RIMS1_MOUSE Loading...

Isoform 3 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 Q99NE5-3 (canonical: Q99NE5), Species MOUSE (Mus musculus, Mouse), Gene Rims1, Length 1,435 aa.

						>RIMS1_MOUSE|Q99NE5-3|Rims1
MSSAVGPRGPRPPTVPPPMQELPDLSHLTEEERNIIMAVMDRQKEEEEKEEAMLKCVVRDMAKPAACKTPRNAESQPHQPPLNIFRCVCVPRKPSSEEGGPDRNWRLHQQFESYKEQVRKIGEEARRYQGEHKDDAPTCGICHKTKFADGCGHLCSYCRTKFCARCGGRVSLRSNNEDKVVMWVCNLCRKQQEILTKSGAWFFGSGPQQPSQDGTLSDTATGAGSEVPREKKARLQERSRSQTPLSTAAVSSQDTASHGAPLDRNKGAEPSQQALGPEQKQASRSRSEPPRERKKAPGLSEQNGKGGQKSERKRVPKSVVQPGEGTADERERKERRETRRLEKGRSQDYPDRLEKREDGRVAEDEKQRKEEEGVSTPEYTSCEDVELESESVSEKGDLDYWLDPATWHSRETSPISSHPVTWQPSKEGDRLIGRVILNKRTTMPKESGALLGLKVVGGKMTDLGRLGAFITKVKKGSLADVVGHLRAGDEVLEWNGKPLPGATNEEVYNIILESKSEPQVEIIVSRPIGDIPRIPESSHPPLESSSSSFESQKMERPSISVISPTSPGALKDAPQVLPGQLSVKLWYDKVGHQLIVNVLQATDLPPRVDGRPRNPYVKMYFLPDRSDKSKRRTKTVKKLLEPKWNQTFVYSHVHRRDFRERMLEITVWDQPRVQDEESEFLGEILIELETALLDDEPHWYKLQTHDESSLPLPQPSPFMPRRHIHGESSSKKLQRSQRISDSDISDYEVDDGIGVVPPVGYRASARESKATTLTVPEQQRTTHHRSRSVSPHRGDDQGRPRSRLPNVPLQRSLDEIHPTRRSRSPTRHHDASRSLADHRSRHAESQYSSEPDSELLMLPRAKRGRSAECLHMTSELQPSLDRARSASTNCLRPDTSLHSPERERHSRKSERSSIQKQSRKGTASDADRVLPPCLSRRGYAIPRATDQPVIRGKHTTRSRSSEHSSIRTLCSMHHLAPGGSAPPSPLLTRTHRQGSPTQSPPADTSFGSRRGRQLPQVPVRSGSIEQASLVVEERTRQMKMKVHRFKQTTGSGSSQELDHEQYSKYNIHKDQYRSCDNASAKSSDSDVSDVSAISRASSTSRLSSTSFMSEQSERPRGRISSFTPKMQGRRMGTSGRAIIKSTSVSGEIYTLEHNDGSQSDTAVGTVGAGGKKRRSSLSAKVVAIVSRRSRSTSQLSQTESGHKKLKSTIQRSTETGMAAEMRKMVRQPSRESTDGSINSYSSEGNLIFPGVRVGPDSQFSDFLDGLGPAQLVGRQTLATPAMGDIQIGMEDKKGQLEVEVIRARSLTQKPGSKSTPAPYVKVYLLENGACIAKKKTRIARKTLDPLYQQSLVFDESPQGKVLQVIVWGDYGRMDHKCFMGVAQILLEELDLSSMVIGWYKLFPPSSLVDPTLTPLTRRASQSSLESSSGPPCIRS
					

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	35	Very low	40.3	Very low	182 Å²	182	136.3 Å²	136.3	90%	0.897	82%	0.823	S	S	*	*				0	113.1	0	-51.6	-166.2	110.5	0	0	107.9	L398	M1-L398 HydrophobicContact CG-CD1 4.05Å; M1-L398 HydrophobicContact CG-CD2 4.13Å; M1-L398 HydrophobicContact SD-CD1 4.38Å; M1-L398 HydrophobicContact SD-CD2 4.18Å
2	S	33.8	Very low	40.9	Very low	122 Å²	122	133.5 Å²	133.5	85%	0.853	81%	0.81	S	S	*	*			cis	107.9	70.3	13.5	-48.7	0	0	0	0	115.1
3	S	38.1	Very low	41.5	Very low	115 Å²	115	132.8 Å²	132.8	80%	0.804	81%	0.81	S	S	*	*			trans	-166.7	113.7	156.8	43.6	0	0	0	0	109
4	A	39.9	Very low	41.8	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	81%	0.808	S	S	*	*				66.1	94.9	85.1	0	0	0	0	0	112.2
5	V	39.8	Very low	42.2	Very low	153 Å²	153	131.7 Å²	131.7	93%	0.927	80%	0.803	S	S	*	*				77.5	114.5	60.6	179.4	0	0	0	0	113.6
6	G	42.3	Very low	43	Very low	75 Å²	75	130.1 Å²	130.1	77%	0.773	80%	0.796	S	S	*	*			trans	-175.3	121.4	172.6	0	0	0	0	0	112.1
7	P	39.8	Very low	43.4	Very low	120 Å²	120	129.4 Å²	129.4	78%	0.779	79%	0.794	S	S	*	*			trans	-114.6	148.2	-173	38.5	-31.1	0	0	0	115.3
8	R	42.4	Very low	43.8	Very low	256 Å²	256	129.2 Å²	129.2	97%	0.966	80%	0.796	S	S	*	*			trans	-176.5	149.4	156.2	-104.9	155.1	-166.4	-107	2.5	112.8
9	G	47.9	Very low	43.9	Very low	73 Å²	73	131.6 Å²	131.6	75%	0.753	80%	0.799	S	S	*	*			trans	97.9	123.8	156.3	0	0	0	0	0	118.2
10	P	42.1	Very low	44.4	Very low	136 Å²	136	135 Å²	135	88%	0.883	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-81.3	155.6	165.2	34.2	-33.4	0	0	0	112
11	R	42.2	Very low	45.1	Very low	176 Å²	176	137.7 Å²	137.7	66%	0.664	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-96.9	140.2	-176.6	-155.2	174	-153.5	-111.7	-0.3	111.9
12	P	47.5	Very low	46.7	Very low	103 Å²	103	135.7 Å²	135.7	67%	0.669	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-67.8	161.7	177.5	-20	33.1	0	0	0	114
13	P	49.5	Very low	48.7	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66	146.2	174.3	29	-35.3	0	0	0	111.9
14	T	45	Very low	50.6	Low	128 Å²	128	131.6 Å²	131.6	79%	0.785	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-83.7	125.9	-179	-54	0	0	0	0	111.2
15	V	47.9	Very low	52.6	Low	122 Å²	122	128.6 Å²	128.6	74%	0.739	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-74.9	140.2	175.1	-174.8	0	0	0	0	109.4
16	P	54.9	Low	54.4	Low	105 Å²	105	124.1 Å²	124.1	68%	0.682	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-63.7	154.6	172.8	27.6	-35.7	0	0	0	112
17	P	49.6	Very low	56.4	Low	118 Å²	118	123.1 Å²	123.1	77%	0.766	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-64.8	149.4	179	28.4	-35.3	0	0	0	111.8
18	P	50.9	Low	58.3	Low	127 Å²	127	118.9 Å²	118.9	83%	0.825	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-66.2	151.8	176.3	29.2	-35.1	0	0	0	111.6
19	M	46.3	Very low	60.4	Low	175 Å²	175	110.3 Å²	110.3	86%	0.862	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-66.4	152.2	174.1	-70.5	176.5	61.8	0	0	111.3
20	Q	54.3	Low	62	Low	198 Å²	198	113.6 Å²	113.6	93%	0.925	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-66.2	139.6	175.6	-69.9	176	-28	0	0	111.1
21	E	57.6	Low	64.1	Low	193 Å²	193	114.5 Å²	114.5	90%	0.902	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-75.2	145.7	-179.5	-156.1	158.3	-146.6	0	0	110.5
22	L	69.1	Low	66.1	Low	140 Å²	140	110.5 Å²	110.5	73%	0.733	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-67.8	141.4	-178.4	-78.1	156.6	0	0	0	110.6	M40	L22-M40 HydrophobicContact CD2-CE 3.91Å
23	P	75.2	Confident	68	Low	71 Å²	71	109 Å²	109	46%	0.461	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-63.5	140.7	173.3	28.2	-33.8	0	0	0	110.3	L25 M40	P23-L25 HydrophobicContact CG-CD2 4.35Å; P23-L25 PolarHBondContact O-N 2.69Å; P23-L25 VanDerWaalsContact O-N 3.16Å; P23-M40 HydrophobicContact CG-CE 4.11Å; P23-M40 HydrophobicContact CG-SD 3.8Å
24	D	77.8	Confident	69.8	Low	80 Å²	80	107.6 Å²	107.6	43%	0.428	58%	0.578	S	S	.	*			trans	-64.9	114	172.5	172.5	33.8	0	0	0	109.6	S26 H27 S1083	D24-S26 WeakPolarHBondContact OD1-CB 3.26Å; D24-S26 PolarHBondContact OD1-N 3.35Å; D24-S26 PolarHBondContact OD1-OG 2.96Å; D24-S26 PolarHBondContact OD2-OG 2.94Å; D24-S26 VanDerWaalsContact OD2-OG 3.09Å; D24-H27 PolarHBondContact O-CE1 2.72Å; D24-H27 PolarHBondContact O-ND1 3.09Å; D24-S1083 PolarHBondContact OD2-N 3.26Å; D24-S1083 VanDerWaalsContact OD2-N 3.13Å
25	L	81.7	Confident	71.7	Confident	28 Å²	28	106.7 Å²	106.7	15%	0.147	57%	0.567	C	S	.	*			trans	-104.5	22.1	174.1	-55.3	-179.2	0	0	0	111.9	P23 H27 L28 R33 I36 M37	P23-L25 HydrophobicContact CG-CD2 4.35Å; P23-L25 PolarHBondContact O-N 2.69Å; P23-L25 VanDerWaalsContact O-N 3.16Å; L25-H27 PolarHBondContact O-N 3.27Å; L25-L28 HydrophobicContact CB-CD1 4.34Å; L25-L28 HydrophobicContact CD2-CD1 4.02Å; L25-R33 HydrophobicContact CB-CG 4.04Å; L25-R33 HydrophobicContact CD1-CG 4.26Å; L25-R33 VanDerWaalsContact O-CZ 3.28Å; L25-R33 PolarHBondContact O-NE 2.75Å; L25-R33 PolarHBondContact O-NH2 3.16Å; L25-I36 HydrophobicContact CD1-CB 4.46Å; L25-I36 HydrophobicContact CD1-CG2 3.81Å; L25-I36 HydrophobicContact CD2-CG2 3.98Å; L25-M37 HydrophobicContact CD1-CG 3.86Å
26	S	79	Confident	73.6	Confident	58 Å²	58	104.1 Å²	104.1	41%	0.406	55%	0.549	S	S	.	.	S	Bend	trans	-59.7	-16.9	-175.7	74.6	0	0	0	0	114.6	D24 R33	D24-S26 WeakPolarHBondContact OD1-CB 3.26Å; D24-S26 PolarHBondContact OD1-N 3.35Å; D24-S26 PolarHBondContact OD1-OG 2.96Å; D24-S26 PolarHBondContact OD2-OG 2.94Å; D24-S26 VanDerWaalsContact OD2-OG 3.09Å; S26-R33 PolarHBondContact O-NH2 3.45Å; S26-R33 VanDerWaalsContact O-NH2 3.13Å
27	H	83.1	Confident	75	Confident	55 Å²	55	103.4 Å²	103.4	26%	0.255	54%	0.537	S	S	.	.	S	Bend	trans	-104.6	-31.7	-159.4	52	-109.7	0	0	0	114.8	D24 L25 S1083 D1084	D24-H27 PolarHBondContact O-CE1 2.72Å; D24-H27 PolarHBondContact O-ND1 3.09Å; L25-H27 PolarHBondContact O-N 3.27Å; H27-S1083 WeakPolarHBondContact CB-OG 3.32Å; H27-S1083 WeakPolarHBondContact ND1-CA 3.48Å; H27-D1084 HydrophobicContact CB-CB 3.7Å; H27-D1084 WeakPolarHBondContact CB-OD2 3.37Å; H27-D1084 IonicContact CD2-OD1 2.63Å; H27-D1084 PolarHBondContact CD2-OD1 3.11Å; H27-D1084 IonicContact CD2-OD2 3.34Å; H27-D1084 PolarHBondContact CD2-OD2 3.29Å; H27-D1084 VanDerWaalsContact CG-CG 3.4Å; H27-D1084 IonicContact CG-OD1 3.32Å; H27-D1084 IonicContact CG-OD2 3.95Å; H27-D1084 PolarHBondContact ND1-N 3.4Å; H27-D1084 IonicContact NE2-OD1 3.35Å; H27-D1084 PolarHBondContact NE2-OD1 3.1Å
28	L	80.8	Confident	76.9	Confident	30 Å²	30	99.8 Å²	99.8	16%	0.157	52%	0.517	C	S	.	.	S	Bend	trans	-60.6	157	174.3	-63.3	173.7	0	0	0	111.9	L25 E32 R33 I36	L25-L28 HydrophobicContact CB-CD1 4.34Å; L25-L28 HydrophobicContact CD2-CD1 4.02Å; L28-E32 HydrophobicContact CB-CB 3.94Å; L28-E32 HydrophobicContact CD1-CB 4.37Å; L28-E32 HydrophobicContact CD2-CB 4.2Å; L28-E32 HydrophobicContact CG-CB 4.4Å; L28-R33 HydrophobicContact CB-CB 4.28Å; L28-I36 HydrophobicContact CD1-CB 4.48Å; L28-I36 HydrophobicContact CD1-CD1 3.57Å
29	T	85.3	Confident	78.7	Confident	77 Å²	77	97.1 Å²	97.1	47%	0.472	50%	0.499	S	S	.	.			trans	-59.1	157.4	162.1	65	0	0	0	0	110.3	E31 E32 R33	T29-E31 PolarHBondContact O-N 3.41Å; T29-E32 VanDerWaalsContact CB-OE2 3.27Å; T29-E32 WeakPolarHBondContact CB-OE2 3.43Å; T29-E32 VanDerWaalsContact CG2-OE2 3.3Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.26Å; T29-E32 PolarHBondContact N-OE2 3.04Å; T29-E32 PolarHBondContact O-N 2.77Å; T29-E32 WeakPolarHBondContact OG1-CB 3.43Å; T29-E32 VanDerWaalsContact OG1-CD 3.23Å; T29-E32 VanDerWaalsContact OG1-CG 3.28Å; T29-E32 WeakPolarHBondContact OG1-CG 3.29Å; T29-E32 PolarHBondContact OG1-N 3.14Å; T29-E32 PolarHBondContact OG1-OE2 3.37Å; T29-R33 WeakPolarHBondContact O-CB 3.46Å; T29-R33 PolarHBondContact O-N 3.44Å
30	E	82.8	Confident	80.5	Confident	142 Å²	142	92.1 Å²	92.1	66%	0.664	47%	0.474	S	S	*	.	H	α-helix	trans	-64	-26.5	-179.8	-170.1	157.7	-161.2	0	0	112	N34	E30-N34 WeakPolarHBondContact O-CB 3.33Å; E30-N34 PolarHBondContact O-N 3.36Å; E30-N34 VanDerWaalsContact O-N 3.08Å; E30-N34 PolarHBondContact O-ND2 3.34Å
31	E	84.9	Confident	82	Confident	155 Å²	155	87.4 Å²	87.4	72%	0.724	46%	0.455	S	S	*	.	H	α-helix	trans	-69.9	-49.8	174	-66.7	171.3	-168.7	0	0	111.4	T29 N34 I35	T29-E31 PolarHBondContact O-N 3.41Å; E31-N34 PolarHBondContact O-N 2.59Å; E31-I35 WeakPolarHBondContact O-CG1 3.19Å; E31-I35 PolarHBondContact O-N 3.38Å
32	E	85.8	Confident	83.4	Confident	91 Å²	91	85.1 Å²	85.1	43%	0.425	44%	0.438	S	S	.	.	H	α-helix	trans	-63.6	-41	176	-70.4	161.6	138.6	0	0	112.5	L28 T29 N34 I35 I36	L28-E32 HydrophobicContact CB-CB 3.94Å; L28-E32 HydrophobicContact CD1-CB 4.37Å; L28-E32 HydrophobicContact CD2-CB 4.2Å; L28-E32 HydrophobicContact CG-CB 4.4Å; T29-E32 VanDerWaalsContact CB-OE2 3.27Å; T29-E32 WeakPolarHBondContact CB-OE2 3.43Å; T29-E32 VanDerWaalsContact CG2-OE2 3.3Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.26Å; T29-E32 PolarHBondContact N-OE2 3.04Å; T29-E32 PolarHBondContact O-N 2.77Å; T29-E32 WeakPolarHBondContact OG1-CB 3.43Å; T29-E32 VanDerWaalsContact OG1-CD 3.23Å; T29-E32 VanDerWaalsContact OG1-CG 3.28Å; T29-E32 WeakPolarHBondContact OG1-CG 3.29Å; T29-E32 PolarHBondContact OG1-N 3.14Å; T29-E32 PolarHBondContact OG1-OE2 3.37Å; E32-N34 PolarHBondContact O-N 2.97Å; E32-I35 PolarHBondContact O-N 2.92Å; E32-I36 PolarHBondContact O-N 2.9Å
33	R	87.6	Confident	84.2	Confident	73 Å²	73	84.5 Å²	84.5	28%	0.275	43%	0.431	S	S	.	.	H	α-helix	trans	-58.3	-47.9	173.8	-179	-176.3	-62.5	140.5	10.8	110.9	L25 S26 L28 T29 I35 I36 M37	L25-R33 HydrophobicContact CB-CG 4.04Å; L25-R33 HydrophobicContact CD1-CG 4.26Å; L25-R33 VanDerWaalsContact O-CZ 3.28Å; L25-R33 PolarHBondContact O-NE 2.75Å; L25-R33 PolarHBondContact O-NH2 3.16Å; S26-R33 PolarHBondContact O-NH2 3.45Å; S26-R33 VanDerWaalsContact O-NH2 3.13Å; L28-R33 HydrophobicContact CB-CB 4.28Å; T29-R33 WeakPolarHBondContact O-CB 3.46Å; T29-R33 PolarHBondContact O-N 3.44Å; R33-I35 VanDerWaalsContact C-N 3.32Å; R33-I35 PolarHBondContact O-N 3.12Å; R33-I36 PolarHBondContact O-N 3.42Å; R33-M37 HydrophobicContact CG-CG 4.38Å; R33-M37 HydrophobicContact CG-SD 3.93Å; R33-M37 WeakPolarHBondContact O-CB 3.27Å; R33-M37 WeakPolarHBondContact O-CG 3.49Å; R33-M37 PolarHBondContact O-N 3.49Å
34	N	86.3	Confident	84.7	Confident	93 Å²	93	87 Å²	87	50%	0.497	44%	0.435	S	S	.	.	H	α-helix	trans	-63.1	-38	177.9	-82.9	-58.6	0	0	0	111.9	E30 E31 E32 A38	E30-N34 WeakPolarHBondContact O-CB 3.33Å; E30-N34 PolarHBondContact O-N 3.36Å; E30-N34 VanDerWaalsContact O-N 3.08Å; E30-N34 PolarHBondContact O-ND2 3.34Å; E31-N34 PolarHBondContact O-N 2.59Å; E32-N34 PolarHBondContact O-N 2.97Å; N34-A38 WeakPolarHBondContact O-CB 3.46Å; N34-A38 PolarHBondContact O-N 3.48Å
35	I	85.7	Confident	85.2	Confident	109 Å²	109	89.3 Å²	89.3	56%	0.559	44%	0.443	S	S	*	.	H	α-helix	trans	-62.9	-47.7	174.8	-69.8	163.9	0	0	0	111.1	E31 E32 R33 A38 V39	E31-I35 WeakPolarHBondContact O-CG1 3.19Å; E31-I35 PolarHBondContact O-N 3.38Å; E32-I35 PolarHBondContact O-N 2.92Å; R33-I35 VanDerWaalsContact C-N 3.32Å; R33-I35 PolarHBondContact O-N 3.12Å; I35-A38 CarbonylContact O-C 3.48Å; I35-A38 PolarHBondContact O-N 3.18Å; I35-V39 WeakPolarHBondContact O-CG2 3.46Å; I35-V39 PolarHBondContact O-N 2.84Å
36	I	86.1	Confident	85.1	Confident	69 Å²	69	94 Å²	94	35%	0.354	47%	0.465	S	S	.	.	H	α-helix	trans	-70.3	-40.8	-177.6	-76.3	167.1	0	0	0	111.5	L25 L28 E32 R33 A38 V39 M40	L25-I36 HydrophobicContact CD1-CB 4.46Å; L25-I36 HydrophobicContact CD1-CG2 3.81Å; L25-I36 HydrophobicContact CD2-CG2 3.98Å; L28-I36 HydrophobicContact CD1-CB 4.48Å; L28-I36 HydrophobicContact CD1-CD1 3.57Å; E32-I36 PolarHBondContact O-N 2.9Å; R33-I36 PolarHBondContact O-N 3.42Å; I36-A38 VanDerWaalsContact C-N 3.34Å; I36-A38 PolarHBondContact O-N 2.97Å; I36-V39 PolarHBondContact O-N 3.11Å; I36-M40 PolarHBondContact O-N 3.29Å
37	M	86.1	Confident	85.3	Confident	89 Å²	89	97.6 Å²	97.6	44%	0.438	48%	0.475	S	S	.	.	H	α-helix	trans	-57.7	-46.5	170	-72.2	179.7	64.6	0	0	111.2	L25 R33 V39 M40 D41	L25-M37 HydrophobicContact CD1-CG 3.86Å; R33-M37 HydrophobicContact CG-CG 4.38Å; R33-M37 HydrophobicContact CG-SD 3.93Å; R33-M37 WeakPolarHBondContact O-CB 3.27Å; R33-M37 WeakPolarHBondContact O-CG 3.49Å; R33-M37 PolarHBondContact O-N 3.49Å; M37-V39 PolarHBondContact O-N 2.86Å; M37-M40 PolarHBondContact O-N 3.41Å; M37-M40 VanDerWaalsContact O-N 3.13Å; M37-D41 PolarHBondContact O-N 3.32Å
38	A	88.6	Confident	85.4	Confident	43 Å²	43	101.1 Å²	101.1	36%	0.355	49%	0.491	S	S	.	.	H	α-helix	trans	-68.6	-10.7	176.2	0	0	0	0	0	114.3	N34 I35 I36 R42	N34-A38 WeakPolarHBondContact O-CB 3.46Å; N34-A38 PolarHBondContact O-N 3.48Å; I35-A38 CarbonylContact O-C 3.48Å; I35-A38 PolarHBondContact O-N 3.18Å; I36-A38 VanDerWaalsContact C-N 3.34Å; I36-A38 PolarHBondContact O-N 2.97Å; A38-R42 PolarHBondContact O-NE 3.35Å; A38-R42 PolarHBondContact O-NH2 3.38Å
39	V	87.6	Confident	85.5	Confident	71 Å²	71	105.3 Å²	105.3	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-86	-46	166.6	170.1	0	0	0	0	110.1	I35 I36 M37 D41 R42 Q43	I35-V39 WeakPolarHBondContact O-CG2 3.46Å; I35-V39 PolarHBondContact O-N 2.84Å; I36-V39 PolarHBondContact O-N 3.11Å; M37-V39 PolarHBondContact O-N 2.86Å; V39-D41 PolarHBondContact O-N 3.07Å; V39-R42 PolarHBondContact O-N 3.31Å; V39-Q43 PolarHBondContact O-N 3.46Å
40	M	84.6	Confident	85.2	Confident	70 Å²	70	107.7 Å²	107.7	35%	0.345	51%	0.514	S	S	.	.	H	α-helix	trans	-60.7	-43	177.1	-68.4	-168.9	71	0	0	112.5	L22 P23 I36 M37 R42 Q43 K44	L22-M40 HydrophobicContact CD2-CE 3.91Å; P23-M40 HydrophobicContact CG-CE 4.11Å; P23-M40 HydrophobicContact CG-SD 3.8Å; I36-M40 PolarHBondContact O-N 3.29Å; M37-M40 PolarHBondContact O-N 3.41Å; M37-M40 VanDerWaalsContact O-N 3.13Å; M40-R42 VanDerWaalsContact C-N 3.33Å; M40-R42 PolarHBondContact O-N 3.05Å; M40-Q43 PolarHBondContact O-N 2.99Å; M40-K44 VanDerWaalsContact O-CB 3.32Å; M40-K44 WeakPolarHBondContact O-CB 3.36Å; M40-K44 PolarHBondContact O-N 3.39Å
41	D	87.1	Confident	85.1	Confident	98 Å²	98	105.4 Å²	105.4	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-37.1	177	-76.9	-33.3	0	0	0	112	M37 V39 K44 E45	M37-D41 PolarHBondContact O-N 3.32Å; V39-D41 PolarHBondContact O-N 3.07Å; D41-K44 PolarHBondContact O-N 3Å; D41-E45 WeakPolarHBondContact O-CB 3.27Å; D41-E45 PolarHBondContact O-N 2.66Å
42	R	87.1	Confident	85	Confident	146 Å²	146	100 Å²	100	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-69.8	-42.1	174.1	-87.2	-179.7	-70.1	157.7	1.7	112.5	A38 V39 M40 K44 E45 E46	A38-R42 PolarHBondContact O-NE 3.35Å; A38-R42 PolarHBondContact O-NH2 3.38Å; V39-R42 PolarHBondContact O-N 3.31Å; M40-R42 VanDerWaalsContact C-N 3.33Å; M40-R42 PolarHBondContact O-N 3.05Å; R42-K44 VanDerWaalsContact C-N 3.27Å; R42-K44 PolarHBondContact O-N 2.95Å; R42-E45 PolarHBondContact O-N 2.95Å; R42-E46 PolarHBondContact O-N 2.74Å
43	Q	86.1	Confident	84.3	Confident	127 Å²	127	100.9 Å²	100.9	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-60.5	-41.3	174.8	-176	-177.3	-39.8	0	0	110.6	V39 M40 E46 E47	V39-Q43 PolarHBondContact O-N 3.46Å; M40-Q43 PolarHBondContact O-N 2.99Å; Q43-E46 PolarHBondContact O-N 3.13Å; Q43-E47 WeakPolarHBondContact O-CB 3.44Å; Q43-E47 PolarHBondContact O-N 2.92Å
44	K	85.7	Confident	83.6	Confident	123 Å²	123	102.7 Å²	102.7	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-66.8	-38.9	175.1	-176.3	-177.8	173.1	-171.1	0	112.8	M40 D41 R42 E46 E47 E48	M40-K44 VanDerWaalsContact O-CB 3.32Å; M40-K44 WeakPolarHBondContact O-CB 3.36Å; M40-K44 PolarHBondContact O-N 3.39Å; D41-K44 PolarHBondContact O-N 3Å; R42-K44 VanDerWaalsContact C-N 3.27Å; R42-K44 PolarHBondContact O-N 2.95Å; K44-E46 VanDerWaalsContact C-N 3.35Å; K44-E47 PolarHBondContact O-N 3.42Å; K44-E48 WeakPolarHBondContact O-CB 3.25Å; K44-E48 PolarHBondContact O-N 3.03Å
45	E	87.3	Confident	83.2	Confident	128 Å²	128	103.9 Å²	103.9	60%	0.598	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-40.5	173	-169.3	-170.7	164.2	0	0	111.1	D41 R42 K49	D41-E45 WeakPolarHBondContact O-CB 3.27Å; D41-E45 PolarHBondContact O-N 2.66Å; R42-E45 PolarHBondContact O-N 2.95Å; E45-K49 WeakPolarHBondContact O-CB 3.45Å; E45-K49 PolarHBondContact O-N 2.86Å
46	E	80.4	Confident	82.4	Confident	128 Å²	128	101.3 Å²	101.3	60%	0.598	50%	0.497	S	S	*	.	H	α-helix	trans	-68.6	-40.6	175.3	-69.8	-165.5	139.5	0	0	112.3	R42 Q43 K44 K49 E50	R42-E46 PolarHBondContact O-N 2.74Å; Q43-E46 PolarHBondContact O-N 3.13Å; K44-E46 VanDerWaalsContact C-N 3.35Å; E46-K49 WeakPolarHBondContact O-CB 3.26Å; E46-K49 PolarHBondContact O-N 3.39Å; E46-E50 WeakPolarHBondContact O-CG 3.49Å; E46-E50 PolarHBondContact O-N 3.13Å
47	E	82.3	Confident	81.6	Confident	132 Å²	132	102.2 Å²	102.2	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-66.9	-44.5	175.4	-172.3	172.5	-169.7	0	0	112.2	Q43 K44 K49 E50 E51	Q43-E47 WeakPolarHBondContact O-CB 3.44Å; Q43-E47 PolarHBondContact O-N 2.92Å; K44-E47 PolarHBondContact O-N 3.42Å; E47-K49 PolarHBondContact O-N 2.94Å; E47-E50 PolarHBondContact O-N 3.36Å; E47-E51 WeakPolarHBondContact O-CB 3.4Å; E47-E51 PolarHBondContact O-N 3.37Å
48	E	84.9	Confident	80.9	Confident	129 Å²	129	102.4 Å²	102.4	60%	0.603	51%	0.512	S	S	*	.	H	α-helix	trans	-62.4	-33.7	173.8	-175.9	173.8	171.1	0	0	111.2	K44 A52	K44-E48 WeakPolarHBondContact O-CB 3.25Å; K44-E48 PolarHBondContact O-N 3.03Å; E48-A52 WeakPolarHBondContact O-CA 3.5Å; E48-A52 WeakPolarHBondContact O-CB 3.38Å; E48-A52 PolarHBondContact O-N 3.43Å
49	K	84.2	Confident	79.8	Confident	119 Å²	119	107 Å²	107	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-73.4	-38.3	176.4	179	-178.8	176.4	-172.4	0	112.6	E45 E46 E47 M53	E45-K49 WeakPolarHBondContact O-CB 3.45Å; E45-K49 PolarHBondContact O-N 2.86Å; E46-K49 WeakPolarHBondContact O-CB 3.26Å; E46-K49 PolarHBondContact O-N 3.39Å; E47-K49 PolarHBondContact O-N 2.94Å; K49-M53 WeakPolarHBondContact O-CG 3.31Å; K49-M53 PolarHBondContact O-N 2.84Å
50	E	78.5	Confident	78.5	Confident	127 Å²	127	108.2 Å²	108.2	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-65.7	-45	169.6	-72.3	-153.6	150.4	0	0	111.3	E46 E47 A52 M53 L54	E46-E50 WeakPolarHBondContact O-CG 3.49Å; E46-E50 PolarHBondContact O-N 3.13Å; E47-E50 PolarHBondContact O-N 3.36Å; E50-A52 VanDerWaalsContact C-N 3.32Å; E50-A52 PolarHBondContact O-N 2.77Å; E50-M53 HydrophobicContact CG-CE 4.17Å; E50-M53 PolarHBondContact O-N 3.47Å; E50-L54 WeakPolarHBondContact O-CB 3.26Å; E50-L54 PolarHBondContact O-N 2.8Å
51	E	80.7	Confident	77	Confident	93 Å²	93	111.2 Å²	111.2	44%	0.435	54%	0.539	S	S	.	.	H	α-helix	trans	-65.8	-34.9	177	-153.6	-144.5	176.9	0	0	111.6	E47 L54 K55	E47-E51 WeakPolarHBondContact O-CB 3.4Å; E47-E51 PolarHBondContact O-N 3.37Å; E51-L54 PolarHBondContact O-N 3.16Å; E51-K55 HydrophobicContact CG-CD 4.4Å; E51-K55 VanDerWaalsContact O-CB 3.22Å; E51-K55 WeakPolarHBondContact O-CB 3.43Å; E51-K55 VanDerWaalsContact O-CG 3.25Å; E51-K55 WeakPolarHBondContact O-CG 3.46Å; E51-K55 PolarHBondContact O-N 3.36Å; E51-K55 WeakPolarHBondContact OE1-CE 3.12Å; E51-K55 IonicContact OE1-NZ 2.74Å; E51-K55 PolarHBondContact OE1-NZ 3.13Å; E51-K55 WeakPolarHBondContact OE2-CE 3.47Å; E51-K55 IonicContact OE2-NZ 2.66Å; E51-K55 PolarHBondContact OE2-NZ 2.79Å
52	A	81.7	Confident	75.4	Confident	43 Å²	43	110 Å²	110	36%	0.355	54%	0.543	S	S	.	.	H	α-helix	trans	-68.1	-37.7	172.7	0	0	0	0	0	112.2	E48 E50 C56	E48-A52 WeakPolarHBondContact O-CA 3.5Å; E48-A52 WeakPolarHBondContact O-CB 3.38Å; E48-A52 PolarHBondContact O-N 3.43Å; E50-A52 VanDerWaalsContact C-N 3.32Å; E50-A52 PolarHBondContact O-N 2.77Å; A52-C56 WeakPolarHBondContact O-CB 3.29Å; A52-C56 PolarHBondContact O-N 3.4Å; A52-C56 PolarHBondContact O-SG 3.11Å
53	M	71.7	Confident	73.4	Confident	109 Å²	109	110.4 Å²	110.4	54%	0.537	55%	0.548	S	S	.	.	H	α-helix	trans	-64.9	-45.4	171.3	-75.8	-172	-63.6	0	0	111.1	K49 E50 C56 V57	K49-M53 WeakPolarHBondContact O-CG 3.31Å; K49-M53 PolarHBondContact O-N 2.84Å; E50-M53 HydrophobicContact CG-CE 4.17Å; E50-M53 PolarHBondContact O-N 3.47Å; M53-C56 PolarHBondContact O-N 3.09Å; M53-V57 WeakPolarHBondContact O-CG2 3.2Å; M53-V57 PolarHBondContact O-N 2.9Å
54	L	73.7	Confident	71.2	Confident	110 Å²	110	110.1 Å²	110.1	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-60.6	-47	174.5	-82.4	156.9	0	0	0	111.9	E50 E51 C56 V57 V58	E50-L54 WeakPolarHBondContact O-CB 3.26Å; E50-L54 PolarHBondContact O-N 2.8Å; E51-L54 PolarHBondContact O-N 3.16Å; L54-C56 VanDerWaalsContact C-N 3.32Å; L54-C56 PolarHBondContact O-N 2.86Å; L54-V57 PolarHBondContact O-N 3.07Å; L54-V58 WeakPolarHBondContact O-CB 3.4Å; L54-V58 WeakPolarHBondContact O-CG2 3.34Å; L54-V58 PolarHBondContact O-N 3.31Å
55	K	76.7	Confident	68.9	Low	118 Å²	118	108.3 Å²	108.3	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-60.3	-38.6	174.1	-79.7	168	172.2	163.5	0	111.9	E51 R59	E51-K55 HydrophobicContact CG-CD 4.4Å; E51-K55 VanDerWaalsContact O-CB 3.22Å; E51-K55 WeakPolarHBondContact O-CB 3.43Å; E51-K55 VanDerWaalsContact O-CG 3.25Å; E51-K55 WeakPolarHBondContact O-CG 3.46Å; E51-K55 PolarHBondContact O-N 3.36Å; E51-K55 WeakPolarHBondContact OE1-CE 3.12Å; E51-K55 IonicContact OE1-NZ 2.74Å; E51-K55 PolarHBondContact OE1-NZ 3.13Å; E51-K55 WeakPolarHBondContact OE2-CE 3.47Å; E51-K55 IonicContact OE2-NZ 2.66Å; E51-K55 PolarHBondContact OE2-NZ 2.79Å; K55-R59 WeakPolarHBondContact O-CB 3.4Å; K55-R59 PolarHBondContact O-N 3.16Å
56	C	70.4	Confident	66.6	Low	55 Å²	55	107.2 Å²	107.2	37%	0.372	58%	0.578	S	S	.	*	H	α-helix	trans	-66.1	-48.4	173.6	-71.8	0	0	0	0	111.7	A52 M53 L54 V58 R59 D60	A52-C56 WeakPolarHBondContact O-CB 3.29Å; A52-C56 PolarHBondContact O-N 3.4Å; A52-C56 PolarHBondContact O-SG 3.11Å; M53-C56 PolarHBondContact O-N 3.09Å; L54-C56 VanDerWaalsContact C-N 3.32Å; L54-C56 PolarHBondContact O-N 2.86Å; C56-V58 PolarHBondContact O-N 3.24Å; C56-R59 PolarHBondContact O-N 3.5Å; C56-D60 WeakPolarHBondContact O-CB 3.3Å; C56-D60 PolarHBondContact O-N 3.26Å
57	V	68.1	Low	64.3	Low	88 Å²	88	106.9 Å²	106.9	53%	0.533	59%	0.589	S	S	.	*	H	α-helix	trans	-58	-48.2	176.8	170.7	0	0	0	0	111	M53 L54 D60 M61	M53-V57 WeakPolarHBondContact O-CG2 3.2Å; M53-V57 PolarHBondContact O-N 2.9Å; L54-V57 PolarHBondContact O-N 3.07Å; V57-D60 PolarHBondContact O-N 2.81Å; V57-M61 HydrophobicContact CG1-SD 4.05Å; V57-M61 WeakPolarHBondContact O-CB 3.3Å; V57-M61 VanDerWaalsContact O-CG 3.23Å; V57-M61 WeakPolarHBondContact O-CG 3.49Å; V57-M61 PolarHBondContact O-N 3.12Å
58	V	70.6	Confident	62.2	Low	94 Å²	94	110.4 Å²	110.4	57%	0.57	60%	0.602	S	S	*	*	H	α-helix	trans	-63.7	-47.4	178.5	171.4	0	0	0	0	111.4	L54 C56 D60 M61 A62	L54-V58 WeakPolarHBondContact O-CB 3.4Å; L54-V58 WeakPolarHBondContact O-CG2 3.34Å; L54-V58 PolarHBondContact O-N 3.31Å; C56-V58 PolarHBondContact O-N 3.24Å; V58-D60 VanDerWaalsContact C-N 3.35Å; V58-D60 PolarHBondContact O-N 2.95Å; V58-M61 PolarHBondContact O-N 3.14Å; V58-A62 WeakPolarHBondContact O-CB 3.35Å; V58-A62 PolarHBondContact O-N 2.96Å
59	R	66.2	Low	59.8	Low	138 Å²	138	110.8 Å²	110.8	52%	0.521	61%	0.613	S	S	.	*	H	α-helix	trans	-64.7	-38.4	-180	-173.8	-159	68.2	-159.2	-9.9	112.2	K55 C56 M61 A62	K55-R59 WeakPolarHBondContact O-CB 3.4Å; K55-R59 PolarHBondContact O-N 3.16Å; C56-R59 PolarHBondContact O-N 3.5Å; R59-M61 VanDerWaalsContact C-N 3.33Å; R59-A62 PolarHBondContact O-N 3.25Å
60	D	60.2	Low	57.5	Low	98 Å²	98	111 Å²	111	52%	0.524	63%	0.627	S	S	.	*	H	α-helix	trans	-79.5	-19.6	-178.2	-62.6	-7.1	0	0	0	111.5	C56 V57 V58	C56-D60 WeakPolarHBondContact O-CB 3.3Å; C56-D60 PolarHBondContact O-N 3.26Å; V57-D60 PolarHBondContact O-N 2.81Å; V58-D60 VanDerWaalsContact C-N 3.35Å; V58-D60 PolarHBondContact O-N 2.95Å
61	M	52.7	Low	55.5	Low	132 Å²	132	116.7 Å²	116.7	65%	0.65	64%	0.643	S	S	*	*	H	α-helix	trans	-79.6	-28.8	163.6	-69.7	179.9	98.3	0	0	113.4	V57 V58 R59 K63 F203	V57-M61 HydrophobicContact CG1-SD 4.05Å; V57-M61 WeakPolarHBondContact O-CB 3.3Å; V57-M61 VanDerWaalsContact O-CG 3.23Å; V57-M61 WeakPolarHBondContact O-CG 3.49Å; V57-M61 PolarHBondContact O-N 3.12Å; V58-M61 PolarHBondContact O-N 3.14Å; R59-M61 VanDerWaalsContact C-N 3.33Å; M61-K63 PolarHBondContact O-N 3.08Å; M61-F203 HydrophobicContact CE-CE1 4.26Å; M61-F203 HydrophobicContact CE-CE2 4.47Å; M61-F203 HydrophobicContact CE-CZ 3.97Å
62	A	54.4	Low	53.1	Low	73 Å²	73	120.1 Å²	120.1	60%	0.603	66%	0.664	S	S	*	*	S	Bend	trans	-90.3	11.3	-173.7	0	0	0	0	0	115.2	V58 R59 P64	V58-A62 WeakPolarHBondContact O-CB 3.35Å; V58-A62 PolarHBondContact O-N 2.96Å; R59-A62 PolarHBondContact O-N 3.25Å; A62-P64 VanDerWaalsContact O-CD 3.27Å; A62-P64 WeakPolarHBondContact O-CD 3.33Å
63	K	44.2	Very low	50.9	Low	154 Å²	154	122.7 Å²	122.7	67%	0.67	69%	0.685	S	S	*	*			trans	-109.3	98.7	-169.3	-152.7	173.4	-169.8	180	0	113.3	M61 A65	M61-K63 PolarHBondContact O-N 3.08Å; K63-A65 PolarHBondContact O-N 3.48Å; K63-A65 VanDerWaalsContact O-N 3.13Å
64	P	40.3	Very low	49.2	Very low	121 Å²	121	126.4 Å²	126.4	79%	0.786	70%	0.701	S	S	*	*			trans	-72.6	104.9	175.5	29.1	-33.6	0	0	0	110.8	A62 A66	A62-P64 VanDerWaalsContact O-CD 3.27Å; A62-P64 WeakPolarHBondContact O-CD 3.33Å; P64-A66 PolarHBondContact O-N 3.07Å
65	A	37.9	Very low	47.4	Very low	86 Å²	86	126.1 Å²	126.1	71%	0.711	71%	0.709	S	S	*	*			trans	-88	103.4	-179.9	0	0	0	0	0	111.8	K63 C67	K63-A65 PolarHBondContact O-N 3.48Å; K63-A65 VanDerWaalsContact O-N 3.13Å; A65-C67 PolarHBondContact O-N 3.34Å; A65-C67 VanDerWaalsContact O-N 3.16Å
66	A	38.8	Very low	45.5	Very low	104 Å²	104	129.6 Å²	129.6	86%	0.86	73%	0.727	S	S	*	*			trans	-75.7	96.9	172.5	0	0	0	0	0	111.2	P64 K68	P64-A66 PolarHBondContact O-N 3.07Å; A66-K68 PolarHBondContact O-N 3.29Å
67	C	32.1	Very low	44.1	Very low	121 Å²	121	131.3 Å²	131.3	82%	0.818	74%	0.737	S	S	*	*			trans	-73.1	116	-177	-60.1	0	0	0	0	113.1	A65	A65-C67 PolarHBondContact O-N 3.34Å; A65-C67 VanDerWaalsContact O-N 3.16Å
68	K	38.5	Very low	42.6	Very low	207 Å²	207	136.4 Å²	136.4	90%	0.9	76%	0.755	S	S	*	*			trans	-112.6	133.7	158.9	-74.2	-176.2	177.7	177.7	0	109.7	A66	A66-K68 PolarHBondContact O-N 3.29Å
69	T	34.8	Very low	41	Very low	137 Å²	137	140.9 Å²	140.9	84%	0.84	77%	0.77	S	S	*	*			trans	-91.7	141	-170.3	-31.3	0	0	0	0	112.9
70	P	36.1	Very low	39.8	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	78%	0.778	S	S	*	*			trans	-121.8	175.3	146.7	6.9	15.6	0	0	0	113.2
71	R	35.3	Very low	38.8	Very low	248 Å²	248	140.3 Å²	140.3	94%	0.936	79%	0.789	S	S	*	*			trans	-95.2	161.7	-167.6	-69.9	173.6	168.4	166.8	-5.5	114.7
72	N	30	Very low	37.9	Very low	164 Å²	164	141.3 Å²	141.3	88%	0.877	80%	0.796	S	S	*	*			trans	-61.6	151.1	169.1	-67.1	-22.4	0	0	0	114.1
73	A	36.9	Very low	37	Very low	97 Å²	97	144.3 Å²	144.3	80%	0.802	80%	0.802	S	S	*	*			trans	-154.2	153.3	137.4	0	0	0	0	0	110.2
74	E	34.8	Very low	36.6	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	81%	0.808	S	S	*	*			trans	-95.5	-179.5	175.5	-58.1	153.8	60.4	0	0	109.1
75	S	36.6	Very low	36.1	Very low	105 Å²	105	148.4 Å²	148.4	73%	0.734	81%	0.813	S	S	*	*			cis	-164.6	129.4	14.9	53.3	0	0	0	0	113.3
76	Q	36	Very low	36	Very low	190 Å²	190	155.5 Å²	155.5	89%	0.888	82%	0.822	S	S	*	*			trans	41.7	176.2	131.7	-110.8	-155.9	21.1	0	0	124.1
77	P	41.9	Very low	35.4	Very low	91 Å²	91	156.2 Å²	156.2	59%	0.591	82%	0.819	S	S	*	*				-134.6	-168.2	-119.2	46.3	-26.7	0	0	0	116.6
78	H	35.8	Very low	35.5	Very low	196 Å²	196	155.6 Å²	155.6	91%	0.907	81%	0.812	S	S	*	*			trans	-144.6	-179.7	160.7	-93	-63.5	0	0	0	113.6
79	Q	36.7	Very low	35	Very low	188 Å²	188	151.7 Å²	151.7	88%	0.879	81%	0.809	S	S	*	*			trans	-112.6	168.3	-151	-98.3	-172.4	-30.1	0	0	117.3
80	P	42.6	Very low	35	Very low	109 Å²	109	150.2 Å²	150.2	71%	0.708	80%	0.799	S	S	*	*			trans	-97.5	-173.6	-170.2	41.4	-38.5	0	0	0	114.6
81	P	38.1	Very low	35.1	Very low	114 Å²	114	150.4 Å²	150.4	74%	0.74	80%	0.801	S	S	*	*				-150.3	154.1	109.7	38.4	-22	0	0	0	118.6
82	L	33.8	Very low	35	Very low	154 Å²	154	150.1 Å²	150.1	81%	0.806	80%	0.8	S	S	*	*			trans	65.1	140.7	143.2	-69.2	170.4	0	0	0	124.8
83	N	35.9	Very low	35.3	Very low	135 Å²	135	151.4 Å²	151.4	72%	0.722	80%	0.797	S	S	*	*			trans	94.3	131.9	140.9	-83.3	3.5	0	0	0	124.2
84	I	35.7	Very low	35.4	Very low	154 Å²	154	153 Å²	153	79%	0.79	80%	0.8	S	S	*	*			trans	85.5	134.5	152.2	-65.7	161.9	0	0	0	119.5
85	F	29.9	Very low	35.4	Very low	207 Å²	207	149.1 Å²	149.1	91%	0.908	79%	0.793	S	S	*	*			trans	-60	135.4	-177.4	-68	-109.6	0	0	0	114.3
86	R	35.1	Very low	35.1	Very low	236 Å²	236	149.3 Å²	149.3	89%	0.891	80%	0.795	S	S	*	*			trans	-153.7	135.5	135.2	-151.3	165.3	-174.4	151.6	0.8	111.1	V88	R86-V88 PolarHBondContact O-N 2.97Å
87	C	26.7	Very low	35	Very low	119 Å²	119	147.9 Å²	147.9	80%	0.804	79%	0.788	S	S	*	*			trans	-75.1	121.9	172	-175.3	0	0	0	0	109.6
88	V	34.2	Very low	34.4	Very low	108 Å²	108	153 Å²	153	66%	0.655	80%	0.804	S	S	*	*			trans	-144.2	115.6	166.2	-169.9	0	0	0	0	108.3	R86 V90	R86-V88 PolarHBondContact O-N 2.97Å; V88-V90 HydrophobicContact CG1-CG2 3.81Å; V88-V90 PolarHBondContact O-N 3.25Å
89	C	28.3	Very low	34.5	Very low	125 Å²	125	144.5 Å²	144.5	85%	0.845	77%	0.769	S	S	*	*			trans	-73.7	113	173.4	-64.9	0	0	0	0	109.8
90	V	35.5	Very low	35.1	Very low	105 Å²	105	138.7 Å²	138.7	64%	0.636	76%	0.76	S	S	*	*			trans	-135.4	121	171.5	-172.1	0	0	0	0	109.3	V88 R92	V88-V90 HydrophobicContact CG1-CG2 3.81Å; V88-V90 PolarHBondContact O-N 3.25Å; V90-R92 PolarHBondContact O-N 2.85Å
91	P	36.3	Very low	35.4	Very low	127 Å²	127	138.7 Å²	138.7	83%	0.825	76%	0.76	S	S	*	*			trans	-71	98	179	28.3	-33.7	0	0	0	110.7	K93	P91-K93 PolarHBondContact O-N 3.24Å
92	R	33.9	Very low	36.2	Very low	241 Å²	241	137.2 Å²	137.2	91%	0.909	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-71.8	118.8	171.7	-84.1	-171.9	164.8	-166.8	-4	110.2	V90	V90-R92 PolarHBondContact O-N 2.85Å
93	K	36	Very low	37.5	Very low	191 Å²	191	134.7 Å²	134.7	83%	0.83	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-53.2	137	179	-62.3	173.7	-179.7	174.3	0	111.6	P91 S95	P91-K93 PolarHBondContact O-N 3.24Å; K93-S95 PolarHBondContact O-N 2.87Å
94	P	39.3	Very low	38.8	Very low	131 Å²	131	130.9 Å²	130.9	85%	0.851	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-65.6	129.8	166.7	28.6	-33	0	0	0	109.4
95	S	35.1	Very low	40.5	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-99.3	121.2	179.1	42.7	0	0	0	0	111	K93	K93-S95 PolarHBondContact O-N 2.87Å
96	S	29.7	Very low	42.7	Very low	109 Å²	109	129.1 Å²	129.1	76%	0.762	68%	0.682	S	S	*	*			trans	51.5	77.9	158.6	58.6	0	0	0	0	118.5
97	E	34.6	Very low	44.6	Very low	160 Å²	160	119.8 Å²	119.8	75%	0.748	65%	0.65	S	S	*	*			trans	-116.6	95.2	136	-97.4	-135.5	112.1	0	0	108.8
98	E	30	Very low	47	Very low	198 Å²	198	118 Å²	118	93%	0.925	63%	0.63	S	S	*	*			trans	-77.1	132.3	165.9	-69.2	-153.7	142.1	0	0	110.1
99	G	37.3	Very low	49.3	Very low	17 Å²	17	118.3 Å²	118.3	18%	0.175	62%	0.624	C	S	.	*			trans	169.4	-10.7	178.1	0	0	0	0	0	117.3	R103	G99-R103 WeakPolarHBondContact O-CB 3.26Å; G99-R103 WeakPolarHBondContact O-CD 3.46Å; G99-R103 WeakPolarHBondContact O-CG 3.16Å; G99-R103 PolarHBondContact O-N 2.79Å
100	G	49.1	Very low	51.6	Low	66 Å²	66	117.7 Å²	117.7	68%	0.68	61%	0.609	S	S	*	*	H	α-helix	trans	-51.4	-64.2	179.6	0	0	0	0	0	114.1
101	P	48.6	Very low	53.8	Low	110 Å²	110	113.5 Å²	113.5	71%	0.714	58%	0.582	S	S	*	*	H	α-helix	trans	-77.2	-40.3	179.9	28.7	-33.3	0	0	0	113.1	R103 N104 W105	P101-R103 VanDerWaalsContact C-N 3.32Å; P101-R103 PolarHBondContact O-N 3.06Å; P101-N104 WeakPolarHBondContact O-CB 3.2Å; P101-N104 PolarHBondContact O-N 2.79Å; P101-W105 PolarHBondContact O-N 2.93Å; P101-W105 VanDerWaalsContact O-N 3.16Å
102	D	56.1	Low	56	Low	83 Å²	83	111.9 Å²	111.9	44%	0.444	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-34.7	-171.7	-174.3	52.1	0	0	0	112.8	N104 W105 R106	D102-N104 VanDerWaalsContact C-N 3.26Å; D102-N104 PolarHBondContact O-N 3.3Å; D102-W105 PolarHBondContact O-N 2.74Å; D102-R106 VanDerWaalsContact O-CB 3.26Å; D102-R106 WeakPolarHBondContact O-CB 3.2Å; D102-R106 PolarHBondContact O-N 2.7Å
103	R	60	Low	58.2	Low	100 Å²	100	104.3 Å²	104.3	38%	0.377	55%	0.548	S	S	.	.	H	α-helix	trans	-60.1	-35.4	172.9	-73.6	171.8	-176.3	-118.5	12.8	112.6	G99 P101 L107	G99-R103 WeakPolarHBondContact O-CB 3.26Å; G99-R103 WeakPolarHBondContact O-CD 3.46Å; G99-R103 WeakPolarHBondContact O-CG 3.16Å; G99-R103 PolarHBondContact O-N 2.79Å; P101-R103 VanDerWaalsContact C-N 3.32Å; P101-R103 PolarHBondContact O-N 3.06Å; R103-L107 WeakPolarHBondContact O-CB 3.2Å; R103-L107 VanDerWaalsContact O-CG 3.3Å; R103-L107 WeakPolarHBondContact O-CG 3.11Å; R103-L107 PolarHBondContact O-N 2.67Å; R103-L107 VanDerWaalsContact O-N 3.11Å
104	N	64	Low	60.3	Low	55 Å²	55	98.2 Å²	98.2	29%	0.294	52%	0.52	S	S	.	.	H	α-helix	trans	-74.9	-43.3	179.9	-167.2	7.9	0	0	0	111.4	P101 D102 R106 L107 H108 S198	P101-N104 WeakPolarHBondContact O-CB 3.2Å; P101-N104 PolarHBondContact O-N 2.79Å; D102-N104 VanDerWaalsContact C-N 3.26Å; D102-N104 PolarHBondContact O-N 3.3Å; N104-R106 PolarHBondContact O-N 3.43Å; N104-L107 PolarHBondContact O-N 3.35Å; N104-H108 PolarHBondContact O-N 2.61Å; N104-H108 VanDerWaalsContact O-N 3.07Å; N104-H108 PolarHBondContact O-ND1 2.86Å; N104-H108 PolarHBondContact OD1-CE1 3.31Å; N104-H108 PolarHBondContact OD1-ND1 2.9Å; N104-H108 VanDerWaalsContact OD1-ND1 3.08Å; N104-S198 WeakPolarHBondContact OD1-CB 3.26Å
105	W	70.1	Confident	62.2	Low	170 Å²	170	96.3 Å²	96.3	64%	0.644	50%	0.498	S	S	*	.	H	α-helix	trans	-56.1	-49.2	171.2	173.3	-110.1	0	0	0	111.6	P101 D102 L107 H108 Q109	P101-W105 PolarHBondContact O-N 2.93Å; P101-W105 VanDerWaalsContact O-N 3.16Å; D102-W105 PolarHBondContact O-N 2.74Å; W105-L107 VanDerWaalsContact C-N 3.32Å; W105-L107 PolarHBondContact O-N 2.87Å; W105-H108 PolarHBondContact O-N 3.25Å; W105-H108 VanDerWaalsContact O-N 3.13Å; W105-Q109 PolarHBondContact O-N 2.99Å
106	R	77.6	Confident	64.5	Low	154 Å²	154	95.2 Å²	95.2	58%	0.581	48%	0.481	S	S	*	.	H	α-helix	trans	-65.6	-31.9	-178.7	-152.6	167.1	-171	170.8	1.3	113	D102 N104 Q110	D102-R106 VanDerWaalsContact O-CB 3.26Å; D102-R106 WeakPolarHBondContact O-CB 3.2Å; D102-R106 PolarHBondContact O-N 2.7Å; N104-R106 PolarHBondContact O-N 3.43Å; R106-Q110 WeakPolarHBondContact O-CB 3.08Å; R106-Q110 WeakPolarHBondContact O-CG 3.16Å; R106-Q110 PolarHBondContact O-N 3.45Å; R106-Q110 VanDerWaalsContact O-N 3.09Å
107	L	74.6	Confident	66.7	Low	40 Å²	40	95.5 Å²	95.5	21%	0.209	47%	0.47	C	S	.	.	H	α-helix	trans	-68.3	-41.7	171.2	-79.6	170	0	0	0	112.5	R103 N104 W105 Q110 F111 I194 K197	R103-L107 WeakPolarHBondContact O-CB 3.2Å; R103-L107 VanDerWaalsContact O-CG 3.3Å; R103-L107 WeakPolarHBondContact O-CG 3.11Å; R103-L107 PolarHBondContact O-N 2.67Å; R103-L107 VanDerWaalsContact O-N 3.11Å; N104-L107 PolarHBondContact O-N 3.35Å; W105-L107 VanDerWaalsContact C-N 3.32Å; W105-L107 PolarHBondContact O-N 2.87Å; L107-Q110 PolarHBondContact O-N 3.49Å; L107-F111 PolarHBondContact O-N 3.36Å; L107-F111 VanDerWaalsContact O-N 3.13Å; L107-I194 HydrophobicContact CB-CG2 4.36Å; L107-K197 HydrophobicContact CD1-CB 4.16Å; L107-K197 HydrophobicContact CD1-CD 4.48Å
108	H	77.1	Confident	68.7	Low	81 Å²	81	89 Å²	89	38%	0.375	44%	0.441	S	S	.	.	H	α-helix	trans	-66.6	-41	174.9	-78.4	85.7	0	0	0	111.9	N104 W105 Q110 F111 E112	N104-H108 PolarHBondContact O-N 2.61Å; N104-H108 VanDerWaalsContact O-N 3.07Å; N104-H108 PolarHBondContact O-ND1 2.86Å; N104-H108 PolarHBondContact OD1-CE1 3.31Å; N104-H108 PolarHBondContact OD1-ND1 2.9Å; N104-H108 VanDerWaalsContact OD1-ND1 3.08Å; W105-H108 PolarHBondContact O-N 3.25Å; W105-H108 VanDerWaalsContact O-N 3.13Å; H108-Q110 VanDerWaalsContact C-N 3.32Å; H108-Q110 PolarHBondContact O-N 3.47Å; H108-F111 WeakPolarHBondContact O-CA 3.23Å; H108-F111 VanDerWaalsContact O-CB 3.27Å; H108-F111 WeakPolarHBondContact O-CB 3.42Å; H108-F111 PolarHBondContact O-N 2.83Å; H108-E112 PolarHBondContact O-N 2.81Å
109	Q	81.9	Confident	70.9	Confident	115 Å²	115	85.7 Å²	85.7	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-39.1	174.7	-162	-179	49.4	0	0	111.8	W105 F111 S113	W105-Q109 PolarHBondContact O-N 2.99Å; Q109-F111 PolarHBondContact O-N 2.89Å; Q109-S113 WeakPolarHBondContact O-CB 3.11Å; Q109-S113 PolarHBondContact O-N 3.02Å
110	Q	77.6	Confident	72.9	Confident	113 Å²	113	91.8 Å²	91.8	53%	0.528	44%	0.442	S	S	.	.	H	α-helix	trans	-70	-13.5	171.3	-76.2	-172.4	0.2	0	0	114.5	R106 L107 H108 Y114 K190	R106-Q110 WeakPolarHBondContact O-CB 3.08Å; R106-Q110 WeakPolarHBondContact O-CG 3.16Å; R106-Q110 PolarHBondContact O-N 3.45Å; R106-Q110 VanDerWaalsContact O-N 3.09Å; L107-Q110 PolarHBondContact O-N 3.49Å; H108-Q110 VanDerWaalsContact C-N 3.32Å; H108-Q110 PolarHBondContact O-N 3.47Å; Q110-Y114 WeakPolarHBondContact O-CB 3.08Å; Q110-K190 PolarHBondContact O-NZ 2.84Å
111	F	80.2	Confident	74	Confident	16 Å²	16	91.5 Å²	91.5	7%	0.07	43%	0.425	C	S	.	.	H	α-helix	trans	-83.8	-53.3	172	-172.1	-110.5	0	0	0	111.2	L107 H108 Q109 S113 Y114 K115 K190 Q191 I194	L107-F111 PolarHBondContact O-N 3.36Å; L107-F111 VanDerWaalsContact O-N 3.13Å; H108-F111 WeakPolarHBondContact O-CA 3.23Å; H108-F111 VanDerWaalsContact O-CB 3.27Å; H108-F111 WeakPolarHBondContact O-CB 3.42Å; H108-F111 PolarHBondContact O-N 2.83Å; Q109-F111 PolarHBondContact O-N 2.89Å; F111-S113 PolarHBondContact O-N 3.34Å; F111-Y114 WeakPolarHBondContact O-CB 3.42Å; F111-Y114 PolarHBondContact O-N 3.26Å; F111-Y114 VanDerWaalsContact O-N 3.07Å; F111-K115 HydrophobicContact CE1-CD 4.18Å; F111-K115 WeakPolarHBondContact O-CB 3.34Å; F111-K115 PolarHBondContact O-N 2.91Å; F111-K190 HydrophobicContact CD2-CB 4.45Å; F111-K190 HydrophobicContact CD2-CD 4.25Å; F111-K190 HydrophobicContact CD2-CG 4.3Å; F111-K190 HydrophobicContact CE2-CB 4.33Å; F111-Q191 HydrophobicContact CE1-CG 4.26Å; F111-Q191 HydrophobicContact CE2-CB 3.71Å; F111-Q191 HydrophobicContact CE2-CG 4.27Å; F111-Q191 HydrophobicContact CZ-CB 3.66Å; F111-Q191 HydrophobicContact CZ-CG 3.82Å; F111-I194 HydrophobicContact CB-CD1 3.57Å; F111-I194 HydrophobicContact CD2-CD1 3.56Å; F111-I194 HydrophobicContact CG-CD1 3.8Å
112	E	82.1	Confident	75	Confident	94 Å²	94	86.4 Å²	86.4	44%	0.439	39%	0.392	S	S	.	.	H	α-helix	trans	-63.5	-40.7	179.6	-68.6	-58.5	134	0	0	111.5	H108 Y114 K115 E116	H108-E112 PolarHBondContact O-N 2.81Å; E112-Y114 VanDerWaalsContact C-N 3.29Å; E112-Y114 PolarHBondContact O-N 3.44Å; E112-K115 PolarHBondContact O-N 3.2Å; E112-K115 WeakPolarHBondContact OE1-CD 3.41Å; E112-K115 IonicContact OE1-NZ 3.57Å; E112-K115 PolarHBondContact OE1-NZ 2.71Å; E112-K115 WeakPolarHBondContact OE2-CD 3.46Å; E112-K115 WeakPolarHBondContact OE2-CE 3.41Å; E112-K115 IonicContact OE2-NZ 2.75Å; E112-K115 PolarHBondContact OE2-NZ 3.46Å; E112-E116 VanDerWaalsContact O-CB 3.29Å; E112-E116 WeakPolarHBondContact O-CB 3.29Å; E112-E116 PolarHBondContact O-N 3.12Å
113	S	82.1	Confident	75.7	Confident	82 Å²	82	84.5 Å²	84.5	57%	0.573	38%	0.38	S	S	*	.	H	α-helix	trans	-57.3	-39.7	171.3	174.7	0	0	0	0	112.9	Q109 F111 Q117	Q109-S113 WeakPolarHBondContact O-CB 3.11Å; Q109-S113 PolarHBondContact O-N 3.02Å; F111-S113 PolarHBondContact O-N 3.34Å; S113-Q117 WeakPolarHBondContact O-CB 3.37Å; S113-Q117 PolarHBondContact O-N 2.94Å
114	Y	79.1	Confident	76.2	Confident	63 Å²	63	84 Å²	84	25%	0.247	38%	0.382	C	S	.	.	H	α-helix	trans	-74.4	-39.2	178.5	177.2	-105.9	0	0	0	112.7	Q110 F111 E112 Q117 V118 L187 K190	Q110-Y114 WeakPolarHBondContact O-CB 3.08Å; F111-Y114 WeakPolarHBondContact O-CB 3.42Å; F111-Y114 PolarHBondContact O-N 3.26Å; F111-Y114 VanDerWaalsContact O-N 3.07Å; E112-Y114 VanDerWaalsContact C-N 3.29Å; E112-Y114 PolarHBondContact O-N 3.44Å; Y114-Q117 PolarHBondContact O-N 3.05Å; Y114-V118 HydrophobicContact CE1-CG2 4.27Å; Y114-V118 HydrophobicContact CE2-CG2 4.39Å; Y114-V118 VanDerWaalsContact O-CG2 3.31Å; Y114-V118 WeakPolarHBondContact O-CG2 3.16Å; Y114-V118 PolarHBondContact O-N 2.94Å; Y114-L187 HydrophobicContact CE1-CG 4.29Å; Y114-K190 VanDerWaalsContact CB-NZ 3.33Å; Y114-K190 HydrophobicContact CD1-CD 3.75Å; Y114-K190 HydrophobicContact CE1-CD 4.19Å; Y114-K190 HydrophobicContact CG-CD 4.2Å
115	K	79.9	Confident	76.2	Confident	91 Å²	91	82.1 Å²	82.1	40%	0.396	37%	0.374	S	S	.	.	H	α-helix	trans	-63.1	-42	175	176.2	178.3	158.9	-144	0	111.1	F111 E112 V118 R119 L187	F111-K115 HydrophobicContact CE1-CD 4.18Å; F111-K115 WeakPolarHBondContact O-CB 3.34Å; F111-K115 PolarHBondContact O-N 2.91Å; E112-K115 PolarHBondContact O-N 3.2Å; E112-K115 WeakPolarHBondContact OE1-CD 3.41Å; E112-K115 IonicContact OE1-NZ 3.57Å; E112-K115 PolarHBondContact OE1-NZ 2.71Å; E112-K115 WeakPolarHBondContact OE2-CD 3.46Å; E112-K115 WeakPolarHBondContact OE2-CE 3.41Å; E112-K115 IonicContact OE2-NZ 2.75Å; E112-K115 PolarHBondContact OE2-NZ 3.46Å; K115-V118 PolarHBondContact O-N 3.13Å; K115-R119 PolarHBondContact O-N 2.74Å; K115-L187 HydrophobicContact CB-CD2 4.42Å; K115-L187 HydrophobicContact CG-CD2 4.33Å
116	E	82.2	Confident	75.8	Confident	82 Å²	82	81.9 Å²	81.9	38%	0.383	37%	0.373	S	S	.	.	H	α-helix	trans	-68.1	-41.4	173.3	178.7	56.4	-164.1	0	0	112.3	E112 V118 R119 K120	E112-E116 VanDerWaalsContact O-CB 3.29Å; E112-E116 WeakPolarHBondContact O-CB 3.29Å; E112-E116 PolarHBondContact O-N 3.12Å; E116-V118 VanDerWaalsContact C-N 3.29Å; E116-V118 PolarHBondContact O-N 3.15Å; E116-R119 VanDerWaalsContact CD-NH2 3.3Å; E116-R119 PolarHBondContact O-N 3.27Å; E116-R119 IonicContact OE1-CZ 3.14Å; E116-R119 IonicContact OE1-NE 3.36Å; E116-R119 IonicContact OE1-NH2 2.69Å; E116-R119 PolarHBondContact OE1-NH2 2.93Å; E116-R119 IonicContact OE2-CZ 2.77Å; E116-R119 IonicContact OE2-NE 3.12Å; E116-R119 PolarHBondContact OE2-NE 3.36Å; E116-R119 IonicContact OE2-NH2 3.67Å; E116-R119 PolarHBondContact OE2-NH2 3.42Å; E116-R119 VanDerWaalsContact OE2-NH2 3.09Å; E116-K120 WeakPolarHBondContact O-CB 3.22Å; E116-K120 PolarHBondContact O-N 2.88Å
117	Q	77.1	Confident	75.1	Confident	115 Å²	115	83 Å²	83	54%	0.537	38%	0.378	S	S	.	.	H	α-helix	trans	-59.6	-40.9	173.8	-170.8	-179.4	25.1	0	0	111.7	S113 Y114 K120 I121	S113-Q117 WeakPolarHBondContact O-CB 3.37Å; S113-Q117 PolarHBondContact O-N 2.94Å; Y114-Q117 PolarHBondContact O-N 3.05Å; Q117-K120 PolarHBondContact O-N 3.11Å; Q117-I121 HydrophobicContact CG-CD1 4.2Å; Q117-I121 WeakPolarHBondContact O-CD1 3.41Å; Q117-I121 VanDerWaalsContact O-CG1 3.26Å; Q117-I121 WeakPolarHBondContact O-CG1 3.26Å; Q117-I121 PolarHBondContact O-N 3.31Å
118	V	75.2	Confident	74.3	Confident	23 Å²	23	90.8 Å²	90.8	14%	0.139	41%	0.406	C	S	.	.	H	α-helix	trans	-63.4	-46.8	173.4	169	0	0	0	0	111.2	Y114 K115 E116 K120 I121 G122 I141 L187	Y114-V118 HydrophobicContact CE1-CG2 4.27Å; Y114-V118 HydrophobicContact CE2-CG2 4.39Å; Y114-V118 VanDerWaalsContact O-CG2 3.31Å; Y114-V118 WeakPolarHBondContact O-CG2 3.16Å; Y114-V118 PolarHBondContact O-N 2.94Å; K115-V118 PolarHBondContact O-N 3.13Å; E116-V118 VanDerWaalsContact C-N 3.29Å; E116-V118 PolarHBondContact O-N 3.15Å; V118-K120 VanDerWaalsContact C-N 3.33Å; V118-K120 PolarHBondContact O-N 3.32Å; V118-I121 PolarHBondContact O-N 2.84Å; V118-G122 PolarHBondContact O-N 2.94Å; V118-I141 HydrophobicContact CG1-CG2 3.86Å; V118-I141 VanDerWaalsContact CG1-O 3.26Å; V118-I141 WeakPolarHBondContact CG1-O 3.17Å; V118-L187 HydrophobicContact CG1-CD1 4.27Å; V118-L187 HydrophobicContact CG2-CD1 4.41Å
119	R	78.1	Confident	72.9	Confident	130 Å²	130	92.9 Å²	92.9	49%	0.491	42%	0.416	S	S	.	.	H	α-helix	trans	-56.8	-46.5	175.7	-173.2	-176.9	70.5	106.2	-11.8	111.6	K115 E116 I121 G122 E123	K115-R119 PolarHBondContact O-N 2.74Å; E116-R119 VanDerWaalsContact CD-NH2 3.3Å; E116-R119 PolarHBondContact O-N 3.27Å; E116-R119 IonicContact OE1-CZ 3.14Å; E116-R119 IonicContact OE1-NE 3.36Å; E116-R119 IonicContact OE1-NH2 2.69Å; E116-R119 PolarHBondContact OE1-NH2 2.93Å; E116-R119 IonicContact OE2-CZ 2.77Å; E116-R119 IonicContact OE2-NE 3.12Å; E116-R119 PolarHBondContact OE2-NE 3.36Å; E116-R119 IonicContact OE2-NH2 3.67Å; E116-R119 PolarHBondContact OE2-NH2 3.42Å; E116-R119 VanDerWaalsContact OE2-NH2 3.09Å; R119-I121 PolarHBondContact O-N 2.96Å; R119-G122 PolarHBondContact O-N 2.8Å; R119-G122 VanDerWaalsContact O-N 3.11Å; R119-E123 IonicContact CZ-OE1 3.88Å; R119-E123 IonicContact NH1-OE1 3.87Å; R119-E123 PolarHBondContact NH1-OE1 3.02Å; R119-E123 PolarHBondContact O-N 3.32Å
120	K	77.7	Confident	71.3	Confident	144 Å²	144	90.4 Å²	90.4	63%	0.626	42%	0.421	S	S	*	.	H	α-helix	trans	-62.8	-41.9	-179.8	-167.8	169.9	-176.7	174.6	0	112.2	E116 Q117 V118 G122 E123 E124	E116-K120 WeakPolarHBondContact O-CB 3.22Å; E116-K120 PolarHBondContact O-N 2.88Å; Q117-K120 PolarHBondContact O-N 3.11Å; V118-K120 VanDerWaalsContact C-N 3.33Å; V118-K120 PolarHBondContact O-N 3.32Å; K120-G122 VanDerWaalsContact C-N 3.29Å; K120-G122 PolarHBondContact O-N 2.87Å; K120-E123 PolarHBondContact O-N 3.28Å; K120-E124 VanDerWaalsContact O-CB 3.26Å; K120-E124 WeakPolarHBondContact O-CB 3.2Å; K120-E124 PolarHBondContact O-N 3.43Å
121	I	73.5	Confident	69.6	Low	61 Å²	61	94.5 Å²	94.5	31%	0.313	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-36.9	173.1	-71	165.8	0	0	0	111.6	Q117 V118 R119 A125 K144	Q117-I121 HydrophobicContact CG-CD1 4.2Å; Q117-I121 WeakPolarHBondContact O-CD1 3.41Å; Q117-I121 VanDerWaalsContact O-CG1 3.26Å; Q117-I121 WeakPolarHBondContact O-CG1 3.26Å; Q117-I121 PolarHBondContact O-N 3.31Å; V118-I121 PolarHBondContact O-N 2.84Å; R119-I121 PolarHBondContact O-N 2.96Å; I121-A125 WeakPolarHBondContact O-CB 3.42Å; I121-A125 PolarHBondContact O-N 3.45Å; I121-K144 HydrophobicContact CG2-CD 4.31Å
122	G	68.5	Low	68.2	Low	2 Å²	2	101.2 Å²	101.2	2%	0.021	47%	0.471	C	S	.	.	H	α-helix	trans	-71.9	-38	177.4	0	0	0	0	0	114.2	V118 R119 K120 R126	V118-G122 PolarHBondContact O-N 2.94Å; R119-G122 PolarHBondContact O-N 2.8Å; R119-G122 VanDerWaalsContact O-N 3.11Å; K120-G122 VanDerWaalsContact C-N 3.29Å; K120-G122 PolarHBondContact O-N 2.87Å; G122-R126 PolarHBondContact O-N 2.87Å
123	E	72	Confident	66.5	Low	44 Å²	44	106 Å²	106	21%	0.206	49%	0.49	C	S	.	.	H	α-helix	trans	-70	-42.3	171.5	-79.1	-177.1	-152.3	0	0	112.8	R119 K120 A125 R126 R127	R119-E123 IonicContact CZ-OE1 3.88Å; R119-E123 IonicContact NH1-OE1 3.87Å; R119-E123 PolarHBondContact NH1-OE1 3.02Å; R119-E123 PolarHBondContact O-N 3.32Å; K120-E123 PolarHBondContact O-N 3.28Å; E123-A125 VanDerWaalsContact C-N 3.28Å; E123-A125 PolarHBondContact O-N 3.02Å; E123-R126 PolarHBondContact O-N 3.19Å; E123-R127 PolarHBondContact O-N 2.97Å; E123-R127 IonicContact OE2-CZ 3.09Å; E123-R127 IonicContact OE2-NH1 3.41Å; E123-R127 PolarHBondContact OE2-NH1 3.22Å; E123-R127 VanDerWaalsContact OE2-NH1 3.14Å; E123-R127 IonicContact OE2-NH2 2.72Å; E123-R127 PolarHBondContact OE2-NH2 3.47Å
124	E	70.4	Confident	64.8	Low	90 Å²	90	105.8 Å²	105.8	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-59	-40.8	175.9	-177.1	-172.6	-112.4	0	0	111.2	K120 R126 R127 Y128 K144	K120-E124 VanDerWaalsContact O-CB 3.26Å; K120-E124 WeakPolarHBondContact O-CB 3.2Å; K120-E124 PolarHBondContact O-N 3.43Å; E124-R126 VanDerWaalsContact C-N 3.27Å; E124-R126 PolarHBondContact O-N 3.27Å; E124-R127 PolarHBondContact O-N 3.31Å; E124-Y128 HydrophobicContact CG-CD2 4.44Å; E124-Y128 HydrophobicContact CG-CE2 4.49Å; E124-Y128 PolarHBondContact O-N 3.48Å; E124-K144 IonicContact OE2-NZ 2.6Å; E124-K144 PolarHBondContact OE2-NZ 3.25Å; E124-K144 VanDerWaalsContact OE2-NZ 3.12Å
125	A	64.1	Low	63.8	Low	15 Å²	15	110.5 Å²	110.5	12%	0.124	51%	0.513	C	S	.	.	H	α-helix	trans	-59.1	-36.3	173.1	0	0	0	0	0	113.1	I121 E123 H143 K144	I121-A125 WeakPolarHBondContact O-CB 3.42Å; I121-A125 PolarHBondContact O-N 3.45Å; E123-A125 VanDerWaalsContact C-N 3.28Å; E123-A125 PolarHBondContact O-N 3.02Å; A125-H143 HydrophobicContact CB-CB 4.14Å; A125-K144 HydrophobicContact CB-CD 4.4Å; A125-K144 HydrophobicContact CB-CG 3.62Å
126	R	60.6	Low	62.9	Low	165 Å²	165	108.2 Å²	108.2	62%	0.623	51%	0.51	S	S	*	.	H	α-helix	trans	-76.4	-33.7	176.7	-72	-171.2	-70.5	-178.7	1.9	113	G122 E123 E124 Y128 Q129	G122-R126 PolarHBondContact O-N 2.87Å; E123-R126 PolarHBondContact O-N 3.19Å; E124-R126 VanDerWaalsContact C-N 3.27Å; E124-R126 PolarHBondContact O-N 3.27Å; R126-Y128 PolarHBondContact O-N 3.38Å; R126-Q129 PolarHBondContact O-N 2.62Å
127	R	63	Low	62.5	Low	178 Å²	178	107.3 Å²	107.3	67%	0.672	51%	0.512	S	S	*	.	H	α-helix	trans	-67.4	-17.5	176.1	-68.9	-174.1	-175.2	94.8	9.5	113.8	E123 E124	E123-R127 PolarHBondContact O-N 2.97Å; E123-R127 IonicContact OE2-CZ 3.09Å; E123-R127 IonicContact OE2-NH1 3.41Å; E123-R127 PolarHBondContact OE2-NH1 3.22Å; E123-R127 VanDerWaalsContact OE2-NH1 3.14Å; E123-R127 IonicContact OE2-NH2 2.72Å; E123-R127 PolarHBondContact OE2-NH2 3.47Å; E124-R127 PolarHBondContact O-N 3.31Å
128	Y	58.3	Low	62.8	Low	203 Å²	203	104.5 Å²	104.5	80%	0.796	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-2.7	176.3	-86.4	-81.3	0	0	0	115	E124 R126	E124-Y128 HydrophobicContact CG-CD2 4.44Å; E124-Y128 HydrophobicContact CG-CE2 4.49Å; E124-Y128 PolarHBondContact O-N 3.48Å; R126-Y128 PolarHBondContact O-N 3.38Å
129	Q	48.2	Very low	63.4	Low	125 Å²	125	103.4 Å²	103.4	58%	0.584	50%	0.496	S	S	*	.	S	Bend	trans	-118	87.5	169.8	-69.5	-169.6	-2.7	0	0	108.6	R126	R126-Q129 PolarHBondContact O-N 2.62Å
130	G	47.6	Very low	63.7	Low	63 Å²	63	98.7 Å²	98.7	65%	0.649	49%	0.488	S	S	*	.			trans	-75	139.8	177.3	0	0	0	0	0	112.2	H132	G130-H132 VanDerWaalsContact C-N 3.28Å; G130-H132 PolarHBondContact O-N 2.92Å
131	E	41.9	Very low	64.1	Low	198 Å²	198	92.5 Å²	92.5	93%	0.925	46%	0.462	S	S	*	.	S	Bend	trans	48.6	34.5	153.6	-67.4	-82.9	75.8	0	0	117.2
132	H	50.3	Low	64.7	Low	157 Å²	157	90.7 Å²	90.7	73%	0.727	45%	0.454	S	S	*	.			trans	-121.6	126.5	168.9	-127.4	-98.3	0	0	0	111.8	G130 D134	G130-H132 VanDerWaalsContact C-N 3.28Å; G130-H132 PolarHBondContact O-N 2.92Å; H132-D134 VanDerWaalsContact C-N 3.27Å; H132-D134 IonicContact ND1-OD1 3.5Å; H132-D134 PolarHBondContact ND1-OD1 2.87Å; H132-D134 PolarHBondContact O-N 3.08Å
133	K	46.3	Very low	65.4	Low	195 Å²	195	93.5 Å²	93.5	85%	0.848	47%	0.467	S	S	*	.			trans	-79.3	74.5	-178.4	-66.9	179.4	-178.7	175	0	110.2	D135	K133-D135 PolarHBondContact O-N 3.27Å
134	D	48	Very low	65.9	Low	78 Å²	78	97.2 Å²	97.2	42%	0.417	48%	0.482	S	S	.	.			trans	-91.1	94.2	179.4	-69	-4.7	0	0	0	110.5	H132 A136 K146	H132-D134 VanDerWaalsContact C-N 3.27Å; H132-D134 IonicContact ND1-OD1 3.5Å; H132-D134 PolarHBondContact ND1-OD1 2.87Å; H132-D134 PolarHBondContact O-N 3.08Å; D134-A136 PolarHBondContact O-N 2.75Å; D134-K146 IonicContact OD2-NZ 3.42Å; D134-K146 PolarHBondContact OD2-NZ 3.24Å
135	D	56.7	Low	66.5	Low	162 Å²	162	95.2 Å²	95.2	87%	0.866	48%	0.476	S	S	*	.			trans	-64.8	6.5	174.8	-67.9	-63.3	0	0	0	114.3	K133	K133-D135 PolarHBondContact O-N 3.27Å
136	A	61.4	Low	67.3	Low	42 Å²	42	98.4 Å²	98.4	35%	0.347	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-71	120.2	179	0	0	0	0	0	111.8	D134 T138 K146	D134-A136 PolarHBondContact O-N 2.75Å; A136-T138 PolarHBondContact O-N 3.43Å; A136-K146 HydrophobicContact CB-CD 4.37Å; A136-K146 HydrophobicContact CB-CG 4.46Å
137	P	73.9	Confident	68.3	Low	64 Å²	64	90.8 Å²	90.8	42%	0.416	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-62.6	126.6	-177.4	23.3	-31.9	0	0	0	111.2	F147	P137-F147 HydrophobicContact CB-CD2 4.31Å; P137-F147 HydrophobicContact CG-CB 4.37Å; P137-F147 WeakPolarHBondContact O-CB 3.49Å; P137-F147 WeakPolarHBondContact O-CD2 3.42Å; P137-F147 PolarHBondContact O-N 3.19Å
138	T	82.9	Confident	68.5	Low	55 Å²	55	85.2 Å²	85.2	34%	0.337	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-101.8	156.5	179.8	44.3	0	0	0	0	113	A136 G140 T145 K146 F147	A136-T138 PolarHBondContact O-N 3.43Å; T138-G140 PolarHBondContact O-N 2.76Å; T138-G140 VanDerWaalsContact O-N 3.12Å; T138-T145 WeakPolarHBondContact CA-O 3.27Å; T138-K146 HydrophobicContact CG2-CB 4.37Å; T138-K146 HydrophobicContact CG2-CG 3.55Å; T138-F147 VanDerWaalsContact C-CE2 3.44Å; T138-F147 WeakPolarHBondContact O-CE2 3.47Å
139	C	88.4	Confident	68.6	Low	0 Å²	0	83.4 Å²	83.4	0%	0	45%	0.454	C	S	.	.			trans	-62.4	108.6	171	174.3	0	0	0	0	110.7	I141 C142 H143 T145 F147 C163 C166	C139-I141 PolarHBondContact O-N 3.18Å; C139-C142 PolarHBondContact SG-SG 3.04Å; C139-H143 VanDerWaalsContact O-CA 3.25Å; C139-H143 WeakPolarHBondContact O-CA 3.3Å; C139-H143 PolarHBondContact O-N 3.12Å; C139-T145 PolarHBondContact N-O 3.23Å; C139-F147 HydrophobicContact CB-CE1 4.36Å; C139-F147 HydrophobicContact CB-CE2 4.28Å; C139-F147 HydrophobicContact CB-CZ 3.72Å; C139-C163 HydrophobicContact CB-CB 4.12Å; C139-C163 PolarHBondContact SG-N 3.49Å; C139-C163 VanDerWaalsContact SG-SG 3.65Å; C139-C166 VanDerWaalsContact SG-SG 3.68Å
140	G	84.6	Confident	69.2	Low	32 Å²	32	79.3 Å²	79.3	33%	0.33	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	30.2	-177.9	0	0	0	0	0	115.5	T138 T160 K161	T138-G140 PolarHBondContact O-N 2.76Å; T138-G140 VanDerWaalsContact O-N 3.12Å; G140-T160 VanDerWaalsContact O-CG2 3.29Å; G140-T160 WeakPolarHBondContact O-CG2 3.4Å; G140-K161 PolarHBondContact N-O 2.88Å
141	I	85.5	Confident	70.3	Confident	14 Å²	14	80.3 Å²	80.3	7%	0.072	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-58.1	175.7	-64.6	-178	0	0	0	109.4	V118 C139 T160 F162 C166 C185 L187	V118-I141 HydrophobicContact CG1-CG2 3.86Å; V118-I141 VanDerWaalsContact CG1-O 3.26Å; V118-I141 WeakPolarHBondContact CG1-O 3.17Å; C139-I141 PolarHBondContact O-N 3.18Å; I141-T160 HydrophobicContact CG1-CG2 4.2Å; I141-F162 HydrophobicContact CD1-CB 3.85Å; I141-F162 HydrophobicContact CD1-CG 4.48Å; I141-F162 HydrophobicContact CG1-CB 4.4Å; I141-C166 HydrophobicContact CB-CB 3.94Å; I141-C166 HydrophobicContact CD1-CB 4.22Å; I141-C166 HydrophobicContact CG2-CB 3.88Å; I141-C185 HydrophobicContact CD1-CB 3.46Å; I141-C185 VanDerWaalsContact CD1-CB 3.46Å; I141-L187 HydrophobicContact CD1-CD1 4.03Å; I141-L187 HydrophobicContact CG1-CD1 4.28Å; I141-L187 HydrophobicContact CG2-CD1 3.79Å
142	C	86.7	Confident	72.2	Confident	23 Å²	23	71.4 Å²	71.4	16%	0.155	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-23.3	177.1	66.5	0	0	0	0	113.8	C139 K144	C139-C142 PolarHBondContact SG-SG 3.04Å; C142-K144 WeakPolarHBondContact O-CG 3.42Å; C142-K144 PolarHBondContact O-N 2.8Å
143	H	83.5	Confident	74	Confident	61 Å²	61	66.6 Å²	66.6	28%	0.282	38%	0.381	S	S	.	.	S	Bend	trans	53	-9.6	-167.6	-60.8	-91	0	0	0	116.3	A125 C139 T145	A125-H143 HydrophobicContact CB-CB 4.14Å; C139-H143 VanDerWaalsContact O-CA 3.25Å; C139-H143 WeakPolarHBondContact O-CA 3.3Å; C139-H143 PolarHBondContact O-N 3.12Å; H143-T145 VanDerWaalsContact C-N 3.32Å; H143-T145 PolarHBondContact O-N 2.85Å
144	K	81.9	Confident	76.1	Confident	122 Å²	122	62.5 Å²	62.5	53%	0.53	37%	0.368	S	S	.	.			trans	-83	3.3	178.8	-64.7	176.4	-175.8	-172.8	0	114	I121 E124 A125 C142	I121-K144 HydrophobicContact CG2-CD 4.31Å; E124-K144 IonicContact OE2-NZ 2.6Å; E124-K144 PolarHBondContact OE2-NZ 3.25Å; E124-K144 VanDerWaalsContact OE2-NZ 3.12Å; A125-K144 HydrophobicContact CB-CD 4.4Å; A125-K144 HydrophobicContact CB-CG 3.62Å; C142-K144 WeakPolarHBondContact O-CG 3.42Å; C142-K144 PolarHBondContact O-N 2.8Å
145	T	82.1	Confident	78.2	Confident	48 Å²	48	58.9 Å²	58.9	29%	0.294	35%	0.348	S	S	.	.			trans	-125.8	111.5	176.2	-52.7	0	0	0	0	109.3	T138 C139 H143 C163	T138-T145 WeakPolarHBondContact CA-O 3.27Å; C139-T145 PolarHBondContact N-O 3.23Å; H143-T145 VanDerWaalsContact C-N 3.32Å; H143-T145 PolarHBondContact O-N 2.85Å; T145-C163 HydrophobicContact CG2-CB 3.73Å
146	K	81.7	Confident	79.7	Confident	81 Å²	81	54.3 Å²	54.3	35%	0.352	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-76.3	142.9	163.9	-70.1	173.6	-179.1	172.5	0	108.6	D134 A136 T138	D134-K146 IonicContact OD2-NZ 3.42Å; D134-K146 PolarHBondContact OD2-NZ 3.24Å; A136-K146 HydrophobicContact CB-CD 4.37Å; A136-K146 HydrophobicContact CB-CG 4.46Å; T138-K146 HydrophobicContact CG2-CB 4.37Å; T138-K146 HydrophobicContact CG2-CG 3.55Å
147	F	80.6	Confident	81	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.026	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-99.3	122.7	170.4	-52.3	-63.9	0	0	0	108.3	P137 T138 C139 G152 K161 C163	P137-F147 HydrophobicContact CB-CD2 4.31Å; P137-F147 HydrophobicContact CG-CB 4.37Å; P137-F147 WeakPolarHBondContact O-CB 3.49Å; P137-F147 WeakPolarHBondContact O-CD2 3.42Å; P137-F147 PolarHBondContact O-N 3.19Å; T138-F147 VanDerWaalsContact C-CE2 3.44Å; T138-F147 WeakPolarHBondContact O-CE2 3.47Å; C139-F147 HydrophobicContact CB-CE1 4.36Å; C139-F147 HydrophobicContact CB-CE2 4.28Å; C139-F147 HydrophobicContact CB-CZ 3.72Å; F147-G152 VanDerWaalsContact CD1-CA 3.48Å; F147-K161 HydrophobicContact CD2-CD 4.12Å; F147-K161 HydrophobicContact CD2-CG 4.31Å; F147-K161 HydrophobicContact CE2-CB 4.17Å; F147-K161 HydrophobicContact CE2-CD 4.02Å; F147-K161 HydrophobicContact CE2-CG 3.71Å; F147-K161 HydrophobicContact CZ-CG 4.21Å; F147-C163 HydrophobicContact CE1-CB 3.77Å; F147-C163 HydrophobicContact CZ-CB 4.33Å
148	A	67.7	Low	81.8	Confident	60 Å²	60	57 Å²	57	50%	0.496	33%	0.331	S	S	.	.	S	Bend	trans	-68.8	144.8	156.8	0	0	0	0	0	108.8	G150 C151	A148-G150 VanDerWaalsContact C-N 3.27Å; A148-G150 PolarHBondContact O-N 3.04Å; A148-C151 WeakPolarHBondContact O-CB 3.03Å; A148-C151 PolarHBondContact O-N 2.59Å; A148-C151 PolarHBondContact O-SG 2.92Å
149	D	61.4	Low	82.1	Confident	166 Å²	166	60.7 Å²	60.7	89%	0.888	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.3	49.1	154.1	-39.7	-37	0	0	0	114.1	C151	D149-C151 PolarHBondContact O-N 3.48Å
150	G	60.7	Low	82	Confident	39 Å²	39	63 Å²	63	40%	0.402	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-7.3	174.8	0	0	0	0	0	117.4	A148 G152 K161	A148-G150 VanDerWaalsContact C-N 3.27Å; A148-G150 PolarHBondContact O-N 3.04Å; G150-G152 PolarHBondContact O-N 3.36Å; G150-K161 WeakPolarHBondContact O-CE 2.97Å; G150-K161 PolarHBondContact O-NZ 3.25Å
151	C	70.5	Confident	82.2	Confident	83 Å²	83	64.3 Å²	64.3	56%	0.561	35%	0.349	S	S	*	.			trans	-66.9	32.6	-162.5	74.5	0	0	0	0	119.5	A148 D149	A148-C151 WeakPolarHBondContact O-CB 3.03Å; A148-C151 PolarHBondContact O-N 2.59Å; A148-C151 PolarHBondContact O-SG 2.92Å; D149-C151 PolarHBondContact O-N 3.48Å
152	G	81.9	Confident	82.5	Confident	11 Å²	11	63.6 Å²	63.6	11%	0.113	35%	0.346	C	S	.	.			trans	-117	143.5	177.4	0	0	0	0	0	113.5	F147 G150 K161	F147-G152 VanDerWaalsContact CD1-CA 3.48Å; G150-G152 PolarHBondContact O-N 3.36Å; G152-K161 WeakPolarHBondContact O-CE 3.44Å
