RIMS1_MOUSE Loading...

Isoform 7 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 Q99NE5-7 (canonical: Q99NE5), Species MOUSE (Mus musculus, Mouse), Gene Rims1, Length 1,184 aa.

						>RIMS1_MOUSE|Q99NE5-7|Rims1
MSSAVGPRGPRPPTVPPPMQELPDLSHLTEEERNIIMAVMDRQKEEEEKEEAMLKCVVRDMAKPAACKTPRNAESQPHQPPLNIFRCVCVPRKPSSEEGGPDRNWRLHQQFESYKEQVRKIGEEARRYQGEHKDDAPTCGICHKTKFADGCGHLCSYCRTKFCARCGGRVSLRSNNEDKVVMWVCNLCRKQQEILTKSGAWFFGSGPQQPSQDGTLSDTATGAGSEVPREKKARLQERSRSQTPLSTAAVSSQDTASHGAPLDRNKGAEPSQQALGPEQKQASRSRSEPPRERKKAPGLSEQNGKGGQKSERKRVPKSVVQPGEGTADERERKERRETRRLEKGRSQDYPDRLEKREDGRVAEDEKQRKEEEYQTRYRSDPNLARYPVKAPLEEQQMRMHARVSRARHERRHSDVALPHTEAAAAVSAETTAGKRAQTTARVSPPESPRARAPAAQPPAEHGPPPPRPAPGPAEPPEPRVPEPLRKQGRLDPGSAVLLRKAKREKAESMLRNDSLSSDQSESVRPSPPKPHRPKRGGKRRQMSVSSSEEEGVSTPEYTSCEDVELESESVSEKGDLDYWLDPATWHSRETSPISSHPVTWQPSKEGDRLIGRVILNKRTTMPKESGALLGLKVVGGKMTDLGRLGAFITKVKKGSLADVVGHLRAGDEVLEWNGKPLPGATNEEVYNIILESKSEPQVEIIVSRPIGDIPRIPESSHPPLESSSSSFESQKMERPSISVISPTSPGALKDAPQVLPGQLSVKLWYDKVGHQLIVNVLQATDLPPRVDGRPRNPYVKMYFLPDRSDKSKRRTKTVKKLLEPKWNQTFVYSHVHRRDFRERMLEITVWDQPRVQDEESEFLGEILIELETALLDDEPHWYKLQTHDESSLPLPQPSPFMPRRHIHGESSSKKLQRSQRISDSDISDYEVDDGIGVVPPVGYRASARESKATTLTVPEQQRTTHHRSRSVSPHRGDDQGRPRSRLPNVPLQRSLDEIHPTRRSRSPTRHHDASRSLADHRSRHAESQYSSEPDRTHRQGSPTQSPPADTSFGSRRGRQLPQVPVRSGSIEQASLVVEERTRQMKMKVHRFKQTTGSGSSQELDHEQYSKYNIHKDQYRSCDNASAKSSDSDVSDVSAISRASSTSRLSSTSFMSEQSERPRGRISSLTLVLLMMALPYKFVQKSRLF
					

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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	41	Very low	45.2	Very low	235 Å²	235	139.3 Å²	139.3	100%	1.158	82%	0.822	S	S	*	*				0	129.3	0	-57	178.5	85.8	0	0	107.5
2	S	39.2	Very low	45.6	Very low	94 Å²	94	136.1 Å²	136.1	66%	0.657	81%	0.808	S	S	*	*			cis	-156	135.2	-13.3	-70	0	0	0	0	106.7
3	S	38.9	Very low	46.4	Very low	123 Å²	123	135 Å²	135	86%	0.86	81%	0.807	S	S	*	*				61.5	136.4	104.1	-44.6	0	0	0	0	114.9
4	A	40.3	Very low	46.2	Very low	87 Å²	87	133.9 Å²	133.9	72%	0.719	80%	0.802	S	S	*	*			cis	-154.6	147.8	-3	0	0	0	0	0	106.8
5	V	49.2	Very low	46.1	Very low	146 Å²	146	133.1 Å²	133.1	89%	0.885	80%	0.797	S	S	*	*				57.8	104.1	63.5	-174.2	0	0	0	0	113.3
6	G	47.3	Very low	46.5	Very low	73 Å²	73	131.1 Å²	131.1	75%	0.753	79%	0.789	S	S	*	*			trans	-157.8	135.4	168.1	0	0	0	0	0	109.8
7	P	50.8	Low	46.5	Very low	109 Å²	109	129.8 Å²	129.8	71%	0.708	78%	0.784	S	S	*	*			trans	-138.5	-177.7	-136.7	38.3	-18	0	0	0	117.7
8	R	43.2	Very low	46.7	Very low	251 Å²	251	129.6 Å²	129.6	95%	0.947	79%	0.786	S	S	*	*			trans	88.9	141	161	-60.7	-179.4	172.3	-129.9	-3.5	118.3
9	G	46.4	Very low	46.7	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	79%	0.788	S	S	*	*			trans	140.6	72.6	178.9	0	0	0	0	0	111.8	R11	G9-R11 PolarHBondContact O-N 3.47Å
10	P	54.1	Low	47.1	Very low	131 Å²	131	133 Å²	133	85%	0.851	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.7	126.3	177.7	29.2	-33.3	0	0	0	110.3
11	R	47	Very low	47.7	Very low	216 Å²	216	135.8 Å²	135.8	82%	0.815	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.9	137.5	171.5	-155.8	172.3	-157.8	-103	2.8	108.4	G9	G9-R11 PolarHBondContact O-N 3.47Å
12	P	49.5	Very low	49	Very low	101 Å²	101	131.4 Å²	131.4	66%	0.656	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.7	152.8	177.7	24.8	-34.9	0	0	0	111.3	T14	P12-T14 PolarHBondContact O-N 2.75Å; P12-T14 VanDerWaalsContact O-N 3.17Å
13	P	56	Low	50.5	Low	122 Å²	122	130 Å²	130	79%	0.792	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-62.8	118.8	177.6	26.7	-33.6	0	0	0	109.7	V15	P13-V15 PolarHBondContact O-N 3.42Å
14	T	44.5	Very low	52.2	Low	119 Å²	119	129.5 Å²	129.5	73%	0.73	75%	0.748	S	S	*	*			trans	-64.6	108.4	167.9	-51	0	0	0	0	107.6	P12	P12-T14 PolarHBondContact O-N 2.75Å; P12-T14 VanDerWaalsContact O-N 3.17Å
15	V	44.3	Very low	53.9	Low	122 Å²	122	126.6 Å²	126.6	74%	0.739	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-53.7	131	170.5	-176.7	0	0	0	0	107.5	P13	P13-V15 PolarHBondContact O-N 3.42Å
16	P	51.9	Low	55.2	Low	101 Å²	101	123.1 Å²	123.1	66%	0.656	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-57.8	147	175.8	25.7	-34.3	0	0	0	109.4
17	P	47	Very low	56.8	Low	109 Å²	109	126.6 Å²	126.6	71%	0.708	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-54.7	140.7	170.7	26.6	-34.2	0	0	0	108.3	M19	P17-M19 PolarHBondContact O-N 3.36Å
18	P	51	Low	58.2	Low	127 Å²	127	123.3 Å²	123.3	83%	0.825	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-55.8	118.5	178	23.9	-32.9	0	0	0	108	Q20	P18-Q20 PolarHBondContact O-N 2.82Å
19	M	46.8	Very low	60.2	Low	169 Å²	169	115 Å²	115	83%	0.833	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-57.2	132.1	169.7	-78.5	-175.9	59.1	0	0	107.1	P17 E21	P17-M19 PolarHBondContact O-N 3.36Å; M19-E21 PolarHBondContact O-N 3.37Å
20	Q	54.8	Low	62	Low	158 Å²	158	118.7 Å²	118.7	74%	0.738	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-52.4	118	171.4	-69.2	167.7	-25.4	0	0	107.4	P18 L22	P18-Q20 PolarHBondContact O-N 2.82Å; Q20-L22 PolarHBondContact O-N 2.69Å
21	E	58.3	Low	63.6	Low	191 Å²	191	119.9 Å²	119.9	89%	0.893	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-59	117.6	177	-73.2	-179.9	118.7	0	0	107.8	M19	M19-E21 PolarHBondContact O-N 3.37Å
22	L	68	Low	65.4	Low	143 Å²	143	113.9 Å²	113.9	75%	0.749	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-57.7	127.4	171.3	-79.3	157.9	0	0	0	107.1	Q20 D24	Q20-L22 PolarHBondContact O-N 2.69Å; L22-D24 PolarHBondContact O-N 2.99Å
23	P	72.3	Confident	67.1	Low	65 Å²	65	113 Å²	113	42%	0.422	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-58.5	140.3	178.2	25	-33.6	0	0	0	109.2	L25 M40	P23-L25 HydrophobicContact CB-CD2 4.48Å; P23-L25 HydrophobicContact CG-CD2 4.29Å; P23-L25 WeakPolarHBondContact O-CG 3.48Å; P23-L25 PolarHBondContact O-N 3.47Å; P23-M40 HydrophobicContact CG-CE 4.35Å; P23-M40 HydrophobicContact CG-SD 3.65Å
24	D	74.1	Confident	68.6	Low	112 Å²	112	111.5 Å²	111.5	60%	0.599	60%	0.596	S	S	*	*			trans	-70.4	97.7	-176.4	179.8	22.9	0	0	0	111.6	L22 S26 H27	L22-D24 PolarHBondContact O-N 2.99Å; D24-S26 PolarHBondContact O-N 3.39Å; D24-S26 WeakPolarHBondContact OD1-CB 3.03Å; D24-S26 PolarHBondContact OD1-N 3.34Å; D24-S26 PolarHBondContact OD1-OG 2.92Å; D24-S26 PolarHBondContact OD2-OG 3.04Å; D24-H27 PolarHBondContact O-CE1 3.08Å; D24-H27 PolarHBondContact O-ND1 3Å
25	L	76.3	Confident	70.6	Confident	26 Å²	26	111.2 Å²	111.2	14%	0.136	59%	0.589	C	S	.	*	G	3₁₀ helix	trans	-86.9	19.3	175.6	-49.9	-176.9	0	0	0	112.7	P23 H27 L28 R33 I36 M37	P23-L25 HydrophobicContact CB-CD2 4.48Å; P23-L25 HydrophobicContact CG-CD2 4.29Å; P23-L25 WeakPolarHBondContact O-CG 3.48Å; P23-L25 PolarHBondContact O-N 3.47Å; L25-H27 PolarHBondContact O-N 2.9Å; L25-L28 HydrophobicContact CB-CD1 4.22Å; L25-L28 HydrophobicContact CD2-CD1 3.72Å; L25-R33 HydrophobicContact CB-CB 4.48Å; L25-R33 HydrophobicContact CB-CG 3.88Å; L25-R33 HydrophobicContact CD1-CG 3.94Å; L25-R33 PolarHBondContact O-NE 2.79Å; L25-R33 PolarHBondContact O-NH2 2.96Å; L25-I36 HydrophobicContact CD1-CB 4.09Å; L25-I36 HydrophobicContact CD1-CG2 3.74Å; L25-I36 HydrophobicContact CD2-CD1 4.47Å; L25-I36 HydrophobicContact CD2-CG2 3.92Å; L25-M37 HydrophobicContact CD1-CG 3.99Å
26	S	76.5	Confident	72.5	Confident	73 Å²	73	108 Å²	108	51%	0.51	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-57.5	-35.2	175.3	64.4	0	0	0	0	113.1	D24 L28 R33	D24-S26 PolarHBondContact O-N 3.39Å; D24-S26 WeakPolarHBondContact OD1-CB 3.03Å; D24-S26 PolarHBondContact OD1-N 3.34Å; D24-S26 PolarHBondContact OD1-OG 2.92Å; D24-S26 PolarHBondContact OD2-OG 3.04Å; S26-L28 PolarHBondContact O-N 3.09Å; S26-R33 PolarHBondContact O-NH2 2.88Å
27	H	80.1	Confident	74.2	Confident	147 Å²	147	107.4 Å²	107.4	68%	0.681	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-85.5	0.4	-171.6	67.5	-85.8	0	0	0	115.3	D24 L25	D24-H27 PolarHBondContact O-CE1 3.08Å; D24-H27 PolarHBondContact O-ND1 3Å; L25-H27 PolarHBondContact O-N 2.9Å
28	L	79.2	Confident	76.2	Confident	39 Å²	39	104.3 Å²	104.3	20%	0.204	54%	0.54	C	S	.	.	S	Bend	trans	-108.5	153	-178	-73.3	143.4	0	0	0	110.6	L25 S26 E32 I36	L25-L28 HydrophobicContact CB-CD1 4.22Å; L25-L28 HydrophobicContact CD2-CD1 3.72Å; S26-L28 PolarHBondContact O-N 3.09Å; L28-E32 HydrophobicContact CB-CB 4.1Å; L28-E32 HydrophobicContact CD2-CB 3.92Å; L28-E32 HydrophobicContact CD2-CG 4.43Å; L28-I36 HydrophobicContact CD1-CD1 3.65Å; L28-I36 HydrophobicContact CD2-CD1 4.1Å; L28-I36 HydrophobicContact CG-CD1 4.45Å
29	T	86.1	Confident	78.1	Confident	77 Å²	77	101.8 Å²	101.8	47%	0.472	52%	0.522	S	S	.	.			trans	-61.5	159	172.7	61.9	0	0	0	0	110.9	E31 E32 R33	T29-E31 PolarHBondContact O-N 3.3Å; T29-E32 WeakPolarHBondContact CB-OE2 3.12Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.4Å; T29-E32 PolarHBondContact N-OE2 2.64Å; T29-E32 PolarHBondContact O-N 2.89Å; T29-E32 WeakPolarHBondContact OG1-CB 3.23Å; T29-E32 VanDerWaalsContact OG1-CD 3.26Å; T29-E32 VanDerWaalsContact OG1-CG 3.22Å; T29-E32 WeakPolarHBondContact OG1-CG 3.36Å; T29-E32 PolarHBondContact OG1-N 3.18Å; T29-E32 PolarHBondContact OG1-OE2 2.94Å; T29-R33 WeakPolarHBondContact O-CB 2.94Å; T29-R33 PolarHBondContact O-N 2.91Å
30	E	84.5	Confident	79.9	Confident	145 Å²	145	97.4 Å²	97.4	68%	0.678	50%	0.5	S	S	*	.	H	α-helix	trans	-62.3	-31.1	-179.7	-173.1	163.3	-165.6	0	0	112.3	N34	E30-N34 WeakPolarHBondContact O-CB 3.32Å; E30-N34 PolarHBondContact O-N 2.79Å; E30-N34 PolarHBondContact O-ND2 2.8Å
31	E	86.5	Confident	81.4	Confident	156 Å²	156	94.5 Å²	94.5	73%	0.729	49%	0.49	S	S	*	.	H	α-helix	trans	-69.2	-48.4	174.6	-61.6	-178.5	159.6	0	0	111.6	T29 R33 N34 I35	T29-E31 PolarHBondContact O-N 3.3Å; E31-R33 PolarHBondContact O-N 3.44Å; E31-N34 PolarHBondContact O-N 2.8Å; E31-I35 VanDerWaalsContact O-CG1 3.3Å; E31-I35 WeakPolarHBondContact O-CG1 3.22Å; E31-I35 PolarHBondContact O-N 3.45Å
32	E	86.2	Confident	82.8	Confident	89 Å²	89	92.5 Å²	92.5	42%	0.416	47%	0.474	S	S	.	.	H	α-helix	trans	-61.8	-42.1	174.8	-70.1	165.6	128	0	0	112	L28 T29 N34 I35 I36	L28-E32 HydrophobicContact CB-CB 4.1Å; L28-E32 HydrophobicContact CD2-CB 3.92Å; L28-E32 HydrophobicContact CD2-CG 4.43Å; T29-E32 WeakPolarHBondContact CB-OE2 3.12Å; T29-E32 WeakPolarHBondContact CG2-OE2 3.4Å; T29-E32 PolarHBondContact N-OE2 2.64Å; T29-E32 PolarHBondContact O-N 2.89Å; T29-E32 WeakPolarHBondContact OG1-CB 3.23Å; T29-E32 VanDerWaalsContact OG1-CD 3.26Å; T29-E32 VanDerWaalsContact OG1-CG 3.22Å; T29-E32 WeakPolarHBondContact OG1-CG 3.36Å; T29-E32 PolarHBondContact OG1-N 3.18Å; T29-E32 PolarHBondContact OG1-OE2 2.94Å; E32-N34 PolarHBondContact O-N 3.46Å; E32-I35 PolarHBondContact O-N 3.18Å; E32-I36 WeakPolarHBondContact O-CB 3.46Å; E32-I36 WeakPolarHBondContact O-CD1 3.34Å; E32-I36 VanDerWaalsContact O-CG1 3.3Å; E32-I36 WeakPolarHBondContact O-CG1 3.49Å; E32-I36 PolarHBondContact O-N 3.19Å
