.72Å; I1200-L1316 HydrophobicContact CG2-CG 4.18Å; L1221-L1316 HydrophobicContact CD2-CD1 3.49Å; L1221-L1316 VanDerWaalsContact CD2-CD1 3.49Å; V1281-L1316 HydrophobicContact CB-CD1 4.49Å; V1281-L1316 HydrophobicContact CG2-CD1 3.6Å; V1281-L1316 HydrophobicContact CG2-CD2 4.03Å; V1281-L1316 HydrophobicContact CG2-CG 4.5Å; A1297-L1316 HydrophobicContact CB-CD2 4.33Å; Y1314-L1316 PolarHBondContact O-N 2.76Å
1317	F	94	Very high	80.9	Confident	10 Å²	10	55.2 Å²	55.2	4%	0.044	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-122.4	164.3	-177.2	-65.4	-71.4	0	0	0	113.1	L1181 V1187 T1191 A1196 G1295 V1296 K1315	L1181-F1317 HydrophobicContact CD2-CE2 4.24Å; L1181-F1317 HydrophobicContact CD2-CZ 4.29Å; V1187-F1317 HydrophobicContact CG1-CE2 4.1Å; V1187-F1317 HydrophobicContact CG1-CZ 4.35Å; V1187-F1317 HydrophobicContact CG2-CD2 4.33Å; V1187-F1317 HydrophobicContact CG2-CE2 3.69Å; V1187-F1317 HydrophobicContact CG2-CZ 4.46Å; T1191-F1317 HydrophobicContact CG2-CB 3.84Å; T1191-F1317 HydrophobicContact CG2-CD1 3.37Å; T1191-F1317 HydrophobicContact CG2-CD2 4.01Å; T1191-F1317 HydrophobicContact CG2-CE1 3.83Å; T1191-F1317 HydrophobicContact CG2-CE2 4.4Å; T1191-F1317 HydrophobicContact CG2-CG 3.47Å; T1191-F1317 VanDerWaalsContact CG2-CG 3.47Å; T1191-F1317 HydrophobicContact CG2-CZ 4.32Å; A1196-F1317 HydrophobicContact CB-CE1 4.4Å; G1295-F1317 CarbonylContact C-O 3.56Å; G1295-F1317 WeakPolarHBondContact CA-O 3.32Å; V1296-F1317 PolarHBondContact N-O 3.28Å; V1296-F1317 PolarHBondContact O-N 3.21Å; K1315-F1317 HydrophobicContact CB-CE1 4.49Å; K1315-F1317 HydrophobicContact CB-CE2 3.72Å; K1315-F1317 HydrophobicContact CB-CZ 3.69Å; K1315-F1317 HydrophobicContact CD-CZ 4.21Å; K1315-F1317 WeakPolarHBondContact O-CD2 3.49Å; K1315-F1317 WeakPolarHBondContact O-CE2 3.39Å
1318	P	91.7	Very high	78.2	Confident	32 Å²	32	53.7 Å²	53.7	21%	0.208	31%	0.308	C	S	.	.			trans	-65.8	162.1	171	-17.7	31.9	0	0	0	112.2	T1194 M1197 S1320 S1321	T1194-P1318 HydrophobicContact CG2-CG 3.96Å; M1197-P1318 HydrophobicContact CG-CG 4.24Å; M1197-P1318 HydrophobicContact SD-CB 4.16Å; M1197-P1318 HydrophobicContact SD-CG 3.91Å; P1318-S1320 PolarHBondContact O-N 3.34Å; P1318-S1321 WeakPolarHBondContact O-CB 3.23Å; P1318-S1321 PolarHBondContact O-N 3.26Å; P1318-S1321 PolarHBondContact O-OG 3.27Å