153	H	87.8	Confident	82.6	Confident	57 Å²	57	63 Å²	63	26%	0.264	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	133.2	-176.2	-51.1	-53.3	0	0	0	111.6	K161 F162 W183	H153-K161 CarbonylContact O-C 3.55Å; H153-K161 WeakPolarHBondContact O-CA 2.99Å; H153-F162 HydrophobicContact CB-CE1 4.42Å; H153-F162 HydrophobicContact CB-CE2 4.11Å; H153-F162 HydrophobicContact CB-CZ 4.06Å; H153-F162 PolarHBondContact N-O 3.03Å; H153-F162 WeakPolarHBondContact O-CD1 3.33Å; H153-F162 PolarHBondContact O-N 2.75Å; H153-W183 HydrophobicContact CB-CB 4.21Å; H153-W183 HydrophobicContact CB-CD2 3.67Å; H153-W183 HydrophobicContact CB-CE3 3.85Å; H153-W183 HydrophobicContact CB-CG 3.85Å; H153-W183 HydrophobicContact CB-CZ3 4.39Å; H153-W183 AromaticContact CD2-CD2 3.98Å; H153-W183 AromaticContact CD2-CE2 3.93Å; H153-W183 AromaticContact CD2-CE3 3.67Å; H153-W183 AromaticContact CD2-CH2 3.23Å; H153-W183 WeakPolarHBondContact CD2-CH2 3.07Å; H153-W183 AromaticContact CD2-CZ2 3.59Å; H153-W183 AromaticContact CD2-CZ3 3.29Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.31Å; H153-W183 AromaticContact CE1-CE2 3.97Å; H153-W183 AromaticContact CE1-CH2 3.72Å; H153-W183 AromaticContact CE1-CZ2 3.43Å; H153-W183 VanDerWaalsContact CE1-CZ2 3.43Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.09Å; H153-W183 AromaticContact CG-CD2 3.62Å; H153-W183 AromaticContact CG-CE2 3.58Å; H153-W183 AromaticContact CG-CE3 3.75Å; H153-W183 AromaticContact CG-CH2 3.78Å; H153-W183 AromaticContact CG-CZ2 3.67Å; H153-W183 AromaticContact CG-CZ3 3.83Å; H153-W183 AromaticContact ND1-CE2 3.6Å; H153-W183 AromaticContact ND1-CZ2 3.57Å; H153-W183 AromaticContact ND1-NE1 3.95Å; H153-W183 AromaticContact NE2-CH2 3.18Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.14Å; H153-W183 AromaticContact NE2-CZ2 3.43Å; H153-W183 WeakPolarHBondContact NE2-CZ2 3.45Å; H153-W183 AromaticContact NE2-CZ3 3.77Å
154	L	89.9	Confident	82.8	Confident	109 Å²	109	63.6 Å²	63.6	57%	0.571	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	136	175.6	-63.4	171.1	0	0	0	110.5	S156 R159 K161 W183	L154-S156 PolarHBondContact O-N 3.42Å; L154-R159 WeakPolarHBondContact CD2-O 3.14Å; L154-K161 HydrophobicContact CD2-CB 3.81Å; L154-K161 HydrophobicContact CD2-CD 4.37Å; L154-K161 HydrophobicContact CD2-CG 3.96Å; L154-W183 WeakPolarHBondContact O-CB 3.48Å
155	C	92.2	Very high	83	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.014	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-75.9	124.9	173.7	-174.5	0	0	0	0	112	Y157 C158 R159 T160 F162 W183 C185	C155-Y157 PolarHBondContact O-N 2.83Å; C155-C158 VanDerWaalsContact CB-SG 3.57Å; C155-R159 WeakPolarHBondContact O-CA 3.32Å; C155-R159 PolarHBondContact O-N 2.84Å; C155-T160 PolarHBondContact N-O 3.45Å; C155-F162 HydrophobicContact CB-CD1 4.05Å; C155-F162 HydrophobicContact CB-CE1 3.79Å; C155-W183 CarbonylContact C-O 3.52Å; C155-W183 WeakPolarHBondContact CA-O 3.49Å; C155-C185 HydrophobicContact CB-CB 4.03Å; C155-C185 PolarHBondContact SG-N 2.61Å
156	S	88.4	Confident	83.4	Confident	65 Å²	65	66.7 Å²	66.7	46%	0.455	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-15.7	178.3	-54.2	0	0	0	0	114.7	L154 W183	L154-S156 PolarHBondContact O-N 3.42Å; S156-W183 PolarHBondContact N-O 2.77Å; S156-W183 PolarHBondContact OG-O 3.06Å
157	Y	90	Very high	83.8	Confident	106 Å²	106	63.3 Å²	63.3	42%	0.416	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-67.2	174.5	-57.3	-60.4	0	0	0	112.2	C155 M182 V184 C188 Q192	C155-Y157 PolarHBondContact O-N 2.83Å; Y157-M182 HydrophobicContact CE1-CE 4Å; Y157-M182 HydrophobicContact CE2-CE 3.94Å; Y157-M182 VanDerWaalsContact CZ-CE 3.48Å; Y157-M182 VanDerWaalsContact OH-CE 3.31Å; Y157-M182 WeakPolarHBondContact OH-CE 3.22Å; Y157-V184 HydrophobicContact CD2-CG1 3.9Å; Y157-V184 HydrophobicContact CD2-CG2 4.23Å; Y157-V184 HydrophobicContact CE2-CB 4.49Å; Y157-V184 HydrophobicContact CE2-CG1 3.88Å; Y157-V184 HydrophobicContact CE2-CG2 3.74Å; Y157-C188 HydrophobicContact CD2-CB 3.97Å; Y157-C188 HydrophobicContact CG-CB 4.46Å; Y157-Q192 VanDerWaalsContact CE2-OE1 3.23Å; Y157-Q192 PolarHBondContact OH-NE2 2.62Å
158	C	90.1	Very high	84.1	Confident	57 Å²	57	63.8 Å²	63.8	39%	0.385	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-0.9	-174.6	68	0	0	0	0	115.4	C155 T160 C185 C188	C155-C158 VanDerWaalsContact CB-SG 3.57Å; C158-T160 PolarHBondContact O-N 3.43Å; C158-T160 PolarHBondContact SG-OG1 3.26Å; C158-C185 VanDerWaalsContact SG-SG 3.61Å; C158-C188 VanDerWaalsContact CB-SG 3.57Å; C158-C188 VanDerWaalsContact SG-SG 3.6Å
159	R	88.8	Confident	85.1	Confident	132 Å²	132	69.6 Å²	69.6	50%	0.498	37%	0.365	S	S	.	.			trans	58.9	-4.7	-179.1	-58.2	-175.7	179.2	-152.6	-5	117	L154 C155 K161	L154-R159 WeakPolarHBondContact CD2-O 3.14Å; C155-R159 WeakPolarHBondContact O-CA 3.32Å; C155-R159 PolarHBondContact O-N 2.84Å; R159-K161 PolarHBondContact O-N 3.42Å
160	T	86.7	Confident	86	Confident	49 Å²	49	64 Å²	64	30%	0.301	34%	0.337	S	S	.	.			trans	-53	132.3	171.2	-44.3	0	0	0	0	111.8	G140 I141 C155 C158	G140-T160 VanDerWaalsContact O-CG2 3.29Å; G140-T160 WeakPolarHBondContact O-CG2 3.4Å; I141-T160 HydrophobicContact CG1-CG2 4.2Å; C155-T160 PolarHBondContact N-O 3.45Å; C158-T160 PolarHBondContact O-N 3.43Å; C158-T160 PolarHBondContact SG-OG1 3.26Å
161	K	88.6	Confident	86.8	Confident	59 Å²	59	65.3 Å²	65.3	26%	0.257	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	122.2	174.2	-158	172	-175.1	169.6	0	110.1	G140 F147 G150 G152 H153 L154 R159	G140-K161 PolarHBondContact N-O 2.88Å; F147-K161 HydrophobicContact CD2-CD 4.12Å; F147-K161 HydrophobicContact CD2-CG 4.31Å; F147-K161 HydrophobicContact CE2-CB 4.17Å; F147-K161 HydrophobicContact CE2-CD 4.02Å; F147-K161 HydrophobicContact CE2-CG 3.71Å; F147-K161 HydrophobicContact CZ-CG 4.21Å; G150-K161 WeakPolarHBondContact O-CE 2.97Å; G150-K161 PolarHBondContact O-NZ 3.25Å; G152-K161 WeakPolarHBondContact O-CE 3.44Å; H153-K161 CarbonylContact O-C 3.55Å; H153-K161 WeakPolarHBondContact O-CA 2.99Å; L154-K161 HydrophobicContact CD2-CB 3.81Å; L154-K161 HydrophobicContact CD2-CD 4.37Å; L154-K161 HydrophobicContact CD2-CG 3.96Å; R159-K161 PolarHBondContact O-N 3.42Å
162	F	90.9	Very high	86.5	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.7	-172.8	69.8	-97.9	0	0	0	112.8	I141 H153 C155 C166 W183 C185	I141-F162 HydrophobicContact CD1-CB 3.85Å; I141-F162 HydrophobicContact CD1-CG 4.48Å; I141-F162 HydrophobicContact CG1-CB 4.4Å; H153-F162 HydrophobicContact CB-CE1 4.42Å; H153-F162 HydrophobicContact CB-CE2 4.11Å; H153-F162 HydrophobicContact CB-CZ 4.06Å; H153-F162 PolarHBondContact N-O 3.03Å; H153-F162 WeakPolarHBondContact O-CD1 3.33Å; H153-F162 PolarHBondContact O-N 2.75Å; C155-F162 HydrophobicContact CB-CD1 4.05Å; C155-F162 HydrophobicContact CB-CE1 3.79Å; F162-C166 HydrophobicContact CB-CB 4.05Å; F162-C166 HydrophobicContact CD2-CB 4.49Å; F162-W183 HydrophobicContact CE1-CB 4.4Å; F162-W183 AromaticContact CE2-CE3 3.99Å; F162-W183 HydrophobicContact CE2-CE3 3.99Å; F162-W183 HydrophobicContact CE2-CZ3 4.47Å; F162-W183 HydrophobicContact CZ-CB 4Å; F162-W183 AromaticContact CZ-CE3 3.92Å; F162-W183 HydrophobicContact CZ-CE3 3.92Å; F162-C185 HydrophobicContact CD1-CB 3.69Å; F162-C185 HydrophobicContact CE1-CB 3.91Å; F162-C185 HydrophobicContact CG-CB 4.19Å
163	C	89.6	Confident	85.1	Confident	11 Å²	11	74.9 Å²	74.9	7%	0.074	37%	0.367	C	S	.	.			trans	-80	157.7	175.6	71.5	0	0	0	0	111.4	C139 T145 F147 R165 C166	C139-C163 HydrophobicContact CB-CB 4.12Å; C139-C163 PolarHBondContact SG-N 3.49Å; C139-C163 VanDerWaalsContact SG-SG 3.65Å; T145-C163 HydrophobicContact CG2-CB 3.73Å; F147-C163 HydrophobicContact CE1-CB 3.77Å; F147-C163 HydrophobicContact CZ-CB 4.33Å; C163-R165 PolarHBondContact O-N 2.88Å; C163-C166 PolarHBondContact O-N 2.88Å; C163-C166 VanDerWaalsContact SG-SG 3.69Å
164	A	87.1	Confident	83.4	Confident	73 Å²	73	75.2 Å²	75.2	60%	0.603	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-3.1	-175.2	0	0	0	0	0	116.5
165	R	87.5	Confident	81.2	Confident	223 Å²	223	76.7 Å²	76.7	84%	0.842	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-21.4	168.9	-61.9	-176.2	-178.5	179.2	2.3	113.8	C163 N186	C163-R165 PolarHBondContact O-N 2.88Å; R165-N186 PolarHBondContact O-ND2 3.01Å
166	C	90.1	Very high	79.2	Confident	12 Å²	12	81.9 Å²	81.9	8%	0.081	41%	0.412	C	S	.	.	S	Bend	trans	-99.7	6.4	-173.7	-66.5	0	0	0	0	114.1	C139 I141 F162 C163 N186	C139-C166 VanDerWaalsContact SG-SG 3.68Å; I141-C166 HydrophobicContact CB-CB 3.94Å; I141-C166 HydrophobicContact CD1-CB 4.22Å; I141-C166 HydrophobicContact CG2-CB 3.88Å; F162-C166 HydrophobicContact CB-CB 4.05Å; F162-C166 HydrophobicContact CD2-CB 4.49Å; C163-C166 PolarHBondContact O-N 2.88Å; C163-C166 VanDerWaalsContact SG-SG 3.69Å; C166-N186 VanDerWaalsContact C-CG 3.48Å; C166-N186 VanDerWaalsContact C-ND2 3.34Å; C166-N186 PolarHBondContact O-N 2.88Å
167	G	89.5	Confident	77.5	Confident	10 Å²	10	88 Å²	88	10%	0.103	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-170.2	177.5	0	0	0	0	0	110.9	V184 N186	G167-V184 CarbonylContact C-O 3.56Å; G167-V184 WeakPolarHBondContact CA-O 3.36Å; G167-N186 WeakPolarHBondContact CA-OD1 3.27Å
168	G	88.1	Confident	75.9	Confident	15 Å²	15	89 Å²	89	16%	0.155	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	173.8	-179.4	0	0	0	0	0	114.4	W183 V184	G168-W183 VanDerWaalsContact C-CE3 3.42Å; G168-V184 PolarHBondContact N-O 3.26Å; G168-V184 PolarHBondContact O-N 3.14Å
169	R	87	Confident	74.4	Confident	183 Å²	183	94.5 Å²	94.5	69%	0.691	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	135.6	173.9	-62.2	-177.8	-151.3	-175.2	6	110.3	V181 W183	R169-V181 HydrophobicContact CB-CG1 3.67Å; R169-V181 HydrophobicContact CG-CG1 3.89Å; R169-W183 HydrophobicContact CG-CD2 3.85Å; R169-W183 HydrophobicContact CG-CE3 3.89Å; R169-W183 HydrophobicContact CG-CH2 3.5Å; R169-W183 VanDerWaalsContact CG-CH2 3.5Å; R169-W183 HydrophobicContact CG-CZ2 3.41Å; R169-W183 VanDerWaalsContact CG-CZ2 3.41Å; R169-W183 HydrophobicContact CG-CZ3 3.72Å
170	V	81.6	Confident	73.3	Confident	49 Å²	49	91.9 Å²	91.9	30%	0.297	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.9	168.7	179.9	0	0	0	0	106.4	M182 V184	V170-M182 HydrophobicContact CB-CG 3.9Å; V170-M182 HydrophobicContact CG1-CG 4.41Å; V170-M182 PolarHBondContact N-O 3.49Å; V170-M182 WeakPolarHBondContact O-CG 3.25Å; V170-M182 PolarHBondContact O-N 3.46Å; V170-V184 HydrophobicContact CB-CG2 4.21Å; V170-V184 HydrophobicContact CG2-CB 4.01Å; V170-V184 HydrophobicContact CG2-CG2 3.72Å
171	S	75.8	Confident	72.8	Confident	65 Å²	65	93.1 Å²	93.1	46%	0.455	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.5	173.8	173.9	0	0	0	0	108.7	V180	S171-V180 WeakPolarHBondContact CA-O 3.32Å
172	L	64.5	Low	72.8	Confident	91 Å²	91	91.6 Å²	91.6	48%	0.476	46%	0.463	S	S	.	.			trans	-78.1	130.8	166	-63.6	174.6	0	0	0	107.8	S174 V180 M182	L172-S174 PolarHBondContact O-N 2.84Å; L172-V180 PolarHBondContact N-O 3.07Å; L172-M182 HydrophobicContact CD1-SD 4.03Å; L172-M182 HydrophobicContact CD2-SD 4.13Å; L172-M182 HydrophobicContact CG-SD 4.05Å
173	R	54.2	Low	72.8	Confident	205 Å²	205	94.1 Å²	94.1	77%	0.774	47%	0.473	S	S	*	.			trans	-92.4	82.6	170.8	-76.2	-174.9	172.6	-174.1	-3.5	109
174	S	50.9	Low	72.9	Confident	64 Å²	64	93.7 Å²	93.7	45%	0.448	47%	0.47	S	S	.	.			trans	-58.2	149	154.9	-4.8	0	0	0	0	109.1	L172 D178	L172-S174 PolarHBondContact O-N 2.84Å; S174-D178 PolarHBondContact OG-O 3.19Å
175	N	43.7	Very low	73.2	Confident	139 Å²	139	90.3 Å²	90.3	74%	0.743	44%	0.441	S	S	*	.	S	Bend	trans	-77.1	144.1	158.5	-162.6	19.6	0	0	0	108.1
176	N	50.1	Low	73.4	Confident	112 Å²	112	82 Å²	82	60%	0.599	41%	0.414	S	S	*	.	S	Bend	trans	64.7	108.4	-169.2	-60.8	-29.8	0	0	0	116.4	D178	N176-D178 PolarHBondContact O-N 2.95Å
177	E	53.5	Low	73.3	Confident	194 Å²	194	83 Å²	83	91%	0.907	42%	0.418	S	S	*	.	S	Bend	trans	58.1	-50	150.9	-47	-154	107.5	0	0	120.2	K179	E177-K179 PolarHBondContact O-N 2.91Å
178	D	55.6	Low	73.4	Confident	127 Å²	127	83.1 Å²	83.1	68%	0.679	42%	0.417	S	S	*	.			trans	-81.9	103.8	-176.3	-88.9	-43.9	0	0	0	113.6	S174 N176 V180	S174-D178 PolarHBondContact OG-O 3.19Å; N176-D178 PolarHBondContact O-N 2.95Å; D178-V180 VanDerWaalsContact C-N 3.3Å; D178-V180 PolarHBondContact O-N 2.94Å
179	K	58.2	Low	73.4	Confident	171 Å²	171	88.8 Å²	88.8	74%	0.743	43%	0.434	S	S	*	.			trans	-79.4	71.7	173.4	-67.4	170.4	-172.6	148.1	0	111	E177 V181	E177-K179 PolarHBondContact O-N 2.91Å; K179-V181 WeakPolarHBondContact O-CG2 3.43Å; K179-V181 PolarHBondContact O-N 2.87Å; K179-V181 VanDerWaalsContact O-N 3.09Å
180	V	67.3	Low	73.4	Confident	78 Å²	78	82.7 Å²	82.7	47%	0.473	41%	0.413	S	S	.	.			trans	-58	116.4	177.6	-177.4	0	0	0	0	110.6	S171 L172 D178	S171-V180 WeakPolarHBondContact CA-O 3.32Å; L172-V180 PolarHBondContact N-O 3.07Å; D178-V180 VanDerWaalsContact C-N 3.3Å; D178-V180 PolarHBondContact O-N 2.94Å
181	V	76.3	Confident	73.5	Confident	75 Å²	75	84.8 Å²	84.8	46%	0.455	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.5	178	-179.5	0	0	0	0	110.2	R169 K179	R169-V181 HydrophobicContact CB-CG1 3.67Å; R169-V181 HydrophobicContact CG-CG1 3.89Å; K179-V181 WeakPolarHBondContact O-CG2 3.43Å; K179-V181 PolarHBondContact O-N 2.87Å; K179-V181 VanDerWaalsContact O-N 3.09Å
182	M	87.2	Confident	73.9	Confident	26 Å²	26	85.3 Å²	85.3	13%	0.128	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	148.6	175.1	68.7	-173.7	-55.5	0	0	111.5	Y157 V170 L172 V184	Y157-M182 HydrophobicContact CE1-CE 4Å; Y157-M182 HydrophobicContact CE2-CE 3.94Å; Y157-M182 VanDerWaalsContact CZ-CE 3.48Å; 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 3.49Å; V170-M182 WeakPolarHBondContact O-CG 3.25Å; V170-M182 PolarHBondContact O-N 3.46Å; L172-M182 HydrophobicContact CD1-SD 4.03Å; L172-M182 HydrophobicContact CD2-SD 4.13Å; L172-M182 HydrophobicContact CG-SD 4.05Å; M182-V184 HydrophobicContact CE-CG2 4.24Å; M182-V184 HydrophobicContact CG-CG2 4.11Å
183	W	90.4	Very high	74.8	Confident	54 Å²	54	85.5 Å²	85.5	21%	0.205	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.2	177.7	-80.1	100.5	0	0	0	110.6	H153 L154 C155 S156 F162 G168 R169	H153-W183 HydrophobicContact CB-CB 4.21Å; H153-W183 HydrophobicContact CB-CD2 3.67Å; H153-W183 HydrophobicContact CB-CE3 3.85Å; H153-W183 HydrophobicContact CB-CG 3.85Å; H153-W183 HydrophobicContact CB-CZ3 4.39Å; H153-W183 AromaticContact CD2-CD2 3.98Å; H153-W183 AromaticContact CD2-CE2 3.93Å; H153-W183 AromaticContact CD2-CE3 3.67Å; H153-W183 AromaticContact CD2-CH2 3.23Å; H153-W183 WeakPolarHBondContact CD2-CH2 3.07Å; H153-W183 AromaticContact CD2-CZ2 3.59Å; H153-W183 AromaticContact CD2-CZ3 3.29Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.31Å; H153-W183 AromaticContact CE1-CE2 3.97Å; H153-W183 AromaticContact CE1-CH2 3.72Å; H153-W183 AromaticContact CE1-CZ2 3.43Å; H153-W183 VanDerWaalsContact CE1-CZ2 3.43Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.09Å; H153-W183 AromaticContact CG-CD2 3.62Å; H153-W183 AromaticContact CG-CE2 3.58Å; H153-W183 AromaticContact CG-CE3 3.75Å; H153-W183 AromaticContact CG-CH2 3.78Å; H153-W183 AromaticContact CG-CZ2 3.67Å; H153-W183 AromaticContact CG-CZ3 3.83Å; H153-W183 AromaticContact ND1-CE2 3.6Å; H153-W183 AromaticContact ND1-CZ2 3.57Å; H153-W183 AromaticContact ND1-NE1 3.95Å; H153-W183 AromaticContact NE2-CH2 3.18Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.14Å; H153-W183 AromaticContact NE2-CZ2 3.43Å; H153-W183 WeakPolarHBondContact NE2-CZ2 3.45Å; H153-W183 AromaticContact NE2-CZ3 3.77Å; L154-W183 WeakPolarHBondContact O-CB 3.48Å; C155-W183 CarbonylContact C-O 3.52Å; C155-W183 WeakPolarHBondContact CA-O 3.49Å; S156-W183 PolarHBondContact N-O 2.77Å; S156-W183 PolarHBondContact OG-O 3.06Å; F162-W183 HydrophobicContact CE1-CB 4.4Å; F162-W183 AromaticContact CE2-CE3 3.99Å; F162-W183 HydrophobicContact CE2-CE3 3.99Å; F162-W183 HydrophobicContact CE2-CZ3 4.47Å; F162-W183 HydrophobicContact CZ-CB 4Å; F162-W183 AromaticContact CZ-CE3 3.92Å; F162-W183 HydrophobicContact CZ-CE3 3.92Å; G168-W183 VanDerWaalsContact C-CE3 3.42Å; R169-W183 HydrophobicContact CG-CD2 3.85Å; R169-W183 HydrophobicContact CG-CE3 3.89Å; R169-W183 HydrophobicContact CG-CH2 3.5Å; R169-W183 VanDerWaalsContact CG-CH2 3.5Å; R169-W183 HydrophobicContact CG-CZ2 3.41Å; R169-W183 VanDerWaalsContact CG-CZ2 3.41Å; R169-W183 HydrophobicContact CG-CZ3 3.72Å
184	V	92.6	Very high	75.9	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.012	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.5	-174.8	-175.1	0	0	0	0	110.4	Y157 G167 G168 V170 M182 C188 R189	Y157-V184 HydrophobicContact CD2-CG1 3.9Å; Y157-V184 HydrophobicContact CD2-CG2 4.23Å; Y157-V184 HydrophobicContact CE2-CB 4.49Å; Y157-V184 HydrophobicContact CE2-CG1 3.88Å; Y157-V184 HydrophobicContact CE2-CG2 3.74Å; G167-V184 CarbonylContact C-O 3.56Å; G167-V184 WeakPolarHBondContact CA-O 3.36Å; G168-V184 PolarHBondContact N-O 3.26Å; G168-V184 PolarHBondContact O-N 3.14Å; V170-V184 HydrophobicContact CB-CG2 4.21Å; V170-V184 HydrophobicContact CG2-CB 4.01Å; V170-V184 HydrophobicContact CG2-CG2 3.72Å; M182-V184 HydrophobicContact CE-CG2 4.24Å; M182-V184 HydrophobicContact CG-CG2 4.11Å; V184-C188 HydrophobicContact CG1-CB 4.32Å; V184-R189 HydrophobicContact CG1-CB 3.96Å
185	C	93.2	Very high	77.1	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.007	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	158.4	177.8	79.3	0	0	0	0	112.2	I141 C155 C158 F162 L187 C188 R189	I141-C185 HydrophobicContact CD1-CB 3.46Å; I141-C185 VanDerWaalsContact CD1-CB 3.46Å; C155-C185 HydrophobicContact CB-CB 4.03Å; C155-C185 PolarHBondContact SG-N 2.61Å; C158-C185 VanDerWaalsContact SG-SG 3.61Å; F162-C185 HydrophobicContact CD1-CB 3.69Å; F162-C185 HydrophobicContact CE1-CB 3.91Å; F162-C185 HydrophobicContact CG-CB 4.19Å; C185-L187 VanDerWaalsContact C-N 3.25Å; C185-L187 PolarHBondContact O-N 3.17Å; C185-C188 PolarHBondContact O-N 3.4Å; C185-C188 PolarHBondContact SG-N 2.86Å; C185-C188 VanDerWaalsContact SG-N 3.36Å; C185-C188 VanDerWaalsContact SG-SG 3.68Å; C185-R189 VanDerWaalsContact O-CB 3.26Å; C185-R189 WeakPolarHBondContact O-CB 3.4Å; C185-R189 PolarHBondContact O-N 2.87Å
186	N	91	Very high	78.7	Confident	49 Å²	49	74.5 Å²	74.5	26%	0.262	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-30	-177.2	-71.7	-18.1	0	0	0	113.1	R165 C166 G167 K190	R165-N186 PolarHBondContact O-ND2 3.01Å; C166-N186 VanDerWaalsContact C-CG 3.48Å; C166-N186 VanDerWaalsContact C-ND2 3.34Å; C166-N186 PolarHBondContact O-N 2.88Å; G167-N186 WeakPolarHBondContact CA-OD1 3.27Å; N186-K190 WeakPolarHBondContact O-CB 3.08Å; N186-K190 PolarHBondContact O-N 3.49Å
187	L	89.6	Confident	79.9	Confident	33 Å²	33	73.5 Å²	73.5	17%	0.173	36%	0.358	C	S	.	.	H	α-helix	trans	-70.1	-55.9	176.8	-73.2	86.1	0	0	0	111.2	Y114 K115 V118 I141 C185 R189 K190 Q191	Y114-L187 HydrophobicContact CE1-CG 4.29Å; K115-L187 HydrophobicContact CB-CD2 4.42Å; K115-L187 HydrophobicContact CG-CD2 4.33Å; V118-L187 HydrophobicContact CG1-CD1 4.27Å; V118-L187 HydrophobicContact CG2-CD1 4.41Å; I141-L187 HydrophobicContact CD1-CD1 4.03Å; I141-L187 HydrophobicContact CG1-CD1 4.28Å; I141-L187 HydrophobicContact CG2-CD1 3.79Å; C185-L187 VanDerWaalsContact C-N 3.25Å; C185-L187 PolarHBondContact O-N 3.17Å; L187-R189 VanDerWaalsContact C-N 3.27Å; L187-R189 PolarHBondContact O-N 2.98Å; L187-K190 PolarHBondContact O-N 3Å; L187-K190 VanDerWaalsContact O-N 3.11Å; L187-Q191 WeakPolarHBondContact O-CB 3.43Å; L187-Q191 PolarHBondContact O-N 3.33Å
188	C	90.4	Very high	81	Confident	12 Å²	12	65.7 Å²	65.7	8%	0.081	32%	0.324	C	S	.	.	H	α-helix	trans	-61.6	-35.7	177.9	-66.6	0	0	0	0	112.3	Y157 C158 V184 C185 Q191 Q192	Y157-C188 HydrophobicContact CD2-CB 3.97Å; Y157-C188 HydrophobicContact CG-CB 4.46Å; C158-C188 VanDerWaalsContact CB-SG 3.57Å; C158-C188 VanDerWaalsContact SG-SG 3.6Å; V184-C188 HydrophobicContact CG1-CB 4.32Å; C185-C188 PolarHBondContact O-N 3.4Å; C185-C188 PolarHBondContact SG-N 2.86Å; C185-C188 VanDerWaalsContact SG-N 3.36Å; C185-C188 VanDerWaalsContact SG-SG 3.68Å; C188-Q191 PolarHBondContact O-N 2.92Å; C188-Q192 WeakPolarHBondContact O-CG 3.39Å; C188-Q192 PolarHBondContact O-N 2.89Å
189	R	89.1	Confident	81.4	Confident	134 Å²	134	60.9 Å²	60.9	51%	0.506	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-44.9	173.6	-170.8	175.4	-178.1	168.4	3.1	111.9	V184 C185 L187 E193	V184-R189 HydrophobicContact CG1-CB 3.96Å; C185-R189 VanDerWaalsContact O-CB 3.26Å; C185-R189 WeakPolarHBondContact O-CB 3.4Å; C185-R189 PolarHBondContact O-N 2.87Å; L187-R189 VanDerWaalsContact C-N 3.27Å; L187-R189 PolarHBondContact O-N 2.98Å; R189-E193 WeakPolarHBondContact O-CB 3.5Å; R189-E193 PolarHBondContact O-N 2.87Å
190	K	85.9	Confident	81.8	Confident	56 Å²	56	54.3 Å²	54.3	24%	0.243	28%	0.283	C	S	.	.	H	α-helix	trans	-68.6	-37	176.4	-163.9	-177.5	-172.9	-170.7	0	111.7	Q110 F111 Y114 N186 L187 E193 I194	Q110-K190 PolarHBondContact O-NZ 2.84Å; F111-K190 HydrophobicContact CD2-CB 4.45Å; F111-K190 HydrophobicContact CD2-CD 4.25Å; F111-K190 HydrophobicContact CD2-CG 4.3Å; F111-K190 HydrophobicContact CE2-CB 4.33Å; Y114-K190 VanDerWaalsContact CB-NZ 3.33Å; Y114-K190 HydrophobicContact CD1-CD 3.75Å; Y114-K190 HydrophobicContact CE1-CD 4.19Å; Y114-K190 HydrophobicContact CG-CD 4.2Å; N186-K190 WeakPolarHBondContact O-CB 3.08Å; N186-K190 PolarHBondContact O-N 3.49Å; L187-K190 PolarHBondContact O-N 3Å; L187-K190 VanDerWaalsContact O-N 3.11Å; K190-E193 WeakPolarHBondContact O-CB 3.49Å; K190-E193 PolarHBondContact O-N 2.78Å; K190-I194 HydrophobicContact CG-CD1 4.22Å; K190-I194 WeakPolarHBondContact O-CD1 2.9Å; K190-I194 VanDerWaalsContact O-CG1 3.3Å; K190-I194 WeakPolarHBondContact O-CG1 3.28Å; K190-I194 PolarHBondContact O-N 3.13Å
191	Q	83.8	Confident	81.5	Confident	92 Å²	92	58.3 Å²	58.3	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-64.7	-45.8	176.9	-163.9	176.6	0.6	0	0	111.7	F111 L187 C188 E193 I194 L195	F111-Q191 HydrophobicContact CE1-CG 4.26Å; F111-Q191 HydrophobicContact CE2-CB 3.71Å; F111-Q191 HydrophobicContact CE2-CG 4.27Å; F111-Q191 HydrophobicContact CZ-CB 3.66Å; F111-Q191 HydrophobicContact CZ-CG 3.82Å; L187-Q191 WeakPolarHBondContact O-CB 3.43Å; L187-Q191 PolarHBondContact O-N 3.33Å; C188-Q191 PolarHBondContact O-N 2.92Å; Q191-E193 VanDerWaalsContact C-N 3.34Å; Q191-I194 PolarHBondContact O-N 3.47Å; Q191-L195 WeakPolarHBondContact O-CG 3.18Å; Q191-L195 PolarHBondContact O-N 3.3Å
192	Q	84.1	Confident	80.2	Confident	76 Å²	76	62 Å²	62	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-60.2	-43.8	171.1	-74.1	-174.8	-55.8	0	0	111.7	Y157 C188 I194 L195 T196	Y157-Q192 VanDerWaalsContact CE2-OE1 3.23Å; Y157-Q192 PolarHBondContact OH-NE2 2.62Å; C188-Q192 WeakPolarHBondContact O-CG 3.39Å; C188-Q192 PolarHBondContact O-N 2.89Å; Q192-I194 VanDerWaalsContact C-N 3.25Å; Q192-I194 PolarHBondContact O-N 3.08Å; Q192-L195 PolarHBondContact O-N 2.87Å; Q192-T196 WeakPolarHBondContact O-CB 3.43Å; Q192-T196 PolarHBondContact O-N 3.09Å; Q192-T196 PolarHBondContact O-OG1 3Å; Q192-T196 VanDerWaalsContact O-OG1 3.07Å
193	E	83.6	Confident	78.6	Confident	96 Å²	96	67.7 Å²	67.7	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-35.6	177.5	-166.4	-176.7	152.6	0	0	112.2	R189 K190 Q191 K197	R189-E193 WeakPolarHBondContact O-CB 3.5Å; R189-E193 PolarHBondContact O-N 2.87Å; K190-E193 WeakPolarHBondContact O-CB 3.49Å; K190-E193 PolarHBondContact O-N 2.78Å; Q191-E193 VanDerWaalsContact C-N 3.34Å; E193-K197 HydrophobicContact CG-CD 4.28Å; E193-K197 VanDerWaalsContact O-CB 3.27Å; E193-K197 WeakPolarHBondContact O-CB 3.22Å; E193-K197 WeakPolarHBondContact O-CD 3.23Å; E193-K197 WeakPolarHBondContact O-CG 3.29Å; E193-K197 PolarHBondContact O-N 2.87Å; E193-K197 VanDerWaalsContact OE1-CE 3.3Å; E193-K197 WeakPolarHBondContact OE1-CE 3.4Å; E193-K197 IonicContact OE1-NZ 3.14Å; E193-K197 PolarHBondContact OE1-NZ 3.4Å
194	I	78.4	Confident	76.1	Confident	10 Å²	10	67.7 Å²	67.7	5%	0.051	34%	0.341	C	S	.	.	H	α-helix	trans	-73.3	-44.4	174.9	-67.9	157.5	0	0	0	111.5	L107 F111 K190 Q191 Q192 T196 K197 S198	L107-I194 HydrophobicContact CB-CG2 4.36Å; F111-I194 HydrophobicContact CB-CD1 3.57Å; F111-I194 HydrophobicContact CD2-CD1 3.56Å; F111-I194 HydrophobicContact CG-CD1 3.8Å; K190-I194 HydrophobicContact CG-CD1 4.22Å; K190-I194 WeakPolarHBondContact O-CD1 2.9Å; K190-I194 VanDerWaalsContact O-CG1 3.3Å; K190-I194 WeakPolarHBondContact O-CG1 3.28Å; K190-I194 PolarHBondContact O-N 3.13Å; Q191-I194 PolarHBondContact O-N 3.47Å; Q192-I194 VanDerWaalsContact C-N 3.25Å; Q192-I194 PolarHBondContact O-N 3.08Å; I194-T196 VanDerWaalsContact C-N 3.35Å; I194-T196 PolarHBondContact O-N 2.86Å; I194-K197 PolarHBondContact O-N 3.05Å; I194-S198 VanDerWaalsContact O-CB 3.29Å; I194-S198 WeakPolarHBondContact O-CB 3.47Å; I194-S198 PolarHBondContact O-N 2.81Å; I194-S198 PolarHBondContact O-OG 2.83Å
195	L	75.1	Confident	73.3	Confident	68 Å²	68	73.9 Å²	73.9	36%	0.356	38%	0.384	S	S	.	.	H	α-helix	trans	-56.8	-49.3	174.8	-72.7	169.9	0	0	0	110.5	Q191 Q192 K197 S198 G199 A200	Q191-L195 WeakPolarHBondContact O-CG 3.18Å; Q191-L195 PolarHBondContact O-N 3.3Å; Q192-L195 PolarHBondContact O-N 2.87Å; L195-K197 PolarHBondContact O-N 3.44Å; L195-S198 PolarHBondContact O-N 2.96Å; L195-S198 PolarHBondContact O-OG 3Å; L195-S198 VanDerWaalsContact O-OG 3.13Å; L195-G199 PolarHBondContact O-N 2.64Å; L195-A200 HydrophobicContact CD2-CB 4.2Å
196	T	76.9	Confident	70.4	Confident	98 Å²	98	76.3 Å²	76.3	60%	0.601	41%	0.409	S	S	*	.	H	α-helix	trans	-61.2	-39.6	175.7	-55.4	0	0	0	0	112.8	Q192 I194	Q192-T196 WeakPolarHBondContact O-CB 3.43Å; Q192-T196 PolarHBondContact O-N 3.09Å; Q192-T196 PolarHBondContact O-OG1 3Å; Q192-T196 VanDerWaalsContact O-OG1 3.07Å; I194-T196 VanDerWaalsContact C-N 3.35Å; I194-T196 PolarHBondContact O-N 2.86Å
197	K	75	Confident	67.9	Low	92 Å²	92	80.5 Å²	80.5	40%	0.4	44%	0.439	S	S	.	.	H	α-helix	trans	-73.5	-28.3	179.1	-80.5	173.3	-177.9	172.9	0	114.8	L107 E193 I194 L195 I1209	L107-K197 HydrophobicContact CD1-CB 4.16Å; L107-K197 HydrophobicContact CD1-CD 4.48Å; E193-K197 HydrophobicContact CG-CD 4.28Å; E193-K197 VanDerWaalsContact O-CB 3.27Å; E193-K197 WeakPolarHBondContact O-CB 3.22Å; E193-K197 WeakPolarHBondContact O-CD 3.23Å; E193-K197 WeakPolarHBondContact O-CG 3.29Å; E193-K197 PolarHBondContact O-N 2.87Å; E193-K197 VanDerWaalsContact OE1-CE 3.3Å; E193-K197 WeakPolarHBondContact OE1-CE 3.4Å; E193-K197 IonicContact OE1-NZ 3.14Å; E193-K197 PolarHBondContact OE1-NZ 3.4Å; I194-K197 PolarHBondContact O-N 3.05Å; L195-K197 PolarHBondContact O-N 3.44Å; K197-I1209 HydrophobicContact CD-CD1 4.29Å; K197-I1209 HydrophobicContact CG-CD1 3.89Å
198	S	77.3	Confident	65.1	Low	29 Å²	29	88.2 Å²	88.2	20%	0.203	48%	0.475	C	S	.	.	H	α-helix	trans	-92	-10.1	-175.6	55	0	0	0	0	113.6	N104 I194 L195 A200	N104-S198 WeakPolarHBondContact OD1-CB 3.26Å; I194-S198 VanDerWaalsContact O-CB 3.29Å; I194-S198 WeakPolarHBondContact O-CB 3.47Å; I194-S198 PolarHBondContact O-N 2.81Å; I194-S198 PolarHBondContact O-OG 2.83Å; L195-S198 PolarHBondContact O-N 2.96Å; L195-S198 PolarHBondContact O-OG 3Å; L195-S198 VanDerWaalsContact O-OG 3.13Å; S198-A200 PolarHBondContact O-N 3.34Å; S198-A200 VanDerWaalsContact O-N 3.12Å; S198-A200 WeakPolarHBondContact OG-CB 3.43Å; S198-A200 PolarHBondContact OG-N 3Å
199	G	64.9	Low	62.3	Low	26 Å²	26	96.2 Å²	96.2	27%	0.268	51%	0.511	S	S	.	.	S	Bend	trans	70	-4.1	-170.9	0	0	0	0	0	114.1	L195 W201 F202	L195-G199 PolarHBondContact O-N 2.64Å; G199-W201 PolarHBondContact O-N 3.33Å; G199-F202 VanDerWaalsContact O-CB 3.27Å; G199-F202 WeakPolarHBondContact O-CB 3.41Å; G199-F202 PolarHBondContact O-N 3.42Å
200	A	65.5	Low	59.7	Low	34 Å²	34	95.8 Å²	95.8	28%	0.281	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.9	-175.4	0	0	0	0	0	114.1	L195 S198 F202 G204	L195-A200 HydrophobicContact CD2-CB 4.2Å; S198-A200 PolarHBondContact O-N 3.34Å; S198-A200 VanDerWaalsContact O-N 3.12Å; S198-A200 WeakPolarHBondContact OG-CB 3.43Å; S198-A200 PolarHBondContact OG-N 3Å; A200-F202 PolarHBondContact O-N 2.66Å; A200-G204 WeakPolarHBondContact O-CA 3.31Å; A200-G204 PolarHBondContact O-N 3.35Å
201	W	61.5	Low	57	Low	162 Å²	162	97.8 Å²	97.8	61%	0.614	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.5	171	71.3	-82.7	0	0	0	113.8	G199	G199-W201 PolarHBondContact O-N 3.33Å
202	F	48.8	Very low	54.7	Low	151 Å²	151	102.6 Å²	102.6	66%	0.662	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-35.6	178.9	-151.8	-90.7	0	0	0	111.8	G199 A200	G199-F202 VanDerWaalsContact O-CB 3.27Å; G199-F202 WeakPolarHBondContact O-CB 3.41Å; G199-F202 PolarHBondContact O-N 3.42Å; A200-F202 PolarHBondContact O-N 2.66Å
203	F	54.2	Low	52.3	Low	146 Å²	146	106.8 Å²	106.8	64%	0.64	59%	0.594	S	S	*	*	S	Bend	trans	-93.2	1.2	175.3	-58.2	-79.8	0	0	0	113.2	M61 S205	M61-F203 HydrophobicContact CE-CE1 4.26Å; M61-F203 HydrophobicContact CE-CE2 4.47Å; M61-F203 HydrophobicContact CE-CZ 3.97Å; F203-S205 PolarHBondContact O-N 3.43Å
204	G	38.2	Very low	49.9	Very low	55 Å²	55	105.5 Å²	105.5	57%	0.567	61%	0.606	S	S	*	*			trans	-73.7	34.6	-165.8	0	0	0	0	0	117	A200 G206	A200-G204 WeakPolarHBondContact O-CA 3.31Å; A200-G204 PolarHBondContact O-N 3.35Å; G204-G206 VanDerWaalsContact C-N 3.3Å; G204-G206 PolarHBondContact O-N 2.76Å
205	S	33.3	Very low	47.9	Very low	131 Å²	131	111.3 Å²	111.3	92%	0.916	64%	0.642	S	S	*	*	S	Bend	trans	-93.9	38.2	176.5	-63.9	0	0	0	0	112.6	F203	F203-S205 PolarHBondContact O-N 3.43Å
206	G	32.8	Very low	46.1	Very low	52 Å²	52	115.7 Å²	115.7	54%	0.536	67%	0.665	S	S	.	*	S	Bend	trans	151.1	149	177.6	0	0	0	0	0	112.7	G204 Q208	G204-G206 VanDerWaalsContact C-N 3.3Å; G204-G206 PolarHBondContact O-N 2.76Å; G206-Q208 PolarHBondContact O-N 2.82Å
207	P	36.7	Very low	44.2	Very low	137 Å²	137	115.4 Å²	115.4	89%	0.89	67%	0.667	S	S	*	*			trans	-86.1	105.9	175.1	32.7	-30.8	0	0	0	110.9
208	Q	32.5	Very low	42.3	Very low	196 Å²	196	117.7 Å²	117.7	92%	0.916	68%	0.684	S	S	*	*			trans	-86.4	116	174	-162.1	173.3	15.4	0	0	110.2	G206	G206-Q208 PolarHBondContact O-N 2.82Å
209	Q	31	Very low	40.4	Very low	180 Å²	180	122.8 Å²	122.8	84%	0.841	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-78.2	149.9	166.4	-75.4	-167.8	-100.6	0	0	110.5
210	P	34.4	Very low	39	Very low	124 Å²	124	125.6 Å²	125.6	81%	0.805	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-70	153.8	174.3	30.4	-35.2	0	0	0	112
211	S	29.4	Very low	37.6	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-76.6	153.3	-172.9	51.2	0	0	0	0	115.1
212	Q	35.6	Very low	36.3	Very low	193 Å²	193	126.2 Å²	126.2	90%	0.902	77%	0.767	S	S	*	*			trans	-133.2	149.3	143.1	-72.2	-167.2	-19.9	0	0	109
213	D	32.3	Very low	35.7	Very low	165 Å²	165	124.3 Å²	124.3	88%	0.882	78%	0.779	S	S	*	*			trans	-82.1	159.3	-168.3	-46.9	-94.1	0	0	0	113.3
214	G	34.5	Very low	34.8	Very low	69 Å²	69	121 Å²	121	71%	0.711	79%	0.786	S	S	*	*			trans	161.9	66.1	172.4	0	0	0	0	0	118.8
215	T	36.5	Very low	34.7	Very low	131 Å²	131	123.2 Å²	123.2	80%	0.804	79%	0.793	S	S	*	*			trans	29.9	131.3	136.9	48	0	0	0	0	123
216	L	37.6	Very low	34.6	Very low	160 Å²	160	122.8 Å²	122.8	84%	0.838	78%	0.776	S	S	*	*			trans	94.6	99	146.9	-64.4	159.7	0	0	0	121.6
217	S	35.3	Very low	34.8	Very low	93 Å²	93	124 Å²	124	65%	0.65	77%	0.773	S	S	*	*				56.6	114.7	117.1	-77	0	0	0	0	125.1
218	D	35.6	Very low	34.9	Very low	139 Å²	139	121.6 Å²	121.6	74%	0.743	76%	0.757	S	S	*	*				71.7	116.9	119	-54.2	-46.5	0	0	0	123.7
219	T	37.8	Very low	35.1	Very low	136 Å²	136	118.2 Å²	118.2	83%	0.834	74%	0.736	S	S	*	*				142.2	131.1	116	-52.1	0	0	0	0	116.1
220	A	35.5	Very low	35.3	Very low	86 Å²	86	114 Å²	114	71%	0.711	72%	0.717	S	S	*	*			trans	65.4	161.6	156.7	0	0	0	0	0	122.1
221	T	36.3	Very low	35.5	Very low	139 Å²	139	115.4 Å²	115.4	85%	0.853	71%	0.71	S	S	*	*			cis	-170.6	136.9	-32	-82.6	0	0	0	0	111.4
222	G	34.3	Very low	35.9	Very low	70 Å²	70	119.1 Å²	119.1	72%	0.722	71%	0.714	S	S	*	*			trans	101.8	136.7	141.3	0	0	0	0	0	123.2
223	A	35.6	Very low	35.7	Very low	111 Å²	111	113.5 Å²	113.5	92%	0.917	70%	0.7	S	S	*	*			trans	54.2	166.9	159.2	0	0	0	0	0	120.4
224	G	35.1	Very low	35.9	Very low	75 Å²	75	116.3 Å²	116.3	77%	0.773	70%	0.698	S	S	*	*			cis	126.7	143.7	-9.1	0	0	0	0	0	114.3
225	S	35.6	Very low	36	Very low	103 Å²	103	120 Å²	120	72%	0.72	70%	0.701	S	S	*	*			cis	-171.9	-170.3	-14.4	-167.8	0	0	0	0	111.1
226	E	33	Very low	36	Very low	122 Å²	122	121.4 Å²	121.4	57%	0.57	70%	0.698	S	S	*	*			trans	84.1	41.2	154	-47	-50.5	119.8	0	0	126.7	K395	E226-K395 PolarHBondContact O-NZ 2.84Å
227	V	35.5	Very low	35.8	Very low	77 Å²	77	120.3 Å²	120.3	47%	0.467	69%	0.689	S	S	.	*				49.5	102.8	113.7	175.9	0	0	0	0	120.5	E394 K395	V227-E394 VanDerWaalsContact CA-OE1 3.24Å; V227-E394 WeakPolarHBondContact CA-OE1 3.37Å; V227-E394 HydrophobicContact CB-CG 4.05Å; V227-E394 HydrophobicContact CG1-CB 4.24Å; V227-E394 HydrophobicContact CG1-CG 3.27Å; V227-K395 HydrophobicContact CB-CG 4.21Å; V227-K395 HydrophobicContact CG1-CB 3.81Å; V227-K395 HydrophobicContact CG1-CG 3.64Å; V227-K395 WeakPolarHBondContact O-CE 3.11Å; V227-K395 WeakPolarHBondContact O-CG 3.46Å; V227-K395 PolarHBondContact O-NZ 3.21Å
228	P	39.6	Very low	35.8	Very low	86 Å²	86	125.2 Å²	125.2	56%	0.558	69%	0.693	S	S	*	*			trans	-160.6	174	154.3	39.7	-21.3	0	0	0	119.2	S393	P228-S393 PolarHBondContact O-OG 3.34Å
229	R	36.8	Very low	35.8	Very low	126 Å²	126	123 Å²	123	48%	0.475	69%	0.689	S	S	.	*				-147.1	154.9	-59.9	179.3	165.5	-169	167.4	10.8	114.4	S393 E394 K395 G396	R229-S393 WeakPolarHBondContact CA-OG 3.34Å; R229-S393 PolarHBondContact N-OG 2.81Å; R229-E394 VanDerWaalsContact CA-CA 3.49Å; R229-E394 WeakPolarHBondContact CG-O 3.27Å; R229-K395 VanDerWaalsContact CD-O 3.29Å; R229-K395 WeakPolarHBondContact CD-O 3.28Å; R229-G396 PolarHBondContact NH1-O 2.83Å
230	E	34.3	Very low	35.8	Very low	91 Å²	91	126.8 Å²	126.8	43%	0.425	69%	0.688	S	S	.	*			trans	-17.2	143.3	166.6	-58.5	178.3	93.4	0	0	117.2	S393	E230-S393 WeakPolarHBondContact CA-O 3.3Å; E230-S393 WeakPolarHBondContact CG-O 3.47Å; E230-S393 PolarHBondContact N-O 3.28Å
231	K	39.3	Very low	35.9	Very low	154 Å²	154	128 Å²	128	67%	0.67	69%	0.691	S	S	*	*				-179	151.7	55.3	-145.5	165.2	-166.5	160.7	0	113.1
232	K	37.1	Very low	35.7	Very low	176 Å²	176	130.3 Å²	130.3	77%	0.765	69%	0.692	S	S	*	*			trans	49.4	113.1	151.1	-83.5	-176.1	174.4	-174.1	0	123.2
233	A	33.1	Very low	35.7	Very low	74 Å²	74	133.3 Å²	133.3	61%	0.612	70%	0.696	S	S	*	*				73.5	158.1	114.3	0	0	0	0	0	124.1
234	R	35.4	Very low	35.5	Very low	225 Å²	225	133 Å²	133	85%	0.849	69%	0.685	S	S	*	*			trans	87.1	102.2	169.1	-96.1	-165.5	163.6	-157.6	-2.6	119.8
235	L	35.7	Very low	35.2	Very low	145 Å²	145	136.7 Å²	136.7	76%	0.759	69%	0.686	S	S	*	*				68.8	151.7	126.8	-66.4	171.5	0	0	0	122.4
236	Q	37.5	Very low	34.9	Very low	161 Å²	161	136.8 Å²	136.8	75%	0.752	69%	0.687	S	S	*	*			trans	84	87.6	146.5	-148.9	154.7	19.7	0	0	121.1
237	E	33.4	Very low	34.8	Very low	137 Å²	137	137.3 Å²	137.3	64%	0.64	70%	0.699	S	S	*	*				57	136.2	119	-69	-162.4	98.9	0	0	124.8
238	R	35.5	Very low	34.7	Very low	197 Å²	197	138 Å²	138	74%	0.743	71%	0.713	S	S	*	*			trans	75.2	116.6	134.9	-76	169.5	82.3	176.4	9.3	120.6
239	S	35.9	Very low	34.5	Very low	92 Å²	92	137.9 Å²	137.9	64%	0.643	72%	0.719	S	S	*	*			trans	78.5	157.1	135.4	-51.8	0	0	0	0	116.3
240	R	37.4	Very low	34.4	Very low	216 Å²	216	138.9 Å²	138.9	82%	0.815	74%	0.739	S	S	*	*			cis	-156.4	169	-4	-132.3	165.9	-173.2	159	-3.1	110.1
241	S	37.4	Very low	34.5	Very low	111 Å²	111	139 Å²	139	78%	0.776	75%	0.749	S	S	*	*			trans	-67.2	136.1	151.3	42.5	0	0	0	0	110
242	Q	32.8	Very low	34.4	Very low	187 Å²	187	135.9 Å²	135.9	87%	0.874	75%	0.747	S	S	*	*			trans	-110.8	112.5	172.9	-86.7	-172.1	-14.8	0	0	112.1
243	T	33.9	Very low	34.4	Very low	133 Å²	133	135.1 Å²	135.1	82%	0.816	75%	0.746	S	S	*	*				-114.9	152.4	126.4	17.3	0	0	0	0	105.6
244	P	31.4	Very low	34.4	Very low	105 Å²	105	136.9 Å²	136.9	68%	0.682	75%	0.745	S	S	*	*	S	Bend	cis	-100.7	176.8	23.7	2.6	20.1	0	0	0	115.5
245	L	29.8	Very low	34.5	Very low	153 Å²	153	132.2 Å²	132.2	80%	0.801	74%	0.742	S	S	*	*			trans	15.4	133.2	149.9	-70.9	80	0	0	0	120.3
246	S	28.2	Very low	34.6	Very low	105 Å²	105	128.9 Å²	128.9	73%	0.734	74%	0.735	S	S	*	*			trans	57.6	138.5	138.1	-45.9	0	0	0	0	118.8
247	T	30.9	Very low	34.5	Very low	133 Å²	133	125.4 Å²	125.4	82%	0.816	73%	0.728	S	S	*	*			cis	-157.5	-178.7	19.1	-29.7	0	0	0	0	109.1
248	A	33.8	Very low	34.6	Very low	92 Å²	92	127.2 Å²	127.2	76%	0.76	74%	0.737	S	S	*	*			trans	8.3	145.5	151.5	0	0	0	0	0	121.2
249	A	34.5	Very low	34.5	Very low	83 Å²	83	121 Å²	121	69%	0.686	73%	0.734	S	S	*	*			cis	-176.2	176.5	-8.5	0	0	0	0	0	109.3
250	V	35.7	Very low	34.5	Very low	147 Å²	147	121.3 Å²	121.3	89%	0.891	74%	0.742	S	S	*	*			trans	67	128.7	162.3	-179.3	0	0	0	0	115.6
251	S	35.2	Very low	34.5	Very low	92 Å²	92	116 Å²	116	64%	0.643	74%	0.735	S	S	*	*			cis	-143.4	146.9	-7.5	80.6	0	0	0	0	108.9
252	S	37.6	Very low	34.3	Very low	90 Å²	90	117.8 Å²	117.8	63%	0.629	74%	0.735	S	S	*	*				59.1	135.4	94.3	-52.1	0	0	0	0	114.6
253	Q	36.5	Very low	34.2	Very low	160 Å²	160	114.4 Å²	114.4	75%	0.748	72%	0.723	S	S	*	*			cis	-170.5	166.5	6.6	-112.9	173.2	-72.9	0	0	107.1
254	D	34.6	Very low	34.2	Very low	111 Å²	111	117.2 Å²	117.2	59%	0.594	72%	0.719	S	S	*	*			cis	-161.3	160.4	-5.2	-140.2	-21.3	0	0	0	110.9
255	T	37.9	Very low	34.3	Very low	127 Å²	127	118.7 Å²	118.7	78%	0.779	72%	0.721	S	S	*	*			trans	53.4	161	155.5	57.4	0	0	0	0	120.7
256	A	36.2	Very low	34.3	Very low	74 Å²	74	121 Å²	121	61%	0.612	73%	0.725	S	S	*	*			cis	-158.1	131.9	-25	0	0	0	0	0	104.7
257	S	35.2	Very low	34.4	Very low	88 Å²	88	119.4 Å²	119.4	62%	0.615	73%	0.725	S	S	*	*				52.8	140.7	73.3	71.8	0	0	0	0	113.7
258	H	35.4	Very low	34.6	Very low	176 Å²	176	118 Å²	118	82%	0.815	73%	0.727	S	S	*	*			cis	-129.5	155.4	18.5	-60.8	-101.2	0	0	0	110.8
259	G	35.3	Very low	34.1	Very low	66 Å²	66	122.1 Å²	122.1	68%	0.68	73%	0.731	S	S	*	*				102	121.6	87	0	0	0	0	0	109.2
260	A	35.1	Very low	34.2	Very low	98 Å²	98	122.3 Å²	122.3	81%	0.81	73%	0.725	S	S	*	*			cis	60	153.3	23.4	0	0	0	0	0	113.2
261	P	37.8	Very low	33.9	Very low	104 Å²	104	119.7 Å²	119.7	68%	0.675	71%	0.713	S	S	*	*			cis	-139.4	-158.4	10.8	32.3	-6.9	0	0	0	113.7
262	L	33.4	Very low	33.7	Very low	149 Å²	149	122.1 Å²	122.1	78%	0.78	71%	0.714	S	S	*	*			trans	71.8	159.9	155.1	-60.6	157.6	0	0	0	119.4
263	D	30.2	Very low	33.4	Very low	117 Å²	117	126 Å²	126	63%	0.626	72%	0.722	S	S	*	*			cis	-169.3	-177.3	-44.9	-151.5	-14.7	0	0	0	109.7
264	R	34.1	Very low	33.2	Very low	192 Å²	192	122.2 Å²	122.2	73%	0.725	72%	0.719	S	S	*	*			trans	58.5	114.1	138.3	-82.6	164.5	175	-138.9	-6.3	120.9
265	N	33.7	Very low	33.4	Very low	136 Å²	136	125.1 Å²	125.1	73%	0.727	73%	0.733	S	S	*	*				71.8	117.3	116.3	-75.5	-12.5	0	0	0	122.2
266	K	29.7	Very low	33.2	Very low	200 Å²	200	122.4 Å²	122.4	87%	0.87	73%	0.73	S	S	*	*				67.1	71.4	108	-157.6	-172.3	178.9	-177	0	118.5
267	G	30	Very low	33.5	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	74%	0.738	S	S	*	*			trans	83.3	-171.2	135.6	0	0	0	0	0	117.9
268	A	33.8	Very low	33.3	Very low	105 Å²	105	127.9 Å²	127.9	87%	0.868	74%	0.744	S	S	*	*			trans	68.8	125.9	-177.4	0	0	0	0	0	117.9
269	E	24.8	Very low	33.4	Very low	178 Å²	178	126.2 Å²	126.2	83%	0.832	74%	0.736	S	S	*	*			trans	-40.2	174.7	139	-89.3	-147	121.4	0	0	115.4
270	P	36.3	Very low	33.4	Very low	87 Å²	87	130.7 Å²	130.7	57%	0.565	74%	0.737	S	S	*	*			cis	-139	-167.2	-26.1	35.2	-16.6	0	0	0	112.3
271	S	28.6	Very low	33.5	Very low	91 Å²	91	133.9 Å²	133.9	64%	0.636	74%	0.735	S	S	*	*			trans	69.6	165.6	147.6	-72.4	0	0	0	0	116.5
272	Q	30.7	Very low	33.3	Very low	143 Å²	143	133 Å²	133	67%	0.668	74%	0.737	S	S	*	*			cis	-161.7	169.6	-15.3	-118.1	171.1	63.2	0	0	110.3
273	Q	32.5	Very low	33.4	Very low	171 Å²	171	131.1 Å²	131.1	80%	0.799	74%	0.736	S	S	*	*			trans	64.5	162.6	156.6	-67.1	158.4	38	0	0	116.6
274	A	32.7	Very low	33.5	Very low	82 Å²	82	136.5 Å²	136.5	68%	0.678	75%	0.748	S	S	*	*			cis	-157.8	157.4	-35.8	0	0	0	0	0	104.9
275	L	38.1	Very low	33.4	Very low	172 Å²	172	132.7 Å²	132.7	90%	0.901	75%	0.75	S	S	*	*			cis	-148.7	162.1	39.7	-63.2	130.8	0	0	0	106.8
276	G	34.4	Very low	33.3	Very low	69 Å²	69	137.4 Å²	137.4	71%	0.711	76%	0.758	S	S	*	*			cis	99.6	137.9	33.5	0	0	0	0	0	109.6
277	P	41.2	Very low	33.2	Very low	119 Å²	119	132.1 Å²	132.1	77%	0.773	75%	0.747	S	S	*	*			cis	-129.6	172.1	16	42.7	-27.9	0	0	0	116.4
278	E	31.3	Very low	33.1	Very low	158 Å²	158	137.8 Å²	137.8	74%	0.738	75%	0.754	S	S	*	*			trans	55.6	151.1	154.7	-72.3	-165.9	83.2	0	0	121.4
279	Q	38.2	Very low	33.6	Very low	141 Å²	141	137.6 Å²	137.6	66%	0.659	74%	0.743	S	S	*	*			cis	-144	142.4	11.7	-155.1	164.8	72.3	0	0	112.3
280	K	35.7	Very low	34.3	Very low	161 Å²	161	135.3 Å²	135.3	70%	0.7	74%	0.744	S	S	*	*			trans	28.7	141.7	157.6	-62.6	170.8	-177.8	167.5	0	121
281	Q	35.8	Very low	34.3	Very low	164 Å²	164	142 Å²	142	77%	0.766	76%	0.758	S	S	*	*			cis	-163.5	137.9	-7.1	-111	162	-52.6	0	0	105.6
282	A	34.6	Very low	34.6	Very low	86 Å²	86	143.9 Å²	143.9	71%	0.711	76%	0.757	S	S	*	*				59.7	134.3	91.4	0	0	0	0	0	114.4
283	S	34.8	Very low	34.9	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	76%	0.758	S	S	*	*			cis	-154.9	147.7	12.4	-58.7	0	0	0	0	114.8
284	R	33.3	Very low	35.2	Very low	229 Å²	229	144.7 Å²	144.7	86%	0.864	75%	0.751	S	S	*	*			trans	7.8	129.8	134.1	-67.2	177.2	173.7	-178	-3	121.3
285	S	31	Very low	35.4	Very low	112 Å²	112	149.2 Å²	149.2	78%	0.783	76%	0.755	S	S	*	*				78.4	144	124.5	-57.3	0	0	0	0	123.8
286	R	32.2	Very low	35.2	Very low	235 Å²	235	145 Å²	145	89%	0.887	75%	0.745	S	S	*	*			trans	85.8	126.6	143.1	-132.5	-166.9	-177.8	-179.5	-1.2	120.1
287	S	28.3	Very low	35.3	Very low	90 Å²	90	148 Å²	148	63%	0.629	75%	0.751	S	S	*	*			trans	47.1	114.2	141.2	59.6	0	0	0	0	122.3
288	E	27.4	Very low	35	Very low	191 Å²	191	145.2 Å²	145.2	89%	0.893	75%	0.745	S	S	*	*			trans	68.1	160.7	137.5	-84.6	-162	86.1	0	0	121.6
289	P	43.2	Very low	35.2	Very low	100 Å²	100	146 Å²	146	65%	0.649	75%	0.753	S	S	*	*			trans	-103	-178.5	-166.3	41.8	-37.2	0	0	0	113.7
290	P	40.4	Very low	34.7	Very low	130 Å²	130	143 Å²	143	84%	0.844	75%	0.748	S	S	*	*			trans	-123.2	172	137.3	35.8	-28.2	0	0	0	113.8
291	R	35.7	Very low	34.4	Very low	227 Å²	227	143 Å²	143	86%	0.857	75%	0.751	S	S	*	*			trans	-104.9	180	-169.5	-67	175.4	164.4	-166.1	-2.2	113.7
292	E	34.4	Very low	34.1	Very low	132 Å²	132	141.8 Å²	141.8	62%	0.617	75%	0.745	S	S	*	*			trans	87	158.2	157.4	-47.1	-149.5	156.7	0	0	116
293	R	38	Very low	33.8	Very low	184 Å²	184	143.6 Å²	143.6	69%	0.694	74%	0.743	S	S	*	*			cis	-161.6	123.6	21.9	-160	158.9	164.1	118.4	-23.9	115.8
294	K	38.9	Very low	33.5	Very low	147 Å²	147	141.6 Å²	141.6	64%	0.639	74%	0.739	S	S	*	*			trans	58.5	161.8	143.6	-65.8	177	-179	159.4	0	118.4
295	K	37.1	Very low	33.3	Very low	176 Å²	176	140.2 Å²	140.2	77%	0.765	74%	0.739	S	S	*	*			cis	-156.1	150.4	-15.5	-111.6	-174.5	174.1	-169.3	0	105.8
296	A	33.3	Very low	33.2	Very low	83 Å²	83	138.8 Å²	138.8	69%	0.686	74%	0.743	S	S	*	*				53.6	146.5	73.3	0	0	0	0	0	114.4
297	P	37.6	Very low	33.1	Very low	132 Å²	132	131.1 Å²	131.1	86%	0.857	74%	0.737	S	S	*	*			cis	-113.7	-175.9	18.2	41.7	-30.9	0	0	0	113.7
298	G	34.7	Very low	33.4	Very low	62 Å²	62	134 Å²	134	64%	0.639	74%	0.74	S	S	*	*			cis	145.1	167.4	-7.6	0	0	0	0	0	112.6
299	L	34.5	Very low	33.6	Very low	174 Å²	174	133.5 Å²	133.5	91%	0.911	74%	0.735	S	S	*	*			trans	67.5	155.9	177.5	-53.5	178.5	0	0	0	115.7
300	S	28.7	Very low	33.2	Very low	79 Å²	79	133 Å²	133	55%	0.552	73%	0.734	S	S	*	*			cis	-172.8	140.9	-27.5	51.5	0	0	0	0	109.5
301	E	28.9	Very low	33.1	Very low	160 Å²	160	133 Å²	133	75%	0.748	72%	0.723	S	S	*	*			trans	63.3	171.6	152.8	-66.1	-171.9	110	0	0	117.1
302	Q	30.1	Very low	33.1	Very low	138 Å²	138	131.7 Å²	131.7	65%	0.645	72%	0.718	S	S	*	*			cis	-150.4	166.1	-24.8	-121.8	-166.6	56.3	0	0	110.2
303	N	27.1	Very low	33.3	Very low	125 Å²	125	134 Å²	134	67%	0.668	73%	0.726	S	S	*	*			trans	26.7	147.8	147.3	-84	-56.9	0	0	0	124.3
304	G	29.2	Very low	33.3	Very low	67 Å²	67	136.5 Å²	136.5	69%	0.691	74%	0.735	S	S	*	*			trans	131.4	91.8	144.2	0	0	0	0	0	114.2
305	K	28.6	Very low	33.4	Very low	200 Å²	200	135.5 Å²	135.5	87%	0.87	74%	0.741	S	S	*	*				72.1	133.3	62.6	-66.2	-174.6	176.1	175	0	115
306	G	29.9	Very low	33.4	Very low	83 Å²	83	132.2 Å²	132.2	86%	0.856	74%	0.738	S	S	*	*			trans	106.2	132.1	-176.2	0	0	0	0	0	110.8
307	G	29.9	Very low	33.5	Very low	74 Å²	74	137.6 Å²	137.6	76%	0.763	75%	0.746	S	S	*	*			cis	119.6	143.3	10.8	0	0	0	0	0	109.7
308	Q	34	Very low	33.3	Very low	151 Å²	151	135.8 Å²	135.8	71%	0.706	74%	0.736	S	S	*	*			cis	-155.6	169.7	4.1	-55.9	179.7	-14.7	0	0	109.8
309	K	31.2	Very low	33.2	Very low	179 Å²	179	139 Å²	139	78%	0.778	74%	0.743	S	S	*	*			trans	63.5	163	156.2	-68.6	154.7	178.9	160.1	0	115.4
310	S	34.2	Very low	33	Very low	91 Å²	91	136.8 Å²	136.8	64%	0.636	74%	0.737	S	S	*	*			cis	-163.2	161.8	-13.9	-107	0	0	0	0	106
311	E	38.2	Very low	33.3	Very low	129 Å²	129	141.1 Å²	141.1	60%	0.603	75%	0.748	S	S	*	*			cis	-160.6	154.4	-6.7	-130.1	-179.2	113.4	0	0	111
312	R	37.3	Very low	33.5	Very low	199 Å²	199	139.7 Å²	139.7	75%	0.751	75%	0.753	S	S	*	*			trans	60.8	159.8	154.8	-64.6	-171.1	-164.8	-165.6	9.1	120
313	K	38.7	Very low	33.6	Very low	180 Å²	180	136 Å²	136	78%	0.783	75%	0.751	S	S	*	*			cis	-177.1	134.9	-38.1	-106.4	172.3	-171.8	175.3	0	102.8
314	R	38.2	Very low	33.7	Very low	238 Å²	238	140 Å²	140	90%	0.898	77%	0.766	S	S	*	*			cis	-119.8	-165.8	13.5	-40.6	178.2	-158.6	-159.2	3.1	107.4
315	V	40.4	Very low	33.7	Very low	126 Å²	126	139.7 Å²	139.7	76%	0.764	76%	0.763	S	S	*	*			cis	-149	165.3	-2.5	93	0	0	0	0	106
316	P	37	Very low	33.9	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	77%	0.765	S	S	*	*			trans	-96.7	157.1	-160.5	41.9	-37.6	0	0	0	113.5
317	K	35.6	Very low	33.9	Very low	196 Å²	196	137.4 Å²	137.4	85%	0.852	76%	0.758	S	S	*	*			cis	67.9	155.3	32.2	-78.5	-164.4	173.3	-180	0	113.9
318	S	33.2	Very low	34	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	76%	0.764	S	S	*	*			cis	-172	-161.7	-19.8	53.3	0	0	0	0	109.3
319	V	32.2	Very low	34.1	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	76%	0.761	S	S	*	*			trans	114	107.5	162.2	-179	0	0	0	0	111
320	V	30.6	Very low	34.2	Very low	129 Å²	129	142.2 Å²	142.2	78%	0.782	76%	0.76	S	S	*	*			cis	97.8	144	36.5	177.5	0	0	0	0	112.3
321	Q	34.4	Very low	34.2	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.794	76%	0.761	S	S	*	*			trans	-71.1	165.2	-172.2	-45.8	-178.1	36.7	0	0	112.8
322	P	34.2	Very low	33.9	Very low	130 Å²	130	148.9 Å²	148.9	84%	0.844	77%	0.772	S	S	*	*				-122	-173.4	75.4	3.8	19.6	0	0	0	112.9
323	G	32.1	Very low	33.8	Very low	59 Å²	59	148.5 Å²	148.5	61%	0.608	78%	0.776	S	S	*	*			cis	134.2	98.6	-4.9	0	0	0	0	0	114
324	E	28.2	Very low	33.6	Very low	210 Å²	210	146.2 Å²	146.2	98%	0.981	77%	0.768	S	S	*	*			trans	60.1	142.2	158.6	-57.8	-172.9	101.3	0	0	122.3
325	G	30	Very low	33.4	Very low	61 Å²	61	144.3 Å²	144.3	63%	0.629	76%	0.761	S	S	*	*			trans	124.7	97	140	0	0	0	0	0	120.1
326	T	31.7	Very low	33	Very low	149 Å²	149	148 Å²	148	91%	0.914	76%	0.761	S	S	*	*			trans	62.5	173.7	149.6	65.2	0	0	0	0	119.3
327	A	31.1	Very low	32.9	Very low	86 Å²	86	151.2 Å²	151.2	71%	0.711	77%	0.766	S	S	*	*				-163.1	136.2	-53.5	0	0	0	0	0	110.7
328	D	32	Very low	32.7	Very low	165 Å²	165	146.1 Å²	146.1	88%	0.882	75%	0.752	S	S	*	*			trans	63.1	167.4	155.6	-112	-57.7	0	0	0	123.5
329	E	34.6	Very low	32.6	Very low	138 Å²	138	151.8 Å²	151.8	65%	0.645	76%	0.759	S	S	*	*			trans	69.7	138	172.6	-82.6	-140.6	99.6	0	0	123.1
330	R	34.7	Very low	32.6	Very low	201 Å²	201	154.2 Å²	154.2	76%	0.758	75%	0.754	S	S	*	*			trans	67.9	97.9	151.2	-69	175	-162.3	-125	-11.1	122.3
331	E	33.1	Very low	32.9	Very low	141 Å²	141	156.2 Å²	156.2	66%	0.659	76%	0.759	S	S	*	*				34.8	134.7	101.2	-150.9	-160.4	119.5	0	0	120.9
332	R	33	Very low	33.1	Very low	219 Å²	219	153.4 Å²	153.4	83%	0.826	75%	0.746	S	S	*	*			trans	80.2	145.3	161.9	-88.2	170.1	170.9	129.7	-7.6	118.8
333	K	35.5	Very low	33.1	Very low	192 Å²	192	155.5 Å²	155.5	84%	0.835	74%	0.742	S	S	*	*			trans	74.3	139.7	167.8	-150.9	167.1	-171.6	175.1	0	115.8
334	E	33.8	Very low	33.6	Very low	131 Å²	131	155.8 Å²	155.8	61%	0.612	75%	0.745	S	S	*	*			cis	169.6	137.3	-22.5	177.8	-161.3	154.7	0	0	104.9
335	R	33.2	Very low	33.8	Very low	198 Å²	198	157.3 Å²	157.3	75%	0.747	74%	0.742	S	S	*	*			trans	57.1	150	163.3	-82.9	177.7	165	-161.2	-1.7	120.6
336	R	33	Very low	34.2	Very low	205 Å²	205	158.7 Å²	158.7	77%	0.774	74%	0.742	S	S	*	*			trans	21	136.3	148	-60.3	-179.6	170.2	-172.2	-1.8	118.7
337	E	34.3	Very low	34.4	Very low	173 Å²	173	159.6 Å²	159.6	81%	0.808	74%	0.736	S	S	*	*				-151.6	163.1	56.5	-79.3	-168.9	122.4	0	0	111.7
338	T	31.5	Very low	34.5	Very low	89 Å²	89	161.8 Å²	161.8	55%	0.546	74%	0.735	S	S	.	*			cis	95	109.6	20.2	-58.7	0	0	0	0	116
339	R	31	Very low	34.6	Very low	213 Å²	213	164.9 Å²	164.9	80%	0.804	74%	0.736	S	S	*	*			trans	69.8	171.2	166.7	-63	167.1	-179	171.8	-1.8	114.2
340	R	33.2	Very low	34.6	Very low	180 Å²	180	163.7 Å²	163.7	68%	0.679	74%	0.741	S	S	*	*			cis	-158.3	163.6	2.5	-141.8	168.7	-164.9	167.2	-1.9	110.2
341	L	36.1	Very low	34.4	Very low	170 Å²	170	161.2 Å²	161.2	89%	0.89	74%	0.742	S	S	*	*			trans	177.1	142.7	141.5	-94.3	146	0	0	0	108.6
342	E	38.1	Very low	34.3	Very low	111 Å²	111	163.8 Å²	163.8	52%	0.519	75%	0.746	S	S	.	*			cis	-175.3	158.9	-45.4	-88.1	-101	96.5	0	0	104.8
343	K	35.2	Very low	34.3	Very low	174 Å²	174	160.5 Å²	160.5	76%	0.757	74%	0.744	S	S	*	*			cis	-177.9	134.1	-4.4	154.9	163.4	154	-177.6	0	112.8
344	G	41.9	Very low	34.2	Very low	65 Å²	65	157.3 Å²	157.3	67%	0.67	73%	0.732	S	S	*	*			trans	173.2	117.4	169	0	0	0	0	0	108.6
345	R	33.8	Very low	34.2	Very low	242 Å²	242	157.7 Å²	157.7	91%	0.913	73%	0.732	S	S	*	*				55.5	119.1	69.8	-70.6	-165.8	173.8	-157.9	-1.8	111.5
346	S	37.9	Very low	34.3	Very low	90 Å²	90	157.3 Å²	157.3	63%	0.629	73%	0.731	S	S	*	*			cis	-159.1	-179.5	7.5	-86.3	0	0	0	0	109.8
347	Q	36.1	Very low	34.4	Very low	168 Å²	168	153.6 Å²	153.6	79%	0.785	72%	0.722	S	S	*	*			cis	-147.5	-158.2	4.4	-145.4	126.5	-87.9	0	0	111.8
348	D	32.7	Very low	34.4	Very low	132 Å²	132	151.6 Å²	151.6	71%	0.706	72%	0.717	S	S	*	*			trans	-91.8	159.5	-169.4	-48.5	-91.7	0	0	0	116.6
349	Y	33.4	Very low	34.7	Very low	230 Å²	230	150.2 Å²	150.2	90%	0.902	72%	0.721	S	S	*	*				166	129.9	124.1	-101.3	-72.9	0	0	0	113.2
350	P	34.3	Very low	34.7	Very low	113 Å²	113	150.9 Å²	150.9	73%	0.734	72%	0.723	S	S	*	*			trans	-137.7	135.7	169.1	38.1	-22	0	0	0	116.2
351	D	31.9	Very low	34.7	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	73%	0.727	S	S	*	*			trans	177.5	175.8	154.2	-107.2	-16.6	0	0	0	107.6
352	R	30.3	Very low	34.6	Very low	196 Å²	196	144.1 Å²	144.1	74%	0.74	72%	0.717	S	S	*	*			cis	167.6	136.5	-40.1	173	179.7	179.2	-164.7	-1.8	107.8
353	L	33.5	Very low	34.4	Very low	150 Å²	150	147.4 Å²	147.4	79%	0.785	73%	0.732	S	S	*	*			trans	157.9	124.5	162	-85.1	150.6	0	0	0	105.3
354	E	32.2	Very low	34.5	Very low	124 Å²	124	146 Å²	146	58%	0.579	73%	0.733	S	S	*	*				70.3	138.4	64.4	-68	-153.2	140.6	0	0	113.2
355	K	35.3	Very low	34.1	Very low	139 Å²	139	148.3 Å²	148.3	60%	0.604	73%	0.726	S	S	*	*			cis	-165.9	152.1	12.3	-127.1	168.2	-179.1	139.2	0	112.4
356	R	35.5	Very low	34.2	Very low	191 Å²	191	143.6 Å²	143.6	72%	0.721	71%	0.713	S	S	*	*			trans	61.4	157	138.4	-81	176.3	151.9	-148.9	-25	121
357	E	35.3	Very low	34	Very low	127 Å²	127	145.4 Å²	145.4	59%	0.593	71%	0.711	S	S	*	*			cis	-153.3	-168.5	-11.8	-135.3	146.5	-159.5	0	0	112.8
358	D	34.2	Very low	34.1	Very low	130 Å²	130	146.2 Å²	146.2	70%	0.695	71%	0.707	S	S	*	*			trans	-49.9	168.4	-177.1	-64.5	-90.8	0	0	0	118.4
359	G	37.1	Very low	34.5	Very low	61 Å²	61	147.2 Å²	147.2	63%	0.629	71%	0.705	S	S	*	*			cis	139.4	142.9	-8.5	0	0	0	0	0	116.1
360	R	30.1	Very low	34.8	Very low	227 Å²	227	142 Å²	142	86%	0.857	69%	0.689	S	S	*	*			trans	70.3	155.3	168.5	-69.3	-174.2	-101.7	-134.9	-8.6	117.2
361	V	33.6	Very low	34.9	Very low	126 Å²	126	144.8 Å²	144.8	76%	0.764	69%	0.692	S	S	*	*			cis	-159	142.2	-6	115.2	0	0	0	0	113.2
362	A	33.8	Very low	35.2	Very low	82 Å²	82	145.8 Å²	145.8	68%	0.678	69%	0.692	S	S	*	*			trans	49.4	167.6	147.1	0	0	0	0	0	126.4
363	E	34.1	Very low	35.5	Very low	179 Å²	179	140.2 Å²	140.2	84%	0.836	70%	0.695	S	S	*	*			trans	71	143	163	-57.8	-176.9	174.3	0	0	117.3
364	D	37.2	Very low	35.6	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	69%	0.685	S	S	*	*			cis	176.6	163.6	-22	-116.1	-63.8	0	0	0	106.2
365	E	33.6	Very low	35.6	Very low	113 Å²	113	133.8 Å²	133.8	53%	0.528	67%	0.673	S	S	.	*			cis	-135.4	-74.8	0.5	173.6	-157.8	102.1	0	0	110.6	Q367	E365-Q367 WeakPolarHBondContact OE1-CG 3.31Å; E365-Q367 PolarHBondContact OE1-NE2 2.84Å
366	K	36.4	Very low	35.9	Very low	143 Å²	143	130.2 Å²	130.2	62%	0.622	66%	0.662	S	S	*	*			cis	-154.3	65.6	-27.3	-156.6	133.9	-158	69.4	0	116.2
367	Q	33.7	Very low	35.9	Very low	128 Å²	128	125.7 Å²	125.7	60%	0.598	66%	0.658	S	S	*	*			trans	71.2	164.2	154.7	-62.9	174.3	26.2	0	0	118.5	E365	E365-Q367 WeakPolarHBondContact OE1-CG 3.31Å; E365-Q367 PolarHBondContact OE1-NE2 2.84Å
368	R	39.2	Very low	35.8	Very low	185 Å²	185	128.6 Å²	128.6	70%	0.698	67%	0.671	S	S	*	*			cis	-153.1	-172.6	-6.9	-126.7	163.6	175.7	149.8	-10.8	106.9	E370	R368-E370 IonicContact NE-OE1 2.64Å
369	K	40.2	Very low	35.9	Very low	153 Å²	153	133 Å²	133	67%	0.665	68%	0.68	S	S	*	*			cis	-159.2	163.2	6.9	-118.3	-161.4	-171.1	-74.3	0	104.1
370	E	39.1	Very low	35.7	Very low	121 Å²	121	134.9 Å²	134.9	57%	0.565	68%	0.68	S	S	*	*			cis	-158.2	-159	-22.7	-131.3	152.5	-124.3	0	0	103.7	R368	R368-E370 IonicContact NE-OE1 2.64Å
371	E	37.6	Very low	35.9	Very low	171 Å²	171	128.7 Å²	128.7	80%	0.799	67%	0.671	S	S	*	*			cis	-148.3	-144.6	10.3	-156.1	-177.3	76.1	0	0	108.4
372	E	37.7	Very low	36	Very low	169 Å²	169	128.3 Å²	128.3	79%	0.79	67%	0.673	S	S	*	*			trans	-141.1	-178.8	-164.7	-70.6	-165	76.7	0	0	116.5	V374	E372-V374 WeakPolarHBondContact OE1-CG2 3.16Å
373	G	36	Very low	35.9	Very low	79 Å²	79	129.2 Å²	129.2	81%	0.814	66%	0.663	S	S	*	*			trans	-178.7	63	177.6	0	0	0	0	0	113.4
374	V	35.3	Very low	36	Very low	94 Å²	94	127.9 Å²	127.9	57%	0.57	66%	0.661	S	S	*	*			trans	-77.8	147.1	-164.6	172.3	0	0	0	0	114.7	E372	E372-V374 WeakPolarHBondContact OE1-CG2 3.16Å
375	S	32.2	Very low	36.2	Very low	46 Å²	46	126.8 Å²	126.8	32%	0.322	66%	0.66	S	S	.	*			trans	153.2	141.8	136.4	-77.6	0	0	0	0	114.9	N504	S375-N504 VanDerWaalsContact CB-CG 3.47Å; S375-N504 WeakPolarHBondContact CB-OD1 3.42Å; S375-N504 VanDerWaalsContact OG-CG 3.27Å; S375-N504 PolarHBondContact OG-OD1 3.41Å; S375-N504 VanDerWaalsContact OG-OD1 3.07Å
376	T	42.3	Very low	36.4	Very low	63 Å²	63	129.9 Å²	129.9	39%	0.387	67%	0.674	S	S	.	*			cis	-159.1	162.9	-15.1	19.3	0	0	0	0	107.3	Y508	T376-Y508 VanDerWaalsContact CB-CD2 3.49Å; T376-Y508 HydrophobicContact CG2-CD1 4.45Å; T376-Y508 HydrophobicContact CG2-CD2 3.69Å; T376-Y508 HydrophobicContact CG2-CE2 3.9Å; T376-Y508 HydrophobicContact CG2-CG 3.99Å; T376-Y508 WeakPolarHBondContact OG1-CD2 3.3Å
377	P	36.4	Very low	36.7	Very low	97 Å²	97	130.8 Å²	130.8	63%	0.63	69%	0.685	S	S	*	*			trans	-103.2	174.5	-145.7	39.2	-39.9	0	0	0	118.4
378	E	32.4	Very low	36.7	Very low	187 Å²	187	133 Å²	133	87%	0.874	70%	0.695	S	S	*	*			trans	-87.8	164.5	170.8	-55.2	-175.1	122.5	0	0	112.9
379	Y	35.1	Very low	36.4	Very low	223 Å²	223	129.3 Å²	129.3	88%	0.875	70%	0.698	S	S	*	*			trans	70.7	69.7	153.1	-136.5	-81.1	0	0	0	121.3
380	T	34.7	Very low	36.1	Very low	101 Å²	101	128.9 Å²	128.9	62%	0.62	70%	0.698	S	S	*	*			trans	-135.8	144.2	148.5	54.4	0	0	0	0	109.1
381	S	33.1	Very low	35.7	Very low	96 Å²	96	128.7 Å²	128.7	67%	0.671	71%	0.71	S	S	*	*			cis	77.1	67.4	22.8	-162.3	0	0	0	0	115.4
382	C	35.7	Very low	35.4	Very low	119 Å²	119	124.4 Å²	124.4	80%	0.804	70%	0.696	S	S	*	*			trans	-101.5	133.3	164.2	-58.4	0	0	0	0	110.4
383	E	32.5	Very low	35.3	Very low	101 Å²	101	118.6 Å²	118.6	47%	0.472	67%	0.674	S	S	.	*			trans	-136.2	166.5	175.3	-41.7	-163.3	126.6	0	0	106.9	R735	E383-R735 IonicContact OE1-CZ 2.67Å; E383-R735 VanDerWaalsContact OE1-CZ 3.23Å; E383-R735 IonicContact OE1-NH1 3.61Å; E383-R735 PolarHBondContact OE1-NH1 3.26Å; E383-R735 IonicContact OE1-NH2 3.6Å; E383-R735 PolarHBondContact OE1-NH2 3.5Å; E383-R735 IonicContact OE2-CZ 2.77Å; E383-R735 IonicContact OE2-NH1 2.7Å; E383-R735 PolarHBondContact OE2-NH1 2.9Å; E383-R735 IonicContact OE2-NH2 3.1Å; E383-R735 PolarHBondContact OE2-NH2 3.3Å
384	D	36.8	Very low	35.3	Very low	150 Å²	150	119.2 Å²	119.2	80%	0.802	66%	0.655	S	S	*	*			trans	64.1	157.2	-163.7	-67.6	-44.1	0	0	0	113.5
385	V	41	Very low	35.2	Very low	124 Å²	124	119.2 Å²	119.2	75%	0.752	65%	0.648	S	S	*	*			cis	-115.4	139.4	10.3	172.8	0	0	0	0	111.8	L387	V385-L387 HydrophobicContact CG1-CG 4.3Å; V385-L387 PolarHBondContact O-N 2.98Å
386	E	37.7	Very low	35.2	Very low	177 Å²	177	118.3 Å²	118.3	83%	0.827	65%	0.646	S	S	*	*			trans	-73.2	114.6	162.2	-68.1	-178.8	134.1	0	0	110.1
387	L	41.4	Very low	34.9	Very low	163 Å²	163	122 Å²	122	85%	0.853	66%	0.663	S	S	*	*			trans	-124.7	109.5	158.8	-87.8	169.5	0	0	0	108.7	V385	V385-L387 HydrophobicContact CG1-CG 4.3Å; V385-L387 PolarHBondContact O-N 2.98Å
388	E	34.2	Very low	34.8	Very low	173 Å²	173	122.4 Å²	122.4	81%	0.808	66%	0.659	S	S	*	*			trans	-72.5	176.6	171.2	-57.6	179.6	98	0	0	111
389	S	34	Very low	34.7	Very low	108 Å²	108	117.8 Å²	117.8	76%	0.755	64%	0.641	S	S	*	*			trans	74.2	135.7	170.6	-7.8	0	0	0	0	114.3
390	E	32.4	Very low	34.7	Very low	145 Å²	145	118.5 Å²	118.5	68%	0.678	64%	0.643	S	S	*	*			cis	-141.6	138.4	-5.4	-58.8	179.1	136.1	0	0	106.1
391	S	30.6	Very low	34.5	Very low	117 Å²	117	123 Å²	123	82%	0.818	65%	0.649	S	S	*	*				70.7	64.5	52.2	-57.5	0	0	0	0	115.9
392	V	31.6	Very low	34.3	Very low	80 Å²	80	125.3 Å²	125.3	49%	0.485	65%	0.653	S	S	.	*			trans	-154.1	118.8	141.5	-136.8	0	0	0	0	106.1
393	S	36.4	Very low	34	Very low	47 Å²	47	126.3 Å²	126.3	33%	0.329	65%	0.65	S	S	.	*				50.5	133.1	82.5	170.6	0	0	0	0	112	P228 R229 E230	P228-S393 PolarHBondContact O-OG 3.34Å; R229-S393 WeakPolarHBondContact CA-OG 3.34Å; R229-S393 PolarHBondContact N-OG 2.81Å; E230-S393 WeakPolarHBondContact CA-O 3.3Å; E230-S393 WeakPolarHBondContact CG-O 3.47Å; E230-S393 PolarHBondContact N-O 3.28Å
394	E	35	Very low	34	Very low	92 Å²	92	126 Å²	126	43%	0.43	66%	0.657	S	S	.	*			cis	156.6	-172.9	37.5	146.1	-76.6	179.5	0	0	107.6	V227 R229	V227-E394 VanDerWaalsContact CA-OE1 3.24Å; V227-E394 WeakPolarHBondContact CA-OE1 3.37Å; V227-E394 HydrophobicContact CB-CG 4.05Å; V227-E394 HydrophobicContact CG1-CB 4.24Å; V227-E394 HydrophobicContact CG1-CG 3.27Å; R229-E394 VanDerWaalsContact CA-CA 3.49Å; R229-E394 WeakPolarHBondContact CG-O 3.27Å
395	K	34.8	Very low	33.6	Very low	94 Å²	94	123.8 Å²	123.8	41%	0.409	66%	0.66	S	S	.	*			trans	-86.5	156.1	-168.5	64.6	108.6	144.3	66.2	0	118.7	E226 V227 R229	E226-K395 PolarHBondContact O-NZ 2.84Å; V227-K395 HydrophobicContact CB-CG 4.21Å; V227-K395 HydrophobicContact CG1-CB 3.81Å; V227-K395 HydrophobicContact CG1-CG 3.64Å; V227-K395 WeakPolarHBondContact O-CE 3.11Å; V227-K395 WeakPolarHBondContact O-CG 3.46Å; V227-K395 PolarHBondContact O-NZ 3.21Å; R229-K395 VanDerWaalsContact CD-O 3.29Å; R229-K395 WeakPolarHBondContact CD-O 3.28Å
396	G	31.6	Very low	33.4	Very low	27 Å²	27	123 Å²	123	28%	0.278	66%	0.656	S	S	.	*			trans	172.7	106.5	152.2	0	0	0	0	0	115.2	R229	R229-G396 PolarHBondContact NH1-O 2.83Å
397	D	35.6	Very low	33.1	Very low	141 Å²	141	126 Å²	126	75%	0.754	66%	0.659	S	S	*	*			trans	56.5	162.2	144.9	-62.1	-43.5	0	0	0	120.6
398	L	35.1	Very low	32.5	Very low	105 Å²	105	126.9 Å²	126.9	55%	0.55	66%	0.659	S	S	.	*			cis	-159.4	179.3	-32.3	-179.2	54.3	0	0	0	106.1	M1	M1-L398 HydrophobicContact CG-CD1 4.05Å; M1-L398 HydrophobicContact CG-CD2 4.13Å; M1-L398 HydrophobicContact SD-CD1 4.38Å; M1-L398 HydrophobicContact SD-CD2 4.18Å