33	R	85.6	Confident	83.6	Confident	84 Å²	84	91.7 Å²	91.7	32%	0.317	47%	0.467	S	S	.	.	H	α-helix	trans	-58.8	-47.8	175.3	-178.3	-177.6	-61.1	150.7	7.5	110.9	L25 S26 T29 E31 I35 I36 M37	L25-R33 HydrophobicContact CB-CB 4.48Å; L25-R33 HydrophobicContact CB-CG 3.88Å; L25-R33 HydrophobicContact CD1-CG 3.94Å; L25-R33 PolarHBondContact O-NE 2.79Å; L25-R33 PolarHBondContact O-NH2 2.96Å; S26-R33 PolarHBondContact O-NH2 2.88Å; T29-R33 WeakPolarHBondContact O-CB 2.94Å; T29-R33 PolarHBondContact O-N 2.91Å; E31-R33 PolarHBondContact O-N 3.44Å; R33-I35 VanDerWaalsContact C-N 3.34Å; R33-I35 PolarHBondContact O-N 3.16Å; R33-I36 PolarHBondContact O-N 3.46Å; R33-M37 HydrophobicContact CG-CG 4.47Å; R33-M37 HydrophobicContact CG-SD 3.94Å; R33-M37 WeakPolarHBondContact O-CB 2.93Å; R33-M37 VanDerWaalsContact O-CG 3.31Å; R33-M37 WeakPolarHBondContact O-CG 3.19Å; R33-M37 PolarHBondContact O-N 3.41Å
34	N	86.7	Confident	84.4	Confident	89 Å²	89	94.6 Å²	94.6	48%	0.476	47%	0.473	S	S	.	.	H	α-helix	trans	-63	-38.8	177	-82.8	-58.7	0	0	0	112.1	E30 E31 E32 A38	E30-N34 WeakPolarHBondContact O-CB 3.32Å; E30-N34 PolarHBondContact O-N 2.79Å; E30-N34 PolarHBondContact O-ND2 2.8Å; E31-N34 PolarHBondContact O-N 2.8Å; E32-N34 PolarHBondContact O-N 3.46Å; N34-A38 WeakPolarHBondContact O-CB 3.19Å; N34-A38 PolarHBondContact O-N 2.82Å
35	I	86.8	Confident	85	Confident	113 Å²	113	94.9 Å²	94.9	58%	0.579	47%	0.471	S	S	*	.	H	α-helix	trans	-62.9	-47.1	174.6	-69.9	163.9	0	0	0	110.9	E31 E32 R33 A38 V39	E31-I35 VanDerWaalsContact O-CG1 3.3Å; E31-I35 WeakPolarHBondContact O-CG1 3.22Å; E31-I35 PolarHBondContact O-N 3.45Å; E32-I35 PolarHBondContact O-N 3.18Å; R33-I35 VanDerWaalsContact C-N 3.34Å; R33-I35 PolarHBondContact O-N 3.16Å; I35-A38 CarbonylContact O-C 3.54Å; I35-A38 PolarHBondContact O-N 2.94Å; I35-V39 WeakPolarHBondContact O-CG2 3.3Å; I35-V39 PolarHBondContact O-N 2.85Å
36	I	84.9	Confident	85.2	Confident	56 Å²	56	99.8 Å²	99.8	29%	0.287	49%	0.493	S	S	.	.	H	α-helix	trans	-67.3	-42.7	-178.6	-67.8	161.5	0	0	0	110.9	L25 L28 E32 R33 V39 M40	L25-I36 HydrophobicContact CD1-CB 4.09Å; L25-I36 HydrophobicContact CD1-CG2 3.74Å; L25-I36 HydrophobicContact CD2-CD1 4.47Å; L25-I36 HydrophobicContact CD2-CG2 3.92Å; L28-I36 HydrophobicContact CD1-CD1 3.65Å; L28-I36 HydrophobicContact CD2-CD1 4.1Å; L28-I36 HydrophobicContact CG-CD1 4.45Å; E32-I36 WeakPolarHBondContact O-CB 3.46Å; E32-I36 WeakPolarHBondContact O-CD1 3.34Å; E32-I36 VanDerWaalsContact O-CG1 3.3Å; E32-I36 WeakPolarHBondContact O-CG1 3.49Å; E32-I36 PolarHBondContact O-N 3.19Å; R33-I36 PolarHBondContact O-N 3.46Å; I36-V39 PolarHBondContact O-N 2.95Å; I36-V39 VanDerWaalsContact O-N 3.15Å; I36-M40 PolarHBondContact O-N 3.25Å
37	M	87	Confident	85.6	Confident	87 Å²	87	101.7 Å²	101.7	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-58.8	-47.6	172.1	-72.6	177.1	63	0	0	111.4	L25 R33 V39 M40 D41	L25-M37 HydrophobicContact CD1-CG 3.99Å; R33-M37 HydrophobicContact CG-CG 4.47Å; R33-M37 HydrophobicContact CG-SD 3.94Å; R33-M37 WeakPolarHBondContact O-CB 2.93Å; R33-M37 VanDerWaalsContact O-CG 3.31Å; R33-M37 WeakPolarHBondContact O-CG 3.19Å; R33-M37 PolarHBondContact O-N 3.41Å; M37-V39 PolarHBondContact O-N 2.9Å; M37-V39 VanDerWaalsContact O-N 3.13Å; M37-M40 PolarHBondContact O-N 3.23Å; M37-D41 PolarHBondContact O-N 2.72Å
38	A	89.3	Confident	85.9	Confident	44 Å²	44	101.1 Å²	101.1	36%	0.364	49%	0.491	S	S	.	.	H	α-helix	trans	-69	-8.2	177.7	0	0	0	0	0	114.7	N34 I35 R42	N34-A38 WeakPolarHBondContact O-CB 3.19Å; N34-A38 PolarHBondContact O-N 2.82Å; I35-A38 CarbonylContact O-C 3.54Å; I35-A38 PolarHBondContact O-N 2.94Å; A38-R42 PolarHBondContact O-NE 2.83Å; A38-R42 PolarHBondContact O-NH2 2.85Å
39	V	89	Confident	86.3	Confident	75 Å²	75	105 Å²	105	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-90.9	-45.3	165.8	169.7	0	0	0	0	110.4	I35 I36 M37 R42 Q43	I35-V39 WeakPolarHBondContact O-CG2 3.3Å; I35-V39 PolarHBondContact O-N 2.85Å; I36-V39 PolarHBondContact O-N 2.95Å; I36-V39 VanDerWaalsContact O-N 3.15Å; M37-V39 PolarHBondContact O-N 2.9Å; M37-V39 VanDerWaalsContact O-N 3.13Å; V39-R42 PolarHBondContact O-N 3.48Å; V39-Q43 WeakPolarHBondContact O-CB 3.28Å; V39-Q43 PolarHBondContact O-N 3.5Å
40	M	84.6	Confident	86	Confident	76 Å²	76	107.4 Å²	107.4	37%	0.374	51%	0.512	S	S	.	.	H	α-helix	trans	-62.3	-45.3	177.6	-72.4	-159.6	72.5	0	0	112.8	P23 I36 M37 R42 Q43 K44	P23-M40 HydrophobicContact CG-CE 4.35Å; P23-M40 HydrophobicContact CG-SD 3.65Å; I36-M40 PolarHBondContact O-N 3.25Å; M37-M40 PolarHBondContact O-N 3.23Å; M40-R42 PolarHBondContact O-N 3.25Å; M40-Q43 PolarHBondContact O-N 2.79Å; M40-K44 VanDerWaalsContact O-CB 3.3Å; M40-K44 WeakPolarHBondContact O-CB 3.48Å; M40-K44 PolarHBondContact O-N 2.55Å
41	D	87.8	Confident	86	Confident	98 Å²	98	105.2 Å²	105.2	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-61.1	-35.5	176.7	-75.5	-35.1	0	0	0	111.8	M37 K44 E45	M37-D41 PolarHBondContact O-N 2.72Å; D41-K44 PolarHBondContact O-N 3.08Å; D41-E45 PolarHBondContact O-N 2.89Å
42	R	87	Confident	85.9	Confident	149 Å²	149	100 Å²	100	56%	0.562	49%	0.486	S	S	*	.	H	α-helix	trans	-76	-37.9	179.5	-157.6	-175.9	-43.2	168	13.1	112.3	A38 V39 M40 K44 E45 E46	A38-R42 PolarHBondContact O-NE 2.83Å; A38-R42 PolarHBondContact O-NH2 2.85Å; V39-R42 PolarHBondContact O-N 3.48Å; M40-R42 PolarHBondContact O-N 3.25Å; R42-K44 VanDerWaalsContact C-N 3.31Å; R42-E45 PolarHBondContact O-N 3.27Å; R42-E46 PolarHBondContact O-N 2.84Å
43	Q	85.9	Confident	85.4	Confident	126 Å²	126	101.1 Å²	101.1	59%	0.589	49%	0.492	S	S	*	.	H	α-helix	trans	-64.2	-39.4	171.3	-174.1	-178.6	-37.9	0	0	110.6	V39 M40 E46 E47	V39-Q43 WeakPolarHBondContact O-CB 3.28Å; V39-Q43 PolarHBondContact O-N 3.5Å; M40-Q43 PolarHBondContact O-N 2.79Å; Q43-E46 PolarHBondContact O-N 2.94Å; Q43-E47 WeakPolarHBondContact O-CB 3.3Å; Q43-E47 PolarHBondContact O-N 3.21Å
44	K	87.3	Confident	85.1	Confident	125 Å²	125	102.7 Å²	102.7	54%	0.543	51%	0.506	S	S	.	.	H	α-helix	trans	-66.7	-38.2	174.1	-177	-178.6	174.8	-173.3	0	112.5	M40 D41 R42 E47 E48	M40-K44 VanDerWaalsContact O-CB 3.3Å; M40-K44 WeakPolarHBondContact O-CB 3.48Å; M40-K44 PolarHBondContact O-N 2.55Å; D41-K44 PolarHBondContact O-N 3.08Å; R42-K44 VanDerWaalsContact C-N 3.31Å; K44-E47 PolarHBondContact O-N 3.04Å; K44-E48 WeakPolarHBondContact O-CB 3.33Å; K44-E48 PolarHBondContact O-N 2.9Å
45	E	87.6	Confident	84.9	Confident	119 Å²	119	104 Å²	104	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-63.2	-41	172	-164.9	-159.1	145.2	0	0	111.3	D41 R42 K49	D41-E45 PolarHBondContact O-N 2.89Å; R42-E45 PolarHBondContact O-N 3.27Å; E45-K49 WeakPolarHBondContact O-CB 3.36Å; E45-K49 PolarHBondContact O-N 3.29Å; E45-K49 VanDerWaalsContact O-N 3.09Å
46	E	81.4	Confident	84.2	Confident	129 Å²	129	101.2 Å²	101.2	60%	0.603	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-40.3	173.7	-70.8	-164	131	0	0	112.3	R42 Q43 K49 E50	R42-E46 PolarHBondContact O-N 2.84Å; Q43-E46 PolarHBondContact O-N 2.94Å; E46-K49 WeakPolarHBondContact O-CB 3.42Å; E46-K49 PolarHBondContact O-N 3.16Å; E46-E50 PolarHBondContact O-N 3.07Å
47	E	83.2	Confident	83.6	Confident	113 Å²	113	102.7 Å²	102.7	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-66.7	-45.2	177.4	-171.4	170.3	-165.5	0	0	112.5	Q43 K44 K49 E50 E51	Q43-E47 WeakPolarHBondContact O-CB 3.3Å; Q43-E47 PolarHBondContact O-N 3.21Å; K44-E47 PolarHBondContact O-N 3.04Å; E47-K49 PolarHBondContact O-N 2.98Å; E47-E50 PolarHBondContact O-N 3.26Å; E47-E51 WeakPolarHBondContact O-CB 3.13Å; E47-E51 PolarHBondContact O-N 2.8Å
48	E	87.5	Confident	83	Confident	134 Å²	134	103.1 Å²	103.1	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-61.7	-34.6	174	-177.5	173.2	179.5	0	0	111.4	K44 E51 A52	K44-E48 WeakPolarHBondContact O-CB 3.33Å; K44-E48 PolarHBondContact O-N 2.9Å; E48-E51 PolarHBondContact O-N 2.84Å; E48-A52 WeakPolarHBondContact O-CB 3.3Å; E48-A52 PolarHBondContact O-N 2.78Å
49	K	86.8	Confident	82.2	Confident	120 Å²	120	108.4 Å²	108.4	52%	0.522	53%	0.527	S	S	.	.	H	α-helix	trans	-73.3	-36.4	177.7	-175.3	-179.5	-168	168.7	0	112.7	E45 E46 E47 M53	E45-K49 WeakPolarHBondContact O-CB 3.36Å; E45-K49 PolarHBondContact O-N 3.29Å; E45-K49 VanDerWaalsContact O-N 3.09Å; E46-K49 WeakPolarHBondContact O-CB 3.42Å; E46-K49 PolarHBondContact O-N 3.16Å; E47-K49 PolarHBondContact O-N 2.98Å; K49-M53 WeakPolarHBondContact O-CG 3.5Å; K49-M53 PolarHBondContact O-N 2.72Å
50	E	81	Confident	81.1	Confident	129 Å²	129	109.4 Å²	109.4	60%	0.603	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-43.6	168.5	-71	-156.9	149	0	0	111.3	E46 E47 A52 M53 L54	E46-E50 PolarHBondContact O-N 3.07Å; E47-E50 PolarHBondContact O-N 3.26Å; E50-A52 VanDerWaalsContact C-N 3.33Å; E50-A52 PolarHBondContact O-N 3.05Å; E50-M53 HydrophobicContact CG-CE 4.17Å; E50-M53 WeakPolarHBondContact O-CB 3.49Å; E50-M53 PolarHBondContact O-N 3.44Å; E50-M53 VanDerWaalsContact O-N 3.14Å; E50-L54 WeakPolarHBondContact O-CD1 3.31Å; E50-L54 PolarHBondContact O-N 3.19Å
51	E	83.8	Confident	80.1	Confident	99 Å²	99	113.4 Å²	113.4	46%	0.463	55%	0.549	S	S	.	.	H	α-helix	trans	-64.2	-37	176.8	-154.5	-144.9	176.2	0	0	111.9	E47 E48 L54 K55	E47-E51 WeakPolarHBondContact O-CB 3.13Å; E47-E51 PolarHBondContact O-N 2.8Å; E48-E51 PolarHBondContact O-N 2.84Å; E51-L54 PolarHBondContact O-N 3.36Å; E51-K55 HydrophobicContact CG-CD 4.47Å; E51-K55 WeakPolarHBondContact O-CB 3.35Å; E51-K55 VanDerWaalsContact O-CG 3.32Å; E51-K55 WeakPolarHBondContact O-CG 3.3Å; E51-K55 PolarHBondContact O-N 3.12Å; E51-K55 WeakPolarHBondContact OE1-CE 3.42Å; E51-K55 IonicContact OE1-NZ 2.66Å; E51-K55 PolarHBondContact OE1-NZ 2.93Å; E51-K55 WeakPolarHBondContact OE2-CE 3.26Å; E51-K55 IonicContact OE2-NZ 2.65Å; E51-K55 PolarHBondContact OE2-NZ 2.88Å
52	A	84.8	Confident	79.1	Confident	47 Å²	47	112.1 Å²	112.1	39%	0.388	55%	0.553	S	S	.	*	H	α-helix	trans	-66.1	-37	173.2	0	0	0	0	0	112.2	E48 E50 C56	E48-A52 WeakPolarHBondContact O-CB 3.3Å; E48-A52 PolarHBondContact O-N 2.78Å; E50-A52 VanDerWaalsContact C-N 3.33Å; E50-A52 PolarHBondContact O-N 3.05Å; A52-C56 PolarHBondContact O-N 2.93Å; A52-C56 PolarHBondContact O-SG 3.02Å
53	M	75.5	Confident	77.3	Confident	112 Å²	112	112 Å²	112	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-66.4	-43.8	171.5	-74.9	-169.9	-64.4	0	0	111.6	K49 E50 C56 V57	K49-M53 WeakPolarHBondContact O-CG 3.5Å; K49-M53 PolarHBondContact O-N 2.72Å; E50-M53 HydrophobicContact CG-CE 4.17Å; E50-M53 WeakPolarHBondContact O-CB 3.49Å; E50-M53 PolarHBondContact O-N 3.44Å; E50-M53 VanDerWaalsContact O-N 3.14Å; M53-C56 WeakPolarHBondContact O-CB 3.46Å; M53-C56 PolarHBondContact O-N 2.79Å; M53-V57 WeakPolarHBondContact O-CG2 3.22Å; M53-V57 PolarHBondContact O-N 3.47Å
54	L	78.1	Confident	75.3	Confident	116 Å²	116	111.3 Å²	111.3	61%	0.607	56%	0.563	S	S	*	*	H	α-helix	trans	-60.4	-47.7	173.5	-96	73.3	0	0	0	111.5	E50 E51 C56 V57 V58	E50-L54 WeakPolarHBondContact O-CD1 3.31Å; E50-L54 PolarHBondContact O-N 3.19Å; E51-L54 PolarHBondContact O-N 3.36Å; L54-C56 VanDerWaalsContact C-N 3.29Å; L54-C56 PolarHBondContact O-N 2.84Å; L54-V57 PolarHBondContact O-N 3.24Å; L54-V57 VanDerWaalsContact O-N 3.13Å; L54-V58 WeakPolarHBondContact O-CB 3.5Å; L54-V58 WeakPolarHBondContact O-CG2 3.29Å; L54-V58 PolarHBondContact O-N 2.87Å
55	K	82.7	Confident	73	Confident	117 Å²	117	110.3 Å²	110.3	51%	0.509	58%	0.578	S	S	.	*	H	α-helix	trans	-58.1	-39.2	176.1	-79.3	168.1	174	162.7	0	112	E51 R59	E51-K55 HydrophobicContact CG-CD 4.47Å; E51-K55 WeakPolarHBondContact O-CB 3.35Å; E51-K55 VanDerWaalsContact O-CG 3.32Å; E51-K55 WeakPolarHBondContact O-CG 3.3Å; E51-K55 PolarHBondContact O-N 3.12Å; E51-K55 WeakPolarHBondContact OE1-CE 3.42Å; E51-K55 IonicContact OE1-NZ 2.66Å; E51-K55 PolarHBondContact OE1-NZ 2.93Å; E51-K55 WeakPolarHBondContact OE2-CE 3.26Å; E51-K55 IonicContact OE2-NZ 2.65Å; E51-K55 PolarHBondContact OE2-NZ 2.88Å; K55-R59 WeakPolarHBondContact O-CB 3.41Å; K55-R59 PolarHBondContact O-N 3.48Å
