RIMS1_MOUSE Loading...

Isoform 4 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 Q99NE5-4 (canonical: Q99NE5), Species MOUSE (Mus musculus, Mouse), Gene Rims1, Length 1,374 aa.

						>RIMS1_MOUSE|Q99NE5-4|Rims1
MSSAVGPRGPRPPTVPPPMQELPDLSHLTEEERNIIMAVMDRQKEEEEKEEAMLKCVVRDMAKPAACKTPRNAESQPHQPPLNIFRCVCVPRKPSSEEGGPDRNWRLHQQFESYKEQVRKIGEEARRYQGEHKDDAPTCGICHKTKFADGCGHLCSYCRTKFCARCGGRVSLRSNNEDKVVMWVCNLCRKQQEILTKSGAWFFGSGPQQPSQDGTLSDTATGAGSEVPREKKARLQERSRSQTPLSTAAVSSQDTASHGAPLDRNKGAEPSQQALGPEQKQASRSRSEPPRERKKAPGLSEQNGKGGQKSERKRVPKSVVQPGEGTADERERKERRETRRLEKGRSQDYPDRLEKREDGRVAEDEKQRKEEEGVSTPEYTSCEDVELESESVSEKGDLDYWLDPATWHSRETSPISSHPVTWQPSKEGDRLIGRVILNKRTTMPKESGALLGLKVVGGKMTDLGRLGAFITKVKKGSLADVVGHLRAGDEVLEWNGKPLPGATNEEVYNIILESKSEPQVEIIVSRPIGDIPRIPESSHPPLESSSSSFESQKMERPSISVISPTSPGALKDAPQVLPGQLSVKLWYDKVGHQLIVNVLQATDLPPRVDGRPRNPYVKMYFLPDRSDKSKRRTKTVKKLLEPKWNQTFVYSHVHRRDFRERMLEITVWDQPRVQDEESEFLGEILIELETALLDDEPHWYKLQTHDESSLPLPQPSPFMPRRHIHGESSSKKLQRSQRISDSDISDYEVDDGIGVVPPVGYRASARESKATTLTVPEQQRTTHHRSRSVSPHRGDDQGRPRSRLPNVPLQRSLDEIHPTRRSRSPTRHHDASRSLADHRSRHAESQYSSEPDSELLMLPRAKRGRSAECLHMTSELQPSLDRARSASTNCLRPDTSLHSPERERHSRKSERSSIQKQSRKGTASDADRTHRQGSPTQSPPADTSFGSRRGRQLPQVPVRSGSIEQASLVVEERTRQMKMKVHRFKQTTGSGSSQELDHEQYSKYNIHKDQYRSCDNASAKSSDSDVSDVSAISRASSTSRLSSTSFMSEQSERPRGRISSFTPKMQGRRMGTSGRAIIKSTSVSGEIYTLEHNDGSQSDTAVGTVGAGGKKRRSSLSAKVVAIVSRRSRSTSQLSQTESGHKKLKSTIQRSTETGMAAEMRKMVRQPSRESTDGSINSYSSEGNLIFPGVRVGPDSQFSDFLDGLGPAQLVGRQTLATPAMGDIQIGMEDKKGQLEVEVIRARSLTQKPGSKSTPAPYVKVYLLENGACIAKKKTRIARKTLDPLYQQSLVFDESPQGKVLQVIVWGDYGRMDHKCFMGVAQILLEELDLSSMVIGWYKLFPPSSLVDPTLTPLTRRASQSSLESSSGPPCIRS
					

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(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	37.6	Very low	40.7	Very low	224 Å²	224	142.4 Å²	142.4	100%	1.103	84%	0.84	S	S	*	*				0	119.6	0	-46.6	-164.8	96.7	0	0	105.5
2	S	38.8	Very low	41.3	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	83%	0.828	S	S	*	*				63.3	118.6	75.7	-41.5	0	0	0	0	110
3	S	37.6	Very low	41.9	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	83%	0.827	S	S	*	*			cis	-151.4	139.1	9.3	-64	0	0	0	0	108.1
4	A	38.7	Very low	42.1	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	83%	0.83	S	S	*	*				78.1	116.1	67.2	0	0	0	0	0	116
5	V	40.7	Very low	42.4	Very low	149 Å²	149	137.4 Å²	137.4	90%	0.903	82%	0.824	S	S	*	*			trans	59.4	125.9	149	-173.7	0	0	0	0	120.5
6	G	39.6	Very low	43.2	Very low	75 Å²	75	135.4 Å²	135.4	77%	0.773	82%	0.815	S	S	*	*			trans	178.8	93.2	162.9	0	0	0	0	0	114.7
7	P	43.1	Very low	43.6	Very low	115 Å²	115	134.2 Å²	134.2	75%	0.747	81%	0.811	S	S	*	*			trans	-101.2	156.9	-175.4	37.3	-33.8	0	0	0	115.6
8	R	37.1	Very low	44.1	Very low	250 Å²	250	133.8 Å²	133.8	94%	0.943	81%	0.812	S	S	*	*			trans	13.2	123	157.9	-66.4	-176.2	173	-144.8	-1.7	119.7
9	G	43.8	Very low	44.2	Very low	70 Å²	70	135.7 Å²	135.7	72%	0.722	81%	0.813	S	S	*	*			trans	-115.9	140.3	141.2	0	0	0	0	0	110.3
10	P	47.6	Very low	44.7	Very low	131 Å²	131	138.3 Å²	138.3	85%	0.851	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-79.4	142	179.4	32	-33.8	0	0	0	112
11	R	43.2	Very low	45.3	Very low	240 Å²	240	140.7 Å²	140.7	91%	0.906	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-89.7	143.3	171.2	-147.1	171.3	-156.9	-104.4	3.6	109.8
12	P	47.6	Very low	46.7	Very low	107 Å²	107	136.6 Å²	136.6	70%	0.695	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-65.2	159.8	-176.3	-22.4	34.8	0	0	0	113.6
13	P	49.6	Very low	48.3	Very low	125 Å²	125	134.6 Å²	134.6	81%	0.812	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65.4	133.7	176.6	27.9	-34.8	0	0	0	111.6	V15	P13-V15 PolarHBondContact O-N 2.78Å
14	T	44.1	Very low	50.1	Low	141 Å²	141	134.5 Å²	134.5	87%	0.865	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-68.9	121.7	175.4	-49	0	0	0	0	110.2
15	V	46.9	Very low	52	Low	122 Å²	122	131.2 Å²	131.2	74%	0.739	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-70.1	137.5	173.8	-175.5	0	0	0	0	108.9	P13	P13-V15 PolarHBondContact O-N 2.78Å
16	P	55.7	Low	53.8	Low	105 Å²	105	127.6 Å²	127.6	68%	0.682	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-61.6	155.1	173.8	26.7	-35.4	0	0	0	111.5
17	P	49.1	Very low	55.8	Low	116 Å²	116	130.9 Å²	130.9	75%	0.753	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-59.6	146.9	177.9	26.3	-34.8	0	0	0	111	M19	P17-M19 PolarHBondContact O-N 2.72Å
18	P	52.7	Low	57.5	Low	127 Å²	127	127.1 Å²	127.1	83%	0.825	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-62.2	135.6	-179.7	26.7	-34.2	0	0	0	110.3
19	M	46.8	Very low	59.8	Low	170 Å²	170	118.8 Å²	118.8	84%	0.837	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-63.4	150.6	169	-59.5	-155.8	-47.2	0	0	109.7	P17 E21	P17-M19 PolarHBondContact O-N 2.72Å; M19-E21 PolarHBondContact O-N 3.14Å
20	Q	53.6	Low	61.7	Low	187 Å²	187	122.1 Å²	122.1	87%	0.874	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57.2	128.9	169.3	-64.6	171.4	1.3	0	0	109	L22	Q20-L22 PolarHBondContact O-N 3.42Å
21	E	57.4	Low	63.5	Low	189 Å²	189	123.2 Å²	123.2	88%	0.883	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.8	131.9	173.6	-74	179.5	118.5	0	0	109.5	M19	M19-E21 PolarHBondContact O-N 3.14Å
22	L	67.4	Low	65.5	Low	138 Å²	138	116 Å²	116	72%	0.723	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-60.1	136.2	172.1	-77.5	151.7	0	0	0	108.7	Q20 D24 M40	Q20-L22 PolarHBondContact O-N 3.42Å; L22-D24 PolarHBondContact O-N 3.08Å; L22-M40 HydrophobicContact CD2-CE 4.04Å
23	P	72.5	Confident	67.4	Low	66 Å²	66	114.8 Å²	114.8	43%	0.429	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-59.7	140.7	174.8	26.6	-34	0	0	0	109.6	L25 M40	P23-L25 HydrophobicContact CB-CD2 4.46Å; P23-L25 HydrophobicContact CG-CD2 4.23Å; P23-L25 WeakPolarHBondContact O-CG 3.48Å; P23-L25 PolarHBondContact O-N 2.95Å; P23-M40 HydrophobicContact CG-CE 4.27Å; P23-M40 HydrophobicContact CG-SD 3.76Å
24	D	74.8	Confident	69.1	Low	111 Å²	111	113 Å²	113	59%	0.594	61%	0.605	S	S	*	*			trans	-71.2	100.1	-177.8	179.6	24.8	0	0	0	111.8	L22 S26 H27	L22-D24 PolarHBondContact O-N 3.08Å; D24-S26 PolarHBondContact O-N 2.99Å; D24-S26 WeakPolarHBondContact OD1-CB 3.28Å; D24-S26 PolarHBondContact OD1-N 2.91Å; D24-S26 PolarHBondContact OD1-OG 3.38Å; D24-S26 VanDerWaalsContact OD1-OG 3.11Å; D24-S26 WeakPolarHBondContact OD2-CB 3.44Å; D24-S26 PolarHBondContact OD2-OG 3.45Å; D24-H27 PolarHBondContact O-CE1 2.74Å; D24-H27 PolarHBondContact O-ND1 3.06Å
25	L	79	Confident	71.2	Confident	22 Å²	22	111.6 Å²	111.6	12%	0.115	59%	0.591	C	S	.	*	G	3₁₀ helix	trans	-86.9	18.9	175.8	-49.3	-177.8	0	0	0	112.7	P23 H27 L28 R33 I36 M37	P23-L25 HydrophobicContact CB-CD2 4.46Å; P23-L25 HydrophobicContact CG-CD2 4.23Å; P23-L25 WeakPolarHBondContact O-CG 3.48Å; P23-L25 PolarHBondContact O-N 2.95Å; L25-H27 PolarHBondContact O-N 2.85Å; L25-L28 HydrophobicContact CB-CD1 4.09Å; L25-L28 HydrophobicContact CD2-CD1 3.66Å; L25-L28 HydrophobicContact CG-CD1 4.41Å; L25-R33 HydrophobicContact CB-CB 4.38Å; L25-R33 HydrophobicContact CB-CG 3.83Å; L25-R33 HydrophobicContact CD1-CG 3.87Å; L25-R33 PolarHBondContact O-NE 3.43Å; L25-R33 PolarHBondContact O-NH2 2.93Å; L25-I36 HydrophobicContact CD1-CB 4.16Å; L25-I36 HydrophobicContact CD1-CG2 3.81Å; L25-I36 HydrophobicContact CD2-CG2 3.9Å; L25-M37 HydrophobicContact CD1-CG 3.93Å
26	S	77.5	Confident	73	Confident	72 Å²	72	108.7 Å²	108.7	50%	0.503	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-58.6	-33.4	175.7	67.5	0	0	0	0	113.4	D24 L28	D24-S26 PolarHBondContact O-N 2.99Å; D24-S26 WeakPolarHBondContact OD1-CB 3.28Å; D24-S26 PolarHBondContact OD1-N 2.91Å; D24-S26 PolarHBondContact OD1-OG 3.38Å; D24-S26 VanDerWaalsContact OD1-OG 3.11Å; D24-S26 WeakPolarHBondContact OD2-CB 3.44Å; D24-S26 PolarHBondContact OD2-OG 3.45Å; S26-L28 PolarHBondContact O-N 3.02Å
27	H	82.2	Confident	74.5	Confident	144 Å²	144	107.6 Å²	107.6	67%	0.667	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-85.5	-1.7	-171.2	67.4	-85.4	0	0	0	115.1	D24 L25	D24-H27 PolarHBondContact O-CE1 2.74Å; D24-H27 PolarHBondContact O-ND1 3.06Å; L25-H27 PolarHBondContact O-N 2.85Å
28	L	79.1	Confident	76.4	Confident	36 Å²	36	104.2 Å²	104.2	19%	0.188	54%	0.539	C	S	.	.	S	Bend	trans	-105.6	156.7	-175.5	-70.9	155.3	0	0	0	111.1	L25 S26 E32 I36	L25-L28 HydrophobicContact CB-CD1 4.09Å; L25-L28 HydrophobicContact CD2-CD1 3.66Å; L25-L28 HydrophobicContact CG-CD1 4.41Å; S26-L28 PolarHBondContact O-N 3.02Å; L28-E32 HydrophobicContact CB-CB 4.07Å; L28-E32 HydrophobicContact CD2-CB 4.02Å; L28-I36 HydrophobicContact CD1-CD1 3.61Å; L28-I36 HydrophobicContact CD2-CD1 4.46Å
29	T	85.4	Confident	78	Confident	75 Å²	75	101.9 Å²	101.9	46%	0.46	52%	0.523	S	S	.	.			trans	-61.8	157.2	167.7	62.4	0	0	0	0	110.6	E31 E32 R33	T29-E31 PolarHBondContact O-N 2.75Å; T29-E32 WeakPolarHBondContact CB-OE2 3.49Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.15Å; T29-E32 PolarHBondContact N-OE2 3.32Å; T29-E32 PolarHBondContact O-N 2.77Å; T29-E32 WeakPolarHBondContact OG1-CB 3.27Å; T29-E32 VanDerWaalsContact OG1-CD 3.26Å; T29-E32 WeakPolarHBondContact OG1-CG 3.02Å; T29-E32 PolarHBondContact OG1-N 3.14Å; T29-E32 PolarHBondContact OG1-OE2 3.42Å; T29-R33 WeakPolarHBondContact O-CB 3.21Å; T29-R33 PolarHBondContact O-N 2.89Å
30	E	83.4	Confident	79.8	Confident	140 Å²	140	97.1 Å²	97.1	65%	0.654	50%	0.499	S	S	*	.	H	α-helix	trans	-63.1	-30.6	179.5	-171	158	-154.4	0	0	112.1	N34	E30-N34 VanDerWaalsContact O-CB 3.32Å; E30-N34 WeakPolarHBondContact O-CB 3.19Å; E30-N34 PolarHBondContact O-N 3.13Å; E30-N34 PolarHBondContact O-ND2 2.68Å
31	E	85.1	Confident	81.4	Confident	155 Å²	155	92.9 Å²	92.9	72%	0.724	48%	0.483	S	S	*	.	H	α-helix	trans	-65.9	-50.3	172.9	-64.3	174.1	180	0	0	111.7	T29 R33 N34 I35	T29-E31 PolarHBondContact O-N 2.75Å; E31-R33 PolarHBondContact O-N 3.26Å; E31-N34 PolarHBondContact O-N 3.33Å; E31-I35 VanDerWaalsContact O-CG1 3.3Å; E31-I35 WeakPolarHBondContact O-CG1 3.34Å; E31-I35 PolarHBondContact O-N 2.86Å
32	E	86.2	Confident	82.8	Confident	88 Å²	88	91 Å²	91	41%	0.411	47%	0.467	S	S	.	.	H	α-helix	trans	-62.5	-41	175.6	-71	164.7	128	0	0	112.3	L28 T29 I35 I36	L28-E32 HydrophobicContact CB-CB 4.07Å; L28-E32 HydrophobicContact CD2-CB 4.02Å; T29-E32 WeakPolarHBondContact CB-OE2 3.49Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.15Å; T29-E32 PolarHBondContact N-OE2 3.32Å; T29-E32 PolarHBondContact O-N 2.77Å; T29-E32 WeakPolarHBondContact OG1-CB 3.27Å; T29-E32 VanDerWaalsContact OG1-CD 3.26Å; T29-E32 WeakPolarHBondContact OG1-CG 3.02Å; T29-E32 PolarHBondContact OG1-N 3.14Å; T29-E32 PolarHBondContact OG1-OE2 3.42Å; E32-I35 PolarHBondContact O-N 3.45Å; E32-I36 WeakPolarHBondContact O-CG1 3.49Å; E32-I36 PolarHBondContact O-N 3.44Å
33	R	86.5	Confident	83.7	Confident	82 Å²	82	90.3 Å²	90.3	31%	0.309	46%	0.46	S	S	.	.	H	α-helix	trans	-58.7	-48.8	174.9	179.6	-177.9	-60.6	154.8	7.9	110.9	L25 T29 E31 I35 I36 M37	L25-R33 HydrophobicContact CB-CB 4.38Å; L25-R33 HydrophobicContact CB-CG 3.83Å; L25-R33 HydrophobicContact CD1-CG 3.87Å; L25-R33 PolarHBondContact O-NE 3.43Å; L25-R33 PolarHBondContact O-NH2 2.93Å; T29-R33 WeakPolarHBondContact O-CB 3.21Å; T29-R33 PolarHBondContact O-N 2.89Å; E31-R33 PolarHBondContact O-N 3.26Å; R33-I35 VanDerWaalsContact C-N 3.33Å; R33-I35 PolarHBondContact O-N 3.07Å; R33-I36 PolarHBondContact O-N 2.88Å; R33-M37 HydrophobicContact CG-CG 4.46Å; R33-M37 HydrophobicContact CG-SD 3.96Å; R33-M37 WeakPolarHBondContact O-CB 3.29Å; R33-M37 WeakPolarHBondContact O-CG 3.48Å; R33-M37 PolarHBondContact O-N 3.08Å
34	N	86.8	Confident	84.4	Confident	87 Å²	87	93.3 Å²	93.3	47%	0.465	47%	0.467	S	S	.	.	H	α-helix	trans	-63.6	-37.7	179.1	-75.4	-34.3	0	0	0	112	E30 E31 A38	E30-N34 VanDerWaalsContact O-CB 3.32Å; E30-N34 WeakPolarHBondContact O-CB 3.19Å; E30-N34 PolarHBondContact O-N 3.13Å; E30-N34 PolarHBondContact O-ND2 2.68Å; E31-N34 PolarHBondContact O-N 3.33Å; N34-A38 VanDerWaalsContact O-CB 3.25Å; N34-A38 WeakPolarHBondContact O-CB 3.28Å; N34-A38 PolarHBondContact O-N 2.87Å
35	I	86.3	Confident	85	Confident	112 Å²	112	93 Å²	93	57%	0.574	46%	0.461	S	S	*	.	H	α-helix	trans	-62.6	-47.1	173.6	-69.6	163.7	0	0	0	111	E31 E32 R33 A38 V39	E31-I35 VanDerWaalsContact O-CG1 3.3Å; E31-I35 WeakPolarHBondContact O-CG1 3.34Å; E31-I35 PolarHBondContact O-N 2.86Å; E32-I35 PolarHBondContact O-N 3.45Å; R33-I35 VanDerWaalsContact C-N 3.33Å; R33-I35 PolarHBondContact O-N 3.07Å; I35-A38 PolarHBondContact O-N 3.44Å; I35-V39 WeakPolarHBondContact O-CG2 3.4Å; I35-V39 PolarHBondContact O-N 3.26Å; I35-V39 VanDerWaalsContact O-N 3.08Å
36	I	85.9	Confident	85.1	Confident	60 Å²	60	97.7 Å²	97.7	31%	0.308	48%	0.483	S	S	.	.	H	α-helix	trans	-68.3	-41.4	-178.1	-70.6	160.4	0	0	0	111.3	L25 L28 E32 R33 V39 M40	L25-I36 HydrophobicContact CD1-CB 4.16Å; L25-I36 HydrophobicContact CD1-CG2 3.81Å; L25-I36 HydrophobicContact CD2-CG2 3.9Å; L28-I36 HydrophobicContact CD1-CD1 3.61Å; L28-I36 HydrophobicContact CD2-CD1 4.46Å; E32-I36 WeakPolarHBondContact O-CG1 3.49Å; E32-I36 PolarHBondContact O-N 3.44Å; R33-I36 PolarHBondContact O-N 2.88Å; I36-V39 PolarHBondContact O-N 3Å; I36-M40 WeakPolarHBondContact O-CG 3.47Å; I36-M40 PolarHBondContact O-N 3.5Å
37	M	86.3	Confident	85.4	Confident	82 Å²	82	100.6 Å²	100.6	40%	0.404	49%	0.488	S	S	.	.	H	α-helix	trans	-58.9	-47.6	172.1	-73	178.4	60.2	0	0	111.4	L25 R33 V39 M40 D41	L25-M37 HydrophobicContact CD1-CG 3.93Å; R33-M37 HydrophobicContact CG-CG 4.46Å; R33-M37 HydrophobicContact CG-SD 3.96Å; R33-M37 WeakPolarHBondContact O-CB 3.29Å; R33-M37 WeakPolarHBondContact O-CG 3.48Å; R33-M37 PolarHBondContact O-N 3.08Å; M37-V39 PolarHBondContact O-N 3.41Å; M37-M40 PolarHBondContact O-N 3.43Å; M37-D41 PolarHBondContact O-N 3.44Å
38	A	88.8	Confident	85.5	Confident	46 Å²	46	99.8 Å²	99.8	38%	0.38	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-16.6	178.6	0	0	0	0	0	114.6	N34 I35 R42	N34-A38 VanDerWaalsContact O-CB 3.25Å; N34-A38 WeakPolarHBondContact O-CB 3.28Å; N34-A38 PolarHBondContact O-N 2.87Å; I35-A38 PolarHBondContact O-N 3.44Å; A38-R42 WeakPolarHBondContact O-CB 3.49Å
39	V	87.7	Confident	85.7	Confident	78 Å²	78	103 Å²	103	47%	0.473	50%	0.497	S	S	.	.	H	α-helix	trans	-83.2	-44.5	168.3	170.5	0	0	0	0	110.8	I35 I36 M37 R42 Q43	I35-V39 WeakPolarHBondContact O-CG2 3.4Å; I35-V39 PolarHBondContact O-N 3.26Å; I35-V39 VanDerWaalsContact O-N 3.08Å; I36-V39 PolarHBondContact O-N 3Å; M37-V39 PolarHBondContact O-N 3.41Å; V39-R42 PolarHBondContact O-N 2.86Å; V39-Q43 PolarHBondContact O-N 3.46Å
40	M	84.1	Confident	85.4	Confident	70 Å²	70	105.5 Å²	105.5	35%	0.345	50%	0.504	S	S	.	.	H	α-helix	trans	-62.6	-44.5	177	-71.8	-172.4	66.9	0	0	112.5	L22 P23 I36 M37 R42 Q43 K44	L22-M40 HydrophobicContact CD2-CE 4.04Å; P23-M40 HydrophobicContact CG-CE 4.27Å; P23-M40 HydrophobicContact CG-SD 3.76Å; I36-M40 WeakPolarHBondContact O-CG 3.47Å; I36-M40 PolarHBondContact O-N 3.5Å; M37-M40 PolarHBondContact O-N 3.43Å; M40-R42 VanDerWaalsContact C-N 3.29Å; M40-R42 PolarHBondContact O-N 3.08Å; M40-Q43 PolarHBondContact O-N 2.96Å; M40-K44 WeakPolarHBondContact O-CB 3.36Å; M40-K44 PolarHBondContact O-N 3.38Å
41	D	87.4	Confident	85.3	Confident	98 Å²	98	103.5 Å²	103.5	52%	0.524	50%	0.495	S	S	.	.	H	α-helix	trans	-61.7	-38.6	177	-74.2	-35.5	0	0	0	111.5	M37 K44 E45	M37-D41 PolarHBondContact O-N 3.44Å; D41-K44 PolarHBondContact O-N 2.86Å; D41-E45 WeakPolarHBondContact O-CB 3.36Å; D41-E45 PolarHBondContact O-N 3.26Å
42	R	87	Confident	85.1	Confident	149 Å²	149	98.3 Å²	98.3	56%	0.562	48%	0.478	S	S	*	.	H	α-helix	trans	-70.8	-41.5	177.7	-165.6	-177.9	-49.3	166	11.5	112.4	A38 V39 M40 K44 E45 E46	A38-R42 WeakPolarHBondContact O-CB 3.49Å; V39-R42 PolarHBondContact O-N 2.86Å; M40-R42 VanDerWaalsContact C-N 3.29Å; M40-R42 PolarHBondContact O-N 3.08Å; R42-K44 VanDerWaalsContact C-N 3.28Å; R42-K44 PolarHBondContact O-N 3.32Å; R42-E45 PolarHBondContact O-N 3.47Å; R42-E46 PolarHBondContact O-N 2.96Å
43	Q	86.2	Confident	84.4	Confident	123 Å²	123	99.7 Å²	99.7	58%	0.575	49%	0.486	S	S	*	.	H	α-helix	trans	-61.1	-41.2	174.1	-171.8	-172.8	-50.4	0	0	110.7	V39 M40 E46 E47	V39-Q43 PolarHBondContact O-N 3.46Å; M40-Q43 PolarHBondContact O-N 2.96Å; Q43-E46 PolarHBondContact O-N 3.28Å; Q43-E47 WeakPolarHBondContact O-CB 3.15Å; Q43-E47 PolarHBondContact O-N 3.37Å
44	K	86.2	Confident	83.8	Confident	130 Å²	130	101.1 Å²	101.1	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-64.7	-39.7	174.2	-177.5	-176.8	174	-172.2	0	112.4	M40 D41 R42 E46 E47 E48	M40-K44 WeakPolarHBondContact O-CB 3.36Å; M40-K44 PolarHBondContact O-N 3.38Å; D41-K44 PolarHBondContact O-N 2.86Å; R42-K44 VanDerWaalsContact C-N 3.28Å; R42-K44 PolarHBondContact O-N 3.32Å; K44-E46 VanDerWaalsContact C-N 3.33Å; K44-E47 PolarHBondContact O-N 2.84Å; K44-E48 WeakPolarHBondContact O-CB 3.4Å; K44-E48 PolarHBondContact O-N 3.33Å
45	E	87.2	Confident	83.3	Confident	103 Å²	103	102.4 Å²	102.4	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-66	-34.4	175.5	-156.9	-158.9	156.1	0	0	112	D41 R42 K49	D41-E45 WeakPolarHBondContact O-CB 3.36Å; D41-E45 PolarHBondContact O-N 3.26Å; R42-E45 PolarHBondContact O-N 3.47Å; E45-K49 WeakPolarHBondContact O-CB 3.33Å; E45-K49 VanDerWaalsContact O-CD 3.29Å; E45-K49 WeakPolarHBondContact O-CD 3Å; E45-K49 WeakPolarHBondContact O-CG 3.47Å; E45-K49 PolarHBondContact O-N 2.97Å; E45-K49 VanDerWaalsContact O-N 3.11Å; E45-K49 WeakPolarHBondContact OE1-CE 3.5Å; E45-K49 IonicContact OE1-NZ 3.28Å; E45-K49 PolarHBondContact OE1-NZ 2.98Å; E45-K49 IonicContact OE2-NZ 3.98Å
46	E	81.7	Confident	82.6	Confident	122 Å²	122	99.9 Å²	99.9	57%	0.57	49%	0.492	S	S	*	.	H	α-helix	trans	-70.2	-43.6	172.2	-72.3	-175.2	153.7	0	0	111.9	R42 Q43 K44 K49 E50	R42-E46 PolarHBondContact O-N 2.96Å; Q43-E46 PolarHBondContact O-N 3.28Å; K44-E46 VanDerWaalsContact C-N 3.33Å; E46-K49 WeakPolarHBondContact O-CB 3.34Å; E46-K49 PolarHBondContact O-N 2.91Å; E46-E50 PolarHBondContact O-N 3.02Å
47	E	83.5	Confident	81.7	Confident	132 Å²	132	101.1 Å²	101.1	62%	0.617	50%	0.503	S	S	*	.	H	α-helix	trans	-63.6	-41.3	176.3	-170.8	169.6	-167.8	0	0	111.9	Q43 K44 K49 E50 E51	Q43-E47 WeakPolarHBondContact O-CB 3.15Å; Q43-E47 PolarHBondContact O-N 3.37Å; K44-E47 PolarHBondContact O-N 2.84Å; E47-K49 VanDerWaalsContact C-N 3.34Å; E47-K49 PolarHBondContact O-N 3.19Å; E47-E50 PolarHBondContact O-N 3.25Å; E47-E51 WeakPolarHBondContact O-CB 3.49Å; E47-E51 PolarHBondContact O-N 3.23Å
48	E	84.7	Confident	80.9	Confident	127 Å²	127	101.6 Å²	101.6	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-66	-34.1	173.9	-172.2	171	177.1	0	0	112	K44 A52	K44-E48 WeakPolarHBondContact O-CB 3.4Å; K44-E48 PolarHBondContact O-N 3.33Å; E48-A52 WeakPolarHBondContact O-CB 3.34Å; E48-A52 PolarHBondContact O-N 3.03Å
49	K	84.2	Confident	79.8	Confident	103 Å²	103	106.3 Å²	106.3	45%	0.448	52%	0.518	S	S	.	.	H	α-helix	trans	-68.1	-42	172.5	-76.1	163.9	-170.2	162.6	0	112.3	E45 E46 E47 A52 M53	E45-K49 WeakPolarHBondContact O-CB 3.33Å; E45-K49 VanDerWaalsContact O-CD 3.29Å; E45-K49 WeakPolarHBondContact O-CD 3Å; E45-K49 WeakPolarHBondContact O-CG 3.47Å; E45-K49 PolarHBondContact O-N 2.97Å; E45-K49 VanDerWaalsContact O-N 3.11Å; E45-K49 WeakPolarHBondContact OE1-CE 3.5Å; E45-K49 IonicContact OE1-NZ 3.28Å; E45-K49 PolarHBondContact OE1-NZ 2.98Å; E45-K49 IonicContact OE2-NZ 3.98Å; E46-K49 WeakPolarHBondContact O-CB 3.34Å; E46-K49 PolarHBondContact O-N 2.91Å; E47-K49 VanDerWaalsContact C-N 3.34Å; E47-K49 PolarHBondContact O-N 3.19Å; K49-A52 PolarHBondContact O-N 3.44Å; K49-M53 WeakPolarHBondContact O-CG 3.48Å; K49-M53 PolarHBondContact O-N 3.32Å
50	E	79.3	Confident	78.6	Confident	129 Å²	129	107.4 Å²	107.4	60%	0.603	52%	0.521	S	S	*	.	H	α-helix	trans	-63.8	-45.5	174.3	-70.8	-154.3	147.1	0	0	111.3	E46 E47 A52 M53 L54	E46-E50 PolarHBondContact O-N 3.02Å; E47-E50 PolarHBondContact O-N 3.25Å; E50-A52 VanDerWaalsContact C-N 3.34Å; E50-A52 PolarHBondContact O-N 2.96Å; E50-M53 HydrophobicContact CG-CE 4.34Å; E50-M53 PolarHBondContact O-N 2.74Å; E50-L54 WeakPolarHBondContact O-CB 3.26Å; E50-L54 PolarHBondContact O-N 3.19Å
51	E	80.9	Confident	77.1	Confident	98 Å²	98	109.9 Å²	109.9	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-65	-37.4	177.4	-153.4	-149.9	177.5	0	0	111.8	E47 L54 K55	E47-E51 WeakPolarHBondContact O-CB 3.49Å; E47-E51 PolarHBondContact O-N 3.23Å; E51-L54 PolarHBondContact O-N 2.81Å; E51-K55 HydrophobicContact CG-CD 4.4Å; E51-K55 VanDerWaalsContact O-CB 3.3Å; E51-K55 WeakPolarHBondContact O-CB 3.3Å; E51-K55 VanDerWaalsContact O-CG 3.26Å; E51-K55 WeakPolarHBondContact O-CG 3.43Å; E51-K55 PolarHBondContact O-N 3.49Å; E51-K55 WeakPolarHBondContact OE1-CE 3.41Å; E51-K55 IonicContact OE1-NZ 3.96Å; E51-K55 PolarHBondContact OE1-NZ 2.74Å; E51-K55 WeakPolarHBondContact OE2-CE 3.36Å; E51-K55 IonicContact OE2-NZ 3.81Å; E51-K55 PolarHBondContact OE2-NZ 2.61Å
52	A	81.6	Confident	75.5	Confident	46 Å²	46	108.2 Å²	108.2	38%	0.38	53%	0.533	S	S	.	.	H	α-helix	trans	-65.4	-40.9	173.8	0	0	0	0	0	112.6	E48 K49 E50 K55 C56	E48-A52 WeakPolarHBondContact O-CB 3.34Å; E48-A52 PolarHBondContact O-N 3.03Å; K49-A52 PolarHBondContact O-N 3.44Å; E50-A52 VanDerWaalsContact C-N 3.34Å; E50-A52 PolarHBondContact O-N 2.96Å; A52-K55 PolarHBondContact O-N 3.45Å; A52-C56 WeakPolarHBondContact O-CB 3.42Å; A52-C56 PolarHBondContact O-N 2.67Å; A52-C56 PolarHBondContact O-SG 2.99Å
53	M	71.1	Confident	73.5	Confident	117 Å²	117	108.6 Å²	108.6	58%	0.576	54%	0.539	S	S	*	.	H	α-helix	trans	-63.3	-45.8	172.9	-75.9	-170.4	-69.3	0	0	111.4	K49 E50 C56 V57	K49-M53 WeakPolarHBondContact O-CG 3.48Å; K49-M53 PolarHBondContact O-N 3.32Å; E50-M53 HydrophobicContact CG-CE 4.34Å; E50-M53 PolarHBondContact O-N 2.74Å; M53-C56 PolarHBondContact O-N 2.91Å; M53-V57 WeakPolarHBondContact O-CG2 3.37Å; M53-V57 PolarHBondContact O-N 2.91Å
54	L	73.9	Confident	71.3	Confident	111 Å²	111	106.8 Å²	106.8	58%	0.581	54%	0.537	S	S	*	.	H	α-helix	trans	-59.1	-47.4	174.6	-84.4	155.3	0	0	0	111.7	E50 E51 C56 V57 V58	E50-L54 WeakPolarHBondContact O-CB 3.26Å; E50-L54 PolarHBondContact O-N 3.19Å; E51-L54 PolarHBondContact O-N 2.81Å; L54-C56 VanDerWaalsContact C-N 3.3Å; L54-C56 PolarHBondContact O-N 3.46Å; L54-V57 PolarHBondContact O-N 3.34Å; L54-V58 WeakPolarHBondContact O-CB 3.31Å; L54-V58 WeakPolarHBondContact O-CG2 3.22Å; L54-V58 PolarHBondContact O-N 3.29Å
55	K	76.5	Confident	68.9	Low	115 Å²	115	105.4 Å²	105.4	50%	0.5	55%	0.551	S	S	.	*	H	α-helix	trans	-59.2	-38.6	174.9	-78.6	167.5	176.4	165.9	0	112.2	E51 A52 R59	E51-K55 HydrophobicContact CG-CD 4.4Å; E51-K55 VanDerWaalsContact O-CB 3.3Å; E51-K55 WeakPolarHBondContact O-CB 3.3Å; E51-K55 VanDerWaalsContact O-CG 3.26Å; E51-K55 WeakPolarHBondContact O-CG 3.43Å; E51-K55 PolarHBondContact O-N 3.49Å; E51-K55 WeakPolarHBondContact OE1-CE 3.41Å; E51-K55 IonicContact OE1-NZ 3.96Å; E51-K55 PolarHBondContact OE1-NZ 2.74Å; E51-K55 WeakPolarHBondContact OE2-CE 3.36Å; E51-K55 IonicContact OE2-NZ 3.81Å; E51-K55 PolarHBondContact OE2-NZ 2.61Å; A52-K55 PolarHBondContact O-N 3.45Å; K55-R59 WeakPolarHBondContact O-CB 3.45Å; K55-R59 PolarHBondContact O-N 3.38Å
56	C	70.5	Confident	66.6	Low	59 Å²	59	105.3 Å²	105.3	40%	0.399	57%	0.567	S	S	.	*	H	α-helix	trans	-68.4	-46.4	176.3	-70.3	0	0	0	0	112.1	A52 M53 L54 V58 R59 D60	A52-C56 WeakPolarHBondContact O-CB 3.42Å; A52-C56 PolarHBondContact O-N 2.67Å; A52-C56 PolarHBondContact O-SG 2.99Å; M53-C56 PolarHBondContact O-N 2.91Å; L54-C56 VanDerWaalsContact C-N 3.3Å; L54-C56 PolarHBondContact O-N 3.46Å; C56-V58 PolarHBondContact O-N 2.95Å; C56-R59 PolarHBondContact O-N 3.22Å; C56-D60 WeakPolarHBondContact O-CB 3.43Å; C56-D60 PolarHBondContact O-N 2.93Å
57	V	66.4	Low	64.1	Low	86 Å²	86	105.4 Å²	105.4	52%	0.521	58%	0.58	S	S	.	*	H	α-helix	trans	-59.4	-45.7	176.2	172.2	0	0	0	0	111.2	M53 L54 M61	M53-V57 WeakPolarHBondContact O-CG2 3.37Å; M53-V57 PolarHBondContact O-N 2.91Å; L54-V57 PolarHBondContact O-N 3.34Å; V57-M61 HydrophobicContact CG1-SD 4.44Å; V57-M61 WeakPolarHBondContact O-CB 3.46Å; V57-M61 WeakPolarHBondContact O-CG 3.16Å; V57-M61 PolarHBondContact O-N 3.24Å
58	V	69.4	Low	61.9	Low	91 Å²	91	109 Å²	109	55%	0.552	59%	0.594	S	S	*	*	H	α-helix	trans	-64.3	-46.3	177.4	171.8	0	0	0	0	111.5	L54 C56 D60 M61 A62	L54-V58 WeakPolarHBondContact O-CB 3.31Å; L54-V58 WeakPolarHBondContact O-CG2 3.22Å; L54-V58 PolarHBondContact O-N 3.29Å; C56-V58 PolarHBondContact O-N 2.95Å; V58-D60 VanDerWaalsContact C-N 3.34Å; V58-D60 PolarHBondContact O-N 3.37Å; V58-M61 PolarHBondContact O-N 3.01Å; V58-A62 VanDerWaalsContact O-CB 3.27Å; V58-A62 WeakPolarHBondContact O-CB 3.43Å; V58-A62 PolarHBondContact O-N 2.83Å
59	R	65.7	Low	59.5	Low	146 Å²	146	109.3 Å²	109.3	55%	0.551	60%	0.604	S	S	*	*	H	α-helix	trans	-64.9	-36.8	-179.3	-170.8	-161	69.3	-171.9	-6.2	112.7	K55 C56 M61 A62	K55-R59 WeakPolarHBondContact O-CB 3.45Å; K55-R59 PolarHBondContact O-N 3.38Å; C56-R59 PolarHBondContact O-N 3.22Å; R59-M61 VanDerWaalsContact C-N 3.35Å; R59-A62 PolarHBondContact O-N 3.14Å
60	D	63.4	Low	57.5	Low	100 Å²	100	110.3 Å²	110.3	54%	0.535	62%	0.621	S	S	.	*	H	α-helix	trans	-80.3	-19.6	-179.7	-66.7	-1.2	0	0	0	111.7	C56 V58	C56-D60 WeakPolarHBondContact O-CB 3.43Å; C56-D60 PolarHBondContact O-N 2.93Å; V58-D60 VanDerWaalsContact C-N 3.34Å; V58-D60 PolarHBondContact O-N 3.37Å
61	M	52.4	Low	55.3	Low	122 Å²	122	114.7 Å²	114.7	60%	0.601	63%	0.632	S	S	*	*	H	α-helix	trans	-78.4	-35.3	164.7	-76.1	-173.7	163	0	0	113.7	V57 V58 R59 K63 F203	V57-M61 HydrophobicContact CG1-SD 4.44Å; V57-M61 WeakPolarHBondContact O-CB 3.46Å; V57-M61 WeakPolarHBondContact O-CG 3.16Å; V57-M61 PolarHBondContact O-N 3.24Å; V58-M61 PolarHBondContact O-N 3.01Å; R59-M61 VanDerWaalsContact C-N 3.35Å; M61-K63 PolarHBondContact O-N 2.97Å; M61-K63 VanDerWaalsContact O-N 3.14Å; M61-F203 HydrophobicContact CE-CD1 4Å; M61-F203 HydrophobicContact CE-CE1 3.54Å; M61-F203 HydrophobicContact CE-CZ 4.02Å
62	A	54.4	Low	53.1	Low	63 Å²	63	116.6 Å²	116.6	52%	0.521	65%	0.646	S	S	.	*	S	Bend	trans	-78.6	11.1	-172.2	0	0	0	0	0	115.4	V58 R59 P64	V58-A62 VanDerWaalsContact O-CB 3.27Å; V58-A62 WeakPolarHBondContact O-CB 3.43Å; V58-A62 PolarHBondContact O-N 2.83Å; R59-A62 PolarHBondContact O-N 3.14Å; A62-P64 WeakPolarHBondContact O-CD 3.22Å
63	K	43.7	Very low	51	Low	158 Å²	158	119.1 Å²	119.1	69%	0.687	67%	0.666	S	S	*	*			trans	-107.9	95.9	-165.4	-145.4	171.3	-168.8	174.4	0	112.8	M61	M61-K63 PolarHBondContact O-N 2.97Å; M61-K63 VanDerWaalsContact O-N 3.14Å
64	P	40.3	Very low	49.3	Very low	84 Å²	84	122.1 Å²	122.1	55%	0.545	68%	0.679	S	S	.	*			trans	-68.5	144.9	177.8	28.5	-34.9	0	0	0	111.9	A62	A62-P64 WeakPolarHBondContact O-CD 3.22Å
65	A	36.7	Very low	47.6	Very low	102 Å²	102	122.7 Å²	122.7	84%	0.843	69%	0.692	S	S	*	*			trans	-82.9	120.4	-175.2	0	0	0	0	0	112.6
66	A	37.4	Very low	45.8	Very low	101 Å²	101	126.3 Å²	126.3	84%	0.835	71%	0.711	S	S	*	*			trans	-112.6	107.4	171.7	0	0	0	0	0	110.7
67	C	29.5	Very low	44.4	Very low	123 Å²	123	128.1 Å²	128.1	83%	0.831	72%	0.722	S	S	*	*			trans	-77.1	132.9	178.6	-61.7	0	0	0	0	112
68	K	38.9	Very low	43.1	Very low	208 Å²	208	133 Å²	133	90%	0.904	74%	0.739	S	S	*	*			trans	-135.6	139.3	160	-71.8	-170.5	177.1	-179.2	0	110.2
69	T	34	Very low	41.5	Very low	133 Å²	133	137.2 Å²	137.2	82%	0.816	75%	0.752	S	S	*	*			trans	-122.8	138.8	-176.6	-42	0	0	0	0	109.8
70	P	40.5	Very low	40.5	Very low	124 Å²	124	135.8 Å²	135.8	81%	0.805	76%	0.762	S	S	*	*			trans	-118.1	161.6	154.7	35.3	-25.1	0	0	0	111.8
71	R	34	Very low	39.6	Very low	221 Å²	221	136.2 Å²	136.2	83%	0.834	77%	0.77	S	S	*	*			trans	-146.3	141.5	-169.9	-150.1	-168.4	-176.2	-178	2.4	112.2
72	N	33.7	Very low	38.7	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	78%	0.782	S	S	*	*			trans	72.5	166.9	159.2	-74.8	11.9	0	0	0	121.3
73	A	38.1	Very low	37.8	Very low	98 Å²	98	142.4 Å²	142.4	81%	0.81	80%	0.796	S	S	*	*			trans	81.5	143.1	173.7	0	0	0	0	0	118.4
74	E	36.3	Very low	37.4	Very low	181 Å²	181	142 Å²	142	85%	0.846	80%	0.8	S	S	*	*				175.7	118.4	-75.6	177.6	174.2	157.2	0	0	111.5
75	S	37.7	Very low	36.8	Very low	123 Å²	123	148.8 Å²	148.8	86%	0.86	82%	0.821	S	S	*	*			trans	-167	154.3	166.8	56.5	0	0	0	0	113.4
76	Q	39.4	Very low	36.6	Very low	190 Å²	190	154.9 Å²	154.9	89%	0.888	82%	0.823	S	S	*	*			trans	-104.2	177.7	-155.7	-89.6	-151.7	36	0	0	117.9
77	P	41.4	Very low	36.2	Very low	98 Å²	98	155.7 Å²	155.7	64%	0.636	82%	0.821	S	S	*	*			trans	-122	-174.7	-158.7	45.3	-34.8	0	0	0	116.7
78	H	38.3	Very low	36.3	Very low	187 Å²	187	156.5 Å²	156.5	87%	0.866	82%	0.822	S	S	*	*			trans	-145.1	-174.1	160.6	-95.6	-74.6	0	0	0	113.4
79	Q	36.7	Very low	35.8	Very low	180 Å²	180	152 Å²	152	84%	0.841	82%	0.815	S	S	*	*			trans	-106.5	161.9	-143.3	-68.3	177.1	-27	0	0	119.3
80	P	43.5	Very low	35.7	Very low	116 Å²	116	152 Å²	152	75%	0.753	82%	0.815	S	S	*	*			trans	-107.4	-172	174.1	45.8	-37.4	0	0	0	112.8
81	P	43.7	Very low	35.3	Very low	109 Å²	109	151.8 Å²	151.8	71%	0.708	81%	0.813	S	S	*	*				-161.9	-179.9	82.2	45.7	-24.6	0	0	0	119.1
82	L	34.9	Very low	34.9	Very low	162 Å²	162	153.1 Å²	153.1	85%	0.848	82%	0.818	S	S	*	*			trans	59.9	115.6	163.1	-49.8	-174.1	0	0	0	118.6
83	N	34.3	Very low	34.7	Very low	153 Å²	153	155.4 Å²	155.4	82%	0.818	82%	0.821	S	S	*	*				-167.7	172.4	67.3	-146.6	-15.6	0	0	0	112.9
84	I	35.2	Very low	34.1	Very low	151 Å²	151	156.7 Å²	156.7	77%	0.774	82%	0.822	S	S	*	*	S	Bend	trans	69.1	131.5	-179.9	-55.5	175.4	0	0	0	114.8	R86	I84-R86 PolarHBondContact O-N 3.01Å
85	F	29.1	Very low	33.8	Very low	226 Å²	226	153 Å²	153	99%	0.991	82%	0.816	S	S	*	*			trans	-71.1	96.1	-172.2	-83.9	-95.9	0	0	0	113.4
86	R	31.8	Very low	33.4	Very low	229 Å²	229	149.2 Å²	149.2	86%	0.864	79%	0.789	S	S	*	*			trans	-133.2	133.8	173	-163.7	173.2	-174.8	167.8	1.3	111.7	I84	I84-R86 PolarHBondContact O-N 3.01Å
87	C	29.3	Very low	33.2	Very low	119 Å²	119	146.1 Å²	146.1	80%	0.804	78%	0.775	S	S	*	*			trans	-2.3	115.2	165.8	-170.3	0	0	0	0	118.5
88	V	30.6	Very low	32.7	Very low	139 Å²	139	150.4 Å²	150.4	84%	0.842	79%	0.787	S	S	*	*			trans	-136.4	135.8	151.2	-177.5	0	0	0	0	110.9
89	C	29.7	Very low	32.6	Very low	113 Å²	113	142.3 Å²	142.3	76%	0.764	75%	0.754	S	S	*	*			trans	-41.2	139.8	-175	-53.4	0	0	0	0	119.2
90	V	31.1	Very low	33.2	Very low	135 Å²	135	137.5 Å²	137.5	82%	0.818	75%	0.752	S	S	*	*			trans	-119.1	144.6	143.5	176.1	0	0	0	0	106.3
91	P	32.4	Very low	33.3	Very low	118 Å²	118	137.2 Å²	137.2	77%	0.766	75%	0.75	S	S	*	*			trans	-59.9	146.2	-155.2	-30	37	0	0	0	117.3	K93	P91-K93 PolarHBondContact O-N 2.86Å; P91-K93 VanDerWaalsContact O-N 3.08Å
92	R	26	Very low	33.9	Very low	249 Å²	249	134.9 Å²	134.9	94%	0.94	73%	0.732	S	S	*	*			trans	-50.1	112.4	167.6	-78.1	177.9	166.8	178.4	-5.5	110.4
93	K	28.5	Very low	35	Very low	187 Å²	187	133.5 Å²	133.5	81%	0.813	72%	0.715	S	S	*	*			trans	-98.6	119	151.2	-81.7	-172.5	174.2	-179.2	0	108.2	P91 S95	P91-K93 PolarHBondContact O-N 2.86Å; P91-K93 VanDerWaalsContact O-N 3.08Å; K93-S95 PolarHBondContact O-N 3.01Å
94	P	25.6	Very low	36.6	Very low	126 Å²	126	128.5 Å²	128.5	82%	0.818	69%	0.688	S	S	*	*			trans	-73.5	82.4	169.7	30.8	-32.9	0	0	0	108.9	S96	P94-S96 PolarHBondContact O-N 3.08Å
95	S	31.5	Very low	38.3	Very low	103 Å²	103	129 Å²	129	72%	0.72	68%	0.681	S	S	*	*			trans	-81.7	50.6	-178.6	62.9	0	0	0	0	113.1	K93 E97	K93-S95 PolarHBondContact O-N 3.01Å; S95-E97 PolarHBondContact O-N 2.93Å
96	S	28.3	Very low	40.6	Very low	43 Å²	43	124 Å²	124	30%	0.301	66%	0.655	S	S	.	*			trans	35.4	82.2	154.4	64.2	0	0	0	0	117.1	P94 R106	P94-S96 PolarHBondContact O-N 3.08Å; S96-R106 PolarHBondContact OG-NH1 2.91Å
97	E	34.6	Very low	42.7	Very low	126 Å²	126	114.6 Å²	114.6	59%	0.589	62%	0.622	S	S	*	*			trans	-132.9	11.1	148.2	-86.8	-131.5	72.3	0	0	113.8	S95 G99 R103	S95-E97 PolarHBondContact O-N 2.93Å; E97-G99 PolarHBondContact O-N 3.02Å; E97-R103 IonicContact OE1-CZ 2.68Å; E97-R103 IonicContact OE1-NE 2.75Å; E97-R103 PolarHBondContact OE1-NE 3.11Å; E97-R103 IonicContact OE1-NH1 3.63Å; E97-R103 PolarHBondContact OE1-NH1 2.66Å; E97-R103 IonicContact OE1-NH2 3.34Å; E97-R103 IonicContact OE2-CZ 3.57Å; E97-R103 IonicContact OE2-NE 3.54Å; E97-R103 IonicContact OE2-NH1 2.77Å; E97-R103 PolarHBondContact OE2-NH1 3.43Å; E97-R103 IonicContact OE2-NH2 3.96Å; E97-R103 PolarHBondContact OE2-NH2 2.68Å
98	E	31.6	Very low	45	Very low	188 Å²	188	112.5 Å²	112.5	88%	0.879	60%	0.6	S	S	*	*			trans	-59.5	114.6	132.9	-72.7	-172.9	167.9	0	0	106.2
99	G	36.7	Very low	47.5	Very low	17 Å²	17	111.3 Å²	111.3	18%	0.175	59%	0.586	C	S	.	*			trans	-165.6	11.3	-161.4	0	0	0	0	0	116.5	E97 P101 D102 R103	E97-G99 PolarHBondContact O-N 3.02Å; G99-P101 CarbonylContact O-C 3.52Å; G99-D102 PolarHBondContact O-N 2.86Å; G99-R103 WeakPolarHBondContact O-CB 3.48Å; G99-R103 PolarHBondContact O-N 3.03Å
100	G	48.4	Very low	49.8	Very low	78 Å²	78	111.8 Å²	111.8	80%	0.804	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.6	-44.9	176.9	0	0	0	0	0	112.8
101	P	46.5	Very low	52.3	Low	110 Å²	110	105.8 Å²	105.8	71%	0.714	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-47	165	-5.4	24.6	0	0	0	113.2	G99 R103 N104 W105	G99-P101 CarbonylContact O-C 3.52Å; P101-R103 VanDerWaalsContact C-N 3.34Å; P101-R103 PolarHBondContact O-N 2.97Å; P101-N104 WeakPolarHBondContact O-CA 3.36Å; P101-N104 WeakPolarHBondContact O-CB 3.33Å; P101-N104 PolarHBondContact O-N 3.31Å; P101-W105 PolarHBondContact O-N 3.44Å
102	D	55.2	Low	54.7	Low	60 Å²	60	104.4 Å²	104.4	32%	0.321	52%	0.523	S	S	.	.	H	α-helix	trans	-67.9	-28.5	-162.7	-169.2	44.9	0	0	0	114	G99 R106	G99-D102 PolarHBondContact O-N 2.86Å; D102-R106 PolarHBondContact O-N 2.94Å; D102-R106 IonicContact OD2-CZ 3.76Å; D102-R106 IonicContact OD2-NE 3.33Å
103	R	59.9	Low	57.5	Low	134 Å²	134	96.3 Å²	96.3	51%	0.506	50%	0.504	S	S	.	.	H	α-helix	trans	-71.5	-34.9	173.9	-129.8	-172.9	-179	174.2	14.8	111.9	E97 G99 P101 L107	E97-R103 IonicContact OE1-CZ 2.68Å; E97-R103 IonicContact OE1-NE 2.75Å; E97-R103 PolarHBondContact OE1-NE 3.11Å; E97-R103 IonicContact OE1-NH1 3.63Å; E97-R103 PolarHBondContact OE1-NH1 2.66Å; E97-R103 IonicContact OE1-NH2 3.34Å; E97-R103 IonicContact OE2-CZ 3.57Å; E97-R103 IonicContact OE2-NE 3.54Å; E97-R103 IonicContact OE2-NH1 2.77Å; E97-R103 PolarHBondContact OE2-NH1 3.43Å; E97-R103 IonicContact OE2-NH2 3.96Å; E97-R103 PolarHBondContact OE2-NH2 2.68Å; G99-R103 WeakPolarHBondContact O-CB 3.48Å; G99-R103 PolarHBondContact O-N 3.03Å; P101-R103 VanDerWaalsContact C-N 3.34Å; P101-R103 PolarHBondContact O-N 2.97Å; R103-L107 WeakPolarHBondContact O-CG 3.41Å; R103-L107 PolarHBondContact O-N 2.59Å; R103-L107 VanDerWaalsContact O-N 3.11Å
104	N	66.1	Low	60	Low	47 Å²	47	90.2 Å²	90.2	25%	0.251	48%	0.477	S	S	.	.	H	α-helix	trans	-69.6	-41.7	175	-165.6	3.7	0	0	0	110.8	P101 L107 H108 S198	P101-N104 WeakPolarHBondContact O-CA 3.36Å; P101-N104 WeakPolarHBondContact O-CB 3.33Å; P101-N104 PolarHBondContact O-N 3.31Å; N104-L107 PolarHBondContact O-N 2.97Å; N104-H108 PolarHBondContact O-N 2.76Å; N104-H108 PolarHBondContact O-ND1 3.45Å; N104-H108 PolarHBondContact OD1-CE1 3.16Å; N104-H108 PolarHBondContact OD1-ND1 3.02Å; N104-S198 WeakPolarHBondContact OD1-CB 3.46Å
105	W	70.7	Confident	62.7	Low	163 Å²	163	88 Å²	88	62%	0.617	45%	0.454	S	S	*	.	H	α-helix	trans	-57.4	-51.2	171.8	175.1	-108.3	0	0	0	112.3	P101 L107 H108 Q109	P101-W105 PolarHBondContact O-N 3.44Å; W105-L107 VanDerWaalsContact C-N 3.31Å; W105-L107 PolarHBondContact O-N 3.29Å; W105-H108 PolarHBondContact O-N 2.92Å; W105-Q109 WeakPolarHBondContact O-CB 3.27Å; W105-Q109 PolarHBondContact O-N 3.47Å
106	R	77.8	Confident	65.2	Low	120 Å²	120	87 Å²	87	45%	0.453	44%	0.438	S	S	.	.	H	α-helix	trans	-60.4	-36.7	177	-78.8	-176.4	177.7	166.7	5.9	113.5	S96 D102 Q110	S96-R106 PolarHBondContact OG-NH1 2.91Å; D102-R106 PolarHBondContact O-N 2.94Å; D102-R106 IonicContact OD2-CZ 3.76Å; D102-R106 IonicContact OD2-NE 3.33Å; R106-Q110 WeakPolarHBondContact O-CG 3.25Å; R106-Q110 PolarHBondContact O-N 3.41Å
107	L	76	Confident	67.7	Low	32 Å²	32	90.4 Å²	90.4	17%	0.168	45%	0.449	C	S	.	.	H	α-helix	trans	-66.4	-44.8	175.1	-74.4	169.2	0	0	0	111.4	R103 N104 W105 Q110 F111 I194 K197	R103-L107 WeakPolarHBondContact O-CG 3.41Å; R103-L107 PolarHBondContact O-N 2.59Å; R103-L107 VanDerWaalsContact O-N 3.11Å; N104-L107 PolarHBondContact O-N 2.97Å; W105-L107 VanDerWaalsContact C-N 3.31Å; W105-L107 PolarHBondContact O-N 3.29Å; L107-Q110 CarbonylContact O-C 3.29Å; L107-Q110 PolarHBondContact O-N 2.89Å; L107-F111 PolarHBondContact O-N 3.18Å; L107-I194 HydrophobicContact CB-CG1 4.43Å; L107-I194 HydrophobicContact CB-CG2 4.03Å; L107-I194 HydrophobicContact CD2-CG1 4.46Å; L107-I194 WeakPolarHBondContact O-CD1 3.27Å; L107-K197 HydrophobicContact CD1-CB 3.93Å; L107-K197 HydrophobicContact CD2-CD 4.44Å
108	H	78.5	Confident	69.7	Low	75 Å²	75	85.4 Å²	85.4	35%	0.347	43%	0.427	S	S	.	.	H	α-helix	trans	-63.2	-40.9	174.7	-80.6	85.9	0	0	0	112.5	N104 W105 Q110 F111 E112	N104-H108 PolarHBondContact O-N 2.76Å; N104-H108 PolarHBondContact O-ND1 3.45Å; N104-H108 PolarHBondContact OD1-CE1 3.16Å; N104-H108 PolarHBondContact OD1-ND1 3.02Å; W105-H108 PolarHBondContact O-N 2.92Å; H108-Q110 VanDerWaalsContact C-N 3.3Å; H108-Q110 PolarHBondContact O-N 2.92Å; H108-F111 WeakPolarHBondContact O-CA 3.31Å; H108-F111 VanDerWaalsContact O-CB 3.28Å; H108-F111 WeakPolarHBondContact O-CB 3.46Å; H108-F111 PolarHBondContact O-N 3.14Å; H108-E112 PolarHBondContact O-N 2.83Å
109	Q	82	Confident	72	Confident	114 Å²	114	82.6 Å²	82.6	53%	0.533	41%	0.408	S	S	.	.	H	α-helix	trans	-62.3	-36.7	174.7	-162.3	178.3	48.8	0	0	111.9	W105 F111 S113	W105-Q109 WeakPolarHBondContact O-CB 3.27Å; W105-Q109 PolarHBondContact O-N 3.47Å; Q109-F111 VanDerWaalsContact C-N 3.28Å; Q109-F111 PolarHBondContact O-N 2.81Å; Q109-S113 WeakPolarHBondContact O-CB 3.39Å; Q109-S113 PolarHBondContact O-N 3.27Å
110	Q	79.2	Confident	74.1	Confident	122 Å²	122	88.1 Å²	88.1	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-72.5	-13.6	170.3	-74.1	-171.6	3.5	0	0	114.5	R106 L107 H108 Y114 K190	R106-Q110 WeakPolarHBondContact O-CG 3.25Å; R106-Q110 PolarHBondContact O-N 3.41Å; L107-Q110 CarbonylContact O-C 3.29Å; L107-Q110 PolarHBondContact O-N 2.89Å; H108-Q110 VanDerWaalsContact C-N 3.3Å; H108-Q110 PolarHBondContact O-N 2.92Å; Q110-Y114 WeakPolarHBondContact O-CB 3.48Å; Q110-K190 PolarHBondContact O-NZ 3.38Å
111	F	82.6	Confident	75.4	Confident	9 Å²	9	87.3 Å²	87.3	4%	0.039	40%	0.404	C	S	.	.	H	α-helix	trans	-82.7	-53.2	170.6	-170.1	-122.6	0	0	0	110.9	L107 H108 Q109 S113 Y114 K115 K190 Q191 I194	L107-F111 PolarHBondContact O-N 3.18Å; H108-F111 WeakPolarHBondContact O-CA 3.31Å; H108-F111 VanDerWaalsContact O-CB 3.28Å; H108-F111 WeakPolarHBondContact O-CB 3.46Å; H108-F111 PolarHBondContact O-N 3.14Å; Q109-F111 VanDerWaalsContact C-N 3.28Å; Q109-F111 PolarHBondContact O-N 2.81Å; F111-S113 PolarHBondContact O-N 3.16Å; F111-Y114 CarbonylContact O-C 3.58Å; F111-Y114 WeakPolarHBondContact O-CA 3.42Å; F111-Y114 WeakPolarHBondContact O-CB 3.46Å; F111-Y114 PolarHBondContact O-N 3.45Å; F111-K115 HydrophobicContact CD1-CD 4.16Å; F111-K115 HydrophobicContact CE1-CD 3.93Å; F111-K115 HydrophobicContact CE1-CG 4.42Å; F111-K115 HydrophobicContact CZ-CD 4.42Å; F111-K115 HydrophobicContact CZ-CG 4.45Å; F111-K115 PolarHBondContact O-N 2.76Å; F111-K190 HydrophobicContact CE2-CB 4.45Å; F111-Q191 HydrophobicContact CE1-CB 4.34Å; F111-Q191 HydrophobicContact CE1-CG 4.02Å; F111-Q191 HydrophobicContact CE2-CB 3.72Å; F111-Q191 HydrophobicContact CE2-CG 4.3Å; F111-Q191 HydrophobicContact CZ-CB 3.57Å; F111-Q191 HydrophobicContact CZ-CG 3.74Å; F111-I194 HydrophobicContact CB-CD1 3.67Å; F111-I194 HydrophobicContact CD2-CD1 4.02Å; F111-I194 HydrophobicContact CG-CD1 4.15Å
112	E	83.9	Confident	76.5	Confident	90 Å²	90	82.1 Å²	82.1	42%	0.421	37%	0.371	S	S	.	.	H	α-helix	trans	-65.2	-39.5	-179.8	-61	-50.9	127.5	0	0	111.7	H108 Y114 K115 E116	H108-E112 PolarHBondContact O-N 2.83Å; E112-Y114 PolarHBondContact O-N 3.45Å; E112-K115 WeakPolarHBondContact O-CB 3.45Å; E112-K115 PolarHBondContact O-N 2.85Å; E112-K115 WeakPolarHBondContact OE1-CD 3.37Å; E112-K115 WeakPolarHBondContact OE1-CE 3.31Å; E112-K115 IonicContact OE1-NZ 3.94Å; E112-K115 PolarHBondContact OE1-NZ 3.26Å; E112-K115 WeakPolarHBondContact OE2-CD 3.14Å; E112-K115 IonicContact OE2-NZ 3.62Å; E112-K115 PolarHBondContact OE2-NZ 2.88Å; E112-E116 VanDerWaalsContact O-CB 3.29Å; E112-E116 WeakPolarHBondContact O-CB 3.44Å; E112-E116 PolarHBondContact O-N 3.07Å
113	S	83.5	Confident	77.4	Confident	78 Å²	78	81.2 Å²	81.2	55%	0.545	37%	0.365	S	S	.	.	H	α-helix	trans	-58.5	-34	170.6	176.5	0	0	0	0	112.7	Q109 F111 Q117	Q109-S113 WeakPolarHBondContact O-CB 3.39Å; Q109-S113 PolarHBondContact O-N 3.27Å; F111-S113 PolarHBondContact O-N 3.16Å; S113-Q117 WeakPolarHBondContact O-CB 3.29Å; S113-Q117 PolarHBondContact O-N 3.36Å
114	Y	81.8	Confident	78	Confident	60 Å²	60	78.8 Å²	78.8	24%	0.235	36%	0.359	C	S	.	.	H	α-helix	trans	-79.2	-39.6	178.2	-177.8	-108	0	0	0	112.9	Q110 F111 E112 E116 Q117 V118 L187 K190	Q110-Y114 WeakPolarHBondContact O-CB 3.48Å; F111-Y114 CarbonylContact O-C 3.58Å; F111-Y114 WeakPolarHBondContact O-CA 3.42Å; F111-Y114 WeakPolarHBondContact O-CB 3.46Å; F111-Y114 PolarHBondContact O-N 3.45Å; E112-Y114 PolarHBondContact O-N 3.45Å; Y114-E116 VanDerWaalsContact C-N 3.32Å; Y114-Q117 PolarHBondContact O-N 2.95Å; Y114-V118 HydrophobicContact CE1-CG2 4.39Å; Y114-V118 HydrophobicContact CE2-CG2 4.46Å; Y114-V118 VanDerWaalsContact O-CG2 3.31Å; Y114-V118 WeakPolarHBondContact O-CG2 3.29Å; Y114-V118 PolarHBondContact O-N 3.08Å; Y114-L187 HydrophobicContact CE1-CD1 4.26Å; Y114-K190 HydrophobicContact CD1-CD 3.57Å; Y114-K190 HydrophobicContact CE1-CD 4.03Å; Y114-K190 HydrophobicContact CG-CD 3.94Å
115	K	82.5	Confident	78	Confident	79 Å²	79	77 Å²	77	34%	0.343	35%	0.351	S	S	.	.	H	α-helix	trans	-54.5	-49.8	167.1	-88.2	165.8	153.1	-178.5	0	110.7	F111 E112 V118 R119 L187	F111-K115 HydrophobicContact CD1-CD 4.16Å; F111-K115 HydrophobicContact CE1-CD 3.93Å; F111-K115 HydrophobicContact CE1-CG 4.42Å; F111-K115 HydrophobicContact CZ-CD 4.42Å; F111-K115 HydrophobicContact CZ-CG 4.45Å; F111-K115 PolarHBondContact O-N 2.76Å; E112-K115 WeakPolarHBondContact O-CB 3.45Å; E112-K115 PolarHBondContact O-N 2.85Å; E112-K115 WeakPolarHBondContact OE1-CD 3.37Å; E112-K115 WeakPolarHBondContact OE1-CE 3.31Å; E112-K115 IonicContact OE1-NZ 3.94Å; E112-K115 PolarHBondContact OE1-NZ 3.26Å; E112-K115 WeakPolarHBondContact OE2-CD 3.14Å; E112-K115 IonicContact OE2-NZ 3.62Å; E112-K115 PolarHBondContact OE2-NZ 2.88Å; K115-V118 CarbonylContact O-C 3.48Å; K115-V118 WeakPolarHBondContact O-CB 3.37Å; K115-V118 PolarHBondContact O-N 3.3Å; K115-V118 VanDerWaalsContact O-N 3.14Å; K115-R119 PolarHBondContact O-N 2.89Å; K115-L187 HydrophobicContact CG-CD2 4.11Å
116	E	84.4	Confident	77.7	Confident	83 Å²	83	76.7 Å²	76.7	39%	0.388	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-40.6	-177.6	177.7	54.9	-161.9	0	0	111.7	E112 Y114 V118 R119 K120	E112-E116 VanDerWaalsContact O-CB 3.29Å; E112-E116 WeakPolarHBondContact O-CB 3.44Å; E112-E116 PolarHBondContact O-N 3.07Å; Y114-E116 VanDerWaalsContact C-N 3.32Å; E116-V118 VanDerWaalsContact C-N 3.28Å; E116-V118 PolarHBondContact O-N 2.85Å; E116-R119 VanDerWaalsContact CD-NH2 3.28Å; E116-R119 PolarHBondContact O-N 3.3Å; E116-R119 IonicContact OE1-CZ 3.06Å; E116-R119 IonicContact OE1-NE 3.98Å; E116-R119 IonicContact OE1-NH2 3.96Å; E116-R119 PolarHBondContact OE1-NH2 3.25Å; E116-R119 IonicContact OE2-CZ 2.99Å; E116-R119 IonicContact OE2-NE 2.74Å; E116-R119 PolarHBondContact OE2-NE 3.23Å; E116-R119 IonicContact OE2-NH2 4Å; E116-R119 PolarHBondContact OE2-NH2 3.29Å; E116-K120 WeakPolarHBondContact O-CB 3.31Å; E116-K120 PolarHBondContact O-N 3.48Å
117	Q	79.4	Confident	77.1	Confident	114 Å²	114	79.5 Å²	79.5	53%	0.533	36%	0.36	S	S	.	.	H	α-helix	trans	-59.6	-40	171.8	-170.8	179.3	23.4	0	0	111.8	S113 Y114 I121	S113-Q117 WeakPolarHBondContact O-CB 3.29Å; S113-Q117 PolarHBondContact O-N 3.36Å; Y114-Q117 PolarHBondContact O-N 2.95Å; Q117-I121 HydrophobicContact CG-CD1 4.13Å; Q117-I121 WeakPolarHBondContact O-CB 3.25Å; Q117-I121 WeakPolarHBondContact O-CD1 3.48Å; Q117-I121 VanDerWaalsContact O-CG1 3.22Å; Q117-I121 WeakPolarHBondContact O-CG1 3.31Å; Q117-I121 PolarHBondContact O-N 3.05Å
118	V	77.4	Confident	76.3	Confident	21 Å²	21	87.6 Å²	87.6	13%	0.127	39%	0.39	C	S	.	.	H	α-helix	trans	-67.6	-44.6	175.6	168.7	0	0	0	0	111.5	Y114 K115 E116 K120 I121 G122 I141 L187	Y114-V118 HydrophobicContact CE1-CG2 4.39Å; Y114-V118 HydrophobicContact CE2-CG2 4.46Å; Y114-V118 VanDerWaalsContact O-CG2 3.31Å; Y114-V118 WeakPolarHBondContact O-CG2 3.29Å; Y114-V118 PolarHBondContact O-N 3.08Å; K115-V118 CarbonylContact O-C 3.48Å; K115-V118 WeakPolarHBondContact O-CB 3.37Å; K115-V118 PolarHBondContact O-N 3.3Å; K115-V118 VanDerWaalsContact O-N 3.14Å; E116-V118 VanDerWaalsContact C-N 3.28Å; E116-V118 PolarHBondContact O-N 2.85Å; V118-K120 VanDerWaalsContact C-N 3.34Å; V118-K120 PolarHBondContact O-N 3.29Å; V118-I121 PolarHBondContact O-N 2.7Å; V118-G122 PolarHBondContact O-N 3.36Å; V118-I141 HydrophobicContact CG1-CG2 3.77Å; V118-I141 VanDerWaalsContact CG1-O 3.22Å; V118-I141 WeakPolarHBondContact CG1-O 3.18Å; V118-L187 HydrophobicContact CB-CD1 4.49Å; V118-L187 HydrophobicContact CG1-CD1 4.14Å; V118-L187 HydrophobicContact CG2-CD1 4.16Å
119	R	79.8	Confident	75	Confident	128 Å²	128	88.8 Å²	88.8	48%	0.483	40%	0.396	S	S	.	.	H	α-helix	trans	-56.8	-48.1	174.2	-173.9	-176.5	70.2	105.9	-10.1	111	K115 E116 I121 G122 E123	K115-R119 PolarHBondContact O-N 2.89Å; E116-R119 VanDerWaalsContact CD-NH2 3.28Å; E116-R119 PolarHBondContact O-N 3.3Å; E116-R119 IonicContact OE1-CZ 3.06Å; E116-R119 IonicContact OE1-NE 3.98Å; E116-R119 IonicContact OE1-NH2 3.96Å; E116-R119 PolarHBondContact OE1-NH2 3.25Å; E116-R119 IonicContact OE2-CZ 2.99Å; E116-R119 IonicContact OE2-NE 2.74Å; E116-R119 PolarHBondContact OE2-NE 3.23Å; E116-R119 IonicContact OE2-NH2 4Å; E116-R119 PolarHBondContact OE2-NH2 3.29Å; R119-I121 PolarHBondContact O-N 3.35Å; R119-G122 CarbonylContact O-C 3.59Å; R119-G122 WeakPolarHBondContact O-CA 3.33Å; R119-G122 PolarHBondContact O-N 3.26Å; R119-G122 VanDerWaalsContact O-N 3.08Å; R119-E123 IonicContact CZ-OE1 2.79Å; R119-E123 IonicContact NE-OE1 3.04Å; R119-E123 IonicContact NH1-OE1 3.7Å; R119-E123 PolarHBondContact NH1-OE1 2.62Å; R119-E123 IonicContact NH1-OE2 3.95Å; R119-E123 PolarHBondContact O-N 2.88Å
120	K	79.8	Confident	73.4	Confident	134 Å²	134	86.3 Å²	86.3	58%	0.583	40%	0.4	S	S	*	.	H	α-helix	trans	-62.3	-39.6	179	-169.5	168.7	-176.6	171.9	0	112.3	E116 V118 G122 E123 E124	E116-K120 WeakPolarHBondContact O-CB 3.31Å; E116-K120 PolarHBondContact O-N 3.48Å; V118-K120 VanDerWaalsContact C-N 3.34Å; V118-K120 PolarHBondContact O-N 3.29Å; K120-G122 VanDerWaalsContact C-N 3.33Å; K120-G122 PolarHBondContact O-N 3.15Å; K120-E123 PolarHBondContact O-N 3.31Å; K120-E124 WeakPolarHBondContact O-CB 3.44Å; K120-E124 PolarHBondContact O-N 2.63Å
121	I	75.8	Confident	71.7	Confident	60 Å²	60	90.1 Å²	90.1	31%	0.308	42%	0.418	S	S	.	.	H	α-helix	trans	-63.6	-37.5	172.8	-73	165.3	0	0	0	111.6	Q117 V118 R119 A125 K144	Q117-I121 HydrophobicContact CG-CD1 4.13Å; Q117-I121 WeakPolarHBondContact O-CB 3.25Å; Q117-I121 WeakPolarHBondContact O-CD1 3.48Å; Q117-I121 VanDerWaalsContact O-CG1 3.22Å; Q117-I121 WeakPolarHBondContact O-CG1 3.31Å; Q117-I121 PolarHBondContact O-N 3.05Å; V118-I121 PolarHBondContact O-N 2.7Å; R119-I121 PolarHBondContact O-N 3.35Å; I121-A125 WeakPolarHBondContact O-CB 3.04Å; I121-A125 PolarHBondContact O-N 3.45Å; I121-K144 HydrophobicContact CG2-CD 4.38Å; I121-K144 WeakPolarHBondContact O-CE 3.11Å
122	G	70.9	Confident	70.3	Confident	2 Å²	2	97 Å²	97	2%	0.021	45%	0.45	C	S	.	.	H	α-helix	trans	-71.1	-37.5	176.1	0	0	0	0	0	113.9	V118 R119 K120 A125 R126	V118-G122 PolarHBondContact O-N 3.36Å; R119-G122 CarbonylContact O-C 3.59Å; R119-G122 WeakPolarHBondContact O-CA 3.33Å; R119-G122 PolarHBondContact O-N 3.26Å; R119-G122 VanDerWaalsContact O-N 3.08Å; K120-G122 VanDerWaalsContact C-N 3.33Å; K120-G122 PolarHBondContact O-N 3.15Å; G122-A125 WeakPolarHBondContact O-CB 3.46Å; G122-R126 PolarHBondContact O-N 2.78Å
123	E	74.2	Confident	68.6	Low	41 Å²	41	102.2 Å²	102.2	19%	0.192	47%	0.472	C	S	.	.	H	α-helix	trans	-70.7	-41.4	172.4	-75.7	179	-156.1	0	0	112.8	R119 K120 A125 R126 R127	R119-E123 IonicContact CZ-OE1 2.79Å; R119-E123 IonicContact NE-OE1 3.04Å; R119-E123 IonicContact NH1-OE1 3.7Å; R119-E123 PolarHBondContact NH1-OE1 2.62Å; R119-E123 IonicContact NH1-OE2 3.95Å; R119-E123 PolarHBondContact O-N 2.88Å; K120-E123 PolarHBondContact O-N 3.31Å; E123-A125 VanDerWaalsContact C-N 3.26Å; E123-A125 PolarHBondContact O-N 2.94Å; E123-R126 CarbonylContact O-C 3.56Å; E123-R126 PolarHBondContact O-N 3.05Å; E123-R126 VanDerWaalsContact O-N 3.08Å; E123-R127 PolarHBondContact O-N 3.2Å; E123-R127 IonicContact OE2-CZ 2.77Å; E123-R127 IonicContact OE2-NH1 3.04Å; E123-R127 IonicContact OE2-NH2 3.14Å; E123-R127 PolarHBondContact OE2-NH2 3.28Å
124	E	72.2	Confident	67.1	Low	82 Å²	82	102.2 Å²	102.2	38%	0.383	47%	0.466	S	S	.	.	H	α-helix	trans	-60.6	-37.5	173.2	-176.7	-169.2	-105.9	0	0	111.4	K120 R126 R127 Y128 K144	K120-E124 WeakPolarHBondContact O-CB 3.44Å; K120-E124 PolarHBondContact O-N 2.63Å; E124-R126 VanDerWaalsContact C-N 3.31Å; E124-R126 PolarHBondContact O-N 2.68Å; E124-R127 PolarHBondContact O-N 2.72Å; E124-Y128 HydrophobicContact CG-CD2 4.22Å; E124-Y128 HydrophobicContact CG-CE2 4.41Å; E124-Y128 PolarHBondContact O-N 3.46Å; E124-Y128 VanDerWaalsContact O-N 3.13Å; E124-K144 IonicContact OE2-NZ 2.74Å; E124-K144 PolarHBondContact OE2-NZ 3.24Å
125	A	65.4	Low	65.9	Low	10 Å²	10	107 Å²	107	8%	0.083	50%	0.495	C	S	.	.	H	α-helix	trans	-59.8	-39.8	171.7	0	0	0	0	0	112.8	I121 G122 E123 Q129 H143 K144	I121-A125 WeakPolarHBondContact O-CB 3.04Å; I121-A125 PolarHBondContact O-N 3.45Å; G122-A125 WeakPolarHBondContact O-CB 3.46Å; E123-A125 VanDerWaalsContact C-N 3.26Å; E123-A125 PolarHBondContact O-N 2.94Å; A125-Q129 PolarHBondContact O-N 2.72Å; A125-H143 HydrophobicContact CB-CB 4.15Å; A125-K144 HydrophobicContact CB-CD 4.22Å; A125-K144 HydrophobicContact CB-CG 3.42Å; A125-K144 VanDerWaalsContact CB-CG 3.42Å
126	R	64.6	Low	65	Low	157 Å²	157	105.1 Å²	105.1	59%	0.592	49%	0.494	S	S	*	.	H	α-helix	trans	-73.8	-35	176.5	-71.1	-173.7	-70.3	-167.6	2.9	112.7	G122 E123 E124 Y128 Q129	G122-R126 PolarHBondContact O-N 2.78Å; E123-R126 CarbonylContact O-C 3.56Å; E123-R126 PolarHBondContact O-N 3.05Å; E123-R126 VanDerWaalsContact O-N 3.08Å; E124-R126 VanDerWaalsContact C-N 3.31Å; E124-R126 PolarHBondContact O-N 2.68Å; R126-Y128 VanDerWaalsContact C-N 3.29Å; R126-Y128 PolarHBondContact O-N 2.85Å; R126-Q129 PolarHBondContact O-N 3.18Å
127	R	65	Low	64.5	Low	178 Å²	178	104 Å²	104	67%	0.672	49%	0.494	S	S	*	.	H	α-helix	trans	-69.1	-24.2	175.1	-67.7	-172.4	-168.2	95.2	10.9	113.6	E123 E124	E123-R127 PolarHBondContact O-N 3.2Å; E123-R127 IonicContact OE2-CZ 2.77Å; E123-R127 IonicContact OE2-NH1 3.04Å; E123-R127 IonicContact OE2-NH2 3.14Å; E123-R127 PolarHBondContact OE2-NH2 3.28Å; E124-R127 PolarHBondContact O-N 2.72Å
128	Y	59.5	Low	64.7	Low	203 Å²	203	101 Å²	101	80%	0.796	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-8	174.5	-89.8	-78.7	0	0	0	114.6	E124 R126	E124-Y128 HydrophobicContact CG-CD2 4.22Å; E124-Y128 HydrophobicContact CG-CE2 4.41Å; E124-Y128 PolarHBondContact O-N 3.46Å; E124-Y128 VanDerWaalsContact O-N 3.13Å; R126-Y128 VanDerWaalsContact C-N 3.29Å; R126-Y128 PolarHBondContact O-N 2.85Å
129	Q	52.1	Low	65.3	Low	100 Å²	100	100 Å²	100	47%	0.467	48%	0.478	S	S	.	.	S	Bend	trans	-106.6	83.9	167.7	-70.5	-173.8	13	0	0	108.3	A125 R126 E131 K146	A125-Q129 PolarHBondContact O-N 2.72Å; R126-Q129 PolarHBondContact O-N 3.18Å; Q129-E131 PolarHBondContact O-N 2.64Å; Q129-K146 VanDerWaalsContact OE1-CE 3.29Å
130	G	47.7	Very low	65.6	Low	61 Å²	61	95.3 Å²	95.3	63%	0.629	47%	0.47	S	S	*	.			trans	-64.4	128.1	176.5	0	0	0	0	0	111.6	H132	G130-H132 PolarHBondContact O-N 2.58Å
131	E	43.7	Very low	65.9	Low	203 Å²	203	89.6 Å²	89.6	95%	0.949	45%	0.445	S	S	*	.	S	Bend	trans	41.8	28.2	159.4	-57.9	-133.6	88.5	0	0	119.6	Q129	Q129-E131 PolarHBondContact O-N 2.64Å
132	H	52.6	Low	66.4	Low	152 Å²	152	87.8 Å²	87.8	70%	0.704	44%	0.438	S	S	*	.			trans	-103.6	118.5	165.8	-108.9	-100.7	0	0	0	111.4	G130 D134	G130-H132 PolarHBondContact O-N 2.58Å; H132-D134 IonicContact ND1-OD1 3.73Å; H132-D134 PolarHBondContact O-N 3.48Å
133	K	48.5	Very low	67.1	Low	201 Å²	201	90.3 Å²	90.3	87%	0.874	45%	0.449	S	S	*	.			trans	-75.4	68.8	174.1	-68.4	-178.8	-180	175.5	0	110.5	D135	K133-D135 PolarHBondContact O-N 3.4Å
134	D	51.4	Low	67.5	Low	78 Å²	78	93.5 Å²	93.5	42%	0.417	46%	0.462	S	S	.	.			trans	-85.8	94.8	176.1	-66.5	-17.1	0	0	0	110.1	H132 A136 K146	H132-D134 IonicContact ND1-OD1 3.73Å; H132-D134 PolarHBondContact O-N 3.48Å; D134-A136 PolarHBondContact O-N 3.33Å; D134-K146 IonicContact OD2-NZ 2.74Å; D134-K146 PolarHBondContact OD2-NZ 3.18Å
135	D	58.2	Low	68	Low	159 Å²	159	92 Å²	92	85%	0.85	46%	0.459	S	S	*	.			trans	-64.4	2.8	174.8	-72.8	-59.2	0	0	0	114.3	K133	K133-D135 PolarHBondContact O-N 3.4Å
136	A	62	Low	68.8	Low	40 Å²	40	95.1 Å²	95.1	33%	0.331	47%	0.47	S	S	.	.	S	Bend	trans	-55.4	118.2	173.1	0	0	0	0	0	111.3	D134 T138 K146	D134-A136 PolarHBondContact O-N 3.33Å; A136-T138 PolarHBondContact O-N 2.82Å; A136-T138 VanDerWaalsContact O-N 3.13Å; A136-K146 HydrophobicContact CB-CB 4.38Å; A136-K146 HydrophobicContact CB-CD 4.16Å; A136-K146 HydrophobicContact CB-CG 4.22Å
137	P	75.3	Confident	69.7	Low	59 Å²	59	88 Å²	88	38%	0.383	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-61.6	121.3	-172.4	22	-32.2	0	0	0	111.1	F147	P137-F147 HydrophobicContact CB-CD2 4.34Å; P137-F147 HydrophobicContact CG-CB 4.43Å; P137-F147 WeakPolarHBondContact O-CB 3.25Å; P137-F147 WeakPolarHBondContact O-CD2 3.11Å; P137-F147 PolarHBondContact O-N 2.98Å
138	T	83	Confident	69.7	Low	51 Å²	51	83.7 Å²	83.7	31%	0.313	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-96.2	157.2	-178.9	50	0	0	0	0	113.1	A136 G140 T145 K146 F147	A136-T138 PolarHBondContact O-N 2.82Å; A136-T138 VanDerWaalsContact O-N 3.13Å; T138-G140 PolarHBondContact O-N 3.41Å; T138-G140 VanDerWaalsContact O-N 3.14Å; T138-T145 CarbonylContact C-O 3.5Å; T138-T145 WeakPolarHBondContact CA-O 3.29Å; T138-K146 HydrophobicContact CG2-CB 4.46Å; T138-K146 HydrophobicContact CG2-CG 3.61Å; T138-F147 VanDerWaalsContact C-CE2 3.49Å; T138-F147 WeakPolarHBondContact O-CE2 3.46Å
139	C	88.9	Confident	69.9	Low	0 Å²	0	80.3 Å²	80.3	0%	0	44%	0.442	C	S	.	.			trans	-63.7	108.5	169.4	172.3	0	0	0	0	110.5	I141 C142 H143 T145 F147 F162 C163 C166	C139-I141 PolarHBondContact O-N 3.13Å; C139-C142 PolarHBondContact O-N 3.49Å; C139-H143 VanDerWaalsContact O-CA 3.27Å; C139-H143 WeakPolarHBondContact O-CA 3.13Å; C139-H143 PolarHBondContact O-N 2.84Å; C139-T145 PolarHBondContact N-O 3.47Å; C139-F147 HydrophobicContact CB-CE1 4.35Å; C139-F147 HydrophobicContact CB-CE2 4.33Å; C139-F147 HydrophobicContact CB-CZ 3.73Å; C139-F162 VanDerWaalsContact SG-CA 3.59Å; C139-C163 HydrophobicContact CB-CB 4.01Å; C139-C163 PolarHBondContact SG-N 2.86Å; C139-C166 VanDerWaalsContact SG-SG 3.68Å
140	G	86.1	Confident	70.4	Confident	31 Å²	31	76.9 Å²	76.9	32%	0.32	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	33.8	-179.4	0	0	0	0	0	115.9	T138 T160 K161	T138-G140 PolarHBondContact O-N 3.41Å; T138-G140 VanDerWaalsContact O-N 3.14Å; G140-T160 VanDerWaalsContact O-CG2 3.25Å; G140-T160 WeakPolarHBondContact O-CG2 3.47Å; G140-K161 PolarHBondContact N-O 2.82Å
141	I	86.6	Confident	71.4	Confident	13 Å²	13	77.4 Å²	77.4	7%	0.067	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	-59.5	174.7	-68.1	-176.2	0	0	0	108.9	V118 C139 T160 F162 C166 C185 L187	V118-I141 HydrophobicContact CG1-CG2 3.77Å; V118-I141 VanDerWaalsContact CG1-O 3.22Å; V118-I141 WeakPolarHBondContact CG1-O 3.18Å; C139-I141 PolarHBondContact O-N 3.13Å; I141-T160 HydrophobicContact CG1-CG2 4.37Å; I141-F162 HydrophobicContact CD1-CB 4Å; I141-F162 HydrophobicContact CG1-CB 4.47Å; I141-C166 HydrophobicContact CB-CB 3.98Å; I141-C166 HydrophobicContact CD1-CB 4.35Å; I141-C166 HydrophobicContact CG2-CB 3.87Å; I141-C185 HydrophobicContact CD1-CB 3.44Å; I141-C185 VanDerWaalsContact CD1-CB 3.44Å; I141-L187 HydrophobicContact CD1-CD1 4.33Å; I141-L187 HydrophobicContact CG2-CD1 4.11Å
142	C	87.1	Confident	73.2	Confident	22 Å²	22	68.4 Å²	68.4	15%	0.149	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-24.1	176.8	66.1	0	0	0	0	114.1	C139 K144 C166	C139-C142 PolarHBondContact O-N 3.49Å; C142-K144 WeakPolarHBondContact O-CG 3.33Å; C142-K144 PolarHBondContact O-N 2.84Å; C142-C166 VanDerWaalsContact CB-SG 3.59Å; C142-C166 VanDerWaalsContact SG-SG 3.65Å
143	H	84.8	Confident	74.9	Confident	55 Å²	55	63.7 Å²	63.7	26%	0.255	37%	0.366	S	S	.	.	S	Bend	trans	54.3	-17.7	-166.6	-61.8	-89.6	0	0	0	116.3	A125 C139 T145	A125-H143 HydrophobicContact CB-CB 4.15Å; C139-H143 VanDerWaalsContact O-CA 3.27Å; C139-H143 WeakPolarHBondContact O-CA 3.13Å; C139-H143 PolarHBondContact O-N 2.84Å; H143-T145 PolarHBondContact O-N 2.78Å; H143-T145 VanDerWaalsContact O-N 3.16Å
144	K	83.2	Confident	76.9	Confident	109 Å²	109	59.3 Å²	59.3	47%	0.474	35%	0.352	S	S	.	.	S	Bend	trans	-73.1	5.2	176.5	-60.8	179.6	-175.3	-172.5	0	114.6	I121 E124 A125 C142	I121-K144 HydrophobicContact CG2-CD 4.38Å; I121-K144 WeakPolarHBondContact O-CE 3.11Å; E124-K144 IonicContact OE2-NZ 2.74Å; E124-K144 PolarHBondContact OE2-NZ 3.24Å; A125-K144 HydrophobicContact CB-CD 4.22Å; A125-K144 HydrophobicContact CB-CG 3.42Å; A125-K144 VanDerWaalsContact CB-CG 3.42Å; C142-K144 WeakPolarHBondContact O-CG 3.33Å; C142-K144 PolarHBondContact O-N 2.84Å
145	T	82.9	Confident	78.9	Confident	50 Å²	50	55.7 Å²	55.7	31%	0.307	33%	0.332	S	S	.	.			trans	-128.3	106.7	175.4	-53.4	0	0	0	0	109.3	T138 C139 H143 C163	T138-T145 CarbonylContact C-O 3.5Å; T138-T145 WeakPolarHBondContact CA-O 3.29Å; C139-T145 PolarHBondContact N-O 3.47Å; H143-T145 PolarHBondContact O-N 2.78Å; H143-T145 VanDerWaalsContact O-N 3.16Å; T145-C163 HydrophobicContact CG2-CB 3.7Å
146	K	82.3	Confident	80.4	Confident	75 Å²	75	51.3 Å²	51.3	33%	0.326	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-71.7	141.5	163	-70.9	171	178.4	165.9	0	108.7	Q129 D134 A136 T138	Q129-K146 VanDerWaalsContact OE1-CE 3.29Å; D134-K146 IonicContact OD2-NZ 2.74Å; D134-K146 PolarHBondContact OD2-NZ 3.18Å; A136-K146 HydrophobicContact CB-CB 4.38Å; A136-K146 HydrophobicContact CB-CD 4.16Å; A136-K146 HydrophobicContact CB-CG 4.22Å; T138-K146 HydrophobicContact CG2-CB 4.46Å; T138-K146 HydrophobicContact CG2-CG 3.61Å