399	D	30.6	Very low	32.3	Very low	90 Å²	90	124.1 Å²	124.1	48%	0.481	66%	0.659	S	S	.	*			trans	-35.5	133.9	175.5	-61.9	-82.8	0	0	0	115.1	W401	D399-W401 PolarHBondContact OD1-NE1 3.13Å
400	Y	33.1	Very low	32	Very low	238 Å²	238	129.4 Å²	129.4	93%	0.933	66%	0.662	S	S	*	*				-140.5	133.9	118.3	-101.3	-72.2	0	0	0	110.5
401	W	30.5	Very low	31.9	Very low	196 Å²	196	129.2 Å²	129.2	74%	0.742	66%	0.661	S	S	*	*			trans	-90	158	179.9	-78.5	68.8	0	0	0	111	D399	D399-W401 PolarHBondContact OD1-NE1 3.13Å
402	L	29.4	Very low	31.8	Very low	145 Å²	145	130.5 Å²	130.5	76%	0.759	66%	0.664	S	S	*	*			trans	59.4	117.1	156.3	-63.6	154.3	0	0	0	117.6
403	D	29.4	Very low	31.7	Very low	139 Å²	139	132.1 Å²	132.1	74%	0.743	68%	0.679	S	S	*	*				-157.1	136.3	99.1	-153.3	15.4	0	0	0	111.5
404	P	33.3	Very low	31.6	Very low	94 Å²	94	135.5 Å²	135.5	61%	0.61	70%	0.7	S	S	*	*			trans	-85.8	156.1	168.3	-7.6	26.8	0	0	0	112.7
405	A	27.7	Very low	31.5	Very low	104 Å²	104	136.5 Å²	136.5	86%	0.86	71%	0.707	S	S	*	*			trans	70.5	67.7	169.1	0	0	0	0	0	117.6
406	T	36.8	Very low	31.5	Very low	108 Å²	108	136.9 Å²	136.9	66%	0.663	72%	0.722	S	S	*	*			trans	-123.1	111.6	164	34.1	0	0	0	0	112.9
407	W	31.9	Very low	32.3	Very low	239 Å²	239	140.5 Å²	140.5	91%	0.905	74%	0.743	S	S	*	*			trans	67	95	159.8	-60.5	89.9	0	0	0	119.5
408	H	28.4	Very low	33.3	Very low	183 Å²	183	140.1 Å²	140.1	85%	0.847	74%	0.736	S	S	*	*			trans	-64.9	137.5	153.9	-65	-94.6	0	0	0	111.3
409	S	29.4	Very low	35.3	Very low	115 Å²	115	138 Å²	138	80%	0.804	73%	0.729	S	S	*	*			trans	-157.7	108.8	141.4	-85.5	0	0	0	0	111.3
410	R	29.4	Very low	38	Very low	218 Å²	218	134.9 Å²	134.9	82%	0.823	71%	0.713	S	S	*	*			trans	33.1	124.5	136.3	-81.1	-169.7	177.4	-110.7	5.6	118.6
411	E	29.2	Very low	40.7	Very low	142 Å²	142	125.1 Å²	125.1	66%	0.664	68%	0.678	S	S	*	*	S	Bend	cis	-143.7	147.8	13.8	-58	-161.5	140.5	0	0	114.1
412	T	29.3	Very low	43.5	Very low	143 Å²	143	119.2 Å²	119.2	88%	0.877	66%	0.656	S	S	*	*			trans	67	94.5	172.3	-4.9	0	0	0	0	117.4
413	S	28.4	Very low	46.2	Very low	115 Å²	115	116.3 Å²	116.3	80%	0.804	64%	0.638	S	S	*	*			trans	-69.1	160.9	177.8	-54.3	0	0	0	0	114.5
414	P	34.9	Very low	49	Very low	118 Å²	118	113.6 Å²	113.6	77%	0.766	63%	0.628	S	S	*	*			trans	-90.5	147.4	-163.7	35.1	-36.4	0	0	0	115.5	S416	P414-S416 PolarHBondContact O-N 2.83Å
415	I	33.9	Very low	51.4	Low	113 Å²	113	109.6 Å²	109.6	58%	0.579	60%	0.602	S	S	*	*			trans	-87.3	82.1	173.7	-54.2	176.3	0	0	0	109.5	S417 T421 Q423	I415-S417 PolarHBondContact O-N 2.85Å; I415-T421 HydrophobicContact CG2-CG2 4.25Å; I415-Q423 VanDerWaalsContact CD1-NE2 3.34Å
416	S	34.5	Very low	53.9	Low	102 Å²	102	114 Å²	114	71%	0.713	60%	0.602	S	S	*	*			trans	-82	112.9	179.2	60.6	0	0	0	0	112.3	P414	P414-S416 PolarHBondContact O-N 2.83Å
417	S	47.2	Very low	55.9	Low	103 Å²	103	114.8 Å²	114.8	72%	0.72	60%	0.598	S	S	*	*	S	Bend	trans	161.8	-29.5	136.7	50	0	0	0	0	114.5	I415	I415-S417 PolarHBondContact O-N 2.85Å
418	H	57.9	Low	58	Low	132 Å²	132	105.2 Å²	105.2	61%	0.611	57%	0.573	S	S	*	*			trans	-92.6	139.9	-174.4	-72.4	-78.6	0	0	0	112.6	V420 T421	H418-V420 PolarHBondContact O-N 2.84Å; H418-T421 HydrophobicContact CB-CG2 4.24Å
419	P	76	Confident	60.7	Low	61 Å²	61	99.9 Å²	99.9	40%	0.396	55%	0.551	S	S	.	*	S	Bend	trans	-76.9	-8.2	177.4	33.3	-36.6	0	0	0	113.4	I436 V482	P419-I436 PolarHBondContact O-N 2.86Å; P419-V482 HydrophobicContact CB-CG1 4.25Å; P419-V482 HydrophobicContact CG-CG1 4.32Å
420	V	87.2	Confident	63.4	Low	25 Å²	25	97 Å²	97	15%	0.152	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.2	174	174	0	0	0	0	108.1	H418 W422 R434 V435 V482	H418-V420 PolarHBondContact O-N 2.84Å; V420-W422 VanDerWaalsContact CG1-NE1 3.26Å; V420-R434 WeakPolarHBondContact CA-O 3.32Å; V420-V435 HydrophobicContact CG1-CG2 4.22Å; V420-V435 HydrophobicContact CG2-CB 4.5Å; V420-V435 HydrophobicContact CG2-CG1 4.17Å; V420-V435 HydrophobicContact CG2-CG2 4.16Å; V420-V482 WeakPolarHBondContact CG2-O 3.4Å
421	T	89.3	Confident	66.3	Low	32 Å²	32	87.8 Å²	87.8	20%	0.196	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.4	170.8	57.4	0	0	0	0	109.6	I415 H418 G433 R434	I415-T421 HydrophobicContact CG2-CG2 4.25Å; H418-T421 HydrophobicContact CB-CG2 4.24Å; T421-G433 CarbonylContact O-C 3.5Å; T421-G433 VanDerWaalsContact O-CA 3.29Å; T421-G433 WeakPolarHBondContact O-CA 3.46Å; T421-R434 PolarHBondContact N-O 2.88Å; T421-R434 PolarHBondContact O-N 2.83Å
422	W	89.5	Confident	69.4	Low	72 Å²	72	83.5 Å²	83.5	27%	0.273	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.8	175	-66.7	92.4	0	0	0	109.6	V420 L431 I432 G433 V524 R526	V420-W422 VanDerWaalsContact CG1-NE1 3.26Å; W422-L431 HydrophobicContact CB-CD2 4.33Å; W422-L431 HydrophobicContact CE3-CB 3.95Å; W422-I432 CarbonylContact C-O 3.57Å; W422-I432 WeakPolarHBondContact CA-O 3.24Å; W422-G433 VanDerWaalsContact CZ3-CA 3.45Å; W422-V524 HydrophobicContact CH2-CG2 3.46Å; W422-V524 VanDerWaalsContact CH2-CG2 3.46Å; W422-V524 HydrophobicContact CZ2-CG2 4.34Å; W422-V524 HydrophobicContact CZ3-CG2 3.93Å; W422-R526 HydrophobicContact CH2-CG 4.44Å; W422-R526 VanDerWaalsContact CZ2-CZ 3.48Å; W422-R526 VanDerWaalsContact CZ2-NH1 3.27Å; W422-R526 HydrophobicContact CZ3-CG 3.92Å
423	Q	86.9	Confident	72.4	Confident	84 Å²	84	76.7 Å²	76.7	39%	0.393	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.1	178.2	-65.9	-176.8	-36.2	0	0	109.5	I415 L431 I432	I415-Q423 VanDerWaalsContact CD1-NE2 3.34Å; Q423-L431 CarbonylContact O-C 3.54Å; Q423-L431 WeakPolarHBondContact O-CA 3.3Å; Q423-I432 PolarHBondContact N-O 3.27Å; Q423-I432 PolarHBondContact O-N 3.49Å
424	P	87.4	Confident	75.5	Confident	82 Å²	82	77 Å²	77	53%	0.532	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	145.8	167.8	-23.1	34.6	0	0	0	111.7	I528	P424-I528 HydrophobicContact CB-CD1 4.38Å
425	S	84.2	Confident	78.3	Confident	10 Å²	10	71.3 Å²	71.3	7%	0.07	38%	0.376	C	S	.	.			trans	-63.4	157.5	165.5	52.8	0	0	0	0	110.9	E427 G428 D429 R430	S425-E427 PolarHBondContact O-N 2.81Å; S425-G428 PolarHBondContact O-N 3.3Å; S425-G428 PolarHBondContact OG-N 2.85Å; S425-D429 PolarHBondContact OG-N 2.85Å; S425-D429 PolarHBondContact OG-OD1 2.87Å; S425-R430 VanDerWaalsContact CB-O 3.28Å; S425-R430 WeakPolarHBondContact CB-O 3.38Å; S425-R430 PolarHBondContact N-O 3.03Å; S425-R430 PolarHBondContact OG-N 2.87Å; S425-R430 VanDerWaalsContact OG-N 3.1Å; S425-R430 PolarHBondContact OG-O 2.89Å
426	K	80	Confident	81.1	Confident	198 Å²	198	68.3 Å²	68.3	86%	0.861	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.6	173.7	63.9	-174.9	-177.4	-171.3	0	112.6
427	E	79.1	Confident	83.8	Confident	124 Å²	124	63.4 Å²	63.4	58%	0.579	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-16.6	173.3	-63.1	81.7	-176.8	0	0	113.9	S425 D429	S425-E427 PolarHBondContact O-N 2.81Å; E427-D429 PolarHBondContact O-N 3.32Å
428	G	76.6	Confident	85.7	Confident	37 Å²	37	61.3 Å²	61.3	38%	0.381	31%	0.307	S	S	.	.	S	Bend	trans	70.2	10.2	-177.8	0	0	0	0	0	115.5	S425 I528	S425-G428 PolarHBondContact O-N 3.3Å; S425-G428 PolarHBondContact OG-N 2.85Å; G428-I528 WeakPolarHBondContact O-CD1 3.22Å
429	D	84.1	Confident	87	Confident	71 Å²	71	58.1 Å²	58.1	38%	0.38	29%	0.291	S	S	.	.	S	Bend	trans	-95.9	-27.6	-179.2	81.5	-42.9	0	0	0	113.3	S425 E427 I528	S425-D429 PolarHBondContact OG-N 2.85Å; S425-D429 PolarHBondContact OG-OD1 2.87Å; E427-D429 PolarHBondContact O-N 3.32Å; D429-I528 WeakPolarHBondContact O-CB 2.82Å; D429-I528 PolarHBondContact O-N 3.36Å
430	R	87.3	Confident	87.1	Confident	56 Å²	56	64.4 Å²	64.4	21%	0.211	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	152	-175.1	-71.1	155.5	-166.8	-102.4	-8.3	112.5	S425 E490 R526 I528	S425-R430 VanDerWaalsContact CB-O 3.28Å; S425-R430 WeakPolarHBondContact CB-O 3.38Å; S425-R430 PolarHBondContact N-O 3.03Å; S425-R430 PolarHBondContact OG-N 2.87Å; S425-R430 VanDerWaalsContact OG-N 3.1Å; S425-R430 PolarHBondContact OG-O 2.89Å; R430-E490 IonicContact NH1-OE2 3.41Å; R430-E490 PolarHBondContact NH1-OE2 2.9Å; R430-R526 CarbonylContact C-O 3.56Å; R430-R526 WeakPolarHBondContact CA-O 3.27Å; R430-R526 WeakPolarHBondContact CB-O 3.39Å; R430-I528 WeakPolarHBondContact O-CD1 3.46Å
431	L	90.5	Very high	86.6	Confident	23 Å²	23	66.2 Å²	66.2	12%	0.12	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	130.9	163.2	-70	122	0	0	0	109.4	W422 Q423 S525 R526 I528 I531	W422-L431 HydrophobicContact CB-CD2 4.33Å; W422-L431 HydrophobicContact CE3-CB 3.95Å; Q423-L431 CarbonylContact O-C 3.54Å; Q423-L431 WeakPolarHBondContact O-CA 3.3Å; L431-S525 VanDerWaalsContact O-CA 3.22Å; L431-S525 WeakPolarHBondContact O-CA 3.38Å; L431-R526 HydrophobicContact CB-CG 4.33Å; L431-R526 PolarHBondContact N-O 3.31Å; L431-R526 PolarHBondContact O-N 3.45Å; L431-I528 HydrophobicContact CD1-CB 4.37Å; L431-I528 HydrophobicContact CD1-CG1 3.51Å; L431-I528 HydrophobicContact CG-CD1 4.27Å; L431-I528 HydrophobicContact CG-CG1 3.62Å; L431-I531 HydrophobicContact CD1-CB 4.47Å; L431-I531 HydrophobicContact CD1-CD1 3.56Å; L431-I531 HydrophobicContact CD1-CG1 3.98Å; L431-I531 HydrophobicContact CD2-CD1 4.27Å
432	I	92.3	Very high	85.2	Confident	52 Å²	52	71.3 Å²	71.3	27%	0.267	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.6	172.4	-58.1	176.9	0	0	0	107.9	W422 Q423 L492 I523 V524	W422-I432 CarbonylContact C-O 3.57Å; W422-I432 WeakPolarHBondContact CA-O 3.24Å; Q423-I432 PolarHBondContact N-O 3.27Å; Q423-I432 PolarHBondContact O-N 3.49Å; I432-L492 HydrophobicContact CG1-CD1 4.44Å; I432-L492 HydrophobicContact CG2-CD1 4.41Å; I432-I523 HydrophobicContact CG2-CG2 3.48Å; I432-I523 VanDerWaalsContact CG2-CG2 3.48Å; I432-V524 CarbonylContact C-O 3.53Å; I432-V524 VanDerWaalsContact CA-O 3.3Å; I432-V524 WeakPolarHBondContact CA-O 2.94Å
433	G	92.7	Very high	83.8	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.5	178.6	0	0	0	0	0	111.1	T421 W422 I523 V524	T421-G433 CarbonylContact O-C 3.5Å; T421-G433 VanDerWaalsContact O-CA 3.29Å; T421-G433 WeakPolarHBondContact O-CA 3.46Å; W422-G433 VanDerWaalsContact CZ3-CA 3.45Å; G433-I523 CarbonylContact O-C 3.5Å; G433-I523 WeakPolarHBondContact O-CA 3.41Å; G433-V524 PolarHBondContact N-O 2.86Å; G433-V524 WeakPolarHBondContact O-CG2 3.39Å; G433-V524 PolarHBondContact O-N 2.89Å
434	R	94.3	Very high	82.3	Confident	121 Å²	121	70.1 Å²	70.1	46%	0.457	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.6	165.8	-54.9	-165.6	-176.9	-164	-0.1	108.7	V420 T421 I523	V420-R434 WeakPolarHBondContact CA-O 3.32Å; T421-R434 PolarHBondContact N-O 2.88Å; T421-R434 PolarHBondContact O-N 2.83Å; R434-I523 HydrophobicContact CG-CD1 4.02Å; R434-I523 HydrophobicContact CG-CG1 4.04Å; R434-I523 HydrophobicContact CG-CG2 4.4Å
435	V	93.9	Very high	80.8	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	121.5	-168.2	174.7	0	0	0	0	110.4	V420 L437 G483 L485 E521 I522	V420-V435 HydrophobicContact CG1-CG2 4.22Å; V420-V435 HydrophobicContact CG2-CB 4.5Å; V420-V435 HydrophobicContact CG2-CG1 4.17Å; V420-V435 HydrophobicContact CG2-CG2 4.16Å; V435-L437 HydrophobicContact CG1-CD2 3.81Å; V435-L437 HydrophobicContact CG1-CG 3.98Å; V435-G483 VanDerWaalsContact CG1-CA 3.49Å; V435-L485 HydrophobicContact CB-CD2 4.31Å; V435-L485 HydrophobicContact CG1-CD1 4.19Å; V435-L485 HydrophobicContact CG1-CD2 4.25Å; V435-L485 HydrophobicContact CG1-CG 4.18Å; V435-L485 HydrophobicContact CG2-CD2 3.86Å; V435-E521 CarbonylContact O-C 3.52Å; V435-E521 WeakPolarHBondContact O-CA 3.19Å; V435-I522 PolarHBondContact N-O 3.21Å; V435-I522 PolarHBondContact O-N 3.16Å
436	I	92.6	Very high	79.4	Confident	49 Å²	49	84.7 Å²	84.7	25%	0.251	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	99.9	-171.5	-58.9	178.4	0	0	0	109.6	P419 Q519 E521	P419-I436 PolarHBondContact O-N 2.86Å; I436-Q519 HydrophobicContact CG2-CG 3.85Å; I436-E521 HydrophobicContact CG1-CG 4.18Å
437	L	89.9	Confident	78.2	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	105.2	-177.2	-56.7	-176.7	0	0	0	111.7	V435 K439 L451 L453 A479 V482 L485 Q519 V520 I522	V435-L437 HydrophobicContact CG1-CD2 3.81Å; V435-L437 HydrophobicContact CG1-CG 3.98Å; L437-K439 PolarHBondContact O-N 2.81Å; L437-L451 HydrophobicContact CB-CD2 3.67Å; L437-L451 HydrophobicContact CD1-CB 4.35Å; L437-L451 HydrophobicContact CD1-CD1 4.48Å; L437-L451 HydrophobicContact CD1-CD2 4.03Å; L437-L453 HydrophobicContact CD1-CD2 4.02Å; L437-A479 HydrophobicContact CD1-CB 4.19Å; L437-V482 HydrophobicContact CD2-CB 4.35Å; L437-V482 HydrophobicContact CD2-CG1 4.47Å; L437-L485 HydrophobicContact CD1-CD1 4.19Å; L437-Q519 WeakPolarHBondContact O-CA 3.47Å; L437-V520 PolarHBondContact N-O 3.38Å; L437-V520 PolarHBondContact O-N 2.88Å; L437-I522 HydrophobicContact CD1-CD1 3.97Å
438	N	87.7	Confident	76.4	Confident	59 Å²	59	73.1 Å²	73.1	32%	0.316	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	112.8	174.4	-172.6	-22.7	0	0	0	111.1	R440 T441 L478 P518	N438-R440 PolarHBondContact O-N 3.21Å; N438-R440 VanDerWaalsContact OD1-CB 3.28Å; N438-R440 WeakPolarHBondContact OD1-CB 3.04Å; N438-R440 PolarHBondContact OD1-N 3.38Å; N438-T441 WeakPolarHBondContact O-CB 3.33Å; N438-T441 PolarHBondContact O-N 3.49Å; N438-T441 PolarHBondContact O-OG1 2.98Å; N438-L478 WeakPolarHBondContact O-CD1 3.49Å; N438-P518 PolarHBondContact OD1-O 2.97Å
439	K	85.1	Confident	75.1	Confident	64 Å²	64	76.3 Å²	76.3	28%	0.278	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-14.9	-179.8	-60.8	178.2	-169.4	146.9	0	113.4	L437 L451 S514 K515 E517 P518	L437-K439 PolarHBondContact O-N 2.81Å; K439-L451 HydrophobicContact CG-CD2 3.78Å; K439-S514 PolarHBondContact NZ-O 2.81Å; K439-K515 PolarHBondContact NZ-O 3.44Å; K439-E517 WeakPolarHBondContact CD-O 3.27Å; K439-E517 WeakPolarHBondContact CE-O 3.1Å; K439-E517 PolarHBondContact NZ-O 2.86Å; K439-P518 WeakPolarHBondContact CB-O 3.14Å; K439-P518 PolarHBondContact N-O 3.18Å
440	R	78.3	Confident	74.4	Confident	194 Å²	194	79.5 Å²	79.5	73%	0.732	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-9.3	177.3	-56.2	-179.1	174.8	169	1.2	113.1	N438 T442 P518	N438-R440 PolarHBondContact O-N 3.21Å; N438-R440 VanDerWaalsContact OD1-CB 3.28Å; N438-R440 WeakPolarHBondContact OD1-CB 3.04Å; N438-R440 PolarHBondContact OD1-N 3.38Å; R440-T442 PolarHBondContact O-N 2.91Å; R440-P518 HydrophobicContact CG-CB 4.32Å
441	T	76.3	Confident	74.2	Confident	63 Å²	63	77.9 Å²	77.9	39%	0.387	41%	0.412	S	S	.	.	S	Bend	trans	-64	124.5	178.8	-64	0	0	0	0	111.3	N438 M443 L478	N438-T441 WeakPolarHBondContact O-CB 3.33Å; N438-T441 PolarHBondContact O-N 3.49Å; N438-T441 PolarHBondContact O-OG1 2.98Å; T441-M443 HydrophobicContact CG2-SD 4.37Å; T441-M443 PolarHBondContact O-N 2.79Å; T441-M443 VanDerWaalsContact O-N 3.08Å; T441-L478 HydrophobicContact CG2-CD2 3.87Å
442	T	60.8	Low	74.1	Confident	139 Å²	139	77.6 Å²	77.6	85%	0.853	42%	0.415	S	S	*	.			trans	-78	93.4	-177.2	52.7	0	0	0	0	111.8	R440	R440-T442 PolarHBondContact O-N 2.91Å
443	M	59.2	Low	74	Confident	43 Å²	43	76.6 Å²	76.6	21%	0.212	41%	0.41	C	S	.	.			trans	-74	161.7	172.2	-64.1	-57.9	-74.5	0	0	112.2	T441 G476 L478 V481	T441-M443 HydrophobicContact CG2-SD 4.37Å; T441-M443 PolarHBondContact O-N 2.79Å; T441-M443 VanDerWaalsContact O-N 3.08Å; M443-G476 VanDerWaalsContact CE-O 3.23Å; M443-G476 WeakPolarHBondContact CE-O 3.31Å; M443-L478 HydrophobicContact CG-CD2 3.65Å; M443-L478 HydrophobicContact CG-CG 3.9Å; M443-L478 HydrophobicContact SD-CD2 3.57Å; M443-L478 VanDerWaalsContact SD-CD2 3.57Å; M443-L478 HydrophobicContact SD-CG 4.31Å; M443-V481 HydrophobicContact CE-CB 3.79Å; M443-V481 HydrophobicContact CE-CG1 4.07Å; M443-V481 HydrophobicContact CE-CG2 3.88Å
444	P	56	Low	74	Confident	88 Å²	88	81.4 Å²	81.4	57%	0.571	43%	0.431	S	S	*	.			trans	-51.7	147.7	169.6	-27.1	36.3	0	0	0	112	E446 S447	P444-E446 PolarHBondContact O-N 3.27Å; P444-S447 WeakPolarHBondContact O-CB 3.43Å; P444-S447 PolarHBondContact O-N 3.37Å
445	K	56.7	Low	73.9	Confident	214 Å²	214	76.5 Å²	76.5	93%	0.93	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-8.5	-165.6	-152.1	172.3	-173.5	174.2	0	115.7
446	E	53.9	Low	73.8	Confident	184 Å²	184	78.8 Å²	78.8	86%	0.86	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-22.9	-179.9	-55.1	-178.2	-128.3	0	0	111.3	P444 G448	P444-E446 PolarHBondContact O-N 3.27Å; E446-G448 PolarHBondContact O-N 2.9Å
447	S	54.7	Low	73.6	Confident	28 Å²	28	76.6 Å²	76.6	20%	0.196	42%	0.417	C	S	.	.	S	Bend	trans	-86.7	80.2	174.5	-58.9	0	0	0	0	110.6	P444 G476	P444-S447 WeakPolarHBondContact O-CB 3.43Å; P444-S447 PolarHBondContact O-N 3.37Å; S447-G476 VanDerWaalsContact CB-O 3.23Å; S447-G476 WeakPolarHBondContact CB-O 3.46Å; S447-G476 PolarHBondContact OG-O 2.84Å
448	G	41.3	Very low	73.2	Confident	51 Å²	51	78 Å²	78	53%	0.526	43%	0.432	S	S	.	.			trans	-51.4	144	179	0	0	0	0	0	113.6	E446 L450	E446-G448 PolarHBondContact O-N 2.9Å; G448-L450 PolarHBondContact O-N 3.01Å
449	A	50.3	Low	73.1	Confident	104 Å²	104	80.9 Å²	80.9	86%	0.86	44%	0.442	S	S	*	.	S	Bend	trans	-70.9	56	-161.8	0	0	0	0	0	116.4
450	L	68.7	Low	72.9	Confident	138 Å²	138	83.4 Å²	83.4	72%	0.723	46%	0.456	S	S	*	.	S	Bend	trans	-119.1	157	169.1	-65.5	169.8	0	0	0	108.3	G448 G452	G448-L450 PolarHBondContact O-N 3.01Å; L450-G452 PolarHBondContact O-N 2.73Å; L450-G452 VanDerWaalsContact O-N 3.17Å
451	L	83.9	Confident	73.1	Confident	21 Å²	21	74.7 Å²	74.7	11%	0.11	43%	0.425	C	S	.	.			trans	-54.5	-35.5	173.3	-63.7	-178.9	0	0	0	111.5	L437 K439 L453 S477 L478 A479 W494 V520	L437-L451 HydrophobicContact CB-CD2 3.67Å; L437-L451 HydrophobicContact CD1-CB 4.35Å; L437-L451 HydrophobicContact CD1-CD1 4.48Å; L437-L451 HydrophobicContact CD1-CD2 4.03Å; K439-L451 HydrophobicContact CG-CD2 3.78Å; L451-L453 HydrophobicContact CB-CD2 4.21Å; L451-L453 HydrophobicContact CB-CG 4.36Å; L451-L453 HydrophobicContact CD1-CD2 4.48Å; L451-S477 WeakPolarHBondContact O-CB 3.5Å; L451-S477 PolarHBondContact O-OG 2.78Å; L451-L478 HydrophobicContact CD2-CD1 4.47Å; L451-L478 PolarHBondContact O-N 3.45Å; L451-A479 VanDerWaalsContact O-CB 3.23Å; L451-A479 WeakPolarHBondContact O-CB 3.23Å; L451-A479 PolarHBondContact O-N 2.95Å; L451-W494 HydrophobicContact CD1-CH2 4.12Å; L451-W494 HydrophobicContact CD1-CZ2 4.4Å; L451-V520 HydrophobicContact CD1-CB 4.28Å; L451-V520 HydrophobicContact CD1-CG2 4.16Å
452	G	87.1	Confident	73.2	Confident	18 Å²	18	79.1 Å²	79.1	19%	0.186	45%	0.446	C	S	.	.			trans	88.3	16.2	173.7	0	0	0	0	0	114.8	L450 V473 K474	L450-G452 PolarHBondContact O-N 2.73Å; L450-G452 VanDerWaalsContact O-N 3.17Å; G452-V473 CarbonylContact O-C 3.49Å; G452-V473 WeakPolarHBondContact O-CA 3.49Å; G452-K474 WeakPolarHBondContact O-CB 3.19Å; G452-K474 PolarHBondContact O-N 2.84Å
453	L	90.9	Very high	73.9	Confident	30 Å²	30	78.1 Å²	78.1	16%	0.157	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	151.3	173.6	65.6	91.9	0	0	0	110.6	L437 L451 V455 I470 K472 A479 L485 W494 I522	L437-L453 HydrophobicContact CD1-CD2 4.02Å; L451-L453 HydrophobicContact CB-CD2 4.21Å; L451-L453 HydrophobicContact CB-CG 4.36Å; L451-L453 HydrophobicContact CD1-CD2 4.48Å; L453-V455 HydrophobicContact CD1-CG2 3.4Å; L453-V455 VanDerWaalsContact CD1-CG2 3.4Å; L453-I470 HydrophobicContact CB-CG2 4.49Å; L453-K472 CarbonylContact C-O 3.56Å; L453-K472 WeakPolarHBondContact CA-O 3.2Å; L453-A479 HydrophobicContact CB-CB 3.92Å; L453-A479 HydrophobicContact CD2-CB 3.97Å; L453-A479 HydrophobicContact CG-CB 4.43Å; L453-L485 HydrophobicContact CD2-CD1 3.79Å; L453-W494 HydrophobicContact CD1-CH2 4.02Å; L453-W494 HydrophobicContact CD1-CZ3 3.9Å; L453-W494 HydrophobicContact CD2-CZ3 4.44Å; L453-I522 HydrophobicContact CD2-CD1 3.69Å
454	K	92.5	Very high	74.8	Confident	101 Å²	101	78.8 Å²	78.8	44%	0.439	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118.2	165.4	179.4	176.2	177.3	170.2	0	109.5	T471 K472	K454-T471 PolarHBondContact O-N 3.38Å; K454-T471 PolarHBondContact O-OG1 3.44Å; K454-T471 VanDerWaalsContact O-OG1 3.07Å; K454-K472 HydrophobicContact CB-CB 4.39Å; K454-K472 PolarHBondContact N-O 2.83Å
455	V	92.7	Very high	76.3	Confident	19 Å²	19	78.9 Å²	78.9	12%	0.115	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	152.1	168.8	-164.8	0	0	0	0	109.6	L453 A468 F469 V491 W494 V507 I511	L453-V455 HydrophobicContact CD1-CG2 3.4Å; L453-V455 VanDerWaalsContact CD1-CG2 3.4Å; V455-A468 HydrophobicContact CG1-CB 3.83Å; V455-F469 CarbonylContact C-O 3.57Å; V455-F469 VanDerWaalsContact CA-O 3.3Å; V455-F469 WeakPolarHBondContact CA-O 2.84Å; V455-V491 HydrophobicContact CG1-CG2 4.08Å; V455-V491 HydrophobicContact CG2-CG2 4.37Å; V455-W494 HydrophobicContact CG2-CZ3 4.02Å; V455-V507 HydrophobicContact CG1-CG1 4.14Å; V455-I511 HydrophobicContact CB-CD1 3.66Å; V455-I511 HydrophobicContact CG1-CD1 4.24Å; V455-I511 HydrophobicContact CG2-CD1 3.78Å
456	V	90.4	Very high	77.8	Confident	47 Å²	47	71.1 Å²	71.1	29%	0.285	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.7	165.1	173.1	0	0	0	0	108.1	A468 F469 T471	V456-A468 CarbonylContact O-C 3.57Å; V456-A468 WeakPolarHBondContact O-CA 3.36Å; V456-F469 PolarHBondContact N-O 2.86Å; V456-F469 PolarHBondContact O-N 2.9Å; V456-T471 HydrophobicContact CB-CG2 3.86Å; V456-T471 HydrophobicContact CG2-CG2 3.59Å
457	G	88.6	Confident	79.5	Confident	3 Å²	3	62.4 Å²	62.4	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	176.7	175.4	0	0	0	0	0	113.3	K459 N504	G457-K459 PolarHBondContact O-N 3.36Å; G457-K459 VanDerWaalsContact O-N 3.12Å; G457-N504 PolarHBondContact N-ND2 3.25Å; G457-N504 PolarHBondContact O-ND2 3.49Å
458	G	83.2	Confident	81.4	Confident	30 Å²	30	61 Å²	61	31%	0.309	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65.1	11.9	174.3	0	0	0	0	0	116	G467	G458-G467 PolarHBondContact N-O 3.43Å
459	K	83.7	Confident	83.9	Confident	120 Å²	120	60 Å²	60	52%	0.522	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.7	175.2	-172.8	-167.7	170.4	-159.6	0	109.3	G457 T461 L466 G467 F469	G457-K459 PolarHBondContact O-N 3.36Å; G457-K459 VanDerWaalsContact O-N 3.12Å; K459-T461 PolarHBondContact O-N 2.86Å; K459-L466 CarbonylContact O-C 3.57Å; K459-G467 PolarHBondContact N-O 3.25Å; K459-G467 PolarHBondContact O-N 3.1Å; K459-F469 HydrophobicContact CB-CD2 3.82Å; K459-F469 HydrophobicContact CB-CE2 3.99Å; K459-F469 HydrophobicContact CD-CD2 3.74Å; K459-F469 HydrophobicContact CD-CE2 3.88Å; K459-F469 HydrophobicContact CD-CG 4.28Å; K459-F469 HydrophobicContact CG-CD2 4.27Å; K459-F469 HydrophobicContact CG-CE2 4.22Å
460	M	82.1	Confident	86	Confident	116 Å²	116	55.1 Å²	55.1	57%	0.571	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	130.2	174.4	-157.4	65.1	72.3	0	0	111.2	G464 L466	M460-G464 VanDerWaalsContact SD-C 3.55Å; M460-G464 VanDerWaalsContact SD-O 3.38Å; M460-L466 HydrophobicContact CE-CD2 4.1Å; M460-L466 HydrophobicContact SD-CD2 4.3Å
461	T	82.5	Confident	87.1	Confident	12 Å²	12	51.5 Å²	51.5	7%	0.074	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-84.6	165.4	170.4	62.2	0	0	0	0	110.9	K459 L463 G464 R465 F469	K459-T461 PolarHBondContact O-N 2.86Å; T461-L463 PolarHBondContact O-N 3.48Å; T461-L463 VanDerWaalsContact O-N 3.1Å; T461-L463 PolarHBondContact OG1-N 2.95Å; T461-G464 PolarHBondContact O-N 3.09Å; T461-R465 WeakPolarHBondContact CB-O 3.38Å; T461-R465 HydrophobicContact CG2-CG 3.89Å; T461-R465 WeakPolarHBondContact CG2-O 3.33Å; T461-R465 PolarHBondContact N-O 3.2Å; T461-R465 WeakPolarHBondContact OG1-CG 3.22Å; T461-R465 PolarHBondContact OG1-N 3.02Å; T461-R465 PolarHBondContact OG1-O 2.63Å; T461-F469 HydrophobicContact CG2-CE2 4.12Å; T461-F469 HydrophobicContact CG2-CZ 3.93Å
462	D	77.3	Confident	87.5	Confident	155 Å²	155	57.8 Å²	57.8	83%	0.829	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.2	173.8	-40.3	-64.7	0	0	0	112.8
463	L	75.2	Confident	87.7	Confident	119 Å²	119	58.7 Å²	58.7	62%	0.623	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	3.2	176.8	-58.9	178.2	0	0	0	113.2	T461 R465	T461-L463 PolarHBondContact O-N 3.48Å; T461-L463 VanDerWaalsContact O-N 3.1Å; T461-L463 PolarHBondContact OG1-N 2.95Å; L463-R465 VanDerWaalsContact C-N 3.25Å; L463-R465 PolarHBondContact O-N 3.41Å
464	G	79.3	Confident	87.6	Confident	57 Å²	57	63.6 Å²	63.6	59%	0.588	33%	0.332	S	S	*	.	S	Bend	trans	73.6	8.9	179.5	0	0	0	0	0	115.3	M460 T461	M460-G464 VanDerWaalsContact SD-C 3.55Å; M460-G464 VanDerWaalsContact SD-O 3.38Å; T461-G464 PolarHBondContact O-N 3.09Å
465	R	86.4	Confident	87.3	Confident	90 Å²	90	65.6 Å²	65.6	34%	0.34	34%	0.341	S	S	.	.	S	Bend	trans	-92.5	152.8	167.6	66	172.3	-170.8	-139.6	0.9	110.8	T461 L463 E490	T461-R465 WeakPolarHBondContact CB-O 3.38Å; T461-R465 HydrophobicContact CG2-CG 3.89Å; T461-R465 WeakPolarHBondContact CG2-O 3.33Å; T461-R465 PolarHBondContact N-O 3.2Å; T461-R465 WeakPolarHBondContact OG1-CG 3.22Å; T461-R465 PolarHBondContact OG1-N 3.02Å; T461-R465 PolarHBondContact OG1-O 2.63Å; L463-R465 VanDerWaalsContact C-N 3.25Å; L463-R465 PolarHBondContact O-N 3.41Å; R465-E490 IonicContact CZ-OE1 3.77Å; R465-E490 IonicContact NE-OE1 3.25Å; R465-E490 PolarHBondContact NE-OE1 2.85Å; R465-E490 IonicContact NH2-OE1 3.96Å; R465-E490 PolarHBondContact NH2-OE1 2.78Å; R465-E490 IonicContact NH2-OE2 2.95Å; R465-E490 PolarHBondContact NH2-OE2 2.86Å
466	L	88.7	Confident	86.9	Confident	51 Å²	51	65.7 Å²	65.7	27%	0.267	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	147	163.2	-57.4	-178.1	0	0	0	109.8	K459 M460 G501	K459-L466 CarbonylContact O-C 3.57Å; M460-L466 HydrophobicContact CE-CD2 4.1Å; M460-L466 HydrophobicContact SD-CD2 4.3Å; L466-G501 PolarHBondContact O-N 3.37Å
467	G	89.8	Confident	86.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	157.9	176.5	0	0	0	0	0	112.5	G458 K459	G458-G467 PolarHBondContact N-O 3.43Å; K459-G467 PolarHBondContact N-O 3.25Å; K459-G467 PolarHBondContact O-N 3.1Å
468	A	94.1	Very high	86.8	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	131.5	173.8	0	0	0	0	0	109.8	V455 V456 E490 V491 L499 V507	V455-A468 HydrophobicContact CG1-CB 3.83Å; V456-A468 CarbonylContact O-C 3.57Å; V456-A468 WeakPolarHBondContact O-CA 3.36Å; A468-E490 CarbonylContact O-C 3.47Å; A468-E490 WeakPolarHBondContact O-CA 3.17Å; A468-V491 HydrophobicContact CB-CB 4.18Å; A468-V491 PolarHBondContact O-N 3.32Å; A468-L499 HydrophobicContact CB-CB 3.76Å; A468-L499 HydrophobicContact CB-CD1 3.63Å; A468-L499 HydrophobicContact CB-CG 4.36Å; A468-V507 HydrophobicContact CB-CG1 4.07Å; A468-V507 HydrophobicContact CB-CG2 3.96Å
469	F	94	Very high	87.2	Confident	29 Å²	29	62.6 Å²	62.6	13%	0.127	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139	-176.1	-69.8	-95	0	0	0	112.2	V455 V456 K459 T461 T471 D489 E490	V455-F469 CarbonylContact C-O 3.57Å; V455-F469 VanDerWaalsContact CA-O 3.3Å; V455-F469 WeakPolarHBondContact CA-O 2.84Å; V456-F469 PolarHBondContact N-O 2.86Å; V456-F469 PolarHBondContact O-N 2.9Å; K459-F469 HydrophobicContact CB-CD2 3.82Å; K459-F469 HydrophobicContact CB-CE2 3.99Å; K459-F469 HydrophobicContact CD-CD2 3.74Å; K459-F469 HydrophobicContact CD-CE2 3.88Å; K459-F469 HydrophobicContact CD-CG 4.28Å; K459-F469 HydrophobicContact CG-CD2 4.27Å; K459-F469 HydrophobicContact CG-CE2 4.22Å; T461-F469 HydrophobicContact CG2-CE2 4.12Å; T461-F469 HydrophobicContact CG2-CZ 3.93Å; F469-T471 PolarHBondContact O-N 3.47Å; F469-D489 WeakPolarHBondContact CA-O 3.27Å; F469-E490 HydrophobicContact CD1-CB 4.08Å; F469-E490 HydrophobicContact CE1-CB 3.85Å; F469-E490 HydrophobicContact CE1-CG 4.13Å; F469-E490 HydrophobicContact CZ-CB 4.43Å; F469-E490 HydrophobicContact CZ-CG 4.22Å
470	I	94	Very high	87.5	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	115.7	169.2	-56.1	-172.2	0	0	0	108.3	L453 V473 L485 R486 A487 G488 D489 V491 V524	L453-I470 HydrophobicContact CB-CG2 4.49Å; I470-V473 HydrophobicContact CG2-CG2 3.5Å; I470-L485 HydrophobicContact CD1-CB 3.98Å; I470-L485 HydrophobicContact CD1-CD1 3.96Å; I470-L485 HydrophobicContact CD1-CD2 4.04Å; I470-L485 HydrophobicContact CD1-CG 4.22Å; I470-R486 WeakPolarHBondContact CB-O 3.43Å; I470-R486 WeakPolarHBondContact CG2-O 3.42Å; I470-A487 CarbonylContact O-C 3.59Å; I470-A487 WeakPolarHBondContact O-CA 3.44Å; I470-G488 PolarHBondContact O-N 2.99Å; I470-D489 HydrophobicContact CB-CB 4.32Å; I470-D489 HydrophobicContact CD1-CB 4.03Å; I470-D489 HydrophobicContact CG1-CB 4.18Å; I470-D489 PolarHBondContact N-O 3.24Å; I470-V491 HydrophobicContact CD1-CG2 4.28Å; I470-V491 HydrophobicContact CG1-CG2 3.71Å; I470-V524 HydrophobicContact CD1-CG1 4.16Å
471	T	92.4	Very high	87.7	Confident	62 Å²	62	57.6 Å²	57.6	38%	0.38	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-27.4	-176.6	55.9	0	0	0	0	113.5	K454 V456 F469	K454-T471 PolarHBondContact O-N 3.38Å; K454-T471 PolarHBondContact O-OG1 3.44Å; K454-T471 VanDerWaalsContact O-OG1 3.07Å; V456-T471 HydrophobicContact CB-CG2 3.86Å; V456-T471 HydrophobicContact CG2-CG2 3.59Å; F469-T471 PolarHBondContact O-N 3.47Å
472	K	91.9	Very high	87.9	Confident	153 Å²	153	58.8 Å²	58.8	67%	0.665	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.9	141.9	174.2	-64.4	-170.8	178.8	-176.6	0	110.2	L453 K454	L453-K472 CarbonylContact C-O 3.56Å; L453-K472 WeakPolarHBondContact CA-O 3.2Å; K454-K472 HydrophobicContact CB-CB 4.39Å; K454-K472 PolarHBondContact N-O 2.83Å
473	V	92.3	Very high	88.3	Confident	36 Å²	36	51.4 Å²	51.4	22%	0.218	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	133.2	167.2	-178.6	0	0	0	0	108.1	G452 I470 A479 D480 L485	G452-V473 CarbonylContact O-C 3.49Å; G452-V473 WeakPolarHBondContact O-CA 3.49Å; I470-V473 HydrophobicContact CG2-CG2 3.5Å; V473-A479 HydrophobicContact CG1-CB 3.99Å; V473-D480 HydrophobicContact CG1-CB 3.94Å; V473-L485 HydrophobicContact CG2-CB 4.38Å
474	K	88.7	Confident	89	Confident	133 Å²	133	50.9 Å²	50.9	58%	0.578	27%	0.266	S	S	*	.			trans	-87.7	115.9	-177.5	-176.8	173.3	-179.3	174.1	0	109.5	G452 G476 S477	G452-K474 WeakPolarHBondContact O-CB 3.19Å; G452-K474 PolarHBondContact O-N 2.84Å; K474-G476 PolarHBondContact O-N 3.23Å; K474-S477 WeakPolarHBondContact O-CB 3.43Å; K474-S477 PolarHBondContact O-N 2.88Å; K474-S477 PolarHBondContact O-OG 2.92Å
475	K	86.3	Confident	89.6	Confident	144 Å²	144	48.4 Å²	48.4	63%	0.626	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	132.4	176.2	-164.2	174.8	-174	177.4	0	111.4	D480 R625	K475-D480 WeakPolarHBondContact CA-OD2 3.23Å; K475-R625 PolarHBondContact NZ-O 3.2Å
476	G	83.2	Confident	89.9	Confident	21 Å²	21	49.9 Å²	49.9	22%	0.216	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-0.4	-175.8	0	0	0	0	0	115.8	M443 S447 K474 D480	M443-G476 VanDerWaalsContact CE-O 3.23Å; M443-G476 WeakPolarHBondContact CE-O 3.31Å; S447-G476 VanDerWaalsContact CB-O 3.23Å; S447-G476 WeakPolarHBondContact CB-O 3.46Å; S447-G476 PolarHBondContact OG-O 2.84Å; K474-G476 PolarHBondContact O-N 3.23Å; G476-D480 PolarHBondContact N-OD2 3.26Å
477	S	88.4	Confident	90	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.042	26%	0.257	C	S	.	.	S	Bend	trans	-82.2	176.6	178.6	69.4	0	0	0	0	113.5	L451 K474 D480 V481	L451-S477 WeakPolarHBondContact O-CB 3.5Å; L451-S477 PolarHBondContact O-OG 2.78Å; K474-S477 WeakPolarHBondContact O-CB 3.43Å; K474-S477 PolarHBondContact O-N 2.88Å; K474-S477 PolarHBondContact O-OG 2.92Å; S477-D480 PolarHBondContact O-N 3.45Å; S477-V481 WeakPolarHBondContact O-CB 3.43Å; S477-V481 WeakPolarHBondContact O-CG2 3.34Å; S477-V481 PolarHBondContact O-N 3.11Å
478	L	88.4	Confident	90	Very high	8 Å²	8	53.1 Å²	53.1	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-40.5	175.6	-71.4	168	0	0	0	112.1	N438 T441 M443 L451 D480 V482 G483	N438-L478 WeakPolarHBondContact O-CD1 3.49Å; T441-L478 HydrophobicContact CG2-CD2 3.87Å; M443-L478 HydrophobicContact CG-CD2 3.65Å; M443-L478 HydrophobicContact CG-CG 3.9Å; M443-L478 HydrophobicContact SD-CD2 3.57Å; M443-L478 VanDerWaalsContact SD-CD2 3.57Å; M443-L478 HydrophobicContact SD-CG 4.31Å; L451-L478 HydrophobicContact CD2-CD1 4.47Å; L451-L478 PolarHBondContact O-N 3.45Å; L478-D480 VanDerWaalsContact C-N 3.29Å; L478-D480 PolarHBondContact O-N 2.96Å; L478-V482 HydrophobicContact CD2-CG2 3.95Å; L478-V482 CarbonylContact O-C 3.6Å; L478-V482 WeakPolarHBondContact O-CA 3.26Å; L478-V482 WeakPolarHBondContact O-CB 3.42Å; L478-V482 PolarHBondContact O-N 3.25Å; L478-G483 PolarHBondContact O-N 2.88Å
479	A	91.6	Very high	90	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.1	-35.2	177.6	0	0	0	0	0	113.2	L437 L451 L453 V473 G483 H484 L485	L437-A479 HydrophobicContact CD1-CB 4.19Å; L451-A479 VanDerWaalsContact O-CB 3.23Å; L451-A479 WeakPolarHBondContact O-CB 3.23Å; L451-A479 PolarHBondContact O-N 2.95Å; L453-A479 HydrophobicContact CB-CB 3.92Å; L453-A479 HydrophobicContact CD2-CB 3.97Å; L453-A479 HydrophobicContact CG-CB 4.43Å; V473-A479 HydrophobicContact CG1-CB 3.99Å; A479-G483 CarbonylContact O-C 3.54Å; A479-G483 WeakPolarHBondContact O-CA 3.41Å; A479-G483 PolarHBondContact O-N 3.36Å; A479-H484 PolarHBondContact O-N 2.69Å; A479-L485 HydrophobicContact CB-CD1 4.12Å; A479-L485 PolarHBondContact O-N 3.32Å
480	D	90.2	Very high	90	Very high	56 Å²	56	52.1 Å²	52.1	30%	0.299	28%	0.28	S	S	.	.	H	α-helix	trans	-77.1	-59.6	178	-176.2	55.3	0	0	0	111.2	V473 K475 G476 S477 L478 H484	V473-D480 HydrophobicContact CG1-CB 3.94Å; K475-D480 WeakPolarHBondContact CA-OD2 3.23Å; G476-D480 PolarHBondContact N-OD2 3.26Å; S477-D480 PolarHBondContact O-N 3.45Å; L478-D480 VanDerWaalsContact C-N 3.29Å; L478-D480 PolarHBondContact O-N 2.96Å; D480-H484 PolarHBondContact O-N 3Å; D480-H484 PolarHBondContact O-ND1 3.49Å
481	V	86.3	Confident	90.1	Very high	75 Å²	75	52 Å²	52	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-80.6	-34.6	-168.4	-179.6	0	0	0	0	113.1	M443 S477 H484	M443-V481 HydrophobicContact CE-CB 3.79Å; M443-V481 HydrophobicContact CE-CG1 4.07Å; M443-V481 HydrophobicContact CE-CG2 3.88Å; S477-V481 WeakPolarHBondContact O-CB 3.43Å; S477-V481 WeakPolarHBondContact O-CG2 3.34Å; S477-V481 PolarHBondContact O-N 3.11Å; V481-H484 PolarHBondContact O-CE1 2.9Å; V481-H484 VanDerWaalsContact O-CE1 3.26Å
482	V	86.4	Confident	90.1	Very high	37 Å²	37	50.6 Å²	50.6	22%	0.224	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-38	179.7	-176.3	0	0	0	0	111.3	P419 V420 L437 L478	P419-V482 HydrophobicContact CB-CG1 4.25Å; P419-V482 HydrophobicContact CG-CG1 4.32Å; V420-V482 WeakPolarHBondContact CG2-O 3.4Å; L437-V482 HydrophobicContact CD2-CB 4.35Å; L437-V482 HydrophobicContact CD2-CG1 4.47Å; L478-V482 HydrophobicContact CD2-CG2 3.95Å; L478-V482 CarbonylContact O-C 3.6Å; L478-V482 WeakPolarHBondContact O-CA 3.26Å; L478-V482 WeakPolarHBondContact O-CB 3.42Å; L478-V482 PolarHBondContact O-N 3.25Å
483	G	85.8	Confident	90.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-23	-173.6	0	0	0	0	0	116.3	V435 L478 A479 L485	V435-G483 VanDerWaalsContact CG1-CA 3.49Å; L478-G483 PolarHBondContact O-N 2.88Å; A479-G483 CarbonylContact O-C 3.54Å; A479-G483 WeakPolarHBondContact O-CA 3.41Å; A479-G483 PolarHBondContact O-N 3.36Å; G483-L485 PolarHBondContact O-N 2.93Å; G483-L485 VanDerWaalsContact O-N 3.12Å
484	H	89.8	Confident	90.4	Very high	108 Å²	108	45.4 Å²	45.4	50%	0.5	25%	0.245	S	C	.	.			trans	50.9	32.2	-172.4	-49.5	-37.1	0	0	0	113.4	A479 D480 V481 R526	A479-H484 PolarHBondContact O-N 2.69Å; D480-H484 PolarHBondContact O-N 3Å; D480-H484 PolarHBondContact O-ND1 3.49Å; V481-H484 PolarHBondContact O-CE1 2.9Å; V481-H484 VanDerWaalsContact O-CE1 3.26Å; H484-R526 PolarHBondContact O-NH2 2.95Å
485	L	93.3	Very high	90.5	Very high	6 Å²	6	41 Å²	41	3%	0.031	23%	0.228	C	C	.	.			trans	-76.1	141.3	176.8	-64.9	177.2	0	0	0	109.7	V435 L437 L453 I470 V473 A479 G483 I522 V524	V435-L485 HydrophobicContact CB-CD2 4.31Å; V435-L485 HydrophobicContact CG1-CD1 4.19Å; V435-L485 HydrophobicContact CG1-CD2 4.25Å; V435-L485 HydrophobicContact CG1-CG 4.18Å; V435-L485 HydrophobicContact CG2-CD2 3.86Å; L437-L485 HydrophobicContact CD1-CD1 4.19Å; L453-L485 HydrophobicContact CD2-CD1 3.79Å; I470-L485 HydrophobicContact CD1-CB 3.98Å; I470-L485 HydrophobicContact CD1-CD1 3.96Å; I470-L485 HydrophobicContact CD1-CD2 4.04Å; I470-L485 HydrophobicContact CD1-CG 4.22Å; V473-L485 HydrophobicContact CG2-CB 4.38Å; A479-L485 HydrophobicContact CB-CD1 4.12Å; A479-L485 PolarHBondContact O-N 3.32Å; G483-L485 PolarHBondContact O-N 2.93Å; G483-L485 VanDerWaalsContact O-N 3.12Å; L485-I522 HydrophobicContact CD1-CD1 4.19Å; L485-V524 HydrophobicContact CD2-CB 4.46Å; L485-V524 HydrophobicContact CD2-CG1 3.85Å; L485-V524 HydrophobicContact CD2-CG2 3.8Å
486	R	91.6	Very high	90.7	Very high	121 Å²	121	36.7 Å²	36.7	46%	0.457	22%	0.224	S	C	.	.			trans	-119.3	154.4	-178	-66.4	-176.7	179.7	-140.9	3.9	110.1	I470 G488 D489 E707	I470-R486 WeakPolarHBondContact CB-O 3.43Å; I470-R486 WeakPolarHBondContact CG2-O 3.42Å; R486-G488 PolarHBondContact O-N 3.31Å; R486-D489 PolarHBondContact N-OD2 2.87Å; R486-D489 PolarHBondContact O-N 3.08Å; R486-E707 IonicContact NH1-OE2 3.78Å
487	A	91.3	Very high	91.2	Very high	64 Å²	64	40 Å²	40	53%	0.529	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	130.6	165.1	0	0	0	0	0	108.4	I470	I470-A487 CarbonylContact O-C 3.59Å; I470-A487 WeakPolarHBondContact O-CA 3.44Å
488	G	90.7	Very high	91.4	Very high	55 Å²	55	44.1 Å²	44.1	57%	0.567	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.6	-24	-171.1	0	0	0	0	0	114.2	I470 R486 E490	I470-G488 PolarHBondContact O-N 2.99Å; R486-G488 PolarHBondContact O-N 3.31Å; G488-E490 PolarHBondContact O-N 2.84Å
489	D	94	Very high	91.5	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	26%	0.257	C	S	.	.			trans	-58.4	127	177.1	-71	-19.2	0	0	0	111.3	F469 I470 R486 V524 R526	F469-D489 WeakPolarHBondContact CA-O 3.27Å; I470-D489 HydrophobicContact CB-CB 4.32Å; I470-D489 HydrophobicContact CD1-CB 4.03Å; I470-D489 HydrophobicContact CG1-CB 4.18Å; I470-D489 PolarHBondContact N-O 3.24Å; R486-D489 PolarHBondContact N-OD2 2.87Å; R486-D489 PolarHBondContact O-N 3.08Å; D489-V524 HydrophobicContact CB-CB 4.18Å; D489-V524 HydrophobicContact CB-CG1 4.34Å; D489-R526 VanDerWaalsContact CG-NH2 3.3Å; D489-R526 IonicContact OD1-CZ 3.43Å; D489-R526 VanDerWaalsContact OD1-CZ 3.3Å; D489-R526 IonicContact OD1-NE 3.06Å; D489-R526 PolarHBondContact OD1-NE 2.9Å; D489-R526 IonicContact OD1-NH2 2.71Å; D489-R526 PolarHBondContact OD1-NH2 2.8Å; D489-R526 IonicContact OD2-CZ 2.79Å; D489-R526 IonicContact OD2-NE 3.38Å; D489-R526 IonicContact OD2-NH2 2.85Å; D489-R526 PolarHBondContact OD2-NH2 3.33Å
490	E	93.9	Very high	91.5	Very high	5 Å²	5	45.8 Å²	45.8	2%	0.023	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.4	171.1	-175.6	-176.9	176.9	0	0	108.7	R430 R465 A468 F469 G488 L492 V524 S525	R430-E490 IonicContact NH1-OE2 3.41Å; R430-E490 PolarHBondContact NH1-OE2 2.9Å; R465-E490 IonicContact CZ-OE1 3.77Å; R465-E490 IonicContact NE-OE1 3.25Å; R465-E490 PolarHBondContact NE-OE1 2.85Å; R465-E490 IonicContact NH2-OE1 3.96Å; R465-E490 PolarHBondContact NH2-OE1 2.78Å; R465-E490 IonicContact NH2-OE2 2.95Å; R465-E490 PolarHBondContact NH2-OE2 2.86Å; A468-E490 CarbonylContact O-C 3.47Å; A468-E490 WeakPolarHBondContact O-CA 3.17Å; F469-E490 HydrophobicContact CD1-CB 4.08Å; F469-E490 HydrophobicContact CE1-CB 3.85Å; F469-E490 HydrophobicContact CE1-CG 4.13Å; F469-E490 HydrophobicContact CZ-CB 4.43Å; F469-E490 HydrophobicContact CZ-CG 4.22Å; G488-E490 PolarHBondContact O-N 2.84Å; E490-L492 HydrophobicContact CG-CD2 4.33Å; E490-L492 PolarHBondContact O-N 2.92Å; E490-V524 CarbonylContact O-C 3.5Å; E490-V524 VanDerWaalsContact O-CA 3.25Å; E490-V524 WeakPolarHBondContact O-CA 3.37Å; E490-S525 PolarHBondContact N-O 2.93Å; E490-S525 PolarHBondContact O-N 3.03Å
491	V	94.9	Very high	91.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	115.9	176.4	-171.3	0	0	0	0	109	V455 A468 I470 W494 L499 I522 V524	V455-V491 HydrophobicContact CG1-CG2 4.08Å; V455-V491 HydrophobicContact CG2-CG2 4.37Å; A468-V491 HydrophobicContact CB-CB 4.18Å; A468-V491 PolarHBondContact O-N 3.32Å; I470-V491 HydrophobicContact CD1-CG2 4.28Å; I470-V491 HydrophobicContact CG1-CG2 3.71Å; V491-W494 HydrophobicContact CG1-CE3 4.49Å; V491-L499 HydrophobicContact CB-CD1 4.01Å; V491-L499 HydrophobicContact CG1-CD1 3.62Å; V491-L499 HydrophobicContact CG1-CG 4.44Å; V491-I522 HydrophobicContact CG1-CG2 3.68Å; V491-V524 HydrophobicContact CG2-CG1 4.17Å
492	L	93.8	Very high	91.5	Very high	32 Å²	32	42.3 Å²	42.3	17%	0.168	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-42.9	177.8	-60.1	-175.4	0	0	0	111.8	I432 E490 P498 L499 P500 I523	I432-L492 HydrophobicContact CG1-CD1 4.44Å; I432-L492 HydrophobicContact CG2-CD1 4.41Å; E490-L492 HydrophobicContact CG-CD2 4.33Å; E490-L492 PolarHBondContact O-N 2.92Å; L492-P498 WeakPolarHBondContact O-CA 3.16Å; L492-L499 PolarHBondContact O-N 3.22Å; L492-P500 HydrophobicContact CD2-CG 3.85Å; L492-P500 WeakPolarHBondContact O-CD 3.4Å; L492-I523 HydrophobicContact CB-CG2 4.34Å; L492-I523 HydrophobicContact CD1-CG2 4.5Å; L492-I523 PolarHBondContact N-O 3.44Å
493	E	94.8	Very high	91.7	Very high	73 Å²	73	42.9 Å²	42.9	34%	0.341	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	151.3	178.9	-60.4	176.1	-148.6	0	0	111.7	K497 I522 I523	E493-K497 CarbonylContact C-O 3.58Å; E493-K497 VanDerWaalsContact CA-O 3.3Å; E493-K497 WeakPolarHBondContact CA-O 3.46Å; E493-I522 WeakPolarHBondContact O-CA 3.4Å; E493-I523 HydrophobicContact CB-CB 3.97Å; E493-I523 HydrophobicContact CB-CD1 4.31Å; E493-I523 HydrophobicContact CB-CG1 4.07Å; E493-I523 HydrophobicContact CG-CB 4.46Å; E493-I523 HydrophobicContact CG-CD1 4.41Å; E493-I523 PolarHBondContact N-O 3.24Å; E493-I523 VanDerWaalsContact N-O 3.1Å; E493-I523 PolarHBondContact O-N 3.47Å
494	W	94.4	Very high	91.9	Very high	6 Å²	6	44 Å²	44	2%	0.023	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	111.9	176.2	-176.8	-77.2	0	0	0	109	L451 L453 V455 V491 G496 K497 L499 I510 I511 S514 V520 I522	L451-W494 HydrophobicContact CD1-CH2 4.12Å; L451-W494 HydrophobicContact CD1-CZ2 4.4Å; L453-W494 HydrophobicContact CD1-CH2 4.02Å; L453-W494 HydrophobicContact CD1-CZ3 3.9Å; L453-W494 HydrophobicContact CD2-CZ3 4.44Å; V455-W494 HydrophobicContact CG2-CZ3 4.02Å; V491-W494 HydrophobicContact CG1-CE3 4.49Å; W494-G496 VanDerWaalsContact C-N 3.25Å; W494-G496 PolarHBondContact O-N 3.18Å; W494-K497 PolarHBondContact N-O 3.04Å; W494-K497 WeakPolarHBondContact O-CB 3.42Å; W494-K497 PolarHBondContact O-N 2.9Å; W494-L499 HydrophobicContact CB-CD1 4.06Å; W494-L499 HydrophobicContact CB-CD2 4.4Å; W494-L499 HydrophobicContact CB-CG 4.3Å; W494-I510 HydrophobicContact CB-CG2 4.06Å; W494-I510 HydrophobicContact CG-CG2 4.04Å; W494-I511 HydrophobicContact CD2-CG1 4.04Å; W494-I511 HydrophobicContact CE3-CG1 4.31Å; W494-I511 HydrophobicContact CH2-CG1 4.2Å; W494-I511 HydrophobicContact CH2-CG2 4.35Å; W494-I511 HydrophobicContact CZ2-CB 4.26Å; W494-I511 HydrophobicContact CZ2-CG1 3.89Å; W494-I511 HydrophobicContact CZ2-CG2 3.96Å; W494-I511 HydrophobicContact CZ3-CG1 4.39Å; W494-S514 VanDerWaalsContact NE1-CB 3.3Å; W494-S514 PolarHBondContact NE1-OG 3.14Å; W494-V520 HydrophobicContact CD2-CG1 4.14Å; W494-V520 HydrophobicContact CH2-CG1 4.31Å; W494-V520 HydrophobicContact CZ2-CG1 3.81Å; W494-I522 HydrophobicContact CD2-CG1 4.45Å; W494-I522 HydrophobicContact CE3-CD1 3.96Å; W494-I522 HydrophobicContact CE3-CG1 3.87Å; W494-I522 HydrophobicContact CE3-CG2 4.07Å; W494-I522 HydrophobicContact CH2-CD1 4.09Å; W494-I522 HydrophobicContact CZ3-CD1 3.54Å; W494-I522 HydrophobicContact CZ3-CG1 3.99Å; W494-I522 HydrophobicContact CZ3-CG2 4.49Å
495	N	92.2	Very high	92	Very high	42 Å²	42	43.9 Å²	43.9	23%	0.225	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	44.4	-169.9	-68.4	-3.1	0	0	0	113	K497 E517 V520 E521	N495-K497 PolarHBondContact O-N 2.75Å; N495-E517 PolarHBondContact ND2-OE1 2.72Å; N495-E517 PolarHBondContact ND2-OE2 2.74Å; N495-V520 VanDerWaalsContact OD1-CA 3.26Å; N495-V520 WeakPolarHBondContact OD1-CA 3.29Å; N495-V520 WeakPolarHBondContact OD1-CG1 3.35Å; N495-E521 PolarHBondContact N-O 2.85Å; N495-E521 PolarHBondContact OD1-N 2.75Å; N495-E521 PolarHBondContact OD1-O 3.13Å
496	G	90.5	Very high	91.9	Very high	53 Å²	53	48.2 Å²	48.2	55%	0.546	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	2.2	-178	0	0	0	0	0	115.4	W494	W494-G496 VanDerWaalsContact C-N 3.25Å; W494-G496 PolarHBondContact O-N 3.18Å
497	K	92.7	Very high	92	Very high	89 Å²	89	42.5 Å²	42.5	39%	0.387	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121.8	170.3	-61	-168.8	175	-169.5	0	109.7	E493 W494 N495 I510 E513	E493-K497 CarbonylContact C-O 3.58Å; E493-K497 VanDerWaalsContact CA-O 3.3Å; E493-K497 WeakPolarHBondContact CA-O 3.46Å; W494-K497 PolarHBondContact N-O 3.04Å; W494-K497 WeakPolarHBondContact O-CB 3.42Å; W494-K497 PolarHBondContact O-N 2.9Å; N495-K497 PolarHBondContact O-N 2.75Å; K497-I510 HydrophobicContact CB-CD1 4.15Å; K497-I510 HydrophobicContact CB-CG2 4.11Å; K497-I510 HydrophobicContact CD-CB 4.48Å; K497-I510 HydrophobicContact CD-CD1 4.26Å; K497-I510 HydrophobicContact CD-CG1 3.83Å; K497-I510 HydrophobicContact CD-CG2 4.04Å; K497-E513 IonicContact NZ-OE1 2.77Å; K497-E513 IonicContact NZ-OE2 3.48Å; K497-E513 PolarHBondContact NZ-OE2 3.27Å
498	P	92	Very high	91.9	Very high	93 Å²	93	42.8 Å²	42.8	60%	0.604	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	140.3	177.4	29.1	-34.4	0	0	0	111.1	L492	L492-P498 WeakPolarHBondContact O-CA 3.16Å
499	L	92.2	Very high	91.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.251	C	S	.	.			trans	-107.3	-21.9	176.7	-54.6	-169.3	0	0	0	115.6	A468 V491 L492 W494 G501 A502 V507 I510	A468-L499 HydrophobicContact CB-CB 3.76Å; A468-L499 HydrophobicContact CB-CD1 3.63Å; A468-L499 HydrophobicContact CB-CG 4.36Å; V491-L499 HydrophobicContact CB-CD1 4.01Å; V491-L499 HydrophobicContact CG1-CD1 3.62Å; V491-L499 HydrophobicContact CG1-CG 4.44Å; L492-L499 PolarHBondContact O-N 3.22Å; W494-L499 HydrophobicContact CB-CD1 4.06Å; W494-L499 HydrophobicContact CB-CD2 4.4Å; W494-L499 HydrophobicContact CB-CG 4.3Å; L499-G501 PolarHBondContact O-N 3.01Å; L499-A502 VanDerWaalsContact O-CB 3.22Å; L499-A502 WeakPolarHBondContact O-CB 3.45Å; L499-A502 PolarHBondContact O-N 2.9Å; L499-V507 HydrophobicContact CB-CG2 4.4Å; L499-V507 HydrophobicContact CD1-CG1 4.33Å; L499-V507 HydrophobicContact CD1-CG2 4.48Å; L499-V507 HydrophobicContact CD2-CG2 4.3Å; L499-I510 HydrophobicContact CD2-CB 4.33Å; L499-I510 HydrophobicContact CD2-CD1 3.53Å; L499-I510 HydrophobicContact CD2-CG2 4.01Å
500	P	90.5	Very high	91.8	Very high	43 Å²	43	44.9 Å²	44.9	28%	0.279	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	127.2	169.9	-29.7	37.3	0	0	0	111.8	L492	L492-P500 HydrophobicContact CD2-CG 3.85Å; L492-P500 WeakPolarHBondContact O-CD 3.4Å
501	G	88.5	Confident	91.6	Very high	47 Å²	47	46.7 Å²	46.7	49%	0.485	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	-17.1	-172.1	0	0	0	0	0	114.7	L466 L499	L466-G501 PolarHBondContact O-N 3.37Å; L499-G501 PolarHBondContact O-N 3.01Å
502	A	88.8	Confident	91.4	Very high	11 Å²	11	49.7 Å²	49.7	9%	0.091	28%	0.281	C	S	.	.			trans	-74.9	142.1	-177	0	0	0	0	0	113.2	L499 E506 V507	L499-A502 VanDerWaalsContact O-CB 3.22Å; L499-A502 WeakPolarHBondContact O-CB 3.45Å; L499-A502 PolarHBondContact O-N 2.9Å; A502-E506 HydrophobicContact CB-CB 4.02Å; A502-V507 HydrophobicContact CB-CG2 3.81Å
503	T	89.8	Confident	91.1	Very high	50 Å²	50	53.3 Å²	53.3	31%	0.307	30%	0.297	S	S	.	.			trans	-64.7	171.5	169.9	58.8	0	0	0	0	112	E505 E506 V507	T503-E505 VanDerWaalsContact C-N 3.3Å; T503-E505 WeakPolarHBondContact CB-OE2 3.29Å; T503-E506 WeakPolarHBondContact CB-OE2 3.43Å; T503-E506 WeakPolarHBondContact CG2-OE2 3.48Å; T503-E506 PolarHBondContact N-OE2 3.31Å; T503-E506 WeakPolarHBondContact OG1-CB 3.43Å; T503-E506 VanDerWaalsContact OG1-CD 3.27Å; T503-E506 VanDerWaalsContact OG1-CG 3.22Å; T503-E506 WeakPolarHBondContact OG1-CG 3.46Å; T503-E506 PolarHBondContact OG1-N 3.38Å; T503-E506 PolarHBondContact OG1-OE2 3.18Å; T503-V507 VanDerWaalsContact O-CG2 3.29Å; T503-V507 WeakPolarHBondContact O-CG2 3.33Å; T503-V507 PolarHBondContact O-N 3.2Å; T503-V507 VanDerWaalsContact O-N 3.15Å
504	N	91.3	Very high	90.8	Very high	24 Å²	24	50.1 Å²	50.1	13%	0.128	28%	0.282	C	S	.	.	H	α-helix	trans	-68.1	-38	176.8	-159.3	-59.8	0	0	0	110.8	S375 G457 V507 Y508	S375-N504 VanDerWaalsContact CB-CG 3.47Å; S375-N504 WeakPolarHBondContact CB-OD1 3.42Å; S375-N504 VanDerWaalsContact OG-CG 3.27Å; S375-N504 PolarHBondContact OG-OD1 3.41Å; S375-N504 VanDerWaalsContact OG-OD1 3.07Å; G457-N504 PolarHBondContact N-ND2 3.25Å; G457-N504 PolarHBondContact O-ND2 3.49Å; N504-V507 PolarHBondContact O-N 3.06Å; N504-Y508 VanDerWaalsContact O-CB 3.28Å; N504-Y508 WeakPolarHBondContact O-CB 3.37Å; N504-Y508 PolarHBondContact O-N 3.15Å
505	E	91.1	Very high	90.3	Very high	105 Å²	105	54.9 Å²	54.9	49%	0.491	30%	0.303	S	S	.	.	H	α-helix	trans	-59.8	-47.6	177.6	-64.2	65.8	-148.5	0	0	110.9	T503 Y508 N509	T503-E505 VanDerWaalsContact C-N 3.3Å; T503-E505 WeakPolarHBondContact CB-OE2 3.29Å; E505-Y508 PolarHBondContact O-N 3.09Å; E505-N509 WeakPolarHBondContact O-CB 3.34Å; E505-N509 PolarHBondContact O-N 2.9Å; E505-N509 PolarHBondContact O-ND2 3.02Å; E505-N509 VanDerWaalsContact O-ND2 3.12Å
506	E	91.6	Very high	89.8	Confident	96 Å²	96	58 Å²	58	45%	0.449	33%	0.328	S	S	.	.	H	α-helix	trans	-64.5	-45.3	175.9	-73.3	164.5	130.4	0	0	112.1	A502 T503 Y508 N509 I510	A502-E506 HydrophobicContact CB-CB 4.02Å; T503-E506 WeakPolarHBondContact CB-OE2 3.43Å; T503-E506 WeakPolarHBondContact CG2-OE2 3.48Å; T503-E506 PolarHBondContact N-OE2 3.31Å; T503-E506 WeakPolarHBondContact OG1-CB 3.43Å; T503-E506 VanDerWaalsContact OG1-CD 3.27Å; T503-E506 VanDerWaalsContact OG1-CG 3.22Å; T503-E506 WeakPolarHBondContact OG1-CG 3.46Å; T503-E506 PolarHBondContact OG1-N 3.38Å; T503-E506 PolarHBondContact OG1-OE2 3.18Å; E506-Y508 VanDerWaalsContact C-N 3.31Å; E506-Y508 PolarHBondContact O-N 3.45Å; E506-N509 PolarHBondContact O-N 3.41Å; E506-I510 WeakPolarHBondContact O-CB 3.32Å; E506-I510 VanDerWaalsContact O-CG1 3.27Å; E506-I510 WeakPolarHBondContact O-CG1 3.5Å; E506-I510 PolarHBondContact O-N 3.36Å
507	V	92.6	Very high	89.5	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-62	-40.3	176.1	171.8	0	0	0	0	111.1	V455 A468 L499 A502 T503 N504 I511	V455-V507 HydrophobicContact CG1-CG1 4.14Å; A468-V507 HydrophobicContact CB-CG1 4.07Å; A468-V507 HydrophobicContact CB-CG2 3.96Å; L499-V507 HydrophobicContact CB-CG2 4.4Å; L499-V507 HydrophobicContact CD1-CG1 4.33Å; L499-V507 HydrophobicContact CD1-CG2 4.48Å; L499-V507 HydrophobicContact CD2-CG2 4.3Å; A502-V507 HydrophobicContact CB-CG2 3.81Å; T503-V507 VanDerWaalsContact O-CG2 3.29Å; T503-V507 WeakPolarHBondContact O-CG2 3.33Å; T503-V507 PolarHBondContact O-N 3.2Å; T503-V507 VanDerWaalsContact O-N 3.15Å; N504-V507 PolarHBondContact O-N 3.06Å; V507-I511 HydrophobicContact CG1-CD1 3.81Å; V507-I511 WeakPolarHBondContact O-CB 3.36Å; V507-I511 WeakPolarHBondContact O-CD1 3.41Å; V507-I511 VanDerWaalsContact O-CG1 3.25Å; V507-I511 WeakPolarHBondContact O-CG1 3.32Å; V507-I511 PolarHBondContact O-N 2.75Å; V507-I511 VanDerWaalsContact O-N 3.12Å
508	Y	88.8	Confident	89.1	Confident	69 Å²	69	57.6 Å²	57.6	27%	0.271	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-46.2	175.1	179.4	-99	0	0	0	111.4	T376 N504 E505 E506 I511 L512	T376-Y508 VanDerWaalsContact CB-CD2 3.49Å; T376-Y508 HydrophobicContact CG2-CD1 4.45Å; T376-Y508 HydrophobicContact CG2-CD2 3.69Å; T376-Y508 HydrophobicContact CG2-CE2 3.9Å; T376-Y508 HydrophobicContact CG2-CG 3.99Å; T376-Y508 WeakPolarHBondContact OG1-CD2 3.3Å; N504-Y508 VanDerWaalsContact O-CB 3.28Å; N504-Y508 WeakPolarHBondContact O-CB 3.37Å; N504-Y508 PolarHBondContact O-N 3.15Å; E505-Y508 PolarHBondContact O-N 3.09Å; E506-Y508 VanDerWaalsContact C-N 3.31Å; E506-Y508 PolarHBondContact O-N 3.45Å; Y508-I511 PolarHBondContact O-N 2.84Å; Y508-L512 HydrophobicContact CE1-CD2 3.91Å; Y508-L512 WeakPolarHBondContact O-CB 3.48Å; Y508-L512 PolarHBondContact O-N 2.78Å
509	N	90.8	Very high	88.9	Confident	79 Å²	79	57.5 Å²	57.5	42%	0.422	31%	0.31	S	S	.	.	H	α-helix	trans	-62.7	-45	178.9	-71.3	-26.8	0	0	0	111.9	E505 E506 I511 L512 E513	E505-N509 WeakPolarHBondContact O-CB 3.34Å; E505-N509 PolarHBondContact O-N 2.9Å; E505-N509 PolarHBondContact O-ND2 3.02Å; E505-N509 VanDerWaalsContact O-ND2 3.12Å; E506-N509 PolarHBondContact O-N 3.41Å; N509-I511 VanDerWaalsContact C-N 3.35Å; N509-I511 PolarHBondContact O-N 2.88Å; N509-L512 WeakPolarHBondContact O-CB 3.38Å; N509-L512 PolarHBondContact O-N 3.42Å; N509-L512 VanDerWaalsContact O-N 3.12Å; N509-E513 WeakPolarHBondContact O-CG 3.33Å; N509-E513 PolarHBondContact O-N 3.18Å
510	I	92	Very high	88.9	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.118	31%	0.31	C	S	.	.	H	α-helix	trans	-61.3	-42.1	177.7	-69.3	167	0	0	0	111.6	W494 K497 L499 E506 L512 S514	W494-I510 HydrophobicContact CB-CG2 4.06Å; W494-I510 HydrophobicContact CG-CG2 4.04Å; K497-I510 HydrophobicContact CB-CD1 4.15Å; K497-I510 HydrophobicContact CB-CG2 4.11Å; K497-I510 HydrophobicContact CD-CB 4.48Å; K497-I510 HydrophobicContact CD-CD1 4.26Å; K497-I510 HydrophobicContact CD-CG1 3.83Å; K497-I510 HydrophobicContact CD-CG2 4.04Å; L499-I510 HydrophobicContact CD2-CB 4.33Å; L499-I510 HydrophobicContact CD2-CD1 3.53Å; L499-I510 HydrophobicContact CD2-CG2 4.01Å; E506-I510 WeakPolarHBondContact O-CB 3.32Å; E506-I510 VanDerWaalsContact O-CG1 3.27Å; E506-I510 WeakPolarHBondContact O-CG1 3.5Å; E506-I510 PolarHBondContact O-N 3.36Å; I510-L512 VanDerWaalsContact C-N 3.35Å; I510-S514 PolarHBondContact O-N 3.37Å
511	I	91	Very high	89	Confident	43 Å²	43	59 Å²	59	22%	0.221	31%	0.314	C	S	.	.	H	α-helix	trans	-70.7	-32.2	176	-65.9	168.5	0	0	0	111.4	V455 W494 V507 Y508 N509 S514	V455-I511 HydrophobicContact CB-CD1 3.66Å; V455-I511 HydrophobicContact CG1-CD1 4.24Å; V455-I511 HydrophobicContact CG2-CD1 3.78Å; W494-I511 HydrophobicContact CD2-CG1 4.04Å; W494-I511 HydrophobicContact CE3-CG1 4.31Å; W494-I511 HydrophobicContact CH2-CG1 4.2Å; W494-I511 HydrophobicContact CH2-CG2 4.35Å; W494-I511 HydrophobicContact CZ2-CB 4.26Å; W494-I511 HydrophobicContact CZ2-CG1 3.89Å; W494-I511 HydrophobicContact CZ2-CG2 3.96Å; W494-I511 HydrophobicContact CZ3-CG1 4.39Å; V507-I511 HydrophobicContact CG1-CD1 3.81Å; V507-I511 WeakPolarHBondContact O-CB 3.36Å; V507-I511 WeakPolarHBondContact O-CD1 3.41Å; V507-I511 VanDerWaalsContact O-CG1 3.25Å; V507-I511 WeakPolarHBondContact O-CG1 3.32Å; V507-I511 PolarHBondContact O-N 2.75Å; V507-I511 VanDerWaalsContact O-N 3.12Å; Y508-I511 PolarHBondContact O-N 2.84Å; N509-I511 VanDerWaalsContact C-N 3.35Å; N509-I511 PolarHBondContact O-N 2.88Å; I511-S514 PolarHBondContact O-OG 3.27Å
512	L	89.5	Confident	89.3	Confident	64 Å²	64	56.8 Å²	56.8	34%	0.335	29%	0.291	S	S	.	.	H	α-helix	trans	-69.2	-46.2	178.6	178.5	60.9	0	0	0	111.9	Y508 N509 I510 K515	Y508-L512 HydrophobicContact CE1-CD2 3.91Å; Y508-L512 WeakPolarHBondContact O-CB 3.48Å; Y508-L512 PolarHBondContact O-N 2.78Å; N509-L512 WeakPolarHBondContact O-CB 3.38Å; N509-L512 PolarHBondContact O-N 3.42Å; N509-L512 VanDerWaalsContact O-N 3.12Å; I510-L512 VanDerWaalsContact C-N 3.35Å; L512-K515 HydrophobicContact CD1-CD 3.91Å; L512-K515 WeakPolarHBondContact O-CB 3.42Å; L512-K515 WeakPolarHBondContact O-CG 3.43Å; L512-K515 PolarHBondContact O-N 3.43Å
513	E	88.4	Confident	89.6	Confident	108 Å²	108	56.9 Å²	56.9	51%	0.505	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-48.2	175.6	-71.7	171.1	171.7	0	0	111.5	K497 N509 K515 S516	K497-E513 IonicContact NZ-OE1 2.77Å; K497-E513 IonicContact NZ-OE2 3.48Å; K497-E513 PolarHBondContact NZ-OE2 3.27Å; N509-E513 WeakPolarHBondContact O-CG 3.33Å; N509-E513 PolarHBondContact O-N 3.18Å; E513-K515 PolarHBondContact O-N 2.68Å; E513-S516 PolarHBondContact O-N 2.92Å; E513-S516 PolarHBondContact O-OG 3Å
514	S	87.8	Confident	89.8	Confident	5 Å²	5	54.5 Å²	54.5	4%	0.035	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-66.3	-9.2	-176.6	88.4	0	0	0	0	114	K439 W494 I510 I511 S516 E517	K439-S514 PolarHBondContact NZ-O 2.81Å; W494-S514 VanDerWaalsContact NE1-CB 3.3Å; W494-S514 PolarHBondContact NE1-OG 3.14Å; I510-S514 PolarHBondContact O-N 3.37Å; I511-S514 PolarHBondContact O-OG 3.27Å; S514-S516 PolarHBondContact O-N 2.97Å; S514-E517 PolarHBondContact O-N 3.07Å; S514-E517 VanDerWaalsContact O-N 3.16Å
515	K	83.9	Confident	89.9	Confident	106 Å²	106	53.6 Å²	53.6	46%	0.461	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-53.3	-37.3	176	-73.4	-176.2	-173	169.9	0	111.9	K439 L512 E513	K439-K515 PolarHBondContact NZ-O 3.44Å; L512-K515 HydrophobicContact CD1-CD 3.91Å; L512-K515 WeakPolarHBondContact O-CB 3.42Å; L512-K515 WeakPolarHBondContact O-CG 3.43Å; L512-K515 PolarHBondContact O-N 3.43Å; E513-K515 PolarHBondContact O-N 2.68Å
516	S	81.7	Confident	89.9	Confident	107 Å²	107	49.6 Å²	49.6	75%	0.748	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-64.6	-33.7	-179.3	61.3	0	0	0	0	114.3	E513 S514	E513-S516 PolarHBondContact O-N 2.92Å; E513-S516 PolarHBondContact O-OG 3Å; S514-S516 PolarHBondContact O-N 2.97Å
517	E	83.9	Confident	89.6	Confident	79 Å²	79	48.1 Å²	48.1	37%	0.369	25%	0.249	S	C	.	.	S	Bend	trans	-71.7	143.4	-172.1	-65.1	177.6	-115.8	0	0	112.4	K439 N495 S514 Q519	K439-E517 WeakPolarHBondContact CD-O 3.27Å; K439-E517 WeakPolarHBondContact CE-O 3.1Å; K439-E517 PolarHBondContact NZ-O 2.86Å; N495-E517 PolarHBondContact ND2-OE1 2.72Å; N495-E517 PolarHBondContact ND2-OE2 2.74Å; S514-E517 PolarHBondContact O-N 3.07Å; S514-E517 VanDerWaalsContact O-N 3.16Å; E517-Q519 WeakPolarHBondContact CB-O 3.2Å; E517-Q519 PolarHBondContact O-N 3.49Å
518	P	84.4	Confident	88.8	Confident	56 Å²	56	48.9 Å²	48.9	36%	0.364	25%	0.253	S	S	.	.	S	Bend	trans	-72.6	-16	-179.1	31.7	-36.7	0	0	0	113.6	N438 K439 R440	N438-P518 PolarHBondContact OD1-O 2.97Å; K439-P518 WeakPolarHBondContact CB-O 3.14Å; K439-P518 PolarHBondContact N-O 3.18Å; R440-P518 HydrophobicContact CG-CB 4.32Å
519	Q	87.9	Confident	87.5	Confident	91 Å²	91	48.8 Å²	48.8	43%	0.425	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.8	-170.6	-179.8	173.1	-14	0	0	106.8	I436 L437 E517	I436-Q519 HydrophobicContact CG2-CG 3.85Å; L437-Q519 WeakPolarHBondContact O-CA 3.47Å; E517-Q519 WeakPolarHBondContact CB-O 3.2Å; E517-Q519 PolarHBondContact O-N 3.49Å
520	V	91.8	Very high	85.7	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.4	174.7	179.2	0	0	0	0	107.6	L437 L451 W494 N495 I522	L437-V520 PolarHBondContact N-O 3.38Å; L437-V520 PolarHBondContact O-N 2.88Å; L451-V520 HydrophobicContact CD1-CB 4.28Å; L451-V520 HydrophobicContact CD1-CG2 4.16Å; W494-V520 HydrophobicContact CD2-CG1 4.14Å; W494-V520 HydrophobicContact CH2-CG1 4.31Å; W494-V520 HydrophobicContact CZ2-CG1 3.81Å; N495-V520 VanDerWaalsContact OD1-CA 3.26Å; N495-V520 WeakPolarHBondContact OD1-CA 3.29Å; N495-V520 WeakPolarHBondContact OD1-CG1 3.35Å; V520-I522 HydrophobicContact CG1-CD1 4.21Å; V520-I522 HydrophobicContact CG1-CG1 3.73Å
521	E	94.2	Very high	83.6	Confident	75 Å²	75	52.7 Å²	52.7	35%	0.35	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.8	169.7	-176.7	165.9	-168.9	0	0	108.7	V435 I436 N495	V435-E521 CarbonylContact O-C 3.52Å; V435-E521 WeakPolarHBondContact O-CA 3.19Å; I436-E521 HydrophobicContact CG1-CG 4.18Å; N495-E521 PolarHBondContact N-O 2.85Å; N495-E521 PolarHBondContact OD1-N 2.75Å; N495-E521 PolarHBondContact OD1-O 3.13Å
522	I	94.7	Very high	81.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.9	-177.3	-48.7	175.3	0	0	0	106.6	V435 L437 L453 L485 V491 E493 W494 V520 V524	V435-I522 PolarHBondContact N-O 3.21Å; V435-I522 PolarHBondContact O-N 3.16Å; L437-I522 HydrophobicContact CD1-CD1 3.97Å; L453-I522 HydrophobicContact CD2-CD1 3.69Å; L485-I522 HydrophobicContact CD1-CD1 4.19Å; V491-I522 HydrophobicContact CG1-CG2 3.68Å; E493-I522 WeakPolarHBondContact O-CA 3.4Å; W494-I522 HydrophobicContact CD2-CG1 4.45Å; W494-I522 HydrophobicContact CE3-CD1 3.96Å; W494-I522 HydrophobicContact CE3-CG1 3.87Å; W494-I522 HydrophobicContact CE3-CG2 4.07Å; W494-I522 HydrophobicContact CH2-CD1 4.09Å; W494-I522 HydrophobicContact CZ3-CD1 3.54Å; W494-I522 HydrophobicContact CZ3-CG1 3.99Å; W494-I522 HydrophobicContact CZ3-CG2 4.49Å; V520-I522 HydrophobicContact CG1-CD1 4.21Å; V520-I522 HydrophobicContact CG1-CG1 3.73Å; I522-V524 HydrophobicContact CG2-CG1 3.8Å