56	C	73.2	Confident	70.8	Confident	55 Å²	55	108.8 Å²	108.8	37%	0.372	59%	0.586	S	S	.	*	H	α-helix	trans	-62.5	-50.5	172	-71.6	0	0	0	0	112.1	A52 M53 L54 V58 R59 D60	A52-C56 PolarHBondContact O-N 2.93Å; A52-C56 PolarHBondContact O-SG 3.02Å; M53-C56 WeakPolarHBondContact O-CB 3.46Å; M53-C56 PolarHBondContact O-N 2.79Å; L54-C56 VanDerWaalsContact C-N 3.29Å; L54-C56 PolarHBondContact O-N 2.84Å; C56-V58 PolarHBondContact O-N 3.48Å; C56-R59 PolarHBondContact O-N 3.24Å; C56-D60 WeakPolarHBondContact O-CB 3.26Å; C56-D60 VanDerWaalsContact O-CG 3.23Å; C56-D60 PolarHBondContact O-N 2.87Å
57	V	71.1	Confident	68.5	Low	86 Å²	86	108.5 Å²	108.5	52%	0.521	60%	0.597	S	S	.	*	H	α-helix	trans	-61.1	-46.9	-179.9	172.8	0	0	0	0	111.2	M53 L54 R59 D60 M61	M53-V57 WeakPolarHBondContact O-CG2 3.22Å; M53-V57 PolarHBondContact O-N 3.47Å; L54-V57 PolarHBondContact O-N 3.24Å; L54-V57 VanDerWaalsContact O-N 3.13Å; V57-R59 PolarHBondContact O-N 3.41Å; V57-D60 PolarHBondContact O-N 3.31Å; V57-M61 HydrophobicContact CG1-SD 4.03Å; V57-M61 WeakPolarHBondContact O-CB 3.42Å; V57-M61 WeakPolarHBondContact O-CG 3.46Å; V57-M61 PolarHBondContact O-N 2.99Å
58	V	76.1	Confident	66.6	Low	97 Å²	97	112.5 Å²	112.5	59%	0.588	61%	0.612	S	S	*	*	H	α-helix	trans	-60.4	-46.5	177.3	171.1	0	0	0	0	111.1	L54 C56 D60 M61 A62	L54-V58 WeakPolarHBondContact O-CB 3.5Å; L54-V58 WeakPolarHBondContact O-CG2 3.29Å; L54-V58 PolarHBondContact O-N 2.87Å; C56-V58 PolarHBondContact O-N 3.48Å; V58-D60 VanDerWaalsContact C-N 3.35Å; V58-D60 PolarHBondContact O-N 3.32Å; V58-M61 PolarHBondContact O-N 3.03Å; V58-A62 WeakPolarHBondContact O-CB 3.49Å; V58-A62 PolarHBondContact O-N 3.12Å
59	R	72.6	Confident	64.3	Low	155 Å²	155	112.5 Å²	112.5	59%	0.585	62%	0.622	S	S	*	*	H	α-helix	trans	-64.4	-38.6	179.2	-171.9	-158	69.4	-177.9	-4	112.5	K55 C56 V57 A62	K55-R59 WeakPolarHBondContact O-CB 3.41Å; K55-R59 PolarHBondContact O-N 3.48Å; C56-R59 PolarHBondContact O-N 3.24Å; V57-R59 PolarHBondContact O-N 3.41Å; R59-A62 PolarHBondContact O-N 2.9Å
60	D	65.2	Low	62.5	Low	95 Å²	95	112.3 Å²	112.3	51%	0.508	63%	0.632	S	S	.	*	H	α-helix	trans	-77.4	-25.8	-178.5	-65.6	-8.2	0	0	0	111.5	C56 V57 V58	C56-D60 WeakPolarHBondContact O-CB 3.26Å; C56-D60 VanDerWaalsContact O-CG 3.23Å; C56-D60 PolarHBondContact O-N 2.87Å; V57-D60 PolarHBondContact O-N 3.31Å; V58-D60 VanDerWaalsContact C-N 3.35Å; V58-D60 PolarHBondContact O-N 3.32Å
61	M	63.6	Low	60.5	Low	160 Å²	160	117.4 Å²	117.4	79%	0.788	65%	0.646	S	S	*	*	H	α-helix	trans	-77.1	-33.5	167.6	-69.9	-176.7	75.2	0	0	113.5	V57 V58 K63	V57-M61 HydrophobicContact CG1-SD 4.03Å; V57-M61 WeakPolarHBondContact O-CB 3.42Å; V57-M61 WeakPolarHBondContact O-CG 3.46Å; V57-M61 PolarHBondContact O-N 2.99Å; V58-M61 PolarHBondContact O-N 3.03Å; M61-K63 PolarHBondContact O-N 3.25Å
62	A	67.2	Low	58.3	Low	72 Å²	72	119.9 Å²	119.9	60%	0.595	66%	0.663	S	S	*	*	S	Bend	trans	-80.4	13.6	-174.3	0	0	0	0	0	115.2	V58 R59 P64	V58-A62 WeakPolarHBondContact O-CB 3.49Å; V58-A62 PolarHBondContact O-N 3.12Å; R59-A62 PolarHBondContact O-N 2.9Å; A62-P64 WeakPolarHBondContact O-CD 3.23Å
63	K	49.4	Very low	56.2	Low	145 Å²	145	121.1 Å²	121.1	63%	0.63	67%	0.673	S	S	*	*			trans	-107.7	94.6	-168.2	-160	174.3	-172.2	179.6	0	112.6	M61	M61-K63 PolarHBondContact O-N 3.25Å
64	P	43.3	Very low	54.4	Low	113 Å²	113	123.7 Å²	123.7	73%	0.734	68%	0.684	S	S	*	*			trans	-71.2	140.2	-180	29.4	-35.4	0	0	0	112.1	A62 A66	A62-P64 WeakPolarHBondContact O-CD 3.23Å; P64-A66 PolarHBondContact O-N 3.2Å
65	A	39.7	Very low	52.5	Low	103 Å²	103	123.6 Å²	123.6	85%	0.851	69%	0.692	S	S	*	*			trans	-76.5	90.2	179.6	0	0	0	0	0	112	C67	A65-C67 PolarHBondContact O-N 3.39Å
66	A	41	Very low	50.4	Low	88 Å²	88	126.4 Å²	126.4	73%	0.727	71%	0.707	S	S	*	*			trans	-86.8	97.4	174.1	0	0	0	0	0	111.6	P64	P64-A66 PolarHBondContact O-N 3.2Å
67	C	32.4	Very low	48.8	Very low	123 Å²	123	128.6 Å²	128.6	83%	0.831	72%	0.721	S	S	*	*			trans	-65.9	138.6	173.2	-64	0	0	0	0	111.7	A65	A65-C67 PolarHBondContact O-N 3.39Å
68	K	44.1	Very low	47.1	Very low	196 Å²	196	133.5 Å²	133.5	85%	0.852	74%	0.738	S	S	*	*			trans	-128.8	126.7	170.4	-70.4	-173	177.3	-177.2	0	110
69	T	39.1	Very low	45.2	Very low	135 Å²	135	137.6 Å²	137.6	83%	0.828	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-102.5	135.4	-172.4	-35.3	0	0	0	0	111.6
70	P	48.9	Very low	43.4	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-86.8	158.5	164	34	-31.5	0	0	0	112.3
71	R	39.9	Very low	42.3	Very low	237 Å²	237	136.4 Å²	136.4	89%	0.894	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.2	144.6	175.3	-74.7	172.6	170.9	167.2	-5.4	110.7
72	N	37.4	Very low	41	Very low	151 Å²	151	136.3 Å²	136.3	81%	0.807	77%	0.77	S	S	*	*				56.6	133.2	81.5	-125.6	44.2	0	0	0	112.9
73	A	39.5	Very low	39.6	Very low	73 Å²	73	139.4 Å²	139.4	60%	0.603	78%	0.776	S	S	*	*			cis	-153.5	147	10.4	0	0	0	0	0	109.2
74	E	38	Very low	39	Very low	166 Å²	166	139.2 Å²	139.2	78%	0.776	78%	0.781	S	S	*	*				93.6	113.7	86	-176.1	178.8	136.4	0	0	115.9
75	S	38.7	Very low	38.6	Very low	113 Å²	113	144.3 Å²	144.3	79%	0.79	79%	0.792	S	S	*	*			trans	154.4	139.5	148.8	-73.4	0	0	0	0	111
76	Q	38.2	Very low	38.5	Very low	176 Å²	176	149.4 Å²	149.4	82%	0.822	79%	0.789	S	S	*	*			cis	-152.1	166.7	-29.1	-105.5	-146.5	5.3	0	0	108.5
77	P	39.5	Very low	38.1	Very low	102 Å²	102	150.8 Å²	150.8	66%	0.662	79%	0.792	S	S	*	*			trans	-127.1	152.4	-153.4	40.8	-27.9	0	0	0	118.8
78	H	36.1	Very low	38.3	Very low	189 Å²	189	149.6 Å²	149.6	88%	0.875	78%	0.781	S	S	*	*			trans	-147.6	143.5	152.5	-61.2	-57.2	0	0	0	108.2
79	Q	35.2	Very low	37.9	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	78%	0.778	S	S	*	*			cis	-147.9	158.1	-9.7	-129.1	-176.6	-1.2	0	0	108.9
80	P	35.2	Very low	37.8	Very low	115 Å²	115	144.2 Å²	144.2	75%	0.747	77%	0.768	S	S	*	*			trans	-121.7	-154.8	-168.2	36.1	-15.9	0	0	0	113
81	P	42	Very low	37.4	Very low	110 Å²	110	144.3 Å²	144.3	71%	0.714	77%	0.768	S	S	*	*				-129.3	175.7	-69.7	38.8	-24.6	0	0	0	113.4
82	L	35.5	Very low	37.1	Very low	158 Å²	158	143.4 Å²	143.4	83%	0.827	77%	0.765	S	S	*	*			trans	-150.2	138.8	147.2	-86.1	-168.4	0	0	0	113.8
83	N	38.9	Very low	36.9	Very low	137 Å²	137	145 Å²	145	73%	0.733	77%	0.765	S	S	*	*			trans	3	121.9	162.5	-50.8	-21.5	0	0	0	117.9
84	I	37.2	Very low	36.7	Very low	142 Å²	142	147.5 Å²	147.5	73%	0.728	78%	0.775	S	S	*	*			cis	63.3	87.4	41.6	-45.6	-179.9	0	0	0	113.9	R86	I84-R86 HydrophobicContact CG2-CB 4.26Å
85	F	34.2	Very low	36.5	Very low	219 Å²	219	144.7 Å²	144.7	96%	0.961	77%	0.773	S	S	*	*			trans	-118.5	103.3	140.4	-112.7	-87.4	0	0	0	108.2	C87	F85-C87 PolarHBondContact O-N 2.87Å
86	R	38.1	Very low	36.1	Very low	210 Å²	210	145 Å²	145	79%	0.792	78%	0.775	S	S	*	*			trans	-95.4	79	-172	-172.4	179.3	-179.9	156.6	-0.4	110.5	I84 V88	I84-R86 HydrophobicContact CG2-CB 4.26Å; R86-V88 HydrophobicContact CG-CG2 4.41Å; R86-V88 WeakPolarHBondContact O-CG2 3.31Å; R86-V88 PolarHBondContact O-N 3Å; R86-V88 VanDerWaalsContact O-N 3.11Å
87	C	32.4	Very low	36	Very low	118 Å²	118	143 Å²	143	80%	0.797	77%	0.766	S	S	*	*			trans	-62.4	114.3	167.3	-171.5	0	0	0	0	108.7	F85 C89	F85-C87 PolarHBondContact O-N 2.87Å; C87-C89 PolarHBondContact O-N 3.25Å; C87-C89 VanDerWaalsContact O-N 3.12Å
88	V	36.2	Very low	35.6	Very low	98 Å²	98	145.7 Å²	145.7	59%	0.594	77%	0.77	S	S	*	*			trans	-84.8	93.4	-173.2	-168.4	0	0	0	0	109.2	R86 V90	R86-V88 HydrophobicContact CG-CG2 4.41Å; R86-V88 WeakPolarHBondContact O-CG2 3.31Å; R86-V88 PolarHBondContact O-N 3Å; R86-V88 VanDerWaalsContact O-N 3.11Å; V88-V90 HydrophobicContact CB-CG2 4.31Å; V88-V90 HydrophobicContact CG1-CG2 3.58Å; V88-V90 PolarHBondContact O-N 3.17Å
89	C	36.9	Very low	35.6	Very low	118 Å²	118	140.4 Å²	140.4	80%	0.797	77%	0.767	S	S	*	*			trans	-63.2	78.2	159.3	-68	0	0	0	0	109.4	C87 P91	C87-C89 PolarHBondContact O-N 3.25Å; C87-C89 VanDerWaalsContact O-N 3.12Å; C89-P91 VanDerWaalsContact O-CD 3.24Å; C89-P91 WeakPolarHBondContact O-CD 3.41Å
90	V	35.7	Very low	35.7	Very low	99 Å²	99	133.2 Å²	133.2	60%	0.6	74%	0.742	S	S	*	*			trans	-64.7	118.3	169.9	179.6	0	0	0	0	106.8	V88 R92	V88-V90 HydrophobicContact CB-CG2 4.31Å; V88-V90 HydrophobicContact CG1-CG2 3.58Å; V88-V90 PolarHBondContact O-N 3.17Å; V90-R92 PolarHBondContact O-N 2.72Å
91	P	40.2	Very low	36.3	Very low	118 Å²	118	133.1 Å²	133.1	77%	0.766	74%	0.741	S	S	*	*			trans	-68	91.4	166.7	29.3	-32.4	0	0	0	107.2	C89 K93	C89-P91 VanDerWaalsContact O-CD 3.24Å; C89-P91 WeakPolarHBondContact O-CD 3.41Å; P91-K93 PolarHBondContact O-N 2.74Å
92	R	34	Very low	36.9	Very low	218 Å²	218	133.5 Å²	133.5	82%	0.823	74%	0.737	S	S	*	*			trans	-60	107.1	171.6	-97.4	-170.9	165.8	-159.2	-6.1	106.9	V90	V90-R92 PolarHBondContact O-N 2.72Å
93	K	32.5	Very low	37.7	Very low	184 Å²	184	131.8 Å²	131.8	80%	0.8	72%	0.72	S	S	*	*			trans	-45.8	143.6	172.3	-66.4	178.8	177.4	179	0	108.9	P91 S95	P91-K93 PolarHBondContact O-N 2.74Å; K93-S95 PolarHBondContact O-N 2.95Å
94	P	36.9	Very low	38.7	Very low	125 Å²	125	129.4 Å²	129.4	81%	0.812	71%	0.707	S	S	*	*			trans	-56.4	112.8	160.6	26.6	-32.7	0	0	0	107.1	S96	P94-S96 PolarHBondContact O-N 2.67Å
95	S	32.7	Very low	39.9	Very low	107 Å²	107	131 Å²	131	75%	0.748	70%	0.703	S	S	*	*			trans	-67.8	114.9	177.3	51.5	0	0	0	0	107.9	K93 E97	K93-S95 PolarHBondContact O-N 2.95Å; S95-E97 PolarHBondContact O-N 2.9Å
96	S	30	Very low	41.8	Very low	119 Å²	119	129.1 Å²	129.1	83%	0.832	69%	0.69	S	S	*	*			trans	-58.4	94.7	-178.8	-50.2	0	0	0	0	111.4	P94	P94-S96 PolarHBondContact O-N 2.67Å
97	E	37.5	Very low	43.3	Very low	136 Å²	136	124.1 Å²	124.1	64%	0.636	68%	0.679	S	S	*	*			trans	-93.3	110.6	158.3	-81.6	-135.2	118.2	0	0	107.8	S95 G99 R103	S95-E97 PolarHBondContact O-N 2.9Å; E97-G99 PolarHBondContact O-N 2.75Å; E97-G99 VanDerWaalsContact O-N 3.07Å; E97-R103 IonicContact OE1-CZ 3.38Å; E97-R103 IonicContact OE1-NH2 3.11Å; E97-R103 PolarHBondContact OE1-NH2 3.11Å; E97-R103 IonicContact OE2-CZ 2.81Å; E97-R103 IonicContact OE2-NH1 3.85Å; E97-R103 PolarHBondContact OE2-NH1 2.95Å; E97-R103 VanDerWaalsContact OE2-NH1 3.08Å; E97-R103 IonicContact OE2-NH2 2.76Å; E97-R103 PolarHBondContact OE2-NH2 2.99Å
98	E	31.2	Very low	45.3	Very low	157 Å²	157	122.4 Å²	122.4	73%	0.734	66%	0.659	S	S	*	*			trans	-66.9	110	-166.9	-60.8	-174.1	130.5	0	0	112.4	G100 R103	E98-G100 PolarHBondContact O-N 3Å; E98-G100 VanDerWaalsContact O-N 3.11Å; E98-R103 WeakPolarHBondContact O-CD 3.45Å; E98-R103 WeakPolarHBondContact O-CG 3.49Å; E98-R103 PolarHBondContact O-NE 2.71Å
99	G	34.4	Very low	47.3	Very low	79 Å²	79	123.3 Å²	123.3	81%	0.814	66%	0.656	S	S	*	*			trans	-75.6	26.3	167	0	0	0	0	0	113.7	E97	E97-G99 PolarHBondContact O-N 2.75Å; E97-G99 VanDerWaalsContact O-N 3.07Å
100	G	37.4	Very low	49.3	Very low	31 Å²	31	123.9 Å²	123.9	32%	0.32	65%	0.648	S	S	.	*	S	Bend	trans	-71.4	169	177.5	0	0	0	0	0	112.8	E98 D102 R103	E98-G100 PolarHBondContact O-N 3Å; E98-G100 VanDerWaalsContact O-N 3.11Å; G100-D102 PolarHBondContact O-N 3.37Å; G100-R103 PolarHBondContact O-N 2.94Å; G100-R103 VanDerWaalsContact O-N 3.09Å