147	F	82.3	Confident	81.8	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.035	32%	0.319	C	S	.	.			trans	-97.3	119.6	167.8	-50.3	-63.4	0	0	0	107.1	P137 T138 C139 K161 C163	P137-F147 HydrophobicContact CB-CD2 4.34Å; P137-F147 HydrophobicContact CG-CB 4.43Å; P137-F147 WeakPolarHBondContact O-CB 3.25Å; P137-F147 WeakPolarHBondContact O-CD2 3.11Å; P137-F147 PolarHBondContact O-N 2.98Å; T138-F147 VanDerWaalsContact C-CE2 3.49Å; T138-F147 WeakPolarHBondContact O-CE2 3.46Å; C139-F147 HydrophobicContact CB-CE1 4.35Å; C139-F147 HydrophobicContact CB-CE2 4.33Å; C139-F147 HydrophobicContact CB-CZ 3.73Å; F147-K161 HydrophobicContact CD2-CD 4.34Å; F147-K161 HydrophobicContact CD2-CG 4.43Å; F147-K161 HydrophobicContact CE2-CB 4.36Å; F147-K161 HydrophobicContact CE2-CD 4.16Å; F147-K161 HydrophobicContact CE2-CG 3.79Å; F147-K161 HydrophobicContact CZ-CG 4.34Å; F147-C163 HydrophobicContact CE1-CB 3.71Å; F147-C163 HydrophobicContact CZ-CB 4.27Å
148	A	66	Low	82.5	Confident	88 Å²	88	54.4 Å²	54.4	73%	0.727	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-61.7	178.9	0	0	0	0	0	110.4	G150	A148-G150 VanDerWaalsContact C-N 3.29Å; A148-G150 PolarHBondContact O-N 3.41Å
149	D	62.9	Low	82.9	Confident	132 Å²	132	62 Å²	62	71%	0.706	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	35.7	-172.6	12.1	-82.5	0	0	0	111.2	C151	D149-C151 PolarHBondContact O-N 3.3Å; D149-C151 WeakPolarHBondContact OD2-CB 3.03Å; D149-C151 PolarHBondContact OD2-SG 2.85Å
150	G	62.6	Low	82.8	Confident	27 Å²	27	64.4 Å²	64.4	28%	0.278	36%	0.356	S	S	.	.	S	Bend	trans	59.8	11.5	-174.2	0	0	0	0	0	114.8	A148 G152 K161	A148-G150 VanDerWaalsContact C-N 3.29Å; A148-G150 PolarHBondContact O-N 3.41Å; G150-G152 PolarHBondContact O-N 3.32Å; G150-K161 WeakPolarHBondContact O-CE 3.44Å; G150-K161 PolarHBondContact O-NZ 2.77Å
151	C	68.3	Low	82.9	Confident	72 Å²	72	66.4 Å²	66.4	49%	0.486	36%	0.356	S	S	.	.			trans	-74.2	40.1	-165.2	60.3	0	0	0	0	116.6	D149	D149-C151 PolarHBondContact O-N 3.3Å; D149-C151 WeakPolarHBondContact OD2-CB 3.03Å; D149-C151 PolarHBondContact OD2-SG 2.85Å
152	G	81.7	Confident	83.2	Confident	14 Å²	14	65.8 Å²	65.8	14%	0.144	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-98.1	149.1	175.7	0	0	0	0	0	113.9	G150	G150-G152 PolarHBondContact O-N 3.32Å
153	H	88.8	Confident	83.4	Confident	53 Å²	53	65.2 Å²	65.2	25%	0.245	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.6	-178.8	-53.8	-45.5	0	0	0	111.3	K161 F162 W183	H153-K161 CarbonylContact O-C 3.59Å; H153-K161 WeakPolarHBondContact O-CA 3.47Å; H153-F162 HydrophobicContact CB-CD2 4.5Å; H153-F162 HydrophobicContact CB-CE1 4.31Å; H153-F162 HydrophobicContact CB-CE2 4.05Å; H153-F162 HydrophobicContact CB-CZ 3.97Å; H153-F162 PolarHBondContact N-O 2.9Å; H153-F162 WeakPolarHBondContact O-CD1 3.45Å; H153-F162 WeakPolarHBondContact O-CE1 3.48Å; H153-F162 PolarHBondContact O-N 3.21Å; H153-W183 HydrophobicContact CB-CB 4.39Å; H153-W183 HydrophobicContact CB-CD2 3.79Å; H153-W183 HydrophobicContact CB-CE3 3.93Å; H153-W183 HydrophobicContact CB-CG 4.03Å; H153-W183 HydrophobicContact CB-CZ3 4.43Å; H153-W183 AromaticContact CD2-CE3 3.69Å; H153-W183 AromaticContact CD2-CH2 3.24Å; H153-W183 WeakPolarHBondContact CD2-CH2 3.42Å; H153-W183 AromaticContact CD2-CZ2 3.64Å; H153-W183 AromaticContact CD2-CZ3 3.27Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.23Å; H153-W183 AromaticContact CE1-CH2 3.72Å; H153-W183 AromaticContact CE1-CZ2 3.48Å; H153-W183 VanDerWaalsContact CE1-CZ2 3.48Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.47Å; H153-W183 AromaticContact CG-CD2 3.73Å; H153-W183 AromaticContact CG-CE2 3.7Å; H153-W183 AromaticContact CG-CE3 3.8Å; H153-W183 AromaticContact CG-CH2 3.8Å; H153-W183 AromaticContact CG-CZ2 3.73Å; H153-W183 AromaticContact CG-CZ3 3.84Å; H153-W183 AromaticContact ND1-CE2 3.74Å; H153-W183 AromaticContact ND1-CZ2 3.62Å; H153-W183 AromaticContact NE2-CH2 3.17Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.48Å; H153-W183 AromaticContact NE2-CZ2 3.48Å; H153-W183 WeakPolarHBondContact NE2-CZ2 3.39Å; H153-W183 AromaticContact NE2-CZ3 3.75Å
154	L	90.8	Very high	83.5	Confident	109 Å²	109	65.5 Å²	65.5	57%	0.571	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	138.7	176.1	-62	170.9	0	0	0	110.6	R159 K161 W183	L154-R159 WeakPolarHBondContact CD2-O 3.43Å; L154-K161 HydrophobicContact CD2-CB 3.82Å; L154-K161 HydrophobicContact CD2-CD 4.31Å; L154-K161 HydrophobicContact CD2-CG 3.93Å; L154-W183 WeakPolarHBondContact O-CB 3.23Å
155	C	92.7	Very high	83.8	Confident	2 Å²	2	71 Å²	71	1%	0.014	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-77.9	123.2	174.3	-173.4	0	0	0	0	111.5	Y157 C158 R159 T160 F162 W183 C185	C155-Y157 PolarHBondContact O-N 3.47Å; C155-C158 VanDerWaalsContact CB-SG 3.54Å; C155-C158 VanDerWaalsContact SG-SG 3.62Å; C155-R159 WeakPolarHBondContact O-CA 3.41Å; C155-R159 PolarHBondContact O-N 2.87Å; C155-T160 PolarHBondContact N-O 3.22Å; C155-F162 HydrophobicContact CB-CD1 4.04Å; C155-F162 HydrophobicContact CB-CE1 3.86Å; C155-W183 CarbonylContact C-O 3.55Å; C155-W183 WeakPolarHBondContact CA-O 3.38Å; C155-C185 HydrophobicContact CB-CB 3.97Å; C155-C185 PolarHBondContact SG-N 3.19Å; C155-C185 VanDerWaalsContact SG-SG 3.63Å
156	S	90.1	Very high	84.2	Confident	67 Å²	67	69.2 Å²	69.2	47%	0.469	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.7	-179.9	-57.8	0	0	0	0	114.7	W183	S156-W183 PolarHBondContact N-O 3.49Å; S156-W183 PolarHBondContact OG-N 3.16Å; S156-W183 PolarHBondContact OG-O 3Å
157	Y	90.7	Very high	84.5	Confident	108 Å²	108	66.2 Å²	66.2	42%	0.424	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-69.8	173.3	-57.4	-63.8	0	0	0	112.3	C155 R159 M182 V184 C188 Q192	C155-Y157 PolarHBondContact O-N 3.47Å; Y157-R159 PolarHBondContact O-N 3.38Å; Y157-M182 HydrophobicContact CE1-CE 4Å; Y157-M182 HydrophobicContact CE2-CE 3.85Å; Y157-M182 VanDerWaalsContact CZ-CE 3.45Å; Y157-M182 VanDerWaalsContact OH-CE 3.3Å; Y157-M182 WeakPolarHBondContact OH-CE 3.31Å; Y157-V184 HydrophobicContact CD2-CG1 3.92Å; Y157-V184 HydrophobicContact CD2-CG2 4.24Å; Y157-V184 HydrophobicContact CE2-CG1 3.91Å; Y157-V184 HydrophobicContact CE2-CG2 3.76Å; Y157-C188 HydrophobicContact CD2-CB 3.91Å; Y157-C188 HydrophobicContact CG-CB 4.41Å; Y157-Q192 PolarHBondContact OH-NE2 3.08Å
158	C	90.7	Very high	84.9	Confident	57 Å²	57	66.7 Å²	66.7	39%	0.385	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	3.3	-175.5	67.4	0	0	0	0	116.1	C155 T160	C155-C158 VanDerWaalsContact CB-SG 3.54Å; C155-C158 VanDerWaalsContact SG-SG 3.62Å; C158-T160 PolarHBondContact O-N 2.89Å; C158-T160 PolarHBondContact O-OG1 3.11Å; C158-T160 PolarHBondContact SG-OG1 2.8Å
159	R	90.6	Very high	85.9	Confident	211 Å²	211	70.7 Å²	70.7	80%	0.796	36%	0.362	S	S	*	.			trans	56.5	-6.9	-176.1	-60.9	-173.7	-178.1	176.8	2.1	117.3	L154 C155 Y157 K161	L154-R159 WeakPolarHBondContact CD2-O 3.43Å; C155-R159 WeakPolarHBondContact O-CA 3.41Å; C155-R159 PolarHBondContact O-N 2.87Å; Y157-R159 PolarHBondContact O-N 3.38Å; R159-K161 PolarHBondContact O-N 2.92Å
160	T	87.6	Confident	86.9	Confident	49 Å²	49	66.7 Å²	66.7	30%	0.301	34%	0.342	S	S	.	.			trans	-53.2	134.8	175.7	-44.2	0	0	0	0	112.5	G140 I141 C155 C158	G140-T160 VanDerWaalsContact O-CG2 3.25Å; G140-T160 WeakPolarHBondContact O-CG2 3.47Å; I141-T160 HydrophobicContact CG1-CG2 4.37Å; C155-T160 PolarHBondContact N-O 3.22Å; C158-T160 PolarHBondContact O-N 2.89Å; C158-T160 PolarHBondContact O-OG1 3.11Å; C158-T160 PolarHBondContact SG-OG1 2.8Å
161	K	89.5	Confident	87.6	Confident	74 Å²	74	69 Å²	69	32%	0.322	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	119.2	178.1	-159.3	171.3	-177	173.1	0	110.4	G140 F147 G150 H153 L154 R159	G140-K161 PolarHBondContact N-O 2.82Å; F147-K161 HydrophobicContact CD2-CD 4.34Å; F147-K161 HydrophobicContact CD2-CG 4.43Å; F147-K161 HydrophobicContact CE2-CB 4.36Å; F147-K161 HydrophobicContact CE2-CD 4.16Å; F147-K161 HydrophobicContact CE2-CG 3.79Å; F147-K161 HydrophobicContact CZ-CG 4.34Å; G150-K161 WeakPolarHBondContact O-CE 3.44Å; G150-K161 PolarHBondContact O-NZ 2.77Å; H153-K161 CarbonylContact O-C 3.59Å; H153-K161 WeakPolarHBondContact O-CA 3.47Å; L154-K161 HydrophobicContact CD2-CB 3.82Å; L154-K161 HydrophobicContact CD2-CD 4.31Å; L154-K161 HydrophobicContact CD2-CG 3.93Å; R159-K161 PolarHBondContact O-N 2.92Å
162	F	91.7	Very high	87.5	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	149.5	-171.6	70.6	-95.7	0	0	0	113.1	C139 I141 H153 C155 C166 W183 C185	C139-F162 VanDerWaalsContact SG-CA 3.59Å; I141-F162 HydrophobicContact CD1-CB 4Å; I141-F162 HydrophobicContact CG1-CB 4.47Å; H153-F162 HydrophobicContact CB-CD2 4.5Å; H153-F162 HydrophobicContact CB-CE1 4.31Å; H153-F162 HydrophobicContact CB-CE2 4.05Å; H153-F162 HydrophobicContact CB-CZ 3.97Å; H153-F162 PolarHBondContact N-O 2.9Å; H153-F162 WeakPolarHBondContact O-CD1 3.45Å; H153-F162 WeakPolarHBondContact O-CE1 3.48Å; H153-F162 PolarHBondContact O-N 3.21Å; C155-F162 HydrophobicContact CB-CD1 4.04Å; C155-F162 HydrophobicContact CB-CE1 3.86Å; F162-C166 HydrophobicContact CB-CB 4.06Å; F162-C166 HydrophobicContact CD2-CB 4.47Å; F162-W183 HydrophobicContact CE1-CB 4.42Å; F162-W183 HydrophobicContact CE2-CE3 4.13Å; F162-W183 HydrophobicContact CZ-CB 4.04Å; F162-W183 AromaticContact CZ-CE3 3.99Å; F162-W183 HydrophobicContact CZ-CE3 3.99Å; F162-C185 HydrophobicContact CD1-CB 3.65Å; F162-C185 HydrophobicContact CE1-CB 3.91Å; F162-C185 HydrophobicContact CG-CB 4.1Å
163	C	90.7	Very high	86.2	Confident	10 Å²	10	81.1 Å²	81.1	7%	0.068	39%	0.391	C	S	.	.			trans	-82.9	158.8	176.7	75.4	0	0	0	0	111.6	C139 T145 F147 R165 C166	C139-C163 HydrophobicContact CB-CB 4.01Å; C139-C163 PolarHBondContact SG-N 2.86Å; T145-C163 HydrophobicContact CG2-CB 3.7Å; F147-C163 HydrophobicContact CE1-CB 3.71Å; F147-C163 HydrophobicContact CZ-CB 4.27Å; C163-R165 PolarHBondContact O-N 3.41Å; C163-C166 PolarHBondContact O-N 2.94Å; C163-C166 VanDerWaalsContact SG-SG 3.69Å
164	A	87.8	Confident	84.4	Confident	60 Å²	60	81.3 Å²	81.3	50%	0.496	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	9.4	-176.2	0	0	0	0	0	116.7
165	R	88.6	Confident	82.6	Confident	225 Å²	225	83 Å²	83	85%	0.849	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-21.7	165	-67.1	-176.8	177.5	174.9	0.8	113.1	C163 N186	C163-R165 PolarHBondContact O-N 3.41Å; R165-N186 PolarHBondContact O-ND2 2.81Å
166	C	91.2	Very high	80.6	Confident	13 Å²	13	88 Å²	88	9%	0.088	44%	0.435	C	S	.	.	S	Bend	trans	-98.5	8.7	-173.9	-66.7	0	0	0	0	113.8	C139 I141 C142 F162 C163 N186	C139-C166 VanDerWaalsContact SG-SG 3.68Å; I141-C166 HydrophobicContact CB-CB 3.98Å; I141-C166 HydrophobicContact CD1-CB 4.35Å; I141-C166 HydrophobicContact CG2-CB 3.87Å; C142-C166 VanDerWaalsContact CB-SG 3.59Å; C142-C166 VanDerWaalsContact SG-SG 3.65Å; F162-C166 HydrophobicContact CB-CB 4.06Å; F162-C166 HydrophobicContact CD2-CB 4.47Å; C163-C166 PolarHBondContact O-N 2.94Å; C163-C166 VanDerWaalsContact SG-SG 3.69Å; C166-N186 VanDerWaalsContact C-CG 3.44Å; C166-N186 PolarHBondContact O-N 2.9Å
167	G	90.5	Very high	78.9	Confident	11 Å²	11	91 Å²	91	11%	0.113	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.6	-173.4	177.8	0	0	0	0	0	110.9	V184 N186	G167-V184 CarbonylContact C-O 3.59Å; G167-V184 VanDerWaalsContact CA-O 3.23Å; G167-V184 WeakPolarHBondContact CA-O 3.15Å; G167-N186 WeakPolarHBondContact CA-OD1 3.29Å; G167-N186 PolarHBondContact N-OD1 3.47Å
168	G	89.3	Confident	77.2	Confident	19 Å²	19	87.8 Å²	87.8	20%	0.196	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	179.5	-178.1	0	0	0	0	0	113.7	W183 V184	G168-W183 VanDerWaalsContact C-CE3 3.44Å; G168-V184 PolarHBondContact N-O 3.42Å; G168-V184 PolarHBondContact O-N 2.81Å
169	R	88.4	Confident	75.7	Confident	171 Å²	171	93 Å²	93	65%	0.645	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	140.2	173.1	-63.8	-174.9	-150.8	-179	2	110.6	V181 M182 W183	R169-V181 HydrophobicContact CB-CG1 3.64Å; R169-V181 HydrophobicContact CG-CG1 3.89Å; R169-M182 CarbonylContact C-O 3.55Å; R169-M182 WeakPolarHBondContact CA-O 3.01Å; R169-W183 HydrophobicContact CG-CD2 3.71Å; R169-W183 HydrophobicContact CG-CE3 3.73Å; R169-W183 HydrophobicContact CG-CH2 3.6Å; R169-W183 HydrophobicContact CG-CZ2 3.56Å; R169-W183 HydrophobicContact CG-CZ3 3.67Å
170	V	82.7	Confident	74.7	Confident	49 Å²	49	86.8 Å²	86.8	30%	0.297	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.5	169.8	-179	0	0	0	0	106.8	M182 V184	V170-M182 HydrophobicContact CB-CG 3.95Å; V170-M182 PolarHBondContact N-O 2.97Å; V170-M182 WeakPolarHBondContact O-CG 3.18Å; V170-M182 PolarHBondContact O-N 3.32Å; V170-V184 HydrophobicContact CB-CG2 4.22Å; V170-V184 HydrophobicContact CG2-CB 4.03Å; V170-V184 HydrophobicContact CG2-CG2 3.74Å
171	S	78.4	Confident	74.2	Confident	74 Å²	74	87.8 Å²	87.8	52%	0.517	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	122.2	168.5	-70.3	0	0	0	0	109	V180	S171-V180 WeakPolarHBondContact CA-O 3.17Å
172	L	65.4	Low	74.1	Confident	88 Å²	88	85.5 Å²	85.5	46%	0.461	43%	0.43	S	S	.	.			trans	-73.7	139.3	164.1	-62.9	176.8	0	0	0	108.5	S174 V180 M182	L172-S174 PolarHBondContact O-N 3Å; L172-V180 PolarHBondContact N-O 2.67Å; L172-M182 HydrophobicContact CD1-SD 3.88Å; L172-M182 HydrophobicContact CD2-SD 3.98Å; L172-M182 HydrophobicContact CG-SD 3.87Å
173	R	54.7	Low	74.1	Confident	253 Å²	253	88.3 Å²	88.3	96%	0.955	44%	0.44	S	S	*	.			trans	-94	82.8	167.7	-73.7	-172	177.7	-165.2	-0.2	108.6
174	S	51.3	Low	74.3	Confident	57 Å²	57	88 Å²	88	40%	0.399	44%	0.438	S	S	.	.			trans	-63.2	156.1	162.2	36.1	0	0	0	0	110.6	L172 N176 D178	L172-S174 PolarHBondContact O-N 3Å; S174-N176 PolarHBondContact O-N 3.06Å; S174-N176 PolarHBondContact OG-O 2.87Å; S174-D178 PolarHBondContact OG-O 2.64Å
175	N	52.2	Low	74.6	Confident	146 Å²	146	85.1 Å²	85.1	78%	0.781	41%	0.414	S	S	*	.	S	Bend	trans	-81.6	9	172.1	-133.5	-1.9	0	0	0	112.6
176	N	50.4	Low	74.7	Confident	106 Å²	106	76.7 Å²	76.7	57%	0.567	39%	0.386	S	S	*	.	S	Bend	trans	-120.5	149.2	172.7	-66.7	-13.6	0	0	0	107.7	S174 D178	S174-N176 PolarHBondContact O-N 3.06Å; S174-N176 PolarHBondContact OG-O 2.87Å; N176-D178 PolarHBondContact O-N 2.94Å; N176-D178 VanDerWaalsContact O-N 3.12Å
177	E	54.9	Low	74.7	Confident	130 Å²	130	77.8 Å²	77.8	61%	0.607	39%	0.391	S	S	*	.	S	Bend	trans	-73.1	-10.2	-159.8	-64.5	-178.8	89.2	0	0	115.4	K179 E727	E177-K179 PolarHBondContact O-N 3.29Å; E177-E727 HydrophobicContact CB-CG 3.94Å
178	D	55.5	Low	74.7	Confident	40 Å²	40	77.8 Å²	77.8	21%	0.214	39%	0.389	C	S	.	.			trans	-62.2	97.7	168.7	-62.4	-22.3	0	0	0	111.2	S174 N176 V180 H725 G726 E727	S174-D178 PolarHBondContact OG-O 2.64Å; N176-D178 PolarHBondContact O-N 2.94Å; N176-D178 VanDerWaalsContact O-N 3.12Å; D178-V180 PolarHBondContact O-N 3.5Å; D178-H725 WeakPolarHBondContact OD2-CA 3.3Å; D178-H725 PolarHBondContact OD2-N 2.88Å; D178-G726 VanDerWaalsContact OD1-C 3.28Å; D178-G726 WeakPolarHBondContact OD1-CA 3.38Å; D178-G726 PolarHBondContact OD1-N 2.9Å; D178-G726 PolarHBondContact OD2-N 2.8Å; D178-E727 PolarHBondContact OD1-N 3.21Å
179	K	58.5	Low	74.8	Confident	166 Å²	166	83.5 Å²	83.5	72%	0.722	41%	0.405	S	S	*	.			trans	-71.6	76.1	173.6	-67.7	-179.4	-176.1	84.7	0	110.8	E177 V181	E177-K179 PolarHBondContact O-N 3.29Å; K179-V181 WeakPolarHBondContact O-CG2 3.3Å; K179-V181 PolarHBondContact O-N 2.81Å; K179-V181 VanDerWaalsContact O-N 3.09Å
180	V	69.2	Low	74.7	Confident	81 Å²	81	77.9 Å²	77.9	49%	0.491	39%	0.385	S	S	.	.			trans	-56.4	115.2	179.4	-178.3	0	0	0	0	110.3	S171 L172 D178	S171-V180 WeakPolarHBondContact CA-O 3.17Å; L172-V180 PolarHBondContact N-O 2.67Å; D178-V180 PolarHBondContact O-N 3.5Å
181	V	77.8	Confident	74.8	Confident	71 Å²	71	79.9 Å²	79.9	43%	0.43	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	101.5	-179.3	-169.6	0	0	0	0	109.9	R169 K179	R169-V181 HydrophobicContact CB-CG1 3.64Å; R169-V181 HydrophobicContact CG-CG1 3.89Å; K179-V181 WeakPolarHBondContact O-CG2 3.3Å; K179-V181 PolarHBondContact O-N 2.81Å; K179-V181 VanDerWaalsContact O-N 3.09Å
182	M	88	Confident	75.2	Confident	26 Å²	26	79.9 Å²	79.9	13%	0.128	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	151.6	177.3	68.1	-171.2	-54.6	0	0	111.8	Y157 R169 V170 L172 V184	Y157-M182 HydrophobicContact CE1-CE 4Å; Y157-M182 HydrophobicContact CE2-CE 3.85Å; Y157-M182 VanDerWaalsContact CZ-CE 3.45Å; Y157-M182 VanDerWaalsContact OH-CE 3.3Å; Y157-M182 WeakPolarHBondContact OH-CE 3.31Å; R169-M182 CarbonylContact C-O 3.55Å; R169-M182 WeakPolarHBondContact CA-O 3.01Å; V170-M182 HydrophobicContact CB-CG 3.95Å; V170-M182 PolarHBondContact N-O 2.97Å; V170-M182 WeakPolarHBondContact O-CG 3.18Å; V170-M182 PolarHBondContact O-N 3.32Å; L172-M182 HydrophobicContact CD1-SD 3.88Å; L172-M182 HydrophobicContact CD2-SD 3.98Å; L172-M182 HydrophobicContact CG-SD 3.87Å; M182-V184 HydrophobicContact CE-CG2 4.24Å; M182-V184 HydrophobicContact CG-CG2 4Å; M182-V184 HydrophobicContact SD-CG2 4.43Å
183	W	91.3	Very high	76.1	Confident	59 Å²	59	80.2 Å²	80.2	22%	0.223	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.8	176	-79.7	102.7	0	0	0	109.8	H153 L154 C155 S156 F162 G168 R169	H153-W183 HydrophobicContact CB-CB 4.39Å; H153-W183 HydrophobicContact CB-CD2 3.79Å; H153-W183 HydrophobicContact CB-CE3 3.93Å; H153-W183 HydrophobicContact CB-CG 4.03Å; H153-W183 HydrophobicContact CB-CZ3 4.43Å; H153-W183 AromaticContact CD2-CE3 3.69Å; H153-W183 AromaticContact CD2-CH2 3.24Å; H153-W183 WeakPolarHBondContact CD2-CH2 3.42Å; H153-W183 AromaticContact CD2-CZ2 3.64Å; H153-W183 AromaticContact CD2-CZ3 3.27Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.23Å; H153-W183 AromaticContact CE1-CH2 3.72Å; H153-W183 AromaticContact CE1-CZ2 3.48Å; H153-W183 VanDerWaalsContact CE1-CZ2 3.48Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.47Å; H153-W183 AromaticContact CG-CD2 3.73Å; H153-W183 AromaticContact CG-CE2 3.7Å; H153-W183 AromaticContact CG-CE3 3.8Å; H153-W183 AromaticContact CG-CH2 3.8Å; H153-W183 AromaticContact CG-CZ2 3.73Å; H153-W183 AromaticContact CG-CZ3 3.84Å; H153-W183 AromaticContact ND1-CE2 3.74Å; H153-W183 AromaticContact ND1-CZ2 3.62Å; H153-W183 AromaticContact NE2-CH2 3.17Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.48Å; H153-W183 AromaticContact NE2-CZ2 3.48Å; H153-W183 WeakPolarHBondContact NE2-CZ2 3.39Å; H153-W183 AromaticContact NE2-CZ3 3.75Å; L154-W183 WeakPolarHBondContact O-CB 3.23Å; C155-W183 CarbonylContact C-O 3.55Å; C155-W183 WeakPolarHBondContact CA-O 3.38Å; S156-W183 PolarHBondContact N-O 3.49Å; S156-W183 PolarHBondContact OG-N 3.16Å; S156-W183 PolarHBondContact OG-O 3Å; F162-W183 HydrophobicContact CE1-CB 4.42Å; F162-W183 HydrophobicContact CE2-CE3 4.13Å; F162-W183 HydrophobicContact CZ-CB 4.04Å; F162-W183 AromaticContact CZ-CE3 3.99Å; F162-W183 HydrophobicContact CZ-CE3 3.99Å; G168-W183 VanDerWaalsContact C-CE3 3.44Å; R169-W183 HydrophobicContact CG-CD2 3.71Å; R169-W183 HydrophobicContact CG-CE3 3.73Å; R169-W183 HydrophobicContact CG-CH2 3.6Å; R169-W183 HydrophobicContact CG-CZ2 3.56Å; R169-W183 HydrophobicContact CG-CZ3 3.67Å
184	V	93.5	Very high	77.3	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.012	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.2	-175.2	-175.3	0	0	0	0	109.8	Y157 G167 G168 V170 M182 C188 R189	Y157-V184 HydrophobicContact CD2-CG1 3.92Å; Y157-V184 HydrophobicContact CD2-CG2 4.24Å; Y157-V184 HydrophobicContact CE2-CG1 3.91Å; Y157-V184 HydrophobicContact CE2-CG2 3.76Å; G167-V184 CarbonylContact C-O 3.59Å; G167-V184 VanDerWaalsContact CA-O 3.23Å; G167-V184 WeakPolarHBondContact CA-O 3.15Å; G168-V184 PolarHBondContact N-O 3.42Å; G168-V184 PolarHBondContact O-N 2.81Å; V170-V184 HydrophobicContact CB-CG2 4.22Å; V170-V184 HydrophobicContact CG2-CB 4.03Å; V170-V184 HydrophobicContact CG2-CG2 3.74Å; M182-V184 HydrophobicContact CE-CG2 4.24Å; M182-V184 HydrophobicContact CG-CG2 4Å; M182-V184 HydrophobicContact SD-CG2 4.43Å; V184-C188 HydrophobicContact CG1-CB 4.2Å; V184-R189 HydrophobicContact CG1-CB 3.97Å
185	C	93.9	Very high	78.5	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.007	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	159.5	177.3	82.4	0	0	0	0	112.3	I141 C155 F162 L187 C188 R189	I141-C185 HydrophobicContact CD1-CB 3.44Å; I141-C185 VanDerWaalsContact CD1-CB 3.44Å; C155-C185 HydrophobicContact CB-CB 3.97Å; C155-C185 PolarHBondContact SG-N 3.19Å; C155-C185 VanDerWaalsContact SG-SG 3.63Å; F162-C185 HydrophobicContact CD1-CB 3.65Å; F162-C185 HydrophobicContact CE1-CB 3.91Å; F162-C185 HydrophobicContact CG-CB 4.1Å; C185-L187 VanDerWaalsContact C-N 3.26Å; C185-L187 PolarHBondContact O-N 3.4Å; C185-C188 PolarHBondContact O-N 2.84Å; C185-C188 PolarHBondContact SG-N 2.78Å; C185-C188 VanDerWaalsContact SG-N 3.41Å; C185-C188 VanDerWaalsContact SG-SG 3.69Å; C185-R189 VanDerWaalsContact O-CB 3.31Å; C185-R189 WeakPolarHBondContact O-CB 3.37Å; C185-R189 PolarHBondContact O-N 2.94Å
186	N	91.9	Very high	79.7	Confident	47 Å²	47	66.7 Å²	66.7	25%	0.251	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-30.7	-177.4	-71.6	-15.7	0	0	0	113.2	R165 C166 G167 K190	R165-N186 PolarHBondContact O-ND2 2.81Å; C166-N186 VanDerWaalsContact C-CG 3.44Å; C166-N186 PolarHBondContact O-N 2.9Å; G167-N186 WeakPolarHBondContact CA-OD1 3.29Å; G167-N186 PolarHBondContact N-OD1 3.47Å; N186-K190 WeakPolarHBondContact O-CB 3.25Å; N186-K190 PolarHBondContact O-N 2.94Å; N186-K190 VanDerWaalsContact O-N 3.07Å
187	L	91	Very high	81	Confident	37 Å²	37	67.5 Å²	67.5	19%	0.194	33%	0.326	C	S	.	.	H	α-helix	trans	-66.9	-58.5	175.9	-86.4	71	0	0	0	110.8	Y114 K115 V118 I141 C185 R189 K190 Q191	Y114-L187 HydrophobicContact CE1-CD1 4.26Å; K115-L187 HydrophobicContact CG-CD2 4.11Å; V118-L187 HydrophobicContact CB-CD1 4.49Å; V118-L187 HydrophobicContact CG1-CD1 4.14Å; V118-L187 HydrophobicContact CG2-CD1 4.16Å; I141-L187 HydrophobicContact CD1-CD1 4.33Å; I141-L187 HydrophobicContact CG2-CD1 4.11Å; C185-L187 VanDerWaalsContact C-N 3.26Å; C185-L187 PolarHBondContact O-N 3.4Å; L187-R189 VanDerWaalsContact C-N 3.27Å; L187-R189 PolarHBondContact O-N 2.99Å; L187-K190 PolarHBondContact O-N 2.82Å; L187-K190 VanDerWaalsContact O-N 3.08Å; L187-Q191 PolarHBondContact O-N 2.82Å
188	C	91.4	Very high	82.1	Confident	11 Å²	11	62.7 Å²	62.7	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-36.4	179.5	-63.7	0	0	0	0	112.3	Y157 V184 C185 K190 Q191 Q192	Y157-C188 HydrophobicContact CD2-CB 3.91Å; Y157-C188 HydrophobicContact CG-CB 4.41Å; V184-C188 HydrophobicContact CG1-CB 4.2Å; C185-C188 PolarHBondContact O-N 2.84Å; C185-C188 PolarHBondContact SG-N 2.78Å; C185-C188 VanDerWaalsContact SG-N 3.41Å; C185-C188 VanDerWaalsContact SG-SG 3.69Å; C188-K190 PolarHBondContact O-N 2.61Å; C188-Q191 PolarHBondContact O-N 3.47Å; C188-Q192 WeakPolarHBondContact O-CG 3.4Å; C188-Q192 PolarHBondContact O-N 3.04Å
189	R	89.9	Confident	82.5	Confident	139 Å²	139	61.8 Å²	61.8	53%	0.525	31%	0.306	S	S	.	.	H	α-helix	trans	-60.9	-43.1	174.2	-173	175.8	-179.8	170.1	2.6	112	V184 C185 L187 E193	V184-R189 HydrophobicContact CG1-CB 3.97Å; C185-R189 VanDerWaalsContact O-CB 3.31Å; C185-R189 WeakPolarHBondContact O-CB 3.37Å; C185-R189 PolarHBondContact O-N 2.94Å; L187-R189 VanDerWaalsContact C-N 3.27Å; L187-R189 PolarHBondContact O-N 2.99Å; R189-E193 WeakPolarHBondContact O-CB 3.16Å; R189-E193 PolarHBondContact O-N 3.19Å
190	K	86.8	Confident	82.9	Confident	53 Å²	53	55.1 Å²	55.1	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-72.2	-33.8	177.3	-160.6	-176.8	-173.8	-166.5	0	112	Q110 F111 Y114 N186 L187 C188 E193 I194	Q110-K190 PolarHBondContact O-NZ 3.38Å; F111-K190 HydrophobicContact CE2-CB 4.45Å; Y114-K190 HydrophobicContact CD1-CD 3.57Å; Y114-K190 HydrophobicContact CE1-CD 4.03Å; Y114-K190 HydrophobicContact CG-CD 3.94Å; N186-K190 WeakPolarHBondContact O-CB 3.25Å; N186-K190 PolarHBondContact O-N 2.94Å; N186-K190 VanDerWaalsContact O-N 3.07Å; L187-K190 PolarHBondContact O-N 2.82Å; L187-K190 VanDerWaalsContact O-N 3.08Å; C188-K190 PolarHBondContact O-N 2.61Å; K190-E193 PolarHBondContact O-N 3.41Å; K190-I194 HydrophobicContact CG-CD1 4.19Å; K190-I194 WeakPolarHBondContact O-CB 3.4Å; K190-I194 VanDerWaalsContact O-CG1 3.31Å; K190-I194 WeakPolarHBondContact O-CG1 3.3Å; K190-I194 PolarHBondContact O-N 3.09Å
191	Q	85.7	Confident	82.6	Confident	91 Å²	91	58.8 Å²	58.8	43%	0.425	29%	0.287	S	S	.	.	H	α-helix	trans	-62.8	-47	173.6	-164	176	-4.1	0	0	111.1	F111 L187 C188 I194 L195	F111-Q191 HydrophobicContact CE1-CB 4.34Å; F111-Q191 HydrophobicContact CE1-CG 4.02Å; F111-Q191 HydrophobicContact CE2-CB 3.72Å; F111-Q191 HydrophobicContact CE2-CG 4.3Å; F111-Q191 HydrophobicContact CZ-CB 3.57Å; F111-Q191 HydrophobicContact CZ-CG 3.74Å; L187-Q191 PolarHBondContact O-N 2.82Å; C188-Q191 PolarHBondContact O-N 3.47Å; Q191-I194 PolarHBondContact O-N 2.82Å; Q191-L195 WeakPolarHBondContact O-CG 3.32Å; Q191-L195 PolarHBondContact O-N 3.25Å
192	Q	85.1	Confident	81.3	Confident	74 Å²	74	62.7 Å²	62.7	35%	0.346	30%	0.299	S	S	.	.	H	α-helix	trans	-60.4	-45.8	172.4	-72.7	-176.6	-56.7	0	0	111.9	Y157 C188 I194 L195 T196	Y157-Q192 PolarHBondContact OH-NE2 3.08Å; C188-Q192 WeakPolarHBondContact O-CG 3.4Å; C188-Q192 PolarHBondContact O-N 3.04Å; Q192-I194 PolarHBondContact O-N 3.49Å; Q192-L195 PolarHBondContact O-N 2.84Å; Q192-T196 WeakPolarHBondContact O-CB 3.29Å; Q192-T196 PolarHBondContact O-N 3.05Å; Q192-T196 PolarHBondContact O-OG1 2.98Å; Q192-T196 VanDerWaalsContact O-OG1 3.06Å
193	E	84.3	Confident	79.8	Confident	94 Å²	94	67.9 Å²	67.9	44%	0.439	32%	0.321	S	S	.	.	H	α-helix	trans	-58.5	-34.2	176.9	-171.6	-179.9	168.8	0	0	112.3	R189 K190 K197	R189-E193 WeakPolarHBondContact O-CB 3.16Å; R189-E193 PolarHBondContact O-N 3.19Å; K190-E193 PolarHBondContact O-N 3.41Å; E193-K197 HydrophobicContact CG-CD 4.22Å; E193-K197 VanDerWaalsContact O-CB 3.29Å; E193-K197 WeakPolarHBondContact O-CB 3.12Å; E193-K197 WeakPolarHBondContact O-CG 3.49Å; E193-K197 PolarHBondContact O-N 2.75Å; E193-K197 WeakPolarHBondContact OE1-CE 3.32Å; E193-K197 IonicContact OE1-NZ 2.74Å; E193-K197 PolarHBondContact OE1-NZ 2.84Å
194	I	80.2	Confident	77.3	Confident	9 Å²	9	67.6 Å²	67.6	5%	0.046	34%	0.337	C	S	.	.	H	α-helix	trans	-78.1	-41.3	177.5	-73.6	169.1	0	0	0	112	L107 F111 K190 Q191 Q192 K197 S198	L107-I194 HydrophobicContact CB-CG1 4.43Å; L107-I194 HydrophobicContact CB-CG2 4.03Å; L107-I194 HydrophobicContact CD2-CG1 4.46Å; L107-I194 WeakPolarHBondContact O-CD1 3.27Å; F111-I194 HydrophobicContact CB-CD1 3.67Å; F111-I194 HydrophobicContact CD2-CD1 4.02Å; F111-I194 HydrophobicContact CG-CD1 4.15Å; K190-I194 HydrophobicContact CG-CD1 4.19Å; K190-I194 WeakPolarHBondContact O-CB 3.4Å; K190-I194 VanDerWaalsContact O-CG1 3.31Å; K190-I194 WeakPolarHBondContact O-CG1 3.3Å; K190-I194 PolarHBondContact O-N 3.09Å; Q191-I194 PolarHBondContact O-N 2.82Å; Q192-I194 PolarHBondContact O-N 3.49Å; I194-K197 PolarHBondContact O-N 2.75Å; I194-S198 VanDerWaalsContact O-CB 3.29Å; I194-S198 WeakPolarHBondContact O-CB 3.48Å; I194-S198 PolarHBondContact O-N 3.04Å; I194-S198 PolarHBondContact O-OG 3.24Å
195	L	77.1	Confident	74.4	Confident	64 Å²	64	73.3 Å²	73.3	34%	0.335	38%	0.377	S	S	.	.	H	α-helix	trans	-57	-51.7	170.8	-72.2	170.3	0	0	0	110.3	Q191 Q192 K197 S198 G199 A200 W201	Q191-L195 WeakPolarHBondContact O-CG 3.32Å; Q191-L195 PolarHBondContact O-N 3.25Å; Q192-L195 PolarHBondContact O-N 2.84Å; L195-K197 VanDerWaalsContact C-N 3.34Å; L195-K197 PolarHBondContact O-N 2.93Å; L195-S198 PolarHBondContact O-N 2.94Å; L195-S198 PolarHBondContact O-OG 2.92Å; L195-S198 VanDerWaalsContact O-OG 3.05Å; L195-G199 PolarHBondContact O-N 3.33Å; L195-G199 VanDerWaalsContact O-N 3.15Å; L195-A200 HydrophobicContact CD2-CB 4.11Å; L195-A200 PolarHBondContact O-N 3.44Å; L195-W201 HydrophobicContact CB-CB 4.41Å
196	T	77.8	Confident	71.4	Confident	99 Å²	99	76.2 Å²	76.2	61%	0.607	41%	0.407	S	S	*	.	H	α-helix	trans	-60.5	-37.6	177.9	-55.5	0	0	0	0	113	Q192	Q192-T196 WeakPolarHBondContact O-CB 3.29Å; Q192-T196 PolarHBondContact O-N 3.05Å; Q192-T196 PolarHBondContact O-OG1 2.98Å; Q192-T196 VanDerWaalsContact O-OG1 3.06Å
197	K	77	Confident	68.7	Low	124 Å²	124	80.5 Å²	80.5	54%	0.539	44%	0.437	S	S	.	.	H	α-helix	trans	-77.6	-29.7	178.9	-78.4	175.4	-173.9	174.3	0	114.8	L107 E193 I194 L195	L107-K197 HydrophobicContact CD1-CB 3.93Å; L107-K197 HydrophobicContact CD2-CD 4.44Å; E193-K197 HydrophobicContact CG-CD 4.22Å; E193-K197 VanDerWaalsContact O-CB 3.29Å; E193-K197 WeakPolarHBondContact O-CB 3.12Å; E193-K197 WeakPolarHBondContact O-CG 3.49Å; E193-K197 PolarHBondContact O-N 2.75Å; E193-K197 WeakPolarHBondContact OE1-CE 3.32Å; E193-K197 IonicContact OE1-NZ 2.74Å; E193-K197 PolarHBondContact OE1-NZ 2.84Å; I194-K197 PolarHBondContact O-N 2.75Å; L195-K197 VanDerWaalsContact C-N 3.34Å; L195-K197 PolarHBondContact O-N 2.93Å
198	S	77.6	Confident	65.8	Low	29 Å²	29	87.9 Å²	87.9	20%	0.203	47%	0.471	C	S	.	.	H	α-helix	trans	-84.9	-15.7	179.8	54.5	0	0	0	0	113.3	N104 I194 L195 A200	N104-S198 WeakPolarHBondContact OD1-CB 3.46Å; I194-S198 VanDerWaalsContact O-CB 3.29Å; I194-S198 WeakPolarHBondContact O-CB 3.48Å; I194-S198 PolarHBondContact O-N 3.04Å; I194-S198 PolarHBondContact O-OG 3.24Å; L195-S198 PolarHBondContact O-N 2.94Å; L195-S198 PolarHBondContact O-OG 2.92Å; L195-S198 VanDerWaalsContact O-OG 3.05Å; S198-A200 PolarHBondContact O-N 2.94Å; S198-A200 VanDerWaalsContact OG-CB 3.31Å; S198-A200 WeakPolarHBondContact OG-CB 3.35Å; S198-A200 PolarHBondContact OG-N 3.46Å
199	G	64.8	Low	63	Low	20 Å²	20	96.2 Å²	96.2	21%	0.206	51%	0.509	C	S	.	.	S	Bend	trans	73.8	-1.8	-168.5	0	0	0	0	0	113.6	L195 W201 F202	L195-G199 PolarHBondContact O-N 3.33Å; L195-G199 VanDerWaalsContact O-N 3.15Å; G199-W201 PolarHBondContact O-N 2.93Å; G199-F202 VanDerWaalsContact O-CB 3.23Å; G199-F202 WeakPolarHBondContact O-CB 3.16Å; G199-F202 PolarHBondContact O-N 3.4Å
200	A	67.1	Low	60.2	Low	26 Å²	26	93.5 Å²	93.5	22%	0.215	51%	0.509	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-11.9	-176.8	0	0	0	0	0	114.3	L195 S198 F202 F203 G204	L195-A200 HydrophobicContact CD2-CB 4.11Å; L195-A200 PolarHBondContact O-N 3.44Å; S198-A200 PolarHBondContact O-N 2.94Å; S198-A200 VanDerWaalsContact OG-CB 3.31Å; S198-A200 WeakPolarHBondContact OG-CB 3.35Å; S198-A200 PolarHBondContact OG-N 3.46Å; A200-F202 VanDerWaalsContact C-N 3.32Å; A200-F203 CarbonylContact O-C 3.6Å; A200-G204 VanDerWaalsContact O-CA 3.27Å; A200-G204 WeakPolarHBondContact O-CA 3.41Å; A200-G204 PolarHBondContact O-N 3.34Å; A200-G204 VanDerWaalsContact O-N 3.16Å
201	W	61.6	Low	57.5	Low	158 Å²	158	95 Å²	95	60%	0.598	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-23.4	168.4	70.7	-81	0	0	0	113.4	L195 G199	L195-W201 HydrophobicContact CB-CB 4.41Å; G199-W201 PolarHBondContact O-N 2.93Å
202	F	51	Low	55.1	Low	153 Å²	153	98.5 Å²	98.5	67%	0.671	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-35	177.6	-158.7	-91.6	0	0	0	111.2	G199 A200 G204	G199-F202 VanDerWaalsContact O-CB 3.23Å; G199-F202 WeakPolarHBondContact O-CB 3.16Å; G199-F202 PolarHBondContact O-N 3.4Å; A200-F202 VanDerWaalsContact C-N 3.32Å; F202-G204 VanDerWaalsContact C-N 3.3Å
203	F	56.4	Low	52.6	Low	135 Å²	135	102.6 Å²	102.6	59%	0.592	57%	0.567	S	S	*	*	S	Bend	trans	-92.9	17.1	171.9	-50.2	-71.4	0	0	0	112.4	M61 A200 S205	M61-F203 HydrophobicContact CE-CD1 4Å; M61-F203 HydrophobicContact CE-CE1 3.54Å; M61-F203 HydrophobicContact CE-CZ 4.02Å; A200-F203 CarbonylContact O-C 3.6Å; F203-S205 PolarHBondContact O-N 3.32Å
204	G	38.5	Very low	50.1	Low	54 Å²	54	101.5 Å²	101.5	56%	0.557	58%	0.581	S	S	*	*			trans	-77.7	32.9	-165.2	0	0	0	0	0	116.2	A200 F202	A200-G204 VanDerWaalsContact O-CA 3.27Å; A200-G204 WeakPolarHBondContact O-CA 3.41Å; A200-G204 PolarHBondContact O-N 3.34Å; A200-G204 VanDerWaalsContact O-N 3.16Å; F202-G204 VanDerWaalsContact C-N 3.3Å
205	S	32.9	Very low	48	Very low	122 Å²	122	107.3 Å²	107.3	85%	0.853	62%	0.617	S	S	*	*	S	Bend	trans	-133.5	75.7	-173.5	-59.2	0	0	0	0	110.9	F203	F203-S205 PolarHBondContact O-N 3.32Å
206	G	30.9	Very low	46	Very low	62 Å²	62	112.2 Å²	112.2	64%	0.639	64%	0.643	S	S	*	*			trans	102.2	135.3	177.2	0	0	0	0	0	114.2
207	P	35	Very low	44	Very low	137 Å²	137	112.1 Å²	112.1	89%	0.89	65%	0.646	S	S	*	*			trans	-89.7	113	171.5	33.3	-28.4	0	0	0	110.3
208	Q	31.4	Very low	42	Very low	192 Å²	192	113.1 Å²	113.1	90%	0.897	66%	0.657	S	S	*	*			trans	-104.9	124	177.9	-156.4	170.9	16	0	0	111.1
209	Q	31.6	Very low	40	Very low	185 Å²	185	118 Å²	118	86%	0.864	69%	0.686	S	S	*	*			trans	-85.2	154.5	168.2	-70.3	-166.8	-90.6	0	0	110.6
210	P	31.9	Very low	38.5	Very low	83 Å²	83	121.6 Å²	121.6	54%	0.539	71%	0.713	S	S	.	*			trans	-92.2	143.2	-164.7	34	-35.4	0	0	0	115.5
211	S	30.6	Very low	36.9	Very low	84 Å²	84	126.9 Å²	126.9	59%	0.587	74%	0.743	S	S	*	*			trans	66.4	145.6	165.8	71.6	0	0	0	0	116.3
212	Q	34.2	Very low	35.4	Very low	165 Å²	165	122.8 Å²	122.8	77%	0.771	75%	0.75	S	S	*	*			cis	-141.6	153.1	29.5	-67.8	166.8	-2.5	0	0	113.9
213	D	31.9	Very low	34.8	Very low	160 Å²	160	120.9 Å²	120.9	86%	0.856	76%	0.763	S	S	*	*			trans	23.3	131.4	147.3	-47	-37.5	0	0	0	121.5
214	G	33.2	Very low	33.8	Very low	71 Å²	71	117.9 Å²	117.9	73%	0.732	77%	0.77	S	S	*	*			trans	176.2	22.9	174	0	0	0	0	0	123.4
215	T	35.5	Very low	33.8	Very low	131 Å²	131	120.4 Å²	120.4	80%	0.804	78%	0.779	S	S	*	*			trans	31.8	129.2	151.1	47.5	0	0	0	0	124.2
216	L	36	Very low	33.9	Very low	167 Å²	167	122 Å²	122	87%	0.874	77%	0.773	S	S	*	*			trans	94.9	160.3	144.1	-65.2	163.2	0	0	0	120.8
217	S	34.8	Very low	34.1	Very low	96 Å²	96	122.3 Å²	122.3	67%	0.671	76%	0.762	S	S	*	*			trans	-140.9	163.9	-143.1	-34.5	0	0	0	0	116.2
218	D	34.2	Very low	34.4	Very low	145 Å²	145	118.7 Å²	118.7	78%	0.775	74%	0.739	S	S	*	*			trans	40.7	133.7	145.5	-54.8	-43.1	0	0	0	123.5
219	T	35.7	Very low	34.7	Very low	132 Å²	132	115.4 Å²	115.4	81%	0.81	72%	0.718	S	S	*	*				147.9	114.1	112.2	-56.9	0	0	0	0	114.5
220	A	34.3	Very low	35	Very low	95 Å²	95	112.5 Å²	112.5	79%	0.785	70%	0.704	S	S	*	*			trans	179	124.4	148.4	0	0	0	0	0	108.1
221	T	32.5	Very low	35.5	Very low	138 Å²	138	115.6 Å²	115.6	85%	0.847	71%	0.709	S	S	*	*			cis	87.9	108.6	42.5	-56.6	0	0	0	0	113.8
222	G	31.2	Very low	35.8	Very low	71 Å²	71	120.6 Å²	120.6	73%	0.732	72%	0.721	S	S	*	*			trans	149.6	123.2	159.3	0	0	0	0	0	119.3
223	A	38.1	Very low	36	Very low	114 Å²	114	117.1 Å²	117.1	94%	0.942	72%	0.72	S	S	*	*			trans	55.2	131.4	145.8	0	0	0	0	0	124.1
224	G	36.3	Very low	36.3	Very low	72 Å²	72	120.1 Å²	120.1	74%	0.742	72%	0.719	S	S	*	*				119.2	55.3	96.6	0	0	0	0	0	124.5
225	S	38.4	Very low	36.6	Very low	107 Å²	107	122.4 Å²	122.4	75%	0.748	71%	0.714	S	S	*	*			trans	57.2	175.2	138.6	-136.4	0	0	0	0	124.4
226	E	34.8	Very low	36.8	Very low	155 Å²	155	122.9 Å²	122.9	72%	0.724	71%	0.707	S	S	*	*			trans	76.2	162.8	164.8	-50.6	-42.2	117.1	0	0	123.9
227	V	34.6	Very low	36.7	Very low	69 Å²	69	121.2 Å²	121.2	42%	0.418	70%	0.695	S	S	.	*			trans	-168.6	166.7	-144.1	168.8	0	0	0	0	108.9	R787	V227-R787 HydrophobicContact CG1-CB 3.84Å; V227-R787 HydrophobicContact CG1-CG 3.98Å; V227-R787 HydrophobicContact CG2-CB 4.28Å
228	P	40.4	Very low	36.9	Very low	61 Å²	61	126.5 Å²	126.5	40%	0.396	70%	0.7	S	S	.	*			cis	-139.7	-178.5	-22.7	38.7	-18.6	0	0	0	117.8	R785 R787	P228-R785 VanDerWaalsContact CG-CA 3.49Å; P228-R787 HydrophobicContact CB-CG 4.42Å
229	R	39.6	Very low	37	Very low	122 Å²	122	124.5 Å²	124.5	46%	0.46	70%	0.697	S	S	.	*				153	173.1	109	-138.1	-141.7	165.3	140.7	14	116	H783 H784 R785	R229-H783 WeakPolarHBondContact CD-O 3.46Å; R229-H783 PolarHBondContact NH1-O 2.92Å; R229-H784 VanDerWaalsContact CD-C 3.42Å; R229-H784 PolarHBondContact NE-O 2.84Å; R229-H784 PolarHBondContact NH1-O 3.2Å; R229-R785 WeakPolarHBondContact CG-O 3.37Å; R229-R785 PolarHBondContact NE-O 3.06Å
230	E	37.2	Very low	37.1	Very low	124 Å²	124	130 Å²	130	58%	0.579	70%	0.704	S	S	*	*			trans	-65.3	176.5	178.2	-56.9	158.8	57.4	0	0	113.7
231	K	41.5	Very low	37.1	Very low	148 Å²	148	131.2 Å²	131.2	64%	0.643	71%	0.706	S	S	*	*			cis	-179.9	148.2	47.9	-145.7	177.7	-167.8	175	0	114.5
232	K	38.2	Very low	37.2	Very low	190 Å²	190	133.4 Å²	133.4	83%	0.826	71%	0.707	S	S	*	*			trans	35.9	121.4	146.7	-79.9	-172.1	174.7	-173.8	0	124.4
233	A	38.2	Very low	37.3	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	71%	0.709	S	S	*	*				108.8	144.7	105.9	0	0	0	0	0	124.5
234	R	37.3	Very low	37.3	Very low	224 Å²	224	135.9 Å²	135.9	85%	0.845	70%	0.698	S	S	*	*			trans	74.6	115.7	149.5	-86	-169	151.5	-156.7	-5.8	123.3
235	L	39.5	Very low	37.2	Very low	119 Å²	119	140 Å²	140	62%	0.623	70%	0.702	S	S	*	*				77.7	117.2	125.5	-70.2	172.7	0	0	0	123.6
236	Q	41.2	Very low	37	Very low	141 Å²	141	139.8 Å²	139.8	66%	0.659	70%	0.7	S	S	*	*				94.7	113.6	113.2	-167.4	165.3	-7.4	0	0	122.4
237	E	33.7	Very low	37	Very low	131 Å²	131	138.2 Å²	138.2	61%	0.612	70%	0.702	S	S	*	*			trans	83.9	143.2	143.7	-90.9	-174.9	99.1	0	0	126
238	R	38.1	Very low	37	Very low	208 Å²	208	139.6 Å²	139.6	79%	0.785	72%	0.72	S	S	*	*			trans	74.2	98.2	142.2	-76.7	174	174	-135.7	-7	123.1
239	S	35.5	Very low	36.8	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	74%	0.735	S	S	*	*				78.8	115.9	108.5	-62.4	0	0	0	0	123.4
240	R	38.3	Very low	36.7	Very low	249 Å²	249	141.5 Å²	141.5	94%	0.94	75%	0.753	S	S	*	*			trans	73.6	153.9	135.1	-72	-176.6	169.5	167.8	-2.7	120.3
241	S	34	Very low	36.8	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	76%	0.76	S	S	*	*			trans	-124	103.7	-175.7	42.3	0	0	0	0	113.2
242	Q	35.2	Very low	36.7	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	76%	0.756	S	S	*	*			trans	-160.7	133.1	153.7	-91	-171.5	-13.3	0	0	104
243	T	32.7	Very low	36.8	Very low	127 Å²	127	135.7 Å²	135.7	78%	0.779	75%	0.751	S	S	*	*			cis	-149.6	173.7	0.6	-2.8	0	0	0	0	107.7
244	P	38.8	Very low	36.7	Very low	109 Å²	109	136.6 Å²	136.6	71%	0.708	74%	0.743	S	S	*	*			trans	-93.6	179.1	-162	39.3	-39.6	0	0	0	114.6
245	L	34.2	Very low	36.7	Very low	159 Å²	159	132 Å²	132	83%	0.832	74%	0.74	S	S	*	*			trans	169.8	141.6	131.5	-91.1	155.6	0	0	0	113.6
246	S	33.8	Very low	36.6	Very low	102 Å²	102	130.1 Å²	130.1	71%	0.713	74%	0.742	S	S	*	*			trans	65.1	155.7	143.7	-67.6	0	0	0	0	122.4
247	T	35	Very low	36.3	Very low	123 Å²	123	127.5 Å²	127.5	76%	0.755	74%	0.739	S	S	*	*			cis	-166.9	140.1	-20.5	-87.6	0	0	0	0	110
248	A	35.8	Very low	36.5	Very low	98 Å²	98	130 Å²	130	81%	0.81	75%	0.751	S	S	*	*			trans	65.4	168.7	166.2	0	0	0	0	0	117.4
249	A	35.9	Very low	36.3	Very low	86 Å²	86	123.5 Å²	123.5	71%	0.711	75%	0.748	S	S	*	*			cis	-154.3	168.8	8.4	0	0	0	0	0	113.9
250	V	37.9	Very low	36.2	Very low	136 Å²	136	123.4 Å²	123.4	82%	0.824	75%	0.754	S	S	*	*			trans	66.5	108.3	160	179.2	0	0	0	0	116.9
251	S	38.5	Very low	36.2	Very low	106 Å²	106	116.8 Å²	116.8	74%	0.741	74%	0.743	S	S	*	*				74.7	144.6	82.9	-104.3	0	0	0	0	115.3
252	S	40	Very low	36.3	Very low	78 Å²	78	118.5 Å²	118.5	55%	0.545	74%	0.742	S	S	.	*			cis	-162.3	147.5	6.2	-119	0	0	0	0	112.9
253	Q	38.5	Very low	36.2	Very low	157 Å²	157	115.4 Å²	115.4	73%	0.734	73%	0.731	S	S	*	*			trans	62.4	152.8	133.7	-65.8	174.5	-89.4	0	0	121.4
254	D	36.4	Very low	36.4	Very low	109 Å²	109	119.1 Å²	119.1	58%	0.583	73%	0.731	S	S	*	*			cis	-163.6	155.1	-7.1	-118.3	-22	0	0	0	115.4
255	T	38.2	Very low	36.2	Very low	127 Å²	127	120.8 Å²	120.8	78%	0.779	73%	0.734	S	S	*	*			trans	56.7	167.2	147.4	59.5	0	0	0	0	121.3
256	A	37.2	Very low	36.2	Very low	81 Å²	81	122.3 Å²	122.3	67%	0.669	73%	0.734	S	S	*	*			cis	-171.3	142.3	-29.5	0	0	0	0	0	105.7
257	S	34.9	Very low	36	Very low	85 Å²	85	121 Å²	121	59%	0.594	74%	0.737	S	S	*	*			cis	108.8	140.9	21.8	76.2	0	0	0	0	114.4
258	H	37.8	Very low	35.9	Very low	185 Å²	185	120.4 Å²	120.4	86%	0.856	74%	0.744	S	S	*	*			trans	73.4	148	175	-39.7	-72.5	0	0	0	118.6
259	G	33.7	Very low	35.6	Very low	70 Å²	70	123 Å²	123	72%	0.722	74%	0.739	S	S	*	*			cis	150.8	121.2	-22.3	0	0	0	0	0	118
260	A	33.4	Very low	35.7	Very low	101 Å²	101	124.3 Å²	124.3	84%	0.835	74%	0.741	S	S	*	*			trans	64.3	177.3	148.8	0	0	0	0	0	119.2
261	P	39	Very low	35.3	Very low	110 Å²	110	121.7 Å²	121.7	71%	0.714	73%	0.728	S	S	*	*			cis	-128.9	-153.6	-42.1	28.7	-6.3	0	0	0	112.2
262	L	35.4	Very low	35	Very low	154 Å²	154	124.6 Å²	124.6	81%	0.806	73%	0.73	S	S	*	*			trans	78.9	144.1	163.2	-65.8	162.4	0	0	0	117.1
263	D	33.2	Very low	34.6	Very low	120 Å²	120	128.4 Å²	128.4	64%	0.642	74%	0.739	S	S	*	*			cis	-160.8	168.7	-15.8	-164.2	12	0	0	0	111.7
264	R	36.4	Very low	34.1	Very low	205 Å²	205	124.9 Å²	124.9	77%	0.774	74%	0.737	S	S	*	*			trans	54.5	113	146.8	-91.8	174.1	173.6	-163.5	-3.9	123.9
265	N	34.4	Very low	34.2	Very low	144 Å²	144	128.5 Å²	128.5	77%	0.77	76%	0.755	S	S	*	*				75.4	126.9	115.4	-108.4	-10.4	0	0	0	124.4
266	K	34	Very low	33.8	Very low	192 Å²	192	125.8 Å²	125.8	84%	0.835	75%	0.753	S	S	*	*				79.9	81.1	124.6	-160	-172.4	-179.4	-173.8	0	121.9
267	G	30.2	Very low	33.9	Very low	75 Å²	75	128 Å²	128	77%	0.773	76%	0.76	S	S	*	*				80.6	161.8	111	0	0	0	0	0	122.8
268	A	32.4	Very low	33.5	Very low	109 Å²	109	130.8 Å²	130.8	90%	0.901	76%	0.764	S	S	*	*			trans	87.4	149.7	172.6	0	0	0	0	0	119.4
269	E	29.9	Very low	33.4	Very low	152 Å²	152	129 Å²	129	71%	0.71	76%	0.756	S	S	*	*			trans	-77	170.7	175.3	-130.4	-146.8	111.5	0	0	111	S271	E269-S271 WeakPolarHBondContact OE1-CA 3.49Å; E269-S271 PolarHBondContact OE1-N 3.18Å; E269-S271 PolarHBondContact OE1-OG 3.05Å
270	P	37.8	Very low	33.2	Very low	115 Å²	115	133.7 Å²	133.7	75%	0.747	76%	0.756	S	S	*	*				-149.4	149.6	54.1	41.4	-20.4	0	0	0	120.2
271	S	29.8	Very low	33.2	Very low	80 Å²	80	138 Å²	138	56%	0.559	76%	0.759	S	S	*	*				46.5	158.1	127.7	-66.8	0	0	0	0	124.5	E269	E269-S271 WeakPolarHBondContact OE1-CA 3.49Å; E269-S271 PolarHBondContact OE1-N 3.18Å; E269-S271 PolarHBondContact OE1-OG 3.05Å
272	Q	31.9	Very low	32.9	Very low	167 Å²	167	136.9 Å²	136.9	78%	0.78	76%	0.759	S	S	*	*			trans	73.6	149.9	163.1	-69.8	169.3	52.3	0	0	116.1
273	Q	32.3	Very low	33	Very low	159 Å²	159	134 Å²	134	74%	0.743	75%	0.752	S	S	*	*			cis	-148.4	136.6	-0.5	-111.3	159.8	42.9	0	0	106.9
274	A	28.9	Very low	33.3	Very low	82 Å²	82	139.6 Å²	139.6	68%	0.678	76%	0.764	S	S	*	*				83.7	153.2	81.4	0	0	0	0	0	116
275	L	36.5	Very low	33.4	Very low	185 Å²	185	135 Å²	135	97%	0.969	76%	0.764	S	S	*	*			trans	73.7	138.4	-178.7	-48.8	169.7	0	0	0	115.8
276	G	31.8	Very low	33.6	Very low	71 Å²	71	138.1 Å²	138.1	73%	0.732	77%	0.765	S	S	*	*			cis	-168.4	165.5	-7.3	0	0	0	0	0	112.8
277	P	37.4	Very low	33.8	Very low	126 Å²	126	133.9 Å²	133.9	82%	0.818	76%	0.759	S	S	*	*			trans	-109.3	-159.9	-174.5	42.8	-35.5	0	0	0	114.8
278	E	28.3	Very low	34	Very low	144 Å²	144	137.1 Å²	137.1	67%	0.673	75%	0.754	S	S	*	*			trans	78	158.4	-177.8	-61.5	-151.5	85.3	0	0	115.7
279	Q	34.4	Very low	34.7	Very low	149 Å²	149	137.6 Å²	137.6	70%	0.696	75%	0.748	S	S	*	*			cis	-148	141.8	3.8	-127.2	148.4	46.2	0	0	106.5
280	K	29.7	Very low	35.4	Very low	167 Å²	167	135.4 Å²	135.4	73%	0.726	75%	0.747	S	S	*	*			cis	91.8	93.7	37.7	179.9	-161.1	-177	-179.1	0	114.6
281	Q	34.3	Very low	35.4	Very low	191 Å²	191	140.7 Å²	140.7	89%	0.893	75%	0.752	S	S	*	*			trans	-169.9	124.6	151.9	-99.6	160.3	26	0	0	107.1
282	A	32.3	Very low	35.8	Very low	87 Å²	87	143.2 Å²	143.2	72%	0.719	76%	0.755	S	S	*	*				70.9	128.3	66.6	0	0	0	0	0	112.5
283	S	37.5	Very low	36	Very low	93 Å²	93	144.3 Å²	144.3	65%	0.65	75%	0.752	S	S	*	*				-172.5	147.9	54.3	-64.3	0	0	0	0	115.7
284	R	38.9	Very low	36.3	Very low	239 Å²	239	144 Å²	144	90%	0.902	75%	0.748	S	S	*	*			trans	67.4	152.8	150	-59.8	156.3	-168.5	-166.1	1.3	116.7
285	S	38.5	Very low	36.5	Very low	109 Å²	109	149.2 Å²	149.2	76%	0.762	76%	0.756	S	S	*	*			cis	-140.3	142.4	15.8	-68	0	0	0	0	109.8
286	R	38.7	Very low	36.3	Very low	209 Å²	209	144.4 Å²	144.4	79%	0.789	74%	0.742	S	S	*	*				63.2	131.5	77	-164.3	171	-168.6	-141.1	4.2	112.8	E288	R286-E288 WeakPolarHBondContact CG-OE2 2.94Å; R286-E288 IonicContact CZ-OE2 3.17Å; R286-E288 IonicContact NE-OE2 3.74Å; R286-E288 PolarHBondContact NE-OE2 2.91Å; R286-E288 VanDerWaalsContact NE-OE2 3.14Å; R286-E288 IonicContact NH2-OE2 2.62Å
287	S	37.9	Very low	36.6	Very low	103 Å²	103	147.5 Å²	147.5	72%	0.72	75%	0.749	S	S	*	*			cis	-163.1	169.4	24.6	16.1	0	0	0	0	110.8
288	E	34.2	Very low	36.4	Very low	143 Å²	143	144.4 Å²	144.4	67%	0.668	74%	0.741	S	S	*	*			cis	-174.5	137.7	-28.4	-135.8	152.2	118.8	0	0	109.4	R286	R286-E288 WeakPolarHBondContact CG-OE2 2.94Å; R286-E288 IonicContact CZ-OE2 3.17Å; R286-E288 IonicContact NE-OE2 3.74Å; R286-E288 PolarHBondContact NE-OE2 2.91Å; R286-E288 VanDerWaalsContact NE-OE2 3.14Å; R286-E288 IonicContact NH2-OE2 2.62Å
289	P	48.5	Very low	36.6	Very low	118 Å²	118	145.5 Å²	145.5	77%	0.766	75%	0.75	S	S	*	*			trans	-108.7	-158.9	-179.8	44.1	-38.1	0	0	0	112.4
290	P	44.3	Very low	36.3	Very low	107 Å²	107	142.8 Å²	142.8	70%	0.695	75%	0.748	S	S	*	*			cis	-136.5	-148.4	-7.1	43.5	-22.6	0	0	0	113.9
291	R	37	Very low	36.3	Very low	225 Å²	225	141.6 Å²	141.6	85%	0.849	75%	0.745	S	S	*	*			trans	119.9	155.1	157.2	-65.4	175.1	-161.8	-144.5	3	115.8
292	E	39.1	Very low	36.2	Very low	134 Å²	134	139.3 Å²	139.3	63%	0.626	73%	0.734	S	S	*	*			cis	-131.1	149.4	3.3	-94.7	-141.2	129.4	0	0	110.8
293	R	36.5	Very low	36	Very low	190 Å²	190	142.1 Å²	142.1	72%	0.717	74%	0.737	S	S	*	*				62.1	145.1	81.4	-102.1	173.2	165	-161.8	0.9	114.2
294	K	36.8	Very low	35.8	Very low	151 Å²	151	141 Å²	141	66%	0.657	74%	0.741	S	S	*	*			cis	-174.1	147.1	-2.5	-154.3	-175.5	-173.8	178.4	0	111.7
295	K	34.1	Very low	35.3	Very low	193 Å²	193	140 Å²	140	84%	0.839	74%	0.743	S	S	*	*			trans	61.3	170.4	158.4	-86.4	-173	173.7	-164.9	0	117
296	A	31.2	Very low	35	Very low	84 Å²	84	138.9 Å²	138.9	69%	0.694	75%	0.749	S	S	*	*			cis	-161.2	166.1	-21.7	0	0	0	0	0	109.8
297	P	38.8	Very low	34.6	Very low	135 Å²	135	132.3 Å²	132.3	88%	0.877	75%	0.745	S	S	*	*			trans	-105.2	166.8	-170.7	39.8	-35.4	0	0	0	116.7
298	G	33.8	Very low	34.4	Very low	62 Å²	62	135.4 Å²	135.4	64%	0.639	75%	0.749	S	S	*	*			trans	-152	130.9	161.6	0	0	0	0	0	109.1
299	L	31.4	Very low	34.2	Very low	166 Å²	166	136.5 Å²	136.5	87%	0.869	75%	0.751	S	S	*	*				65	102.2	78.1	-65	173.9	0	0	0	111.4
300	S	29.2	Very low	33.3	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	74%	0.741	S	S	*	*				107.8	161	81.2	80.8	0	0	0	0	108.7
301	E	30.2	Very low	32.7	Very low	143 Å²	143	136.1 Å²	136.1	67%	0.668	74%	0.739	S	S	*	*			cis	-164	167.4	12.2	-139.3	160.9	119.5	0	0	113.2
302	Q	31.5	Very low	32.6	Very low	143 Å²	143	134.8 Å²	134.8	67%	0.668	73%	0.734	S	S	*	*			trans	50.9	128.5	145	-86.8	-176.3	73.6	0	0	125.7
303	N	27.3	Very low	32.2	Very low	145 Å²	145	136.9 Å²	136.9	78%	0.775	74%	0.741	S	S	*	*				72	158	129.6	-75.3	-38.7	0	0	0	124.2
304	G	34.4	Very low	32.1	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	75%	0.747	S	S	*	*			trans	101.2	90	175.2	0	0	0	0	0	113.7
305	K	28.6	Very low	31.9	Very low	217 Å²	217	137.3 Å²	137.3	94%	0.943	75%	0.752	S	S	*	*			cis	61.8	105.6	47.8	-90.3	-170.9	179.1	178.6	0	115.2
306	G	30.9	Very low	32.2	Very low	86 Å²	86	132.8 Å²	132.8	89%	0.887	74%	0.742	S	S	*	*			trans	121.6	139.8	164.7	0	0	0	0	0	114.2
307	G	31.7	Very low	32.3	Very low	70 Å²	70	138.1 Å²	138.1	72%	0.722	75%	0.75	S	S	*	*			cis	161.7	134.9	-14.7	0	0	0	0	0	115.2
308	Q	32.3	Very low	32	Very low	168 Å²	168	136.3 Å²	136.3	79%	0.785	74%	0.74	S	S	*	*			trans	68.3	170.1	167.9	-45.7	-168.3	-5.3	0	0	115.2
309	K	30.4	Very low	32	Very low	167 Å²	167	139.8 Å²	139.8	73%	0.726	75%	0.749	S	S	*	*			cis	-158.1	160.1	8.8	-147.6	161.3	-173.8	158.6	0	113.4
310	S	29.4	Very low	32.3	Very low	80 Å²	80	137.1 Å²	137.1	56%	0.559	74%	0.739	S	S	*	*			trans	38.6	120.1	145.2	-78.5	0	0	0	0	122.6
311	E	32	Very low	32.6	Very low	137 Å²	137	140.9 Å²	140.9	64%	0.64	75%	0.747	S	S	*	*				99	157.5	96.6	-80.6	177.2	96.6	0	0	113.1
312	R	34.3	Very low	33.1	Very low	196 Å²	196	139.6 Å²	139.6	74%	0.74	75%	0.751	S	S	*	*			cis	-145.8	145.2	2.7	-113	155.1	-162	-167.5	11.5	107.9
313	K	31.8	Very low	33.4	Very low	179 Å²	179	135.6 Å²	135.6	78%	0.778	75%	0.748	S	S	*	*				60.4	107.2	77.3	-135.2	174.1	-173.1	172.7	0	111.9
314	R	35.1	Very low	33.9	Very low	224 Å²	224	137.6 Å²	137.6	85%	0.845	75%	0.752	S	S	*	*				-173.2	155	76.8	-79	167	-178.7	159.1	-1.4	109.2
315	V	32.5	Very low	34.1	Very low	126 Å²	126	136.2 Å²	136.2	76%	0.764	74%	0.739	S	S	*	*			cis	83.5	136.2	34.5	166.3	0	0	0	0	112.9
316	P	40.3	Very low	34.6	Very low	98 Å²	98	133 Å²	133	64%	0.636	74%	0.738	S	S	*	*			cis	-150.1	-175.4	-21.9	42	-21.6	0	0	0	118.3
317	K	33	Very low	34.9	Very low	196 Å²	196	132.8 Å²	132.8	85%	0.852	73%	0.727	S	S	*	*			trans	64.6	164.1	141.2	-85.7	175.1	-179.6	-175.6	0	120.2
318	S	31.2	Very low	35.2	Very low	96 Å²	96	136 Å²	136	67%	0.671	73%	0.728	S	S	*	*			cis	-171.9	175.6	-3	40.9	0	0	0	0	113.3
319	V	35	Very low	35.4	Very low	136 Å²	136	133.9 Å²	133.9	82%	0.824	72%	0.718	S	S	*	*			trans	74.7	141.9	154	157.9	0	0	0	0	116.3
320	V	36.4	Very low	35.7	Very low	110 Å²	110	136.2 Å²	136.2	67%	0.667	72%	0.722	S	S	*	*			cis	-157.4	134	-7.7	120.2	0	0	0	0	107.6
321	Q	36.2	Very low	36	Very low	171 Å²	171	137.5 Å²	137.5	80%	0.799	72%	0.719	S	S	*	*				56	155.1	94.2	-85.2	-149	107.4	0	0	118.3
322	P	40	Very low	36.2	Very low	115 Å²	115	140.3 Å²	140.3	75%	0.747	72%	0.724	S	S	*	*			cis	-133.7	163.9	-2.5	36	-17.5	0	0	0	118.8
323	G	39.2	Very low	36.2	Very low	59 Å²	59	138 Å²	138	61%	0.608	72%	0.719	S	S	*	*			trans	82.3	175.7	152.2	0	0	0	0	0	119
324	E	36.8	Very low	36.2	Very low	187 Å²	187	135.3 Å²	135.3	87%	0.874	71%	0.709	S	S	*	*			cis	-170.3	173	-28.5	-103.2	-32.9	96.7	0	0	108.5
325	G	39	Very low	36.1	Very low	43 Å²	43	132.6 Å²	132.6	44%	0.443	70%	0.699	S	S	.	*			cis	171.2	159	-2.9	0	0	0	0	0	113.2
326	T	38.8	Very low	36.1	Very low	150 Å²	150	135 Å²	135	92%	0.92	69%	0.694	S	S	*	*			trans	61.8	138.7	175.4	64.8	0	0	0	0	118.9
327	A	37.7	Very low	35.8	Very low	81 Å²	81	137 Å²	137	67%	0.669	70%	0.695	S	S	*	*			cis	-158.9	150.3	-10.6	0	0	0	0	0	113.1
328	D	37.7	Very low	35.7	Very low	137 Å²	137	133 Å²	133	73%	0.733	69%	0.687	S	S	*	*			trans	46.6	124.8	151.6	-67.1	-75.2	0	0	0	122.9
329	E	36	Very low	35.8	Very low	124 Å²	124	139.3 Å²	139.3	58%	0.579	70%	0.697	S	S	*	*				71.9	143.6	75.6	-72.6	-123.6	103.6	0	0	113.6
330	R	37	Very low	35.8	Very low	215 Å²	215	144.5 Å²	144.5	81%	0.811	70%	0.701	S	S	*	*			cis	-159	-169.1	22.1	-151.7	170	-116.2	-165.8	1.2	111.2
331	E	36	Very low	35.6	Very low	107 Å²	107	146.8 Å²	146.8	50%	0.5	71%	0.709	S	S	.	*				-152.2	145.9	-93	-154.6	-143.5	55	0	0	111.2
332	R	36.8	Very low	35.6	Very low	196 Å²	196	145.6 Å²	145.6	74%	0.74	70%	0.703	S	S	*	*			trans	57	173.7	154.3	-81.5	-163.7	-160.9	114	9.6	119.7
333	K	34.4	Very low	35.4	Very low	148 Å²	148	148.5 Å²	148.5	64%	0.643	70%	0.704	S	S	*	*			cis	-164.3	148.2	-31.8	170	167.8	-178.6	-178.1	0	112
334	E	31.4	Very low	35.3	Very low	122 Å²	122	148.9 Å²	148.9	57%	0.57	71%	0.709	S	S	*	*			trans	6.4	137.7	145.1	-155.3	-153.6	147.6	0	0	117.9
335	R	33.1	Very low	35.3	Very low	168 Å²	168	151.9 Å²	151.9	63%	0.634	71%	0.712	S	S	*	*				147.5	131	98.2	-163.4	174.8	-144	-122.4	3.5	116.5
336	R	33.2	Very low	35.2	Very low	175 Å²	175	153.7 Å²	153.7	66%	0.66	72%	0.718	S	S	*	*			trans	61.5	174	158.7	-78.8	167	167	-130.5	4.2	115.6
337	E	32.8	Very low	35.1	Very low	141 Å²	141	154.3 Å²	154.3	66%	0.659	71%	0.71	S	S	*	*			cis	-129.7	-156.9	-3.4	-155.9	90.8	-112.8	0	0	110.6
338	T	32.1	Very low	35	Very low	111 Å²	111	156.2 Å²	156.2	68%	0.681	71%	0.709	S	S	*	*			trans	-102.9	157.7	-168.4	-0.9	0	0	0	0	113.8
339	R	32.6	Very low	34.7	Very low	229 Å²	229	159.2 Å²	159.2	86%	0.864	71%	0.712	S	S	*	*			trans	85.2	145	149.4	-70	160.2	173.8	-166.5	-2.6	120.9
340	R	34	Very low	35	Very low	246 Å²	246	158.9 Å²	158.9	93%	0.928	72%	0.72	S	S	*	*			trans	83.4	154.5	159.3	-75.2	177.7	173.2	-177.3	-3.9	118.9
341	L	33.5	Very low	34.9	Very low	157 Å²	157	153.9 Å²	153.9	82%	0.822	71%	0.709	S	S	*	*			trans	-116.2	150.1	-172.4	-63	70.9	0	0	0	109.2
342	E	35.9	Very low	34.8	Very low	146 Å²	146	157.8 Å²	157.8	68%	0.682	72%	0.72	S	S	*	*				165.3	128.1	119.3	-92.6	-91	87.4	0	0	113.8
343	K	36.4	Very low	34.7	Very low	176 Å²	176	154.9 Å²	154.9	77%	0.765	72%	0.718	S	S	*	*			trans	53.4	130	130.7	-149.8	-175.3	-99.6	84.4	0	123.4
344	G	36.3	Very low	34.8	Very low	68 Å²	68	154.2 Å²	154.2	70%	0.701	72%	0.717	S	S	*	*			trans	123.1	119.6	164.8	0	0	0	0	0	113.4
345	R	35.9	Very low	35	Very low	249 Å²	249	155.3 Å²	155.3	94%	0.94	72%	0.72	S	S	*	*				61.7	133.8	63.9	-80.2	-164.7	178.6	-153.6	1.1	114.2
346	S	37.4	Very low	35.2	Very low	82 Å²	82	156.2 Å²	156.2	57%	0.573	72%	0.723	S	S	*	*			cis	-165.5	151.7	-4.2	-149.6	0	0	0	0	111.5
347	Q	37	Very low	35.4	Very low	162 Å²	162	153.9 Å²	153.9	76%	0.757	72%	0.72	S	S	*	*			trans	62.3	160.5	150.4	-70.6	167.4	-92.3	0	0	120.4
348	D	34.7	Very low	35.6	Very low	121 Å²	121	151.9 Å²	151.9	65%	0.647	71%	0.714	S	S	*	*			cis	-155.8	-174.9	-10.2	-115.9	-32.2	0	0	0	114.3
349	Y	33.2	Very low	35.9	Very low	201 Å²	201	149.9 Å²	149.9	79%	0.788	72%	0.715	S	S	*	*			trans	-54.9	-176.8	178.5	-85.1	-95.1	0	0	0	118.4
350	P	41	Very low	36	Very low	117 Å²	117	148.1 Å²	148.1	76%	0.76	71%	0.709	S	S	*	*			cis	-123.1	173.5	14.4	19.8	7.9	0	0	0	116.2
351	D	35	Very low	36	Very low	109 Å²	109	142.8 Å²	142.8	58%	0.583	70%	0.703	S	S	*	*			cis	77.8	148	40.9	-144.1	31	0	0	0	113
352	R	34.5	Very low	36.2	Very low	190 Å²	190	138.5 Å²	138.5	72%	0.717	69%	0.691	S	S	*	*			cis	-166.6	177	21.9	-162	174.2	-176.9	85.4	-5.3	112.5
353	L	34.8	Very low	36.2	Very low	135 Å²	135	140 Å²	140	71%	0.707	70%	0.698	S	S	*	*			trans	79.1	146.5	159.6	-53.2	174.7	0	0	0	118.8
354	E	35.4	Very low	36.4	Very low	133 Å²	133	138.2 Å²	138.2	62%	0.621	70%	0.696	S	S	*	*			cis	-161.3	-160.4	-12.2	-121.9	-175.5	135.4	0	0	108.2
355	K	36.9	Very low	36.4	Very low	145 Å²	145	141.1 Å²	141.1	63%	0.63	69%	0.692	S	S	*	*			cis	-162.8	-174.5	3	-129.1	165.7	172.4	69.7	0	105.1
356	R	35.6	Very low	36.5	Very low	187 Å²	187	135.3 Å²	135.3	71%	0.706	67%	0.673	S	S	*	*			cis	-172.9	166.9	-19.3	-132.7	-172.9	170.6	-155.4	-22.8	103.5
357	E	38.4	Very low	36.4	Very low	126 Å²	126	138.2 Å²	138.2	59%	0.589	68%	0.678	S	S	*	*			cis	-164.8	176.1	-18.3	-130.9	163.7	-137.7	0	0	104.9
358	D	36	Very low	36.4	Very low	99 Å²	99	139.9 Å²	139.9	53%	0.529	68%	0.677	S	S	.	*			cis	-141.9	-75.1	-0.5	-179.6	-94.9	0	0	0	112.4	R360	D358-R360 VanDerWaalsContact CG-NH2 3.26Å; D358-R360 IonicContact OD1-CZ 2.97Å; D358-R360 IonicContact OD1-NE 2.62Å; D358-R360 PolarHBondContact OD1-NE 2.89Å; D358-R360 IonicContact OD1-NH2 2.72Å; D358-R360 PolarHBondContact OD1-NH2 3.31Å; D358-R360 VanDerWaalsContact OD1-NH2 3.08Å; D358-R360 IonicContact OD2-CZ 2.68Å; D358-R360 IonicContact OD2-NE 2.59Å; D358-R360 IonicContact OD2-NH2 2.63Å; D358-R360 PolarHBondContact OD2-NH2 3.21Å
359	G	40.1	Very low	36.5	Very low	69 Å²	69	141 Å²	141	71%	0.711	68%	0.676	S	S	*	*			trans	-178	-152.4	-155.9	0	0	0	0	0	117.4
360	R	33.5	Very low	36.6	Very low	193 Å²	193	137.4 Å²	137.4	73%	0.728	67%	0.667	S	S	*	*			cis	-166.2	164	0.6	-144.9	-172.1	-78.7	-157.6	-5.6	111.7	D358	D358-R360 VanDerWaalsContact CG-NH2 3.26Å; D358-R360 IonicContact OD1-CZ 2.97Å; D358-R360 IonicContact OD1-NE 2.62Å; D358-R360 PolarHBondContact OD1-NE 2.89Å; D358-R360 IonicContact OD1-NH2 2.72Å; D358-R360 PolarHBondContact OD1-NH2 3.31Å; D358-R360 VanDerWaalsContact OD1-NH2 3.08Å; D358-R360 IonicContact OD2-CZ 2.68Å; D358-R360 IonicContact OD2-NE 2.59Å; D358-R360 IonicContact OD2-NH2 2.63Å; D358-R360 PolarHBondContact OD2-NH2 3.21Å
361	V	34.8	Very low	36.3	Very low	133 Å²	133	139 Å²	139	81%	0.806	66%	0.664	S	S	*	*			trans	70	149.1	162.2	176.1	0	0	0	0	115.1
362	A	36.9	Very low	36.3	Very low	68 Å²	68	143 Å²	143	56%	0.562	68%	0.679	S	S	*	*			cis	-133.1	159.2	3.1	0	0	0	0	0	110.7
363	E	35.6	Very low	36.4	Very low	178 Å²	178	137.3 Å²	137.3	83%	0.832	68%	0.679	S	S	*	*				62.3	138.7	95.2	-55.6	171.7	148.6	0	0	113.9
364	D	40.6	Very low	36.2	Very low	138 Å²	138	137.3 Å²	137.3	74%	0.738	69%	0.685	S	S	*	*			cis	-159.1	172.4	31	-146.5	-12.9	0	0	0	114.7
365	E	37.6	Very low	36.1	Very low	129 Å²	129	135.6 Å²	135.6	60%	0.603	69%	0.687	S	S	*	*			trans	41.8	148	147.6	-70.9	-119.4	104.1	0	0	123
366	K	37	Very low	36.1	Very low	126 Å²	126	135.2 Å²	135.2	55%	0.548	70%	0.697	S	S	.	*			cis	-179.3	137.5	-0.5	165.1	-173.5	-127.1	137.7	0	112.7
367	Q	35.2	Very low	36.3	Very low	143 Å²	143	131.7 Å²	131.7	67%	0.668	70%	0.699	S	S	*	*			trans	63.6	154.1	156.7	-66.4	168	6.2	0	0	119.4
368	R	37.4	Very low	35.9	Very low	197 Å²	197	134.3 Å²	134.3	74%	0.743	71%	0.711	S	S	*	*			cis	-160.9	156.6	-14.4	-118.4	171.4	-176.3	-145.6	2.6	112.3
369	K	36.9	Very low	35.8	Very low	145 Å²	145	139.3 Å²	139.3	63%	0.63	72%	0.724	S	S	*	*				19.5	146.6	129.2	-69.7	177.9	150	-112.4	0	119.8
370	E	34.6	Very low	35.4	Very low	126 Å²	126	141 Å²	141	59%	0.589	72%	0.72	S	S	*	*			cis	-165.7	174.8	4	-123.6	154.3	-173.3	0	0	115.6
371	E	35.7	Very low	35.4	Very low	150 Å²	150	135.9 Å²	135.9	70%	0.701	71%	0.714	S	S	*	*			trans	-4.4	131.1	152.3	-74.4	163.4	153.6	0	0	119.9
372	E	34.3	Very low	35.5	Very low	194 Å²	194	134.4 Å²	134.4	91%	0.907	71%	0.709	S	S	*	*				80.9	151.8	84.5	-70.1	-154.1	135.8	0	0	116.2
373	G	36.8	Very low	35.3	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	72%	0.716	S	S	*	*			trans	119.9	78.9	149.7	0	0	0	0	0	121.1
374	V	32	Very low	35.4	Very low	136 Å²	136	136.7 Å²	136.7	82%	0.824	71%	0.712	S	S	*	*			trans	51.8	104.4	130.8	-176.2	0	0	0	0	121.5
375	S	32.4	Very low	35.4	Very low	97 Å²	97	135.8 Å²	135.8	68%	0.678	71%	0.711	S	S	*	*				55.4	128.8	126.5	-49.5	0	0	0	0	125.5
376	T	37.9	Very low	35.5	Very low	137 Å²	137	137.8 Å²	137.8	84%	0.84	72%	0.721	S	S	*	*			trans	69.1	161.7	143.1	51.9	0	0	0	0	119.2
377	P	37.9	Very low	35.6	Very low	113 Å²	113	140 Å²	140	73%	0.734	74%	0.738	S	S	*	*			cis	-134.6	-174.3	12.6	44.4	-26.2	0	0	0	118.4
378	E	30.7	Very low	35.5	Very low	180 Å²	180	141 Å²	141	84%	0.841	74%	0.742	S	S	*	*			trans	-23.5	152.2	166.4	-53.3	162.6	138.3	0	0	121.3
379	Y	34.4	Very low	35.4	Very low	205 Å²	205	135.6 Å²	135.6	80%	0.804	74%	0.735	S	S	*	*				-173.9	131.3	120.6	-145.3	-124.7	0	0	0	114.9