523	I	94.9	Very high	78.6	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.062	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.2	168.1	-51.4	-169.5	0	0	0	107.6	I432 G433 R434 L492 E493	I432-I523 HydrophobicContact CG2-CG2 3.48Å; I432-I523 VanDerWaalsContact CG2-CG2 3.48Å; G433-I523 CarbonylContact O-C 3.5Å; G433-I523 WeakPolarHBondContact O-CA 3.41Å; R434-I523 HydrophobicContact CG-CD1 4.02Å; R434-I523 HydrophobicContact CG-CG1 4.04Å; R434-I523 HydrophobicContact CG-CG2 4.4Å; L492-I523 HydrophobicContact CB-CG2 4.34Å; L492-I523 HydrophobicContact CD1-CG2 4.5Å; L492-I523 PolarHBondContact N-O 3.44Å; E493-I523 HydrophobicContact CB-CB 3.97Å; E493-I523 HydrophobicContact CB-CD1 4.31Å; E493-I523 HydrophobicContact CB-CG1 4.07Å; E493-I523 HydrophobicContact CG-CB 4.46Å; E493-I523 HydrophobicContact CG-CD1 4.41Å; E493-I523 PolarHBondContact N-O 3.24Å; E493-I523 VanDerWaalsContact N-O 3.1Å; E493-I523 PolarHBondContact O-N 3.47Å
524	V	94.6	Very high	76.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	161.6	179.2	-65.3	0	0	0	0	111.2	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 4.34Å; W422-V524 HydrophobicContact CZ3-CG2 3.93Å; I432-V524 CarbonylContact C-O 3.53Å; I432-V524 VanDerWaalsContact CA-O 3.3Å; I432-V524 WeakPolarHBondContact CA-O 2.94Å; G433-V524 PolarHBondContact N-O 2.86Å; G433-V524 WeakPolarHBondContact O-CG2 3.39Å; G433-V524 PolarHBondContact O-N 2.89Å; I470-V524 HydrophobicContact CD1-CG1 4.16Å; L485-V524 HydrophobicContact CD2-CB 4.46Å; L485-V524 HydrophobicContact CD2-CG1 3.85Å; L485-V524 HydrophobicContact CD2-CG2 3.8Å; D489-V524 HydrophobicContact CB-CB 4.18Å; D489-V524 HydrophobicContact CB-CG1 4.34Å; E490-V524 CarbonylContact O-C 3.5Å; E490-V524 VanDerWaalsContact O-CA 3.25Å; E490-V524 WeakPolarHBondContact O-CA 3.37Å; V491-V524 HydrophobicContact CG2-CG1 4.17Å; I522-V524 HydrophobicContact CG2-CG1 3.8Å
525	S	92.7	Very high	73.7	Confident	5 Å²	5	67.1 Å²	67.1	4%	0.035	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	147.3	166.3	73	0	0	0	0	112.8	L431 E490	L431-S525 VanDerWaalsContact O-CA 3.22Å; L431-S525 WeakPolarHBondContact O-CA 3.38Å; E490-S525 PolarHBondContact N-O 2.93Å; E490-S525 PolarHBondContact O-N 3.03Å
526	R	91.7	Very high	71.3	Confident	22 Å²	22	69.7 Å²	69.7	8%	0.083	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	152.2	175.3	60.3	174.6	64.2	141.1	-0.2	110	W422 R430 L431 H484 D489	W422-R526 HydrophobicContact CH2-CG 4.44Å; W422-R526 VanDerWaalsContact CZ2-CZ 3.48Å; W422-R526 VanDerWaalsContact CZ2-NH1 3.27Å; W422-R526 HydrophobicContact CZ3-CG 3.92Å; R430-R526 CarbonylContact C-O 3.56Å; R430-R526 WeakPolarHBondContact CA-O 3.27Å; R430-R526 WeakPolarHBondContact CB-O 3.39Å; L431-R526 HydrophobicContact CB-CG 4.33Å; L431-R526 PolarHBondContact N-O 3.31Å; L431-R526 PolarHBondContact O-N 3.45Å; H484-R526 PolarHBondContact O-NH2 2.95Å; D489-R526 VanDerWaalsContact CG-NH2 3.3Å; D489-R526 IonicContact OD1-CZ 3.43Å; D489-R526 VanDerWaalsContact OD1-CZ 3.3Å; D489-R526 IonicContact OD1-NE 3.06Å; D489-R526 PolarHBondContact OD1-NE 2.9Å; D489-R526 IonicContact OD1-NH2 2.71Å; D489-R526 PolarHBondContact OD1-NH2 2.8Å; D489-R526 IonicContact OD2-CZ 2.79Å; D489-R526 IonicContact OD2-NE 3.38Å; D489-R526 IonicContact OD2-NH2 2.85Å; D489-R526 PolarHBondContact OD2-NH2 3.33Å
527	P	85.3	Confident	68.8	Low	64 Å²	64	70 Å²	70	42%	0.416	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	148.3	179.5	27.6	-34.9	0	0	0	112.2	G529	P527-G529 PolarHBondContact O-N 2.88Å
528	I	74.2	Confident	66.3	Low	19 Å²	19	71.3 Å²	71.3	10%	0.097	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-71.3	-8.9	176.3	-83.6	165.5	0	0	0	112.7	P424 G428 D429 R430 L431 D530 R533	P424-I528 HydrophobicContact CB-CD1 4.38Å; G428-I528 WeakPolarHBondContact O-CD1 3.22Å; D429-I528 WeakPolarHBondContact O-CB 2.82Å; D429-I528 PolarHBondContact O-N 3.36Å; R430-I528 WeakPolarHBondContact O-CD1 3.46Å; L431-I528 HydrophobicContact CD1-CB 4.37Å; L431-I528 HydrophobicContact CD1-CG1 3.51Å; L431-I528 HydrophobicContact CG-CD1 4.27Å; L431-I528 HydrophobicContact CG-CG1 3.62Å; I528-D530 PolarHBondContact O-N 3.05Å; I528-R533 HydrophobicContact CG2-CG 4.22Å
529	G	62.6	Low	63.8	Low	67 Å²	67	76.6 Å²	76.6	69%	0.691	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-62.9	-22.9	175	0	0	0	0	0	114.9	P527	P527-G529 PolarHBondContact O-N 2.88Å
530	D	52.6	Low	61.2	Low	105 Å²	105	78 Å²	78	56%	0.561	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-95.4	12.5	-173.5	-55.1	-30.2	0	0	0	113.6	I528	I528-D530 PolarHBondContact O-N 3.05Å
531	I	47.9	Very low	58.6	Low	78 Å²	78	83.9 Å²	83.9	40%	0.4	48%	0.479	S	S	.	.	S	Bend	trans	-133.9	133	172.8	-56.7	-167.2	0	0	0	109.1	L431 R533	L431-I531 HydrophobicContact CD1-CB 4.47Å; L431-I531 HydrophobicContact CD1-CD1 3.56Å; L431-I531 HydrophobicContact CD1-CG1 3.98Å; L431-I531 HydrophobicContact CD2-CD1 4.27Å; I531-R533 PolarHBondContact O-N 2.92Å; I531-R533 VanDerWaalsContact O-N 3.14Å
532	P	40.7	Very low	55.6	Low	80 Å²	80	87.9 Å²	87.9	52%	0.519	50%	0.502	S	S	.	.			trans	-57.1	119.8	171.7	-23.8	34.4	0	0	0	110.2	I534	P532-I534 PolarHBondContact O-N 3.33Å
533	R	35.5	Very low	52.7	Low	183 Å²	183	95.6 Å²	95.6	69%	0.691	54%	0.538	S	S	*	.			trans	-65.4	103	-180	-78.5	-171	171.5	102.9	-4.1	110.2	I528 I531 P535	I528-R533 HydrophobicContact CG2-CG 4.22Å; I531-R533 PolarHBondContact O-N 2.92Å; I531-R533 VanDerWaalsContact O-N 3.14Å; R533-P535 VanDerWaalsContact O-CD 3.27Å; R533-P535 WeakPolarHBondContact O-CD 3.36Å
534	I	36	Very low	49.7	Very low	137 Å²	137	99.7 Å²	99.7	70%	0.703	57%	0.567	S	S	*	*			trans	-62.1	122	152.9	-58.5	175.4	0	0	0	106.1	P532 E536	P532-I534 PolarHBondContact O-N 3.33Å; I534-E536 VanDerWaalsContact C-N 3.29Å; I534-E536 HydrophobicContact CG2-CG 4.29Å; I534-E536 PolarHBondContact O-N 3.3Å
535	P	36.7	Very low	46.8	Very low	124 Å²	124	102.5 Å²	102.5	81%	0.805	59%	0.587	S	S	*	*			trans	-74	85.4	175.1	-15.3	32	0	0	0	109.3	R533	R533-P535 VanDerWaalsContact O-CD 3.27Å; R533-P535 WeakPolarHBondContact O-CD 3.36Å
536	E	33	Very low	44	Very low	159 Å²	159	105.2 Å²	105.2	74%	0.743	61%	0.606	S	S	*	*			trans	-65.9	140.8	176.2	-71.9	-161.7	144.8	0	0	111.5	I534 S538	I534-E536 VanDerWaalsContact C-N 3.29Å; I534-E536 HydrophobicContact CG2-CG 4.29Å; I534-E536 PolarHBondContact O-N 3.3Å; E536-S538 PolarHBondContact O-N 3.08Å
537	S	29.5	Very low	41.3	Very low	113 Å²	113	106.1 Å²	106.1	79%	0.79	62%	0.616	S	S	*	*			trans	-59.4	125.1	-167.9	51.2	0	0	0	0	114.7
538	S	31.5	Very low	38.9	Very low	108 Å²	108	107.3 Å²	107.3	76%	0.755	63%	0.626	S	S	*	*			trans	-128	88.4	161.7	66.2	0	0	0	0	111.3	E536	E536-S538 PolarHBondContact O-N 3.08Å
539	H	32.3	Very low	36.9	Very low	167 Å²	167	112.7 Å²	112.7	77%	0.773	65%	0.649	S	S	*	*			trans	29	119.6	156.8	-52.3	-74.4	0	0	0	120.2
540	P	32.9	Very low	35.7	Very low	120 Å²	120	115.4 Å²	115.4	78%	0.779	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-82.7	140.6	175.4	33.9	-33.8	0	0	0	113
541	P	37.1	Very low	35.2	Very low	124 Å²	124	112.3 Å²	112.3	81%	0.805	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-72.3	144.7	148.4	-13.6	30.6	0	0	0	110.4
542	L	31.7	Very low	34.7	Very low	158 Å²	158	113.8 Å²	113.8	83%	0.827	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-68.9	147.9	-179.5	-58.9	163.5	0	0	0	112.1
543	E	34	Very low	34.5	Very low	163 Å²	163	118 Å²	118	76%	0.762	65%	0.646	S	S	*	*				164.2	101.7	126.5	-87.7	-56.9	120	0	0	112.4
544	S	32.1	Very low	34.5	Very low	97 Å²	97	114.7 Å²	114.7	68%	0.678	64%	0.639	S	S	*	*			trans	66.3	92.9	137.5	-56.8	0	0	0	0	123.4
545	S	33.3	Very low	34.5	Very low	60 Å²	60	116.3 Å²	116.3	42%	0.42	64%	0.644	S	S	.	*			trans	73.4	163.5	144.7	-101.2	0	0	0	0	122.1	T873	S545-T873 PolarHBondContact OG-OG1 3.29Å
546	S	33.8	Very low	34.7	Very low	61 Å²	61	121.3 Å²	121.3	43%	0.427	65%	0.647	S	S	.	*			cis	-172.4	-100	-36.3	51.8	0	0	0	0	117.3	H871 M872	S546-H871 PolarHBondContact N-CD2 3.49Å; S546-H871 VanDerWaalsContact N-CD2 3.31Å; S546-H871 PolarHBondContact N-NE2 3.46Å; S546-H871 WeakPolarHBondContact OG-CA 3.21Å; S546-H871 VanDerWaalsContact OG-CB 3.31Å; S546-H871 WeakPolarHBondContact OG-CB 3.35Å; S546-H871 PolarHBondContact OG-CD2 2.88Å; S546-M872 WeakPolarHBondContact OG-CA 3.3Å; S546-M872 PolarHBondContact OG-N 2.84Å
547	S	34.6	Very low	35	Very low	41 Å²	41	119.6 Å²	119.6	29%	0.287	65%	0.649	S	S	.	*			trans	-126.5	143.3	-146.3	68.9	0	0	0	0	121.6	C869 L870 H871 M872	S547-C869 CarbonylContact O-C 3.27Å; S547-L870 CarbonylContact O-C 3.12Å; S547-L870 WeakPolarHBondContact O-CA 3.05Å; S547-L870 PolarHBondContact O-N 2.9Å; S547-H871 PolarHBondContact N-CD2 3.07Å; S547-H871 PolarHBondContact O-N 3.31Å; S547-H871 VanDerWaalsContact OG-C 3.25Å; S547-H871 WeakPolarHBondContact OG-CA 3.29Å; S547-H871 PolarHBondContact OG-N 2.8Å; S547-M872 WeakPolarHBondContact CB-O 3.45Å; S547-M872 PolarHBondContact OG-N 2.84Å; S547-M872 PolarHBondContact OG-O 3.1Å
548	S	35.5	Very low	35	Very low	90 Å²	90	119.2 Å²	119.2	63%	0.629	65%	0.647	S	S	*	*				38.2	131.9	129.3	-159.9	0	0	0	0	121.7	C869	S548-C869 CarbonylContact C-O 2.95Å; S548-C869 VanDerWaalsContact C-O 3.32Å; S548-C869 VanDerWaalsContact O-O 3.04Å
549	F	32.6	Very low	35.1	Very low	132 Å²	132	122.6 Å²	122.6	58%	0.579	65%	0.654	S	S	*	*				-176.7	114.3	60.4	178.7	-93.4	0	0	0	113.3	A867 C869	F549-A867 CarbonylContact C-O 3.36Å; F549-A867 VanDerWaalsContact C-O 3.27Å; F549-C869 PolarHBondContact N-O 2.99Å
550	E	36.9	Very low	35.1	Very low	123 Å²	123	119.3 Å²	119.3	58%	0.575	65%	0.65	S	S	*	*				69.5	138.1	106.4	-116.2	-150.3	106.1	0	0	117	A867	E550-A867 CarbonylContact C-O 3.57Å; E550-A867 VanDerWaalsContact CA-O 3.32Å; E550-A867 WeakPolarHBondContact CA-O 3.45Å; E550-A867 PolarHBondContact N-O 2.9Å
551	S	42.6	Very low	35.1	Very low	40 Å²	40	120.2 Å²	120.2	28%	0.28	65%	0.653	S	S	.	*			cis	-175.1	152	20.1	-160.7	0	0	0	0	115.1	R865 S866	S551-R865 CarbonylContact O-C 3.51Å; S551-R865 VanDerWaalsContact O-O 3.11Å; S551-S866 VanDerWaalsContact C-N 3.35Å; S551-S866 WeakPolarHBondContact O-CA 3Å; S551-S866 PolarHBondContact O-N 2.98Å
552	Q	36.2	Very low	35	Very low	110 Å²	110	121.8 Å²	121.8	51%	0.514	65%	0.653	S	S	.	*			trans	100.9	116.2	155.5	-54.9	-179.5	7.7	0	0	124.4	G864 R865 S866	Q552-G864 PolarHBondContact OE1-O 3.47Å; Q552-R865 CarbonylContact O-C 3.35Å; Q552-R865 WeakPolarHBondContact O-CA 3.18Å; Q552-R865 PolarHBondContact O-N 2.74Å; Q552-S866 PolarHBondContact O-N 3.12Å
553	K	36.7	Very low	35	Very low	169 Å²	169	119.4 Å²	119.4	74%	0.735	65%	0.649	S	S	*	*				66	139.2	120.7	-148.4	175.5	-174	168	0	124.4
554	M	34.7	Very low	35.2	Very low	113 Å²	113	117 Å²	117	56%	0.557	65%	0.648	S	S	*	*			trans	81.8	135.4	170.8	-63.2	-172.9	-178.4	0	0	117.4	K862	M554-K862 HydrophobicContact CE-CD 4.19Å; M554-K862 HydrophobicContact CE-CG 4.5Å
555	E	36.3	Very low	35.1	Very low	171 Å²	171	118.5 Å²	118.5	80%	0.799	65%	0.653	S	S	*	*			cis	-154.8	169.5	-20.9	-158.2	163.2	128	0	0	109.4
556	R	42.4	Very low	35.1	Very low	229 Å²	229	121.3 Å²	121.3	86%	0.864	67%	0.673	S	S	*	*			trans	-65.8	153.6	-170.6	-137.9	175.6	-172.3	159.7	0.8	113.1
557	P	37.9	Very low	35.2	Very low	123 Å²	123	125 Å²	125	80%	0.799	70%	0.696	S	S	*	*				-138.3	173.6	103.3	39.2	-28.9	0	0	0	114.9
558	S	30	Very low	35.1	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	72%	0.718	S	S	*	*			trans	-82.9	152.7	177.5	49.3	0	0	0	0	113.9
559	I	33.4	Very low	35.1	Very low	178 Å²	178	127.2 Å²	127.2	91%	0.913	73%	0.729	S	S	*	*			trans	-141.1	161.3	155.2	-113.8	170.1	0	0	0	109.8
560	S	31.8	Very low	35.3	Very low	99 Å²	99	129.1 Å²	129.1	69%	0.692	74%	0.744	S	S	*	*			trans	-145.6	132.7	-158.1	57.9	0	0	0	0	115.2
561	V	33.6	Very low	35.4	Very low	139 Å²	139	132 Å²	132	84%	0.842	76%	0.755	S	S	*	*			trans	71.1	157.9	159.6	-172.7	0	0	0	0	116.3
562	I	35.6	Very low	35.4	Very low	157 Å²	157	138.4 Å²	138.4	81%	0.805	79%	0.786	S	S	*	*			trans	79.7	126.8	-171.5	-56	178.9	0	0	0	112
563	S	30	Very low	35.8	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	79%	0.792	S	S	*	*			cis	-148.8	169.4	-4.4	-123.1	0	0	0	0	111.7
564	P	38.6	Very low	36.4	Very low	112 Å²	112	133.3 Å²	133.3	73%	0.727	79%	0.786	S	S	*	*			trans	-97.1	173.3	-170.9	38.2	-35.9	0	0	0	115.8
565	T	31.3	Very low	37.3	Very low	129 Å²	129	133.8 Å²	133.8	79%	0.791	79%	0.787	S	S	*	*			trans	97.2	76.2	162.6	-34.2	0	0	0	0	117.5
566	S	31.6	Very low	38.4	Very low	120 Å²	120	129.6 Å²	129.6	84%	0.839	77%	0.773	S	S	*	*			trans	-162.5	116.5	152.3	-80.8	0	0	0	0	110.1
567	P	37	Very low	39.8	Very low	138 Å²	138	120.7 Å²	120.7	90%	0.896	74%	0.743	S	S	*	*			trans	-99.8	125.1	-177.6	34.4	-29.6	0	0	0	112.8
568	G	32.1	Very low	41.8	Very low	74 Å²	74	118.8 Å²	118.8	76%	0.763	73%	0.73	S	S	*	*			trans	-177.5	136.8	172.9	0	0	0	0	0	117.1
569	A	35.4	Very low	44.6	Very low	103 Å²	103	114 Å²	114	85%	0.851	70%	0.697	S	S	*	*			trans	59.8	46.1	144.1	0	0	0	0	0	121.4
570	L	37.6	Very low	47.5	Very low	172 Å²	172	108.5 Å²	108.5	90%	0.901	67%	0.667	S	S	*	*			trans	-140	119.1	144.5	-78.6	-177.8	0	0	0	110.5
571	K	39.6	Very low	50.6	Low	183 Å²	183	103.8 Å²	103.8	80%	0.796	63%	0.634	S	S	*	*			trans	-148.3	76.6	176	-82.9	-169.1	172.1	-172.4	0	109.9
572	D	42.6	Very low	53.6	Low	176 Å²	176	97.3 Å²	97.3	94%	0.941	60%	0.596	S	S	*	*			trans	-151.4	30.2	175.9	-109.2	-30.1	0	0	0	113
573	A	44.4	Very low	56.5	Low	78 Å²	78	89.9 Å²	89.9	65%	0.645	56%	0.557	S	S	*	*	S	Bend	trans	-116.9	137.4	165.1	0	0	0	0	0	108.1	Q575	A573-Q575 PolarHBondContact O-N 2.83Å
574	P	49.6	Very low	59.7	Low	94 Å²	94	86.6 Å²	86.6	61%	0.61	53%	0.53	S	S	*	.			trans	-57.5	126.6	177.8	23.5	-33	0	0	0	109.2	V576	P574-V576 VanDerWaalsContact C-N 3.32Å; P574-V576 PolarHBondContact O-N 3.11Å
575	Q	53.7	Low	62.5	Low	122 Å²	122	81.3 Å²	81.3	57%	0.57	50%	0.495	S	S	*	.			trans	-73.9	91.8	-177.8	-67.6	-169.3	15.1	0	0	108.9	A573 L577 T704	A573-Q575 PolarHBondContact O-N 2.83Å; Q575-L577 PolarHBondContact O-N 3.41Å; Q575-L577 VanDerWaalsContact O-N 3.13Å; Q575-T704 HydrophobicContact CB-CG2 4.35Å; Q575-T704 PolarHBondContact O-OG1 2.89Å
576	V	57.7	Low	65.5	Low	83 Å²	83	78.5 Å²	78.5	50%	0.503	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	113.3	169.5	179.9	0	0	0	0	107.5	P574 K701	P574-V576 VanDerWaalsContact C-N 3.32Å; P574-V576 PolarHBondContact O-N 3.11Å; V576-K701 HydrophobicContact CG1-CB 4.08Å; V576-K701 HydrophobicContact CG1-CD 4.04Å
577	L	73.5	Confident	68.6	Low	43 Å²	43	74.8 Å²	74.8	23%	0.225	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	149.1	177.6	-67.9	175.4	0	0	0	109.2	Q575 G579 L681 L702 Q703 T704	Q575-L577 PolarHBondContact O-N 3.41Å; Q575-L577 VanDerWaalsContact O-N 3.13Å; L577-G579 PolarHBondContact O-N 3.04Å; L577-G579 VanDerWaalsContact O-N 3.15Å; L577-L681 WeakPolarHBondContact CD1-O 3.43Å; L577-L702 HydrophobicContact CB-CB 4.28Å; L577-L702 PolarHBondContact N-O 3.09Å; L577-Q703 WeakPolarHBondContact CD1-O 3.48Å; L577-T704 HydrophobicContact CD1-CG2 4.13Å; L577-T704 HydrophobicContact CD2-CG2 3.8Å; L577-T704 HydrophobicContact CG-CG2 3.96Å
578	P	78.1	Confident	71.3	Confident	83 Å²	83	70.5 Å²	70.5	54%	0.539	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	120.3	165.8	25.4	-29.6	0	0	0	108.2	D603 P605	P578-D603 CarbonylContact C-O 3.32Å; P578-P605 HydrophobicContact CG-CG 4.21Å; P578-P605 VanDerWaalsContact O-CD 3.26Å; P578-P605 WeakPolarHBondContact O-CD 3.46Å; P578-P605 WeakPolarHBondContact O-CG 3.24Å
579	G	89.4	Confident	74.2	Confident	4 Å²	4	75 Å²	75	4%	0.041	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.4	141.1	-177.7	0	0	0	0	0	113.1	L577 T602 D603 L702	L577-G579 PolarHBondContact O-N 3.04Å; L577-G579 VanDerWaalsContact O-N 3.15Å; G579-T602 VanDerWaalsContact CA-O 3.31Å; G579-T602 WeakPolarHBondContact CA-O 3.48Å; G579-D603 WeakPolarHBondContact CA-O 3.48Å; G579-D603 PolarHBondContact N-O 2.82Å; G579-L702 PolarHBondContact O-N 3.48Å
580	Q	94.4	Very high	76.8	Confident	62 Å²	62	76.5 Å²	76.5	29%	0.29	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	148.9	173.7	-53.9	-171.7	45.6	0	0	110.2	A601 T602 W699 Y700 K701	Q580-A601 CarbonylContact O-C 3.57Å; Q580-A601 WeakPolarHBondContact O-CA 3.41Å; Q580-A601 VanDerWaalsContact O-CB 3.29Å; Q580-A601 WeakPolarHBondContact O-CB 3.32Å; Q580-T602 PolarHBondContact N-O 3.28Å; Q580-T602 PolarHBondContact O-N 3.46Å; Q580-W699 HydrophobicContact CB-CE3 3.82Å; Q580-W699 HydrophobicContact CB-CZ3 4.21Å; Q580-Y700 CarbonylContact C-O 3.59Å; Q580-Y700 WeakPolarHBondContact CA-O 3.42Å; Q580-K701 HydrophobicContact CG-CG 4.27Å
581	L	96.3	Very high	79.4	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.7	178	-171.4	72.4	0	0	0	109.9	V583 V598 A601 V617 W644 I665 V667 I684 Y700 L702	L581-V583 HydrophobicContact CD2-CG2 3.64Å; L581-V583 HydrophobicContact CG-CG2 3.78Å; L581-V598 HydrophobicContact CD1-CG1 4.3Å; L581-A601 HydrophobicContact CD1-CB 3.89Å; L581-V617 HydrophobicContact CD1-CG2 4.3Å; 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 3.46Å; L581-I665 VanDerWaalsContact CD2-CG2 3.46Å; L581-V667 HydrophobicContact CD2-CG2 4.45Å; L581-I684 HydrophobicContact CB-CD1 3.5Å; L581-I684 VanDerWaalsContact CB-CD1 3.5Å; L581-I684 HydrophobicContact CD2-CD1 3.72Å; L581-I684 HydrophobicContact CG-CD1 4.23Å; L581-Y700 PolarHBondContact N-O 2.84Å; L581-Y700 PolarHBondContact O-N 3.41Å; L581-L702 HydrophobicContact CB-CD2 4.43Å
582	S	97.1	Very high	82	Confident	4 Å²	4	64.9 Å²	64.9	3%	0.028	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	119.1	171.9	-177.5	0	0	0	0	110.1	L599 Q600 H698	S582-L599 PolarHBondContact O-N 2.92Å; S582-Q600 PolarHBondContact N-O 3.13Å; S582-H698 CarbonylContact C-O 3.47Å; S582-H698 WeakPolarHBondContact CA-O 3.45Å
583	V	97.3	Very high	84.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.3	-178.9	-171.9	0	0	0	0	109.2	L581 L585 V596 N597 I665 H698 Y700	L581-V583 HydrophobicContact CD2-CG2 3.64Å; L581-V583 HydrophobicContact CG-CG2 3.78Å; V583-L585 HydrophobicContact CG1-CD2 3.78Å; V583-L585 HydrophobicContact CG1-CG 4.12Å; V583-V596 HydrophobicContact CG1-CG1 4.13Å; V583-N597 WeakPolarHBondContact CA-O 3.36Å; V583-I665 HydrophobicContact CG1-CD1 4.11Å; V583-I665 HydrophobicContact CG2-CD1 4.06Å; V583-H698 PolarHBondContact N-O 3.11Å; V583-H698 PolarHBondContact O-N 3.13Å; V583-Y700 HydrophobicContact CB-CD2 4.14Å; V583-Y700 HydrophobicContact CB-CE2 4.05Å; V583-Y700 HydrophobicContact CG2-CD2 4.25Å
584	K	96.5	Very high	86.9	Confident	38 Å²	38	55.5 Å²	55.5	17%	0.165	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129	173.8	160.9	-178.2	-104.1	-116.9	0	108.4	W586 N597 L599 D695 E696 P697	K584-W586 HydrophobicContact CD-CZ3 4.45Å; K584-W586 HydrophobicContact CG-CE3 4.13Å; K584-W586 HydrophobicContact CG-CZ3 4.09Å; K584-N597 HydrophobicContact CB-CB 3.81Å; K584-N597 HydrophobicContact CD-CB 4.37Å; K584-N597 HydrophobicContact CG-CB 4.15Å; K584-N597 PolarHBondContact N-O 3.42Å; K584-N597 PolarHBondContact O-N 2.77Å; K584-L599 HydrophobicContact CB-CD1 4.09Å; K584-D695 WeakPolarHBondContact CD-OD1 3.26Å; K584-D695 WeakPolarHBondContact CE-O 3.34Å; K584-D695 VanDerWaalsContact CE-OD1 3.28Å; K584-D695 WeakPolarHBondContact CE-OD1 3.37Å; K584-D695 WeakPolarHBondContact CG-OD1 3.23Å; K584-D695 PolarHBondContact NZ-O 3.1Å; K584-D695 IonicContact NZ-OD1 3.09Å; K584-D695 PolarHBondContact NZ-OD1 3.08Å; K584-D695 IonicContact NZ-OD2 3.99Å; K584-D695 PolarHBondContact NZ-OD2 2.91Å; K584-E696 WeakPolarHBondContact CA-O 3.35Å; K584-P697 HydrophobicContact CB-CB 4.38Å
585	L	96.9	Very high	89.2	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.1	-174.8	-60.5	177.6	0	0	0	110.5	V583 V596 L663 I686 A691 L693 D695	V583-L585 HydrophobicContact CG1-CD2 3.78Å; V583-L585 HydrophobicContact CG1-CG 4.12Å; L585-V596 HydrophobicContact CD2-CB 4.13Å; L585-V596 HydrophobicContact CD2-CG1 3.85Å; L585-V596 HydrophobicContact CD2-CG2 3.86Å; L585-L663 HydrophobicContact CD2-CD2 3.79Å; L585-I686 HydrophobicContact CD1-CD1 4.03Å; L585-I686 HydrophobicContact CD1-CG2 4.14Å; L585-A691 HydrophobicContact CD1-CB 4.34Å; L585-L693 HydrophobicContact CB-CD2 4.18Å; L585-L693 CarbonylContact O-C 3.56Å; L585-L693 WeakPolarHBondContact O-CA 3.03Å; L585-D695 PolarHBondContact O-N 2.89Å
586	W	95.1	Very high	91.2	Very high	70 Å²	70	45.9 Å²	45.9	27%	0.265	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	160.7	170.6	70.4	111.9	0	0	0	111.7	K584 I595 N597 T647 D695	K584-W586 HydrophobicContact CD-CZ3 4.45Å; K584-W586 HydrophobicContact CG-CE3 4.13Å; K584-W586 HydrophobicContact CG-CZ3 4.09Å; W586-I595 HydrophobicContact CD2-CB 3.84Å; W586-I595 HydrophobicContact CD2-CG2 4.28Å; W586-I595 HydrophobicContact CE3-CB 4.07Å; W586-I595 HydrophobicContact CE3-CG2 4.23Å; W586-I595 HydrophobicContact CG-CB 4.48Å; W586-I595 HydrophobicContact CG-CD1 4.48Å; W586-I595 HydrophobicContact CH2-CB 3.97Å; W586-I595 HydrophobicContact CH2-CG2 3.29Å; W586-I595 HydrophobicContact CZ2-CB 3.76Å; W586-I595 HydrophobicContact CZ2-CG1 4.39Å; W586-I595 HydrophobicContact CZ2-CG2 3.35Å; W586-I595 HydrophobicContact CZ3-CB 4.11Å; W586-I595 HydrophobicContact CZ3-CG2 3.74Å; W586-I595 PolarHBondContact N-O 3.02Å; W586-I595 PolarHBondContact O-N 2.74Å; W586-N597 VanDerWaalsContact CH2-ND2 3.27Å; W586-N597 WeakPolarHBondContact CH2-ND2 3.47Å; W586-N597 HydrophobicContact CZ3-CB 3.97Å; W586-N597 VanDerWaalsContact CZ3-ND2 3.27Å; W586-N597 WeakPolarHBondContact CZ3-ND2 3.46Å; W586-T647 HydrophobicContact CH2-CG2 4.18Å; W586-D695 HydrophobicContact CB-CB 3.86Å; W586-D695 HydrophobicContact CD2-CB 4.42Å; W586-D695 HydrophobicContact CG-CB 4.11Å
587	Y	95.9	Very high	93.1	Very high	43 Å²	43	43 Å²	43	17%	0.169	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.6	-175.2	173.5	-111.1	0	0	0	111.9	K589 Q593 V653 R655 F658	Y587-K589 HydrophobicContact CD1-CB 4.42Å; Y587-K589 HydrophobicContact CE1-CB 4.01Å; Y587-K589 HydrophobicContact CE1-CG 4.38Å; Y587-K589 PolarHBondContact O-N 2.92Å; Y587-Q593 VanDerWaalsContact CD2-O 3.22Å; Y587-Q593 WeakPolarHBondContact CD2-O 3.17Å; Y587-V653 WeakPolarHBondContact CE2-O 3.27Å; Y587-V653 PolarHBondContact OH-O 3.12Å; Y587-R655 HydrophobicContact CE1-CB 3.89Å; Y587-R655 HydrophobicContact CE1-CG 4.44Å; Y587-R655 PolarHBondContact OH-N 3.12Å; Y587-F658 HydrophobicContact CD1-CZ 4.4Å; Y587-F658 HydrophobicContact CD2-CE1 4.1Å; Y587-F658 HydrophobicContact CD2-CE2 4.5Å; Y587-F658 AromaticContact CD2-CZ 3.49Å; Y587-F658 HydrophobicContact CD2-CZ 3.49Å; Y587-F658 VanDerWaalsContact CD2-CZ 3.49Å; Y587-F658 HydrophobicContact CE2-CE1 4.03Å; Y587-F658 AromaticContact CE2-CZ 3.88Å; Y587-F658 HydrophobicContact CE2-CZ 3.88Å; Y587-F658 HydrophobicContact CG-CE2 4.4Å; Y587-F658 AromaticContact CG-CZ 3.77Å; Y587-F658 HydrophobicContact CG-CZ 3.77Å
588	D	94.6	Very high	94.3	Very high	48 Å²	48	41 Å²	41	26%	0.257	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	102	169.2	168.2	17.8	0	0	0	109.6	V590 G591 H592 Q593 I595	D588-V590 PolarHBondContact O-N 3.47Å; D588-V590 WeakPolarHBondContact OD1-CA 3.32Å; D588-V590 PolarHBondContact OD1-N 3.01Å; D588-G591 VanDerWaalsContact CG-N 3.25Å; D588-G591 PolarHBondContact OD1-N 3.06Å; D588-G591 VanDerWaalsContact OD2-CA 3.24Å; D588-G591 WeakPolarHBondContact OD2-CA 3.41Å; D588-G591 PolarHBondContact OD2-N 3.19Å; D588-G591 VanDerWaalsContact OD2-N 3.13Å; D588-H592 WeakPolarHBondContact O-CA 3.32Å; D588-H592 PolarHBondContact O-N 3.35Å; D588-H592 VanDerWaalsContact O-N 3.08Å; D588-Q593 HydrophobicContact CB-CB 4.15Å; D588-Q593 PolarHBondContact N-O 3.16Å; D588-Q593 PolarHBondContact O-N 3.05Å; D588-Q593 VanDerWaalsContact O-N 3.1Å; D588-Q593 PolarHBondContact OD2-NE2 3.25Å; D588-I595 HydrophobicContact CB-CD1 3.86Å
589	K	91.8	Very high	95.1	Very high	169 Å²	169	38.7 Å²	38.7	74%	0.735	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-30.4	177	-172.6	-178.5	176.7	-173.3	0	112.4	Y587 H592	Y587-K589 HydrophobicContact CD1-CB 4.42Å; Y587-K589 HydrophobicContact CE1-CB 4.01Å; Y587-K589 HydrophobicContact CE1-CG 4.38Å; Y587-K589 PolarHBondContact O-N 2.92Å; K589-H592 PolarHBondContact O-CE1 2.83Å; K589-H592 VanDerWaalsContact O-CE1 3.32Å; K589-H592 PolarHBondContact O-ND1 3.44Å
590	V	91.7	Very high	95.5	Very high	134 Å²	134	40.5 Å²	40.5	81%	0.812	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-50.1	-172.6	-176.9	0	0	0	0	111	D588 H592	D588-V590 PolarHBondContact O-N 3.47Å; D588-V590 WeakPolarHBondContact OD1-CA 3.32Å; D588-V590 PolarHBondContact OD1-N 3.01Å; V590-H592 VanDerWaalsContact C-N 3.28Å; V590-H592 PolarHBondContact O-N 3.12Å
591	G	90.8	Very high	95.6	Very high	38 Å²	38	37.6 Å²	37.6	39%	0.392	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-6.3	176.3	0	0	0	0	0	114.7	D588 Q593	D588-G591 VanDerWaalsContact CG-N 3.25Å; D588-G591 PolarHBondContact OD1-N 3.06Å; D588-G591 VanDerWaalsContact OD2-CA 3.24Å; D588-G591 WeakPolarHBondContact OD2-CA 3.41Å; D588-G591 PolarHBondContact OD2-N 3.19Å; D588-G591 VanDerWaalsContact OD2-N 3.13Å; G591-Q593 VanDerWaalsContact O-CG 3.26Å; G591-Q593 WeakPolarHBondContact O-CG 3.28Å
592	H	94.6	Very high	95.5	Very high	73 Å²	73	38.9 Å²	38.9	34%	0.338	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	57.4	-172.6	-58.8	-10.4	0	0	0	111.2	D588 K589 V590 H652 V653 H654	D588-H592 WeakPolarHBondContact O-CA 3.32Å; D588-H592 PolarHBondContact O-N 3.35Å; D588-H592 VanDerWaalsContact O-N 3.08Å; K589-H592 PolarHBondContact O-CE1 2.83Å; K589-H592 VanDerWaalsContact O-CE1 3.32Å; K589-H592 PolarHBondContact O-ND1 3.44Å; V590-H592 VanDerWaalsContact C-N 3.28Å; V590-H592 PolarHBondContact O-N 3.12Å; H592-H652 PolarHBondContact O-N 2.81Å; H592-V653 CarbonylContact C-O 3.57Å; H592-V653 VanDerWaalsContact C-O 3.25Å; H592-V653 WeakPolarHBondContact CA-O 3.5Å; H592-V653 WeakPolarHBondContact CB-O 3.46Å; H592-V653 PolarHBondContact O-N 2.95Å; H592-H654 AromaticContact CD2-CD2 3.41Å; H592-H654 PolarHBondContact CD2-CD2 3.26Å; H592-H654 VanDerWaalsContact CD2-CD2 3.41Å; H592-H654 AromaticContact CD2-NE2 3.42Å; H592-H654 PolarHBondContact CD2-NE2 2.93Å; H592-H654 AromaticContact NE2-CD2 3.83Å
593	Q	95.4	Very high	95.3	Very high	57 Å²	57	43.2 Å²	43.2	27%	0.266	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.2	-174	-42.1	-175.6	89	0	0	111.5	Y587 D588 G591 I595 V649 Y650 S651	Y587-Q593 VanDerWaalsContact CD2-O 3.22Å; Y587-Q593 WeakPolarHBondContact CD2-O 3.17Å; D588-Q593 HydrophobicContact CB-CB 4.15Å; D588-Q593 PolarHBondContact N-O 3.16Å; D588-Q593 PolarHBondContact O-N 3.05Å; D588-Q593 VanDerWaalsContact O-N 3.1Å; D588-Q593 PolarHBondContact OD2-NE2 3.25Å; G591-Q593 VanDerWaalsContact O-CG 3.26Å; G591-Q593 WeakPolarHBondContact O-CG 3.28Å; Q593-I595 HydrophobicContact CB-CD1 4.27Å; Q593-I595 WeakPolarHBondContact O-CD1 3.29Å; Q593-V649 HydrophobicContact CB-CG1 3.97Å; Q593-V649 HydrophobicContact CG-CG1 4.47Å; Q593-Y650 CarbonylContact C-O 3.47Å; Q593-Y650 VanDerWaalsContact CA-O 3.26Å; Q593-Y650 WeakPolarHBondContact CA-O 3.38Å; Q593-S651 PolarHBondContact OE1-OG 2.6Å
594	L	95.5	Very high	95.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	130.1	163.7	-179.3	70.4	0	0	0	108.7	V596 F621 Y650 V653 L688 L693	L594-V596 HydrophobicContact CD2-CG2 4.31Å; L594-V596 HydrophobicContact CG-CG2 4.24Å; L594-F621 HydrophobicContact CD2-CD2 4.27Å; L594-F621 HydrophobicContact CD2-CE2 3.57Å; L594-F621 HydrophobicContact CD2-CZ 4.44Å; L594-Y650 HydrophobicContact CD2-CD2 4.33Å; L594-Y650 PolarHBondContact N-O 2.68Å; L594-Y650 PolarHBondContact O-N 2.91Å; L594-V653 HydrophobicContact CB-CG2 4.48Å; L594-L688 HydrophobicContact CD2-CD1 4.27Å; L594-L688 HydrophobicContact CD2-CD2 3.72Å; L594-L693 HydrophobicContact CD1-CD2 3.86Å
595	I	96.4	Very high	94.7	Very high	13 Å²	13	42.6 Å²	42.6	7%	0.067	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.7	178.2	-48	90.1	0	0	0	109.6	W586 D588 Q593 T647 V649	W586-I595 HydrophobicContact CD2-CB 3.84Å; W586-I595 HydrophobicContact CD2-CG2 4.28Å; W586-I595 HydrophobicContact CE3-CB 4.07Å; W586-I595 HydrophobicContact CE3-CG2 4.23Å; W586-I595 HydrophobicContact CG-CB 4.48Å; W586-I595 HydrophobicContact CG-CD1 4.48Å; W586-I595 HydrophobicContact CH2-CB 3.97Å; W586-I595 HydrophobicContact CH2-CG2 3.29Å; W586-I595 HydrophobicContact CZ2-CB 3.76Å; W586-I595 HydrophobicContact CZ2-CG1 4.39Å; W586-I595 HydrophobicContact CZ2-CG2 3.35Å; W586-I595 HydrophobicContact CZ3-CB 4.11Å; W586-I595 HydrophobicContact CZ3-CG2 3.74Å; W586-I595 PolarHBondContact N-O 3.02Å; W586-I595 PolarHBondContact O-N 2.74Å; D588-I595 HydrophobicContact CB-CD1 3.86Å; Q593-I595 HydrophobicContact CB-CD1 4.27Å; Q593-I595 WeakPolarHBondContact O-CD1 3.29Å; I595-T647 HydrophobicContact CG2-CG2 3.5Å; I595-T647 VanDerWaalsContact CG2-CG2 3.5Å; I595-V649 HydrophobicContact CG1-CG1 4.47Å; I595-V649 HydrophobicContact CG1-CG2 4.24Å; I595-V649 HydrophobicContact CG2-CG2 4.13Å
596	V	97.3	Very high	94.2	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	112.4	-170.9	-177.7	0	0	0	0	109.5	V583 L585 L594 V598 M619 T647 F648 Y650 L663	V583-V596 HydrophobicContact CG1-CG1 4.13Å; L585-V596 HydrophobicContact CD2-CB 4.13Å; L585-V596 HydrophobicContact CD2-CG1 3.85Å; L585-V596 HydrophobicContact CD2-CG2 3.86Å; L594-V596 HydrophobicContact CD2-CG2 4.31Å; L594-V596 HydrophobicContact CG-CG2 4.24Å; V596-V598 HydrophobicContact CG1-CG2 4.35Å; V596-M619 HydrophobicContact CB-CE 4.28Å; V596-M619 HydrophobicContact CG1-CE 3.8Å; V596-M619 HydrophobicContact CG1-SD 3.8Å; V596-T647 CarbonylContact O-C 3.58Å; V596-T647 WeakPolarHBondContact O-CA 3.49Å; V596-F648 PolarHBondContact N-O 3.08Å; V596-F648 PolarHBondContact O-N 2.8Å; V596-Y650 HydrophobicContact CG2-CD2 4.2Å; V596-Y650 HydrophobicContact CG2-CE2 3.97Å; V596-L663 HydrophobicContact CB-CD2 4.43Å; V596-L663 HydrophobicContact CG1-CD2 3.86Å; V596-L663 HydrophobicContact CG2-CD1 4.45Å; V596-L663 HydrophobicContact CG2-CD2 3.64Å
597	N	96.9	Very high	93.8	Very high	24 Å²	24	45.3 Å²	45.3	13%	0.128	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	108	172.8	-91.6	-17.5	0	0	0	110	V583 K584 W586 L599 T647	V583-N597 WeakPolarHBondContact CA-O 3.36Å; K584-N597 HydrophobicContact CB-CB 3.81Å; K584-N597 HydrophobicContact CD-CB 4.37Å; K584-N597 HydrophobicContact CG-CB 4.15Å; K584-N597 PolarHBondContact N-O 3.42Å; K584-N597 PolarHBondContact O-N 2.77Å; W586-N597 VanDerWaalsContact CH2-ND2 3.27Å; W586-N597 WeakPolarHBondContact CH2-ND2 3.47Å; W586-N597 HydrophobicContact CZ3-CB 3.97Å; W586-N597 VanDerWaalsContact CZ3-ND2 3.27Å; W586-N597 WeakPolarHBondContact CZ3-ND2 3.46Å; N597-L599 HydrophobicContact CB-CD2 4.02Å; N597-L599 HydrophobicContact CB-CG 4.42Å; N597-L599 PolarHBondContact O-N 2.7Å; N597-T647 VanDerWaalsContact OD1-CA 3.29Å; N597-T647 WeakPolarHBondContact OD1-CA 3.26Å; N597-T647 WeakPolarHBondContact OD1-CB 3.24Å; N597-T647 WeakPolarHBondContact OD1-CG2 3.46Å; N597-T647 PolarHBondContact OD1-OG1 3.13Å
598	V	97.5	Very high	93.2	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	108.1	169.1	-176.6	0	0	0	0	108.1	L581 V596 V617 M619 T633 W644 N645 Q646 F648	L581-V598 HydrophobicContact CD1-CG1 4.3Å; V596-V598 HydrophobicContact CG1-CG2 4.35Å; V598-V617 HydrophobicContact CG1-CB 4.34Å; V598-V617 HydrophobicContact CG1-CG1 4.48Å; V598-V617 HydrophobicContact CG1-CG2 3.95Å; V598-M619 HydrophobicContact CG2-CE 4.14Å; V598-M619 HydrophobicContact CG2-SD 3.48Å; V598-M619 WeakPolarHBondContact CG2-SD 3.35Å; V598-T633 HydrophobicContact CB-CG2 3.99Å; V598-T633 HydrophobicContact CG1-CG2 3.95Å; V598-T633 HydrophobicContact CG2-CG2 4.38Å; V598-W644 HydrophobicContact CG1-CD2 4.44Å; V598-W644 HydrophobicContact CG1-CE3 3.9Å; V598-W644 HydrophobicContact CG1-CZ3 4.46Å; V598-N645 WeakPolarHBondContact O-CA 3.33Å; V598-N645 PolarHBondContact O-N 3.18Å; V598-Q646 PolarHBondContact N-O 3.27Å; V598-Q646 PolarHBondContact O-N 3.41Å; V598-F648 HydrophobicContact CB-CE2 4.44Å; V598-F648 HydrophobicContact CG2-CD2 4.3Å; V598-F648 HydrophobicContact CG2-CE2 4.03Å
599	L	96.7	Very high	92.6	Very high	34 Å²	34	51.8 Å²	51.8	18%	0.178	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-71.9	-169.9	-60.1	178.5	0	0	0	111.5	S582 K584 N597 W644 N645 P697	S582-L599 PolarHBondContact O-N 2.92Å; K584-L599 HydrophobicContact CB-CD1 4.09Å; N597-L599 HydrophobicContact CB-CD2 4.02Å; N597-L599 HydrophobicContact CB-CG 4.42Å; N597-L599 PolarHBondContact O-N 2.7Å; L599-W644 PolarHBondContact O-N 3.03Å; L599-N645 PolarHBondContact O-N 3.37Å; L599-N645 PolarHBondContact O-OD1 3.01Å; L599-P697 HydrophobicContact CD1-CB 3.52Å
600	Q	96.8	Very high	92.1	Very high	43 Å²	43	46.9 Å²	46.9	20%	0.201	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	161.2	-174.8	62.1	-178.7	12.5	0	0	111.8	S582 P642 K643 W699	S582-Q600 PolarHBondContact N-O 3.13Å; Q600-P642 CarbonylContact C-O 3.54Å; Q600-P642 WeakPolarHBondContact CA-O 3.23Å; Q600-P642 WeakPolarHBondContact CB-O 3.41Å; Q600-K643 HydrophobicContact CB-CB 4.28Å; Q600-K643 HydrophobicContact CB-CG 3.93Å; Q600-W699 HydrophobicContact CG-CH2 3.9Å; Q600-W699 HydrophobicContact CG-CZ2 4.48Å; Q600-W699 VanDerWaalsContact NE2-CH2 3.32Å; Q600-W699 VanDerWaalsContact NE2-CZ2 3.27Å
601	A	96.7	Very high	91.7	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	158	163.1	0	0	0	0	0	111.1	Q580 L581 L604 E641 P642 W644	Q580-A601 CarbonylContact O-C 3.57Å; Q580-A601 WeakPolarHBondContact O-CA 3.41Å; Q580-A601 VanDerWaalsContact O-CB 3.29Å; Q580-A601 WeakPolarHBondContact O-CB 3.32Å; L581-A601 HydrophobicContact CD1-CB 3.89Å; A601-L604 HydrophobicContact CB-CD1 4.07Å; A601-L604 HydrophobicContact CB-CD2 3.99Å; A601-L604 HydrophobicContact CB-CG 4.04Å; A601-E641 CarbonylContact O-C 3.6Å; A601-E641 VanDerWaalsContact O-CA 3.23Å; A601-E641 WeakPolarHBondContact O-CA 3.38Å; A601-P642 HydrophobicContact CB-CG 3.91Å; A601-P642 PolarHBondContact N-O 3.05Å; A601-W644 HydrophobicContact CB-CH2 4.03Å; A601-W644 HydrophobicContact CB-CZ3 3.81Å
602	T	95.1	Very high	91.5	Very high	26 Å²	26	46.9 Å²	46.9	16%	0.16	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	168.5	171	53.5	0	0	0	0	110	G579 Q580 L604 E641 W699	G579-T602 VanDerWaalsContact CA-O 3.31Å; G579-T602 WeakPolarHBondContact CA-O 3.48Å; Q580-T602 PolarHBondContact N-O 3.28Å; Q580-T602 PolarHBondContact O-N 3.46Å; T602-L604 PolarHBondContact O-N 3.29Å; T602-E641 HydrophobicContact CG2-CG 4.45Å; T602-W699 HydrophobicContact CG2-CH2 3.74Å; T602-W699 HydrophobicContact CG2-CZ3 4.17Å
603	D	92.5	Very high	91.3	Very high	96 Å²	96	43.8 Å²	43.8	51%	0.513	25%	0.251	S	S	.	.	S	Bend	trans	55.5	18.5	173.1	-53.8	-45.6	0	0	0	116.5	P578 G579	P578-D603 CarbonylContact C-O 3.32Å; G579-D603 WeakPolarHBondContact CA-O 3.48Å; G579-D603 PolarHBondContact N-O 2.82Å
604	L	93.1	Very high	91.2	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-59.6	143	-175.8	-66.4	-176.9	0	0	0	112.1	A601 T602 P615 L640 P642 V667 L681 L702	A601-L604 HydrophobicContact CB-CD1 4.07Å; A601-L604 HydrophobicContact CB-CD2 3.99Å; A601-L604 HydrophobicContact CB-CG 4.04Å; T602-L604 PolarHBondContact O-N 3.29Å; L604-P615 HydrophobicContact CD1-CB 3.81Å; L604-P615 HydrophobicContact CD1-CG 3.97Å; L604-L640 WeakPolarHBondContact CB-O 3.09Å; L604-L640 WeakPolarHBondContact CD1-O 3.26Å; L604-L640 VanDerWaalsContact CG-O 3.27Å; L604-L640 WeakPolarHBondContact CG-O 3.14Å; L604-P642 HydrophobicContact CD1-CG 3.82Å; L604-V667 HydrophobicContact CD1-CG1 4.46Å; L604-V667 HydrophobicContact CD2-CG1 4.28Å; L604-L681 HydrophobicContact CD1-CD1 4.26Å; L604-L702 HydrophobicContact CD2-CD1 3.51Å
605	P	87.9	Confident	91.3	Very high	23 Å²	23	41.5 Å²	41.5	15%	0.149	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-61	128.2	-175	-18.1	29	0	0	0	111	P578 R613	P578-P605 HydrophobicContact CG-CG 4.21Å; P578-P605 VanDerWaalsContact O-CD 3.26Å; P578-P605 WeakPolarHBondContact O-CD 3.46Å; P578-P605 WeakPolarHBondContact O-CG 3.24Å; P605-R613 PolarHBondContact O-NE 3.12Å
606	P	86.4	Confident	91.3	Very high	93 Å²	93	41 Å²	41	60%	0.604	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-62.8	162.3	170.6	27.6	-34.1	0	0	0	110.6	R613 L640	P606-R613 PolarHBondContact O-NH2 3.42Å; P606-L640 HydrophobicContact CB-CD1 4.4Å
607	R	87	Confident	91.3	Very high	34 Å²	34	41 Å²	41	13%	0.128	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-76.8	141.5	169.5	-76.4	-170.8	175.4	-137.2	-11.6	110.7	D609 G610 R611 D669	R607-D609 WeakPolarHBondContact CB-OD1 3.5Å; R607-D609 WeakPolarHBondContact CD-OD1 3.48Å; R607-D609 IonicContact NH1-OD2 3.17Å; R607-D609 PolarHBondContact NH1-OD2 3.21Å; R607-D609 VanDerWaalsContact NH1-OD2 3.17Å; R607-D609 PolarHBondContact O-N 3.24Å; R607-G610 PolarHBondContact O-N 3.16Å; R607-G610 VanDerWaalsContact O-N 3.07Å; R607-R611 VanDerWaalsContact CD-O 3.31Å; R607-R611 WeakPolarHBondContact CD-O 3.39Å; R607-D669 IonicContact CZ-OD2 3.23Å; R607-D669 VanDerWaalsContact CZ-OD2 3.23Å; R607-D669 IonicContact NE-OD2 2.76Å; R607-D669 PolarHBondContact NE-OD2 3.14Å; R607-D669 IonicContact NH2-OD2 2.82Å; R607-D669 PolarHBondContact NH2-OD2 2.77Å
608	V	81.9	Confident	91.3	Very high	162 Å²	162	41.9 Å²	41.9	98%	0.982	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.6	167.7	-62.7	0	0	0	0	113	G610	V608-G610 VanDerWaalsContact C-N 3.29Å; V608-G610 PolarHBondContact O-N 2.85Å
609	D	83.1	Confident	91.2	Very high	66 Å²	66	41.9 Å²	41.9	35%	0.353	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.4	176	73.8	9.2	0	0	0	114.1	R607 R611	R607-D609 WeakPolarHBondContact CB-OD1 3.5Å; R607-D609 WeakPolarHBondContact CD-OD1 3.48Å; R607-D609 IonicContact NH1-OD2 3.17Å; R607-D609 PolarHBondContact NH1-OD2 3.21Å; R607-D609 VanDerWaalsContact NH1-OD2 3.17Å; R607-D609 PolarHBondContact O-N 3.24Å; D609-R611 HydrophobicContact CB-CG 4.35Å; D609-R611 VanDerWaalsContact CG-CG 3.43Å; D609-R611 PolarHBondContact O-N 2.91Å; D609-R611 VanDerWaalsContact O-N 3.07Å; D609-R611 WeakPolarHBondContact OD1-CA 2.9Å; D609-R611 WeakPolarHBondContact OD1-CB 3.31Å; D609-R611 WeakPolarHBondContact OD1-CG 3.28Å; D609-R611 PolarHBondContact OD1-N 3.39Å; D609-R611 WeakPolarHBondContact OD2-CD 3.32Å; D609-R611 WeakPolarHBondContact OD2-CG 3.32Å; D609-R611 IonicContact OD2-CZ 2.72Å; D609-R611 IonicContact OD2-NE 3.18Å; D609-R611 PolarHBondContact OD2-NE 3.49Å; D609-R611 IonicContact OD2-NH1 2.74Å
610	G	81.1	Confident	91.2	Very high	66 Å²	66	42.4 Å²	42.4	68%	0.68	24%	0.24	S	C	*	.			trans	66.5	0.6	-177.1	0	0	0	0	0	115.4	R607 V608 P612	R607-G610 PolarHBondContact O-N 3.16Å; R607-G610 VanDerWaalsContact O-N 3.07Å; V608-G610 VanDerWaalsContact C-N 3.29Å; V608-G610 PolarHBondContact O-N 2.85Å; G610-P612 WeakPolarHBondContact O-CD 3.43Å
611	R	84	Confident	91.1	Very high	113 Å²	113	41 Å²	41	43%	0.426	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-77.5	130.1	179.1	-54.4	175.9	-163	169.1	1.1	108.8	R607 D609 R613 E676	R607-R611 VanDerWaalsContact CD-O 3.31Å; R607-R611 WeakPolarHBondContact CD-O 3.39Å; D609-R611 HydrophobicContact CB-CG 4.35Å; D609-R611 VanDerWaalsContact CG-CG 3.43Å; D609-R611 PolarHBondContact O-N 2.91Å; D609-R611 VanDerWaalsContact O-N 3.07Å; D609-R611 WeakPolarHBondContact OD1-CA 2.9Å; D609-R611 WeakPolarHBondContact OD1-CB 3.31Å; D609-R611 WeakPolarHBondContact OD1-CG 3.28Å; D609-R611 PolarHBondContact OD1-N 3.39Å; D609-R611 WeakPolarHBondContact OD2-CD 3.32Å; D609-R611 WeakPolarHBondContact OD2-CG 3.32Å; D609-R611 IonicContact OD2-CZ 2.72Å; D609-R611 IonicContact OD2-NE 3.18Å; D609-R611 PolarHBondContact OD2-NE 3.49Å; D609-R611 IonicContact OD2-NH1 2.74Å; R611-R613 PolarHBondContact O-N 2.92Å; R611-E676 IonicContact NH1-OE1 3.77Å; R611-E676 PolarHBondContact NH1-OE1 2.84Å
612	P	85.2	Confident	91	Very high	59 Å²	59	41.4 Å²	41.4	38%	0.383	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-55.3	130.2	174.8	-18.7	13.3	0	0	0	114.9	G610 K638 R672	G610-P612 WeakPolarHBondContact O-CD 3.43Å; P612-K638 HydrophobicContact CB-CB 3.75Å; P612-K638 HydrophobicContact CB-CD 4.47Å; P612-K638 HydrophobicContact CB-CG 3.98Å; P612-K638 HydrophobicContact CG-CB 4.45Å; P612-K638 HydrophobicContact CG-CD 4.46Å; P612-K638 HydrophobicContact CG-CG 4.48Å; P612-R672 PolarHBondContact O-NH2 2.95Å
613	R	90.9	Very high	90.8	Very high	7 Å²	7	45 Å²	45	3%	0.026	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-54.3	151.4	173.1	-64	-68.6	-175.4	-169.2	1.6	112.8	P605 P606 R611 K638 L639 L640 D669 E679 L681	P605-R613 PolarHBondContact O-NE 3.12Å; P606-R613 PolarHBondContact O-NH2 3.42Å; R611-R613 PolarHBondContact O-N 2.92Å; R613-K638 WeakPolarHBondContact O-CA 3.23Å; R613-K638 PolarHBondContact O-N 3.32Å; R613-L639 PolarHBondContact O-N 3.32Å; R613-L640 HydrophobicContact CB-CD2 4Å; R613-L640 HydrophobicContact CG-CD2 3.47Å; R613-L640 VanDerWaalsContact CG-CD2 3.47Å; R613-D669 VanDerWaalsContact CD-CG 3.49Å; R613-D669 WeakPolarHBondContact CD-OD2 3.37Å; R613-D669 IonicContact CZ-OD2 3.68Å; R613-D669 IonicContact NE-OD2 3.91Å; R613-D669 IonicContact NH1-OD2 3.16Å; R613-D669 PolarHBondContact NH1-OD2 2.85Å; R613-E679 IonicContact CZ-OE1 2.86Å; R613-E679 VanDerWaalsContact CZ-OE1 3.25Å; R613-E679 IonicContact CZ-OE2 2.88Å; R613-E679 IonicContact NH1-OE1 3.52Å; R613-E679 PolarHBondContact NH1-OE1 2.7Å; R613-E679 IonicContact NH1-OE2 2.73Å; R613-E679 PolarHBondContact NH1-OE2 3.43Å; R613-E679 IonicContact NH2-OE1 3.75Å; R613-E679 PolarHBondContact NH2-OE1 3.15Å; R613-E679 IonicContact NH2-OE2 3.8Å; R613-L681 VanDerWaalsContact CZ-CD2 3.44Å
614	N	94	Very high	90.6	Very high	10 Å²	10	43.3 Å²	43.3	5%	0.053	25%	0.25	C	S	.	.			trans	-125.7	73.2	167	-39.1	-82.2	0	0	0	109.4	T635 V636 K637 K638 D669 Q670	N614-T635 HydrophobicContact CB-CG2 3.96Å; N614-T635 WeakPolarHBondContact O-CG2 3.42Å; N614-V636 CarbonylContact C-O 3.16Å; N614-V636 WeakPolarHBondContact CA-O 3.32Å; N614-V636 WeakPolarHBondContact CB-O 3.41Å; N614-K637 HydrophobicContact CB-CG 4.35Å; N614-K638 PolarHBondContact OD1-N 3.46Å; N614-D669 PolarHBondContact N-OD1 3.06Å; N614-Q670 WeakPolarHBondContact CB-O 3.33Å; N614-Q670 PolarHBondContact ND2-O 3.1Å; N614-Q670 PolarHBondContact O-N 3.1Å
615	P	96.2	Very high	90.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	149.9	-169.2	31.3	-38.1	0	0	0	113.9	L604 V636 L639 P642 W644 W668 L681	L604-P615 HydrophobicContact CD1-CB 3.81Å; L604-P615 HydrophobicContact CD1-CG 3.97Å; P615-V636 WeakPolarHBondContact CD-O 3.42Å; P615-V636 PolarHBondContact O-N 2.96Å; P615-L639 VanDerWaalsContact CD-O 3.32Å; P615-L639 WeakPolarHBondContact CD-O 3.36Å; P615-L639 WeakPolarHBondContact CG-O 3.38Å; P615-P642 HydrophobicContact CB-CG 4.13Å; P615-P642 HydrophobicContact CG-CB 3.61Å; P615-P642 HydrophobicContact CG-CG 3.49Å; P615-P642 VanDerWaalsContact CG-CG 3.49Å; P615-W644 HydrophobicContact CB-CZ2 4.09Å; P615-W644 HydrophobicContact CG-CZ2 4.42Å; P615-W668 CarbonylContact C-O 3.59Å; P615-W668 VanDerWaalsContact CA-O 3.25Å; P615-W668 WeakPolarHBondContact CA-O 3.42Å; P615-L681 HydrophobicContact CB-CD1 4.23Å
616	Y	97.1	Very high	90.4	Very high	3 Å²	3	48.8 Å²	48.8	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	162.4	170.8	70.5	-87.8	0	0	0	110.1	K618 R632 T635 W668 Q670 S678	Y616-K618 HydrophobicContact CD2-CG 4.49Å; Y616-K618 HydrophobicContact CE2-CD 3.78Å; Y616-K618 HydrophobicContact CE2-CG 3.91Å; Y616-K618 WeakPolarHBondContact OH-CE 3.01Å; Y616-K618 PolarHBondContact OH-NZ 2.82Å; Y616-R632 HydrophobicContact CD2-CG 3.87Å; Y616-R632 VanDerWaalsContact CE1-NH2 3.26Å; Y616-R632 HydrophobicContact CE2-CG 4.29Å; Y616-R632 VanDerWaalsContact CE2-NH2 3.29Å; Y616-T635 HydrophobicContact CD1-CG2 4.34Å; Y616-W668 HydrophobicContact CD1-CB 4.04Å; Y616-W668 VanDerWaalsContact CD1-O 3.23Å; Y616-W668 WeakPolarHBondContact CD1-O 3.4Å; Y616-W668 HydrophobicContact CD2-CB 4.23Å; Y616-W668 HydrophobicContact CE1-CB 3.54Å; Y616-W668 HydrophobicContact CE2-CB 3.77Å; Y616-W668 HydrophobicContact CE2-CG 4.15Å; Y616-W668 HydrophobicContact CG-CB 4.37Å; Y616-W668 VanDerWaalsContact CZ-CB 3.4Å; Y616-W668 PolarHBondContact N-O 2.9Å; Y616-W668 PolarHBondContact O-N 2.75Å; Y616-Q670 HydrophobicContact CD1-CB 3.84Å; Y616-Q670 HydrophobicContact CE1-CB 3.78Å; Y616-S678 WeakPolarHBondContact OH-CB 3.44Å; Y616-S678 PolarHBondContact OH-OG 2.56Å
617	V	97.6	Very high	90.4	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139	178.1	-179	0	0	0	0	109.4	L581 V598 M619 R632 T633 W644 I665 T666 V667	L581-V617 HydrophobicContact CD1-CG2 4.3Å; V598-V617 HydrophobicContact CG1-CB 4.34Å; V598-V617 HydrophobicContact CG1-CG1 4.48Å; V598-V617 HydrophobicContact CG1-CG2 3.95Å; V617-M619 HydrophobicContact CG1-CG 3.9Å; V617-R632 CarbonylContact O-C 3.34Å; V617-R632 VanDerWaalsContact O-CA 3.23Å; V617-R632 WeakPolarHBondContact O-CA 3.21Å; V617-R632 VanDerWaalsContact O-CG 3.28Å; V617-R632 WeakPolarHBondContact O-CG 3.49Å; V617-T633 HydrophobicContact CB-CG2 3.98Å; V617-T633 PolarHBondContact N-OG1 3.26Å; V617-T633 PolarHBondContact O-N 3.33Å; V617-W644 HydrophobicContact CG2-CD2 4.35Å; V617-W644 HydrophobicContact CG2-CE3 4.15Å; V617-W644 HydrophobicContact CG2-CH2 3.55Å; V617-W644 HydrophobicContact CG2-CZ2 3.78Å; V617-W644 HydrophobicContact CG2-CZ3 3.77Å; V617-I665 HydrophobicContact CG1-CG2 3.47Å; V617-I665 VanDerWaalsContact CG1-CG2 3.47Å; V617-T666 CarbonylContact C-O 3.52Å; V617-T666 WeakPolarHBondContact CA-O 3.4Å; V617-V667 HydrophobicContact CG2-CG2 4.33Å
618	K	96.2	Very high	90.4	Very high	41 Å²	41	55.7 Å²	55.7	18%	0.178	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	143.9	163.2	-81.6	144	165.9	172.1	0	107.4	Y616 R631 R632 T666 W668	Y616-K618 HydrophobicContact CD2-CG 4.49Å; Y616-K618 HydrophobicContact CE2-CD 3.78Å; Y616-K618 HydrophobicContact CE2-CG 3.91Å; Y616-K618 WeakPolarHBondContact OH-CE 3.01Å; Y616-K618 PolarHBondContact OH-NZ 2.82Å; K618-R631 CarbonylContact C-O 3.56Å; K618-R631 WeakPolarHBondContact CA-O 3.33Å; K618-R632 HydrophobicContact CG-CG 4.39Å; K618-T666 WeakPolarHBondContact CB-OG1 3.23Å; K618-T666 PolarHBondContact N-O 3.4Å; K618-T666 PolarHBondContact O-N 2.65Å; K618-T666 PolarHBondContact O-OG1 3.03Å; K618-W668 VanDerWaalsContact CD-CD1 3.49Å; K618-W668 HydrophobicContact CD-CD2 4.04Å; K618-W668 HydrophobicContact CD-CG 3.94Å; K618-W668 HydrophobicContact CD-CZ2 4.28Å; K618-W668 VanDerWaalsContact CD-NE1 3.28Å
619	M	96.4	Very high	90.9	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151	173.3	-47.3	-173.4	-58.1	0	0	111.2	V596 V598 V617 K630 R631 F648 L663 E664 I665	V596-M619 HydrophobicContact CB-CE 4.28Å; V596-M619 HydrophobicContact CG1-CE 3.8Å; V596-M619 HydrophobicContact CG1-SD 3.8Å; V598-M619 HydrophobicContact CG2-CE 4.14Å; V598-M619 HydrophobicContact CG2-SD 3.48Å; V598-M619 WeakPolarHBondContact CG2-SD 3.35Å; V617-M619 HydrophobicContact CG1-CG 3.9Å; M619-K630 CarbonylContact O-C 3.58Å; M619-K630 WeakPolarHBondContact O-CA 3.47Å; M619-R631 HydrophobicContact CB-CB 4.31Å; M619-R631 HydrophobicContact CE-CB 3.78Å; M619-R631 HydrophobicContact CE-CG 4.26Å; M619-R631 PolarHBondContact N-O 3.42Å; M619-R631 PolarHBondContact O-N 2.66Å; M619-F648 HydrophobicContact CE-CB 3.98Å; M619-F648 HydrophobicContact CE-CD2 3.31Å; M619-F648 HydrophobicContact CE-CE2 3.84Å; M619-F648 HydrophobicContact CE-CG 3.73Å; M619-L663 HydrophobicContact CB-CD1 4.48Å; M619-E664 CarbonylContact C-O 3.59Å; M619-E664 WeakPolarHBondContact CA-O 3.18Å; M619-E664 WeakPolarHBondContact CB-O 3.4Å; M619-I665 HydrophobicContact CG-CB 4.46Å; M619-I665 HydrophobicContact CG-CG1 4.23Å; M619-I665 HydrophobicContact CG-CG2 4.12Å; M619-I665 HydrophobicContact SD-CD1 4.23Å; M619-I665 HydrophobicContact SD-CG1 4.12Å; M619-I665 HydrophobicContact SD-CG2 4.34Å
620	Y	96.3	Very high	91.4	Very high	45 Å²	45	48.8 Å²	48.8	18%	0.176	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151.8	170.6	-64.2	-87.7	0	0	0	110.6	K630 E664	Y620-K630 HydrophobicContact CD1-CB 3.96Å; Y620-K630 HydrophobicContact CD1-CG 4.11Å; Y620-K630 HydrophobicContact CE1-CB 3.74Å; Y620-K630 HydrophobicContact CE1-CD 3.71Å; Y620-K630 HydrophobicContact CE1-CG 3.51Å; Y620-K630 VanDerWaalsContact OH-CE 3.27Å; Y620-K630 WeakPolarHBondContact OH-CE 3.2Å; Y620-E664 WeakPolarHBondContact CD2-OE2 3.45Å; Y620-E664 PolarHBondContact N-O 3.31Å; Y620-E664 PolarHBondContact O-N 3.21Å
621	F	94.5	Very high	92.2	Very high	12 Å²	12	48.7 Å²	48.7	5%	0.053	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	86.1	-179.8	-166.8	-112.8	0	0	0	109.6	L594 D624 Y650 V653 R661 L688	L594-F621 HydrophobicContact CD2-CD2 4.27Å; L594-F621 HydrophobicContact CD2-CE2 3.57Å; L594-F621 HydrophobicContact CD2-CZ 4.44Å; F621-D624 WeakPolarHBondContact O-CB 3.47Å; F621-D624 PolarHBondContact O-N 3.08Å; F621-D624 VanDerWaalsContact O-N 3.12Å; F621-Y650 HydrophobicContact CB-CD1 4.1Å; F621-Y650 HydrophobicContact CB-CE1 3.89Å; F621-Y650 HydrophobicContact CB-CE2 4.42Å; F621-Y650 HydrophobicContact CB-CG 4.47Å; F621-Y650 AromaticContact CD2-CD2 3.96Å; F621-Y650 HydrophobicContact CD2-CD2 3.96Å; F621-Y650 HydrophobicContact CD2-CE2 4.12Å; F621-Y650 HydrophobicContact CD2-CG 4.22Å; F621-Y650 HydrophobicContact CE2-CD2 4.47Å; F621-Y650 HydrophobicContact CG-CD1 4.29Å; F621-Y650 HydrophobicContact CG-CD2 4.39Å; F621-Y650 HydrophobicContact CG-CG 4.23Å; F621-V653 HydrophobicContact CD1-CG2 4.45Å; F621-V653 HydrophobicContact CE1-CB 4.41Å; F621-V653 HydrophobicContact CE1-CG1 3.95Å; F621-V653 HydrophobicContact CE1-CG2 3.54Å; F621-V653 HydrophobicContact CE2-CG2 4.48Å; F621-V653 HydrophobicContact CZ-CB 4.21Å; F621-V653 HydrophobicContact CZ-CG1 3.46Å; F621-V653 VanDerWaalsContact CZ-CG1 3.46Å; F621-V653 HydrophobicContact CZ-CG2 3.6Å; F621-R661 VanDerWaalsContact CE1-CD 3.46Å; F621-R661 HydrophobicContact CZ-CB 4.49Å; F621-L688 HydrophobicContact CE2-CD1 3.43Å; F621-L688 VanDerWaalsContact CE2-CD1 3.43Å; F621-L688 HydrophobicContact CZ-CD1 3.64Å
622	L	93.9	Very high	92.8	Very high	10 Å²	10	48.4 Å²	48.4	5%	0.052	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	148.9	-170.1	-57.7	-171.5	0	0	0	111.6	D624 R625 R661 M662 E664 L685 L710	L622-D624 VanDerWaalsContact C-N 3.34Å; L622-R625 HydrophobicContact CD2-CG 3.45Å; L622-R625 VanDerWaalsContact CD2-CG 3.45Å; L622-R661 WeakPolarHBondContact O-CA 3.33Å; L622-R661 WeakPolarHBondContact O-CB 3.39Å; L622-M662 HydrophobicContact CB-CB 4.28Å; L622-M662 WeakPolarHBondContact CB-O 3.39Å; L622-M662 HydrophobicContact CD1-CB 4.37Å; L622-M662 PolarHBondContact N-O 3.49Å; L622-E664 HydrophobicContact CD1-CB 3.95Å; L622-E664 HydrophobicContact CD2-CB 4.24Å; L622-E664 HydrophobicContact CG-CB 3.92Å; L622-L685 HydrophobicContact CD1-CD2 4.06Å; L622-L710 HydrophobicContact CD1-CD2 3.84Å
623	P	92.1	Very high	93.4	Very high	102 Å²	102	45.9 Å²	45.9	66%	0.662	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	cis	-79	-1.6	3.9	32	-36.9	0	0	0	115.2	R625	P623-R625 PolarHBondContact O-N 3.21Å; P623-R625 VanDerWaalsContact O-N 3.1Å
624	D	87.7	Confident	93.6	Very high	60 Å²	60	52.1 Å²	52.1	32%	0.321	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-70.8	107.9	177.5	-176.3	7.9	0	0	0	110.5	F621 L622 S626 S629	F621-D624 WeakPolarHBondContact O-CB 3.47Å; F621-D624 PolarHBondContact O-N 3.08Å; F621-D624 VanDerWaalsContact O-N 3.12Å; L622-D624 VanDerWaalsContact C-N 3.34Å; D624-S626 VanDerWaalsContact CG-OG 3.27Å; D624-S626 WeakPolarHBondContact OD1-CA 3.36Å; D624-S626 WeakPolarHBondContact OD1-CB 3.39Å; D624-S626 PolarHBondContact OD1-N 3.13Å; D624-S626 PolarHBondContact OD1-OG 3.31Å; D624-S626 PolarHBondContact OD2-OG 2.86Å; D624-S626 VanDerWaalsContact OD2-OG 3.08Å; D624-S629 WeakPolarHBondContact O-CB 3.44Å; D624-S629 PolarHBondContact O-OG 3.13Å; D624-S629 WeakPolarHBondContact OD2-CB 3.38Å
625	R	89.6	Confident	93.6	Very high	98 Å²	98	53 Å²	53	37%	0.37	25%	0.25	S	C	.	.			trans	-106.3	41.6	167.9	-73.1	-174.2	169.4	172.7	3.2	111.6	K475 L622 P623 E664	K475-R625 PolarHBondContact NZ-O 3.2Å; L622-R625 HydrophobicContact CD2-CG 3.45Å; L622-R625 VanDerWaalsContact CD2-CG 3.45Å; P623-R625 PolarHBondContact O-N 3.21Å; P623-R625 VanDerWaalsContact O-N 3.1Å; R625-E664 IonicContact CZ-OE1 3.45Å; R625-E664 IonicContact CZ-OE2 2.69Å; R625-E664 IonicContact NE-OE1 2.78Å; R625-E664 PolarHBondContact NE-OE1 3.07Å; R625-E664 IonicContact NE-OE2 3.45Å; R625-E664 PolarHBondContact NE-OE2 3.17Å; R625-E664 IonicContact NH2-OE1 3.3Å; R625-E664 PolarHBondContact NH2-OE1 2.85Å; R625-E664 IonicContact NH2-OE2 3.99Å
626	S	87.1	Confident	93.6	Very high	43 Å²	43	54.4 Å²	54.4	30%	0.301	26%	0.258	S	S	.	.	S	Bend	trans	-91.5	174.3	169	76.7	0	0	0	0	112.1	D624 K628 S629 K630	D624-S626 VanDerWaalsContact CG-OG 3.27Å; D624-S626 WeakPolarHBondContact OD1-CA 3.36Å; D624-S626 WeakPolarHBondContact OD1-CB 3.39Å; D624-S626 PolarHBondContact OD1-N 3.13Å; D624-S626 PolarHBondContact OD1-OG 3.31Å; D624-S626 PolarHBondContact OD2-OG 2.86Å; D624-S626 VanDerWaalsContact OD2-OG 3.08Å; S626-K628 PolarHBondContact O-N 2.84Å; S626-K628 PolarHBondContact OG-N 2.64Å; S626-K628 VanDerWaalsContact OG-N 3.15Å; S626-S629 PolarHBondContact O-OG 2.84Å; S626-S629 VanDerWaalsContact O-OG 3.06Å; S626-K630 PolarHBondContact O-N 3.09Å
627	D	86.1	Confident	93.3	Very high	96 Å²	96	61.2 Å²	61.2	51%	0.513	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.3	172.5	-65.3	-60.2	0	0	0	113.5	K630	D627-K630 HydrophobicContact CB-CD 4.48Å; D627-K630 WeakPolarHBondContact OD1-CD 3.43Å; D627-K630 WeakPolarHBondContact OD1-CE 3.37Å; D627-K630 IonicContact OD1-NZ 3.23Å; D627-K630 PolarHBondContact OD1-NZ 3Å
628	K	87.5	Confident	93	Very high	175 Å²	175	66.3 Å²	66.3	76%	0.761	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-39.3	174.8	-66.1	-177.8	179.9	176.1	0	112.5	S626 K630 R631	S626-K628 PolarHBondContact O-N 2.84Å; S626-K628 PolarHBondContact OG-N 2.64Å; S626-K628 VanDerWaalsContact OG-N 3.15Å; K628-K630 VanDerWaalsContact C-N 3.34Å; K628-R631 PolarHBondContact O-NH1 3.27Å
629	S	91.6	Very high	92.7	Very high	5 Å²	5	68.5 Å²	68.5	4%	0.035	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-12	175.5	61.4	0	0	0	0	113.5	D624 S626 Y650	D624-S629 WeakPolarHBondContact O-CB 3.44Å; D624-S629 PolarHBondContact O-OG 3.13Å; D624-S629 WeakPolarHBondContact OD2-CB 3.38Å; S626-S629 PolarHBondContact O-OG 2.84Å; S626-S629 VanDerWaalsContact O-OG 3.06Å; S629-Y650 VanDerWaalsContact O-CE1 3.23Å; S629-Y650 WeakPolarHBondContact O-CE1 3.43Å; S629-Y650 PolarHBondContact O-OH 2.86Å
630	K	95.2	Very high	92.5	Very high	79 Å²	79	71.9 Å²	71.9	34%	0.343	34%	0.341	S	S	.	.			trans	-73.9	137.6	-177	-165.5	173.2	-169.8	163.5	0	112.2	M619 Y620 S626 D627 K628	M619-K630 CarbonylContact O-C 3.58Å; M619-K630 WeakPolarHBondContact O-CA 3.47Å; Y620-K630 HydrophobicContact CD1-CB 3.96Å; Y620-K630 HydrophobicContact CD1-CG 4.11Å; Y620-K630 HydrophobicContact CE1-CB 3.74Å; Y620-K630 HydrophobicContact CE1-CD 3.71Å; Y620-K630 HydrophobicContact CE1-CG 3.51Å; Y620-K630 VanDerWaalsContact OH-CE 3.27Å; Y620-K630 WeakPolarHBondContact OH-CE 3.2Å; S626-K630 PolarHBondContact O-N 3.09Å; D627-K630 HydrophobicContact CB-CD 4.48Å; D627-K630 WeakPolarHBondContact OD1-CD 3.43Å; D627-K630 WeakPolarHBondContact OD1-CE 3.37Å; D627-K630 IonicContact OD1-NZ 3.23Å; D627-K630 PolarHBondContact OD1-NZ 3Å; K628-K630 VanDerWaalsContact C-N 3.34Å
631	R	96.3	Very high	92.4	Very high	64 Å²	64	75.1 Å²	75.1	24%	0.242	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	157.1	170.2	-58.5	-66.7	-179	-92.9	-0.6	109.9	K618 M619 K628 F648 V649 Y650	K618-R631 CarbonylContact C-O 3.56Å; K618-R631 WeakPolarHBondContact CA-O 3.33Å; M619-R631 HydrophobicContact CB-CB 4.31Å; M619-R631 HydrophobicContact CE-CB 3.78Å; M619-R631 HydrophobicContact CE-CG 4.26Å; M619-R631 PolarHBondContact N-O 3.42Å; M619-R631 PolarHBondContact O-N 2.66Å; K628-R631 PolarHBondContact O-NH1 3.27Å; R631-F648 HydrophobicContact CB-CB 4.49Å; R631-F648 HydrophobicContact CB-CD1 3.74Å; R631-F648 HydrophobicContact CB-CE1 3.99Å; R631-F648 HydrophobicContact CB-CG 4.06Å; R631-F648 HydrophobicContact CG-CB 4.09Å; R631-F648 HydrophobicContact CG-CD1 3.99Å; R631-F648 HydrophobicContact CG-CG 4.18Å; R631-V649 PolarHBondContact NE-O 2.95Å; R631-V649 PolarHBondContact NH2-O 3.23Å; R631-Y650 HydrophobicContact CG-CE1 3.66Å; R631-Y650 VanDerWaalsContact CG-OH 3.25Å; R631-Y650 WeakPolarHBondContact CG-OH 3.38Å
632	R	96.6	Very high	92.4	Very high	106 Å²	106	74.5 Å²	74.5	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	135.9	178.5	-168.6	-171.1	169	166.9	1.8	112	Y616 V617 K618 Q646 F648	Y616-R632 HydrophobicContact CD2-CG 3.87Å; Y616-R632 VanDerWaalsContact CE1-NH2 3.26Å; Y616-R632 HydrophobicContact CE2-CG 4.29Å; Y616-R632 VanDerWaalsContact CE2-NH2 3.29Å; V617-R632 CarbonylContact O-C 3.34Å; V617-R632 VanDerWaalsContact O-CA 3.23Å; V617-R632 WeakPolarHBondContact O-CA 3.21Å; V617-R632 VanDerWaalsContact O-CG 3.28Å; V617-R632 WeakPolarHBondContact O-CG 3.49Å; K618-R632 HydrophobicContact CG-CG 4.39Å; R632-Q646 PolarHBondContact O-NE2 3.03Å; R632-F648 WeakPolarHBondContact O-CE1 3.31Å; R632-F648 WeakPolarHBondContact O-CZ 3.26Å
633	T	97.5	Very high	92.5	Very high	7 Å²	7	80.2 Å²	80.2	4%	0.043	38%	0.379	C	S	.	.			trans	-79.9	161.4	173.2	64.2	0	0	0	0	112.9	V598 V617 T635 W644 Q646 F648	V598-T633 HydrophobicContact CB-CG2 3.99Å; V598-T633 HydrophobicContact CG1-CG2 3.95Å; V598-T633 HydrophobicContact CG2-CG2 4.38Å; V617-T633 HydrophobicContact CB-CG2 3.98Å; V617-T633 PolarHBondContact N-OG1 3.26Å; V617-T633 PolarHBondContact O-N 3.33Å; T633-T635 PolarHBondContact O-N 2.87Å; T633-W644 HydrophobicContact CG2-CB 4.2Å; T633-W644 HydrophobicContact CG2-CG 4.06Å; T633-W644 VanDerWaalsContact OG1-CD1 3.3Å; T633-W644 PolarHBondContact OG1-NE1 3.23Å; T633-Q646 HydrophobicContact CG2-CB 4.36Å; T633-F648 HydrophobicContact CG2-CE2 3.75Å; T633-F648 HydrophobicContact CG2-CZ 3.76Å
634	K	95.6	Very high	92.7	Very high	137 Å²	137	76.3 Å²	76.3	60%	0.596	35%	0.351	S	S	*	.			trans	-62.4	130.1	168.6	-64.7	162.9	-172.4	163.1	0	110	V636 W644	K634-V636 PolarHBondContact O-N 3.26Å; K634-V636 VanDerWaalsContact O-N 3.16Å; K634-W644 PolarHBondContact O-NE1 3.31Å; K634-W644 VanDerWaalsContact O-NE1 3.12Å
635	T	95.2	Very high	93.1	Very high	30 Å²	30	78.8 Å²	78.8	18%	0.184	36%	0.364	C	S	.	.			trans	-61.1	115.6	172.9	-42	0	0	0	0	111.9	N614 Y616 T633 Q670	N614-T635 HydrophobicContact CB-CG2 3.96Å; N614-T635 WeakPolarHBondContact O-CG2 3.42Å; Y616-T635 HydrophobicContact CD1-CG2 4.34Å; T633-T635 PolarHBondContact O-N 2.87Å; T635-Q670 HydrophobicContact CG2-CB 3.64Å; T635-Q670 PolarHBondContact OG1-OE1 3.41Å
636	V	94.4	Very high	93.4	Very high	28 Å²	28	76 Å²	76	17%	0.17	36%	0.356	C	S	.	.			trans	-82.8	143.6	170.2	175.4	0	0	0	0	107.6	N614 P615 K634 L639 P642 W644	N614-V636 CarbonylContact C-O 3.16Å; N614-V636 WeakPolarHBondContact CA-O 3.32Å; N614-V636 WeakPolarHBondContact CB-O 3.41Å; P615-V636 WeakPolarHBondContact CD-O 3.42Å; P615-V636 PolarHBondContact O-N 2.96Å; K634-V636 PolarHBondContact O-N 3.26Å; K634-V636 VanDerWaalsContact O-N 3.16Å; V636-L639 HydrophobicContact CG1-CB 4.28Å; V636-L639 HydrophobicContact CG1-CD1 3.8Å; V636-L639 HydrophobicContact CG1-CG 4.4Å; V636-P642 HydrophobicContact CB-CB 3.83Å; V636-P642 HydrophobicContact CG1-CB 3.91Å; V636-P642 HydrophobicContact CG2-CB 4.09Å; V636-W644 HydrophobicContact CG2-CG 4.39Å
637	K	92.6	Very high	93.9	Very high	146 Å²	146	77.7 Å²	77.7	64%	0.635	36%	0.364	S	S	*	.			trans	-116	131.9	-170.4	-63.8	-169.4	177.5	-168.2	0	112.3	N614	N614-K637 HydrophobicContact CB-CG 4.35Å