101	P	49.6	Very low	51.1	Low	113 Å²	113	123.3 Å²	123.3	73%	0.734	64%	0.637	S	S	*	*	H	α-helix	trans	-56.2	-25.3	179.4	22.4	-32.9	0	0	0	113.4	R103 N104 W105	P101-R103 VanDerWaalsContact C-N 3.3Å; P101-R103 PolarHBondContact O-N 2.97Å; P101-N104 WeakPolarHBondContact O-CA 3.2Å; P101-N104 VanDerWaalsContact O-CB 3.29Å; P101-N104 WeakPolarHBondContact O-CB 3.4Å; P101-N104 PolarHBondContact O-N 3.25Å; P101-W105 PolarHBondContact O-N 3.2Å
102	D	53.3	Low	53.1	Low	117 Å²	117	121.5 Å²	121.5	63%	0.626	62%	0.618	S	S	*	*	H	α-helix	trans	-54.6	-35.9	173.6	-96.5	-61.2	0	0	0	114.8	G100 N104 W105 R106	G100-D102 PolarHBondContact O-N 3.37Å; D102-N104 PolarHBondContact O-N 3.37Å; D102-W105 PolarHBondContact O-N 2.95Å; D102-R106 WeakPolarHBondContact O-CB 3.37Å; D102-R106 PolarHBondContact O-N 2.8Å
103	R	52.5	Low	55.4	Low	123 Å²	123	114.7 Å²	114.7	46%	0.464	60%	0.604	S	S	.	*	H	α-helix	trans	-64.1	-31.4	174.6	-85.8	-167.1	167.4	-162.5	-16.6	111.9	E97 E98 G100 P101 L107	E97-R103 IonicContact OE1-CZ 3.38Å; E97-R103 IonicContact OE1-NH2 3.11Å; E97-R103 PolarHBondContact OE1-NH2 3.11Å; E97-R103 IonicContact OE2-CZ 2.81Å; E97-R103 IonicContact OE2-NH1 3.85Å; E97-R103 PolarHBondContact OE2-NH1 2.95Å; E97-R103 VanDerWaalsContact OE2-NH1 3.08Å; E97-R103 IonicContact OE2-NH2 2.76Å; E97-R103 PolarHBondContact OE2-NH2 2.99Å; E98-R103 WeakPolarHBondContact O-CD 3.45Å; E98-R103 WeakPolarHBondContact O-CG 3.49Å; E98-R103 PolarHBondContact O-NE 2.71Å; G100-R103 PolarHBondContact O-N 2.94Å; G100-R103 VanDerWaalsContact O-N 3.09Å; P101-R103 VanDerWaalsContact C-N 3.3Å; P101-R103 PolarHBondContact O-N 2.97Å; R103-L107 WeakPolarHBondContact O-CB 3.33Å; R103-L107 PolarHBondContact O-N 3.04Å
104	N	59.2	Low	57.7	Low	86 Å²	86	112.4 Å²	112.4	46%	0.46	59%	0.592	S	S	.	*	H	α-helix	trans	-77.7	-41.6	176.8	-149.2	4.4	0	0	0	110.9	P101 D102 L107 H108	P101-N104 WeakPolarHBondContact O-CA 3.2Å; P101-N104 VanDerWaalsContact O-CB 3.29Å; P101-N104 WeakPolarHBondContact O-CB 3.4Å; P101-N104 PolarHBondContact O-N 3.25Å; D102-N104 PolarHBondContact O-N 3.37Å; N104-L107 PolarHBondContact O-N 3.33Å; N104-H108 WeakPolarHBondContact O-CB 3.3Å; N104-H108 PolarHBondContact O-N 3.15Å
105	W	64	Low	59.9	Low	175 Å²	175	110.9 Å²	110.9	66%	0.663	57%	0.572	S	S	*	*	H	α-helix	trans	-57.5	-48.5	171.9	175.1	-105.9	0	0	0	112.1	P101 D102 L107 H108 Q109	P101-W105 PolarHBondContact O-N 3.2Å; D102-W105 PolarHBondContact O-N 2.95Å; W105-L107 VanDerWaalsContact C-N 3.34Å; W105-L107 PolarHBondContact O-N 2.68Å; W105-H108 CarbonylContact O-C 3.53Å; W105-H108 WeakPolarHBondContact O-CA 3.48Å; W105-H108 WeakPolarHBondContact O-CB 3.46Å; W105-H108 PolarHBondContact O-N 3.1Å; W105-Q109 PolarHBondContact O-N 2.86Å
106	R	72.4	Confident	62.3	Low	180 Å²	180	110 Å²	110	68%	0.679	56%	0.556	S	S	*	*	H	α-helix	trans	-67.1	-33.2	-179.8	-158.6	170	-171.3	174.3	2.2	112.7	D102 Q110	D102-R106 WeakPolarHBondContact O-CB 3.37Å; D102-R106 PolarHBondContact O-N 2.8Å; R106-Q110 WeakPolarHBondContact O-CG 3.34Å; R106-Q110 PolarHBondContact O-N 3.08Å
107	L	70.6	Confident	64.7	Low	106 Å²	106	109.7 Å²	109.7	56%	0.555	54%	0.542	S	S	*	.	H	α-helix	trans	-64.9	-41.6	168.4	-94.1	163.1	0	0	0	112	R103 N104 W105 Q110 F111	R103-L107 WeakPolarHBondContact O-CB 3.33Å; R103-L107 PolarHBondContact O-N 3.04Å; N104-L107 PolarHBondContact O-N 3.33Å; W105-L107 VanDerWaalsContact C-N 3.34Å; W105-L107 PolarHBondContact O-N 2.68Å; L107-Q110 PolarHBondContact O-N 3.37Å; L107-F111 PolarHBondContact O-N 3.07Å
108	H	73.4	Confident	66.7	Low	82 Å²	82	106.3 Å²	106.3	38%	0.38	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-44.3	176.2	-143.2	104.7	0	0	0	111.4	N104 W105 Q110 F111 E112	N104-H108 WeakPolarHBondContact O-CB 3.3Å; N104-H108 PolarHBondContact O-N 3.15Å; W105-H108 CarbonylContact O-C 3.53Å; W105-H108 WeakPolarHBondContact O-CA 3.48Å; W105-H108 WeakPolarHBondContact O-CB 3.46Å; W105-H108 PolarHBondContact O-N 3.1Å; H108-Q110 PolarHBondContact O-N 2.79Å; H108-F111 WeakPolarHBondContact O-CB 3.37Å; H108-F111 PolarHBondContact O-N 3.36Å; H108-F111 VanDerWaalsContact O-N 3.07Å; H108-E112 PolarHBondContact O-N 3.34Å
109	Q	79.9	Confident	69.2	Low	116 Å²	116	105.2 Å²	105.2	54%	0.542	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-39.1	176.7	-165.8	-178.8	45.1	0	0	112	W105 F111 S113	W105-Q109 PolarHBondContact O-N 2.86Å; Q109-F111 VanDerWaalsContact C-N 3.34Å; Q109-S113 WeakPolarHBondContact O-CB 3.45Å; Q109-S113 PolarHBondContact O-N 2.91Å
110	Q	77.3	Confident	71.4	Confident	131 Å²	131	107.3 Å²	107.3	61%	0.612	51%	0.506	S	S	*	.	H	α-helix	trans	-64.8	-35.9	170.3	-78.2	-171.3	-28.1	0	0	112.6	R106 L107 H108 Y114	R106-Q110 WeakPolarHBondContact O-CG 3.34Å; R106-Q110 PolarHBondContact O-N 3.08Å; L107-Q110 PolarHBondContact O-N 3.37Å; H108-Q110 PolarHBondContact O-N 2.79Å; Q110-Y114 WeakPolarHBondContact O-CB 3.18Å; Q110-Y114 PolarHBondContact O-N 2.95Å
111	F	75	Confident	73.3	Confident	87 Å²	87	110.5 Å²	110.5	38%	0.382	52%	0.515	S	S	.	.	H	α-helix	trans	-70.8	-42	178.7	-139.5	-83.8	0	0	0	112.3	L107 H108 Q109 Y114 K115 Q191 I194	L107-F111 PolarHBondContact O-N 3.07Å; H108-F111 WeakPolarHBondContact O-CB 3.37Å; H108-F111 PolarHBondContact O-N 3.36Å; H108-F111 VanDerWaalsContact O-N 3.07Å; Q109-F111 VanDerWaalsContact C-N 3.34Å; F111-Y114 PolarHBondContact O-N 3.49Å; F111-K115 WeakPolarHBondContact O-CB 3.38Å; F111-K115 PolarHBondContact O-N 2.89Å; F111-Q191 HydrophobicContact CE1-CG 4.46Å; F111-I194 HydrophobicContact CD2-CD1 4.48Å; F111-I194 HydrophobicContact CE2-CD1 3.93Å; F111-I194 HydrophobicContact CZ-CD1 4.05Å
112	E	80.9	Confident	74.7	Confident	79 Å²	79	106.8 Å²	106.8	37%	0.369	50%	0.496	S	S	.	.	H	α-helix	trans	-69.3	-37.5	173.9	-68.7	-60.5	120.8	0	0	111.7	H108 K115 E116	H108-E112 PolarHBondContact O-N 3.34Å; E112-K115 WeakPolarHBondContact O-CB 3.43Å; E112-K115 PolarHBondContact O-N 2.85Å; E112-K115 WeakPolarHBondContact OE1-CD 3.27Å; E112-K115 WeakPolarHBondContact OE1-CE 3.33Å; E112-K115 IonicContact OE1-NZ 2.68Å; E112-K115 PolarHBondContact OE1-NZ 2.91Å; E112-K115 WeakPolarHBondContact OE2-CD 3.5Å; E112-K115 IonicContact OE2-NZ 2.69Å; E112-K115 PolarHBondContact OE2-NZ 3.33Å; E112-E116 WeakPolarHBondContact O-CB 3.34Å; E112-E116 PolarHBondContact O-N 2.94Å
113	S	82.8	Confident	75.9	Confident	75 Å²	75	104.6 Å²	104.6	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-60.5	-44	171.2	178.6	0	0	0	0	112.2	Q109 K115 E116 Q117	Q109-S113 WeakPolarHBondContact O-CB 3.45Å; Q109-S113 PolarHBondContact O-N 2.91Å; S113-K115 PolarHBondContact O-N 2.98Å; S113-E116 WeakPolarHBondContact O-CB 3.41Å; S113-E116 PolarHBondContact O-N 3.26Å; S113-Q117 WeakPolarHBondContact O-CB 3.42Å; S113-Q117 PolarHBondContact O-N 3.22Å
114	Y	81.3	Confident	76.8	Confident	137 Å²	137	102.9 Å²	102.9	54%	0.537	48%	0.48	S	S	.	.	H	α-helix	trans	-66.2	-36.3	174.5	-179.3	-106.6	0	0	0	112.7	Q110 F111 Q117 V118	Q110-Y114 WeakPolarHBondContact O-CB 3.18Å; Q110-Y114 PolarHBondContact O-N 2.95Å; F111-Y114 PolarHBondContact O-N 3.49Å; Y114-Q117 PolarHBondContact O-N 3.16Å; Y114-V118 HydrophobicContact CD1-CG2 4.25Å; Y114-V118 HydrophobicContact CE1-CG2 3.81Å; Y114-V118 HydrophobicContact CE2-CG2 4.11Å; Y114-V118 WeakPolarHBondContact O-CB 3.49Å; Y114-V118 VanDerWaalsContact O-CG2 3.32Å; Y114-V118 WeakPolarHBondContact O-CG2 3.39Å; Y114-V118 PolarHBondContact O-N 2.86Å
115	K	82.6	Confident	77.4	Confident	92 Å²	92	101.2 Å²	101.2	40%	0.4	48%	0.478	S	S	.	.	H	α-helix	trans	-69.9	-36.6	177.1	-179.6	-171.5	171.3	-158.6	0	112	F111 E112 S113 R119	F111-K115 WeakPolarHBondContact O-CB 3.38Å; F111-K115 PolarHBondContact O-N 2.89Å; E112-K115 WeakPolarHBondContact O-CB 3.43Å; E112-K115 PolarHBondContact O-N 2.85Å; E112-K115 WeakPolarHBondContact OE1-CD 3.27Å; E112-K115 WeakPolarHBondContact OE1-CE 3.33Å; E112-K115 IonicContact OE1-NZ 2.68Å; E112-K115 PolarHBondContact OE1-NZ 2.91Å; E112-K115 WeakPolarHBondContact OE2-CD 3.5Å; E112-K115 IonicContact OE2-NZ 2.69Å; E112-K115 PolarHBondContact OE2-NZ 3.33Å; S113-K115 PolarHBondContact O-N 2.98Å; K115-R119 PolarHBondContact O-N 3.27Å
116	E	83.4	Confident	77.6	Confident	90 Å²	90	101.3 Å²	101.3	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-62.7	-48.2	166.9	-177.1	63	-116.3	0	0	110.5	E112 S113 V118 R119 K120	E112-E116 WeakPolarHBondContact O-CB 3.34Å; E112-E116 PolarHBondContact O-N 2.94Å; S113-E116 WeakPolarHBondContact O-CB 3.41Å; S113-E116 PolarHBondContact O-N 3.26Å; E116-V118 PolarHBondContact O-N 3.5Å; E116-R119 CarbonylContact O-C 3.38Å; E116-R119 WeakPolarHBondContact O-CB 3.47Å; E116-R119 PolarHBondContact O-N 3.44Å; E116-R119 VanDerWaalsContact O-N 3.11Å; E116-R119 IonicContact OE1-CZ 3.36Å; E116-R119 IonicContact OE1-NH1 2.71Å; E116-R119 PolarHBondContact OE1-NH1 2.92Å; E116-R119 IonicContact OE1-NH2 3.64Å; E116-R119 IonicContact OE2-CZ 3.17Å; E116-R119 IonicContact OE2-NH1 2.9Å; E116-R119 PolarHBondContact OE2-NH1 3.33Å; E116-R119 IonicContact OE2-NH2 2.67Å; E116-R119 PolarHBondContact OE2-NH2 3.13Å; E116-K120 WeakPolarHBondContact O-CB 3.06Å; E116-K120 PolarHBondContact O-N 2.83Å
117	Q	79.7	Confident	77.1	Confident	112 Å²	112	100.9 Å²	100.9	52%	0.523	48%	0.477	S	S	.	.	H	α-helix	trans	-61.6	-40.7	178.1	-165.9	176.8	28.9	0	0	112.6	S113 Y114 K120 I121	S113-Q117 WeakPolarHBondContact O-CB 3.42Å; S113-Q117 PolarHBondContact O-N 3.22Å; Y114-Q117 PolarHBondContact O-N 3.16Å; Q117-K120 PolarHBondContact O-N 3.07Å; Q117-I121 HydrophobicContact CG-CD1 4.15Å; Q117-I121 WeakPolarHBondContact O-CB 3.16Å; Q117-I121 VanDerWaalsContact O-CG1 3.28Å; Q117-I121 WeakPolarHBondContact O-CG1 3.49Å; Q117-I121 PolarHBondContact O-N 2.89Å
118	V	79.5	Confident	76.4	Confident	65 Å²	65	105.2 Å²	105.2	39%	0.394	49%	0.487	S	S	.	.	H	α-helix	trans	-66.9	-37.6	173.5	168.8	0	0	0	0	111.5	Y114 E116 G122	Y114-V118 HydrophobicContact CD1-CG2 4.25Å; Y114-V118 HydrophobicContact CE1-CG2 3.81Å; Y114-V118 HydrophobicContact CE2-CG2 4.11Å; Y114-V118 WeakPolarHBondContact O-CB 3.49Å; Y114-V118 VanDerWaalsContact O-CG2 3.32Å; Y114-V118 WeakPolarHBondContact O-CG2 3.39Å; Y114-V118 PolarHBondContact O-N 2.86Å; E116-V118 PolarHBondContact O-N 3.5Å; V118-G122 PolarHBondContact O-N 3.26Å
119	R	83.3	Confident	75.1	Confident	133 Å²	133	106.9 Å²	106.9	50%	0.502	50%	0.495	S	S	.	.	H	α-helix	trans	-63.2	-46.8	172.5	-161.9	-154	-49.9	128.1	15.4	110.6	K115 E116 G122 E123	K115-R119 PolarHBondContact O-N 3.27Å; E116-R119 CarbonylContact O-C 3.38Å; E116-R119 WeakPolarHBondContact O-CB 3.47Å; E116-R119 PolarHBondContact O-N 3.44Å; E116-R119 VanDerWaalsContact O-N 3.11Å; E116-R119 IonicContact OE1-CZ 3.36Å; E116-R119 IonicContact OE1-NH1 2.71Å; E116-R119 PolarHBondContact OE1-NH1 2.92Å; E116-R119 IonicContact OE1-NH2 3.64Å; E116-R119 IonicContact OE2-CZ 3.17Å; E116-R119 IonicContact OE2-NH1 2.9Å; E116-R119 PolarHBondContact OE2-NH1 3.33Å; E116-R119 IonicContact OE2-NH2 2.67Å; E116-R119 PolarHBondContact OE2-NH2 3.13Å; R119-G122 CarbonylContact O-C 3.58Å; R119-G122 PolarHBondContact O-N 3.15Å; R119-E123 WeakPolarHBondContact O-CB 3.46Å; R119-E123 PolarHBondContact O-N 2.82Å