380	T	32.4	Very low	35.3	Very low	103 Å²	103	136.2 Å²	136.2	63%	0.632	74%	0.74	S	S	*	*			trans	51.3	157	153.6	52.7	0	0	0	0	121.1
381	S	32.5	Very low	35	Very low	86 Å²	86	135.7 Å²	135.7	60%	0.601	75%	0.75	S	S	*	*			cis	-155.7	-179	-10.3	-100.3	0	0	0	0	105.7
382	C	36.8	Very low	34.8	Very low	103 Å²	103	135 Å²	135	70%	0.696	76%	0.756	S	S	*	*			cis	-119.5	-179.5	14.8	-74.8	0	0	0	0	109.8
383	E	33.5	Very low	34.9	Very low	152 Å²	152	130.2 Å²	130.2	71%	0.71	74%	0.744	S	S	*	*			cis	70.7	131.5	32.3	-41.1	145.2	157.6	0	0	112.2
384	D	37.1	Very low	34.6	Very low	141 Å²	141	133.6 Å²	133.6	75%	0.754	74%	0.741	S	S	*	*			cis	-150.5	166.1	8.3	-148.8	23.9	0	0	0	107.7
385	V	40.3	Very low	34.7	Very low	119 Å²	119	135.8 Å²	135.8	72%	0.721	74%	0.739	S	S	*	*			cis	-145.7	158.5	16.7	-154.2	0	0	0	0	109.6
386	E	38.9	Very low	34.7	Very low	171 Å²	171	134.1 Å²	134.1	80%	0.799	74%	0.737	S	S	*	*			trans	-85.9	141	160.6	-70.4	177.2	117.5	0	0	111.6
387	L	40.3	Very low	34.6	Very low	174 Å²	174	135 Å²	135	91%	0.911	74%	0.737	S	S	*	*			trans	-133.6	99.7	153.2	-102.3	171.9	0	0	0	109.7
388	E	33.3	Very low	34.4	Very low	163 Å²	163	135.9 Å²	135.9	76%	0.762	74%	0.735	S	S	*	*			trans	-50.8	153.6	146.7	-54.1	-172.8	102.2	0	0	108.4
389	S	35.6	Very low	34.4	Very low	83 Å²	83	132.7 Å²	132.7	58%	0.58	72%	0.724	S	S	*	*				-173.8	156.8	76.4	-118.7	0	0	0	0	113.5
390	E	33.4	Very low	34.4	Very low	159 Å²	159	132.2 Å²	132.2	74%	0.743	72%	0.722	S	S	*	*			trans	44	112.6	136.3	-58.9	156.1	137.7	0	0	118.4
391	S	28.6	Very low	34.3	Very low	115 Å²	115	137.4 Å²	137.4	80%	0.804	73%	0.73	S	S	*	*			cis	68.9	66	47.3	92	0	0	0	0	116.1
392	V	32.9	Very low	34.2	Very low	135 Å²	135	140.4 Å²	140.4	82%	0.818	74%	0.738	S	S	*	*			trans	-134.8	141.9	161.4	-179.3	0	0	0	0	112.4
393	S	35.3	Very low	33.9	Very low	93 Å²	93	143.1 Å²	143.1	65%	0.65	75%	0.746	S	S	*	*			trans	-24.4	141.9	156.9	-92.1	0	0	0	0	116.9
394	E	30.8	Very low	34	Very low	141 Å²	141	140.6 Å²	140.6	66%	0.659	74%	0.743	S	S	*	*				82.6	132.3	71.5	-159.5	-153.2	124.5	0	0	114
395	K	32.8	Very low	33.6	Very low	181 Å²	181	138.6 Å²	138.6	79%	0.787	75%	0.746	S	S	*	*			trans	71.3	165.1	-178.6	-59.5	-168.6	-179.3	71.4	0	116.1
396	G	34.1	Very low	33.5	Very low	62 Å²	62	139 Å²	139	64%	0.639	75%	0.749	S	S	*	*			trans	100.7	116.5	-160.4	0	0	0	0	0	109.8
397	D	34.1	Very low	33.2	Very low	155 Å²	155	142.7 Å²	142.7	83%	0.829	76%	0.756	S	S	*	*			cis	62.6	132.6	30.5	-60.3	-44.1	0	0	0	113.1
398	L	34.3	Very low	32.7	Very low	133 Å²	133	143 Å²	143	70%	0.696	75%	0.752	S	S	*	*			cis	-166	125.1	-3.5	167.8	70.7	0	0	0	111.6
399	D	30.6	Very low	32.5	Very low	113 Å²	113	141 Å²	141	60%	0.604	76%	0.756	S	S	*	*			trans	54.4	-172.6	153	-140.3	-22.2	0	0	0	119.5
400	Y	34.6	Very low	32.3	Very low	195 Å²	195	146.3 Å²	146.3	77%	0.765	76%	0.763	S	S	*	*			trans	63.3	100	176.5	-54.4	-77.7	0	0	0	114.6
401	W	30.2	Very low	32.1	Very low	212 Å²	212	145.7 Å²	145.7	80%	0.803	76%	0.76	S	S	*	*			cis	56.8	118.8	43.3	-73.6	107.4	0	0	0	115.8
402	L	30.4	Very low	32.2	Very low	148 Å²	148	146.8 Å²	146.8	78%	0.775	76%	0.762	S	S	*	*			trans	69.4	118.4	160.6	-58.7	163.6	0	0	0	118
403	D	31.8	Very low	32.1	Very low	161 Å²	161	145.5 Å²	145.5	86%	0.861	76%	0.759	S	S	*	*				-156.5	135.6	99.8	-154	21.4	0	0	0	111.3
404	P	34	Very low	31.9	Very low	98 Å²	98	146.7 Å²	146.7	64%	0.636	77%	0.765	S	S	*	*			trans	-103.5	159	175.4	36.8	-30.8	0	0	0	114
405	A	28.6	Very low	32.1	Very low	99 Å²	99	145.2 Å²	145.2	82%	0.818	76%	0.76	S	S	*	*			trans	81.1	82.6	169.2	0	0	0	0	0	118.4
406	T	38.9	Very low	32	Very low	127 Å²	127	140.9 Å²	140.9	78%	0.779	75%	0.753	S	S	*	*			trans	-131.3	97.9	157.1	47.7	0	0	0	0	113.4
407	W	33.1	Very low	32.5	Very low	250 Å²	250	142.9 Å²	142.9	95%	0.947	76%	0.757	S	S	*	*			trans	72	137.1	148.9	-61.5	85.4	0	0	0	121.3
408	H	30	Very low	33.6	Very low	181 Å²	181	141.7 Å²	141.7	84%	0.838	75%	0.746	S	S	*	*			trans	-102.3	142.9	-174.2	-55.9	-106.1	0	0	0	112.4
409	S	29.1	Very low	35.6	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	73%	0.733	S	S	*	*			trans	168.1	140.3	139.7	-82.5	0	0	0	0	110.5
410	R	29.8	Very low	38.3	Very low	195 Å²	195	134.1 Å²	134.1	74%	0.736	71%	0.711	S	S	*	*			cis	-164.1	136.4	-8	173.9	173.7	176.7	-147.5	-19.2	108.5
411	E	30.7	Very low	40.9	Very low	145 Å²	145	126.2 Å²	126.2	68%	0.678	68%	0.683	S	S	*	*	S	Bend	trans	52.1	112.2	167.4	-69.2	155.5	-146.8	0	0	117
412	T	31	Very low	43.7	Very low	138 Å²	138	119.5 Å²	119.5	85%	0.847	66%	0.657	S	S	*	*			cis	-148.2	148.6	12.6	-58.9	0	0	0	0	110.7
413	S	29.3	Very low	46.4	Very low	108 Å²	108	116.9 Å²	116.9	76%	0.755	64%	0.641	S	S	*	*			trans	-65.6	151.6	-166.2	-52.7	0	0	0	0	116.4
414	P	32.2	Very low	49.1	Very low	118 Å²	118	113.6 Å²	113.6	77%	0.766	63%	0.629	S	S	*	*			trans	-83.2	137	-172.2	32.5	-35.9	0	0	0	114.5	S416	P414-S416 PolarHBondContact O-N 3.34Å
415	I	34.1	Very low	51.5	Low	110 Å²	110	109.4 Å²	109.4	56%	0.564	60%	0.602	S	S	*	*			trans	-79.3	86.4	171.7	-54.3	178.7	0	0	0	109.3	T421	I415-T421 HydrophobicContact CG2-CG2 3.87Å
416	S	32	Very low	54	Low	91 Å²	91	114.2 Å²	114.2	64%	0.636	60%	0.604	S	S	*	*			trans	-74.7	164.2	177.7	74.7	0	0	0	0	113.3	P414 H418	P414-S416 PolarHBondContact O-N 3.34Å; S416-H418 PolarHBondContact O-N 2.87Å
417	S	44.4	Very low	56	Low	104 Å²	104	114.2 Å²	114.2	73%	0.727	60%	0.595	S	S	*	*	S	Bend	trans	76	-4.1	165.3	83.5	0	0	0	0	120.4
418	H	57.5	Low	58.1	Low	129 Å²	129	104.6 Å²	104.6	60%	0.597	57%	0.574	S	S	*	*			trans	-117.5	129.6	179	-70.4	-3.4	0	0	0	112.7	S416 V420 T421	S416-H418 PolarHBondContact O-N 2.87Å; H418-V420 PolarHBondContact O-N 3.01Å; H418-T421 HydrophobicContact CB-CG2 4.45Å
419	P	76	Confident	60.7	Low	65 Å²	65	99.6 Å²	99.6	42%	0.422	55%	0.553	S	S	.	*	S	Bend	trans	-76.2	-6.1	-179.1	33.3	-37	0	0	0	113.3	I436 V482	P419-I436 PolarHBondContact O-N 2.86Å; P419-V482 HydrophobicContact CB-CG1 4.09Å; P419-V482 HydrophobicContact CG-CG1 4.09Å
420	V	86.6	Confident	63.5	Low	23 Å²	23	96.9 Å²	96.9	14%	0.139	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	130.1	174	174.8	0	0	0	0	108.7	H418 R434 V435 V482	H418-V420 PolarHBondContact O-N 3.01Å; V420-R434 WeakPolarHBondContact CA-O 3.47Å; V420-V435 HydrophobicContact CG1-CG2 4.16Å; V420-V435 HydrophobicContact CG2-CB 4.45Å; V420-V435 HydrophobicContact CG2-CG1 4.17Å; V420-V435 HydrophobicContact CG2-CG2 4.11Å; V420-V482 WeakPolarHBondContact CG2-O 3.31Å
421	T	89.4	Confident	66.4	Low	29 Å²	29	88.6 Å²	88.6	18%	0.178	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	127.2	172.6	59.9	0	0	0	0	109.7	I415 H418 G433 R434	I415-T421 HydrophobicContact CG2-CG2 3.87Å; H418-T421 HydrophobicContact CB-CG2 4.45Å; T421-G433 CarbonylContact O-C 3.56Å; T421-G433 WeakPolarHBondContact O-CA 3.3Å; T421-R434 PolarHBondContact N-O 3.07Å; T421-R434 PolarHBondContact O-N 2.89Å
422	W	89.5	Confident	69.3	Low	70 Å²	70	84.3 Å²	84.3	27%	0.265	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.5	175.5	-66.4	93.3	0	0	0	110.5	L431 I432 G433 V524 R526	W422-L431 HydrophobicContact CB-CD2 4.16Å; W422-L431 HydrophobicContact CE3-CB 4Å; W422-I432 CarbonylContact C-O 3.46Å; W422-I432 WeakPolarHBondContact CA-O 3.33Å; W422-G433 VanDerWaalsContact CZ3-CA 3.45Å; W422-V524 HydrophobicContact CH2-CG2 3.47Å; W422-V524 VanDerWaalsContact CH2-CG2 3.47Å; W422-V524 HydrophobicContact CZ2-CG2 4.35Å; W422-V524 HydrophobicContact CZ3-CG2 3.94Å; W422-R526 HydrophobicContact CH2-CG 4.5Å; W422-R526 VanDerWaalsContact CH2-NH1 3.33Å; W422-R526 HydrophobicContact CZ3-CG 3.97Å
423	Q	87.5	Confident	72.3	Confident	94 Å²	94	77.8 Å²	77.8	44%	0.439	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.3	178.2	-66.9	-179.4	-21.7	0	0	109.6	L431 I432	Q423-L431 CarbonylContact O-C 3.6Å; Q423-I432 PolarHBondContact N-O 3.42Å; Q423-I432 PolarHBondContact O-N 2.86Å
424	P	87.4	Confident	75.4	Confident	92 Å²	92	78.8 Å²	78.8	60%	0.597	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	150.7	169.9	-23.9	35.2	0	0	0	112.4	R430 I528	P424-R430 CarbonylContact C-O 3.48Å; P424-R430 WeakPolarHBondContact CA-O 3.49Å; P424-I528 HydrophobicContact CB-CD1 4.25Å
425	S	85.2	Confident	78.4	Confident	10 Å²	10	73.1 Å²	73.1	7%	0.07	39%	0.387	C	S	.	.			trans	-65.5	156.6	166.8	62.6	0	0	0	0	110.3	E427 G428 D429 R430	S425-E427 WeakPolarHBondContact CB-OE2 3.13Å; S425-E427 PolarHBondContact O-N 2.85Å; S425-G428 PolarHBondContact O-N 3.26Å; S425-G428 PolarHBondContact OG-N 3.35Å; S425-G428 VanDerWaalsContact OG-N 3.16Å; S425-D429 PolarHBondContact OG-N 2.89Å; S425-D429 PolarHBondContact OG-OD1 2.83Å; S425-R430 PolarHBondContact N-O 3.48Å; S425-R430 PolarHBondContact OG-N 2.84Å; S425-R430 VanDerWaalsContact OG-N 3.13Å; S425-R430 PolarHBondContact OG-O 2.99Å
426	K	81.2	Confident	81.2	Confident	199 Å²	199	70.3 Å²	70.3	87%	0.865	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.3	173.6	63.3	-176.5	-177.8	-174.1	0	112.1
427	E	79.6	Confident	83.9	Confident	127 Å²	127	66 Å²	66	59%	0.593	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-15.1	172.9	-61.1	80.7	-175.8	0	0	113.6	S425 D429	S425-E427 WeakPolarHBondContact CB-OE2 3.13Å; S425-E427 PolarHBondContact O-N 2.85Å; E427-D429 VanDerWaalsContact C-N 3.25Å; E427-D429 PolarHBondContact O-N 2.88Å
428	G	77.3	Confident	86	Confident	48 Å²	48	63.8 Å²	63.8	50%	0.495	32%	0.322	S	S	.	.	S	Bend	trans	72.2	8.6	-178.8	0	0	0	0	0	115.7	S425 I528	S425-G428 PolarHBondContact O-N 3.26Å; S425-G428 PolarHBondContact OG-N 3.35Å; S425-G428 VanDerWaalsContact OG-N 3.16Å; G428-I528 WeakPolarHBondContact O-CD1 3.38Å
429	D	84.4	Confident	87.4	Confident	76 Å²	76	60.9 Å²	60.9	41%	0.406	31%	0.307	S	S	.	.	S	Bend	trans	-94.1	-24.1	-177.3	76.8	-41.1	0	0	0	114	S425 E427 I528	S425-D429 PolarHBondContact OG-N 2.89Å; S425-D429 PolarHBondContact OG-OD1 2.83Å; E427-D429 VanDerWaalsContact C-N 3.25Å; E427-D429 PolarHBondContact O-N 2.88Å; D429-I528 PolarHBondContact O-N 3.26Å
430	R	88.1	Confident	87.6	Confident	63 Å²	63	67 Å²	67	24%	0.238	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155	-167.7	-75.8	160.1	-172.1	-108.7	-2.6	111.8	P424 S425 E490 R526 I528	P424-R430 CarbonylContact C-O 3.48Å; P424-R430 WeakPolarHBondContact CA-O 3.49Å; S425-R430 PolarHBondContact N-O 3.48Å; S425-R430 PolarHBondContact OG-N 2.84Å; S425-R430 VanDerWaalsContact OG-N 3.13Å; S425-R430 PolarHBondContact OG-O 2.99Å; R430-E490 IonicContact NH1-OE2 2.75Å; R430-E490 PolarHBondContact NH1-OE2 3.35Å; R430-R526 CarbonylContact C-O 3.59Å; R430-R526 WeakPolarHBondContact CA-O 3.33Å; R430-R526 WeakPolarHBondContact CB-O 3.34Å; R430-I528 VanDerWaalsContact O-CD1 3.3Å; R430-I528 WeakPolarHBondContact O-CD1 3.45Å
431	L	90.7	Very high	87.1	Confident	22 Å²	22	68.9 Å²	68.9	12%	0.115	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.9	168.1	-86.4	148.6	0	0	0	108.8	W422 Q423 S525 R526 I528 I531	W422-L431 HydrophobicContact CB-CD2 4.16Å; W422-L431 HydrophobicContact CE3-CB 4Å; Q423-L431 CarbonylContact O-C 3.6Å; L431-S525 VanDerWaalsContact O-CA 3.29Å; L431-S525 WeakPolarHBondContact O-CA 3.42Å; L431-R526 HydrophobicContact CB-CG 4.15Å; L431-R526 PolarHBondContact N-O 2.98Å; L431-R526 PolarHBondContact O-N 3.5Å; L431-I528 HydrophobicContact CB-CG1 4.45Å; L431-I528 HydrophobicContact CD1-CG1 3.77Å; L431-I528 HydrophobicContact CG-CD1 4.36Å; L431-I528 HydrophobicContact CG-CG1 3.65Å; L431-I531 HydrophobicContact CD1-CD1 3.5Å; L431-I531 VanDerWaalsContact CD1-CD1 3.5Å; L431-I531 HydrophobicContact CD1-CG1 4.02Å
432	I	92.7	Very high	85.8	Confident	55 Å²	55	74.1 Å²	74.1	28%	0.282	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	120.5	173.2	-57.1	176.8	0	0	0	107.8	W422 Q423 L492 I523 V524	W422-I432 CarbonylContact C-O 3.46Å; W422-I432 WeakPolarHBondContact CA-O 3.33Å; Q423-I432 PolarHBondContact N-O 3.42Å; Q423-I432 PolarHBondContact O-N 2.86Å; I432-L492 HydrophobicContact CG2-CD1 4.49Å; I432-I523 HydrophobicContact CG2-CG2 3.57Å; I432-V524 CarbonylContact C-O 3.59Å; I432-V524 VanDerWaalsContact CA-O 3.31Å; I432-V524 WeakPolarHBondContact CA-O 3.21Å
433	G	93	Very high	84.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.7	177.8	0	0	0	0	0	110.9	T421 W422 I523 V524	T421-G433 CarbonylContact O-C 3.56Å; T421-G433 WeakPolarHBondContact O-CA 3.3Å; W422-G433 VanDerWaalsContact CZ3-CA 3.45Å; G433-I523 CarbonylContact O-C 3.56Å; G433-I523 WeakPolarHBondContact O-CA 3.47Å; G433-V524 PolarHBondContact N-O 3.2Å; G433-V524 WeakPolarHBondContact O-CG2 3.37Å; G433-V524 PolarHBondContact O-N 2.83Å
434	R	95.1	Very high	83	Confident	129 Å²	129	72.7 Å²	72.7	49%	0.487	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.2	163.2	-56.4	-165.4	176.8	-172.4	-3.2	108.5	V420 T421 I523	V420-R434 WeakPolarHBondContact CA-O 3.47Å; T421-R434 PolarHBondContact N-O 3.07Å; T421-R434 PolarHBondContact O-N 2.89Å; R434-I523 HydrophobicContact CG-CD1 3.95Å; R434-I523 HydrophobicContact CG-CG1 4.02Å; R434-I523 HydrophobicContact CG-CG2 4.44Å
435	V	94	Very high	81.5	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	121.1	-168.6	173.5	0	0	0	0	110.4	V420 L437 G483 L485 E521 I522 V524	V420-V435 HydrophobicContact CG1-CG2 4.16Å; V420-V435 HydrophobicContact CG2-CB 4.45Å; V420-V435 HydrophobicContact CG2-CG1 4.17Å; V420-V435 HydrophobicContact CG2-CG2 4.11Å; V435-L437 HydrophobicContact CG1-CD2 3.85Å; V435-L437 HydrophobicContact CG1-CG 4Å; V435-G483 VanDerWaalsContact CG1-CA 3.46Å; V435-L485 HydrophobicContact CB-CD2 4.33Å; V435-L485 HydrophobicContact CG1-CD1 4.18Å; V435-L485 HydrophobicContact CG1-CD2 4.25Å; V435-L485 HydrophobicContact CG1-CG 4.19Å; V435-L485 HydrophobicContact CG2-CD2 3.87Å; V435-E521 CarbonylContact O-C 3.59Å; V435-E521 WeakPolarHBondContact O-CA 3.4Å; V435-I522 PolarHBondContact N-O 3.17Å; V435-I522 PolarHBondContact O-N 3.18Å; V435-V524 HydrophobicContact CG2-CG2 4.49Å
436	I	93.1	Very high	80	Confident	51 Å²	51	85.8 Å²	85.8	26%	0.262	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	109.3	-173.9	-61.1	176.7	0	0	0	109.7	P419 Q519 E521	P419-I436 PolarHBondContact O-N 2.86Å; I436-Q519 HydrophobicContact CG2-CG 3.84Å; I436-E521 HydrophobicContact CG1-CB 4.4Å; I436-E521 HydrophobicContact CG1-CG 4.1Å
437	L	90.2	Very high	78.7	Confident	0 Å²	0	78 Å²	78	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	101.5	-177	-56.6	-177.1	0	0	0	111.5	V435 K439 L451 L453 L478 A479 V482 L485 Q519 V520 I522	V435-L437 HydrophobicContact CG1-CD2 3.85Å; V435-L437 HydrophobicContact CG1-CG 4Å; L437-K439 PolarHBondContact O-N 3.4Å; L437-L451 HydrophobicContact CB-CD2 3.73Å; L437-L451 HydrophobicContact CD1-CB 4.34Å; L437-L451 HydrophobicContact CD1-CD2 4.14Å; L437-L453 HydrophobicContact CD1-CD2 4.03Å; L437-L478 HydrophobicContact CD2-CB 4.49Å; L437-A479 HydrophobicContact CD1-CB 4.18Å; L437-V482 HydrophobicContact CD2-CB 4.23Å; L437-V482 HydrophobicContact CD2-CG1 4.36Å; L437-L485 HydrophobicContact CD1-CD1 4.24Å; L437-Q519 WeakPolarHBondContact O-CA 3.4Å; L437-V520 PolarHBondContact N-O 3.33Å; L437-V520 PolarHBondContact O-N 2.87Å; L437-I522 HydrophobicContact CD1-CD1 3.97Å
438	N	88.3	Confident	77	Confident	58 Å²	58	74.6 Å²	74.6	31%	0.31	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	115.2	174.4	-176.4	-20.5	0	0	0	111.2	R440 T441 L478 P518	N438-R440 VanDerWaalsContact C-N 3.27Å; N438-R440 PolarHBondContact O-N 3.35Å; N438-R440 WeakPolarHBondContact OD1-CB 3.27Å; N438-R440 PolarHBondContact OD1-N 3.15Å; N438-T441 VanDerWaalsContact O-CB 3.24Å; N438-T441 WeakPolarHBondContact O-CB 3.24Å; N438-T441 PolarHBondContact O-N 2.86Å; N438-T441 PolarHBondContact O-OG1 3.41Å; N438-L478 WeakPolarHBondContact O-CD1 3.41Å; N438-P518 PolarHBondContact OD1-O 3.35Å
439	K	86	Confident	75.7	Confident	67 Å²	67	77.5 Å²	77.5	29%	0.291	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.9	-178.8	-60.9	176.3	-169.3	149.4	0	113.6	L437 T441 L451 S514 K515 E517 P518	L437-K439 PolarHBondContact O-N 3.4Å; K439-T441 PolarHBondContact O-N 2.88Å; K439-L451 HydrophobicContact CG-CD2 3.79Å; K439-S514 PolarHBondContact NZ-O 3.34Å; K439-K515 VanDerWaalsContact NZ-C 3.32Å; K439-K515 PolarHBondContact NZ-O 2.73Å; K439-E517 WeakPolarHBondContact CD-O 3.43Å; K439-E517 WeakPolarHBondContact CE-O 3.44Å; K439-E517 PolarHBondContact NZ-O 2.96Å; K439-P518 WeakPolarHBondContact CB-O 3.22Å; K439-P518 PolarHBondContact N-O 2.97Å
440	R	80	Confident	75	Confident	195 Å²	195	79.9 Å²	79.9	74%	0.736	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.9	176.4	-58.4	-178.1	175.6	169	1.1	112.6	N438 T442 P518	N438-R440 VanDerWaalsContact C-N 3.27Å; N438-R440 PolarHBondContact O-N 3.35Å; N438-R440 WeakPolarHBondContact OD1-CB 3.27Å; N438-R440 PolarHBondContact OD1-N 3.15Å; R440-T442 PolarHBondContact O-N 2.84Å; R440-P518 HydrophobicContact CG-CB 4.28Å
441	T	76.5	Confident	74.9	Confident	61 Å²	61	77.9 Å²	77.9	37%	0.374	41%	0.414	S	S	.	.	S	Bend	trans	-61.7	119.9	177.1	-51.6	0	0	0	0	110.7	N438 K439 M443 L478	N438-T441 VanDerWaalsContact O-CB 3.24Å; N438-T441 WeakPolarHBondContact O-CB 3.24Å; N438-T441 PolarHBondContact O-N 2.86Å; N438-T441 PolarHBondContact O-OG1 3.41Å; K439-T441 PolarHBondContact O-N 2.88Å; T441-M443 PolarHBondContact O-N 2.95Å; T441-L478 HydrophobicContact CG2-CD2 3.97Å
442	T	62.9	Low	74.7	Confident	139 Å²	139	77.2 Å²	77.2	85%	0.853	41%	0.413	S	S	*	.			trans	-74.8	87.5	-174.9	54.3	0	0	0	0	112.1	R440	R440-T442 PolarHBondContact O-N 2.84Å
443	M	59.2	Low	74.7	Confident	44 Å²	44	76 Å²	76	22%	0.217	41%	0.407	C	S	.	.			trans	-69.7	158.6	173.6	-66	-58.2	-75.4	0	0	112.4	T441 G476 L478 V481	T441-M443 PolarHBondContact O-N 2.95Å; M443-G476 WeakPolarHBondContact CE-O 3.33Å; M443-L478 HydrophobicContact CG-CD2 3.64Å; M443-L478 HydrophobicContact CG-CG 3.81Å; M443-L478 HydrophobicContact SD-CD2 3.51Å; M443-L478 VanDerWaalsContact SD-CD2 3.51Å; M443-L478 HydrophobicContact SD-CG 4.18Å; M443-V481 HydrophobicContact CE-CB 4.01Å; M443-V481 HydrophobicContact CE-CG1 4.34Å; M443-V481 HydrophobicContact CE-CG2 4.03Å
444	P	57.3	Low	74.7	Confident	90 Å²	90	81.8 Å²	81.8	58%	0.584	43%	0.432	S	S	*	.			trans	-52.5	143.2	171	-26.2	35.7	0	0	0	111.7	E446 S447	P444-E446 PolarHBondContact O-N 3.12Å; P444-S447 WeakPolarHBondContact O-CB 3.45Å; P444-S447 PolarHBondContact O-N 2.87Å
445	K	56.5	Low	74.6	Confident	216 Å²	216	76.4 Å²	76.4	94%	0.939	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-4.5	-165.6	-153.5	169.5	-174	172	0	116
446	E	54.3	Low	74.5	Confident	161 Å²	161	78.5 Å²	78.5	75%	0.752	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-22.9	177.4	-58.4	-179.7	-144.3	0	0	111.5	P444 G448	P444-E446 PolarHBondContact O-N 3.12Å; E446-G448 PolarHBondContact O-N 2.63Å; E446-G448 VanDerWaalsContact O-N 3.16Å
447	S	54.2	Low	74.3	Confident	37 Å²	37	76.2 Å²	76.2	26%	0.259	42%	0.415	S	S	.	.	S	Bend	trans	-86.1	76	174.4	-60.7	0	0	0	0	110.9	P444 G476	P444-S447 WeakPolarHBondContact O-CB 3.45Å; P444-S447 PolarHBondContact O-N 2.87Å; S447-G476 WeakPolarHBondContact CB-O 3.23Å; S447-G476 PolarHBondContact OG-O 3.4Å
448	G	42.4	Very low	74	Confident	55 Å²	55	77.7 Å²	77.7	57%	0.567	43%	0.43	S	S	*	.			trans	-53.4	145.7	-177	0	0	0	0	0	114.6	E446 L450	E446-G448 PolarHBondContact O-N 2.63Å; E446-G448 VanDerWaalsContact O-N 3.16Å; G448-L450 VanDerWaalsContact C-N 3.28Å; G448-L450 PolarHBondContact O-N 3.11Å
449	A	51.1	Low	73.8	Confident	108 Å²	108	80.4 Å²	80.4	89%	0.893	44%	0.439	S	S	*	.	S	Bend	trans	-62.8	60.9	-159.6	0	0	0	0	0	117.6
450	L	69.8	Low	73.7	Confident	126 Å²	126	82.5 Å²	82.5	66%	0.66	45%	0.451	S	S	*	.	S	Bend	trans	-135.5	150.2	171.7	-66.7	169	0	0	0	108.1	G448 G452	G448-L450 VanDerWaalsContact C-N 3.28Å; G448-L450 PolarHBondContact O-N 3.11Å; L450-G452 PolarHBondContact O-N 2.89Å
451	L	85	Confident	73.8	Confident	21 Å²	21	73.8 Å²	73.8	11%	0.11	42%	0.42	C	S	.	.			trans	-49.9	-33.9	178.2	-61.7	178	0	0	0	112.7	L437 K439 L453 S477 L478 A479 W494 V520	L437-L451 HydrophobicContact CB-CD2 3.73Å; L437-L451 HydrophobicContact CD1-CB 4.34Å; L437-L451 HydrophobicContact CD1-CD2 4.14Å; K439-L451 HydrophobicContact CG-CD2 3.79Å; L451-L453 HydrophobicContact CB-CD2 4.27Å; L451-L453 HydrophobicContact CB-CG 4.37Å; L451-L453 HydrophobicContact CD1-CD2 4.49Å; L451-S477 PolarHBondContact O-OG 2.83Å; L451-L478 HydrophobicContact CD2-CD1 4.46Å; L451-L478 PolarHBondContact O-N 3.23Å; L451-A479 VanDerWaalsContact O-CB 3.28Å; L451-A479 WeakPolarHBondContact O-CB 3.48Å; L451-A479 PolarHBondContact O-N 3.33Å; L451-W494 HydrophobicContact CD1-CH2 3.97Å; L451-W494 HydrophobicContact CD1-CZ2 4.15Å; L451-V520 HydrophobicContact CD1-CB 4.23Å; L451-V520 HydrophobicContact CD1-CG1 4.39Å; L451-V520 HydrophobicContact CD1-CG2 4.13Å
452	G	87.5	Confident	73.8	Confident	9 Å²	9	78.5 Å²	78.5	9%	0.093	44%	0.443	C	S	.	.			trans	96	-6.7	170.1	0	0	0	0	0	115.2	L450 K474	L450-G452 PolarHBondContact O-N 2.89Å; G452-K474 WeakPolarHBondContact O-CB 3.45Å; G452-K474 WeakPolarHBondContact O-CG 3.43Å; G452-K474 PolarHBondContact O-N 3.02Å
453	L	91.9	Very high	74.4	Confident	29 Å²	29	78 Å²	78	15%	0.152	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	161.1	168.3	66.6	92.1	0	0	0	112.1	L437 L451 V455 I470 K472 V473 A479 L485 W494 I522	L437-L453 HydrophobicContact CD1-CD2 4.03Å; L451-L453 HydrophobicContact CB-CD2 4.27Å; L451-L453 HydrophobicContact CB-CG 4.37Å; L451-L453 HydrophobicContact CD1-CD2 4.49Å; L453-V455 HydrophobicContact CD1-CG2 3.44Å; L453-V455 VanDerWaalsContact CD1-CG2 3.44Å; L453-I470 HydrophobicContact CB-CG2 4.43Å; L453-K472 CarbonylContact C-O 3.52Å; L453-K472 WeakPolarHBondContact CA-O 3.24Å; L453-V473 HydrophobicContact CB-CG2 4.46Å; L453-A479 HydrophobicContact CB-CB 3.83Å; L453-A479 HydrophobicContact CD2-CB 4.01Å; L453-A479 HydrophobicContact CG-CB 4.37Å; L453-L485 HydrophobicContact CD2-CD1 3.79Å; L453-W494 HydrophobicContact CD1-CH2 3.93Å; L453-W494 HydrophobicContact CD1-CZ3 3.83Å; L453-W494 HydrophobicContact CD2-CH2 4.34Å; L453-W494 HydrophobicContact CD2-CZ3 4.27Å; L453-I522 HydrophobicContact CD2-CD1 3.61Å
454	K	93	Very high	75.4	Confident	121 Å²	121	78.5 Å²	78.5	53%	0.526	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	110	164.9	-172.9	-158.5	169	-162.8	0	110.6	T471 K472	K454-T471 PolarHBondContact O-N 3.48Å; K454-T471 PolarHBondContact O-OG1 2.84Å; K454-K472 HydrophobicContact CB-CB 4.4Å; K454-K472 PolarHBondContact N-O 2.98Å
455	V	93.2	Very high	76.8	Confident	17 Å²	17	78.6 Å²	78.6	10%	0.103	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	154.3	169.7	-162.6	0	0	0	0	110.8	L453 A468 F469 V491 W494 V507 I511	L453-V455 HydrophobicContact CD1-CG2 3.44Å; L453-V455 VanDerWaalsContact CD1-CG2 3.44Å; V455-A468 HydrophobicContact CG1-CB 3.79Å; V455-F469 CarbonylContact C-O 3.58Å; V455-F469 VanDerWaalsContact CA-O 3.29Å; V455-F469 WeakPolarHBondContact CA-O 3.25Å; V455-V491 HydrophobicContact CG1-CG2 4.07Å; V455-V491 HydrophobicContact CG2-CG2 4.32Å; V455-W494 HydrophobicContact CG2-CE3 4.37Å; V455-W494 HydrophobicContact CG2-CZ3 3.8Å; V455-V507 HydrophobicContact CG1-CG1 4.07Å; V455-I511 HydrophobicContact CB-CD1 3.63Å; V455-I511 HydrophobicContact CG1-CD1 4.26Å; V455-I511 HydrophobicContact CG2-CD1 3.7Å
456	V	91.3	Very high	78.4	Confident	44 Å²	44	70.7 Å²	70.7	27%	0.267	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	119.5	162	172.9	0	0	0	0	108.1	A468 F469 T471	V456-A468 WeakPolarHBondContact O-CA 3.49Å; V456-F469 PolarHBondContact N-O 2.98Å; V456-F469 PolarHBondContact O-N 2.89Å; V456-T471 HydrophobicContact CB-CG2 3.8Å; V456-T471 HydrophobicContact CG2-CG2 3.55Å
457	G	89.7	Confident	80.1	Confident	3 Å²	3	63 Å²	63	3%	0.031	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	173.7	173.2	0	0	0	0	0	113.4	K459 N504	G457-K459 PolarHBondContact O-N 2.96Å; G457-N504 PolarHBondContact O-ND2 3.21Å
458	G	84	Confident	82	Confident	31 Å²	31	61.3 Å²	61.3	32%	0.32	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65.4	17.6	175.1	0	0	0	0	0	115.7	G467 A502	G458-G467 PolarHBondContact N-O 2.96Å; G458-A502 PolarHBondContact N-O 2.63Å
459	K	83.8	Confident	84.5	Confident	114 Å²	114	59.9 Å²	59.9	50%	0.496	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.7	171.4	-174.3	-162.1	163	-152.5	0	108.7	G457 T461 L466 G467 F469	G457-K459 PolarHBondContact O-N 2.96Å; K459-T461 PolarHBondContact O-N 3.08Å; K459-L466 CarbonylContact O-C 3.2Å; K459-G467 PolarHBondContact N-O 2.83Å; K459-G467 VanDerWaalsContact N-O 3.16Å; K459-G467 PolarHBondContact O-N 3.46Å; K459-F469 HydrophobicContact CB-CD2 3.84Å; K459-F469 HydrophobicContact CB-CE2 4.02Å; K459-F469 HydrophobicContact CD-CD2 3.66Å; K459-F469 HydrophobicContact CD-CE2 3.78Å; K459-F469 HydrophobicContact CD-CG 4.18Å; K459-F469 HydrophobicContact CD-CZ 4.39Å; K459-F469 HydrophobicContact CG-CD2 4.28Å; K459-F469 HydrophobicContact CG-CE2 4.26Å
460	M	83.3	Confident	86.6	Confident	111 Å²	111	54.9 Å²	54.9	55%	0.547	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	131.1	172.6	-155.1	65.9	78.7	0	0	111	G464 L466	M460-G464 VanDerWaalsContact SD-C 3.54Å; M460-L466 HydrophobicContact CE-CD2 4.17Å; M460-L466 HydrophobicContact SD-CD2 4.16Å
461	T	82.8	Confident	87.7	Confident	12 Å²	12	51.7 Å²	51.7	7%	0.074	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-84.1	165.4	168.8	61.9	0	0	0	0	110.5	K459 L463 G464 R465 F469	K459-T461 PolarHBondContact O-N 3.08Å; T461-L463 PolarHBondContact O-N 2.94Å; T461-L463 VanDerWaalsContact O-N 3.15Å; T461-L463 PolarHBondContact OG1-N 2.97Å; T461-G464 PolarHBondContact O-N 3.36Å; T461-R465 WeakPolarHBondContact CB-O 3.41Å; T461-R465 HydrophobicContact CG2-CG 3.89Å; T461-R465 WeakPolarHBondContact CG2-O 3.47Å; T461-R465 PolarHBondContact N-O 3.32Å; T461-R465 WeakPolarHBondContact OG1-CG 3.48Å; T461-R465 PolarHBondContact OG1-N 2.88Å; T461-R465 PolarHBondContact OG1-O 2.97Å; T461-F469 HydrophobicContact CG2-CE2 4.12Å; T461-F469 HydrophobicContact CG2-CZ 3.95Å
462	D	76.9	Confident	88.1	Confident	161 Å²	161	58 Å²	58	86%	0.861	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.4	174.6	-44	-70.8	0	0	0	112.8	G464	D462-G464 VanDerWaalsContact C-N 3.34Å
463	L	76.4	Confident	88.4	Confident	129 Å²	129	59.1 Å²	59.1	68%	0.675	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	4.9	174.6	-59.2	177.9	0	0	0	113.4	T461 R465	T461-L463 PolarHBondContact O-N 2.94Å; T461-L463 VanDerWaalsContact O-N 3.15Å; T461-L463 PolarHBondContact OG1-N 2.97Å; L463-R465 PolarHBondContact O-N 3.26Å
464	G	79.4	Confident	88.3	Confident	54 Å²	54	63.9 Å²	63.9	56%	0.557	33%	0.332	S	S	*	.	S	Bend	trans	73.1	4.2	179.3	0	0	0	0	0	115.6	M460 T461 D462	M460-G464 VanDerWaalsContact SD-C 3.54Å; T461-G464 PolarHBondContact O-N 3.36Å; D462-G464 VanDerWaalsContact C-N 3.34Å
465	R	87.1	Confident	88	Confident	92 Å²	92	67.2 Å²	67.2	35%	0.347	35%	0.347	S	S	.	.	S	Bend	trans	-87.1	152.3	167.4	67.9	172.1	-170.6	-143.7	1.7	111.1	T461 L463 E490	T461-R465 WeakPolarHBondContact CB-O 3.41Å; T461-R465 HydrophobicContact CG2-CG 3.89Å; T461-R465 WeakPolarHBondContact CG2-O 3.47Å; T461-R465 PolarHBondContact N-O 3.32Å; T461-R465 WeakPolarHBondContact OG1-CG 3.48Å; T461-R465 PolarHBondContact OG1-N 2.88Å; T461-R465 PolarHBondContact OG1-O 2.97Å; L463-R465 PolarHBondContact O-N 3.26Å; R465-E490 IonicContact CZ-OE1 3.13Å; R465-E490 IonicContact NE-OE1 3.22Å; R465-E490 PolarHBondContact NE-OE1 2.81Å; R465-E490 IonicContact NH2-OE1 2.97Å; R465-E490 PolarHBondContact NH2-OE1 3.1Å; R465-E490 IonicContact NH2-OE2 3.22Å
466	L	89.1	Confident	87.5	Confident	50 Å²	50	67.4 Å²	67.4	26%	0.262	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	148	162.5	-59.5	-177.6	0	0	0	110	K459 M460 G501	K459-L466 CarbonylContact O-C 3.2Å; M460-L466 HydrophobicContact CE-CD2 4.17Å; M460-L466 HydrophobicContact SD-CD2 4.16Å; L466-G501 PolarHBondContact O-N 2.81Å
467	G	90.7	Very high	87.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	159	176.3	0	0	0	0	0	112.4	G458 K459	G458-G467 PolarHBondContact N-O 2.96Å; K459-G467 PolarHBondContact N-O 2.83Å; K459-G467 VanDerWaalsContact N-O 3.16Å; K459-G467 PolarHBondContact O-N 3.46Å
468	A	94.6	Very high	87.4	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131	175.3	0	0	0	0	0	110	V455 V456 E490 V491 L499 V507	V455-A468 HydrophobicContact CG1-CB 3.79Å; V456-A468 WeakPolarHBondContact O-CA 3.49Å; A468-E490 CarbonylContact O-C 3.49Å; A468-E490 WeakPolarHBondContact O-CA 3.43Å; A468-V491 HydrophobicContact CB-CB 4.16Å; A468-V491 PolarHBondContact O-N 3.49Å; A468-L499 HydrophobicContact CB-CB 3.71Å; A468-L499 HydrophobicContact CB-CD1 3.61Å; A468-L499 HydrophobicContact CB-CG 4.34Å; A468-V507 HydrophobicContact CB-CG1 4.11Å; A468-V507 HydrophobicContact CB-CG2 4.03Å
469	F	94.6	Very high	87.8	Confident	26 Å²	26	64.6 Å²	64.6	11%	0.114	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.6	-175.1	-69.9	-95.7	0	0	0	112.3	V455 V456 K459 T461 T471 D489 E490	V455-F469 CarbonylContact C-O 3.58Å; V455-F469 VanDerWaalsContact CA-O 3.29Å; V455-F469 WeakPolarHBondContact CA-O 3.25Å; V456-F469 PolarHBondContact N-O 2.98Å; V456-F469 PolarHBondContact O-N 2.89Å; K459-F469 HydrophobicContact CB-CD2 3.84Å; K459-F469 HydrophobicContact CB-CE2 4.02Å; K459-F469 HydrophobicContact CD-CD2 3.66Å; K459-F469 HydrophobicContact CD-CE2 3.78Å; K459-F469 HydrophobicContact CD-CG 4.18Å; K459-F469 HydrophobicContact CD-CZ 4.39Å; K459-F469 HydrophobicContact CG-CD2 4.28Å; K459-F469 HydrophobicContact CG-CE2 4.26Å; T461-F469 HydrophobicContact CG2-CE2 4.12Å; T461-F469 HydrophobicContact CG2-CZ 3.95Å; F469-T471 PolarHBondContact O-N 3.32Å; F469-D489 WeakPolarHBondContact CA-O 3.49Å; F469-E490 HydrophobicContact CD1-CB 4.09Å; F469-E490 HydrophobicContact CD1-CG 4.5Å; F469-E490 HydrophobicContact CE1-CB 3.82Å; F469-E490 HydrophobicContact CE1-CG 4.05Å; F469-E490 HydrophobicContact CZ-CB 4.39Å; F469-E490 HydrophobicContact CZ-CG 4.11Å
470	I	94.6	Very high	88.1	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	110.1	170	-56.8	-171.5	0	0	0	108.3	L453 V473 L485 R486 A487 G488 D489 V491 V524	L453-I470 HydrophobicContact CB-CG2 4.43Å; I470-V473 HydrophobicContact CG2-CG2 3.49Å; I470-V473 VanDerWaalsContact CG2-CG2 3.49Å; I470-L485 HydrophobicContact CD1-CB 3.93Å; I470-L485 HydrophobicContact CD1-CD1 3.9Å; I470-L485 HydrophobicContact CD1-CD2 3.99Å; I470-L485 HydrophobicContact CD1-CG 4.16Å; I470-R486 WeakPolarHBondContact CB-O 3.39Å; I470-R486 WeakPolarHBondContact CG2-O 3.49Å; I470-A487 CarbonylContact O-C 3.5Å; I470-A487 VanDerWaalsContact O-CA 3.31Å; I470-A487 WeakPolarHBondContact O-CA 3.05Å; I470-G488 PolarHBondContact O-N 3.1Å; I470-D489 HydrophobicContact CB-CB 4.3Å; I470-D489 HydrophobicContact CD1-CB 4.03Å; I470-D489 HydrophobicContact CG1-CB 4.19Å; I470-D489 PolarHBondContact N-O 2.88Å; I470-V491 HydrophobicContact CD1-CG2 4.25Å; I470-V491 HydrophobicContact CG1-CG2 3.69Å; I470-V524 HydrophobicContact CD1-CG1 4.14Å
471	T	93.2	Very high	88.2	Confident	60 Å²	60	60.1 Å²	60.1	37%	0.368	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-24.1	-176.9	58.7	0	0	0	0	113.7	K454 V456 F469	K454-T471 PolarHBondContact O-N 3.48Å; K454-T471 PolarHBondContact O-OG1 2.84Å; V456-T471 HydrophobicContact CB-CG2 3.8Å; V456-T471 HydrophobicContact CG2-CG2 3.55Å; F469-T471 PolarHBondContact O-N 3.32Å
472	K	93	Very high	88.4	Confident	152 Å²	152	61.4 Å²	61.4	66%	0.661	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.6	145.9	174.7	-64.4	-165.2	177.2	-165.4	0	110.3	L453 K454	L453-K472 CarbonylContact C-O 3.52Å; L453-K472 WeakPolarHBondContact CA-O 3.24Å; K454-K472 HydrophobicContact CB-CB 4.4Å; K454-K472 PolarHBondContact N-O 2.98Å
473	V	93.4	Very high	88.9	Confident	34 Å²	34	53.7 Å²	53.7	21%	0.206	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134	166.1	-178.5	0	0	0	0	108	L453 I470 A479 D480 L485	L453-V473 HydrophobicContact CB-CG2 4.46Å; I470-V473 HydrophobicContact CG2-CG2 3.49Å; I470-V473 VanDerWaalsContact CG2-CG2 3.49Å; V473-A479 HydrophobicContact CG1-CB 3.92Å; V473-D480 HydrophobicContact CG1-CB 3.87Å; V473-L485 HydrophobicContact CG2-CB 4.29Å
474	K	89.9	Confident	89.6	Confident	128 Å²	128	52.9 Å²	52.9	56%	0.557	27%	0.273	S	S	*	.			trans	-80.3	119.6	176	-74.7	-177.9	-179.5	-179.4	0	109.9	G452 G476 S477 D480	G452-K474 WeakPolarHBondContact O-CB 3.45Å; G452-K474 WeakPolarHBondContact O-CG 3.43Å; G452-K474 PolarHBondContact O-N 3.02Å; K474-G476 PolarHBondContact O-N 2.8Å; K474-S477 VanDerWaalsContact O-CB 3.23Å; K474-S477 WeakPolarHBondContact O-CB 3.17Å; K474-S477 PolarHBondContact O-N 2.91Å; K474-S477 PolarHBondContact O-OG 2.92Å; K474-D480 WeakPolarHBondContact O-CB 3.46Å
475	K	87.2	Confident	90.3	Very high	192 Å²	192	50.5 Å²	50.5	84%	0.835	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	130.1	171.8	-164.1	163.8	-171.9	163.5	0	110.6	D480	K475-D480 WeakPolarHBondContact CA-OD2 3.45Å
476	G	83.3	Confident	90.5	Very high	20 Å²	20	51.6 Å²	51.6	21%	0.206	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	4.4	-175.2	0	0	0	0	0	116.1	M443 S447 K474 D480	M443-G476 WeakPolarHBondContact CE-O 3.33Å; S447-G476 WeakPolarHBondContact CB-O 3.23Å; S447-G476 PolarHBondContact OG-O 3.4Å; K474-G476 PolarHBondContact O-N 2.8Å; G476-D480 PolarHBondContact N-OD2 2.96Å
477	S	88.6	Confident	90.6	Very high	8 Å²	8	52.3 Å²	52.3	6%	0.056	27%	0.265	C	S	.	.	S	Bend	trans	-89.4	173.6	176.9	69.3	0	0	0	0	113.4	L451 K474 A479 D480 V481	L451-S477 PolarHBondContact O-OG 2.83Å; K474-S477 VanDerWaalsContact O-CB 3.23Å; K474-S477 WeakPolarHBondContact O-CB 3.17Å; K474-S477 PolarHBondContact O-N 2.91Å; K474-S477 PolarHBondContact O-OG 2.92Å; S477-A479 VanDerWaalsContact C-N 3.32Å; S477-A479 PolarHBondContact O-N 2.91Å; S477-D480 PolarHBondContact O-N 2.97Å; S477-V481 WeakPolarHBondContact O-CB 3.3Å; S477-V481 WeakPolarHBondContact O-CG2 3.42Å; S477-V481 PolarHBondContact O-N 2.9Å
478	L	89	Confident	90.7	Very high	11 Å²	11	55 Å²	55	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-42	177.3	-72	168.6	0	0	0	112.1	L437 N438 T441 M443 L451 D480 V482 G483	L437-L478 HydrophobicContact CD2-CB 4.49Å; N438-L478 WeakPolarHBondContact O-CD1 3.41Å; T441-L478 HydrophobicContact CG2-CD2 3.97Å; M443-L478 HydrophobicContact CG-CD2 3.64Å; M443-L478 HydrophobicContact CG-CG 3.81Å; M443-L478 HydrophobicContact SD-CD2 3.51Å; M443-L478 VanDerWaalsContact SD-CD2 3.51Å; M443-L478 HydrophobicContact SD-CG 4.18Å; L451-L478 HydrophobicContact CD2-CD1 4.46Å; L451-L478 PolarHBondContact O-N 3.23Å; L478-D480 VanDerWaalsContact C-N 3.27Å; L478-D480 PolarHBondContact O-N 2.93Å; L478-V482 HydrophobicContact CD2-CG2 3.95Å; L478-V482 WeakPolarHBondContact O-CA 3.41Å; L478-V482 WeakPolarHBondContact O-CB 3.31Å; L478-V482 PolarHBondContact O-N 3.45Å; L478-G483 PolarHBondContact O-N 2.94Å
479	A	92	Very high	90.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-32.3	177.7	0	0	0	0	0	113.7	L437 L451 L453 V473 S477 G483 H484 L485	L437-A479 HydrophobicContact CD1-CB 4.18Å; L451-A479 VanDerWaalsContact O-CB 3.28Å; L451-A479 WeakPolarHBondContact O-CB 3.48Å; L451-A479 PolarHBondContact O-N 3.33Å; L453-A479 HydrophobicContact CB-CB 3.83Å; L453-A479 HydrophobicContact CD2-CB 4.01Å; L453-A479 HydrophobicContact CG-CB 4.37Å; V473-A479 HydrophobicContact CG1-CB 3.92Å; S477-A479 VanDerWaalsContact C-N 3.32Å; S477-A479 PolarHBondContact O-N 2.91Å; A479-G483 CarbonylContact O-C 3.13Å; A479-G483 WeakPolarHBondContact O-CA 3.14Å; A479-H484 PolarHBondContact O-N 2.74Å; A479-H484 VanDerWaalsContact O-N 3.1Å; A479-L485 HydrophobicContact CB-CD1 4.09Å; A479-L485 WeakPolarHBondContact O-CB 3.46Å; A479-L485 PolarHBondContact O-N 2.95Å
480	D	90.8	Very high	90.6	Very high	56 Å²	56	54.2 Å²	54.2	30%	0.299	29%	0.289	S	S	.	.	H	α-helix	trans	-81.6	-56	178.7	-176.8	58.5	0	0	0	111.1	V473 K474 K475 G476 S477 L478 H484	V473-D480 HydrophobicContact CG1-CB 3.87Å; K474-D480 WeakPolarHBondContact O-CB 3.46Å; K475-D480 WeakPolarHBondContact CA-OD2 3.45Å; G476-D480 PolarHBondContact N-OD2 2.96Å; S477-D480 PolarHBondContact O-N 2.97Å; L478-D480 VanDerWaalsContact C-N 3.27Å; L478-D480 PolarHBondContact O-N 2.93Å; D480-H484 PolarHBondContact O-N 2.87Å; D480-H484 PolarHBondContact O-ND1 3.5Å; D480-H484 VanDerWaalsContact O-ND1 3.1Å
481	V	86.3	Confident	90.7	Very high	76 Å²	76	54.1 Å²	54.1	46%	0.461	29%	0.289	S	S	.	.	H	α-helix	trans	-81.3	-37.3	-168.6	179.6	0	0	0	0	112.9	M443 S477 H484	M443-V481 HydrophobicContact CE-CB 4.01Å; M443-V481 HydrophobicContact CE-CG1 4.34Å; M443-V481 HydrophobicContact CE-CG2 4.03Å; S477-V481 WeakPolarHBondContact O-CB 3.3Å; S477-V481 WeakPolarHBondContact O-CG2 3.42Å; S477-V481 PolarHBondContact O-N 2.9Å; V481-H484 PolarHBondContact O-CE1 3.38Å
482	V	86.9	Confident	90.7	Very high	38 Å²	38	52.8 Å²	52.8	23%	0.23	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-45.5	177.9	-177.1	0	0	0	0	110.5	P419 V420 L437 L478	P419-V482 HydrophobicContact CB-CG1 4.09Å; P419-V482 HydrophobicContact CG-CG1 4.09Å; V420-V482 WeakPolarHBondContact CG2-O 3.31Å; L437-V482 HydrophobicContact CD2-CB 4.23Å; L437-V482 HydrophobicContact CD2-CG1 4.36Å; L478-V482 HydrophobicContact CD2-CG2 3.95Å; L478-V482 WeakPolarHBondContact O-CA 3.41Å; L478-V482 WeakPolarHBondContact O-CB 3.31Å; L478-V482 PolarHBondContact O-N 3.45Å
483	G	87	Confident	90.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-20.9	-171.8	0	0	0	0	0	116.5	V435 L478 A479 L485	V435-G483 VanDerWaalsContact CG1-CA 3.46Å; L478-G483 PolarHBondContact O-N 2.94Å; A479-G483 CarbonylContact O-C 3.13Å; A479-G483 WeakPolarHBondContact O-CA 3.14Å; G483-L485 PolarHBondContact O-N 2.85Å; G483-L485 VanDerWaalsContact O-N 3.08Å
484	H	90.5	Very high	90.9	Very high	111 Å²	111	47.7 Å²	47.7	51%	0.514	26%	0.255	S	S	.	.			trans	49.3	33	-172.4	-53.6	-30.5	0	0	0	113.5	A479 D480 V481 R526	A479-H484 PolarHBondContact O-N 2.74Å; A479-H484 VanDerWaalsContact O-N 3.1Å; D480-H484 PolarHBondContact O-N 2.87Å; D480-H484 PolarHBondContact O-ND1 3.5Å; D480-H484 VanDerWaalsContact O-ND1 3.1Å; V481-H484 PolarHBondContact O-CE1 3.38Å; H484-R526 PolarHBondContact O-NH2 2.86Å
485	L	93.7	Very high	91.1	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	24%	0.24	C	C	.	.			trans	-75.2	140	177.2	-64.2	176.7	0	0	0	109.5	V435 L437 L453 I470 V473 A479 G483 D489 I522 V524	V435-L485 HydrophobicContact CB-CD2 4.33Å; V435-L485 HydrophobicContact CG1-CD1 4.18Å; V435-L485 HydrophobicContact CG1-CD2 4.25Å; V435-L485 HydrophobicContact CG1-CG 4.19Å; V435-L485 HydrophobicContact CG2-CD2 3.87Å; L437-L485 HydrophobicContact CD1-CD1 4.24Å; L453-L485 HydrophobicContact CD2-CD1 3.79Å; I470-L485 HydrophobicContact CD1-CB 3.93Å; I470-L485 HydrophobicContact CD1-CD1 3.9Å; I470-L485 HydrophobicContact CD1-CD2 3.99Å; I470-L485 HydrophobicContact CD1-CG 4.16Å; V473-L485 HydrophobicContact CG2-CB 4.29Å; A479-L485 HydrophobicContact CB-CD1 4.09Å; A479-L485 WeakPolarHBondContact O-CB 3.46Å; A479-L485 PolarHBondContact O-N 2.95Å; G483-L485 PolarHBondContact O-N 2.85Å; G483-L485 VanDerWaalsContact O-N 3.08Å; L485-D489 WeakPolarHBondContact CA-OD2 3.44Å; L485-I522 HydrophobicContact CD1-CD1 4.24Å; L485-V524 HydrophobicContact CD2-CB 4.45Å; L485-V524 HydrophobicContact CD2-CG1 3.85Å; L485-V524 HydrophobicContact CD2-CG2 3.79Å
486	R	92	Very high	91.3	Very high	115 Å²	115	37 Å²	37	43%	0.434	23%	0.226	S	C	.	.			trans	-115.4	156	-178.6	-66.9	-179.2	179.7	-175	1.8	109.8	I470 G488 D489 D530	I470-R486 WeakPolarHBondContact CB-O 3.39Å; I470-R486 WeakPolarHBondContact CG2-O 3.49Å; R486-G488 PolarHBondContact O-N 2.74Å; R486-D489 PolarHBondContact N-OD2 2.79Å; R486-D530 PolarHBondContact NH1-O 3.21Å
487	A	92	Very high	91.7	Very high	65 Å²	65	40.4 Å²	40.4	54%	0.537	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	128.8	164.8	0	0	0	0	0	108.2	I470	I470-A487 CarbonylContact O-C 3.5Å; I470-A487 VanDerWaalsContact O-CA 3.31Å; I470-A487 WeakPolarHBondContact O-CA 3.05Å
488	G	91.3	Very high	91.9	Very high	55 Å²	55	44.5 Å²	44.5	57%	0.567	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.6	-28	-171.5	0	0	0	0	0	113.9	I470 R486 E490	I470-G488 PolarHBondContact O-N 3.1Å; R486-G488 PolarHBondContact O-N 2.74Å; G488-E490 PolarHBondContact O-N 2.97Å
489	D	94.4	Very high	92.1	Very high	3 Å²	3	44 Å²	44	2%	0.016	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-55.5	128.1	178.3	-69.4	-17.8	0	0	0	111.4	F469 I470 L485 R486 V524 R526	F469-D489 WeakPolarHBondContact CA-O 3.49Å; I470-D489 HydrophobicContact CB-CB 4.3Å; I470-D489 HydrophobicContact CD1-CB 4.03Å; I470-D489 HydrophobicContact CG1-CB 4.19Å; I470-D489 PolarHBondContact N-O 2.88Å; L485-D489 WeakPolarHBondContact CA-OD2 3.44Å; R486-D489 PolarHBondContact N-OD2 2.79Å; D489-V524 HydrophobicContact CB-CB 4.21Å; D489-V524 HydrophobicContact CB-CG1 4.35Å; D489-R526 VanDerWaalsContact CG-NH2 3.31Å; D489-R526 IonicContact OD1-CZ 3.16Å; D489-R526 IonicContact OD1-NE 3.35Å; D489-R526 PolarHBondContact OD1-NE 3.48Å; D489-R526 IonicContact OD1-NH2 2.73Å; D489-R526 PolarHBondContact OD1-NH2 2.64Å; D489-R526 IonicContact OD2-CZ 2.63Å; D489-R526 IonicContact OD2-NE 3.65Å; D489-R526 IonicContact OD2-NH2 2.73Å; D489-R526 PolarHBondContact OD2-NH2 3.12Å
490	E	94.4	Very high	92.1	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.037	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	116.1	172.2	-175.4	-178.8	175.1	0	0	108.6	R430 R465 A468 F469 G488 L492 V524 S525	R430-E490 IonicContact NH1-OE2 2.75Å; R430-E490 PolarHBondContact NH1-OE2 3.35Å; R465-E490 IonicContact CZ-OE1 3.13Å; R465-E490 IonicContact NE-OE1 3.22Å; R465-E490 PolarHBondContact NE-OE1 2.81Å; R465-E490 IonicContact NH2-OE1 2.97Å; R465-E490 PolarHBondContact NH2-OE1 3.1Å; R465-E490 IonicContact NH2-OE2 3.22Å; A468-E490 CarbonylContact O-C 3.49Å; A468-E490 WeakPolarHBondContact O-CA 3.43Å; F469-E490 HydrophobicContact CD1-CB 4.09Å; F469-E490 HydrophobicContact CD1-CG 4.5Å; F469-E490 HydrophobicContact CE1-CB 3.82Å; F469-E490 HydrophobicContact CE1-CG 4.05Å; F469-E490 HydrophobicContact CZ-CB 4.39Å; F469-E490 HydrophobicContact CZ-CG 4.11Å; G488-E490 PolarHBondContact O-N 2.97Å; E490-L492 HydrophobicContact CG-CD2 4.35Å; E490-L492 PolarHBondContact O-N 2.69Å; E490-V524 CarbonylContact O-C 3.49Å; E490-V524 VanDerWaalsContact O-CA 3.26Å; E490-V524 WeakPolarHBondContact O-CA 3.32Å; E490-S525 PolarHBondContact N-O 3.14Å; E490-S525 PolarHBondContact O-N 3.04Å
491	V	95.5	Very high	92	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	116.7	176.4	-172.1	0	0	0	0	108.8	V455 A468 I470 E493 L499 I522 V524	V455-V491 HydrophobicContact CG1-CG2 4.07Å; V455-V491 HydrophobicContact CG2-CG2 4.32Å; A468-V491 HydrophobicContact CB-CB 4.16Å; A468-V491 PolarHBondContact O-N 3.49Å; I470-V491 HydrophobicContact CD1-CG2 4.25Å; I470-V491 HydrophobicContact CG1-CG2 3.69Å; V491-E493 WeakPolarHBondContact CG1-O 3.47Å; V491-L499 HydrophobicContact CB-CD1 4.04Å; V491-L499 HydrophobicContact CG1-CD1 3.61Å; V491-L499 HydrophobicContact CG1-CG 4.39Å; V491-I522 HydrophobicContact CG1-CG2 3.67Å; V491-V524 HydrophobicContact CG2-CG1 4.16Å
492	L	94.1	Very high	92.1	Very high	32 Å²	32	42.4 Å²	42.4	17%	0.168	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-42.1	177.3	-59.7	-175.6	0	0	0	111.5	I432 E490 P498 L499 P500 I523	I432-L492 HydrophobicContact CG2-CD1 4.49Å; E490-L492 HydrophobicContact CG-CD2 4.35Å; E490-L492 PolarHBondContact O-N 2.69Å; L492-P498 WeakPolarHBondContact O-CA 3.4Å; L492-L499 PolarHBondContact O-N 3.09Å; L492-P500 HydrophobicContact CD2-CG 3.92Å; L492-P500 WeakPolarHBondContact O-CD 3.4Å; L492-I523 HydrophobicContact CB-CB 4.49Å; L492-I523 HydrophobicContact CB-CG2 4.32Å; L492-I523 HydrophobicContact CD1-CG2 4.44Å; L492-I523 PolarHBondContact N-O 2.79Å
493	E	95.4	Very high	92.3	Very high	74 Å²	74	43 Å²	43	35%	0.346	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	151.3	179.7	-61.5	172.8	-146	0	0	111.4	V491 K497 I522 I523	V491-E493 WeakPolarHBondContact CG1-O 3.47Å; E493-K497 CarbonylContact C-O 3.52Å; E493-K497 WeakPolarHBondContact CA-O 3.48Å; E493-I522 WeakPolarHBondContact O-CA 3.5Å; E493-I523 HydrophobicContact CB-CB 3.97Å; E493-I523 HydrophobicContact CB-CD1 4.37Å; E493-I523 HydrophobicContact CB-CG1 4.06Å; E493-I523 HydrophobicContact CG-CB 4.46Å; E493-I523 HydrophobicContact CG-CD1 4.45Å; E493-I523 PolarHBondContact N-O 2.8Å; E493-I523 VanDerWaalsContact N-O 3.14Å; E493-I523 PolarHBondContact O-N 2.99Å; E493-I523 WeakPolarHBondContact OE2-CD1 3.41Å
494	W	95	Very high	92.6	Very high	5 Å²	5	46.9 Å²	46.9	2%	0.019	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	112.9	175.2	-175.8	-72.2	0	0	0	108.8	L451 L453 V455 G496 K497 L499 I510 I511 S514 V520 I522	L451-W494 HydrophobicContact CD1-CH2 3.97Å; L451-W494 HydrophobicContact CD1-CZ2 4.15Å; L453-W494 HydrophobicContact CD1-CH2 3.93Å; L453-W494 HydrophobicContact CD1-CZ3 3.83Å; L453-W494 HydrophobicContact CD2-CH2 4.34Å; L453-W494 HydrophobicContact CD2-CZ3 4.27Å; V455-W494 HydrophobicContact CG2-CE3 4.37Å; V455-W494 HydrophobicContact CG2-CZ3 3.8Å; W494-G496 VanDerWaalsContact C-N 3.26Å; W494-G496 PolarHBondContact O-N 2.64Å; W494-K497 PolarHBondContact N-O 3.48Å; W494-K497 WeakPolarHBondContact O-CB 3.4Å; W494-K497 PolarHBondContact O-N 2.86Å; W494-L499 HydrophobicContact CB-CD1 4.05Å; W494-L499 HydrophobicContact CB-CD2 4.35Å; W494-L499 HydrophobicContact CB-CG 4.3Å; W494-I510 HydrophobicContact CB-CG2 4.02Å; W494-I510 HydrophobicContact CG-CG2 4.01Å; W494-I511 HydrophobicContact CD2-CG1 3.99Å; W494-I511 HydrophobicContact CE3-CG1 4.22Å; W494-I511 HydrophobicContact CH2-CG1 4.2Å; W494-I511 HydrophobicContact CH2-CG2 4.4Å; W494-I511 HydrophobicContact CZ2-CB 4.37Å; W494-I511 HydrophobicContact CZ2-CG1 3.94Å; W494-I511 HydrophobicContact CZ2-CG2 4.06Å; W494-I511 HydrophobicContact CZ3-CD1 4.48Å; W494-I511 HydrophobicContact CZ3-CG1 4.33Å; W494-S514 VanDerWaalsContact NE1-CB 3.27Å; W494-S514 PolarHBondContact NE1-OG 2.86Å; W494-V520 HydrophobicContact CD2-CG1 4.15Å; W494-V520 HydrophobicContact CH2-CG1 4.31Å; W494-V520 HydrophobicContact CZ2-CG1 3.7Å; W494-I522 HydrophobicContact CD2-CG1 4.41Å; W494-I522 HydrophobicContact CE3-CD1 3.95Å; W494-I522 HydrophobicContact CE3-CG1 3.93Å; W494-I522 HydrophobicContact CE3-CG2 4.13Å; W494-I522 HydrophobicContact CH2-CD1 4.03Å; W494-I522 HydrophobicContact CZ3-CD1 3.55Å; W494-I522 HydrophobicContact CZ3-CG1 4.07Å
495	N	93	Very high	92.7	Very high	43 Å²	43	47.5 Å²	47.5	23%	0.23	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	46.5	-170.6	-66.7	-5.5	0	0	0	112.6	K497 S514 E517 V520 E521	N495-K497 PolarHBondContact O-N 3.25Å; N495-K497 VanDerWaalsContact O-N 3.16Å; N495-S514 WeakPolarHBondContact ND2-CB 3.32Å; N495-E517 PolarHBondContact ND2-OE1 2.97Å; N495-E517 PolarHBondContact ND2-OE2 3.12Å; N495-V520 VanDerWaalsContact OD1-CA 3.25Å; N495-V520 WeakPolarHBondContact OD1-CA 3.48Å; N495-V520 WeakPolarHBondContact OD1-CG1 3.17Å; N495-E521 PolarHBondContact N-O 3.31Å; N495-E521 PolarHBondContact OD1-N 3.24Å; N495-E521 PolarHBondContact OD1-O 3.29Å
496	G	91.4	Very high	92.6	Very high	53 Å²	53	51.9 Å²	51.9	55%	0.546	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	-2.5	-177.3	0	0	0	0	0	115.5	W494	W494-G496 VanDerWaalsContact C-N 3.26Å; W494-G496 PolarHBondContact O-N 2.64Å
497	K	93.5	Very high	92.7	Very high	90 Å²	90	46.6 Å²	46.6	39%	0.391	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	120.4	173.4	-59.8	-168.8	176.1	-170.2	0	109.7	E493 W494 N495 I510 E513	E493-K497 CarbonylContact C-O 3.52Å; E493-K497 WeakPolarHBondContact CA-O 3.48Å; W494-K497 PolarHBondContact N-O 3.48Å; W494-K497 WeakPolarHBondContact O-CB 3.4Å; W494-K497 PolarHBondContact O-N 2.86Å; N495-K497 PolarHBondContact O-N 3.25Å; N495-K497 VanDerWaalsContact O-N 3.16Å; K497-I510 HydrophobicContact CB-CD1 4.09Å; K497-I510 HydrophobicContact CB-CG1 4.43Å; K497-I510 HydrophobicContact CB-CG2 4.09Å; K497-I510 HydrophobicContact CD-CD1 4.31Å; K497-I510 HydrophobicContact CD-CG1 3.85Å; K497-I510 HydrophobicContact CD-CG2 4.09Å; K497-E513 IonicContact NZ-OE2 2.82Å; K497-E513 PolarHBondContact NZ-OE2 2.9Å
498	P	92.7	Very high	92.7	Very high	94 Å²	94	50.2 Å²	50.2	61%	0.61	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	139.4	179.2	28.8	-34.5	0	0	0	111.2	L492	L492-P498 WeakPolarHBondContact O-CA 3.4Å
499	L	93	Very high	92.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.284	C	S	.	.			trans	-107.5	-19.5	178.4	-53.2	-167.2	0	0	0	115.9	A468 V491 L492 W494 G501 A502 V507 I510	A468-L499 HydrophobicContact CB-CB 3.71Å; A468-L499 HydrophobicContact CB-CD1 3.61Å; A468-L499 HydrophobicContact CB-CG 4.34Å; V491-L499 HydrophobicContact CB-CD1 4.04Å; V491-L499 HydrophobicContact CG1-CD1 3.61Å; V491-L499 HydrophobicContact CG1-CG 4.39Å; L492-L499 PolarHBondContact O-N 3.09Å; W494-L499 HydrophobicContact CB-CD1 4.05Å; W494-L499 HydrophobicContact CB-CD2 4.35Å; W494-L499 HydrophobicContact CB-CG 4.3Å; L499-G501 PolarHBondContact O-N 3.05Å; L499-A502 VanDerWaalsContact O-CB 3.26Å; L499-A502 WeakPolarHBondContact O-CB 3.25Å; L499-A502 PolarHBondContact O-N 3.48Å; L499-V507 HydrophobicContact CB-CG2 4.37Å; L499-V507 HydrophobicContact CD1-CG1 4.26Å; L499-V507 HydrophobicContact CD1-CG2 4.41Å; L499-V507 HydrophobicContact CD2-CG2 4.28Å; L499-I510 HydrophobicContact CD2-CB 4.43Å; L499-I510 HydrophobicContact CD2-CD1 3.53Å; L499-I510 HydrophobicContact CD2-CG2 4.12Å
500	P	90.8	Very high	92.7	Very high	45 Å²	45	52.2 Å²	52.2	29%	0.292	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	128.8	167.4	-29.3	37	0	0	0	111.5	L492 A502	L492-P500 HydrophobicContact CD2-CG 3.92Å; L492-P500 WeakPolarHBondContact O-CD 3.4Å; P500-A502 VanDerWaalsContact C-N 3.33Å
501	G	88.9	Confident	92.5	Very high	45 Å²	45	54 Å²	54	46%	0.464	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-21.8	-171.5	0	0	0	0	0	114.6	L466 L499	L466-G501 PolarHBondContact O-N 2.81Å; L499-G501 PolarHBondContact O-N 3.05Å
502	A	89.7	Confident	92.3	Very high	10 Å²	10	57.4 Å²	57.4	8%	0.083	32%	0.316	C	S	.	.			trans	-72.7	140.8	-174.2	0	0	0	0	0	113.6	G458 L499 P500 E506 V507	G458-A502 PolarHBondContact N-O 2.63Å; L499-A502 VanDerWaalsContact O-CB 3.26Å; L499-A502 WeakPolarHBondContact O-CB 3.25Å; L499-A502 PolarHBondContact O-N 3.48Å; P500-A502 VanDerWaalsContact C-N 3.33Å; A502-E506 HydrophobicContact CB-CB 4.1Å; A502-V507 HydrophobicContact CB-CG2 3.72Å
503	T	90.6	Very high	92.1	Very high	51 Å²	51	60.8 Å²	60.8	31%	0.313	33%	0.331	S	S	.	.			trans	-66	174.6	174.2	59.1	0	0	0	0	112.6	E505 E506 V507	T503-E505 VanDerWaalsContact C-N 3.31Å; T503-E506 VanDerWaalsContact CB-OE2 3.29Å; T503-E506 WeakPolarHBondContact CB-OE2 3.33Å; T503-E506 VanDerWaalsContact CG2-OE2 3.31Å; T503-E506 WeakPolarHBondContact CG2-OE2 3.34Å; T503-E506 PolarHBondContact N-OE2 2.81Å; T503-E506 WeakPolarHBondContact OG1-CB 3.5Å; T503-E506 VanDerWaalsContact OG1-CD 3.26Å; T503-E506 VanDerWaalsContact OG1-CG 3.24Å; T503-E506 WeakPolarHBondContact OG1-CG 3.29Å; T503-E506 PolarHBondContact OG1-N 3.42Å; T503-E506 VanDerWaalsContact OG1-N 3.12Å; T503-E506 PolarHBondContact OG1-OE2 2.93Å; T503-V507 VanDerWaalsContact O-CG2 3.3Å; T503-V507 WeakPolarHBondContact O-CG2 3.43Å; T503-V507 PolarHBondContact O-N 2.9Å
504	N	92.1	Very high	91.8	Very high	80 Å²	80	57.5 Å²	57.5	43%	0.428	32%	0.316	S	S	.	.	H	α-helix	trans	-68.7	-36.5	176.2	-162.3	-104.3	0	0	0	111.1	G457 Y508	G457-N504 PolarHBondContact O-ND2 3.21Å; N504-Y508 VanDerWaalsContact O-CB 3.3Å; N504-Y508 WeakPolarHBondContact O-CB 3.34Å; N504-Y508 PolarHBondContact O-N 2.92Å
505	E	92.7	Very high	91.4	Very high	125 Å²	125	63.4 Å²	63.4	58%	0.584	34%	0.342	S	S	*	.	H	α-helix	trans	-64.6	-49.9	176.9	-66.8	74.3	-170.3	0	0	111.6	T503 Y508 N509	T503-E505 VanDerWaalsContact C-N 3.31Å; E505-Y508 WeakPolarHBondContact O-CB 3.29Å; E505-Y508 PolarHBondContact O-N 3Å; E505-N509 WeakPolarHBondContact O-CB 3.37Å; E505-N509 PolarHBondContact O-N 2.91Å; E505-N509 PolarHBondContact O-ND2 3.46Å
506	E	92.9	Very high	91	Very high	97 Å²	97	66.5 Å²	66.5	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-45.4	178.6	-72.3	161	133.4	0	0	111.8	A502 T503 Y508 N509 I510	A502-E506 HydrophobicContact CB-CB 4.1Å; T503-E506 VanDerWaalsContact CB-OE2 3.29Å; T503-E506 WeakPolarHBondContact CB-OE2 3.33Å; T503-E506 VanDerWaalsContact CG2-OE2 3.31Å; T503-E506 WeakPolarHBondContact CG2-OE2 3.34Å; T503-E506 PolarHBondContact N-OE2 2.81Å; T503-E506 WeakPolarHBondContact OG1-CB 3.5Å; T503-E506 VanDerWaalsContact OG1-CD 3.26Å; T503-E506 VanDerWaalsContact OG1-CG 3.24Å; T503-E506 WeakPolarHBondContact OG1-CG 3.29Å; T503-E506 PolarHBondContact OG1-N 3.42Å; T503-E506 VanDerWaalsContact OG1-N 3.12Å; T503-E506 PolarHBondContact OG1-OE2 2.93Å; E506-Y508 VanDerWaalsContact C-N 3.27Å; E506-Y508 PolarHBondContact O-N 2.82Å; E506-N509 PolarHBondContact O-N 3.24Å; E506-I510 VanDerWaalsContact O-CG1 3.29Å; E506-I510 WeakPolarHBondContact O-CG1 3.44Å; E506-I510 PolarHBondContact O-N 2.84Å
507	V	93.8	Very high	90.7	Very high	3 Å²	3	67.7 Å²	67.7	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-35.6	175.4	173.5	0	0	0	0	111.3	V455 A468 L499 A502 T503 I511	V455-V507 HydrophobicContact CG1-CG1 4.07Å; A468-V507 HydrophobicContact CB-CG1 4.11Å; A468-V507 HydrophobicContact CB-CG2 4.03Å; L499-V507 HydrophobicContact CB-CG2 4.37Å; L499-V507 HydrophobicContact CD1-CG1 4.26Å; L499-V507 HydrophobicContact CD1-CG2 4.41Å; L499-V507 HydrophobicContact CD2-CG2 4.28Å; A502-V507 HydrophobicContact CB-CG2 3.72Å; T503-V507 VanDerWaalsContact O-CG2 3.3Å; T503-V507 WeakPolarHBondContact O-CG2 3.43Å; T503-V507 PolarHBondContact O-N 2.9Å; V507-I511 HydrophobicContact CG1-CD1 3.84Å; V507-I511 WeakPolarHBondContact O-CB 3.42Å; V507-I511 WeakPolarHBondContact O-CD1 3.34Å; V507-I511 WeakPolarHBondContact O-CG1 3.49Å; V507-I511 PolarHBondContact O-N 2.96Å
508	Y	91.3	Very high	90.3	Very high	142 Å²	142	66.1 Å²	66.1	56%	0.557	36%	0.357	S	S	*	.	H	α-helix	trans	-65.7	-44.4	173.5	-178.4	-92.6	0	0	0	111.9	N504 E505 E506 I511 L512	N504-Y508 VanDerWaalsContact O-CB 3.3Å; N504-Y508 WeakPolarHBondContact O-CB 3.34Å; N504-Y508 PolarHBondContact O-N 2.92Å; E505-Y508 WeakPolarHBondContact O-CB 3.29Å; E505-Y508 PolarHBondContact O-N 3Å; E506-Y508 VanDerWaalsContact C-N 3.27Å; E506-Y508 PolarHBondContact O-N 2.82Å; Y508-I511 PolarHBondContact O-N 3.25Å; Y508-L512 HydrophobicContact CE1-CD2 3.96Å; Y508-L512 WeakPolarHBondContact O-CB 3.44Å; Y508-L512 PolarHBondContact O-N 3.12Å
509	N	92.6	Very high	90.1	Very high	77 Å²	77	66 Å²	66	41%	0.412	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-46.1	-179.8	-68.8	-15.9	0	0	0	111.8	E505 E506 I511 L512 E513	E505-N509 WeakPolarHBondContact O-CB 3.37Å; E505-N509 PolarHBondContact O-N 2.91Å; E505-N509 PolarHBondContact O-ND2 3.46Å; E506-N509 PolarHBondContact O-N 3.24Å; N509-I511 VanDerWaalsContact C-N 3.32Å; N509-I511 PolarHBondContact O-N 3.18Å; N509-L512 WeakPolarHBondContact O-CA 3.24Å; N509-L512 WeakPolarHBondContact O-CB 3.12Å; N509-L512 PolarHBondContact O-N 2.96Å; N509-E513 VanDerWaalsContact O-CG 3.31Å; N509-E513 WeakPolarHBondContact O-CG 3.42Å; N509-E513 PolarHBondContact O-N 3.01Å
510	I	93	Very high	90.1	Very high	22 Å²	22	66 Å²	66	11%	0.113	35%	0.348	C	S	.	.	H	α-helix	trans	-59.1	-43.4	176.6	-68.1	166.4	0	0	0	111.2	W494 K497 L499 E506 L512 S514	W494-I510 HydrophobicContact CB-CG2 4.02Å; W494-I510 HydrophobicContact CG-CG2 4.01Å; K497-I510 HydrophobicContact CB-CD1 4.09Å; K497-I510 HydrophobicContact CB-CG1 4.43Å; K497-I510 HydrophobicContact CB-CG2 4.09Å; K497-I510 HydrophobicContact CD-CD1 4.31Å; K497-I510 HydrophobicContact CD-CG1 3.85Å; K497-I510 HydrophobicContact CD-CG2 4.09Å; L499-I510 HydrophobicContact CD2-CB 4.43Å; L499-I510 HydrophobicContact CD2-CD1 3.53Å; L499-I510 HydrophobicContact CD2-CG2 4.12Å; E506-I510 VanDerWaalsContact O-CG1 3.29Å; E506-I510 WeakPolarHBondContact O-CG1 3.44Å; E506-I510 PolarHBondContact O-N 2.84Å; I510-L512 VanDerWaalsContact C-N 3.34Å; I510-S514 PolarHBondContact O-N 2.92Å; I510-S514 PolarHBondContact O-OG 2.76Å
511	I	91.7	Very high	90.3	Very high	45 Å²	45	67.4 Å²	67.4	23%	0.231	35%	0.351	C	S	.	.	H	α-helix	trans	-69.9	-32.3	176.1	-65.7	169.7	0	0	0	111.4	V455 W494 V507 Y508 N509 S514	V455-I511 HydrophobicContact CB-CD1 3.63Å; V455-I511 HydrophobicContact CG1-CD1 4.26Å; V455-I511 HydrophobicContact CG2-CD1 3.7Å; W494-I511 HydrophobicContact CD2-CG1 3.99Å; W494-I511 HydrophobicContact CE3-CG1 4.22Å; W494-I511 HydrophobicContact CH2-CG1 4.2Å; W494-I511 HydrophobicContact CH2-CG2 4.4Å; W494-I511 HydrophobicContact CZ2-CB 4.37Å; W494-I511 HydrophobicContact CZ2-CG1 3.94Å; W494-I511 HydrophobicContact CZ2-CG2 4.06Å; W494-I511 HydrophobicContact CZ3-CD1 4.48Å; W494-I511 HydrophobicContact CZ3-CG1 4.33Å; V507-I511 HydrophobicContact CG1-CD1 3.84Å; V507-I511 WeakPolarHBondContact O-CB 3.42Å; V507-I511 WeakPolarHBondContact O-CD1 3.34Å; V507-I511 WeakPolarHBondContact O-CG1 3.49Å; V507-I511 PolarHBondContact O-N 2.96Å; Y508-I511 PolarHBondContact O-N 3.25Å; N509-I511 VanDerWaalsContact C-N 3.32Å; N509-I511 PolarHBondContact O-N 3.18Å; I511-S514 PolarHBondContact O-OG 3.16Å
512	L	91	Very high	90.6	Very high	72 Å²	72	65.2 Å²	65.2	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-68.7	-47.7	177.2	175.1	62.1	0	0	0	112.2	Y508 N509 I510 K515	Y508-L512 HydrophobicContact CE1-CD2 3.96Å; Y508-L512 WeakPolarHBondContact O-CB 3.44Å; Y508-L512 PolarHBondContact O-N 3.12Å; N509-L512 WeakPolarHBondContact O-CA 3.24Å; N509-L512 WeakPolarHBondContact O-CB 3.12Å; N509-L512 PolarHBondContact O-N 2.96Å; I510-L512 VanDerWaalsContact C-N 3.34Å; L512-K515 HydrophobicContact CD1-CD 3.95Å; L512-K515 VanDerWaalsContact O-CB 3.3Å; L512-K515 WeakPolarHBondContact O-CB 3.22Å; L512-K515 VanDerWaalsContact O-CG 3.27Å; L512-K515 WeakPolarHBondContact O-CG 3.48Å; L512-K515 PolarHBondContact O-N 2.73Å
513	E	89.6	Confident	90.9	Very high	104 Å²	104	65.2 Å²	65.2	49%	0.486	33%	0.327	S	S	.	.	H	α-helix	trans	-56.7	-51.1	175.9	-71.7	164.4	-170.8	0	0	110.8	K497 N509 K515 S516	K497-E513 IonicContact NZ-OE2 2.82Å; K497-E513 PolarHBondContact NZ-OE2 2.9Å; N509-E513 VanDerWaalsContact O-CG 3.31Å; N509-E513 WeakPolarHBondContact O-CG 3.42Å; N509-E513 PolarHBondContact O-N 3.01Å; E513-K515 PolarHBondContact O-N 2.89Å; E513-S516 PolarHBondContact O-OG 3.35Å