638	K	90.3	Very high	94.4	Very high	107 Å²	107	74 Å²	74	47%	0.465	34%	0.344	S	S	.	.	S	Bend	trans	60.8	39.7	174.4	-52.5	-168.5	174.9	-170.1	0	115.1	P612 R613 N614	P612-K638 HydrophobicContact CB-CB 3.75Å; P612-K638 HydrophobicContact CB-CD 4.47Å; P612-K638 HydrophobicContact CB-CG 3.98Å; P612-K638 HydrophobicContact CG-CB 4.45Å; P612-K638 HydrophobicContact CG-CD 4.46Å; P612-K638 HydrophobicContact CG-CG 4.48Å; R613-K638 WeakPolarHBondContact O-CA 3.23Å; R613-K638 PolarHBondContact O-N 3.32Å; N614-K638 PolarHBondContact OD1-N 3.46Å
639	L	90.7	Very high	94.8	Very high	88 Å²	88	68.3 Å²	68.3	46%	0.461	32%	0.324	S	S	.	.			trans	-134	140.8	174.9	-67.5	175.8	0	0	0	110.2	R613 P615 V636	R613-L639 PolarHBondContact O-N 3.32Å; P615-L639 VanDerWaalsContact CD-O 3.32Å; P615-L639 WeakPolarHBondContact CD-O 3.36Å; P615-L639 WeakPolarHBondContact CG-O 3.38Å; V636-L639 HydrophobicContact CG1-CB 4.28Å; V636-L639 HydrophobicContact CG1-CD1 3.8Å; V636-L639 HydrophobicContact CG1-CG 4.4Å
640	L	91.3	Very high	95	Very high	71 Å²	71	68.4 Å²	68.4	37%	0.372	32%	0.323	S	S	.	.	S	Bend	trans	-87.1	-19.5	165.7	-57.8	-179.7	0	0	0	111.5	L604 P606 R613 P642	L604-L640 WeakPolarHBondContact CB-O 3.09Å; L604-L640 WeakPolarHBondContact CD1-O 3.26Å; L604-L640 VanDerWaalsContact CG-O 3.27Å; L604-L640 WeakPolarHBondContact CG-O 3.14Å; P606-L640 HydrophobicContact CB-CD1 4.4Å; R613-L640 HydrophobicContact CB-CD2 4Å; R613-L640 HydrophobicContact CG-CD2 3.47Å; R613-L640 VanDerWaalsContact CG-CD2 3.47Å; L640-P642 WeakPolarHBondContact O-CD 3.41Å
641	E	94	Very high	94.9	Very high	113 Å²	113	67.7 Å²	67.7	53%	0.528	33%	0.328	S	S	.	.	S	Bend	trans	-111.6	72.2	174.2	-56.5	-170.5	135	0	0	111.1	A601 T602	A601-E641 CarbonylContact O-C 3.6Å; A601-E641 VanDerWaalsContact O-CA 3.23Å; A601-E641 WeakPolarHBondContact O-CA 3.38Å; T602-E641 HydrophobicContact CG2-CG 4.45Å
642	P	95.5	Very high	94.6	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.351	C	S	.	.			trans	-72.4	136.4	-179.8	31.4	-37.5	0	0	0	111.9	Q600 A601 L604 P615 V636 L640 W644	Q600-P642 CarbonylContact C-O 3.54Å; Q600-P642 WeakPolarHBondContact CA-O 3.23Å; Q600-P642 WeakPolarHBondContact CB-O 3.41Å; A601-P642 HydrophobicContact CB-CG 3.91Å; A601-P642 PolarHBondContact N-O 3.05Å; L604-P642 HydrophobicContact CD1-CG 3.82Å; P615-P642 HydrophobicContact CB-CG 4.13Å; P615-P642 HydrophobicContact CG-CB 3.61Å; P615-P642 HydrophobicContact CG-CG 3.49Å; P615-P642 VanDerWaalsContact CG-CG 3.49Å; V636-P642 HydrophobicContact CB-CB 3.83Å; V636-P642 HydrophobicContact CG1-CB 3.91Å; V636-P642 HydrophobicContact CG2-CB 4.09Å; L640-P642 WeakPolarHBondContact O-CD 3.41Å; P642-W644 HydrophobicContact CB-CD2 4.35Å; P642-W644 HydrophobicContact CB-CE3 4.49Å; P642-W644 HydrophobicContact CB-CH2 3.92Å; P642-W644 HydrophobicContact CB-CZ2 3.71Å; P642-W644 HydrophobicContact CB-CZ3 4.28Å; P642-W644 HydrophobicContact CG-CE3 4.36Å; P642-W644 HydrophobicContact CG-CH2 3.24Å; P642-W644 HydrophobicContact CG-CZ2 3.51Å; P642-W644 HydrophobicContact CG-CZ3 3.7Å
643	K	96.3	Very high	94.3	Very high	129 Å²	129	67.2 Å²	67.2	56%	0.561	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.8	167	-47.9	-160	-176.1	-142.1	0	108.9	Q600	Q600-K643 HydrophobicContact CB-CB 4.28Å; Q600-K643 HydrophobicContact CB-CG 3.93Å
644	W	96.7	Very high	94.1	Very high	21 Å²	21	69.6 Å²	69.6	8%	0.08	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-41.4	-178.8	-67.2	-72	0	0	0	112.5	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 4.44Å; V598-W644 HydrophobicContact CG1-CE3 3.9Å; V598-W644 HydrophobicContact CG1-CZ3 4.46Å; L599-W644 PolarHBondContact O-N 3.03Å; A601-W644 HydrophobicContact CB-CH2 4.03Å; A601-W644 HydrophobicContact CB-CZ3 3.81Å; P615-W644 HydrophobicContact CB-CZ2 4.09Å; P615-W644 HydrophobicContact CG-CZ2 4.42Å; V617-W644 HydrophobicContact CG2-CD2 4.35Å; V617-W644 HydrophobicContact CG2-CE3 4.15Å; V617-W644 HydrophobicContact CG2-CH2 3.55Å; V617-W644 HydrophobicContact CG2-CZ2 3.78Å; V617-W644 HydrophobicContact CG2-CZ3 3.77Å; T633-W644 HydrophobicContact CG2-CB 4.2Å; T633-W644 HydrophobicContact CG2-CG 4.06Å; T633-W644 VanDerWaalsContact OG1-CD1 3.3Å; T633-W644 PolarHBondContact OG1-NE1 3.23Å; K634-W644 PolarHBondContact O-NE1 3.31Å; K634-W644 VanDerWaalsContact O-NE1 3.12Å; V636-W644 HydrophobicContact CG2-CG 4.39Å; P642-W644 HydrophobicContact CB-CD2 4.35Å; P642-W644 HydrophobicContact CB-CE3 4.49Å; P642-W644 HydrophobicContact CB-CH2 3.92Å; P642-W644 HydrophobicContact CB-CZ2 3.71Å; P642-W644 HydrophobicContact CB-CZ3 4.28Å; P642-W644 HydrophobicContact CG-CE3 4.36Å; P642-W644 HydrophobicContact CG-CH2 3.24Å; P642-W644 HydrophobicContact CG-CZ2 3.51Å; P642-W644 HydrophobicContact CG-CZ3 3.7Å; W644-Q646 VanDerWaalsContact C-N 3.28Å; W644-Q646 HydrophobicContact CB-CB 4.46Å; W644-Q646 PolarHBondContact O-N 2.89Å; W644-V667 HydrophobicContact CH2-CG1 4.37Å
645	N	95.2	Very high	93.8	Very high	111 Å²	111	68.5 Å²	68.5	59%	0.594	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	41.1	55.1	-175.1	-64.2	-8.1	0	0	0	112	V598 L599	V598-N645 WeakPolarHBondContact O-CA 3.33Å; V598-N645 PolarHBondContact O-N 3.18Å; L599-N645 PolarHBondContact O-N 3.37Å; L599-N645 PolarHBondContact O-OD1 3.01Å
646	Q	96.6	Very high	93.6	Very high	40 Å²	40	76 Å²	76	19%	0.187	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	115	-171.7	-170.8	174	-24.4	0	0	111.7	V598 R632 T633 W644 F648	V598-Q646 PolarHBondContact N-O 3.27Å; V598-Q646 PolarHBondContact O-N 3.41Å; R632-Q646 PolarHBondContact O-NE2 3.03Å; T633-Q646 HydrophobicContact CG2-CB 4.36Å; W644-Q646 VanDerWaalsContact C-N 3.28Å; W644-Q646 HydrophobicContact CB-CB 4.46Å; W644-Q646 PolarHBondContact O-N 2.89Å; Q646-F648 HydrophobicContact CB-CE2 4.22Å; Q646-F648 HydrophobicContact CB-CZ 4.36Å; Q646-F648 VanDerWaalsContact CD-CZ 3.49Å; Q646-F648 HydrophobicContact CG-CE1 4.21Å; Q646-F648 HydrophobicContact CG-CE2 3.94Å; Q646-F648 HydrophobicContact CG-CZ 3.7Å; Q646-F648 WeakPolarHBondContact O-CD2 3.32Å; Q646-F648 WeakPolarHBondContact O-CE2 3.38Å
647	T	96.9	Very high	93.4	Very high	78 Å²	78	76.1 Å²	76.1	48%	0.479	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	143.2	173.9	-41.9	0	0	0	0	111.9	W586 I595 V596 N597	W586-T647 HydrophobicContact CH2-CG2 4.18Å; I595-T647 HydrophobicContact CG2-CG2 3.5Å; I595-T647 VanDerWaalsContact CG2-CG2 3.5Å; V596-T647 CarbonylContact O-C 3.58Å; V596-T647 WeakPolarHBondContact O-CA 3.49Å; N597-T647 VanDerWaalsContact OD1-CA 3.29Å; N597-T647 WeakPolarHBondContact OD1-CA 3.26Å; N597-T647 WeakPolarHBondContact OD1-CB 3.24Å; N597-T647 WeakPolarHBondContact OD1-CG2 3.46Å; N597-T647 PolarHBondContact OD1-OG1 3.13Å
648	F	97	Very high	93.5	Very high	19 Å²	19	69.2 Å²	69.2	8%	0.083	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147.4	168.8	-55.5	-86.2	0	0	0	110.1	V596 V598 M619 R631 R632 T633 Q646	V596-F648 PolarHBondContact N-O 3.08Å; V596-F648 PolarHBondContact O-N 2.8Å; V598-F648 HydrophobicContact CB-CE2 4.44Å; V598-F648 HydrophobicContact CG2-CD2 4.3Å; V598-F648 HydrophobicContact CG2-CE2 4.03Å; M619-F648 HydrophobicContact CE-CB 3.98Å; M619-F648 HydrophobicContact CE-CD2 3.31Å; M619-F648 HydrophobicContact CE-CE2 3.84Å; M619-F648 HydrophobicContact CE-CG 3.73Å; R631-F648 HydrophobicContact CB-CB 4.49Å; R631-F648 HydrophobicContact CB-CD1 3.74Å; R631-F648 HydrophobicContact CB-CE1 3.99Å; R631-F648 HydrophobicContact CB-CG 4.06Å; R631-F648 HydrophobicContact CG-CB 4.09Å; R631-F648 HydrophobicContact CG-CD1 3.99Å; R631-F648 HydrophobicContact CG-CG 4.18Å; R632-F648 WeakPolarHBondContact O-CE1 3.31Å; R632-F648 WeakPolarHBondContact O-CZ 3.26Å; T633-F648 HydrophobicContact CG2-CE2 3.75Å; T633-F648 HydrophobicContact CG2-CZ 3.76Å; Q646-F648 HydrophobicContact CB-CE2 4.22Å; Q646-F648 HydrophobicContact CB-CZ 4.36Å; Q646-F648 VanDerWaalsContact CD-CZ 3.49Å; Q646-F648 HydrophobicContact CG-CE1 4.21Å; Q646-F648 HydrophobicContact CG-CE2 3.94Å; Q646-F648 HydrophobicContact CG-CZ 3.7Å; Q646-F648 WeakPolarHBondContact O-CD2 3.32Å; Q646-F648 WeakPolarHBondContact O-CE2 3.38Å
649	V	96	Very high	93.5	Very high	56 Å²	56	72.8 Å²	72.8	34%	0.339	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.4	179	-176	0	0	0	0	110	Q593 I595 R631	Q593-V649 HydrophobicContact CB-CG1 3.97Å; Q593-V649 HydrophobicContact CG-CG1 4.47Å; I595-V649 HydrophobicContact CG1-CG1 4.47Å; I595-V649 HydrophobicContact CG1-CG2 4.24Å; I595-V649 HydrophobicContact CG2-CG2 4.13Å; R631-V649 PolarHBondContact NE-O 2.95Å; R631-V649 PolarHBondContact NH2-O 3.23Å
650	Y	95.1	Very high	93.4	Very high	7 Å²	7	75.5 Å²	75.5	3%	0.027	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	108	166.2	-60.4	-69.2	0	0	0	108.7	Q593 L594 V596 F621 S629 R631 V653 L663	Q593-Y650 CarbonylContact C-O 3.47Å; Q593-Y650 VanDerWaalsContact CA-O 3.26Å; Q593-Y650 WeakPolarHBondContact CA-O 3.38Å; L594-Y650 HydrophobicContact CD2-CD2 4.33Å; L594-Y650 PolarHBondContact N-O 2.68Å; L594-Y650 PolarHBondContact O-N 2.91Å; V596-Y650 HydrophobicContact CG2-CD2 4.2Å; V596-Y650 HydrophobicContact CG2-CE2 3.97Å; F621-Y650 HydrophobicContact CB-CD1 4.1Å; F621-Y650 HydrophobicContact CB-CE1 3.89Å; F621-Y650 HydrophobicContact CB-CE2 4.42Å; F621-Y650 HydrophobicContact CB-CG 4.47Å; F621-Y650 AromaticContact CD2-CD2 3.96Å; F621-Y650 HydrophobicContact CD2-CD2 3.96Å; F621-Y650 HydrophobicContact CD2-CE2 4.12Å; F621-Y650 HydrophobicContact CD2-CG 4.22Å; F621-Y650 HydrophobicContact CE2-CD2 4.47Å; F621-Y650 HydrophobicContact CG-CD1 4.29Å; F621-Y650 HydrophobicContact CG-CD2 4.39Å; F621-Y650 HydrophobicContact CG-CG 4.23Å; S629-Y650 VanDerWaalsContact O-CE1 3.23Å; S629-Y650 WeakPolarHBondContact O-CE1 3.43Å; S629-Y650 PolarHBondContact O-OH 2.86Å; R631-Y650 HydrophobicContact CG-CE1 3.66Å; R631-Y650 VanDerWaalsContact CG-OH 3.25Å; R631-Y650 WeakPolarHBondContact CG-OH 3.38Å; Y650-V653 WeakPolarHBondContact O-CG2 3.28Å; Y650-L663 HydrophobicContact CE2-CD1 3.76Å
651	S	93	Very high	93.4	Very high	63 Å²	63	75.1 Å²	75.1	44%	0.441	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	159.8	178.7	-46.8	0	0	0	0	111.7	Q593 V653	Q593-S651 PolarHBondContact OE1-OG 2.6Å; S651-V653 VanDerWaalsContact C-N 3.26Å; S651-V653 PolarHBondContact O-N 3.25Å
652	H	89.2	Confident	93.4	Very high	157 Å²	157	71 Å²	71	73%	0.727	33%	0.326	S	S	*	.	S	Bend	trans	66	18.9	-176.3	-43.8	-69	0	0	0	115.2	H592 H654	H592-H652 PolarHBondContact O-N 2.81Å; H652-H654 PolarHBondContact O-ND1 3.43Å; H652-H654 VanDerWaalsContact O-ND1 3.1Å
653	V	92.3	Very high	93.4	Very high	4 Å²	4	71 Å²	71	2%	0.024	33%	0.326	C	S	.	.			trans	-86.9	118.1	173.7	-170.1	0	0	0	0	108.3	Y587 H592 L594 F621 Y650 S651 F658	Y587-V653 WeakPolarHBondContact CE2-O 3.27Å; Y587-V653 PolarHBondContact OH-O 3.12Å; H592-V653 CarbonylContact C-O 3.57Å; H592-V653 VanDerWaalsContact C-O 3.25Å; H592-V653 WeakPolarHBondContact CA-O 3.5Å; H592-V653 WeakPolarHBondContact CB-O 3.46Å; H592-V653 PolarHBondContact O-N 2.95Å; L594-V653 HydrophobicContact CB-CG2 4.48Å; F621-V653 HydrophobicContact CD1-CG2 4.45Å; F621-V653 HydrophobicContact CE1-CB 4.41Å; F621-V653 HydrophobicContact CE1-CG1 3.95Å; F621-V653 HydrophobicContact CE1-CG2 3.54Å; F621-V653 HydrophobicContact CE2-CG2 4.48Å; F621-V653 HydrophobicContact CZ-CB 4.21Å; F621-V653 HydrophobicContact CZ-CG1 3.46Å; F621-V653 VanDerWaalsContact CZ-CG1 3.46Å; F621-V653 HydrophobicContact CZ-CG2 3.6Å; Y650-V653 WeakPolarHBondContact O-CG2 3.28Å; S651-V653 VanDerWaalsContact C-N 3.26Å; S651-V653 PolarHBondContact O-N 3.25Å; V653-F658 HydrophobicContact CG1-CD1 4.22Å; V653-F658 HydrophobicContact CG1-CE1 3.65Å
654	H	92.2	Very high	93.4	Very high	56 Å²	56	65.3 Å²	65.3	26%	0.259	30%	0.301	S	S	.	.			trans	-98.2	145.2	178.6	-58.3	69.1	0	0	0	110.1	H592 H652 R656 D657 F658	H592-H654 AromaticContact CD2-CD2 3.41Å; H592-H654 PolarHBondContact CD2-CD2 3.26Å; H592-H654 VanDerWaalsContact CD2-CD2 3.41Å; H592-H654 AromaticContact CD2-NE2 3.42Å; H592-H654 PolarHBondContact CD2-NE2 2.93Å; H592-H654 AromaticContact NE2-CD2 3.83Å; H652-H654 PolarHBondContact O-ND1 3.43Å; H652-H654 VanDerWaalsContact O-ND1 3.1Å; H654-R656 HydrophobicContact CB-CG 4.04Å; H654-R656 PolarHBondContact O-N 3.38Å; H654-R656 VanDerWaalsContact O-N 3.08Å; H654-D657 WeakPolarHBondContact O-CB 3.25Å; H654-D657 PolarHBondContact O-N 2.81Å; H654-F658 WeakPolarHBondContact O-CD1 3.49Å
655	R	89.7	Confident	93.4	Very high	115 Å²	115	64.3 Å²	64.3	43%	0.434	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-56.7	-27.5	-178.7	-168.8	58.8	173.2	97	-11.8	114.2	Y587 D657 F658	Y587-R655 HydrophobicContact CE1-CB 3.89Å; Y587-R655 HydrophobicContact CE1-CG 4.44Å; Y587-R655 PolarHBondContact OH-N 3.12Å; R655-D657 VanDerWaalsContact C-N 3.3Å; R655-D657 PolarHBondContact O-N 2.89Å; R655-F658 WeakPolarHBondContact O-CB 3.45Å; R655-F658 PolarHBondContact O-N 3.39Å
656	R	90.9	Very high	93.4	Very high	186 Å²	186	59.3 Å²	59.3	70%	0.702	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-63	-33.2	174	72.6	-172.7	170.8	-159.5	-10.9	113	H654 F658	H654-R656 HydrophobicContact CB-CG 4.04Å; H654-R656 PolarHBondContact O-N 3.38Å; H654-R656 VanDerWaalsContact O-N 3.08Å; R656-F658 PolarHBondContact O-N 2.79Å
657	D	91	Very high	93.4	Very high	31 Å²	31	57.4 Å²	57.4	17%	0.166	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-74.7	-11.5	-176.4	-54.6	18	0	0	0	112.2	H654 R655 R659 E660 R661	H654-D657 WeakPolarHBondContact O-CB 3.25Å; H654-D657 PolarHBondContact O-N 2.81Å; R655-D657 VanDerWaalsContact C-N 3.3Å; R655-D657 PolarHBondContact O-N 2.89Å; D657-R659 PolarHBondContact O-N 3.34Å; D657-R659 VanDerWaalsContact O-N 3.1Å; D657-E660 PolarHBondContact O-N 3.15Å; D657-E660 VanDerWaalsContact O-N 3.11Å; D657-R661 HydrophobicContact CB-CG 4.34Å; D657-R661 VanDerWaalsContact O-CG 3.32Å; D657-R661 WeakPolarHBondContact O-CG 3.49Å; D657-R661 IonicContact OD2-CZ 3.39Å; D657-R661 IonicContact OD2-NE 3.87Å; D657-R661 PolarHBondContact OD2-NE 3.18Å; D657-R661 VanDerWaalsContact OD2-NE 3.1Å; D657-R661 IonicContact OD2-NH2 2.66Å; D657-R661 PolarHBondContact OD2-NH2 3.38Å
658	F	92.9	Very high	93.3	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.009	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-64.9	-18	-170.5	-78.8	37.2	0	0	0	113.1	Y587 V653 H654 R655 R656 L688 E689 L693	Y587-F658 HydrophobicContact CD1-CZ 4.4Å; Y587-F658 HydrophobicContact CD2-CE1 4.1Å; Y587-F658 HydrophobicContact CD2-CE2 4.5Å; Y587-F658 AromaticContact CD2-CZ 3.49Å; Y587-F658 HydrophobicContact CD2-CZ 3.49Å; Y587-F658 VanDerWaalsContact CD2-CZ 3.49Å; Y587-F658 HydrophobicContact CE2-CE1 4.03Å; Y587-F658 AromaticContact CE2-CZ 3.88Å; Y587-F658 HydrophobicContact CE2-CZ 3.88Å; Y587-F658 HydrophobicContact CG-CE2 4.4Å; Y587-F658 AromaticContact CG-CZ 3.77Å; Y587-F658 HydrophobicContact CG-CZ 3.77Å; V653-F658 HydrophobicContact CG1-CD1 4.22Å; V653-F658 HydrophobicContact CG1-CE1 3.65Å; H654-F658 WeakPolarHBondContact O-CD1 3.49Å; R655-F658 WeakPolarHBondContact O-CB 3.45Å; R655-F658 PolarHBondContact O-N 3.39Å; R656-F658 PolarHBondContact O-N 2.79Å; F658-L688 HydrophobicContact CB-CB 3.81Å; F658-L688 HydrophobicContact CD2-CB 3.68Å; F658-L688 VanDerWaalsContact CD2-O 3.27Å; F658-L688 WeakPolarHBondContact CD2-O 3.43Å; F658-L688 HydrophobicContact CE2-CB 4.34Å; F658-L688 HydrophobicContact CG-CB 3.75Å; F658-E689 PolarHBondContact O-N 2.9Å; F658-E689 VanDerWaalsContact O-N 3.15Å; F658-L693 HydrophobicContact CD2-CD1 4.2Å; F658-L693 HydrophobicContact CE2-CD1 3.7Å
659	R	90.5	Very high	93.2	Very high	182 Å²	182	55.6 Å²	55.6	69%	0.687	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-73	-26.7	176.7	-44	-162.2	121.3	154.7	7.7	113.7	D657 E689	D657-R659 PolarHBondContact O-N 3.34Å; D657-R659 VanDerWaalsContact O-N 3.1Å; R659-E689 WeakPolarHBondContact CB-OE2 3.23Å; R659-E689 VanDerWaalsContact CG-OE2 3.28Å; R659-E689 WeakPolarHBondContact CG-OE2 3.47Å; R659-E689 IonicContact CZ-OE1 3.33Å; R659-E689 IonicContact NE-OE1 3.18Å; R659-E689 PolarHBondContact NE-OE1 3.33Å; R659-E689 IonicContact NE-OE2 3.84Å; R659-E689 PolarHBondContact NE-OE2 3.43Å; R659-E689 IonicContact NH2-OE1 3.26Å; R659-E689 PolarHBondContact NH2-OE1 2.92Å
660	E	89.7	Confident	93	Very high	144 Å²	144	56.4 Å²	56.4	67%	0.673	25%	0.246	S	C	*	.	S	Bend	trans	-114.1	12.3	-172.4	-63.8	177.1	-167.6	0	0	111.9	D657	D657-E660 PolarHBondContact O-N 3.15Å; D657-E660 VanDerWaalsContact O-N 3.11Å
661	R	91.1	Very high	92.5	Very high	64 Å²	64	56.8 Å²	56.8	24%	0.242	25%	0.25	C	C	.	.			trans	-135.4	142	-171.7	-68.2	-172.6	-171.3	-83.5	4.3	112	F621 L622 D657 L688	F621-R661 VanDerWaalsContact CE1-CD 3.46Å; F621-R661 HydrophobicContact CZ-CB 4.49Å; L622-R661 WeakPolarHBondContact O-CA 3.33Å; L622-R661 WeakPolarHBondContact O-CB 3.39Å; D657-R661 HydrophobicContact CB-CG 4.34Å; D657-R661 VanDerWaalsContact O-CG 3.32Å; D657-R661 WeakPolarHBondContact O-CG 3.49Å; D657-R661 IonicContact OD2-CZ 3.39Å; D657-R661 IonicContact OD2-NE 3.87Å; D657-R661 PolarHBondContact OD2-NE 3.18Å; D657-R661 VanDerWaalsContact OD2-NE 3.1Å; D657-R661 IonicContact OD2-NH2 2.66Å; D657-R661 PolarHBondContact OD2-NH2 3.38Å; R661-L688 HydrophobicContact CB-CD1 3.63Å; R661-L688 HydrophobicContact CB-CG 4.48Å; R661-L688 WeakPolarHBondContact O-CG 3.38Å; R661-L688 PolarHBondContact O-N 2.95Å
662	M	93.8	Very high	91.7	Very high	27 Å²	27	59.6 Å²	59.6	13%	0.133	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.2	177.9	-54.5	171.4	84.6	0	0	109.7	L622 L685 I686 E687 L710	L622-M662 HydrophobicContact CB-CB 4.28Å; L622-M662 WeakPolarHBondContact CB-O 3.39Å; L622-M662 HydrophobicContact CD1-CB 4.37Å; L622-M662 PolarHBondContact N-O 3.49Å; M662-L685 HydrophobicContact CE-CB 3.99Å; M662-I686 CarbonylContact C-O 3.41Å; M662-I686 VanDerWaalsContact CA-O 3.27Å; M662-I686 WeakPolarHBondContact CA-O 3.27Å; M662-E687 HydrophobicContact CE-CG 3.81Å; M662-E687 HydrophobicContact CG-CG 4.45Å; M662-L710 HydrophobicContact SD-CD2 3.93Å
663	L	95.7	Very high	91.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.4	169.5	179.7	64.5	0	0	0	109	L585 V596 M619 Y650 I665 I686 L688	L585-L663 HydrophobicContact CD2-CD2 3.79Å; V596-L663 HydrophobicContact CB-CD2 4.43Å; V596-L663 HydrophobicContact CG1-CD2 3.86Å; V596-L663 HydrophobicContact CG2-CD1 4.45Å; V596-L663 HydrophobicContact CG2-CD2 3.64Å; M619-L663 HydrophobicContact CB-CD1 4.48Å; Y650-L663 HydrophobicContact CE2-CD1 3.76Å; L663-I665 HydrophobicContact CD2-CD1 3.87Å; L663-I665 HydrophobicContact CD2-CG1 4.28Å; L663-I665 HydrophobicContact CG-CD1 4.04Å; L663-I665 HydrophobicContact CG-CG1 3.88Å; L663-I686 HydrophobicContact CB-CB 4.39Å; L663-I686 PolarHBondContact N-O 2.61Å; L663-I686 PolarHBondContact O-N 3.36Å; L663-L688 HydrophobicContact CB-CD2 4.19Å
664	E	95.7	Very high	90	Very high	8 Å²	8	64.2 Å²	64.2	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.9	175.8	171.3	176	-81.4	0	0	109.3	M619 Y620 L622 R625 T666 L685	M619-E664 CarbonylContact C-O 3.59Å; M619-E664 WeakPolarHBondContact CA-O 3.18Å; M619-E664 WeakPolarHBondContact CB-O 3.4Å; Y620-E664 WeakPolarHBondContact CD2-OE2 3.45Å; Y620-E664 PolarHBondContact N-O 3.31Å; Y620-E664 PolarHBondContact O-N 3.21Å; L622-E664 HydrophobicContact CD1-CB 3.95Å; L622-E664 HydrophobicContact CD2-CB 4.24Å; L622-E664 HydrophobicContact CG-CB 3.92Å; R625-E664 IonicContact CZ-OE1 3.45Å; R625-E664 IonicContact CZ-OE2 2.69Å; R625-E664 IonicContact NE-OE1 2.78Å; R625-E664 PolarHBondContact NE-OE1 3.07Å; R625-E664 IonicContact NE-OE2 3.45Å; R625-E664 PolarHBondContact NE-OE2 3.17Å; R625-E664 IonicContact NH2-OE1 3.3Å; R625-E664 PolarHBondContact NH2-OE1 2.85Å; R625-E664 IonicContact NH2-OE2 3.99Å; E664-T666 HydrophobicContact CG-CG2 4.2Å; E664-L685 HydrophobicContact CB-CD2 3.94Å; E664-L685 HydrophobicContact CG-CD2 4.18Å
665	I	96.2	Very high	89	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	110.9	-177.2	-50.9	-174.5	0	0	0	108.9	L581 V583 V617 M619 L663 E683 I684 I686	L581-I665 HydrophobicContact CD2-CG2 3.46Å; L581-I665 VanDerWaalsContact CD2-CG2 3.46Å; V583-I665 HydrophobicContact CG1-CD1 4.11Å; V583-I665 HydrophobicContact CG2-CD1 4.06Å; V617-I665 HydrophobicContact CG1-CG2 3.47Å; V617-I665 VanDerWaalsContact CG1-CG2 3.47Å; M619-I665 HydrophobicContact CG-CB 4.46Å; M619-I665 HydrophobicContact CG-CG1 4.23Å; M619-I665 HydrophobicContact CG-CG2 4.12Å; M619-I665 HydrophobicContact SD-CD1 4.23Å; M619-I665 HydrophobicContact SD-CG1 4.12Å; M619-I665 HydrophobicContact SD-CG2 4.34Å; L663-I665 HydrophobicContact CD2-CD1 3.87Å; L663-I665 HydrophobicContact CD2-CG1 4.28Å; L663-I665 HydrophobicContact CG-CD1 4.04Å; L663-I665 HydrophobicContact CG-CG1 3.88Å; I665-E683 CarbonylContact O-C 2.98Å; I665-E683 WeakPolarHBondContact O-CA 3.3Å; I665-I684 HydrophobicContact CB-CB 4.39Å; I665-I684 PolarHBondContact N-O 3.37Å; I665-I684 PolarHBondContact O-N 2.89Å; I665-I686 HydrophobicContact CD1-CD1 3.81Å
666	T	95.3	Very high	88.5	Confident	7 Å²	7	66.3 Å²	66.3	4%	0.043	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	134.1	-176.6	57	0	0	0	0	110.9	V617 K618 E664 W668 F680 E683	V617-T666 CarbonylContact C-O 3.52Å; V617-T666 WeakPolarHBondContact CA-O 3.4Å; K618-T666 WeakPolarHBondContact CB-OG1 3.23Å; K618-T666 PolarHBondContact N-O 3.4Å; K618-T666 PolarHBondContact O-N 2.65Å; K618-T666 PolarHBondContact O-OG1 3.03Å; E664-T666 HydrophobicContact CG-CG2 4.2Å; T666-W668 VanDerWaalsContact CB-NE1 3.28Å; T666-W668 PolarHBondContact OG1-NE1 2.73Å; T666-F680 HydrophobicContact CG2-CE2 4.22Å; T666-E683 HydrophobicContact CG2-CB 3.81Å
667	V	96.3	Very high	88.1	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.3	-179.3	-168	0	0	0	0	109.8	L581 L604 V617 W644 L681 G682 L702	L581-V667 HydrophobicContact CD2-CG2 4.45Å; L604-V667 HydrophobicContact CD1-CG1 4.46Å; L604-V667 HydrophobicContact CD2-CG1 4.28Å; V617-V667 HydrophobicContact CG2-CG2 4.33Å; W644-V667 HydrophobicContact CH2-CG1 4.37Å; V667-L681 HydrophobicContact CB-CB 4.27Å; V667-L681 HydrophobicContact CG1-CB 4.23Å; V667-L681 HydrophobicContact CG1-CD1 4.22Å; V667-L681 PolarHBondContact O-N 2.94Å; V667-G682 PolarHBondContact N-O 3.44Å; V667-L702 HydrophobicContact CB-CD1 4.43Å; V667-L702 HydrophobicContact CG2-CD1 4.23Å; V667-L702 HydrophobicContact CG2-CD2 3.7Å
668	W	95.5	Very high	88.1	Confident	58 Å²	58	66.5 Å²	66.5	22%	0.22	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	141.2	-170.7	-64.4	75.4	0	0	0	111.4	P615 Y616 K618 T666 S678 E679 F680	P615-W668 CarbonylContact C-O 3.59Å; P615-W668 VanDerWaalsContact CA-O 3.25Å; P615-W668 WeakPolarHBondContact CA-O 3.42Å; Y616-W668 HydrophobicContact CD1-CB 4.04Å; Y616-W668 VanDerWaalsContact CD1-O 3.23Å; Y616-W668 WeakPolarHBondContact CD1-O 3.4Å; Y616-W668 HydrophobicContact CD2-CB 4.23Å; Y616-W668 HydrophobicContact CE1-CB 3.54Å; Y616-W668 HydrophobicContact CE2-CB 3.77Å; Y616-W668 HydrophobicContact CE2-CG 4.15Å; Y616-W668 HydrophobicContact CG-CB 4.37Å; Y616-W668 VanDerWaalsContact CZ-CB 3.4Å; Y616-W668 PolarHBondContact N-O 2.9Å; Y616-W668 PolarHBondContact O-N 2.75Å; K618-W668 VanDerWaalsContact CD-CD1 3.49Å; K618-W668 HydrophobicContact CD-CD2 4.04Å; K618-W668 HydrophobicContact CD-CG 3.94Å; K618-W668 HydrophobicContact CD-CZ2 4.28Å; K618-W668 VanDerWaalsContact CD-NE1 3.28Å; T666-W668 VanDerWaalsContact CB-NE1 3.28Å; T666-W668 PolarHBondContact OG1-NE1 2.73Å; W668-S678 VanDerWaalsContact CE3-O 3.29Å; W668-S678 WeakPolarHBondContact CZ3-O 3.48Å; W668-E679 CarbonylContact C-O 3.52Å; W668-E679 WeakPolarHBondContact CA-O 3.49Å; W668-F680 HydrophobicContact CD2-CD2 4.41Å; W668-F680 AromaticContact CE2-CD2 3.98Å; W668-F680 HydrophobicContact CE3-CB 4.21Å; W668-F680 HydrophobicContact CH2-CB 4.44Å; W668-F680 HydrophobicContact CH2-CD2 4.46Å; W668-F680 HydrophobicContact CZ2-CD2 4.03Å; W668-F680 HydrophobicContact CZ3-CB 4.16Å
669	D	94.4	Very high	88	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	124.7	169.4	-177.9	18.5	0	0	0	110.5	R607 R613 N614 P671 S678 E679 L681	R607-D669 IonicContact CZ-OD2 3.23Å; R607-D669 VanDerWaalsContact CZ-OD2 3.23Å; R607-D669 IonicContact NE-OD2 2.76Å; R607-D669 PolarHBondContact NE-OD2 3.14Å; R607-D669 IonicContact NH2-OD2 2.82Å; R607-D669 PolarHBondContact NH2-OD2 2.77Å; R613-D669 VanDerWaalsContact CD-CG 3.49Å; R613-D669 WeakPolarHBondContact CD-OD2 3.37Å; R613-D669 IonicContact CZ-OD2 3.68Å; R613-D669 IonicContact NE-OD2 3.91Å; R613-D669 IonicContact NH1-OD2 3.16Å; R613-D669 PolarHBondContact NH1-OD2 2.85Å; N614-D669 PolarHBondContact N-OD1 3.06Å; D669-P671 WeakPolarHBondContact O-CD 3.01Å; D669-S678 VanDerWaalsContact O-CA 3.31Å; D669-S678 WeakPolarHBondContact O-CA 3.46Å; D669-S678 WeakPolarHBondContact O-CB 3.34Å; D669-E679 HydrophobicContact CB-CB 4.25Å; D669-E679 PolarHBondContact N-O 3.42Å; D669-E679 PolarHBondContact O-N 3.06Å; D669-L681 HydrophobicContact CB-CD1 4.12Å; D669-L681 HydrophobicContact CB-CD2 4.17Å; D669-L681 HydrophobicContact CB-CG 4.22Å
670	Q	92.8	Very high	88.1	Confident	73 Å²	73	64.3 Å²	64.3	34%	0.341	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-85.6	123.8	170.3	-166.9	172.3	0.4	0	0	110.4	N614 Y616 T635	N614-Q670 WeakPolarHBondContact CB-O 3.33Å; N614-Q670 PolarHBondContact ND2-O 3.1Å; N614-Q670 PolarHBondContact O-N 3.1Å; Y616-Q670 HydrophobicContact CD1-CB 3.84Å; Y616-Q670 HydrophobicContact CE1-CB 3.78Å; T635-Q670 HydrophobicContact CG2-CB 3.64Å; T635-Q670 PolarHBondContact OG1-OE1 3.41Å
671	P	84	Confident	88.2	Confident	16 Å²	16	57.7 Å²	57.7	10%	0.104	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-62.9	172.9	173.3	23.4	-33.7	0	0	0	113.7	D669 E676 E677	D669-P671 WeakPolarHBondContact O-CD 3.01Å; P671-E676 HydrophobicContact CB-CB 3.36Å; P671-E676 HydrophobicContact CB-CG 4.24Å; P671-E676 WeakPolarHBondContact CB-OE2 3.21Å; P671-E676 HydrophobicContact CG-CB 3.6Å; P671-E676 WeakPolarHBondContact CG-O 3.45Å; P671-E677 WeakPolarHBondContact CD-O 3.43Å; P671-E677 VanDerWaalsContact CG-O 3.29Å; P671-E677 WeakPolarHBondContact CG-O 3.46Å
672	R	75.8	Confident	88.2	Confident	122 Å²	122	54.6 Å²	54.6	46%	0.46	26%	0.263	S	S	.	.	S	Bend	trans	-99.1	-29	-179.3	-59.9	-177.1	-169.1	145.1	10.2	112.7	P612	P612-R672 PolarHBondContact O-NH2 2.95Å
673	V	78.5	Confident	88.2	Confident	70 Å²	70	53.8 Å²	53.8	42%	0.424	26%	0.259	S	S	.	.	S	Bend	trans	-77.9	147.5	165.7	-172	0	0	0	0	107.2	D675 E676	V673-D675 VanDerWaalsContact C-N 3.27Å; V673-D675 HydrophobicContact CG1-CB 4.2Å; V673-D675 VanDerWaalsContact CG1-OD2 3.22Å; V673-D675 WeakPolarHBondContact CG1-OD2 3.46Å; V673-E676 HydrophobicContact CB-CB 4.22Å; V673-E676 HydrophobicContact CB-CG 3.83Å; V673-E676 HydrophobicContact CG2-CG 4.23Å; V673-E676 PolarHBondContact N-OE2 2.8Å
674	Q	67.2	Low	88.1	Confident	187 Å²	187	54 Å²	54	87%	0.874	26%	0.26	S	S	*	.	S	Bend	trans	-79.6	-19.2	-178.7	-175.9	164.5	-32.9	0	0	112.1
675	D	73.3	Confident	88.1	Confident	146 Å²	146	55.7 Å²	55.7	78%	0.781	27%	0.268	S	S	*	.	S	Bend	trans	-101.8	-7.4	-171.2	-31.9	-78.2	0	0	0	112.2	V673	V673-D675 VanDerWaalsContact C-N 3.27Å; V673-D675 HydrophobicContact CG1-CB 4.2Å; V673-D675 VanDerWaalsContact CG1-OD2 3.22Å; V673-D675 WeakPolarHBondContact CG1-OD2 3.46Å
676	E	77.6	Confident	88	Confident	70 Å²	70	56 Å²	56	33%	0.327	27%	0.27	S	S	.	.	S	Bend	trans	-76.3	144.8	165.4	-79.6	171.8	162.1	0	0	109	R611 P671 V673	R611-E676 IonicContact NH1-OE1 3.77Å; R611-E676 PolarHBondContact NH1-OE1 2.84Å; P671-E676 HydrophobicContact CB-CB 3.36Å; P671-E676 HydrophobicContact CB-CG 4.24Å; P671-E676 WeakPolarHBondContact CB-OE2 3.21Å; P671-E676 HydrophobicContact CG-CB 3.6Å; P671-E676 WeakPolarHBondContact CG-O 3.45Å; V673-E676 HydrophobicContact CB-CB 4.22Å; V673-E676 HydrophobicContact CB-CG 3.83Å; V673-E676 HydrophobicContact CG2-CG 4.23Å; V673-E676 PolarHBondContact N-OE2 2.8Å
677	E	83	Confident	87.9	Confident	181 Å²	181	59.9 Å²	59.9	85%	0.846	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-79.7	159.8	175.1	-63.1	-164.8	149.4	0	0	113	P671 E679	P671-E677 WeakPolarHBondContact CD-O 3.43Å; P671-E677 VanDerWaalsContact CG-O 3.29Å; P671-E677 WeakPolarHBondContact CG-O 3.46Å; E677-E679 PolarHBondContact O-N 3.08Å
678	S	90.4	Very high	87.8	Confident	39 Å²	39	59.9 Å²	59.9	27%	0.273	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-76.6	120.3	173.9	-62.6	0	0	0	0	110.9	Y616 W668 D669	Y616-S678 WeakPolarHBondContact OH-CB 3.44Å; Y616-S678 PolarHBondContact OH-OG 2.56Å; W668-S678 VanDerWaalsContact CE3-O 3.29Å; W668-S678 WeakPolarHBondContact CZ3-O 3.48Å; D669-S678 VanDerWaalsContact O-CA 3.31Å; D669-S678 WeakPolarHBondContact O-CA 3.46Å; D669-S678 WeakPolarHBondContact O-CB 3.34Å
679	E	90.5	Very high	87.7	Confident	80 Å²	80	61 Å²	61	37%	0.374	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	136.1	176.6	-163.9	-173.6	137.8	0	0	109.9	R613 W668 D669 E677	R613-E679 IonicContact CZ-OE1 2.86Å; R613-E679 VanDerWaalsContact CZ-OE1 3.25Å; R613-E679 IonicContact CZ-OE2 2.88Å; R613-E679 IonicContact NH1-OE1 3.52Å; R613-E679 PolarHBondContact NH1-OE1 2.7Å; R613-E679 IonicContact NH1-OE2 2.73Å; R613-E679 PolarHBondContact NH1-OE2 3.43Å; R613-E679 IonicContact NH2-OE1 3.75Å; R613-E679 PolarHBondContact NH2-OE1 3.15Å; R613-E679 IonicContact NH2-OE2 3.8Å; W668-E679 CarbonylContact C-O 3.52Å; W668-E679 WeakPolarHBondContact CA-O 3.49Å; D669-E679 HydrophobicContact CB-CB 4.25Å; D669-E679 PolarHBondContact N-O 3.42Å; D669-E679 PolarHBondContact O-N 3.06Å; E677-E679 PolarHBondContact O-N 3.08Å
680	F	92.7	Very high	87.5	Confident	59 Å²	59	65.5 Å²	65.5	26%	0.259	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	138.8	176	173.6	-96	0	0	0	110.4	T666 W668 G682 E683 H705	T666-F680 HydrophobicContact CG2-CE2 4.22Å; W668-F680 HydrophobicContact CD2-CD2 4.41Å; W668-F680 AromaticContact CE2-CD2 3.98Å; W668-F680 HydrophobicContact CE3-CB 4.21Å; W668-F680 HydrophobicContact CH2-CB 4.44Å; W668-F680 HydrophobicContact CH2-CD2 4.46Å; W668-F680 HydrophobicContact CZ2-CD2 4.03Å; W668-F680 HydrophobicContact CZ3-CB 4.16Å; F680-G682 VanDerWaalsContact CE1-N 3.32Å; F680-E683 HydrophobicContact CE2-CB 4.05Å; F680-E683 HydrophobicContact CZ-CB 3.8Å; F680-E683 HydrophobicContact CZ-CG 4.09Å; F680-H705 HydrophobicContact CE1-CB 3.76Å; F680-H705 HydrophobicContact CE2-CB 4.25Å; F680-H705 HydrophobicContact CZ-CB 3.59Å
681	L	92.2	Very high	87.4	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	-9.7	-178	-60.2	-176.6	0	0	0	114.2	L577 L604 R613 P615 V667 D669	L577-L681 WeakPolarHBondContact CD1-O 3.43Å; L604-L681 HydrophobicContact CD1-CD1 4.26Å; R613-L681 VanDerWaalsContact CZ-CD2 3.44Å; P615-L681 HydrophobicContact CB-CD1 4.23Å; V667-L681 HydrophobicContact CB-CB 4.27Å; V667-L681 HydrophobicContact CG1-CB 4.23Å; V667-L681 HydrophobicContact CG1-CD1 4.22Å; V667-L681 PolarHBondContact O-N 2.94Å; D669-L681 HydrophobicContact CB-CD1 4.12Å; D669-L681 HydrophobicContact CB-CD2 4.17Å; D669-L681 HydrophobicContact CB-CG 4.22Å
682	G	92	Very high	87.7	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137	163.7	-178.5	0	0	0	0	0	113.5	V667 F680 Q703	V667-G682 PolarHBondContact N-O 3.44Å; F680-G682 VanDerWaalsContact CE1-N 3.32Å; G682-Q703 CarbonylContact C-O 3.25Å; G682-Q703 VanDerWaalsContact CA-O 3.24Å; G682-Q703 WeakPolarHBondContact CA-O 3.3Å
683	E	94.2	Very high	88.5	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.047	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	166	-178.2	70.5	178	-169.4	0	0	114.5	I665 T666 F680 Q703 H705	I665-E683 CarbonylContact O-C 2.98Å; I665-E683 WeakPolarHBondContact O-CA 3.3Å; T666-E683 HydrophobicContact CG2-CB 3.81Å; F680-E683 HydrophobicContact CE2-CB 4.05Å; F680-E683 HydrophobicContact CZ-CB 3.8Å; F680-E683 HydrophobicContact CZ-CG 4.09Å; E683-Q703 PolarHBondContact N-O 3.23Å; E683-Q703 PolarHBondContact O-N 3.32Å; E683-H705 WeakPolarHBondContact OE1-CA 3.39Å; E683-H705 IonicContact OE2-CD2 3.11Å; E683-H705 PolarHBondContact OE2-CD2 3.24Å; E683-H705 IonicContact OE2-CG 3.25Å
684	I	93.5	Very high	89.1	Confident	4 Å²	4	63 Å²	63	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	129.1	174.1	-63.4	147.8	0	0	0	107.1	L581 I665 I686 Y700 L702	L581-I684 HydrophobicContact CB-CD1 3.5Å; L581-I684 VanDerWaalsContact CB-CD1 3.5Å; L581-I684 HydrophobicContact CD2-CD1 3.72Å; L581-I684 HydrophobicContact CG-CD1 4.23Å; I665-I684 HydrophobicContact CB-CB 4.39Å; I665-I684 PolarHBondContact N-O 3.37Å; I665-I684 PolarHBondContact O-N 2.89Å; I684-I686 HydrophobicContact CG2-CD1 4.12Å; I684-I686 HydrophobicContact CG2-CG1 3.64Å; I684-Y700 HydrophobicContact CG2-CD1 3.88Å; I684-Y700 HydrophobicContact CG2-CG 3.92Å; I684-L702 HydrophobicContact CD1-CD2 3.72Å; I684-L702 HydrophobicContact CG1-CD2 4.04Å
685	L	94.1	Very high	90.3	Very high	43 Å²	43	56.8 Å²	56.8	23%	0.225	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.5	167.1	-71.1	167.4	0	0	0	108.3	L622 M662 E664 S709 L710	L622-L685 HydrophobicContact CD1-CD2 4.06Å; M662-L685 HydrophobicContact CE-CB 3.99Å; E664-L685 HydrophobicContact CB-CD2 3.94Å; E664-L685 HydrophobicContact CG-CD2 4.18Å; L685-S709 WeakPolarHBondContact CD1-OG 3.35Å; L685-L710 HydrophobicContact CD1-CD2 4.2Å; L685-L710 HydrophobicContact CD2-CD2 4.29Å
686	I	94.6	Very high	91.3	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.041	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	110.4	178.4	-46.6	-179.4	0	0	0	109	L585 M662 L663 I665 I684 A691 Y700	L585-I686 HydrophobicContact CD1-CD1 4.03Å; L585-I686 HydrophobicContact CD1-CG2 4.14Å; M662-I686 CarbonylContact C-O 3.41Å; M662-I686 VanDerWaalsContact CA-O 3.27Å; M662-I686 WeakPolarHBondContact CA-O 3.27Å; L663-I686 HydrophobicContact CB-CB 4.39Å; L663-I686 PolarHBondContact N-O 2.61Å; L663-I686 PolarHBondContact O-N 3.36Å; I665-I686 HydrophobicContact CD1-CD1 3.81Å; I684-I686 HydrophobicContact CG2-CD1 4.12Å; I684-I686 HydrophobicContact CG2-CG1 3.64Å; I686-A691 HydrophobicContact CG2-CB 3.9Å; I686-Y700 HydrophobicContact CD1-CD1 4.25Å; I686-Y700 HydrophobicContact CD1-CD2 4.36Å; I686-Y700 HydrophobicContact CD1-CE1 3.85Å; I686-Y700 HydrophobicContact CD1-CE2 3.97Å; I686-Y700 HydrophobicContact CD1-CG 4.5Å; I686-Y700 HydrophobicContact CG1-CD1 4.35Å; I686-Y700 HydrophobicContact CG1-CE1 4.05Å; I686-Y700 HydrophobicContact CG2-CE1 4.43Å
687	E	94.2	Very high	92.1	Very high	87 Å²	87	54.4 Å²	54.4	41%	0.407	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	131.1	168.8	-67.9	171.9	174.9	0	0	110.4	M662 T690 A691	M662-E687 HydrophobicContact CE-CG 3.81Å; M662-E687 HydrophobicContact CG-CG 4.45Å; E687-T690 VanDerWaalsContact CB-OG1 3.31Å; E687-T690 WeakPolarHBondContact CB-OG1 3.27Å; E687-T690 PolarHBondContact OE2-OG1 2.71Å; E687-A691 VanDerWaalsContact O-CB 3.29Å; E687-A691 WeakPolarHBondContact O-CB 3.28Å; E687-A691 PolarHBondContact O-N 3.42Å
688	L	94.5	Very high	92.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-24.5	-176.3	-59.2	176.8	0	0	0	113.1	L594 F621 F658 R661 L663	L594-L688 HydrophobicContact CD2-CD1 4.27Å; L594-L688 HydrophobicContact CD2-CD2 3.72Å; F621-L688 HydrophobicContact CE2-CD1 3.43Å; F621-L688 VanDerWaalsContact CE2-CD1 3.43Å; F621-L688 HydrophobicContact CZ-CD1 3.64Å; F658-L688 HydrophobicContact CB-CB 3.81Å; F658-L688 HydrophobicContact CD2-CB 3.68Å; F658-L688 VanDerWaalsContact CD2-O 3.27Å; F658-L688 WeakPolarHBondContact CD2-O 3.43Å; F658-L688 HydrophobicContact CE2-CB 4.34Å; F658-L688 HydrophobicContact CG-CB 3.75Å; R661-L688 HydrophobicContact CB-CD1 3.63Å; R661-L688 HydrophobicContact CB-CG 4.48Å; R661-L688 WeakPolarHBondContact O-CG 3.38Å; R661-L688 PolarHBondContact O-N 2.95Å; L663-L688 HydrophobicContact CB-CD2 4.19Å
689	E	92.3	Very high	92.9	Very high	81 Å²	81	51.8 Å²	51.8	38%	0.379	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-36.6	175.9	-177.1	155.4	-150.1	0	0	112.4	F658 R659	F658-E689 PolarHBondContact O-N 2.9Å; F658-E689 VanDerWaalsContact O-N 3.15Å; R659-E689 WeakPolarHBondContact CB-OE2 3.23Å; R659-E689 VanDerWaalsContact CG-OE2 3.28Å; R659-E689 WeakPolarHBondContact CG-OE2 3.47Å; R659-E689 IonicContact CZ-OE1 3.33Å; R659-E689 IonicContact NE-OE1 3.18Å; R659-E689 PolarHBondContact NE-OE1 3.33Å; R659-E689 IonicContact NE-OE2 3.84Å; R659-E689 PolarHBondContact NE-OE2 3.43Å; R659-E689 IonicContact NH2-OE1 3.26Å; R659-E689 PolarHBondContact NH2-OE1 2.92Å
690	T	91	Very high	93.1	Very high	96 Å²	96	50.2 Å²	50.2	59%	0.589	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-6.8	-178	58.5	0	0	0	0	114	E687	E687-T690 VanDerWaalsContact CB-OG1 3.31Å; E687-T690 WeakPolarHBondContact CB-OG1 3.27Å; E687-T690 PolarHBondContact OE2-OG1 2.71Å
691	A	90.5	Very high	93.1	Very high	15 Å²	15	53.4 Å²	53.4	12%	0.124	26%	0.264	C	S	.	.			trans	-58.2	140.3	177.3	0	0	0	0	0	113.4	L585 I686 E687 L693	L585-A691 HydrophobicContact CD1-CB 4.34Å; I686-A691 HydrophobicContact CG2-CB 3.9Å; E687-A691 VanDerWaalsContact O-CB 3.29Å; E687-A691 WeakPolarHBondContact O-CB 3.28Å; E687-A691 PolarHBondContact O-N 3.42Å; A691-L693 HydrophobicContact CB-CD2 4.31Å; A691-L693 HydrophobicContact CB-CG 4.16Å; A691-L693 PolarHBondContact O-N 3.34Å
692	L	90.5	Very high	93.1	Very high	90 Å²	90	53.2 Å²	53.2	47%	0.471	26%	0.263	S	S	.	.			trans	-75	121.7	164.5	-59.9	174.5	0	0	0	108.2	H698	L692-H698 VanDerWaalsContact CD1-NE2 3.32Å; L692-H698 WeakPolarHBondContact CD1-NE2 3.49Å
693	L	92.5	Very high	92.9	Very high	40 Å²	40	57.3 Å²	57.3	21%	0.209	28%	0.282	C	S	.	.			trans	-125.1	27.9	-169.3	-66.3	162.6	0	0	0	110.9	L585 L594 F658 A691 D695	L585-L693 HydrophobicContact CB-CD2 4.18Å; L585-L693 CarbonylContact O-C 3.56Å; L585-L693 WeakPolarHBondContact O-CA 3.03Å; L594-L693 HydrophobicContact CD1-CD2 3.86Å; F658-L693 HydrophobicContact CD2-CD1 4.2Å; F658-L693 HydrophobicContact CE2-CD1 3.7Å; A691-L693 HydrophobicContact CB-CD2 4.31Å; A691-L693 HydrophobicContact CB-CG 4.16Å; A691-L693 PolarHBondContact O-N 3.34Å; L693-D695 VanDerWaalsContact C-N 3.33Å
694	D	90.5	Very high	92.2	Very high	84 Å²	84	59.4 Å²	59.4	45%	0.449	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-2.7	-170.3	47.2	18.6	0	0	0	114.2	E696 H698	D694-E696 PolarHBondContact OD1-N 2.76Å; D694-H698 IonicContact OD1-CE1 3.25Å; D694-H698 PolarHBondContact OD1-CE1 2.93Å; D694-H698 IonicContact OD1-ND1 3.75Å; D694-H698 IonicContact OD2-CE1 3.92Å; D694-H698 PolarHBondContact OD2-CE1 2.97Å; D694-H698 VanDerWaalsContact OD2-CE1 3.25Å; D694-H698 IonicContact OD2-NE2 2.75Å
695	D	92.6	Very high	91	Very high	55 Å²	55	63.2 Å²	63.2	29%	0.294	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.5	44.2	-165.4	-161.9	35.6	0	0	0	112.9	K584 L585 W586 L693	K584-D695 WeakPolarHBondContact CD-OD1 3.26Å; K584-D695 WeakPolarHBondContact CE-O 3.34Å; K584-D695 VanDerWaalsContact CE-OD1 3.28Å; K584-D695 WeakPolarHBondContact CE-OD1 3.37Å; K584-D695 WeakPolarHBondContact CG-OD1 3.23Å; K584-D695 PolarHBondContact NZ-O 3.1Å; K584-D695 IonicContact NZ-OD1 3.09Å; K584-D695 PolarHBondContact NZ-OD1 3.08Å; K584-D695 IonicContact NZ-OD2 3.99Å; K584-D695 PolarHBondContact NZ-OD2 2.91Å; L585-D695 PolarHBondContact O-N 2.89Å; W586-D695 HydrophobicContact CB-CB 3.86Å; W586-D695 HydrophobicContact CD2-CB 4.42Å; W586-D695 HydrophobicContact CG-CB 4.11Å; L693-D695 VanDerWaalsContact C-N 3.33Å
696	E	93.5	Very high	89.1	Confident	115 Å²	115	65 Å²	65	54%	0.537	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	154.9	166.7	-75.1	-60.8	152.2	0	0	112.8	K584 D694 H698	K584-E696 WeakPolarHBondContact CA-O 3.35Å; D694-E696 PolarHBondContact OD1-N 2.76Å; E696-H698 PolarHBondContact O-N 2.91Å; E696-H698 PolarHBondContact O-ND1 3.37Å
697	P	94.7	Very high	86.7	Confident	52 Å²	52	71.1 Å²	71.1	34%	0.338	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	102.9	-170.7	34.7	-33.5	0	0	0	112.8	K584 L599	K584-P697 HydrophobicContact CB-CB 4.38Å; L599-P697 HydrophobicContact CD1-CB 3.52Å
698	H	94.7	Very high	84.1	Confident	52 Å²	52	69.4 Å²	69.4	24%	0.241	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	139.4	-175.9	-74.1	86.7	0	0	0	112.8	S582 V583 L692 D694 E696 Y700	S582-H698 CarbonylContact C-O 3.47Å; S582-H698 WeakPolarHBondContact CA-O 3.45Å; V583-H698 PolarHBondContact N-O 3.11Å; V583-H698 PolarHBondContact O-N 3.13Å; L692-H698 VanDerWaalsContact CD1-NE2 3.32Å; L692-H698 WeakPolarHBondContact CD1-NE2 3.49Å; D694-H698 IonicContact OD1-CE1 3.25Å; D694-H698 PolarHBondContact OD1-CE1 2.93Å; D694-H698 IonicContact OD1-ND1 3.75Å; D694-H698 IonicContact OD2-CE1 3.92Å; D694-H698 PolarHBondContact OD2-CE1 2.97Å; D694-H698 VanDerWaalsContact OD2-CE1 3.25Å; D694-H698 IonicContact OD2-NE2 2.75Å; E696-H698 PolarHBondContact O-N 2.91Å; E696-H698 PolarHBondContact O-ND1 3.37Å; H698-Y700 HydrophobicContact CB-CD2 4.4Å; H698-Y700 HydrophobicContact CB-CE2 3.6Å; H698-Y700 WeakPolarHBondContact O-CD2 3.22Å
699	W	95	Very high	81.6	Confident	113 Å²	113	71.8 Å²	71.8	43%	0.428	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	119.5	177.7	-73.5	101.7	0	0	0	111.3	Q580 Q600 T602	Q580-W699 HydrophobicContact CB-CE3 3.82Å; Q580-W699 HydrophobicContact CB-CZ3 4.21Å; Q600-W699 HydrophobicContact CG-CH2 3.9Å; Q600-W699 HydrophobicContact CG-CZ2 4.48Å; Q600-W699 VanDerWaalsContact NE2-CH2 3.32Å; Q600-W699 VanDerWaalsContact NE2-CZ2 3.27Å; T602-W699 HydrophobicContact CG2-CH2 3.74Å; T602-W699 HydrophobicContact CG2-CZ3 4.17Å
700	Y	94.6	Very high	79.1	Confident	47 Å²	47	71.1 Å²	71.1	18%	0.184	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.7	176.9	-62	-93.4	0	0	0	109.5	Q580 L581 V583 I684 I686 H698	Q580-Y700 CarbonylContact C-O 3.59Å; Q580-Y700 WeakPolarHBondContact CA-O 3.42Å; L581-Y700 PolarHBondContact N-O 2.84Å; L581-Y700 PolarHBondContact O-N 3.41Å; V583-Y700 HydrophobicContact CB-CD2 4.14Å; V583-Y700 HydrophobicContact CB-CE2 4.05Å; V583-Y700 HydrophobicContact CG2-CD2 4.25Å; I684-Y700 HydrophobicContact CG2-CD1 3.88Å; I684-Y700 HydrophobicContact CG2-CG 3.92Å; I686-Y700 HydrophobicContact CD1-CD1 4.25Å; I686-Y700 HydrophobicContact CD1-CD2 4.36Å; I686-Y700 HydrophobicContact CD1-CE1 3.85Å; I686-Y700 HydrophobicContact CD1-CE2 3.97Å; I686-Y700 HydrophobicContact CD1-CG 4.5Å; I686-Y700 HydrophobicContact CG1-CD1 4.35Å; I686-Y700 HydrophobicContact CG1-CE1 4.05Å; I686-Y700 HydrophobicContact CG2-CE1 4.43Å; H698-Y700 HydrophobicContact CB-CD2 4.4Å; H698-Y700 HydrophobicContact CB-CE2 3.6Å; H698-Y700 WeakPolarHBondContact O-CD2 3.22Å
701	K	93.5	Very high	76.5	Confident	125 Å²	125	70.6 Å²	70.6	54%	0.543	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	141.7	177	-61	-176.1	-178.5	178.6	0	110.4	V576 Q580	V576-K701 HydrophobicContact CG1-CB 4.08Å; V576-K701 HydrophobicContact CG1-CD 4.04Å; Q580-K701 HydrophobicContact CG-CG 4.27Å
702	L	92.8	Very high	73.9	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	136.2	175.8	-64.2	-173.5	0	0	0	111.2	L577 G579 L581 L604 V667 I684	L577-L702 HydrophobicContact CB-CB 4.28Å; L577-L702 PolarHBondContact N-O 3.09Å; G579-L702 PolarHBondContact O-N 3.48Å; L581-L702 HydrophobicContact CB-CD2 4.43Å; L604-L702 HydrophobicContact CD2-CD1 3.51Å; V667-L702 HydrophobicContact CB-CD1 4.43Å; V667-L702 HydrophobicContact CG2-CD1 4.23Å; V667-L702 HydrophobicContact CG2-CD2 3.7Å; I684-L702 HydrophobicContact CD1-CD2 3.72Å; I684-L702 HydrophobicContact CG1-CD2 4.04Å
703	Q	88.1	Confident	71.4	Confident	86 Å²	86	76.9 Å²	76.9	40%	0.402	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	159.7	177.7	-56.9	-172.5	55.1	0	0	110.3	L577 G682 E683	L577-Q703 WeakPolarHBondContact CD1-O 3.48Å; G682-Q703 CarbonylContact C-O 3.25Å; G682-Q703 VanDerWaalsContact CA-O 3.24Å; G682-Q703 WeakPolarHBondContact CA-O 3.3Å; E683-Q703 PolarHBondContact N-O 3.23Å; E683-Q703 PolarHBondContact O-N 3.32Å
704	T	79	Confident	68.7	Low	54 Å²	54	82.6 Å²	82.6	33%	0.331	42%	0.424	S	S	.	.			trans	-66.4	146.8	167.3	29.2	0	0	0	0	109.9	Q575 L577 D706	Q575-T704 HydrophobicContact CB-CG2 4.35Å; Q575-T704 PolarHBondContact O-OG1 2.89Å; L577-T704 HydrophobicContact CD1-CG2 4.13Å; L577-T704 HydrophobicContact CD2-CG2 3.8Å; L577-T704 HydrophobicContact CG-CG2 3.96Å; T704-D706 PolarHBondContact O-N 3Å
705	H	68	Low	66	Low	84 Å²	84	84.2 Å²	84.2	39%	0.389	44%	0.44	S	S	.	.			trans	-72.8	96.8	179.7	-177.8	-84.8	0	0	0	110.3	F680 E683 E707	F680-H705 HydrophobicContact CE1-CB 3.76Å; F680-H705 HydrophobicContact CE2-CB 4.25Å; F680-H705 HydrophobicContact CZ-CB 3.59Å; E683-H705 WeakPolarHBondContact OE1-CA 3.39Å; E683-H705 IonicContact OE2-CD2 3.11Å; E683-H705 PolarHBondContact OE2-CD2 3.24Å; E683-H705 IonicContact OE2-CG 3.25Å; H705-E707 IonicContact CE1-OE1 3.32Å; H705-E707 PolarHBondContact CE1-OE1 3.32Å
706	D	54.3	Low	63.1	Low	81 Å²	81	86.6 Å²	86.6	43%	0.433	46%	0.46	S	S	.	.			trans	-99.4	102.5	-177.6	-169.7	74	0	0	0	109.4	T704 S708 S709	T704-D706 PolarHBondContact O-N 3Å; D706-S708 VanDerWaalsContact CG-OG 3.25Å; D706-S708 PolarHBondContact O-N 2.8Å; D706-S708 PolarHBondContact OD1-OG 3.4Å; D706-S708 WeakPolarHBondContact OD2-CB 3.4Å; D706-S708 PolarHBondContact OD2-OG 3.26Å; D706-S709 WeakPolarHBondContact O-CB 3.41Å; D706-S709 PolarHBondContact O-N 2.65Å; D706-S709 PolarHBondContact O-OG 2.88Å; D706-S709 PolarHBondContact OD2-N 2.82Å
707	E	44.7	Very low	60.5	Low	137 Å²	137	86 Å²	86	64%	0.64	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.1	-175.3	-63.2	-145.5	121.9	0	0	113.9	R486 H705	R486-E707 IonicContact NH1-OE2 3.78Å; H705-E707 IonicContact CE1-OE1 3.32Å; H705-E707 PolarHBondContact CE1-OE1 3.32Å
708	S	39.5	Very low	57.7	Low	50 Å²	50	92.2 Å²	92.2	35%	0.35	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-12.6	174.3	22.1	0	0	0	0	114.9	D706 L710	D706-S708 VanDerWaalsContact CG-OG 3.25Å; D706-S708 PolarHBondContact O-N 2.8Å; D706-S708 PolarHBondContact OD1-OG 3.4Å; D706-S708 WeakPolarHBondContact OD2-CB 3.4Å; D706-S708 PolarHBondContact OD2-OG 3.26Å; S708-L710 VanDerWaalsContact C-N 3.26Å; S708-L710 PolarHBondContact O-N 2.81Å; S708-L710 VanDerWaalsContact O-N 3.15Å
709	S	40.7	Very low	55	Low	50 Å²	50	98.2 Å²	98.2	35%	0.35	52%	0.519	S	S	.	.			trans	-77	4.2	-167.8	64.2	0	0	0	0	116.5	L685 D706 P711	L685-S709 WeakPolarHBondContact CD1-OG 3.35Å; D706-S709 WeakPolarHBondContact O-CB 3.41Å; D706-S709 PolarHBondContact O-N 2.65Å; D706-S709 PolarHBondContact O-OG 2.88Å; D706-S709 PolarHBondContact OD2-N 2.82Å; S709-P711 WeakPolarHBondContact O-CD 3.22Å
710	L	41.4	Very low	52.4	Low	68 Å²	68	98.6 Å²	98.6	36%	0.356	54%	0.536	S	S	.	.			trans	-88.8	107.1	173.6	-68.5	179.5	0	0	0	111	L622 M662 L685 S708 L712	L622-L710 HydrophobicContact CD1-CD2 3.84Å; M662-L710 HydrophobicContact SD-CD2 3.93Å; L685-L710 HydrophobicContact CD1-CD2 4.2Å; L685-L710 HydrophobicContact CD2-CD2 4.29Å; S708-L710 VanDerWaalsContact C-N 3.26Å; S708-L710 PolarHBondContact O-N 2.81Å; S708-L710 VanDerWaalsContact O-N 3.15Å; L710-L712 PolarHBondContact O-N 2.81Å
711	P	35.2	Very low	49.7	Very low	85 Å²	85	105.9 Å²	105.9	55%	0.552	56%	0.563	S	S	*	*			trans	-67	105.6	165.1	29	-32.8	0	0	0	108.4	S709 P713	S709-P711 WeakPolarHBondContact O-CD 3.22Å; P711-P713 WeakPolarHBondContact O-CD 3.41Å
712	L	36.1	Very low	47	Very low	151 Å²	151	112 Å²	112	79%	0.791	58%	0.583	S	S	*	*			trans	-57.9	126.2	167.1	-68.5	175.9	0	0	0	108	L710 Q714	L710-L712 PolarHBondContact O-N 2.81Å; L712-Q714 PolarHBondContact O-N 2.78Å
713	P	37.2	Very low	44.2	Very low	86 Å²	86	118.3 Å²	118.3	56%	0.558	61%	0.612	S	S	*	*			trans	-58.3	111.4	172.6	-21.7	32.5	0	0	0	108.1	P711 P715	P711-P713 WeakPolarHBondContact O-CD 3.41Å; P713-P715 WeakPolarHBondContact O-CD 3.22Å; P713-P715 VanDerWaalsContact O-N 3.12Å
714	Q	37.4	Very low	41.7	Very low	160 Å²	160	121.4 Å²	121.4	75%	0.748	63%	0.63	S	S	*	*			trans	-61.8	119.2	-176.7	-112.8	-155.9	19.8	0	0	108.8	L712 S716	L712-Q714 PolarHBondContact O-N 2.78Å; Q714-S716 PolarHBondContact O-N 3.12Å
715	P	33.2	Very low	39.7	Very low	118 Å²	118	125.8 Å²	125.8	77%	0.766	65%	0.646	S	S	*	*			trans	-66	107.6	168.6	-12.4	28.5	0	0	0	106.2	P713	P713-P715 WeakPolarHBondContact O-CD 3.22Å; P713-P715 VanDerWaalsContact O-N 3.12Å
716	S	31.6	Very low	38.2	Very low	104 Å²	104	125 Å²	125	73%	0.727	66%	0.661	S	S	*	*			trans	-52.2	125.4	-176.1	-69.2	0	0	0	0	109.6	Q714 F718	Q714-S716 PolarHBondContact O-N 3.12Å; S716-F718 PolarHBondContact O-N 3.06Å
717	P	37.9	Very low	37.4	Very low	104 Å²	104	128.6 Å²	128.6	68%	0.675	68%	0.675	S	S	*	*	S	Bend	trans	-65.2	13.4	-164.4	-27.5	36.3	0	0	0	118.3
718	F	36	Very low	37.1	Very low	181 Å²	181	126.7 Å²	126.7	79%	0.794	68%	0.676	S	S	*	*			trans	-132.5	65.7	-165.1	-72.2	-84.4	0	0	0	114	S716	S716-F718 PolarHBondContact O-N 3.06Å
719	M	39.2	Very low	36.8	Very low	178 Å²	178	127.9 Å²	127.9	88%	0.877	69%	0.685	S	S	*	*			trans	-155.3	102.3	155.5	-102.3	-51.6	109.1	0	0	113.5	R721	M719-R721 PolarHBondContact O-N 3.05Å
720	P	40.5	Very low	36.8	Very low	121 Å²	121	130.7 Å²	130.7	79%	0.786	70%	0.704	S	S	*	*			trans	-81.2	100.4	179.1	-15.9	32.3	0	0	0	115
721	R	37.8	Very low	36.9	Very low	200 Å²	200	136.3 Å²	136.3	76%	0.755	73%	0.726	S	S	*	*			trans	26.2	120.1	135.2	-171.6	-167.9	-146	169	9.7	119	M719 H723	M719-R721 PolarHBondContact O-N 3.05Å; R721-H723 PolarHBondContact NE-CD2 3.46Å; R721-H723 PolarHBondContact NE-NE2 3.26Å; R721-H723 PolarHBondContact NH2-NE2 3.36Å
722	R	37.3	Very low	37.6	Very low	255 Å²	255	140.1 Å²	140.1	96%	0.962	73%	0.734	S	S	*	*			trans	-135.3	132.3	140	-71.7	-163	178.7	-164.4	0.2	112.3
723	H	33.6	Very low	37.9	Very low	132 Å²	132	138.5 Å²	138.5	61%	0.611	73%	0.726	S	S	*	*			trans	-95.1	147.5	174.5	-69.6	-98.6	0	0	0	111.4	R721	R721-H723 PolarHBondContact NE-CD2 3.46Å; R721-H723 PolarHBondContact NE-NE2 3.26Å; R721-H723 PolarHBondContact NH2-NE2 3.36Å
724	I	35.4	Very low	38.4	Very low	151 Å²	151	139.1 Å²	139.1	77%	0.774	72%	0.721	S	S	*	*			trans	-149.3	105.5	138.4	-54.7	-176.3	0	0	0	104.3
725	H	37.4	Very low	38.9	Very low	146 Å²	146	136.5 Å²	136.5	68%	0.676	70%	0.704	S	S	*	*			cis	75.5	100.6	47.4	-153.8	-48.5	0	0	0	115.3	E727	H725-E727 IonicContact CE1-OE2 3.21Å
726	G	36.5	Very low	39.4	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	70%	0.701	S	S	*	*			trans	114.6	153.4	133	0	0	0	0	0	118.3
727	E	38	Very low	39.8	Very low	156 Å²	156	137 Å²	137	73%	0.729	70%	0.696	S	S	*	*			cis	-166.1	148.5	-7.6	-120.6	-168.1	106.9	0	0	113.5	H725	H725-E727 IonicContact CE1-OE2 3.21Å
728	S	38.3	Very low	39.9	Very low	97 Å²	97	143.1 Å²	143.1	68%	0.678	71%	0.706	S	S	*	*				52.4	163.5	127.1	-140.5	0	0	0	0	124
729	S	32	Very low	40.2	Very low	76 Å²	76	142 Å²	142	53%	0.531	71%	0.706	S	S	.	*				-177.8	119.2	-67.8	176.3	0	0	0	0	113.6
730	S	40.6	Very low	40.2	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	69%	0.694	S	S	*	*			trans	65.2	-175.2	145.7	-49.7	0	0	0	0	120.6
731	K	44.5	Very low	39.9	Very low	186 Å²	186	138.8 Å²	138.8	81%	0.809	69%	0.693	S	S	*	*			trans	85.1	154.6	169.1	-54.7	148.7	-175.5	167.6	0	114.7
732	K	48.6	Very low	39.9	Very low	166 Å²	166	134.8 Å²	134.8	72%	0.722	70%	0.696	S	S	*	*			cis	-158.4	170.9	-1.9	-125.9	-124.7	-178.8	-175	0	106.9
733	L	42.6	Very low	40	Very low	117 Å²	117	130.2 Å²	130.2	61%	0.613	69%	0.69	S	S	*	*				-166.4	-175.1	-55.4	-131.2	-179.8	0	0	0	108.4
734	Q	48	Very low	40.4	Very low	98 Å²	98	132 Å²	132	46%	0.458	70%	0.703	S	S	.	*			trans	73.1	157.2	149.6	-80.6	166.4	-84.5	0	0	119.1
735	R	48.8	Very low	40.6	Very low	106 Å²	106	129.7 Å²	129.7	40%	0.4	70%	0.7	S	S	.	*			cis	-161.6	174.7	-17.9	-134.4	171.4	100.4	154.2	5.2	115.1	E383	E383-R735 IonicContact OE1-CZ 2.67Å; E383-R735 VanDerWaalsContact OE1-CZ 3.23Å; E383-R735 IonicContact OE1-NH1 3.61Å; E383-R735 PolarHBondContact OE1-NH1 3.26Å; E383-R735 IonicContact OE1-NH2 3.6Å; E383-R735 PolarHBondContact OE1-NH2 3.5Å; E383-R735 IonicContact OE2-CZ 2.77Å; E383-R735 IonicContact OE2-NH1 2.7Å; E383-R735 PolarHBondContact OE2-NH1 2.9Å; E383-R735 IonicContact OE2-NH2 3.1Å; E383-R735 PolarHBondContact OE2-NH2 3.3Å
736	S	42.8	Very low	41.1	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	71%	0.709	S	S	*	*			trans	76.4	151.6	139.7	50.7	0	0	0	0	123.5
737	Q	40.6	Very low	41.3	Very low	132 Å²	132	137.9 Å²	137.9	62%	0.617	72%	0.717	S	S	*	*			cis	-174	175.8	-30	-154.7	148.8	-17	0	0	110.4
738	R	39.4	Very low	41.8	Very low	233 Å²	233	139 Å²	139	88%	0.879	72%	0.723	S	S	*	*			trans	74.7	150.5	174	-46.1	-175.1	-176.4	-171.9	-0.5	114
739	I	43	Very low	42.4	Very low	156 Å²	156	141.3 Å²	141.3	80%	0.8	73%	0.733	S	S	*	*			cis	-133.9	156.7	16.5	-62.4	164	0	0	0	110.9
740	S	38.1	Very low	43.2	Very low	91 Å²	91	143.9 Å²	143.9	64%	0.636	74%	0.74	S	S	*	*			trans	-26.2	173	155.2	-63.1	0	0	0	0	121
741	D	35.6	Very low	43.2	Very low	141 Å²	141	146 Å²	146	75%	0.754	74%	0.743	S	S	*	*			cis	-169.4	170.6	-24.3	-89.6	-34.7	0	0	0	110.1
742	S	37.4	Very low	43.3	Very low	116 Å²	116	140.1 Å²	140.1	81%	0.811	74%	0.735	S	S	*	*			trans	76	154.6	155.5	-63.6	0	0	0	0	123
743	D	39.1	Very low	42.8	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	74%	0.742	S	S	*	*			trans	-107.9	170.4	-156.6	-49	-93.6	0	0	0	115.7
744	I	40.6	Very low	42.7	Very low	171 Å²	171	137.7 Å²	137.7	88%	0.877	74%	0.744	S	S	*	*			trans	-159.4	149.5	148.4	-166	60.7	0	0	0	110
745	S	40.6	Very low	42.2	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	76%	0.759	S	S	*	*			trans	-141.7	145.1	-175	57.5	0	0	0	0	115.2
746	D	48	Very low	41.8	Very low	160 Å²	160	140.2 Å²	140.2	86%	0.856	78%	0.777	S	S	*	*			trans	63.8	161.3	160.9	-92.2	-43.7	0	0	0	121.7
747	Y	41.3	Very low	42.1	Very low	224 Å²	224	140.6 Å²	140.6	88%	0.878	78%	0.777	S	S	*	*			trans	-159.1	126	169.5	-125.8	-78.7	0	0	0	110.2
748	E	48.8	Very low	42.4	Very low	181 Å²	181	139.8 Å²	139.8	85%	0.846	78%	0.784	S	S	*	*			trans	-84.5	170.4	174.8	-71.5	-177.3	101.1	0	0	113.2
749	V	49.7	Very low	42.5	Very low	145 Å²	145	135.6 Å²	135.6	88%	0.879	78%	0.783	S	S	*	*			trans	-139.4	129.2	147.6	-177.8	0	0	0	0	108.4
750	D	49	Very low	42.2	Very low	129 Å²	129	131 Å²	131	69%	0.69	77%	0.774	S	S	*	*			trans	-93.9	-179.8	-178.8	-178.5	40	0	0	0	112.5
751	D	41.7	Very low	42.1	Very low	153 Å²	153	136.5 Å²	136.5	82%	0.818	78%	0.782	S	S	*	*				-177.2	127.7	129.1	-97.1	-33	0	0	0	112.8
752	G	44.5	Very low	42.2	Very low	62 Å²	62	140.7 Å²	140.7	64%	0.639	79%	0.788	S	S	*	*			trans	-87.1	-141.2	172.7	0	0	0	0	0	114.8
753	I	39.1	Very low	42.1	Very low	169 Å²	169	139.4 Å²	139.4	87%	0.867	79%	0.785	S	S	*	*			cis	-158	157.2	11.7	-70.4	175.5	0	0	0	109.2
754	G	39.5	Very low	42	Very low	63 Å²	63	137.4 Å²	137.4	65%	0.649	78%	0.783	S	S	*	*			trans	144.1	137.4	167.9	0	0	0	0	0	114.3
755	V	38.3	Very low	42	Very low	130 Å²	130	133.4 Å²	133.4	79%	0.788	78%	0.775	S	S	*	*			cis	64.5	143	2.3	-117.2	0	0	0	0	115.6
756	V	41.6	Very low	42.1	Very low	128 Å²	128	138 Å²	138	78%	0.776	78%	0.777	S	S	*	*			cis	-145.4	150.2	14.3	-159.9	0	0	0	0	112.6
757	P	49	Very low	41.7	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	77%	0.768	S	S	*	*			trans	-92.2	-160.4	167.9	41	-39.8	0	0	0	112.3
758	P	45.8	Very low	41.6	Very low	115 Å²	115	130.8 Å²	130.8	75%	0.747	76%	0.756	S	S	*	*			cis	-140.3	-137.9	2.8	43	-19.1	0	0	0	115.4
759	V	41.3	Very low	41	Very low	144 Å²	144	131.6 Å²	131.6	87%	0.873	76%	0.757	S	S	*	*			trans	80.4	126.4	173.2	-173.5	0	0	0	0	119.5
760	G	37.3	Very low	40.3	Very low	59 Å²	59	129.1 Å²	129.1	61%	0.608	75%	0.752	S	S	*	*			trans	112.3	107.1	136.4	0	0	0	0	0	121
761	Y	36.3	Very low	39.8	Very low	207 Å²	207	129.5 Å²	129.5	81%	0.812	76%	0.759	S	S	*	*			trans	53.1	121.3	148.2	-75.7	-101.7	0	0	0	122.7
762	R	37.7	Very low	39.6	Very low	229 Å²	229	128 Å²	128	86%	0.864	76%	0.755	S	S	*	*			trans	36.4	137.2	137.9	-56.1	-179	-177.8	-167.8	-1	119.6
763	A	34.8	Very low	39.2	Very low	90 Å²	90	132.4 Å²	132.4	74%	0.744	76%	0.763	S	S	*	*			cis	-175.9	177.9	-10.7	0	0	0	0	0	105.1
764	S	38	Very low	39.2	Very low	116 Å²	116	130.6 Å²	130.6	81%	0.811	76%	0.761	S	S	*	*			cis	-164.3	166.9	-4.7	-130.3	0	0	0	0	105.3
765	A	39.8	Very low	39.2	Very low	87 Å²	87	133.7 Å²	133.7	72%	0.719	77%	0.766	S	S	*	*			cis	-151.7	-156.9	1	0	0	0	0	0	106.1
766	R	42.7	Very low	39.3	Very low	198 Å²	198	132.9 Å²	132.9	75%	0.747	76%	0.764	S	S	*	*			cis	-154.2	130.1	1.2	-166.6	178.9	171.6	145.1	12.7	109.1
767	E	39.4	Very low	39.3	Very low	142 Å²	142	134.3 Å²	134.3	66%	0.664	76%	0.762	S	S	*	*			trans	49.5	141.7	158.6	-66.3	149.1	-171.6	0	0	120.1
768	S	38.8	Very low	38.8	Very low	92 Å²	92	136.4 Å²	136.4	64%	0.643	76%	0.763	S	S	*	*			cis	-165.8	133.3	-15.1	-92.7	0	0	0	0	108.5
769	K	37.5	Very low	38.5	Very low	198 Å²	198	137.8 Å²	137.8	86%	0.861	76%	0.759	S	S	*	*				53.6	127.5	97.5	-57.9	178.2	-180	-178.6	0	115.4
770	A	33.9	Very low	38.5	Very low	93 Å²	93	141.1 Å²	141.1	77%	0.769	76%	0.756	S	S	*	*			cis	96.8	113.8	15.1	0	0	0	0	0	117.8
771	T	38.9	Very low	38.5	Very low	136 Å²	136	143.4 Å²	143.4	83%	0.834	76%	0.758	S	S	*	*			trans	-179.5	141.7	159.3	34.3	0	0	0	0	108.1
772	T	37.3	Very low	38.5	Very low	121 Å²	121	139.1 Å²	139.1	74%	0.742	75%	0.754	S	S	*	*			cis	108.8	136.1	-5.7	-42.5	0	0	0	0	116.8
773	L	37.3	Very low	38.6	Very low	155 Å²	155	135.2 Å²	135.2	81%	0.812	75%	0.745	S	S	*	*			trans	77.1	148	-179.9	-45.7	179.4	0	0	0	115.8
774	T	38.6	Very low	38.7	Very low	132 Å²	132	138.9 Å²	138.9	81%	0.81	75%	0.747	S	S	*	*			cis	-151	173.8	2.1	-17.3	0	0	0	0	112.2
775	V	39.1	Very low	38.7	Very low	127 Å²	127	144.8 Å²	144.8	77%	0.77	75%	0.751	S	S	*	*			trans	-124.6	138.2	177.1	168.4	0	0	0	0	107.3
776	P	41.4	Very low	38.4	Very low	114 Å²	114	146.2 Å²	146.2	74%	0.74	76%	0.756	S	S	*	*				-160.5	149.3	91.3	41.8	-19.9	0	0	0	120.9
777	E	40.3	Very low	38.2	Very low	157 Å²	157	147.9 Å²	147.9	73%	0.734	76%	0.762	S	S	*	*				50.3	148	122.3	-155	167.6	143.3	0	0	126
778	Q	39.5	Very low	37.7	Very low	153 Å²	153	146.1 Å²	146.1	72%	0.715	77%	0.765	S	S	*	*			trans	70.4	150.2	159.9	-91.4	168.3	58.5	0	0	118.2
779	Q	38.7	Very low	37.4	Very low	143 Å²	143	148.3 Å²	148.3	67%	0.668	78%	0.775	S	S	*	*			cis	-163.8	152	-13.7	-149.1	-171.1	5.7	0	0	110.4
780	R	40.4	Very low	37.5	Very low	215 Å²	215	144 Å²	144	81%	0.811	77%	0.769	S	S	*	*			trans	63.4	162.9	165.4	-66.6	-174.1	168.6	178.8	-4.1	117.3
781	T	38.3	Very low	37.8	Very low	107 Å²	107	145.5 Å²	145.5	66%	0.656	77%	0.771	S	S	*	*			cis	-161	143.9	-23.6	25.8	0	0	0	0	112.1
782	T	36.5	Very low	37.7	Very low	117 Å²	117	147.6 Å²	147.6	72%	0.718	77%	0.771	S	S	*	*			trans	66.7	149.6	146.1	56.3	0	0	0	0	124.5
783	H	39	Very low	37.9	Very low	147 Å²	147	153 Å²	153	68%	0.681	78%	0.778	S	S	*	*			trans	84.7	95	157.2	-64.3	-64.2	0	0	0	123.3
784	H	37.5	Very low	38.1	Very low	167 Å²	167	148.4 Å²	148.4	77%	0.773	77%	0.768	S	S	*	*				71.5	153.1	126.7	-59.4	-43.1	0	0	0	124.9
785	R	37.4	Very low	38.1	Very low	239 Å²	239	148.7 Å²	148.7	90%	0.902	77%	0.765	S	S	*	*			trans	77.8	87.7	159.2	-75.7	-179.9	177.7	174.7	0.1	120.1
786	S	34	Very low	38.2	Very low	117 Å²	117	149 Å²	149	82%	0.818	76%	0.762	S	S	*	*				14.3	143.1	126.6	-40.7	0	0	0	0	122
787	R	37.8	Very low	38.1	Very low	234 Å²	234	151.5 Å²	151.5	88%	0.883	76%	0.764	S	S	*	*			trans	104.7	99.9	156.3	-64.3	-175.1	174.4	-106.7	1.5	118.3
788	S	29.9	Very low	37.9	Very low	104 Å²	104	147.5 Å²	147.5	73%	0.727	77%	0.765	S	S	*	*				70.8	142.7	125.6	67.4	0	0	0	0	123.1
789	V	31.7	Very low	38.1	Very low	139 Å²	139	151.6 Å²	151.6	84%	0.842	77%	0.774	S	S	*	*			trans	80.6	136.6	161.9	-158.1	0	0	0	0	117.3
790	S	39.5	Very low	38.4	Very low	107 Å²	107	149.5 Å²	149.5	75%	0.748	77%	0.772	S	S	*	*			trans	-68.7	165.6	173.9	-37.1	0	0	0	0	113
791	P	40.3	Very low	38.4	Very low	124 Å²	124	150.4 Å²	150.4	81%	0.805	78%	0.776	S	S	*	*				-153.4	-175.2	98.4	40.2	-21.6	0	0	0	116.7
792	H	37.3	Very low	38.6	Very low	181 Å²	181	149.3 Å²	149.3	84%	0.838	77%	0.773	S	S	*	*			trans	-74.2	161.4	179.2	-49	-97.1	0	0	0	115.7
793	R	41.1	Very low	38.7	Very low	233 Å²	233	154.7 Å²	154.7	88%	0.879	78%	0.78	S	S	*	*				-161.4	161.2	120.3	-75	-140.3	-177.3	-174.1	1.4	109
794	G	41.1	Very low	38.6	Very low	60 Å²	60	155.7 Å²	155.7	62%	0.619	79%	0.789	S	S	*	*			cis	158	144.9	-8.8	0	0	0	0	0	111.3
795	D	39.1	Very low	39	Very low	138 Å²	138	153 Å²	153	74%	0.738	79%	0.787	S	S	*	*			cis	-131.7	-98.9	-5	-71.7	-65.5	0	0	0	112.4
796	D	41.8	Very low	39.2	Very low	133 Å²	133	149 Å²	149	71%	0.711	78%	0.783	S	S	*	*			cis	-144.1	-122.7	-0.8	-174.7	66.6	0	0	0	111.3