120	K	81.4	Confident	73.3	Confident	123 Å²	123	104 Å²	104	54%	0.535	50%	0.497	S	S	.	.	H	α-helix	trans	-59.4	-50.1	178.6	-172.8	177.6	177	-177.4	0	111	E116 Q117 G122 E123 E124	E116-K120 WeakPolarHBondContact O-CB 3.06Å; E116-K120 PolarHBondContact O-N 2.83Å; Q117-K120 PolarHBondContact O-N 3.07Å; K120-G122 VanDerWaalsContact C-N 3.31Å; K120-G122 PolarHBondContact O-N 2.89Å; K120-E123 CarbonylContact O-C 3.5Å; K120-E123 PolarHBondContact O-N 3.24Å; K120-E124 WeakPolarHBondContact O-CB 3.47Å; K120-E124 PolarHBondContact O-N 2.97Å
121	I	77.6	Confident	71.3	Confident	99 Å²	99	107.2 Å²	107.2	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-59	-42.6	175.6	-68.2	164	0	0	0	111.1	Q117 E123 A125	Q117-I121 HydrophobicContact CG-CD1 4.15Å; Q117-I121 WeakPolarHBondContact O-CB 3.16Å; Q117-I121 VanDerWaalsContact O-CG1 3.28Å; Q117-I121 WeakPolarHBondContact O-CG1 3.49Å; Q117-I121 PolarHBondContact O-N 2.89Å; I121-E123 PolarHBondContact O-N 3.07Å; I121-A125 VanDerWaalsContact O-CB 3.27Å; I121-A125 WeakPolarHBondContact O-CB 3.46Å; I121-A125 PolarHBondContact O-N 3.45Å
122	G	79.6	Confident	69.8	Low	34 Å²	34	110.7 Å²	110.7	35%	0.351	53%	0.529	S	S	.	.	H	α-helix	trans	-72.1	-3.7	175.8	0	0	0	0	0	115.3	V118 R119 K120 R126	V118-G122 PolarHBondContact O-N 3.26Å; R119-G122 CarbonylContact O-C 3.58Å; R119-G122 PolarHBondContact O-N 3.15Å; K120-G122 VanDerWaalsContact C-N 3.31Å; K120-G122 PolarHBondContact O-N 2.89Å; G122-R126 PolarHBondContact O-NE 3.35Å; G122-R126 PolarHBondContact O-NH2 2.94Å
123	E	76.8	Confident	67.9	Low	72 Å²	72	115.3 Å²	115.3	34%	0.336	55%	0.548	S	S	.	.	H	α-helix	trans	-111.8	-35	175.6	-159.4	-177	-101.6	0	0	111.1	R119 K120 I121 R126 R127	R119-E123 WeakPolarHBondContact O-CB 3.46Å; R119-E123 PolarHBondContact O-N 2.82Å; K120-E123 CarbonylContact O-C 3.5Å; K120-E123 PolarHBondContact O-N 3.24Å; I121-E123 PolarHBondContact O-N 3.07Å; E123-R126 CarbonylContact O-C 3.55Å; E123-R126 WeakPolarHBondContact O-CA 3.31Å; E123-R126 PolarHBondContact O-N 3.27Å; E123-R126 VanDerWaalsContact O-N 3.16Å; E123-R127 WeakPolarHBondContact O-CG 3.4Å; E123-R127 PolarHBondContact O-N 3.38Å; E123-R127 IonicContact OE2-CZ 3.17Å; E123-R127 IonicContact OE2-NH1 2.74Å; E123-R127 PolarHBondContact OE2-NH1 3.01Å; E123-R127 IonicContact OE2-NH2 2.72Å; E123-R127 PolarHBondContact OE2-NH2 3.44Å
124	E	72.1	Confident	66.1	Low	86 Å²	86	118.8 Å²	118.8	40%	0.402	56%	0.56	S	S	.	*	H	α-helix	trans	-64	-44.1	170.2	-170.4	158.6	-147.6	0	0	110.9	K120 R126 R127 Y128	K120-E124 WeakPolarHBondContact O-CB 3.47Å; K120-E124 PolarHBondContact O-N 2.97Å; E124-R126 PolarHBondContact O-N 3.18Å; E124-R127 PolarHBondContact O-N 3.29Å; E124-Y128 HydrophobicContact CG-CD2 4.33Å; E124-Y128 HydrophobicContact CG-CE2 4.44Å; E124-Y128 PolarHBondContact O-N 3.27Å
125	A	71.9	Confident	64.8	Low	51 Å²	51	116.5 Å²	116.5	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-57.9	-35.8	169.2	0	0	0	0	0	112.6	I121 Q129	I121-A125 VanDerWaalsContact O-CB 3.27Å; I121-A125 WeakPolarHBondContact O-CB 3.46Å; I121-A125 PolarHBondContact O-N 3.45Å; A125-Q129 PolarHBondContact O-N 3.4Å
126	R	68.7	Low	63.8	Low	177 Å²	177	113.9 Å²	113.9	67%	0.668	55%	0.553	S	S	*	*	H	α-helix	trans	-81.7	-12.1	176	-75.3	-174.5	-69.7	154.5	7	114.3	G122 E123 E124	G122-R126 PolarHBondContact O-NE 3.35Å; G122-R126 PolarHBondContact O-NH2 2.94Å; E123-R126 CarbonylContact O-C 3.55Å; E123-R126 WeakPolarHBondContact O-CA 3.31Å; E123-R126 PolarHBondContact O-N 3.27Å; E123-R126 VanDerWaalsContact O-N 3.16Å; E124-R126 PolarHBondContact O-N 3.18Å
127	R	60.9	Low	63.5	Low	172 Å²	172	111.5 Å²	111.5	65%	0.649	55%	0.545	S	S	*	.	H	α-helix	trans	-86.9	-30.8	168.1	-73.5	-176.4	-176.1	93.7	3	112	E123 E124	E123-R127 WeakPolarHBondContact O-CG 3.4Å; E123-R127 PolarHBondContact O-N 3.38Å; E123-R127 IonicContact OE2-CZ 3.17Å; E123-R127 IonicContact OE2-NH1 2.74Å; E123-R127 PolarHBondContact OE2-NH1 3.01Å; E123-R127 IonicContact OE2-NH2 2.72Å; E123-R127 PolarHBondContact OE2-NH2 3.44Å; E124-R127 PolarHBondContact O-N 3.29Å
128	Y	56	Low	63.7	Low	197 Å²	197	108.4 Å²	108.4	77%	0.773	53%	0.534	S	S	*	.	H	α-helix	trans	-83.1	-24.3	176.3	-87.5	-77.2	0	0	0	114	E124 G130	E124-Y128 HydrophobicContact CG-CD2 4.33Å; E124-Y128 HydrophobicContact CG-CE2 4.44Å; E124-Y128 PolarHBondContact O-N 3.27Å; Y128-G130 PolarHBondContact O-N 3.18Å; Y128-G130 VanDerWaalsContact O-N 3.08Å
129	Q	46.5	Very low	64.3	Low	116 Å²	116	105.3 Å²	105.3	54%	0.542	52%	0.515	S	S	.	.			trans	-83.8	60.7	168.5	-68.3	-170.2	-63.5	0	0	112.3	A125 D135	A125-Q129 PolarHBondContact O-N 3.4Å; Q129-D135 PolarHBondContact NE2-OD2 3.3Å
130	G	41.4	Very low	64.4	Low	57 Å²	57	100.4 Å²	100.4	59%	0.588	51%	0.506	S	S	*	.			trans	-75.5	137.8	148.4	0	0	0	0	0	108.8	Y128	Y128-G130 PolarHBondContact O-N 3.18Å; Y128-G130 VanDerWaalsContact O-N 3.08Å
131	E	36.3	Very low	64.7	Low	198 Å²	198	96.7 Å²	96.7	93%	0.925	49%	0.492	S	S	*	.	S	Bend	trans	50.9	62.5	169.8	-58.3	-158.9	92.2	0	0	117.7
132	H	43.6	Very low	65.3	Low	159 Å²	159	93.9 Å²	93.9	74%	0.736	48%	0.48	S	S	*	.			trans	-142.7	143.2	135.5	-140.9	-83.1	0	0	0	111.9
133	K	41.3	Very low	65.7	Low	177 Å²	177	98.9 Å²	98.9	77%	0.77	49%	0.494	S	S	*	.			trans	-93.5	-177.4	170.1	-67.9	174.6	-177.6	170.2	0	109.3	D135	K133-D135 PolarHBondContact O-N 3.45Å
134	D	45.1	Very low	66.1	Low	147 Å²	147	104.5 Å²	104.5	79%	0.786	52%	0.518	S	S	*	.			trans	72.5	21.5	172.9	-42	-43	0	0	0	116.4	A136	D134-A136 PolarHBondContact O-N 2.79Å
135	D	53.6	Low	66.7	Low	90 Å²	90	102.8 Å²	102.8	48%	0.481	51%	0.513	S	S	.	.			trans	-78.7	82.3	177.6	-138.6	-17.2	0	0	0	112.3	Q129 K133 P137	Q129-D135 PolarHBondContact NE2-OD2 3.3Å; K133-D135 PolarHBondContact O-N 3.45Å; D135-P137 VanDerWaalsContact O-N 3.16Å
136	A	61.4	Low	67.3	Low	36 Å²	36	107.1 Å²	107.1	30%	0.298	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-48.8	119.5	176.5	0	0	0	0	0	110.9	D134 T138 K146	D134-A136 PolarHBondContact O-N 2.79Å; A136-T138 PolarHBondContact O-N 3.1Å; A136-T138 PolarHBondContact O-OG1 3.28Å; A136-K146 HydrophobicContact CB-CD 4.4Å
137	P	76.5	Confident	68	Low	41 Å²	41	99.1 Å²	99.1	27%	0.266	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-60.8	124.2	-158	18.1	-30.5	0	0	0	111.2	D135 F147	D135-P137 VanDerWaalsContact O-N 3.16Å; P137-F147 HydrophobicContact CB-CD2 4.41Å; P137-F147 HydrophobicContact CG-CB 4.37Å; P137-F147 WeakPolarHBondContact O-CA 3.33Å; P137-F147 WeakPolarHBondContact O-CB 3.45Å; P137-F147 WeakPolarHBondContact O-CD2 3.5Å; P137-F147 VanDerWaalsContact O-CG 3.3Å; P137-F147 WeakPolarHBondContact O-CG 3.49Å; P137-F147 PolarHBondContact O-N 2.75Å
138	T	84.4	Confident	68.7	Low	46 Å²	46	94.4 Å²	94.4	28%	0.282	49%	0.49	S	S	.	.	B	Isolated β-bridge	trans	-100.5	148.6	-173.1	-64.7	0	0	0	0	112	A136 G140	A136-T138 PolarHBondContact O-N 3.1Å; A136-T138 PolarHBondContact O-OG1 3.28Å; T138-G140 PolarHBondContact O-N 2.8Å
139	C	91.1	Very high	69.3	Low	0 Å²	0	91.6 Å²	91.6	0%	0	49%	0.488	C	S	.	.			trans	-58.3	105.2	175.7	176.6	0	0	0	0	111.8	I141 C142 H143 T145 F147 C163	C139-I141 PolarHBondContact O-N 2.79Å; C139-C142 PolarHBondContact O-N 3.01Å; C139-C142 PolarHBondContact SG-SG 3.16Å; C139-H143 WeakPolarHBondContact O-CA 3.5Å; C139-H143 PolarHBondContact O-N 3.33Å; C139-T145 WeakPolarHBondContact CB-O 3.49Å; C139-T145 PolarHBondContact N-O 3.1Å; C139-F147 HydrophobicContact CB-CE1 4.26Å; C139-F147 HydrophobicContact CB-CE2 4.17Å; C139-F147 HydrophobicContact CB-CZ 3.61Å; C139-C163 HydrophobicContact CB-CB 4.15Å; C139-C163 PolarHBondContact SG-N 3.41Å
140	G	86.9	Confident	70.3	Confident	30 Å²	30	89.7 Å²	89.7	31%	0.309	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	34.1	-177	0	0	0	0	0	115.4	T138 T160 K161	T138-G140 PolarHBondContact O-N 2.8Å; G140-T160 VanDerWaalsContact O-CG2 3.29Å; G140-T160 WeakPolarHBondContact O-CG2 3.28Å; G140-K161 PolarHBondContact N-O 3.32Å
141	I	87.7	Confident	71.9	Confident	46 Å²	46	90 Å²	90	24%	0.236	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.9	-39.7	178.3	-62.4	-175	0	0	0	111.1	C139 T160 F162 C166 C185 L187	C139-I141 PolarHBondContact O-N 2.79Å; I141-T160 HydrophobicContact CG1-CG2 4.08Å; I141-F162 HydrophobicContact CD1-CB 3.69Å; I141-F162 HydrophobicContact CD1-CG 4.39Å; I141-F162 HydrophobicContact CG1-CB 4.3Å; I141-C166 HydrophobicContact CB-CB 3.96Å; I141-C166 HydrophobicContact CD1-CB 4.34Å; I141-C166 HydrophobicContact CG2-CB 3.85Å; I141-C185 HydrophobicContact CD1-CB 3.39Å; I141-L187 HydrophobicContact CD1-CD1 4.16Å; I141-L187 HydrophobicContact CG1-CD1 4.32Å; I141-L187 HydrophobicContact CG2-CD1 3.66Å
142	C	90.1	Very high	74.1	Confident	40 Å²	40	81.7 Å²	81.7	27%	0.27	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-18.9	174.3	67.3	0	0	0	0	113.9	C139 K144 C166	C139-C142 PolarHBondContact O-N 3.01Å; C139-C142 PolarHBondContact SG-SG 3.16Å; C142-K144 WeakPolarHBondContact O-CG 3.31Å; C142-K144 PolarHBondContact O-N 2.71Å; C142-C166 VanDerWaalsContact CB-SG 3.57Å
143	H	87.9	Confident	76.2	Confident	139 Å²	139	77 Å²	77	64%	0.644	44%	0.438	S	S	*	.	S	Bend	trans	52.8	14.7	-174.5	-61	-98.9	0	0	0	115.1	C139	C139-H143 WeakPolarHBondContact O-CA 3.5Å; C139-H143 PolarHBondContact O-N 3.33Å
144	K	85.3	Confident	78.6	Confident	190 Å²	190	73.8 Å²	73.8	83%	0.826	43%	0.429	S	S	*	.			trans	-114.3	-6.7	-176.1	-72.9	176.7	-176.2	-166	0	114.2	C142	C142-K144 WeakPolarHBondContact O-CG 3.31Å; C142-K144 PolarHBondContact O-N 2.71Å
145	T	84.7	Confident	80.9	Confident	50 Å²	50	66.9 Å²	66.9	31%	0.307	39%	0.392	S	S	.	.			trans	-116.5	99.8	176	-53.3	0	0	0	0	107.7	C139 F147 C163	C139-T145 WeakPolarHBondContact CB-O 3.49Å; C139-T145 PolarHBondContact N-O 3.1Å; T145-F147 HydrophobicContact CG2-CD1 4.45Å; T145-F147 HydrophobicContact CG2-CE1 4.34Å; T145-C163 HydrophobicContact CG2-CB 3.7Å; T145-C163 PolarHBondContact OG1-SG 2.89Å
146	K	84.2	Confident	82.6	Confident	141 Å²	141	65.5 Å²	65.5	61%	0.613	39%	0.39	S	S	*	.	B	Isolated β-bridge	trans	-62.1	140	160.1	-65.5	-160.7	168.3	-162.1	0	108.1	A136	A136-K146 HydrophobicContact CB-CD 4.4Å
147	F	83.4	Confident	84	Confident	10 Å²	10	69 Å²	69	4%	0.044	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-96.6	137.6	166.6	-53.3	-56.8	0	0	0	107.8	P137 C139 T145 C151 K161 F162 C163	P137-F147 HydrophobicContact CB-CD2 4.41Å; P137-F147 HydrophobicContact CG-CB 4.37Å; P137-F147 WeakPolarHBondContact O-CA 3.33Å; P137-F147 WeakPolarHBondContact O-CB 3.45Å; P137-F147 WeakPolarHBondContact O-CD2 3.5Å; P137-F147 VanDerWaalsContact O-CG 3.3Å; P137-F147 WeakPolarHBondContact O-CG 3.49Å; P137-F147 PolarHBondContact O-N 2.75Å; C139-F147 HydrophobicContact CB-CE1 4.26Å; C139-F147 HydrophobicContact CB-CE2 4.17Å; C139-F147 HydrophobicContact CB-CZ 3.61Å; T145-F147 HydrophobicContact CG2-CD1 4.45Å; T145-F147 HydrophobicContact CG2-CE1 4.34Å; F147-C151 HydrophobicContact CB-CB 4.02Å; F147-C151 VanDerWaalsContact CB-O 3.28Å; F147-C151 WeakPolarHBondContact CB-O 3.49Å; F147-C151 WeakPolarHBondContact CG-O 3.11Å; F147-K161 HydrophobicContact CD2-CD 3.72Å; F147-K161 HydrophobicContact CD2-CG 4.11Å; F147-K161 HydrophobicContact CE2-CB 4.04Å; F147-K161 HydrophobicContact CE2-CD 3.78Å; F147-K161 HydrophobicContact CE2-CG 3.64Å; F147-K161 HydrophobicContact CZ-CG 4.36Å; F147-F162 VanDerWaalsContact CZ-C 3.46Å; F147-C163 HydrophobicContact CE1-CB 3.67Å; F147-C163 HydrophobicContact CZ-CB 4.18Å