514	S	89.4	Confident	91.1	Very high	4 Å²	4	62.8 Å²	62.8	3%	0.028	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-4.4	-178.6	72.8	0	0	0	0	114.9	K439 W494 N495 I510 I511 S516 E517	K439-S514 PolarHBondContact NZ-O 3.34Å; W494-S514 VanDerWaalsContact NE1-CB 3.27Å; W494-S514 PolarHBondContact NE1-OG 2.86Å; N495-S514 WeakPolarHBondContact ND2-CB 3.32Å; I510-S514 PolarHBondContact O-N 2.92Å; I510-S514 PolarHBondContact O-OG 2.76Å; I511-S514 PolarHBondContact O-OG 3.16Å; S514-S516 VanDerWaalsContact C-N 3.32Å; S514-S516 PolarHBondContact O-N 2.83Å; S514-E517 WeakPolarHBondContact CA-OE1 3.35Å; S514-E517 PolarHBondContact O-N 2.97Å
515	K	85.7	Confident	91.1	Very high	129 Å²	129	59.2 Å²	59.2	56%	0.561	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-36.9	179.3	-74.4	-178.4	-171	166.8	0	112.8	K439 L512 E513	K439-K515 VanDerWaalsContact NZ-C 3.32Å; K439-K515 PolarHBondContact NZ-O 2.73Å; L512-K515 HydrophobicContact CD1-CD 3.95Å; L512-K515 VanDerWaalsContact O-CB 3.3Å; L512-K515 WeakPolarHBondContact O-CB 3.22Å; L512-K515 VanDerWaalsContact O-CG 3.27Å; L512-K515 WeakPolarHBondContact O-CG 3.48Å; L512-K515 PolarHBondContact O-N 2.73Å; E513-K515 PolarHBondContact O-N 2.89Å
516	S	84.2	Confident	91.1	Very high	108 Å²	108	53.9 Å²	53.9	76%	0.755	27%	0.268	S	S	*	.	S	Bend	trans	-68.4	-34	-178.9	54.9	0	0	0	0	113.2	E513 S514	E513-S516 PolarHBondContact O-OG 3.35Å; S514-S516 VanDerWaalsContact C-N 3.32Å; S514-S516 PolarHBondContact O-N 2.83Å
517	E	85.5	Confident	90.8	Very high	78 Å²	78	52.6 Å²	52.6	36%	0.364	27%	0.268	S	S	.	.	S	Bend	trans	-62.9	141.2	-175	-63.8	177.4	-117.9	0	0	112.2	K439 N495 S514 Q519	K439-E517 WeakPolarHBondContact CD-O 3.43Å; K439-E517 WeakPolarHBondContact CE-O 3.44Å; K439-E517 PolarHBondContact NZ-O 2.96Å; N495-E517 PolarHBondContact ND2-OE1 2.97Å; N495-E517 PolarHBondContact ND2-OE2 3.12Å; S514-E517 WeakPolarHBondContact CA-OE1 3.35Å; S514-E517 PolarHBondContact O-N 2.97Å; E517-Q519 WeakPolarHBondContact CB-O 3.19Å; E517-Q519 PolarHBondContact O-N 3.28Å
518	P	85.4	Confident	90	Very high	57 Å²	57	55 Å²	55	37%	0.37	28%	0.28	S	S	.	.	S	Bend	trans	-71.3	-16.9	179.8	31	-36.3	0	0	0	113.2	N438 K439 R440	N438-P518 PolarHBondContact OD1-O 3.35Å; K439-P518 WeakPolarHBondContact CB-O 3.22Å; K439-P518 PolarHBondContact N-O 2.97Å; R440-P518 HydrophobicContact CG-CB 4.28Å
519	Q	88.9	Confident	88.8	Confident	91 Å²	91	51.2 Å²	51.2	43%	0.425	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150.4	-169.9	179.5	172	-24.2	0	0	107.9	I436 L437 E517	I436-Q519 HydrophobicContact CG2-CG 3.84Å; L437-Q519 WeakPolarHBondContact O-CA 3.4Å; E517-Q519 WeakPolarHBondContact CB-O 3.19Å; E517-Q519 PolarHBondContact O-N 3.28Å
520	V	92.6	Very high	87	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	125.2	175.3	177.9	0	0	0	0	108	L437 L451 W494 N495 I522	L437-V520 PolarHBondContact N-O 3.33Å; L437-V520 PolarHBondContact O-N 2.87Å; L451-V520 HydrophobicContact CD1-CB 4.23Å; L451-V520 HydrophobicContact CD1-CG1 4.39Å; L451-V520 HydrophobicContact CD1-CG2 4.13Å; W494-V520 HydrophobicContact CD2-CG1 4.15Å; W494-V520 HydrophobicContact CH2-CG1 4.31Å; W494-V520 HydrophobicContact CZ2-CG1 3.7Å; N495-V520 VanDerWaalsContact OD1-CA 3.25Å; N495-V520 WeakPolarHBondContact OD1-CA 3.48Å; N495-V520 WeakPolarHBondContact OD1-CG1 3.17Å; V520-I522 HydrophobicContact CG1-CD1 4.2Å; V520-I522 HydrophobicContact CG1-CG1 3.77Å
521	E	94.7	Very high	85	Confident	75 Å²	75	53 Å²	53	35%	0.35	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.8	169.7	-176.7	166.3	-168.3	0	0	109.4	V435 I436 N495	V435-E521 CarbonylContact O-C 3.59Å; V435-E521 WeakPolarHBondContact O-CA 3.4Å; I436-E521 HydrophobicContact CG1-CB 4.4Å; I436-E521 HydrophobicContact CG1-CG 4.1Å; N495-E521 PolarHBondContact N-O 3.31Å; N495-E521 PolarHBondContact OD1-N 3.24Å; N495-E521 PolarHBondContact OD1-O 3.29Å
522	I	95	Very high	82.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	125.1	-176.7	-48.3	175.9	0	0	0	107	V435 L437 L453 L485 V491 E493 W494 V520 V524	V435-I522 PolarHBondContact N-O 3.17Å; V435-I522 PolarHBondContact O-N 3.18Å; L437-I522 HydrophobicContact CD1-CD1 3.97Å; L453-I522 HydrophobicContact CD2-CD1 3.61Å; L485-I522 HydrophobicContact CD1-CD1 4.24Å; V491-I522 HydrophobicContact CG1-CG2 3.67Å; E493-I522 WeakPolarHBondContact O-CA 3.5Å; W494-I522 HydrophobicContact CD2-CG1 4.41Å; W494-I522 HydrophobicContact CE3-CD1 3.95Å; W494-I522 HydrophobicContact CE3-CG1 3.93Å; W494-I522 HydrophobicContact CE3-CG2 4.13Å; W494-I522 HydrophobicContact CH2-CD1 4.03Å; W494-I522 HydrophobicContact CZ3-CD1 3.55Å; W494-I522 HydrophobicContact CZ3-CG1 4.07Å; V520-I522 HydrophobicContact CG1-CD1 4.2Å; V520-I522 HydrophobicContact CG1-CG1 3.77Å; I522-V524 HydrophobicContact CG2-CG1 3.84Å
523	I	95.5	Very high	80.2	Confident	10 Å²	10	61.3 Å²	61.3	5%	0.051	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.6	168	-51.3	-167.7	0	0	0	107.8	I432 G433 R434 L492 E493	I432-I523 HydrophobicContact CG2-CG2 3.57Å; G433-I523 CarbonylContact O-C 3.56Å; G433-I523 WeakPolarHBondContact O-CA 3.47Å; R434-I523 HydrophobicContact CG-CD1 3.95Å; R434-I523 HydrophobicContact CG-CG1 4.02Å; R434-I523 HydrophobicContact CG-CG2 4.44Å; L492-I523 HydrophobicContact CB-CB 4.49Å; L492-I523 HydrophobicContact CB-CG2 4.32Å; L492-I523 HydrophobicContact CD1-CG2 4.44Å; L492-I523 PolarHBondContact N-O 2.79Å; E493-I523 HydrophobicContact CB-CB 3.97Å; E493-I523 HydrophobicContact CB-CD1 4.37Å; E493-I523 HydrophobicContact CB-CG1 4.06Å; E493-I523 HydrophobicContact CG-CB 4.46Å; E493-I523 HydrophobicContact CG-CD1 4.45Å; E493-I523 PolarHBondContact N-O 2.8Å; E493-I523 VanDerWaalsContact N-O 3.14Å; E493-I523 PolarHBondContact O-N 2.99Å; E493-I523 WeakPolarHBondContact OE2-CD1 3.41Å
524	V	94.9	Very high	77.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	159.4	179.4	-66.1	0	0	0	0	111.3	W422 I432 G433 V435 I470 L485 D489 E490 V491 I522	W422-V524 HydrophobicContact CH2-CG2 3.47Å; W422-V524 VanDerWaalsContact CH2-CG2 3.47Å; W422-V524 HydrophobicContact CZ2-CG2 4.35Å; W422-V524 HydrophobicContact CZ3-CG2 3.94Å; I432-V524 CarbonylContact C-O 3.59Å; I432-V524 VanDerWaalsContact CA-O 3.31Å; I432-V524 WeakPolarHBondContact CA-O 3.21Å; G433-V524 PolarHBondContact N-O 3.2Å; G433-V524 WeakPolarHBondContact O-CG2 3.37Å; G433-V524 PolarHBondContact O-N 2.83Å; V435-V524 HydrophobicContact CG2-CG2 4.49Å; I470-V524 HydrophobicContact CD1-CG1 4.14Å; L485-V524 HydrophobicContact CD2-CB 4.45Å; L485-V524 HydrophobicContact CD2-CG1 3.85Å; L485-V524 HydrophobicContact CD2-CG2 3.79Å; D489-V524 HydrophobicContact CB-CB 4.21Å; D489-V524 HydrophobicContact CB-CG1 4.35Å; E490-V524 CarbonylContact O-C 3.49Å; E490-V524 VanDerWaalsContact O-CA 3.26Å; E490-V524 WeakPolarHBondContact O-CA 3.32Å; V491-V524 HydrophobicContact CG2-CG1 4.16Å; I522-V524 HydrophobicContact CG2-CG1 3.84Å
525	S	93.2	Very high	75.3	Confident	5 Å²	5	68.7 Å²	68.7	4%	0.035	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	146.9	166.2	73.5	0	0	0	0	112.5	L431 E490	L431-S525 VanDerWaalsContact O-CA 3.29Å; L431-S525 WeakPolarHBondContact O-CA 3.42Å; E490-S525 PolarHBondContact N-O 3.14Å; E490-S525 PolarHBondContact O-N 3.04Å
526	R	91.9	Very high	72.9	Confident	13 Å²	13	71.6 Å²	71.6	5%	0.049	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	159.4	173.5	60.9	174.4	63.9	139.4	-1.2	110.4	W422 R430 L431 H484 D489	W422-R526 HydrophobicContact CH2-CG 4.5Å; W422-R526 VanDerWaalsContact CH2-NH1 3.33Å; W422-R526 HydrophobicContact CZ3-CG 3.97Å; R430-R526 CarbonylContact C-O 3.59Å; R430-R526 WeakPolarHBondContact CA-O 3.33Å; R430-R526 WeakPolarHBondContact CB-O 3.34Å; L431-R526 HydrophobicContact CB-CG 4.15Å; L431-R526 PolarHBondContact N-O 2.98Å; L431-R526 PolarHBondContact O-N 3.5Å; H484-R526 PolarHBondContact O-NH2 2.86Å; D489-R526 VanDerWaalsContact CG-NH2 3.31Å; D489-R526 IonicContact OD1-CZ 3.16Å; D489-R526 IonicContact OD1-NE 3.35Å; D489-R526 PolarHBondContact OD1-NE 3.48Å; D489-R526 IonicContact OD1-NH2 2.73Å; D489-R526 PolarHBondContact OD1-NH2 2.64Å; D489-R526 IonicContact OD2-CZ 2.63Å; D489-R526 IonicContact OD2-NE 3.65Å; D489-R526 IonicContact OD2-NH2 2.73Å; D489-R526 PolarHBondContact OD2-NH2 3.12Å
527	P	86.4	Confident	70.5	Confident	70 Å²	70	71.5 Å²	71.5	46%	0.455	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	153.1	176.2	-20.8	34	0	0	0	112.7	G529	P527-G529 VanDerWaalsContact C-N 3.3Å; P527-G529 PolarHBondContact O-N 2.73Å
528	I	77.1	Confident	67.8	Low	52 Å²	52	72.1 Å²	72.1	27%	0.267	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-73.2	-17.1	177.5	-92.4	166.7	0	0	0	114.2	P424 G428 D429 R430 L431 D530	P424-I528 HydrophobicContact CB-CD1 4.25Å; G428-I528 WeakPolarHBondContact O-CD1 3.38Å; D429-I528 PolarHBondContact O-N 3.26Å; R430-I528 VanDerWaalsContact O-CD1 3.3Å; R430-I528 WeakPolarHBondContact O-CD1 3.45Å; L431-I528 HydrophobicContact CB-CG1 4.45Å; L431-I528 HydrophobicContact CD1-CG1 3.77Å; L431-I528 HydrophobicContact CG-CD1 4.36Å; L431-I528 HydrophobicContact CG-CG1 3.65Å; I528-D530 VanDerWaalsContact C-N 3.28Å; I528-D530 PolarHBondContact O-N 3.1Å
529	G	66.2	Low	65.4	Low	64 Å²	64	77.4 Å²	77.4	66%	0.66	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-64.2	-22.8	-179.4	0	0	0	0	0	115.7	P527 I531	P527-G529 VanDerWaalsContact C-N 3.3Å; P527-G529 PolarHBondContact O-N 2.73Å; G529-I531 VanDerWaalsContact C-N 3.28Å; G529-I531 PolarHBondContact O-N 3.19Å
530	D	54.6	Low	62.7	Low	64 Å²	64	78.4 Å²	78.4	34%	0.342	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-86.6	16.3	-168.7	-57.6	-23.2	0	0	0	114.8	R486 I528	R486-D530 PolarHBondContact NH1-O 3.21Å; I528-D530 VanDerWaalsContact C-N 3.28Å; I528-D530 PolarHBondContact O-N 3.1Å
531	I	51.5	Low	60.2	Low	71 Å²	71	84.3 Å²	84.3	36%	0.364	48%	0.478	S	S	.	.	S	Bend	trans	-129.5	119.1	179.1	-59.2	-163.5	0	0	0	111	L431 G529 R533	L431-I531 HydrophobicContact CD1-CD1 3.5Å; L431-I531 VanDerWaalsContact CD1-CD1 3.5Å; L431-I531 HydrophobicContact CD1-CG1 4.02Å; G529-I531 VanDerWaalsContact C-N 3.28Å; G529-I531 PolarHBondContact O-N 3.19Å; I531-R533 PolarHBondContact O-N 2.89Å; I531-R533 VanDerWaalsContact O-N 3.12Å
532	P	44.6	Very low	57.3	Low	104 Å²	104	87.9 Å²	87.9	68%	0.675	50%	0.499	S	S	*	.			trans	-58.9	115	165	-22.4	33.8	0	0	0	110.2	I534	P532-I534 PolarHBondContact O-N 2.98Å
533	R	37.2	Very low	54.5	Low	188 Å²	188	95.3 Å²	95.3	71%	0.709	53%	0.534	S	S	*	.			trans	-55.1	111.8	179	-70.9	176.2	173.5	121.3	-5.1	109.6	I531 P535 D572	I531-R533 PolarHBondContact O-N 2.89Å; I531-R533 VanDerWaalsContact O-N 3.12Å; R533-P535 WeakPolarHBondContact O-CD 3.4Å; R533-D572 IonicContact CZ-OD2 2.88Å; R533-D572 IonicContact NH1-OD2 3.17Å; R533-D572 PolarHBondContact NH1-OD2 2.71Å; R533-D572 IonicContact NH2-OD2 3.98Å; R533-D572 PolarHBondContact NH2-OD2 3.33Å; R533-D572 VanDerWaalsContact NH2-OD2 3.13Å
534	I	37.2	Very low	51.5	Low	148 Å²	148	99.7 Å²	99.7	76%	0.759	57%	0.565	S	S	*	*			trans	-65.4	124	168.3	-60.2	174.6	0	0	0	106.7	P532 E536	P532-I534 PolarHBondContact O-N 2.98Å; I534-E536 PolarHBondContact O-N 3.38Å
535	P	38.4	Very low	48.6	Very low	116 Å²	116	104.4 Å²	104.4	75%	0.753	60%	0.598	S	S	*	*			trans	-65.5	117.2	172	-18.3	32.2	0	0	0	109	R533 S537	R533-P535 WeakPolarHBondContact O-CD 3.4Å; P535-S537 PolarHBondContact O-N 2.8Å; P535-S537 VanDerWaalsContact O-N 3.14Å
536	E	36.2	Very low	45.7	Very low	190 Å²	190	109.5 Å²	109.5	89%	0.888	63%	0.633	S	S	*	*			trans	-64.4	115.4	179.6	-66.6	-171	140.8	0	0	110.1	I534	I534-E536 PolarHBondContact O-N 3.38Å
537	S	32.8	Very low	43	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	67%	0.668	S	S	*	*			trans	-75.9	124.2	174.9	56	0	0	0	0	110	P535	P535-S537 PolarHBondContact O-N 2.8Å; P535-S537 VanDerWaalsContact O-N 3.14Å
538	S	29.6	Very low	40.5	Very low	90 Å²	90	115.7 Å²	115.7	63%	0.629	68%	0.681	S	S	*	*			trans	61.5	133.3	-176.5	50.1	0	0	0	0	114.4
539	H	33.9	Very low	38.4	Very low	169 Å²	169	121 Å²	121	78%	0.782	70%	0.702	S	S	*	*			cis	-137.1	162.5	27.9	-66.6	-96.6	0	0	0	112.7
540	P	32.8	Very low	36.9	Very low	111 Å²	111	125 Å²	125	72%	0.721	70%	0.704	S	S	*	*			trans	-85.1	131.4	-178.6	32.6	-33.4	0	0	0	113.5
541	P	41.3	Very low	36.1	Very low	124 Å²	124	126.6 Å²	126.6	81%	0.805	72%	0.72	S	S	*	*			trans	-76.5	135.9	151	-8	26.5	0	0	0	109.5
542	L	33.1	Very low	35.2	Very low	151 Å²	151	131.8 Å²	131.8	79%	0.791	74%	0.743	S	S	*	*			trans	-88	-173.9	168.9	-70.4	169.6	0	0	0	110.4
543	E	36.3	Very low	34.7	Very low	156 Å²	156	135.5 Å²	135.5	73%	0.729	75%	0.748	S	S	*	*			trans	75.1	85.9	176.9	-51.6	-46.8	113.2	0	0	117.9
544	S	33	Very low	34.6	Very low	101 Å²	101	134.6 Å²	134.6	71%	0.706	75%	0.754	S	S	*	*				59.5	133.6	119.1	-54.1	0	0	0	0	120.8
545	S	33.1	Very low	34.6	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	75%	0.752	S	S	*	*			cis	-170.2	156.9	-4.9	-89.8	0	0	0	0	110.8
546	S	32.9	Very low	34.3	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	75%	0.754	S	S	*	*			trans	39.8	146.2	146.1	61.5	0	0	0	0	123.2
547	S	34.2	Very low	34.5	Very low	110 Å²	110	135.1 Å²	135.1	77%	0.769	74%	0.743	S	S	*	*			cis	-173.5	141.6	-10.6	49.7	0	0	0	0	113
548	S	34.9	Very low	34.4	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	74%	0.742	S	S	*	*			trans	-21.3	141	150.6	151.7	0	0	0	0	118.6
549	F	33.6	Very low	34.7	Very low	164 Å²	164	139.1 Å²	139.1	72%	0.719	76%	0.755	S	S	*	*				-172.7	170	99	-169.2	-118	0	0	0	114
550	E	34	Very low	34.7	Very low	147 Å²	147	135.8 Å²	135.8	69%	0.687	75%	0.751	S	S	*	*			trans	-90.2	151.3	-174.8	-55.9	165.7	66.6	0	0	114.3
551	S	37.1	Very low	34.7	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	75%	0.754	S	S	*	*				166.4	119.3	118.8	-77.7	0	0	0	0	116.1
552	Q	33.4	Very low	34.5	Very low	180 Å²	180	137.7 Å²	137.7	84%	0.841	75%	0.751	S	S	*	*			trans	43.8	121.8	139.5	-51.7	-169.3	9	0	0	123.3
553	K	33.9	Very low	34.4	Very low	181 Å²	181	135.6 Å²	135.6	79%	0.787	75%	0.749	S	S	*	*				113.3	135.9	122.4	-151.2	174.9	-175.3	172.2	0	119.8
554	M	35.2	Very low	34.4	Very low	170 Å²	170	133.6 Å²	133.6	84%	0.837	75%	0.75	S	S	*	*			trans	98.1	141.5	165.6	-56.6	-155.1	-175.5	0	0	119.2
555	E	36	Very low	34.3	Very low	154 Å²	154	135.3 Å²	135.3	72%	0.72	76%	0.756	S	S	*	*			trans	-63.4	170.6	167.5	-54.2	160.3	50.2	0	0	110.6
556	R	34	Very low	34.4	Very low	211 Å²	211	136.3 Å²	136.3	80%	0.796	76%	0.763	S	S	*	*			cis	-178.1	175.8	37.8	-151.1	165.6	165.1	130.9	-10.4	108.7
557	P	40	Very low	34.4	Very low	100 Å²	100	137.5 Å²	137.5	65%	0.649	77%	0.768	S	S	*	*				-124.1	172.9	-65	41.6	-28.8	0	0	0	114.5
558	S	30.3	Very low	34.4	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	77%	0.768	S	S	*	*			trans	38.3	117.7	143.6	65.3	0	0	0	0	122.4
559	I	36.2	Very low	34.4	Very low	175 Å²	175	135.6 Å²	135.6	90%	0.897	77%	0.772	S	S	*	*			trans	-121	154.7	136.9	-80.9	179.5	0	0	0	108
560	S	32.9	Very low	34.4	Very low	98 Å²	98	136 Å²	136	69%	0.685	78%	0.781	S	S	*	*			trans	-142.5	158	-170.7	55.5	0	0	0	0	113
561	V	34.2	Very low	34.6	Very low	129 Å²	129	136.5 Å²	136.5	78%	0.782	78%	0.781	S	S	*	*			trans	66.5	148	178.4	-133.2	0	0	0	0	111.7
562	I	35.9	Very low	34.8	Very low	147 Å²	147	138.1 Å²	138.1	75%	0.754	78%	0.782	S	S	*	*			cis	-145.2	128.9	16.7	-32	168.9	0	0	0	106.9
563	S	31.5	Very low	35.3	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	77%	0.768	S	S	*	*				171.2	159.2	89.4	-66	0	0	0	0	110.4
564	P	36.1	Very low	36	Very low	114 Å²	114	128.5 Å²	128.5	74%	0.74	76%	0.759	S	S	*	*			trans	-90.8	176.4	178.7	36.7	-36	0	0	0	114.8
565	T	31.3	Very low	36.8	Very low	137 Å²	137	125.2 Å²	125.2	84%	0.84	74%	0.742	S	S	*	*			trans	73.1	80.5	163.6	15.9	0	0	0	0	119
566	S	34.2	Very low	37.8	Very low	120 Å²	120	121.8 Å²	121.8	84%	0.839	73%	0.731	S	S	*	*			trans	-171.8	130.9	139.5	34.5	0	0	0	0	111
567	P	34.4	Very low	39.7	Very low	137 Å²	137	113.9 Å²	113.9	89%	0.89	71%	0.705	S	S	*	*			trans	-103	127.6	177.2	35	-28.5	0	0	0	112.5
568	G	34	Very low	41.6	Very low	74 Å²	74	112.8 Å²	112.8	76%	0.763	70%	0.697	S	S	*	*			trans	-168.8	149.2	176.4	0	0	0	0	0	115.9
569	A	34.6	Very low	44.4	Very low	100 Å²	100	108 Å²	108	83%	0.826	67%	0.665	S	S	*	*			trans	45	89.7	159.4	0	0	0	0	0	119.9
570	L	34.1	Very low	47.2	Very low	173 Å²	173	102.6 Å²	102.6	91%	0.906	64%	0.636	S	S	*	*			trans	172.1	94.8	135.6	-98.7	169.2	0	0	0	111.3
571	K	37.6	Very low	50.2	Low	157 Å²	157	97.9 Å²	97.9	68%	0.683	60%	0.603	S	S	*	*			trans	-151.5	46.1	174.5	-75.5	-161.4	169.6	-176.9	0	114.7	A573 Q575	K571-A573 PolarHBondContact O-N 3.37Å; K571-Q575 HydrophobicContact CD-CG 4.23Å
572	D	41.1	Very low	53.2	Low	131 Å²	131	92 Å²	92	70%	0.701	57%	0.567	S	S	*	*			trans	-90.8	39.6	167.9	-153.9	28	0	0	0	111.6	R533	R533-D572 IonicContact CZ-OD2 2.88Å; R533-D572 IonicContact NH1-OD2 3.17Å; R533-D572 PolarHBondContact NH1-OD2 2.71Å; R533-D572 IonicContact NH2-OD2 3.98Å; R533-D572 PolarHBondContact NH2-OD2 3.33Å; R533-D572 VanDerWaalsContact NH2-OD2 3.13Å
573	A	43.8	Very low	56.1	Low	66 Å²	66	85 Å²	85	55%	0.545	53%	0.531	S	S	.	.	S	Bend	trans	-130.8	143.6	174.1	0	0	0	0	0	108.1	K571 Q575	K571-A573 PolarHBondContact O-N 3.37Å; A573-Q575 PolarHBondContact O-N 2.71Å; A573-Q575 VanDerWaalsContact O-N 3.15Å
574	P	48.6	Very low	59.2	Low	93 Å²	93	81.9 Å²	81.9	60%	0.604	50%	0.504	S	S	*	.			trans	-55.2	125.4	-178.1	22.5	-33.3	0	0	0	109.5	V576	P574-V576 VanDerWaalsContact C-N 3.26Å; P574-V576 PolarHBondContact O-N 2.79Å
575	Q	51.9	Low	62.1	Low	101 Å²	101	76.5 Å²	76.5	47%	0.472	47%	0.469	S	S	.	.			trans	-72	88	-177.7	-71.6	-166.7	77.4	0	0	109.4	K571 A573 L577	K571-Q575 HydrophobicContact CD-CG 4.23Å; A573-Q575 PolarHBondContact O-N 2.71Å; A573-Q575 VanDerWaalsContact O-N 3.15Å; Q575-L577 PolarHBondContact O-N 3.08Å; Q575-L577 VanDerWaalsContact O-N 3.11Å
576	V	57.1	Low	65.2	Low	82 Å²	82	74.3 Å²	74.3	50%	0.497	45%	0.446	S	S	.	.			trans	-51.5	114.3	169.3	174.8	0	0	0	0	107.7	P574 K701	P574-V576 VanDerWaalsContact C-N 3.26Å; P574-V576 PolarHBondContact O-N 2.79Å; V576-K701 HydrophobicContact CG1-CB 4.12Å; V576-K701 HydrophobicContact CG1-CD 4.13Å
577	L	74.4	Confident	68.1	Low	46 Å²	46	70.4 Å²	70.4	24%	0.241	41%	0.413	C	S	.	.			trans	-71.9	149.8	173.8	-67.2	177.2	0	0	0	108.6	Q575 G579 L681 L702 Q703 T704	Q575-L577 PolarHBondContact O-N 3.08Å; Q575-L577 VanDerWaalsContact O-N 3.11Å; L577-G579 PolarHBondContact O-N 2.7Å; L577-L681 WeakPolarHBondContact CD1-O 3.43Å; L577-L702 HydrophobicContact CB-CB 4.21Å; L577-L702 PolarHBondContact N-O 2.86Å; L577-Q703 WeakPolarHBondContact CD1-O 3.13Å; L577-T704 HydrophobicContact CD1-CG2 4.1Å; L577-T704 HydrophobicContact CD2-CG2 3.79Å; L577-T704 HydrophobicContact CG-CG2 3.96Å
578	P	79.2	Confident	71	Confident	76 Å²	76	65.5 Å²	65.5	49%	0.494	38%	0.379	S	S	.	.	S	Bend	trans	-56.6	127	164.9	27.5	-34.9	0	0	0	108.3	D603 P605	P578-D603 CarbonylContact C-O 3.56Å; P578-P605 HydrophobicContact CG-CB 4Å; P578-P605 HydrophobicContact CG-CG 4.44Å; P578-P605 WeakPolarHBondContact O-CD 3.22Å
579	G	89.7	Confident	73.7	Confident	5 Å²	5	70 Å²	70	5%	0.052	38%	0.377	C	S	.	.			trans	132	141	-179.1	0	0	0	0	0	113.9	L577 T602 D603 L702	L577-G579 PolarHBondContact O-N 2.7Å; G579-T602 VanDerWaalsContact CA-O 3.26Å; G579-T602 WeakPolarHBondContact CA-O 3.44Å; G579-D603 WeakPolarHBondContact CA-O 3.32Å; G579-D603 PolarHBondContact N-O 3.18Å; G579-L702 PolarHBondContact O-N 3.04Å
580	Q	94.5	Very high	76.5	Confident	61 Å²	61	71.6 Å²	71.6	29%	0.285	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.4	173.1	-52.6	-171	43.9	0	0	109.8	A601 T602 W699 Y700 K701	Q580-A601 CarbonylContact O-C 3.53Å; Q580-A601 WeakPolarHBondContact O-CA 3.43Å; Q580-A601 VanDerWaalsContact O-CB 3.31Å; Q580-A601 WeakPolarHBondContact O-CB 3.19Å; Q580-T602 PolarHBondContact N-O 3.32Å; Q580-T602 VanDerWaalsContact N-O 3.08Å; Q580-T602 PolarHBondContact O-N 2.97Å; Q580-W699 HydrophobicContact CB-CE3 3.79Å; Q580-W699 HydrophobicContact CB-CZ3 4.21Å; Q580-Y700 CarbonylContact C-O 3.59Å; Q580-Y700 WeakPolarHBondContact CA-O 3.21Å; Q580-K701 HydrophobicContact CG-CG 4.23Å
581	L	96.4	Very high	79.2	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.5	178	-171.8	72.9	0	0	0	109.8	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 4.33Å; L581-A601 HydrophobicContact CD1-CB 3.89Å; L581-V617 HydrophobicContact CD1-CG2 4.24Å; L581-W644 HydrophobicContact CD1-CE3 4.29Å; L581-W644 HydrophobicContact CD1-CH2 4.25Å; L581-W644 HydrophobicContact CD1-CZ3 3.49Å; L581-W644 VanDerWaalsContact CD1-CZ3 3.49Å; L581-I665 HydrophobicContact CD2-CG2 3.43Å; L581-I665 VanDerWaalsContact CD2-CG2 3.43Å; L581-V667 HydrophobicContact CD2-CG2 4.46Å; L581-I684 HydrophobicContact CB-CD1 3.51Å; L581-I684 HydrophobicContact CD2-CD1 3.74Å; L581-I684 HydrophobicContact CG-CD1 4.25Å; L581-Y700 PolarHBondContact N-O 2.8Å; L581-Y700 PolarHBondContact O-N 3.28Å; L581-L702 HydrophobicContact CB-CD2 4.49Å
582	S	97.2	Very high	81.9	Confident	4 Å²	4	61.2 Å²	61.2	3%	0.028	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118.4	172	-176.4	0	0	0	0	110	L599 Q600 H698	S582-L599 PolarHBondContact O-N 2.82Å; S582-Q600 PolarHBondContact N-O 2.93Å; S582-H698 CarbonylContact C-O 3.54Å; S582-H698 WeakPolarHBondContact CA-O 3.19Å
583	V	97.3	Very high	84.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126.1	-179.5	-171.6	0	0	0	0	109.1	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 3.77Å; V583-L585 HydrophobicContact CG1-CG 4.13Å; V583-V596 HydrophobicContact CG1-CG1 4.11Å; V583-N597 WeakPolarHBondContact CA-O 3.48Å; V583-I665 HydrophobicContact CG1-CD1 4.13Å; V583-I665 HydrophobicContact CG2-CD1 4.04Å; V583-H698 PolarHBondContact N-O 2.73Å; V583-H698 PolarHBondContact O-N 2.84Å; V583-Y700 HydrophobicContact CB-CD2 4.13Å; V583-Y700 HydrophobicContact CB-CE2 4.05Å; V583-Y700 HydrophobicContact CG2-CD2 4.25Å
584	K	96.5	Very high	87	Confident	43 Å²	43	54.5 Å²	54.5	19%	0.187	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.3	173.3	157.7	-179.9	-99.7	-121.4	0	108.5	N597 L599 D695 E696 P697	K584-N597 HydrophobicContact CB-CB 3.82Å; K584-N597 HydrophobicContact CD-CB 4.35Å; K584-N597 HydrophobicContact CG-CB 4.04Å; K584-N597 PolarHBondContact N-O 3.16Å; K584-N597 WeakPolarHBondContact O-CB 3.29Å; K584-N597 PolarHBondContact O-N 3.07Å; K584-L599 HydrophobicContact CB-CD1 4.09Å; K584-D695 WeakPolarHBondContact CD-OD1 3.29Å; K584-D695 VanDerWaalsContact CE-C 3.5Å; K584-D695 WeakPolarHBondContact CE-O 3.42Å; K584-D695 WeakPolarHBondContact CE-OD1 3.31Å; K584-D695 WeakPolarHBondContact CG-OD1 3.41Å; K584-D695 PolarHBondContact NZ-O 2.81Å; K584-D695 IonicContact NZ-OD1 3.56Å; K584-D695 PolarHBondContact NZ-OD1 2.96Å; K584-D695 VanDerWaalsContact NZ-OD1 3.12Å; K584-D695 IonicContact NZ-OD2 3.4Å; K584-D695 PolarHBondContact NZ-OD2 3.2Å; K584-E696 WeakPolarHBondContact CA-O 3.3Å; K584-P697 HydrophobicContact CB-CB 4.32Å
585	L	96.9	Very high	89.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.9	-174.8	-62.1	178.7	0	0	0	110.4	V583 V596 L663 I686 A691 L693 D695	V583-L585 HydrophobicContact CG1-CD2 3.77Å; V583-L585 HydrophobicContact CG1-CG 4.13Å; L585-V596 HydrophobicContact CD2-CB 4.15Å; L585-V596 HydrophobicContact CD2-CG1 3.87Å; L585-V596 HydrophobicContact CD2-CG2 3.88Å; L585-L663 HydrophobicContact CD2-CD2 3.8Å; L585-I686 HydrophobicContact CD1-CD1 4.03Å; L585-I686 HydrophobicContact CD1-CG2 4.13Å; L585-A691 HydrophobicContact CD1-CB 4.35Å; L585-L693 HydrophobicContact CB-CD2 4.27Å; L585-L693 CarbonylContact O-C 3.42Å; L585-L693 WeakPolarHBondContact O-CA 3.22Å; L585-D695 PolarHBondContact O-N 2.65Å; L585-D695 VanDerWaalsContact O-N 3.13Å
586	W	95	Very high	91.4	Very high	91 Å²	91	45.7 Å²	45.7	35%	0.345	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	162.5	168.5	65	-86.1	0	0	0	112.5	D588 I595 D695	W586-D588 HydrophobicContact CZ3-CB 3.84Å; W586-I595 HydrophobicContact CD2-CB 3.97Å; W586-I595 HydrophobicContact CD2-CD1 3.94Å; W586-I595 HydrophobicContact CD2-CG1 4.14Å; W586-I595 HydrophobicContact CE3-CD1 3.81Å; W586-I595 HydrophobicContact CE3-CG1 4.47Å; W586-I595 HydrophobicContact CG-CB 4.19Å; W586-I595 HydrophobicContact CH2-CD1 3.72Å; W586-I595 HydrophobicContact CH2-CG1 3.97Å; W586-I595 HydrophobicContact CZ2-CB 4.02Å; W586-I595 HydrophobicContact CZ2-CD1 3.85Å; W586-I595 HydrophobicContact CZ2-CG1 3.6Å; W586-I595 HydrophobicContact CZ2-CG2 4.14Å; W586-I595 HydrophobicContact CZ3-CD1 3.7Å; W586-I595 HydrophobicContact CZ3-CG1 4.39Å; W586-I595 PolarHBondContact N-O 2.88Å; W586-I595 PolarHBondContact O-N 3.11Å; W586-D695 HydrophobicContact CB-CB 3.82Å; W586-D695 HydrophobicContact CG-CB 4.02Å
587	Y	95.9	Very high	93.3	Very high	38 Å²	38	42.8 Å²	42.8	15%	0.149	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	115.1	-175.3	177.2	-115.3	0	0	0	112.5	K589 Q593 V653 R655 F658	Y587-K589 HydrophobicContact CD1-CB 4.38Å; Y587-K589 HydrophobicContact CE1-CB 4.08Å; Y587-K589 HydrophobicContact CE1-CG 4.44Å; Y587-K589 PolarHBondContact O-N 2.96Å; Y587-K589 VanDerWaalsContact O-N 3.17Å; Y587-Q593 WeakPolarHBondContact CD2-O 3.47Å; Y587-V653 VanDerWaalsContact CE2-O 3.27Å; Y587-V653 WeakPolarHBondContact CE2-O 3.24Å; Y587-V653 PolarHBondContact OH-O 3.25Å; Y587-V653 VanDerWaalsContact OH-O 3.07Å; Y587-R655 HydrophobicContact CE1-CB 3.88Å; Y587-R655 HydrophobicContact CE1-CG 4.41Å; Y587-R655 PolarHBondContact OH-N 2.64Å; Y587-R655 VanDerWaalsContact OH-N 3.14Å; Y587-F658 HydrophobicContact CD1-CZ 4.28Å; Y587-F658 HydrophobicContact CD2-CE1 4.06Å; Y587-F658 AromaticContact CD2-CZ 3.47Å; Y587-F658 HydrophobicContact CD2-CZ 3.47Å; Y587-F658 VanDerWaalsContact CD2-CZ 3.47Å; Y587-F658 AromaticContact CE2-CE1 3.95Å; Y587-F658 HydrophobicContact CE2-CE1 3.95Å; Y587-F658 AromaticContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CG-CE2 4.39Å; Y587-F658 AromaticContact CG-CZ 3.71Å; Y587-F658 HydrophobicContact CG-CZ 3.71Å
588	D	94.7	Very high	94.4	Very high	33 Å²	33	40.6 Å²	40.6	18%	0.176	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	101.5	167.1	173.3	13	0	0	0	109.7	W586 V590 G591 H592 Q593 I595	W586-D588 HydrophobicContact CZ3-CB 3.84Å; D588-V590 VanDerWaalsContact C-N 3.26Å; D588-V590 PolarHBondContact O-N 2.8Å; D588-V590 WeakPolarHBondContact OD1-CA 3.41Å; D588-V590 WeakPolarHBondContact OD1-CB 3.43Å; D588-V590 PolarHBondContact OD1-N 3.36Å; D588-G591 PolarHBondContact OD1-N 3.37Å; D588-G591 WeakPolarHBondContact OD2-CA 3.19Å; D588-G591 PolarHBondContact OD2-N 3.47Å; D588-H592 VanDerWaalsContact O-CA 3.28Å; D588-H592 WeakPolarHBondContact O-CA 3.27Å; D588-H592 PolarHBondContact O-N 2.78Å; D588-Q593 HydrophobicContact CB-CB 4.05Å; D588-Q593 HydrophobicContact CB-CG 4.39Å; D588-Q593 PolarHBondContact N-O 3.26Å; D588-Q593 PolarHBondContact O-N 3.35Å; D588-Q593 PolarHBondContact OD2-NE2 3.3Å; D588-I595 HydrophobicContact CB-CD1 3.94Å
589	K	91.9	Very high	95.3	Very high	168 Å²	168	38.7 Å²	38.7	73%	0.73	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-27.9	175.5	-173.7	-178.6	175.4	-172.8	0	112.7	Y587 H592	Y587-K589 HydrophobicContact CD1-CB 4.38Å; Y587-K589 HydrophobicContact CE1-CB 4.08Å; Y587-K589 HydrophobicContact CE1-CG 4.44Å; Y587-K589 PolarHBondContact O-N 2.96Å; Y587-K589 VanDerWaalsContact O-N 3.17Å; K589-H592 PolarHBondContact O-CE1 3.48Å; K589-H592 VanDerWaalsContact O-CE1 3.3Å; K589-H592 PolarHBondContact O-ND1 2.96Å
590	V	92.2	Very high	95.6	Very high	135 Å²	135	40.5 Å²	40.5	82%	0.818	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-54.1	-173.3	-177.3	0	0	0	0	110.8	D588 H592	D588-V590 VanDerWaalsContact C-N 3.26Å; D588-V590 PolarHBondContact O-N 2.8Å; D588-V590 WeakPolarHBondContact OD1-CA 3.41Å; D588-V590 WeakPolarHBondContact OD1-CB 3.43Å; D588-V590 PolarHBondContact OD1-N 3.36Å; V590-H592 VanDerWaalsContact C-N 3.25Å; V590-H592 PolarHBondContact O-N 2.71Å
591	G	91.2	Very high	95.7	Very high	39 Å²	39	37.7 Å²	37.7	40%	0.402	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-4.8	175.7	0	0	0	0	0	114.6	D588 Q593	D588-G591 PolarHBondContact OD1-N 3.37Å; D588-G591 WeakPolarHBondContact OD2-CA 3.19Å; D588-G591 PolarHBondContact OD2-N 3.47Å; G591-Q593 VanDerWaalsContact O-CG 3.26Å; G591-Q593 WeakPolarHBondContact O-CG 3.13Å
592	H	94.9	Very high	95.6	Very high	73 Å²	73	39 Å²	39	34%	0.338	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	58.6	-174.8	-59.8	-9.7	0	0	0	111.5	D588 K589 V590 H652 V653 H654	D588-H592 VanDerWaalsContact O-CA 3.28Å; D588-H592 WeakPolarHBondContact O-CA 3.27Å; D588-H592 PolarHBondContact O-N 2.78Å; K589-H592 PolarHBondContact O-CE1 3.48Å; K589-H592 VanDerWaalsContact O-CE1 3.3Å; K589-H592 PolarHBondContact O-ND1 2.96Å; V590-H592 VanDerWaalsContact C-N 3.25Å; V590-H592 PolarHBondContact O-N 2.71Å; H592-H652 CarbonylContact O-C 3.56Å; H592-H652 WeakPolarHBondContact O-CA 3.32Å; H592-H652 PolarHBondContact O-N 3.23Å; H592-V653 CarbonylContact C-O 3.6Å; H592-V653 VanDerWaalsContact C-O 3.29Å; H592-V653 WeakPolarHBondContact CB-O 3.49Å; H592-V653 PolarHBondContact O-N 2.82Å; H592-H654 AromaticContact CD2-CD2 3.56Å; H592-H654 AromaticContact CD2-NE2 3.55Å; H592-H654 AromaticContact NE2-CD2 3.98Å
593	Q	95.4	Very high	95.4	Very high	56 Å²	56	43.3 Å²	43.3	26%	0.262	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	133.7	-173.4	-39.3	-172.5	83.8	0	0	111.4	Y587 D588 G591 I595 V649 Y650 S651	Y587-Q593 WeakPolarHBondContact CD2-O 3.47Å; D588-Q593 HydrophobicContact CB-CB 4.05Å; D588-Q593 HydrophobicContact CB-CG 4.39Å; D588-Q593 PolarHBondContact N-O 3.26Å; D588-Q593 PolarHBondContact O-N 3.35Å; D588-Q593 PolarHBondContact OD2-NE2 3.3Å; G591-Q593 VanDerWaalsContact O-CG 3.26Å; G591-Q593 WeakPolarHBondContact O-CG 3.13Å; Q593-I595 HydrophobicContact CB-CD1 3.97Å; Q593-I595 WeakPolarHBondContact O-CD1 3.31Å; Q593-V649 HydrophobicContact CB-CG1 3.92Å; Q593-Y650 CarbonylContact C-O 3.54Å; Q593-Y650 VanDerWaalsContact CA-O 3.28Å; Q593-Y650 WeakPolarHBondContact CA-O 3.36Å; Q593-S651 PolarHBondContact OE1-OG 3.27Å; Q593-S651 VanDerWaalsContact OE1-OG 3.12Å
594	L	95.5	Very high	95.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.2	165.1	-178.6	71.5	0	0	0	108.7	V596 F621 Y650 V653 L688 L693	L594-V596 HydrophobicContact CD2-CG2 4.24Å; L594-V596 HydrophobicContact CG-CG2 4.18Å; L594-F621 HydrophobicContact CD2-CD2 4.24Å; L594-F621 HydrophobicContact CD2-CE2 3.55Å; L594-F621 HydrophobicContact CD2-CZ 4.43Å; L594-Y650 HydrophobicContact CD2-CD2 4.35Å; L594-Y650 PolarHBondContact N-O 2.8Å; L594-Y650 PolarHBondContact O-N 2.8Å; L594-V653 HydrophobicContact CB-CG2 4.44Å; L594-L688 HydrophobicContact CD2-CD1 4.37Å; L594-L688 HydrophobicContact CD2-CD2 3.71Å; L594-L693 HydrophobicContact CD1-CD2 3.78Å
595	I	96.5	Very high	94.7	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.046	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.4	178	-60.4	76.3	0	0	0	108.4	W586 D588 Q593 T647 V649	W586-I595 HydrophobicContact CD2-CB 3.97Å; W586-I595 HydrophobicContact CD2-CD1 3.94Å; W586-I595 HydrophobicContact CD2-CG1 4.14Å; W586-I595 HydrophobicContact CE3-CD1 3.81Å; W586-I595 HydrophobicContact CE3-CG1 4.47Å; W586-I595 HydrophobicContact CG-CB 4.19Å; W586-I595 HydrophobicContact CH2-CD1 3.72Å; W586-I595 HydrophobicContact CH2-CG1 3.97Å; W586-I595 HydrophobicContact CZ2-CB 4.02Å; W586-I595 HydrophobicContact CZ2-CD1 3.85Å; W586-I595 HydrophobicContact CZ2-CG1 3.6Å; W586-I595 HydrophobicContact CZ2-CG2 4.14Å; W586-I595 HydrophobicContact CZ3-CD1 3.7Å; W586-I595 HydrophobicContact CZ3-CG1 4.39Å; W586-I595 PolarHBondContact N-O 2.88Å; W586-I595 PolarHBondContact O-N 3.11Å; D588-I595 HydrophobicContact CB-CD1 3.94Å; Q593-I595 HydrophobicContact CB-CD1 3.97Å; Q593-I595 WeakPolarHBondContact O-CD1 3.31Å; I595-T647 HydrophobicContact CG2-CG2 3.72Å; I595-V649 HydrophobicContact CG1-CG1 4.42Å; I595-V649 HydrophobicContact CG1-CG2 4.25Å
596	V	97.3	Very high	94.2	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	111.4	-174.6	-177.6	0	0	0	0	109.4	V583 L585 L594 V598 M619 T647 F648 Y650 L663	V583-V596 HydrophobicContact CG1-CG1 4.11Å; L585-V596 HydrophobicContact CD2-CB 4.15Å; L585-V596 HydrophobicContact CD2-CG1 3.87Å; L585-V596 HydrophobicContact CD2-CG2 3.88Å; L594-V596 HydrophobicContact CD2-CG2 4.24Å; L594-V596 HydrophobicContact CG-CG2 4.18Å; V596-V598 HydrophobicContact CG1-CG2 4.31Å; V596-M619 HydrophobicContact CB-CE 4.28Å; V596-M619 HydrophobicContact CG1-CE 3.75Å; V596-M619 HydrophobicContact CG1-SD 3.72Å; V596-T647 CarbonylContact O-C 3.51Å; V596-T647 WeakPolarHBondContact O-CA 3.16Å; V596-F648 PolarHBondContact N-O 2.91Å; V596-F648 PolarHBondContact O-N 3.3Å; V596-Y650 HydrophobicContact CG2-CD2 4.08Å; V596-Y650 HydrophobicContact CG2-CE2 3.89Å; V596-L663 HydrophobicContact CB-CD2 4.39Å; V596-L663 HydrophobicContact CG1-CD2 3.81Å; V596-L663 HydrophobicContact CG2-CD1 4.4Å; V596-L663 HydrophobicContact CG2-CD2 3.62Å
597	N	97.1	Very high	93.8	Very high	20 Å²	20	44 Å²	44	11%	0.107	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	104.1	177.7	-72.9	-37.2	0	0	0	109.7	V583 K584 L599 T647	V583-N597 WeakPolarHBondContact CA-O 3.48Å; K584-N597 HydrophobicContact CB-CB 3.82Å; K584-N597 HydrophobicContact CD-CB 4.35Å; K584-N597 HydrophobicContact CG-CB 4.04Å; K584-N597 PolarHBondContact N-O 3.16Å; K584-N597 WeakPolarHBondContact O-CB 3.29Å; K584-N597 PolarHBondContact O-N 3.07Å; N597-L599 HydrophobicContact CB-CD2 4.13Å; N597-L599 PolarHBondContact O-N 3.13Å; N597-T647 WeakPolarHBondContact OD1-CA 3.26Å; N597-T647 VanDerWaalsContact OD1-CB 3.23Å; N597-T647 WeakPolarHBondContact OD1-CB 3.48Å; N597-T647 VanDerWaalsContact OD1-CG2 3.26Å; N597-T647 WeakPolarHBondContact OD1-CG2 3.48Å; N597-T647 PolarHBondContact OD1-OG1 2.77Å
598	V	97.5	Very high	93.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	107.3	173.8	-176.3	0	0	0	0	108.4	L581 V596 V617 M619 T633 W644 N645 Q646 F648	L581-V598 HydrophobicContact CD1-CG1 4.33Å; V596-V598 HydrophobicContact CG1-CG2 4.31Å; V598-V617 HydrophobicContact CG1-CB 4.35Å; V598-V617 HydrophobicContact CG1-CG1 4.49Å; V598-V617 HydrophobicContact CG1-CG2 3.96Å; V598-M619 HydrophobicContact CG2-CE 3.93Å; V598-M619 HydrophobicContact CG2-SD 3.48Å; V598-M619 WeakPolarHBondContact CG2-SD 3.48Å; V598-T633 HydrophobicContact CB-CG2 4.01Å; V598-T633 HydrophobicContact CG1-CG2 3.92Å; V598-T633 HydrophobicContact CG2-CG2 4.43Å; V598-W644 HydrophobicContact CG1-CD2 4.49Å; V598-W644 HydrophobicContact CG1-CE3 3.96Å; V598-N645 WeakPolarHBondContact O-CA 3.37Å; V598-N645 PolarHBondContact O-N 3.3Å; V598-Q646 PolarHBondContact N-O 3.3Å; V598-Q646 PolarHBondContact O-N 3.41Å; V598-F648 HydrophobicContact CB-CE2 4.43Å; V598-F648 HydrophobicContact CG2-CD2 4.24Å; V598-F648 HydrophobicContact CG2-CE2 4.04Å
599	L	96.9	Very high	92.5	Very high	37 Å²	37	51.2 Å²	51.2	19%	0.194	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-70.7	-169.1	-58.8	180	0	0	0	111.6	S582 K584 N597 W644 N645 P697	S582-L599 PolarHBondContact O-N 2.82Å; K584-L599 HydrophobicContact CB-CD1 4.09Å; N597-L599 HydrophobicContact CB-CD2 4.13Å; N597-L599 PolarHBondContact O-N 3.13Å; L599-W644 PolarHBondContact O-N 3.39Å; L599-N645 PolarHBondContact O-N 3.01Å; L599-N645 PolarHBondContact O-OD1 2.81Å; L599-P697 HydrophobicContact CD1-CB 3.54Å
600	Q	96.8	Very high	91.8	Very high	43 Å²	43	46.3 Å²	46.3	20%	0.201	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	161	-173.9	61.7	-178.7	13	0	0	111.8	S582 P642 K643 W699	S582-Q600 PolarHBondContact N-O 2.93Å; Q600-P642 CarbonylContact C-O 3.5Å; Q600-P642 WeakPolarHBondContact CA-O 3.31Å; Q600-P642 WeakPolarHBondContact CB-O 3.25Å; Q600-K643 HydrophobicContact CB-CB 4.29Å; Q600-K643 HydrophobicContact CB-CD 4.5Å; Q600-K643 HydrophobicContact CB-CG 3.93Å; Q600-K643 VanDerWaalsContact OE1-CE 3.22Å; Q600-W699 HydrophobicContact CG-CH2 3.88Å; Q600-W699 HydrophobicContact CG-CZ2 4.48Å; Q600-W699 VanDerWaalsContact NE2-CH2 3.31Å; Q600-W699 VanDerWaalsContact NE2-CZ2 3.27Å
601	A	96.6	Very high	91.3	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	157	163.4	0	0	0	0	0	111.2	Q580 L581 L604 E641 P642 W644	Q580-A601 CarbonylContact O-C 3.53Å; Q580-A601 WeakPolarHBondContact O-CA 3.43Å; Q580-A601 VanDerWaalsContact O-CB 3.31Å; Q580-A601 WeakPolarHBondContact O-CB 3.19Å; L581-A601 HydrophobicContact CD1-CB 3.89Å; A601-L604 HydrophobicContact CB-CD1 4.09Å; A601-L604 HydrophobicContact CB-CD2 4.04Å; A601-L604 HydrophobicContact CB-CG 4.07Å; A601-E641 CarbonylContact O-C 3.59Å; A601-E641 VanDerWaalsContact O-CA 3.23Å; A601-E641 WeakPolarHBondContact O-CA 3.34Å; A601-P642 HydrophobicContact CB-CG 3.91Å; A601-P642 PolarHBondContact N-O 2.83Å; A601-W644 HydrophobicContact CB-CH2 4.02Å; A601-W644 HydrophobicContact CB-CZ3 3.82Å
602	T	95.1	Very high	90.9	Very high	27 Å²	27	46.9 Å²	46.9	17%	0.166	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	170.1	169.8	54.5	0	0	0	0	109.9	G579 Q580 L604 W699	G579-T602 VanDerWaalsContact CA-O 3.26Å; G579-T602 WeakPolarHBondContact CA-O 3.44Å; Q580-T602 PolarHBondContact N-O 3.32Å; Q580-T602 VanDerWaalsContact N-O 3.08Å; Q580-T602 PolarHBondContact O-N 2.97Å; T602-L604 PolarHBondContact O-N 3.5Å; T602-W699 HydrophobicContact CG2-CH2 3.73Å; T602-W699 HydrophobicContact CG2-CZ3 4.15Å
603	D	92.3	Very high	90.7	Very high	95 Å²	95	43.7 Å²	43.7	51%	0.508	25%	0.25	S	C	.	.	S	Bend	trans	55.3	17.9	171.5	-52.2	-47.7	0	0	0	116.6	P578 G579	P578-D603 CarbonylContact C-O 3.56Å; G579-D603 WeakPolarHBondContact CA-O 3.32Å; G579-D603 PolarHBondContact N-O 3.18Å
604	L	92.7	Very high	90.6	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.016	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-60.4	137.7	-179.4	-63.3	-176.9	0	0	0	111.1	A601 T602 P615 L640 P642 V667 L681 L702	A601-L604 HydrophobicContact CB-CD1 4.09Å; A601-L604 HydrophobicContact CB-CD2 4.04Å; A601-L604 HydrophobicContact CB-CG 4.07Å; T602-L604 PolarHBondContact O-N 3.5Å; L604-P615 HydrophobicContact CD1-CB 3.78Å; L604-P615 HydrophobicContact CD1-CG 4.03Å; L604-L640 WeakPolarHBondContact CB-O 3.33Å; L604-L640 WeakPolarHBondContact CD1-O 3.2Å; L604-L640 VanDerWaalsContact CG-O 3.3Å; L604-L640 WeakPolarHBondContact CG-O 3.48Å; L604-P642 HydrophobicContact CD1-CG 3.83Å; L604-V667 HydrophobicContact CD1-CG1 4.48Å; L604-V667 HydrophobicContact CD2-CG1 4.33Å; L604-L681 HydrophobicContact CD1-CD1 4.25Å; L604-L702 HydrophobicContact CD2-CD1 3.56Å
605	P	87.1	Confident	90.7	Very high	29 Å²	29	41.7 Å²	41.7	19%	0.188	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-62.8	134	-174	23.1	-31.6	0	0	0	110.5	P578 R613 L681	P578-P605 HydrophobicContact CG-CB 4Å; P578-P605 HydrophobicContact CG-CG 4.44Å; P578-P605 WeakPolarHBondContact O-CD 3.22Å; P605-R613 PolarHBondContact O-NE 2.82Å; P605-L681 HydrophobicContact CG-CD2 4.31Å
606	P	85.2	Confident	90.7	Very high	90 Å²	90	41.6 Å²	41.6	58%	0.584	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-61	163.7	171.2	27.6	-34.4	0	0	0	110.6	R613 L640	P606-R613 PolarHBondContact O-NH2 2.95Å; P606-L640 HydrophobicContact CB-CD1 4.44Å
607	R	86.6	Confident	90.7	Very high	28 Å²	28	41.6 Å²	41.6	11%	0.106	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-74.5	143.2	168.5	-70.9	-170.9	170.4	-140.5	-10.1	110.3	D609 G610 R611 R613 D669	R607-D609 WeakPolarHBondContact CB-OD1 2.98Å; R607-D609 WeakPolarHBondContact CD-OD1 3.49Å; R607-D609 IonicContact NH1-OD2 3.77Å; R607-D609 PolarHBondContact O-N 3.23Å; R607-G610 PolarHBondContact O-N 3.35Å; R607-R611 WeakPolarHBondContact CB-O 3.24Å; R607-R611 VanDerWaalsContact CD-O 3.25Å; R607-R611 WeakPolarHBondContact CD-O 3.37Å; R607-R611 WeakPolarHBondContact CG-O 3.47Å; R607-R613 HydrophobicContact CG-CG 4.49Å; R607-D669 IonicContact CZ-OD2 3.88Å; R607-D669 IonicContact NE-OD2 3.71Å; R607-D669 PolarHBondContact NE-OD2 2.89Å; R607-D669 IonicContact NH2-OD1 3.72Å; R607-D669 IonicContact NH2-OD2 3.71Å; R607-D669 PolarHBondContact NH2-OD2 3.35Å
608	V	81.4	Confident	90.6	Very high	160 Å²	160	42.5 Å²	42.5	97%	0.97	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.4	168.7	-62.5	0	0	0	0	113.1	G610	V608-G610 VanDerWaalsContact C-N 3.29Å; V608-G610 PolarHBondContact O-N 2.73Å
609	D	81.4	Confident	90.6	Very high	62 Å²	62	42.5 Å²	42.5	33%	0.332	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	4.5	175.1	72.8	6.6	0	0	0	114	R607 R611	R607-D609 WeakPolarHBondContact CB-OD1 2.98Å; R607-D609 WeakPolarHBondContact CD-OD1 3.49Å; R607-D609 IonicContact NH1-OD2 3.77Å; R607-D609 PolarHBondContact O-N 3.23Å; D609-R611 HydrophobicContact CB-CG 4.32Å; D609-R611 VanDerWaalsContact CG-CG 3.47Å; D609-R611 PolarHBondContact O-N 3.2Å; D609-R611 VanDerWaalsContact O-N 3.08Å; D609-R611 WeakPolarHBondContact OD1-CA 3.28Å; D609-R611 WeakPolarHBondContact OD1-CB 3.03Å; D609-R611 VanDerWaalsContact OD1-CG 3.24Å; D609-R611 WeakPolarHBondContact OD1-CG 3.37Å; D609-R611 PolarHBondContact OD1-N 3.48Å; D609-R611 WeakPolarHBondContact OD2-CD 3.43Å; D609-R611 IonicContact OD2-CZ 3.43Å; D609-R611 VanDerWaalsContact OD2-CZ 3.3Å; D609-R611 IonicContact OD2-NE 2.97Å; D609-R611 PolarHBondContact OD2-NE 2.84Å; D609-R611 IonicContact OD2-NH1 3.71Å; D609-R611 PolarHBondContact OD2-NH1 2.78Å
610	G	79	Confident	90.5	Very high	65 Å²	65	42.7 Å²	42.7	67%	0.67	24%	0.241	S	C	*	.			trans	66.9	0.7	-177	0	0	0	0	0	115.1	R607 V608	R607-G610 PolarHBondContact O-N 3.35Å; V608-G610 VanDerWaalsContact C-N 3.29Å; V608-G610 PolarHBondContact O-N 2.73Å
611	R	81.6	Confident	90.4	Very high	127 Å²	127	41.1 Å²	41.1	48%	0.479	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-81.5	136.9	-177.2	-54.1	177.5	-166.7	140.1	-11.1	109.5	R607 D609 R613	R607-R611 WeakPolarHBondContact CB-O 3.24Å; R607-R611 VanDerWaalsContact CD-O 3.25Å; R607-R611 WeakPolarHBondContact CD-O 3.37Å; R607-R611 WeakPolarHBondContact CG-O 3.47Å; D609-R611 HydrophobicContact CB-CG 4.32Å; D609-R611 VanDerWaalsContact CG-CG 3.47Å; D609-R611 PolarHBondContact O-N 3.2Å; D609-R611 VanDerWaalsContact O-N 3.08Å; D609-R611 WeakPolarHBondContact OD1-CA 3.28Å; D609-R611 WeakPolarHBondContact OD1-CB 3.03Å; D609-R611 VanDerWaalsContact OD1-CG 3.24Å; D609-R611 WeakPolarHBondContact OD1-CG 3.37Å; D609-R611 PolarHBondContact OD1-N 3.48Å; D609-R611 WeakPolarHBondContact OD2-CD 3.43Å; D609-R611 IonicContact OD2-CZ 3.43Å; D609-R611 VanDerWaalsContact OD2-CZ 3.3Å; D609-R611 IonicContact OD2-NE 2.97Å; D609-R611 PolarHBondContact OD2-NE 2.84Å; D609-R611 IonicContact OD2-NH1 3.71Å; D609-R611 PolarHBondContact OD2-NH1 2.78Å; R611-R613 PolarHBondContact O-N 2.99Å
612	P	82.5	Confident	90.2	Very high	59 Å²	59	41.4 Å²	41.4	38%	0.383	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-54.5	130.4	174.9	-30.7	31.7	0	0	0	114.9	K638 R672	P612-K638 HydrophobicContact CB-CB 3.64Å; P612-K638 HydrophobicContact CB-CG 3.99Å; P612-K638 HydrophobicContact CG-CB 4.42Å; P612-R672 VanDerWaalsContact CD-NH2 3.28Å; P612-R672 VanDerWaalsContact N-NH2 3.11Å; P612-R672 PolarHBondContact O-NH2 3.33Å
613	R	90.2	Very high	90	Very high	7 Å²	7	44.8 Å²	44.8	3%	0.026	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-56.7	151.8	172	-64.5	-69.4	-174.8	-172.2	2.3	112.2	P605 P606 R607 R611 K638 L639 L640 D669 E679	P605-R613 PolarHBondContact O-NE 2.82Å; P606-R613 PolarHBondContact O-NH2 2.95Å; R607-R613 HydrophobicContact CG-CG 4.49Å; R611-R613 PolarHBondContact O-N 2.99Å; R613-K638 CarbonylContact O-C 3.5Å; R613-K638 WeakPolarHBondContact O-CA 3.26Å; R613-K638 PolarHBondContact O-N 3.05Å; R613-L639 PolarHBondContact O-N 3.37Å; R613-L640 HydrophobicContact CB-CD2 3.98Å; R613-L640 HydrophobicContact CG-CD2 3.44Å; R613-L640 VanDerWaalsContact CG-CD2 3.44Å; R613-D669 WeakPolarHBondContact CD-OD2 3.42Å; R613-D669 IonicContact CZ-OD2 2.71Å; R613-D669 IonicContact NE-OD2 3.56Å; R613-D669 IonicContact NH1-OD2 3.93Å; R613-D669 PolarHBondContact NH1-OD2 2.74Å; R613-E679 IonicContact CZ-OE1 3.53Å; R613-E679 VanDerWaalsContact CZ-OE1 3.24Å; R613-E679 IonicContact CZ-OE2 3.61Å; R613-E679 IonicContact NH1-OE1 2.71Å; R613-E679 PolarHBondContact NH1-OE1 3.43Å; R613-E679 IonicContact NH1-OE2 3.85Å; R613-E679 PolarHBondContact NH1-OE2 2.87Å; R613-E679 IonicContact NH2-OE1 3.49Å; R613-E679 PolarHBondContact NH2-OE1 2.88Å; R613-E679 IonicContact NH2-OE2 2.77Å
614	N	93.8	Very high	89.8	Confident	13 Å²	13	43.1 Å²	43.1	7%	0.07	25%	0.249	C	C	.	.			trans	-121.6	74	164.8	-47.4	-66.8	0	0	0	110.2	T635 V636 K637 K638 D669 Q670	N614-T635 HydrophobicContact CB-CG2 3.88Å; N614-T635 VanDerWaalsContact O-CG2 3.29Å; N614-T635 WeakPolarHBondContact O-CG2 3.42Å; N614-V636 CarbonylContact C-O 3.52Å; N614-V636 WeakPolarHBondContact CA-O 3.49Å; N614-V636 WeakPolarHBondContact CB-O 3.36Å; N614-K637 WeakPolarHBondContact OD1-CA 3.31Å; N614-K638 PolarHBondContact OD1-N 3.41Å; N614-K638 VanDerWaalsContact OD1-N 3.15Å; N614-D669 PolarHBondContact N-OD1 2.82Å; N614-Q670 HydrophobicContact CB-CB 4.42Å; N614-Q670 WeakPolarHBondContact CB-O 3.39Å; N614-Q670 PolarHBondContact ND2-O 3.04Å; N614-Q670 PolarHBondContact O-N 3.48Å
615	P	96.2	Very high	89.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	149.5	-170.4	31.5	-38.6	0	0	0	114	L604 V636 L639 P642 W644 W668 L681	L604-P615 HydrophobicContact CD1-CB 3.78Å; L604-P615 HydrophobicContact CD1-CG 4.03Å; P615-V636 WeakPolarHBondContact CD-O 3.33Å; P615-V636 PolarHBondContact O-N 3.48Å; P615-L639 VanDerWaalsContact CD-O 3.28Å; P615-L639 WeakPolarHBondContact CD-O 3.42Å; P615-L639 WeakPolarHBondContact CG-O 3.43Å; P615-P642 HydrophobicContact CB-CG 4.08Å; P615-P642 HydrophobicContact CG-CB 3.59Å; P615-P642 HydrophobicContact CG-CG 3.49Å; P615-P642 VanDerWaalsContact CG-CG 3.49Å; P615-W644 HydrophobicContact CB-CZ2 4.1Å; P615-W644 HydrophobicContact CG-CZ2 4.45Å; P615-W668 CarbonylContact C-O 3.55Å; P615-W668 VanDerWaalsContact CA-O 3.27Å; P615-W668 WeakPolarHBondContact CA-O 3.42Å; P615-L681 HydrophobicContact CB-CD1 4.32Å
616	Y	97.1	Very high	89.5	Confident	7 Å²	7	49.2 Å²	49.2	3%	0.027	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	160	170.4	70.7	-88.4	0	0	0	110.3	K618 R632 T635 W668 Q670 S678	Y616-K618 HydrophobicContact CD2-CG 4.28Å; Y616-K618 HydrophobicContact CE2-CD 4.37Å; Y616-K618 HydrophobicContact CE2-CG 3.72Å; Y616-K618 PolarHBondContact OH-NZ 3.41Å; Y616-R632 HydrophobicContact CD2-CG 3.86Å; Y616-R632 VanDerWaalsContact CD2-NH2 3.34Å; Y616-R632 VanDerWaalsContact CE1-NH2 3.27Å; Y616-R632 HydrophobicContact CE2-CG 4.24Å; Y616-R632 VanDerWaalsContact CE2-CZ 3.46Å; Y616-R632 VanDerWaalsContact CZ-NH2 3.32Å; Y616-T635 HydrophobicContact CD1-CG2 4.46Å; Y616-W668 HydrophobicContact CD1-CB 4.01Å; Y616-W668 VanDerWaalsContact CD1-O 3.24Å; Y616-W668 WeakPolarHBondContact CD1-O 3.37Å; Y616-W668 HydrophobicContact CD2-CB 4.2Å; Y616-W668 HydrophobicContact CE1-CB 3.53Å; Y616-W668 HydrophobicContact CE2-CB 3.76Å; Y616-W668 HydrophobicContact CE2-CG 4.11Å; Y616-W668 HydrophobicContact CG-CB 4.35Å; Y616-W668 VanDerWaalsContact CZ-CB 3.41Å; Y616-W668 PolarHBondContact N-O 3.18Å; Y616-W668 PolarHBondContact O-N 3.25Å; Y616-Q670 HydrophobicContact CD1-CB 3.87Å; Y616-Q670 HydrophobicContact CE1-CB 3.78Å; Y616-S678 WeakPolarHBondContact OH-CB 3.35Å; Y616-S678 PolarHBondContact OH-OG 3.24Å
617	V	97.5	Very high	89.5	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	140.7	178.4	-177.6	0	0	0	0	109.5	L581 V598 M619 R632 T633 W644 I665 T666 V667	L581-V617 HydrophobicContact CD1-CG2 4.24Å; V598-V617 HydrophobicContact CG1-CB 4.35Å; V598-V617 HydrophobicContact CG1-CG1 4.49Å; V598-V617 HydrophobicContact CG1-CG2 3.96Å; V617-M619 HydrophobicContact CG1-CG 3.92Å; V617-R632 CarbonylContact O-C 3.58Å; V617-R632 VanDerWaalsContact O-CA 3.25Å; V617-R632 WeakPolarHBondContact O-CA 3.29Å; V617-R632 VanDerWaalsContact O-CG 3.26Å; V617-R632 WeakPolarHBondContact O-CG 3.06Å; V617-T633 HydrophobicContact CB-CG2 4.01Å; V617-T633 HydrophobicContact CG2-CG2 4.49Å; V617-T633 PolarHBondContact N-OG1 3.4Å; V617-T633 PolarHBondContact O-N 3.29Å; V617-W644 HydrophobicContact CG2-CD2 4.31Å; V617-W644 HydrophobicContact CG2-CE3 4.12Å; V617-W644 HydrophobicContact CG2-CH2 3.55Å; V617-W644 HydrophobicContact CG2-CZ2 3.79Å; V617-W644 HydrophobicContact CG2-CZ3 3.75Å; V617-I665 HydrophobicContact CG1-CG2 3.46Å; V617-I665 VanDerWaalsContact CG1-CG2 3.46Å; V617-T666 CarbonylContact C-O 3.59Å; V617-T666 WeakPolarHBondContact CA-O 2.97Å; V617-V667 HydrophobicContact CG2-CG2 4.36Å
618	K	96.1	Very high	89.6	Confident	38 Å²	38	56 Å²	56	17%	0.165	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	147.2	160.2	-54.5	-174.6	-172	80.8	0	108.3	Y616 R631 R632 T666 W668	Y616-K618 HydrophobicContact CD2-CG 4.28Å; Y616-K618 HydrophobicContact CE2-CD 4.37Å; Y616-K618 HydrophobicContact CE2-CG 3.72Å; Y616-K618 PolarHBondContact OH-NZ 3.41Å; K618-R631 CarbonylContact C-O 3.55Å; K618-R631 WeakPolarHBondContact CA-O 3.3Å; K618-R632 HydrophobicContact CG-CG 4.42Å; K618-T666 PolarHBondContact N-O 2.65Å; K618-T666 PolarHBondContact O-N 2.84Å; K618-T666 PolarHBondContact O-OG1 3.29Å; K618-W668 VanDerWaalsContact NZ-CD1 3.29Å; K618-W668 VanDerWaalsContact NZ-NE1 3.2Å
619	M	96	Very high	90.1	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.1	173.2	-50.1	-173.5	-61.2	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 3.75Å; V596-M619 HydrophobicContact CG1-SD 3.72Å; V598-M619 HydrophobicContact CG2-CE 3.93Å; V598-M619 HydrophobicContact CG2-SD 3.48Å; V598-M619 WeakPolarHBondContact CG2-SD 3.48Å; V617-M619 HydrophobicContact CG1-CG 3.92Å; M619-K630 CarbonylContact O-C 3.48Å; M619-K630 VanDerWaalsContact O-CA 3.3Å; M619-K630 WeakPolarHBondContact O-CA 3.3Å; M619-R631 HydrophobicContact CB-CB 4.32Å; M619-R631 HydrophobicContact CE-CB 3.84Å; M619-R631 HydrophobicContact CE-CG 4.34Å; M619-R631 PolarHBondContact N-O 3.05Å; M619-R631 PolarHBondContact O-N 2.95Å; M619-F648 HydrophobicContact CE-CB 4.03Å; M619-F648 HydrophobicContact CE-CD2 3.29Å; M619-F648 HydrophobicContact CE-CE2 3.81Å; M619-F648 HydrophobicContact CE-CG 3.77Å; M619-L663 HydrophobicContact CB-CD1 4.44Å; M619-E664 CarbonylContact C-O 3.48Å; M619-E664 WeakPolarHBondContact CA-O 3.18Å; M619-E664 WeakPolarHBondContact CB-O 3.5Å; M619-I665 HydrophobicContact CG-CB 4.35Å; M619-I665 HydrophobicContact CG-CG1 4.11Å; M619-I665 HydrophobicContact CG-CG2 4.05Å; M619-I665 HydrophobicContact SD-CD1 4.16Å; M619-I665 HydrophobicContact SD-CG1 4.01Å; M619-I665 HydrophobicContact SD-CG2 4.28Å
620	Y	95.6	Very high	90.7	Very high	40 Å²	40	49.4 Å²	49.4	16%	0.157	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	151.4	170.2	-62.7	-87.6	0	0	0	110.7	R625 K630 E664	Y620-R625 HydrophobicContact CD1-CB 4.39Å; Y620-R625 WeakPolarHBondContact CE1-O 2.96Å; Y620-R625 HydrophobicContact CG-CG 4.43Å; Y620-K630 HydrophobicContact CD1-CB 3.94Å; Y620-K630 HydrophobicContact CD1-CG 4.1Å; Y620-K630 HydrophobicContact CE1-CB 3.73Å; Y620-K630 HydrophobicContact CE1-CD 3.77Å; Y620-K630 HydrophobicContact CE1-CG 3.5Å; Y620-K630 WeakPolarHBondContact OH-CE 3.24Å; Y620-K630 PolarHBondContact OH-NZ 3.41Å; Y620-E664 WeakPolarHBondContact CB-OE2 3.4Å; Y620-E664 HydrophobicContact CD2-CG 4.47Å; Y620-E664 WeakPolarHBondContact CD2-OE2 3.44Å; Y620-E664 PolarHBondContact N-O 3.2Å; Y620-E664 PolarHBondContact O-N 3.33Å
621	F	94	Very high	91.5	Very high	11 Å²	11	49.5 Å²	49.5	5%	0.048	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	83.1	-179.3	-167.1	-111.4	0	0	0	110.1	L594 D624 Y650 V653 R661 L688	L594-F621 HydrophobicContact CD2-CD2 4.24Å; L594-F621 HydrophobicContact CD2-CE2 3.55Å; L594-F621 HydrophobicContact CD2-CZ 4.43Å; F621-D624 CarbonylContact C-O 3.52Å; F621-D624 WeakPolarHBondContact O-CB 3.14Å; F621-D624 PolarHBondContact O-N 3.07Å; F621-D624 VanDerWaalsContact O-N 3.16Å; F621-Y650 HydrophobicContact CB-CD1 4.09Å; F621-Y650 HydrophobicContact CB-CE1 3.91Å; F621-Y650 HydrophobicContact CB-CE2 4.4Å; F621-Y650 HydrophobicContact CB-CG 4.43Å; F621-Y650 AromaticContact CD2-CD2 3.98Å; F621-Y650 HydrophobicContact CD2-CD2 3.98Å; F621-Y650 HydrophobicContact CD2-CE2 4.17Å; F621-Y650 HydrophobicContact CD2-CG 4.24Å; F621-Y650 HydrophobicContact CG-CD1 4.33Å; F621-Y650 HydrophobicContact CG-CD2 4.39Å; F621-Y650 HydrophobicContact CG-CG 4.24Å; F621-V653 HydrophobicContact CD1-CG2 4.38Å; F621-V653 HydrophobicContact CE1-CB 4.4Å; F621-V653 HydrophobicContact CE1-CG1 3.93Å; F621-V653 HydrophobicContact CE1-CG2 3.53Å; F621-V653 HydrophobicContact CE2-CG2 4.45Å; 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 3.49Å; F621-L688 HydrophobicContact CE2-CD1 3.4Å; F621-L688 VanDerWaalsContact CE2-CD1 3.4Å; F621-L688 HydrophobicContact CZ-CD1 3.55Å
622	L	92.9	Very high	92.2	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	149.6	-169.1	-59.1	-172.3	0	0	0	111.9	D624 R625 R661 M662 E664 L685 L710	L622-D624 VanDerWaalsContact C-N 3.32Å; L622-R625 HydrophobicContact CD2-CG 3.45Å; L622-R625 VanDerWaalsContact CD2-CG 3.45Å; L622-R661 WeakPolarHBondContact O-CA 3.1Å; L622-R661 WeakPolarHBondContact O-CB 3.46Å; L622-R661 WeakPolarHBondContact O-CG 3.42Å; L622-M662 HydrophobicContact CB-CB 4.35Å; L622-M662 WeakPolarHBondContact CB-O 3.28Å; L622-M662 HydrophobicContact CD1-CB 4.44Å; L622-M662 PolarHBondContact N-O 2.92Å; L622-E664 HydrophobicContact CD1-CB 3.87Å; L622-E664 HydrophobicContact CD2-CB 4.29Å; L622-E664 HydrophobicContact CG-CB 3.89Å; L622-L685 HydrophobicContact CD1-CD2 4.02Å; L622-L710 HydrophobicContact CD1-CD2 3.66Å
623	P	91.3	Very high	92.9	Very high	98 Å²	98	46 Å²	46	64%	0.636	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	cis	-80.3	4.4	3.2	33.3	-37.3	0	0	0	115.1	R625	P623-R625 PolarHBondContact O-N 3.3Å
624	D	87	Confident	93.2	Very high	59 Å²	59	53.5 Å²	53.5	32%	0.316	25%	0.25	S	C	.	.	B	Isolated β-bridge	trans	-76.1	113.7	174.8	-174.4	3.2	0	0	0	109.8	F621 L622 S626 S629	F621-D624 CarbonylContact C-O 3.52Å; F621-D624 WeakPolarHBondContact O-CB 3.14Å; F621-D624 PolarHBondContact O-N 3.07Å; F621-D624 VanDerWaalsContact O-N 3.16Å; L622-D624 VanDerWaalsContact C-N 3.32Å; D624-S626 WeakPolarHBondContact OD1-CB 3.34Å; D624-S626 PolarHBondContact OD1-N 2.9Å; D624-S626 PolarHBondContact OD1-OG 3.3Å; D624-S626 PolarHBondContact OD2-OG 2.89Å; D624-S629 VanDerWaalsContact C-OG 3.25Å; D624-S629 WeakPolarHBondContact O-CB 3.4Å; D624-S629 PolarHBondContact O-OG 3.42Å
625	R	88.5	Confident	93.3	Very high	117 Å²	117	54.8 Å²	54.8	44%	0.442	26%	0.258	S	S	.	.			trans	-104.5	13.1	170.7	-77.2	-169.2	168.9	170.6	7.1	113.3	Y620 L622 P623 E664	Y620-R625 HydrophobicContact CD1-CB 4.39Å; Y620-R625 WeakPolarHBondContact CE1-O 2.96Å; Y620-R625 HydrophobicContact CG-CG 4.43Å; L622-R625 HydrophobicContact CD2-CG 3.45Å; L622-R625 VanDerWaalsContact CD2-CG 3.45Å; P623-R625 PolarHBondContact O-N 3.3Å; R625-E664 IonicContact CZ-OE1 2.85Å; R625-E664 IonicContact CZ-OE2 2.67Å; R625-E664 IonicContact NE-OE1 3.3Å; R625-E664 IonicContact NE-OE2 2.75Å; R625-E664 PolarHBondContact NE-OE2 2.95Å; R625-E664 IonicContact NH2-OE1 2.85Å; R625-E664 PolarHBondContact NH2-OE1 3.23Å; R625-E664 IonicContact NH2-OE2 3.21Å
626	S	86.1	Confident	93.2	Very high	44 Å²	44	56 Å²	56	31%	0.308	27%	0.266	S	S	.	.	S	Bend	trans	-71	165.8	178	74.5	0	0	0	0	113	D624 K628 S629 K630	D624-S626 WeakPolarHBondContact OD1-CB 3.34Å; D624-S626 PolarHBondContact OD1-N 2.9Å; D624-S626 PolarHBondContact OD1-OG 3.3Å; D624-S626 PolarHBondContact OD2-OG 2.89Å; S626-K628 PolarHBondContact O-N 2.95Å; S626-K628 PolarHBondContact OG-N 3.04Å; S626-S629 PolarHBondContact O-N 3.03Å; S626-S629 VanDerWaalsContact O-N 3.15Å; S626-S629 PolarHBondContact O-OG 3.19Å; S626-K630 PolarHBondContact O-N 3.15Å
627	D	85.3	Confident	93	Very high	121 Å²	121	63.4 Å²	63.4	65%	0.647	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-8.1	172.8	-84.2	-8.3	0	0	0	113.9	K630	D627-K630 WeakPolarHBondContact OD1-CD 3.18Å; D627-K630 WeakPolarHBondContact OD1-CE 3.2Å; D627-K630 IonicContact OD1-NZ 3.82Å; D627-K630 PolarHBondContact OD1-NZ 2.91Å
628	K	87.5	Confident	92.6	Very high	140 Å²	140	70 Å²	70	61%	0.609	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-39.2	173.1	-64.8	-176.9	-178.4	177.2	0	113.7	S626 K630 R631	S626-K628 PolarHBondContact O-N 2.95Å; S626-K628 PolarHBondContact OG-N 3.04Å; K628-K630 VanDerWaalsContact C-N 3.33Å; K628-R631 PolarHBondContact O-NH1 2.92Å
629	S	91.6	Very high	92.4	Very high	5 Å²	5	72.3 Å²	72.3	4%	0.035	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-16.1	176.6	66.5	0	0	0	0	112.2	D624 S626 Y650	D624-S629 VanDerWaalsContact C-OG 3.25Å; D624-S629 WeakPolarHBondContact O-CB 3.4Å; D624-S629 PolarHBondContact O-OG 3.42Å; S626-S629 PolarHBondContact O-N 3.03Å; S626-S629 VanDerWaalsContact O-N 3.15Å; S626-S629 PolarHBondContact O-OG 3.19Å; S629-Y650 WeakPolarHBondContact O-CE1 3.45Å; S629-Y650 PolarHBondContact O-OH 3.06Å
630	K	94.7	Very high	92.1	Very high	78 Å²	78	75.6 Å²	75.6	34%	0.339	36%	0.358	S	S	.	.			trans	-66.4	135.6	179.2	-161.6	172.6	-159.2	150.4	0	112.4	M619 Y620 S626 D627 K628	M619-K630 CarbonylContact O-C 3.48Å; M619-K630 VanDerWaalsContact O-CA 3.3Å; M619-K630 WeakPolarHBondContact O-CA 3.3Å; Y620-K630 HydrophobicContact CD1-CB 3.94Å; Y620-K630 HydrophobicContact CD1-CG 4.1Å; Y620-K630 HydrophobicContact CE1-CB 3.73Å; Y620-K630 HydrophobicContact CE1-CD 3.77Å; Y620-K630 HydrophobicContact CE1-CG 3.5Å; Y620-K630 WeakPolarHBondContact OH-CE 3.24Å; Y620-K630 PolarHBondContact OH-NZ 3.41Å; S626-K630 PolarHBondContact O-N 3.15Å; D627-K630 WeakPolarHBondContact OD1-CD 3.18Å; D627-K630 WeakPolarHBondContact OD1-CE 3.2Å; D627-K630 IonicContact OD1-NZ 3.82Å; D627-K630 PolarHBondContact OD1-NZ 2.91Å; K628-K630 VanDerWaalsContact C-N 3.33Å
631	R	96.2	Very high	92	Very high	66 Å²	66	79.3 Å²	79.3	25%	0.249	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	157.9	167.5	-59.3	-66.6	-178.3	-91.2	-1.7	109.5	K618 M619 K628 F648 V649 Y650	K618-R631 CarbonylContact C-O 3.55Å; K618-R631 WeakPolarHBondContact CA-O 3.3Å; M619-R631 HydrophobicContact CB-CB 4.32Å; M619-R631 HydrophobicContact CE-CB 3.84Å; M619-R631 HydrophobicContact CE-CG 4.34Å; M619-R631 PolarHBondContact N-O 3.05Å; M619-R631 PolarHBondContact O-N 2.95Å; K628-R631 PolarHBondContact O-NH1 2.92Å; R631-F648 HydrophobicContact CB-CB 4.46Å; R631-F648 HydrophobicContact CB-CD1 3.76Å; R631-F648 HydrophobicContact CB-CE1 4.03Å; R631-F648 HydrophobicContact CB-CG 4.03Å; R631-F648 HydrophobicContact CG-CB 4.03Å; R631-F648 HydrophobicContact CG-CD1 3.97Å; R631-F648 HydrophobicContact CG-CG 4.12Å; R631-V649 PolarHBondContact NH2-O 2.85Å; R631-Y650 HydrophobicContact CG-CE1 3.71Å; R631-Y650 VanDerWaalsContact CG-OH 3.25Å; R631-Y650 WeakPolarHBondContact CG-OH 3.19Å