797	Q	38.3	Very low	39.3	Very low	167 Å²	167	149.1 Å²	149.1	78%	0.78	78%	0.778	S	S	*	*			trans	-109	157.1	-157.9	-68.4	169.5	89.8	0	0	116.1
798	G	37.5	Very low	39.4	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	77%	0.77	S	S	*	*			cis	-176.1	171.6	-0.5	0	0	0	0	0	108.4
799	R	42	Very low	39.7	Very low	240 Å²	240	145 Å²	145	91%	0.906	77%	0.771	S	S	*	*			cis	-157	179.2	28.6	-111.1	-155.5	162.7	-147	-1	110.5
800	P	45.6	Very low	39.9	Very low	98 Å²	98	145.8 Å²	145.8	64%	0.636	77%	0.766	S	S	*	*			trans	-136.6	179.7	-138.2	43.1	-26	0	0	0	118.3
801	R	41.2	Very low	39.8	Very low	234 Å²	234	151.4 Å²	151.4	88%	0.883	77%	0.77	S	S	*	*			trans	139.3	146.5	143.1	-79.2	177.4	176.6	-174.8	-1.1	113
802	S	42.1	Very low	39.3	Very low	85 Å²	85	150 Å²	150	59%	0.594	76%	0.763	S	S	*	*			cis	-174.9	148.5	-18.8	56.1	0	0	0	0	114.4
803	R	39.1	Very low	39.3	Very low	230 Å²	230	148.3 Å²	148.3	87%	0.868	76%	0.76	S	S	*	*			trans	74.6	158.1	158	-63.4	166.1	-169.4	-99.7	3	118.8
804	L	36.9	Very low	38.9	Very low	167 Å²	167	143.5 Å²	143.5	87%	0.874	75%	0.752	S	S	*	*				-173.3	172.8	-58.9	-97.3	170.7	0	0	0	109.1
805	P	44.4	Very low	38.5	Very low	112 Å²	112	148.3 Å²	148.3	73%	0.727	76%	0.758	S	S	*	*			trans	-120.2	-178	-150.8	45.5	-38.6	0	0	0	117.1
806	N	43.3	Very low	38.5	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	76%	0.756	S	S	*	*			trans	-159.4	173.6	150.3	-146.8	-1.9	0	0	0	114.5
807	V	35.4	Very low	38.5	Very low	120 Å²	120	150.1 Å²	150.1	73%	0.727	76%	0.76	S	S	*	*			trans	-151.3	-170.3	-179.9	-69.7	0	0	0	0	109
808	P	40.8	Very low	38.6	Very low	109 Å²	109	147.5 Å²	147.5	71%	0.708	76%	0.758	S	S	*	*			cis	-140.2	-174.7	-2.9	41.8	-21.5	0	0	0	117.8
809	L	36.2	Very low	38.3	Very low	143 Å²	143	149.5 Å²	149.5	75%	0.749	76%	0.756	S	S	*	*			trans	82.8	125.9	142.1	-136.8	76.8	0	0	0	123.8
810	Q	34.1	Very low	37.8	Very low	156 Å²	156	147.8 Å²	147.8	73%	0.729	75%	0.749	S	S	*	*			trans	56.2	155.2	145.2	-85.8	-179.2	-60.4	0	0	123.9
811	R	38.6	Very low	37.4	Very low	224 Å²	224	152.5 Å²	152.5	85%	0.845	76%	0.755	S	S	*	*			trans	73.9	150.2	174.3	-66.7	-178.3	171.2	93.1	-1.7	116.3
812	S	30.6	Very low	36.9	Very low	94 Å²	94	146 Å²	146	66%	0.657	74%	0.744	S	S	*	*			cis	179.9	140.8	-38.2	46	0	0	0	0	108.7
813	L	36.2	Very low	36.7	Very low	146 Å²	146	153.5 Å²	153.5	76%	0.764	76%	0.76	S	S	*	*			trans	66.9	151.4	161.5	-72.3	171.8	0	0	0	118.8
814	D	32.6	Very low	36.5	Very low	132 Å²	132	147.7 Å²	147.7	71%	0.706	76%	0.755	S	S	*	*			trans	59	142	140.1	-60.8	-9.9	0	0	0	121.1
815	E	33.7	Very low	36.7	Very low	161 Å²	161	144.7 Å²	144.7	75%	0.752	75%	0.745	S	S	*	*			cis	-167	-160.1	-16.4	-155.1	-154.7	145.2	0	0	107.9
816	I	38.5	Very low	36	Very low	136 Å²	136	144.6 Å²	144.6	70%	0.697	74%	0.743	S	S	*	*			trans	71.6	100.9	152.2	-63.8	149	0	0	0	118.4
817	H	41.7	Very low	35.4	Very low	173 Å²	173	147 Å²	147	80%	0.801	74%	0.74	S	S	*	*			trans	-43.2	154.7	150.4	-89.5	-69	0	0	0	114
818	P	41	Very low	35.3	Very low	113 Å²	113	147.2 Å²	147.2	73%	0.734	73%	0.733	S	S	*	*				-144.4	132	102	34.8	-19.3	0	0	0	116.6
819	T	31.1	Very low	35.1	Very low	113 Å²	113	148.9 Å²	148.9	69%	0.693	73%	0.731	S	S	*	*			trans	20.3	149.5	136.7	71.9	0	0	0	0	122.9
820	R	31.1	Very low	34.9	Very low	204 Å²	204	148.3 Å²	148.3	77%	0.77	73%	0.729	S	S	*	*				119.7	136.2	114.8	-119.9	172.9	179.8	-168.3	1	117.8
821	R	36.4	Very low	35	Very low	198 Å²	198	144.8 Å²	144.8	75%	0.747	73%	0.726	S	S	*	*			trans	70.9	119.1	165.7	-53.5	175	-171.8	-88.4	6.5	115
822	S	32.2	Very low	35	Very low	96 Å²	96	138.7 Å²	138.7	67%	0.671	72%	0.718	S	S	*	*			cis	82.7	108	30.5	87.3	0	0	0	0	115.7
823	R	36.6	Very low	35.3	Very low	243 Å²	243	144.5 Å²	144.5	92%	0.917	73%	0.725	S	S	*	*				179.7	128.1	128.9	-100	160.5	-170.6	-100.4	0.7	112.7
824	S	35.3	Very low	35.5	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	73%	0.728	S	S	*	*			trans	-76	-176.9	154	-21	0	0	0	0	109.7
825	P	41	Very low	35.7	Very low	104 Å²	104	143.6 Å²	143.6	68%	0.675	73%	0.73	S	S	*	*			cis	-136.4	-156	-8.3	35.5	-13.3	0	0	0	113
826	T	29.6	Very low	35.8	Very low	110 Å²	110	139.4 Å²	139.4	68%	0.675	72%	0.723	S	S	*	*			trans	78.9	135.7	145.7	39.4	0	0	0	0	123.1
827	R	31.2	Very low	35.8	Very low	203 Å²	203	139.3 Å²	139.3	77%	0.766	72%	0.724	S	S	*	*			trans	91.8	122.5	132.9	-85.5	174.1	-178.6	-122.4	12.5	121.9
828	H	32.9	Very low	35.6	Very low	124 Å²	124	137.4 Å²	137.4	57%	0.574	72%	0.715	S	S	*	*			trans	84.8	128.2	132.1	-74.6	-53.5	0	0	0	123
829	H	36.4	Very low	35.5	Very low	145 Å²	145	141.9 Å²	141.9	67%	0.671	72%	0.717	S	S	*	*			trans	66.1	145.9	139.2	-67.1	-58.4	0	0	0	119.6
830	D	33.1	Very low	35.7	Very low	131 Å²	131	140.4 Å²	140.4	70%	0.701	71%	0.711	S	S	*	*			cis	-157.1	169.8	-3.7	-129.2	-20.7	0	0	0	115.4
831	A	34.7	Very low	36	Very low	81 Å²	81	141.4 Å²	141.4	67%	0.669	72%	0.715	S	S	*	*			trans	49.2	152.2	140.7	0	0	0	0	0	123.4
832	S	38.5	Very low	36	Very low	96 Å²	96	139.5 Å²	139.5	67%	0.671	71%	0.714	S	S	*	*			cis	-171.8	135.8	-20.8	56.1	0	0	0	0	114.8
833	R	37.8	Very low	36.5	Very low	216 Å²	216	138.6 Å²	138.6	82%	0.815	71%	0.712	S	S	*	*				56.4	126.9	128.8	-59.7	170.7	179.2	-118	0.2	123.5
834	S	40.8	Very low	36.4	Very low	117 Å²	117	133.8 Å²	133.8	82%	0.818	70%	0.7	S	S	*	*				-151.9	135.4	107.3	44.4	0	0	0	0	108.4
835	L	35.5	Very low	36.5	Very low	142 Å²	142	133.4 Å²	133.4	74%	0.743	70%	0.698	S	S	*	*			cis	80.2	136.4	46.4	-102.1	76.8	0	0	0	114.3
836	A	36.6	Very low	36	Very low	73 Å²	73	135.2 Å²	135.2	60%	0.603	70%	0.697	S	S	*	*			cis	-157.1	179.6	6.8	0	0	0	0	0	114.8
837	D	38.2	Very low	36.3	Very low	135 Å²	135	139.6 Å²	139.6	72%	0.722	70%	0.703	S	S	*	*			trans	78.3	139.9	146.2	-78.6	11.8	0	0	0	123.4
838	H	37.4	Very low	36.3	Very low	132 Å²	132	135.1 Å²	135.1	61%	0.611	70%	0.703	S	S	*	*			cis	-163.9	138.9	-17.6	-140.2	48.9	0	0	0	113.8
839	R	38.2	Very low	36.1	Very low	208 Å²	208	133.8 Å²	133.8	79%	0.785	71%	0.707	S	S	*	*			trans	60.7	159.4	154.6	-69.2	-178.7	-176.7	-152.3	-1.9	121.8
840	S	35.3	Very low	36	Very low	81 Å²	81	135 Å²	135	57%	0.566	71%	0.713	S	S	*	*			cis	-174.5	160.8	-31.5	64	0	0	0	0	113.2
841	R	39.1	Very low	36.2	Very low	226 Å²	226	133.1 Å²	133.1	85%	0.853	71%	0.708	S	S	*	*			trans	72.4	151.2	155.1	-70.2	173.5	-169	-138.3	0.4	118.2
842	H	35.7	Very low	36	Very low	158 Å²	158	136 Å²	136	73%	0.731	71%	0.712	S	S	*	*			cis	-167.8	174.5	-24	-161.3	-101.1	0	0	0	108.8	E844	H842-E844 IonicContact CE1-OE2 3.76Å; H842-E844 IonicContact ND1-OE2 3.62Å
843	A	42	Very low	35.6	Very low	76 Å²	76	135.8 Å²	135.8	63%	0.628	71%	0.711	S	S	*	*			trans	70.6	141.2	158.1	0	0	0	0	0	118.8
844	E	34.6	Very low	35.2	Very low	143 Å²	143	133.6 Å²	133.6	67%	0.668	71%	0.71	S	S	*	*			cis	-167	165.5	-24.4	-134.1	158	114.9	0	0	112.8	H842	H842-E844 IonicContact CE1-OE2 3.76Å; H842-E844 IonicContact ND1-OE2 3.62Å
845	S	37.7	Very low	34.6	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	71%	0.706	S	S	*	*			trans	71.6	148.2	155.8	83.8	0	0	0	0	118.8
846	Q	31.3	Very low	34.6	Very low	141 Å²	141	135.1 Å²	135.1	66%	0.659	71%	0.708	S	S	*	*			cis	-174.2	173	-36.6	-118.6	168.9	11.2	0	0	109.2
847	Y	34.5	Very low	34.5	Very low	203 Å²	203	139.9 Å²	139.9	80%	0.796	72%	0.72	S	S	*	*			trans	66.5	131.5	169.4	-62.3	-72.3	0	0	0	117.5
848	S	32.7	Very low	34.5	Very low	109 Å²	109	141 Å²	141	76%	0.762	73%	0.725	S	S	*	*			cis	-152.1	164.5	-14.6	-145.8	0	0	0	0	112.1
849	S	29.3	Very low	34.7	Very low	95 Å²	95	139.1 Å²	139.1	66%	0.664	72%	0.724	S	S	*	*			trans	-139.9	162.8	-164.4	58.8	0	0	0	0	111.9
850	E	32.7	Very low	34.4	Very low	171 Å²	171	140.4 Å²	140.4	80%	0.799	73%	0.729	S	S	*	*			trans	69.1	175.4	158.9	-61.4	-67.9	100.1	0	0	116.3
851	P	38.5	Very low	34.4	Very low	92 Å²	92	141.1 Å²	141.1	60%	0.597	74%	0.74	S	S	*	*				-138.5	-149.1	-63.7	43.6	-27.4	0	0	0	111.5
852	D	29	Very low	34	Very low	142 Å²	142	138.4 Å²	138.4	76%	0.759	73%	0.734	S	S	*	*			trans	65	166.4	164	-83.6	-47.9	0	0	0	116.2
853	S	30.1	Very low	33.7	Very low	91 Å²	91	141.5 Å²	141.5	64%	0.636	74%	0.74	S	S	*	*			cis	-160	-171.8	-41.5	-113.1	0	0	0	0	107.2
854	E	29.5	Very low	33.3	Very low	170 Å²	170	139.3 Å²	139.3	79%	0.794	72%	0.724	S	S	*	*			trans	64.9	107.5	163.7	-57.1	-154.7	115.9	0	0	116.8
855	L	29.9	Very low	33.2	Very low	141 Å²	141	141.7 Å²	141.7	74%	0.738	73%	0.727	S	S	*	*				107.2	166.4	78.5	-90.7	173	0	0	0	111.9
856	L	33.9	Very low	32.7	Very low	149 Å²	149	140.4 Å²	140.4	78%	0.78	72%	0.718	S	S	*	*			trans	72.5	105.6	166.6	-59	-172.9	0	0	0	120.5
857	M	34.3	Very low	32.6	Very low	173 Å²	173	135.8 Å²	135.8	85%	0.852	70%	0.704	S	S	*	*			trans	88.4	116.6	130.2	-58	-60.7	-87.2	0	0	122.3
858	L	38.5	Very low	32.2	Very low	158 Å²	158	133.9 Å²	133.9	83%	0.827	70%	0.702	S	S	*	*			trans	-58.4	169.4	157.2	-72.8	173.2	0	0	0	112.3
859	P	41	Very low	32	Very low	93 Å²	93	132.8 Å²	132.8	60%	0.604	69%	0.694	S	S	*	*			cis	-158.9	175.2	40.7	45.3	-23.5	0	0	0	122.4
860	R	31.9	Very low	31.9	Very low	235 Å²	235	134 Å²	134	89%	0.887	69%	0.692	S	S	*	*			trans	73.2	142.3	156.1	-74.9	157.1	173.6	120	-1.9	117.3
861	A	36.3	Very low	31.7	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	68%	0.676	S	S	*	*			cis	-136.1	161.8	4.6	0	0	0	0	0	114
862	K	30.8	Very low	31.2	Very low	169 Å²	169	132.7 Å²	132.7	74%	0.735	68%	0.68	S	S	*	*			trans	-149.4	168.9	178.4	-84.3	-171.7	174.9	-170.4	0	110.1	M554	M554-K862 HydrophobicContact CE-CD 4.19Å; M554-K862 HydrophobicContact CE-CG 4.5Å
863	R	30	Very low	31.4	Very low	224 Å²	224	129.7 Å²	129.7	85%	0.845	67%	0.666	S	S	*	*			trans	84.7	157.6	176.3	-51.5	173.4	-179	-169.7	0.3	113.8
864	G	32	Very low	31.5	Very low	30 Å²	30	129.4 Å²	129.4	31%	0.309	67%	0.665	S	S	.	*			cis	-86.8	-166.2	0.6	0	0	0	0	0	115.7	Q552	Q552-G864 PolarHBondContact OE1-O 3.47Å
865	R	32.8	Very low	31.6	Very low	193 Å²	193	129.1 Å²	129.1	73%	0.728	66%	0.663	S	S	*	*			cis	108.1	75.5	-0.4	-68.5	-166.5	170.2	-86.2	0.7	123	S551 Q552	S551-R865 CarbonylContact O-C 3.51Å; S551-R865 VanDerWaalsContact O-O 3.11Å; Q552-R865 CarbonylContact O-C 3.35Å; Q552-R865 WeakPolarHBondContact O-CA 3.18Å; Q552-R865 PolarHBondContact O-N 2.74Å
866	S	28.4	Very low	31.9	Very low	74 Å²	74	129.8 Å²	129.8	52%	0.517	67%	0.667	S	S	.	*			trans	34.7	137.9	140.7	59.4	0	0	0	0	124.4	S551 Q552	S551-S866 VanDerWaalsContact C-N 3.35Å; S551-S866 WeakPolarHBondContact O-CA 3Å; S551-S866 PolarHBondContact O-N 2.98Å; Q552-S866 PolarHBondContact O-N 3.12Å
867	A	27.7	Very low	31.7	Very low	44 Å²	44	130.8 Å²	130.8	36%	0.364	67%	0.668	S	S	.	*				139.7	131.7	124.2	0	0	0	0	0	116.6	F549 E550	F549-A867 CarbonylContact C-O 3.36Å; F549-A867 VanDerWaalsContact C-O 3.27Å; E550-A867 CarbonylContact C-O 3.57Å; E550-A867 VanDerWaalsContact CA-O 3.32Å; E550-A867 WeakPolarHBondContact CA-O 3.45Å; E550-A867 PolarHBondContact N-O 2.9Å
868	E	27.1	Very low	31.9	Very low	162 Å²	162	127.7 Å²	127.7	76%	0.757	66%	0.66	S	S	*	*				44.6	138.8	124.6	-58.1	170.3	144.1	0	0	126.5
869	C	27.3	Very low	31.6	Very low	86 Å²	86	125.3 Å²	125.3	58%	0.581	66%	0.657	S	S	*	*			trans	79	140.8	130.3	-79	0	0	0	0	126.9	S547 S548 F549	S547-C869 CarbonylContact O-C 3.27Å; S548-C869 CarbonylContact C-O 2.95Å; S548-C869 VanDerWaalsContact C-O 3.32Å; S548-C869 VanDerWaalsContact O-O 3.04Å; F549-C869 PolarHBondContact N-O 2.99Å
870	L	27.4	Very low	31.1	Very low	121 Å²	121	128.6 Å²	128.6	63%	0.634	67%	0.668	S	S	*	*			trans	35.1	141.6	152.4	-38.3	-175.8	0	0	0	123.3	S547	S547-L870 CarbonylContact O-C 3.12Å; S547-L870 WeakPolarHBondContact O-CA 3.05Å; S547-L870 PolarHBondContact O-N 2.9Å
871	H	29.4	Very low	31.1	Very low	97 Å²	97	122.8 Å²	122.8	45%	0.449	66%	0.655	S	S	.	*			cis	-171.2	117.1	-9.9	-110	-164	0	0	0	113.5	S546 S547	S546-H871 PolarHBondContact N-CD2 3.49Å; S546-H871 VanDerWaalsContact N-CD2 3.31Å; S546-H871 PolarHBondContact N-NE2 3.46Å; S546-H871 WeakPolarHBondContact OG-CA 3.21Å; S546-H871 VanDerWaalsContact OG-CB 3.31Å; S546-H871 WeakPolarHBondContact OG-CB 3.35Å; S546-H871 PolarHBondContact OG-CD2 2.88Å; S547-H871 PolarHBondContact N-CD2 3.07Å; S547-H871 PolarHBondContact O-N 3.31Å; S547-H871 VanDerWaalsContact OG-C 3.25Å; S547-H871 WeakPolarHBondContact OG-CA 3.29Å; S547-H871 PolarHBondContact OG-N 2.8Å
872	M	28.8	Very low	30.9	Very low	139 Å²	139	128.2 Å²	128.2	69%	0.685	66%	0.655	S	S	*	*			trans	-173	161.9	147.9	-97.4	-104.9	156.9	0	0	111.7	S546 S547	S546-M872 WeakPolarHBondContact OG-CA 3.3Å; S546-M872 PolarHBondContact OG-N 2.84Å; S547-M872 WeakPolarHBondContact CB-O 3.45Å; S547-M872 PolarHBondContact OG-N 2.84Å; S547-M872 PolarHBondContact OG-O 3.1Å
873	T	31.6	Very low	30.9	Very low	78 Å²	78	124.5 Å²	124.5	48%	0.479	66%	0.656	S	S	.	*			cis	81.5	137.1	10.8	50.4	0	0	0	0	119.7	S545	S545-T873 PolarHBondContact OG-OG1 3.29Å
874	S	32.2	Very low	31	Very low	86 Å²	86	125.2 Å²	125.2	60%	0.601	66%	0.659	S	S	*	*			cis	-159.8	167.3	-12.6	75.1	0	0	0	0	113.8
875	E	31.3	Very low	30.9	Very low	163 Å²	163	128.6 Å²	128.6	76%	0.762	68%	0.677	S	S	*	*			trans	68.2	171	144.1	-73.3	166.1	-99.2	0	0	125.5
876	L	36.2	Very low	30.7	Very low	156 Å²	156	124 Å²	124	82%	0.817	68%	0.681	S	S	*	*			trans	72.9	140.2	168.5	-48.7	-177.7	0	0	0	118.4
877	Q	30.8	Very low	30.7	Very low	170 Å²	170	124.8 Å²	124.8	79%	0.794	69%	0.686	S	S	*	*			cis	-170.8	160.3	-36.7	-112	-88	-48.7	0	0	106.1
878	P	38.8	Very low	30.8	Very low	107 Å²	107	128.2 Å²	128.2	70%	0.695	70%	0.703	S	S	*	*			trans	-106	135.6	-166.9	36.5	-27.9	0	0	0	115.9
879	S	31.7	Very low	30.9	Very low	108 Å²	108	127.2 Å²	127.2	76%	0.755	70%	0.703	S	S	*	*			trans	-153.2	113.3	163.4	56.3	0	0	0	0	108.3
880	L	31.4	Very low	31	Very low	162 Å²	162	127.9 Å²	127.9	85%	0.848	71%	0.707	S	S	*	*				79	131.2	80.9	-78.8	175.2	0	0	0	114.9
881	D	30.2	Very low	31.5	Very low	114 Å²	114	130.3 Å²	130.3	61%	0.61	72%	0.72	S	S	*	*			trans	82.5	147.1	150.8	-110.9	-64.1	0	0	0	123.1
882	R	32.2	Very low	32.1	Very low	210 Å²	210	136.3 Å²	136.3	79%	0.792	74%	0.739	S	S	*	*			trans	34.3	105.4	167.3	-76.6	151	170.7	85	-6.8	118.3
883	A	31.6	Very low	32.9	Very low	91 Å²	91	134.4 Å²	134.4	75%	0.752	74%	0.736	S	S	*	*			cis	72.4	145.4	43.2	0	0	0	0	0	116
884	R	32.8	Very low	32.9	Very low	239 Å²	239	137.2 Å²	137.2	90%	0.902	75%	0.749	S	S	*	*			trans	71.8	148.8	-174.6	-61.9	-175.4	176.2	162.1	-1	114.9
885	S	29.6	Very low	32.7	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	76%	0.755	S	S	*	*			cis	-169.8	163.4	-19.7	-100.2	0	0	0	0	107.7
886	A	28.7	Very low	32.6	Very low	98 Å²	98	135.3 Å²	135.3	81%	0.81	75%	0.749	S	S	*	*			trans	65.2	160.8	164.4	0	0	0	0	0	114.2
887	S	28.8	Very low	32.3	Very low	90 Å²	90	134.7 Å²	134.7	63%	0.629	75%	0.745	S	S	*	*			cis	-164.1	-171.4	-24.1	50.3	0	0	0	0	107.4
888	T	28.6	Very low	32.3	Very low	116 Å²	116	134.5 Å²	134.5	71%	0.712	74%	0.744	S	S	*	*			trans	65.5	111.7	158.4	43.9	0	0	0	0	115.8
889	N	29.9	Very low	32.1	Very low	140 Å²	140	134.7 Å²	134.7	75%	0.749	75%	0.748	S	S	*	*				79.6	119.4	62.2	-173.9	50.2	0	0	0	111.6
890	C	29.3	Very low	32.5	Very low	100 Å²	100	134.4 Å²	134.4	68%	0.676	74%	0.744	S	S	*	*			trans	65.7	159.3	-178.7	-56	0	0	0	0	113.7
891	L	38.4	Very low	32.3	Very low	172 Å²	172	134.5 Å²	134.5	90%	0.901	74%	0.739	S	S	*	*			cis	-126.7	141.1	16	-79.3	160	0	0	0	114.2
892	R	40.4	Very low	32.7	Very low	224 Å²	224	141 Å²	141	85%	0.845	76%	0.756	S	S	*	*			trans	-93.3	176.6	153.3	-150.2	-150.5	-166.9	177.9	5.7	106.7
893	P	46.1	Very low	32.5	Very low	98 Å²	98	138 Å²	138	64%	0.636	75%	0.75	S	S	*	*			cis	-102.4	-151.2	-34.2	32.1	-12.8	0	0	0	108.7
894	D	31.3	Very low	32.9	Very low	138 Å²	138	144.4 Å²	144.4	74%	0.738	76%	0.755	S	S	*	*				-150.5	170.2	106.4	-130.1	-33.8	0	0	0	114.2
895	T	28	Very low	33.1	Very low	119 Å²	119	139.8 Å²	139.8	73%	0.73	74%	0.743	S	S	*	*			trans	-53.5	171.6	174.5	58.8	0	0	0	0	113.6
896	S	30.1	Very low	33.2	Very low	90 Å²	90	139.8 Å²	139.8	63%	0.629	74%	0.744	S	S	*	*			cis	-166.2	144	31.9	63.3	0	0	0	0	115.4
897	L	29.9	Very low	33.7	Very low	143 Å²	143	146 Å²	146	75%	0.749	75%	0.746	S	S	*	*			trans	65.4	150.1	138.1	-63.9	166.3	0	0	0	122.7
898	H	31	Very low	33.8	Very low	166 Å²	166	151.3 Å²	151.3	77%	0.769	76%	0.758	S	S	*	*			trans	69.7	101.4	152.1	-64.4	-42.2	0	0	0	122.2
899	S	34.7	Very low	34	Very low	110 Å²	110	149.7 Å²	149.7	77%	0.769	75%	0.751	S	S	*	*			trans	-47.3	161	131.2	-27.1	0	0	0	0	111.8
900	P	39.3	Very low	34.1	Very low	103 Å²	103	150.7 Å²	150.7	67%	0.669	75%	0.751	S	S	*	*				-156.6	172.3	79.6	43.1	-23.5	0	0	0	118.7
901	E	27.7	Very low	34.2	Very low	163 Å²	163	155.7 Å²	155.7	76%	0.762	76%	0.756	S	S	*	*			trans	46	123.3	139.6	-66.9	164	134.8	0	0	122.5
902	R	38.7	Very low	33.8	Very low	252 Å²	252	152.3 Å²	152.3	95%	0.951	75%	0.747	S	S	*	*				-152.1	143.5	97.1	-117.2	175.5	-178.1	-100.1	-5	113.9
903	E	28.8	Very low	33.4	Very low	145 Å²	145	146.1 Å²	146.1	68%	0.678	74%	0.738	S	S	*	*			trans	-81.1	151.3	-173.9	-52.3	164.7	81.4	0	0	113.8	H905	E903-H905 IonicContact OE1-CE1 4Å
904	R	38.5	Very low	32.9	Very low	227 Å²	227	148.9 Å²	148.9	86%	0.857	75%	0.745	S	S	*	*				-145.6	109.2	121.8	-76.3	-155.1	175.3	-173.2	-1.1	111.7
905	H	37.9	Very low	32.9	Very low	141 Å²	141	148.7 Å²	148.7	65%	0.653	74%	0.74	S	S	*	*			trans	30.1	144.4	133.6	-33.7	-49.4	0	0	0	120.9	E903	E903-H905 IonicContact OE1-CE1 4Å
906	S	31.9	Very low	33.2	Very low	101 Å²	101	150.2 Å²	150.2	71%	0.706	74%	0.737	S	S	*	*			cis	-176.4	168.4	-12.1	-177.3	0	0	0	0	110.1
907	R	39.2	Very low	33.4	Very low	227 Å²	227	153.9 Å²	153.9	86%	0.857	74%	0.744	S	S	*	*			trans	75.4	128	171.9	-45	-172.7	-179.8	-155.2	-2.5	114.1
908	K	30.8	Very low	33.5	Very low	202 Å²	202	152 Å²	152	88%	0.878	74%	0.743	S	S	*	*			cis	65.3	140.6	37.9	-54.8	-169.9	176.7	-174.5	0	112.7
909	S	31.9	Very low	33.5	Very low	82 Å²	82	155.3 Å²	155.3	57%	0.573	75%	0.748	S	S	*	*			cis	-159.3	153.8	1.6	-139.5	0	0	0	0	109.8
910	E	32.4	Very low	33.5	Very low	161 Å²	161	160.4 Å²	160.4	75%	0.752	76%	0.757	S	S	*	*			trans	61.1	170.2	148.1	-70	162.8	82.5	0	0	117.8
911	R	31.4	Very low	33.1	Very low	206 Å²	206	158.3 Å²	158.3	78%	0.777	75%	0.754	S	S	*	*			cis	-154.2	150.6	11.2	-151.4	177.3	-170.2	-143.4	2.3	111.8
912	S	30.6	Very low	33.3	Very low	101 Å²	101	157.4 Å²	157.4	71%	0.706	76%	0.76	S	S	*	*			trans	58.1	142.8	149.8	47	0	0	0	0	121.1
913	S	31.4	Very low	33	Very low	94 Å²	94	150 Å²	150	66%	0.657	75%	0.753	S	S	*	*			cis	-173.9	165.9	-12.9	51	0	0	0	0	111.1
914	I	36.1	Very low	33.2	Very low	155 Å²	155	148.1 Å²	148.1	80%	0.795	76%	0.755	S	S	*	*			trans	70.1	141.4	150.6	-77.4	160	0	0	0	117.6
915	Q	31.1	Very low	32.9	Very low	135 Å²	135	144.9 Å²	144.9	63%	0.631	76%	0.755	S	S	*	*			cis	-172.8	152.6	-29.1	-141.5	-170.6	18.3	0	0	108.4
916	K	33.6	Very low	32.7	Very low	151 Å²	151	142.1 Å²	142.1	66%	0.657	76%	0.757	S	S	*	*			trans	66.1	164.4	158.4	-64.6	164.5	174.3	150.5	0	116.9
917	Q	34.6	Very low	32.6	Very low	167 Å²	167	143.2 Å²	143.2	78%	0.78	76%	0.755	S	S	*	*			cis	-158.6	154.1	-24.4	-111.5	163.1	-27.4	0	0	111.7
918	S	31.1	Very low	32.1	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	75%	0.752	S	S	*	*			trans	17.3	113.2	145.7	-177.9	0	0	0	0	122.1
919	R	32.2	Very low	32	Very low	235 Å²	235	138.4 Å²	138.4	89%	0.887	74%	0.744	S	S	*	*				39	87.6	121.2	-165.1	-170.2	-166.7	-172	6.4	119
920	K	34.2	Very low	32.3	Very low	217 Å²	217	142 Å²	142	94%	0.943	76%	0.756	S	S	*	*			trans	168.6	148.7	148	-98.3	174.3	-180	-176.1	0	106.7
921	G	31.4	Very low	33	Very low	60 Å²	60	139.4 Å²	139.4	62%	0.619	75%	0.753	S	S	*	*			cis	161.1	148.4	-5.7	0	0	0	0	0	109.9
922	T	32	Very low	33.5	Very low	143 Å²	143	135.1 Å²	135.1	88%	0.877	75%	0.752	S	S	*	*			trans	54	127.9	168.2	52.8	0	0	0	0	120.5
923	A	31.2	Very low	33.6	Very low	97 Å²	97	135.6 Å²	135.6	80%	0.802	75%	0.754	S	S	*	*			trans	65.7	153.5	150	0	0	0	0	0	118.2
924	S	32.7	Very low	33.6	Very low	105 Å²	105	139.1 Å²	139.1	73%	0.734	76%	0.764	S	S	*	*			cis	-168.1	153.2	-14	44.2	0	0	0	0	111.3
925	D	32.7	Very low	33.5	Very low	160 Å²	160	137.5 Å²	137.5	86%	0.856	77%	0.767	S	S	*	*			trans	72.1	165.2	152.9	-128.2	-37.8	0	0	0	121
926	A	34.2	Very low	33.8	Very low	83 Å²	83	142.4 Å²	142.4	69%	0.686	78%	0.779	S	S	*	*			trans	55.4	83.3	157.5	0	0	0	0	0	121.2
927	D	29.6	Very low	33.9	Very low	124 Å²	124	146.7 Å²	146.7	66%	0.663	79%	0.791	S	S	*	*				31.1	129.4	125.8	-161.5	22.5	0	0	0	121.3
928	R	29.9	Very low	34	Very low	210 Å²	210	141.5 Å²	141.5	79%	0.792	78%	0.783	S	S	*	*			trans	101	142.5	133.7	-122.6	166.1	-128	-178.8	-3.1	122.8
929	V	28.1	Very low	34.4	Very low	118 Å²	118	147.1 Å²	147.1	72%	0.715	79%	0.79	S	S	*	*			trans	75.3	119	165.2	-160.9	0	0	0	0	114.8
930	L	37.9	Very low	34.5	Very low	158 Å²	158	139.4 Å²	139.4	83%	0.827	78%	0.777	S	S	*	*			cis	73.4	168.7	46	-62.3	174.2	0	0	0	114.2
931	P	46.9	Very low	34.5	Very low	106 Å²	106	137 Å²	137	69%	0.688	77%	0.773	S	S	*	*			cis	-117.6	-127.9	-17.5	42.4	-23.9	0	0	0	108.7
932	P	42.5	Very low	35	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	78%	0.775	S	S	*	*			cis	-85.3	-175.5	-4	41.5	-39.4	0	0	0	111.7
933	C	33	Very low	35	Very low	111 Å²	111	143.8 Å²	143.8	75%	0.75	78%	0.777	S	S	*	*			cis	-116.5	-167.9	-3.3	-62.9	0	0	0	0	109.1
934	L	30.7	Very low	35	Very low	169 Å²	169	143.2 Å²	143.2	89%	0.885	77%	0.772	S	S	*	*			cis	-127.9	147.5	-5.5	-81.6	166.3	0	0	0	107.2
935	S	34.7	Very low	34.8	Very low	120 Å²	120	144.4 Å²	144.4	84%	0.839	78%	0.775	S	S	*	*			trans	-162.4	167.9	175.8	-157.9	0	0	0	0	115.3
936	R	36.7	Very low	34.6	Very low	238 Å²	238	143.8 Å²	143.8	90%	0.898	77%	0.772	S	S	*	*			trans	84.3	133.2	-170.7	-56	176.5	-178	-104.1	-1.2	114
937	R	36.3	Very low	34.5	Very low	241 Å²	241	147.8 Å²	147.8	91%	0.909	78%	0.776	S	S	*	*			cis	-119.6	157.1	1.2	-59.8	173.4	175.8	-178.7	-2.8	109.8
938	G	36.6	Very low	35	Very low	59 Å²	59	146.7 Å²	146.7	61%	0.608	78%	0.776	S	S	*	*			cis	155.8	153.4	-7.2	0	0	0	0	0	112.8
939	Y	38.5	Very low	34.9	Very low	220 Å²	220	142.3 Å²	142.3	86%	0.863	77%	0.772	S	S	*	*			trans	70.9	150.1	168.8	-47.3	-70	0	0	0	118
940	A	35.3	Very low	35.1	Very low	74 Å²	74	143.8 Å²	143.8	61%	0.612	78%	0.775	S	S	*	*			cis	-167.9	150.1	-24.8	0	0	0	0	0	112.9
941	I	33.8	Very low	34.9	Very low	167 Å²	167	147.7 Å²	147.7	86%	0.856	78%	0.779	S	S	*	*			trans	74.6	150	144.8	-75.7	166.6	0	0	0	119.5
942	P	41.3	Very low	34.1	Very low	104 Å²	104	145.4 Å²	145.4	68%	0.675	77%	0.774	S	S	*	*			trans	-139.7	-167.4	-148.8	41.5	-20.4	0	0	0	117.3
943	R	32.3	Very low	33.7	Very low	240 Å²	240	149.9 Å²	149.9	91%	0.906	78%	0.781	S	S	*	*			trans	90.3	149.8	157	-75.7	-177.8	173.6	-155.6	-0.3	120.7
944	A	31.1	Very low	33.6	Very low	85 Å²	85	153.1 Å²	153.1	70%	0.702	79%	0.785	S	S	*	*			trans	78.4	105.4	146.9	0	0	0	0	0	121.3
945	T	29.3	Very low	33.4	Very low	131 Å²	131	151.6 Å²	151.6	80%	0.804	78%	0.783	S	S	*	*				66.8	135.1	117.6	-39.8	0	0	0	0	122.1
946	D	28.5	Very low	33.1	Very low	146 Å²	146	152.1 Å²	152.1	78%	0.781	78%	0.781	S	S	*	*			trans	91.6	160.6	153.8	-112.1	-48.6	0	0	0	122.9
947	Q	31.9	Very low	32.8	Very low	167 Å²	167	152.7 Å²	152.7	78%	0.78	78%	0.784	S	S	*	*			trans	-96.5	-176.2	-174.5	-84.1	-164.6	91.8	0	0	112.4
948	P	39.8	Very low	32.4	Very low	102 Å²	102	146.2 Å²	146.2	66%	0.662	78%	0.776	S	S	*	*			cis	-130.6	-154.9	-26.6	23.2	2	0	0	0	111.7
949	V	27.5	Very low	32.1	Very low	117 Å²	117	154 Å²	154	71%	0.709	79%	0.786	S	S	*	*			trans	84.2	107.1	153.5	-179.7	0	0	0	0	119.4
950	I	33.4	Very low	31.5	Very low	149 Å²	149	147.1 Å²	147.1	76%	0.764	77%	0.771	S	S	*	*				36.4	119.7	129	-49.7	168.6	0	0	0	116.2
951	R	32.7	Very low	31.2	Very low	241 Å²	241	147.2 Å²	147.2	91%	0.909	77%	0.767	S	S	*	*				-171.9	134.4	73.2	-153.5	168.5	-168.3	170.1	2.4	114.5
952	G	30.2	Very low	30.9	Very low	57 Å²	57	145 Å²	145	59%	0.588	75%	0.753	S	S	*	*			trans	84	80.8	133.4	0	0	0	0	0	121.5
953	K	34.3	Very low	30.3	Very low	209 Å²	209	147.3 Å²	147.3	91%	0.909	75%	0.754	S	S	*	*				-175.9	116.9	126.8	-98.7	157	-173.9	178.1	0	109.2
954	H	29.7	Very low	30	Very low	179 Å²	179	141.3 Å²	141.3	83%	0.829	75%	0.749	S	S	*	*			trans	-139.2	137.3	-172.2	-70.7	-91	0	0	0	112.9
955	T	27.4	Very low	30	Very low	138 Å²	138	141.6 Å²	141.6	85%	0.847	75%	0.746	S	S	*	*			trans	-140.3	82.2	160.4	34.5	0	0	0	0	111.5
956	T	28	Very low	30	Very low	130 Å²	130	142 Å²	142	80%	0.798	74%	0.742	S	S	*	*			trans	39.1	112.3	139	44.1	0	0	0	0	122
957	R	31.9	Very low	30.4	Very low	250 Å²	250	145 Å²	145	94%	0.943	74%	0.742	S	S	*	*			trans	-79.7	111.6	144.7	168.9	-164.9	-176.4	-161.9	4.9	109.5
958	S	27.6	Very low	30.6	Very low	106 Å²	106	143.1 Å²	143.1	74%	0.741	74%	0.742	S	S	*	*			trans	-172.6	142.1	162.6	-88.5	0	0	0	0	115.4
959	R	29.2	Very low	30.4	Very low	221 Å²	221	144.6 Å²	144.6	83%	0.834	74%	0.744	S	S	*	*			trans	36.1	140.9	149.4	-67.2	-175.1	170	-178.5	-2.9	123.5
960	S	27	Very low	31	Very low	76 Å²	76	144.7 Å²	144.7	53%	0.531	75%	0.748	S	S	.	*			trans	72.5	146.8	140.4	53.5	0	0	0	0	122.8
961	S	27.9	Very low	31.2	Very low	76 Å²	76	142 Å²	142	53%	0.531	74%	0.743	S	S	.	*			trans	70.2	122.2	146	52.7	0	0	0	0	122.1
962	E	27.6	Very low	31.4	Very low	121 Å²	121	136.7 Å²	136.7	57%	0.565	73%	0.73	S	S	*	*			trans	68.4	121.3	134	-61.4	-171.7	118.2	0	0	123.6	I1024	E962-I1024 WeakPolarHBondContact OE1-CD1 3.34Å
963	H	28.1	Very low	31.7	Very low	152 Å²	152	140.9 Å²	140.9	70%	0.704	73%	0.734	S	S	*	*			trans	50.5	121.1	134.5	-77	-85.8	0	0	0	123.1
964	S	26.7	Very low	31.7	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	72%	0.723	S	S	*	*			trans	78	162.5	144.1	91.2	0	0	0	0	116.8
965	S	31.1	Very low	32	Very low	92 Å²	92	137.2 Å²	137.2	64%	0.643	72%	0.724	S	S	*	*			cis	-163.3	164.7	-2.8	-135.9	0	0	0	0	113.7
966	I	30.6	Very low	32.2	Very low	138 Å²	138	134.9 Å²	134.9	71%	0.708	72%	0.719	S	S	*	*			trans	70.7	111.2	143.3	-72.3	161.8	0	0	0	121.6
967	R	35.1	Very low	32.6	Very low	210 Å²	210	134.8 Å²	134.8	79%	0.792	72%	0.721	S	S	*	*			trans	44.7	145	131	-55.9	178	170.8	170.6	-5.5	123.5
968	T	37.3	Very low	32.5	Very low	127 Å²	127	126.4 Å²	126.4	78%	0.779	71%	0.712	S	S	*	*				-149	110.4	119	-75.1	0	0	0	0	106.7
969	L	36.1	Very low	32.5	Very low	134 Å²	134	125.1 Å²	125.1	70%	0.702	72%	0.716	S	S	*	*				59.3	136.5	103.4	-55.9	173.5	0	0	0	113.3
970	C	39	Very low	32.5	Very low	118 Å²	118	120.8 Å²	120.8	80%	0.797	72%	0.72	S	S	*	*			cis	-146	179.8	39.4	-80	0	0	0	0	110.7
971	S	37.5	Very low	32.9	Very low	94 Å²	94	121.1 Å²	121.1	66%	0.657	73%	0.726	S	S	*	*			cis	179.7	157.4	-24.5	-85	0	0	0	0	106.6
972	M	36.6	Very low	33.4	Very low	129 Å²	129	123.7 Å²	123.7	64%	0.635	74%	0.741	S	S	*	*			cis	-165.9	-178.7	-7.1	-106.4	-90.3	85.9	0	0	108.6
973	H	37.2	Very low	34	Very low	145 Å²	145	123.4 Å²	123.4	67%	0.671	75%	0.75	S	S	*	*			trans	77.2	138.1	161.5	-39.8	-68	0	0	0	118.3
974	H	34.2	Very low	34.3	Very low	145 Å²	145	121.3 Å²	121.3	67%	0.671	75%	0.752	S	S	*	*			cis	-161.8	154.1	-20.1	-110.1	-28.7	0	0	0	112.6
975	L	36	Very low	34.8	Very low	165 Å²	165	121.2 Å²	121.2	86%	0.864	75%	0.749	S	S	*	*			trans	70.4	147.4	154.5	-64.9	163.5	0	0	0	120.1
976	A	32.6	Very low	34.7	Very low	89 Å²	89	124 Å²	124	74%	0.736	76%	0.756	S	S	*	*			trans	-120.4	-162.5	178.1	0	0	0	0	0	107.1
977	P	36.2	Very low	34.9	Very low	128 Å²	128	124.5 Å²	124.5	83%	0.831	76%	0.759	S	S	*	*			cis	-138.5	-174.7	0.4	43.6	-25.6	0	0	0	115.6
978	G	28.7	Very low	34.8	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	76%	0.755	S	S	*	*			trans	110.6	92.1	137.9	0	0	0	0	0	119.7
979	G	28.2	Very low	34.6	Very low	79 Å²	79	124.9 Å²	124.9	81%	0.814	76%	0.76	S	S	*	*				65.6	118.4	126.1	0	0	0	0	0	122.2
980	S	29.1	Very low	34.5	Very low	131 Å²	131	124.1 Å²	124.1	92%	0.916	76%	0.761	S	S	*	*				-171.7	158.6	127.5	32.6	0	0	0	0	110.8
981	A	35.8	Very low	34	Very low	82 Å²	82	126.5 Å²	126.5	68%	0.678	76%	0.76	S	S	*	*			trans	-105.5	176.8	-179.7	0	0	0	0	0	111.7
982	P	37.8	Very low	33.8	Very low	130 Å²	130	131 Å²	131	84%	0.844	76%	0.762	S	S	*	*				-128.2	159.2	110.7	36.6	-31.7	0	0	0	114.4
983	P	41.2	Very low	33.5	Very low	116 Å²	116	132.7 Å²	132.7	75%	0.753	77%	0.769	S	S	*	*			trans	-134.4	-164.2	-147.7	33.5	-9.7	0	0	0	114.4
984	S	33.1	Very low	33.3	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	77%	0.771	S	S	*	*	S	Bend	trans	-82.3	-169.6	152.2	-54.2	0	0	0	0	110.3
985	P	38.6	Very low	33.2	Very low	113 Å²	113	127.9 Å²	127.9	73%	0.734	78%	0.779	S	S	*	*				-101.8	178.1	-106.5	42.4	-32.8	0	0	0	116
986	L	29	Very low	33.4	Very low	149 Å²	149	125.5 Å²	125.5	78%	0.78	77%	0.773	S	S	*	*			trans	86	125.6	157.7	-63.9	167.4	0	0	0	121.7
987	L	33.5	Very low	33.5	Very low	149 Å²	149	127.2 Å²	127.2	78%	0.78	78%	0.775	S	S	*	*			trans	84.2	122.5	130.8	-76.9	172.4	0	0	0	124.7
988	T	32.5	Very low	33.5	Very low	114 Å²	114	129 Å²	129	70%	0.699	77%	0.772	S	S	*	*			trans	102.3	106.5	133.1	-58.7	0	0	0	0	121.9
989	R	34.4	Very low	33.6	Very low	232 Å²	232	130.1 Å²	130.1	88%	0.875	77%	0.768	S	S	*	*			trans	63.6	134.2	138.6	-139.7	176.9	177.3	-178.2	-1.3	117.3
990	T	33.1	Very low	34.5	Very low	118 Å²	118	132 Å²	132	72%	0.724	77%	0.766	S	S	*	*				-153.3	147	51.2	43.9	0	0	0	0	115.7
991	H	29.5	Very low	35.4	Very low	168 Å²	168	131.3 Å²	131.3	78%	0.778	76%	0.758	S	S	*	*			trans	59.9	137.2	156.3	-95.4	-158	0	0	0	119.9
992	R	31.6	Very low	35.6	Very low	188 Å²	188	131.6 Å²	131.6	71%	0.709	76%	0.761	S	S	*	*			cis	-128	147.8	1.7	-95.6	-174.9	167.1	-179	-2.2	111.5
993	Q	31.1	Very low	35.5	Very low	165 Å²	165	132.2 Å²	132.2	77%	0.771	76%	0.757	S	S	*	*			trans	30.6	125.9	140.6	-59.4	160	-33.8	0	0	118.1
994	G	34	Very low	35.4	Very low	70 Å²	70	132.1 Å²	132.1	72%	0.722	76%	0.755	S	S	*	*			cis	154	167.7	8.8	0	0	0	0	0	108.2
995	S	32	Very low	35.4	Very low	119 Å²	119	131.5 Å²	131.5	83%	0.832	75%	0.75	S	S	*	*			cis	-156.5	162.4	-5.4	-73	0	0	0	0	109
996	P	40.1	Very low	35.5	Very low	115 Å²	115	135.9 Å²	135.9	75%	0.747	76%	0.758	S	S	*	*			trans	-103.8	174.7	-170.4	40.4	-36.3	0	0	0	114.9
997	T	35.1	Very low	36	Very low	125 Å²	125	132.3 Å²	132.3	77%	0.767	76%	0.757	S	S	*	*			trans	158.4	159.2	155.6	36.2	0	0	0	0	109
998	Q	35.3	Very low	35.9	Very low	164 Å²	164	130.7 Å²	130.7	77%	0.766	76%	0.758	S	S	*	*			cis	-157.2	152.6	-14.5	-119.6	178	51.8	0	0	111.2
999	S	30	Very low	36.2	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	77%	0.767	S	S	*	*			trans	54.8	146.1	143	-52.2	0	0	0	0	125.2
1000	P	47.9	Very low	36.4	Very low	118 Å²	118	137.5 Å²	137.5	77%	0.766	77%	0.771	S	S	*	*			trans	-108.3	-152.8	172.5	42.2	-27.7	0	0	0	111.1
1001	P	47.5	Very low	36.5	Very low	117 Å²	117	135 Å²	135	76%	0.76	77%	0.768	S	S	*	*			cis	-144	-152.9	7	45	-22	0	0	0	117.3
1002	A	39.4	Very low	37	Very low	89 Å²	89	138.6 Å²	138.6	74%	0.736	78%	0.775	S	S	*	*			trans	85.2	140.1	169.3	0	0	0	0	0	117.1
1003	D	36.7	Very low	37	Very low	142 Å²	142	137.8 Å²	137.8	76%	0.759	78%	0.779	S	S	*	*			cis	-158.2	169	-9.6	-137.1	-41.9	0	0	0	114.2
1004	T	38.8	Very low	37.4	Very low	115 Å²	115	136.9 Å²	136.9	71%	0.706	78%	0.779	S	S	*	*			trans	63.4	135	170.5	63.1	0	0	0	0	118
1005	S	34.1	Very low	37.6	Very low	93 Å²	93	139.2 Å²	139.2	65%	0.65	78%	0.781	S	S	*	*			cis	76.6	132.5	30.2	-54.9	0	0	0	0	113.7
1006	F	39.5	Very low	37.7	Very low	206 Å²	206	141.8 Å²	141.8	90%	0.904	78%	0.78	S	S	*	*			cis	-144	172.3	19.6	-66.7	-97.5	0	0	0	110.6
1007	G	39.2	Very low	37.5	Very low	73 Å²	73	143.2 Å²	143.2	75%	0.753	79%	0.786	S	S	*	*			cis	175.5	145.7	-6.9	0	0	0	0	0	112.5
1008	S	32	Very low	37.6	Very low	115 Å²	115	142 Å²	142	80%	0.804	78%	0.781	S	S	*	*			trans	-155.4	128.2	174.5	173.8	0	0	0	0	110
1009	R	39.1	Very low	37.5	Very low	236 Å²	236	140.2 Å²	140.2	89%	0.891	78%	0.781	S	S	*	*			trans	172	147.6	163.9	-102.8	161.7	-160.7	-108.4	5.7	113.2
1010	R	38	Very low	37.8	Very low	254 Å²	254	146.9 Å²	146.9	96%	0.958	79%	0.791	S	S	*	*			trans	141.3	133.3	138.2	-76.9	173.1	-148.6	-107.4	6.7	109.9
1011	G	35.1	Very low	36.9	Very low	65 Å²	65	147.4 Å²	147.4	67%	0.67	80%	0.797	S	S	*	*			cis	159.8	169.5	-8.8	0	0	0	0	0	112.9
1012	R	39.7	Very low	36.2	Very low	244 Å²	244	145.2 Å²	145.2	92%	0.921	80%	0.797	S	S	*	*			trans	74.4	119.1	178.1	-48.6	178.2	-173.3	-83.5	4.5	114.4
1013	Q	32.1	Very low	35.7	Very low	171 Å²	171	146.5 Å²	146.5	80%	0.799	80%	0.8	S	S	*	*			cis	98.8	144.2	8.1	-155.8	-167.7	-0.3	0	0	116.6
1014	L	40.7	Very low	35.5	Very low	145 Å²	145	144.7 Å²	144.7	76%	0.759	79%	0.789	S	S	*	*			trans	97	148.8	165.5	-54.8	175.1	0	0	0	116.7
1015	P	36.6	Very low	35.1	Very low	119 Å²	119	144.3 Å²	144.3	77%	0.773	78%	0.779	S	S	*	*			cis	-134.9	178.2	-49.6	38	-22.4	0	0	0	113.8
1016	Q	34.8	Very low	34.8	Very low	173 Å²	173	146 Å²	146	81%	0.808	78%	0.777	S	S	*	*			trans	-88.1	154.7	176.1	-65.9	177.3	-18.4	0	0	113.4
1017	V	35.6	Very low	34.3	Very low	145 Å²	145	141.2 Å²	141.2	88%	0.879	78%	0.775	S	S	*	*			trans	-142.5	117.7	145.9	-176	0	0	0	0	109.6
1018	P	38.2	Very low	33.9	Very low	100 Å²	100	143 Å²	143	65%	0.649	78%	0.776	S	S	*	*			trans	-110.2	142.9	167.7	36	-27.4	0	0	0	112
1019	V	32.9	Very low	33.9	Very low	127 Å²	127	144.4 Å²	144.4	77%	0.77	77%	0.774	S	S	*	*			trans	-166	133.6	158.3	119.2	0	0	0	0	115.2
1020	R	35	Very low	33.5	Very low	237 Å²	237	138.5 Å²	138.5	89%	0.894	76%	0.764	S	S	*	*			trans	70.8	162	153.8	-71.4	174.6	-174.7	172.7	1.4	122.5
1021	S	29.5	Very low	33.7	Very low	129 Å²	129	132.9 Å²	132.9	90%	0.902	76%	0.757	S	S	*	*			trans	-130.3	161.7	-166.9	-41.6	0	0	0	0	110.9
1022	G	34	Very low	33.7	Very low	72 Å²	72	136.8 Å²	136.8	74%	0.742	76%	0.759	S	S	*	*			trans	144.9	118.6	179.5	0	0	0	0	0	107.7
1023	S	29.2	Very low	33.4	Very low	116 Å²	116	133 Å²	133	81%	0.811	75%	0.751	S	S	*	*			cis	85.2	139.1	36.1	-159.8	0	0	0	0	113.9
1024	I	31.9	Very low	33.3	Very low	103 Å²	103	135.6 Å²	135.6	53%	0.528	75%	0.754	S	S	.	*			trans	81.7	106	169	-75.5	158.7	0	0	0	118.5	E962	E962-I1024 WeakPolarHBondContact OE1-CD1 3.34Å
1025	E	30	Very low	33	Very low	107 Å²	107	133.6 Å²	133.6	50%	0.5	75%	0.747	S	S	.	*				60.6	136.6	128.8	-55.8	-113.5	76.1	0	0	124.4
1026	Q	28	Very low	32.8	Very low	129 Å²	129	137 Å²	137	60%	0.603	75%	0.745	S	S	*	*			trans	32.5	121.7	136.4	-55.5	179.9	49	0	0	121.6
1027	A	28.7	Very low	32.6	Very low	105 Å²	105	134.9 Å²	134.9	87%	0.868	74%	0.735	S	S	*	*			trans	-162.6	138.3	130.2	0	0	0	0	0	115.3
1028	S	30.2	Very low	32.2	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	73%	0.725	S	S	*	*			trans	30.3	108	151.1	-146.3	0	0	0	0	123.1
1029	L	32.3	Very low	32.2	Very low	146 Å²	146	138 Å²	138	76%	0.764	73%	0.73	S	S	*	*				9.7	155.7	105.2	-86	166.4	0	0	0	121
1030	V	30.5	Very low	32.1	Very low	112 Å²	112	139.8 Å²	139.8	68%	0.679	73%	0.732	S	S	*	*			trans	74	104.7	165.7	-162.4	0	0	0	0	116.5
1031	V	43.5	Very low	31.9	Very low	135 Å²	135	137.2 Å²	137.2	82%	0.818	73%	0.728	S	S	*	*				-155.1	125.6	108.1	142.4	0	0	0	0	110.9
1032	E	35.2	Very low	32.1	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.692	72%	0.718	S	S	*	*			trans	-14.4	132.5	153.4	-83.1	158.5	73.3	0	0	119.9
1033	E	32.2	Very low	32.3	Very low	163 Å²	163	139.1 Å²	139.1	76%	0.762	71%	0.71	S	S	*	*				43.1	120.9	106.1	-179.2	176.1	164	0	0	118.9
1034	R	30.3	Very low	32.3	Very low	227 Å²	227	142.8 Å²	142.8	86%	0.857	71%	0.706	S	S	*	*				-156.1	121.9	128.7	-115.8	-174	169.8	80.2	-4.4	113.1
1035	T	34.5	Very low	32.3	Very low	102 Å²	102	145.1 Å²	145.1	63%	0.626	71%	0.713	S	S	*	*				69.5	136.5	126.7	-69.3	0	0	0	0	120.2
1036	R	31.7	Very low	32.7	Very low	191 Å²	191	146.3 Å²	146.3	72%	0.721	72%	0.717	S	S	*	*			cis	-169.6	143.7	-17.9	-108.9	-178.2	178.6	-170.2	2.5	108.1
1037	Q	31.1	Very low	32.9	Very low	128 Å²	128	147 Å²	147	60%	0.598	72%	0.719	S	S	*	*			trans	57.1	143.5	133.2	-63	171.4	-9.3	0	0	123.6
1038	M	28	Very low	33.1	Very low	136 Å²	136	147 Å²	147	67%	0.67	71%	0.709	S	S	*	*			trans	61.5	116.2	138.1	-70.9	174.8	-158.2	0	0	119.3
1039	K	37.5	Very low	33.1	Very low	176 Å²	176	148.3 Å²	148.3	77%	0.765	71%	0.713	S	S	*	*				-173.5	144.8	62	-96.4	125.9	-175	175.4	0	108.9
1040	M	30.6	Very low	33	Very low	164 Å²	164	144.4 Å²	144.4	81%	0.808	71%	0.708	S	S	*	*			cis	86.9	137.8	49.6	-91	-90.4	-131.7	0	0	115.5
1041	K	30.6	Very low	33	Very low	183 Å²	183	145.7 Å²	145.7	80%	0.796	72%	0.721	S	S	*	*			trans	71.2	151.3	161.8	-68.6	-166.3	171.1	179.8	0	117.6
1042	V	35.1	Very low	32.4	Very low	117 Å²	117	142 Å²	142	71%	0.709	71%	0.711	S	S	*	*			cis	-157.2	177.2	-16.8	-95	0	0	0	0	106.7
1043	H	36.2	Very low	32	Very low	124 Å²	124	141.1 Å²	141.1	57%	0.574	72%	0.721	S	S	*	*			cis	-148.2	147.1	3	-141.4	-137.3	0	0	0	104.6
1044	R	30	Very low	32	Very low	192 Å²	192	137.9 Å²	137.9	73%	0.725	72%	0.716	S	S	*	*			cis	72.8	100.6	40	-173.5	-127	-169	159.7	5.2	114.6
1045	F	32.1	Very low	31.9	Very low	152 Å²	152	133.9 Å²	133.9	67%	0.667	71%	0.707	S	S	*	*			trans	176.5	149.6	145.7	-108.5	-146.9	0	0	0	109
1046	K	37.5	Very low	31.6	Very low	133 Å²	133	136.2 Å²	136.2	58%	0.578	71%	0.711	S	S	*	*			cis	-163.9	139.5	-10.2	-143.4	-161.9	-172.7	-147.2	0	109.5
1047	Q	33.3	Very low	31.6	Very low	142 Å²	142	135.3 Å²	135.3	66%	0.664	72%	0.72	S	S	*	*			trans	54.5	160.2	136.6	-81	177.3	-13.3	0	0	120.9
1048	T	32.3	Very low	31.5	Very low	106 Å²	106	136.2 Å²	136.2	65%	0.65	73%	0.729	S	S	*	*			cis	-153.6	156.8	5.7	-6.8	0	0	0	0	110.9
1049	T	31.1	Very low	31.5	Very low	138 Å²	138	137.9 Å²	137.9	85%	0.847	74%	0.735	S	S	*	*			trans	32.8	143.8	148.4	54.4	0	0	0	0	122.3
1050	G	30.5	Very low	31.3	Very low	64 Å²	64	136.8 Å²	136.8	66%	0.66	73%	0.732	S	S	*	*			cis	143.8	157	1.6	0	0	0	0	0	112.7
1051	S	28.8	Very low	31.5	Very low	138 Å²	138	138.4 Å²	138.4	97%	0.965	74%	0.738	S	S	*	*			trans	66.8	146	177.4	-52.9	0	0	0	0	116.4
1052	G	31.3	Very low	31.5	Very low	59 Å²	59	139.6 Å²	139.6	61%	0.608	74%	0.739	S	S	*	*			cis	157.6	157.3	-8.8	0	0	0	0	0	111.9
1053	S	28.4	Very low	31.7	Very low	129 Å²	129	139 Å²	139	90%	0.902	74%	0.74	S	S	*	*			trans	60.9	160.4	173.1	35.2	0	0	0	0	117
1054	S	31.5	Very low	31.9	Very low	94 Å²	94	140.4 Å²	140.4	66%	0.657	74%	0.744	S	S	*	*			cis	-161.5	137.3	-18.2	179.2	0	0	0	0	109.1
1055	Q	27.9	Very low	32.2	Very low	143 Å²	143	139.8 Å²	139.8	67%	0.668	74%	0.743	S	S	*	*			trans	40.8	135.7	132.9	-159.4	168.7	-3.2	0	0	122.3
1056	E	27.9	Very low	32.4	Very low	151 Å²	151	138.7 Å²	138.7	71%	0.706	74%	0.744	S	S	*	*			trans	49.9	128.7	152.5	-70.3	151.7	-149.5	0	0	120.9
1057	L	32.9	Very low	32.4	Very low	172 Å²	172	139 Å²	139	90%	0.901	75%	0.751	S	S	*	*				-173.3	163.9	102.4	-97.6	168.5	0	0	0	112.2
1058	D	27.3	Very low	32.6	Very low	147 Å²	147	139.6 Å²	139.6	79%	0.786	75%	0.753	S	S	*	*			trans	-91.8	159.7	-175.2	-88.8	-72.2	0	0	0	114.6
1059	H	29.7	Very low	32.7	Very low	172 Å²	172	141.6 Å²	141.6	80%	0.796	75%	0.753	S	S	*	*			trans	79.1	159.2	146.9	-122.2	-92.5	0	0	0	122.4
1060	E	32.5	Very low	32.7	Very low	152 Å²	152	140.3 Å²	140.3	71%	0.71	74%	0.741	S	S	*	*			trans	66.1	112	165.6	-58.1	-159.6	89.6	0	0	121
1061	Q	35.6	Very low	32.8	Very low	198 Å²	198	145.9 Å²	145.9	93%	0.925	75%	0.75	S	S	*	*				-160.8	162.6	97.2	-105.3	-175.8	3.4	0	0	113.7
1062	Y	30.4	Very low	32.9	Very low	209 Å²	209	148 Å²	148	82%	0.82	74%	0.738	S	S	*	*			trans	-105.4	141.6	-163.7	-103.3	-106.9	0	0	0	114.5
1063	S	38.8	Very low	32.9	Very low	104 Å²	104	155 Å²	155	73%	0.727	75%	0.746	S	S	*	*				169.2	123.8	122.4	-79	0	0	0	0	112.5
1064	K	39.1	Very low	33	Very low	153 Å²	153	153.2 Å²	153.2	67%	0.665	73%	0.733	S	S	*	*				77.3	127.3	78.3	-131.7	-175.5	-179	-164.8	0	112
1065	Y	37.6	Very low	33	Very low	179 Å²	179	153.6 Å²	153.6	70%	0.702	74%	0.735	S	S	*	*			cis	-124.8	154.6	10.1	-77.6	-111.3	0	0	0	110.6
1066	N	35.1	Very low	33.3	Very low	129 Å²	129	152.7 Å²	152.7	69%	0.69	73%	0.734	S	S	*	*			cis	111.2	151.2	13	-169.5	32.2	0	0	0	113.8
1067	I	39.4	Very low	33.3	Very low	139 Å²	139	152.4 Å²	152.4	71%	0.713	74%	0.738	S	S	*	*			trans	77.4	125.8	-174.4	-57.2	171.2	0	0	0	112
1068	H	37.3	Very low	33.4	Very low	155 Å²	155	148.8 Å²	148.8	72%	0.718	73%	0.733	S	S	*	*			cis	-150.6	166.2	-6.6	-132.5	-123.3	0	0	0	107.9
1069	K	32.8	Very low	33.8	Very low	148 Å²	148	147.5 Å²	147.5	64%	0.643	74%	0.735	S	S	*	*			cis	77	138.1	22.5	-75.1	-162.8	164.1	-68.1	0	116
1070	D	31.6	Very low	34.2	Very low	111 Å²	111	142.6 Å²	142.6	59%	0.594	72%	0.724	S	S	*	*			cis	-166.4	179.4	-7	-124.6	8.2	0	0	0	110.6
1071	Q	34.1	Very low	34.5	Very low	181 Å²	181	144.5 Å²	144.5	85%	0.846	73%	0.73	S	S	*	*			trans	83.5	160.2	159.1	-43.3	-166	20.2	0	0	120.3
1072	Y	29	Very low	34.4	Very low	183 Å²	183	138.5 Å²	138.5	72%	0.718	71%	0.711	S	S	*	*			cis	-177.4	150.2	-43.8	-168.2	-147.5	0	0	0	108.7
1073	R	33.3	Very low	34.5	Very low	207 Å²	207	131.9 Å²	131.9	78%	0.781	70%	0.695	S	S	*	*			trans	62.2	170.1	171.2	-70.7	173.6	-172	-115.5	3.5	116.2
1074	S	29.8	Very low	34.2	Very low	90 Å²	90	131.2 Å²	131.2	63%	0.629	68%	0.683	S	S	*	*			cis	-169.8	133.2	-38.9	-175.7	0	0	0	0	109.9
1075	C	31.1	Very low	34	Very low	103 Å²	103	128.4 Å²	128.4	70%	0.696	68%	0.682	S	S	*	*			trans	53.8	164.2	153	67.1	0	0	0	0	122.4
1076	D	34.3	Very low	33.9	Very low	123 Å²	123	126.7 Å²	126.7	66%	0.658	69%	0.685	S	S	*	*			trans	77.1	89.8	158.4	-62	-56	0	0	0	122.3
1077	N	27.6	Very low	34.1	Very low	146 Å²	146	126.8 Å²	126.8	78%	0.781	69%	0.69	S	S	*	*				51.3	110.7	108.9	-67	-54.4	0	0	0	119.5
1078	A	36.1	Very low	33.6	Very low	96 Å²	96	124.9 Å²	124.9	79%	0.793	69%	0.689	S	S	*	*				-179	139	108.2	0	0	0	0	0	114.2
1079	S	34	Very low	33.5	Very low	119 Å²	119	125.1 Å²	125.1	83%	0.832	70%	0.696	S	S	*	*			trans	59.2	133.7	136.4	-173.2	0	0	0	0	121.3
1080	A	38.5	Very low	33.6	Very low	69 Å²	69	123.8 Å²	123.8	57%	0.57	70%	0.7	S	S	*	*			cis	-175.2	152.7	-11.4	0	0	0	0	0	111.6
1081	K	39.6	Very low	33.7	Very low	192 Å²	192	124.1 Å²	124.1	84%	0.835	71%	0.711	S	S	*	*			trans	68.7	148.8	151	-68.9	160.3	-176.6	-179.2	0	119.3
1082	S	32.6	Very low	33.8	Very low	73 Å²	73	119.3 Å²	119.3	51%	0.51	70%	0.702	S	S	.	*			cis	-178.5	146.4	-18.6	52	0	0	0	0	113.2
1083	S	34	Very low	34.1	Very low	70 Å²	70	118.1 Å²	118.1	49%	0.49	71%	0.707	S	S	.	*			trans	81.8	121.8	137.8	-68.6	0	0	0	0	123.1	D24 H27	D24-S1083 PolarHBondContact OD2-N 3.26Å; D24-S1083 VanDerWaalsContact OD2-N 3.13Å; H27-S1083 WeakPolarHBondContact CB-OG 3.32Å; H27-S1083 WeakPolarHBondContact ND1-CA 3.48Å
1084	D	32.3	Very low	33.9	Very low	90 Å²	90	113.6 Å²	113.6	48%	0.481	71%	0.707	S	S	.	*				50.6	155	102.9	-115.9	-8.4	0	0	0	121.3	H27	H27-D1084 HydrophobicContact CB-CB 3.7Å; H27-D1084 WeakPolarHBondContact CB-OD2 3.37Å; H27-D1084 IonicContact CD2-OD1 2.63Å; H27-D1084 PolarHBondContact CD2-OD1 3.11Å; H27-D1084 IonicContact CD2-OD2 3.34Å; H27-D1084 PolarHBondContact CD2-OD2 3.29Å; H27-D1084 VanDerWaalsContact CG-CG 3.4Å; H27-D1084 IonicContact CG-OD1 3.32Å; H27-D1084 IonicContact CG-OD2 3.95Å; H27-D1084 PolarHBondContact ND1-N 3.4Å; H27-D1084 IonicContact NE2-OD1 3.35Å; H27-D1084 PolarHBondContact NE2-OD1 3.1Å
1085	S	34.7	Very low	34.3	Very low	93 Å²	93	121.3 Å²	121.3	65%	0.65	72%	0.722	S	S	*	*			cis	-152.6	165.2	7	75.7	0	0	0	0	115.5
1086	D	35.6	Very low	34.4	Very low	143 Å²	143	120.5 Å²	120.5	77%	0.765	72%	0.723	S	S	*	*			trans	-67.3	160	153.9	-95.6	-53.4	0	0	0	111.5
1087	V	37.9	Very low	34.1	Very low	131 Å²	131	119.9 Å²	119.9	79%	0.794	73%	0.728	S	S	*	*				177.7	121	117.3	-84.5	0	0	0	0	114.5
1088	S	29.5	Very low	34.1	Very low	99 Å²	99	118.2 Å²	118.2	69%	0.692	73%	0.728	S	S	*	*			trans	23.1	119.6	138.6	69.5	0	0	0	0	124
1089	D	34.4	Very low	33.8	Very low	160 Å²	160	120.8 Å²	120.8	86%	0.856	73%	0.734	S	S	*	*				77.7	163.2	119.4	-102.1	-42.7	0	0	0	125.9
1090	V	35.3	Very low	33.7	Very low	121 Å²	121	120.4 Å²	120.4	73%	0.733	73%	0.732	S	S	*	*			trans	75.2	106.3	164.7	172.1	0	0	0	0	119.5
1091	S	33.6	Very low	33.5	Very low	117 Å²	117	129.3 Å²	129.3	82%	0.818	75%	0.75	S	S	*	*			trans	54	147.1	137.7	-53.1	0	0	0	0	120.7
1092	A	36.6	Very low	33.1	Very low	81 Å²	81	128 Å²	128	67%	0.669	75%	0.751	S	S	*	*			cis	-166.7	160.4	29.7	0	0	0	0	0	114
1093	I	34.4	Very low	33	Very low	157 Å²	157	129.7 Å²	129.7	81%	0.805	76%	0.763	S	S	*	*			trans	57.8	95.4	148.4	-54.6	155.6	0	0	0	119
1094	S	31.1	Very low	33	Very low	112 Å²	112	130.7 Å²	130.7	78%	0.783	77%	0.771	S	S	*	*			trans	16.5	119.2	133.8	-49.1	0	0	0	0	121.4
1095	R	36.4	Very low	32.9	Very low	252 Å²	252	133 Å²	133	95%	0.951	79%	0.788	S	S	*	*			trans	-164.7	146.3	135.4	-115.7	165.5	179.4	177.2	-1	114.9
1096	A	33.2	Very low	32.7	Very low	87 Å²	87	133.3 Å²	133.3	72%	0.719	79%	0.79	S	S	*	*			trans	54.4	101.3	157.1	0	0	0	0	0	120.3
1097	S	28.4	Very low	32.5	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	79%	0.792	S	S	*	*				33.6	124.8	118.4	-45.9	0	0	0	0	121.4
1098	S	28	Very low	32.4	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	79%	0.79	S	S	*	*			trans	64.1	106.9	139.4	-52.7	0	0	0	0	119.6
1099	T	30.3	Very low	32.5	Very low	150 Å²	150	135.7 Å²	135.7	92%	0.92	79%	0.786	S	S	*	*				-175.5	149.6	104.6	24.7	0	0	0	0	112.2
1100	S	31.4	Very low	32.5	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	78%	0.78	S	S	*	*			trans	-97.1	137	174.7	49	0	0	0	0	111.4
1101	R	34.4	Very low	32.3	Very low	256 Å²	256	137.2 Å²	137.2	97%	0.966	78%	0.78	S	S	*	*			trans	-144	136.4	152.1	-73.4	-155.7	175.7	-145.5	-4.4	112.7
1102	L	31.7	Very low	32.2	Very low	163 Å²	163	137 Å²	137	85%	0.853	78%	0.779	S	S	*	*			trans	-76.3	164.6	-166.3	-63	148.7	0	0	0	115.4
1103	S	30.3	Very low	32.1	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	79%	0.785	S	S	*	*			trans	75.1	156.7	140.9	-77.7	0	0	0	0	121.1
1104	S	33.5	Very low	32.2	Very low	92 Å²	92	144.1 Å²	144.1	64%	0.643	79%	0.786	S	S	*	*			cis	-175.7	158.9	-22.4	-94.5	0	0	0	0	110.9
1105	T	30.7	Very low	32.7	Very low	138 Å²	138	142.3 Å²	142.3	85%	0.847	77%	0.771	S	S	*	*			trans	65.2	156.3	153.7	41.6	0	0	0	0	119.7
1106	S	30.2	Very low	32.5	Very low	99 Å²	99	142.3 Å²	142.3	69%	0.692	77%	0.771	S	S	*	*			cis	-171.7	160.1	-5.4	45.6	0	0	0	0	113.6
1107	F	30.7	Very low	32.5	Very low	185 Å²	185	141.9 Å²	141.9	81%	0.811	78%	0.775	S	S	*	*			trans	70.8	152.4	153.7	-99.5	-138.9	0	0	0	118
1108	M	37.4	Very low	32.8	Very low	150 Å²	150	147.3 Å²	147.3	74%	0.739	78%	0.778	S	S	*	*			cis	-129.8	156.8	10.3	-64.3	-165.6	68.5	0	0	112.6
1109	S	29.7	Very low	33.3	Very low	89 Å²	89	148.8 Å²	148.8	62%	0.622	78%	0.776	S	S	*	*				48.8	142.9	102.9	-42.2	0	0	0	0	116.3
1110	E	35.6	Very low	33.5	Very low	155 Å²	155	146.6 Å²	146.6	72%	0.724	77%	0.767	S	S	*	*			cis	-148.6	140.2	43.7	-69.6	-162.6	99.2	0	0	113.5
1111	Q	31.4	Very low	33.4	Very low	157 Å²	157	146.2 Å²	146.2	73%	0.734	76%	0.764	S	S	*	*				83.5	121.9	93.1	-59.9	-157.4	65.5	0	0	119.3
1112	S	30.7	Very low	33.3	Very low	114 Å²	114	143.6 Å²	143.6	80%	0.797	76%	0.76	S	S	*	*			trans	74.1	151.7	147.4	82.3	0	0	0	0	119.3
1113	E	34	Very low	33.8	Very low	168 Å²	168	141.1 Å²	141.1	79%	0.785	75%	0.752	S	S	*	*			cis	-134.6	170.6	3.5	-85.4	-157.8	122.1	0	0	113.9
1114	R	37.9	Very low	34.3	Very low	219 Å²	219	141.7 Å²	141.7	83%	0.826	75%	0.753	S	S	*	*			trans	-135.4	156.7	166.6	-100	180	176.9	143.3	-2.1	106.8
1115	P	40.5	Very low	34.6	Very low	73 Å²	73	146.3 Å²	146.3	47%	0.474	76%	0.762	S	S	.	*				-165.5	160.2	69.6	42.4	-19.5	0	0	0	121.8
1116	R	33.4	Very low	34.9	Very low	253 Å²	253	147 Å²	147	96%	0.955	76%	0.757	S	S	*	*			trans	50.9	130.4	135.5	-64.3	173.9	179.4	-173.9	1.1	124.2
1117	G	32.6	Very low	35.2	Very low	77 Å²	77	150.2 Å²	150.2	79%	0.794	76%	0.761	S	S	*	*				127.6	160.3	128.8	0	0	0	0	0	117.7
1118	R	35.6	Very low	35.5	Very low	224 Å²	224	144.4 Å²	144.4	85%	0.845	75%	0.754	S	S	*	*			cis	-173.4	147	-24.3	-144.9	-166.7	-174.9	-160.1	4.3	110.3
1119	I	38.4	Very low	35.5	Very low	143 Å²	143	147.7 Å²	147.7	73%	0.733	76%	0.758	S	S	*	*			trans	57.3	167.7	164.7	19.2	178.4	0	0	0	117.7
1120	S	33	Very low	36	Very low	104 Å²	104	153.5 Å²	153.5	73%	0.727	77%	0.766	S	S	*	*			cis	-148.6	175	-2.8	-151.4	0	0	0	0	113.6
1121	S	29.2	Very low	36.1	Very low	103 Å²	103	153.8 Å²	153.8	72%	0.72	77%	0.769	S	S	*	*			trans	-135.1	149.8	-179.5	62.3	0	0	0	0	113.2
1122	F	32.3	Very low	36.4	Very low	200 Å²	200	149 Å²	149	88%	0.877	76%	0.763	S	S	*	*			trans	-145.1	164.3	168.4	-105.9	-79.9	0	0	0	115.8
1123	T	43.2	Very low	37	Very low	111 Å²	111	150.5 Å²	150.5	68%	0.681	77%	0.767	S	S	*	*			trans	-142.4	157.8	-173.3	63.2	0	0	0	0	112.7
1124	P	40.8	Very low	37	Very low	122 Å²	122	148.3 Å²	148.3	79%	0.792	77%	0.77	S	S	*	*			trans	-138.7	145.3	130.2	24.1	-4.6	0	0	0	112.7
1125	K	39	Very low	37	Very low	189 Å²	189	141.4 Å²	141.4	82%	0.822	77%	0.768	S	S	*	*			cis	87.1	122.1	44.6	-81	-175.8	175	174.2	0	115.4
1126	M	38	Very low	36.9	Very low	152 Å²	152	149.6 Å²	149.6	75%	0.749	79%	0.789	S	S	*	*			trans	171.2	112.2	136	-88	-50	165.7	0	0	109.4
1127	Q	37	Very low	37	Very low	166 Å²	166	141.5 Å²	141.5	78%	0.776	78%	0.776	S	S	*	*				64.9	138	94.1	-67.2	-169.7	21.2	0	0	116.8
1128	G	35.2	Very low	37.4	Very low	64 Å²	64	145.1 Å²	145.1	66%	0.66	78%	0.776	S	S	*	*			cis	134.6	126.8	-16.9	0	0	0	0	0	117
1129	R	37.5	Very low	37.6	Very low	219 Å²	219	140.9 Å²	140.9	83%	0.826	77%	0.768	S	S	*	*			trans	177.3	132.3	157.7	-93.7	144.5	-153.2	-94.8	4.3	110.2
1130	R	40.2	Very low	37.6	Very low	210 Å²	210	142.9 Å²	142.9	79%	0.792	77%	0.772	S	S	*	*				72.1	142.8	75.4	-65.7	-175.2	-163.9	-96.6	6.1	113.7
1131	M	37.7	Very low	37.8	Very low	161 Å²	161	142.5 Å²	142.5	79%	0.793	77%	0.769	S	S	*	*			cis	-161	172.8	6.8	-142.8	67.1	179.2	0	0	107.7
1132	G	38.9	Very low	38.1	Very low	57 Å²	57	143.3 Å²	143.3	59%	0.588	77%	0.77	S	S	*	*			cis	154.1	162.3	-13.5	0	0	0	0	0	114
1133	T	41.8	Very low	38.1	Very low	145 Å²	145	138.9 Å²	138.9	89%	0.89	76%	0.764	S	S	*	*			trans	77.2	162.7	164.3	72.8	0	0	0	0	122.1
1134	S	35.7	Very low	37.9	Very low	122 Å²	122	140.3 Å²	140.3	85%	0.853	77%	0.772	S	S	*	*				-174	148.4	-51.4	-151.4	0	0	0	0	115.3
1135	G	37.2	Very low	37.4	Very low	75 Å²	75	140 Å²	140	77%	0.773	77%	0.773	S	S	*	*			trans	89.4	164.2	151.8	0	0	0	0	0	121
1136	R	38.1	Very low	37.3	Very low	244 Å²	244	134.8 Å²	134.8	92%	0.921	77%	0.772	S	S	*	*			cis	-169.8	122.6	-19.4	-170.5	-178.1	-172.1	-159.1	3.2	114.4
1137	A	35.5	Very low	37.2	Very low	83 Å²	83	136.6 Å²	136.6	69%	0.686	78%	0.779	S	S	*	*			trans	48.6	148	150.1	0	0	0	0	0	124.9
1138	I	40.5	Very low	37.1	Very low	153 Å²	153	135.7 Å²	135.7	79%	0.785	78%	0.778	S	S	*	*				173.5	112.7	121.7	-88.8	164.6	0	0	0	115.4
1139	I	41.1	Very low	37	Very low	135 Å²	135	142.1 Å²	142.1	69%	0.692	78%	0.784	S	S	*	*				65.5	109.7	129.1	-58	-179.2	0	0	0	124.8
1140	K	37.9	Very low	37.1	Very low	185 Å²	185	138.4 Å²	138.4	80%	0.804	79%	0.785	S	S	*	*			trans	69	128.4	132.1	-67.3	-179.8	-169	177.6	0	126.7
1141	S	36.6	Very low	37	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	78%	0.782	S	S	*	*				100.7	109.8	121.2	-78	0	0	0	0	125.5
1142	T	35.2	Very low	37	Very low	120 Å²	120	134.6 Å²	134.6	74%	0.736	78%	0.778	S	S	*	*				68.9	109.1	125.4	60.8	0	0	0	0	125.3
1143	S	33.8	Very low	37.1	Very low	108 Å²	108	139.1 Å²	139.1	76%	0.755	78%	0.784	S	S	*	*				89.5	154.1	112.7	73	0	0	0	0	124.7
1144	V	37.6	Very low	36.9	Very low	141 Å²	141	137.5 Å²	137.5	86%	0.855	77%	0.77	S	S	*	*			trans	97.6	150.1	162.1	-170.8	0	0	0	0	117.8
1145	S	30.8	Very low	37.1	Very low	116 Å²	116	139 Å²	139	81%	0.811	77%	0.768	S	S	*	*			trans	-98.6	166.4	-160.8	50.8	0	0	0	0	116.3
1146	G	36.9	Very low	37.1	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	76%	0.764	S	S	*	*			trans	-170.6	153.3	164.1	0	0	0	0	0	113.6
1147	E	35.5	Very low	37.4	Very low	190 Å²	190	132 Å²	132	89%	0.888	76%	0.755	S	S	*	*			trans	-130.1	-175.6	-177.6	-66.2	-175.9	118	0	0	111.6
1148	I	34.9	Very low	37.7	Very low	147 Å²	147	135.9 Å²	135.9	75%	0.754	76%	0.759	S	S	*	*			trans	96.4	109.9	155.9	-56.1	174.8	0	0	0	119.8
1149	Y	33.3	Very low	37.6	Very low	200 Å²	200	133.1 Å²	133.1	78%	0.784	75%	0.754	S	S	*	*			trans	32.5	137.2	141.4	-78.5	-98.8	0	0	0	125.3
1150	T	40.2	Very low	37.5	Very low	140 Å²	140	133.7 Å²	133.7	86%	0.859	76%	0.758	S	S	*	*				165	176.9	118.6	34.9	0	0	0	0	111.4
1151	L	38.4	Very low	37.7	Very low	136 Å²	136	131 Å²	131	71%	0.712	76%	0.758	S	S	*	*				-158.7	165.9	-75.3	-165.3	69.6	0	0	0	109.9
1152	E	37	Very low	37.9	Very low	155 Å²	155	130.6 Å²	130.6	72%	0.724	76%	0.76	S	S	*	*			trans	72.6	156.8	164	-50.7	-165.1	155	0	0	117.8
1153	H	40.6	Very low	38.3	Very low	152 Å²	152	131.6 Å²	131.6	70%	0.704	77%	0.765	S	S	*	*			cis	-174.3	164.8	-22	-104.8	-44.6	0	0	0	108.6
1154	N	38.7	Very low	38.5	Very low	112 Å²	112	129.5 Å²	129.5	60%	0.599	76%	0.761	S	S	*	*			cis	-164.2	172.7	-18.6	-148.3	59.4	0	0	0	111.2
1155	D	39.6	Very low	38.7	Very low	152 Å²	152	129 Å²	129	81%	0.813	76%	0.759	S	S	*	*			trans	62.8	154.8	163.1	-62.3	-55.4	0	0	0	121.1
1156	G	37.9	Very low	39.2	Very low	67 Å²	67	130.2 Å²	130.2	69%	0.691	76%	0.761	S	S	*	*			cis	175.5	167.8	-5.8	0	0	0	0	0	116.3
1157	S	43.4	Very low	39.3	Very low	105 Å²	105	129.9 Å²	129.9	73%	0.734	76%	0.758	S	S	*	*			trans	12	152.8	159.5	-64.2	0	0	0	0	125.3
1158	Q	41.9	Very low	39.4	Very low	165 Å²	165	125.9 Å²	125.9	77%	0.771	76%	0.757	S	S	*	*			cis	-179.6	144.1	-24.9	-115.7	163.3	-43.3	0	0	114.1
1159	S	37.5	Very low	39.5	Very low	96 Å²	96	122.9 Å²	122.9	67%	0.671	76%	0.762	S	S	*	*			trans	62.3	168.1	137.2	-59.6	0	0	0	0	126.7
1160	D	40.2	Very low	39.8	Very low	146 Å²	146	117 Å²	117	78%	0.781	76%	0.762	S	S	*	*			trans	80.1	147.5	156	-67.9	-9.5	0	0	0	120
1161	T	41.4	Very low	39.8	Very low	130 Å²	130	120.2 Å²	120.2	80%	0.798	76%	0.764	S	S	*	*			cis	-162	-177.7	-3.1	17.9	0	0	0	0	108.3
1162	A	41.1	Very low	39.8	Very low	86 Å²	86	123.2 Å²	123.2	71%	0.711	77%	0.772	S	S	*	*			cis	-173.6	178.3	-11.8	0	0	0	0	0	108.1
1163	V	43.3	Very low	40	Very low	141 Å²	141	127.6 Å²	127.6	86%	0.855	78%	0.781	S	S	*	*			cis	-167	145.5	-33.2	147.8	0	0	0	0	108.6
1164	G	38.8	Very low	39.9	Very low	65 Å²	65	131.7 Å²	131.7	67%	0.67	79%	0.791	S	S	*	*			trans	105.4	163	150.6	0	0	0	0	0	120.2
1165	T	42.3	Very low	39.8	Very low	131 Å²	131	131 Å²	131	80%	0.804	80%	0.795	S	S	*	*			cis	-167	143.2	-10.8	9.7	0	0	0	0	114.5
1166	V	40.9	Very low	39.6	Very low	141 Å²	141	128.4 Å²	128.4	86%	0.855	79%	0.788	S	S	*	*			trans	69.2	119.3	145.3	179.4	0	0	0	0	123.4
1167	G	38.2	Very low	39.6	Very low	71 Å²	71	132.5 Å²	132.5	73%	0.732	79%	0.793	S	S	*	*				98.5	149.7	129.4	0	0	0	0	0	120.4
1168	A	38.2	Very low	39	Very low	105 Å²	105	132.2 Å²	132.2	87%	0.868	79%	0.791	S	S	*	*			cis	-165.8	148.8	-16.7	0	0	0	0	0	113.3
1169	G	35.9	Very low	38.7	Very low	84 Å²	84	128.5 Å²	128.5	87%	0.866	79%	0.789	S	S	*	*			trans	85.1	155.6	155.5	0	0	0	0	0	119.6
1170	G	40	Very low	38.5	Very low	76 Å²	76	132.8 Å²	132.8	78%	0.784	80%	0.796	S	S	*	*			trans	168.4	-47.5	162.6	0	0	0	0	0	122.6
1171	K	40.6	Very low	38.3	Very low	209 Å²	209	132.7 Å²	132.7	91%	0.909	80%	0.8	S	S	*	*			trans	69.9	152.8	-175.6	-60.2	172.8	174.2	168.1	0	118.6
1172	K	38.8	Very low	38.1	Very low	199 Å²	199	132.5 Å²	132.5	87%	0.865	80%	0.799	S	S	*	*			trans	78.7	87.8	161.9	-70.1	-178.4	178.5	177.5	0	121.2
1173	R	41.6	Very low	37.8	Very low	246 Å²	246	132.7 Å²	132.7	93%	0.928	80%	0.8	S	S	*	*			trans	61.2	89	130.3	-69.3	-171.7	169.3	-166.7	-3.7	120.5
1174	R	37.8	Very low	37.5	Very low	238 Å²	238	134.3 Å²	134.3	90%	0.898	80%	0.802	S	S	*	*				55.4	97.2	126.2	-154.2	176.7	-143.2	-145.4	5.4	119.4
1175	S	36.6	Very low	37.4	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	80%	0.802	S	S	*	*			trans	60.5	103.3	138.4	-46.6	0	0	0	0	117.9
1176	S	34.2	Very low	37	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	81%	0.805	S	S	*	*				64.4	114.9	57.1	92.4	0	0	0	0	112.1
1177	L	39.3	Very low	37	Very low	153 Å²	153	139.3 Å²	139.3	80%	0.801	80%	0.802	S	S	*	*				60.2	109.7	74.5	-60.4	162.7	0	0	0	110
1178	S	29.8	Very low	36.9	Very low	99 Å²	99	147.1 Å²	147.1	69%	0.692	81%	0.809	S	S	*	*				79.8	149.4	56.8	82.6	0	0	0	0	113.8
1179	A	36.5	Very low	36.6	Very low	88 Å²	88	147.3 Å²	147.3	73%	0.727	80%	0.804	S	S	*	*			trans	80.2	158.6	-173.6	0	0	0	0	0	113.6
1180	K	33.5	Very low	36.6	Very low	185 Å²	185	155.3 Å²	155.3	80%	0.804	81%	0.808	S	S	*	*			cis	169.2	113.3	-25.3	-97.6	168.2	-179.1	172.5	0	103
1181	V	35.8	Very low	36.3	Very low	144 Å²	144	156.5 Å²	156.5	87%	0.873	81%	0.805	S	S	*	*			trans	-135.8	102	156.6	-177.6	0	0	0	0	103.8
1182	V	37.4	Very low	35.8	Very low	127 Å²	127	152.9 Å²	152.9	77%	0.77	80%	0.801	S	S	*	*				70.8	121.4	65.4	-176.8	0	0	0	0	110.9
1183	A	34.3	Very low	35.7	Very low	90 Å²	90	149.2 Å²	149.2	74%	0.744	80%	0.8	S	S	*	*			trans	-91.8	153	-160.6	0	0	0	0	0	113.9
1184	I	37.1	Very low	35.2	Very low	174 Å²	174	146 Å²	146	89%	0.892	80%	0.795	S	S	*	*			trans	-118.4	151.1	152.4	-65	-175	0	0	0	109.9
1185	V	36	Very low	35	Very low	109 Å²	109	142.8 Å²	142.8	66%	0.661	80%	0.795	S	S	*	*			trans	-82.2	140.7	-162.7	171.4	0	0	0	0	113	R1187	V1185-R1187 HydrophobicContact CG1-CG 3.67Å
1186	S	35.4	Very low	34.8	Very low	126 Å²	126	143.1 Å²	143.1	88%	0.881	80%	0.797	S	S	*	*			trans	-139.6	158.8	137.4	-163.5	0	0	0	0	111.5
1187	R	39.3	Very low	34.7	Very low	208 Å²	208	146.5 Å²	146.5	79%	0.785	80%	0.802	S	S	*	*			trans	-120.7	148.8	-153.8	-65	176.4	173.7	169.8	-2.3	113.9	V1185	V1185-R1187 HydrophobicContact CG1-CG 3.67Å
1188	R	36.7	Very low	34.4	Very low	235 Å²	235	146 Å²	146	89%	0.887	81%	0.806	S	S	*	*			trans	52.4	125.8	151.8	-74.1	177.6	168.5	171.2	-4.7	118.3
1189	S	32.6	Very low	34.4	Very low	109 Å²	109	149.6 Å²	149.6	76%	0.762	81%	0.812	S	S	*	*				-164.2	133	88.8	-81.2	0	0	0	0	113.6
1190	R	34.9	Very low	34.1	Very low	251 Å²	251	151 Å²	151	95%	0.947	82%	0.817	S	S	*	*			trans	-105.6	124.9	157.9	-75.2	-179.1	174.5	178.5	-2	106.7
1191	S	33.4	Very low	34	Very low	102 Å²	102	145.3 Å²	145.3	71%	0.713	81%	0.81	S	S	*	*			trans	-137.1	84.8	177.7	-57	0	0	0	0	110.6
1192	T	31.7	Very low	33.9	Very low	133 Å²	133	147 Å²	147	82%	0.816	81%	0.808	S	S	*	*			trans	-77.3	122.9	160.4	46.9	0	0	0	0	108.5
1193	S	35	Very low	33.7	Very low	121 Å²	121	150.2 Å²	150.2	85%	0.846	81%	0.812	S	S	*	*			trans	-104.4	117.9	166.1	38.8	0	0	0	0	108.7
1194	Q	32.9	Very low	33.8	Very low	179 Å²	179	156.1 Å²	156.1	84%	0.836	82%	0.821	S	S	*	*			trans	-88.9	140.4	173.2	-60.6	171.3	-1.8	0	0	108.7
1195	L	32.4	Very low	33.7	Very low	171 Å²	171	153.9 Å²	153.9	90%	0.895	81%	0.81	S	S	*	*			trans	179.4	125.2	163.7	-98.4	150.1	0	0	0	106
1196	S	33.2	Very low	33.6	Very low	105 Å²	105	157.4 Å²	157.4	73%	0.734	82%	0.816	S	S	*	*			cis	-154.8	166.4	-14.4	32.3	0	0	0	0	108.5
1197	Q	32.2	Very low	33.5	Very low	167 Å²	167	155.3 Å²	155.3	78%	0.78	80%	0.802	S	S	*	*			trans	-69.4	144.1	-178.5	-69.5	151.6	-71	0	0	112.7
1198	T	32.2	Very low	33.2	Very low	144 Å²	144	149.2 Å²	149.2	88%	0.883	79%	0.788	S	S	*	*			trans	-150.6	121.8	146.3	-36.1	0	0	0	0	106.8
1199	E	29	Very low	33.1	Very low	173 Å²	173	143 Å²	143	81%	0.808	77%	0.771	S	S	*	*			trans	-105.2	122.1	-170.1	-65.9	-179.7	99.6	0	0	111.7
1200	S	32.2	Very low	33.3	Very low	119 Å²	119	145 Å²	145	83%	0.832	77%	0.768	S	S	*	*			trans	-167.4	110.2	155.5	60.8	0	0	0	0	112.7
1201	G	30.9	Very low	33.3	Very low	65 Å²	65	144.1 Å²	144.1	67%	0.67	77%	0.765	S	S	*	*			trans	81.2	148.3	143.7	0	0	0	0	0	121.6
1202	H	33.5	Very low	33.5	Very low	178 Å²	178	145.1 Å²	145.1	82%	0.824	77%	0.772	S	S	*	*			trans	73.2	104.3	150.4	-50.4	-72.4	0	0	0	121.7
1203	K	33.7	Very low	33.5	Very low	195 Å²	195	145.7 Å²	145.7	85%	0.848	78%	0.775	S	S	*	*			trans	44.9	95.8	133.7	-59.9	-176	178.6	-177.4	0	118	L1205	K1203-L1205 PolarHBondContact O-N 3.47Å; K1203-L1205 VanDerWaalsContact O-N 3.16Å
1204	K	34.9	Very low	33.3	Very low	215 Å²	215	148.1 Å²	148.1	94%	0.935	77%	0.773	S	S	*	*			trans	-77.8	90	168.3	-77.7	179.2	176.3	168.6	0	112.6
1205	L	35	Very low	33.1	Very low	126 Å²	126	144.5 Å²	144.5	66%	0.66	76%	0.763	S	S	*	*			trans	-66.6	141.3	161.2	-75.4	167	0	0	0	110.5	K1203	K1203-L1205 PolarHBondContact O-N 3.47Å; K1203-L1205 VanDerWaalsContact O-N 3.16Å
1206	K	35	Very low	33.1	Very low	184 Å²	184	140 Å²	140	80%	0.8	76%	0.758	S	S	*	*			trans	-126.9	73.4	-165.4	-176.1	-172	171.2	-167.6	0	110.5	T1208	K1206-T1208 PolarHBondContact O-N 3.08Å
1207	S	32.7	Very low	33	Very low	82 Å²	82	142.1 Å²	142.1	57%	0.573	76%	0.758	S	S	*	*			trans	-62.2	119.4	-179.5	48.6	0	0	0	0	112	I1209	S1207-I1209 PolarHBondContact O-N 2.91Å
1208	T	32.7	Very low	32.9	Very low	80 Å²	80	139.5 Å²	139.5	49%	0.491	77%	0.765	S	S	.	*			trans	-60.6	129.6	167.8	-75.6	0	0	0	0	109.9	K1206 Q1210 C1330	K1206-T1208 PolarHBondContact O-N 3.08Å; T1208-Q1210 HydrophobicContact CG2-CG 4.49Å; T1208-C1330 PolarHBondContact OG1-O 3.12Å