1319	P	85.5	Confident	75.6	Confident	72 Å²	72	53.8 Å²	53.8	47%	0.468	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-62.2	-14.3	-177.2	-20.7	33.1	0	0	0	115	F1293 S1321 L1322	F1293-P1319 HydrophobicContact CD1-CG 4.06Å; F1293-P1319 HydrophobicContact CD2-CG 4.35Å; F1293-P1319 VanDerWaalsContact CE1-CD 3.48Å; F1293-P1319 HydrophobicContact CE1-CG 3.7Å; F1293-P1319 HydrophobicContact CE2-CG 4Å; F1293-P1319 HydrophobicContact CG-CG 4.37Å; F1293-P1319 HydrophobicContact CZ-CG 3.66Å; P1319-S1321 PolarHBondContact O-N 3.21Å; P1319-L1322 WeakPolarHBondContact O-CB 3.37Å; P1319-L1322 PolarHBondContact O-N 2.9Å
1320	S	76.6	Confident	73	Confident	72 Å²	72	54.7 Å²	54.7	50%	0.503	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-62.9	-20.9	171.7	49.4	0	0	0	0	113.2	P1318 L1322 V1323	P1318-S1320 PolarHBondContact O-N 3.34Å; S1320-L1322 PolarHBondContact O-N 3.22Å; S1320-V1323 PolarHBondContact O-N 3.35Å
1321	S	76.8	Confident	70.3	Confident	9 Å²	9	56.5 Å²	56.5	6%	0.063	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-70.2	-9.5	176	70.3	0	0	0	0	114.9	T1191 P1318 P1319 V1323	T1191-S1321 VanDerWaalsContact OG1-CA 3.24Å; T1191-S1321 WeakPolarHBondContact OG1-CA 3.13Å; T1191-S1321 VanDerWaalsContact OG1-CB 3.31Å; T1191-S1321 WeakPolarHBondContact OG1-CB 3.23Å; P1318-S1321 WeakPolarHBondContact O-CB 3.23Å; P1318-S1321 PolarHBondContact O-N 3.26Å; P1318-S1321 PolarHBondContact O-OG 3.27Å; P1319-S1321 PolarHBondContact O-N 3.21Å; S1321-V1323 VanDerWaalsContact C-N 3.31Å
1322	L	72.9	Confident	67.3	Low	60 Å²	60	63.4 Å²	63.4	31%	0.314	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-88.9	0.5	176.3	-52	178.9	0	0	0	112.4	V1296 Q1298 P1319 S1320	V1296-L1322 HydrophobicContact CG1-CD1 4.36Å; V1296-L1322 HydrophobicContact CG1-CD2 4.03Å; V1296-L1322 HydrophobicContact CG1-CG 4.19Å; V1296-L1322 HydrophobicContact CG2-CD2 4.16Å; Q1298-L1322 HydrophobicContact CG-CD2 4.01Å; P1319-L1322 WeakPolarHBondContact O-CB 3.37Å; P1319-L1322 PolarHBondContact O-N 2.9Å; S1320-L1322 PolarHBondContact O-N 3.22Å
1323	V	56	Low	64.2	Low	95 Å²	95	75.3 Å²	75.3	58%	0.576	39%	0.387	S	S	*	.	S	Bend	trans	-98.5	134.1	172.4	-172.1	0	0	0	0	108.2	S1320 S1321 P1325	S1320-V1323 PolarHBondContact O-N 3.35Å; S1321-V1323 VanDerWaalsContact C-N 3.31Å; V1323-P1325 VanDerWaalsContact C-CD 3.5Å
1324	D	53	Low	60.9	Low	89 Å²	89	77 Å²	77	48%	0.476	42%	0.415	S	S	.	.			trans	48.2	58	-169.8	-59.8	-27.3	0	0	0	115.4	G1188 T1326	G1188-D1324 VanDerWaalsContact CA-O 3.3Å; G1188-D1324 WeakPolarHBondContact CA-O 3.3Å; D1324-T1326 HydrophobicContact CB-CG2 4.43Å; D1324-T1326 PolarHBondContact O-N 2.83Å