632	R	96.3	Very high	92.1	Very high	108 Å²	108	78.8 Å²	78.8	41%	0.408	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	135.5	177.9	-168.1	-166.1	169.3	179.2	-0.5	111.1	Y616 V617 K618 T635 F648	Y616-R632 HydrophobicContact CD2-CG 3.86Å; Y616-R632 VanDerWaalsContact CD2-NH2 3.34Å; Y616-R632 VanDerWaalsContact CE1-NH2 3.27Å; Y616-R632 HydrophobicContact CE2-CG 4.24Å; Y616-R632 VanDerWaalsContact CE2-CZ 3.46Å; Y616-R632 VanDerWaalsContact CZ-NH2 3.32Å; V617-R632 CarbonylContact O-C 3.58Å; V617-R632 VanDerWaalsContact O-CA 3.25Å; V617-R632 WeakPolarHBondContact O-CA 3.29Å; V617-R632 VanDerWaalsContact O-CG 3.26Å; V617-R632 WeakPolarHBondContact O-CG 3.06Å; K618-R632 HydrophobicContact CG-CG 4.42Å; R632-T635 PolarHBondContact NH2-OG1 3.12Å; R632-T635 VanDerWaalsContact NH2-OG1 3.14Å; R632-F648 WeakPolarHBondContact O-CE1 3.49Å; R632-F648 WeakPolarHBondContact O-CZ 3.37Å
633	T	97.5	Very high	92.3	Very high	5 Å²	5	84.7 Å²	84.7	3%	0.031	40%	0.399	C	S	.	.			trans	-78.8	160.1	172.4	63.4	0	0	0	0	112.9	V598 V617 W644 Q646 F648	V598-T633 HydrophobicContact CB-CG2 4.01Å; V598-T633 HydrophobicContact CG1-CG2 3.92Å; V598-T633 HydrophobicContact CG2-CG2 4.43Å; V617-T633 HydrophobicContact CB-CG2 4.01Å; V617-T633 HydrophobicContact CG2-CG2 4.49Å; V617-T633 PolarHBondContact N-OG1 3.4Å; V617-T633 PolarHBondContact O-N 3.29Å; T633-W644 VanDerWaalsContact CB-CD1 3.47Å; T633-W644 HydrophobicContact CG2-CB 4.13Å; T633-W644 HydrophobicContact CG2-CD2 4.47Å; T633-W644 HydrophobicContact CG2-CG 3.99Å; T633-W644 VanDerWaalsContact OG1-CD1 3.26Å; T633-W644 PolarHBondContact OG1-NE1 2.72Å; T633-W644 VanDerWaalsContact OG1-NE1 3.14Å; T633-Q646 VanDerWaalsContact CA-OE1 3.28Å; T633-Q646 HydrophobicContact CG2-CB 4.34Å; T633-F648 HydrophobicContact CG2-CE2 3.75Å; T633-F648 HydrophobicContact CG2-CZ 3.8Å
634	K	95.9	Very high	92.5	Very high	164 Å²	164	81.1 Å²	81.1	71%	0.713	37%	0.373	S	S	*	.			trans	-59.1	138.3	167.1	-68.1	176.6	179.8	174.8	0	110.3	V636 W644	K634-V636 PolarHBondContact O-N 2.76Å; K634-W644 PolarHBondContact O-NE1 2.91Å
635	T	95.3	Very high	92.9	Very high	40 Å²	40	83.8 Å²	83.8	25%	0.245	39%	0.388	C	S	.	.			trans	-72.7	114.1	176.6	-53.9	0	0	0	0	111.2	N614 Y616 R632 Q670	N614-T635 HydrophobicContact CB-CG2 3.88Å; N614-T635 VanDerWaalsContact O-CG2 3.29Å; N614-T635 WeakPolarHBondContact O-CG2 3.42Å; Y616-T635 HydrophobicContact CD1-CG2 4.46Å; R632-T635 PolarHBondContact NH2-OG1 3.12Å; R632-T635 VanDerWaalsContact NH2-OG1 3.14Å; T635-Q670 HydrophobicContact CG2-CB 3.79Å; T635-Q670 PolarHBondContact OG1-OE1 3.14Å; T635-Q670 VanDerWaalsContact OG1-OE1 3.06Å
636	V	94.5	Very high	93.3	Very high	27 Å²	27	80.5 Å²	80.5	16%	0.164	38%	0.377	C	S	.	.			trans	-78.5	140	170.6	176.8	0	0	0	0	107.8	N614 P615 K634 L639 P642 W644	N614-V636 CarbonylContact C-O 3.52Å; N614-V636 WeakPolarHBondContact CA-O 3.49Å; N614-V636 WeakPolarHBondContact CB-O 3.36Å; P615-V636 WeakPolarHBondContact CD-O 3.33Å; P615-V636 PolarHBondContact O-N 3.48Å; K634-V636 PolarHBondContact O-N 2.76Å; V636-L639 HydrophobicContact CG1-CB 4.17Å; V636-L639 HydrophobicContact CG1-CD1 3.77Å; V636-L639 HydrophobicContact CG1-CG 4.34Å; V636-P642 HydrophobicContact CB-CB 3.8Å; V636-P642 HydrophobicContact CG1-CB 3.9Å; V636-P642 HydrophobicContact CG2-CB 4.01Å; V636-W644 HydrophobicContact CG2-CG 4.4Å
637	K	92.5	Very high	93.8	Very high	161 Å²	161	82.1 Å²	82.1	70%	0.7	39%	0.386	S	S	*	.			trans	-110.3	135.6	-171.8	-64.8	176.2	-175	169.9	0	111.4	N614 L639	N614-K637 WeakPolarHBondContact OD1-CA 3.31Å; K637-L639 PolarHBondContact O-N 3.44Å
638	K	90.3	Very high	94.4	Very high	140 Å²	140	77.3 Å²	77.3	61%	0.609	36%	0.359	S	S	*	.	S	Bend	trans	58	35.5	173.9	-52.6	-174.2	179.6	-179.9	0	115.9	P612 R613 N614	P612-K638 HydrophobicContact CB-CB 3.64Å; P612-K638 HydrophobicContact CB-CG 3.99Å; P612-K638 HydrophobicContact CG-CB 4.42Å; R613-K638 CarbonylContact O-C 3.5Å; R613-K638 WeakPolarHBondContact O-CA 3.26Å; R613-K638 PolarHBondContact O-N 3.05Å; N614-K638 PolarHBondContact OD1-N 3.41Å; N614-K638 VanDerWaalsContact OD1-N 3.15Å
639	L	90.6	Very high	94.8	Very high	86 Å²	86	73.2 Å²	73.2	45%	0.45	35%	0.346	S	S	.	.			trans	-131	142.2	177.2	-68.7	176.2	0	0	0	111.3	R613 P615 V636 K637	R613-L639 PolarHBondContact O-N 3.37Å; P615-L639 VanDerWaalsContact CD-O 3.28Å; P615-L639 WeakPolarHBondContact CD-O 3.42Å; P615-L639 WeakPolarHBondContact CG-O 3.43Å; V636-L639 HydrophobicContact CG1-CB 4.17Å; V636-L639 HydrophobicContact CG1-CD1 3.77Å; V636-L639 HydrophobicContact CG1-CG 4.34Å; K637-L639 PolarHBondContact O-N 3.44Å
640	L	90.8	Very high	95	Very high	71 Å²	71	73.4 Å²	73.4	37%	0.372	35%	0.345	S	S	.	.	S	Bend	trans	-89.1	-20.9	167.1	-57	-178.3	0	0	0	111.7	L604 P606 R613 P642	L604-L640 WeakPolarHBondContact CB-O 3.33Å; L604-L640 WeakPolarHBondContact CD1-O 3.2Å; L604-L640 VanDerWaalsContact CG-O 3.3Å; L604-L640 WeakPolarHBondContact CG-O 3.48Å; P606-L640 HydrophobicContact CB-CD1 4.44Å; R613-L640 HydrophobicContact CB-CD2 3.98Å; R613-L640 HydrophobicContact CG-CD2 3.44Å; R613-L640 VanDerWaalsContact CG-CD2 3.44Å; L640-P642 WeakPolarHBondContact O-CD 3.46Å
641	E	93.9	Very high	94.9	Very high	117 Å²	117	72.6 Å²	72.6	55%	0.547	35%	0.35	S	S	.	.	S	Bend	trans	-111.5	71.6	174.3	-57.8	-173.7	138.7	0	0	110.9	A601	A601-E641 CarbonylContact O-C 3.59Å; A601-E641 VanDerWaalsContact O-CA 3.23Å; A601-E641 WeakPolarHBondContact O-CA 3.34Å
642	P	95.3	Very high	94.6	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	37%	0.372	C	S	.	.			trans	-72	138	-179.2	31.4	-37.7	0	0	0	111.9	Q600 A601 L604 P615 V636 L640 W644	Q600-P642 CarbonylContact C-O 3.5Å; Q600-P642 WeakPolarHBondContact CA-O 3.31Å; Q600-P642 WeakPolarHBondContact CB-O 3.25Å; A601-P642 HydrophobicContact CB-CG 3.91Å; A601-P642 PolarHBondContact N-O 2.83Å; L604-P642 HydrophobicContact CD1-CG 3.83Å; P615-P642 HydrophobicContact CB-CG 4.08Å; P615-P642 HydrophobicContact CG-CB 3.59Å; P615-P642 HydrophobicContact CG-CG 3.49Å; P615-P642 VanDerWaalsContact CG-CG 3.49Å; V636-P642 HydrophobicContact CB-CB 3.8Å; V636-P642 HydrophobicContact CG1-CB 3.9Å; V636-P642 HydrophobicContact CG2-CB 4.01Å; L640-P642 WeakPolarHBondContact O-CD 3.46Å; P642-W644 HydrophobicContact CB-CD2 4.39Å; P642-W644 HydrophobicContact CB-CH2 3.91Å; P642-W644 HydrophobicContact CB-CZ2 3.71Å; P642-W644 HydrophobicContact CB-CZ3 4.29Å; P642-W644 HydrophobicContact CG-CE3 4.4Å; P642-W644 HydrophobicContact CG-CH2 3.24Å; P642-W644 HydrophobicContact CG-CZ2 3.53Å; P642-W644 HydrophobicContact CG-CZ3 3.71Å
643	K	96.4	Very high	94.4	Very high	131 Å²	131	71.9 Å²	71.9	57%	0.57	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.4	166.8	-48.2	-159.8	-176	-141.6	0	108.9	Q600	Q600-K643 HydrophobicContact CB-CB 4.29Å; Q600-K643 HydrophobicContact CB-CD 4.5Å; Q600-K643 HydrophobicContact CB-CG 3.93Å; Q600-K643 VanDerWaalsContact OE1-CE 3.22Å
644	W	96.7	Very high	94.1	Very high	24 Å²	24	74.2 Å²	74.2	9%	0.091	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-40.9	-179.6	-66.2	-72.6	0	0	0	112.2	L581 V598 L599 A601 P615 V617 T633 K634 V636 P642 Q646 V667	L581-W644 HydrophobicContact CD1-CE3 4.29Å; L581-W644 HydrophobicContact CD1-CH2 4.25Å; L581-W644 HydrophobicContact CD1-CZ3 3.49Å; L581-W644 VanDerWaalsContact CD1-CZ3 3.49Å; V598-W644 HydrophobicContact CG1-CD2 4.49Å; V598-W644 HydrophobicContact CG1-CE3 3.96Å; L599-W644 PolarHBondContact O-N 3.39Å; A601-W644 HydrophobicContact CB-CH2 4.02Å; A601-W644 HydrophobicContact CB-CZ3 3.82Å; P615-W644 HydrophobicContact CB-CZ2 4.1Å; P615-W644 HydrophobicContact CG-CZ2 4.45Å; V617-W644 HydrophobicContact CG2-CD2 4.31Å; V617-W644 HydrophobicContact CG2-CE3 4.12Å; V617-W644 HydrophobicContact CG2-CH2 3.55Å; V617-W644 HydrophobicContact CG2-CZ2 3.79Å; V617-W644 HydrophobicContact CG2-CZ3 3.75Å; T633-W644 VanDerWaalsContact CB-CD1 3.47Å; T633-W644 HydrophobicContact CG2-CB 4.13Å; T633-W644 HydrophobicContact CG2-CD2 4.47Å; T633-W644 HydrophobicContact CG2-CG 3.99Å; T633-W644 VanDerWaalsContact OG1-CD1 3.26Å; T633-W644 PolarHBondContact OG1-NE1 2.72Å; T633-W644 VanDerWaalsContact OG1-NE1 3.14Å; K634-W644 PolarHBondContact O-NE1 2.91Å; V636-W644 HydrophobicContact CG2-CG 4.4Å; P642-W644 HydrophobicContact CB-CD2 4.39Å; P642-W644 HydrophobicContact CB-CH2 3.91Å; P642-W644 HydrophobicContact CB-CZ2 3.71Å; P642-W644 HydrophobicContact CB-CZ3 4.29Å; P642-W644 HydrophobicContact CG-CE3 4.4Å; P642-W644 HydrophobicContact CG-CH2 3.24Å; P642-W644 HydrophobicContact CG-CZ2 3.53Å; P642-W644 HydrophobicContact CG-CZ3 3.71Å; W644-Q646 HydrophobicContact CB-CB 4.43Å; W644-Q646 PolarHBondContact O-N 3.32Å; W644-V667 HydrophobicContact CH2-CG1 4.42Å
645	N	95.7	Very high	93.8	Very high	115 Å²	115	72.1 Å²	72.1	62%	0.615	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	42.9	50.3	-176	-63.7	-11.6	0	0	0	112.3	V598 L599	V598-N645 WeakPolarHBondContact O-CA 3.37Å; V598-N645 PolarHBondContact O-N 3.3Å; L599-N645 PolarHBondContact O-N 3.01Å; L599-N645 PolarHBondContact O-OD1 2.81Å
646	Q	96.6	Very high	93.6	Very high	47 Å²	47	78.6 Å²	78.6	22%	0.22	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	114.1	-170.7	-168.7	173.3	-15.9	0	0	111.7	V598 T633 W644 F648	V598-Q646 PolarHBondContact N-O 3.3Å; V598-Q646 PolarHBondContact O-N 3.41Å; T633-Q646 VanDerWaalsContact CA-OE1 3.28Å; T633-Q646 HydrophobicContact CG2-CB 4.34Å; W644-Q646 HydrophobicContact CB-CB 4.43Å; W644-Q646 PolarHBondContact O-N 3.32Å; Q646-F648 HydrophobicContact CB-CE2 4.14Å; Q646-F648 HydrophobicContact CB-CZ 4.28Å; Q646-F648 VanDerWaalsContact CD-CZ 3.43Å; Q646-F648 HydrophobicContact CG-CE1 4.15Å; Q646-F648 HydrophobicContact CG-CE2 3.89Å; Q646-F648 HydrophobicContact CG-CZ 3.64Å; Q646-F648 VanDerWaalsContact NE2-CE1 3.28Å; Q646-F648 VanDerWaalsContact NE2-CZ 3.29Å; Q646-F648 WeakPolarHBondContact O-CD2 3.46Å; Q646-F648 WeakPolarHBondContact O-CE2 3.42Å
647	T	96.9	Very high	93.4	Very high	79 Å²	79	78.7 Å²	78.7	49%	0.485	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	142.4	172.6	-50.9	0	0	0	0	111.6	I595 V596 N597	I595-T647 HydrophobicContact CG2-CG2 3.72Å; V596-T647 CarbonylContact O-C 3.51Å; V596-T647 WeakPolarHBondContact O-CA 3.16Å; N597-T647 WeakPolarHBondContact OD1-CA 3.26Å; N597-T647 VanDerWaalsContact OD1-CB 3.23Å; N597-T647 WeakPolarHBondContact OD1-CB 3.48Å; N597-T647 VanDerWaalsContact OD1-CG2 3.26Å; N597-T647 WeakPolarHBondContact OD1-CG2 3.48Å; N597-T647 PolarHBondContact OD1-OG1 2.77Å
648	F	97	Very high	93.4	Very high	20 Å²	20	71.1 Å²	71.1	9%	0.088	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145	168	-55.6	-84.6	0	0	0	109.7	V596 V598 M619 R631 R632 T633 Q646	V596-F648 PolarHBondContact N-O 2.91Å; V596-F648 PolarHBondContact O-N 3.3Å; V598-F648 HydrophobicContact CB-CE2 4.43Å; V598-F648 HydrophobicContact CG2-CD2 4.24Å; V598-F648 HydrophobicContact CG2-CE2 4.04Å; M619-F648 HydrophobicContact CE-CB 4.03Å; M619-F648 HydrophobicContact CE-CD2 3.29Å; M619-F648 HydrophobicContact CE-CE2 3.81Å; M619-F648 HydrophobicContact CE-CG 3.77Å; R631-F648 HydrophobicContact CB-CB 4.46Å; R631-F648 HydrophobicContact CB-CD1 3.76Å; R631-F648 HydrophobicContact CB-CE1 4.03Å; R631-F648 HydrophobicContact CB-CG 4.03Å; R631-F648 HydrophobicContact CG-CB 4.03Å; R631-F648 HydrophobicContact CG-CD1 3.97Å; R631-F648 HydrophobicContact CG-CG 4.12Å; R632-F648 WeakPolarHBondContact O-CE1 3.49Å; R632-F648 WeakPolarHBondContact O-CZ 3.37Å; T633-F648 HydrophobicContact CG2-CE2 3.75Å; T633-F648 HydrophobicContact CG2-CZ 3.8Å; Q646-F648 HydrophobicContact CB-CE2 4.14Å; Q646-F648 HydrophobicContact CB-CZ 4.28Å; Q646-F648 VanDerWaalsContact CD-CZ 3.43Å; Q646-F648 HydrophobicContact CG-CE1 4.15Å; Q646-F648 HydrophobicContact CG-CE2 3.89Å; Q646-F648 HydrophobicContact CG-CZ 3.64Å; Q646-F648 VanDerWaalsContact NE2-CE1 3.28Å; Q646-F648 VanDerWaalsContact NE2-CZ 3.29Å; Q646-F648 WeakPolarHBondContact O-CD2 3.46Å; Q646-F648 WeakPolarHBondContact O-CE2 3.42Å
649	V	96.1	Very high	93.4	Very high	54 Å²	54	73.1 Å²	73.1	33%	0.327	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.3	179	-172.4	0	0	0	0	110.1	Q593 I595 R631	Q593-V649 HydrophobicContact CB-CG1 3.92Å; I595-V649 HydrophobicContact CG1-CG1 4.42Å; I595-V649 HydrophobicContact CG1-CG2 4.25Å; R631-V649 PolarHBondContact NH2-O 2.85Å
650	Y	95.2	Very high	93.3	Very high	8 Å²	8	75.6 Å²	75.6	3%	0.031	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	102.7	167.1	-61.4	-67.6	0	0	0	108.7	Q593 L594 V596 F621 S629 R631 V653 L663	Q593-Y650 CarbonylContact C-O 3.54Å; Q593-Y650 VanDerWaalsContact CA-O 3.28Å; Q593-Y650 WeakPolarHBondContact CA-O 3.36Å; L594-Y650 HydrophobicContact CD2-CD2 4.35Å; L594-Y650 PolarHBondContact N-O 2.8Å; L594-Y650 PolarHBondContact O-N 2.8Å; V596-Y650 HydrophobicContact CG2-CD2 4.08Å; V596-Y650 HydrophobicContact CG2-CE2 3.89Å; F621-Y650 HydrophobicContact CB-CD1 4.09Å; F621-Y650 HydrophobicContact CB-CE1 3.91Å; F621-Y650 HydrophobicContact CB-CE2 4.4Å; F621-Y650 HydrophobicContact CB-CG 4.43Å; F621-Y650 AromaticContact CD2-CD2 3.98Å; F621-Y650 HydrophobicContact CD2-CD2 3.98Å; F621-Y650 HydrophobicContact CD2-CE2 4.17Å; F621-Y650 HydrophobicContact CD2-CG 4.24Å; F621-Y650 HydrophobicContact CG-CD1 4.33Å; F621-Y650 HydrophobicContact CG-CD2 4.39Å; F621-Y650 HydrophobicContact CG-CG 4.24Å; S629-Y650 WeakPolarHBondContact O-CE1 3.45Å; S629-Y650 PolarHBondContact O-OH 3.06Å; R631-Y650 HydrophobicContact CG-CE1 3.71Å; R631-Y650 VanDerWaalsContact CG-OH 3.25Å; R631-Y650 WeakPolarHBondContact CG-OH 3.19Å; Y650-V653 WeakPolarHBondContact O-CG2 3.23Å; Y650-L663 HydrophobicContact CE2-CD1 3.76Å
651	S	93.1	Very high	93.3	Very high	62 Å²	62	75.6 Å²	75.6	43%	0.434	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	159.7	177.7	-45.1	0	0	0	0	111.9	Q593 V653	Q593-S651 PolarHBondContact OE1-OG 3.27Å; Q593-S651 VanDerWaalsContact OE1-OG 3.12Å; S651-V653 VanDerWaalsContact C-N 3.27Å; S651-V653 PolarHBondContact O-N 3.44Å
652	H	89.2	Confident	93.3	Very high	154 Å²	154	71.3 Å²	71.3	71%	0.713	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	16.8	-176.5	-43.2	-64.6	0	0	0	115.8	H592 H654	H592-H652 CarbonylContact O-C 3.56Å; H592-H652 WeakPolarHBondContact O-CA 3.32Å; H592-H652 PolarHBondContact O-N 3.23Å; H652-H654 PolarHBondContact O-CE1 2.68Å; H652-H654 PolarHBondContact O-ND1 2.86Å
653	V	92.4	Very high	93.3	Very high	5 Å²	5	71.3 Å²	71.3	3%	0.03	33%	0.327	C	S	.	.			trans	-83.2	118.6	173.5	-170.7	0	0	0	0	108.9	Y587 H592 L594 F621 Y650 S651 F658	Y587-V653 VanDerWaalsContact CE2-O 3.27Å; Y587-V653 WeakPolarHBondContact CE2-O 3.24Å; Y587-V653 PolarHBondContact OH-O 3.25Å; Y587-V653 VanDerWaalsContact OH-O 3.07Å; H592-V653 CarbonylContact C-O 3.6Å; H592-V653 VanDerWaalsContact C-O 3.29Å; H592-V653 WeakPolarHBondContact CB-O 3.49Å; H592-V653 PolarHBondContact O-N 2.82Å; L594-V653 HydrophobicContact CB-CG2 4.44Å; F621-V653 HydrophobicContact CD1-CG2 4.38Å; F621-V653 HydrophobicContact CE1-CB 4.4Å; F621-V653 HydrophobicContact CE1-CG1 3.93Å; F621-V653 HydrophobicContact CE1-CG2 3.53Å; F621-V653 HydrophobicContact CE2-CG2 4.45Å; 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 3.23Å; S651-V653 VanDerWaalsContact C-N 3.27Å; S651-V653 PolarHBondContact O-N 3.44Å; V653-F658 HydrophobicContact CG1-CD1 4.17Å; V653-F658 HydrophobicContact CG1-CE1 3.64Å
654	H	92.2	Very high	93.2	Very high	54 Å²	54	65.3 Å²	65.3	25%	0.25	30%	0.301	C	S	.	.			trans	-97.9	145.3	179.6	-60.3	61.5	0	0	0	110	H592 H652 R656 D657 F658	H592-H654 AromaticContact CD2-CD2 3.56Å; H592-H654 AromaticContact CD2-NE2 3.55Å; H592-H654 AromaticContact NE2-CD2 3.98Å; H652-H654 PolarHBondContact O-CE1 2.68Å; H652-H654 PolarHBondContact O-ND1 2.86Å; H654-R656 HydrophobicContact CB-CG 4.02Å; H654-R656 PolarHBondContact CD2-NH2 2.98Å; H654-R656 VanDerWaalsContact CD2-NH2 3.29Å; H654-R656 PolarHBondContact NE2-NH2 2.91Å; H654-R656 PolarHBondContact O-N 3.41Å; H654-D657 PolarHBondContact N-OD2 3.41Å; H654-D657 IonicContact ND1-OD2 3.8Å; H654-D657 VanDerWaalsContact O-CB 3.29Å; H654-D657 WeakPolarHBondContact O-CB 3.46Å; H654-D657 VanDerWaalsContact O-CG 3.32Å; H654-D657 PolarHBondContact O-N 3.21Å; H654-F658 VanDerWaalsContact O-CD1 3.31Å; H654-F658 WeakPolarHBondContact O-CD1 3.19Å
655	R	89.6	Confident	93.2	Very high	119 Å²	119	64.2 Å²	64.2	45%	0.449	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-57.3	-25.3	-179.1	-165.9	58.5	169.2	99	-11.3	114.2	Y587 D657 F658	Y587-R655 HydrophobicContact CE1-CB 3.88Å; Y587-R655 HydrophobicContact CE1-CG 4.41Å; Y587-R655 PolarHBondContact OH-N 2.64Å; Y587-R655 VanDerWaalsContact OH-N 3.14Å; R655-D657 VanDerWaalsContact C-N 3.29Å; R655-D657 PolarHBondContact O-N 3.26Å; R655-F658 VanDerWaalsContact NH1-CD2 3.31Å; R655-F658 WeakPolarHBondContact O-CB 3.44Å; R655-F658 PolarHBondContact O-N 3.43Å
656	R	90.7	Very high	93.2	Very high	177 Å²	177	59 Å²	59	67%	0.668	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-64.4	-30.5	171.9	75.8	-171.3	169.9	-152.8	-14.9	113	H654 F658	H654-R656 HydrophobicContact CB-CG 4.02Å; H654-R656 PolarHBondContact CD2-NH2 2.98Å; H654-R656 VanDerWaalsContact CD2-NH2 3.29Å; H654-R656 PolarHBondContact NE2-NH2 2.91Å; H654-R656 PolarHBondContact O-N 3.41Å; R656-F658 PolarHBondContact O-N 3.5Å
657	D	90	Very high	93.1	Very high	29 Å²	29	56.8 Å²	56.8	16%	0.155	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-77.2	-12.4	-174.4	-44.1	-21.4	0	0	0	111.4	H654 R655 R659 E660 R661	H654-D657 PolarHBondContact N-OD2 3.41Å; H654-D657 IonicContact ND1-OD2 3.8Å; H654-D657 VanDerWaalsContact O-CB 3.29Å; H654-D657 WeakPolarHBondContact O-CB 3.46Å; H654-D657 VanDerWaalsContact O-CG 3.32Å; H654-D657 PolarHBondContact O-N 3.21Å; R655-D657 VanDerWaalsContact C-N 3.29Å; R655-D657 PolarHBondContact O-N 3.26Å; D657-R659 PolarHBondContact O-N 2.92Å; D657-E660 PolarHBondContact O-N 2.94Å; D657-R661 WeakPolarHBondContact O-CB 3.27Å; D657-R661 WeakPolarHBondContact O-CG 3.28Å
658	F	92.5	Very high	93	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.009	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-66.2	-19.8	-172.6	-77.4	38.3	0	0	0	112.9	Y587 V653 H654 R655 R656 E660 L688 E689 L693	Y587-F658 HydrophobicContact CD1-CZ 4.28Å; Y587-F658 HydrophobicContact CD2-CE1 4.06Å; Y587-F658 AromaticContact CD2-CZ 3.47Å; Y587-F658 HydrophobicContact CD2-CZ 3.47Å; Y587-F658 VanDerWaalsContact CD2-CZ 3.47Å; Y587-F658 AromaticContact CE2-CE1 3.95Å; Y587-F658 HydrophobicContact CE2-CE1 3.95Å; Y587-F658 AromaticContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CE2-CZ 3.84Å; Y587-F658 HydrophobicContact CG-CE2 4.39Å; Y587-F658 AromaticContact CG-CZ 3.71Å; Y587-F658 HydrophobicContact CG-CZ 3.71Å; V653-F658 HydrophobicContact CG1-CD1 4.17Å; V653-F658 HydrophobicContact CG1-CE1 3.64Å; H654-F658 VanDerWaalsContact O-CD1 3.31Å; H654-F658 WeakPolarHBondContact O-CD1 3.19Å; R655-F658 VanDerWaalsContact NH1-CD2 3.31Å; R655-F658 WeakPolarHBondContact O-CB 3.44Å; R655-F658 PolarHBondContact O-N 3.43Å; R656-F658 PolarHBondContact O-N 3.5Å; F658-E660 VanDerWaalsContact C-N 3.34Å; F658-L688 HydrophobicContact CB-CB 3.78Å; F658-L688 HydrophobicContact CD2-CB 3.68Å; F658-L688 VanDerWaalsContact CD2-O 3.24Å; F658-L688 WeakPolarHBondContact CD2-O 3.21Å; F658-L688 HydrophobicContact CE2-CB 4.34Å; F658-L688 HydrophobicContact CG-CB 3.74Å; F658-E689 PolarHBondContact O-N 2.87Å; F658-L693 HydrophobicContact CD2-CD1 4.2Å; F658-L693 HydrophobicContact CE2-CD1 3.69Å; F658-L693 HydrophobicContact CE2-CD2 4.39Å
659	R	90.4	Very high	92.9	Very high	181 Å²	181	55 Å²	55	68%	0.683	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-77.5	-17.9	-179.8	-40	-162.3	79.8	-170.4	9.5	114.1	D657 E689	D657-R659 PolarHBondContact O-N 2.92Å; R659-E689 VanDerWaalsContact CA-OE2 3.3Å; R659-E689 WeakPolarHBondContact CA-OE2 3.37Å; R659-E689 WeakPolarHBondContact CB-OE2 3.36Å; R659-E689 WeakPolarHBondContact CG-OE2 3.27Å; R659-E689 IonicContact CZ-OE1 3.48Å; R659-E689 IonicContact CZ-OE2 2.78Å; R659-E689 VanDerWaalsContact NE-CD 3.25Å; R659-E689 IonicContact NE-OE1 2.64Å; R659-E689 PolarHBondContact NE-OE1 3.39Å; R659-E689 IonicContact NE-OE2 2.76Å; R659-E689 PolarHBondContact NE-OE2 3.23Å; R659-E689 IonicContact NH2-OE1 3.67Å; R659-E689 PolarHBondContact NH2-OE1 2.88Å; R659-E689 IonicContact NH2-OE2 3.24Å
660	E	89	Confident	92.8	Very high	138 Å²	138	55.9 Å²	55.9	65%	0.645	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-122.6	16.9	-174.5	-63.5	178.6	-166.4	0	0	111.4	D657 F658 P713	D657-E660 PolarHBondContact O-N 2.94Å; F658-E660 VanDerWaalsContact C-N 3.34Å; E660-P713 HydrophobicContact CB-CG 4.45Å
661	R	90.3	Very high	92.2	Very high	71 Å²	71	56.3 Å²	56.3	27%	0.268	25%	0.247	S	C	.	.			trans	-142.3	144.7	-170.4	-68.9	-174	-178	-90.7	9.8	112.7	F621 L622 D657 L688	F621-R661 VanDerWaalsContact CE1-CD 3.49Å; L622-R661 WeakPolarHBondContact O-CA 3.1Å; L622-R661 WeakPolarHBondContact O-CB 3.46Å; L622-R661 WeakPolarHBondContact O-CG 3.42Å; D657-R661 WeakPolarHBondContact O-CB 3.27Å; D657-R661 WeakPolarHBondContact O-CG 3.28Å; R661-L688 HydrophobicContact CB-CD1 3.66Å; R661-L688 HydrophobicContact CB-CG 4.5Å; R661-L688 WeakPolarHBondContact O-CG 3.47Å; R661-L688 PolarHBondContact O-N 3.36Å
662	M	93.5	Very high	91.5	Very high	28 Å²	28	59.1 Å²	59.1	14%	0.138	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.7	178.2	-54	169.4	90.7	0	0	109.4	L622 L685 I686 E687	L622-M662 HydrophobicContact CB-CB 4.35Å; L622-M662 WeakPolarHBondContact CB-O 3.28Å; L622-M662 HydrophobicContact CD1-CB 4.44Å; L622-M662 PolarHBondContact N-O 2.92Å; M662-L685 HydrophobicContact CE-CB 4Å; M662-I686 CarbonylContact C-O 3.59Å; M662-I686 VanDerWaalsContact CA-O 3.24Å; M662-I686 WeakPolarHBondContact CA-O 3.26Å; M662-E687 HydrophobicContact CE-CG 3.75Å; M662-E687 HydrophobicContact CG-CG 4.33Å
663	L	95.3	Very high	91	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	112	168.3	178	64.1	0	0	0	108.6	L585 V596 M619 Y650 I665 I686 L688	L585-L663 HydrophobicContact CD2-CD2 3.8Å; V596-L663 HydrophobicContact CB-CD2 4.39Å; V596-L663 HydrophobicContact CG1-CD2 3.81Å; V596-L663 HydrophobicContact CG2-CD1 4.4Å; V596-L663 HydrophobicContact CG2-CD2 3.62Å; M619-L663 HydrophobicContact CB-CD1 4.44Å; Y650-L663 HydrophobicContact CE2-CD1 3.76Å; L663-I665 HydrophobicContact CD2-CD1 3.88Å; L663-I665 HydrophobicContact CD2-CG1 4.28Å; L663-I665 HydrophobicContact CG-CD1 4.02Å; L663-I665 HydrophobicContact CG-CG1 3.87Å; L663-I686 HydrophobicContact CB-CB 4.38Å; L663-I686 PolarHBondContact N-O 3.1Å; L663-I686 PolarHBondContact O-N 3.33Å; L663-L688 HydrophobicContact CB-CD2 4.22Å
664	E	95.3	Very high	89.8	Confident	5 Å²	5	63.2 Å²	63.2	2%	0.023	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.1	175.1	168.1	172.7	-96.9	0	0	109.5	M619 Y620 L622 R625 T666 L685	M619-E664 CarbonylContact C-O 3.48Å; M619-E664 WeakPolarHBondContact CA-O 3.18Å; M619-E664 WeakPolarHBondContact CB-O 3.5Å; Y620-E664 WeakPolarHBondContact CB-OE2 3.4Å; Y620-E664 HydrophobicContact CD2-CG 4.47Å; Y620-E664 WeakPolarHBondContact CD2-OE2 3.44Å; Y620-E664 PolarHBondContact N-O 3.2Å; Y620-E664 PolarHBondContact O-N 3.33Å; L622-E664 HydrophobicContact CD1-CB 3.87Å; L622-E664 HydrophobicContact CD2-CB 4.29Å; L622-E664 HydrophobicContact CG-CB 3.89Å; R625-E664 IonicContact CZ-OE1 2.85Å; R625-E664 IonicContact CZ-OE2 2.67Å; R625-E664 IonicContact NE-OE1 3.3Å; R625-E664 IonicContact NE-OE2 2.75Å; R625-E664 PolarHBondContact NE-OE2 2.95Å; R625-E664 IonicContact NH2-OE1 2.85Å; R625-E664 PolarHBondContact NH2-OE1 3.23Å; R625-E664 IonicContact NH2-OE2 3.21Å; E664-T666 HydrophobicContact CG-CG2 4.18Å; E664-L685 HydrophobicContact CB-CD2 3.89Å; E664-L685 HydrophobicContact CG-CD2 4.21Å
665	I	96	Very high	89	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	111.1	-177.4	-51.3	-176.3	0	0	0	108.7	L581 V583 V617 M619 L663 E683 I684 I686	L581-I665 HydrophobicContact CD2-CG2 3.43Å; L581-I665 VanDerWaalsContact CD2-CG2 3.43Å; V583-I665 HydrophobicContact CG1-CD1 4.13Å; V583-I665 HydrophobicContact CG2-CD1 4.04Å; V617-I665 HydrophobicContact CG1-CG2 3.46Å; V617-I665 VanDerWaalsContact CG1-CG2 3.46Å; M619-I665 HydrophobicContact CG-CB 4.35Å; M619-I665 HydrophobicContact CG-CG1 4.11Å; M619-I665 HydrophobicContact CG-CG2 4.05Å; M619-I665 HydrophobicContact SD-CD1 4.16Å; M619-I665 HydrophobicContact SD-CG1 4.01Å; M619-I665 HydrophobicContact SD-CG2 4.28Å; L663-I665 HydrophobicContact CD2-CD1 3.88Å; L663-I665 HydrophobicContact CD2-CG1 4.28Å; L663-I665 HydrophobicContact CG-CD1 4.02Å; L663-I665 HydrophobicContact CG-CG1 3.87Å; I665-E683 CarbonylContact O-C 3.3Å; I665-E683 WeakPolarHBondContact O-CA 3.38Å; I665-I684 HydrophobicContact CB-CB 4.37Å; I665-I684 PolarHBondContact N-O 3.33Å; I665-I684 PolarHBondContact O-N 2.63Å; I665-I686 HydrophobicContact CD1-CD1 3.8Å
666	T	95.1	Very high	88.5	Confident	7 Å²	7	66.1 Å²	66.1	4%	0.043	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.5	-176.5	55.8	0	0	0	0	110.9	V617 K618 E664 W668 F680 E683	V617-T666 CarbonylContact C-O 3.59Å; V617-T666 WeakPolarHBondContact CA-O 2.97Å; K618-T666 PolarHBondContact N-O 2.65Å; K618-T666 PolarHBondContact O-N 2.84Å; K618-T666 PolarHBondContact O-OG1 3.29Å; E664-T666 HydrophobicContact CG-CG2 4.18Å; T666-W668 VanDerWaalsContact CB-NE1 3.34Å; T666-W668 VanDerWaalsContact O-CD1 3.28Å; T666-W668 PolarHBondContact OG1-NE1 3.49Å; T666-F680 HydrophobicContact CG2-CE2 4.18Å; T666-E683 HydrophobicContact CG2-CB 3.81Å
667	V	96	Very high	88.1	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.4	-179.7	-167.4	0	0	0	0	109.7	L581 L604 V617 W644 L681 G682 L702	L581-V667 HydrophobicContact CD2-CG2 4.46Å; L604-V667 HydrophobicContact CD1-CG1 4.48Å; L604-V667 HydrophobicContact CD2-CG1 4.33Å; V617-V667 HydrophobicContact CG2-CG2 4.36Å; W644-V667 HydrophobicContact CH2-CG1 4.42Å; V667-L681 HydrophobicContact CB-CB 4.26Å; V667-L681 HydrophobicContact CG1-CB 4.24Å; V667-L681 HydrophobicContact CG1-CD1 4.2Å; V667-L681 PolarHBondContact O-N 3.36Å; V667-G682 PolarHBondContact N-O 2.86Å; V667-L702 HydrophobicContact CB-CD1 4.48Å; V667-L702 HydrophobicContact CG2-CD1 4.29Å; V667-L702 HydrophobicContact CG2-CD2 3.68Å
668	W	95.3	Very high	88.1	Confident	60 Å²	60	65.6 Å²	65.6	23%	0.227	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	141.9	-171.4	-63.7	82.8	0	0	0	111.6	P615 Y616 K618 T666 S678 E679 F680	P615-W668 CarbonylContact C-O 3.55Å; P615-W668 VanDerWaalsContact CA-O 3.27Å; P615-W668 WeakPolarHBondContact CA-O 3.42Å; Y616-W668 HydrophobicContact CD1-CB 4.01Å; Y616-W668 VanDerWaalsContact CD1-O 3.24Å; Y616-W668 WeakPolarHBondContact CD1-O 3.37Å; Y616-W668 HydrophobicContact CD2-CB 4.2Å; Y616-W668 HydrophobicContact CE1-CB 3.53Å; Y616-W668 HydrophobicContact CE2-CB 3.76Å; Y616-W668 HydrophobicContact CE2-CG 4.11Å; Y616-W668 HydrophobicContact CG-CB 4.35Å; Y616-W668 VanDerWaalsContact CZ-CB 3.41Å; Y616-W668 PolarHBondContact N-O 3.18Å; Y616-W668 PolarHBondContact O-N 3.25Å; K618-W668 VanDerWaalsContact NZ-CD1 3.29Å; K618-W668 VanDerWaalsContact NZ-NE1 3.2Å; T666-W668 VanDerWaalsContact CB-NE1 3.34Å; T666-W668 VanDerWaalsContact O-CD1 3.28Å; T666-W668 PolarHBondContact OG1-NE1 3.49Å; W668-S678 WeakPolarHBondContact CZ3-O 3.49Å; W668-E679 CarbonylContact C-O 3.59Å; W668-E679 VanDerWaalsContact CA-O 3.31Å; W668-E679 WeakPolarHBondContact CA-O 3.28Å; W668-F680 HydrophobicContact CD2-CD2 4.41Å; W668-F680 HydrophobicContact CE3-CB 4.06Å; W668-F680 HydrophobicContact CH2-CB 4.27Å; W668-F680 HydrophobicContact CH2-CD2 4.28Å; W668-F680 AromaticContact CZ2-CD2 3.97Å; W668-F680 HydrophobicContact CZ2-CD2 3.97Å; W668-F680 HydrophobicContact CZ3-CB 3.93Å
669	D	94.2	Very high	88	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.2	169.3	-178	12.4	0	0	0	110.5	R607 R613 N614 P671 S678 E679 L681	R607-D669 IonicContact CZ-OD2 3.88Å; R607-D669 IonicContact NE-OD2 3.71Å; R607-D669 PolarHBondContact NE-OD2 2.89Å; R607-D669 IonicContact NH2-OD1 3.72Å; R607-D669 IonicContact NH2-OD2 3.71Å; R607-D669 PolarHBondContact NH2-OD2 3.35Å; R613-D669 WeakPolarHBondContact CD-OD2 3.42Å; R613-D669 IonicContact CZ-OD2 2.71Å; R613-D669 IonicContact NE-OD2 3.56Å; R613-D669 IonicContact NH1-OD2 3.93Å; R613-D669 PolarHBondContact NH1-OD2 2.74Å; N614-D669 PolarHBondContact N-OD1 2.82Å; D669-P671 WeakPolarHBondContact O-CD 3.44Å; D669-S678 WeakPolarHBondContact O-CA 3.3Å; D669-S678 WeakPolarHBondContact O-CB 3.47Å; D669-E679 HydrophobicContact CB-CB 4.27Å; D669-E679 PolarHBondContact N-O 3.17Å; D669-E679 PolarHBondContact O-N 2.88Å; D669-L681 HydrophobicContact CB-CD1 4.12Å; D669-L681 HydrophobicContact CB-CD2 4.12Å; D669-L681 HydrophobicContact CB-CG 4.21Å
670	Q	92.8	Very high	88.1	Confident	74 Å²	74	63.8 Å²	63.8	35%	0.346	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-85.8	120.1	173.2	-169.6	169.3	-37.7	0	0	111	N614 Y616 T635	N614-Q670 HydrophobicContact CB-CB 4.42Å; N614-Q670 WeakPolarHBondContact CB-O 3.39Å; N614-Q670 PolarHBondContact ND2-O 3.04Å; N614-Q670 PolarHBondContact O-N 3.48Å; Y616-Q670 HydrophobicContact CD1-CB 3.87Å; Y616-Q670 HydrophobicContact CE1-CB 3.78Å; T635-Q670 HydrophobicContact CG2-CB 3.79Å; T635-Q670 PolarHBondContact OG1-OE1 3.14Å; T635-Q670 VanDerWaalsContact OG1-OE1 3.06Å
671	P	84.4	Confident	88.2	Confident	16 Å²	16	57.4 Å²	57.4	10%	0.104	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-60.4	162.8	174.3	23.5	-34.8	0	0	0	113.6	D669 E676 E677	D669-P671 WeakPolarHBondContact O-CD 3.44Å; P671-E676 HydrophobicContact CB-CB 3.38Å; P671-E676 HydrophobicContact CB-CG 4.28Å; P671-E676 WeakPolarHBondContact CB-OE2 3.35Å; P671-E676 HydrophobicContact CG-CB 3.61Å; P671-E676 VanDerWaalsContact CG-O 3.32Å; P671-E676 WeakPolarHBondContact CG-O 3.37Å; P671-E677 WeakPolarHBondContact CD-O 3.27Å; P671-E677 WeakPolarHBondContact CG-O 3.41Å
672	R	76.7	Confident	88.3	Confident	122 Å²	122	54 Å²	54	46%	0.46	26%	0.26	S	S	.	.	S	Bend	trans	-88.7	-27.3	178.8	-59.8	178.9	-170.8	171.1	4	111.9	P612	P612-R672 VanDerWaalsContact CD-NH2 3.28Å; P612-R672 VanDerWaalsContact N-NH2 3.11Å; P612-R672 PolarHBondContact O-NH2 3.33Å
673	V	79.5	Confident	88.3	Confident	72 Å²	72	53.1 Å²	53.1	44%	0.436	26%	0.256	S	S	.	.	S	Bend	trans	-86.8	137.1	171.7	-170.3	0	0	0	0	108.1	D675 E676	V673-D675 HydrophobicContact CG1-CB 4.42Å; V673-D675 PolarHBondContact O-N 2.57Å; V673-E676 HydrophobicContact CB-CB 4.34Å; V673-E676 HydrophobicContact CB-CG 3.86Å; V673-E676 HydrophobicContact CG2-CG 4.38Å; V673-E676 PolarHBondContact N-OE2 2.88Å; V673-E676 PolarHBondContact O-N 3.16Å
674	Q	67.9	Low	88.2	Confident	173 Å²	173	53.3 Å²	53.3	81%	0.808	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-16.6	-176.5	-176.2	160.7	42.2	0	0	113.6
675	D	75	Confident	88.2	Confident	150 Å²	150	55.1 Å²	55.1	80%	0.802	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-10.7	-179.9	-57.5	-68.1	0	0	0	113.5	V673	V673-D675 HydrophobicContact CG1-CB 4.42Å; V673-D675 PolarHBondContact O-N 2.57Å
676	E	77.9	Confident	88.1	Confident	84 Å²	84	55.5 Å²	55.5	39%	0.393	27%	0.268	S	S	.	.	S	Bend	trans	-75.8	149.4	169.9	-75.7	167.8	173.1	0	0	110.1	P671 V673	P671-E676 HydrophobicContact CB-CB 3.38Å; P671-E676 HydrophobicContact CB-CG 4.28Å; P671-E676 WeakPolarHBondContact CB-OE2 3.35Å; P671-E676 HydrophobicContact CG-CB 3.61Å; P671-E676 VanDerWaalsContact CG-O 3.32Å; P671-E676 WeakPolarHBondContact CG-O 3.37Å; V673-E676 HydrophobicContact CB-CB 4.34Å; V673-E676 HydrophobicContact CB-CG 3.86Å; V673-E676 HydrophobicContact CG2-CG 4.38Å; V673-E676 PolarHBondContact N-OE2 2.88Å; V673-E676 PolarHBondContact O-N 3.16Å
677	E	82.9	Confident	88	Confident	154 Å²	154	59.9 Å²	59.9	72%	0.72	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-89.9	159	177.1	-56.2	-163.6	154.1	0	0	111.2	P671 E679 K731	P671-E677 WeakPolarHBondContact CD-O 3.27Å; P671-E677 WeakPolarHBondContact CG-O 3.41Å; E677-E679 PolarHBondContact O-N 2.85Å; E677-K731 IonicContact OE1-NZ 2.64Å
678	S	90.1	Very high	87.9	Confident	41 Å²	41	59.9 Å²	59.9	29%	0.287	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-74.5	126.1	179.5	-61.7	0	0	0	0	110.7	Y616 W668 D669	Y616-S678 WeakPolarHBondContact OH-CB 3.35Å; Y616-S678 PolarHBondContact OH-OG 3.24Å; W668-S678 WeakPolarHBondContact CZ3-O 3.49Å; D669-S678 WeakPolarHBondContact O-CA 3.3Å; D669-S678 WeakPolarHBondContact O-CB 3.47Å
679	E	90.1	Very high	87.8	Confident	85 Å²	85	61.1 Å²	61.1	40%	0.397	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	135.2	175.6	-165.4	-174	138.8	0	0	109.1	R613 W668 D669 E677	R613-E679 IonicContact CZ-OE1 3.53Å; R613-E679 VanDerWaalsContact CZ-OE1 3.24Å; R613-E679 IonicContact CZ-OE2 3.61Å; R613-E679 IonicContact NH1-OE1 2.71Å; R613-E679 PolarHBondContact NH1-OE1 3.43Å; R613-E679 IonicContact NH1-OE2 3.85Å; R613-E679 PolarHBondContact NH1-OE2 2.87Å; R613-E679 IonicContact NH2-OE1 3.49Å; R613-E679 PolarHBondContact NH2-OE1 2.88Å; R613-E679 IonicContact NH2-OE2 2.77Å; W668-E679 CarbonylContact C-O 3.59Å; W668-E679 VanDerWaalsContact CA-O 3.31Å; W668-E679 WeakPolarHBondContact CA-O 3.28Å; D669-E679 HydrophobicContact CB-CB 4.27Å; D669-E679 PolarHBondContact N-O 3.17Å; D669-E679 PolarHBondContact O-N 2.88Å; E677-E679 PolarHBondContact O-N 2.85Å
680	F	92.4	Very high	87.6	Confident	59 Å²	59	65.7 Å²	65.7	26%	0.259	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	137	175.6	172.9	-95.4	0	0	0	109.8	T666 W668 E683 H705	T666-F680 HydrophobicContact CG2-CE2 4.18Å; W668-F680 HydrophobicContact CD2-CD2 4.41Å; W668-F680 HydrophobicContact CE3-CB 4.06Å; W668-F680 HydrophobicContact CH2-CB 4.27Å; W668-F680 HydrophobicContact CH2-CD2 4.28Å; W668-F680 AromaticContact CZ2-CD2 3.97Å; W668-F680 HydrophobicContact CZ2-CD2 3.97Å; W668-F680 HydrophobicContact CZ3-CB 3.93Å; F680-E683 HydrophobicContact CE2-CB 4.07Å; F680-E683 HydrophobicContact CZ-CB 3.83Å; F680-E683 HydrophobicContact CZ-CG 4.19Å; F680-H705 HydrophobicContact CE1-CB 3.82Å; F680-H705 HydrophobicContact CE2-CB 4.2Å; F680-H705 HydrophobicContact CZ-CB 3.59Å
681	L	91.8	Very high	87.6	Confident	5 Å²	5	62.8 Å²	62.8	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-13.7	-178.6	-59.5	-175.1	0	0	0	113.9	L577 L604 P605 P615 V667 D669	L577-L681 WeakPolarHBondContact CD1-O 3.43Å; L604-L681 HydrophobicContact CD1-CD1 4.25Å; P605-L681 HydrophobicContact CG-CD2 4.31Å; P615-L681 HydrophobicContact CB-CD1 4.32Å; V667-L681 HydrophobicContact CB-CB 4.26Å; V667-L681 HydrophobicContact CG1-CB 4.24Å; V667-L681 HydrophobicContact CG1-CD1 4.2Å; V667-L681 PolarHBondContact O-N 3.36Å; D669-L681 HydrophobicContact CB-CD1 4.12Å; D669-L681 HydrophobicContact CB-CD2 4.12Å; D669-L681 HydrophobicContact CB-CG 4.21Å
682	G	91.8	Very high	87.9	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143.5	164.1	-179.3	0	0	0	0	0	113.4	V667 Q703	V667-G682 PolarHBondContact N-O 2.86Å; G682-Q703 CarbonylContact C-O 3.39Å; G682-Q703 VanDerWaalsContact CA-O 3.25Å; G682-Q703 WeakPolarHBondContact CA-O 3.39Å
683	E	94.1	Very high	88.6	Confident	8 Å²	8	62.4 Å²	62.4	4%	0.037	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	164.7	179.9	72.9	-180	-168.8	0	0	114.3	I665 T666 F680 Q703 H705 D706	I665-E683 CarbonylContact O-C 3.3Å; I665-E683 WeakPolarHBondContact O-CA 3.38Å; T666-E683 HydrophobicContact CG2-CB 3.81Å; F680-E683 HydrophobicContact CE2-CB 4.07Å; F680-E683 HydrophobicContact CZ-CB 3.83Å; F680-E683 HydrophobicContact CZ-CG 4.19Å; E683-Q703 PolarHBondContact N-O 3.08Å; E683-Q703 PolarHBondContact O-N 2.85Å; E683-H705 WeakPolarHBondContact OE1-CA 3.42Å; E683-H705 IonicContact OE2-CD2 3.81Å; E683-H705 PolarHBondContact OE2-CD2 3Å; E683-H705 IonicContact OE2-CG 2.79Å; E683-D706 PolarHBondContact OE1-N 3.2Å
684	I	93.4	Very high	89.2	Confident	5 Å²	5	63 Å²	63	3%	0.026	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	129.1	173.1	-63.1	148.1	0	0	0	106.8	L581 I665 I686 Y700 L702	L581-I684 HydrophobicContact CB-CD1 3.51Å; L581-I684 HydrophobicContact CD2-CD1 3.74Å; L581-I684 HydrophobicContact CG-CD1 4.25Å; I665-I684 HydrophobicContact CB-CB 4.37Å; I665-I684 PolarHBondContact N-O 3.33Å; I665-I684 PolarHBondContact O-N 2.63Å; 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 3.91Å; I684-L702 HydrophobicContact CD1-CD2 3.75Å; I684-L702 HydrophobicContact CG1-CD2 4.07Å
685	L	93.8	Very high	90.4	Very high	43 Å²	43	57.5 Å²	57.5	23%	0.225	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.7	168.2	-69.8	166.4	0	0	0	108.1	L622 M662 E664 S709	L622-L685 HydrophobicContact CD1-CD2 4.02Å; M662-L685 HydrophobicContact CE-CB 4Å; E664-L685 HydrophobicContact CB-CD2 3.89Å; E664-L685 HydrophobicContact CG-CD2 4.21Å; L685-S709 VanDerWaalsContact CD1-OG 3.28Å; L685-S709 WeakPolarHBondContact CD1-OG 3.36Å
686	I	94.2	Very high	91.3	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	109.7	179.2	-46.7	-179.7	0	0	0	109	L585 M662 L663 I665 I684 A691 Y700	L585-I686 HydrophobicContact CD1-CD1 4.03Å; L585-I686 HydrophobicContact CD1-CG2 4.13Å; M662-I686 CarbonylContact C-O 3.59Å; M662-I686 VanDerWaalsContact CA-O 3.24Å; M662-I686 WeakPolarHBondContact CA-O 3.26Å; L663-I686 HydrophobicContact CB-CB 4.38Å; L663-I686 PolarHBondContact N-O 3.1Å; L663-I686 PolarHBondContact O-N 3.33Å; I665-I686 HydrophobicContact CD1-CD1 3.8Å; I684-I686 HydrophobicContact CG2-CD1 4.12Å; I684-I686 HydrophobicContact CG2-CG1 3.64Å; I686-A691 HydrophobicContact CG2-CB 3.89Å; I686-Y700 HydrophobicContact CD1-CD1 4.18Å; I686-Y700 HydrophobicContact CD1-CD2 4.29Å; I686-Y700 HydrophobicContact CD1-CE1 3.8Å; I686-Y700 HydrophobicContact CD1-CE2 3.92Å; I686-Y700 HydrophobicContact CD1-CG 4.42Å; I686-Y700 HydrophobicContact CG1-CD1 4.28Å; I686-Y700 HydrophobicContact CG1-CE1 4Å; I686-Y700 HydrophobicContact CG2-CE1 4.37Å
687	E	94	Very high	92.1	Very high	99 Å²	99	54.2 Å²	54.2	46%	0.463	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	130.2	169.1	-70.2	176.1	172	0	0	110.7	M662 T690 A691	M662-E687 HydrophobicContact CE-CG 3.75Å; M662-E687 HydrophobicContact CG-CG 4.33Å; E687-T690 VanDerWaalsContact CB-OG1 3.29Å; E687-T690 WeakPolarHBondContact CB-OG1 3.42Å; E687-T690 PolarHBondContact OE2-OG1 2.74Å; E687-A691 VanDerWaalsContact O-CB 3.28Å; E687-A691 WeakPolarHBondContact O-CB 3.12Å; E687-A691 PolarHBondContact O-N 2.8Å
688	L	94.2	Very high	92.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-24.3	-176.2	-58	175.9	0	0	0	112.9	L594 F621 F658 R661 L663 T690	L594-L688 HydrophobicContact CD2-CD1 4.37Å; L594-L688 HydrophobicContact CD2-CD2 3.71Å; F621-L688 HydrophobicContact CE2-CD1 3.4Å; F621-L688 VanDerWaalsContact CE2-CD1 3.4Å; F621-L688 HydrophobicContact CZ-CD1 3.55Å; F658-L688 HydrophobicContact CB-CB 3.78Å; F658-L688 HydrophobicContact CD2-CB 3.68Å; F658-L688 VanDerWaalsContact CD2-O 3.24Å; F658-L688 WeakPolarHBondContact CD2-O 3.21Å; F658-L688 HydrophobicContact CE2-CB 4.34Å; F658-L688 HydrophobicContact CG-CB 3.74Å; R661-L688 HydrophobicContact CB-CD1 3.66Å; R661-L688 HydrophobicContact CB-CG 4.5Å; R661-L688 WeakPolarHBondContact O-CG 3.47Å; R661-L688 PolarHBondContact O-N 3.36Å; L663-L688 HydrophobicContact CB-CD2 4.22Å; L688-T690 VanDerWaalsContact C-N 3.34Å
689	E	92.2	Very high	92.9	Very high	85 Å²	85	52.7 Å²	52.7	40%	0.397	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-36	176.7	-174.6	159.3	-172.8	0	0	112.3	F658 R659	F658-E689 PolarHBondContact O-N 2.87Å; R659-E689 VanDerWaalsContact CA-OE2 3.3Å; R659-E689 WeakPolarHBondContact CA-OE2 3.37Å; R659-E689 WeakPolarHBondContact CB-OE2 3.36Å; R659-E689 WeakPolarHBondContact CG-OE2 3.27Å; R659-E689 IonicContact CZ-OE1 3.48Å; R659-E689 IonicContact CZ-OE2 2.78Å; R659-E689 VanDerWaalsContact NE-CD 3.25Å; R659-E689 IonicContact NE-OE1 2.64Å; R659-E689 PolarHBondContact NE-OE1 3.39Å; R659-E689 IonicContact NE-OE2 2.76Å; R659-E689 PolarHBondContact NE-OE2 3.23Å; R659-E689 IonicContact NH2-OE1 3.67Å; R659-E689 PolarHBondContact NH2-OE1 2.88Å; R659-E689 IonicContact NH2-OE2 3.24Å
690	T	91.4	Very high	93.1	Very high	96 Å²	96	50.8 Å²	50.8	59%	0.589	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-9.4	-177.9	54.8	0	0	0	0	114	E687 L688	E687-T690 VanDerWaalsContact CB-OG1 3.29Å; E687-T690 WeakPolarHBondContact CB-OG1 3.42Å; E687-T690 PolarHBondContact OE2-OG1 2.74Å; L688-T690 VanDerWaalsContact C-N 3.34Å
691	A	90.9	Very high	93.2	Very high	14 Å²	14	53.9 Å²	53.9	12%	0.116	27%	0.266	C	S	.	.			trans	-56.6	139.8	177.4	0	0	0	0	0	113.7	L585 I686 E687 L693	L585-A691 HydrophobicContact CD1-CB 4.35Å; I686-A691 HydrophobicContact CG2-CB 3.89Å; E687-A691 VanDerWaalsContact O-CB 3.28Å; E687-A691 WeakPolarHBondContact O-CB 3.12Å; E687-A691 PolarHBondContact O-N 2.8Å; A691-L693 HydrophobicContact CB-CD2 4.34Å; A691-L693 HydrophobicContact CB-CG 4.14Å; A691-L693 WeakPolarHBondContact O-CG 3.36Å
692	L	90.6	Very high	93.2	Very high	91 Å²	91	53.6 Å²	53.6	48%	0.476	27%	0.265	S	S	.	.			trans	-74.2	125.8	163.7	-59.8	175	0	0	0	108.4	H698	L692-H698 VanDerWaalsContact CD1-NE2 3.29Å; L692-H698 WeakPolarHBondContact CD1-NE2 3.45Å
693	L	92.5	Very high	93.1	Very high	39 Å²	39	57.7 Å²	57.7	20%	0.204	28%	0.284	C	S	.	.			trans	-131.1	29.2	-166.6	-67.3	159.6	0	0	0	110.8	L585 L594 F658 A691	L585-L693 HydrophobicContact CB-CD2 4.27Å; L585-L693 CarbonylContact O-C 3.42Å; L585-L693 WeakPolarHBondContact O-CA 3.22Å; L594-L693 HydrophobicContact CD1-CD2 3.78Å; F658-L693 HydrophobicContact CD2-CD1 4.2Å; F658-L693 HydrophobicContact CE2-CD1 3.69Å; F658-L693 HydrophobicContact CE2-CD2 4.39Å; A691-L693 HydrophobicContact CB-CD2 4.34Å; A691-L693 HydrophobicContact CB-CG 4.14Å; A691-L693 WeakPolarHBondContact O-CG 3.36Å
694	D	91	Very high	92.4	Very high	85 Å²	85	60.5 Å²	60.5	46%	0.455	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-4.7	-170.5	44.5	21.5	0	0	0	114.1	E696 H698	D694-E696 PolarHBondContact OD1-N 2.81Å; D694-H698 IonicContact OD1-CE1 3.84Å; D694-H698 PolarHBondContact OD1-CE1 3.22Å; D694-H698 IonicContact OD1-ND1 2.72Å; D694-H698 IonicContact OD2-CE1 3.08Å; D694-H698 PolarHBondContact OD2-CE1 3.4Å; D694-H698 VanDerWaalsContact OD2-CE1 3.28Å; D694-H698 IonicContact OD2-NE2 2.71Å
695	D	93.3	Very high	91.4	Very high	56 Å²	56	64.1 Å²	64.1	30%	0.299	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.2	46.8	-162.8	-160.6	40.8	0	0	0	112.8	K584 L585 W586	K584-D695 WeakPolarHBondContact CD-OD1 3.29Å; K584-D695 VanDerWaalsContact CE-C 3.5Å; K584-D695 WeakPolarHBondContact CE-O 3.42Å; K584-D695 WeakPolarHBondContact CE-OD1 3.31Å; K584-D695 WeakPolarHBondContact CG-OD1 3.41Å; K584-D695 PolarHBondContact NZ-O 2.81Å; K584-D695 IonicContact NZ-OD1 3.56Å; K584-D695 PolarHBondContact NZ-OD1 2.96Å; K584-D695 VanDerWaalsContact NZ-OD1 3.12Å; K584-D695 IonicContact NZ-OD2 3.4Å; K584-D695 PolarHBondContact NZ-OD2 3.2Å; L585-D695 PolarHBondContact O-N 2.65Å; L585-D695 VanDerWaalsContact O-N 3.13Å; W586-D695 HydrophobicContact CB-CB 3.82Å; W586-D695 HydrophobicContact CG-CB 4.02Å
696	E	93.8	Very high	89.7	Confident	113 Å²	113	65.5 Å²	65.5	53%	0.528	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	154.3	165.3	-72.9	-59.9	161.6	0	0	112.9	K584 D694 H698	K584-E696 WeakPolarHBondContact CA-O 3.3Å; D694-E696 PolarHBondContact OD1-N 2.81Å; E696-H698 PolarHBondContact O-N 3.37Å; E696-H698 PolarHBondContact O-ND1 3.42Å
697	P	95	Very high	87.6	Confident	53 Å²	53	73.3 Å²	73.3	34%	0.344	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	104.7	-171.1	34.3	-34.3	0	0	0	112.8	K584 L599	K584-P697 HydrophobicContact CB-CB 4.32Å; L599-P697 HydrophobicContact CD1-CB 3.54Å
698	H	95.1	Very high	85.2	Confident	48 Å²	48	70.7 Å²	70.7	22%	0.222	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	139.2	-176.2	-73.5	86.5	0	0	0	112.6	S582 V583 L692 D694 E696 Y700	S582-H698 CarbonylContact C-O 3.54Å; S582-H698 WeakPolarHBondContact CA-O 3.19Å; V583-H698 PolarHBondContact N-O 2.73Å; V583-H698 PolarHBondContact O-N 2.84Å; L692-H698 VanDerWaalsContact CD1-NE2 3.29Å; L692-H698 WeakPolarHBondContact CD1-NE2 3.45Å; D694-H698 IonicContact OD1-CE1 3.84Å; D694-H698 PolarHBondContact OD1-CE1 3.22Å; D694-H698 IonicContact OD1-ND1 2.72Å; D694-H698 IonicContact OD2-CE1 3.08Å; D694-H698 PolarHBondContact OD2-CE1 3.4Å; D694-H698 VanDerWaalsContact OD2-CE1 3.28Å; D694-H698 IonicContact OD2-NE2 2.71Å; E696-H698 PolarHBondContact O-N 3.37Å; E696-H698 PolarHBondContact O-ND1 3.42Å; H698-Y700 HydrophobicContact CB-CD2 4.4Å; H698-Y700 HydrophobicContact CB-CE2 3.58Å; H698-Y700 WeakPolarHBondContact O-CD2 3.37Å
699	W	95.2	Very high	82.8	Confident	114 Å²	114	72.4 Å²	72.4	43%	0.432	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.6	178	-73.3	101.8	0	0	0	111.3	Q580 Q600 T602	Q580-W699 HydrophobicContact CB-CE3 3.79Å; Q580-W699 HydrophobicContact CB-CZ3 4.21Å; Q600-W699 HydrophobicContact CG-CH2 3.88Å; Q600-W699 HydrophobicContact CG-CZ2 4.48Å; Q600-W699 VanDerWaalsContact NE2-CH2 3.31Å; Q600-W699 VanDerWaalsContact NE2-CZ2 3.27Å; T602-W699 HydrophobicContact CG2-CH2 3.73Å; T602-W699 HydrophobicContact CG2-CZ3 4.15Å
700	Y	94.7	Very high	80.5	Confident	46 Å²	46	71.4 Å²	71.4	18%	0.18	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.6	177.1	-62.1	-92.8	0	0	0	109.4	Q580 L581 V583 I684 I686 H698	Q580-Y700 CarbonylContact C-O 3.59Å; Q580-Y700 WeakPolarHBondContact CA-O 3.21Å; L581-Y700 PolarHBondContact N-O 2.8Å; L581-Y700 PolarHBondContact O-N 3.28Å; V583-Y700 HydrophobicContact CB-CD2 4.13Å; 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 3.91Å; I686-Y700 HydrophobicContact CD1-CD1 4.18Å; I686-Y700 HydrophobicContact CD1-CD2 4.29Å; I686-Y700 HydrophobicContact CD1-CE1 3.8Å; I686-Y700 HydrophobicContact CD1-CE2 3.92Å; I686-Y700 HydrophobicContact CD1-CG 4.42Å; I686-Y700 HydrophobicContact CG1-CD1 4.28Å; I686-Y700 HydrophobicContact CG1-CE1 4Å; I686-Y700 HydrophobicContact CG2-CE1 4.37Å; H698-Y700 HydrophobicContact CB-CD2 4.4Å; H698-Y700 HydrophobicContact CB-CE2 3.58Å; H698-Y700 WeakPolarHBondContact O-CD2 3.37Å
701	K	94	Very high	77.8	Confident	123 Å²	123	71.4 Å²	71.4	54%	0.535	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	140.8	177.1	-63.2	-179.8	178.9	179	0	110.4	V576 Q580	V576-K701 HydrophobicContact CG1-CB 4.12Å; V576-K701 HydrophobicContact CG1-CD 4.13Å; Q580-K701 HydrophobicContact CG-CG 4.23Å
702	L	92.9	Very high	75	Confident	0 Å²	0	78 Å²	78	0%	0	40%	0.398	C	S	.	.			trans	-73	136.8	176.6	-64.8	-173.9	0	0	0	111.5	L577 G579 L581 L604 V667 I684	L577-L702 HydrophobicContact CB-CB 4.21Å; L577-L702 PolarHBondContact N-O 2.86Å; G579-L702 PolarHBondContact O-N 3.04Å; L581-L702 HydrophobicContact CB-CD2 4.49Å; L604-L702 HydrophobicContact CD2-CD1 3.56Å; V667-L702 HydrophobicContact CB-CD1 4.48Å; V667-L702 HydrophobicContact CG2-CD1 4.29Å; V667-L702 HydrophobicContact CG2-CD2 3.68Å; I684-L702 HydrophobicContact CD1-CD2 3.75Å; I684-L702 HydrophobicContact CG1-CD2 4.07Å
703	Q	88.3	Confident	72.5	Confident	86 Å²	86	77 Å²	77	40%	0.402	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-115.4	162.8	178.5	-55	-171.9	45.4	0	0	110.4	L577 G682 E683	L577-Q703 WeakPolarHBondContact CD1-O 3.13Å; G682-Q703 CarbonylContact C-O 3.39Å; G682-Q703 VanDerWaalsContact CA-O 3.25Å; G682-Q703 WeakPolarHBondContact CA-O 3.39Å; E683-Q703 PolarHBondContact N-O 3.08Å; E683-Q703 PolarHBondContact O-N 2.85Å
704	T	80.8	Confident	69.8	Low	67 Å²	67	83.5 Å²	83.5	41%	0.411	43%	0.427	S	S	.	.			trans	-70.8	149.8	169.8	32.8	0	0	0	0	110.1	L577 D706	L577-T704 HydrophobicContact CD1-CG2 4.1Å; L577-T704 HydrophobicContact CD2-CG2 3.79Å; L577-T704 HydrophobicContact CG-CG2 3.96Å; T704-D706 PolarHBondContact O-N 3.1Å; T704-D706 VanDerWaalsContact O-N 3.16Å
705	H	71	Confident	67	Low	81 Å²	81	85.1 Å²	85.1	38%	0.375	44%	0.442	S	S	.	.			trans	-72.9	105.2	-178.4	-178	-84.8	0	0	0	110.9	F680 E683 E707	F680-H705 HydrophobicContact CE1-CB 3.82Å; F680-H705 HydrophobicContact CE2-CB 4.2Å; F680-H705 HydrophobicContact CZ-CB 3.59Å; E683-H705 WeakPolarHBondContact OE1-CA 3.42Å; E683-H705 IonicContact OE2-CD2 3.81Å; E683-H705 PolarHBondContact OE2-CD2 3Å; E683-H705 IonicContact OE2-CG 2.79Å; H705-E707 IonicContact CE1-OE1 2.7Å
706	D	58.4	Low	64.1	Low	72 Å²	72	86.4 Å²	86.4	39%	0.385	46%	0.455	S	S	.	.			trans	-98.6	104.1	-179.3	178.8	4.7	0	0	0	110.4	E683 T704 S708 S709	E683-D706 PolarHBondContact OE1-N 3.2Å; T704-D706 PolarHBondContact O-N 3.1Å; T704-D706 VanDerWaalsContact O-N 3.16Å; D706-S708 VanDerWaalsContact CG-OG 3.31Å; D706-S708 PolarHBondContact O-N 2.84Å; D706-S708 VanDerWaalsContact O-N 3.13Å; D706-S708 WeakPolarHBondContact OD1-CA 3.49Å; D706-S708 VanDerWaalsContact OD1-CB 3.26Å; D706-S708 WeakPolarHBondContact OD1-CB 3.2Å; D706-S708 PolarHBondContact OD1-N 2.91Å; D706-S708 PolarHBondContact OD1-OG 2.86Å; D706-S708 PolarHBondContact OD2-OG 3.38Å; D706-S709 WeakPolarHBondContact O-CB 3.41Å; D706-S709 PolarHBondContact O-N 3.19Å; D706-S709 PolarHBondContact O-OG 3.44Å
707	E	49.6	Very low	61.3	Low	171 Å²	171	86.4 Å²	86.4	80%	0.799	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-11.4	178.5	-55.2	-147.4	103.5	0	0	113.6	H705	H705-E707 IonicContact CE1-OE1 2.7Å
708	S	43.9	Very low	58.5	Low	45 Å²	45	89.5 Å²	89.5	32%	0.315	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-15.8	177.6	82.7	0	0	0	0	114.2	D706 L710	D706-S708 VanDerWaalsContact CG-OG 3.31Å; D706-S708 PolarHBondContact O-N 2.84Å; D706-S708 VanDerWaalsContact O-N 3.13Å; D706-S708 WeakPolarHBondContact OD1-CA 3.49Å; D706-S708 VanDerWaalsContact OD1-CB 3.26Å; D706-S708 WeakPolarHBondContact OD1-CB 3.2Å; D706-S708 PolarHBondContact OD1-N 2.91Å; D706-S708 PolarHBondContact OD1-OG 2.86Å; D706-S708 PolarHBondContact OD2-OG 3.38Å; S708-L710 PolarHBondContact O-N 3.18Å
709	S	43.8	Very low	55.8	Low	36 Å²	36	92.7 Å²	92.7	25%	0.252	49%	0.49	S	S	.	.			trans	-68.2	6.8	-169.6	64.7	0	0	0	0	116.9	L685 D706 P711	L685-S709 VanDerWaalsContact CD1-OG 3.28Å; L685-S709 WeakPolarHBondContact CD1-OG 3.36Å; D706-S709 WeakPolarHBondContact O-CB 3.41Å; D706-S709 PolarHBondContact O-N 3.19Å; D706-S709 PolarHBondContact O-OG 3.44Å; S709-P711 WeakPolarHBondContact O-CD 3.13Å
710	L	43.7	Very low	53.4	Low	64 Å²	64	91.7 Å²	91.7	34%	0.335	50%	0.498	S	S	.	.			trans	-98.9	102.2	-179.1	-64.3	-175.2	0	0	0	112.3	L622 S708 L712	L622-L710 HydrophobicContact CD1-CD2 3.66Å; S708-L710 PolarHBondContact O-N 3.18Å; L710-L712 PolarHBondContact O-N 2.97Å
711	P	35	Very low	50.8	Low	95 Å²	95	100 Å²	100	62%	0.617	53%	0.529	S	S	*	.			trans	-68.9	100	167.9	29.1	-33.7	0	0	0	109.6	S709 P713	S709-P711 WeakPolarHBondContact O-CD 3.13Å; P711-P713 VanDerWaalsContact O-CD 3.27Å; P711-P713 WeakPolarHBondContact O-CD 3.21Å
712	L	33.3	Very low	48	Very low	153 Å²	153	106.2 Å²	106.2	80%	0.801	55%	0.549	S	S	*	.			trans	-64.2	119.2	171.4	-69	176.8	0	0	0	109.4	L710 Q714	L710-L712 PolarHBondContact O-N 2.97Å; L712-Q714 PolarHBondContact O-N 2.81Å
713	P	37.4	Very low	45.4	Very low	70 Å²	70	112 Å²	112	46%	0.455	58%	0.576	S	S	.	*			trans	-61.4	124.9	175.5	-21.2	33.2	0	0	0	109.6	E660 P711 P715	E660-P713 HydrophobicContact CB-CG 4.45Å; P711-P713 VanDerWaalsContact O-CD 3.27Å; P711-P713 WeakPolarHBondContact O-CD 3.21Å; P713-P715 WeakPolarHBondContact O-CD 3.25Å; P713-P715 VanDerWaalsContact O-N 3.13Å
714	Q	35.6	Very low	43.1	Very low	176 Å²	176	114 Å²	114	82%	0.822	59%	0.588	S	S	*	*			trans	-58.5	115.9	179.3	-84.7	-162.7	3	0	0	110.8	L712 S716	L712-Q714 PolarHBondContact O-N 2.81Å; Q714-S716 PolarHBondContact O-N 2.98Å
715	P	32.8	Very low	41.1	Very low	119 Å²	119	117.2 Å²	117.2	77%	0.773	60%	0.598	S	S	*	*			trans	-74.4	110.3	165.2	-4.9	24.3	0	0	0	106.8	P713	P713-P715 WeakPolarHBondContact O-CD 3.25Å; P713-P715 VanDerWaalsContact O-N 3.13Å
716	S	30.8	Very low	39.5	Very low	82 Å²	82	116.3 Å²	116.3	57%	0.573	61%	0.61	S	S	*	*			trans	-53.1	138.6	-177.5	-47.5	0	0	0	0	111	Q714 F718	Q714-S716 PolarHBondContact O-N 2.98Å; S716-F718 VanDerWaalsContact C-N 3.3Å; S716-F718 PolarHBondContact O-N 2.89Å
717	P	36	Very low	38.2	Very low	114 Å²	114	118 Å²	118	74%	0.74	62%	0.616	S	S	*	*	S	Bend	trans	-83.3	52.4	-135.5	31.6	-39.6	0	0	0	116.1
718	F	35.9	Very low	37.7	Very low	117 Å²	117	115.8 Å²	115.8	51%	0.513	62%	0.619	S	S	.	*			trans	-150	149.4	-178.2	-73.9	-128.9	0	0	0	110.3	S716 L1041 S1042	S716-F718 VanDerWaalsContact C-N 3.3Å; S716-F718 PolarHBondContact O-N 2.89Å; F718-L1041 VanDerWaalsContact CB-CA 3.43Å; F718-L1041 HydrophobicContact CB-CB 3.2Å; F718-L1041 HydrophobicContact CB-CD1 3.89Å; F718-L1041 HydrophobicContact CB-CD2 3.63Å; F718-L1041 HydrophobicContact CB-CG 3.61Å; F718-L1041 HydrophobicContact CD1-CB 3.68Å; F718-L1041 HydrophobicContact CD1-CD1 4.41Å; F718-L1041 HydrophobicContact CD2-CD1 4.23Å; F718-L1041 HydrophobicContact CG-CB 3.72Å; F718-L1041 HydrophobicContact CG-CD1 4.01Å; F718-L1041 HydrophobicContact CG-CG 4.22Å; F718-L1041 VanDerWaalsContact O-CD2 3.3Å; F718-L1041 WeakPolarHBondContact O-CD2 3.38Å; F718-S1042 WeakPolarHBondContact CA-OG 3.37Å; F718-S1042 WeakPolarHBondContact CB-OG 3.48Å; F718-S1042 VanDerWaalsContact CD1-CB 3.41Å; F718-S1042 WeakPolarHBondContact CD1-OG 3.48Å; F718-S1042 WeakPolarHBondContact CG-OG 3.48Å
719	M	39.4	Very low	37	Very low	116 Å²	116	118.7 Å²	118.7	57%	0.571	64%	0.64	S	S	*	*			trans	85.6	102.3	178.6	-104.9	-37.7	162	0	0	116.1	S1042	M719-S1042 VanDerWaalsContact CA-N 3.27Å; M719-S1042 WeakPolarHBondContact CE-O 3.31Å; M719-S1042 VanDerWaalsContact N-CA 3.3Å
720	P	44.3	Very low	36.7	Very low	93 Å²	93	121.3 Å²	121.3	60%	0.604	66%	0.658	S	S	*	*			trans	-82.9	127.5	179.2	-8.9	28.6	0	0	0	112.2	S1043	P720-S1043 VanDerWaalsContact CD-OG 3.24Å; P720-S1043 WeakPolarHBondContact CD-OG 3.21Å; P720-S1043 VanDerWaalsContact CG-OG 3.3Å; P720-S1043 WeakPolarHBondContact CG-OG 3.37Å
721	R	39.5	Very low	36.4	Very low	219 Å²	219	126.3 Å²	126.3	83%	0.826	68%	0.677	S	S	*	*			trans	-93.4	126.6	176.1	-155.6	-179.5	-158.3	153.9	2.9	109.1	H723	R721-H723 PolarHBondContact O-N 2.71Å; R721-H723 VanDerWaalsContact O-N 3.11Å
722	R	36.5	Very low	36.6	Very low	254 Å²	254	130.6 Å²	130.6	96%	0.958	69%	0.686	S	S	*	*			trans	-69.6	108.7	174	-67.7	-169.2	-169.9	-179.9	5.2	110.4
723	H	36.3	Very low	36.8	Very low	123 Å²	123	131.8 Å²	131.8	57%	0.569	69%	0.692	S	S	*	*			trans	-137	142.8	168.6	-95	-103.7	0	0	0	108.3	R721	R721-H723 PolarHBondContact O-N 2.71Å; R721-H723 VanDerWaalsContact O-N 3.11Å
724	I	41	Very low	36.9	Very low	126 Å²	126	134.3 Å²	134.3	65%	0.646	70%	0.698	S	S	*	*			trans	168.9	120.1	146.3	-89.4	153	0	0	0	105.5
725	H	38.3	Very low	37	Very low	136 Å²	136	130.9 Å²	130.9	63%	0.63	68%	0.677	S	S	*	*			cis	90.6	112.5	30.6	-162.9	36.8	0	0	0	114.2	D178	D178-H725 WeakPolarHBondContact OD2-CA 3.3Å; D178-H725 PolarHBondContact OD2-N 2.88Å
726	G	37.2	Very low	37.1	Very low	61 Å²	61	129.9 Å²	129.9	63%	0.629	67%	0.674	S	S	*	*			trans	-169.1	53.2	-176	0	0	0	0	0	115.9	D178	D178-G726 VanDerWaalsContact OD1-C 3.28Å; D178-G726 WeakPolarHBondContact OD1-CA 3.38Å; D178-G726 PolarHBondContact OD1-N 2.9Å; D178-G726 PolarHBondContact OD2-N 2.8Å
727	E	32.1	Very low	37.3	Very low	107 Å²	107	132.6 Å²	132.6	50%	0.5	68%	0.677	S	S	.	*			trans	-73.5	158.1	173.8	-74.7	-162.4	89.4	0	0	114.9	E177 D178	E177-E727 HydrophobicContact CB-CG 3.94Å; D178-E727 PolarHBondContact OD1-N 3.21Å
728	S	38.5	Very low	37.1	Very low	125 Å²	125	136.2 Å²	136.2	87%	0.874	68%	0.676	S	S	*	*			trans	-161.7	141	154.7	-160.3	0	0	0	0	112.9
729	S	29.9	Very low	37.3	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	69%	0.685	S	S	*	*			trans	-151.5	101.8	176.9	-177.3	0	0	0	0	113.2
730	S	36.2	Very low	36.9	Very low	91 Å²	91	136.1 Å²	136.1	64%	0.636	69%	0.689	S	S	*	*			trans	173.9	140.1	130.4	-86.3	0	0	0	0	115.5
731	K	37.5	Very low	36.2	Very low	169 Å²	169	138.3 Å²	138.3	74%	0.735	70%	0.696	S	S	*	*			trans	26.3	153.1	137.4	-42.4	167.1	-163	164.8	0	120.9	E677	E677-K731 IonicContact OE1-NZ 2.64Å
732	K	40.1	Very low	35.9	Very low	185 Å²	185	132.4 Å²	132.4	80%	0.804	69%	0.688	S	S	*	*			cis	173.3	111.9	-38.9	170.2	-171.2	175.7	-164.3	0	108.8
733	L	37.6	Very low	35.8	Very low	177 Å²	177	126.7 Å²	126.7	93%	0.927	68%	0.676	S	S	*	*			trans	-135.9	173.2	165.8	-97.3	171.9	0	0	0	112.1
734	Q	38.7	Very low	35.8	Very low	124 Å²	124	129 Å²	129	58%	0.579	69%	0.691	S	S	*	*			trans	-111	117.8	-152.9	-69.1	-163.5	158.1	0	0	117.9	T1131 S1132	Q734-T1131 HydrophobicContact CB-CG2 4.08Å; Q734-T1131 HydrophobicContact CG-CG2 4Å; Q734-S1132 PolarHBondContact NE2-OG 3.24Å
735	R	38	Very low	35.4	Very low	103 Å²	103	126.3 Å²	126.3	39%	0.389	68%	0.683	S	S	.	*			trans	10.7	118.3	142.9	179.8	-93.5	-154.3	144.9	1.6	119.1	S1130 T1131	R735-S1130 PolarHBondContact NH1-O 3.18Å; R735-S1130 PolarHBondContact NH2-O 2.8Å; R735-T1131 HydrophobicContact CB-CG2 4.33Å; R735-T1131 WeakPolarHBondContact CD-OG1 3.47Å; R735-T1131 PolarHBondContact NH1-O 2.61Å; R735-T1131 PolarHBondContact NH1-OG1 3.17Å
736	S	36.3	Very low	35.4	Very low	99 Å²	99	126.8 Å²	126.8	69%	0.692	69%	0.691	S	S	*	*				-128.1	149.7	120.6	74.6	0	0	0	0	107
737	Q	34	Very low	35.4	Very low	138 Å²	138	132.9 Å²	132.9	65%	0.645	70%	0.696	S	S	*	*				46.7	134.8	95.2	-76.2	178.7	-18.7	0	0	115.2
738	R	31.6	Very low	35.9	Very low	191 Å²	191	135.3 Å²	135.3	72%	0.721	71%	0.707	S	S	*	*			cis	-160.5	164.1	-7.3	-157.1	-165.8	-76	-162	-0.9	107.9
739	I	39.3	Very low	36.3	Very low	137 Å²	137	135.1 Å²	135.1	70%	0.703	70%	0.701	S	S	*	*			trans	72.9	144.2	173.9	-42.9	149.9	0	0	0	108.7
740	S	31.3	Very low	37	Very low	93 Å²	93	137.1 Å²	137.1	65%	0.65	70%	0.703	S	S	*	*			cis	68.1	157.2	44.5	-8.1	0	0	0	0	113.2
741	D	30.9	Very low	37.2	Very low	140 Å²	140	139.9 Å²	139.9	75%	0.749	71%	0.711	S	S	*	*			cis	-149.6	169.6	-2.9	-110.2	-36.5	0	0	0	109.6
742	S	33.4	Very low	37.3	Very low	94 Å²	94	135.3 Å²	135.3	66%	0.657	71%	0.711	S	S	*	*			trans	64.1	147	160.8	-51.5	0	0	0	0	118
743	D	32.7	Very low	37.1	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	71%	0.713	S	S	*	*			cis	77.9	90.8	28.5	-55.6	-51.7	0	0	0	114.7	S745	D743-S745 WeakPolarHBondContact O-CB 3.26Å; D743-S745 PolarHBondContact O-OG 2.97Å
744	I	36.9	Very low	37.1	Very low	171 Å²	171	129.3 Å²	129.3	88%	0.877	70%	0.703	S	S	*	*			trans	-99.3	95.5	141.1	-165.4	171.8	0	0	0	103.7
745	S	33.4	Very low	37.1	Very low	69 Å²	69	129.6 Å²	129.6	48%	0.483	71%	0.714	S	S	.	*			cis	55.1	90.3	37.9	85.2	0	0	0	0	111.6	D743	D743-S745 WeakPolarHBondContact O-CB 3.26Å; D743-S745 PolarHBondContact O-OG 2.97Å