1209	I	35.3	Very low	32.9	Very low	103 Å²	103	137.1 Å²	137.1	53%	0.528	76%	0.761	S	S	.	*			trans	-105.3	109.9	164.2	-64.8	173.8	0	0	0	105.9	K197 S1207 R1211	K197-I1209 HydrophobicContact CD-CD1 4.29Å; K197-I1209 HydrophobicContact CG-CD1 3.89Å; S1207-I1209 PolarHBondContact O-N 2.91Å; I1209-R1211 PolarHBondContact O-N 2.85Å
1210	Q	36.7	Very low	33.1	Very low	153 Å²	153	137.9 Å²	137.9	72%	0.715	76%	0.764	S	S	*	*			trans	-61.8	132	166.8	-75	163.3	-47.4	0	0	108.5	T1208	T1208-Q1210 HydrophobicContact CG2-CG 4.49Å
1211	R	33.9	Very low	33.2	Very low	232 Å²	232	136 Å²	136	88%	0.875	74%	0.743	S	S	*	*			trans	-118.7	136.1	157.2	-83.9	-172.5	163.8	-153.8	-7.6	106.4	I1209	I1209-R1211 PolarHBondContact O-N 2.85Å
1212	S	37.5	Very low	33.3	Very low	122 Å²	122	143 Å²	143	85%	0.853	75%	0.75	S	S	*	*			trans	-55.2	144	-174	30.5	0	0	0	0	112.8	E1214	S1212-E1214 PolarHBondContact O-N 3.24Å
1213	T	32.4	Very low	33.3	Very low	146 Å²	146	144.3 Å²	144.3	90%	0.896	75%	0.753	S	S	*	*			trans	-79.5	92.9	-179.5	-59.2	0	0	0	0	110.2
1214	E	31	Very low	33.4	Very low	171 Å²	171	143.5 Å²	143.5	80%	0.799	75%	0.754	S	S	*	*			trans	-157.6	173	165.9	-127.7	-154.2	89.6	0	0	115.2	S1212	S1212-E1214 PolarHBondContact O-N 3.24Å
1215	T	29.6	Very low	33.5	Very low	103 Å²	103	139.5 Å²	139.5	63%	0.632	75%	0.747	S	S	*	*			trans	61.2	68.7	170.3	-30.9	0	0	0	0	116.9
1216	G	31.5	Very low	33.5	Very low	76 Å²	76	143.1 Å²	143.1	78%	0.784	75%	0.752	S	S	*	*			trans	-114.9	33.3	-172.1	0	0	0	0	0	119
1217	M	31	Very low	33.6	Very low	150 Å²	150	143.6 Å²	143.6	74%	0.739	76%	0.757	S	S	*	*			trans	55.6	99.2	171.2	-64.3	-178.6	172.4	0	0	117.9
1218	A	30.2	Very low	33.7	Very low	112 Å²	112	144.4 Å²	144.4	93%	0.926	76%	0.761	S	S	*	*			trans	-127	80.8	165.2	0	0	0	0	0	110.9
1219	A	32.5	Very low	34	Very low	95 Å²	95	146 Å²	146	79%	0.785	78%	0.775	S	S	*	*			trans	-134.8	154.4	177.4	0	0	0	0	0	111.7
1220	E	32.8	Very low	34.1	Very low	188 Å²	188	151 Å²	151	88%	0.879	79%	0.787	S	S	*	*			trans	58.4	78.5	161.7	-158.7	-170	170.7	0	0	118.7
1221	M	34	Very low	34.2	Very low	81 Å²	81	150.6 Å²	150.6	40%	0.399	79%	0.785	S	S	.	*			trans	-150.9	88.5	153.1	-72.1	-157.9	127.9	0	0	113.3	K1309 P1310	M1221-K1309 HydrophobicContact CE-CD 3.82Å; M1221-K1309 HydrophobicContact CE-CG 3.77Å; M1221-K1309 HydrophobicContact SD-CD 4.09Å; M1221-K1309 HydrophobicContact SD-CG 3.58Å; M1221-K1309 VanDerWaalsContact SD-CG 3.58Å; M1221-P1310 WeakPolarHBondContact CE-O 3.28Å; M1221-P1310 HydrophobicContact SD-CB 4.49Å
1222	R	33.5	Very low	34.3	Very low	212 Å²	212	144.5 Å²	144.5	80%	0.8	78%	0.778	S	S	*	*			trans	-155.9	94.7	167.3	-80	-164.4	171.9	132.2	-4.6	114.3
1223	K	33.9	Very low	34.3	Very low	205 Å²	205	144.4 Å²	144.4	89%	0.891	77%	0.773	S	S	*	*			trans	-167.3	108.3	155.1	-115.7	169	-176.7	172.6	0	113
1224	M	35.1	Very low	34.4	Very low	177 Å²	177	145.1 Å²	145.1	87%	0.872	77%	0.771	S	S	*	*			trans	167.8	118.2	156.3	-94.4	-169.1	-58	0	0	104.6
1225	V	37.8	Very low	34.8	Very low	131 Å²	131	140.6 Å²	140.6	79%	0.794	77%	0.77	S	S	*	*			cis	100.3	84.8	27.4	-176.1	0	0	0	0	113.4
1226	R	34.9	Very low	35	Very low	202 Å²	202	141.4 Å²	141.4	76%	0.762	78%	0.78	S	S	*	*			trans	40	133.7	145.3	-81.9	-178.6	160.1	-173.6	-10.3	122
1227	Q	37.2	Very low	35.2	Very low	195 Å²	195	144.2 Å²	144.2	91%	0.911	78%	0.776	S	S	*	*				-124.8	156.6	122.1	-79.3	-161.6	-80.5	0	0	110.7
1228	P	34	Very low	35.1	Very low	99 Å²	99	143.5 Å²	143.5	64%	0.643	78%	0.775	S	S	*	*			trans	-134.3	140.2	176.2	38.8	-22.4	0	0	0	116.9
1229	S	39.4	Very low	35.1	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	77%	0.767	S	S	*	*			trans	-143.2	141	151.6	-54.5	0	0	0	0	105.4
1230	R	37.6	Very low	35	Very low	209 Å²	209	149.4 Å²	149.4	79%	0.789	77%	0.771	S	S	*	*			cis	64.1	130.2	45.8	-53.6	-167.9	71.4	125.7	8.3	111.1
1231	E	39.2	Very low	34.9	Very low	145 Å²	145	144.7 Å²	144.7	68%	0.678	76%	0.759	S	S	*	*			cis	-124.6	-160.7	24.1	-127.1	65.9	-129.8	0	0	114.7
1232	S	35.2	Very low	34.7	Very low	103 Å²	103	146.8 Å²	146.8	72%	0.72	78%	0.782	S	S	*	*			trans	-81.6	-176.6	-171.6	58.9	0	0	0	0	114.8
1233	T	38.2	Very low	34.6	Very low	121 Å²	121	146.4 Å²	146.4	74%	0.742	79%	0.789	S	S	*	*			cis	-158.6	167.5	34.7	-52.5	0	0	0	0	112.4
1234	D	34.1	Very low	34.3	Very low	161 Å²	161	139.8 Å²	139.8	86%	0.861	78%	0.779	S	S	*	*			trans	-64.9	161.1	-176.4	-50.6	-90	0	0	0	117.5
1235	G	38.4	Very low	34.1	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	77%	0.769	S	S	*	*			trans	-179.2	144.9	171	0	0	0	0	0	113.5
1236	S	33.8	Very low	34	Very low	119 Å²	119	139.4 Å²	139.4	83%	0.832	78%	0.775	S	S	*	*			trans	-161.3	172.6	-174.3	60.8	0	0	0	0	110
1237	I	36.4	Very low	33.9	Very low	136 Å²	136	135.2 Å²	135.2	70%	0.697	77%	0.767	S	S	*	*			cis	-135.2	-162.1	20.1	60.5	165.1	0	0	0	112.2
1238	N	29.8	Very low	33.8	Very low	134 Å²	134	134 Å²	134	72%	0.717	76%	0.759	S	S	*	*			trans	-13	140.2	154.6	-39.6	-8.7	0	0	0	115.4
1239	S	29.4	Very low	33.6	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	77%	0.769	S	S	*	*				-171.2	152.8	50.5	-73	0	0	0	0	113.6
1240	Y	30.2	Very low	33.3	Very low	220 Å²	220	134.1 Å²	134.1	86%	0.863	77%	0.771	S	S	*	*			trans	51	119.8	145.7	-135	-113.3	0	0	0	122.5
1241	S	31.6	Very low	33.4	Very low	89 Å²	89	127.9 Å²	127.9	62%	0.622	76%	0.756	S	S	*	*			trans	57.5	94.2	146.2	-59.6	0	0	0	0	120.9
1242	S	29.3	Very low	33.2	Very low	126 Å²	126	132.3 Å²	132.3	88%	0.881	77%	0.767	S	S	*	*			trans	-168.1	164	132	31.1	0	0	0	0	110.9
1243	E	30.5	Very low	33.5	Very low	203 Å²	203	132.3 Å²	132.3	95%	0.949	76%	0.763	S	S	*	*			trans	-71.9	129.8	-178.6	-54.1	176	120.9	0	0	111.2
1244	G	29.2	Very low	33.6	Very low	67 Å²	67	128 Å²	128	69%	0.691	74%	0.742	S	S	*	*			trans	176	115.1	176.1	0	0	0	0	0	118.7
1245	N	30.2	Very low	34.3	Very low	121 Å²	121	126.3 Å²	126.3	65%	0.647	74%	0.74	S	S	*	*			trans	46.2	97.9	133.4	-71.4	-15.6	0	0	0	120.2	I1247	N1245-I1247 HydrophobicContact CB-CD1 4.07Å; N1245-I1247 HydrophobicContact CB-CG1 3.98Å
1246	L	35.1	Very low	34.8	Very low	178 Å²	178	128.8 Å²	128.8	93%	0.932	74%	0.735	S	S	*	*			trans	-99.8	104.7	142.1	-73.6	-179.1	0	0	0	109.6
1247	I	33.2	Very low	36	Very low	115 Å²	115	126.1 Å²	126.1	59%	0.59	72%	0.716	S	S	*	*			trans	-87.5	122	-169.4	-70.9	164.8	0	0	0	111.2	N1245	N1245-I1247 HydrophobicContact CB-CD1 4.07Å; N1245-I1247 HydrophobicContact CB-CG1 3.98Å
1248	F	34.9	Very low	37.3	Very low	169 Å²	169	123.6 Å²	123.6	74%	0.741	70%	0.702	S	S	*	*			trans	-69.2	123.5	150.6	-76	-86.4	0	0	0	107.9	G1250 V1251	F1248-G1250 PolarHBondContact O-N 2.98Å; F1248-V1251 PolarHBondContact O-N 2.97Å; F1248-V1251 VanDerWaalsContact O-N 3.1Å
1249	P	30.6	Very low	39.1	Very low	133 Å²	133	122.7 Å²	122.7	86%	0.864	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	98.2	-174.2	25.5	-34.2	0	0	0	111.1
1250	G	33.4	Very low	41.2	Very low	80 Å²	80	120 Å²	120	83%	0.825	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.7	-18.4	-178.7	0	0	0	0	0	115.2	F1248	F1248-G1250 PolarHBondContact O-N 2.98Å
1251	V	39	Very low	43.3	Very low	78 Å²	78	114 Å²	114	47%	0.473	66%	0.656	S	S	.	*			trans	-117.7	112.9	-174.5	-174.6	0	0	0	0	111	F1248 Q1258	F1248-V1251 PolarHBondContact O-N 2.97Å; F1248-V1251 VanDerWaalsContact O-N 3.1Å; V1251-Q1258 VanDerWaalsContact CG1-NE2 3.26Å
1252	R	34.9	Very low	45.6	Very low	238 Å²	238	111.5 Å²	111.5	90%	0.898	63%	0.634	S	S	*	*			trans	-79.4	133.1	166.3	-58.7	-172	-162.8	-121.5	6.8	108.8	G1254 Q1258	R1252-G1254 PolarHBondContact O-N 2.88Å; R1252-Q1258 PolarHBondContact O-NE2 3.26Å; R1252-Q1258 VanDerWaalsContact O-NE2 3.09Å
1253	V	42.5	Very low	48.1	Very low	104 Å²	104	109.3 Å²	109.3	63%	0.63	61%	0.612	S	S	*	*			trans	-93.1	93.2	174.6	-174.5	0	0	0	0	108.2
1254	G	39.4	Very low	50.4	Low	31 Å²	31	106.5 Å²	106.5	32%	0.32	60%	0.603	S	S	.	*			trans	-87	135.3	163.7	0	0	0	0	0	109.1	R1252 D1256	R1252-G1254 PolarHBondContact O-N 2.88Å; G1254-D1256 PolarHBondContact O-N 2.87Å
1255	P	49.4	Very low	53	Low	124 Å²	124	104.9 Å²	104.9	81%	0.805	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	-44.9	-166.5	-29.7	36.1	0	0	0	115.2
1256	D	49.3	Very low	55.9	Low	128 Å²	128	100.5 Å²	100.5	68%	0.684	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-13.3	-170.5	-47.2	-78.2	0	0	0	114.4	G1254 S1260	G1254-D1256 PolarHBondContact O-N 2.87Å; D1256-S1260 PolarHBondContact O-OG 2.87Å
1257	S	57.8	Low	58.6	Low	63 Å²	63	92.3 Å²	92.3	44%	0.441	52%	0.522	S	S	.	.	H	α-helix	trans	-67.5	-54.6	-174.7	-165	0	0	0	0	111.4	F1259 S1260 D1261	S1257-F1259 PolarHBondContact O-N 3.25Å; S1257-F1259 VanDerWaalsContact O-N 3.08Å; S1257-S1260 CarbonylContact O-C 3.08Å; S1257-S1260 WeakPolarHBondContact O-CA 3.46Å; S1257-S1260 VanDerWaalsContact O-CB 3.31Å; S1257-S1260 WeakPolarHBondContact O-CB 3.32Å; S1257-S1260 PolarHBondContact O-N 3.22Å; S1257-D1261 WeakPolarHBondContact CB-OD2 3.4Å; S1257-D1261 PolarHBondContact O-N 3.48Å; S1257-D1261 PolarHBondContact OG-OD2 2.93Å
1258	Q	63.2	Low	61.5	Low	84 Å²	84	89.7 Å²	89.7	39%	0.393	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-25.4	-166.3	-63.8	-170.5	7.2	0	0	114.3	V1251 R1252 F1262	V1251-Q1258 VanDerWaalsContact CG1-NE2 3.26Å; R1252-Q1258 PolarHBondContact O-NE2 3.26Å; R1252-Q1258 VanDerWaalsContact O-NE2 3.09Å; Q1258-F1262 VanDerWaalsContact O-CB 3.32Å; Q1258-F1262 WeakPolarHBondContact O-CB 3.05Å; Q1258-F1262 PolarHBondContact O-N 3.19Å; Q1258-F1262 VanDerWaalsContact O-N 3.13Å
1259	F	68.3	Low	64.2	Low	115 Å²	115	82.3 Å²	82.3	50%	0.504	48%	0.482	S	S	.	.	H	α-helix	trans	-73.7	-43.2	172.5	-176.8	-110.9	0	0	0	111.3	S1257 F1262 L1263 L1277	S1257-F1259 PolarHBondContact O-N 3.25Å; S1257-F1259 VanDerWaalsContact O-N 3.08Å; F1259-F1262 WeakPolarHBondContact O-CB 3.25Å; F1259-F1262 PolarHBondContact O-N 2.88Å; F1259-L1263 HydrophobicContact CD1-CD1 4.01Å; F1259-L1263 HydrophobicContact CE1-CD1 3.53Å; F1259-L1263 HydrophobicContact CE1-CG 4.32Å; F1259-L1263 HydrophobicContact CZ-CD1 3.82Å; F1259-L1263 HydrophobicContact CZ-CD2 4.47Å; F1259-L1263 HydrophobicContact CZ-CG 4.27Å; F1259-L1263 WeakPolarHBondContact O-CG 3.22Å; F1259-L1263 PolarHBondContact O-N 2.87Å; F1259-L1277 HydrophobicContact CD2-CD1 4.26Å; F1259-L1277 HydrophobicContact CD2-CD2 3.84Å; F1259-L1277 HydrophobicContact CE2-CD1 4.23Å; F1259-L1277 HydrophobicContact CE2-CD2 4.01Å
1260	S	72.5	Confident	67.2	Low	55 Å²	55	76.9 Å²	76.9	39%	0.385	45%	0.445	S	S	.	.	H	α-helix	trans	-61.7	-51	173.6	-49	0	0	0	0	111	D1256 S1257 F1262 L1263 D1264	D1256-S1260 PolarHBondContact O-OG 2.87Å; S1257-S1260 CarbonylContact O-C 3.08Å; S1257-S1260 WeakPolarHBondContact O-CA 3.46Å; S1257-S1260 VanDerWaalsContact O-CB 3.31Å; S1257-S1260 WeakPolarHBondContact O-CB 3.32Å; S1257-S1260 PolarHBondContact O-N 3.22Å; S1260-F1262 PolarHBondContact O-N 2.94Å; S1260-F1262 VanDerWaalsContact O-N 3.16Å; S1260-L1263 PolarHBondContact O-N 2.89Å; S1260-D1264 WeakPolarHBondContact O-CB 3.4Å; S1260-D1264 PolarHBondContact O-N 2.82Å
1261	D	75	Confident	70	Confident	94 Å²	94	74.4 Å²	74.4	50%	0.503	41%	0.413	S	S	.	.	H	α-helix	trans	-55.7	-32.8	174.3	-65.9	-59.3	0	0	0	112.8	S1257 G1265	S1257-D1261 WeakPolarHBondContact CB-OD2 3.4Å; S1257-D1261 PolarHBondContact O-N 3.48Å; S1257-D1261 PolarHBondContact OG-OD2 2.93Å; D1261-G1265 PolarHBondContact O-N 3.07Å
1262	F	80.9	Confident	72.2	Confident	35 Å²	35	72.3 Å²	72.3	15%	0.154	40%	0.401	C	S	.	.	H	α-helix	trans	-71.4	-47.8	175	175.5	-89.9	0	0	0	111.8	Q1258 F1259 S1260 G1265 L1266 V1272 T1276 L1277 K1400 F1402	Q1258-F1262 VanDerWaalsContact O-CB 3.32Å; Q1258-F1262 WeakPolarHBondContact O-CB 3.05Å; Q1258-F1262 PolarHBondContact O-N 3.19Å; Q1258-F1262 VanDerWaalsContact O-N 3.13Å; F1259-F1262 WeakPolarHBondContact O-CB 3.25Å; F1259-F1262 PolarHBondContact O-N 2.88Å; S1260-F1262 PolarHBondContact O-N 2.94Å; S1260-F1262 VanDerWaalsContact O-N 3.16Å; F1262-G1265 PolarHBondContact O-N 2.66Å; F1262-L1266 HydrophobicContact CD1-CD1 4.5Å; F1262-L1266 HydrophobicContact CE1-CD1 4.02Å; F1262-L1266 HydrophobicContact CE1-CD2 4.32Å; F1262-L1266 HydrophobicContact CE1-CG 4.33Å; F1262-L1266 HydrophobicContact CZ-CD2 4.35Å; F1262-L1266 PolarHBondContact O-N 3.16Å; F1262-V1272 HydrophobicContact CE1-CG1 4.39Å; F1262-V1272 HydrophobicContact CZ-CG1 4.22Å; F1262-T1276 HydrophobicContact CZ-CG2 4.15Å; F1262-L1277 HydrophobicContact CD1-CD2 3.62Å; F1262-L1277 HydrophobicContact CD2-CD2 4.38Å; F1262-L1277 HydrophobicContact CE1-CD2 3.8Å; F1262-L1277 HydrophobicContact CG-CD2 3.94Å; F1262-L1277 HydrophobicContact CZ-CD2 4.27Å; F1262-K1400 PolarHBondContact O-NZ 2.89Å; F1262-F1402 HydrophobicContact CE2-CZ 4.4Å; F1262-F1402 HydrophobicContact CZ-CZ 4.25Å
1263	L	80.9	Confident	74.4	Confident	81 Å²	81	61.6 Å²	61.6	42%	0.424	36%	0.364	S	S	.	.	H	α-helix	trans	-66.1	-46.2	-179.8	-71.3	-179.3	0	0	0	112.3	F1259 S1260 G1265 L1266	F1259-L1263 HydrophobicContact CD1-CD1 4.01Å; F1259-L1263 HydrophobicContact CE1-CD1 3.53Å; F1259-L1263 HydrophobicContact CE1-CG 4.32Å; F1259-L1263 HydrophobicContact CZ-CD1 3.82Å; F1259-L1263 HydrophobicContact CZ-CD2 4.47Å; F1259-L1263 HydrophobicContact CZ-CG 4.27Å; F1259-L1263 WeakPolarHBondContact O-CG 3.22Å; F1259-L1263 PolarHBondContact O-N 2.87Å; S1260-L1263 PolarHBondContact O-N 2.89Å; L1263-G1265 PolarHBondContact O-N 3.5Å; L1263-L1266 HydrophobicContact CD2-CD1 4.01Å; L1263-L1266 VanDerWaalsContact O-CB 3.32Å; L1263-L1266 WeakPolarHBondContact O-CB 3.42Å; L1263-L1266 PolarHBondContact O-N 3.12Å
1264	D	80	Confident	76.1	Confident	143 Å²	143	67.7 Å²	67.7	77%	0.765	38%	0.376	S	S	*	.	H	α-helix	trans	-62.7	-23.5	176.6	-72.1	-16	0	0	0	112.1	S1260	S1260-D1264 WeakPolarHBondContact O-CB 3.4Å; S1260-D1264 PolarHBondContact O-N 2.82Å
1265	G	83.4	Confident	77.8	Confident	33 Å²	33	70.9 Å²	70.9	34%	0.34	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4.9	171	0	0	0	0	0	115.1	D1261 F1262 L1263 K1400	D1261-G1265 PolarHBondContact O-N 3.07Å; F1262-G1265 PolarHBondContact O-N 2.66Å; L1263-G1265 PolarHBondContact O-N 3.5Å; G1265-K1400 VanDerWaalsContact C-NZ 3.3Å; G1265-K1400 VanDerWaalsContact O-CD 3.31Å; G1265-K1400 WeakPolarHBondContact O-CD 3.44Å; G1265-K1400 WeakPolarHBondContact O-CE 3.47Å; G1265-K1400 WeakPolarHBondContact O-CG 3.49Å; G1265-K1400 PolarHBondContact O-NZ 2.73Å; G1265-K1400 VanDerWaalsContact O-NZ 3.07Å
1266	L	90.9	Very high	79.3	Confident	30 Å²	30	65 Å²	65	16%	0.157	34%	0.344	C	S	.	.	S	Bend	trans	-87.5	157.6	170.8	-66.9	178.7	0	0	0	111.1	F1262 L1263 Q1270 V1272 K1400 F1402	F1262-L1266 HydrophobicContact CD1-CD1 4.5Å; F1262-L1266 HydrophobicContact CE1-CD1 4.02Å; F1262-L1266 HydrophobicContact CE1-CD2 4.32Å; F1262-L1266 HydrophobicContact CE1-CG 4.33Å; F1262-L1266 HydrophobicContact CZ-CD2 4.35Å; F1262-L1266 PolarHBondContact O-N 3.16Å; L1263-L1266 HydrophobicContact CD2-CD1 4.01Å; L1263-L1266 VanDerWaalsContact O-CB 3.32Å; L1263-L1266 WeakPolarHBondContact O-CB 3.42Å; L1263-L1266 PolarHBondContact O-N 3.12Å; L1266-Q1270 HydrophobicContact CB-CB 4.36Å; L1266-V1272 HydrophobicContact CD1-CB 4.3Å; L1266-V1272 HydrophobicContact CD1-CG2 3.83Å; L1266-V1272 HydrophobicContact CD2-CG2 3.75Å; L1266-V1272 HydrophobicContact CG-CG2 4.46Å; L1266-K1400 HydrophobicContact CD2-CB 4.49Å; L1266-K1400 HydrophobicContact CD2-CD 4.14Å; L1266-F1402 HydrophobicContact CD2-CE2 4.02Å; L1266-F1402 HydrophobicContact CD2-CZ 4.17Å
1267	G	91.9	Very high	80.6	Confident	6 Å²	6	63.4 Å²	63.4	6%	0.062	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-73.2	155.7	173.4	0	0	0	0	0	112.6	A1269 Q1270 W1398	G1267-A1269 PolarHBondContact O-N 3.28Å; G1267-Q1270 VanDerWaalsContact N-OE1 3.09Å; G1267-Q1270 WeakPolarHBondContact O-CB 3.15Å; G1267-Q1270 PolarHBondContact O-N 3.36Å; G1267-W1398 WeakPolarHBondContact CA-O 3.49Å; G1267-W1398 PolarHBondContact N-O 2.86Å
1268	P	92.6	Very high	81.5	Confident	59 Å²	59	65 Å²	65	38%	0.383	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	131.3	179	23.1	-29.8	0	0	0	110.3	Q1270 L1389 V1395 Y1399	P1268-Q1270 PolarHBondContact O-N 3.44Å; P1268-L1389 HydrophobicContact CB-CD2 3.97Å; P1268-V1395 HydrophobicContact CG-CG1 4.36Å; P1268-Y1399 WeakPolarHBondContact CG-OH 3.26Å; P1268-Y1399 VanDerWaalsContact O-CE1 3.27Å; P1268-Y1399 WeakPolarHBondContact O-CE1 3.32Å; P1268-Y1399 PolarHBondContact O-OH 2.98Å
1269	A	92.2	Very high	82.3	Confident	15 Å²	15	62.7 Å²	62.7	12%	0.124	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	21.8	-170.4	0	0	0	0	0	116.2	G1267 L1271 I1384 L1385 E1388 L1389	G1267-A1269 PolarHBondContact O-N 3.28Å; A1269-L1271 PolarHBondContact O-N 2.96Å; A1269-I1384 HydrophobicContact CB-CG2 4.03Å; A1269-I1384 WeakPolarHBondContact O-CA 3.2Å; A1269-L1385 WeakPolarHBondContact CB-O 3.33Å; A1269-L1385 PolarHBondContact O-N 2.79Å; A1269-E1388 HydrophobicContact CB-CB 3.66Å; A1269-L1389 HydrophobicContact CB-CD1 4.28Å; A1269-L1389 HydrophobicContact CB-CD2 3.57Å; A1269-L1389 HydrophobicContact CB-CG 3.71Å
1270	Q	94.2	Very high	83.1	Confident	18 Å²	18	62.4 Å²	62.4	8%	0.084	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	120.7	178.6	-171.2	174.8	-15.6	0	0	112	L1266 G1267 P1268 V1272 Q1383 Y1399 K1400	L1266-Q1270 HydrophobicContact CB-CB 4.36Å; G1267-Q1270 VanDerWaalsContact N-OE1 3.09Å; G1267-Q1270 WeakPolarHBondContact O-CB 3.15Å; G1267-Q1270 PolarHBondContact O-N 3.36Å; P1268-Q1270 PolarHBondContact O-N 3.44Å; Q1270-V1272 HydrophobicContact CG-CG2 4.02Å; Q1270-Q1383 CarbonylContact C-O 3.6Å; Q1270-Q1383 WeakPolarHBondContact CA-O 3.44Å; Q1270-Q1383 WeakPolarHBondContact CG-O 3.41Å; Q1270-Y1399 HydrophobicContact CB-CD1 3.88Å; Q1270-Y1399 HydrophobicContact CB-CE1 4.07Å; Q1270-Y1399 HydrophobicContact CG-CD1 4.05Å; Q1270-K1400 PolarHBondContact NE2-O 2.84Å; Q1270-K1400 VanDerWaalsContact OE1-N 3.16Å
1271	L	91.5	Very high	84	Confident	28 Å²	28	62 Å²	62	15%	0.147	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	129.7	175.9	-60.5	173.8	0	0	0	111	A1269 V1361 Q1383 L1385 V1408 T1413	A1269-L1271 PolarHBondContact O-N 2.96Å; L1271-V1361 HydrophobicContact CD1-CG1 4.02Å; L1271-V1361 HydrophobicContact CD1-CG2 4.02Å; L1271-Q1383 HydrophobicContact CB-CB 3.91Å; L1271-Q1383 HydrophobicContact CD1-CB 4.31Å; L1271-Q1383 PolarHBondContact N-O 2.82Å; L1271-L1385 HydrophobicContact CD1-CB 4.12Å; L1271-L1385 HydrophobicContact CD2-CB 4.11Å; L1271-L1385 HydrophobicContact CG-CB 4.14Å; L1271-V1408 HydrophobicContact CB-CG2 4.26Å; L1271-T1413 HydrophobicContact CD1-CG2 3.52Å; L1271-T1413 HydrophobicContact CD2-CG2 4.29Å
1272	V	86.3	Confident	84.9	Confident	35 Å²	35	59.2 Å²	59.2	21%	0.212	34%	0.337	C	S	.	.			trans	-146.3	130.3	-175.7	179.9	0	0	0	0	110.5	F1262 L1266 Q1270 T1276 F1402 V1408	F1262-V1272 HydrophobicContact CE1-CG1 4.39Å; F1262-V1272 HydrophobicContact CZ-CG1 4.22Å; L1266-V1272 HydrophobicContact CD1-CB 4.3Å; L1266-V1272 HydrophobicContact CD1-CG2 3.83Å; L1266-V1272 HydrophobicContact CD2-CG2 3.75Å; L1266-V1272 HydrophobicContact CG-CG2 4.46Å; Q1270-V1272 HydrophobicContact CG-CG2 4.02Å; V1272-T1276 HydrophobicContact CG1-CG2 3.63Å; V1272-T1276 WeakPolarHBondContact CG1-OG1 3.28Å; V1272-F1402 HydrophobicContact CG1-CE2 4.43Å; V1272-F1402 HydrophobicContact CG2-CD2 4.47Å; V1272-F1402 HydrophobicContact CG2-CE2 3.99Å; V1272-V1408 VanDerWaalsContact C-CG2 3.48Å
1273	G	80.9	Confident	85.5	Confident	12 Å²	12	57.8 Å²	57.8	12%	0.124	33%	0.332	C	S	.	.			trans	-79.9	151.6	175.3	0	0	0	0	0	113.5	Q1275 T1276 S1406	G1273-Q1275 VanDerWaalsContact CA-OE1 3.25Å; G1273-Q1275 PolarHBondContact O-N 3.1Å; G1273-T1276 VanDerWaalsContact O-CB 3.23Å; G1273-T1276 WeakPolarHBondContact O-CB 3.19Å; G1273-T1276 PolarHBondContact O-N 2.82Å; G1273-T1276 PolarHBondContact O-OG1 3.47Å; G1273-S1406 PolarHBondContact N-O 3.07Å
1274	R	78.1	Confident	86.3	Confident	233 Å²	233	55.2 Å²	55.2	88%	0.879	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-49.8	-33.8	-178.5	-69.9	-175.9	177.7	-179.1	-1.1	113.9	T1276 L1277	R1274-T1276 PolarHBondContact O-N 3.2Å; R1274-L1277 PolarHBondContact O-N 2.73Å
1275	Q	74.2	Confident	87.1	Confident	98 Å²	98	48.4 Å²	48.4	46%	0.458	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-58.7	-13.2	176.2	68	-84	25	0	0	114.6	G1273 T1279 S1405	G1273-Q1275 VanDerWaalsContact CA-OE1 3.25Å; G1273-Q1275 PolarHBondContact O-N 3.1Å; Q1275-T1279 PolarHBondContact O-OG1 3.33Å; Q1275-S1405 WeakPolarHBondContact CG-O 3.36Å; Q1275-S1405 PolarHBondContact NE2-O 3.07Å
1276	T	82	Confident	87.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-83.4	-17.4	-174.8	-44.9	0	0	0	0	113.4	F1262 V1272 G1273 R1274 A1278 T1279 F1402 S1406	F1262-T1276 HydrophobicContact CZ-CG2 4.15Å; V1272-T1276 HydrophobicContact CG1-CG2 3.63Å; V1272-T1276 WeakPolarHBondContact CG1-OG1 3.28Å; G1273-T1276 VanDerWaalsContact O-CB 3.23Å; G1273-T1276 WeakPolarHBondContact O-CB 3.19Å; G1273-T1276 PolarHBondContact O-N 2.82Å; G1273-T1276 PolarHBondContact O-OG1 3.47Å; R1274-T1276 PolarHBondContact O-N 3.2Å; T1276-A1278 PolarHBondContact O-N 3.01Å; T1276-T1279 PolarHBondContact O-N 2.83Å; T1276-F1402 HydrophobicContact CG2-CB 4.42Å; T1276-F1402 HydrophobicContact CG2-CD1 3.31Å; T1276-F1402 HydrophobicContact CG2-CD2 3.91Å; T1276-F1402 HydrophobicContact CG2-CE1 3.3Å; T1276-F1402 HydrophobicContact CG2-CE2 3.89Å; T1276-F1402 HydrophobicContact CG2-CG 3.62Å; T1276-F1402 HydrophobicContact CG2-CZ 3.59Å; T1276-S1406 WeakPolarHBondContact OG1-CB 3.27Å; T1276-S1406 PolarHBondContact OG1-OG 3.01Å; T1276-S1406 VanDerWaalsContact OG1-OG 3.11Å
1277	L	76.4	Confident	88.1	Confident	95 Å²	95	46.9 Å²	46.9	50%	0.497	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-31.9	178.2	-64.8	173.8	0	0	0	112.9	F1259 F1262 R1274	F1259-L1277 HydrophobicContact CD2-CD1 4.26Å; F1259-L1277 HydrophobicContact CD2-CD2 3.84Å; F1259-L1277 HydrophobicContact CE2-CD1 4.23Å; F1259-L1277 HydrophobicContact CE2-CD2 4.01Å; F1262-L1277 HydrophobicContact CD1-CD2 3.62Å; F1262-L1277 HydrophobicContact CD2-CD2 4.38Å; F1262-L1277 HydrophobicContact CE1-CD2 3.8Å; F1262-L1277 HydrophobicContact CG-CD2 3.94Å; F1262-L1277 HydrophobicContact CZ-CD2 4.27Å; R1274-L1277 PolarHBondContact O-N 2.73Å
1278	A	75.6	Confident	88.4	Confident	95 Å²	95	46.6 Å²	46.6	79%	0.785	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	8.3	175	0	0	0	0	0	113.9	T1276	T1276-A1278 PolarHBondContact O-N 3.01Å
1279	T	81.6	Confident	88.6	Confident	36 Å²	36	43.8 Å²	43.8	22%	0.221	25%	0.245	C	C	.	.	S	Bend	trans	-109.8	113.1	-173.3	-61.3	0	0	0	0	111	Q1275 T1276 A1281 P1403	Q1275-T1279 PolarHBondContact O-OG1 3.33Å; T1276-T1279 PolarHBondContact O-N 2.83Å; T1279-A1281 PolarHBondContact O-N 2.94Å; T1279-P1403 HydrophobicContact CG2-CG 3.74Å
1280	P	85.3	Confident	88.7	Confident	110 Å²	110	45 Å²	45	71%	0.714	25%	0.248	S	C	*	.			trans	-58.2	137.3	175.7	-25.4	34.8	0	0	0	112.6
1281	A	90.2	Very high	88.7	Confident	45 Å²	45	46.5 Å²	46.5	37%	0.372	26%	0.256	S	S	.	.			trans	-64.4	139	172.1	0	0	0	0	0	110.6	T1279 G1283 K1400 L1401 F1402	T1279-A1281 PolarHBondContact O-N 2.94Å; A1281-G1283 VanDerWaalsContact C-N 3.25Å; A1281-G1283 PolarHBondContact O-N 3.39Å; A1281-K1400 HydrophobicContact CB-CB 4.28Å; A1281-K1400 HydrophobicContact CB-CG 4.4Å; A1281-L1401 CarbonylContact C-O 3.52Å; A1281-L1401 WeakPolarHBondContact CA-O 3.29Å; A1281-F1402 HydrophobicContact CB-CD1 4.44Å; A1281-F1402 HydrophobicContact CB-CE1 4Å
1282	M	93.3	Very high	88.7	Confident	36 Å²	36	49.2 Å²	49.2	18%	0.177	27%	0.267	C	S	.	.			trans	-81.8	-2	179.7	-61	-171.8	68.6	0	0	113.4	L1306 T1307 F1378 L1401 P1403	M1282-L1306 CarbonylContact O-C 3.52Å; M1282-L1306 WeakPolarHBondContact O-CA 3.18Å; M1282-T1307 WeakPolarHBondContact CA-OG1 3.23Å; M1282-T1307 PolarHBondContact O-N 3.24Å; M1282-T1307 PolarHBondContact O-OG1 3.1Å; M1282-F1378 HydrophobicContact CE-CD1 4.38Å; M1282-F1378 HydrophobicContact SD-CD1 4.37Å; M1282-F1378 HydrophobicContact SD-CE1 3.98Å; M1282-L1401 HydrophobicContact CB-CB 4.46Å; M1282-L1401 PolarHBondContact N-O 2.95Å; M1282-P1403 HydrophobicContact CG-CG 4.39Å; M1282-P1403 HydrophobicContact SD-CB 4.4Å; M1282-P1403 HydrophobicContact SD-CG 4.01Å
1283	G	94.6	Very high	88.9	Confident	5 Å²	5	57.8 Å²	57.8	5%	0.052	30%	0.301	C	S	.	.			trans	140.7	-179.7	-174.5	0	0	0	0	0	110.3	A1281 R1304 S1305 L1401	A1281-G1283 VanDerWaalsContact C-N 3.25Å; A1281-G1283 PolarHBondContact O-N 3.39Å; G1283-R1304 WeakPolarHBondContact CA-O 3.38Å; G1283-S1305 WeakPolarHBondContact CA-O 3.45Å; G1283-L1401 VanDerWaalsContact O-CB 3.28Å; G1283-L1401 WeakPolarHBondContact O-CB 3.31Å; G1283-L1401 PolarHBondContact O-N 3.23Å
1284	D	96.7	Very high	89.1	Confident	28 Å²	28	58.9 Å²	58.9	15%	0.15	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.4	175.1	-50.4	-43.4	0	0	0	111.2	A1303 R1304 W1398 Y1399	D1284-A1303 CarbonylContact O-C 3.57Å; D1284-A1303 WeakPolarHBondContact O-CA 3.37Å; D1284-A1303 VanDerWaalsContact O-CB 3.29Å; D1284-A1303 WeakPolarHBondContact O-CB 3.25Å; D1284-R1304 HydrophobicContact CB-CG 3.97Å; D1284-R1304 PolarHBondContact N-O 2.76Å; D1284-R1304 PolarHBondContact O-N 2.86Å; D1284-R1304 IonicContact OD2-CZ 2.61Å; D1284-R1304 IonicContact OD2-NE 3.79Å; D1284-R1304 PolarHBondContact OD2-NE 2.63Å; D1284-R1304 IonicContact OD2-NH2 2.77Å; D1284-R1304 PolarHBondContact OD2-NH2 3.32Å; D1284-W1398 HydrophobicContact CB-CE3 3.68Å; D1284-W1398 HydrophobicContact CB-CZ3 3.91Å; D1284-Y1399 WeakPolarHBondContact CA-O 3.35Å
1285	I	97.9	Very high	89.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.9	172	-167.6	164.3	0	0	0	111.5	I1287 V1300 R1302 A1303 V1320 V1364 V1366 Y1399 L1401	I1285-I1287 HydrophobicContact CD1-CD1 3.87Å; I1285-I1287 HydrophobicContact CG1-CD1 3.83Å; I1285-I1287 HydrophobicContact CG1-CG1 4.18Å; I1285-I1287 HydrophobicContact CG2-CG1 4.2Å; I1285-V1300 HydrophobicContact CD1-CG1 4.33Å; I1285-R1302 WeakPolarHBondContact CG1-O 3.29Å; I1285-A1303 HydrophobicContact CB-CB 4.25Å; I1285-A1303 HydrophobicContact CG1-CB 4.15Å; I1285-V1320 HydrophobicContact CD1-CB 4.49Å; I1285-V1320 HydrophobicContact CD1-CG1 3.94Å; I1285-V1320 HydrophobicContact CD1-CG2 3.69Å; I1285-V1364 HydrophobicContact CD1-CG1 3.83Å; I1285-V1364 HydrophobicContact CG2-CG1 4.41Å; I1285-V1366 HydrophobicContact CD1-CG2 3.97Å; I1285-Y1399 PolarHBondContact N-O 2.92Å; I1285-Y1399 PolarHBondContact O-N 2.95Å; I1285-L1401 HydrophobicContact CB-CD1 4.31Å; I1285-L1401 HydrophobicContact CB-CD2 4.26Å; I1285-L1401 HydrophobicContact CB-CG 4.37Å; I1285-L1401 HydrophobicContact CG2-CD2 3.7Å; I1285-L1401 HydrophobicContact CG2-CG 4.16Å
1286	Q	97.9	Very high	90.8	Very high	31 Å²	31	47 Å²	47	15%	0.145	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.8	175.6	-160.9	-177.1	-9.9	0	0	109.5	I1301 R1302 I1396 G1397 W1398	Q1286-I1301 HydrophobicContact CB-CB 4.29Å; Q1286-I1301 HydrophobicContact CG-CB 4.47Å; Q1286-I1301 HydrophobicContact CG-CD1 4.16Å; Q1286-I1301 PolarHBondContact O-N 2.77Å; Q1286-I1301 VanDerWaalsContact O-N 3.13Å; Q1286-R1302 HydrophobicContact CB-CG 3.91Å; Q1286-R1302 PolarHBondContact N-O 3.48Å; Q1286-R1302 VanDerWaalsContact OE1-NH2 3.12Å; Q1286-I1396 HydrophobicContact CG-CG2 4.05Å; Q1286-G1397 WeakPolarHBondContact CA-O 3.41Å; Q1286-W1398 HydrophobicContact CB-CD2 3.97Å; Q1286-W1398 HydrophobicContact CB-CE3 3.76Å; Q1286-W1398 HydrophobicContact CB-CH2 4.1Å; Q1286-W1398 HydrophobicContact CB-CZ2 4.31Å; Q1286-W1398 HydrophobicContact CB-CZ3 3.81Å; Q1286-W1398 HydrophobicContact CG-CD2 4.14Å; Q1286-W1398 HydrophobicContact CG-CE3 4.43Å
1287	I	97.9	Very high	91.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.7	-174.8	-58.5	-64.8	0	0	0	109.3	I1285 M1289 V1298 E1299 V1300 V1364 I1396 G1397 Y1399	I1285-I1287 HydrophobicContact CD1-CD1 3.87Å; I1285-I1287 HydrophobicContact CG1-CD1 3.83Å; I1285-I1287 HydrophobicContact CG1-CG1 4.18Å; I1285-I1287 HydrophobicContact CG2-CG1 4.2Å; I1287-M1289 HydrophobicContact CG2-CE 4.47Å; I1287-M1289 HydrophobicContact CG2-CG 3.96Å; I1287-M1289 HydrophobicContact CG2-SD 4.33Å; I1287-V1298 HydrophobicContact CG2-CG1 3.68Å; I1287-E1299 CarbonylContact C-O 3.53Å; I1287-E1299 WeakPolarHBondContact CA-O 3.33Å; I1287-V1300 HydrophobicContact CD1-CB 4.29Å; I1287-V1300 HydrophobicContact CD1-CG1 4.07Å; I1287-V1300 HydrophobicContact CD1-CG2 4.07Å; I1287-V1364 HydrophobicContact CD1-CG1 4.07Å; I1287-V1364 HydrophobicContact CG1-CG1 4.47Å; I1287-I1396 WeakPolarHBondContact O-CA 3.44Å; I1287-G1397 PolarHBondContact N-O 2.93Å; I1287-G1397 PolarHBondContact O-N 2.85Å; I1287-Y1399 HydrophobicContact CB-CD2 4.06Å; I1287-Y1399 HydrophobicContact CB-CE2 4.06Å; I1287-Y1399 HydrophobicContact CG1-CD2 4.17Å
1288	G	96.9	Very high	92.4	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	143.4	165.1	0	0	0	0	0	111.3	V1298 E1299 V1395	G1288-V1298 CarbonylContact O-C 3.51Å; G1288-V1298 VanDerWaalsContact O-CA 3.31Å; G1288-V1298 WeakPolarHBondContact O-CA 3.48Å; G1288-E1299 PolarHBondContact N-O 2.99Å; G1288-E1299 PolarHBondContact O-N 3.49Å; G1288-V1395 CarbonylContact C-O 3.59Å; G1288-V1395 VanDerWaalsContact CA-O 3.3Å; G1288-V1395 WeakPolarHBondContact CA-O 3.43Å
1289	M	96.8	Very high	93.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.7	177.3	-65.7	166.9	-70.5	0	0	111	I1287 L1296 E1297 V1298 L1362 I1384 L1386 L1389 L1391 M1394 V1395 Y1399	I1287-M1289 HydrophobicContact CG2-CE 4.47Å; I1287-M1289 HydrophobicContact CG2-CG 3.96Å; I1287-M1289 HydrophobicContact CG2-SD 4.33Å; M1289-L1296 HydrophobicContact CB-CD1 4.3Å; M1289-E1297 VanDerWaalsContact CA-O 3.32Å; M1289-E1297 WeakPolarHBondContact CA-O 2.98Å; M1289-V1298 HydrophobicContact CG-CG1 4.39Å; M1289-V1298 HydrophobicContact CG-CG2 4.43Å; M1289-L1362 HydrophobicContact CG-CD2 4.17Å; M1289-L1362 HydrophobicContact SD-CD2 3.62Å; M1289-I1384 HydrophobicContact CE-CD1 4.06Å; M1289-I1384 HydrophobicContact CE-CG2 4.19Å; M1289-I1384 HydrophobicContact SD-CD1 4.07Å; M1289-I1384 HydrophobicContact SD-CG2 4.38Å; M1289-L1386 HydrophobicContact SD-CD2 3.73Å; M1289-L1389 HydrophobicContact CE-CD1 3.52Å; M1289-L1389 HydrophobicContact SD-CD1 4.15Å; M1289-L1391 HydrophobicContact CB-CD2 3.61Å; M1289-M1394 CarbonylContact O-C 3.4Å; M1289-M1394 WeakPolarHBondContact O-CA 3.5Å; M1289-V1395 PolarHBondContact N-O 3.27Å; M1289-V1395 PolarHBondContact O-N 2.61Å; M1289-Y1399 HydrophobicContact CE-CE2 4.22Å; M1289-Y1399 VanDerWaalsContact CE-OH 3.23Å; M1289-Y1399 WeakPolarHBondContact CE-OH 3.43Å
1290	E	95.3	Very high	94.2	Very high	40 Å²	40	39.8 Å²	39.8	19%	0.187	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	145.1	-179.8	-171.5	-179.5	168.9	0	0	110.1	K1292 L1296 E1297 M1394	E1290-K1292 VanDerWaalsContact CD-NZ 3.34Å; E1290-K1292 HydrophobicContact CG-CG 4.29Å; E1290-K1292 WeakPolarHBondContact OE1-CE 3.35Å; E1290-K1292 IonicContact OE1-NZ 2.59Å; E1290-K1292 WeakPolarHBondContact OE2-CE 3.21Å; E1290-K1292 IonicContact OE2-NZ 3.36Å; E1290-K1292 PolarHBondContact OE2-NZ 2.74Å; E1290-L1296 CarbonylContact O-C 3.55Å; E1290-L1296 WeakPolarHBondContact O-CA 3.39Å; E1290-E1297 PolarHBondContact N-O 2.77Å; E1290-E1297 PolarHBondContact O-N 2.77Å; E1290-M1394 HydrophobicContact CB-CB 4.15Å; E1290-M1394 HydrophobicContact CB-CE 3.72Å; E1290-M1394 HydrophobicContact CG-CB 4.48Å
1291	D	94.2	Very high	94.8	Very high	49 Å²	49	35.5 Å²	35.5	26%	0.262	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	103.7	171.6	-172.8	-7.1	0	0	0	111.6	K1293 G1294 Q1295 P1357 L1391	D1291-K1293 PolarHBondContact O-N 3.42Å; D1291-K1293 PolarHBondContact OD1-N 2.84Å; D1291-G1294 WeakPolarHBondContact OD1-CA 3.27Å; D1291-G1294 PolarHBondContact OD1-N 3.2Å; D1291-Q1295 PolarHBondContact OD1-N 3.36Å; D1291-P1357 HydrophobicContact CB-CG 4.14Å; D1291-P1357 WeakPolarHBondContact OD2-CD 3.36Å; D1291-P1357 WeakPolarHBondContact OD2-CG 3.29Å; D1291-L1391 HydrophobicContact CB-CB 4.14Å; D1291-L1391 PolarHBondContact N-O 2.96Å
1292	K	91.7	Very high	95.1	Very high	85 Å²	85	38.5 Å²	38.5	37%	0.37	19%	0.185	S	C	.	.	S	Bend	trans	-92.5	78.3	176	-76.2	175.4	172.4	129.3	0	111.2	E1290 Q1295 E1297	E1290-K1292 VanDerWaalsContact CD-NZ 3.34Å; E1290-K1292 HydrophobicContact CG-CG 4.29Å; E1290-K1292 WeakPolarHBondContact OE1-CE 3.35Å; E1290-K1292 IonicContact OE1-NZ 2.59Å; E1290-K1292 WeakPolarHBondContact OE2-CE 3.21Å; E1290-K1292 IonicContact OE2-NZ 3.36Å; E1290-K1292 PolarHBondContact OE2-NZ 2.74Å; K1292-Q1295 PolarHBondContact N-O 2.76Å; K1292-E1297 VanDerWaalsContact CD-OE2 3.26Å; K1292-E1297 WeakPolarHBondContact CD-OE2 3.34Å; K1292-E1297 IonicContact NZ-OE2 3.85Å; K1292-E1297 PolarHBondContact NZ-OE2 3.01Å
1293	K	88.7	Confident	95.3	Very high	215 Å²	215	36.9 Å²	36.9	94%	0.935	18%	0.177	S	C	*	.	S	Bend	trans	67.6	42.9	171.5	-48.2	173.6	-177.7	177.2	0	113.5	D1291	D1291-K1293 PolarHBondContact O-N 3.42Å; D1291-K1293 PolarHBondContact OD1-N 2.84Å
1294	G	86.6	Confident	95.4	Very high	35 Å²	35	41.3 Å²	41.3	36%	0.361	19%	0.192	S	C	.	.	S	Bend	trans	86.7	24.4	-173.1	0	0	0	0	0	113.1	D1291 E1355	D1291-G1294 WeakPolarHBondContact OD1-CA 3.27Å; D1291-G1294 PolarHBondContact OD1-N 3.2Å; G1294-E1355 CarbonylContact O-C 3.55Å
1295	Q	91.4	Very high	95.3	Very high	83 Å²	83	43.7 Å²	43.7	39%	0.388	21%	0.211	S	C	.	.			trans	-134.5	107.4	176.6	-62	-170.7	-2	0	0	109.6	D1291 K1292 E1297 V1352 F1353	D1291-Q1295 PolarHBondContact OD1-N 3.36Å; K1292-Q1295 PolarHBondContact N-O 2.76Å; Q1295-E1297 PolarHBondContact O-N 2.8Å; Q1295-E1297 VanDerWaalsContact O-N 3.12Å; Q1295-V1352 HydrophobicContact CB-CG1 4.06Å; Q1295-F1353 CarbonylContact C-O 3.51Å; Q1295-F1353 VanDerWaalsContact CA-O 3.26Å; Q1295-F1353 WeakPolarHBondContact CA-O 3.27Å; Q1295-F1353 WeakPolarHBondContact CB-O 3.14Å
1296	L	95.2	Very high	95.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	106.8	175.7	174.8	69.4	0	0	0	111.1	M1289 E1290 V1298 L1324 V1352 F1353 E1355 P1357 L1362 L1386 L1391	M1289-L1296 HydrophobicContact CB-CD1 4.3Å; E1290-L1296 CarbonylContact O-C 3.55Å; E1290-L1296 WeakPolarHBondContact O-CA 3.39Å; L1296-V1298 HydrophobicContact CD1-CG2 4.33Å; L1296-V1298 HydrophobicContact CD2-CG2 3.86Å; L1296-V1298 HydrophobicContact CG-CG2 3.77Å; L1296-L1324 HydrophobicContact CD2-CD1 3.93Å; L1296-V1352 CarbonylContact O-C 3.53Å; L1296-F1353 HydrophobicContact CB-CB 4.35Å; L1296-F1353 PolarHBondContact N-O 2.78Å; L1296-F1353 PolarHBondContact O-N 3.01Å; L1296-E1355 PolarHBondContact N-O 3.15Å; L1296-P1357 HydrophobicContact CD1-CB 4.37Å; L1296-L1362 HydrophobicContact CD2-CD1 4.04Å; L1296-L1386 HydrophobicContact CD1-CD2 4.34Å; L1296-L1386 HydrophobicContact CD2-CD1 3.57Å; L1296-L1386 HydrophobicContact CD2-CD2 4.36Å; L1296-L1391 HydrophobicContact CD1-CD1 4.09Å
1297	E	95.6	Very high	94.8	Very high	31 Å²	31	45.7 Å²	45.7	15%	0.145	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	116.3	167.4	-174.5	170.3	179.6	0	0	110.7	M1289 E1290 K1292 Q1295 S1350 V1352 M1394	M1289-E1297 VanDerWaalsContact CA-O 3.32Å; M1289-E1297 WeakPolarHBondContact CA-O 2.98Å; E1290-E1297 PolarHBondContact N-O 2.77Å; E1290-E1297 PolarHBondContact O-N 2.77Å; K1292-E1297 VanDerWaalsContact CD-OE2 3.26Å; K1292-E1297 WeakPolarHBondContact CD-OE2 3.34Å; K1292-E1297 IonicContact NZ-OE2 3.85Å; K1292-E1297 PolarHBondContact NZ-OE2 3.01Å; Q1295-E1297 PolarHBondContact O-N 2.8Å; Q1295-E1297 VanDerWaalsContact O-N 3.12Å; E1297-S1350 WeakPolarHBondContact OE1-CB 3.38Å; E1297-S1350 PolarHBondContact OE1-OG 2.99Å; E1297-V1352 HydrophobicContact CB-CG2 4.22Å; E1297-V1352 HydrophobicContact CG-CG2 3.93Å; E1297-M1394 HydrophobicContact CG-CE 4.5Å
1298	V	97.1	Very high	94.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	105.8	174.8	-174.7	0	0	0	0	109.9	I1287 G1288 M1289 L1296 V1300 V1322 S1350 L1351 F1353 L1362	I1287-V1298 HydrophobicContact CG2-CG1 3.68Å; G1288-V1298 CarbonylContact O-C 3.51Å; G1288-V1298 VanDerWaalsContact O-CA 3.31Å; G1288-V1298 WeakPolarHBondContact O-CA 3.48Å; M1289-V1298 HydrophobicContact CG-CG1 4.39Å; M1289-V1298 HydrophobicContact CG-CG2 4.43Å; L1296-V1298 HydrophobicContact CD1-CG2 4.33Å; L1296-V1298 HydrophobicContact CD2-CG2 3.86Å; L1296-V1298 HydrophobicContact CG-CG2 3.77Å; V1298-V1300 PolarHBondContact O-N 3.43Å; V1298-V1322 HydrophobicContact CG1-CG1 4.4Å; V1298-S1350 CarbonylContact O-C 3.59Å; V1298-L1351 PolarHBondContact N-O 3.43Å; V1298-L1351 WeakPolarHBondContact O-CB 3.42Å; V1298-L1351 PolarHBondContact O-N 3.1Å; V1298-F1353 HydrophobicContact CB-CE2 4.22Å; V1298-F1353 HydrophobicContact CG2-CD2 3.9Å; V1298-F1353 HydrophobicContact CG2-CE2 3.77Å; V1298-L1362 HydrophobicContact CG1-CD2 3.93Å; V1298-L1362 HydrophobicContact CG2-CD1 4.14Å; V1298-L1362 HydrophobicContact CG2-CD2 3.78Å
1299	E	97.4	Very high	93.5	Very high	43 Å²	43	51.3 Å²	51.3	20%	0.201	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116	169.4	-158.8	-160.6	163.8	0	0	110.5	I1287 G1288 I1301 M1394	I1287-E1299 CarbonylContact C-O 3.53Å; I1287-E1299 WeakPolarHBondContact CA-O 3.33Å; G1288-E1299 PolarHBondContact N-O 2.99Å; G1288-E1299 PolarHBondContact O-N 3.49Å; E1299-I1301 HydrophobicContact CB-CG1 4.28Å; E1299-I1301 HydrophobicContact CG-CG1 4.03Å; E1299-I1301 PolarHBondContact O-N 3.15Å; E1299-M1394 HydrophobicContact CB-CE 4.47Å; E1299-M1394 HydrophobicContact CB-SD 4.34Å
1300	V	97.9	Very high	92.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	103.1	166.7	-174.6	0	0	0	0	107.9	I1285 I1287 V1298 V1320 V1322 T1336 Y1347 Q1348 Q1349 L1351	I1285-V1300 HydrophobicContact CD1-CG1 4.33Å; I1287-V1300 HydrophobicContact CD1-CB 4.29Å; I1287-V1300 HydrophobicContact CD1-CG1 4.07Å; I1287-V1300 HydrophobicContact CD1-CG2 4.07Å; V1298-V1300 PolarHBondContact O-N 3.43Å; V1300-V1320 HydrophobicContact CG1-CB 4.12Å; V1300-V1320 HydrophobicContact CG1-CG1 4.36Å; V1300-V1320 HydrophobicContact CG1-CG2 3.8Å; V1300-V1322 HydrophobicContact CG2-CG2 3.93Å; V1300-T1336 HydrophobicContact CB-CG2 3.63Å; V1300-T1336 HydrophobicContact CG1-CG2 3.75Å; V1300-T1336 HydrophobicContact CG2-CG2 3.83Å; V1300-Y1347 HydrophobicContact CG1-CD2 3.76Å; V1300-Y1347 HydrophobicContact CG1-CE2 4.44Å; V1300-Y1347 HydrophobicContact CG1-CG 4.09Å; V1300-Y1347 VanDerWaalsContact O-CB 3.28Å; V1300-Y1347 WeakPolarHBondContact O-CB 3.41Å; V1300-Q1348 PolarHBondContact O-N 3.21Å; V1300-Q1348 VanDerWaalsContact O-N 3.08Å; V1300-Q1349 PolarHBondContact N-O 2.86Å; V1300-Q1349 PolarHBondContact O-N 2.92Å; V1300-L1351 HydrophobicContact CG2-CD1 3.74Å; V1300-L1351 HydrophobicContact CG2-CG 4.39Å
1301	I	97.5	Very high	91.7	Very high	20 Å²	20	57.2 Å²	57.2	10%	0.103	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-64.5	-171.4	-58	170.8	0	0	0	110.2	Q1286 E1299 Y1347 Q1348 I1396	Q1286-I1301 HydrophobicContact CB-CB 4.29Å; Q1286-I1301 HydrophobicContact CG-CB 4.47Å; Q1286-I1301 HydrophobicContact CG-CD1 4.16Å; Q1286-I1301 PolarHBondContact O-N 2.77Å; Q1286-I1301 VanDerWaalsContact O-N 3.13Å; E1299-I1301 HydrophobicContact CB-CG1 4.28Å; E1299-I1301 HydrophobicContact CG-CG1 4.03Å; E1299-I1301 PolarHBondContact O-N 3.15Å; I1301-Y1347 PolarHBondContact O-N 3.45Å; I1301-Q1348 PolarHBondContact O-N 3.04Å; I1301-I1396 HydrophobicContact CD1-CD1 4.23Å; I1301-I1396 HydrophobicContact CD1-CG1 4.44Å; I1301-I1396 HydrophobicContact CD1-CG2 3.64Å
1302	R	97.3	Very high	90.9	Very high	107 Å²	107	55.6 Å²	55.6	40%	0.404	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	166.6	-178.9	60.5	174.4	165.6	169.9	-9.7	112.2	I1285 Q1286 P1345 L1346 W1398	I1285-R1302 WeakPolarHBondContact CG1-O 3.29Å; Q1286-R1302 HydrophobicContact CB-CG 3.91Å; Q1286-R1302 PolarHBondContact N-O 3.48Å; Q1286-R1302 VanDerWaalsContact OE1-NH2 3.12Å; R1302-P1345 CarbonylContact C-O 3.53Å; R1302-P1345 WeakPolarHBondContact CA-O 3.43Å; R1302-P1345 WeakPolarHBondContact CB-O 3.04Å; R1302-L1346 HydrophobicContact CB-CD1 4.07Å; R1302-W1398 HydrophobicContact CG-CH2 4.08Å; R1302-W1398 VanDerWaalsContact CZ-CZ2 3.49Å
1303	A	97.7	Very high	90.2	Very high	2 Å²	2	61.9 Å²	61.9	2%	0.017	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	161.8	158.7	0	0	0	0	0	110.6	D1284 I1285 L1306 D1344 P1345	D1284-A1303 CarbonylContact O-C 3.57Å; D1284-A1303 WeakPolarHBondContact O-CA 3.37Å; D1284-A1303 VanDerWaalsContact O-CB 3.29Å; D1284-A1303 WeakPolarHBondContact O-CB 3.25Å; I1285-A1303 HydrophobicContact CB-CB 4.25Å; I1285-A1303 HydrophobicContact CG1-CB 4.15Å; A1303-L1306 HydrophobicContact CB-CD1 4.09Å; A1303-L1306 HydrophobicContact CB-CD2 4.06Å; A1303-L1306 HydrophobicContact CB-CG 4.14Å; A1303-D1344 CarbonylContact O-C 3.35Å; A1303-D1344 WeakPolarHBondContact O-CA 3.07Å; A1303-P1345 HydrophobicContact CB-CG 3.87Å; A1303-P1345 PolarHBondContact N-O 3.32Å; A1303-P1345 WeakPolarHBondContact O-CD 3.49Å
1304	R	95.7	Very high	89.8	Confident	98 Å²	98	53.4 Å²	53.4	37%	0.37	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.3	176.1	68.3	177.4	-178.2	-159.5	-3.9	111.6	G1283 D1284 L1306 D1344 W1398	G1283-R1304 WeakPolarHBondContact CA-O 3.38Å; D1284-R1304 HydrophobicContact CB-CG 3.97Å; D1284-R1304 PolarHBondContact N-O 2.76Å; D1284-R1304 PolarHBondContact O-N 2.86Å; D1284-R1304 IonicContact OD2-CZ 2.61Å; D1284-R1304 IonicContact OD2-NE 3.79Å; D1284-R1304 PolarHBondContact OD2-NE 2.63Å; D1284-R1304 IonicContact OD2-NH2 2.77Å; D1284-R1304 PolarHBondContact OD2-NH2 3.32Å; R1304-L1306 PolarHBondContact O-N 3.38Å; R1304-L1306 VanDerWaalsContact O-N 3.14Å; R1304-D1344 WeakPolarHBondContact CA-OD1 3.4Å; R1304-W1398 HydrophobicContact CB-CH2 4.32Å; R1304-W1398 HydrophobicContact CB-CZ3 4.5Å; R1304-W1398 HydrophobicContact CG-CH2 3.79Å; R1304-W1398 HydrophobicContact CG-CZ3 3.74Å
1305	S	94.1	Very high	89.9	Confident	78 Å²	78	54.3 Å²	54.3	55%	0.545	29%	0.29	S	S	.	.	S	Bend	trans	56.9	28.6	171.9	-50.5	0	0	0	0	114.2	G1283 T1307 D1344	G1283-S1305 WeakPolarHBondContact CA-O 3.45Å; S1305-T1307 PolarHBondContact O-N 2.87Å; S1305-D1344 PolarHBondContact N-OD1 2.71Å
1306	L	95.3	Very high	89.9	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-65.4	128.7	-175.8	-66.1	177.2	0	0	0	111.6	M1282 A1303 R1304 Q1308 P1318 L1343 P1345 V1366 M1379 L1401	M1282-L1306 CarbonylContact O-C 3.52Å; M1282-L1306 WeakPolarHBondContact O-CA 3.18Å; A1303-L1306 HydrophobicContact CB-CD1 4.09Å; A1303-L1306 HydrophobicContact CB-CD2 4.06Å; A1303-L1306 HydrophobicContact CB-CG 4.14Å; R1304-L1306 PolarHBondContact O-N 3.38Å; R1304-L1306 VanDerWaalsContact O-N 3.14Å; L1306-Q1308 PolarHBondContact O-N 2.95Å; L1306-P1318 HydrophobicContact CD1-CB 4.15Å; L1306-P1318 HydrophobicContact CD1-CG 4.34Å; L1306-L1343 HydrophobicContact CB-CB 4.38Å; L1306-L1343 VanDerWaalsContact CB-O 3.24Å; L1306-L1343 WeakPolarHBondContact CB-O 3.43Å; L1306-L1343 WeakPolarHBondContact CD1-O 3.41Å; L1306-L1343 WeakPolarHBondContact CG-O 3.42Å; L1306-L1343 PolarHBondContact N-O 2.8Å; L1306-P1345 HydrophobicContact CD1-CG 3.81Å; L1306-V1366 HydrophobicContact CD1-CG1 3.91Å; L1306-V1366 HydrophobicContact CD2-CG1 4.18Å; L1306-M1379 HydrophobicContact CB-CE 3.74Å; L1306-M1379 HydrophobicContact CD1-CE 4.45Å; L1306-L1401 HydrophobicContact CD2-CD1 3.49Å; L1306-L1401 VanDerWaalsContact CD2-CD1 3.49Å
1307	T	90	Very high	89.8	Confident	71 Å²	71	51.3 Å²	51.3	44%	0.436	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-69.1	118.5	-176.6	-60.8	0	0	0	0	111.5	M1282 S1305 M1379	M1282-T1307 WeakPolarHBondContact CA-OG1 3.23Å; M1282-T1307 PolarHBondContact O-N 3.24Å; M1282-T1307 PolarHBondContact O-OG1 3.1Å; S1305-T1307 PolarHBondContact O-N 2.87Å; T1307-M1379 VanDerWaalsContact O-CE 3.26Å; T1307-M1379 WeakPolarHBondContact O-CE 3.06Å
1308	Q	86.2	Confident	89.8	Confident	60 Å²	60	49.8 Å²	49.8	28%	0.28	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-76.2	136.7	176.9	-175.4	170.6	-16.3	0	0	111.9	L1306 P1310 S1312 S1314 L1343	L1306-Q1308 PolarHBondContact O-N 2.95Å; Q1308-P1310 WeakPolarHBondContact O-CD 3.41Å; Q1308-S1312 WeakPolarHBondContact CG-OG 3.39Å; Q1308-S1312 PolarHBondContact NE2-O 2.87Å; Q1308-S1312 PolarHBondContact NE2-OG 2.84Å; Q1308-S1314 PolarHBondContact NE2-O 3.2Å; Q1308-L1343 HydrophobicContact CB-CD1 4.14Å; Q1308-L1343 HydrophobicContact CB-CD2 4.02Å
1309	K	81.9	Confident	89.8	Confident	57 Å²	57	50.2 Å²	50.2	25%	0.248	27%	0.274	C	S	.	.			trans	-52.1	114.6	175.9	-166.2	-165	176.2	-164	0	111.4	M1221 G1311 S1312 Y1370 D1374	M1221-K1309 HydrophobicContact CE-CD 3.82Å; M1221-K1309 HydrophobicContact CE-CG 3.77Å; M1221-K1309 HydrophobicContact SD-CD 4.09Å; M1221-K1309 HydrophobicContact SD-CG 3.58Å; M1221-K1309 VanDerWaalsContact SD-CG 3.58Å; K1309-G1311 PolarHBondContact O-N 3.28Å; K1309-G1311 VanDerWaalsContact O-N 3.12Å; K1309-S1312 WeakPolarHBondContact O-CB 3.27Å; K1309-S1312 PolarHBondContact O-N 2.89Å; K1309-S1312 PolarHBondContact O-OG 3.2Å; K1309-Y1370 HydrophobicContact CB-CE1 4.47Å; K1309-Y1370 HydrophobicContact CB-CE2 4.06Å; K1309-Y1370 WeakPolarHBondContact CB-OH 3.44Å; K1309-Y1370 PolarHBondContact N-OH 2.88Å; K1309-D1374 IonicContact NZ-OD1 2.92Å
1310	P	79.9	Confident	89.8	Confident	101 Å²	101	48.1 Å²	48.1	66%	0.656	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	108.8	-166.7	-29.2	37	0	0	0	115.7	M1221 Q1308	M1221-P1310 WeakPolarHBondContact CE-O 3.28Å; M1221-P1310 HydrophobicContact SD-CB 4.49Å; Q1308-P1310 WeakPolarHBondContact O-CD 3.41Å
1311	G	74.9	Confident	89.8	Confident	63 Å²	63	50.8 Å²	50.8	65%	0.649	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.5	-2.4	-177.8	0	0	0	0	0	114.7	K1309 K1313	K1309-G1311 PolarHBondContact O-N 3.28Å; K1309-G1311 VanDerWaalsContact O-N 3.12Å; G1311-K1313 PolarHBondContact O-N 3.43Å
1312	S	76.2	Confident	89.8	Confident	16 Å²	16	49.9 Å²	49.9	11%	0.112	27%	0.271	C	S	.	.			trans	-65.9	125.4	163.7	59.9	0	0	0	0	110.3	Q1308 K1309 Y1370	Q1308-S1312 WeakPolarHBondContact CG-OG 3.39Å; Q1308-S1312 PolarHBondContact NE2-O 2.87Å; Q1308-S1312 PolarHBondContact NE2-OG 2.84Å; K1309-S1312 WeakPolarHBondContact O-CB 3.27Å; K1309-S1312 PolarHBondContact O-N 2.89Å; K1309-S1312 PolarHBondContact O-OG 3.2Å; S1312-Y1370 VanDerWaalsContact OG-CE1 3.29Å; S1312-Y1370 WeakPolarHBondContact OG-CE1 3.42Å
1313	K	76.8	Confident	89.8	Confident	217 Å²	217	47 Å²	47	94%	0.943	26%	0.261	S	S	*	.	S	Bend	trans	-84.2	-16.1	178.2	-67.4	-173.6	179.1	-178.5	0	113.9	G1311	G1311-K1313 PolarHBondContact O-N 3.43Å
1314	S	81.8	Confident	89.7	Confident	36 Å²	36	46.9 Å²	46.9	25%	0.252	26%	0.26	S	S	.	.	S	Bend	trans	-101.6	136.9	177.1	52.2	0	0	0	0	110.6	Q1308 Y1370	Q1308-S1314 PolarHBondContact NE2-O 3.2Å; S1314-Y1370 WeakPolarHBondContact O-CD1 3.48Å; S1314-Y1370 WeakPolarHBondContact O-CE1 3.35Å
1315	T	87.9	Confident	89.6	Confident	54 Å²	54	42.7 Å²	42.7	33%	0.331	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-64.2	140.8	168.5	47.7	0	0	0	0	111.2	K1341	T1315-K1341 WeakPolarHBondContact CB-O 2.94Å; T1315-K1341 WeakPolarHBondContact OG1-CB 3.15Å; T1315-K1341 PolarHBondContact OG1-O 2.8Å
1316	P	91.4	Very high	89.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.8	151.4	176.1	26.9	-32.3	0	0	0	111	P1318 K1341 T1342 L1343 Y1370 M1379	P1316-P1318 WeakPolarHBondContact O-CD 3.1Å; P1316-K1341 CarbonylContact O-C 3.48Å; P1316-K1341 WeakPolarHBondContact O-CA 3.27Å; P1316-T1342 PolarHBondContact O-N 2.79Å; P1316-T1342 VanDerWaalsContact O-N 3.08Å; P1316-L1343 HydrophobicContact CG-CD2 3.55Å; P1316-Y1370 HydrophobicContact CB-CD1 4.45Å; P1316-Y1370 HydrophobicContact CB-CD2 4.24Å; P1316-Y1370 HydrophobicContact CB-CE1 3.99Å; P1316-Y1370 HydrophobicContact CB-CE2 3.74Å; P1316-Y1370 HydrophobicContact CG-CE1 4.38Å; P1316-M1379 HydrophobicContact CB-CE 4.4Å; P1316-M1379 HydrophobicContact CB-SD 4.09Å; P1316-M1379 HydrophobicContact CG-CE 3.69Å; P1316-M1379 HydrophobicContact CG-SD 4Å
1317	A	93.6	Very high	88.9	Confident	20 Å²	20	48.4 Å²	48.4	17%	0.165	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	93.9	162.7	0	0	0	0	0	108.3	I1338 A1339 D1369	A1317-I1338 HydrophobicContact CB-CG2 3.64Å; A1317-I1338 WeakPolarHBondContact O-CG2 3.48Å; A1317-A1339 CarbonylContact C-O 3.54Å; A1317-A1339 VanDerWaalsContact CA-O 3.26Å; A1317-A1339 WeakPolarHBondContact CA-O 3.28Å; A1317-A1339 WeakPolarHBondContact CB-O 3.05Å; A1317-D1369 PolarHBondContact N-O 2.73Å; A1317-D1369 WeakPolarHBondContact O-CB 3.46Å; A1317-D1369 PolarHBondContact O-N 2.88Å
1318	P	96.2	Very high	88.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	156.9	-170.1	34.1	-38.6	0	0	0	112.5	L1306 P1316 A1339 T1342 P1345 Y1347 V1366 W1367 M1379	L1306-P1318 HydrophobicContact CD1-CB 4.15Å; L1306-P1318 HydrophobicContact CD1-CG 4.34Å; P1316-P1318 WeakPolarHBondContact O-CD 3.1Å; P1318-A1339 HydrophobicContact CG-CB 4.17Å; P1318-A1339 PolarHBondContact O-N 2.81Å; P1318-T1342 VanDerWaalsContact CD-O 3.27Å; P1318-T1342 WeakPolarHBondContact CD-O 3.39Å; P1318-T1342 WeakPolarHBondContact CG-O 3.37Å; P1318-P1345 HydrophobicContact CB-CG 4.38Å; P1318-P1345 HydrophobicContact CG-CB 3.66Å; P1318-P1345 HydrophobicContact CG-CG 3.64Å; P1318-Y1347 PolarHBondContact O-OH 3.3Å; P1318-V1366 HydrophobicContact CB-CG1 4.34Å; P1318-W1367 CarbonylContact C-O 3.58Å; P1318-W1367 VanDerWaalsContact CA-O 3.23Å; P1318-W1367 WeakPolarHBondContact CA-O 3.31Å; P1318-M1379 HydrophobicContact CB-SD 4.32Å
1319	Y	96.6	Very high	88.6	Confident	8 Å²	8	45.4 Å²	45.4	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157.9	169.3	63.6	-90.3	0	0	0	110.7	K1321 K1335 I1338 Y1347 W1367 D1369	Y1319-K1321 HydrophobicContact CD2-CG 4.42Å; Y1319-K1321 HydrophobicContact CE2-CG 4.08Å; Y1319-K1335 HydrophobicContact CD2-CD 3.47Å; Y1319-K1335 VanDerWaalsContact CD2-CD 3.47Å; Y1319-K1335 HydrophobicContact CD2-CG 3.72Å; Y1319-K1335 HydrophobicContact CE2-CD 3.73Å; Y1319-K1335 HydrophobicContact CE2-CG 4.25Å; Y1319-K1335 HydrophobicContact CG-CD 4.29Å; Y1319-I1338 HydrophobicContact CD1-CD1 4.36Å; Y1319-I1338 HydrophobicContact CD1-CG1 4.05Å; Y1319-I1338 HydrophobicContact CG-CG1 4.29Å; Y1319-Y1347 WeakPolarHBondContact CA-OH 3.32Å; Y1319-Y1347 PolarHBondContact N-OH 2.84Å; Y1319-W1367 HydrophobicContact CD1-CB 4.24Å; Y1319-W1367 WeakPolarHBondContact CD1-O 3.12Å; Y1319-W1367 HydrophobicContact CD2-CB 4.13Å; Y1319-W1367 HydrophobicContact CE1-CB 3.72Å; Y1319-W1367 HydrophobicContact CE2-CB 3.63Å; Y1319-W1367 AromaticContact CE2-CG 3.98Å; Y1319-W1367 HydrophobicContact CE2-CG 3.98Å; Y1319-W1367 HydrophobicContact CG-CB 4.42Å; Y1319-W1367 AromaticContact CZ-CG 3.97Å; Y1319-W1367 PolarHBondContact N-O 2.75Å; Y1319-W1367 PolarHBondContact O-N 3.48Å; Y1319-D1369 HydrophobicContact CE1-CB 4.3Å
1320	V	97.8	Very high	89.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.1	-178.1	-170.6	0	0	0	0	109.2	I1285 V1300 V1322 K1335 T1336 Y1347 V1364 I1365 V1366	I1285-V1320 HydrophobicContact CD1-CB 4.49Å; I1285-V1320 HydrophobicContact CD1-CG1 3.94Å; I1285-V1320 HydrophobicContact CD1-CG2 3.69Å; V1300-V1320 HydrophobicContact CG1-CB 4.12Å; V1300-V1320 HydrophobicContact CG1-CG1 4.36Å; V1300-V1320 HydrophobicContact CG1-CG2 3.8Å; V1320-V1322 HydrophobicContact CG1-CG2 4.08Å; V1320-K1335 VanDerWaalsContact O-CA 3.27Å; V1320-K1335 WeakPolarHBondContact O-CA 3.25Å; V1320-K1335 WeakPolarHBondContact O-CG 3.34Å; V1320-T1336 HydrophobicContact CB-CG2 4.19Å; V1320-T1336 PolarHBondContact N-OG1 2.83Å; V1320-T1336 PolarHBondContact O-N 3.24Å; V1320-Y1347 HydrophobicContact CG2-CD2 4.11Å; V1320-Y1347 HydrophobicContact CG2-CE1 4.33Å; V1320-Y1347 HydrophobicContact CG2-CE2 3.48Å; V1320-Y1347 VanDerWaalsContact CG2-CE2 3.48Å; V1320-V1364 HydrophobicContact CG1-CG1 3.56Å; V1320-I1365 CarbonylContact C-O 3.59Å; V1320-I1365 WeakPolarHBondContact CA-O 3.15Å; V1320-V1366 HydrophobicContact CG2-CG2 4.37Å
1321	K	97.5	Very high	89.7	Confident	56 Å²	56	41.7 Å²	41.7	24%	0.243	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.1	162.5	-63.9	-179.8	-169.4	165.4	0	107.9	Y1319 Y1323 K1335 I1365	Y1319-K1321 HydrophobicContact CD2-CG 4.42Å; Y1319-K1321 HydrophobicContact CE2-CG 4.08Å; K1321-Y1323 HydrophobicContact CB-CD2 4.3Å; K1321-Y1323 HydrophobicContact CB-CE2 3.61Å; K1321-Y1323 HydrophobicContact CD-CE2 4.09Å; K1321-Y1323 WeakPolarHBondContact CD-OH 3.36Å; K1321-K1335 HydrophobicContact CG-CG 4.06Å; K1321-I1365 PolarHBondContact N-O 3.41Å; K1321-I1365 PolarHBondContact O-N 3.25Å
1322	V	97.6	Very high	90.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.8	174	-178.4	0	0	0	0	107.4	V1298 V1300 V1320 K1333 K1334 L1351 F1353 L1362 V1364	V1298-V1322 HydrophobicContact CG1-CG1 4.4Å; V1300-V1322 HydrophobicContact CG2-CG2 3.93Å; V1320-V1322 HydrophobicContact CG1-CG2 4.08Å; V1322-K1333 CarbonylContact O-C 3.57Å; V1322-K1333 VanDerWaalsContact O-CA 3.22Å; V1322-K1333 WeakPolarHBondContact O-CA 3.23Å; V1322-K1334 PolarHBondContact N-O 3.03Å; V1322-K1334 PolarHBondContact O-N 3.19Å; V1322-L1351 HydrophobicContact CB-CD1 4.27Å; V1322-L1351 HydrophobicContact CG2-CD1 3.86Å; V1322-F1353 HydrophobicContact CB-CZ 4.08Å; V1322-F1353 HydrophobicContact CG1-CE2 3.95Å; V1322-F1353 HydrophobicContact CG1-CZ 3.75Å; V1322-L1362 HydrophobicContact CG1-CD1 3.47Å; V1322-L1362 VanDerWaalsContact CG1-CD1 3.47Å; V1322-L1362 HydrophobicContact CG1-CD2 4.18Å; V1322-L1362 HydrophobicContact CG1-CG 3.83Å; V1322-V1364 HydrophobicContact CG1-CG2 4.46Å; V1322-V1364 HydrophobicContact CG2-CG1 4.45Å; V1322-V1364 HydrophobicContact CG2-CG2 4.45Å
1323	Y	97	Very high	91.6	Very high	46 Å²	46	44.6 Å²	44.6	18%	0.18	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.1	175.9	-55.6	-101.3	0	0	0	108.6	K1321 A1332 K1333 Q1363 I1365	K1321-Y1323 HydrophobicContact CB-CD2 4.3Å; K1321-Y1323 HydrophobicContact CB-CE2 3.61Å; K1321-Y1323 HydrophobicContact CD-CE2 4.09Å; K1321-Y1323 WeakPolarHBondContact CD-OH 3.36Å; Y1323-A1332 WeakPolarHBondContact CA-O 3.49Å; Y1323-K1333 HydrophobicContact CD1-CB 3.58Å; Y1323-K1333 HydrophobicContact CD1-CD 3.84Å; Y1323-K1333 HydrophobicContact CD1-CG 4.37Å; Y1323-K1333 HydrophobicContact CE1-CB 4.13Å; Y1323-K1333 HydrophobicContact CE1-CD 3.77Å; Y1323-K1333 HydrophobicContact CG-CB 4.2Å; Y1323-Q1363 PolarHBondContact N-O 2.83Å; Y1323-Q1363 PolarHBondContact O-N 3.07Å; Y1323-I1365 HydrophobicContact CD2-CD1 4.13Å; Y1323-I1365 HydrophobicContact CD2-CG1 4.22Å; Y1323-I1365 HydrophobicContact CE2-CD1 3.56Å; Y1323-I1365 HydrophobicContact CE2-CG1 3.91Å
1324	L	95.6	Very high	92.6	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.2	168.6	-169.7	61.5	0	0	0	107.4	L1296 I1331 A1332 F1353 E1355 K1360 L1362 L1386	L1296-L1324 HydrophobicContact CD2-CD1 3.93Å; L1324-I1331 HydrophobicContact CB-CG1 4.14Å; L1324-I1331 HydrophobicContact CD2-CD1 3.87Å; L1324-I1331 HydrophobicContact CD2-CG1 4.18Å; L1324-I1331 HydrophobicContact CG-CD1 3.96Å; L1324-I1331 HydrophobicContact CG-CG1 4.01Å; L1324-I1331 PolarHBondContact O-N 2.91Å; L1324-I1331 VanDerWaalsContact O-N 3.14Å; L1324-A1332 HydrophobicContact CB-CB 4.24Å; L1324-A1332 PolarHBondContact N-O 2.76Å; L1324-A1332 PolarHBondContact O-N 3.01Å; L1324-F1353 HydrophobicContact CB-CD1 4.36Å; L1324-F1353 HydrophobicContact CB-CE1 4.4Å; L1324-F1353 HydrophobicContact CD2-CB 4.43Å; L1324-E1355 HydrophobicContact CD2-CB 3.55Å; L1324-E1355 HydrophobicContact CD2-CG 4.03Å; L1324-K1360 HydrophobicContact CD1-CB 3.85Å; L1324-K1360 HydrophobicContact CD2-CD 4.32Å; L1324-K1360 HydrophobicContact CG-CB 4.36Å; L1324-K1360 HydrophobicContact CG-CD 4.4Å; L1324-L1362 HydrophobicContact CD1-CD1 4Å; L1324-L1386 HydrophobicContact CD1-CD1 3.47Å; L1324-L1386 VanDerWaalsContact CD1-CD1 3.47Å
1325	L	93.8	Very high	93.3	Very high	11 Å²	11	40.7 Å²	40.7	6%	0.058	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.6	-175.9	-51.1	179.9	0	0	0	110.2	A1329 C1330 K1360 V1361 Q1363 P1410	L1325-A1329 CarbonylContact C-O 3.44Å; L1325-A1329 VanDerWaalsContact CA-O 3.28Å; L1325-A1329 WeakPolarHBondContact CA-O 3.29Å; L1325-C1330 HydrophobicContact CD2-CB 3.71Å; L1325-K1360 CarbonylContact O-C 3.53Å; L1325-K1360 VanDerWaalsContact O-CA 3.22Å; L1325-K1360 WeakPolarHBondContact O-CA 3.48Å; L1325-K1360 VanDerWaalsContact O-CB 3.31Å; L1325-K1360 WeakPolarHBondContact O-CB 3.33Å; L1325-V1361 HydrophobicContact CB-CB 4.35Å; L1325-V1361 WeakPolarHBondContact CB-O 3.1Å; L1325-V1361 PolarHBondContact N-O 2.86Å; L1325-V1361 PolarHBondContact O-N 2.98Å; L1325-Q1363 HydrophobicContact CD1-CB 3.89Å; L1325-Q1363 HydrophobicContact CG-CB 4.36Å; L1325-P1410 HydrophobicContact CD1-CG 3.99Å
1326	E	90.6	Very high	93.7	Very high	76 Å²	76	38.2 Å²	38.2	36%	0.355	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	117.9	176.6	-172.2	169.4	-126.7	0	0	107	G1328 A1329 I1331 K1360	E1326-G1328 PolarHBondContact O-N 2.85Å; E1326-G1328 VanDerWaalsContact O-N 3.13Å; E1326-A1329 PolarHBondContact N-O 3.06Å; E1326-A1329 WeakPolarHBondContact O-CA 3.31Å; E1326-A1329 WeakPolarHBondContact O-CB 3.38Å; E1326-A1329 PolarHBondContact O-N 2.62Å; E1326-I1331 HydrophobicContact CB-CD1 4.27Å; E1326-I1331 HydrophobicContact CB-CG2 3.93Å; E1326-K1360 HydrophobicContact CB-CG 3.98Å; E1326-K1360 HydrophobicContact CG-CG 4.13Å; E1326-K1360 WeakPolarHBondContact OE1-CE 3.49Å; E1326-K1360 IonicContact OE1-NZ 3.38Å
1327	N	84.1	Confident	93.9	Very high	124 Å²	124	47.8 Å²	47.8	66%	0.663	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.8	42.9	-174.2	-58	-29	0	0	0	113.4	A1329	N1327-A1329 PolarHBondContact O-N 2.79Å
1328	G	82.1	Confident	93.9	Very high	34 Å²	34	50.9 Å²	50.9	35%	0.351	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	-16.3	-175.5	0	0	0	0	0	116.1	E1326	E1326-G1328 PolarHBondContact O-N 2.85Å; E1326-G1328 VanDerWaalsContact O-N 3.13Å
1329	A	87.5	Confident	93.8	Very high	35 Å²	35	51.5 Å²	51.5	29%	0.289	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	132.9	177.9	0	0	0	0	0	111.9	L1325 E1326 N1327 I1331	L1325-A1329 CarbonylContact C-O 3.44Å; L1325-A1329 VanDerWaalsContact CA-O 3.28Å; L1325-A1329 WeakPolarHBondContact CA-O 3.29Å; E1326-A1329 PolarHBondContact N-O 3.06Å; E1326-A1329 WeakPolarHBondContact O-CA 3.31Å; E1326-A1329 WeakPolarHBondContact O-CB 3.38Å; E1326-A1329 PolarHBondContact O-N 2.62Å; N1327-A1329 PolarHBondContact O-N 2.79Å; A1329-I1331 PolarHBondContact O-N 2.7Å
1330	C	92.5	Very high	93.4	Very high	31 Å²	31	62.3 Å²	62.3	21%	0.209	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	103	176.3	176.7	0	0	0	0	111.5	T1208 L1325 A1332	T1208-C1330 PolarHBondContact OG1-O 3.12Å; L1325-C1330 HydrophobicContact CD2-CB 3.71Å; C1330-A1332 PolarHBondContact SG-O 2.85Å; C1330-A1332 VanDerWaalsContact SG-O 3.4Å
1331	I	92.4	Very high	93.1	Very high	48 Å²	48	68.9 Å²	68.9	25%	0.246	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-45.5	176.5	61.9	178.1	0	0	0	111.4	L1324 E1326 A1329 E1355 K1360	L1324-I1331 HydrophobicContact CB-CG1 4.14Å; L1324-I1331 HydrophobicContact CD2-CD1 3.87Å; L1324-I1331 HydrophobicContact CD2-CG1 4.18Å; L1324-I1331 HydrophobicContact CG-CD1 3.96Å; L1324-I1331 HydrophobicContact CG-CG1 4.01Å; L1324-I1331 PolarHBondContact O-N 2.91Å; L1324-I1331 VanDerWaalsContact O-N 3.14Å; E1326-I1331 HydrophobicContact CB-CD1 4.27Å; E1326-I1331 HydrophobicContact CB-CG2 3.93Å; A1329-I1331 PolarHBondContact O-N 2.7Å; I1331-E1355 HydrophobicContact CD1-CG 4.21Å; I1331-K1360 HydrophobicContact CD1-CD 3.76Å; I1331-K1360 VanDerWaalsContact CD1-CE 3.46Å; I1331-K1360 HydrophobicContact CD1-CG 4.25Å
1332	A	94.6	Very high	92.9	Very high	21 Å²	21	68.1 Å²	68.1	17%	0.174	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.8	-175.7	0	0	0	0	0	113	Y1323 L1324 C1330 F1353 E1355	Y1323-A1332 WeakPolarHBondContact CA-O 3.49Å; L1324-A1332 HydrophobicContact CB-CB 4.24Å; L1324-A1332 PolarHBondContact N-O 2.76Å; L1324-A1332 PolarHBondContact O-N 3.01Å; C1330-A1332 PolarHBondContact SG-O 2.85Å; C1330-A1332 VanDerWaalsContact SG-O 3.4Å; A1332-F1353 HydrophobicContact CB-CD1 3.63Å; A1332-F1353 HydrophobicContact CB-CE1 4Å; A1332-E1355 HydrophobicContact CB-CG 4.37Å
1333	K	96.2	Very high	92.7	Very high	120 Å²	120	70.2 Å²	70.2	52%	0.522	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	137.4	177.1	60.8	-162.4	168.8	-149.9	0	113.2	V1322 Y1323	V1322-K1333 CarbonylContact O-C 3.57Å; V1322-K1333 VanDerWaalsContact O-CA 3.22Å; V1322-K1333 WeakPolarHBondContact O-CA 3.23Å; Y1323-K1333 HydrophobicContact CD1-CB 3.58Å; Y1323-K1333 HydrophobicContact CD1-CD 3.84Å; Y1323-K1333 HydrophobicContact CD1-CG 4.37Å; Y1323-K1333 HydrophobicContact CE1-CB 4.13Å; Y1323-K1333 HydrophobicContact CE1-CD 3.77Å; Y1323-K1333 HydrophobicContact CG-CB 4.2Å