148	A	76.2	Confident	84.7	Confident	72 Å²	72	69.6 Å²	69.6	60%	0.595	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-64.3	163.7	151.3	0	0	0	0	0	109	C151	A148-C151 VanDerWaalsContact O-CB 3.23Å; A148-C151 WeakPolarHBondContact O-CB 3.38Å; A148-C151 PolarHBondContact O-N 3.49Å
149	D	67.4	Low	85.1	Confident	138 Å²	138	77.5 Å²	77.5	74%	0.738	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	147.7	-178.9	-69.8	-61.8	0	0	0	113.1	C151	D149-C151 PolarHBondContact O-N 2.81Å
150	G	67.5	Low	85	Confident	76 Å²	76	79.8 Å²	79.8	78%	0.784	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	-24.4	-168.7	0	0	0	0	0	116.1
151	C	74.5	Confident	85.2	Confident	65 Å²	65	81 Å²	81	44%	0.439	44%	0.436	S	S	.	.			trans	-74.5	150.2	-173	-60.8	0	0	0	0	113.3	F147 A148 D149 K161	F147-C151 HydrophobicContact CB-CB 4.02Å; F147-C151 VanDerWaalsContact CB-O 3.28Å; F147-C151 WeakPolarHBondContact CB-O 3.49Å; F147-C151 WeakPolarHBondContact CG-O 3.11Å; A148-C151 VanDerWaalsContact O-CB 3.23Å; A148-C151 WeakPolarHBondContact O-CB 3.38Å; A148-C151 PolarHBondContact O-N 3.49Å; D149-C151 PolarHBondContact O-N 2.81Å; C151-K161 WeakPolarHBondContact O-CE 3.16Å; C151-K161 PolarHBondContact O-NZ 2.88Å
152	G	82.3	Confident	85.4	Confident	23 Å²	23	78.8 Å²	78.8	24%	0.237	43%	0.425	C	S	.	.	S	Bend	trans	93.5	157.8	179.8	0	0	0	0	0	114.3
153	H	89	Confident	85.4	Confident	60 Å²	60	77.3 Å²	77.3	28%	0.278	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139.6	-169.2	-51.5	-57.2	0	0	0	112.1	K161 F162 W183	H153-K161 CarbonylContact O-C 3.52Å; H153-K161 WeakPolarHBondContact O-CA 3.49Å; H153-F162 HydrophobicContact CB-CE1 4.35Å; H153-F162 HydrophobicContact CB-CE2 4.14Å; H153-F162 HydrophobicContact CB-CZ 4.02Å; H153-F162 PolarHBondContact N-O 3.49Å; H153-F162 WeakPolarHBondContact O-CD1 3.37Å; H153-F162 PolarHBondContact O-N 3.43Å; H153-W183 HydrophobicContact CB-CB 4.25Å; H153-W183 HydrophobicContact CB-CD2 3.68Å; H153-W183 HydrophobicContact CB-CE3 3.8Å; H153-W183 HydrophobicContact CB-CG 3.91Å; H153-W183 HydrophobicContact CB-CZ3 4.33Å; H153-W183 AromaticContact CD2-CE3 3.66Å; H153-W183 AromaticContact CD2-CH2 3.31Å; H153-W183 WeakPolarHBondContact CD2-CH2 3.27Å; H153-W183 AromaticContact CD2-CZ2 3.76Å; H153-W183 AromaticContact CD2-CZ3 3.26Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.34Å; H153-W183 AromaticContact CE1-CH2 3.63Å; H153-W183 AromaticContact CE1-CZ2 3.46Å; H153-W183 VanDerWaalsContact CE1-CZ2 3.46Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.46Å; H153-W183 AromaticContact CG-CD2 3.63Å; H153-W183 AromaticContact CG-CE2 3.66Å; H153-W183 AromaticContact CG-CE3 3.67Å; H153-W183 AromaticContact CG-CH2 3.76Å; H153-W183 AromaticContact CG-CZ2 3.75Å; H153-W183 AromaticContact CG-CZ3 3.73Å; H153-W183 AromaticContact ND1-CE2 3.62Å; H153-W183 AromaticContact ND1-CH2 3.94Å; H153-W183 AromaticContact ND1-CZ2 3.56Å; H153-W183 AromaticContact NE2-CH2 3.22Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.24Å; H153-W183 AromaticContact NE2-CZ2 3.59Å; H153-W183 AromaticContact NE2-CZ3 3.71Å
154	L	91.3	Very high	85.5	Confident	109 Å²	109	74.4 Å²	74.4	57%	0.571	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	139.2	176.5	-61	171.1	0	0	0	110.5	R159 K161 W183	L154-R159 WeakPolarHBondContact CD2-O 3.32Å; L154-K161 HydrophobicContact CD2-CB 3.84Å; L154-K161 HydrophobicContact CD2-CG 3.9Å; L154-W183 VanDerWaalsContact O-CB 3.3Å; L154-W183 WeakPolarHBondContact O-CB 3.3Å
155	C	92.8	Very high	85.6	Confident	2 Å²	2	76 Å²	76	1%	0.014	42%	0.416	C	S	.	.			trans	-75.7	125.6	172.5	-174.8	0	0	0	0	111.5	Y157 C158 R159 T160 F162 C185	C155-Y157 PolarHBondContact O-N 2.99Å; C155-Y157 VanDerWaalsContact O-N 3.16Å; C155-C158 WeakPolarHBondContact CB-SG 3.5Å; C155-C158 VanDerWaalsContact SG-SG 3.63Å; C155-R159 WeakPolarHBondContact O-CA 3.47Å; C155-R159 PolarHBondContact O-N 2.81Å; C155-T160 PolarHBondContact N-O 3.08Å; C155-F162 HydrophobicContact CB-CD1 4.08Å; C155-F162 HydrophobicContact CB-CE1 3.93Å; C155-C185 HydrophobicContact CB-CB 3.94Å; C155-C185 PolarHBondContact SG-N 3.2Å; C155-C185 VanDerWaalsContact SG-N 3.36Å
156	S	90.6	Very high	86	Confident	62 Å²	62	74.3 Å²	74.3	43%	0.434	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.7	-178.6	-48.1	0	0	0	0	113	W183	S156-W183 WeakPolarHBondContact CB-O 3.49Å; S156-W183 PolarHBondContact N-O 2.96Å; S156-W183 PolarHBondContact OG-N 2.92Å; S156-W183 PolarHBondContact OG-O 3.24Å
157	Y	91.1	Very high	86.4	Confident	108 Å²	108	68.1 Å²	68.1	42%	0.424	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-59.7	175.2	-54.2	-68.7	0	0	0	113.5	C155 M182 V184 C188 Q192	C155-Y157 PolarHBondContact O-N 2.99Å; C155-Y157 VanDerWaalsContact O-N 3.16Å; Y157-M182 HydrophobicContact CE1-CE 3.98Å; Y157-M182 HydrophobicContact CE2-CE 3.9Å; Y157-M182 VanDerWaalsContact CZ-CE 3.49Å; Y157-M182 WeakPolarHBondContact OH-CE 3.29Å; Y157-V184 HydrophobicContact CD2-CG1 3.92Å; Y157-V184 HydrophobicContact CD2-CG2 4.26Å; Y157-V184 HydrophobicContact CE2-CB 4.41Å; Y157-V184 HydrophobicContact CE2-CG1 3.78Å; Y157-V184 HydrophobicContact CE2-CG2 3.72Å; Y157-C188 HydrophobicContact CD2-CB 3.76Å; Y157-C188 HydrophobicContact CG-CB 4.31Å; Y157-Q192 VanDerWaalsContact CE2-OE1 3.3Å; Y157-Q192 PolarHBondContact OH-NE2 3.33Å; Y157-Q192 PolarHBondContact OH-OE1 2.66Å; Y157-Q192 VanDerWaalsContact OH-OE1 3.12Å
158	C	91	Very high	86.7	Confident	55 Å²	55	68.5 Å²	68.5	37%	0.372	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	3.5	-172.7	70.4	0	0	0	0	115.8	C155 T160 C185 C188	C155-C158 WeakPolarHBondContact CB-SG 3.5Å; C155-C158 VanDerWaalsContact SG-SG 3.63Å; C158-T160 PolarHBondContact O-N 2.65Å; C158-T160 PolarHBondContact O-OG1 3.41Å; C158-T160 PolarHBondContact SG-OG1 2.83Å; C158-C185 VanDerWaalsContact SG-SG 3.66Å; C158-C188 VanDerWaalsContact SG-SG 3.62Å
159	R	91.3	Very high	87.3	Confident	212 Å²	212	73.8 Å²	73.8	80%	0.8	39%	0.393	S	S	*	.			trans	56.1	-3.7	-178.1	-60.5	-174.6	-179.1	179.2	0.5	117.3	L154 C155 K161	L154-R159 WeakPolarHBondContact CD2-O 3.32Å; C155-R159 WeakPolarHBondContact O-CA 3.47Å; C155-R159 PolarHBondContact O-N 2.81Å; R159-K161 PolarHBondContact O-N 3.24Å
160	T	89.1	Confident	88.1	Confident	47 Å²	47	69.5 Å²	69.5	29%	0.288	37%	0.372	S	S	.	.			trans	-55.6	133	174.3	-44.3	0	0	0	0	112.1	G140 I141 C155 C158	G140-T160 VanDerWaalsContact O-CG2 3.29Å; G140-T160 WeakPolarHBondContact O-CG2 3.28Å; I141-T160 HydrophobicContact CG1-CG2 4.08Å; C155-T160 PolarHBondContact N-O 3.08Å; C158-T160 PolarHBondContact O-N 2.65Å; C158-T160 PolarHBondContact O-OG1 3.41Å; C158-T160 PolarHBondContact SG-OG1 2.83Å
161	K	91	Very high	88.7	Confident	55 Å²	55	69.5 Å²	69.5	24%	0.239	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.9	175	-154.2	-178.1	-173.2	-159.1	0	110.2	G140 F147 C151 H153 L154 R159	G140-K161 PolarHBondContact N-O 3.32Å; F147-K161 HydrophobicContact CD2-CD 3.72Å; F147-K161 HydrophobicContact CD2-CG 4.11Å; F147-K161 HydrophobicContact CE2-CB 4.04Å; F147-K161 HydrophobicContact CE2-CD 3.78Å; F147-K161 HydrophobicContact CE2-CG 3.64Å; F147-K161 HydrophobicContact CZ-CG 4.36Å; C151-K161 WeakPolarHBondContact O-CE 3.16Å; C151-K161 PolarHBondContact O-NZ 2.88Å; H153-K161 CarbonylContact O-C 3.52Å; H153-K161 WeakPolarHBondContact O-CA 3.49Å; L154-K161 HydrophobicContact CD2-CB 3.84Å; L154-K161 HydrophobicContact CD2-CG 3.9Å; R159-K161 PolarHBondContact O-N 3.24Å
162	F	92	Very high	88.5	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.8	-172.2	70.9	-98.4	0	0	0	113.2	I141 F147 H153 C155 C166 W183 C185	I141-F162 HydrophobicContact CD1-CB 3.69Å; I141-F162 HydrophobicContact CD1-CG 4.39Å; I141-F162 HydrophobicContact CG1-CB 4.3Å; F147-F162 VanDerWaalsContact CZ-C 3.46Å; H153-F162 HydrophobicContact CB-CE1 4.35Å; H153-F162 HydrophobicContact CB-CE2 4.14Å; H153-F162 HydrophobicContact CB-CZ 4.02Å; H153-F162 PolarHBondContact N-O 3.49Å; H153-F162 WeakPolarHBondContact O-CD1 3.37Å; H153-F162 PolarHBondContact O-N 3.43Å; C155-F162 HydrophobicContact CB-CD1 4.08Å; C155-F162 HydrophobicContact CB-CE1 3.93Å; F162-C166 HydrophobicContact CB-CB 4.03Å; F162-W183 HydrophobicContact CE1-CB 4.37Å; F162-W183 HydrophobicContact CE2-CE3 4.11Å; F162-W183 HydrophobicContact CZ-CB 4.02Å; F162-W183 AromaticContact CZ-CE3 3.96Å; F162-W183 HydrophobicContact CZ-CE3 3.96Å; F162-C185 HydrophobicContact CD1-CB 3.72Å; F162-C185 HydrophobicContact CE1-CB 3.99Å; F162-C185 HydrophobicContact CG-CB 4.18Å
163	C	91.5	Very high	87.5	Confident	10 Å²	10	81.6 Å²	81.6	7%	0.068	40%	0.396	C	S	.	.			trans	-84.4	161.7	177.9	73.9	0	0	0	0	111.6	C139 T145 F147 R165 C166	C139-C163 HydrophobicContact CB-CB 4.15Å; C139-C163 PolarHBondContact SG-N 3.41Å; T145-C163 HydrophobicContact CG2-CB 3.7Å; T145-C163 PolarHBondContact OG1-SG 2.89Å; F147-C163 HydrophobicContact CE1-CB 3.67Å; F147-C163 HydrophobicContact CZ-CB 4.18Å; C163-R165 PolarHBondContact O-N 3.49Å; C163-C166 PolarHBondContact O-N 2.94Å
164	A	88.3	Confident	86	Confident	78 Å²	78	81.8 Å²	81.8	65%	0.645	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-6.5	-175.3	0	0	0	0	0	116.1
165	R	89.3	Confident	84.2	Confident	224 Å²	224	84.4 Å²	84.4	85%	0.845	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-17.8	170.3	-64.7	-179.5	177.5	172.2	0.2	113.6	C163 N186	C163-R165 PolarHBondContact O-N 3.49Å; R165-N186 PolarHBondContact O-ND2 2.86Å
166	C	92.3	Very high	82.3	Confident	14 Å²	14	90.8 Å²	90.8	10%	0.095	45%	0.452	C	S	.	.	S	Bend	trans	-103.2	4.5	-172.7	-71	0	0	0	0	114.5	I141 C142 F162 C163 N186	I141-C166 HydrophobicContact CB-CB 3.96Å; I141-C166 HydrophobicContact CD1-CB 4.34Å; I141-C166 HydrophobicContact CG2-CB 3.85Å; C142-C166 VanDerWaalsContact CB-SG 3.57Å; F162-C166 HydrophobicContact CB-CB 4.03Å; C163-C166 PolarHBondContact O-N 2.94Å; C166-N186 VanDerWaalsContact C-CG 3.48Å; C166-N186 VanDerWaalsContact C-ND2 3.32Å; C166-N186 WeakPolarHBondContact O-CB 3.24Å; C166-N186 PolarHBondContact O-N 2.9Å; C166-N186 PolarHBondContact O-ND2 3.39Å
167	G	91.6	Very high	80.9	Confident	11 Å²	11	97 Å²	97	11%	0.113	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	-168.1	176.8	0	0	0	0	0	110.9	V184 N186	G167-V184 CarbonylContact C-O 3.43Å; G167-V184 VanDerWaalsContact CA-O 3.23Å; G167-V184 WeakPolarHBondContact CA-O 3.13Å; G167-N186 WeakPolarHBondContact CA-OD1 3.21Å
168	G	89.9	Confident	79.6	Confident	18 Å²	18	98.1 Å²	98.1	19%	0.186	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	178.8	179.2	0	0	0	0	0	114.6	V184	G168-V184 PolarHBondContact N-O 3.47Å; G168-V184 PolarHBondContact O-N 2.85Å
169	R	89	Confident	78.3	Confident	182 Å²	182	103.9 Å²	103.9	69%	0.687	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	136	174.3	-66.4	-176.3	-78.1	-164.4	-2.8	110.5	V181 W183	R169-V181 HydrophobicContact CB-CG1 3.95Å; R169-V181 HydrophobicContact CG-CG1 3.95Å; R169-W183 HydrophobicContact CG-CD2 3.82Å; R169-W183 HydrophobicContact CG-CE3 3.76Å; R169-W183 HydrophobicContact CG-CH2 3.4Å; R169-W183 HydrophobicContact CG-CZ2 3.4Å; R169-W183 VanDerWaalsContact CG-CZ2 3.4Å; R169-W183 HydrophobicContact CG-CZ3 3.57Å