1325	P	54.6	Low	57.7	Low	58 Å²	58	82.7 Å²	82.7	38%	0.377	46%	0.455	S	S	.	.			trans	-70.9	65.8	156.2	34.9	-34.3	0	0	0	108.9	V1323 L1327	V1323-P1325 VanDerWaalsContact C-CD 3.5Å; P1325-L1327 PolarHBondContact O-N 3.35Å
1326	T	42.5	Very low	54.6	Low	70 Å²	70	89.9 Å²	89.9	43%	0.429	49%	0.489	S	S	.	.			trans	-57.3	121.3	171.4	53.8	0	0	0	0	108.1	D1324 T1328	D1324-T1326 HydrophobicContact CB-CG2 4.43Å; D1324-T1326 PolarHBondContact O-N 2.83Å; T1326-T1328 PolarHBondContact O-N 3.32Å
1327	L	44.7	Very low	51.5	Low	138 Å²	138	95.7 Å²	95.7	72%	0.723	53%	0.53	S	S	*	.	S	Bend	trans	-70.3	71	-177.9	-64.7	174.7	0	0	0	111.3	P1325	P1325-L1327 PolarHBondContact O-N 3.35Å
1328	T	36.3	Very low	48.7	Very low	60 Å²	60	100.3 Å²	100.3	37%	0.368	56%	0.563	S	S	.	*			trans	-122.6	101.3	165.4	53.8	0	0	0	0	107.2	T1326 L1330	T1326-T1328 PolarHBondContact O-N 3.32Å; T1328-L1330 PolarHBondContact O-N 3.45Å; T1328-L1330 VanDerWaalsContact O-N 3.12Å
1329	P	37.6	Very low	45.9	Very low	72 Å²	72	106.6 Å²	106.6	47%	0.468	59%	0.594	S	S	.	*			trans	-52	116.9	169.3	-27.8	36.6	0	0	0	109.9	E1303 T1331	E1303-P1329 WeakPolarHBondContact OE1-CB 3.28Å; E1303-P1329 WeakPolarHBondContact OE1-CG 3.27Å; P1329-T1331 WeakPolarHBondContact CB-OG1 3.47Å; P1329-T1331 PolarHBondContact O-N 3.01Å
1330	L	39.3	Very low	43.6	Very low	77 Å²	77	112.6 Å²	112.6	40%	0.403	62%	0.616	S	S	.	*	S	Bend	trans	-84.3	11.3	174.2	-64.6	177.7	0	0	0	111.8	L1178 L1192 T1328	L1178-L1330 HydrophobicContact CD2-CD1 4.35Å; L1192-L1330 HydrophobicContact CD1-CD1 3.92Å; L1192-L1330 HydrophobicContact CD2-CD1 4.48Å; T1328-L1330 PolarHBondContact O-N 3.45Å; T1328-L1330 VanDerWaalsContact O-N 3.12Å
1331	T	37.9	Very low	41.4	Very low	70 Å²	70	114.9 Å²	114.9	43%	0.429	63%	0.632	S	S	.	*			trans	-101.7	35	-166.9	37.5	0	0	0	0	112.7	E1303 P1329	E1303-T1331 WeakPolarHBondContact OE2-CB 3.22Å; E1303-T1331 PolarHBondContact OE2-OG1 3.3Å; P1329-T1331 WeakPolarHBondContact CB-OG1 3.47Å; P1329-T1331 PolarHBondContact O-N 3.01Å
1332	R	32.9	Very low	39.5	Very low	230 Å²	230	119.9 Å²	119.9	87%	0.868	67%	0.667	S	S	*	*			trans	-144.2	68.1	-175	-139.6	179.2	-152.3	-134.8	5.6	117.5
1333	R	30.8	Very low	37.7	Very low	256 Å²	256	123 Å²	123	97%	0.966	69%	0.694	S	S	*	*			trans	-179.5	93.3	140.3	-104.5	172.6	179.7	-173.2	0	112.4
1334	A	27.8	Very low	36.8	Very low	99 Å²	99	122 Å²	122	82%	0.818	70%	0.703	S	S	*	*	S	Bend	trans	-156.6	34.6	170.7	0	0	0	0	0	113.9