746	D	36.8	Very low	37.1	Very low	146 Å²	146	130.4 Å²	130.4	78%	0.781	73%	0.73	S	S	*	*				98.5	-177.8	88.4	-148.4	-22.3	0	0	0	108.4
747	Y	38.8	Very low	37.5	Very low	189 Å²	189	131.6 Å²	131.6	74%	0.741	74%	0.735	S	S	*	*			trans	70.7	131	-174.3	-49.3	-80.1	0	0	0	113.5
748	E	41.6	Very low	38	Very low	159 Å²	159	129.7 Å²	129.7	74%	0.743	74%	0.735	S	S	*	*			cis	-139.8	149.8	-5.3	-105.8	160.2	125.5	0	0	107.9
749	V	48.2	Very low	38.3	Very low	121 Å²	121	127.1 Å²	127.1	73%	0.733	74%	0.74	S	S	*	*				49.8	120.1	83.8	-167.6	0	0	0	0	110.2
750	D	43.6	Very low	38.1	Very low	148 Å²	148	123.5 Å²	123.5	79%	0.791	74%	0.736	S	S	*	*				-155.7	-173.6	52.2	-153.8	4.3	0	0	0	115.6
751	D	39.9	Very low	38.3	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	74%	0.744	S	S	*	*			trans	-55.3	159.9	177.1	-88.1	-41.7	0	0	0	116.6
752	G	40.8	Very low	38.4	Very low	72 Å²	72	132.8 Å²	132.8	74%	0.742	75%	0.748	S	S	*	*			trans	-166.2	20.2	-174.8	0	0	0	0	0	120.3
753	I	36.3	Very low	38.2	Very low	166 Å²	166	132.9 Å²	132.9	85%	0.851	75%	0.754	S	S	*	*			trans	35.3	115.6	156.7	-54.3	173.3	0	0	0	120.1
754	G	36.6	Very low	38.3	Very low	70 Å²	70	132.2 Å²	132.2	72%	0.722	76%	0.76	S	S	*	*			trans	100.5	167.5	137.1	0	0	0	0	0	118.6
755	V	39	Very low	38.2	Very low	131 Å²	131	127.9 Å²	127.9	79%	0.794	75%	0.75	S	S	*	*			cis	-140.6	118	0.1	170.3	0	0	0	0	110.8
756	V	37.3	Very low	38.4	Very low	120 Å²	120	135.2 Å²	135.2	73%	0.727	77%	0.767	S	S	*	*			trans	52	130.3	145.3	-177.6	0	0	0	0	121.3
757	P	45.9	Very low	38.4	Very low	123 Å²	123	134.9 Å²	134.9	80%	0.799	76%	0.761	S	S	*	*			trans	-85.2	-108.6	167.1	34.5	-29	0	0	0	112.4
758	P	44.5	Very low	38.1	Very low	99 Å²	99	130.7 Å²	130.7	64%	0.643	76%	0.759	S	S	*	*			cis	-125.6	-173.8	-5.7	36.4	-14.4	0	0	0	115.5
759	V	37	Very low	37.9	Very low	136 Å²	136	132.4 Å²	132.4	82%	0.824	76%	0.764	S	S	*	*			trans	71.4	139.2	168.3	-164	0	0	0	0	116.2	Y761	V759-Y761 HydrophobicContact CG1-CD2 4.5Å
760	G	35.8	Very low	37.1	Very low	61 Å²	61	130.6 Å²	130.6	63%	0.629	76%	0.762	S	S	*	*			cis	167.6	-176.4	-7.8	0	0	0	0	0	112.8
761	Y	34.2	Very low	36.6	Very low	205 Å²	205	129.7 Å²	129.7	80%	0.804	76%	0.762	S	S	*	*			trans	58.7	112.7	165.4	-71.3	-93.9	0	0	0	121.9	V759	V759-Y761 HydrophobicContact CG1-CD2 4.5Å
762	R	33.5	Very low	36.1	Very low	224 Å²	224	127.6 Å²	127.6	85%	0.845	76%	0.755	S	S	*	*			trans	53.5	103.6	133.7	-65.3	-173.1	175.4	-164.6	-1.5	121.3
763	A	30.7	Very low	35.6	Very low	95 Å²	95	131.3 Å²	131.3	79%	0.785	76%	0.757	S	S	*	*				58.9	122.8	112.8	0	0	0	0	0	122.5
764	S	34.2	Very low	35.4	Very low	121 Å²	121	128.8 Å²	128.8	85%	0.846	75%	0.749	S	S	*	*			trans	68.6	120.3	144.1	-157.2	0	0	0	0	119.7
765	A	34.4	Very low	35.6	Very low	81 Å²	81	130.7 Å²	130.7	67%	0.669	75%	0.747	S	S	*	*				167.9	166.9	98	0	0	0	0	0	111.5
766	R	38.5	Very low	35.5	Very low	222 Å²	222	130 Å²	130	84%	0.838	75%	0.745	S	S	*	*			trans	67.8	159.4	159.7	-66.9	-161.4	141.7	129.8	5.1	118.6
767	E	35	Very low	35.5	Very low	139 Å²	139	131.6 Å²	131.6	65%	0.65	74%	0.744	S	S	*	*			cis	-169.8	140.6	-42	-118.6	-179.5	103.9	0	0	107	K769	E767-K769 PolarHBondContact O-N 2.97Å
768	S	34	Very low	35.1	Very low	101 Å²	101	132.4 Å²	132.4	71%	0.706	74%	0.738	S	S	*	*			trans	22.3	92.5	143.2	-52.2	0	0	0	0	120.4
769	K	37.2	Very low	34.8	Very low	196 Å²	196	134 Å²	134	85%	0.852	74%	0.737	S	S	*	*				-157.9	123.5	126.9	-95.5	134.9	-172.1	177.7	0	107.7	E767	E767-K769 PolarHBondContact O-N 2.97Å
770	A	30.1	Very low	35.1	Very low	83 Å²	83	137 Å²	137	69%	0.686	73%	0.733	S	S	*	*			cis	72.1	141.8	47.8	0	0	0	0	0	113.4
771	T	34.5	Very low	35.2	Very low	129 Å²	129	140 Å²	140	79%	0.791	74%	0.739	S	S	*	*			trans	64.8	149.6	165.8	48.8	0	0	0	0	118.8
772	T	29.8	Very low	35.5	Very low	106 Å²	106	135.4 Å²	135.4	65%	0.65	73%	0.733	S	S	*	*			cis	174.9	132	-26.8	-99.5	0	0	0	0	106.6
773	L	30	Very low	35.8	Very low	149 Å²	149	130.8 Å²	130.8	78%	0.78	72%	0.721	S	S	*	*			trans	60.6	178.9	170	-61.5	167.1	0	0	0	114.5
774	T	32.3	Very low	36.1	Very low	113 Å²	113	132.4 Å²	132.4	69%	0.693	71%	0.712	S	S	*	*			cis	-146.7	134.7	5.3	-15.8	0	0	0	0	107.5
775	V	39.3	Very low	36.3	Very low	111 Å²	111	135.7 Å²	135.7	67%	0.673	71%	0.705	S	S	*	*				42	116.9	89.9	-168.4	0	0	0	0	114.3
776	P	38	Very low	36.3	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	70%	0.702	S	S	*	*				-114	146.2	116	-8.4	28.1	0	0	0	111.5
777	E	37.7	Very low	36.2	Very low	153 Å²	153	134.1 Å²	134.1	72%	0.715	70%	0.695	S	S	*	*				70.9	130.7	57	-92.2	-168	74.9	0	0	113.7
778	Q	36.6	Very low	36.1	Very low	140 Å²	140	132.1 Å²	132.1	65%	0.654	70%	0.697	S	S	*	*			cis	-136.1	-162.4	4.9	-56.4	-172.6	-17.6	0	0	110.1
779	Q	38.1	Very low	36.1	Very low	134 Å²	134	133.4 Å²	133.4	63%	0.626	70%	0.7	S	S	*	*			cis	-158.4	174.5	0.6	-146.5	-175.6	97	0	0	110.2
780	R	42.4	Very low	36.1	Very low	197 Å²	197	129.4 Å²	129.4	74%	0.743	70%	0.697	S	S	*	*			trans	66.2	89.6	154.9	-75	-178.1	-171.3	-134.1	-3.5	122.5
781	T	39.3	Very low	36.4	Very low	124 Å²	124	130.5 Å²	130.5	76%	0.761	70%	0.697	S	S	*	*				78.5	146	117.4	53.4	0	0	0	0	124.3
782	T	39.1	Very low	36.5	Very low	110 Å²	110	132.8 Å²	132.8	68%	0.675	70%	0.698	S	S	*	*			trans	84.9	104.4	154.1	52.6	0	0	0	0	124.7
783	H	40.9	Very low	36.8	Very low	127 Å²	127	139.9 Å²	139.9	59%	0.588	71%	0.713	S	S	*	*			trans	79.9	129.3	133.5	-77.2	-77.3	0	0	0	125.5	R229	R229-H783 WeakPolarHBondContact CD-O 3.46Å; R229-H783 PolarHBondContact NH1-O 2.92Å
784	H	36.8	Very low	37.2	Very low	129 Å²	129	136.1 Å²	136.1	60%	0.597	71%	0.71	S	S	*	*			trans	78.3	95.7	131.4	-67.3	-38.1	0	0	0	127.5	R229	R229-H784 VanDerWaalsContact CD-C 3.42Å; R229-H784 PolarHBondContact NE-O 2.84Å; R229-H784 PolarHBondContact NH1-O 3.2Å
785	R	38.5	Very low	37.3	Very low	189 Å²	189	138.7 Å²	138.7	71%	0.713	72%	0.72	S	S	*	*			trans	67.2	153.2	148.3	-65.6	-178.2	173.2	161.6	-3.3	119.4	P228 R229	P228-R785 VanDerWaalsContact CG-CA 3.49Å; R229-R785 WeakPolarHBondContact CG-O 3.37Å; R229-R785 PolarHBondContact NE-O 3.06Å
786	S	34.2	Very low	37	Very low	85 Å²	85	139.7 Å²	139.7	59%	0.594	72%	0.721	S	S	*	*			cis	-157.8	171	-18.3	-98	0	0	0	0	112.1
787	R	36.3	Very low	37	Very low	185 Å²	185	142.4 Å²	142.4	70%	0.698	72%	0.724	S	S	*	*			trans	-105.3	-171.3	-178.8	-69.2	177.3	166.3	-160.2	-0.2	113.1	V227 P228	V227-R787 HydrophobicContact CG1-CB 3.84Å; V227-R787 HydrophobicContact CG1-CG 3.98Å; V227-R787 HydrophobicContact CG2-CB 4.28Å; P228-R787 HydrophobicContact CB-CG 4.42Å
788	S	32.5	Very low	36.9	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	73%	0.727	S	S	*	*			trans	72.2	142.9	160.6	26.3	0	0	0	0	117.3
789	V	33.9	Very low	36.7	Very low	128 Å²	128	143.2 Å²	143.2	78%	0.776	74%	0.738	S	S	*	*			cis	74.7	102.8	10.4	-166.5	0	0	0	0	116.9
790	S	37	Very low	36.6	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	74%	0.736	S	S	*	*			trans	168.1	159	131.6	-91.1	0	0	0	0	113.1
791	P	36.9	Very low	36.1	Very low	105 Å²	105	141.4 Å²	141.4	68%	0.682	74%	0.737	S	S	*	*			trans	-117.4	161.8	177.2	41.1	-31.6	0	0	0	116.2
792	H	35.9	Very low	35.8	Very low	178 Å²	178	139.6 Å²	139.6	82%	0.824	73%	0.73	S	S	*	*			trans	71.4	128	154	-69.6	-49	0	0	0	123.9
793	R	37.8	Very low	35.7	Very low	255 Å²	255	146.1 Å²	146.1	96%	0.962	74%	0.742	S	S	*	*			trans	65.2	154.1	152.4	-68.6	-168.9	177.6	-153.2	0.5	118.9
794	G	38.2	Very low	35.6	Very low	70 Å²	70	148 Å²	148	72%	0.722	76%	0.755	S	S	*	*			trans	175.8	-37.6	160.2	0	0	0	0	0	121
795	D	33.8	Very low	35.9	Very low	166 Å²	166	147.1 Å²	147.1	89%	0.888	76%	0.761	S	S	*	*			trans	58.1	160.7	179.7	-84.5	-63.6	0	0	0	121
796	D	33.9	Very low	35.9	Very low	132 Å²	132	144.7 Å²	144.7	71%	0.706	76%	0.762	S	S	*	*			trans	76.7	150	159.8	-127.2	-40.1	0	0	0	122.6
797	Q	36.3	Very low	36.3	Very low	173 Å²	173	145.9 Å²	145.9	81%	0.808	77%	0.766	S	S	*	*			trans	61.4	133	168.6	-55.6	-62.5	-52.1	0	0	120.3
798	G	36.6	Very low	36.4	Very low	75 Å²	75	142.3 Å²	142.3	77%	0.773	77%	0.766	S	S	*	*			trans	114.2	53.7	142.5	0	0	0	0	0	121.9
799	R	31.6	Very low	36.8	Very low	235 Å²	235	145 Å²	145	89%	0.887	77%	0.773	S	S	*	*			trans	-42.1	168	152.8	-88.1	178	153	-117.1	1.4	114.5
800	P	36.3	Very low	36.8	Very low	91 Å²	91	145.2 Å²	145.2	59%	0.591	77%	0.765	S	S	*	*			cis	-147.2	-167.8	-44.4	43.5	-24.3	0	0	0	114.1
801	R	31.9	Very low	36.8	Very low	203 Å²	203	149.9 Å²	149.9	77%	0.766	77%	0.765	S	S	*	*			trans	67.2	163.4	154.8	-79	-177.4	175.1	-164	-6.5	118.6
802	S	32.9	Very low	36.8	Very low	86 Å²	86	149.6 Å²	149.6	60%	0.601	77%	0.766	S	S	*	*			cis	173.6	144	-37.2	57.4	0	0	0	0	110.7
803	R	38.1	Very low	36.8	Very low	247 Å²	247	148 Å²	148	93%	0.932	76%	0.763	S	S	*	*			trans	179.3	157.5	146	-100.7	158.4	-154.2	-86.6	3.8	113.3
804	L	39.1	Very low	36.5	Very low	166 Å²	166	142.3 Å²	142.3	87%	0.869	75%	0.751	S	S	*	*			trans	-138.9	162.2	-179.9	-78.9	170.7	0	0	0	110.7
805	P	41.6	Very low	36.3	Very low	110 Å²	110	145.4 Å²	145.4	71%	0.714	75%	0.747	S	S	*	*				-122.6	176.4	118.4	38.7	-33.1	0	0	0	109.8
806	N	39.8	Very low	36.6	Very low	138 Å²	138	144.2 Å²	144.2	74%	0.738	74%	0.739	S	S	*	*			cis	-155.5	164.6	-2.4	-128.3	39.8	0	0	0	106.1
807	V	41.9	Very low	36.7	Very low	111 Å²	111	144.1 Å²	144.1	67%	0.673	73%	0.734	S	S	*	*			cis	72.3	123.2	25.6	-173	0	0	0	0	113.5
808	P	38.3	Very low	36.9	Very low	110 Å²	110	140.6 Å²	140.6	71%	0.714	73%	0.726	S	S	*	*			cis	-73	175.8	-0.2	34.7	-38.6	0	0	0	112.9
809	L	41.4	Very low	36.6	Very low	154 Å²	154	142.4 Å²	142.4	81%	0.806	72%	0.722	S	S	*	*			cis	-144	169.5	-12	-138.6	65.2	0	0	0	105.3
810	Q	34.6	Very low	36.6	Very low	131 Å²	131	141.4 Å²	141.4	61%	0.612	72%	0.718	S	S	*	*			cis	-145.9	174.4	8.1	176.7	161.6	-152.7	0	0	109.9
811	R	36.4	Very low	36.3	Very low	211 Å²	211	147.6 Å²	147.6	80%	0.796	73%	0.73	S	S	*	*			trans	-10	130.4	163.2	-62.8	169.2	164.7	110.6	-3.9	116.2
812	S	36.7	Very low	36.3	Very low	100 Å²	100	143 Å²	143	70%	0.699	73%	0.729	S	S	*	*			cis	-161.8	135.3	-4	32.3	0	0	0	0	109.1
813	L	36.5	Very low	36.1	Very low	145 Å²	145	149.6 Å²	149.6	76%	0.759	74%	0.741	S	S	*	*				56.1	140.4	89.6	-49.3	-172.8	0	0	0	114.1
814	D	31.7	Very low	35.9	Very low	134 Å²	134	143.1 Å²	143.1	72%	0.717	73%	0.733	S	S	*	*			cis	-171.3	166	-9.3	-99.5	-15.1	0	0	0	107.6
815	E	33	Very low	35.8	Very low	136 Å²	136	140.3 Å²	140.3	64%	0.636	73%	0.725	S	S	*	*			cis	-162.1	-103.1	-26.4	-170.2	-76.7	126.8	0	0	105.6	H817	E815-H817 IonicContact OE1-CD2 3.98Å; E815-H817 IonicContact OE2-CD2 3.96Å
816	I	40.7	Very low	35.2	Very low	141 Å²	141	140 Å²	140	72%	0.723	72%	0.721	S	S	*	*			trans	39.1	95	156.7	-48.8	-179.5	0	0	0	116.9
817	H	35.8	Very low	34.8	Very low	130 Å²	130	143.4 Å²	143.4	60%	0.602	72%	0.724	S	S	*	*				77.8	155.7	81	-93.8	-127.9	0	0	0	116.5	E815	E815-H817 IonicContact OE1-CD2 3.98Å; E815-H817 IonicContact OE2-CD2 3.96Å
818	P	39.6	Very low	34.3	Very low	98 Å²	98	144.5 Å²	144.5	64%	0.636	72%	0.721	S	S	*	*			trans	-124.5	-150.9	-143	44.5	-31.5	0	0	0	114.5
819	T	30.3	Very low	34.1	Very low	114 Å²	114	146.3 Å²	146.3	70%	0.699	72%	0.72	S	S	*	*			trans	92.5	162	167.4	80.9	0	0	0	0	117.2
820	R	31.3	Very low	33.6	Very low	213 Å²	213	145.5 Å²	145.5	80%	0.804	72%	0.716	S	S	*	*			trans	72.8	127.3	169.3	-71.2	175.1	-179.8	-129.7	-2	113.6
821	R	31.5	Very low	33.4	Very low	222 Å²	222	142.6 Å²	142.6	84%	0.838	72%	0.715	S	S	*	*				57.1	127.6	79.8	-62.6	-177.2	-175.7	-154.5	2.3	110.2
822	S	30.4	Very low	33.1	Very low	105 Å²	105	136.9 Å²	136.9	73%	0.734	71%	0.707	S	S	*	*			cis	-165.8	171.7	13.5	25	0	0	0	0	112.3
823	R	30.1	Very low	33.1	Very low	226 Å²	226	143.6 Å²	143.6	85%	0.853	72%	0.717	S	S	*	*			trans	17.2	123.3	145.3	-60.8	-179.8	176.6	-157.4	-3.4	117.2
824	S	33.5	Very low	33	Very low	111 Å²	111	142 Å²	142	78%	0.776	72%	0.718	S	S	*	*				30	137.2	115.8	-42.5	0	0	0	0	117.5
825	P	37.7	Very low	33.1	Very low	106 Å²	106	143.3 Å²	143.3	69%	0.688	72%	0.724	S	S	*	*				-158.7	168.1	59.6	44.3	-23.9	0	0	0	119.7
826	T	29.3	Very low	33.2	Very low	105 Å²	105	140.8 Å²	140.8	64%	0.644	73%	0.727	S	S	*	*			trans	51.1	127.4	138.4	54.4	0	0	0	0	123.9
827	R	30.3	Very low	33	Very low	209 Å²	209	140.8 Å²	140.8	79%	0.789	73%	0.728	S	S	*	*			trans	68.3	162.3	138.9	-56	163.9	-178.3	-170.7	-1.3	115
828	H	32.4	Very low	33.1	Very low	133 Å²	133	141.5 Å²	141.5	62%	0.616	73%	0.731	S	S	*	*			cis	-142.1	171.1	18.8	-92.1	-83.6	0	0	0	111.8
829	H	33.5	Very low	33.1	Very low	149 Å²	149	147 Å²	147	69%	0.69	74%	0.739	S	S	*	*			trans	29.1	142.4	139.6	-58.3	-54.2	0	0	0	121.6
830	D	30.2	Very low	33.4	Very low	136 Å²	136	145.3 Å²	145.3	73%	0.727	73%	0.732	S	S	*	*			cis	-161	-178.6	-5	-131.8	-47.4	0	0	0	114.9
831	A	29.9	Very low	33.8	Very low	70 Å²	70	146 Å²	146	58%	0.579	74%	0.735	S	S	*	*			trans	-41.2	138.9	176	0	0	0	0	0	119.8
832	S	31	Very low	34.1	Very low	92 Å²	92	142.6 Å²	142.6	64%	0.643	73%	0.728	S	S	*	*				75.8	130.7	129.2	73.9	0	0	0	0	121
833	R	36.8	Very low	34.7	Very low	241 Å²	241	141.8 Å²	141.8	91%	0.909	73%	0.728	S	S	*	*				179.8	159.6	102.8	-92.2	153.4	-168.9	-113.6	3.1	111.9
834	S	34.5	Very low	35	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	72%	0.721	S	S	*	*			trans	-138.2	120.7	174.1	59.1	0	0	0	0	110.7
835	L	33.8	Very low	35.2	Very low	162 Å²	162	138.1 Å²	138.1	85%	0.848	72%	0.72	S	S	*	*			trans	-150.7	137.9	164.6	-103.8	103.1	0	0	0	106.2
836	A	35.4	Very low	35	Very low	83 Å²	83	141.3 Å²	141.3	69%	0.686	73%	0.726	S	S	*	*			cis	94.1	121.5	26.1	0	0	0	0	0	114.5
837	D	36.9	Very low	35.1	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	73%	0.733	S	S	*	*			trans	171.2	153.3	155.2	-105.8	15.1	0	0	0	111.1
838	H	37	Very low	35.1	Very low	145 Å²	145	140.8 Å²	140.8	67%	0.671	73%	0.728	S	S	*	*			cis	-166.8	158.4	-19.3	-140.9	-3.1	0	0	0	114.1
839	R	39.1	Very low	35.1	Very low	213 Å²	213	139.7 Å²	139.7	80%	0.804	74%	0.736	S	S	*	*			trans	81.7	152.8	152.6	-68.2	178.2	176.8	-155.8	-1.2	123.6
840	S	37	Very low	35	Very low	79 Å²	79	141 Å²	141	55%	0.552	74%	0.742	S	S	*	*			cis	177.9	154.9	-34.3	59.1	0	0	0	0	115.5
841	R	40.5	Very low	35.2	Very low	227 Å²	227	140.7 Å²	140.7	86%	0.857	75%	0.748	S	S	*	*			trans	76	149.2	148.2	-75.4	158.1	-170.1	-109.3	0.1	119.5
842	H	36.9	Very low	35.1	Very low	152 Å²	152	144.3 Å²	144.3	70%	0.704	76%	0.757	S	S	*	*			cis	-167.3	172	-16.6	-146.1	-100	0	0	0	111	E844	H842-E844 IonicContact CE1-OE2 3.37Å; H842-E844 PolarHBondContact CE1-OE2 3.33Å; H842-E844 VanDerWaalsContact CE1-OE2 3.22Å; H842-E844 IonicContact CG-OE2 3.52Å; H842-E844 IonicContact ND1-OE2 2.61Å; H842-E844 PolarHBondContact ND1-OE2 2.97Å
843	A	42.6	Very low	35.1	Very low	87 Å²	87	144.5 Å²	144.5	72%	0.719	76%	0.759	S	S	*	*			trans	79.3	155.2	160.6	0	0	0	0	0	122.6
844	E	37.5	Very low	34.8	Very low	154 Å²	154	141.2 Å²	141.2	72%	0.72	75%	0.753	S	S	*	*			cis	-173.8	163.9	-46.4	-104.6	150.3	90.8	0	0	114.5	H842	H842-E844 IonicContact CE1-OE2 3.37Å; H842-E844 PolarHBondContact CE1-OE2 3.33Å; H842-E844 VanDerWaalsContact CE1-OE2 3.22Å; H842-E844 IonicContact CG-OE2 3.52Å; H842-E844 IonicContact ND1-OE2 2.61Å; H842-E844 PolarHBondContact ND1-OE2 2.97Å
845	S	36.5	Very low	34.6	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	75%	0.752	S	S	*	*			trans	65.2	116.2	162.6	78.1	0	0	0	0	126.6
846	Q	34.1	Very low	34.5	Very low	173 Å²	173	142 Å²	142	81%	0.808	75%	0.748	S	S	*	*			trans	90.9	127.7	131	-80.5	-172.3	20.6	0	0	126.1
847	Y	31.8	Very low	34.2	Very low	205 Å²	205	145.9 Å²	145.9	80%	0.804	75%	0.754	S	S	*	*			trans	76.6	123.7	152.3	-85.3	-76.6	0	0	0	124.7
848	S	29.9	Very low	34.7	Very low	98 Å²	98	146.5 Å²	146.5	69%	0.685	76%	0.757	S	S	*	*			trans	88.8	111.3	142.5	-59.9	0	0	0	0	124
849	S	31.5	Very low	34.8	Very low	110 Å²	110	145.4 Å²	145.4	77%	0.769	76%	0.762	S	S	*	*			trans	70.9	150.9	140.5	53.2	0	0	0	0	122.9
850	E	32.7	Very low	34.7	Very low	176 Å²	176	146.8 Å²	146.8	82%	0.822	77%	0.767	S	S	*	*			trans	64.2	122.2	178	-58.3	-55.5	88	0	0	118.5
851	P	33.3	Very low	34.7	Very low	130 Å²	130	146.4 Å²	146.4	84%	0.844	77%	0.769	S	S	*	*			trans	-96.7	107.8	179.5	35.5	-30.3	0	0	0	113
852	D	29.5	Very low	34.8	Very low	146 Å²	146	144.4 Å²	144.4	78%	0.781	77%	0.767	S	S	*	*			trans	-118.6	147.2	162.4	-161.7	-20.1	0	0	0	109.2
853	S	30.6	Very low	35	Very low	96 Å²	96	148.4 Å²	148.4	67%	0.671	78%	0.776	S	S	*	*			trans	55.1	129.5	160.5	-67	0	0	0	0	122.1
854	E	29.3	Very low	34.8	Very low	172 Å²	172	147.4 Å²	147.4	80%	0.804	77%	0.774	S	S	*	*			trans	60.4	104.6	143.2	-62.2	-152.7	102.4	0	0	122.8
855	L	30.4	Very low	35.1	Very low	142 Å²	142	151.3 Å²	151.3	74%	0.743	78%	0.782	S	S	*	*				61.4	152.9	114.8	-90.1	169.2	0	0	0	123
856	L	31.7	Very low	35.2	Very low	148 Å²	148	150.5 Å²	150.5	78%	0.775	78%	0.776	S	S	*	*			trans	73.5	143.3	172.7	-45.7	-175.3	0	0	0	114.9
857	M	29.3	Very low	35.3	Very low	163 Å²	163	146.3 Å²	146.3	80%	0.803	77%	0.771	S	S	*	*			cis	-131.7	158.8	4.6	-84.2	-61.1	-84	0	0	113
858	L	46.9	Very low	35.4	Very low	154 Å²	154	143.6 Å²	143.6	81%	0.806	77%	0.766	S	S	*	*			trans	-72.9	171.1	167.3	-63.2	168.2	0	0	0	112.6
859	P	39.4	Very low	35.7	Very low	121 Å²	121	144.6 Å²	144.6	79%	0.786	77%	0.772	S	S	*	*				-138.4	135.4	109	36.4	-25.8	0	0	0	116.6
860	R	36.7	Very low	35.9	Very low	242 Å²	242	144.8 Å²	144.8	91%	0.913	76%	0.763	S	S	*	*			trans	29.9	144.7	134	-74.7	-178.3	159.8	112.1	-1.4	120.2
861	A	38.8	Very low	36.1	Very low	72 Å²	72	144.8 Å²	144.8	60%	0.595	76%	0.763	S	S	*	*			cis	-167.9	151	33.7	0	0	0	0	0	116.8
862	K	40.7	Very low	36	Very low	184 Å²	184	145.2 Å²	145.2	80%	0.8	76%	0.755	S	S	*	*			trans	64.9	150.7	147.8	-62.9	165.8	-174.6	171.7	0	117.2
863	R	41.5	Very low	36.3	Very low	236 Å²	236	143.7 Å²	143.7	89%	0.891	75%	0.752	S	S	*	*			cis	-164.6	152.9	-6.9	-111.5	174.3	178.7	178.3	-1.5	105.8
864	G	39.2	Very low	36.5	Very low	66 Å²	66	144.2 Å²	144.2	68%	0.68	76%	0.755	S	S	*	*			cis	153.8	172.7	-6.6	0	0	0	0	0	112.7
865	R	42.5	Very low	36.7	Very low	237 Å²	237	144.3 Å²	144.3	89%	0.894	76%	0.756	S	S	*	*			trans	78.2	145.1	175.1	-58.2	-173.3	175.2	-75.8	3.6	116.9
866	S	39.2	Very low	37.1	Very low	89 Å²	89	145.5 Å²	145.5	62%	0.622	76%	0.762	S	S	*	*			cis	-173.3	168	-20.6	47.7	0	0	0	0	106.9	E868	S866-E868 WeakPolarHBondContact CA-OE2 3.25Å; S866-E868 WeakPolarHBondContact CB-OE2 3.46Å
867	A	35.9	Very low	37.1	Very low	85 Å²	85	147 Å²	147	70%	0.702	77%	0.765	S	S	*	*			cis	-144.7	161.4	14.8	0	0	0	0	0	109.5
868	E	34.5	Very low	37.7	Very low	149 Å²	149	144 Å²	144	70%	0.696	76%	0.757	S	S	*	*			cis	80.5	84.9	26.9	-51.5	156.9	83.7	0	0	111.7	S866	S866-E868 WeakPolarHBondContact CA-OE2 3.25Å; S866-E868 WeakPolarHBondContact CB-OE2 3.46Å
869	C	36.8	Very low	37	Very low	119 Å²	119	142.9 Å²	142.9	80%	0.804	76%	0.762	S	S	*	*			cis	80	176.6	41.3	-159.7	0	0	0	0	115
870	L	35.6	Very low	36.7	Very low	113 Å²	113	144.3 Å²	144.3	59%	0.592	76%	0.763	S	S	*	*			trans	101.4	155.5	162.4	-52.9	177.6	0	0	0	117.3	M872	L870-M872 HydrophobicContact CD2-SD 4.49Å
871	H	36.3	Very low	36.6	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.815	75%	0.748	S	S	*	*			cis	-140.4	-164.5	32.8	-76.3	-93.9	0	0	0	116.8
872	M	31.5	Very low	36.4	Very low	140 Å²	140	144.7 Å²	144.7	69%	0.69	76%	0.757	S	S	*	*			trans	-145.9	161.9	-141.3	-69.6	170.5	50.8	0	0	118.6	L870	L870-M872 HydrophobicContact CD2-SD 4.49Å
873	T	34.7	Very low	36.2	Very low	114 Å²	114	140 Å²	140	70%	0.699	75%	0.752	S	S	*	*			trans	61.7	129.8	139.1	51.9	0	0	0	0	127.2
874	S	35.6	Very low	36.1	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	75%	0.752	S	S	*	*				59.3	128.5	129.7	-65.7	0	0	0	0	128.2
875	E	33.8	Very low	35.9	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	76%	0.762	S	S	*	*			trans	74	151.2	135	-70	-163.4	-151.7	0	0	126.1
876	L	37.6	Very low	35.6	Very low	166 Å²	166	135.7 Å²	135.7	87%	0.869	75%	0.754	S	S	*	*			trans	79.9	159.9	167.1	-60.6	-178.1	0	0	0	121.7
877	Q	32.9	Very low	35.5	Very low	180 Å²	180	136 Å²	136	84%	0.841	76%	0.756	S	S	*	*			trans	-112.7	179.5	-172.3	-96.6	-146.6	0.9	0	0	111.5
878	P	41.6	Very low	35.5	Very low	100 Å²	100	137.8 Å²	137.8	65%	0.649	76%	0.759	S	S	*	*			cis	-135.3	161.9	-41.7	37.5	-22.5	0	0	0	113.1
879	S	32.2	Very low	35.9	Very low	130 Å²	130	138.7 Å²	138.7	91%	0.909	77%	0.768	S	S	*	*			trans	-179.8	162.2	143.3	33.2	0	0	0	0	115
880	L	33.7	Very low	35.9	Very low	152 Å²	152	137.5 Å²	137.5	80%	0.796	76%	0.76	S	S	*	*			trans	-66.9	162.7	-163	-64.5	160.3	0	0	0	119.2
881	D	34.2	Very low	36.1	Very low	112 Å²	112	140.1 Å²	140.1	60%	0.599	77%	0.774	S	S	*	*			trans	67.9	151.6	142.4	-80.5	-42.2	0	0	0	119.8
882	R	33.8	Very low	36.1	Very low	209 Å²	209	140.8 Å²	140.8	79%	0.789	77%	0.769	S	S	*	*			cis	-161.4	168	-12.7	-129	156.7	173.2	113.3	-17.4	105.6
883	A	37.5	Very low	37.1	Very low	85 Å²	85	138.1 Å²	138.1	70%	0.702	76%	0.762	S	S	*	*			cis	-144.8	172.9	2.4	0	0	0	0	0	107.4
884	R	39.1	Very low	37.2	Very low	235 Å²	235	137.6 Å²	137.6	89%	0.887	76%	0.755	S	S	*	*			cis	74.8	122.3	32.6	-103.4	-168.2	-171.7	-173.5	5	117.3
885	S	34.8	Very low	37.1	Very low	126 Å²	126	138.6 Å²	138.6	88%	0.881	76%	0.757	S	S	*	*			trans	176.5	158.6	143.2	-83.5	0	0	0	0	109.7
886	A	36.3	Very low	37.1	Very low	89 Å²	89	134.6 Å²	134.6	74%	0.736	75%	0.749	S	S	*	*			cis	-162.8	167.7	4.4	0	0	0	0	0	109
887	S	37.4	Very low	37	Very low	95 Å²	95	133.5 Å²	133.5	66%	0.664	74%	0.743	S	S	*	*			cis	-171	131.4	-16.7	52.3	0	0	0	0	112.6
888	T	35.7	Very low	37.1	Very low	123 Å²	123	132.6 Å²	132.6	76%	0.755	74%	0.738	S	S	*	*			trans	56.4	137.9	134.9	62.4	0	0	0	0	124.3
889	N	43.9	Very low	36.6	Very low	167 Å²	167	132.4 Å²	132.4	89%	0.893	74%	0.739	S	S	*	*				-148.1	164.2	126.6	-147.7	-8.4	0	0	0	110.6
890	C	36	Very low	37	Very low	95 Å²	95	131.8 Å²	131.8	64%	0.642	73%	0.732	S	S	*	*			trans	-137.3	-179.1	-149.7	-64.6	0	0	0	0	118.6
891	L	40.5	Very low	36.9	Very low	168 Å²	168	132.3 Å²	132.3	88%	0.88	73%	0.731	S	S	*	*			trans	85	148.1	173.5	-48.6	175.7	0	0	0	115.8
892	R	35.2	Very low	37	Very low	190 Å²	190	136.8 Å²	136.8	72%	0.717	74%	0.739	S	S	*	*			cis	-150.9	173.1	-16.3	-121	-138.4	115.2	-119.8	-2.4	109.5	D894	R892-D894 IonicContact CZ-OD2 2.7Å; R892-D894 IonicContact NH1-OD2 3.88Å; R892-D894 PolarHBondContact NH1-OD2 2.85Å; R892-D894 IonicContact NH2-OD1 3.75Å; R892-D894 IonicContact NH2-OD2 2.74Å; R892-D894 PolarHBondContact NH2-OD2 2.84Å
893	P	52.5	Low	36.9	Very low	83 Å²	83	132.8 Å²	132.8	54%	0.539	73%	0.729	S	S	.	*			trans	-126.3	-177.3	-169.5	38.1	-19.8	0	0	0	116.3
894	D	37.1	Very low	36.8	Very low	103 Å²	103	137.8 Å²	137.8	55%	0.551	73%	0.73	S	S	*	*				169.9	137	112.9	-87.2	-40.8	0	0	0	116.2	R892	R892-D894 IonicContact CZ-OD2 2.7Å; R892-D894 IonicContact NH1-OD2 3.88Å; R892-D894 PolarHBondContact NH1-OD2 2.85Å; R892-D894 IonicContact NH2-OD1 3.75Å; R892-D894 IonicContact NH2-OD2 2.74Å; R892-D894 PolarHBondContact NH2-OD2 2.84Å
895	T	33.4	Very low	36.6	Very low	129 Å²	129	134.9 Å²	134.9	79%	0.791	73%	0.726	S	S	*	*			trans	62.2	151.1	152.2	55.6	0	0	0	0	122.5
896	S	34	Very low	36.5	Very low	90 Å²	90	133.1 Å²	133.1	63%	0.629	71%	0.714	S	S	*	*			cis	-177.2	159.3	-20	55.3	0	0	0	0	114
897	L	36.2	Very low	36.4	Very low	142 Å²	142	139.4 Å²	139.4	74%	0.743	72%	0.718	S	S	*	*			trans	71	161.1	163.6	-44.2	-171.2	0	0	0	117
898	H	33.4	Very low	36.1	Very low	161 Å²	161	144.2 Å²	144.2	75%	0.745	73%	0.727	S	S	*	*			cis	-173.5	170.4	-17.8	-99.7	-20.4	0	0	0	107.6
899	S	31.1	Very low	35.8	Very low	97 Å²	97	142.9 Å²	142.9	68%	0.678	72%	0.723	S	S	*	*			cis	-167.7	170.5	-18	-91.8	0	0	0	0	110.8
900	P	42.2	Very low	35	Very low	116 Å²	116	142.7 Å²	142.7	75%	0.753	72%	0.717	S	S	*	*			trans	-128.2	-167.1	-163.9	38.9	-20.6	0	0	0	117.6
901	E	31.5	Very low	34.7	Very low	164 Å²	164	148.6 Å²	148.6	77%	0.766	73%	0.726	S	S	*	*			trans	122.3	152.1	145.6	-63.4	-152.6	109.4	0	0	122.3
902	R	35.9	Very low	33.9	Very low	205 Å²	205	145 Å²	145	77%	0.774	72%	0.715	S	S	*	*			trans	99.3	152.6	148.8	-61.7	-160.1	172.1	-164.4	-4.7	122.3
903	E	31.9	Very low	33.6	Very low	125 Å²	125	140.9 Å²	140.9	58%	0.584	72%	0.715	S	S	*	*			cis	-174.7	168.1	-38.7	-144.4	-161.6	154.1	0	0	111.6
904	R	35.4	Very low	32.6	Very low	190 Å²	190	143.5 Å²	143.5	72%	0.717	72%	0.723	S	S	*	*			trans	72.7	176.3	158.6	-65.4	166.5	-157	-115.2	-18	119.4
905	H	34.6	Very low	32.2	Very low	175 Å²	175	145.2 Å²	145.2	81%	0.81	73%	0.728	S	S	*	*				-175.4	166.1	-65.7	-114.2	43.4	0	0	0	110.4
906	S	31.5	Very low	32.2	Very low	89 Å²	89	147.1 Å²	147.1	62%	0.622	73%	0.725	S	S	*	*			cis	178.5	166.5	-30.6	-177.5	0	0	0	0	111.4
907	R	35.8	Very low	32.3	Very low	220 Å²	220	151 Å²	151	83%	0.83	73%	0.733	S	S	*	*			trans	90.3	122.5	163.3	-58.6	178.5	173.1	-173.5	-1.3	123.2
908	K	29.6	Very low	32.4	Very low	196 Å²	196	148 Å²	148	85%	0.852	72%	0.724	S	S	*	*				63.6	135.6	128	-68	-168.4	172.6	-168.5	0	125.8
909	S	29.7	Very low	32.5	Very low	95 Å²	95	151.9 Å²	151.9	66%	0.664	73%	0.732	S	S	*	*			trans	90	130.6	137.5	-111.3	0	0	0	0	124.3
910	E	26.9	Very low	32.7	Very low	163 Å²	163	156.3 Å²	156.3	76%	0.762	74%	0.739	S	S	*	*			trans	75.5	122.8	134.3	-84.5	166	101	0	0	126.2
911	R	29.4	Very low	32.8	Very low	219 Å²	219	153.8 Å²	153.8	83%	0.826	74%	0.735	S	S	*	*				82.2	109.9	121.5	-160	171.1	-166.6	-125.1	4.3	121.5
912	S	25.6	Very low	32.8	Very low	94 Å²	94	152.2 Å²	152.2	66%	0.657	74%	0.736	S	S	*	*			trans	70.6	109.8	141.2	-64.2	0	0	0	0	122.8
913	S	27.6	Very low	32.9	Very low	102 Å²	102	146.5 Å²	146.5	71%	0.713	73%	0.733	S	S	*	*				92.3	154.4	115.4	81.5	0	0	0	0	122.5
914	I	31.3	Very low	32.9	Very low	139 Å²	139	145.3 Å²	145.3	71%	0.713	74%	0.739	S	S	*	*			trans	84.2	96.6	150.2	-73	164.9	0	0	0	120
915	Q	28.9	Very low	32.9	Very low	138 Å²	138	143.2 Å²	143.2	65%	0.645	74%	0.742	S	S	*	*				83.3	131	125.4	-73.8	-171.5	10.4	0	0	125
916	K	33.1	Very low	33.1	Very low	169 Å²	169	139.3 Å²	139.3	74%	0.735	74%	0.739	S	S	*	*			trans	72	150.5	140.9	-67.8	165.6	179.8	160.5	0	117
917	Q	37.9	Very low	33.2	Very low	171 Å²	171	141 Å²	141	80%	0.799	74%	0.742	S	S	*	*			cis	-155.2	171	-5.4	-127.6	-159	117.6	0	0	108
918	S	36.3	Very low	33.2	Very low	81 Å²	81	140.2 Å²	140.2	57%	0.566	74%	0.739	S	S	*	*			cis	-144.8	-144	-2.9	-156.7	0	0	0	0	106.4
919	R	37.4	Very low	33.5	Very low	241 Å²	241	136.6 Å²	136.6	91%	0.909	73%	0.733	S	S	*	*			cis	-152.2	-179.8	-5.9	-150.9	173.4	177.6	167.1	-0.7	108
920	K	33.5	Very low	33.7	Very low	190 Å²	190	139.5 Å²	139.5	83%	0.826	74%	0.736	S	S	*	*				-149.3	142.3	-107.6	-171.2	-173.6	179.5	-170.4	0	113.8
921	G	44.7	Very low	33.9	Very low	64 Å²	64	140 Å²	140	66%	0.66	73%	0.731	S	S	*	*			trans	163.3	125.4	158.2	0	0	0	0	0	111.2
922	T	32.9	Very low	34	Very low	130 Å²	130	137.3 Å²	137.3	80%	0.798	73%	0.728	S	S	*	*			cis	80.7	135.6	35.1	70	0	0	0	0	114.3
923	A	36.1	Very low	34.2	Very low	85 Å²	85	136.7 Å²	136.7	70%	0.702	74%	0.736	S	S	*	*			cis	-145.2	157.8	8.4	0	0	0	0	0	111.1
924	S	33.2	Very low	34.3	Very low	101 Å²	101	137.6 Å²	137.6	71%	0.706	74%	0.742	S	S	*	*				42.7	146.5	94.6	98.6	0	0	0	0	116.8
925	D	35.1	Very low	34.6	Very low	146 Å²	146	136 Å²	136	78%	0.781	74%	0.741	S	S	*	*			cis	-166.2	-176.9	32.7	-133.1	-60.8	0	0	0	114.8
926	A	38.3	Very low	34.5	Very low	92 Å²	92	134.9 Å²	134.9	76%	0.76	74%	0.744	S	S	*	*			trans	64.5	153	158.6	0	0	0	0	0	121.3
927	D	33.2	Very low	34.3	Very low	125 Å²	125	135.6 Å²	135.6	67%	0.668	75%	0.75	S	S	*	*			cis	-163.9	169.1	-20.6	178.4	32.4	0	0	0	110.1
928	R	36.8	Very low	33.8	Very low	204 Å²	204	132.4 Å²	132.4	77%	0.77	75%	0.746	S	S	*	*			trans	91.2	89.2	160.5	-53.9	-158.1	170.1	-175.1	-5.7	122.1
929	T	34.7	Very low	34.3	Very low	119 Å²	119	134.1 Å²	134.1	73%	0.73	76%	0.756	S	S	*	*				40.1	142.2	112.1	63.5	0	0	0	0	119.8
930	H	34.4	Very low	34.7	Very low	156 Å²	156	128.4 Å²	128.4	72%	0.722	75%	0.749	S	S	*	*			cis	-166.7	142.9	29.3	-157.8	-139.5	0	0	0	114.6
931	R	32.6	Very low	34.8	Very low	174 Å²	174	123.1 Å²	123.1	66%	0.657	74%	0.741	S	S	*	*			trans	44.3	124.8	148	-79.4	-168.1	180	-131.3	6.4	125.4
932	Q	29.7	Very low	34.4	Very low	163 Å²	163	126.9 Å²	126.9	76%	0.762	75%	0.746	S	S	*	*				62.6	129	121.3	-63.3	176.2	-24.1	0	0	122.4
933	G	30.1	Very low	34.6	Very low	81 Å²	81	126.7 Å²	126.7	84%	0.835	75%	0.745	S	S	*	*			trans	167.5	103.7	161.2	0	0	0	0	0	114.7
934	S	31	Very low	34.7	Very low	120 Å²	120	126.5 Å²	126.5	84%	0.839	74%	0.739	S	S	*	*			trans	-105.4	169.9	170.9	-55.3	0	0	0	0	109.9
935	P	36	Very low	34.9	Very low	106 Å²	106	131.8 Å²	131.8	69%	0.688	75%	0.749	S	S	*	*			cis	-133.2	-167.2	-30.1	26	-2.1	0	0	0	112.7
936	T	27	Very low	35.3	Very low	115 Å²	115	128.6 Å²	128.6	71%	0.706	75%	0.751	S	S	*	*			trans	86.7	156.9	156.7	82.1	0	0	0	0	120.9
937	Q	28.6	Very low	35.4	Very low	183 Å²	183	129.6 Å²	129.6	86%	0.855	75%	0.752	S	S	*	*			trans	76.2	178.2	161.2	-69.8	-179	83.4	0	0	119
938	S	28.4	Very low	35.7	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	76%	0.758	S	S	*	*			trans	-123.1	161.4	-140.2	38.1	0	0	0	0	114.3
939	P	47.3	Very low	35.7	Very low	117 Å²	117	134.6 Å²	134.6	76%	0.76	76%	0.762	S	S	*	*			trans	-75.5	-176	178	38.2	-42.1	0	0	0	111.2
940	P	45.7	Very low	35.8	Very low	120 Å²	120	132.6 Å²	132.6	78%	0.779	77%	0.765	S	S	*	*			cis	-148.7	-137.5	22	44.5	-20.7	0	0	0	114.4
941	A	35.2	Very low	36.1	Very low	79 Å²	79	135.5 Å²	135.5	65%	0.653	77%	0.77	S	S	*	*			trans	92.5	150.9	153.1	0	0	0	0	0	117
942	D	35.3	Very low	36.2	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	77%	0.769	S	S	*	*			cis	-159.1	179.8	-4.7	-138	-25.7	0	0	0	114.3
943	T	38.8	Very low	36.6	Very low	125 Å²	125	133.3 Å²	133.3	77%	0.767	77%	0.771	S	S	*	*			trans	133.6	132.8	147.7	56.2	0	0	0	0	113.4
944	S	37.9	Very low	36.9	Very low	82 Å²	82	135 Å²	135	57%	0.573	77%	0.768	S	S	*	*			cis	-160.1	170.5	-5.2	-110.5	0	0	0	0	113.1
945	F	37.8	Very low	37.1	Very low	211 Å²	211	137.8 Å²	137.8	93%	0.925	77%	0.767	S	S	*	*			trans	70.2	129.3	173.5	-41.5	-75.7	0	0	0	116.5
946	G	42.5	Very low	37.2	Very low	80 Å²	80	139 Å²	139	83%	0.825	77%	0.773	S	S	*	*			cis	159.9	159.2	-6	0	0	0	0	0	108.5
947	S	40.1	Very low	37.8	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	77%	0.774	S	S	*	*			cis	160.8	152.7	-4.9	178	0	0	0	0	106
948	R	39.7	Very low	38	Very low	210 Å²	210	136.1 Å²	136.1	79%	0.792	77%	0.769	S	S	*	*			cis	-175.6	167.3	-33.2	-158.6	-175.1	-134.5	-109.8	8.5	111
949	R	37.8	Very low	38.1	Very low	225 Å²	225	142 Å²	142	85%	0.849	78%	0.775	S	S	*	*			trans	93.9	143.5	157.7	-55	161.3	-161.3	-89.6	1.2	116.9
950	G	37	Very low	37.2	Very low	77 Å²	77	142.2 Å²	142.2	79%	0.794	78%	0.779	S	S	*	*			cis	-171.7	178.8	-3.3	0	0	0	0	0	108.8
951	R	39	Very low	36.3	Very low	217 Å²	217	140.4 Å²	140.4	82%	0.819	78%	0.782	S	S	*	*			cis	-140.3	166.5	5.8	-80.7	-168.1	-174.1	-105.6	16.6	109
952	Q	35.7	Very low	35.9	Very low	138 Å²	138	142.1 Å²	142.1	65%	0.645	79%	0.79	S	S	*	*				49.4	146.9	76.4	-34.2	171	-90	0	0	116.7
953	L	38.5	Very low	35.6	Very low	153 Å²	153	141.9 Å²	141.9	80%	0.801	79%	0.787	S	S	*	*			cis	178.9	175.8	-16.6	-100.8	-178.4	0	0	0	107.5
954	P	36.6	Very low	35.1	Very low	117 Å²	117	142.9 Å²	142.9	76%	0.76	78%	0.783	S	S	*	*			cis	-130.3	-156.5	-22.9	39.9	-19.2	0	0	0	114.6
955	Q	35.2	Very low	34.6	Very low	177 Å²	177	147.2 Å²	147.2	83%	0.827	79%	0.794	S	S	*	*			trans	-72.4	178.3	-171.3	-58.3	168.7	-18	0	0	115.4
956	V	36.3	Very low	34.1	Very low	133 Å²	133	141.9 Å²	141.9	81%	0.806	79%	0.789	S	S	*	*			cis	-150.3	-174.6	32.8	-114.5	0	0	0	0	112
957	P	40.7	Very low	33.6	Very low	112 Å²	112	143.4 Å²	143.4	73%	0.727	79%	0.787	S	S	*	*			trans	-117.5	-177.1	-152.8	43.6	-33.3	0	0	0	117
958	V	31.6	Very low	33.3	Very low	125 Å²	125	145.5 Å²	145.5	76%	0.758	79%	0.789	S	S	*	*			trans	156.1	131.6	137.2	158.8	0	0	0	0	114.2
959	R	31.2	Very low	32.9	Very low	227 Å²	227	141 Å²	141	86%	0.857	78%	0.784	S	S	*	*			trans	51.4	124.2	157.2	-73.5	168.7	-176.6	178.7	-0	123.5
960	S	28.2	Very low	33.1	Very low	122 Å²	122	136.5 Å²	136.5	85%	0.853	78%	0.781	S	S	*	*				36.7	121.4	121.7	-43.6	0	0	0	0	121.4
961	G	27.9	Very low	33.3	Very low	82 Å²	82	139.4 Å²	139.4	85%	0.845	77%	0.774	S	S	*	*			trans	-175.7	128.8	165.1	0	0	0	0	0	114.1
962	S	27	Very low	33.1	Very low	115 Å²	115	137.3 Å²	137.3	80%	0.804	77%	0.774	S	S	*	*			trans	-72.6	-174.1	-173.6	-157.5	0	0	0	0	116
963	I	28.8	Very low	32.7	Very low	140 Å²	140	139.2 Å²	139.2	72%	0.718	78%	0.775	S	S	*	*			trans	84.5	102.1	154.1	-69.9	165.4	0	0	0	119.1
964	E	28.1	Very low	32.5	Very low	146 Å²	146	137.9 Å²	137.9	68%	0.682	77%	0.773	S	S	*	*				62.8	137.8	124.3	-56	-153.7	89.9	0	0	125.6
965	Q	27	Very low	32.8	Very low	172 Å²	172	142.7 Å²	142.7	80%	0.804	78%	0.777	S	S	*	*			trans	40.9	98.9	136	-58.2	-170.3	60.8	0	0	120.2
966	A	28.3	Very low	32.8	Very low	99 Å²	99	142.4 Å²	142.4	82%	0.818	78%	0.775	S	S	*	*			trans	-149.4	133	150.2	0	0	0	0	0	113.1
967	S	31.5	Very low	32.7	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	78%	0.778	S	S	*	*			trans	22.7	128.6	151.3	-95.8	0	0	0	0	120.4
968	L	33.2	Very low	32.5	Very low	156 Å²	156	148.2 Å²	148.2	82%	0.817	78%	0.783	S	S	*	*			cis	58.1	134.7	18.2	-122.5	-176.8	0	0	0	115.8
969	V	31.4	Very low	32.9	Very low	116 Å²	116	150.3 Å²	150.3	70%	0.703	79%	0.787	S	S	*	*			trans	66.6	107.2	-172.2	-157.3	0	0	0	0	111.5
970	V	41.4	Very low	33	Very low	130 Å²	130	148.1 Å²	148.1	79%	0.788	78%	0.783	S	S	*	*				-175.2	143.1	94.9	146.6	0	0	0	0	107.3
971	E	42.8	Very low	33.5	Very low	139 Å²	139	149 Å²	149	65%	0.65	78%	0.783	S	S	*	*			cis	-154.5	159.2	-22.3	-167.8	177.7	145.3	0	0	109.4
972	E	33.4	Very low	33.9	Very low	173 Å²	173	152.1 Å²	152.1	81%	0.808	78%	0.775	S	S	*	*			trans	-62.3	-169.3	163.1	-161.5	178	115.3	0	0	112.7
973	R	27.5	Very low	33.9	Very low	177 Å²	177	158 Å²	158	67%	0.668	78%	0.78	S	S	*	*			trans	87.8	70.9	148	-155.2	-163.5	-146.2	94.9	4.7	120.2
974	T	34.2	Very low	34	Very low	125 Å²	125	160 Å²	160	77%	0.767	78%	0.784	S	S	*	*			trans	-169.1	132.4	146.9	-96.6	0	0	0	0	110.7
975	R	43.4	Very low	34.3	Very low	219 Å²	219	159.2 Å²	159.2	83%	0.826	78%	0.778	S	S	*	*			cis	-145.4	144.6	-16.9	-82.4	159.8	-170	-171.3	0.1	105
976	Q	35.1	Very low	34.4	Very low	171 Å²	171	160.6 Å²	160.6	80%	0.799	78%	0.784	S	S	*	*			cis	69.3	89.2	39.9	-68.5	-155	14.8	0	0	117.3
977	M	34.3	Very low	34.4	Very low	177 Å²	177	160.3 Å²	160.3	87%	0.872	77%	0.773	S	S	*	*			trans	-163.8	119.9	146.5	-98.4	162	-170	0	0	107
978	K	36.6	Very low	34.4	Very low	189 Å²	189	161.4 Å²	161.4	82%	0.822	78%	0.775	S	S	*	*				59.8	132.8	85.3	-65.5	178.6	-179.3	176.6	0	112.6
979	M	39.9	Very low	34.3	Very low	169 Å²	169	157.2 Å²	157.2	83%	0.833	77%	0.769	S	S	*	*			cis	-113	160.8	13.6	-50.3	-66	-168.4	0	0	111.5
980	K	32.2	Very low	34.1	Very low	182 Å²	182	158.1 Å²	158.1	79%	0.791	78%	0.781	S	S	*	*			cis	83.6	90.5	23.9	-164.3	-162.6	176	-169.6	0	116.5
981	V	40.4	Very low	33.7	Very low	139 Å²	139	155.3 Å²	155.3	84%	0.842	78%	0.778	S	S	*	*			trans	-135.8	151.6	146.3	-179.4	0	0	0	0	108.9
982	H	35.4	Very low	33	Very low	149 Å²	149	154 Å²	154	69%	0.69	78%	0.784	S	S	*	*			trans	-44.6	153.4	-175.3	-75.9	-106.3	0	0	0	116.2
983	R	27.1	Very low	32.9	Very low	237 Å²	237	150.9 Å²	150.9	89%	0.894	78%	0.781	S	S	*	*			cis	61.3	78.2	16.4	-158.6	-175.4	-171.9	173.9	5	117.2
984	F	30	Very low	33	Very low	182 Å²	182	150 Å²	150	80%	0.798	79%	0.785	S	S	*	*			trans	-163.9	148.9	150.9	-134.1	-110.8	0	0	0	108.2
985	K	35	Very low	32.9	Very low	130 Å²	130	151.9 Å²	151.9	57%	0.565	79%	0.785	S	S	*	*			cis	-163.3	109	-32.6	172.9	-173.4	173.8	-163.5	0	106.9	T987	K985-T987 VanDerWaalsContact CE-OG1 3.28Å; K985-T987 WeakPolarHBondContact CE-OG1 3.06Å; K985-T987 WeakPolarHBondContact CG-OG1 3.44Å; K985-T987 PolarHBondContact O-N 2.84Å
986	Q	28.4	Very low	32.1	Very low	201 Å²	201	148.3 Å²	148.3	94%	0.939	78%	0.782	S	S	*	*			trans	-84	103.8	165.5	-87.5	-173.7	-20.1	0	0	108.9
987	T	28.4	Very low	32	Very low	93 Å²	93	146.7 Å²	146.7	57%	0.571	78%	0.779	S	S	*	*			trans	-176.3	140.3	164.5	2.9	0	0	0	0	108.4	K985	K985-T987 VanDerWaalsContact CE-OG1 3.28Å; K985-T987 WeakPolarHBondContact CE-OG1 3.06Å; K985-T987 WeakPolarHBondContact CG-OG1 3.44Å; K985-T987 PolarHBondContact O-N 2.84Å
988	T	31.4	Very low	31.8	Very low	136 Å²	136	145.7 Å²	145.7	83%	0.834	77%	0.771	S	S	*	*			trans	57.5	128.7	174.4	57	0	0	0	0	116.9
989	G	31.7	Very low	31.7	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	76%	0.764	S	S	*	*			cis	159.4	155	-8.3	0	0	0	0	0	113.1
990	S	27.1	Very low	31.4	Very low	135 Å²	135	141 Å²	141	94%	0.944	75%	0.75	S	S	*	*			trans	68	145.3	164.5	-56.1	0	0	0	0	119.6
991	G	32.7	Very low	31.5	Very low	71 Å²	71	141.4 Å²	141.4	73%	0.732	75%	0.748	S	S	*	*			trans	88.3	142.2	167	0	0	0	0	0	116.1
992	S	29.3	Very low	31.3	Very low	112 Å²	112	139.5 Å²	139.5	78%	0.783	74%	0.741	S	S	*	*			cis	171.7	137.9	-38.8	40.6	0	0	0	0	107.6
993	S	31.7	Very low	31.4	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	74%	0.739	S	S	*	*			trans	64.3	134.7	179.9	-76.1	0	0	0	0	114.6
994	Q	27.7	Very low	31.8	Very low	160 Å²	160	137 Å²	137	75%	0.748	73%	0.731	S	S	*	*			cis	96.8	149.6	44.1	-171.1	-173.6	-15.6	0	0	109.8
995	E	32.9	Very low	31.7	Very low	163 Å²	163	135 Å²	135	76%	0.762	73%	0.728	S	S	*	*			trans	70.9	148.6	-176.7	-48.6	-167.6	152.1	0	0	112.2
996	L	27	Very low	31.9	Very low	144 Å²	144	136.2 Å²	136.2	75%	0.754	74%	0.74	S	S	*	*			cis	179.7	-176.3	-33.9	-113.1	167	0	0	0	103
997	D	32	Very low	32.2	Very low	138 Å²	138	133.1 Å²	133.1	74%	0.738	73%	0.725	S	S	*	*			trans	64.1	164.3	166.4	-64.4	-31.4	0	0	0	118.4
998	H	31.4	Very low	32.3	Very low	155 Å²	155	135.5 Å²	135.5	72%	0.718	73%	0.727	S	S	*	*				-160.9	167.1	-52.2	-146.4	-74.6	0	0	0	106.6
999	E	34.2	Very low	32.6	Very low	145 Å²	145	136.2 Å²	136.2	68%	0.678	73%	0.726	S	S	*	*			trans	68.7	158.4	156.2	-62.8	-144.4	109	0	0	117.8
1000	Q	33.2	Very low	32.4	Very low	114 Å²	114	140.3 Å²	140.3	53%	0.533	73%	0.727	S	S	.	*			cis	-155	155.7	-3.2	-129.6	169.2	24.8	0	0	112.4
1001	Y	33.7	Very low	32.7	Very low	191 Å²	191	143.1 Å²	143.1	75%	0.749	72%	0.719	S	S	*	*			trans	59.3	155.7	153.2	-67.6	-45.1	0	0	0	120.3
1002	S	36.7	Very low	32.9	Very low	100 Å²	100	148.9 Å²	148.9	70%	0.699	72%	0.718	S	S	*	*			cis	-164.9	163.6	-7.8	-112	0	0	0	0	108.1
1003	K	38.6	Very low	33.1	Very low	147 Å²	147	148 Å²	148	64%	0.639	71%	0.712	S	S	*	*			cis	-159.9	130.6	-14.7	-175	-177	179.1	-164.9	0	104.9
1004	Y	34.5	Very low	33.1	Very low	186 Å²	186	147.2 Å²	147.2	73%	0.729	71%	0.705	S	S	*	*				179.8	147.8	99.9	-102.7	-76.1	0	0	0	110.4
1005	N	28.9	Very low	33.5	Very low	139 Å²	139	146.1 Å²	146.1	74%	0.743	71%	0.705	S	S	*	*			trans	-154.1	119.5	-179.7	-172.5	11.6	0	0	0	110.5
1006	I	38	Very low	33.2	Very low	156 Å²	156	145.1 Å²	145.1	80%	0.8	71%	0.705	S	S	*	*			trans	-149	109.3	167.5	-52.5	178.6	0	0	0	104.1
1007	H	34.6	Very low	33.7	Very low	136 Å²	136	142.8 Å²	142.8	63%	0.63	71%	0.706	S	S	*	*			cis	87.7	77.2	31.4	-153.2	-85.5	0	0	0	115.2
1008	K	31.8	Very low	33.8	Very low	143 Å²	143	142 Å²	142	62%	0.622	71%	0.712	S	S	*	*				54.4	109.4	126.4	-175.5	-162.7	179.4	-172.1	0	118.9
1009	D	35.9	Very low	34	Very low	151 Å²	151	138.6 Å²	138.6	81%	0.807	71%	0.71	S	S	*	*			trans	-142.7	141.6	133.8	-82.4	-45.5	0	0	0	106.7
1010	Q	29.2	Very low	34.3	Very low	153 Å²	153	141.2 Å²	141.2	72%	0.715	72%	0.719	S	S	*	*			cis	67.9	84.4	44.7	-72	-155.1	-4.1	0	0	115.1
1011	Y	33.2	Very low	34.3	Very low	195 Å²	195	141.1 Å²	141.1	77%	0.765	73%	0.731	S	S	*	*			trans	-152.5	165	138.1	-136	-118.2	0	0	0	114
1012	R	36.3	Very low	34.5	Very low	191 Å²	191	136.7 Å²	136.7	72%	0.721	73%	0.728	S	S	*	*			trans	-51.4	172.8	-177.3	-47	-180	-170.2	-147.6	5	115.7
1013	S	33.5	Very low	34.4	Very low	95 Å²	95	138.6 Å²	138.6	66%	0.664	73%	0.731	S	S	*	*			cis	-157.6	-178.7	1.2	-138.8	0	0	0	0	112
1014	C	31.3	Very low	34.2	Very low	89 Å²	89	136.4 Å²	136.4	60%	0.601	73%	0.734	S	S	*	*			trans	-43	160.7	152.1	54.2	0	0	0	0	113.6
1015	D	35.7	Very low	34.2	Very low	137 Å²	137	134.4 Å²	134.4	73%	0.733	74%	0.736	S	S	*	*				-157.3	-174.1	55.8	-123.4	-56.4	0	0	0	118.4
1016	N	28.3	Very low	34.7	Very low	143 Å²	143	133.9 Å²	133.9	77%	0.765	74%	0.737	S	S	*	*			trans	-95.8	-174	-160.8	-66.4	-89.9	0	0	0	115.5
1017	A	36.3	Very low	34.3	Very low	95 Å²	95	131 Å²	131	79%	0.785	73%	0.731	S	S	*	*			trans	81.9	117.2	-179.9	0	0	0	0	0	114.9
1018	S	34.3	Very low	34.1	Very low	122 Å²	122	131.4 Å²	131.4	85%	0.853	74%	0.738	S	S	*	*			cis	84.2	94.6	43.4	-170.4	0	0	0	0	114.4
1019	A	36.2	Very low	34.2	Very low	83 Å²	83	129.9 Å²	129.9	69%	0.686	74%	0.74	S	S	*	*			trans	-177.9	140.8	133.6	0	0	0	0	0	111.2
1020	K	39.7	Very low	34	Very low	200 Å²	200	127.9 Å²	127.9	87%	0.87	74%	0.738	S	S	*	*			trans	32.5	125.4	138.2	-51.6	165.5	-173	176.1	0	116.2
1021	S	34.4	Very low	34.3	Very low	111 Å²	111	124.2 Å²	124.2	78%	0.776	73%	0.734	S	S	*	*			cis	162.8	158.4	34.9	37.7	0	0	0	0	105
1022	S	36.8	Very low	34.2	Very low	99 Å²	99	122.2 Å²	122.2	69%	0.692	74%	0.735	S	S	*	*			cis	-155.6	173.4	5.7	-112.2	0	0	0	0	110.1
1023	D	34.4	Very low	33.8	Very low	140 Å²	140	118.3 Å²	118.3	75%	0.749	74%	0.737	S	S	*	*			trans	-17.8	160.6	139.5	-54.3	-79	0	0	0	117
1024	S	35.8	Very low	33.8	Very low	100 Å²	100	126 Å²	126	70%	0.699	75%	0.751	S	S	*	*			cis	-146.3	150.9	17.2	55.7	0	0	0	0	109.7
1025	D	33.6	Very low	33.8	Very low	144 Å²	144	126 Å²	126	77%	0.77	76%	0.757	S	S	*	*			cis	60.9	71.6	29.3	-91.5	13.2	0	0	0	115.9
1026	V	38.8	Very low	33.5	Very low	128 Å²	128	124.5 Å²	124.5	78%	0.776	76%	0.757	S	S	*	*			trans	-134.8	134.7	135.9	-69.3	0	0	0	0	108.1
1027	S	29.7	Very low	33.6	Very low	96 Å²	96	122.5 Å²	122.5	67%	0.671	76%	0.755	S	S	*	*			cis	71.8	133.9	41.6	-54.6	0	0	0	0	111.1
1028	D	31.7	Very low	33.3	Very low	144 Å²	144	124.5 Å²	124.5	77%	0.77	76%	0.757	S	S	*	*			cis	-165	-156.6	-8.5	-151.3	-42.1	0	0	0	107.7
1029	V	32.1	Very low	33.3	Very low	111 Å²	111	123.6 Å²	123.6	67%	0.673	75%	0.751	S	S	*	*			trans	65.7	97.3	135.5	161.8	0	0	0	0	116
1030	S	32.7	Very low	33.2	Very low	110 Å²	110	129.5 Å²	129.5	77%	0.769	76%	0.756	S	S	*	*				84.7	157	114	-67.1	0	0	0	0	119.9
1031	A	35.7	Very low	32.8	Very low	76 Å²	76	123 Å²	123	63%	0.628	73%	0.73	S	S	*	*			cis	-160.3	161.6	-20.7	0	0	0	0	0	110.8
1032	I	30.6	Very low	32.7	Very low	153 Å²	153	119.8 Å²	119.8	79%	0.785	71%	0.708	S	S	*	*			trans	30.5	107.1	135.9	-54.7	167.1	0	0	0	116.4
1033	S	28	Very low	32.4	Very low	108 Å²	108	117.5 Å²	117.5	76%	0.755	69%	0.691	S	S	*	*			trans	32.4	121.2	133	-48.4	0	0	0	0	119.4
1034	R	34.4	Very low	32.3	Very low	258 Å²	258	117.1 Å²	117.1	97%	0.974	70%	0.695	S	S	*	*			trans	-144.1	148.7	131	-117.2	156.8	-174.9	171.1	1.1	113.1
1035	A	30.1	Very low	32.1	Very low	88 Å²	88	117.4 Å²	117.4	73%	0.727	70%	0.696	S	S	*	*			trans	-85.6	-173.8	-163.5	0	0	0	0	0	113.3
1036	S	29.8	Very low	32	Very low	105 Å²	105	118.9 Å²	118.9	73%	0.734	70%	0.696	S	S	*	*			trans	78.6	101.5	151.5	-57.1	0	0	0	0	119
1037	S	29.6	Very low	31.9	Very low	102 Å²	102	119.1 Å²	119.1	71%	0.713	69%	0.691	S	S	*	*				87.4	154.5	120.4	-58.2	0	0	0	0	121
1038	T	31.8	Very low	32	Very low	136 Å²	136	119 Å²	119	83%	0.834	69%	0.689	S	S	*	*			trans	73.8	141.8	172.1	70	0	0	0	0	116.9
1039	S	32.8	Very low	32.1	Very low	103 Å²	103	120.1 Å²	120.1	72%	0.72	69%	0.69	S	S	*	*			trans	-83.6	161.2	171.4	50.5	0	0	0	0	110.2
1040	R	35.3	Very low	32.1	Very low	208 Å²	208	122.7 Å²	122.7	79%	0.785	70%	0.695	S	S	*	*				159.6	120.2	129.9	-86.2	-172.7	-175.9	-138.3	-0.7	113.9
1041	L	31.4	Very low	32.1	Very low	63 Å²	63	122.1 Å²	122.1	33%	0.33	69%	0.691	S	S	.	*				72.1	110.4	123.4	-54.9	-162.4	0	0	0	123.5	F718	F718-L1041 VanDerWaalsContact CB-CA 3.43Å; F718-L1041 HydrophobicContact CB-CB 3.2Å; F718-L1041 HydrophobicContact CB-CD1 3.89Å; F718-L1041 HydrophobicContact CB-CD2 3.63Å; F718-L1041 HydrophobicContact CB-CG 3.61Å; F718-L1041 HydrophobicContact CD1-CB 3.68Å; F718-L1041 HydrophobicContact CD1-CD1 4.41Å; F718-L1041 HydrophobicContact CD2-CD1 4.23Å; F718-L1041 HydrophobicContact CG-CB 3.72Å; F718-L1041 HydrophobicContact CG-CD1 4.01Å; F718-L1041 HydrophobicContact CG-CG 4.22Å; F718-L1041 VanDerWaalsContact O-CD2 3.3Å; F718-L1041 WeakPolarHBondContact O-CD2 3.38Å
1042	S	31.4	Very low	32	Very low	44 Å²	44	122.6 Å²	122.6	31%	0.308	68%	0.68	S	S	.	*			trans	84	132.1	159.3	-81.9	0	0	0	0	121.7	F718 M719	F718-S1042 WeakPolarHBondContact CA-OG 3.37Å; F718-S1042 WeakPolarHBondContact CB-OG 3.48Å; F718-S1042 VanDerWaalsContact CD1-CB 3.41Å; F718-S1042 WeakPolarHBondContact CD1-OG 3.48Å; F718-S1042 WeakPolarHBondContact CG-OG 3.48Å; M719-S1042 VanDerWaalsContact CA-N 3.27Å; M719-S1042 WeakPolarHBondContact CE-O 3.31Å; M719-S1042 VanDerWaalsContact N-CA 3.3Å
1043	S	31.8	Very low	32.4	Very low	50 Å²	50	124.4 Å²	124.4	35%	0.35	68%	0.677	S	S	.	*				89.3	154.2	50.9	-58.4	0	0	0	0	113.1	P720	P720-S1043 VanDerWaalsContact CD-OG 3.24Å; P720-S1043 WeakPolarHBondContact CD-OG 3.21Å; P720-S1043 VanDerWaalsContact CG-OG 3.3Å; P720-S1043 WeakPolarHBondContact CG-OG 3.37Å
1044	T	32.4	Very low	33.1	Very low	133 Å²	133	125.2 Å²	125.2	82%	0.816	68%	0.68	S	S	*	*			trans	71.4	134.1	-173.3	66	0	0	0	0	113.9
1045	S	30.9	Very low	33.2	Very low	105 Å²	105	123.1 Å²	123.1	73%	0.734	67%	0.672	S	S	*	*			cis	83	149.7	34.2	86	0	0	0	0	113.1
1046	F	31.3	Very low	33.3	Very low	176 Å²	176	122.2 Å²	122.2	77%	0.772	67%	0.671	S	S	*	*			cis	-158.4	-172.3	8	-165.3	-139.2	0	0	0	111.1
1047	M	36.5	Very low	33.7	Very low	133 Å²	133	129 Å²	129	66%	0.655	68%	0.681	S	S	*	*			trans	71.5	140.5	170.1	-47.9	-88.9	57.3	0	0	114.8
1048	S	31	Very low	34.1	Very low	92 Å²	92	131.8 Å²	131.8	64%	0.643	69%	0.686	S	S	*	*			cis	79.4	148.7	44.8	-52.3	0	0	0	0	112.7
1049	E	34	Very low	34.1	Very low	168 Å²	168	130.1 Å²	130.1	79%	0.785	68%	0.68	S	S	*	*			cis	-129.1	174.4	27.3	-70.5	175.1	111.2	0	0	113.1
1050	Q	32.4	Very low	34.1	Very low	165 Å²	165	129.4 Å²	129.4	77%	0.771	68%	0.675	S	S	*	*				51.6	160.8	63.6	-26.7	-170.3	27.7	0	0	115.7
1051	S	32.9	Very low	34.1	Very low	99 Å²	99	129.1 Å²	129.1	69%	0.692	68%	0.68	S	S	*	*			cis	-150.7	-179.1	1.2	63.4	0	0	0	0	108.7
1052	E	33.8	Very low	34.6	Very low	86 Å²	86	132 Å²	132	40%	0.402	70%	0.7	S	S	.	*			cis	-97.7	-134.9	-2.1	-102.3	-82.6	64.3	0	0	109.4	R1055	E1052-R1055 IonicContact OE2-CZ 3.01Å; E1052-R1055 IonicContact OE2-NE 2.66Å; E1052-R1055 PolarHBondContact OE2-NE 2.82Å; E1052-R1055 IonicContact OE2-NH2 2.98Å; E1052-R1055 PolarHBondContact OE2-NH2 2.82Å
1053	R	39.5	Very low	35	Very low	190 Å²	190	134.9 Å²	134.9	72%	0.717	72%	0.718	S	S	*	*			cis	68	158.2	4.4	-34.8	-179.3	-179.2	80.4	-0	115.6	R1055	R1053-R1055 HydrophobicContact CB-CG 4.36Å
1054	P	42	Very low	35.1	Very low	126 Å²	126	141.5 Å²	141.5	82%	0.818	74%	0.74	S	S	*	*				-122.4	-175.3	59.1	20.5	1	0	0	0	114.2
1055	R	35.8	Very low	35.4	Very low	213 Å²	213	142.6 Å²	142.6	80%	0.804	74%	0.738	S	S	*	*			cis	174.1	140	-46.5	-101.9	-176.6	-172.3	-152.3	4.4	109	E1052 R1053	E1052-R1055 IonicContact OE2-CZ 3.01Å; E1052-R1055 IonicContact OE2-NE 2.66Å; E1052-R1055 PolarHBondContact OE2-NE 2.82Å; E1052-R1055 IonicContact OE2-NH2 2.98Å; E1052-R1055 PolarHBondContact OE2-NH2 2.82Å; R1053-R1055 HydrophobicContact CB-CG 4.36Å
1056	G	33.7	Very low	35.7	Very low	69 Å²	69	146 Å²	146	71%	0.711	74%	0.742	S	S	*	*			trans	143.4	127.8	174.5	0	0	0	0	0	109.8
1057	R	37.7	Very low	35.7	Very low	249 Å²	249	140.9 Å²	140.9	94%	0.94	74%	0.739	S	S	*	*			cis	63.4	123.9	46.1	-63	-165.5	175.6	-155.6	-0.1	111.2
1058	I	37.5	Very low	35.7	Very low	159 Å²	159	145.9 Å²	145.9	82%	0.815	75%	0.751	S	S	*	*				-152.9	128.9	51.3	-72.1	166.7	0	0	0	109.1
1059	S	32.6	Very low	36	Very low	101 Å²	101	152.1 Å²	152.1	71%	0.706	76%	0.76	S	S	*	*				68.7	111.1	96.7	-144.5	0	0	0	0	120.7
1060	S	32	Very low	36	Very low	89 Å²	89	153.5 Å²	153.5	62%	0.622	77%	0.769	S	S	*	*			trans	47.6	129	136.2	60.7	0	0	0	0	123.3
1061	F	35	Very low	36.2	Very low	202 Å²	202	148.5 Å²	148.5	89%	0.886	76%	0.762	S	S	*	*				178.5	162.3	110.3	-109.1	-83.4	0	0	0	113.2
1062	T	41.6	Very low	36.6	Very low	123 Å²	123	150.6 Å²	150.6	76%	0.755	77%	0.771	S	S	*	*			trans	-111.4	166.3	173.6	69.5	0	0	0	0	110.7
1063	P	40.1	Very low	36.7	Very low	104 Å²	104	152.1 Å²	152.1	68%	0.675	79%	0.791	S	S	*	*				-164	168	80.5	43.2	-21.5	0	0	0	120.4
1064	K	34.8	Very low	36.6	Very low	189 Å²	189	146.8 Å²	146.8	82%	0.822	80%	0.795	S	S	*	*			trans	47.4	134.5	141.1	-66.4	165.8	-177.7	172.2	0	122.7
1065	M	38.8	Very low	36.5	Very low	157 Å²	157	152.4 Å²	152.4	77%	0.773	80%	0.8	S	S	*	*				-174.3	162	115	-99	-62.4	156.8	0	0	115.4
1066	Q	35.9	Very low	36.5	Very low	175 Å²	175	146 Å²	146	82%	0.818	79%	0.793	S	S	*	*			trans	-72.6	171.3	-169.4	-55.2	145.2	2.7	0	0	115.2
1067	G	32.8	Very low	36.9	Very low	69 Å²	69	149.8 Å²	149.8	71%	0.711	80%	0.795	S	S	*	*			cis	147.5	154	-9	0	0	0	0	0	116.1
1068	R	35.9	Very low	37.1	Very low	238 Å²	238	144.6 Å²	144.6	90%	0.898	79%	0.785	S	S	*	*			trans	97.1	148.5	159.3	-54.2	177.2	177.7	-105.6	3	122.7
1069	R	36.7	Very low	37.1	Very low	224 Å²	224	146 Å²	146	85%	0.845	79%	0.785	S	S	*	*			trans	87.5	110.5	163.4	-50	-175.4	-162.1	-98.8	4.5	116.8
1070	M	34	Very low	37.1	Very low	196 Å²	196	145.6 Å²	145.6	97%	0.966	78%	0.782	S	S	*	*				76.6	130.2	75.1	-97.6	87.7	-178.9	0	0	115.5
1071	G	36.8	Very low	37.2	Very low	60 Å²	60	147.5 Å²	147.5	62%	0.619	79%	0.79	S	S	*	*			cis	161	167.2	-11.3	0	0	0	0	0	115.6
1072	T	41.3	Very low	37	Very low	143 Å²	143	142.6 Å²	142.6	88%	0.877	78%	0.781	S	S	*	*			trans	74.6	154.6	165.1	76.8	0	0	0	0	118.8
1073	S	37.1	Very low	36.9	Very low	118 Å²	118	143 Å²	143	83%	0.825	78%	0.783	S	S	*	*			cis	-165.5	143	-1.3	-128.1	0	0	0	0	116.2
1074	G	35.8	Very low	36.4	Very low	79 Å²	79	143 Å²	143	81%	0.814	79%	0.785	S	S	*	*			trans	81.3	157.6	151.3	0	0	0	0	0	120.3
1075	R	40.4	Very low	36.4	Very low	243 Å²	243	137.5 Å²	137.5	92%	0.917	78%	0.783	S	S	*	*			cis	-169.1	145.6	-5.1	-168.2	-173.9	-173.9	-170.7	2.6	112.3
1076	A	36.1	Very low	36.1	Very low	80 Å²	80	138.2 Å²	138.2	66%	0.661	78%	0.784	S	S	*	*			trans	71.7	151	155.8	0	0	0	0	0	119.9
1077	I	41.9	Very low	36	Very low	147 Å²	147	136 Å²	136	75%	0.754	78%	0.776	S	S	*	*			cis	-163.7	145.8	-8.5	-120.6	167.1	0	0	0	112.3
1078	I	42.2	Very low	35.9	Very low	140 Å²	140	142.3 Å²	142.3	72%	0.718	78%	0.78	S	S	*	*			trans	57	119.7	155.8	-66.7	172.8	0	0	0	118.6
1079	K	36.8	Very low	36.1	Very low	188 Å²	188	136.8 Å²	136.8	82%	0.817	77%	0.773	S	S	*	*				71.2	148.8	58.4	-66.6	-176.2	179.3	-175.1	0	114
1080	S	32.6	Very low	36.1	Very low	94 Å²	94	132.7 Å²	132.7	66%	0.657	77%	0.767	S	S	*	*			cis	-172.7	-170.5	-14.9	-86.8	0	0	0	0	108.2
1081	T	35.6	Very low	36.3	Very low	128 Å²	128	131 Å²	131	79%	0.785	76%	0.757	S	S	*	*			trans	65.7	135.1	162.1	52.3	0	0	0	0	117.9
1082	S	29.7	Very low	36.4	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	76%	0.763	S	S	*	*			cis	86.4	161.3	34.9	81.5	0	0	0	0	115.1
1083	V	39.8	Very low	36.2	Very low	130 Å²	130	136 Å²	136	79%	0.788	76%	0.758	S	S	*	*			trans	78.8	120.3	-164	-175.4	0	0	0	0	111.2
1084	S	29.9	Very low	36.1	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	76%	0.758	S	S	*	*			cis	99.9	122.2	18.6	83.5	0	0	0	0	115.3
1085	G	33.6	Very low	36	Very low	74 Å²	74	137 Å²	137	76%	0.763	75%	0.751	S	S	*	*			trans	74	168.4	-179.8	0	0	0	0	0	114.2
1086	E	32.8	Very low	35.8	Very low	173 Å²	173	130.5 Å²	130.5	81%	0.808	74%	0.743	S	S	*	*			cis	-170.4	169.7	-24.3	-131.8	175.7	-159.2	0	0	108.6
1087	I	33.5	Very low	35.7	Very low	127 Å²	127	135 Å²	135	65%	0.651	75%	0.75	S	S	*	*			trans	65.5	115.1	148.9	-73.5	166	0	0	0	120.2
1088	Y	31.4	Very low	35.3	Very low	203 Å²	203	132.5 Å²	132.5	80%	0.796	75%	0.746	S	S	*	*			trans	53.7	142	145.5	-67.2	-115.5	0	0	0	119.1
1089	T	39.5	Very low	35.1	Very low	121 Å²	121	132.9 Å²	132.9	74%	0.742	75%	0.749	S	S	*	*			cis	-141.1	146.1	38.1	45	0	0	0	0	112
1090	L	38	Very low	35.2	Very low	138 Å²	138	129.9 Å²	129.9	72%	0.723	75%	0.747	S	S	*	*				60.5	128.8	82.9	-125.5	81.6	0	0	0	112.1
1091	E	38.4	Very low	35.4	Very low	160 Å²	160	129.7 Å²	129.7	75%	0.748	75%	0.751	S	S	*	*			cis	-147.8	172.7	31.8	-76.3	-175.1	125	0	0	114.7
1092	H	38.3	Very low	35.6	Very low	164 Å²	164	130.1 Å²	130.1	76%	0.759	75%	0.753	S	S	*	*			trans	21.6	147.3	149.9	-77.4	-88.5	0	0	0	122.3
1093	N	37.8	Very low	35.9	Very low	144 Å²	144	128.8 Å²	128.8	77%	0.77	76%	0.755	S	S	*	*			cis	-149.8	165.5	28.7	-146.7	0.1	0	0	0	114.7
1094	D	33.3	Very low	36	Very low	155 Å²	155	128.4 Å²	128.4	83%	0.829	75%	0.753	S	S	*	*			trans	-103.7	167.3	-179.7	-163	-0.2	0	0	0	111.8
1095	G	35.2	Very low	36.5	Very low	63 Å²	63	130.3 Å²	130.3	65%	0.649	76%	0.76	S	S	*	*			trans	114.5	117.8	-178.9	0	0	0	0	0	112.3
1096	S	34.7	Very low	36.8	Very low	107 Å²	107	130 Å²	130	75%	0.748	76%	0.757	S	S	*	*			cis	90.3	123.8	38	-165.6	0	0	0	0	114.3
1097	Q	34.4	Very low	37.1	Very low	174 Å²	174	127.1 Å²	127.1	81%	0.813	76%	0.763	S	S	*	*			trans	68.5	117	163.4	-71.8	-174.5	23.7	0	0	121.6
1098	S	33.7	Very low	37.2	Very low	96 Å²	96	125.2 Å²	125.2	67%	0.671	77%	0.774	S	S	*	*				80.7	114.5	125	-55.2	0	0	0	0	122.4
1099	D	38.8	Very low	37.6	Very low	148 Å²	148	118.9 Å²	118.9	79%	0.791	77%	0.771	S	S	*	*			trans	81.8	153.2	130.1	-101.7	-45.6	0	0	0	124.2
1100	T	38.6	Very low	37.6	Very low	125 Å²	125	122.4 Å²	122.4	77%	0.767	78%	0.776	S	S	*	*			trans	66	106.2	158.6	45.2	0	0	0	0	122
1101	A	37	Very low	37.7	Very low	89 Å²	89	124 Å²	124	74%	0.736	78%	0.777	S	S	*	*				122.6	125.6	107.6	0	0	0	0	0	120.3
1102	V	39.7	Very low	37.9	Very low	137 Å²	137	127.3 Å²	127.3	83%	0.83	78%	0.782	S	S	*	*			trans	40	109	134.9	-171.7	0	0	0	0	118.1
1103	G	36.1	Very low	38	Very low	72 Å²	72	130 Å²	130	74%	0.742	79%	0.786	S	S	*	*				106.1	167.9	90.4	0	0	0	0	0	111.1
1104	T	41.8	Very low	37.9	Very low	122 Å²	122	127.4 Å²	127.4	75%	0.748	78%	0.779	S	S	*	*			cis	-165.4	151.5	2	-20.5	0	0	0	0	110
1105	V	41	Very low	38.1	Very low	145 Å²	145	124.5 Å²	124.5	88%	0.879	77%	0.771	S	S	*	*			trans	66.9	147.8	164.4	-174.1	0	0	0	0	116.9
1106	G	38.4	Very low	38.4	Very low	67 Å²	67	129 Å²	129	69%	0.691	78%	0.779	S	S	*	*			cis	153	155.6	-16.6	0	0	0	0	0	116.7
1107	A	39.5	Very low	38.5	Very low	113 Å²	113	128.5 Å²	128.5	93%	0.934	78%	0.776	S	S	*	*			trans	80	130.9	156.7	0	0	0	0	0	123.2
1108	G	35.3	Very low	38.9	Very low	87 Å²	87	124.2 Å²	124.2	90%	0.897	77%	0.77	S	S	*	*			trans	111.5	127.1	151.9	0	0	0	0	0	117.4
1109	G	39.9	Very low	39.2	Very low	70 Å²	70	129.1 Å²	129.1	72%	0.722	78%	0.779	S	S	*	*			cis	169.2	146	-16.8	0	0	0	0	0	115.7
1110	K	40.5	Very low	39.2	Very low	195 Å²	195	128.3 Å²	128.3	85%	0.848	78%	0.779	S	S	*	*			trans	45.4	126.5	143.3	-71.8	164.1	-175.9	166.2	0	118.4
1111	K	40.3	Very low	39	Very low	170 Å²	170	128.4 Å²	128.4	74%	0.739	78%	0.78	S	S	*	*			cis	173.2	152	49.8	-116.7	162.2	-176.8	175.4	0	112.7
1112	R	41.2	Very low	38.9	Very low	230 Å²	230	128.2 Å²	128.2	87%	0.868	78%	0.778	S	S	*	*			trans	67	165	150.1	-66.2	172.9	168.5	-173.6	-5.2	120.8
1113	R	40.5	Very low	38.7	Very low	221 Å²	221	130.1 Å²	130.1	83%	0.834	78%	0.782	S	S	*	*				-176.3	143.6	-51.9	-158.1	-164.5	-175.7	-142.9	6.9	110.6
1114	S	36.6	Very low	38.6	Very low	90 Å²	90	133 Å²	133	63%	0.629	79%	0.785	S	S	*	*			trans	66.7	156.9	152.5	26.6	0	0	0	0	118.6
1115	S	37.2	Very low	38.2	Very low	93 Å²	93	131.8 Å²	131.8	65%	0.65	78%	0.781	S	S	*	*			cis	-176.5	177.4	-15.9	49.5	0	0	0	0	111.7
1116	L	41.6	Very low	38.1	Very low	157 Å²	157	134.6 Å²	134.6	82%	0.822	78%	0.776	S	S	*	*			trans	79.2	159	161.4	-57.1	156.2	0	0	0	117.8
1117	S	36.1	Very low	38.1	Very low	97 Å²	97	142.5 Å²	142.5	68%	0.678	79%	0.785	S	S	*	*			cis	-168.9	141.5	-47	56.7	0	0	0	0	114.7
1118	A	42.3	Very low	38	Very low	84 Å²	84	141.7 Å²	141.7	69%	0.694	77%	0.773	S	S	*	*			trans	79.5	150.7	141.5	0	0	0	0	0	123.2
1119	K	40.1	Very low	38.3	Very low	199 Å²	199	147.6 Å²	147.6	87%	0.865	77%	0.768	S	S	*	*			trans	72.4	154.2	169	-54.3	169.5	-172.5	172	0	115.1
1120	V	38.8	Very low	38.2	Very low	131 Å²	131	147.7 Å²	147.7	79%	0.794	76%	0.758	S	S	*	*			cis	-165	151.3	-17.4	132.3	0	0	0	0	107
1121	V	35.6	Very low	37.9	Very low	127 Å²	127	140.8 Å²	140.8	77%	0.77	73%	0.732	S	S	*	*			cis	-163.5	152.4	-38.7	92.3	0	0	0	0	110.1
1122	A	33.7	Very low	37.6	Very low	86 Å²	86	136.9 Å²	136.9	71%	0.711	73%	0.726	S	S	*	*			trans	59.9	125.9	168.9	0	0	0	0	0	120.9
1123	I	37.3	Very low	37.4	Very low	176 Å²	176	134.2 Å²	134.2	90%	0.903	72%	0.723	S	S	*	*				-173.5	157.8	116.9	-95.3	161.2	0	0	0	110.9
1124	V	32.5	Very low	37.1	Very low	134 Å²	134	130.7 Å²	130.7	81%	0.812	72%	0.72	S	S	*	*			trans	-75.5	121.8	-168.9	177.4	0	0	0	0	114.3
1125	S	33.1	Very low	36.9	Very low	96 Å²	96	130.6 Å²	130.6	67%	0.671	72%	0.719	S	S	*	*			trans	-169.8	132.9	140	-92.8	0	0	0	0	118.2
1126	R	39.5	Very low	36.8	Very low	203 Å²	203	134.4 Å²	134.4	77%	0.766	73%	0.727	S	S	*	*			trans	40.6	134.8	130.5	-61.1	176.2	167.6	-171.1	-4	122.5
1127	R	39.5	Very low	36.3	Very low	233 Å²	233	132.3 Å²	132.3	88%	0.879	72%	0.721	S	S	*	*			trans	69.2	160.1	151.7	-72.1	175	164.4	172.2	-7.4	116.6
1128	S	36.4	Very low	36.1	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	73%	0.728	S	S	*	*			cis	-176.1	164.3	-32	-91.6	0	0	0	0	109.3
1129	R	42.5	Very low	35.5	Very low	212 Å²	212	137.7 Å²	137.7	80%	0.8	73%	0.734	S	S	*	*			trans	71.1	147.6	170.7	-58.3	167.5	171.9	175.6	-5.9	114.4
1130	S	36.1	Very low	35.2	Very low	72 Å²	72	131.8 Å²	131.8	50%	0.503	73%	0.729	S	S	.	*			cis	-179.3	179.4	-19	-101.1	0	0	0	0	109.1	R735	R735-S1130 PolarHBondContact NH1-O 3.18Å; R735-S1130 PolarHBondContact NH2-O 2.8Å
1131	T	34.5	Very low	34.9	Very low	50 Å²	50	134.4 Å²	134.4	31%	0.307	73%	0.733	S	S	.	*			trans	16.5	124.7	157.4	81.5	0	0	0	0	120	Q734 R735	Q734-T1131 HydrophobicContact CB-CG2 4.08Å; Q734-T1131 HydrophobicContact CG-CG2 4Å; R735-T1131 HydrophobicContact CB-CG2 4.33Å; R735-T1131 WeakPolarHBondContact CD-OG1 3.47Å; R735-T1131 PolarHBondContact NH1-O 2.61Å; R735-T1131 PolarHBondContact NH1-OG1 3.17Å
1132	S	34.8	Very low	35	Very low	87 Å²	87	137.8 Å²	137.8	61%	0.608	74%	0.737	S	S	*	*				80.4	117.4	78.4	89.9	0	0	0	0	116.9	Q734	Q734-S1132 PolarHBondContact NE2-OG 3.24Å
1133	Q	37	Very low	34.9	Very low	174 Å²	174	143.9 Å²	143.9	81%	0.813	75%	0.747	S	S	*	*			trans	-164.1	149.9	147.4	-106.8	173.1	8.7	0	0	108.7
1134	L	34.5	Very low	34.8	Very low	148 Å²	148	144.1 Å²	144.1	78%	0.775	75%	0.75	S	S	*	*			trans	36.6	149.6	140.8	-57.7	168.6	0	0	0	121.4
1135	S	31.8	Very low	34.7	Very low	88 Å²	88	147.4 Å²	147.4	62%	0.615	75%	0.753	S	S	*	*			cis	174.1	168.4	-32.6	46.8	0	0	0	0	108.5
1136	Q	34.6	Very low	34.6	Very low	173 Å²	173	148.1 Å²	148.1	81%	0.808	76%	0.758	S	S	*	*			trans	80.9	137.9	169.2	-57.8	-176.2	-13	0	0	118.9
1137	T	32.4	Very low	34.3	Very low	113 Å²	113	144 Å²	144	69%	0.693	76%	0.755	S	S	*	*			trans	45.6	140.6	150.9	52.2	0	0	0	0	121.2