170	V	84.8	Confident	77.5	Confident	48 Å²	48	97.7 Å²	97.7	29%	0.291	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.4	168.2	-179.9	0	0	0	0	106.6	M182 V184	V170-M182 HydrophobicContact CB-CG 3.83Å; V170-M182 HydrophobicContact CG1-CG 4.31Å; V170-M182 HydrophobicContact CG1-SD 4.48Å; V170-M182 PolarHBondContact N-O 3.34Å; V170-M182 WeakPolarHBondContact O-CG 3.41Å; V170-M182 PolarHBondContact O-N 3.47Å; V170-V184 HydrophobicContact CB-CG2 4.24Å; V170-V184 HydrophobicContact CG2-CB 4.1Å; V170-V184 HydrophobicContact CG2-CG2 3.81Å
171	S	80.9	Confident	77.1	Confident	77 Å²	77	98.9 Å²	98.9	54%	0.538	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.1	170.6	-65.3	0	0	0	0	108.8
172	L	69.6	Low	77	Confident	91 Å²	91	97.5 Å²	97.5	48%	0.476	49%	0.494	S	S	.	.			trans	-73.7	137.9	164.7	-66.3	173.2	0	0	0	108.4	V180 M182	L172-V180 PolarHBondContact N-O 3.42Å; L172-V180 VanDerWaalsContact N-O 3.08Å; L172-M182 HydrophobicContact CD1-SD 3.86Å; L172-M182 HydrophobicContact CD2-SD 4.16Å; L172-M182 HydrophobicContact CG-SD 3.89Å
173	R	61	Low	77	Confident	251 Å²	251	100.7 Å²	100.7	95%	0.947	51%	0.506	S	S	*	.			trans	-97.9	83.7	168.9	-75.9	-176.9	173.3	176.9	-3.7	108.5
174	S	57.3	Low	77.1	Confident	63 Å²	63	100.3 Å²	100.3	44%	0.441	50%	0.503	S	S	.	.			trans	-58.2	151.7	155.6	41.2	0	0	0	0	109.7	N176 D178	S174-N176 PolarHBondContact O-N 3.29Å; S174-N176 PolarHBondContact OG-O 3.05Å; S174-D178 PolarHBondContact OG-O 3.12Å
175	N	53.2	Low	77.4	Confident	164 Å²	164	96.7 Å²	96.7	88%	0.877	47%	0.473	S	S	*	.	S	Bend	trans	-87.7	15.3	178.1	-160.7	42.8	0	0	0	113.2
176	N	54.3	Low	77.6	Confident	137 Å²	137	89.2 Å²	89.2	73%	0.733	45%	0.45	S	S	*	.	S	Bend	trans	-146.5	123	171.4	-89	-42.2	0	0	0	109.5	S174 D178	S174-N176 PolarHBondContact O-N 3.29Å; S174-N176 PolarHBondContact OG-O 3.05Å; N176-D178 VanDerWaalsContact C-N 3.29Å; N176-D178 PolarHBondContact O-N 3.24Å
177	E	61.4	Low	77.6	Confident	193 Å²	193	92.6 Å²	92.6	90%	0.902	47%	0.467	S	S	*	.	S	Bend	trans	29.5	-45.5	168.3	-49.4	-149.6	100.6	0	0	121.6	K179	E177-K179 PolarHBondContact O-N 3.14Å
178	D	62.3	Low	77.6	Confident	130 Å²	130	92.5 Å²	92.5	70%	0.695	46%	0.464	S	S	*	.			trans	-78.5	101.2	-175.3	-87.1	-44.9	0	0	0	113.5	S174 N176 V180	S174-D178 PolarHBondContact OG-O 3.12Å; N176-D178 VanDerWaalsContact C-N 3.29Å; N176-D178 PolarHBondContact O-N 3.24Å; D178-V180 VanDerWaalsContact C-N 3.27Å; D178-V180 PolarHBondContact O-N 2.76Å
179	K	65.3	Low	77.7	Confident	176 Å²	176	97.6 Å²	97.6	77%	0.765	48%	0.478	S	S	*	.			trans	-73.1	75.5	171.7	-70	173.2	-176	156.7	0	111.4	E177 V181	E177-K179 PolarHBondContact O-N 3.14Å; K179-V181 WeakPolarHBondContact O-CG2 3.47Å; K179-V181 PolarHBondContact O-N 3.35Å
180	V	74.6	Confident	77.7	Confident	82 Å²	82	95.3 Å²	95.3	50%	0.497	47%	0.473	S	S	.	.			trans	-58.6	109.4	176.1	-176.8	0	0	0	0	110.4	L172 D178	L172-V180 PolarHBondContact N-O 3.42Å; L172-V180 VanDerWaalsContact N-O 3.08Å; D178-V180 VanDerWaalsContact C-N 3.27Å; D178-V180 PolarHBondContact O-N 2.76Å
181	V	80	Confident	77.6	Confident	73 Å²	73	95.8 Å²	95.8	44%	0.442	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	100.1	175.3	-177.2	0	0	0	0	108.8	R169 K179	R169-V181 HydrophobicContact CB-CG1 3.95Å; R169-V181 HydrophobicContact CG-CG1 3.95Å; K179-V181 WeakPolarHBondContact O-CG2 3.47Å; K179-V181 PolarHBondContact O-N 3.35Å
182	M	89.3	Confident	77.8	Confident	25 Å²	25	96.1 Å²	96.1	12%	0.123	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.6	175.5	74.1	-175.7	-52.4	0	0	110.8	Y157 V170 L172 V184	Y157-M182 HydrophobicContact CE1-CE 3.98Å; Y157-M182 HydrophobicContact CE2-CE 3.9Å; Y157-M182 VanDerWaalsContact CZ-CE 3.49Å; Y157-M182 WeakPolarHBondContact OH-CE 3.29Å; V170-M182 HydrophobicContact CB-CG 3.83Å; V170-M182 HydrophobicContact CG1-CG 4.31Å; V170-M182 HydrophobicContact CG1-SD 4.48Å; V170-M182 PolarHBondContact N-O 3.34Å; V170-M182 WeakPolarHBondContact O-CG 3.41Å; V170-M182 PolarHBondContact O-N 3.47Å; L172-M182 HydrophobicContact CD1-SD 3.86Å; L172-M182 HydrophobicContact CD2-SD 4.16Å; L172-M182 HydrophobicContact CG-SD 3.89Å; M182-V184 HydrophobicContact CE-CG2 4.18Å; M182-V184 HydrophobicContact CG-CG2 3.95Å; M182-V184 HydrophobicContact SD-CG2 4.32Å
183	W	91.8	Very high	78.6	Confident	67 Å²	67	95.8 Å²	95.8	25%	0.254	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.7	173.4	-77.2	98.5	0	0	0	109.9	H153 L154 S156 F162 R169	H153-W183 HydrophobicContact CB-CB 4.25Å; H153-W183 HydrophobicContact CB-CD2 3.68Å; H153-W183 HydrophobicContact CB-CE3 3.8Å; H153-W183 HydrophobicContact CB-CG 3.91Å; H153-W183 HydrophobicContact CB-CZ3 4.33Å; H153-W183 AromaticContact CD2-CE3 3.66Å; H153-W183 AromaticContact CD2-CH2 3.31Å; H153-W183 WeakPolarHBondContact CD2-CH2 3.27Å; H153-W183 AromaticContact CD2-CZ2 3.76Å; H153-W183 AromaticContact CD2-CZ3 3.26Å; H153-W183 WeakPolarHBondContact CD2-CZ3 3.34Å; H153-W183 AromaticContact CE1-CH2 3.63Å; H153-W183 AromaticContact CE1-CZ2 3.46Å; H153-W183 VanDerWaalsContact CE1-CZ2 3.46Å; H153-W183 WeakPolarHBondContact CE1-CZ2 3.46Å; H153-W183 AromaticContact CG-CD2 3.63Å; H153-W183 AromaticContact CG-CE2 3.66Å; H153-W183 AromaticContact CG-CE3 3.67Å; H153-W183 AromaticContact CG-CH2 3.76Å; H153-W183 AromaticContact CG-CZ2 3.75Å; H153-W183 AromaticContact CG-CZ3 3.73Å; H153-W183 AromaticContact ND1-CE2 3.62Å; H153-W183 AromaticContact ND1-CH2 3.94Å; H153-W183 AromaticContact ND1-CZ2 3.56Å; H153-W183 AromaticContact NE2-CH2 3.22Å; H153-W183 WeakPolarHBondContact NE2-CH2 3.24Å; H153-W183 AromaticContact NE2-CZ2 3.59Å; H153-W183 AromaticContact NE2-CZ3 3.71Å; L154-W183 VanDerWaalsContact O-CB 3.3Å; L154-W183 WeakPolarHBondContact O-CB 3.3Å; S156-W183 WeakPolarHBondContact CB-O 3.49Å; S156-W183 PolarHBondContact N-O 2.96Å; S156-W183 PolarHBondContact OG-N 2.92Å; S156-W183 PolarHBondContact OG-O 3.24Å; F162-W183 HydrophobicContact CE1-CB 4.37Å; F162-W183 HydrophobicContact CE2-CE3 4.11Å; F162-W183 HydrophobicContact CZ-CB 4.02Å; F162-W183 AromaticContact CZ-CE3 3.96Å; F162-W183 HydrophobicContact CZ-CE3 3.96Å; R169-W183 HydrophobicContact CG-CD2 3.82Å; R169-W183 HydrophobicContact CG-CE3 3.76Å; R169-W183 HydrophobicContact CG-CH2 3.4Å; R169-W183 HydrophobicContact CG-CZ2 3.4Å; R169-W183 VanDerWaalsContact CG-CZ2 3.4Å; R169-W183 HydrophobicContact CG-CZ3 3.57Å
184	V	93.7	Very high	79.6	Confident	3 Å²	3	86.9 Å²	86.9	2%	0.018	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.9	-174.7	-177.4	0	0	0	0	110	Y157 G167 G168 V170 M182 C188 R189	Y157-V184 HydrophobicContact CD2-CG1 3.92Å; Y157-V184 HydrophobicContact CD2-CG2 4.26Å; Y157-V184 HydrophobicContact CE2-CB 4.41Å; Y157-V184 HydrophobicContact CE2-CG1 3.78Å; Y157-V184 HydrophobicContact CE2-CG2 3.72Å; G167-V184 CarbonylContact C-O 3.43Å; G167-V184 VanDerWaalsContact CA-O 3.23Å; G167-V184 WeakPolarHBondContact CA-O 3.13Å; G168-V184 PolarHBondContact N-O 3.47Å; G168-V184 PolarHBondContact O-N 2.85Å; V170-V184 HydrophobicContact CB-CG2 4.24Å; V170-V184 HydrophobicContact CG2-CB 4.1Å; V170-V184 HydrophobicContact CG2-CG2 3.81Å; M182-V184 HydrophobicContact CE-CG2 4.18Å; M182-V184 HydrophobicContact CG-CG2 3.95Å; M182-V184 HydrophobicContact SD-CG2 4.32Å; V184-C188 HydrophobicContact CG1-CB 4.3Å; V184-R189 HydrophobicContact CG1-CB 4.04Å
185	C	94.7	Very high	80.6	Confident	1 Å²	1	87.4 Å²	87.4	1%	0.007	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	159.6	177.6	78.1	0	0	0	0	112.6	I141 C155 C158 F162 L187 C188 R189	I141-C185 HydrophobicContact CD1-CB 3.39Å; C155-C185 HydrophobicContact CB-CB 3.94Å; C155-C185 PolarHBondContact SG-N 3.2Å; C155-C185 VanDerWaalsContact SG-N 3.36Å; C158-C185 VanDerWaalsContact SG-SG 3.66Å; F162-C185 HydrophobicContact CD1-CB 3.72Å; F162-C185 HydrophobicContact CE1-CB 3.99Å; F162-C185 HydrophobicContact CG-CB 4.18Å; C185-L187 PolarHBondContact O-N 3.27Å; C185-C188 PolarHBondContact O-N 2.87Å; C185-C188 PolarHBondContact SG-N 3.31Å; C185-C188 VanDerWaalsContact SG-SG 3.69Å; C185-R189 WeakPolarHBondContact O-CB 3.34Å; C185-R189 PolarHBondContact O-N 3Å
186	N	92.8	Very high	81.9	Confident	67 Å²	67	83.1 Å²	83.1	36%	0.358	41%	0.409	S	S	.	.	H	α-helix	trans	-64.3	-23.2	-179.4	-72.3	-18.2	0	0	0	113.4	R165 C166 G167 K190	R165-N186 PolarHBondContact O-ND2 2.86Å; C166-N186 VanDerWaalsContact C-CG 3.48Å; C166-N186 VanDerWaalsContact C-ND2 3.32Å; C166-N186 WeakPolarHBondContact O-CB 3.24Å; C166-N186 PolarHBondContact O-N 2.9Å; C166-N186 PolarHBondContact O-ND2 3.39Å; G167-N186 WeakPolarHBondContact CA-OD1 3.21Å; N186-K190 WeakPolarHBondContact O-CB 3.39Å; N186-K190 WeakPolarHBondContact O-CG 3.43Å; N186-K190 PolarHBondContact O-N 3.37Å; N186-K190 VanDerWaalsContact O-N 3.16Å
187	L	91.8	Very high	83	Confident	86 Å²	86	83.5 Å²	83.5	45%	0.45	40%	0.404	S	S	.	.	H	α-helix	trans	-72.1	-55.4	174.1	-79.2	79.3	0	0	0	110.7	I141 C185 R189 K190 Q191	I141-L187 HydrophobicContact CD1-CD1 4.16Å; I141-L187 HydrophobicContact CG1-CD1 4.32Å; I141-L187 HydrophobicContact CG2-CD1 3.66Å; C185-L187 PolarHBondContact O-N 3.27Å; L187-R189 VanDerWaalsContact C-N 3.3Å; L187-R189 PolarHBondContact O-N 2.83Å; L187-K190 CarbonylContact O-C 3.52Å; L187-K190 WeakPolarHBondContact O-CA 3.45Å; L187-K190 WeakPolarHBondContact O-CB 3.05Å; L187-K190 PolarHBondContact O-N 3.26Å; L187-K190 VanDerWaalsContact O-N 3.08Å; L187-Q191 PolarHBondContact O-N 3.46Å
188	C	92.6	Very high	83.8	Confident	8 Å²	8	76.3 Å²	76.3	5%	0.054	38%	0.375	C	S	.	.	H	α-helix	trans	-65.4	-33	179.2	-63.9	0	0	0	0	112.6	Y157 C158 V184 C185 K190 Q191 Q192	Y157-C188 HydrophobicContact CD2-CB 3.76Å; Y157-C188 HydrophobicContact CG-CB 4.31Å; C158-C188 VanDerWaalsContact SG-SG 3.62Å; V184-C188 HydrophobicContact CG1-CB 4.3Å; C185-C188 PolarHBondContact O-N 2.87Å; C185-C188 PolarHBondContact SG-N 3.31Å; C185-C188 VanDerWaalsContact SG-SG 3.69Å; C188-K190 VanDerWaalsContact C-N 3.35Å; C188-Q191 PolarHBondContact O-N 3.37Å; C188-Q192 PolarHBondContact O-N 2.86Å
189	R	90.6	Very high	83.9	Confident	125 Å²	125	71.5 Å²	71.5	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-40.5	171.3	-171.9	173.7	178.8	159.2	3.7	112	V184 C185 L187 Q192 E193	V184-R189 HydrophobicContact CG1-CB 4.04Å; C185-R189 WeakPolarHBondContact O-CB 3.34Å; C185-R189 PolarHBondContact O-N 3Å; L187-R189 VanDerWaalsContact C-N 3.3Å; L187-R189 PolarHBondContact O-N 2.83Å; R189-Q192 PolarHBondContact O-N 2.87Å; R189-E193 PolarHBondContact O-N 3.32Å
190	K	89.1	Confident	83.7	Confident	134 Å²	134	64.9 Å²	64.9	58%	0.583	33%	0.334	S	S	*	.	H	α-helix	trans	-67.3	-39.1	172	-81.1	-177.5	175.2	-172.9	0	112.4	N186 L187 C188 E193 I194	N186-K190 WeakPolarHBondContact O-CB 3.39Å; N186-K190 WeakPolarHBondContact O-CG 3.43Å; N186-K190 PolarHBondContact O-N 3.37Å; N186-K190 VanDerWaalsContact O-N 3.16Å; L187-K190 CarbonylContact O-C 3.52Å; L187-K190 WeakPolarHBondContact O-CA 3.45Å; L187-K190 WeakPolarHBondContact O-CB 3.05Å; L187-K190 PolarHBondContact O-N 3.26Å; L187-K190 VanDerWaalsContact O-N 3.08Å; C188-K190 VanDerWaalsContact C-N 3.35Å; K190-E193 PolarHBondContact O-N 3.07Å; K190-I194 WeakPolarHBondContact O-CB 3.33Å; K190-I194 VanDerWaalsContact O-CG1 3.24Å; K190-I194 WeakPolarHBondContact O-CG1 3.49Å; K190-I194 PolarHBondContact O-N 3.04Å