1335	S	29.7	Very low	36.1	Very low	120 Å²	120	123.7 Å²	123.7	84%	0.839	72%	0.718	S	S	*	*			trans	-168.6	91.2	172	-82.4	0	0	0	0	112.2
1336	Q	30.8	Very low	35.2	Very low	198 Å²	198	126.5 Å²	126.5	93%	0.925	74%	0.737	S	S	*	*			trans	-153.8	93.2	160.4	-83.5	-159.6	-26.6	0	0	109.7
1337	S	29.6	Very low	34.9	Very low	123 Å²	123	129.5 Å²	129.5	86%	0.86	76%	0.759	S	S	*	*			trans	-161.1	53.6	174.6	65.2	0	0	0	0	114.4
1338	S	36.4	Very low	34.4	Very low	107 Å²	107	130.4 Å²	130.4	75%	0.748	76%	0.763	S	S	*	*			trans	-162.6	118.4	158	57	0	0	0	0	112.7
1339	L	31.8	Very low	34.4	Very low	163 Å²	163	138.8 Å²	138.8	85%	0.853	79%	0.788	S	S	*	*			trans	41.6	115.3	139.3	-50.1	174.9	0	0	0	119.1
1340	E	37.2	Very low	34.3	Very low	198 Å²	198	144.8 Å²	144.8	93%	0.925	83%	0.832	S	S	*	*				-164.5	169.2	95.3	-99.4	-177.5	139.1	0	0	110.2
1341	S	31.2	Very low	34	Very low	121 Å²	121	148.2 Å²	148.2	85%	0.846	85%	0.853	S	S	*	*			trans	-145	126.7	-158.6	58.7	0	0	0	0	115.4
1342	S	36.4	Very low	33.8	Very low	114 Å²	114	152.3 Å²	152.3	80%	0.797	88%	0.875	S	S	*	*			trans	-147.1	106	166.9	62	0	0	0	0	113.3
1343	S	34.3	Very low	33.9	Very low	126 Å²	126	148 Å²	148	88%	0.881	88%	0.876	S	S	*	*			trans	2.5	127.8	154.2	54.7	0	0	0	0	121
1344	G	37.6	Very low	34.1	Very low	73 Å²	73	141.6 Å²	141.6	75%	0.753	87%	0.871	S	S	*	*			trans	-179.2	108.8	159.5	0	0	0	0	0	112.5
1345	P	37.9	Very low	34.5	Very low	124 Å²	124	144.3 Å²	144.3	81%	0.805	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-84.6	155.1	-174.7	33.2	-34.8	0	0	0	113.7
1346	P	36.3	Very low	34.8	Very low	118 Å²	118	145.9 Å²	145.9	77%	0.766	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-89.3	144.2	-170.5	34.5	-35.6	0	0	0	114.4
1347	C	37.3	Very low	35.1	Very low	133 Å²	133	142.2 Å²	142.2	90%	0.899	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-102.3	118.4	169.6	-57.6	0	0	0	0	110.6
1348	I	33.8	Very low	35.5	Very low	157 Å²	157	143.7 Å²	143.7	81%	0.805	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-100.7	124.6	173.1	-59.8	172.3	0	0	0	109.1
1349	R	35.5	Very low	35.4	Very low	235 Å²	235	146.8 Å²	146.8	89%	0.887	88%	0.884	S	S	*	*			trans	175.7	105.3	142.3	-101.5	164.4	-179.7	-177.3	0.2	111.7
1350	S	35.6	Very low	35.7	Very low	199 Å²	199	145.3 Å²	145.3	100%	1.392	89%	0.887	S	S	*	*				178.5	0	102.8	-104.2	0	0	0	0	111.3

Retrieved 1,350 of 1,350 residues in 2157.4 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).