1138	E	31.4	Very low	34	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	75%	0.754	S	S	*	*			cis	-151.9	-170.6	3.9	-136.7	151.2	-134.6	0	0	114
1139	S	30.3	Very low	34.2	Very low	117 Å²	117	143.8 Å²	143.8	82%	0.818	76%	0.757	S	S	*	*			trans	-55.3	147.7	-168.8	54.1	0	0	0	0	117.5
1140	G	33.6	Very low	33.7	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	76%	0.761	S	S	*	*			trans	174	105.9	171.4	0	0	0	0	0	115.4	K1142	G1140-K1142 PolarHBondContact O-N 2.96Å
1141	H	31.8	Very low	33.8	Very low	186 Å²	186	145.2 Å²	145.2	86%	0.861	76%	0.764	S	S	*	*			trans	-67.8	116.3	-173.4	-71.1	-121.4	0	0	0	114.8
1142	K	37.1	Very low	34	Very low	198 Å²	198	148.4 Å²	148.4	86%	0.861	78%	0.784	S	S	*	*				175.9	133.2	117.9	-92.8	154.5	-174.2	174.6	0	111.9	G1140 L1144	G1140-K1142 PolarHBondContact O-N 2.96Å; K1142-L1144 PolarHBondContact O-N 3.14Å
1143	K	31.9	Very low	34	Very low	214 Å²	214	153.7 Å²	153.7	93%	0.93	80%	0.799	S	S	*	*			trans	-78.4	100	-173.6	-72.1	179.1	178.6	174.3	0	112.6
1144	L	34.7	Very low	34.2	Very low	181 Å²	181	150.6 Å²	150.6	95%	0.948	79%	0.792	S	S	*	*			trans	-126.4	93.5	157.2	-73.3	175.7	0	0	0	108.9	K1142	K1142-L1144 PolarHBondContact O-N 3.14Å
1145	K	31.3	Very low	34.2	Very low	203 Å²	203	147.2 Å²	147.2	88%	0.883	79%	0.793	S	S	*	*			trans	-131.7	129.6	176	-162.4	164.1	-174.5	173	0	110.4	T1147	K1145-T1147 PolarHBondContact O-N 2.9Å
1146	S	31	Very low	34.3	Very low	110 Å²	110	151.9 Å²	151.9	77%	0.769	81%	0.807	S	S	*	*			trans	-79.2	105	-169.3	54.4	0	0	0	0	112.7
1147	T	32.7	Very low	34.1	Very low	117 Å²	117	148.3 Å²	148.3	72%	0.718	81%	0.808	S	S	*	*			trans	-79.6	118.8	163.7	-57.8	0	0	0	0	109.3	K1145 Q1149	K1145-T1147 PolarHBondContact O-N 2.9Å; T1147-Q1149 VanDerWaalsContact C-N 3.3Å; T1147-Q1149 HydrophobicContact CG2-CG 3.92Å; T1147-Q1149 PolarHBondContact O-N 3.04Å
1148	I	32.9	Very low	34.2	Very low	165 Å²	165	147.8 Å²	147.8	85%	0.846	82%	0.815	S	S	*	*			trans	-79.5	84.1	172.6	-59.3	177.7	0	0	0	107.9	R1150	I1148-R1150 PolarHBondContact O-N 3.49Å
1149	Q	40.5	Very low	34.4	Very low	159 Å²	159	146.1 Å²	146.1	74%	0.743	81%	0.807	S	S	*	*			trans	-68.6	126.3	176.5	-66.8	175.9	-69.8	0	0	110.3	T1147 S1151	T1147-Q1149 VanDerWaalsContact C-N 3.3Å; T1147-Q1149 HydrophobicContact CG2-CG 3.92Å; T1147-Q1149 PolarHBondContact O-N 3.04Å; Q1149-S1151 PolarHBondContact O-N 2.68Å
1150	R	32	Very low	34.7	Very low	233 Å²	233	149.8 Å²	149.8	88%	0.879	81%	0.813	S	S	*	*			trans	-70.4	115.2	151.7	-78.3	-178.1	164.7	-162.3	-4.2	106.8	I1148 T1152	I1148-R1150 PolarHBondContact O-N 3.49Å; R1150-T1152 PolarHBondContact O-N 3.38Å
1151	S	40.1	Very low	34.8	Very low	81 Å²	81	155.8 Å²	155.8	57%	0.566	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-59.4	125.8	-173.2	-56.5	0	0	0	0	111.9	Q1149	Q1149-S1151 PolarHBondContact O-N 2.68Å
1152	T	36.8	Very low	35	Very low	118 Å²	118	156.7 Å²	156.7	72%	0.724	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-69.2	144.5	165.1	41.8	0	0	0	0	110.7	R1150	R1150-T1152 PolarHBondContact O-N 3.38Å
1153	E	36.7	Very low	34.9	Very low	197 Å²	197	155.5 Å²	155.5	92%	0.921	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.7	136.3	161.9	-167.6	176.8	104.2	0	0	109.4
1154	T	39.4	Very low	35.2	Very low	110 Å²	110	151.7 Å²	151.7	68%	0.675	81%	0.808	S	S	*	*			trans	-111.4	103.4	-169.3	-58.4	0	0	0	0	111.3
1155	G	35.9	Very low	35.3	Very low	77 Å²	77	153.7 Å²	153.7	79%	0.794	80%	0.803	S	S	*	*			trans	-75.8	125.8	157	0	0	0	0	0	109.7
1156	M	32.7	Very low	35.5	Very low	185 Å²	185	151.8 Å²	151.8	91%	0.911	80%	0.797	S	S	*	*			trans	-86.7	122.2	173.3	-69.2	-168.4	-177.8	0	0	110.7
1157	A	31.8	Very low	35.8	Very low	99 Å²	99	151.6 Å²	151.6	82%	0.818	79%	0.793	S	S	*	*			trans	-159.7	146.8	159.4	0	0	0	0	0	110.9
1158	A	34	Very low	35.9	Very low	102 Å²	102	151.1 Å²	151.1	84%	0.843	80%	0.795	S	S	*	*			trans	55.3	100.4	164.5	0	0	0	0	0	119.1
1159	E	34.5	Very low	36.2	Very low	141 Å²	141	153 Å²	153	66%	0.659	79%	0.791	S	S	*	*				-148.8	105.3	109.9	-174.4	161.3	-167.3	0	0	112.3	R1161	E1159-R1161 WeakPolarHBondContact OE1-CD 3.45Å; E1159-R1161 IonicContact OE1-CZ 2.89Å; E1159-R1161 IonicContact OE1-NE 2.77Å; E1159-R1161 IonicContact OE1-NH1 3.18Å; E1159-R1161 PolarHBondContact OE1-NH1 3.06Å
1160	M	37.9	Very low	35.9	Very low	194 Å²	194	152 Å²	152	96%	0.956	79%	0.786	S	S	*	*			trans	-137	128.5	147.7	-71.9	-162.8	-173.1	0	0	107.9
1161	R	35.2	Very low	36	Very low	202 Å²	202	145.7 Å²	145.7	76%	0.762	78%	0.778	S	S	*	*			trans	-123	123	-176.7	-75.1	172.9	156.5	138	-11.7	110.3	E1159	E1159-R1161 WeakPolarHBondContact OE1-CD 3.45Å; E1159-R1161 IonicContact OE1-CZ 2.89Å; E1159-R1161 IonicContact OE1-NE 2.77Å; E1159-R1161 IonicContact OE1-NH1 3.18Å; E1159-R1161 PolarHBondContact OE1-NH1 3.06Å
1162	K	35.7	Very low	35.9	Very low	205 Å²	205	147.5 Å²	147.5	89%	0.891	79%	0.786	S	S	*	*			trans	179.7	160.5	131.9	-104.6	171.9	179.4	-176.8	0	113.5
1163	M	35.2	Very low	35.7	Very low	173 Å²	173	149.2 Å²	149.2	85%	0.852	79%	0.791	S	S	*	*			trans	74.8	100.6	174.8	-46.8	-142.7	-67.4	0	0	113.7
1164	V	37.7	Very low	35.5	Very low	133 Å²	133	142.9 Å²	142.9	81%	0.806	78%	0.779	S	S	*	*				84.9	99.1	73.7	164.9	0	0	0	0	110
1165	R	36.8	Very low	35.3	Very low	223 Å²	223	142.7 Å²	142.7	84%	0.842	78%	0.782	S	S	*	*				65.6	131.7	98.3	-103.6	-170.8	177.1	-177.8	-1.3	112.4
1166	Q	36.9	Very low	35.3	Very low	164 Å²	164	145.9 Å²	145.9	77%	0.766	78%	0.779	S	S	*	*			cis	-143.5	179.2	23.3	-107.5	-175.1	-112.4	0	0	113.6
1167	P	37	Very low	35.1	Very low	105 Å²	105	143.8 Å²	143.8	68%	0.682	77%	0.771	S	S	*	*			trans	-108.6	-155.4	-167	44.3	-38.7	0	0	0	114.8
1168	S	34.5	Very low	35.1	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	77%	0.769	S	S	*	*			trans	92.8	137.4	171	-21.2	0	0	0	0	114.2
1169	R	38.6	Very low	35	Very low	205 Å²	205	149.4 Å²	149.4	77%	0.774	77%	0.768	S	S	*	*			cis	-144	175.5	1.8	-76.2	-157.2	86.9	141.1	-2.9	112.8
1170	E	34	Very low	34.9	Very low	137 Å²	137	147.2 Å²	147.2	64%	0.64	77%	0.768	S	S	*	*			trans	-29.1	161	161.6	-53.9	89.6	102.9	0	0	116.9
1171	S	35.3	Very low	34.6	Very low	102 Å²	102	143.9 Å²	143.9	71%	0.713	76%	0.764	S	S	*	*			cis	-159.8	161.7	21.4	57.1	0	0	0	0	115.3
1172	T	36.3	Very low	34.5	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	77%	0.772	S	S	*	*				12.3	146.5	128.1	-18.8	0	0	0	0	119
1173	D	33.1	Very low	34.4	Very low	154 Å²	154	137.6 Å²	137.6	82%	0.824	77%	0.767	S	S	*	*			cis	-163.5	163.3	21.5	-149.8	-15	0	0	0	114.2
1174	G	33.9	Very low	34.3	Very low	65 Å²	65	136 Å²	136	67%	0.67	76%	0.762	S	S	*	*			trans	59.8	171.6	160.7	0	0	0	0	0	121.2
1175	S	33.8	Very low	34.2	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	77%	0.77	S	S	*	*			cis	-166.4	118.4	-28	58.7	0	0	0	0	113.6
1176	I	36	Very low	34.2	Very low	144 Å²	144	132.7 Å²	132.7	74%	0.738	75%	0.754	S	S	*	*			trans	51.6	146.2	154.5	84	172	0	0	0	123.2
1177	N	29.8	Very low	34	Very low	140 Å²	140	134.2 Å²	134.2	75%	0.749	76%	0.759	S	S	*	*			trans	62.8	131.6	153.4	-62.2	0.1	0	0	0	118.5
1178	S	31	Very low	33.8	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	77%	0.768	S	S	*	*			cis	-166.3	163	20.6	-97.2	0	0	0	0	113.4
1179	Y	31	Very low	33.8	Very low	210 Å²	210	134.2 Å²	134.2	82%	0.824	77%	0.77	S	S	*	*			trans	64	106.7	150.3	-160.3	-96.9	0	0	0	121.7
1180	S	33.8	Very low	33.7	Very low	95 Å²	95	129.8 Å²	129.8	66%	0.664	77%	0.766	S	S	*	*			trans	34.9	100.7	138.7	-48.5	0	0	0	0	121.4
1181	S	31.8	Very low	33.6	Very low	124 Å²	124	135 Å²	135	87%	0.867	78%	0.78	S	S	*	*			trans	-152.9	165.9	140.4	62.3	0	0	0	0	111.1
1182	E	32.5	Very low	33.7	Very low	199 Å²	199	135.3 Å²	135.3	93%	0.93	78%	0.777	S	S	*	*			trans	-85.2	140.6	179.1	-52.6	-179	134.4	0	0	110.7
1183	G	32.4	Very low	33.6	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	77%	0.767	S	S	*	*			trans	167.2	126	173.5	0	0	0	0	0	115.7
1184	N	33.7	Very low	33.8	Very low	140 Å²	140	130.3 Å²	130.3	75%	0.749	76%	0.764	S	S	*	*			trans	-63.5	147.5	176.8	-65.4	-28.9	0	0	0	113.4	I1186	N1184-I1186 HydrophobicContact CB-CG1 4.36Å
1185	L	37	Very low	33.8	Very low	184 Å²	184	134.7 Å²	134.7	96%	0.963	77%	0.772	S	S	*	*			trans	-126.7	128.7	138	-75.8	179.3	0	0	0	109.7
1186	I	35.4	Very low	34.4	Very low	101 Å²	101	132.7 Å²	132.7	52%	0.518	76%	0.758	S	S	.	*			trans	-113	140.2	-176.7	-66	170.5	0	0	0	108.3	N1184 P1188	N1184-I1186 HydrophobicContact CB-CG1 4.36Å; I1186-P1188 WeakPolarHBondContact O-CD 3.38Å
1187	F	33.4	Very low	34.9	Very low	196 Å²	196	133.2 Å²	133.2	86%	0.86	76%	0.758	S	S	*	*			trans	-60.7	119.8	171.9	-78	-86.9	0	0	0	110.5	G1189	F1187-G1189 PolarHBondContact O-N 3.14Å
1188	P	33.3	Very low	35.4	Very low	134 Å²	134	135.1 Å²	135.1	87%	0.87	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	118	-175.3	27.6	-34	0	0	0	110.9	I1186	I1186-P1188 WeakPolarHBondContact O-CD 3.38Å
1189	G	34.1	Very low	35.9	Very low	78 Å²	78	131.2 Å²	131.2	80%	0.804	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	158.9	-24.7	173.1	0	0	0	0	0	116.1	F1187	F1187-G1189 PolarHBondContact O-N 3.14Å
1190	V	36.9	Very low	36.6	Very low	112 Å²	112	125.9 Å²	125.9	68%	0.679	72%	0.718	S	S	*	*	S	Bend	trans	-113.1	122.9	179	-175.8	0	0	0	0	109.6	V1192	V1190-V1192 PolarHBondContact O-N 3.02Å; V1190-V1192 VanDerWaalsContact O-N 3.15Å
1191	R	32.1	Very low	37.3	Very low	248 Å²	248	128.5 Å²	128.5	94%	0.936	72%	0.717	S	S	*	*			trans	-68.4	110.2	175.2	-65.1	-175.1	-171.1	-111.7	4.2	109.2	G1193	R1191-G1193 PolarHBondContact O-N 3.25Å
1192	V	35.9	Very low	38.6	Very low	107 Å²	107	125.3 Å²	125.3	65%	0.648	69%	0.691	S	S	*	*			trans	-78.3	107.5	170.7	-179.7	0	0	0	0	108.1	V1190	V1190-V1192 PolarHBondContact O-N 3.02Å; V1190-V1192 VanDerWaalsContact O-N 3.15Å
1193	G	34.6	Very low	39.9	Very low	51 Å²	51	120 Å²	120	53%	0.526	67%	0.669	S	S	.	*			trans	-77.2	161.5	161.8	0	0	0	0	0	110.6	R1191	R1191-G1193 PolarHBondContact O-N 3.25Å
1194	P	38.2	Very low	41.9	Very low	117 Å²	117	118.8 Å²	118.8	76%	0.76	66%	0.656	S	S	*	*	S	Bend	trans	-61.2	155.1	168.6	29.6	-34.9	0	0	0	110.9
1195	D	34	Very low	44.5	Very low	156 Å²	156	114.5 Å²	114.5	83%	0.834	63%	0.632	S	S	*	*	S	Bend	trans	58.4	72.5	160.6	-49.1	-36.4	0	0	0	118.3
1196	S	45.3	Very low	47.1	Very low	64 Å²	64	106.1 Å²	106.1	45%	0.448	59%	0.591	S	S	.	*			trans	-151.9	-70.6	154.8	-162.3	0	0	0	0	114.2	F1198 S1199 D1200	S1196-F1198 VanDerWaalsContact C-N 3.3Å; S1196-F1198 PolarHBondContact O-N 3.23Å; S1196-S1199 WeakPolarHBondContact O-CA 3.21Å; S1196-S1199 WeakPolarHBondContact O-CB 3.17Å; S1196-S1199 PolarHBondContact O-N 3.15Å; S1196-S1199 PolarHBondContact O-OG 3.31Å; S1196-D1200 VanDerWaalsContact C-OD2 3.26Å; S1196-D1200 PolarHBondContact O-N 2.62Å; S1196-D1200 PolarHBondContact OG-OD2 3.34Å
1197	Q	47.4	Very low	49.8	Very low	155 Å²	155	103.9 Å²	103.9	72%	0.724	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-20.8	-148.3	-65.8	-173.9	5.4	0	0	118.3	D1200 F1201	Q1197-D1200 WeakPolarHBondContact CA-OD2 3.3Å; Q1197-F1201 WeakPolarHBondContact O-CD2 3.29Å
1198	F	39.3	Very low	52.7	Low	181 Å²	181	95.1 Å²	95.1	79%	0.794	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-21.2	173.6	-130.9	-84.4	0	0	0	113.1	S1196	S1196-F1198 VanDerWaalsContact C-N 3.3Å; S1196-F1198 PolarHBondContact O-N 3.23Å
1199	S	41.7	Very low	55.6	Low	26 Å²	26	89.6 Å²	89.6	18%	0.182	51%	0.509	C	S	.	.	H	α-helix	trans	-70.4	-41.9	174.5	-52	0	0	0	0	111	S1196 F1201 L1202 D1203 R1356	S1196-S1199 WeakPolarHBondContact O-CA 3.21Å; S1196-S1199 WeakPolarHBondContact O-CB 3.17Å; S1196-S1199 PolarHBondContact O-N 3.15Å; S1196-S1199 PolarHBondContact O-OG 3.31Å; S1199-F1201 PolarHBondContact O-N 3.37Å; S1199-L1202 CarbonylContact O-C 3.36Å; S1199-L1202 WeakPolarHBondContact O-CA 3.31Å; S1199-L1202 PolarHBondContact O-N 3.16Å; S1199-D1203 WeakPolarHBondContact CB-OD2 3.44Å; S1199-D1203 WeakPolarHBondContact O-CB 3.3Å; S1199-D1203 PolarHBondContact O-N 2.81Å; S1199-R1356 PolarHBondContact OG-NH2 2.7Å
1200	D	45.3	Very low	58.3	Low	98 Å²	98	87.5 Å²	87.5	52%	0.524	48%	0.479	S	S	.	.	H	α-helix	trans	-55	-24.1	-178.9	-62.7	-67.7	0	0	0	114	S1196 Q1197	S1196-D1200 VanDerWaalsContact C-OD2 3.26Å; S1196-D1200 PolarHBondContact O-N 2.62Å; S1196-D1200 PolarHBondContact OG-OD2 3.34Å; Q1197-D1200 WeakPolarHBondContact CA-OD2 3.3Å
1201	F	49.4	Very low	60.6	Low	150 Å²	150	83.3 Å²	83.3	66%	0.658	45%	0.454	S	S	*	.	H	α-helix	trans	-85.5	-26.9	174.1	-74.5	-86	0	0	0	114.3	Q1197 S1199	Q1197-F1201 WeakPolarHBondContact O-CD2 3.29Å; S1199-F1201 PolarHBondContact O-N 3.37Å
1202	L	58.4	Low	62.8	Low	58 Å²	58	71.7 Å²	71.7	30%	0.304	41%	0.411	S	S	.	.	H	α-helix	trans	-90.6	-30.3	178	-63.3	175.4	0	0	0	111.9	S1199 L1205 L1216	S1199-L1202 CarbonylContact O-C 3.36Å; S1199-L1202 WeakPolarHBondContact O-CA 3.31Å; S1199-L1202 PolarHBondContact O-N 3.16Å; L1202-L1205 PolarHBondContact O-N 2.98Å; L1202-L1216 HydrophobicContact CD2-CD1 4.37Å
1203	D	59.2	Low	64.9	Low	88 Å²	88	74 Å²	74	47%	0.471	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	138.2	-172.2	-87.4	-49.1	0	0	0	113	S1199 K1339	S1199-D1203 WeakPolarHBondContact CB-OD2 3.44Å; S1199-D1203 WeakPolarHBondContact O-CB 3.3Å; S1199-D1203 PolarHBondContact O-N 2.81Å; D1203-K1339 PolarHBondContact O-NZ 3Å
1204	G	74.8	Confident	66.7	Low	50 Å²	50	78.7 Å²	78.7	52%	0.515	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	13.4	-174.9	0	0	0	0	0	115.6	K1339	G1204-K1339 WeakPolarHBondContact O-CE 3.39Å
1205	L	88.1	Confident	68.8	Low	50 Å²	50	73.3 Å²	73.3	26%	0.262	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.5	151.3	154.3	-73.9	174.7	0	0	0	110.3	L1202 Q1209 V1211 L1216 K1339 F1341	L1202-L1205 PolarHBondContact O-N 2.98Å; L1205-Q1209 HydrophobicContact CD2-CG 4.48Å; L1205-V1211 HydrophobicContact CD1-CG2 4.37Å; L1205-V1211 HydrophobicContact CD2-CG2 3.63Å; L1205-L1216 HydrophobicContact CD1-CD2 4.04Å; L1205-K1339 HydrophobicContact CD2-CB 4.44Å; L1205-K1339 HydrophobicContact CD2-CD 4.05Å; L1205-F1341 HydrophobicContact CD2-CE2 4.15Å; L1205-F1341 HydrophobicContact CD2-CZ 4.24Å
1206	G	91.4	Very high	70.9	Confident	9 Å²	9	68.5 Å²	68.5	9%	0.093	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-77.8	161.4	-179.7	0	0	0	0	0	113.9	A1208 Q1209 W1337	G1206-A1208 PolarHBondContact O-N 2.83Å; G1206-Q1209 WeakPolarHBondContact O-CB 3.4Å; G1206-Q1209 PolarHBondContact O-N 2.97Å; G1206-W1337 WeakPolarHBondContact CA-O 3.38Å; G1206-W1337 PolarHBondContact N-O 2.96Å
1207	P	93.3	Very high	72.4	Confident	54 Å²	54	70 Å²	70	35%	0.351	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	124.9	172.9	-25.5	33.7	0	0	0	111.4	Q1209 L1328 V1334 Y1338	P1207-Q1209 PolarHBondContact O-N 2.81Å; P1207-L1328 HydrophobicContact CB-CD2 3.7Å; P1207-V1334 HydrophobicContact CB-CG1 4.38Å; P1207-Y1338 WeakPolarHBondContact CD-OH 3.49Å; P1207-Y1338 WeakPolarHBondContact O-CE1 3.26Å; P1207-Y1338 PolarHBondContact O-OH 2.83Å
1208	A	93.1	Very high	74	Confident	11 Å²	11	64.7 Å²	64.7	9%	0.091	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	26.5	-174.6	0	0	0	0	0	115.7	G1206 L1210 I1323 L1324 E1327 L1328	G1206-A1208 PolarHBondContact O-N 2.83Å; A1208-L1210 PolarHBondContact O-N 2.9Å; A1208-I1323 HydrophobicContact CB-CG2 4.15Å; A1208-I1323 CarbonylContact O-C 3.57Å; A1208-I1323 WeakPolarHBondContact O-CA 3.45Å; A1208-L1324 HydrophobicContact CB-CB 4.48Å; A1208-L1324 WeakPolarHBondContact CB-O 3.3Å; A1208-L1324 PolarHBondContact O-N 2.86Å; A1208-E1327 WeakPolarHBondContact CA-OE2 3.19Å; A1208-E1327 HydrophobicContact CB-CB 3.58Å; A1208-E1327 HydrophobicContact CB-CG 4.49Å; A1208-E1327 WeakPolarHBondContact CB-OE2 3.49Å; A1208-L1328 HydrophobicContact CB-CD1 4.37Å; A1208-L1328 HydrophobicContact CB-CD2 3.58Å; A1208-L1328 HydrophobicContact CB-CG 3.8Å
1209	Q	94.5	Very high	76.3	Confident	19 Å²	19	61.4 Å²	61.4	9%	0.089	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	114	-179.4	-171.5	175.2	-11	0	0	111.9	L1205 G1206 P1207 V1211 Q1322 Y1338 K1339	L1205-Q1209 HydrophobicContact CD2-CG 4.48Å; G1206-Q1209 WeakPolarHBondContact O-CB 3.4Å; G1206-Q1209 PolarHBondContact O-N 2.97Å; P1207-Q1209 PolarHBondContact O-N 2.81Å; Q1209-V1211 HydrophobicContact CG-CG2 4.01Å; Q1209-Q1322 CarbonylContact C-O 3.58Å; Q1209-Q1322 WeakPolarHBondContact CA-O 3.34Å; Q1209-Q1322 WeakPolarHBondContact CG-O 3.06Å; Q1209-Y1338 HydrophobicContact CB-CD1 3.82Å; Q1209-Y1338 HydrophobicContact CB-CE1 3.98Å; Q1209-Y1338 HydrophobicContact CG-CD1 3.92Å; Q1209-K1339 PolarHBondContact NE2-O 3.22Å; Q1209-K1339 VanDerWaalsContact OE1-N 3.1Å
1210	L	90.7	Very high	78.6	Confident	33 Å²	33	62.2 Å²	62.2	17%	0.173	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	125.8	173.8	-61.1	178.8	0	0	0	110.9	A1208 V1300 Q1322 L1324	A1208-L1210 PolarHBondContact O-N 2.9Å; L1210-V1300 HydrophobicContact CD1-CG1 4.02Å; L1210-V1300 HydrophobicContact CD1-CG2 3.96Å; L1210-Q1322 HydrophobicContact CB-CB 3.97Å; L1210-Q1322 HydrophobicContact CD1-CB 4.49Å; L1210-Q1322 PolarHBondContact N-O 2.97Å; L1210-L1324 HydrophobicContact CD1-CB 4.16Å; L1210-L1324 HydrophobicContact CD2-CB 4.11Å; L1210-L1324 HydrophobicContact CG-CB 4.11Å
1211	V	86.6	Confident	80.9	Confident	25 Å²	25	59.2 Å²	59.2	15%	0.152	34%	0.338	C	S	.	.			trans	-142.7	117.5	176.9	-176	0	0	0	0	109.7	L1205 Q1209 T1215 L1216 F1341	L1205-V1211 HydrophobicContact CD1-CG2 4.37Å; L1205-V1211 HydrophobicContact CD2-CG2 3.63Å; Q1209-V1211 HydrophobicContact CG-CG2 4.01Å; V1211-T1215 HydrophobicContact CG1-CG2 3.69Å; V1211-L1216 HydrophobicContact CB-CD2 4.21Å; V1211-L1216 HydrophobicContact CG1-CD2 3.83Å; V1211-L1216 HydrophobicContact CG1-CG 4.31Å; V1211-F1341 HydrophobicContact CG1-CE2 4.09Å; V1211-F1341 HydrophobicContact CG1-CZ 4.33Å; V1211-F1341 HydrophobicContact CG2-CD2 4.27Å; V1211-F1341 HydrophobicContact CG2-CE2 3.66Å; V1211-F1341 HydrophobicContact CG2-CZ 4.43Å
1212	G	78.5	Confident	83.1	Confident	4 Å²	4	52.3 Å²	52.3	4%	0.041	31%	0.31	C	S	.	.			trans	-62.8	142.2	175.7	0	0	0	0	0	111.9	Q1214 T1215 D1348	G1212-Q1214 VanDerWaalsContact C-N 3.27Å; G1212-Q1214 PolarHBondContact O-N 2.91Å; G1212-T1215 WeakPolarHBondContact O-CA 3.24Å; G1212-T1215 VanDerWaalsContact O-CB 3.25Å; G1212-T1215 WeakPolarHBondContact O-CB 3.24Å; G1212-T1215 PolarHBondContact O-N 2.96Å; G1212-D1348 WeakPolarHBondContact CA-O 3.44Å
1213	R	78.5	Confident	85	Confident	154 Å²	154	50.8 Å²	50.8	58%	0.581	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-50.9	-40.4	-168	-64.2	-176.6	179.6	-156.4	-3.5	114.5	T1215 L1216 T1352	R1213-T1215 PolarHBondContact O-N 3.24Å; R1213-L1216 PolarHBondContact O-N 3.04Å; R1213-T1352 PolarHBondContact NH2-OG1 3.49Å
1214	Q	73.9	Confident	86.8	Confident	150 Å²	150	46.6 Å²	46.6	70%	0.701	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-64.4	-23.3	178.5	-54.9	-174.6	44.7	0	0	113.3	G1212 D1348	G1212-Q1214 VanDerWaalsContact C-N 3.27Å; G1212-Q1214 PolarHBondContact O-N 2.91Å; Q1214-D1348 PolarHBondContact NE2-OD2 3.15Å
1215	T	82.2	Confident	88	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.031	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-81.1	-20	-179.1	-59	0	0	0	0	112.8	V1211 G1212 R1213 A1217 T1218 F1341 S1345	V1211-T1215 HydrophobicContact CG1-CG2 3.69Å; G1212-T1215 WeakPolarHBondContact O-CA 3.24Å; G1212-T1215 VanDerWaalsContact O-CB 3.25Å; G1212-T1215 WeakPolarHBondContact O-CB 3.24Å; G1212-T1215 PolarHBondContact O-N 2.96Å; R1213-T1215 PolarHBondContact O-N 3.24Å; T1215-A1217 PolarHBondContact O-N 2.88Å; T1215-A1217 VanDerWaalsContact O-N 3.13Å; T1215-T1218 WeakPolarHBondContact O-CA 3.09Å; T1215-T1218 VanDerWaalsContact O-CB 3.26Å; T1215-T1218 WeakPolarHBondContact O-CB 3.33Å; T1215-T1218 PolarHBondContact O-N 2.77Å; T1215-F1341 HydrophobicContact CG2-CB 3.85Å; T1215-F1341 HydrophobicContact CG2-CD1 3.34Å; T1215-F1341 HydrophobicContact CG2-CD2 4.04Å; T1215-F1341 HydrophobicContact CG2-CE1 3.8Å; T1215-F1341 HydrophobicContact CG2-CE2 4.43Å; T1215-F1341 HydrophobicContact CG2-CG 3.47Å; T1215-F1341 VanDerWaalsContact CG2-CG 3.47Å; T1215-F1341 HydrophobicContact CG2-CZ 4.32Å; T1215-S1345 VanDerWaalsContact OG1-CA 3.26Å; T1215-S1345 WeakPolarHBondContact OG1-CA 3.44Å; T1215-S1345 WeakPolarHBondContact OG1-CB 3.23Å
1216	L	77	Confident	88.4	Confident	54 Å²	54	43.4 Å²	43.4	28%	0.283	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-60.6	-26.1	179	-63.3	172.8	0	0	0	112.7	L1202 L1205 V1211 R1213 L1354	L1202-L1216 HydrophobicContact CD2-CD1 4.37Å; L1205-L1216 HydrophobicContact CD1-CD2 4.04Å; V1211-L1216 HydrophobicContact CB-CD2 4.21Å; V1211-L1216 HydrophobicContact CG1-CD2 3.83Å; V1211-L1216 HydrophobicContact CG1-CG 4.31Å; R1213-L1216 PolarHBondContact O-N 3.04Å; L1216-L1354 HydrophobicContact CD1-CD1 4.12Å
1217	A	76.8	Confident	88.7	Confident	95 Å²	95	43 Å²	43	79%	0.785	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-89	-0.1	172.8	0	0	0	0	0	114.4	T1215	T1215-A1217 PolarHBondContact O-N 2.88Å; T1215-A1217 VanDerWaalsContact O-N 3.13Å
1218	T	82.3	Confident	89	Confident	45 Å²	45	40.4 Å²	40.4	28%	0.276	23%	0.228	S	C	.	.	S	Bend	trans	-93.7	128.1	-177.7	-60.4	0	0	0	0	110.6	T1215 A1220 P1342	T1215-T1218 WeakPolarHBondContact O-CA 3.09Å; T1215-T1218 VanDerWaalsContact O-CB 3.26Å; T1215-T1218 WeakPolarHBondContact O-CB 3.33Å; T1215-T1218 PolarHBondContact O-N 2.77Å; T1218-A1220 PolarHBondContact O-N 2.79Å; T1218-P1342 HydrophobicContact CG2-CG 3.93Å
1219	P	85.7	Confident	89.1	Confident	112 Å²	112	41.8 Å²	41.8	73%	0.727	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-57.7	133.8	175.3	-25.9	35.1	0	0	0	112.7
1220	A	90.7	Very high	89.2	Confident	42 Å²	42	43 Å²	43	35%	0.347	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-65.1	140.1	174.7	0	0	0	0	0	111.1	T1218 G1222 K1339 L1340 F1341	T1218-A1220 PolarHBondContact O-N 2.79Å; A1220-G1222 PolarHBondContact O-N 2.79Å; A1220-K1339 HydrophobicContact CB-CB 4.1Å; A1220-K1339 HydrophobicContact CB-CG 4.3Å; A1220-L1340 CarbonylContact C-O 3.56Å; A1220-L1340 WeakPolarHBondContact CA-O 3.24Å; A1220-F1341 HydrophobicContact CB-CE1 4.39Å
1221	M	94.5	Very high	89.4	Confident	36 Å²	36	45.2 Å²	45.2	18%	0.177	25%	0.248	C	C	.	.	S	Bend	trans	-79.1	-0.1	177.9	-63.3	-171.7	66.6	0	0	113.6	L1245 T1246 F1317 L1340 P1342	M1221-L1245 CarbonylContact O-C 3.55Å; M1221-L1245 WeakPolarHBondContact O-CA 3.43Å; M1221-T1246 WeakPolarHBondContact CA-OG1 3.09Å; M1221-T1246 WeakPolarHBondContact O-CB 3.41Å; M1221-T1246 PolarHBondContact O-N 3.06Å; M1221-T1246 PolarHBondContact O-OG1 3.21Å; M1221-F1317 HydrophobicContact CE-CD1 4.43Å; M1221-F1317 HydrophobicContact SD-CD1 4.45Å; M1221-F1317 HydrophobicContact SD-CE1 3.97Å; M1221-L1340 HydrophobicContact CB-CB 4.48Å; M1221-L1340 PolarHBondContact N-O 3.34Å; M1221-P1342 HydrophobicContact CG-CG 4.24Å; M1221-P1342 HydrophobicContact SD-CB 4.2Å; M1221-P1342 HydrophobicContact SD-CG 3.95Å
1222	G	95.7	Very high	89.6	Confident	5 Å²	5	54 Å²	54	5%	0.052	29%	0.285	C	S	.	.			trans	141	-179	-173.6	0	0	0	0	0	110	A1220 R1243 S1244 L1340	A1220-G1222 PolarHBondContact O-N 2.79Å; G1222-R1243 WeakPolarHBondContact CA-O 3.44Å; G1222-S1244 WeakPolarHBondContact CA-O 3.3Å; G1222-L1340 VanDerWaalsContact O-CB 3.31Å; G1222-L1340 WeakPolarHBondContact O-CB 2.98Å; G1222-L1340 PolarHBondContact O-N 3.08Å
1223	D	97.1	Very high	90.2	Very high	26 Å²	26	55.4 Å²	55.4	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150.9	173.8	-48.9	-53.9	0	0	0	111.1	A1242 R1243 W1337 Y1338	D1223-A1242 CarbonylContact O-C 3.54Å; D1223-A1242 WeakPolarHBondContact O-CA 3.24Å; D1223-A1242 VanDerWaalsContact O-CB 3.32Å; D1223-A1242 WeakPolarHBondContact O-CB 3.43Å; D1223-R1243 HydrophobicContact CB-CG 4.01Å; D1223-R1243 PolarHBondContact N-O 2.63Å; D1223-R1243 PolarHBondContact O-N 3.49Å; D1223-R1243 IonicContact OD2-CZ 3.51Å; D1223-R1243 IonicContact OD2-NE 3.43Å; D1223-R1243 PolarHBondContact OD2-NE 3.45Å; D1223-R1243 IonicContact OD2-NH2 3.96Å; D1223-R1243 PolarHBondContact OD2-NH2 3.18Å; D1223-W1337 HydrophobicContact CB-CE3 3.57Å; D1223-W1337 HydrophobicContact CB-CZ3 3.77Å; D1223-Y1338 WeakPolarHBondContact CA-O 3.36Å
1224	I	98.3	Very high	91	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.1	171.9	-168.2	162.6	0	0	0	111.6	I1226 V1239 R1241 A1242 V1259 V1303 V1305 W1337 Y1338 L1340	I1224-I1226 HydrophobicContact CD1-CD1 3.9Å; I1224-I1226 HydrophobicContact CG1-CD1 3.83Å; I1224-I1226 HydrophobicContact CG1-CG1 4.13Å; I1224-I1226 HydrophobicContact CG2-CG1 4.2Å; I1224-V1239 HydrophobicContact CD1-CG1 4.39Å; I1224-R1241 WeakPolarHBondContact CG1-O 3.44Å; I1224-A1242 HydrophobicContact CB-CB 4.25Å; I1224-A1242 HydrophobicContact CG1-CB 4.16Å; I1224-V1259 HydrophobicContact CD1-CB 4.4Å; I1224-V1259 HydrophobicContact CD1-CG1 3.87Å; I1224-V1259 HydrophobicContact CD1-CG2 3.58Å; I1224-V1303 HydrophobicContact CD1-CG1 3.79Å; I1224-V1303 HydrophobicContact CG2-CG1 4.34Å; I1224-V1305 HydrophobicContact CD1-CG2 3.98Å; I1224-W1337 VanDerWaalsContact C-CE3 3.46Å; I1224-Y1338 PolarHBondContact N-O 2.96Å; I1224-Y1338 PolarHBondContact O-N 3.32Å; I1224-L1340 HydrophobicContact CB-CD1 4.31Å; I1224-L1340 HydrophobicContact CB-CD2 4.27Å; I1224-L1340 HydrophobicContact CB-CG 4.39Å; I1224-L1340 HydrophobicContact CG2-CD2 3.71Å; I1224-L1340 HydrophobicContact CG2-CG 4.17Å
1225	Q	98.2	Very high	92.1	Very high	32 Å²	32	44.6 Å²	44.6	15%	0.15	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.1	175.7	-161	-175.6	-12.9	0	0	109.4	I1240 R1241 I1335 G1336 W1337	Q1225-I1240 HydrophobicContact CB-CB 4.32Å; Q1225-I1240 HydrophobicContact CG-CB 4.49Å; Q1225-I1240 HydrophobicContact CG-CD1 4.13Å; Q1225-I1240 PolarHBondContact O-N 2.82Å; Q1225-I1240 VanDerWaalsContact O-N 3.15Å; Q1225-R1241 HydrophobicContact CB-CG 3.92Å; Q1225-R1241 PolarHBondContact N-O 2.74Å; Q1225-I1335 HydrophobicContact CG-CG2 4.07Å; Q1225-G1336 WeakPolarHBondContact CA-O 3.48Å; Q1225-W1337 HydrophobicContact CB-CD2 3.9Å; Q1225-W1337 HydrophobicContact CB-CE3 3.77Å; Q1225-W1337 HydrophobicContact CB-CH2 4.06Å; Q1225-W1337 HydrophobicContact CB-CZ2 4.18Å; Q1225-W1337 HydrophobicContact CB-CZ3 3.84Å; Q1225-W1337 HydrophobicContact CG-CD2 4.12Å; Q1225-W1337 HydrophobicContact CG-CE3 4.49Å; Q1225-W1337 HydrophobicContact CG-CG 4.45Å
1226	I	98.3	Very high	92.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.5	-174.2	-60.3	-63.8	0	0	0	109.1	I1224 M1228 V1237 E1238 V1239 V1303 I1335 G1336 Y1338	I1224-I1226 HydrophobicContact CD1-CD1 3.9Å; I1224-I1226 HydrophobicContact CG1-CD1 3.83Å; I1224-I1226 HydrophobicContact CG1-CG1 4.13Å; I1224-I1226 HydrophobicContact CG2-CG1 4.2Å; I1226-M1228 HydrophobicContact CG2-CE 4.33Å; I1226-M1228 HydrophobicContact CG2-CG 3.95Å; I1226-M1228 HydrophobicContact CG2-SD 4.23Å; I1226-V1237 HydrophobicContact CG2-CG1 3.69Å; I1226-E1238 WeakPolarHBondContact CA-O 3.29Å; I1226-V1239 HydrophobicContact CD1-CB 4.31Å; I1226-V1239 HydrophobicContact CD1-CG1 4.12Å; I1226-V1239 HydrophobicContact CD1-CG2 4.07Å; I1226-V1303 HydrophobicContact CD1-CG1 4.05Å; I1226-V1303 HydrophobicContact CG1-CG1 4.4Å; I1226-I1335 WeakPolarHBondContact O-CA 3.41Å; I1226-G1336 PolarHBondContact N-O 3.12Å; I1226-G1336 PolarHBondContact O-N 3.24Å; I1226-Y1338 HydrophobicContact CB-CD2 4.1Å; I1226-Y1338 HydrophobicContact CB-CE2 4.12Å; I1226-Y1338 HydrophobicContact CG1-CD2 4.25Å
1227	G	97.6	Very high	93.8	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	143.2	163.8	0	0	0	0	0	110.9	V1237 E1238 V1334	G1227-V1237 CarbonylContact O-C 3.41Å; G1227-V1237 WeakPolarHBondContact O-CA 3.32Å; G1227-E1238 PolarHBondContact N-O 2.85Å; G1227-E1238 PolarHBondContact O-N 2.87Å; G1227-V1334 CarbonylContact C-O 3.51Å; G1227-V1334 VanDerWaalsContact CA-O 3.31Å; G1227-V1334 WeakPolarHBondContact CA-O 3.49Å
1228	M	98	Very high	94.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.4	175.7	-67	159.8	-67.2	0	0	110.3	I1226 L1235 E1236 V1237 L1301 I1323 L1325 L1328 L1330 M1333 V1334 Y1338	I1226-M1228 HydrophobicContact CG2-CE 4.33Å; I1226-M1228 HydrophobicContact CG2-CG 3.95Å; I1226-M1228 HydrophobicContact CG2-SD 4.23Å; M1228-L1235 HydrophobicContact CB-CD1 4.24Å; M1228-E1236 CarbonylContact C-O 3.59Å; M1228-E1236 VanDerWaalsContact CA-O 3.32Å; M1228-E1236 WeakPolarHBondContact CA-O 3.38Å; M1228-V1237 HydrophobicContact CG-CG1 4.37Å; M1228-V1237 HydrophobicContact CG-CG2 4.42Å; M1228-L1301 HydrophobicContact CG-CD2 4.08Å; M1228-L1301 HydrophobicContact SD-CD2 3.66Å; M1228-I1323 HydrophobicContact CE-CD1 4.04Å; M1228-I1323 HydrophobicContact CE-CG2 4.21Å; M1228-I1323 HydrophobicContact SD-CD1 3.92Å; M1228-I1323 HydrophobicContact SD-CG2 4.26Å; M1228-L1325 HydrophobicContact SD-CD2 3.7Å; M1228-L1328 HydrophobicContact CE-CD1 3.61Å; M1228-L1328 HydrophobicContact SD-CD1 4.2Å; M1228-L1330 HydrophobicContact CB-CD2 3.59Å; M1228-L1330 WeakPolarHBondContact O-CD2 3.21Å; M1228-M1333 CarbonylContact O-C 3.59Å; M1228-M1333 WeakPolarHBondContact O-CA 3.26Å; M1228-V1334 PolarHBondContact N-O 2.82Å; M1228-V1334 PolarHBondContact O-N 2.89Å; M1228-Y1338 HydrophobicContact CE-CE2 4.18Å; M1228-Y1338 WeakPolarHBondContact CE-OH 3.25Å
1229	E	96.9	Very high	95.6	Very high	41 Å²	41	38.2 Å²	38.2	19%	0.192	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	143.5	-178.8	-169.9	-177.4	162.9	0	0	110	K1231 L1235 E1236 M1333	E1229-K1231 VanDerWaalsContact CD-NZ 3.27Å; E1229-K1231 HydrophobicContact CG-CG 4.23Å; E1229-K1231 WeakPolarHBondContact OE1-CE 3.42Å; E1229-K1231 IonicContact OE1-NZ 3.6Å; E1229-K1231 PolarHBondContact OE1-NZ 2.86Å; E1229-K1231 VanDerWaalsContact OE2-CE 3.29Å; E1229-K1231 WeakPolarHBondContact OE2-CE 3.23Å; E1229-K1231 IonicContact OE2-NZ 2.61Å; E1229-K1231 PolarHBondContact OE2-NZ 2.92Å; E1229-L1235 CarbonylContact O-C 3.58Å; E1229-E1236 PolarHBondContact N-O 3.04Å; E1229-E1236 PolarHBondContact O-N 2.98Å; E1229-M1333 HydrophobicContact CB-CB 4.16Å; E1229-M1333 HydrophobicContact CB-CE 4.34Å; E1229-M1333 HydrophobicContact CB-CG 4.48Å; E1229-M1333 HydrophobicContact CG-CB 4.41Å; E1229-M1333 WeakPolarHBondContact OE2-CE 3.41Å
1230	D	96.3	Very high	96.2	Very high	45 Å²	45	33.9 Å²	33.9	24%	0.241	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	107.8	169.7	-170.3	-23.6	0	0	0	110.6	K1232 G1233 Q1234 P1296 L1330	D1230-K1232 PolarHBondContact O-N 2.82Å; D1230-K1232 PolarHBondContact OD1-N 3.13Å; D1230-G1233 VanDerWaalsContact OD1-CA 3.25Å; D1230-G1233 WeakPolarHBondContact OD1-CA 3.39Å; D1230-G1233 PolarHBondContact OD1-N 3.22Å; D1230-Q1234 PolarHBondContact OD1-N 2.69Å; D1230-P1296 HydrophobicContact CB-CG 4.06Å; D1230-P1296 WeakPolarHBondContact OD2-CD 3.29Å; D1230-P1296 WeakPolarHBondContact OD2-CG 3.26Å; D1230-L1330 HydrophobicContact CB-CB 4.18Å; D1230-L1330 PolarHBondContact N-O 2.92Å
1231	K	93.6	Very high	96.5	Very high	78 Å²	78	36.9 Å²	36.9	34%	0.339	18%	0.176	S	C	.	.	S	Bend	trans	-100.1	79.3	175.3	-76	179.9	170.2	116.9	0	111.1	E1229 Q1234 E1236	E1229-K1231 VanDerWaalsContact CD-NZ 3.27Å; E1229-K1231 HydrophobicContact CG-CG 4.23Å; E1229-K1231 WeakPolarHBondContact OE1-CE 3.42Å; E1229-K1231 IonicContact OE1-NZ 3.6Å; E1229-K1231 PolarHBondContact OE1-NZ 2.86Å; E1229-K1231 VanDerWaalsContact OE2-CE 3.29Å; E1229-K1231 WeakPolarHBondContact OE2-CE 3.23Å; E1229-K1231 IonicContact OE2-NZ 2.61Å; E1229-K1231 PolarHBondContact OE2-NZ 2.92Å; K1231-Q1234 PolarHBondContact N-O 3.22Å; K1231-E1236 HydrophobicContact CD-CB 4.45Å; K1231-E1236 VanDerWaalsContact CD-OE2 3.25Å; K1231-E1236 WeakPolarHBondContact CD-OE2 3.44Å; K1231-E1236 WeakPolarHBondContact CE-OE2 3.42Å; K1231-E1236 IonicContact NZ-OE1 3.76Å; K1231-E1236 IonicContact NZ-OE2 2.66Å; K1231-E1236 PolarHBondContact NZ-OE2 2.85Å
1232	K	92.3	Very high	96.7	Very high	211 Å²	211	35.2 Å²	35.2	92%	0.917	17%	0.169	S	C	*	.	S	Bend	trans	70	42.9	171.7	-45.7	175.2	-177.9	-178.4	0	113.6	D1230	D1230-K1232 PolarHBondContact O-N 2.82Å; D1230-K1232 PolarHBondContact OD1-N 3.13Å
1233	G	89.9	Confident	96.8	Very high	32 Å²	32	39.6 Å²	39.6	33%	0.33	18%	0.184	S	C	.	.	S	Bend	trans	87.7	13	-174.2	0	0	0	0	0	113.7	D1230 E1294 S1295	D1230-G1233 VanDerWaalsContact OD1-CA 3.25Å; D1230-G1233 WeakPolarHBondContact OD1-CA 3.39Å; D1230-G1233 PolarHBondContact OD1-N 3.22Å; G1233-E1294 CarbonylContact O-C 3.53Å; G1233-S1295 WeakPolarHBondContact O-CA 3.32Å; G1233-S1295 PolarHBondContact O-N 3.01Å
1234	Q	94.8	Very high	96.8	Very high	78 Å²	78	42 Å²	42	36%	0.364	20%	0.203	S	C	.	.			trans	-124.4	113.3	179.4	-67.6	-163.1	-25.8	0	0	109.8	D1230 K1231 E1236 V1291 F1292	D1230-Q1234 PolarHBondContact OD1-N 2.69Å; K1231-Q1234 PolarHBondContact N-O 3.22Å; Q1234-E1236 PolarHBondContact O-N 2.94Å; Q1234-V1291 HydrophobicContact CB-CG1 4.17Å; Q1234-F1292 WeakPolarHBondContact CA-O 3.4Å; Q1234-F1292 VanDerWaalsContact CB-O 3.31Å; Q1234-F1292 WeakPolarHBondContact CB-O 3.38Å
1235	L	97.2	Very high	96.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	108.2	176.8	169.9	63.5	0	0	0	111.2	M1228 E1229 V1237 L1263 F1292 E1294 P1296 L1301 L1325 L1330	M1228-L1235 HydrophobicContact CB-CD1 4.24Å; E1229-L1235 CarbonylContact O-C 3.58Å; L1235-V1237 HydrophobicContact CD1-CG2 4.13Å; L1235-V1237 HydrophobicContact CD2-CG2 4.04Å; L1235-V1237 HydrophobicContact CG-CG2 3.8Å; L1235-L1263 HydrophobicContact CD2-CD1 3.86Å; L1235-F1292 HydrophobicContact CB-CB 4.19Å; L1235-F1292 WeakPolarHBondContact O-CB 3.37Å; L1235-F1292 PolarHBondContact O-N 3.41Å; L1235-E1294 PolarHBondContact N-O 2.84Å; L1235-E1294 VanDerWaalsContact N-O 3.16Å; L1235-P1296 HydrophobicContact CB-CB 4.44Å; L1235-P1296 HydrophobicContact CD1-CB 4.31Å; L1235-L1301 HydrophobicContact CD2-CD1 4.04Å; L1235-L1325 HydrophobicContact CD1-CD2 4.45Å; L1235-L1325 HydrophobicContact CD2-CD1 3.58Å; L1235-L1325 HydrophobicContact CD2-CD2 4.36Å; L1235-L1330 HydrophobicContact CD1-CD1 4.36Å
1236	E	97.4	Very high	96.5	Very high	26 Å²	26	43.8 Å²	43.8	12%	0.121	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	123	166.3	-173.6	174.4	161.5	0	0	110.6	M1228 E1229 K1231 Q1234 S1289 V1291	M1228-E1236 CarbonylContact C-O 3.59Å; M1228-E1236 VanDerWaalsContact CA-O 3.32Å; M1228-E1236 WeakPolarHBondContact CA-O 3.38Å; E1229-E1236 PolarHBondContact N-O 3.04Å; E1229-E1236 PolarHBondContact O-N 2.98Å; K1231-E1236 HydrophobicContact CD-CB 4.45Å; K1231-E1236 VanDerWaalsContact CD-OE2 3.25Å; K1231-E1236 WeakPolarHBondContact CD-OE2 3.44Å; K1231-E1236 WeakPolarHBondContact CE-OE2 3.42Å; K1231-E1236 IonicContact NZ-OE1 3.76Å; K1231-E1236 IonicContact NZ-OE2 2.66Å; K1231-E1236 PolarHBondContact NZ-OE2 2.85Å; Q1234-E1236 PolarHBondContact O-N 2.94Å; E1236-S1289 WeakPolarHBondContact OE1-CB 3.46Å; E1236-S1289 PolarHBondContact OE1-OG 2.87Å; E1236-V1291 HydrophobicContact CB-CG2 4.22Å; E1236-V1291 HydrophobicContact CG-CG2 3.91Å
1237	V	98.1	Very high	96.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	105.3	173.9	-174.2	0	0	0	0	109.9	I1226 G1227 M1228 L1235 V1239 V1261 S1289 L1290 F1292 L1301	I1226-V1237 HydrophobicContact CG2-CG1 3.69Å; G1227-V1237 CarbonylContact O-C 3.41Å; G1227-V1237 WeakPolarHBondContact O-CA 3.32Å; M1228-V1237 HydrophobicContact CG-CG1 4.37Å; M1228-V1237 HydrophobicContact CG-CG2 4.42Å; L1235-V1237 HydrophobicContact CD1-CG2 4.13Å; L1235-V1237 HydrophobicContact CD2-CG2 4.04Å; L1235-V1237 HydrophobicContact CG-CG2 3.8Å; V1237-V1239 PolarHBondContact O-N 3.13Å; V1237-V1261 HydrophobicContact CG1-CG1 4.42Å; V1237-V1261 HydrophobicContact CG1-CG2 4.4Å; V1237-S1289 CarbonylContact O-C 3.53Å; V1237-L1290 HydrophobicContact CB-CB 4.48Å; V1237-L1290 PolarHBondContact N-O 3.28Å; V1237-L1290 PolarHBondContact O-N 2.84Å; V1237-F1292 HydrophobicContact CB-CE2 4.35Å; V1237-F1292 HydrophobicContact CG2-CD2 3.9Å; V1237-F1292 HydrophobicContact CG2-CE2 3.85Å; V1237-L1301 HydrophobicContact CG1-CD2 3.91Å; V1237-L1301 HydrophobicContact CG2-CD1 4.2Å; V1237-L1301 HydrophobicContact CG2-CD2 3.76Å
1238	E	98.1	Very high	95.8	Very high	39 Å²	39	51 Å²	51	18%	0.182	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	113.9	169.4	-159.3	-159.6	162.7	0	0	110.4	I1226 G1227 I1240 M1333	I1226-E1238 WeakPolarHBondContact CA-O 3.29Å; G1227-E1238 PolarHBondContact N-O 2.85Å; G1227-E1238 PolarHBondContact O-N 2.87Å; E1238-I1240 HydrophobicContact CB-CG1 4.33Å; E1238-I1240 HydrophobicContact CG-CG1 4.06Å; E1238-I1240 PolarHBondContact O-N 2.97Å; E1238-M1333 HydrophobicContact CB-CE 4.3Å; E1238-M1333 HydrophobicContact CB-SD 4.47Å
1239	V	98.5	Very high	95.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	102.8	166.3	-175	0	0	0	0	108.1	I1224 I1226 V1237 V1259 V1261 T1275 Y1286 Q1287 Q1288 L1290	I1224-V1239 HydrophobicContact CD1-CG1 4.39Å; I1226-V1239 HydrophobicContact CD1-CB 4.31Å; I1226-V1239 HydrophobicContact CD1-CG1 4.12Å; I1226-V1239 HydrophobicContact CD1-CG2 4.07Å; V1237-V1239 PolarHBondContact O-N 3.13Å; V1239-V1259 HydrophobicContact CG1-CB 3.92Å; V1239-V1259 HydrophobicContact CG1-CG1 4.08Å; V1239-V1259 HydrophobicContact CG1-CG2 3.77Å; V1239-V1259 HydrophobicContact CG2-CG1 4.27Å; V1239-V1261 HydrophobicContact CG2-CG2 3.98Å; V1239-T1275 HydrophobicContact CB-CG2 3.59Å; V1239-T1275 HydrophobicContact CG1-CG2 3.73Å; V1239-T1275 HydrophobicContact CG2-CG2 3.82Å; V1239-Y1286 HydrophobicContact CG1-CD2 3.74Å; V1239-Y1286 HydrophobicContact CG1-CE2 4.43Å; V1239-Y1286 HydrophobicContact CG1-CG 4.07Å; V1239-Y1286 VanDerWaalsContact O-CB 3.3Å; V1239-Y1286 WeakPolarHBondContact O-CB 3.42Å; V1239-Q1287 WeakPolarHBondContact O-CA 3.39Å; V1239-Q1287 PolarHBondContact O-N 2.83Å; V1239-Q1288 PolarHBondContact N-O 3.16Å; V1239-Q1288 PolarHBondContact O-N 2.66Å; V1239-L1290 HydrophobicContact CG2-CD1 3.78Å; V1239-L1290 HydrophobicContact CG2-CG 4.38Å
1240	I	98.2	Very high	94.5	Very high	20 Å²	20	57.1 Å²	57.1	10%	0.103	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-64.3	-173.2	-57.5	170	0	0	0	110.1	Q1225 E1238 Y1286 Q1287 I1335	Q1225-I1240 HydrophobicContact CB-CB 4.32Å; Q1225-I1240 HydrophobicContact CG-CB 4.49Å; Q1225-I1240 HydrophobicContact CG-CD1 4.13Å; Q1225-I1240 PolarHBondContact O-N 2.82Å; Q1225-I1240 VanDerWaalsContact O-N 3.15Å; E1238-I1240 HydrophobicContact CB-CG1 4.33Å; E1238-I1240 HydrophobicContact CG-CG1 4.06Å; E1238-I1240 PolarHBondContact O-N 2.97Å; I1240-Y1286 PolarHBondContact O-N 3.41Å; I1240-Q1287 PolarHBondContact O-N 3.22Å; I1240-I1335 HydrophobicContact CD1-CD1 4.22Å; I1240-I1335 HydrophobicContact CD1-CG1 4.44Å; I1240-I1335 HydrophobicContact CD1-CG2 3.61Å
1241	R	98.3	Very high	93.9	Very high	105 Å²	105	56.3 Å²	56.3	40%	0.396	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	166.5	-177.5	60.5	175.3	167.2	163.4	-8.4	112.4	I1224 Q1225 P1284 L1285 W1337	I1224-R1241 WeakPolarHBondContact CG1-O 3.44Å; Q1225-R1241 HydrophobicContact CB-CG 3.92Å; Q1225-R1241 PolarHBondContact N-O 2.74Å; R1241-P1284 CarbonylContact C-O 3.56Å; R1241-P1284 WeakPolarHBondContact CA-O 3.06Å; R1241-P1284 VanDerWaalsContact CB-O 3.31Å; R1241-P1284 WeakPolarHBondContact CB-O 3.44Å; R1241-L1285 HydrophobicContact CB-CD1 4.09Å; R1241-W1337 HydrophobicContact CG-CH2 4.09Å; R1241-W1337 VanDerWaalsContact CZ-CZ2 3.46Å
1242	A	98.4	Very high	93.4	Very high	2 Å²	2	62.9 Å²	62.9	2%	0.017	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	162.6	159.9	0	0	0	0	0	110.8	D1223 I1224 L1245 D1283 P1284	D1223-A1242 CarbonylContact O-C 3.54Å; D1223-A1242 WeakPolarHBondContact O-CA 3.24Å; D1223-A1242 VanDerWaalsContact O-CB 3.32Å; D1223-A1242 WeakPolarHBondContact O-CB 3.43Å; I1224-A1242 HydrophobicContact CB-CB 4.25Å; I1224-A1242 HydrophobicContact CG1-CB 4.16Å; A1242-L1245 HydrophobicContact CB-CD1 4.09Å; A1242-L1245 HydrophobicContact CB-CD2 4.05Å; A1242-L1245 HydrophobicContact CB-CG 4.13Å; A1242-D1283 CarbonylContact O-C 3.58Å; A1242-D1283 WeakPolarHBondContact O-CA 3.27Å; A1242-P1284 HydrophobicContact CB-CG 3.9Å; A1242-P1284 PolarHBondContact N-O 3.12Å; A1242-P1284 WeakPolarHBondContact O-CD 3.29Å
1243	R	97.5	Very high	93.2	Very high	97 Å²	97	55.2 Å²	55.2	37%	0.366	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	159.8	176.1	69.1	179.2	-178.2	-154.4	-5.5	111.4	G1222 D1223 L1245 D1283 W1337	G1222-R1243 WeakPolarHBondContact CA-O 3.44Å; D1223-R1243 HydrophobicContact CB-CG 4.01Å; D1223-R1243 PolarHBondContact N-O 2.63Å; D1223-R1243 PolarHBondContact O-N 3.49Å; D1223-R1243 IonicContact OD2-CZ 3.51Å; D1223-R1243 IonicContact OD2-NE 3.43Å; D1223-R1243 PolarHBondContact OD2-NE 3.45Å; D1223-R1243 IonicContact OD2-NH2 3.96Å; D1223-R1243 PolarHBondContact OD2-NH2 3.18Å; R1243-L1245 PolarHBondContact O-N 2.81Å; R1243-L1245 VanDerWaalsContact O-N 3.12Å; R1243-D1283 VanDerWaalsContact CA-OD1 3.28Å; R1243-D1283 WeakPolarHBondContact CA-OD1 3.49Å; R1243-W1337 HydrophobicContact CB-CH2 4.18Å; R1243-W1337 HydrophobicContact CB-CZ3 4.48Å; R1243-W1337 HydrophobicContact CG-CH2 3.68Å; R1243-W1337 HydrophobicContact CG-CZ3 3.73Å
1244	S	96.1	Very high	93.4	Very high	77 Å²	77	56.1 Å²	56.1	54%	0.538	30%	0.304	S	S	.	.	S	Bend	trans	57.2	26.8	171.5	-51.1	0	0	0	0	114.3	G1222 T1246 D1283	G1222-S1244 WeakPolarHBondContact CA-O 3.3Å; S1244-T1246 PolarHBondContact O-N 3.45Å; S1244-D1283 PolarHBondContact N-OD1 3.39Å
1245	L	97.4	Very high	93.4	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	29%	0.287	C	S	.	.			trans	-64	130.3	-175.1	-66.5	175.5	0	0	0	111.7	M1221 A1242 R1243 Q1247 P1257 L1282 P1284 V1305 M1318 L1340	M1221-L1245 CarbonylContact O-C 3.55Å; M1221-L1245 WeakPolarHBondContact O-CA 3.43Å; A1242-L1245 HydrophobicContact CB-CD1 4.09Å; A1242-L1245 HydrophobicContact CB-CD2 4.05Å; A1242-L1245 HydrophobicContact CB-CG 4.13Å; R1243-L1245 PolarHBondContact O-N 2.81Å; R1243-L1245 VanDerWaalsContact O-N 3.12Å; L1245-Q1247 PolarHBondContact O-N 2.83Å; L1245-P1257 HydrophobicContact CD1-CB 4.19Å; L1245-P1257 HydrophobicContact CD1-CG 4.32Å; L1245-L1282 HydrophobicContact CB-CB 4.27Å; L1245-L1282 VanDerWaalsContact CB-O 3.24Å; L1245-L1282 WeakPolarHBondContact CB-O 3.46Å; L1245-L1282 WeakPolarHBondContact CD1-O 3.26Å; L1245-L1282 WeakPolarHBondContact CG-O 3.39Å; L1245-L1282 PolarHBondContact N-O 2.8Å; L1245-L1282 VanDerWaalsContact N-O 3.16Å; L1245-L1282 WeakPolarHBondContact O-CD2 3.24Å; L1245-P1284 HydrophobicContact CD1-CG 3.82Å; L1245-V1305 HydrophobicContact CD1-CG1 3.88Å; L1245-V1305 HydrophobicContact CD2-CB 4.46Å; L1245-V1305 HydrophobicContact CD2-CG1 4.12Å; L1245-V1305 HydrophobicContact CD2-CG2 4.33Å; L1245-M1318 HydrophobicContact CB-CE 3.79Å; L1245-M1318 HydrophobicContact CD1-CE 4.48Å; L1245-L1340 HydrophobicContact CD2-CD1 3.49Å; L1245-L1340 VanDerWaalsContact CD2-CD1 3.49Å
1246	T	94.2	Very high	93.4	Very high	66 Å²	66	53 Å²	53	41%	0.405	29%	0.292	S	S	.	.			trans	-68.4	114.6	-176.2	-62.4	0	0	0	0	111.6	M1221 S1244 M1318	M1221-T1246 WeakPolarHBondContact CA-OG1 3.09Å; M1221-T1246 WeakPolarHBondContact O-CB 3.41Å; M1221-T1246 PolarHBondContact O-N 3.06Å; M1221-T1246 PolarHBondContact O-OG1 3.21Å; S1244-T1246 PolarHBondContact O-N 3.45Å; T1246-M1318 WeakPolarHBondContact O-CE 3.12Å
1247	Q	92.3	Very high	93.4	Very high	64 Å²	64	51.8 Å²	51.8	30%	0.299	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-72.7	128	173.2	-177.7	167.7	-32.1	0	0	111	L1245 S1251 L1282 Y1309	L1245-Q1247 PolarHBondContact O-N 2.83Å; Q1247-S1251 VanDerWaalsContact CG-OG 3.29Å; Q1247-S1251 WeakPolarHBondContact CG-OG 3.43Å; Q1247-S1251 PolarHBondContact NE2-O 3.05Å; Q1247-S1251 PolarHBondContact NE2-OG 3.02Å; Q1247-L1282 HydrophobicContact CB-CD1 4.06Å; Q1247-L1282 HydrophobicContact CB-CD2 3.98Å; Q1247-Y1309 HydrophobicContact CG-CE1 4.41Å
1248	K	88.5	Confident	93.5	Very high	88 Å²	88	53.3 Å²	53.3	38%	0.383	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-47	122	175.6	-176.6	173.9	-171	156.6	0	112.6	G1250 S1251 Y1309 D1313	K1248-G1250 PolarHBondContact O-N 2.95Å; K1248-S1251 VanDerWaalsContact O-CB 3.31Å; K1248-S1251 WeakPolarHBondContact O-CB 3.17Å; K1248-S1251 PolarHBondContact O-N 3.49Å; K1248-S1251 VanDerWaalsContact O-N 3.12Å; K1248-S1251 PolarHBondContact O-OG 2.87Å; K1248-Y1309 HydrophobicContact CB-CE1 4.4Å; K1248-Y1309 HydrophobicContact CB-CE2 4.06Å; K1248-Y1309 WeakPolarHBondContact CB-OH 3.25Å; K1248-Y1309 HydrophobicContact CD-CE2 4.5Å; K1248-Y1309 PolarHBondContact N-OH 2.75Å; K1248-D1313 IonicContact NZ-OD2 3.41Å; K1248-D1313 PolarHBondContact NZ-OD2 3.18Å
1249	P	86.8	Confident	93.5	Very high	91 Å²	91	51.5 Å²	51.5	59%	0.591	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	138.1	177	-29.3	36.1	0	0	0	113	S1251	P1249-S1251 PolarHBondContact O-N 2.9Å
1250	G	81.2	Confident	93.5	Very high	79 Å²	79	54 Å²	54	81%	0.814	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	-6.5	-177.5	0	0	0	0	0	115.9	K1248	K1248-G1250 PolarHBondContact O-N 2.95Å
1251	S	83.7	Confident	93.5	Very high	28 Å²	28	53 Å²	53	20%	0.196	29%	0.289	C	S	.	.			trans	-75.7	126.4	173.8	67.8	0	0	0	0	111.5	Q1247 K1248 P1249 S1253 Y1309	Q1247-S1251 VanDerWaalsContact CG-OG 3.29Å; Q1247-S1251 WeakPolarHBondContact CG-OG 3.43Å; Q1247-S1251 PolarHBondContact NE2-O 3.05Å; Q1247-S1251 PolarHBondContact NE2-OG 3.02Å; K1248-S1251 VanDerWaalsContact O-CB 3.31Å; K1248-S1251 WeakPolarHBondContact O-CB 3.17Å; K1248-S1251 PolarHBondContact O-N 3.49Å; K1248-S1251 VanDerWaalsContact O-N 3.12Å; K1248-S1251 PolarHBondContact O-OG 2.87Å; P1249-S1251 PolarHBondContact O-N 2.9Å; S1251-S1253 VanDerWaalsContact C-N 3.33Å; S1251-Y1309 VanDerWaalsContact OG-CE1 3.31Å; S1251-Y1309 WeakPolarHBondContact OG-CE1 3.16Å
1252	K	82.4	Confident	93.5	Very high	216 Å²	216	49.7 Å²	49.7	94%	0.939	28%	0.277	S	S	*	.	S	Bend	trans	-85.8	1.2	178.7	-68.7	-167.6	176.9	-172.1	0	114.6
1253	S	88.4	Confident	93.4	Very high	49 Å²	49	49.6 Å²	49.6	34%	0.343	28%	0.276	S	S	.	.	S	Bend	trans	-139.1	131.5	-174.3	60.5	0	0	0	0	110.5	S1251 Y1309	S1251-S1253 VanDerWaalsContact C-N 3.33Å; S1253-Y1309 WeakPolarHBondContact O-CD1 3.13Å; S1253-Y1309 WeakPolarHBondContact O-CE1 3.11Å
1254	T	93.3	Very high	93.3	Very high	52 Å²	52	45.7 Å²	45.7	32%	0.319	26%	0.262	S	S	.	.			trans	-56.6	136.1	172	-39.6	0	0	0	0	110.6	K1280 L1282	T1254-K1280 WeakPolarHBondContact O-CD 3.46Å; T1254-L1282 HydrophobicContact CG2-CD2 3.81Å; T1254-L1282 HydrophobicContact CG2-CG 3.95Å
1255	P	95.9	Very high	93.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.253	C	S	.	.			trans	-68.9	159.3	175.4	28.6	-32.9	0	0	0	111.3	P1257 K1280 T1281 L1282 D1308 Y1309 M1318	P1255-P1257 WeakPolarHBondContact O-CD 3.28Å; P1255-K1280 CarbonylContact O-C 3.58Å; P1255-K1280 WeakPolarHBondContact O-CA 3.29Å; P1255-T1281 PolarHBondContact O-N 2.77Å; P1255-T1281 VanDerWaalsContact O-N 3.1Å; P1255-L1282 HydrophobicContact CG-CD2 4.05Å; P1255-D1308 WeakPolarHBondContact CA-O 3.13Å; P1255-Y1309 HydrophobicContact CB-CD1 4.25Å; P1255-Y1309 HydrophobicContact CB-CD2 4.04Å; P1255-Y1309 HydrophobicContact CB-CE1 3.96Å; P1255-Y1309 HydrophobicContact CB-CE2 3.74Å; P1255-Y1309 HydrophobicContact CB-CG 4.27Å; P1255-Y1309 HydrophobicContact CG-CE1 4.11Å; P1255-Y1309 HydrophobicContact CG-CE2 4.17Å; P1255-M1318 HydrophobicContact CB-SD 4.2Å; P1255-M1318 HydrophobicContact CG-CE 3.61Å; P1255-M1318 HydrophobicContact CG-SD 3.72Å
1256	A	97.1	Very high	92.8	Very high	12 Å²	12	53.1 Å²	53.1	10%	0.099	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	100.8	160.2	0	0	0	0	0	107.9	I1277 K1280 D1308	A1256-I1277 HydrophobicContact CB-CG2 3.73Å; A1256-K1280 HydrophobicContact CB-CG 3.93Å; A1256-D1308 HydrophobicContact CB-CB 4.42Å; A1256-D1308 PolarHBondContact N-O 2.73Å; A1256-D1308 WeakPolarHBondContact O-CB 3.31Å; A1256-D1308 PolarHBondContact O-N 2.77Å
1257	P	98	Very high	92.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	155.7	-172.8	33.9	-37.6	0	0	0	112.7	L1245 P1255 A1278 T1281 P1284 Y1286 V1305 W1306 M1318	L1245-P1257 HydrophobicContact CD1-CB 4.19Å; L1245-P1257 HydrophobicContact CD1-CG 4.32Å; P1255-P1257 WeakPolarHBondContact O-CD 3.28Å; P1257-A1278 HydrophobicContact CG-CB 4.3Å; P1257-A1278 WeakPolarHBondContact O-CB 3.31Å; P1257-A1278 PolarHBondContact O-N 3.36Å; P1257-T1281 WeakPolarHBondContact CD-O 3.45Å; P1257-P1284 HydrophobicContact CB-CG 4.36Å; P1257-P1284 HydrophobicContact CG-CB 3.62Å; P1257-P1284 HydrophobicContact CG-CG 3.59Å; P1257-Y1286 WeakPolarHBondContact CB-OH 3.5Å; P1257-Y1286 PolarHBondContact O-OH 3.16Å; P1257-V1305 HydrophobicContact CB-CG1 4.22Å; P1257-W1306 CarbonylContact C-O 3.49Å; P1257-W1306 WeakPolarHBondContact CA-O 3.45Å; P1257-M1318 HydrophobicContact CB-SD 4.38Å
1258	Y	98.3	Very high	92.2	Very high	33 Å²	33	53 Å²	53	13%	0.129	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	157.2	165.8	65.3	-86.4	0	0	0	110.1	I1277 Y1286 W1306	Y1258-I1277 HydrophobicContact CD1-CD1 4.49Å; Y1258-I1277 HydrophobicContact CD1-CG1 4.04Å; Y1258-I1277 HydrophobicContact CG-CG1 4.28Å; Y1258-Y1286 WeakPolarHBondContact CA-OH 3.4Å; Y1258-Y1286 PolarHBondContact N-OH 3.24Å; Y1258-W1306 HydrophobicContact CD1-CB 4.12Å; Y1258-W1306 WeakPolarHBondContact CD1-O 3.28Å; Y1258-W1306 HydrophobicContact CD2-CB 4.21Å; Y1258-W1306 HydrophobicContact CE1-CB 3.66Å; Y1258-W1306 HydrophobicContact CE2-CB 3.75Å; Y1258-W1306 AromaticContact CE2-CD1 3.89Å; Y1258-W1306 AromaticContact CE2-CG 4Å; Y1258-W1306 HydrophobicContact CE2-CG 4Å; Y1258-W1306 HydrophobicContact CG-CB 4.38Å; Y1258-W1306 VanDerWaalsContact CZ-CB 3.46Å; Y1258-W1306 AromaticContact CZ-CG 3.98Å; Y1258-W1306 PolarHBondContact N-O 3.15Å; Y1258-W1306 PolarHBondContact O-N 2.77Å
1259	V	98.5	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.5	178.8	-177.9	0	0	0	0	108.5	I1224 V1239 V1261 K1274 T1275 Y1286 V1303 V1305	I1224-V1259 HydrophobicContact CD1-CB 4.4Å; I1224-V1259 HydrophobicContact CD1-CG1 3.87Å; I1224-V1259 HydrophobicContact CD1-CG2 3.58Å; V1239-V1259 HydrophobicContact CG1-CB 3.92Å; V1239-V1259 HydrophobicContact CG1-CG1 4.08Å; V1239-V1259 HydrophobicContact CG1-CG2 3.77Å; V1239-V1259 HydrophobicContact CG2-CG1 4.27Å; V1259-V1261 HydrophobicContact CG1-CG2 4.13Å; V1259-K1274 CarbonylContact O-C 3.53Å; V1259-K1274 VanDerWaalsContact O-CA 3.3Å; V1259-K1274 WeakPolarHBondContact O-CA 2.94Å; V1259-K1274 WeakPolarHBondContact O-CB 3.34Å; V1259-T1275 HydrophobicContact CB-CG2 4.19Å; V1259-T1275 PolarHBondContact N-OG1 3.37Å; V1259-T1275 PolarHBondContact O-N 3.03Å; V1259-T1275 PolarHBondContact O-OG1 2.76Å; V1259-Y1286 HydrophobicContact CG2-CD2 4.05Å; V1259-Y1286 HydrophobicContact CG2-CE1 4.38Å; V1259-Y1286 HydrophobicContact CG2-CE2 3.42Å; V1259-Y1286 VanDerWaalsContact CG2-CE2 3.42Å; V1259-V1303 HydrophobicContact CG1-CG1 3.68Å; V1259-V1305 HydrophobicContact CG2-CG2 4.37Å
1260	K	98.2	Very high	93	Very high	53 Å²	53	50 Å²	50	23%	0.23	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.3	168	-175.1	174.7	168.4	-154.6	0	109	Y1262 K1274 I1304	K1260-Y1262 HydrophobicContact CB-CE2 4.1Å; K1260-Y1262 HydrophobicContact CD-CE1 4.18Å; K1260-Y1262 HydrophobicContact CD-CE2 3.87Å; K1260-Y1262 WeakPolarHBondContact CD-OH 3.47Å; K1260-Y1262 VanDerWaalsContact CE-CE1 3.42Å; K1260-Y1262 WeakPolarHBondContact CE-OH 3.35Å; K1260-Y1262 HydrophobicContact CG-CD2 4.23Å; K1260-Y1262 HydrophobicContact CG-CE2 3.7Å; K1260-Y1262 PolarHBondContact NZ-OH 2.66Å; K1260-K1274 HydrophobicContact CB-CB 4.19Å; K1260-K1274 HydrophobicContact CG-CB 4.16Å; K1260-I1304 PolarHBondContact N-O 3.24Å; K1260-I1304 PolarHBondContact O-N 2.7Å
1261	V	98.3	Very high	93.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.5	178.6	-177.2	0	0	0	0	107.9	V1237 V1239 V1259 K1272 K1273 L1290 F1292 L1301 V1303	V1237-V1261 HydrophobicContact CG1-CG1 4.42Å; V1237-V1261 HydrophobicContact CG1-CG2 4.4Å; V1239-V1261 HydrophobicContact CG2-CG2 3.98Å; V1259-V1261 HydrophobicContact CG1-CG2 4.13Å; V1261-K1272 CarbonylContact O-C 3.45Å; V1261-K1272 VanDerWaalsContact O-CA 3.25Å; V1261-K1272 WeakPolarHBondContact O-CA 3.37Å; V1261-K1273 PolarHBondContact N-O 2.62Å; V1261-K1273 PolarHBondContact O-N 3.12Å; V1261-K1273 VanDerWaalsContact O-O 3.07Å; V1261-L1290 HydrophobicContact CB-CD1 4.24Å; V1261-L1290 HydrophobicContact CG2-CD1 3.8Å; V1261-F1292 HydrophobicContact CB-CE2 4.36Å; V1261-F1292 HydrophobicContact CB-CZ 4.08Å; V1261-F1292 HydrophobicContact CG1-CE2 3.91Å; V1261-F1292 HydrophobicContact CG1-CZ 3.78Å; V1261-L1301 HydrophobicContact CG1-CD1 3.42Å; V1261-L1301 VanDerWaalsContact CG1-CD1 3.42Å; V1261-L1301 HydrophobicContact CG1-CD2 4.01Å; V1261-L1301 HydrophobicContact CG1-CG 3.69Å; V1261-V1303 HydrophobicContact CG1-CG2 4.46Å; V1261-V1303 HydrophobicContact CG2-CG1 4.46Å; V1261-V1303 HydrophobicContact CG2-CG2 4.42Å
1262	Y	98	Very high	94.4	Very high	35 Å²	35	50.8 Å²	50.8	14%	0.137	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129	176.3	-58.3	-108	0	0	0	107.6	K1260 A1271 K1272 Q1302 I1304	K1260-Y1262 HydrophobicContact CB-CE2 4.1Å; K1260-Y1262 HydrophobicContact CD-CE1 4.18Å; K1260-Y1262 HydrophobicContact CD-CE2 3.87Å; K1260-Y1262 WeakPolarHBondContact CD-OH 3.47Å; K1260-Y1262 VanDerWaalsContact CE-CE1 3.42Å; K1260-Y1262 WeakPolarHBondContact CE-OH 3.35Å; K1260-Y1262 HydrophobicContact CG-CD2 4.23Å; K1260-Y1262 HydrophobicContact CG-CE2 3.7Å; K1260-Y1262 PolarHBondContact NZ-OH 2.66Å; Y1262-A1271 WeakPolarHBondContact CA-O 3.05Å; Y1262-K1272 HydrophobicContact CD1-CB 3.82Å; Y1262-K1272 HydrophobicContact CD1-CD 4.47Å; Y1262-K1272 HydrophobicContact CE1-CB 4.36Å; Y1262-K1272 HydrophobicContact CG-CB 4.25Å; Y1262-Q1302 PolarHBondContact N-O 3.04Å; Y1262-Q1302 PolarHBondContact O-N 2.9Å; Y1262-I1304 HydrophobicContact CD2-CD1 4.24Å; Y1262-I1304 HydrophobicContact CD2-CG1 4.32Å; Y1262-I1304 HydrophobicContact CE2-CB 4.34Å; Y1262-I1304 HydrophobicContact CE2-CD1 3.69Å; Y1262-I1304 HydrophobicContact CE2-CG1 4Å
1263	L	97.5	Very high	95.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.7	169.7	-172	59.5	0	0	0	107.6	L1235 I1270 A1271 F1292 E1294 K1299 L1301 L1325	L1235-L1263 HydrophobicContact CD2-CD1 3.86Å; L1263-I1270 HydrophobicContact CB-CG1 4.31Å; L1263-I1270 HydrophobicContact CD2-CD1 4.04Å; L1263-I1270 HydrophobicContact CD2-CG1 4.32Å; L1263-I1270 HydrophobicContact CG-CD1 4.17Å; L1263-I1270 HydrophobicContact CG-CG1 4.17Å; L1263-I1270 PolarHBondContact O-N 2.82Å; L1263-A1271 HydrophobicContact CB-CB 4.16Å; L1263-A1271 PolarHBondContact N-O 3.04Å; L1263-F1292 HydrophobicContact CB-CD1 4.1Å; L1263-F1292 HydrophobicContact CB-CE1 4.03Å; L1263-F1292 HydrophobicContact CD2-CB 4.41Å; L1263-F1292 HydrophobicContact CD2-CD1 4.15Å; L1263-F1292 HydrophobicContact CD2-CG 4.45Å; L1263-E1294 HydrophobicContact CD2-CB 3.8Å; L1263-E1294 HydrophobicContact CD2-CG 4.39Å; L1263-K1299 HydrophobicContact CD1-CB 3.8Å; L1263-K1299 HydrophobicContact CD1-CD 3.97Å; L1263-K1299 HydrophobicContact CD1-CG 4.42Å; L1263-K1299 HydrophobicContact CD2-CD 3.95Å; L1263-K1299 HydrophobicContact CG-CB 4.48Å; L1263-K1299 HydrophobicContact CG-CD 3.93Å; L1263-L1301 HydrophobicContact CD1-CD1 3.98Å; L1263-L1325 HydrophobicContact CD1-CD1 3.56Å
1264	L	95.9	Very high	95.6	Very high	15 Å²	15	47.7 Å²	47.7	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.8	-178.3	-48.7	179.6	0	0	0	110.1	A1268 C1269 K1299 V1300 Q1302	L1264-A1268 CarbonylContact C-O 3.38Å; L1264-A1268 VanDerWaalsContact CA-O 3.23Å; L1264-A1268 WeakPolarHBondContact CA-O 3.45Å; L1264-C1269 HydrophobicContact CD2-CB 3.57Å; L1264-K1299 CarbonylContact O-C 3.59Å; L1264-K1299 VanDerWaalsContact O-CA 3.25Å; L1264-K1299 WeakPolarHBondContact O-CA 3.37Å; L1264-K1299 VanDerWaalsContact O-CB 3.24Å; L1264-K1299 WeakPolarHBondContact O-CB 3.42Å; L1264-V1300 WeakPolarHBondContact CA-O 3.4Å; L1264-V1300 HydrophobicContact CB-CB 4.28Å; L1264-V1300 VanDerWaalsContact CB-O 3.29Å; L1264-V1300 WeakPolarHBondContact CB-O 3.37Å; L1264-V1300 HydrophobicContact CD1-CG1 4.35Å; L1264-V1300 WeakPolarHBondContact CG-O 3.44Å; L1264-V1300 PolarHBondContact N-O 2.87Å; L1264-V1300 PolarHBondContact O-N 2.87Å; L1264-Q1302 HydrophobicContact CD1-CB 3.89Å; L1264-Q1302 HydrophobicContact CG-CB 4.27Å
1265	E	93.3	Very high	95.8	Very high	71 Å²	71	45.4 Å²	45.4	33%	0.332	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.4	175.3	-171.2	161.8	-126.6	0	0	107.1	G1267 A1268 I1270 K1299	E1265-G1267 PolarHBondContact O-N 3.14Å; E1265-A1268 PolarHBondContact N-O 3.4Å; E1265-A1268 PolarHBondContact O-N 2.77Å; E1265-I1270 HydrophobicContact CB-CD1 4.14Å; E1265-I1270 HydrophobicContact CB-CG2 3.94Å; E1265-K1299 HydrophobicContact CB-CG 3.99Å; E1265-K1299 HydrophobicContact CG-CG 4.12Å; E1265-K1299 WeakPolarHBondContact OE1-CE 3.46Å; E1265-K1299 IonicContact OE1-NZ 2.67Å; E1265-K1299 PolarHBondContact OE1-NZ 3.36Å
1266	N	88.5	Confident	95.9	Very high	164 Å²	164	55 Å²	55	88%	0.877	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	32.8	-171.9	-59.8	-15.1	0	0	0	113.7	A1268	N1266-A1268 VanDerWaalsContact C-N 3.26Å; N1266-A1268 PolarHBondContact O-N 2.9Å
1267	G	85.1	Confident	95.8	Very high	66 Å²	66	59 Å²	59	68%	0.68	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-13.5	-175.5	0	0	0	0	0	115.8	E1265	E1265-G1267 PolarHBondContact O-N 3.14Å
1268	A	90.3	Very high	95.8	Very high	61 Å²	61	59.9 Å²	59.9	50%	0.504	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	140.9	176.5	0	0	0	0	0	111.7	L1264 E1265 N1266 I1270	L1264-A1268 CarbonylContact C-O 3.38Å; L1264-A1268 VanDerWaalsContact CA-O 3.23Å; L1264-A1268 WeakPolarHBondContact CA-O 3.45Å; E1265-A1268 PolarHBondContact N-O 3.4Å; E1265-A1268 PolarHBondContact O-N 2.77Å; N1266-A1268 VanDerWaalsContact C-N 3.26Å; N1266-A1268 PolarHBondContact O-N 2.9Å; A1268-I1270 PolarHBondContact O-N 3.06Å
1269	C	95.3	Very high	95.7	Very high	49 Å²	49	67.6 Å²	67.6	33%	0.331	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	99.7	-179.7	178.4	0	0	0	0	112.4	L1264 A1271	L1264-C1269 HydrophobicContact CD2-CB 3.57Å; C1269-A1271 PolarHBondContact SG-O 2.76Å; C1269-A1271 VanDerWaalsContact SG-O 3.34Å
1270	I	95.9	Very high	95.6	Very high	66 Å²	66	73.6 Å²	73.6	34%	0.338	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	-55	175.1	64	177.8	0	0	0	110.8	L1263 E1265 A1268 E1294 K1299	L1263-I1270 HydrophobicContact CB-CG1 4.31Å; L1263-I1270 HydrophobicContact CD2-CD1 4.04Å; L1263-I1270 HydrophobicContact CD2-CG1 4.32Å; L1263-I1270 HydrophobicContact CG-CD1 4.17Å; L1263-I1270 HydrophobicContact CG-CG1 4.17Å; L1263-I1270 PolarHBondContact O-N 2.82Å; E1265-I1270 HydrophobicContact CB-CD1 4.14Å; E1265-I1270 HydrophobicContact CB-CG2 3.94Å; A1268-I1270 PolarHBondContact O-N 3.06Å; I1270-E1294 HydrophobicContact CD1-CB 4.36Å; I1270-E1294 HydrophobicContact CD1-CG 4.11Å; I1270-K1299 HydrophobicContact CD1-CD 3.97Å