1334	K	97.1	Very high	92.7	Very high	78 Å²	78	72.4 Å²	72.4	34%	0.339	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	167.4	176.1	-62.8	-164.2	178.8	-165.9	0	110.3	V1322 L1351 V1352 F1353 D1354	V1322-K1334 PolarHBondContact N-O 3.03Å; V1322-K1334 PolarHBondContact O-N 3.19Å; K1334-L1351 HydrophobicContact CB-CB 4.14Å; K1334-L1351 HydrophobicContact CB-CD1 4.11Å; K1334-L1351 HydrophobicContact CB-CD2 4.2Å; K1334-L1351 HydrophobicContact CB-CG 4.39Å; K1334-L1351 HydrophobicContact CD-CB 4.41Å; K1334-V1352 VanDerWaalsContact CD-O 3.31Å; K1334-V1352 WeakPolarHBondContact CD-O 3.15Å; K1334-V1352 WeakPolarHBondContact CE-O 3.48Å; K1334-V1352 PolarHBondContact NZ-O 3.23Å; K1334-F1353 HydrophobicContact CB-CE1 4.26Å; K1334-F1353 HydrophobicContact CB-CZ 3.89Å; K1334-F1353 HydrophobicContact CD-CE1 4.44Å; K1334-F1353 HydrophobicContact CD-CZ 4.49Å; K1334-F1353 HydrophobicContact CG-CD1 4.4Å; K1334-F1353 HydrophobicContact CG-CE1 3.85Å; K1334-F1353 HydrophobicContact CG-CZ 3.95Å; K1334-D1354 IonicContact NZ-OD2 3.06Å
1335	K	96.7	Very high	92.8	Very high	92 Å²	92	72.5 Å²	72.5	40%	0.4	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	138.5	-174.8	-168.2	-158.5	124.6	144	0	110.6	Y1319 V1320 K1321	Y1319-K1335 HydrophobicContact CD2-CD 3.47Å; Y1319-K1335 VanDerWaalsContact CD2-CD 3.47Å; Y1319-K1335 HydrophobicContact CD2-CG 3.72Å; Y1319-K1335 HydrophobicContact CE2-CD 3.73Å; Y1319-K1335 HydrophobicContact CE2-CG 4.25Å; Y1319-K1335 HydrophobicContact CG-CD 4.29Å; V1320-K1335 VanDerWaalsContact O-CA 3.27Å; V1320-K1335 WeakPolarHBondContact O-CA 3.25Å; V1320-K1335 WeakPolarHBondContact O-CG 3.34Å; K1321-K1335 HydrophobicContact CG-CG 4.06Å
1336	T	97.3	Very high	92.9	Very high	3 Å²	3	77 Å²	77	2%	0.018	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-73	162.1	171.6	60.6	0	0	0	0	113.3	V1300 V1320 Y1347 Q1349 L1351	V1300-T1336 HydrophobicContact CB-CG2 3.63Å; V1300-T1336 HydrophobicContact CG1-CG2 3.75Å; V1300-T1336 HydrophobicContact CG2-CG2 3.83Å; V1320-T1336 HydrophobicContact CB-CG2 4.19Å; V1320-T1336 PolarHBondContact N-OG1 2.83Å; V1320-T1336 PolarHBondContact O-N 3.24Å; T1336-Y1347 HydrophobicContact CG2-CD1 4.27Å; T1336-Y1347 HydrophobicContact CG2-CG 4.36Å; T1336-Y1347 WeakPolarHBondContact OG1-CE1 3.39Å; T1336-Q1349 HydrophobicContact CG2-CB 4.29Å; T1336-L1351 HydrophobicContact CG2-CD1 4.3Å
1337	R	94.8	Very high	93.2	Very high	201 Å²	201	74 Å²	74	76%	0.758	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-58.3	149.7	161.5	-61.6	172.9	-175.8	-164.3	1.9	109.7
1338	I	94.2	Very high	93.7	Very high	84 Å²	84	74.2 Å²	74.2	43%	0.431	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-77.7	125.3	-179.3	-53.4	178.2	0	0	0	109.6	A1317 Y1319	A1317-I1338 HydrophobicContact CB-CG2 3.64Å; A1317-I1338 WeakPolarHBondContact O-CG2 3.48Å; Y1319-I1338 HydrophobicContact CD1-CD1 4.36Å; Y1319-I1338 HydrophobicContact CD1-CG1 4.05Å; Y1319-I1338 HydrophobicContact CG-CG1 4.29Å
1339	A	94.2	Very high	94.4	Very high	14 Å²	14	74.5 Å²	74.5	12%	0.116	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-77.1	147.8	175	0	0	0	0	0	111.1	A1317 P1318 K1341 T1342 P1345 Y1347	A1317-A1339 CarbonylContact C-O 3.54Å; A1317-A1339 VanDerWaalsContact CA-O 3.26Å; A1317-A1339 WeakPolarHBondContact CA-O 3.28Å; A1317-A1339 WeakPolarHBondContact CB-O 3.05Å; P1318-A1339 HydrophobicContact CG-CB 4.17Å; P1318-A1339 PolarHBondContact O-N 2.81Å; A1339-K1341 PolarHBondContact O-N 2.76Å; A1339-T1342 HydrophobicContact CB-CG2 4.28Å; A1339-P1345 HydrophobicContact CB-CB 3.44Å; A1339-P1345 VanDerWaalsContact CB-CB 3.44Å; A1339-Y1347 HydrophobicContact CB-CD1 4.49Å; A1339-Y1347 HydrophobicContact CB-CE1 3.94Å
1340	R	89	Confident	94.8	Very high	235 Å²	235	76 Å²	76	89%	0.887	36%	0.359	S	S	*	.	S	Bend	trans	-83	100	-171.3	-66.5	-179.7	179.1	176.1	0.1	111.8	T1342	R1340-T1342 PolarHBondContact O-N 2.87Å
1341	K	89.8	Confident	95	Very high	137 Å²	137	75.3 Å²	75.3	60%	0.596	35%	0.353	S	S	*	.	S	Bend	trans	51.7	48	159.7	-77.9	-162.2	169.8	-171.1	0	115.5	T1315 P1316 A1339	T1315-K1341 WeakPolarHBondContact CB-O 2.94Å; T1315-K1341 WeakPolarHBondContact OG1-CB 3.15Å; T1315-K1341 PolarHBondContact OG1-O 2.8Å; P1316-K1341 CarbonylContact O-C 3.48Å; P1316-K1341 WeakPolarHBondContact O-CA 3.27Å; A1339-K1341 PolarHBondContact O-N 2.76Å
1342	T	94	Very high	95.2	Very high	40 Å²	40	75.3 Å²	75.3	25%	0.245	36%	0.355	C	S	.	.			trans	-136.9	153.6	-173.6	-179	0	0	0	0	111.8	P1316 P1318 A1339 R1340 D1344 P1345	P1316-T1342 PolarHBondContact O-N 2.79Å; P1316-T1342 VanDerWaalsContact O-N 3.08Å; P1318-T1342 VanDerWaalsContact CD-O 3.27Å; P1318-T1342 WeakPolarHBondContact CD-O 3.39Å; P1318-T1342 WeakPolarHBondContact CG-O 3.37Å; A1339-T1342 HydrophobicContact CB-CG2 4.28Å; R1340-T1342 PolarHBondContact O-N 2.87Å; T1342-D1344 PolarHBondContact OG1-N 3.31Å; T1342-D1344 PolarHBondContact OG1-O 3.22Å; T1342-P1345 HydrophobicContact CG2-CB 3.9Å
1343	L	94.4	Very high	95.2	Very high	44 Å²	44	74.3 Å²	74.3	23%	0.23	35%	0.347	C	S	.	.	S	Bend	trans	-92.8	-11.1	169.2	-56.3	-178.7	0	0	0	112.4	L1306 Q1308 P1316 P1345 M1379	L1306-L1343 HydrophobicContact CB-CB 4.38Å; L1306-L1343 VanDerWaalsContact CB-O 3.24Å; L1306-L1343 WeakPolarHBondContact CB-O 3.43Å; L1306-L1343 WeakPolarHBondContact CD1-O 3.41Å; L1306-L1343 WeakPolarHBondContact CG-O 3.42Å; L1306-L1343 PolarHBondContact N-O 2.8Å; Q1308-L1343 HydrophobicContact CB-CD1 4.14Å; Q1308-L1343 HydrophobicContact CB-CD2 4.02Å; P1316-L1343 HydrophobicContact CG-CD2 3.55Å; L1343-P1345 VanDerWaalsContact O-CD 3.27Å; L1343-P1345 WeakPolarHBondContact O-CD 3.3Å; L1343-M1379 HydrophobicContact CD2-CE 4.25Å
1344	D	96.3	Very high	95.1	Very high	93 Å²	93	74.2 Å²	74.2	50%	0.497	35%	0.352	S	S	.	.	S	Bend	trans	-122	71.7	179.2	-54.4	-81	0	0	0	109.3	A1303 R1304 S1305 T1342	A1303-D1344 CarbonylContact O-C 3.35Å; A1303-D1344 WeakPolarHBondContact O-CA 3.07Å; R1304-D1344 WeakPolarHBondContact CA-OD1 3.4Å; S1305-D1344 PolarHBondContact N-OD1 2.71Å; T1342-D1344 PolarHBondContact OG1-N 3.31Å; T1342-D1344 PolarHBondContact OG1-O 3.22Å
1345	P	96.6	Very high	94.8	Very high	1 Å²	1	73.6 Å²	73.6	1%	0.006	35%	0.35	C	S	.	.			trans	-79.4	123.6	-174.7	31.4	-36.9	0	0	0	112.8	R1302 A1303 L1306 P1318 A1339 T1342 L1343 Y1347	R1302-P1345 CarbonylContact C-O 3.53Å; R1302-P1345 WeakPolarHBondContact CA-O 3.43Å; R1302-P1345 WeakPolarHBondContact CB-O 3.04Å; A1303-P1345 HydrophobicContact CB-CG 3.87Å; A1303-P1345 PolarHBondContact N-O 3.32Å; A1303-P1345 WeakPolarHBondContact O-CD 3.49Å; L1306-P1345 HydrophobicContact CD1-CG 3.81Å; P1318-P1345 HydrophobicContact CB-CG 4.38Å; P1318-P1345 HydrophobicContact CG-CB 3.66Å; P1318-P1345 HydrophobicContact CG-CG 3.64Å; A1339-P1345 HydrophobicContact CB-CB 3.44Å; A1339-P1345 VanDerWaalsContact CB-CB 3.44Å; T1342-P1345 HydrophobicContact CG2-CB 3.9Å; L1343-P1345 VanDerWaalsContact O-CD 3.27Å; L1343-P1345 WeakPolarHBondContact O-CD 3.3Å; P1345-Y1347 HydrophobicContact CB-CD2 4.42Å; P1345-Y1347 HydrophobicContact CB-CE1 4.16Å; P1345-Y1347 HydrophobicContact CB-CE2 3.75Å; P1345-Y1347 HydrophobicContact CG-CD2 4.48Å; P1345-Y1347 HydrophobicContact CG-CE2 3.53Å; P1345-Y1347 WeakPolarHBondContact CG-OH 3.1Å
1346	L	96.5	Very high	94.4	Very high	106 Å²	106	71.3 Å²	71.3	56%	0.555	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	129.8	161.7	-171.1	62.8	0	0	0	109.4	R1302 Q1348	R1302-L1346 HydrophobicContact CB-CD1 4.07Å; L1346-Q1348 HydrophobicContact CD1-CG 3.74Å; L1346-Q1348 HydrophobicContact CG-CG 4.05Å
1347	Y	96.5	Very high	94	Very high	12 Å²	12	71.6 Å²	71.6	5%	0.047	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	-50	-178.8	-65.5	-71.7	0	0	0	112.5	V1300 I1301 P1318 Y1319 V1320 T1336 A1339 P1345 Q1349	V1300-Y1347 HydrophobicContact CG1-CD2 3.76Å; V1300-Y1347 HydrophobicContact CG1-CE2 4.44Å; V1300-Y1347 HydrophobicContact CG1-CG 4.09Å; V1300-Y1347 VanDerWaalsContact O-CB 3.28Å; V1300-Y1347 WeakPolarHBondContact O-CB 3.41Å; I1301-Y1347 PolarHBondContact O-N 3.45Å; P1318-Y1347 PolarHBondContact O-OH 3.3Å; Y1319-Y1347 WeakPolarHBondContact CA-OH 3.32Å; Y1319-Y1347 PolarHBondContact N-OH 2.84Å; V1320-Y1347 HydrophobicContact CG2-CD2 4.11Å; V1320-Y1347 HydrophobicContact CG2-CE1 4.33Å; V1320-Y1347 HydrophobicContact CG2-CE2 3.48Å; V1320-Y1347 VanDerWaalsContact CG2-CE2 3.48Å; T1336-Y1347 HydrophobicContact CG2-CD1 4.27Å; T1336-Y1347 HydrophobicContact CG2-CG 4.36Å; T1336-Y1347 WeakPolarHBondContact OG1-CE1 3.39Å; A1339-Y1347 HydrophobicContact CB-CD1 4.49Å; A1339-Y1347 HydrophobicContact CB-CE1 3.94Å; P1345-Y1347 HydrophobicContact CB-CD2 4.42Å; P1345-Y1347 HydrophobicContact CB-CE1 4.16Å; P1345-Y1347 HydrophobicContact CB-CE2 3.75Å; P1345-Y1347 HydrophobicContact CG-CD2 4.48Å; P1345-Y1347 HydrophobicContact CG-CE2 3.53Å; P1345-Y1347 WeakPolarHBondContact CG-OH 3.1Å; Y1347-Q1349 WeakPolarHBondContact O-CG 3.22Å; Y1347-Q1349 PolarHBondContact O-N 2.95Å; Y1347-Q1349 PolarHBondContact O-NE2 2.77Å
1348	Q	96	Very high	93.6	Very high	130 Å²	130	69 Å²	69	61%	0.607	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	44.6	61.8	-178	-64.2	177.3	-68.1	0	0	112.5	V1300 I1301 L1346	V1300-Q1348 PolarHBondContact O-N 3.21Å; V1300-Q1348 VanDerWaalsContact O-N 3.08Å; I1301-Q1348 PolarHBondContact O-N 3.04Å; L1346-Q1348 HydrophobicContact CD1-CG 3.74Å; L1346-Q1348 HydrophobicContact CG-CG 4.05Å
1349	Q	96.2	Very high	93.1	Very high	40 Å²	40	66.7 Å²	66.7	19%	0.187	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	106.9	-170.8	-87.2	160.9	73.7	0	0	112.5	V1300 T1336 Y1347	V1300-Q1349 PolarHBondContact N-O 2.86Å; V1300-Q1349 PolarHBondContact O-N 2.92Å; T1336-Q1349 HydrophobicContact CG2-CB 4.29Å; Y1347-Q1349 WeakPolarHBondContact O-CG 3.22Å; Y1347-Q1349 PolarHBondContact O-N 2.95Å; Y1347-Q1349 PolarHBondContact O-NE2 2.77Å
1350	S	96.3	Very high	93.1	Very high	66 Å²	66	66.3 Å²	66.3	46%	0.462	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	131.1	163.8	-59.5	0	0	0	0	112.6	E1297 V1298	E1297-S1350 WeakPolarHBondContact OE1-CB 3.38Å; E1297-S1350 PolarHBondContact OE1-OG 2.99Å; V1298-S1350 CarbonylContact O-C 3.59Å
1351	L	96.5	Very high	93.3	Very high	17 Å²	17	55.3 Å²	55.3	9%	0.089	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	81.5	173.4	-56.7	179.3	0	0	0	107.8	V1298 V1300 V1322 K1334 T1336 F1353	V1298-L1351 PolarHBondContact N-O 3.43Å; V1298-L1351 WeakPolarHBondContact O-CB 3.42Å; V1298-L1351 PolarHBondContact O-N 3.1Å; V1300-L1351 HydrophobicContact CG2-CD1 3.74Å; V1300-L1351 HydrophobicContact CG2-CG 4.39Å; V1322-L1351 HydrophobicContact CB-CD1 4.27Å; V1322-L1351 HydrophobicContact CG2-CD1 3.86Å; K1334-L1351 HydrophobicContact CB-CB 4.14Å; K1334-L1351 HydrophobicContact CB-CD1 4.11Å; K1334-L1351 HydrophobicContact CB-CD2 4.2Å; K1334-L1351 HydrophobicContact CB-CG 4.39Å; K1334-L1351 HydrophobicContact CD-CB 4.41Å; T1336-L1351 HydrophobicContact CG2-CD1 4.3Å; L1351-F1353 HydrophobicContact CB-CE2 4.17Å; L1351-F1353 WeakPolarHBondContact O-CD2 3.36Å; L1351-F1353 VanDerWaalsContact O-CE2 3.3Å; L1351-F1353 WeakPolarHBondContact O-CE2 3.31Å
1352	V	96.1	Very high	93.6	Very high	48 Å²	48	48.8 Å²	48.8	29%	0.291	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	132	174.8	-176.6	0	0	0	0	109.9	Q1295 L1296 E1297 K1334	Q1295-V1352 HydrophobicContact CB-CG1 4.06Å; L1296-V1352 CarbonylContact O-C 3.53Å; E1297-V1352 HydrophobicContact CB-CG2 4.22Å; E1297-V1352 HydrophobicContact CG-CG2 3.93Å; K1334-V1352 VanDerWaalsContact CD-O 3.31Å; K1334-V1352 WeakPolarHBondContact CD-O 3.15Å; K1334-V1352 WeakPolarHBondContact CE-O 3.48Å; K1334-V1352 PolarHBondContact NZ-O 3.23Å
1353	F	95.3	Very high	93.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.7	171.8	-70.1	-97.6	0	0	0	109.2	Q1295 L1296 V1298 V1322 L1324 A1332 K1334 L1351 E1355	Q1295-F1353 CarbonylContact C-O 3.51Å; Q1295-F1353 VanDerWaalsContact CA-O 3.26Å; Q1295-F1353 WeakPolarHBondContact CA-O 3.27Å; Q1295-F1353 WeakPolarHBondContact CB-O 3.14Å; L1296-F1353 HydrophobicContact CB-CB 4.35Å; L1296-F1353 PolarHBondContact N-O 2.78Å; L1296-F1353 PolarHBondContact O-N 3.01Å; V1298-F1353 HydrophobicContact CB-CE2 4.22Å; V1298-F1353 HydrophobicContact CG2-CD2 3.9Å; V1298-F1353 HydrophobicContact CG2-CE2 3.77Å; V1322-F1353 HydrophobicContact CB-CZ 4.08Å; V1322-F1353 HydrophobicContact CG1-CE2 3.95Å; V1322-F1353 HydrophobicContact CG1-CZ 3.75Å; L1324-F1353 HydrophobicContact CB-CD1 4.36Å; L1324-F1353 HydrophobicContact CB-CE1 4.4Å; L1324-F1353 HydrophobicContact CD2-CB 4.43Å; A1332-F1353 HydrophobicContact CB-CD1 3.63Å; A1332-F1353 HydrophobicContact CB-CE1 4Å; K1334-F1353 HydrophobicContact CB-CE1 4.26Å; K1334-F1353 HydrophobicContact CB-CZ 3.89Å; K1334-F1353 HydrophobicContact CD-CE1 4.44Å; K1334-F1353 HydrophobicContact CD-CZ 4.49Å; K1334-F1353 HydrophobicContact CG-CD1 4.4Å; K1334-F1353 HydrophobicContact CG-CE1 3.85Å; K1334-F1353 HydrophobicContact CG-CZ 3.95Å; L1351-F1353 HydrophobicContact CB-CE2 4.17Å; L1351-F1353 WeakPolarHBondContact O-CD2 3.36Å; L1351-F1353 VanDerWaalsContact O-CE2 3.3Å; L1351-F1353 WeakPolarHBondContact O-CE2 3.31Å; F1353-E1355 HydrophobicContact CB-CB 4.36Å; F1353-E1355 PolarHBondContact O-N 2.99Å
1354	D	93.3	Very high	93.9	Very high	118 Å²	118	46.3 Å²	46.3	63%	0.631	25%	0.252	S	S	*	.	S	Bend	trans	-78.9	42.7	-178.2	-45.6	-89.9	0	0	0	111.2	K1334	K1334-D1354 IonicContact NZ-OD2 3.06Å
1355	E	90.2	Very high	93.9	Very high	65 Å²	65	42.7 Å²	42.7	30%	0.304	23%	0.232	S	C	.	.	S	Bend	trans	-147.1	138.8	-163.8	-74.1	-71.3	165.7	0	0	109.7	G1294 L1296 L1324 I1331 A1332 F1353 K1360	G1294-E1355 CarbonylContact O-C 3.55Å; L1296-E1355 PolarHBondContact N-O 3.15Å; L1324-E1355 HydrophobicContact CD2-CB 3.55Å; L1324-E1355 HydrophobicContact CD2-CG 4.03Å; I1331-E1355 HydrophobicContact CD1-CG 4.21Å; A1332-E1355 HydrophobicContact CB-CG 4.37Å; F1353-E1355 HydrophobicContact CB-CB 4.36Å; F1353-E1355 PolarHBondContact O-N 2.99Å; E1355-K1360 IonicContact OE2-NZ 3.47Å; E1355-K1360 PolarHBondContact OE2-NZ 3.24Å
1356	S	88.2	Confident	93.9	Very high	43 Å²	43	42.6 Å²	42.6	30%	0.301	23%	0.232	S	C	.	.			trans	-65.6	153.2	169.5	59.2	0	0	0	0	111.6	K1360	S1356-K1360 WeakPolarHBondContact O-CD 3.29Å; S1356-K1360 PolarHBondContact O-NZ 2.89Å; S1356-K1360 VanDerWaalsContact O-NZ 3.08Å; S1356-K1360 PolarHBondContact OG-NZ 3.09Å
1357	P	89.6	Confident	93.8	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.058	22%	0.216	C	C	.	.			trans	-83.9	-16.9	177.6	32.7	-36.5	0	0	0	114.8	D1291 L1296 K1360 L1386 L1391	D1291-P1357 HydrophobicContact CB-CG 4.14Å; D1291-P1357 WeakPolarHBondContact OD2-CD 3.36Å; D1291-P1357 WeakPolarHBondContact OD2-CG 3.29Å; L1296-P1357 HydrophobicContact CD1-CB 4.37Å; P1357-K1360 PolarHBondContact O-N 2.97Å; P1357-L1386 HydrophobicContact CB-CB 4.03Å; P1357-L1386 HydrophobicContact CB-CD1 4.07Å; P1357-L1386 WeakPolarHBondContact O-CB 3.42Å; P1357-L1391 HydrophobicContact CB-CD1 3.51Å; P1357-L1391 HydrophobicContact CG-CD1 3.88Å
1358	Q	85.8	Confident	93.7	Very high	148 Å²	148	39.7 Å²	39.7	69%	0.692	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	137.2	-172.8	-66.6	171.1	-21.5	0	0	112.2	K1360	Q1358-K1360 WeakPolarHBondContact O-CD 3.21Å; Q1358-K1360 WeakPolarHBondContact O-CG 3.49Å; Q1358-K1360 PolarHBondContact O-N 2.71Å; Q1358-K1360 VanDerWaalsContact O-N 3.17Å
1359	G	85.3	Confident	93.4	Very high	35 Å²	35	35.2 Å²	35.2	36%	0.361	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	8.9	179.1	0	0	0	0	0	115.9	E1387	G1359-E1387 WeakPolarHBondContact CA-OE2 3.42Å
1360	K	92.4	Very high	93	Very high	5 Å²	5	34.1 Å²	34.1	2%	0.022	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	149.9	-168.2	-70.4	153.2	-175.8	-176	0	113.2	L1324 L1325 E1326 I1331 E1355 S1356 P1357 Q1358 L1386	L1324-K1360 HydrophobicContact CD1-CB 3.85Å; L1324-K1360 HydrophobicContact CD2-CD 4.32Å; L1324-K1360 HydrophobicContact CG-CB 4.36Å; L1324-K1360 HydrophobicContact CG-CD 4.4Å; L1325-K1360 CarbonylContact O-C 3.53Å; L1325-K1360 VanDerWaalsContact O-CA 3.22Å; L1325-K1360 WeakPolarHBondContact O-CA 3.48Å; L1325-K1360 VanDerWaalsContact O-CB 3.31Å; L1325-K1360 WeakPolarHBondContact O-CB 3.33Å; E1326-K1360 HydrophobicContact CB-CG 3.98Å; E1326-K1360 HydrophobicContact CG-CG 4.13Å; E1326-K1360 WeakPolarHBondContact OE1-CE 3.49Å; E1326-K1360 IonicContact OE1-NZ 3.38Å; I1331-K1360 HydrophobicContact CD1-CD 3.76Å; I1331-K1360 VanDerWaalsContact CD1-CE 3.46Å; I1331-K1360 HydrophobicContact CD1-CG 4.25Å; E1355-K1360 IonicContact OE2-NZ 3.47Å; E1355-K1360 PolarHBondContact OE2-NZ 3.24Å; S1356-K1360 WeakPolarHBondContact O-CD 3.29Å; S1356-K1360 PolarHBondContact O-NZ 2.89Å; S1356-K1360 VanDerWaalsContact O-NZ 3.08Å; S1356-K1360 PolarHBondContact OG-NZ 3.09Å; P1357-K1360 PolarHBondContact O-N 2.97Å; Q1358-K1360 WeakPolarHBondContact O-CD 3.21Å; Q1358-K1360 WeakPolarHBondContact O-CG 3.49Å; Q1358-K1360 PolarHBondContact O-N 2.71Å; Q1358-K1360 VanDerWaalsContact O-N 3.17Å; K1360-L1386 HydrophobicContact CB-CD1 4.23Å; K1360-L1386 WeakPolarHBondContact O-CB 3.08Å; K1360-L1386 PolarHBondContact O-N 3.02Å
1361	V	94.6	Very high	92.2	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.6	177.6	174.2	0	0	0	0	109.6	L1271 L1325 Q1383 I1384 L1385 P1410	L1271-V1361 HydrophobicContact CD1-CG1 4.02Å; L1271-V1361 HydrophobicContact CD1-CG2 4.02Å; L1325-V1361 HydrophobicContact CB-CB 4.35Å; L1325-V1361 WeakPolarHBondContact CB-O 3.1Å; L1325-V1361 PolarHBondContact N-O 2.86Å; L1325-V1361 PolarHBondContact O-N 2.98Å; V1361-Q1383 HydrophobicContact CG1-CB 4.13Å; V1361-Q1383 HydrophobicContact CG1-CG 4.29Å; V1361-I1384 CarbonylContact C-O 3.51Å; V1361-I1384 WeakPolarHBondContact CA-O 3.02Å; V1361-L1385 HydrophobicContact CG2-CD1 3.88Å; V1361-P1410 HydrophobicContact CG2-CB 4.45Å
1362	L	95.9	Very high	90.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.1	174.5	-162.2	72	0	0	0	109.9	M1289 L1296 V1298 V1322 L1324 V1364 Q1383 I1384 L1386	M1289-L1362 HydrophobicContact CG-CD2 4.17Å; M1289-L1362 HydrophobicContact SD-CD2 3.62Å; L1296-L1362 HydrophobicContact CD2-CD1 4.04Å; V1298-L1362 HydrophobicContact CG1-CD2 3.93Å; V1298-L1362 HydrophobicContact CG2-CD1 4.14Å; V1298-L1362 HydrophobicContact CG2-CD2 3.78Å; V1322-L1362 HydrophobicContact CG1-CD1 3.47Å; V1322-L1362 VanDerWaalsContact CG1-CD1 3.47Å; V1322-L1362 HydrophobicContact CG1-CD2 4.18Å; V1322-L1362 HydrophobicContact CG1-CG 3.83Å; L1324-L1362 HydrophobicContact CD1-CD1 4Å; L1362-V1364 HydrophobicContact CD2-CG2 4.29Å; L1362-V1364 HydrophobicContact CG-CG2 4.29Å; L1362-Q1383 CarbonylContact O-C 3.55Å; L1362-Q1383 WeakPolarHBondContact O-CA 3.44Å; L1362-I1384 HydrophobicContact CB-CB 4.32Å; L1362-I1384 PolarHBondContact N-O 3.48Å; L1362-I1384 PolarHBondContact O-N 2.85Å; L1362-L1386 HydrophobicContact CB-CD1 4.25Å; L1362-L1386 HydrophobicContact CB-CD2 4.01Å; L1362-L1386 HydrophobicContact CB-CG 4.16Å; L1362-L1386 HydrophobicContact CD2-CD2 4.46Å
1363	Q	96.1	Very high	89.1	Confident	31 Å²	31	51.1 Å²	51.1	15%	0.145	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	118.2	176.4	-171.8	-178.3	83.4	0	0	110.7	Y1323 L1325 I1365 V1381 A1382 Q1383	Y1323-Q1363 PolarHBondContact N-O 2.83Å; Y1323-Q1363 PolarHBondContact O-N 3.07Å; L1325-Q1363 HydrophobicContact CD1-CB 3.89Å; L1325-Q1363 HydrophobicContact CG-CB 4.36Å; Q1363-I1365 HydrophobicContact CG-CG1 4.23Å; Q1363-V1381 HydrophobicContact CG-CG2 3.61Å; Q1363-A1382 WeakPolarHBondContact CA-O 3.03Å; Q1363-Q1383 HydrophobicContact CB-CG 4.38Å; Q1363-Q1383 HydrophobicContact CG-CG 4.11Å
1364	V	97.2	Very high	87.6	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	112	-173.2	-177.5	0	0	0	0	109.1	I1285 I1287 V1320 V1322 L1362 V1381 A1382 I1384	I1285-V1364 HydrophobicContact CD1-CG1 3.83Å; I1285-V1364 HydrophobicContact CG2-CG1 4.41Å; I1287-V1364 HydrophobicContact CD1-CG1 4.07Å; I1287-V1364 HydrophobicContact CG1-CG1 4.47Å; V1320-V1364 HydrophobicContact CG1-CG1 3.56Å; V1322-V1364 HydrophobicContact CG1-CG2 4.46Å; V1322-V1364 HydrophobicContact CG2-CG1 4.45Å; V1322-V1364 HydrophobicContact CG2-CG2 4.45Å; L1362-V1364 HydrophobicContact CD2-CG2 4.29Å; L1362-V1364 HydrophobicContact CG-CG2 4.29Å; V1364-V1381 CarbonylContact O-C 3.59Å; V1364-V1381 VanDerWaalsContact O-CA 3.3Å; V1364-V1381 WeakPolarHBondContact O-CA 3.28Å; V1364-A1382 PolarHBondContact N-O 3.03Å; V1364-A1382 PolarHBondContact O-N 2.78Å; V1364-I1384 HydrophobicContact CG2-CD1 4.42Å
1365	I	96.8	Very high	86.7	Confident	16 Å²	16	54.4 Å²	54.4	8%	0.082	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.5	-176	-42.6	-173.3	0	0	0	111.7	V1320 K1321 Y1323 Q1363 W1367 F1378 V1381	V1320-I1365 CarbonylContact C-O 3.59Å; V1320-I1365 WeakPolarHBondContact CA-O 3.15Å; K1321-I1365 PolarHBondContact N-O 3.41Å; K1321-I1365 PolarHBondContact O-N 3.25Å; Y1323-I1365 HydrophobicContact CD2-CD1 4.13Å; Y1323-I1365 HydrophobicContact CD2-CG1 4.22Å; Y1323-I1365 HydrophobicContact CE2-CD1 3.56Å; Y1323-I1365 HydrophobicContact CE2-CG1 3.91Å; Q1363-I1365 HydrophobicContact CG-CG1 4.23Å; I1365-W1367 HydrophobicContact CG2-CZ2 4.35Å; I1365-F1378 HydrophobicContact CG2-CD2 3.81Å; I1365-F1378 HydrophobicContact CG2-CE2 3.46Å; I1365-F1378 VanDerWaalsContact CG2-CE2 3.46Å; I1365-F1378 HydrophobicContact CG2-CZ 4.4Å; I1365-V1381 HydrophobicContact CD1-CG2 4.5Å; I1365-V1381 HydrophobicContact CG1-CB 4.33Å; I1365-V1381 HydrophobicContact CG1-CG2 3.8Å; I1365-V1381 HydrophobicContact CG2-CB 4.49Å
1366	V	97.3	Very high	86.5	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.3	174.2	-168.5	0	0	0	0	110.9	I1285 L1306 P1318 V1320 M1379 G1380 L1401	I1285-V1366 HydrophobicContact CD1-CG2 3.97Å; L1306-V1366 HydrophobicContact CD1-CG1 3.91Å; L1306-V1366 HydrophobicContact CD2-CG1 4.18Å; P1318-V1366 HydrophobicContact CB-CG1 4.34Å; V1320-V1366 HydrophobicContact CG2-CG2 4.37Å; V1366-M1379 HydrophobicContact CB-CB 4.16Å; V1366-M1379 HydrophobicContact CG1-CB 4.04Å; V1366-M1379 PolarHBondContact O-N 2.94Å; V1366-G1380 PolarHBondContact N-O 3.17Å; V1366-L1401 HydrophobicContact CB-CD1 4.4Å; V1366-L1401 HydrophobicContact CG2-CD1 3.64Å; V1366-L1401 HydrophobicContact CG2-CD2 3.97Å; V1366-L1401 HydrophobicContact CG2-CG 4.49Å
1367	W	94.9	Very high	86.5	Confident	56 Å²	56	56.2 Å²	56.2	21%	0.212	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.9	-178	-70.5	84.1	0	0	0	111.1	P1318 Y1319 I1365 K1376 C1377 F1378	P1318-W1367 CarbonylContact C-O 3.58Å; P1318-W1367 VanDerWaalsContact CA-O 3.23Å; P1318-W1367 WeakPolarHBondContact CA-O 3.31Å; Y1319-W1367 HydrophobicContact CD1-CB 4.24Å; Y1319-W1367 WeakPolarHBondContact CD1-O 3.12Å; Y1319-W1367 HydrophobicContact CD2-CB 4.13Å; Y1319-W1367 HydrophobicContact CE1-CB 3.72Å; Y1319-W1367 HydrophobicContact CE2-CB 3.63Å; Y1319-W1367 AromaticContact CE2-CG 3.98Å; Y1319-W1367 HydrophobicContact CE2-CG 3.98Å; Y1319-W1367 HydrophobicContact CG-CB 4.42Å; Y1319-W1367 AromaticContact CZ-CG 3.97Å; Y1319-W1367 PolarHBondContact N-O 2.75Å; Y1319-W1367 PolarHBondContact O-N 3.48Å; I1365-W1367 HydrophobicContact CG2-CZ2 4.35Å; W1367-K1376 HydrophobicContact CE3-CB 4.38Å; W1367-C1377 CarbonylContact C-O 3.45Å; W1367-C1377 WeakPolarHBondContact CA-O 3.43Å; W1367-F1378 HydrophobicContact CH2-CD2 4.5Å; W1367-F1378 HydrophobicContact CZ2-CD2 4.34Å; W1367-F1378 HydrophobicContact CZ3-CB 4.37Å
1368	G	92.9	Very high	86.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120	175.1	0	0	0	0	0	112	K1376 C1377 M1379	G1368-K1376 CarbonylContact O-C 3.59Å; G1368-K1376 WeakPolarHBondContact O-CA 3.13Å; G1368-C1377 PolarHBondContact N-O 2.88Å; G1368-C1377 PolarHBondContact O-N 2.8Å; G1368-M1379 WeakPolarHBondContact CA-SD 3.32Å; G1368-M1379 PolarHBondContact N-SD 3.36Å
1369	D	90.2	Very high	87	Confident	36 Å²	36	51.1 Å²	51.1	19%	0.193	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.8	171.1	-153.3	-47	0	0	0	110	A1317 Y1319 G1371 K1376	A1317-D1369 PolarHBondContact N-O 2.73Å; A1317-D1369 WeakPolarHBondContact O-CB 3.46Å; A1317-D1369 PolarHBondContact O-N 2.88Å; Y1319-D1369 HydrophobicContact CE1-CB 4.3Å; D1369-G1371 PolarHBondContact OD1-N 2.86Å; D1369-K1376 WeakPolarHBondContact OD2-CE 3.23Å; D1369-K1376 IonicContact OD2-NZ 2.62Å
1370	Y	87.5	Confident	87.5	Confident	18 Å²	18	49.5 Å²	49.5	7%	0.071	24%	0.235	C	C	.	.			trans	-96.9	-7.3	-176.4	-77.1	-91.7	0	0	0	113	K1309 S1312 S1314 P1316 D1374 C1377	K1309-Y1370 HydrophobicContact CB-CE1 4.47Å; K1309-Y1370 HydrophobicContact CB-CE2 4.06Å; K1309-Y1370 WeakPolarHBondContact CB-OH 3.44Å; K1309-Y1370 PolarHBondContact N-OH 2.88Å; S1312-Y1370 VanDerWaalsContact OG-CE1 3.29Å; S1312-Y1370 WeakPolarHBondContact OG-CE1 3.42Å; S1314-Y1370 WeakPolarHBondContact O-CD1 3.48Å; S1314-Y1370 WeakPolarHBondContact O-CE1 3.35Å; P1316-Y1370 HydrophobicContact CB-CD1 4.45Å; P1316-Y1370 HydrophobicContact CB-CD2 4.24Å; P1316-Y1370 HydrophobicContact CB-CE1 3.99Å; P1316-Y1370 HydrophobicContact CB-CE2 3.74Å; P1316-Y1370 HydrophobicContact CG-CE1 4.38Å; Y1370-D1374 VanDerWaalsContact CB-CB 3.41Å; Y1370-D1374 HydrophobicContact CG-CB 4.33Å; Y1370-C1377 HydrophobicContact CD2-CB 4.02Å; Y1370-C1377 HydrophobicContact CE2-CB 3.56Å
1371	G	79.3	Confident	87.6	Confident	44 Å²	44	49.5 Å²	49.5	45%	0.454	24%	0.235	S	C	.	.			trans	122.2	-145.6	174.6	0	0	0	0	0	114.1	D1369	D1369-G1371 PolarHBondContact OD1-N 2.86Å
1372	R	70.5	Confident	87.7	Confident	264 Å²	264	49.3 Å²	49.3	100%	0.996	23%	0.234	S	C	*	.	S	Bend	trans	-87.3	-27.3	-177	-68.3	-169.8	-175.4	-177.9	3.9	114.5
1373	M	58.3	Low	87.6	Confident	180 Å²	180	49.5 Å²	49.5	89%	0.887	24%	0.235	S	C	*	.	S	Bend	trans	-85.6	-48.4	-176.8	-142.3	85.8	86	0	0	111
1374	D	63.5	Low	87.6	Confident	57 Å²	57	48 Å²	48	31%	0.305	23%	0.228	S	C	.	.	S	Bend	trans	-88.2	135.3	-178.7	-78.8	-83.4	0	0	0	112.4	K1309 Y1370	K1309-D1374 IonicContact NZ-OD1 2.92Å; Y1370-D1374 VanDerWaalsContact CB-CB 3.41Å; Y1370-D1374 HydrophobicContact CG-CB 4.33Å
1375	H	74.8	Confident	87.4	Confident	130 Å²	130	49 Å²	49	60%	0.602	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-68	153.8	171.4	-62.8	-13.7	0	0	0	112.2	C1377	H1375-C1377 PolarHBondContact O-N 2.86Å
1376	K	86.2	Confident	87.3	Confident	118 Å²	118	48.4 Å²	48.4	51%	0.513	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-58.2	120.4	176.8	-75.5	158.3	176.3	164.4	0	110.7	W1367 G1368 D1369	W1367-K1376 HydrophobicContact CE3-CB 4.38Å; G1368-K1376 CarbonylContact O-C 3.59Å; G1368-K1376 WeakPolarHBondContact O-CA 3.13Å; D1369-K1376 WeakPolarHBondContact OD2-CE 3.23Å; D1369-K1376 IonicContact OD2-NZ 2.62Å
1377	C	88.1	Confident	86.9	Confident	28 Å²	28	55 Å²	55	19%	0.189	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	141.7	177.9	-160.2	0	0	0	0	110.3	W1367 G1368 Y1370 H1375	W1367-C1377 CarbonylContact C-O 3.45Å; W1367-C1377 WeakPolarHBondContact CA-O 3.43Å; G1368-C1377 PolarHBondContact N-O 2.88Å; G1368-C1377 PolarHBondContact O-N 2.8Å; Y1370-C1377 HydrophobicContact CD2-CB 4.02Å; Y1370-C1377 HydrophobicContact CE2-CB 3.56Å; H1375-C1377 PolarHBondContact O-N 2.86Å
1378	F	92.3	Very high	86.6	Confident	50 Å²	50	55.4 Å²	55.4	22%	0.219	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	138.8	160.4	177.7	-87.1	0	0	0	108.9	M1282 I1365 W1367 V1381 P1404	M1282-F1378 HydrophobicContact CE-CD1 4.38Å; M1282-F1378 HydrophobicContact SD-CD1 4.37Å; M1282-F1378 HydrophobicContact SD-CE1 3.98Å; I1365-F1378 HydrophobicContact CG2-CD2 3.81Å; I1365-F1378 HydrophobicContact CG2-CE2 3.46Å; I1365-F1378 VanDerWaalsContact CG2-CE2 3.46Å; I1365-F1378 HydrophobicContact CG2-CZ 4.4Å; W1367-F1378 HydrophobicContact CH2-CD2 4.5Å; W1367-F1378 HydrophobicContact CZ2-CD2 4.34Å; W1367-F1378 HydrophobicContact CZ3-CB 4.37Å; F1378-V1381 HydrophobicContact CE2-CB 4.23Å; F1378-V1381 HydrophobicContact CE2-CG1 4.48Å; F1378-V1381 HydrophobicContact CZ-CB 3.87Å; F1378-V1381 HydrophobicContact CZ-CG1 3.83Å; F1378-P1404 HydrophobicContact CD1-CG 4.31Å; F1378-P1404 HydrophobicContact CD2-CG 4.38Å; F1378-P1404 HydrophobicContact CE1-CG 3.85Å; F1378-P1404 HydrophobicContact CE2-CG 3.9Å; F1378-P1404 HydrophobicContact CZ-CG 3.62Å
1379	M	93.2	Very high	86.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	11.2	-178.4	-61.2	-170.7	81.6	0	0	113.6	L1306 T1307 P1316 P1318 L1343 V1366 G1368	L1306-M1379 HydrophobicContact CB-CE 3.74Å; L1306-M1379 HydrophobicContact CD1-CE 4.45Å; T1307-M1379 VanDerWaalsContact O-CE 3.26Å; T1307-M1379 WeakPolarHBondContact O-CE 3.06Å; P1316-M1379 HydrophobicContact CB-CE 4.4Å; P1316-M1379 HydrophobicContact CB-SD 4.09Å; P1316-M1379 HydrophobicContact CG-CE 3.69Å; P1316-M1379 HydrophobicContact CG-SD 4Å; P1318-M1379 HydrophobicContact CB-SD 4.32Å; L1343-M1379 HydrophobicContact CD2-CE 4.25Å; V1366-M1379 HydrophobicContact CB-CB 4.16Å; V1366-M1379 HydrophobicContact CG1-CB 4.04Å; V1366-M1379 PolarHBondContact O-N 2.94Å; G1368-M1379 WeakPolarHBondContact CA-SD 3.32Å; G1368-M1379 PolarHBondContact N-SD 3.36Å
1380	G	94.7	Very high	86.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	126.2	158.5	175.7	0	0	0	0	0	114.1	V1366 F1402	V1366-G1380 PolarHBondContact N-O 3.17Å; G1380-F1402 CarbonylContact C-O 3.5Å; G1380-F1402 WeakPolarHBondContact CA-O 3.12Å
1381	V	95.9	Very high	86.8	Confident	5 Å²	5	60 Å²	60	3%	0.03	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	148.5	176.5	62.4	0	0	0	0	111.7	Q1363 V1364 I1365 F1378 F1402 L1407	Q1363-V1381 HydrophobicContact CG-CG2 3.61Å; V1364-V1381 CarbonylContact O-C 3.59Å; V1364-V1381 VanDerWaalsContact O-CA 3.3Å; V1364-V1381 WeakPolarHBondContact O-CA 3.28Å; I1365-V1381 HydrophobicContact CD1-CG2 4.5Å; I1365-V1381 HydrophobicContact CG1-CB 4.33Å; I1365-V1381 HydrophobicContact CG1-CG2 3.8Å; I1365-V1381 HydrophobicContact CG2-CB 4.49Å; F1378-V1381 HydrophobicContact CE2-CB 4.23Å; F1378-V1381 HydrophobicContact CE2-CG1 4.48Å; F1378-V1381 HydrophobicContact CZ-CB 3.87Å; F1378-V1381 HydrophobicContact CZ-CG1 3.83Å; V1381-F1402 WeakPolarHBondContact CG1-O 3.27Å; V1381-F1402 PolarHBondContact N-O 3.03Å; V1381-F1402 PolarHBondContact O-N 3.18Å; V1381-L1407 HydrophobicContact CB-CD2 4.37Å; V1381-L1407 HydrophobicContact CG1-CD1 4.33Å; V1381-L1407 HydrophobicContact CG1-CD2 3.56Å; V1381-L1407 HydrophobicContact CG1-CG 3.94Å; V1381-L1407 HydrophobicContact CG2-CD2 3.8Å
1382	A	95.9	Very high	87.3	Confident	2 Å²	2	62.1 Å²	62.1	2%	0.017	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.3	161.5	0	0	0	0	0	110.3	Q1363 V1364 L1401	Q1363-A1382 WeakPolarHBondContact CA-O 3.03Å; V1364-A1382 PolarHBondContact N-O 3.03Å; V1364-A1382 PolarHBondContact O-N 2.78Å; A1382-L1401 HydrophobicContact CB-CD2 4.45Å
1383	Q	95.1	Very high	88.3	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.019	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.3	168.4	-78.6	168.6	-56.9	0	0	108.6	Q1270 L1271 V1361 L1362 Q1363 L1407 V1408	Q1270-Q1383 CarbonylContact C-O 3.6Å; Q1270-Q1383 WeakPolarHBondContact CA-O 3.44Å; Q1270-Q1383 WeakPolarHBondContact CG-O 3.41Å; L1271-Q1383 HydrophobicContact CB-CB 3.91Å; L1271-Q1383 HydrophobicContact CD1-CB 4.31Å; L1271-Q1383 PolarHBondContact N-O 2.82Å; V1361-Q1383 HydrophobicContact CG1-CB 4.13Å; V1361-Q1383 HydrophobicContact CG1-CG 4.29Å; L1362-Q1383 CarbonylContact O-C 3.55Å; L1362-Q1383 WeakPolarHBondContact O-CA 3.44Å; Q1363-Q1383 HydrophobicContact CB-CG 4.38Å; Q1363-Q1383 HydrophobicContact CG-CG 4.11Å; Q1383-L1407 HydrophobicContact CG-CD2 3.7Å; Q1383-L1407 VanDerWaalsContact OE1-CD2 3.24Å; Q1383-V1408 PolarHBondContact NE2-O 2.76Å; Q1383-V1408 PolarHBondContact OE1-O 3.2Å
1384	I	95	Very high	89.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	126.5	-177.8	-47.9	170.9	0	0	0	108.1	A1269 M1289 V1361 L1362 V1364 L1389 Y1399	A1269-I1384 HydrophobicContact CB-CG2 4.03Å; A1269-I1384 WeakPolarHBondContact O-CA 3.2Å; M1289-I1384 HydrophobicContact CE-CD1 4.06Å; M1289-I1384 HydrophobicContact CE-CG2 4.19Å; M1289-I1384 HydrophobicContact SD-CD1 4.07Å; M1289-I1384 HydrophobicContact SD-CG2 4.38Å; V1361-I1384 CarbonylContact C-O 3.51Å; V1361-I1384 WeakPolarHBondContact CA-O 3.02Å; L1362-I1384 HydrophobicContact CB-CB 4.32Å; L1362-I1384 PolarHBondContact N-O 3.48Å; L1362-I1384 PolarHBondContact O-N 2.85Å; V1364-I1384 HydrophobicContact CG2-CD1 4.42Å; I1384-L1389 HydrophobicContact CG2-CD1 3.92Å; I1384-Y1399 HydrophobicContact CB-CE1 4.42Å; I1384-Y1399 HydrophobicContact CD1-CD1 3.74Å; I1384-Y1399 HydrophobicContact CD1-CD2 4.09Å; I1384-Y1399 HydrophobicContact CD1-CE1 3.48Å; I1384-Y1399 VanDerWaalsContact CD1-CE1 3.48Å; I1384-Y1399 HydrophobicContact CD1-CE2 3.83Å; I1384-Y1399 HydrophobicContact CD1-CG 4.06Å; I1384-Y1399 HydrophobicContact CG1-CD1 3.77Å; I1384-Y1399 HydrophobicContact CG1-CE1 3.54Å; I1384-Y1399 HydrophobicContact CG2-CE1 4.04Å
1385	L	93.9	Very high	91.4	Very high	22 Å²	22	45.7 Å²	45.7	12%	0.115	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	110.9	175.3	-178.8	53.2	0	0	0	109.6	A1269 L1271 V1361 E1387 E1388	A1269-L1385 WeakPolarHBondContact CB-O 3.33Å; A1269-L1385 PolarHBondContact O-N 2.79Å; L1271-L1385 HydrophobicContact CD1-CB 4.12Å; L1271-L1385 HydrophobicContact CD2-CB 4.11Å; L1271-L1385 HydrophobicContact CG-CB 4.14Å; V1361-L1385 HydrophobicContact CG2-CD1 3.88Å; L1385-E1387 HydrophobicContact CD1-CB 4.34Å; L1385-E1387 HydrophobicContact CG-CB 4.42Å; L1385-E1387 PolarHBondContact O-N 2.94Å; L1385-E1388 HydrophobicContact CB-CG 4.48Å; L1385-E1388 HydrophobicContact CD2-CG 3.95Å; L1385-E1388 HydrophobicContact CG-CG 4.16Å; L1385-E1388 PolarHBondContact O-N 2.74Å
1386	L	93.8	Very high	92.4	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.016	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-72.2	-20.1	-171.4	-64.1	170.9	0	0	0	113.5	M1289 L1296 L1324 P1357 K1360 L1362 E1388 L1389 L1391	M1289-L1386 HydrophobicContact SD-CD2 3.73Å; L1296-L1386 HydrophobicContact CD1-CD2 4.34Å; L1296-L1386 HydrophobicContact CD2-CD1 3.57Å; L1296-L1386 HydrophobicContact CD2-CD2 4.36Å; L1324-L1386 HydrophobicContact CD1-CD1 3.47Å; L1324-L1386 VanDerWaalsContact CD1-CD1 3.47Å; P1357-L1386 HydrophobicContact CB-CB 4.03Å; P1357-L1386 HydrophobicContact CB-CD1 4.07Å; P1357-L1386 WeakPolarHBondContact O-CB 3.42Å; K1360-L1386 HydrophobicContact CB-CD1 4.23Å; K1360-L1386 WeakPolarHBondContact O-CB 3.08Å; K1360-L1386 PolarHBondContact O-N 3.02Å; L1362-L1386 HydrophobicContact CB-CD1 4.25Å; L1362-L1386 HydrophobicContact CB-CD2 4.01Å; L1362-L1386 HydrophobicContact CB-CG 4.16Å; L1362-L1386 HydrophobicContact CD2-CD2 4.46Å; L1386-E1388 VanDerWaalsContact C-N 3.29Å; L1386-E1388 PolarHBondContact O-N 3.34Å; L1386-L1389 PolarHBondContact O-N 3.1Å; L1386-L1391 HydrophobicContact CB-CD1 4.27Å; L1386-L1391 HydrophobicContact CD2-CD1 4.24Å
1387	E	89.5	Confident	92.8	Very high	139 Å²	139	38.4 Å²	38.4	65%	0.65	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-73.9	-17.4	178.1	-170.3	167.4	-174.2	0	0	113.4	G1359 L1385 L1389	G1359-E1387 WeakPolarHBondContact CA-OE2 3.42Å; L1385-E1387 HydrophobicContact CD1-CB 4.34Å; L1385-E1387 HydrophobicContact CG-CB 4.42Å; L1385-E1387 PolarHBondContact O-N 2.94Å; E1387-L1389 VanDerWaalsContact C-N 3.32Å
1388	E	88.4	Confident	93.2	Very high	64 Å²	64	40.4 Å²	40.4	30%	0.299	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-88.3	5	173.6	-67.6	-175.6	-174.9	0	0	113.3	A1269 L1385 L1386 R1417	A1269-E1388 HydrophobicContact CB-CB 3.66Å; L1385-E1388 HydrophobicContact CB-CG 4.48Å; L1385-E1388 HydrophobicContact CD2-CG 3.95Å; L1385-E1388 HydrophobicContact CG-CG 4.16Å; L1385-E1388 PolarHBondContact O-N 2.74Å; L1386-E1388 VanDerWaalsContact C-N 3.29Å; L1386-E1388 PolarHBondContact O-N 3.34Å; E1388-R1417 VanDerWaalsContact CD-NH2 3.28Å; E1388-R1417 WeakPolarHBondContact OE1-CD 3.45Å; E1388-R1417 IonicContact OE1-CZ 2.77Å; E1388-R1417 IonicContact OE1-NE 3.01Å; E1388-R1417 PolarHBondContact OE1-NE 3.36Å; E1388-R1417 VanDerWaalsContact OE1-NE 3.11Å; E1388-R1417 IonicContact OE1-NH1 3.22Å; E1388-R1417 PolarHBondContact OE1-NH1 3.24Å; E1388-R1417 IonicContact OE1-NH2 3.3Å; E1388-R1417 PolarHBondContact OE1-NH2 3.25Å; E1388-R1417 IonicContact OE2-CZ 2.71Å; E1388-R1417 IonicContact OE2-NE 3.77Å; E1388-R1417 IonicContact OE2-NH1 2.77Å; E1388-R1417 PolarHBondContact OE2-NH1 3.37Å; E1388-R1417 IonicContact OE2-NH2 3.97Å; E1388-R1417 PolarHBondContact OE2-NH2 2.8Å
1389	L	90.8	Very high	93.5	Very high	24 Å²	24	38 Å²	38	13%	0.126	20%	0.204	C	C	.	.	S	Bend	trans	-116.3	132.3	-176	-61.6	-179.1	0	0	0	111.9	P1268 A1269 M1289 I1384 L1386 E1387 L1391 V1395	P1268-L1389 HydrophobicContact CB-CD2 3.97Å; A1269-L1389 HydrophobicContact CB-CD1 4.28Å; A1269-L1389 HydrophobicContact CB-CD2 3.57Å; A1269-L1389 HydrophobicContact CB-CG 3.71Å; M1289-L1389 HydrophobicContact CE-CD1 3.52Å; M1289-L1389 HydrophobicContact SD-CD1 4.15Å; I1384-L1389 HydrophobicContact CG2-CD1 3.92Å; L1386-L1389 PolarHBondContact O-N 3.1Å; E1387-L1389 VanDerWaalsContact C-N 3.32Å; L1389-L1391 VanDerWaalsContact C-N 3.33Å; L1389-L1391 HydrophobicContact CB-CD2 3.86Å; L1389-L1391 HydrophobicContact CB-CG 3.88Å; L1389-L1391 HydrophobicContact CD1-CD2 4.19Å; L1389-L1391 PolarHBondContact O-N 2.81Å; L1389-V1395 HydrophobicContact CD2-CG1 4.39Å
1390	D	90.4	Very high	93.6	Very high	115 Å²	115	39.9 Å²	39.9	62%	0.615	21%	0.212	S	C	*	.			trans	-75.7	87.4	165.8	-177.9	5.2	0	0	0	110.1	S1392 V1395	D1390-S1392 VanDerWaalsContact CG-OG 3.3Å; D1390-S1392 PolarHBondContact O-N 3.27Å; D1390-S1392 WeakPolarHBondContact OD1-CB 3.24Å; D1390-S1392 PolarHBondContact OD1-N 3.27Å; D1390-S1392 VanDerWaalsContact OD1-N 3.09Å; D1390-S1392 PolarHBondContact OD1-OG 2.77Å; D1390-S1392 PolarHBondContact OD2-OG 3.14Å; D1390-V1395 WeakPolarHBondContact O-CG2 3.36Å
1391	L	92.8	Very high	93.6	Very high	10 Å²	10	39.9 Å²	39.9	5%	0.052	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	13.4	180	-61	173.5	0	0	0	113.4	M1289 D1291 L1296 P1357 L1386 L1389 S1393 V1395	M1289-L1391 HydrophobicContact CB-CD2 3.61Å; D1291-L1391 HydrophobicContact CB-CB 4.14Å; D1291-L1391 PolarHBondContact N-O 2.96Å; L1296-L1391 HydrophobicContact CD1-CD1 4.09Å; P1357-L1391 HydrophobicContact CB-CD1 3.51Å; P1357-L1391 HydrophobicContact CG-CD1 3.88Å; L1386-L1391 HydrophobicContact CB-CD1 4.27Å; L1386-L1391 HydrophobicContact CD2-CD1 4.24Å; L1389-L1391 VanDerWaalsContact C-N 3.33Å; L1389-L1391 HydrophobicContact CB-CD2 3.86Å; L1389-L1391 HydrophobicContact CB-CG 3.88Å; L1389-L1391 HydrophobicContact CD1-CD2 4.19Å; L1389-L1391 PolarHBondContact O-N 2.81Å; L1391-S1393 PolarHBondContact O-N 2.83Å; L1391-V1395 HydrophobicContact CD2-CB 4.47Å; L1391-V1395 HydrophobicContact CD2-CG2 4.26Å
1392	S	91	Very high	93.5	Very high	90 Å²	90	40 Å²	40	63%	0.629	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.5	173.2	67.5	0	0	0	0	113.6	D1390	D1390-S1392 VanDerWaalsContact CG-OG 3.3Å; D1390-S1392 PolarHBondContact O-N 3.27Å; D1390-S1392 WeakPolarHBondContact OD1-CB 3.24Å; D1390-S1392 PolarHBondContact OD1-N 3.27Å; D1390-S1392 VanDerWaalsContact OD1-N 3.09Å; D1390-S1392 PolarHBondContact OD1-OG 2.77Å; D1390-S1392 PolarHBondContact OD2-OG 3.14Å
1393	S	90.5	Very high	93.3	Very high	69 Å²	69	41.4 Å²	41.4	48%	0.483	22%	0.221	S	C	.	.	S	Bend	trans	-141.5	172.5	170.7	66.1	0	0	0	0	110	L1391 V1395	L1391-S1393 PolarHBondContact O-N 2.83Å; S1393-V1395 PolarHBondContact O-N 3.04Å
1394	M	93.3	Very high	92.9	Very high	54 Å²	54	44.7 Å²	44.7	27%	0.266	24%	0.243	S	C	.	.			trans	-73.6	101.1	-177.8	-179.4	146.1	-75.6	0	0	112.7	M1289 E1290 E1297 E1299 I1396	M1289-M1394 CarbonylContact O-C 3.4Å; M1289-M1394 WeakPolarHBondContact O-CA 3.5Å; E1290-M1394 HydrophobicContact CB-CB 4.15Å; E1290-M1394 HydrophobicContact CB-CE 3.72Å; E1290-M1394 HydrophobicContact CG-CB 4.48Å; E1297-M1394 HydrophobicContact CG-CE 4.5Å; E1299-M1394 HydrophobicContact CB-CE 4.47Å; E1299-M1394 HydrophobicContact CB-SD 4.34Å; M1394-I1396 HydrophobicContact CG-CD1 4.22Å; M1394-I1396 HydrophobicContact CG-CG1 3.75Å; M1394-I1396 PolarHBondContact O-N 3.35Å
1395	V	94.4	Very high	92.1	Very high	32 Å²	32	48.8 Å²	48.8	19%	0.194	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	115.4	170.9	-178.9	0	0	0	0	109.2	P1268 G1288 M1289 L1389 D1390 L1391 S1393	P1268-V1395 HydrophobicContact CG-CG1 4.36Å; G1288-V1395 CarbonylContact C-O 3.59Å; G1288-V1395 VanDerWaalsContact CA-O 3.3Å; G1288-V1395 WeakPolarHBondContact CA-O 3.43Å; M1289-V1395 PolarHBondContact N-O 3.27Å; M1289-V1395 PolarHBondContact O-N 2.61Å; L1389-V1395 HydrophobicContact CD2-CG1 4.39Å; D1390-V1395 WeakPolarHBondContact O-CG2 3.36Å; L1391-V1395 HydrophobicContact CD2-CB 4.47Å; L1391-V1395 HydrophobicContact CD2-CG2 4.26Å; S1393-V1395 PolarHBondContact O-N 3.04Å
1396	I	95.2	Very high	91.3	Very high	90 Å²	90	48 Å²	48	46%	0.462	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.9	178.1	-57.4	179	0	0	0	110.2	Q1286 I1287 I1301 M1394	Q1286-I1396 HydrophobicContact CG-CG2 4.05Å; I1287-I1396 WeakPolarHBondContact O-CA 3.44Å; I1301-I1396 HydrophobicContact CD1-CD1 4.23Å; I1301-I1396 HydrophobicContact CD1-CG1 4.44Å; I1301-I1396 HydrophobicContact CD1-CG2 3.64Å; M1394-I1396 HydrophobicContact CG-CD1 4.22Å; M1394-I1396 HydrophobicContact CG-CG1 3.75Å; M1394-I1396 PolarHBondContact O-N 3.35Å
1397	G	95.1	Very high	90.6	Very high	5 Å²	5	50.5 Å²	50.5	5%	0.052	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	155	-179.9	0	0	0	0	0	113.8	Q1286 I1287	Q1286-G1397 WeakPolarHBondContact CA-O 3.41Å; I1287-G1397 PolarHBondContact N-O 2.93Å; I1287-G1397 PolarHBondContact O-N 2.85Å
1398	W	97	Very high	90	Very high	70 Å²	70	45 Å²	45	27%	0.265	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.8	159.9	-82.5	109.5	0	0	0	109.2	G1267 D1284 Q1286 R1302 R1304	G1267-W1398 WeakPolarHBondContact CA-O 3.49Å; G1267-W1398 PolarHBondContact N-O 2.86Å; D1284-W1398 HydrophobicContact CB-CE3 3.68Å; D1284-W1398 HydrophobicContact CB-CZ3 3.91Å; Q1286-W1398 HydrophobicContact CB-CD2 3.97Å; Q1286-W1398 HydrophobicContact CB-CE3 3.76Å; Q1286-W1398 HydrophobicContact CB-CH2 4.1Å; Q1286-W1398 HydrophobicContact CB-CZ2 4.31Å; Q1286-W1398 HydrophobicContact CB-CZ3 3.81Å; Q1286-W1398 HydrophobicContact CG-CD2 4.14Å; Q1286-W1398 HydrophobicContact CG-CE3 4.43Å; R1302-W1398 HydrophobicContact CG-CH2 4.08Å; R1302-W1398 VanDerWaalsContact CZ-CZ2 3.49Å; R1304-W1398 HydrophobicContact CB-CH2 4.32Å; R1304-W1398 HydrophobicContact CB-CZ3 4.5Å; R1304-W1398 HydrophobicContact CG-CH2 3.79Å; R1304-W1398 HydrophobicContact CG-CZ3 3.74Å
1399	Y	97.1	Very high	89.1	Confident	1 Å²	1	46 Å²	46	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.8	-176.9	-66.8	-86.2	0	0	0	110	P1268 Q1270 D1284 I1285 I1287 M1289 I1384	P1268-Y1399 WeakPolarHBondContact CG-OH 3.26Å; P1268-Y1399 VanDerWaalsContact O-CE1 3.27Å; P1268-Y1399 WeakPolarHBondContact O-CE1 3.32Å; P1268-Y1399 PolarHBondContact O-OH 2.98Å; Q1270-Y1399 HydrophobicContact CB-CD1 3.88Å; Q1270-Y1399 HydrophobicContact CB-CE1 4.07Å; Q1270-Y1399 HydrophobicContact CG-CD1 4.05Å; D1284-Y1399 WeakPolarHBondContact CA-O 3.35Å; I1285-Y1399 PolarHBondContact N-O 2.92Å; I1285-Y1399 PolarHBondContact O-N 2.95Å; I1287-Y1399 HydrophobicContact CB-CD2 4.06Å; I1287-Y1399 HydrophobicContact CB-CE2 4.06Å; I1287-Y1399 HydrophobicContact CG1-CD2 4.17Å; M1289-Y1399 HydrophobicContact CE-CE2 4.22Å; M1289-Y1399 VanDerWaalsContact CE-OH 3.23Å; M1289-Y1399 WeakPolarHBondContact CE-OH 3.43Å; I1384-Y1399 HydrophobicContact CB-CE1 4.42Å; I1384-Y1399 HydrophobicContact CD1-CD1 3.74Å; I1384-Y1399 HydrophobicContact CD1-CD2 4.09Å; I1384-Y1399 HydrophobicContact CD1-CE1 3.48Å; I1384-Y1399 VanDerWaalsContact CD1-CE1 3.48Å; I1384-Y1399 HydrophobicContact CD1-CE2 3.83Å; I1384-Y1399 HydrophobicContact CD1-CG 4.06Å; I1384-Y1399 HydrophobicContact CG1-CD1 3.77Å; I1384-Y1399 HydrophobicContact CG1-CE1 3.54Å; I1384-Y1399 HydrophobicContact CG2-CE1 4.04Å
1400	K	95.2	Very high	87.8	Confident	39 Å²	39	45.7 Å²	45.7	17%	0.17	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	131.8	174.2	-75.3	178.1	-177.6	148.5	0	109.1	F1262 G1265 L1266 Q1270 A1281 F1402	F1262-K1400 PolarHBondContact O-NZ 2.89Å; G1265-K1400 VanDerWaalsContact C-NZ 3.3Å; G1265-K1400 VanDerWaalsContact O-CD 3.31Å; G1265-K1400 WeakPolarHBondContact O-CD 3.44Å; G1265-K1400 WeakPolarHBondContact O-CE 3.47Å; G1265-K1400 WeakPolarHBondContact O-CG 3.49Å; G1265-K1400 PolarHBondContact O-NZ 2.73Å; G1265-K1400 VanDerWaalsContact O-NZ 3.07Å; L1266-K1400 HydrophobicContact CD2-CB 4.49Å; L1266-K1400 HydrophobicContact CD2-CD 4.14Å; Q1270-K1400 PolarHBondContact NE2-O 2.84Å; Q1270-K1400 VanDerWaalsContact OE1-N 3.16Å; A1281-K1400 HydrophobicContact CB-CB 4.28Å; A1281-K1400 HydrophobicContact CB-CG 4.4Å; K1400-F1402 HydrophobicContact CB-CE1 4.32Å; K1400-F1402 HydrophobicContact CB-CE2 3.66Å; K1400-F1402 HydrophobicContact CB-CZ 3.55Å; K1400-F1402 HydrophobicContact CD-CZ 3.94Å; K1400-F1402 HydrophobicContact CG-CZ 4.39Å
1401	L	96	Very high	86.3	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.258	C	S	.	.			trans	-92.5	133.1	178.2	-64.6	168.7	0	0	0	110.5	A1281 M1282 G1283 I1285 L1306 V1366 A1382	A1281-L1401 CarbonylContact C-O 3.52Å; A1281-L1401 WeakPolarHBondContact CA-O 3.29Å; M1282-L1401 HydrophobicContact CB-CB 4.46Å; M1282-L1401 PolarHBondContact N-O 2.95Å; G1283-L1401 VanDerWaalsContact O-CB 3.28Å; G1283-L1401 WeakPolarHBondContact O-CB 3.31Å; G1283-L1401 PolarHBondContact O-N 3.23Å; I1285-L1401 HydrophobicContact CB-CD1 4.31Å; I1285-L1401 HydrophobicContact CB-CD2 4.26Å; I1285-L1401 HydrophobicContact CB-CG 4.37Å; I1285-L1401 HydrophobicContact CG2-CD2 3.7Å; I1285-L1401 HydrophobicContact CG2-CG 4.16Å; L1306-L1401 HydrophobicContact CD2-CD1 3.49Å; L1306-L1401 VanDerWaalsContact CD2-CD1 3.49Å; V1366-L1401 HydrophobicContact CB-CD1 4.4Å; V1366-L1401 HydrophobicContact CG2-CD1 3.64Å; V1366-L1401 HydrophobicContact CG2-CD2 3.97Å; V1366-L1401 HydrophobicContact CG2-CG 4.49Å; A1382-L1401 HydrophobicContact CB-CD2 4.45Å
1402	F	94	Very high	84.5	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.031	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-123.7	167.2	-177.9	-62.9	-67.8	0	0	0	113	F1262 L1266 V1272 T1276 A1281 G1380 V1381 K1400	F1262-F1402 HydrophobicContact CE2-CZ 4.4Å; F1262-F1402 HydrophobicContact CZ-CZ 4.25Å; L1266-F1402 HydrophobicContact CD2-CE2 4.02Å; L1266-F1402 HydrophobicContact CD2-CZ 4.17Å; V1272-F1402 HydrophobicContact CG1-CE2 4.43Å; V1272-F1402 HydrophobicContact CG2-CD2 4.47Å; V1272-F1402 HydrophobicContact CG2-CE2 3.99Å; T1276-F1402 HydrophobicContact CG2-CB 4.42Å; T1276-F1402 HydrophobicContact CG2-CD1 3.31Å; T1276-F1402 HydrophobicContact CG2-CD2 3.91Å; T1276-F1402 HydrophobicContact CG2-CE1 3.3Å; T1276-F1402 HydrophobicContact CG2-CE2 3.89Å; T1276-F1402 HydrophobicContact CG2-CG 3.62Å; T1276-F1402 HydrophobicContact CG2-CZ 3.59Å; A1281-F1402 HydrophobicContact CB-CD1 4.44Å; A1281-F1402 HydrophobicContact CB-CE1 4Å; G1380-F1402 CarbonylContact C-O 3.5Å; G1380-F1402 WeakPolarHBondContact CA-O 3.12Å; V1381-F1402 WeakPolarHBondContact CG1-O 3.27Å; V1381-F1402 PolarHBondContact N-O 3.03Å; V1381-F1402 PolarHBondContact O-N 3.18Å; K1400-F1402 HydrophobicContact CB-CE1 4.32Å; K1400-F1402 HydrophobicContact CB-CE2 3.66Å; K1400-F1402 HydrophobicContact CB-CZ 3.55Å; K1400-F1402 HydrophobicContact CD-CZ 3.94Å; K1400-F1402 HydrophobicContact CG-CZ 4.39Å
1403	P	91.3	Very high	82.7	Confident	31 Å²	31	44 Å²	44	20%	0.201	25%	0.251	C	S	.	.			trans	-63.5	161.1	169.5	-21.1	34.4	0	0	0	112.5	T1279 M1282 S1405 S1406	T1279-P1403 HydrophobicContact CG2-CG 3.74Å; M1282-P1403 HydrophobicContact CG-CG 4.39Å; M1282-P1403 HydrophobicContact SD-CB 4.4Å; M1282-P1403 HydrophobicContact SD-CG 4.01Å; P1403-S1405 PolarHBondContact O-N 3.47Å; P1403-S1405 VanDerWaalsContact O-N 3.11Å; P1403-S1406 WeakPolarHBondContact O-CB 3.37Å; P1403-S1406 PolarHBondContact O-N 2.99Å
1404	P	85.6	Confident	80.5	Confident	74 Å²	74	44.7 Å²	44.7	48%	0.481	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-61.7	-22.9	179.8	-20.6	33.1	0	0	0	114	F1378 S1406 L1407	F1378-P1404 HydrophobicContact CD1-CG 4.31Å; F1378-P1404 HydrophobicContact CD2-CG 4.38Å; F1378-P1404 HydrophobicContact CE1-CG 3.85Å; F1378-P1404 HydrophobicContact CE2-CG 3.9Å; F1378-P1404 HydrophobicContact CZ-CG 3.62Å; P1404-S1406 PolarHBondContact O-N 3.26Å; P1404-L1407 HydrophobicContact CB-CD1 4.43Å; P1404-L1407 WeakPolarHBondContact O-CB 3.41Å; P1404-L1407 WeakPolarHBondContact O-CD1 3.31Å; P1404-L1407 VanDerWaalsContact O-CG 3.32Å; P1404-L1407 WeakPolarHBondContact O-CG 3.33Å; P1404-L1407 PolarHBondContact O-N 3.31Å
1405	S	78.7	Confident	77.6	Confident	86 Å²	86	47.5 Å²	47.5	60%	0.601	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-70.5	-12.5	176	51.4	0	0	0	0	114.3	Q1275 P1403	Q1275-S1405 WeakPolarHBondContact CG-O 3.36Å; Q1275-S1405 PolarHBondContact NE2-O 3.07Å; P1403-S1405 PolarHBondContact O-N 3.47Å; P1403-S1405 VanDerWaalsContact O-N 3.11Å
1406	S	77	Confident	75.1	Confident	5 Å²	5	49.5 Å²	49.5	4%	0.035	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-91.6	-3.8	177.3	-71.9	0	0	0	0	113.9	G1273 T1276 P1403 P1404	G1273-S1406 PolarHBondContact N-O 3.07Å; T1276-S1406 WeakPolarHBondContact OG1-CB 3.27Å; T1276-S1406 PolarHBondContact OG1-OG 3.01Å; T1276-S1406 VanDerWaalsContact OG1-OG 3.11Å; P1403-S1406 WeakPolarHBondContact O-CB 3.37Å; P1403-S1406 PolarHBondContact O-N 2.99Å; P1404-S1406 PolarHBondContact O-N 3.26Å
1407	L	78.4	Confident	72.6	Confident	56 Å²	56	50.9 Å²	50.9	29%	0.293	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-64.2	142.6	179.1	-68.6	171.6	0	0	0	111.4	V1381 Q1383 P1404	V1381-L1407 HydrophobicContact CB-CD2 4.37Å; V1381-L1407 HydrophobicContact CG1-CD1 4.33Å; V1381-L1407 HydrophobicContact CG1-CD2 3.56Å; V1381-L1407 HydrophobicContact CG1-CG 3.94Å; V1381-L1407 HydrophobicContact CG2-CD2 3.8Å; Q1383-L1407 HydrophobicContact CG-CD2 3.7Å; Q1383-L1407 VanDerWaalsContact OE1-CD2 3.24Å; P1404-L1407 HydrophobicContact CB-CD1 4.43Å; P1404-L1407 WeakPolarHBondContact O-CB 3.41Å; P1404-L1407 WeakPolarHBondContact O-CD1 3.31Å; P1404-L1407 VanDerWaalsContact O-CG 3.32Å; P1404-L1407 WeakPolarHBondContact O-CG 3.33Å; P1404-L1407 PolarHBondContact O-N 3.31Å
1408	V	78.1	Confident	69.9	Low	23 Å²	23	60.5 Å²	60.5	14%	0.139	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-88.2	143.7	165.4	-175.4	0	0	0	0	108	L1271 V1272 Q1383 P1410	L1271-V1408 HydrophobicContact CB-CG2 4.26Å; V1272-V1408 VanDerWaalsContact C-CG2 3.48Å; Q1383-V1408 PolarHBondContact NE2-O 2.76Å; Q1383-V1408 PolarHBondContact OE1-O 3.2Å; V1408-P1410 WeakPolarHBondContact O-CD 3.15Å
1409	D	69.7	Low	66.8	Low	84 Å²	84	61.1 Å²	61.1	45%	0.449	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-69.5	120.1	172.5	-164.8	-51.4	0	0	0	110.1	T1411 L1412	D1409-T1411 VanDerWaalsContact CG-OG1 3.29Å; D1409-T1411 PolarHBondContact O-N 2.94Å; D1409-T1411 VanDerWaalsContact O-N 3.1Å; D1409-T1411 WeakPolarHBondContact OD1-CB 3.13Å; D1409-T1411 WeakPolarHBondContact OD1-CG2 2.94Å; D1409-T1411 PolarHBondContact OD1-N 2.85Å; D1409-T1411 PolarHBondContact OD1-OG1 3.13Å; D1409-L1412 HydrophobicContact CB-CB 4.5Å; D1409-L1412 HydrophobicContact CB-CD1 4.05Å; D1409-L1412 HydrophobicContact CB-CG 4.07Å; D1409-L1412 PolarHBondContact O-N 3.15Å
1410	P	63.6	Low	64	Low	19 Å²	19	64.2 Å²	64.2	12%	0.123	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	1.4	-179.4	-12.6	27.9	0	0	0	114.8	L1325 V1361 V1408 T1413	L1325-P1410 HydrophobicContact CD1-CG 3.99Å; V1361-P1410 HydrophobicContact CG2-CB 4.45Å; V1408-P1410 WeakPolarHBondContact O-CD 3.15Å; P1410-T1413 PolarHBondContact O-OG1 3.31Å
1411	T	59.4	Low	61.3	Low	78 Å²	78	67.8 Å²	67.8	48%	0.479	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-23.5	166.5	63.1	0	0	0	0	112.2	D1409	D1409-T1411 VanDerWaalsContact CG-OG1 3.29Å; D1409-T1411 PolarHBondContact O-N 2.94Å; D1409-T1411 VanDerWaalsContact O-N 3.1Å; D1409-T1411 WeakPolarHBondContact OD1-CB 3.13Å; D1409-T1411 WeakPolarHBondContact OD1-CG2 2.94Å; D1409-T1411 PolarHBondContact OD1-N 2.85Å; D1409-T1411 PolarHBondContact OD1-OG1 3.13Å
1412	L	54.1	Low	58.3	Low	83 Å²	83	72.9 Å²	72.9	44%	0.435	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-7.7	-177.4	-59.5	-179.6	0	0	0	113.6	D1409 P1414 L1415 T1416	D1409-L1412 HydrophobicContact CB-CB 4.5Å; D1409-L1412 HydrophobicContact CB-CD1 4.05Å; D1409-L1412 HydrophobicContact CB-CG 4.07Å; D1409-L1412 PolarHBondContact O-N 3.15Å; L1412-P1414 VanDerWaalsContact C-N 3.34Å; L1412-L1415 HydrophobicContact CD2-CD1 4.09Å; L1412-L1415 WeakPolarHBondContact O-CA 3.32Å; L1412-L1415 WeakPolarHBondContact O-CB 3.39Å; L1412-L1415 PolarHBondContact O-N 3.31Å; L1412-T1416 HydrophobicContact CB-CG2 4.26Å; L1412-T1416 PolarHBondContact O-N 3.46Å; L1412-T1416 PolarHBondContact O-OG1 2.91Å
1413	T	53.3	Low	55.5	Low	19 Å²	19	76.7 Å²	76.7	12%	0.117	44%	0.438	C	S	.	.	H	α-helix	trans	-55.6	-33.5	-178.7	41	0	0	0	0	115.4	L1271 P1410 L1415 T1416	L1271-T1413 HydrophobicContact CD1-CG2 3.52Å; L1271-T1413 HydrophobicContact CD2-CG2 4.29Å; P1410-T1413 PolarHBondContact O-OG1 3.31Å; T1413-L1415 VanDerWaalsContact C-N 3.26Å; T1413-L1415 PolarHBondContact O-N 3.21Å; T1413-T1416 PolarHBondContact O-OG1 2.97Å
1414	P	43.2	Very low	52.7	Low	82 Å²	82	82.2 Å²	82.2	53%	0.532	47%	0.465	S	S	.	.	H	α-helix	trans	-67.6	-24.3	172.9	-19.9	34	0	0	0	113.9	L1412	L1412-P1414 VanDerWaalsContact C-N 3.34Å
1415	L	32.9	Very low	50.1	Low	113 Å²	113	87.3 Å²	87.3	59%	0.592	48%	0.483	S	S	*	.	H	α-helix	trans	-91.9	-40.7	-175.4	-59.7	173	0	0	0	111.6	L1412 T1413 R1417 R1418 A1419	L1412-L1415 HydrophobicContact CD2-CD1 4.09Å; L1412-L1415 WeakPolarHBondContact O-CA 3.32Å; L1412-L1415 WeakPolarHBondContact O-CB 3.39Å; L1412-L1415 PolarHBondContact O-N 3.31Å; T1413-L1415 VanDerWaalsContact C-N 3.26Å; T1413-L1415 PolarHBondContact O-N 3.21Å; L1415-R1417 VanDerWaalsContact C-N 3.27Å; L1415-R1417 PolarHBondContact O-N 3.44Å; L1415-R1417 VanDerWaalsContact O-N 3.15Å; L1415-R1418 PolarHBondContact O-N 3.22Å; L1415-A1419 WeakPolarHBondContact O-CB 3.17Å; L1415-A1419 PolarHBondContact O-N 3.36Å
1416	T	42.1	Very low	47.9	Very low	74 Å²	74	88.9 Å²	88.9	45%	0.454	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-18.9	-169.6	47.1	0	0	0	0	115.6	L1412 T1413 S1420	L1412-T1416 HydrophobicContact CB-CG2 4.26Å; L1412-T1416 PolarHBondContact O-N 3.46Å; L1412-T1416 PolarHBondContact O-OG1 2.91Å; T1413-T1416 PolarHBondContact O-OG1 2.97Å; T1416-S1420 PolarHBondContact O-OG 3.18Å
1417	R	43.7	Very low	45.9	Very low	120 Å²	120	94.2 Å²	94.2	45%	0.453	53%	0.531	S	S	.	.	H	α-helix	trans	-103.7	-35.6	175.9	-120.9	-168.1	-157.9	-167.5	18.7	114.5	E1388 L1415 A1419 S1420 Q1421	E1388-R1417 VanDerWaalsContact CD-NH2 3.28Å; E1388-R1417 WeakPolarHBondContact OE1-CD 3.45Å; E1388-R1417 IonicContact OE1-CZ 2.77Å; E1388-R1417 IonicContact OE1-NE 3.01Å; E1388-R1417 PolarHBondContact OE1-NE 3.36Å; E1388-R1417 VanDerWaalsContact OE1-NE 3.11Å; E1388-R1417 IonicContact OE1-NH1 3.22Å; E1388-R1417 PolarHBondContact OE1-NH1 3.24Å; E1388-R1417 IonicContact OE1-NH2 3.3Å; E1388-R1417 PolarHBondContact OE1-NH2 3.25Å; E1388-R1417 IonicContact OE2-CZ 2.71Å; E1388-R1417 IonicContact OE2-NE 3.77Å; E1388-R1417 IonicContact OE2-NH1 2.77Å; E1388-R1417 PolarHBondContact OE2-NH1 3.37Å; E1388-R1417 IonicContact OE2-NH2 3.97Å; E1388-R1417 PolarHBondContact OE2-NH2 2.8Å; L1415-R1417 VanDerWaalsContact C-N 3.27Å; L1415-R1417 PolarHBondContact O-N 3.44Å; L1415-R1417 VanDerWaalsContact O-N 3.15Å; R1417-A1419 VanDerWaalsContact C-N 3.29Å; R1417-A1419 PolarHBondContact O-N 2.78Å; R1417-S1420 CarbonylContact O-C 3.52Å; R1417-S1420 PolarHBondContact O-N 2.83Å; R1417-S1420 PolarHBondContact O-OG 2.88Å; R1417-Q1421 PolarHBondContact O-N 3.35Å
1418	R	36.7	Very low	43.8	Very low	207 Å²	207	98 Å²	98	78%	0.781	56%	0.562	S	S	*	*	H	α-helix	trans	-59.5	-42.8	174.9	-82.6	-175	171	176.1	-0.9	111.1	L1415 S1420 Q1421 S1422	L1415-R1418 PolarHBondContact O-N 3.22Å; R1418-S1420 PolarHBondContact O-N 3.36Å; R1418-S1420 VanDerWaalsContact O-N 3.09Å; R1418-Q1421 PolarHBondContact O-N 2.89Å; R1418-S1422 PolarHBondContact O-N 3.35Å; R1418-S1422 PolarHBondContact O-OG 2.8Å
1419	A	33.4	Very low	41.9	Very low	82 Å²	82	99.8 Å²	99.8	68%	0.678	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	0.5	176.4	0	0	0	0	0	115.1	L1415 R1417	L1415-A1419 WeakPolarHBondContact O-CB 3.17Å; L1415-A1419 PolarHBondContact O-N 3.36Å; R1417-A1419 VanDerWaalsContact C-N 3.29Å; R1417-A1419 PolarHBondContact O-N 2.78Å
1420	S	36.7	Very low	40.4	Very low	66 Å²	66	101.2 Å²	101.2	46%	0.462	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.1	10.3	178.6	68.5	0	0	0	0	114.2	T1416 R1417 R1418	T1416-S1420 PolarHBondContact O-OG 3.18Å; R1417-S1420 CarbonylContact O-C 3.52Å; R1417-S1420 PolarHBondContact O-N 2.83Å; R1417-S1420 PolarHBondContact O-OG 2.88Å; R1418-S1420 PolarHBondContact O-N 3.36Å; R1418-S1420 VanDerWaalsContact O-N 3.09Å
1421	Q	38.9	Very low	39.1	Very low	114 Å²	114	106.2 Å²	106.2	53%	0.533	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.3	-22.5	172.3	-70.4	-172.5	-51.3	0	0	112.7	R1417 R1418 S1423	R1417-Q1421 PolarHBondContact O-N 3.35Å; R1418-Q1421 PolarHBondContact O-N 2.89Å; Q1421-S1423 PolarHBondContact O-N 2.79Å; Q1421-S1423 VanDerWaalsContact O-N 3.13Å
1422	S	33.8	Very low	38.2	Very low	108 Å²	108	108.6 Å²	108.6	76%	0.755	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	21.3	-178.8	69	0	0	0	0	115.5	R1418	R1418-S1422 PolarHBondContact O-N 3.35Å; R1418-S1422 PolarHBondContact O-OG 2.8Å
1423	S	35.1	Very low	37.2	Very low	87 Å²	87	112.3 Å²	112.3	61%	0.608	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.4	11.7	-173.9	72	0	0	0	0	115.3	Q1421	Q1421-S1423 PolarHBondContact O-N 2.79Å; Q1421-S1423 VanDerWaalsContact O-N 3.13Å
1424	L	32.2	Very low	36.3	Very low	147 Å²	147	122.6 Å²	122.6	77%	0.77	71%	0.705	S	S	*	*	S	Bend	trans	-139.8	29.1	-172	-71.4	175.7	0	0	0	114.3
1425	E	32.3	Very low	35.9	Very low	181 Å²	181	128.1 Å²	128.1	85%	0.846	75%	0.745	S	S	*	*	S	Bend	trans	-127.3	27.8	-179.2	-70.3	-163.3	101.3	0	0	115.2
1426	S	31.2	Very low	36	Very low	118 Å²	118	128.9 Å²	128.9	83%	0.825	75%	0.753	S	S	*	*	S	Bend	trans	-159.5	66.6	175.5	64.6	0	0	0	0	117.4
1427	S	34.6	Very low	35.7	Very low	118 Å²	118	131.7 Å²	131.7	83%	0.825	77%	0.769	S	S	*	*			trans	-164.4	105.6	151.6	60.3	0	0	0	0	113.3	G1429	S1427-G1429 PolarHBondContact O-N 3.26Å
1428	S	34.1	Very low	35.2	Very low	136 Å²	136	132.4 Å²	132.4	95%	0.951	79%	0.786	S	S	*	*			trans	-84.9	98.9	166.4	56.1	0	0	0	0	110.3
1429	G	38.9	Very low	35.1	Very low	60 Å²	60	128 Å²	128	62%	0.619	79%	0.787	S	S	*	*			trans	-154.2	147.1	177.4	0	0	0	0	0	112.2	S1427	S1427-G1429 PolarHBondContact O-N 3.26Å
1430	P	37.4	Very low	35.3	Very low	114 Å²	114	130.9 Å²	130.9	74%	0.74	79%	0.793	S	S	*	*			trans	-75.7	152	-179.7	32	-35.2	0	0	0	112	C1432	P1430-C1432 PolarHBondContact O-N 2.73Å
1431	P	37.2	Very low	35.2	Very low	123 Å²	123	135.2 Å²	135.2	80%	0.799	82%	0.816	S	S	*	*			trans	-75.7	117.2	-177	29.7	-34.3	0	0	0	112.3
1432	C	41.2	Very low	34.9	Very low	128 Å²	128	136.7 Å²	136.7	87%	0.865	84%	0.836	S	S	*	*			trans	-89.9	102.7	173.1	-66.9	0	0	0	0	110.8	P1430	P1430-C1432 PolarHBondContact O-N 2.73Å
1433	I	33.3	Very low	35	Very low	162 Å²	162	138.9 Å²	138.9	83%	0.831	84%	0.842	S	S	*	*			trans	-76.5	123.3	170.2	-58.6	168.3	0	0	0	109.4
1434	R	33.6	Very low	35	Very low	234 Å²	234	143.3 Å²	143.3	88%	0.883	86%	0.861	S	S	*	*			trans	-173.7	148.2	143.4	-112.1	165.6	-178	173.6	0.3	114.6
1435	S	33.9	Very low	35.2	Very low	198 Å²	198	142.9 Å²	142.9	100%	1.385	87%	0.87	S	S	*	*			trans	66.6	0	169.4	-66	0	0	0	0	115.7

Retrieved 1,435 of 1,435 residues in 2166.3 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).