1271	A	96.9	Very high	95.5	Very high	7 Å²	7	72 Å²	72	6%	0.058	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.1	-170.7	0	0	0	0	0	112.7	Y1262 L1263 C1269 F1292 E1294	Y1262-A1271 WeakPolarHBondContact CA-O 3.05Å; L1263-A1271 HydrophobicContact CB-CB 4.16Å; L1263-A1271 PolarHBondContact N-O 3.04Å; C1269-A1271 PolarHBondContact SG-O 2.76Å; C1269-A1271 VanDerWaalsContact SG-O 3.34Å; A1271-F1292 HydrophobicContact CB-CD1 3.67Å; A1271-F1292 HydrophobicContact CB-CE1 3.87Å; A1271-E1294 VanDerWaalsContact CB-OE1 3.3Å; A1271-E1294 WeakPolarHBondContact CB-OE1 3.32Å
1272	K	97.5	Very high	95.5	Very high	118 Å²	118	74 Å²	74	51%	0.513	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	127.6	175.5	53.9	-101.6	167.5	-160.1	0	113.1	V1261 Y1262	V1261-K1272 CarbonylContact O-C 3.45Å; V1261-K1272 VanDerWaalsContact O-CA 3.25Å; V1261-K1272 WeakPolarHBondContact O-CA 3.37Å; Y1262-K1272 HydrophobicContact CD1-CB 3.82Å; Y1262-K1272 HydrophobicContact CD1-CD 4.47Å; Y1262-K1272 HydrophobicContact CE1-CB 4.36Å; Y1262-K1272 HydrophobicContact CG-CB 4.25Å
1273	K	98	Very high	95.5	Very high	59 Å²	59	76.4 Å²	76.4	26%	0.257	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160.1	179.4	-56.6	-172.3	-173.6	-167.1	0	109.2	V1261 L1290 V1291 F1292 D1293	V1261-K1273 PolarHBondContact N-O 2.62Å; V1261-K1273 PolarHBondContact O-N 3.12Å; V1261-K1273 VanDerWaalsContact O-O 3.07Å; K1273-L1290 HydrophobicContact CB-CB 4.17Å; K1273-L1290 HydrophobicContact CB-CD1 4.35Å; K1273-L1290 HydrophobicContact CB-CD2 4.35Å; K1273-V1291 WeakPolarHBondContact CD-O 3.35Å; K1273-V1291 VanDerWaalsContact CE-O 3.31Å; K1273-V1291 WeakPolarHBondContact CE-O 3.03Å; K1273-V1291 PolarHBondContact NZ-O 2.79Å; K1273-F1292 HydrophobicContact CB-CE1 4.23Å; K1273-F1292 HydrophobicContact CB-CE2 4.25Å; K1273-F1292 HydrophobicContact CB-CZ 3.81Å; K1273-F1292 HydrophobicContact CD-CD1 4.15Å; K1273-F1292 HydrophobicContact CD-CD2 4.47Å; K1273-F1292 HydrophobicContact CD-CE1 4.2Å; K1273-F1292 HydrophobicContact CD-CE2 4.49Å; K1273-F1292 HydrophobicContact CD-CG 4.3Å; K1273-F1292 HydrophobicContact CD-CZ 4.37Å; K1273-F1292 HydrophobicContact CG-CD1 4.26Å; K1273-F1292 HydrophobicContact CG-CE1 3.81Å; K1273-F1292 HydrophobicContact CG-CE2 4.43Å; K1273-F1292 HydrophobicContact CG-CZ 3.91Å; K1273-D1293 IonicContact NZ-OD2 3.12Å; K1273-D1293 PolarHBondContact NZ-OD2 2.91Å
1274	K	97.4	Very high	95.5	Very high	140 Å²	140	76.4 Å²	76.4	61%	0.609	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	150.7	-171.9	65.2	167.6	-174.3	170.1	0	112.6	V1259 K1260	V1259-K1274 CarbonylContact O-C 3.53Å; V1259-K1274 VanDerWaalsContact O-CA 3.3Å; V1259-K1274 WeakPolarHBondContact O-CA 2.94Å; V1259-K1274 WeakPolarHBondContact O-CB 3.34Å; K1260-K1274 HydrophobicContact CB-CB 4.19Å; K1260-K1274 HydrophobicContact CG-CB 4.16Å
1275	T	98.3	Very high	95.6	Very high	5 Å²	5	80.7 Å²	80.7	3%	0.031	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-76.6	164.7	172.5	61.6	0	0	0	0	112.3	V1239 V1259 Y1286 Q1288 L1290	V1239-T1275 HydrophobicContact CB-CG2 3.59Å; V1239-T1275 HydrophobicContact CG1-CG2 3.73Å; V1239-T1275 HydrophobicContact CG2-CG2 3.82Å; V1259-T1275 HydrophobicContact CB-CG2 4.19Å; V1259-T1275 PolarHBondContact N-OG1 3.37Å; V1259-T1275 PolarHBondContact O-N 3.03Å; V1259-T1275 PolarHBondContact O-OG1 2.76Å; T1275-Y1286 HydrophobicContact CG2-CD1 4.18Å; T1275-Y1286 HydrophobicContact CG2-CG 4.26Å; T1275-Y1286 WeakPolarHBondContact OG1-CD1 3.49Å; T1275-Y1286 WeakPolarHBondContact OG1-CE1 3.38Å; T1275-Q1288 HydrophobicContact CG2-CB 4.14Å; T1275-L1290 HydrophobicContact CG2-CD1 4.43Å
1276	R	96.9	Very high	95.8	Very high	201 Å²	201	78 Å²	78	76%	0.758	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-63.6	146.3	161	-60.7	172.3	-172.3	-162.1	3	109.3	A1278	R1276-A1278 PolarHBondContact O-N 2.93Å
1277	I	96.4	Very high	96.2	Very high	95 Å²	95	76.2 Å²	76.2	49%	0.487	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-66.6	128.6	176.6	-52.6	176.1	0	0	0	109.2	A1256 Y1258	A1256-I1277 HydrophobicContact CB-CG2 3.73Å; Y1258-I1277 HydrophobicContact CD1-CD1 4.49Å; Y1258-I1277 HydrophobicContact CD1-CG1 4.04Å; Y1258-I1277 HydrophobicContact CG-CG1 4.28Å
1278	A	97	Very high	96.8	Very high	19 Å²	19	75 Å²	75	16%	0.157	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-75.3	172.5	178.2	0	0	0	0	0	112.1	P1257 R1276 P1284 Y1286	P1257-A1278 HydrophobicContact CG-CB 4.3Å; P1257-A1278 WeakPolarHBondContact O-CB 3.31Å; P1257-A1278 PolarHBondContact O-N 3.36Å; R1276-A1278 PolarHBondContact O-N 2.93Å; A1278-P1284 HydrophobicContact CB-CB 3.7Å; A1278-Y1286 HydrophobicContact CB-CD1 4.41Å; A1278-Y1286 HydrophobicContact CB-CE1 3.84Å
1279	R	96	Very high	97.1	Very high	195 Å²	195	75.1 Å²	75.1	74%	0.736	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-58.4	164.3	165.3	66	179.8	179.7	171.2	-0.1	110.8	T1281	R1279-T1281 HydrophobicContact CG-CG2 4.05Å; R1279-T1281 PolarHBondContact O-N 3.26Å
1280	K	96.2	Very high	97.2	Very high	126 Å²	126	73.7 Å²	73.7	55%	0.548	34%	0.344	S	S	.	.	S	Bend	trans	-66.5	108.7	173.6	-71.1	-173.5	171.7	-163	0	110.9	T1254 P1255 A1256	T1254-K1280 WeakPolarHBondContact O-CD 3.46Å; P1255-K1280 CarbonylContact O-C 3.58Å; P1255-K1280 WeakPolarHBondContact O-CA 3.29Å; A1256-K1280 HydrophobicContact CB-CG 3.93Å
1281	T	96.9	Very high	97.3	Very high	20 Å²	20	73.1 Å²	73.1	12%	0.123	34%	0.344	C	S	.	.			trans	-165.7	159.7	-176.5	-172.5	0	0	0	0	110.7	P1255 P1257 R1279 D1283 P1284	P1255-T1281 PolarHBondContact O-N 2.77Å; P1255-T1281 VanDerWaalsContact O-N 3.1Å; P1257-T1281 WeakPolarHBondContact CD-O 3.45Å; R1279-T1281 HydrophobicContact CG-CG2 4.05Å; R1279-T1281 PolarHBondContact O-N 3.26Å; T1281-D1283 PolarHBondContact OG1-N 3.22Å; T1281-D1283 VanDerWaalsContact OG1-N 3.1Å; T1281-P1284 HydrophobicContact CG2-CB 3.88Å
1282	L	97.5	Very high	97.3	Very high	43 Å²	43	72.8 Å²	72.8	23%	0.225	34%	0.341	C	S	.	.	S	Bend	trans	-95	-5.4	168	-54.1	-179.3	0	0	0	112	L1245 Q1247 T1254 P1255 P1284 M1318	L1245-L1282 HydrophobicContact CB-CB 4.27Å; L1245-L1282 VanDerWaalsContact CB-O 3.24Å; L1245-L1282 WeakPolarHBondContact CB-O 3.46Å; L1245-L1282 WeakPolarHBondContact CD1-O 3.26Å; L1245-L1282 WeakPolarHBondContact CG-O 3.39Å; L1245-L1282 PolarHBondContact N-O 2.8Å; L1245-L1282 VanDerWaalsContact N-O 3.16Å; L1245-L1282 WeakPolarHBondContact O-CD2 3.24Å; Q1247-L1282 HydrophobicContact CB-CD1 4.06Å; Q1247-L1282 HydrophobicContact CB-CD2 3.98Å; T1254-L1282 HydrophobicContact CG2-CD2 3.81Å; T1254-L1282 HydrophobicContact CG2-CG 3.95Å; P1255-L1282 HydrophobicContact CG-CD2 4.05Å; L1282-P1284 VanDerWaalsContact C-CD 3.42Å; L1282-P1284 WeakPolarHBondContact O-CD 3.08Å; L1282-M1318 HydrophobicContact CD2-CE 4.29Å
1283	D	98.1	Very high	97.3	Very high	84 Å²	84	72.1 Å²	72.1	45%	0.449	34%	0.343	S	S	.	.	S	Bend	trans	-127.7	68.9	-177.2	-51.9	-83.3	0	0	0	109.6	A1242 R1243 S1244 T1281	A1242-D1283 CarbonylContact O-C 3.58Å; A1242-D1283 WeakPolarHBondContact O-CA 3.27Å; R1243-D1283 VanDerWaalsContact CA-OD1 3.28Å; R1243-D1283 WeakPolarHBondContact CA-OD1 3.49Å; S1244-D1283 PolarHBondContact N-OD1 3.39Å; T1281-D1283 PolarHBondContact OG1-N 3.22Å; T1281-D1283 VanDerWaalsContact OG1-N 3.1Å
1284	P	98	Very high	97.1	Very high	1 Å²	1	72.1 Å²	72.1	1%	0.006	34%	0.344	C	S	.	.			trans	-78.9	129.9	-174.2	31.9	-37.1	0	0	0	112.6	R1241 A1242 L1245 P1257 A1278 T1281 L1282 Y1286	R1241-P1284 CarbonylContact C-O 3.56Å; R1241-P1284 WeakPolarHBondContact CA-O 3.06Å; R1241-P1284 VanDerWaalsContact CB-O 3.31Å; R1241-P1284 WeakPolarHBondContact CB-O 3.44Å; A1242-P1284 HydrophobicContact CB-CG 3.9Å; A1242-P1284 PolarHBondContact N-O 3.12Å; A1242-P1284 WeakPolarHBondContact O-CD 3.29Å; L1245-P1284 HydrophobicContact CD1-CG 3.82Å; P1257-P1284 HydrophobicContact CB-CG 4.36Å; P1257-P1284 HydrophobicContact CG-CB 3.62Å; P1257-P1284 HydrophobicContact CG-CG 3.59Å; A1278-P1284 HydrophobicContact CB-CB 3.7Å; T1281-P1284 HydrophobicContact CG2-CB 3.88Å; L1282-P1284 VanDerWaalsContact C-CD 3.42Å; L1282-P1284 WeakPolarHBondContact O-CD 3.08Å; P1284-Y1286 HydrophobicContact CB-CD2 4.44Å; P1284-Y1286 HydrophobicContact CB-CE1 4.23Å; P1284-Y1286 HydrophobicContact CB-CE2 3.73Å; P1284-Y1286 HydrophobicContact CG-CE2 3.53Å; P1284-Y1286 WeakPolarHBondContact CG-OH 3.41Å
1285	L	98.1	Very high	96.9	Very high	105 Å²	105	67.3 Å²	67.3	55%	0.55	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131.5	164	-173	64.2	0	0	0	108.7	R1241 Q1287	R1241-L1285 HydrophobicContact CB-CD1 4.09Å; L1285-Q1287 HydrophobicContact CD1-CG 3.75Å; L1285-Q1287 HydrophobicContact CG-CG 4.12Å
1286	Y	98	Very high	96.7	Very high	13 Å²	13	67.4 Å²	67.4	5%	0.051	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-51.4	-179.2	-64.2	-73.8	0	0	0	112.4	V1239 I1240 P1257 Y1258 V1259 T1275 A1278 P1284 Q1288	V1239-Y1286 HydrophobicContact CG1-CD2 3.74Å; V1239-Y1286 HydrophobicContact CG1-CE2 4.43Å; V1239-Y1286 HydrophobicContact CG1-CG 4.07Å; V1239-Y1286 VanDerWaalsContact O-CB 3.3Å; V1239-Y1286 WeakPolarHBondContact O-CB 3.42Å; I1240-Y1286 PolarHBondContact O-N 3.41Å; P1257-Y1286 WeakPolarHBondContact CB-OH 3.5Å; P1257-Y1286 PolarHBondContact O-OH 3.16Å; Y1258-Y1286 WeakPolarHBondContact CA-OH 3.4Å; Y1258-Y1286 PolarHBondContact N-OH 3.24Å; V1259-Y1286 HydrophobicContact CG2-CD2 4.05Å; V1259-Y1286 HydrophobicContact CG2-CE1 4.38Å; V1259-Y1286 HydrophobicContact CG2-CE2 3.42Å; V1259-Y1286 VanDerWaalsContact CG2-CE2 3.42Å; T1275-Y1286 HydrophobicContact CG2-CD1 4.18Å; T1275-Y1286 HydrophobicContact CG2-CG 4.26Å; T1275-Y1286 WeakPolarHBondContact OG1-CD1 3.49Å; T1275-Y1286 WeakPolarHBondContact OG1-CE1 3.38Å; A1278-Y1286 HydrophobicContact CB-CD1 4.41Å; A1278-Y1286 HydrophobicContact CB-CE1 3.84Å; P1284-Y1286 HydrophobicContact CB-CD2 4.44Å; P1284-Y1286 HydrophobicContact CB-CE1 4.23Å; P1284-Y1286 HydrophobicContact CB-CE2 3.73Å; P1284-Y1286 HydrophobicContact CG-CE2 3.53Å; P1284-Y1286 WeakPolarHBondContact CG-OH 3.41Å; Y1286-Q1288 WeakPolarHBondContact O-CG 3.49Å; Y1286-Q1288 PolarHBondContact O-N 3.42Å; Y1286-Q1288 PolarHBondContact O-NE2 2.92Å
1287	Q	97	Very high	96.5	Very high	127 Å²	127	64.5 Å²	64.5	59%	0.593	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	43.9	61.4	-176.2	-62.2	-177.9	-82.5	0	0	112.3	V1239 I1240 L1285	V1239-Q1287 WeakPolarHBondContact O-CA 3.39Å; V1239-Q1287 PolarHBondContact O-N 2.83Å; I1240-Q1287 PolarHBondContact O-N 3.22Å; L1285-Q1287 HydrophobicContact CD1-CG 3.75Å; L1285-Q1287 HydrophobicContact CG-CG 4.12Å
1288	Q	97.2	Very high	96.2	Very high	41 Å²	41	61.7 Å²	61.7	19%	0.192	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	108	-171.5	-86.6	161.2	76.7	0	0	111.7	V1239 T1275 Y1286	V1239-Q1288 PolarHBondContact N-O 3.16Å; V1239-Q1288 PolarHBondContact O-N 2.66Å; T1275-Q1288 HydrophobicContact CG2-CB 4.14Å; Y1286-Q1288 WeakPolarHBondContact O-CG 3.49Å; Y1286-Q1288 PolarHBondContact O-N 3.42Å; Y1286-Q1288 PolarHBondContact O-NE2 2.92Å
1289	S	97.3	Very high	96.2	Very high	63 Å²	63	61.3 Å²	61.3	44%	0.441	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	132.6	164.3	-55.5	0	0	0	0	112.2	E1236 V1237	E1236-S1289 WeakPolarHBondContact OE1-CB 3.46Å; E1236-S1289 PolarHBondContact OE1-OG 2.87Å; V1237-S1289 CarbonylContact O-C 3.53Å
1290	L	97.7	Very high	96.2	Very high	19 Å²	19	53.4 Å²	53.4	10%	0.099	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	89.6	170.4	-57.9	178.2	0	0	0	107.2	V1237 V1239 V1261 K1273 T1275 F1292	V1237-L1290 HydrophobicContact CB-CB 4.48Å; V1237-L1290 PolarHBondContact N-O 3.28Å; V1237-L1290 PolarHBondContact O-N 2.84Å; V1239-L1290 HydrophobicContact CG2-CD1 3.78Å; V1239-L1290 HydrophobicContact CG2-CG 4.38Å; V1261-L1290 HydrophobicContact CB-CD1 4.24Å; V1261-L1290 HydrophobicContact CG2-CD1 3.8Å; K1273-L1290 HydrophobicContact CB-CB 4.17Å; K1273-L1290 HydrophobicContact CB-CD1 4.35Å; K1273-L1290 HydrophobicContact CB-CD2 4.35Å; T1275-L1290 HydrophobicContact CG2-CD1 4.43Å; L1290-F1292 HydrophobicContact CB-CE2 4.22Å; L1290-F1292 VanDerWaalsContact O-CD2 3.29Å; L1290-F1292 WeakPolarHBondContact O-CD2 3.4Å; L1290-F1292 PolarHBondContact O-N 2.98Å
1291	V	97.4	Very high	96.2	Very high	55 Å²	55	47.4 Å²	47.4	33%	0.333	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.8	174.2	-177.1	0	0	0	0	109	Q1234 E1236 K1273	Q1234-V1291 HydrophobicContact CB-CG1 4.17Å; E1236-V1291 HydrophobicContact CB-CG2 4.22Å; E1236-V1291 HydrophobicContact CG-CG2 3.91Å; K1273-V1291 WeakPolarHBondContact CD-O 3.35Å; K1273-V1291 VanDerWaalsContact CE-O 3.31Å; K1273-V1291 WeakPolarHBondContact CE-O 3.03Å; K1273-V1291 PolarHBondContact NZ-O 2.79Å
1292	F	97.2	Very high	96.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.26	C	S	.	.			trans	-93.1	147.4	168.5	-74	-95.9	0	0	0	109.2	Q1234 L1235 V1237 V1261 L1263 A1271 K1273 L1290 E1294	Q1234-F1292 WeakPolarHBondContact CA-O 3.4Å; Q1234-F1292 VanDerWaalsContact CB-O 3.31Å; Q1234-F1292 WeakPolarHBondContact CB-O 3.38Å; L1235-F1292 HydrophobicContact CB-CB 4.19Å; L1235-F1292 WeakPolarHBondContact O-CB 3.37Å; L1235-F1292 PolarHBondContact O-N 3.41Å; V1237-F1292 HydrophobicContact CB-CE2 4.35Å; V1237-F1292 HydrophobicContact CG2-CD2 3.9Å; V1237-F1292 HydrophobicContact CG2-CE2 3.85Å; V1261-F1292 HydrophobicContact CB-CE2 4.36Å; V1261-F1292 HydrophobicContact CB-CZ 4.08Å; V1261-F1292 HydrophobicContact CG1-CE2 3.91Å; V1261-F1292 HydrophobicContact CG1-CZ 3.78Å; L1263-F1292 HydrophobicContact CB-CD1 4.1Å; L1263-F1292 HydrophobicContact CB-CE1 4.03Å; L1263-F1292 HydrophobicContact CD2-CB 4.41Å; L1263-F1292 HydrophobicContact CD2-CD1 4.15Å; L1263-F1292 HydrophobicContact CD2-CG 4.45Å; A1271-F1292 HydrophobicContact CB-CD1 3.67Å; A1271-F1292 HydrophobicContact CB-CE1 3.87Å; K1273-F1292 HydrophobicContact CB-CE1 4.23Å; K1273-F1292 HydrophobicContact CB-CE2 4.25Å; K1273-F1292 HydrophobicContact CB-CZ 3.81Å; K1273-F1292 HydrophobicContact CD-CD1 4.15Å; K1273-F1292 HydrophobicContact CD-CD2 4.47Å; K1273-F1292 HydrophobicContact CD-CE1 4.2Å; K1273-F1292 HydrophobicContact CD-CE2 4.49Å; K1273-F1292 HydrophobicContact CD-CG 4.3Å; K1273-F1292 HydrophobicContact CD-CZ 4.37Å; K1273-F1292 HydrophobicContact CG-CD1 4.26Å; K1273-F1292 HydrophobicContact CG-CE1 3.81Å; K1273-F1292 HydrophobicContact CG-CE2 4.43Å; K1273-F1292 HydrophobicContact CG-CZ 3.91Å; L1290-F1292 HydrophobicContact CB-CE2 4.22Å; L1290-F1292 VanDerWaalsContact O-CD2 3.29Å; L1290-F1292 WeakPolarHBondContact O-CD2 3.4Å; L1290-F1292 PolarHBondContact O-N 2.98Å; F1292-E1294 WeakPolarHBondContact CB-OE2 2.98Å
1293	D	95.9	Very high	96.3	Very high	104 Å²	104	45.7 Å²	45.7	56%	0.556	25%	0.249	S	C	*	.	S	Bend	trans	-89.6	-3	-174.7	-56.1	-82.1	0	0	0	111.1	K1273	K1273-D1293 IonicContact NZ-OD2 3.12Å; K1273-D1293 PolarHBondContact NZ-OD2 2.91Å
1294	E	94.8	Very high	96.3	Very high	59 Å²	59	42.2 Å²	42.2	28%	0.276	23%	0.231	S	C	.	.	S	Bend	trans	-104.4	148.4	-177.7	-50.9	83.5	177.3	0	0	111.6	G1233 L1235 L1263 I1270 A1271 F1292	G1233-E1294 CarbonylContact O-C 3.53Å; L1235-E1294 PolarHBondContact N-O 2.84Å; L1235-E1294 VanDerWaalsContact N-O 3.16Å; L1263-E1294 HydrophobicContact CD2-CB 3.8Å; L1263-E1294 HydrophobicContact CD2-CG 4.39Å; I1270-E1294 HydrophobicContact CD1-CB 4.36Å; I1270-E1294 HydrophobicContact CD1-CG 4.11Å; A1271-E1294 VanDerWaalsContact CB-OE1 3.3Å; A1271-E1294 WeakPolarHBondContact CB-OE1 3.32Å; F1292-E1294 WeakPolarHBondContact CB-OE2 2.98Å
1295	S	93.6	Very high	96.3	Very high	39 Å²	39	42.2 Å²	42.2	27%	0.273	23%	0.23	S	C	.	.			trans	-73.1	152.9	175.4	67.7	0	0	0	0	111.9	G1233 Q1297 K1299	G1233-S1295 WeakPolarHBondContact O-CA 3.32Å; G1233-S1295 PolarHBondContact O-N 3.01Å; S1295-Q1297 PolarHBondContact O-N 2.86Å; S1295-K1299 WeakPolarHBondContact O-CD 3.29Å; S1295-K1299 WeakPolarHBondContact O-CE 3.25Å; S1295-K1299 PolarHBondContact O-NZ 2.78Å
1296	P	94.4	Very high	96.3	Very high	7 Å²	7	38.6 Å²	38.6	5%	0.045	21%	0.209	C	C	.	.			trans	-76.6	-15.6	-178.4	29.5	-34.9	0	0	0	115.2	D1230 L1235 K1299 L1325 L1330	D1230-P1296 HydrophobicContact CB-CG 4.06Å; D1230-P1296 WeakPolarHBondContact OD2-CD 3.29Å; D1230-P1296 WeakPolarHBondContact OD2-CG 3.26Å; L1235-P1296 HydrophobicContact CB-CB 4.44Å; L1235-P1296 HydrophobicContact CD1-CB 4.31Å; P1296-K1299 PolarHBondContact O-N 2.8Å; P1296-L1325 HydrophobicContact CB-CB 4.01Å; P1296-L1325 HydrophobicContact CB-CD1 4.08Å; P1296-L1325 WeakPolarHBondContact O-CB 3.31Å; P1296-L1330 HydrophobicContact CB-CD1 3.46Å; P1296-L1330 VanDerWaalsContact CB-CD1 3.46Å; P1296-L1330 HydrophobicContact CG-CD1 3.72Å
1297	Q	91.6	Very high	96.2	Very high	140 Å²	140	38 Å²	38	65%	0.654	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	136.7	-174.4	-67.3	172	-22	0	0	112.1	S1295 K1299	S1295-Q1297 PolarHBondContact O-N 2.86Å; Q1297-K1299 WeakPolarHBondContact O-CG 3.26Å; Q1297-K1299 PolarHBondContact O-N 2.89Å; Q1297-K1299 PolarHBondContact O-NZ 2.76Å
1298	G	91.3	Very high	96.1	Very high	35 Å²	35	33.9 Å²	33.9	36%	0.361	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	14.5	178.7	0	0	0	0	0	116.1
1299	K	95.6	Very high	95.9	Very high	11 Å²	11	33.1 Å²	33.1	5%	0.048	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	154.9	-169	-68.6	168.2	-165.8	57.9	0	114.2	L1263 L1264 E1265 I1270 S1295 P1296 Q1297 L1325	L1263-K1299 HydrophobicContact CD1-CB 3.8Å; L1263-K1299 HydrophobicContact CD1-CD 3.97Å; L1263-K1299 HydrophobicContact CD1-CG 4.42Å; L1263-K1299 HydrophobicContact CD2-CD 3.95Å; L1263-K1299 HydrophobicContact CG-CB 4.48Å; L1263-K1299 HydrophobicContact CG-CD 3.93Å; L1264-K1299 CarbonylContact O-C 3.59Å; L1264-K1299 VanDerWaalsContact O-CA 3.25Å; L1264-K1299 WeakPolarHBondContact O-CA 3.37Å; L1264-K1299 VanDerWaalsContact O-CB 3.24Å; L1264-K1299 WeakPolarHBondContact O-CB 3.42Å; E1265-K1299 HydrophobicContact CB-CG 3.99Å; E1265-K1299 HydrophobicContact CG-CG 4.12Å; E1265-K1299 WeakPolarHBondContact OE1-CE 3.46Å; E1265-K1299 IonicContact OE1-NZ 2.67Å; E1265-K1299 PolarHBondContact OE1-NZ 3.36Å; I1270-K1299 HydrophobicContact CD1-CD 3.97Å; S1295-K1299 WeakPolarHBondContact O-CD 3.29Å; S1295-K1299 WeakPolarHBondContact O-CE 3.25Å; S1295-K1299 PolarHBondContact O-NZ 2.78Å; P1296-K1299 PolarHBondContact O-N 2.8Å; Q1297-K1299 WeakPolarHBondContact O-CG 3.26Å; Q1297-K1299 PolarHBondContact O-N 2.89Å; Q1297-K1299 PolarHBondContact O-NZ 2.76Å; K1299-L1325 HydrophobicContact CB-CD1 4.08Å; K1299-L1325 WeakPolarHBondContact O-CB 3.31Å; K1299-L1325 PolarHBondContact O-N 2.91Å
1300	V	96.5	Very high	95.5	Very high	29 Å²	29	31.3 Å²	31.3	18%	0.176	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.7	176	173.6	0	0	0	0	109.7	L1210 L1264 Q1322 I1323 L1324	L1210-V1300 HydrophobicContact CD1-CG1 4.02Å; L1210-V1300 HydrophobicContact CD1-CG2 3.96Å; L1264-V1300 WeakPolarHBondContact CA-O 3.4Å; L1264-V1300 HydrophobicContact CB-CB 4.28Å; L1264-V1300 VanDerWaalsContact CB-O 3.29Å; L1264-V1300 WeakPolarHBondContact CB-O 3.37Å; L1264-V1300 HydrophobicContact CD1-CG1 4.35Å; L1264-V1300 WeakPolarHBondContact CG-O 3.44Å; L1264-V1300 PolarHBondContact N-O 2.87Å; L1264-V1300 PolarHBondContact O-N 2.87Å; V1300-Q1322 HydrophobicContact CG1-CB 4.1Å; V1300-Q1322 HydrophobicContact CG1-CG 4.26Å; V1300-I1323 CarbonylContact C-O 3.55Å; V1300-I1323 VanDerWaalsContact CA-O 3.29Å; V1300-I1323 WeakPolarHBondContact CA-O 3.43Å; V1300-L1324 HydrophobicContact CG2-CD1 3.81Å
1301	L	97.2	Very high	94.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	116.4	174.1	-158.3	70.2	0	0	0	110.1	M1228 L1235 V1237 V1261 L1263 V1303 Q1322 I1323 L1325	M1228-L1301 HydrophobicContact CG-CD2 4.08Å; M1228-L1301 HydrophobicContact SD-CD2 3.66Å; L1235-L1301 HydrophobicContact CD2-CD1 4.04Å; V1237-L1301 HydrophobicContact CG1-CD2 3.91Å; V1237-L1301 HydrophobicContact CG2-CD1 4.2Å; V1237-L1301 HydrophobicContact CG2-CD2 3.76Å; V1261-L1301 HydrophobicContact CG1-CD1 3.42Å; V1261-L1301 VanDerWaalsContact CG1-CD1 3.42Å; V1261-L1301 HydrophobicContact CG1-CD2 4.01Å; V1261-L1301 HydrophobicContact CG1-CG 3.69Å; L1263-L1301 HydrophobicContact CD1-CD1 3.98Å; L1301-V1303 HydrophobicContact CD2-CG2 4.25Å; L1301-V1303 HydrophobicContact CG-CG2 4.29Å; L1301-Q1322 CarbonylContact O-C 3.6Å; L1301-Q1322 WeakPolarHBondContact O-CA 3.4Å; L1301-I1323 HydrophobicContact CB-CB 4.26Å; L1301-I1323 HydrophobicContact CD2-CD1 4.48Å; L1301-I1323 PolarHBondContact N-O 2.85Å; L1301-I1323 PolarHBondContact O-N 2.98Å; L1301-L1325 HydrophobicContact CB-CD1 4.16Å; L1301-L1325 HydrophobicContact CB-CD2 4.01Å; L1301-L1325 HydrophobicContact CB-CG 4.11Å; L1301-L1325 HydrophobicContact CD2-CD2 4.44Å
1302	Q	97.2	Very high	94.2	Very high	27 Å²	27	47.8 Å²	47.8	13%	0.126	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	116	174.6	-175.3	-177.2	80.1	0	0	110.3	Y1262 L1264 I1304 V1320 A1321 Q1322	Y1262-Q1302 PolarHBondContact N-O 3.04Å; Y1262-Q1302 PolarHBondContact O-N 2.9Å; L1264-Q1302 HydrophobicContact CD1-CB 3.89Å; L1264-Q1302 HydrophobicContact CG-CB 4.27Å; Q1302-I1304 HydrophobicContact CG-CD1 4.43Å; Q1302-I1304 HydrophobicContact CG-CG1 4.19Å; Q1302-V1320 HydrophobicContact CG-CG2 3.56Å; Q1302-A1321 WeakPolarHBondContact CA-O 3.29Å; Q1302-Q1322 HydrophobicContact CB-CG 4.13Å; Q1302-Q1322 HydrophobicContact CG-CG 3.99Å
1303	V	98	Very high	93.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	116.2	-175.4	-177.1	0	0	0	0	109	I1224 I1226 V1259 V1261 L1301 V1320 A1321 I1323	I1224-V1303 HydrophobicContact CD1-CG1 3.79Å; I1224-V1303 HydrophobicContact CG2-CG1 4.34Å; I1226-V1303 HydrophobicContact CD1-CG1 4.05Å; I1226-V1303 HydrophobicContact CG1-CG1 4.4Å; V1259-V1303 HydrophobicContact CG1-CG1 3.68Å; V1261-V1303 HydrophobicContact CG1-CG2 4.46Å; V1261-V1303 HydrophobicContact CG2-CG1 4.46Å; V1261-V1303 HydrophobicContact CG2-CG2 4.42Å; L1301-V1303 HydrophobicContact CD2-CG2 4.25Å; L1301-V1303 HydrophobicContact CG-CG2 4.29Å; V1303-V1320 CarbonylContact O-C 3.59Å; V1303-V1320 WeakPolarHBondContact O-CA 3.44Å; V1303-A1321 PolarHBondContact N-O 2.85Å; V1303-A1321 PolarHBondContact O-N 2.93Å; V1303-I1323 HydrophobicContact CG2-CD1 4.33Å
1304	I	98	Very high	93.3	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.062	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.8	-178.6	-50.8	-176.2	0	0	0	111.3	K1260 Y1262 Q1302 W1306 F1317 G1319 V1320	K1260-I1304 PolarHBondContact N-O 3.24Å; K1260-I1304 PolarHBondContact O-N 2.7Å; Y1262-I1304 HydrophobicContact CD2-CD1 4.24Å; Y1262-I1304 HydrophobicContact CD2-CG1 4.32Å; Y1262-I1304 HydrophobicContact CE2-CB 4.34Å; Y1262-I1304 HydrophobicContact CE2-CD1 3.69Å; Y1262-I1304 HydrophobicContact CE2-CG1 4Å; Q1302-I1304 HydrophobicContact CG-CD1 4.43Å; Q1302-I1304 HydrophobicContact CG-CG1 4.19Å; I1304-W1306 HydrophobicContact CD1-CZ2 4.3Å; I1304-W1306 HydrophobicContact CG2-CD2 4.2Å; I1304-W1306 VanDerWaalsContact CG2-CE2 3.48Å; I1304-W1306 HydrophobicContact CG2-CZ2 3.7Å; I1304-W1306 VanDerWaalsContact CG2-NE1 3.31Å; I1304-F1317 HydrophobicContact CG2-CD2 3.78Å; I1304-F1317 HydrophobicContact CG2-CE2 3.59Å; I1304-G1319 WeakPolarHBondContact CA-O 3.35Å; I1304-V1320 HydrophobicContact CD1-CG2 4.37Å; I1304-V1320 HydrophobicContact CG1-CB 4.13Å; I1304-V1320 HydrophobicContact CG1-CG2 3.75Å
1305	V	98.3	Very high	93.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.6	171.7	-168.1	0	0	0	0	110.4	I1224 L1245 P1257 V1259 M1318 G1319 L1340	I1224-V1305 HydrophobicContact CD1-CG2 3.98Å; L1245-V1305 HydrophobicContact CD1-CG1 3.88Å; L1245-V1305 HydrophobicContact CD2-CB 4.46Å; L1245-V1305 HydrophobicContact CD2-CG1 4.12Å; L1245-V1305 HydrophobicContact CD2-CG2 4.33Å; P1257-V1305 HydrophobicContact CB-CG1 4.22Å; V1259-V1305 HydrophobicContact CG2-CG2 4.37Å; V1305-M1318 HydrophobicContact CB-CB 4.07Å; V1305-M1318 HydrophobicContact CG1-CB 4.02Å; V1305-M1318 PolarHBondContact O-N 3.4Å; V1305-G1319 PolarHBondContact N-O 2.83Å; V1305-L1340 HydrophobicContact CB-CD1 4.49Å; V1305-L1340 HydrophobicContact CG2-CD1 3.61Å; V1305-L1340 HydrophobicContact CG2-CD2 4.03Å
1306	W	97.5	Very high	93.2	Very high	29 Å²	29	51.8 Å²	51.8	11%	0.11	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.4	179.9	-62.5	93.6	0	0	0	110.7	P1257 Y1258 I1304 K1315 C1316 F1317	P1257-W1306 CarbonylContact C-O 3.49Å; P1257-W1306 WeakPolarHBondContact CA-O 3.45Å; Y1258-W1306 HydrophobicContact CD1-CB 4.12Å; Y1258-W1306 WeakPolarHBondContact CD1-O 3.28Å; Y1258-W1306 HydrophobicContact CD2-CB 4.21Å; Y1258-W1306 HydrophobicContact CE1-CB 3.66Å; Y1258-W1306 HydrophobicContact CE2-CB 3.75Å; Y1258-W1306 AromaticContact CE2-CD1 3.89Å; Y1258-W1306 AromaticContact CE2-CG 4Å; Y1258-W1306 HydrophobicContact CE2-CG 4Å; Y1258-W1306 HydrophobicContact CG-CB 4.38Å; Y1258-W1306 VanDerWaalsContact CZ-CB 3.46Å; Y1258-W1306 AromaticContact CZ-CG 3.98Å; Y1258-W1306 PolarHBondContact N-O 3.15Å; Y1258-W1306 PolarHBondContact O-N 2.77Å; I1304-W1306 HydrophobicContact CD1-CZ2 4.3Å; I1304-W1306 HydrophobicContact CG2-CD2 4.2Å; I1304-W1306 VanDerWaalsContact CG2-CE2 3.48Å; I1304-W1306 HydrophobicContact CG2-CZ2 3.7Å; I1304-W1306 VanDerWaalsContact CG2-NE1 3.31Å; W1306-K1315 HydrophobicContact CD2-CG 4.11Å; W1306-K1315 HydrophobicContact CE3-CD 4.11Å; W1306-K1315 HydrophobicContact CE3-CG 3.57Å; W1306-K1315 HydrophobicContact CZ3-CD 4.12Å; W1306-K1315 VanDerWaalsContact CZ3-CE 3.49Å; W1306-K1315 HydrophobicContact CZ3-CG 4.01Å; W1306-C1316 CarbonylContact C-O 3.44Å; W1306-C1316 VanDerWaalsContact CA-O 3.29Å; W1306-C1316 WeakPolarHBondContact CA-O 3.42Å; W1306-F1317 HydrophobicContact CE3-CB 4.31Å; W1306-F1317 HydrophobicContact CH2-CD2 4.08Å; W1306-F1317 HydrophobicContact CZ2-CD2 4.47Å; W1306-F1317 HydrophobicContact CZ3-CB 3.92Å; W1306-F1317 HydrophobicContact CZ3-CD2 4.22Å
1307	G	96.2	Very high	93.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.1	178.1	0	0	0	0	0	113.1	C1316 M1318	G1307-C1316 PolarHBondContact N-O 2.74Å; G1307-C1316 PolarHBondContact O-N 3.34Å; G1307-M1318 VanDerWaalsContact CA-SD 3.51Å
1308	D	95.3	Very high	93.4	Very high	41 Å²	41	47.1 Å²	47.1	22%	0.219	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	106	167.4	-175.4	-5	0	0	0	110.2	P1255 A1256 G1310 H1314	P1255-D1308 WeakPolarHBondContact CA-O 3.13Å; A1256-D1308 HydrophobicContact CB-CB 4.42Å; A1256-D1308 PolarHBondContact N-O 2.73Å; A1256-D1308 WeakPolarHBondContact O-CB 3.31Å; A1256-D1308 PolarHBondContact O-N 2.77Å; D1308-G1310 VanDerWaalsContact C-N 3.29Å; D1308-G1310 VanDerWaalsContact OD1-CA 3.24Å; D1308-G1310 WeakPolarHBondContact OD1-CA 3.04Å; D1308-G1310 PolarHBondContact OD1-N 3.27Å; D1308-H1314 WeakPolarHBondContact OD1-CA 3.44Å
1309	Y	93.8	Very high	93.7	Very high	25 Å²	25	45.4 Å²	45.4	10%	0.098	21%	0.213	C	C	.	.			trans	-86.6	2.3	173.6	-72.9	-89.9	0	0	0	112.9	Q1247 K1248 S1251 S1253 P1255 D1313 C1316	Q1247-Y1309 HydrophobicContact CG-CE1 4.41Å; K1248-Y1309 HydrophobicContact CB-CE1 4.4Å; K1248-Y1309 HydrophobicContact CB-CE2 4.06Å; K1248-Y1309 WeakPolarHBondContact CB-OH 3.25Å; K1248-Y1309 HydrophobicContact CD-CE2 4.5Å; K1248-Y1309 PolarHBondContact N-OH 2.75Å; S1251-Y1309 VanDerWaalsContact OG-CE1 3.31Å; S1251-Y1309 WeakPolarHBondContact OG-CE1 3.16Å; S1253-Y1309 WeakPolarHBondContact O-CD1 3.13Å; S1253-Y1309 WeakPolarHBondContact O-CE1 3.11Å; P1255-Y1309 HydrophobicContact CB-CD1 4.25Å; P1255-Y1309 HydrophobicContact CB-CD2 4.04Å; P1255-Y1309 HydrophobicContact CB-CE1 3.96Å; P1255-Y1309 HydrophobicContact CB-CE2 3.74Å; P1255-Y1309 HydrophobicContact CB-CG 4.27Å; P1255-Y1309 HydrophobicContact CG-CE1 4.11Å; P1255-Y1309 HydrophobicContact CG-CE2 4.17Å; Y1309-D1313 WeakPolarHBondContact CB-O 3.28Å; Y1309-D1313 PolarHBondContact N-O 3.14Å; Y1309-C1316 HydrophobicContact CD2-CB 3.7Å; Y1309-C1316 HydrophobicContact CE2-CB 3.54Å
1310	G	88	Confident	93.8	Very high	25 Å²	25	44.9 Å²	44.9	26%	0.258	21%	0.211	S	C	.	.	S	Bend	trans	101.9	-169.3	-174.2	0	0	0	0	0	112.9	D1308 M1312 D1313 H1314	D1308-G1310 VanDerWaalsContact C-N 3.29Å; D1308-G1310 VanDerWaalsContact OD1-CA 3.24Å; D1308-G1310 WeakPolarHBondContact OD1-CA 3.04Å; D1308-G1310 PolarHBondContact OD1-N 3.27Å; G1310-M1312 PolarHBondContact O-N 3.35Å; G1310-D1313 CarbonylContact O-C 3.56Å; G1310-D1313 VanDerWaalsContact O-C 3.3Å; G1310-D1313 PolarHBondContact O-N 3.45Å; G1310-H1314 PolarHBondContact O-N 2.87Å
1311	R	85.1	Confident	93.8	Very high	238 Å²	238	43.6 Å²	43.6	90%	0.898	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49	-33.4	-165.8	-61.6	-175.6	-174.9	178.7	2.5	115.9
1312	M	82.7	Confident	93.7	Very high	182 Å²	182	44.7 Å²	44.7	90%	0.897	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-23.2	-178.2	-68.2	76.5	73.9	0	0	113.9	G1310	G1310-M1312 PolarHBondContact O-N 3.35Å
1313	D	85.9	Confident	93.6	Very high	44 Å²	44	43.4 Å²	43.4	24%	0.235	20%	0.202	C	C	.	.			trans	-155.7	68.4	-174.3	-169.9	4.7	0	0	0	110.7	K1248 Y1309 G1310 K1315 C1316	K1248-D1313 IonicContact NZ-OD2 3.41Å; K1248-D1313 PolarHBondContact NZ-OD2 3.18Å; Y1309-D1313 WeakPolarHBondContact CB-O 3.28Å; Y1309-D1313 PolarHBondContact N-O 3.14Å; G1310-D1313 CarbonylContact O-C 3.56Å; G1310-D1313 VanDerWaalsContact O-C 3.3Å; G1310-D1313 PolarHBondContact O-N 3.45Å; D1313-K1315 PolarHBondContact O-N 2.79Å; D1313-C1316 PolarHBondContact OD1-N 2.77Å
1314	H	89.1	Confident	93.5	Very high	121 Å²	121	44.7 Å²	44.7	56%	0.56	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	8.2	-175.9	60.1	-92.1	0	0	0	113.6	D1308 G1310	D1308-H1314 WeakPolarHBondContact OD1-CA 3.44Å; G1310-H1314 PolarHBondContact O-N 2.87Å
1315	K	91.6	Very high	93.4	Very high	104 Å²	104	44.2 Å²	44.2	45%	0.452	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-155.8	54.3	-175.2	-159	-160.3	175	-154.9	0	111.9	W1306 D1313	W1306-K1315 HydrophobicContact CD2-CG 4.11Å; W1306-K1315 HydrophobicContact CE3-CD 4.11Å; W1306-K1315 HydrophobicContact CE3-CG 3.57Å; W1306-K1315 HydrophobicContact CZ3-CD 4.12Å; W1306-K1315 VanDerWaalsContact CZ3-CE 3.49Å; W1306-K1315 HydrophobicContact CZ3-CG 4.01Å; D1313-K1315 PolarHBondContact O-N 2.79Å
1316	C	93.3	Very high	93.1	Very high	17 Å²	17	50.8 Å²	50.8	12%	0.115	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	137	168.3	-174.1	0	0	0	0	109.8	W1306 G1307 Y1309 D1313	W1306-C1316 CarbonylContact C-O 3.44Å; W1306-C1316 VanDerWaalsContact CA-O 3.29Å; W1306-C1316 WeakPolarHBondContact CA-O 3.42Å; G1307-C1316 PolarHBondContact N-O 2.74Å; G1307-C1316 PolarHBondContact O-N 3.34Å; Y1309-C1316 HydrophobicContact CD2-CB 3.7Å; Y1309-C1316 HydrophobicContact CE2-CB 3.54Å; D1313-C1316 PolarHBondContact OD1-N 2.77Å
1317	F	96.1	Very high	92.8	Very high	48 Å²	48	52.7 Å²	52.7	21%	0.211	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	140	169.2	179.2	-90.1	0	0	0	109.9	M1221 I1304 W1306 G1319 V1320 P1343	M1221-F1317 HydrophobicContact CE-CD1 4.43Å; M1221-F1317 HydrophobicContact SD-CD1 4.45Å; M1221-F1317 HydrophobicContact SD-CE1 3.97Å; I1304-F1317 HydrophobicContact CG2-CD2 3.78Å; I1304-F1317 HydrophobicContact CG2-CE2 3.59Å; W1306-F1317 HydrophobicContact CE3-CB 4.31Å; W1306-F1317 HydrophobicContact CH2-CD2 4.08Å; W1306-F1317 HydrophobicContact CZ2-CD2 4.47Å; W1306-F1317 HydrophobicContact CZ3-CB 3.92Å; W1306-F1317 HydrophobicContact CZ3-CD2 4.22Å; F1317-G1319 VanDerWaalsContact CZ-CA 3.47Å; F1317-V1320 HydrophobicContact CE2-CB 4.18Å; F1317-V1320 HydrophobicContact CZ-CB 3.93Å; F1317-V1320 HydrophobicContact CZ-CG1 3.95Å; F1317-P1343 HydrophobicContact CD1-CG 4.1Å; F1317-P1343 HydrophobicContact CD2-CG 4.38Å; F1317-P1343 VanDerWaalsContact CE1-CD 3.49Å; F1317-P1343 HydrophobicContact CE1-CG 3.73Å; F1317-P1343 HydrophobicContact CE2-CG 4.02Å; F1317-P1343 HydrophobicContact CG-CG 4.41Å; F1317-P1343 HydrophobicContact CZ-CG 3.67Å
1318	M	95.8	Very high	92.7	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	11.8	179.7	-61.5	-168.3	78.8	0	0	113.8	L1245 T1246 P1255 P1257 L1282 V1305 G1307	L1245-M1318 HydrophobicContact CB-CE 3.79Å; L1245-M1318 HydrophobicContact CD1-CE 4.48Å; T1246-M1318 WeakPolarHBondContact O-CE 3.12Å; P1255-M1318 HydrophobicContact CB-SD 4.2Å; P1255-M1318 HydrophobicContact CG-CE 3.61Å; P1255-M1318 HydrophobicContact CG-SD 3.72Å; P1257-M1318 HydrophobicContact CB-SD 4.38Å; L1282-M1318 HydrophobicContact CD2-CE 4.29Å; V1305-M1318 HydrophobicContact CB-CB 4.07Å; V1305-M1318 HydrophobicContact CG1-CB 4.02Å; V1305-M1318 PolarHBondContact O-N 3.4Å; G1307-M1318 VanDerWaalsContact CA-SD 3.51Å
1319	G	96.5	Very high	92.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	127.6	154.4	174.9	0	0	0	0	0	114	I1304 V1305 F1317 F1341	I1304-G1319 WeakPolarHBondContact CA-O 3.35Å; V1305-G1319 PolarHBondContact N-O 2.83Å; F1317-G1319 VanDerWaalsContact CZ-CA 3.47Å; G1319-F1341 CarbonylContact C-O 3.54Å; G1319-F1341 WeakPolarHBondContact CA-O 3.12Å
1320	V	97.1	Very high	92.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.6	175.6	62.4	0	0	0	0	111.6	Q1302 V1303 I1304 F1317 F1341 L1346	Q1302-V1320 HydrophobicContact CG-CG2 3.56Å; V1303-V1320 CarbonylContact O-C 3.59Å; V1303-V1320 WeakPolarHBondContact O-CA 3.44Å; I1304-V1320 HydrophobicContact CD1-CG2 4.37Å; I1304-V1320 HydrophobicContact CG1-CB 4.13Å; I1304-V1320 HydrophobicContact CG1-CG2 3.75Å; F1317-V1320 HydrophobicContact CE2-CB 4.18Å; F1317-V1320 HydrophobicContact CZ-CB 3.93Å; F1317-V1320 HydrophobicContact CZ-CG1 3.95Å; V1320-F1341 PolarHBondContact N-O 2.71Å; V1320-F1341 PolarHBondContact O-N 3.43Å; V1320-L1346 HydrophobicContact CG1-CD1 4.39Å; V1320-L1346 HydrophobicContact CG1-CD2 4.08Å; V1320-L1346 HydrophobicContact CG1-CG 4.22Å; V1320-L1346 HydrophobicContact CG2-CD2 4.15Å
1321	A	96.6	Very high	92.8	Very high	2 Å²	2	59.6 Å²	59.6	2%	0.017	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	151.6	160	0	0	0	0	0	109.7	Q1302 V1303 L1340	Q1302-A1321 WeakPolarHBondContact CA-O 3.29Å; V1303-A1321 PolarHBondContact N-O 2.85Å; V1303-A1321 PolarHBondContact O-N 2.93Å; A1321-L1340 HydrophobicContact CB-CD2 4.35Å
1322	Q	95.3	Very high	93.2	Very high	23 Å²	23	51.6 Å²	51.6	11%	0.107	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143.5	168.2	-78.8	-178.6	-54.7	0	0	109.3	Q1209 L1210 V1300 L1301 Q1302 L1346	Q1209-Q1322 CarbonylContact C-O 3.58Å; Q1209-Q1322 WeakPolarHBondContact CA-O 3.34Å; Q1209-Q1322 WeakPolarHBondContact CG-O 3.06Å; L1210-Q1322 HydrophobicContact CB-CB 3.97Å; L1210-Q1322 HydrophobicContact CD1-CB 4.49Å; L1210-Q1322 PolarHBondContact N-O 2.97Å; V1300-Q1322 HydrophobicContact CG1-CB 4.1Å; V1300-Q1322 HydrophobicContact CG1-CG 4.26Å; L1301-Q1322 CarbonylContact O-C 3.6Å; L1301-Q1322 WeakPolarHBondContact O-CA 3.4Å; Q1302-Q1322 HydrophobicContact CB-CG 4.13Å; Q1302-Q1322 HydrophobicContact CG-CG 3.99Å; Q1322-L1346 HydrophobicContact CG-CD2 4Å
1323	I	96.1	Very high	93.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	125.3	-175.1	-46.3	174.2	0	0	0	107.7	A1208 M1228 V1300 L1301 V1303 L1325 L1328 Y1338	A1208-I1323 HydrophobicContact CB-CG2 4.15Å; A1208-I1323 CarbonylContact O-C 3.57Å; A1208-I1323 WeakPolarHBondContact O-CA 3.45Å; M1228-I1323 HydrophobicContact CE-CD1 4.04Å; M1228-I1323 HydrophobicContact CE-CG2 4.21Å; M1228-I1323 HydrophobicContact SD-CD1 3.92Å; M1228-I1323 HydrophobicContact SD-CG2 4.26Å; V1300-I1323 CarbonylContact C-O 3.55Å; V1300-I1323 VanDerWaalsContact CA-O 3.29Å; V1300-I1323 WeakPolarHBondContact CA-O 3.43Å; L1301-I1323 HydrophobicContact CB-CB 4.26Å; L1301-I1323 HydrophobicContact CD2-CD1 4.48Å; L1301-I1323 PolarHBondContact N-O 2.85Å; L1301-I1323 PolarHBondContact O-N 2.98Å; V1303-I1323 HydrophobicContact CG2-CD1 4.33Å; I1323-L1325 PolarHBondContact O-N 3.45Å; I1323-L1328 HydrophobicContact CG2-CD1 3.94Å; I1323-Y1338 HydrophobicContact CB-CE1 4.35Å; I1323-Y1338 HydrophobicContact CD1-CD1 3.8Å; I1323-Y1338 HydrophobicContact CD1-CD2 4.04Å; I1323-Y1338 HydrophobicContact CD1-CE1 3.54Å; I1323-Y1338 HydrophobicContact CD1-CE2 3.78Å; I1323-Y1338 HydrophobicContact CD1-CG 4.07Å; I1323-Y1338 HydrophobicContact CG1-CD1 3.76Å; I1323-Y1338 HydrophobicContact CG1-CE1 3.54Å; I1323-Y1338 HydrophobicContact CG1-CG 4.45Å; I1323-Y1338 HydrophobicContact CG2-CE1 3.98Å
1324	L	95	Very high	94.2	Very high	26 Å²	26	45.1 Å²	45.1	14%	0.136	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.6	173.8	-177.9	52.9	0	0	0	109	A1208 L1210 V1300 E1326 E1327	A1208-L1324 HydrophobicContact CB-CB 4.48Å; A1208-L1324 WeakPolarHBondContact CB-O 3.3Å; A1208-L1324 PolarHBondContact O-N 2.86Å; L1210-L1324 HydrophobicContact CD1-CB 4.16Å; L1210-L1324 HydrophobicContact CD2-CB 4.11Å; L1210-L1324 HydrophobicContact CG-CB 4.11Å; V1300-L1324 HydrophobicContact CG2-CD1 3.81Å; L1324-E1326 VanDerWaalsContact C-N 3.27Å; L1324-E1326 HydrophobicContact CD1-CB 4.32Å; L1324-E1326 HydrophobicContact CG-CB 4.43Å; L1324-E1326 PolarHBondContact O-N 3.02Å; L1324-E1327 HydrophobicContact CD2-CG 4Å; L1324-E1327 HydrophobicContact CG-CG 4.23Å; L1324-E1327 PolarHBondContact O-N 2.74Å
1325	L	96	Very high	94.6	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-73.4	-22.7	-171.5	-65.7	167.4	0	0	0	113	M1228 L1235 L1263 P1296 K1299 L1301 I1323 E1327 L1328 L1330	M1228-L1325 HydrophobicContact SD-CD2 3.7Å; L1235-L1325 HydrophobicContact CD1-CD2 4.45Å; L1235-L1325 HydrophobicContact CD2-CD1 3.58Å; L1235-L1325 HydrophobicContact CD2-CD2 4.36Å; L1263-L1325 HydrophobicContact CD1-CD1 3.56Å; P1296-L1325 HydrophobicContact CB-CB 4.01Å; P1296-L1325 HydrophobicContact CB-CD1 4.08Å; P1296-L1325 WeakPolarHBondContact O-CB 3.31Å; K1299-L1325 HydrophobicContact CB-CD1 4.08Å; K1299-L1325 WeakPolarHBondContact O-CB 3.31Å; K1299-L1325 PolarHBondContact O-N 2.91Å; L1301-L1325 HydrophobicContact CB-CD1 4.16Å; L1301-L1325 HydrophobicContact CB-CD2 4.01Å; L1301-L1325 HydrophobicContact CB-CG 4.11Å; L1301-L1325 HydrophobicContact CD2-CD2 4.44Å; I1323-L1325 PolarHBondContact O-N 3.45Å; L1325-E1327 VanDerWaalsContact C-N 3.3Å; L1325-E1327 PolarHBondContact O-N 3.45Å; L1325-L1328 PolarHBondContact O-N 3.22Å; L1325-L1330 HydrophobicContact CB-CD1 4.27Å; L1325-L1330 HydrophobicContact CD2-CD1 4.16Å
1326	E	92	Very high	94.7	Very high	138 Å²	138	38.6 Å²	38.6	65%	0.645	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-72.2	-20.2	179.3	-173.8	163.4	-143.9	0	0	113.6	L1324 L1328	L1324-E1326 VanDerWaalsContact C-N 3.27Å; L1324-E1326 HydrophobicContact CD1-CB 4.32Å; L1324-E1326 HydrophobicContact CG-CB 4.43Å; L1324-E1326 PolarHBondContact O-N 3.02Å; E1326-L1328 VanDerWaalsContact C-N 3.28Å
1327	E	91.4	Very high	94.9	Very high	69 Å²	69	40.9 Å²	40.9	32%	0.322	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-82.3	-1.3	172.5	-75	-179.9	-168.9	0	0	113.2	A1208 L1324 L1325 P1353	A1208-E1327 WeakPolarHBondContact CA-OE2 3.19Å; A1208-E1327 HydrophobicContact CB-CB 3.58Å; A1208-E1327 HydrophobicContact CB-CG 4.49Å; A1208-E1327 WeakPolarHBondContact CB-OE2 3.49Å; L1324-E1327 HydrophobicContact CD2-CG 4Å; L1324-E1327 HydrophobicContact CG-CG 4.23Å; L1324-E1327 PolarHBondContact O-N 2.74Å; L1325-E1327 VanDerWaalsContact C-N 3.3Å; L1325-E1327 PolarHBondContact O-N 3.45Å; E1327-P1353 VanDerWaalsContact OE1-CB 3.27Å; E1327-P1353 WeakPolarHBondContact OE1-CB 3.32Å; E1327-P1353 WeakPolarHBondContact OE1-CG 3.4Å
1328	L	93.3	Very high	95	Very high	25 Å²	25	38.6 Å²	38.6	13%	0.131	21%	0.207	C	C	.	.	S	Bend	trans	-111.8	131.1	-174.5	-59	-177	0	0	0	111.9	P1207 A1208 M1228 I1323 L1325 E1326 L1330 V1334	P1207-L1328 HydrophobicContact CB-CD2 3.7Å; A1208-L1328 HydrophobicContact CB-CD1 4.37Å; A1208-L1328 HydrophobicContact CB-CD2 3.58Å; A1208-L1328 HydrophobicContact CB-CG 3.8Å; M1228-L1328 HydrophobicContact CE-CD1 3.61Å; M1228-L1328 HydrophobicContact SD-CD1 4.2Å; I1323-L1328 HydrophobicContact CG2-CD1 3.94Å; L1325-L1328 PolarHBondContact O-N 3.22Å; E1326-L1328 VanDerWaalsContact C-N 3.28Å; L1328-L1330 VanDerWaalsContact C-N 3.33Å; L1328-L1330 HydrophobicContact CB-CD1 4.45Å; L1328-L1330 HydrophobicContact CB-CD2 3.84Å; L1328-L1330 HydrophobicContact CB-CG 3.85Å; L1328-L1330 HydrophobicContact CD1-CD2 4.21Å; L1328-L1330 PolarHBondContact O-N 2.89Å; L1328-V1334 HydrophobicContact CD1-CG1 4.45Å; L1328-V1334 HydrophobicContact CD2-CG1 4.33Å
1329	D	92.7	Very high	95	Very high	111 Å²	111	40.8 Å²	40.8	59%	0.594	22%	0.217	S	C	*	.			trans	-74.8	88.7	165.7	-178.9	5	0	0	0	110	S1331 V1334	D1329-S1331 PolarHBondContact O-N 3.11Å; D1329-S1331 WeakPolarHBondContact OD1-CB 3.41Å; D1329-S1331 PolarHBondContact OD1-N 2.98Å; D1329-S1331 VanDerWaalsContact OD1-N 3.09Å; D1329-S1331 PolarHBondContact OD1-OG 3.21Å; D1329-S1331 PolarHBondContact OD2-OG 3.22Å; D1329-V1334 WeakPolarHBondContact O-CG2 3.1Å
1330	L	95	Very high	95	Very high	10 Å²	10	40.8 Å²	40.8	5%	0.052	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	12.3	-179.6	-61	173.4	0	0	0	113.2	M1228 D1230 L1235 P1296 L1325 L1328 S1332 V1334	M1228-L1330 HydrophobicContact CB-CD2 3.59Å; M1228-L1330 WeakPolarHBondContact O-CD2 3.21Å; D1230-L1330 HydrophobicContact CB-CB 4.18Å; D1230-L1330 PolarHBondContact N-O 2.92Å; L1235-L1330 HydrophobicContact CD1-CD1 4.36Å; P1296-L1330 HydrophobicContact CB-CD1 3.46Å; P1296-L1330 VanDerWaalsContact CB-CD1 3.46Å; P1296-L1330 HydrophobicContact CG-CD1 3.72Å; L1325-L1330 HydrophobicContact CB-CD1 4.27Å; L1325-L1330 HydrophobicContact CD2-CD1 4.16Å; L1328-L1330 VanDerWaalsContact C-N 3.33Å; L1328-L1330 HydrophobicContact CB-CD1 4.45Å; L1328-L1330 HydrophobicContact CB-CD2 3.84Å; L1328-L1330 HydrophobicContact CB-CG 3.85Å; L1328-L1330 HydrophobicContact CD1-CD2 4.21Å; L1328-L1330 PolarHBondContact O-N 2.89Å; L1330-S1332 CarbonylContact C-O 3.47Å; L1330-S1332 PolarHBondContact O-N 3.08Å; L1330-V1334 HydrophobicContact CD2-CB 4.23Å; L1330-V1334 HydrophobicContact CD2-CG2 4.06Å
1331	S	93.3	Very high	94.8	Very high	91 Å²	91	41.2 Å²	41.2	64%	0.636	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-16.2	171.4	68.3	0	0	0	0	113.3	D1329	D1329-S1331 PolarHBondContact O-N 3.11Å; D1329-S1331 WeakPolarHBondContact OD1-CB 3.41Å; D1329-S1331 PolarHBondContact OD1-N 2.98Å; D1329-S1331 VanDerWaalsContact OD1-N 3.09Å; D1329-S1331 PolarHBondContact OD1-OG 3.21Å; D1329-S1331 PolarHBondContact OD2-OG 3.22Å
1332	S	91.7	Very high	94.6	Very high	70 Å²	70	42.7 Å²	42.7	49%	0.49	23%	0.228	S	C	.	.	S	Bend	trans	-139.4	171.3	170	67.7	0	0	0	0	110.1	L1330 V1334	L1330-S1332 CarbonylContact C-O 3.47Å; L1330-S1332 PolarHBondContact O-N 3.08Å; S1332-V1334 PolarHBondContact O-N 3.2Å; S1332-V1334 VanDerWaalsContact O-N 3.08Å
1333	M	94.7	Very high	94.2	Very high	57 Å²	57	45 Å²	45	28%	0.281	24%	0.244	S	C	.	.			trans	-74.1	103.3	-176	-173.2	172.2	-79.4	0	0	112.6	M1228 E1229 E1238 I1335	M1228-M1333 CarbonylContact O-C 3.59Å; M1228-M1333 WeakPolarHBondContact O-CA 3.26Å; E1229-M1333 HydrophobicContact CB-CB 4.16Å; E1229-M1333 HydrophobicContact CB-CE 4.34Å; E1229-M1333 HydrophobicContact CB-CG 4.48Å; E1229-M1333 HydrophobicContact CG-CB 4.41Å; E1229-M1333 WeakPolarHBondContact OE2-CE 3.41Å; E1238-M1333 HydrophobicContact CB-CE 4.3Å; E1238-M1333 HydrophobicContact CB-SD 4.47Å; M1333-I1335 HydrophobicContact CG-CD1 4.36Å; M1333-I1335 HydrophobicContact CG-CG1 3.87Å; M1333-I1335 PolarHBondContact O-N 2.8Å; M1333-I1335 HydrophobicContact SD-CD1 4.18Å; M1333-I1335 HydrophobicContact SD-CG1 4.2Å
1334	V	96.2	Very high	93.4	Very high	32 Å²	32	48.2 Å²	48.2	19%	0.194	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	113.2	172.2	179.9	0	0	0	0	109.5	P1207 G1227 M1228 L1328 D1329 L1330 S1332	P1207-V1334 HydrophobicContact CB-CG1 4.38Å; G1227-V1334 CarbonylContact C-O 3.51Å; G1227-V1334 VanDerWaalsContact CA-O 3.31Å; G1227-V1334 WeakPolarHBondContact CA-O 3.49Å; M1228-V1334 PolarHBondContact N-O 2.82Å; M1228-V1334 PolarHBondContact O-N 2.89Å; L1328-V1334 HydrophobicContact CD1-CG1 4.45Å; L1328-V1334 HydrophobicContact CD2-CG1 4.33Å; D1329-V1334 WeakPolarHBondContact O-CG2 3.1Å; L1330-V1334 HydrophobicContact CD2-CB 4.23Å; L1330-V1334 HydrophobicContact CD2-CG2 4.06Å; S1332-V1334 PolarHBondContact O-N 3.2Å; S1332-V1334 VanDerWaalsContact O-N 3.08Å
1335	I	96.5	Very high	92.6	Very high	84 Å²	84	47.3 Å²	47.3	43%	0.431	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.9	178.5	-56.9	179.5	0	0	0	110.6	Q1225 I1226 I1240 M1333	Q1225-I1335 HydrophobicContact CG-CG2 4.07Å; I1226-I1335 WeakPolarHBondContact O-CA 3.41Å; I1240-I1335 HydrophobicContact CD1-CD1 4.22Å; I1240-I1335 HydrophobicContact CD1-CG1 4.44Å; I1240-I1335 HydrophobicContact CD1-CG2 3.61Å; M1333-I1335 HydrophobicContact CG-CD1 4.36Å; M1333-I1335 HydrophobicContact CG-CG1 3.87Å; M1333-I1335 PolarHBondContact O-N 2.8Å; M1333-I1335 HydrophobicContact SD-CD1 4.18Å; M1333-I1335 HydrophobicContact SD-CG1 4.2Å
1336	G	95.2	Very high	91.7	Very high	5 Å²	5	50 Å²	50	5%	0.052	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	155.4	-179.5	0	0	0	0	0	114.1	Q1225 I1226	Q1225-G1336 WeakPolarHBondContact CA-O 3.48Å; I1226-G1336 PolarHBondContact N-O 3.12Å; I1226-G1336 PolarHBondContact O-N 3.24Å
1337	W	97.2	Very high	89.9	Confident	65 Å²	65	48 Å²	48	25%	0.246	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	131.1	161	-86.3	110.7	0	0	0	109.2	G1206 D1223 I1224 Q1225 R1241 R1243	G1206-W1337 WeakPolarHBondContact CA-O 3.38Å; G1206-W1337 PolarHBondContact N-O 2.96Å; D1223-W1337 HydrophobicContact CB-CE3 3.57Å; D1223-W1337 HydrophobicContact CB-CZ3 3.77Å; I1224-W1337 VanDerWaalsContact C-CE3 3.46Å; Q1225-W1337 HydrophobicContact CB-CD2 3.9Å; Q1225-W1337 HydrophobicContact CB-CE3 3.77Å; Q1225-W1337 HydrophobicContact CB-CH2 4.06Å; Q1225-W1337 HydrophobicContact CB-CZ2 4.18Å; Q1225-W1337 HydrophobicContact CB-CZ3 3.84Å; Q1225-W1337 HydrophobicContact CG-CD2 4.12Å; Q1225-W1337 HydrophobicContact CG-CE3 4.49Å; Q1225-W1337 HydrophobicContact CG-CG 4.45Å; R1241-W1337 HydrophobicContact CG-CH2 4.09Å; R1241-W1337 VanDerWaalsContact CZ-CZ2 3.46Å; R1243-W1337 HydrophobicContact CB-CH2 4.18Å; R1243-W1337 HydrophobicContact CB-CZ3 4.48Å; R1243-W1337 HydrophobicContact CG-CH2 3.68Å; R1243-W1337 HydrophobicContact CG-CZ3 3.73Å
1338	Y	97.2	Very high	88.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.4	-175.8	-66.7	-85.6	0	0	0	110.4	P1207 Q1209 D1223 I1224 I1226 M1228 I1323 L1340	P1207-Y1338 WeakPolarHBondContact CD-OH 3.49Å; P1207-Y1338 WeakPolarHBondContact O-CE1 3.26Å; P1207-Y1338 PolarHBondContact O-OH 2.83Å; Q1209-Y1338 HydrophobicContact CB-CD1 3.82Å; Q1209-Y1338 HydrophobicContact CB-CE1 3.98Å; Q1209-Y1338 HydrophobicContact CG-CD1 3.92Å; D1223-Y1338 WeakPolarHBondContact CA-O 3.36Å; I1224-Y1338 PolarHBondContact N-O 2.96Å; I1224-Y1338 PolarHBondContact O-N 3.32Å; I1226-Y1338 HydrophobicContact CB-CD2 4.1Å; I1226-Y1338 HydrophobicContact CB-CE2 4.12Å; I1226-Y1338 HydrophobicContact CG1-CD2 4.25Å; M1228-Y1338 HydrophobicContact CE-CE2 4.18Å; M1228-Y1338 WeakPolarHBondContact CE-OH 3.25Å; I1323-Y1338 HydrophobicContact CB-CE1 4.35Å; I1323-Y1338 HydrophobicContact CD1-CD1 3.8Å; I1323-Y1338 HydrophobicContact CD1-CD2 4.04Å; I1323-Y1338 HydrophobicContact CD1-CE1 3.54Å; I1323-Y1338 HydrophobicContact CD1-CE2 3.78Å; I1323-Y1338 HydrophobicContact CD1-CG 4.07Å; I1323-Y1338 HydrophobicContact CG1-CD1 3.76Å; I1323-Y1338 HydrophobicContact CG1-CE1 3.54Å; I1323-Y1338 HydrophobicContact CG1-CG 4.45Å; I1323-Y1338 HydrophobicContact CG2-CE1 3.98Å; Y1338-L1340 PolarHBondContact O-N 3.2Å
1339	K	95.5	Very high	86.2	Confident	47 Å²	47	50.5 Å²	50.5	20%	0.204	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	128.1	174.4	-74.6	174.8	-177.1	158.7	0	108.9	D1203 G1204 L1205 Q1209 A1220 F1341	D1203-K1339 PolarHBondContact O-NZ 3Å; G1204-K1339 WeakPolarHBondContact O-CE 3.39Å; L1205-K1339 HydrophobicContact CD2-CB 4.44Å; L1205-K1339 HydrophobicContact CD2-CD 4.05Å; Q1209-K1339 PolarHBondContact NE2-O 3.22Å; Q1209-K1339 VanDerWaalsContact OE1-N 3.1Å; A1220-K1339 HydrophobicContact CB-CB 4.1Å; A1220-K1339 HydrophobicContact CB-CG 4.3Å; K1339-F1341 HydrophobicContact CB-CE2 3.72Å; K1339-F1341 HydrophobicContact CB-CZ 3.73Å; K1339-F1341 HydrophobicContact CD-CZ 4.25Å; K1339-F1341 WeakPolarHBondContact O-CD2 3.3Å
1340	L	96.6	Very high	83.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.289	C	S	.	.			trans	-89.7	133.5	178.4	-65.5	168.3	0	0	0	110.3	A1220 M1221 G1222 I1224 L1245 V1305 A1321 Y1338	A1220-L1340 CarbonylContact C-O 3.56Å; A1220-L1340 WeakPolarHBondContact CA-O 3.24Å; M1221-L1340 HydrophobicContact CB-CB 4.48Å; M1221-L1340 PolarHBondContact N-O 3.34Å; G1222-L1340 VanDerWaalsContact O-CB 3.31Å; G1222-L1340 WeakPolarHBondContact O-CB 2.98Å; G1222-L1340 PolarHBondContact O-N 3.08Å; I1224-L1340 HydrophobicContact CB-CD1 4.31Å; I1224-L1340 HydrophobicContact CB-CD2 4.27Å; I1224-L1340 HydrophobicContact CB-CG 4.39Å; I1224-L1340 HydrophobicContact CG2-CD2 3.71Å; I1224-L1340 HydrophobicContact CG2-CG 4.17Å; L1245-L1340 HydrophobicContact CD2-CD1 3.49Å; L1245-L1340 VanDerWaalsContact CD2-CD1 3.49Å; V1305-L1340 HydrophobicContact CB-CD1 4.49Å; V1305-L1340 HydrophobicContact CG2-CD1 3.61Å; V1305-L1340 HydrophobicContact CG2-CD2 4.03Å; A1321-L1340 HydrophobicContact CB-CD2 4.35Å; Y1338-L1340 PolarHBondContact O-N 3.2Å
1341	F	94.4	Very high	81.2	Confident	9 Å²	9	55.4 Å²	55.4	4%	0.039	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-120.2	164.9	-177.4	-66.1	-72.5	0	0	0	113.2	L1205 V1211 T1215 A1220 G1319 V1320 K1339	L1205-F1341 HydrophobicContact CD2-CE2 4.15Å; L1205-F1341 HydrophobicContact CD2-CZ 4.24Å; V1211-F1341 HydrophobicContact CG1-CE2 4.09Å; V1211-F1341 HydrophobicContact CG1-CZ 4.33Å; V1211-F1341 HydrophobicContact CG2-CD2 4.27Å; V1211-F1341 HydrophobicContact CG2-CE2 3.66Å; V1211-F1341 HydrophobicContact CG2-CZ 4.43Å; T1215-F1341 HydrophobicContact CG2-CB 3.85Å; T1215-F1341 HydrophobicContact CG2-CD1 3.34Å; T1215-F1341 HydrophobicContact CG2-CD2 4.04Å; T1215-F1341 HydrophobicContact CG2-CE1 3.8Å; T1215-F1341 HydrophobicContact CG2-CE2 4.43Å; T1215-F1341 HydrophobicContact CG2-CG 3.47Å; T1215-F1341 VanDerWaalsContact CG2-CG 3.47Å; T1215-F1341 HydrophobicContact CG2-CZ 4.32Å; A1220-F1341 HydrophobicContact CB-CE1 4.39Å; G1319-F1341 CarbonylContact C-O 3.54Å; G1319-F1341 WeakPolarHBondContact CA-O 3.12Å; V1320-F1341 PolarHBondContact N-O 2.71Å; V1320-F1341 PolarHBondContact O-N 3.43Å; K1339-F1341 HydrophobicContact CB-CE2 3.72Å; K1339-F1341 HydrophobicContact CB-CZ 3.73Å; K1339-F1341 HydrophobicContact CD-CZ 4.25Å; K1339-F1341 WeakPolarHBondContact O-CD2 3.3Å
1342	P	92.1	Very high	78.4	Confident	32 Å²	32	54 Å²	54	21%	0.208	31%	0.31	C	S	.	.			trans	-65.3	162.4	170.1	-18.1	32.3	0	0	0	112.1	T1218 M1221 S1344 S1345	T1218-P1342 HydrophobicContact CG2-CG 3.93Å; M1221-P1342 HydrophobicContact CG-CG 4.24Å; M1221-P1342 HydrophobicContact SD-CB 4.2Å; M1221-P1342 HydrophobicContact SD-CG 3.95Å; P1342-S1344 PolarHBondContact O-N 3.13Å; P1342-S1345 WeakPolarHBondContact O-CB 3.47Å; P1342-S1345 PolarHBondContact O-N 2.72Å; P1342-S1345 PolarHBondContact O-OG 3.16Å
1343	P	86.5	Confident	75.7	Confident	71 Å²	71	54.2 Å²	54.2	46%	0.461	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-62.1	-13.7	-177.5	-20.9	33.3	0	0	0	115.1	F1317 S1345 L1346	F1317-P1343 HydrophobicContact CD1-CG 4.1Å; F1317-P1343 HydrophobicContact CD2-CG 4.38Å; F1317-P1343 VanDerWaalsContact CE1-CD 3.49Å; F1317-P1343 HydrophobicContact CE1-CG 3.73Å; F1317-P1343 HydrophobicContact CE2-CG 4.02Å; F1317-P1343 HydrophobicContact CG-CG 4.41Å; F1317-P1343 HydrophobicContact CZ-CG 3.67Å; P1343-S1345 PolarHBondContact O-N 2.98Å; P1343-L1346 WeakPolarHBondContact O-CB 3.32Å; P1343-L1346 PolarHBondContact O-N 3.22Å
1344	S	78.5	Confident	72.9	Confident	68 Å²	68	56.1 Å²	56.1	48%	0.476	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-62.8	-21	171.4	49.1	0	0	0	0	113.2	P1342 L1346 V1347	P1342-S1344 PolarHBondContact O-N 3.13Å; S1344-L1346 PolarHBondContact O-N 3.13Å; S1344-V1347 PolarHBondContact O-N 2.97Å
1345	S	79.3	Confident	70.1	Confident	7 Å²	7	58.7 Å²	58.7	5%	0.049	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-69.8	-6.3	175.6	77.9	0	0	0	0	114.6	T1215 P1342 P1343	T1215-S1345 VanDerWaalsContact OG1-CA 3.26Å; T1215-S1345 WeakPolarHBondContact OG1-CA 3.44Å; T1215-S1345 WeakPolarHBondContact OG1-CB 3.23Å; P1342-S1345 WeakPolarHBondContact O-CB 3.47Å; P1342-S1345 PolarHBondContact O-N 2.72Å; P1342-S1345 PolarHBondContact O-OG 3.16Å; P1343-S1345 PolarHBondContact O-N 2.98Å
1346	L	76.1	Confident	67.2	Low	60 Å²	60	63.3 Å²	63.3	31%	0.314	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-93.7	-0.3	176.8	-52	178.6	0	0	0	112.1	V1320 Q1322 P1343 S1344	V1320-L1346 HydrophobicContact CG1-CD1 4.39Å; V1320-L1346 HydrophobicContact CG1-CD2 4.08Å; V1320-L1346 HydrophobicContact CG1-CG 4.22Å; V1320-L1346 HydrophobicContact CG2-CD2 4.15Å; Q1322-L1346 HydrophobicContact CG-CD2 4Å; P1343-L1346 WeakPolarHBondContact O-CB 3.32Å; P1343-L1346 PolarHBondContact O-N 3.22Å; S1344-L1346 PolarHBondContact O-N 3.13Å
1347	V	55.2	Low	64.1	Low	95 Å²	95	75.4 Å²	75.4	58%	0.576	39%	0.392	S	S	*	.	S	Bend	trans	-98.1	136.4	171	-171.3	0	0	0	0	107.7	S1344	S1344-V1347 PolarHBondContact O-N 2.97Å
1348	D	52.9	Low	60.7	Low	81 Å²	81	76 Å²	76	43%	0.433	41%	0.41	S	S	.	.			trans	51	55.5	-169.8	-54.3	-27.8	0	0	0	115.9	G1212 Q1214 T1350	G1212-D1348 WeakPolarHBondContact CA-O 3.44Å; Q1214-D1348 PolarHBondContact NE2-OD2 3.15Å; D1348-T1350 HydrophobicContact CB-CG2 4.49Å; D1348-T1350 PolarHBondContact O-N 3.15Å; D1348-T1350 PolarHBondContact O-OG1 3.22Å
1349	P	54	Low	57.5	Low	66 Å²	66	81.3 Å²	81.3	43%	0.429	45%	0.448	S	S	.	.			trans	-70.9	59.3	157.3	35.9	-35.5	0	0	0	109.5	L1351	P1349-L1351 PolarHBondContact O-N 3.35Å
1350	T	40.3	Very low	54.3	Low	81 Å²	81	88.1 Å²	88.1	50%	0.497	48%	0.48	S	S	.	.			trans	-62.5	124.3	172.9	39.4	0	0	0	0	108.4	D1348 T1352	D1348-T1350 HydrophobicContact CB-CG2 4.49Å; D1348-T1350 PolarHBondContact O-N 3.15Å; D1348-T1350 PolarHBondContact O-OG1 3.22Å; T1350-T1352 PolarHBondContact O-N 2.78Å
1351	L	41.7	Very low	51.3	Low	142 Å²	142	94 Å²	94	74%	0.743	52%	0.521	S	S	*	.	S	Bend	trans	-73.3	74.6	-174.9	-66.7	173.8	0	0	0	111.3	P1349	P1349-L1351 PolarHBondContact O-N 3.35Å
1352	T	34.2	Very low	48.2	Very low	63 Å²	63	99 Å²	99	39%	0.387	56%	0.558	S	S	.	*			trans	-118.4	101.2	157.5	56.6	0	0	0	0	108.2	R1213 T1350 L1354	R1213-T1352 PolarHBondContact NH2-OG1 3.49Å; T1350-T1352 PolarHBondContact O-N 2.78Å; T1352-L1354 PolarHBondContact O-N 2.75Å
1353	P	35.4	Very low	45.3	Very low	73 Å²	73	105.5 Å²	105.5	47%	0.474	59%	0.59	S	S	.	*			trans	-55.3	110.4	167.5	-26.4	36.7	0	0	0	109.7	E1327 T1355	E1327-P1353 VanDerWaalsContact OE1-CB 3.27Å; E1327-P1353 WeakPolarHBondContact OE1-CB 3.32Å; E1327-P1353 WeakPolarHBondContact OE1-CG 3.4Å; P1353-T1355 HydrophobicContact CB-CG2 4.37Å; P1353-T1355 PolarHBondContact O-N 3.22Å; P1353-T1355 VanDerWaalsContact O-N 3.14Å
1354	L	35.6	Very low	42.8	Very low	98 Å²	98	111.2 Å²	111.2	51%	0.513	61%	0.611	S	S	.	*			trans	-84.9	35.6	172.9	-66.3	178.7	0	0	0	111	L1216 T1352	L1216-L1354 HydrophobicContact CD1-CD1 4.12Å; T1352-L1354 PolarHBondContact O-N 2.75Å
1355	T	37.9	Very low	40.6	Very low	86 Å²	86	113.1 Å²	113.1	53%	0.528	62%	0.624	S	S	.	*			trans	-75.5	120.2	172.1	52.3	0	0	0	0	109.3	P1353 R1357	P1353-T1355 HydrophobicContact CB-CG2 4.37Å; P1353-T1355 PolarHBondContact O-N 3.22Å; P1353-T1355 VanDerWaalsContact O-N 3.14Å; T1355-R1357 PolarHBondContact O-N 2.74Å; T1355-R1357 VanDerWaalsContact O-N 3.1Å
1356	R	35.1	Very low	38.4	Very low	181 Å²	181	118 Å²	118	68%	0.683	66%	0.658	S	S	*	*			trans	-52.2	117.4	173.4	-82.5	-179.5	170.3	175.2	-1.2	110.6	S1199	S1199-R1356 PolarHBondContact OG-NH2 2.7Å
1357	R	30.3	Very low	36.2	Very low	259 Å²	259	121 Å²	121	98%	0.977	68%	0.684	S	S	*	*			trans	-115.4	78.2	156.1	-130.6	-178.7	-170.8	179.6	4.2	108.8	T1355	T1355-R1357 PolarHBondContact O-N 2.74Å; T1355-R1357 VanDerWaalsContact O-N 3.1Å
1358	A	27	Very low	35.3	Very low	76 Å²	76	120 Å²	120	63%	0.628	69%	0.692	S	S	*	*			trans	-132.8	116.8	179	0	0	0	0	0	110
1359	S	28.1	Very low	34.5	Very low	113 Å²	113	122 Å²	122	79%	0.79	71%	0.71	S	S	*	*			trans	78.8	136.7	156.2	-49.1	0	0	0	0	119.9
1360	Q	30.2	Very low	33.9	Very low	189 Å²	189	124.6 Å²	124.6	88%	0.883	73%	0.727	S	S	*	*			trans	73.7	93.3	158.3	-53.3	-174.5	24.9	0	0	120.6
1361	S	32.6	Very low	33.7	Very low	123 Å²	123	126.4 Å²	126.4	86%	0.86	74%	0.742	S	S	*	*				-172.3	96	122.9	61.4	0	0	0	0	111.1
1362	S	30	Very low	33.3	Very low	116 Å²	116	126.9 Å²	126.9	81%	0.811	74%	0.743	S	S	*	*			trans	-150.6	47.6	178.6	68.5	0	0	0	0	113.2
1363	L	30.1	Very low	33.2	Very low	167 Å²	167	134.7 Å²	134.7	87%	0.874	77%	0.766	S	S	*	*			trans	-145.9	104.2	173.1	-74.2	178.2	0	0	0	110.2
1364	E	34.6	Very low	33.3	Very low	192 Å²	192	140.6 Å²	140.6	90%	0.897	81%	0.809	S	S	*	*			trans	-162.8	100.3	145.7	-113.1	170.8	159.7	0	0	111.1
1365	S	31.6	Very low	33.1	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	82%	0.823	S	S	*	*			trans	12.6	125.2	156.3	53.3	0	0	0	0	121.2
1366	S	32.5	Very low	32.9	Very low	110 Å²	110	145.7 Å²	145.7	77%	0.769	84%	0.839	S	S	*	*				174.1	151.4	89.3	46.4	0	0	0	0	115.3
1367	S	31	Very low	32.8	Very low	122 Å²	122	143.7 Å²	143.7	85%	0.853	85%	0.848	S	S	*	*			trans	37.1	113.2	156.4	56.3	0	0	0	0	121.8
1368	G	35.6	Very low	32.9	Very low	74 Å²	74	136.9 Å²	136.9	76%	0.763	84%	0.84	S	S	*	*			trans	173.3	105.5	160.3	0	0	0	0	0	113.3
1369	P	37.6	Very low	33.3	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	85%	0.853	S	S	*	*			trans	-85.3	157.5	-174	33.4	-35	0	0	0	114.2
1370	P	40.7	Very low	33.6	Very low	120 Å²	120	142.6 Å²	142.6	78%	0.779	86%	0.857	S	S	*	*			trans	-91.8	139.3	-170.9	34.9	-35.2	0	0	0	115
1371	C	35.9	Very low	33.9	Very low	120 Å²	120	139.3 Å²	139.3	81%	0.811	86%	0.855	S	S	*	*			trans	-140.4	99.7	167.6	-66	0	0	0	0	107.6
1372	I	33.3	Very low	34	Very low	151 Å²	151	140.5 Å²	140.5	77%	0.774	86%	0.855	S	S	*	*				56.9	102	92	-58.2	178.6	0	0	0	113.7
1373	R	31.4	Very low	34.3	Very low	228 Å²	228	142.6 Å²	142.6	86%	0.86	86%	0.859	S	S	*	*			trans	53.9	121.4	153.6	-69.4	179.2	170.3	163.4	-3.3	120
1374	S	37.6	Very low	34.7	Very low	196 Å²	196	140.4 Å²	140.4	100%	1.371	86%	0.857	S	S	*	*				-124.8	0	97.7	-68.5	0	0	0	0	109.3

Retrieved 1,374 of 1,374 residues in 2442.4 ms (Link to these results)

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