191	Q	84.5	Confident	83	Confident	58 Å²	58	65.9 Å²	65.9	27%	0.271	33%	0.329	S	S	.	.	H	α-helix	trans	-61	-44.3	174.3	-71.7	174.6	-53.5	0	0	111.2	F111 L187 C188 I194 L195	F111-Q191 HydrophobicContact CE1-CG 4.46Å; L187-Q191 PolarHBondContact O-N 3.46Å; C188-Q191 PolarHBondContact O-N 3.37Å; Q191-I194 PolarHBondContact O-N 3.34Å; Q191-L195 WeakPolarHBondContact O-CB 3.47Å; Q191-L195 VanDerWaalsContact O-CG 3.29Å; Q191-L195 WeakPolarHBondContact O-CG 3.37Å; Q191-L195 PolarHBondContact O-N 2.86Å
192	Q	84.6	Confident	81.6	Confident	84 Å²	84	69.4 Å²	69.4	39%	0.393	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-44.5	173.1	-70.8	-168.2	-63.5	0	0	111.8	Y157 C188 R189 I194 L195 T196	Y157-Q192 VanDerWaalsContact CE2-OE1 3.3Å; Y157-Q192 PolarHBondContact OH-NE2 3.33Å; Y157-Q192 PolarHBondContact OH-OE1 2.66Å; Y157-Q192 VanDerWaalsContact OH-OE1 3.12Å; C188-Q192 PolarHBondContact O-N 2.86Å; R189-Q192 PolarHBondContact O-N 2.87Å; Q192-I194 VanDerWaalsContact C-N 3.34Å; Q192-I194 PolarHBondContact O-N 2.9Å; Q192-L195 PolarHBondContact O-N 3.5Å; Q192-T196 WeakPolarHBondContact O-CB 3.35Å; Q192-T196 PolarHBondContact O-N 2.99Å; Q192-T196 PolarHBondContact O-OG1 2.9Å
193	E	85.3	Confident	79.9	Confident	85 Å²	85	77.1 Å²	77.1	40%	0.397	37%	0.372	S	S	.	.	H	α-helix	trans	-60.6	-38.3	173.9	-81.2	-170.8	-136.7	0	0	113.6	R189 K190 K197	R189-E193 PolarHBondContact O-N 3.32Å; K190-E193 PolarHBondContact O-N 3.07Å; E193-K197 VanDerWaalsContact O-CB 3.24Å; E193-K197 WeakPolarHBondContact O-CB 3.15Å; E193-K197 WeakPolarHBondContact O-CD 3.47Å; E193-K197 WeakPolarHBondContact O-CG 3.39Å; E193-K197 PolarHBondContact O-N 3.46Å; E193-K197 IonicContact OE2-NZ 3.4Å; E193-K197 PolarHBondContact OE2-NZ 3.17Å
194	I	82.7	Confident	77.5	Confident	63 Å²	63	77 Å²	77	32%	0.323	39%	0.391	S	S	.	.	H	α-helix	trans	-68.9	-46	177.7	-70.2	162.9	0	0	0	110.3	F111 K190 Q191 Q192 K197 S198	F111-I194 HydrophobicContact CD2-CD1 4.48Å; F111-I194 HydrophobicContact CE2-CD1 3.93Å; F111-I194 HydrophobicContact CZ-CD1 4.05Å; K190-I194 WeakPolarHBondContact O-CB 3.33Å; K190-I194 VanDerWaalsContact O-CG1 3.24Å; K190-I194 WeakPolarHBondContact O-CG1 3.49Å; K190-I194 PolarHBondContact O-N 3.04Å; Q191-I194 PolarHBondContact O-N 3.34Å; Q192-I194 VanDerWaalsContact C-N 3.34Å; Q192-I194 PolarHBondContact O-N 2.9Å; I194-K197 PolarHBondContact O-N 3.1Å; I194-S198 VanDerWaalsContact O-CB 3.29Å; I194-S198 WeakPolarHBondContact O-CB 3.29Å; I194-S198 PolarHBondContact O-N 3.33Å; I194-S198 PolarHBondContact O-OG 3.37Å
195	L	79.1	Confident	74.7	Confident	74 Å²	74	82.2 Å²	82.2	39%	0.387	43%	0.428	S	S	.	.	H	α-helix	trans	-60.2	-47.3	175.6	-71.4	168.7	0	0	0	111	Q191 Q192 K197 S198 G199 A200 W201	Q191-L195 WeakPolarHBondContact O-CB 3.47Å; Q191-L195 VanDerWaalsContact O-CG 3.29Å; Q191-L195 WeakPolarHBondContact O-CG 3.37Å; Q191-L195 PolarHBondContact O-N 2.86Å; Q192-L195 PolarHBondContact O-N 3.5Å; L195-K197 PolarHBondContact O-N 3.26Å; L195-S198 PolarHBondContact O-N 3.23Å; L195-S198 PolarHBondContact O-OG 3.05Å; L195-S198 VanDerWaalsContact O-OG 3.14Å; L195-G199 PolarHBondContact O-N 2.89Å; L195-A200 HydrophobicContact CD2-CB 4.17Å; L195-W201 HydrophobicContact CB-CB 4.49Å
196	T	79.5	Confident	71.6	Confident	75 Å²	75	84.8 Å²	84.8	46%	0.46	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-44	176.2	-57.2	0	0	0	0	112.3	Q192 W201	Q192-T196 WeakPolarHBondContact O-CB 3.35Å; Q192-T196 PolarHBondContact O-N 2.99Å; Q192-T196 PolarHBondContact O-OG1 2.9Å; T196-W201 PolarHBondContact O-NE1 2.93Å
197	K	78.1	Confident	68.9	Low	144 Å²	144	88.3 Å²	88.3	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-75.1	-26.3	-177.8	-72.1	167.3	-168.6	167	0	114.2	E193 I194 L195	E193-K197 VanDerWaalsContact O-CB 3.24Å; E193-K197 WeakPolarHBondContact O-CB 3.15Å; E193-K197 WeakPolarHBondContact O-CD 3.47Å; E193-K197 WeakPolarHBondContact O-CG 3.39Å; E193-K197 PolarHBondContact O-N 3.46Å; E193-K197 IonicContact OE2-NZ 3.4Å; E193-K197 PolarHBondContact OE2-NZ 3.17Å; I194-K197 PolarHBondContact O-N 3.1Å; L195-K197 PolarHBondContact O-N 3.26Å
198	S	77.7	Confident	66.1	Low	43 Å²	43	93.1 Å²	93.1	30%	0.301	50%	0.501	S	S	.	.	H	α-helix	trans	-86.4	-7.5	178.4	57.4	0	0	0	0	113.8	I194 L195 A200	I194-S198 VanDerWaalsContact O-CB 3.29Å; I194-S198 WeakPolarHBondContact O-CB 3.29Å; I194-S198 PolarHBondContact O-N 3.33Å; I194-S198 PolarHBondContact O-OG 3.37Å; L195-S198 PolarHBondContact O-N 3.23Å; L195-S198 PolarHBondContact O-OG 3.05Å; L195-S198 VanDerWaalsContact O-OG 3.14Å; S198-A200 PolarHBondContact O-N 2.99Å; S198-A200 VanDerWaalsContact O-N 3.12Å; S198-A200 WeakPolarHBondContact OG-CB 3.41Å
199	G	64.1	Low	63.1	Low	28 Å²	28	101 Å²	101	29%	0.289	54%	0.537	S	S	.	.	S	Bend	trans	71.6	-8.3	-171.6	0	0	0	0	0	114.3	L195 W201 F202	L195-G199 PolarHBondContact O-N 2.89Å; G199-W201 PolarHBondContact O-N 3.39Å; G199-F202 VanDerWaalsContact O-CB 3.27Å; G199-F202 WeakPolarHBondContact O-CB 3.45Å; G199-F202 PolarHBondContact O-N 3.44Å
200	A	60.6	Low	60.2	Low	38 Å²	38	101.1 Å²	101.1	31%	0.314	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-59.7	-25.5	-174.8	0	0	0	0	0	114	L195 S198 F202 F203 G204	L195-A200 HydrophobicContact CD2-CB 4.17Å; S198-A200 PolarHBondContact O-N 2.99Å; S198-A200 VanDerWaalsContact O-N 3.12Å; S198-A200 WeakPolarHBondContact OG-CB 3.41Å; A200-F202 PolarHBondContact O-N 3.49Å; A200-F203 PolarHBondContact O-N 2.84Å; A200-F203 VanDerWaalsContact O-N 3.1Å; A200-G204 PolarHBondContact O-N 3.07Å; A200-G204 VanDerWaalsContact O-N 3.15Å
201	W	61.6	Low	57.6	Low	102 Å²	102	99.8 Å²	99.8	39%	0.386	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-59.8	-24.4	172.4	69.6	-68.4	0	0	0	114.1	L195 T196 G199 F203 Y1175	L195-W201 HydrophobicContact CB-CB 4.49Å; T196-W201 PolarHBondContact O-NE1 2.93Å; G199-W201 PolarHBondContact O-N 3.39Å; W201-F203 VanDerWaalsContact C-N 3.33Å; W201-Y1175 HydrophobicContact CH2-CE2 4.33Å; W201-Y1175 AromaticContact CH2-CZ 3.78Å; W201-Y1175 WeakPolarHBondContact CH2-OH 3.48Å; W201-Y1175 HydrophobicContact CZ2-CE2 4.45Å
202	F	48.8	Very low	55.3	Low	148 Å²	148	105.6 Å²	105.6	65%	0.649	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-71.7	-27.2	175.8	-130.7	-93.5	0	0	0	112.6	G199 A200	G199-F202 VanDerWaalsContact O-CB 3.27Å; G199-F202 WeakPolarHBondContact O-CB 3.45Å; G199-F202 PolarHBondContact O-N 3.44Å; A200-F202 PolarHBondContact O-N 3.49Å
203	F	54.6	Low	52.9	Low	186 Å²	186	109.1 Å²	109.1	82%	0.816	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-9.8	178.7	-60.2	-79.6	0	0	0	113.2	A200 W201 S205	A200-F203 PolarHBondContact O-N 2.84Å; A200-F203 VanDerWaalsContact O-N 3.1Å; W201-F203 VanDerWaalsContact C-N 3.33Å; F203-S205 VanDerWaalsContact C-N 3.34Å; F203-S205 PolarHBondContact O-N 2.88Å
204	G	40.9	Very low	50.5	Low	64 Å²	64	108.2 Å²	108.2	66%	0.66	62%	0.624	S	S	*	*	S	Bend	trans	-86.2	16.3	-173.2	0	0	0	0	0	116.3	A200	A200-G204 PolarHBondContact O-N 3.07Å; A200-G204 VanDerWaalsContact O-N 3.15Å
205	S	35.2	Very low	48.2	Very low	114 Å²	114	111.3 Å²	111.3	80%	0.797	65%	0.646	S	S	*	*			trans	-125.8	55.1	-171.3	-60.2	0	0	0	0	113.3	F203	F203-S205 VanDerWaalsContact C-N 3.34Å; F203-S205 PolarHBondContact O-N 2.88Å
206	G	29.9	Very low	46.2	Very low	54 Å²	54	115.5 Å²	115.5	56%	0.557	67%	0.668	S	S	*	*			trans	-154.3	132.2	172	0	0	0	0	0	111.5	Q208	G206-Q208 PolarHBondContact O-N 3.06Å
207	P	35.8	Very low	44.2	Very low	141 Å²	141	116.2 Å²	116.2	92%	0.916	68%	0.676	S	S	*	*			trans	-81.9	59.5	177.5	35.3	-35.6	0	0	0	110.8
208	Q	33.3	Very low	42.2	Very low	188 Å²	188	115.7 Å²	115.7	88%	0.879	68%	0.68	S	S	*	*			trans	-91.3	126.4	-176.7	-155.5	165.5	11.5	0	0	111.1	G206	G206-Q208 PolarHBondContact O-N 3.06Å
209	Q	30.3	Very low	40.3	Very low	172 Å²	172	119.8 Å²	119.8	80%	0.804	70%	0.704	S	S	*	*			trans	-69.5	153.4	-178.4	-66.5	176.8	-97.5	0	0	111.9	S211	Q209-S211 VanDerWaalsContact C-N 3.32Å; Q209-S211 PolarHBondContact O-N 2.9Å
210	P	29.7	Very low	39.1	Very low	128 Å²	128	122.3 Å²	122.3	83%	0.831	72%	0.721	S	S	*	*			trans	-72.8	86	167.1	31.9	-34	0	0	0	110.1
211	S	32.8	Very low	38	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	75%	0.747	S	S	*	*			trans	-85.5	121	166.2	-158.7	0	0	0	0	109.2	Q209	Q209-S211 VanDerWaalsContact C-N 3.32Å; Q209-S211 PolarHBondContact O-N 2.9Å
212	Q	36.6	Very low	36.5	Very low	181 Å²	181	125.6 Å²	125.6	85%	0.846	76%	0.763	S	S	*	*			trans	-99.9	111.6	174.8	-69.4	-177.7	-3.6	0	0	109.7
213	D	33.9	Very low	35.9	Very low	157 Å²	157	123.7 Å²	123.7	84%	0.84	78%	0.775	S	S	*	*			trans	-118.8	132.1	156.4	-73.3	-67.3	0	0	0	108.1
214	G	34.7	Very low	35	Very low	67 Å²	67	118.6 Å²	118.6	69%	0.691	78%	0.775	S	S	*	*			cis	149.6	73	-0.9	0	0	0	0	0	112.1
215	T	34.6	Very low	34.8	Very low	128 Å²	128	120.7 Å²	120.7	79%	0.785	78%	0.779	S	S	*	*			trans	-142.7	103.2	171.3	35.2	0	0	0	0	112.8
216	L	38	Very low	34.9	Very low	162 Å²	162	123.6 Å²	123.6	85%	0.848	78%	0.78	S	S	*	*			trans	58.3	125	144.3	-44.8	179.8	0	0	0	117.3
217	S	38	Very low	35.3	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	79%	0.788	S	S	*	*			cis	-154.4	145.9	27.2	-113.2	0	0	0	0	113.1
218	D	34.3	Very low	35.7	Very low	133 Å²	133	125.5 Å²	125.5	71%	0.711	78%	0.78	S	S	*	*			trans	55.5	130.4	136.9	-47.4	-38.6	0	0	0	120
219	T	37.8	Very low	36	Very low	130 Å²	130	125.7 Å²	125.7	80%	0.798	77%	0.773	S	S	*	*			cis	-156.8	150.8	11.6	-24.9	0	0	0	0	112.4
220	A	39	Very low	36.5	Very low	80 Å²	80	123.6 Å²	123.6	66%	0.661	76%	0.763	S	S	*	*			trans	41.7	122	150.8	0	0	0	0	0	121.1
221	T	38.1	Very low	36.9	Very low	140 Å²	140	127 Å²	127	86%	0.859	77%	0.765	S	S	*	*				67	128.4	73.8	-51.3	0	0	0	0	114
222	G	30.1	Very low	37.1	Very low	70 Å²	70	131.1 Å²	131.1	72%	0.722	77%	0.77	S	S	*	*			cis	124	106.7	-2.6	0	0	0	0	0	113.7
223	A	35.4	Very low	37.2	Very low	107 Å²	107	127.5 Å²	127.5	88%	0.884	77%	0.77	S	S	*	*			trans	-164.5	150.3	173.8	0	0	0	0	0	113.7
224	G	36.8	Very low	37.4	Very low	79 Å²	79	130.4 Å²	130.4	81%	0.814	77%	0.77	S	S	*	*			trans	79.4	118.5	166.9	0	0	0	0	0	116.5
225	S	37.3	Very low	37.6	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	77%	0.77	S	S	*	*			cis	131.1	132.6	-12.4	-159.7	0	0	0	0	111.7
226	E	36.4	Very low	37.8	Very low	175 Å²	175	133.9 Å²	133.9	82%	0.818	76%	0.763	S	S	*	*			trans	70.5	128	171	-41.7	-146.3	153	0	0	117.2
227	V	37.9	Very low	37.7	Very low	120 Å²	120	132 Å²	132	73%	0.727	75%	0.749	S	S	*	*			cis	95.7	111.8	30.8	174.7	0	0	0	0	113.6	R229	V227-R229 HydrophobicContact CG1-CG 4.45Å
228	P	44.2	Very low	37.7	Very low	116 Å²	116	137.6 Å²	137.6	75%	0.753	76%	0.757	S	S	*	*				-129.7	145.4	106.5	6.7	15.8	0	0	0	112.7
229	R	40.4	Very low	37.9	Very low	192 Å²	192	136 Å²	136	73%	0.725	76%	0.756	S	S	*	*				63.2	136.5	71.2	-63.2	-178.9	74.3	142.2	5.9	113.3	V227	V227-R229 HydrophobicContact CG1-CG 4.45Å
230	E	39.8	Very low	37.9	Very low	128 Å²	128	140.7 Å²	140.7	60%	0.598	76%	0.759	S	S	*	*			cis	-154	177.4	5.1	-118.3	164.1	136.4	0	0	109.2
231	K	38.8	Very low	37.8	Very low	198 Å²	198	141.9 Å²	141.9	86%	0.861	76%	0.762	S	S	*	*			cis	-149.9	-159.2	39	-139.6	154.3	-174.6	170.9	0	112.3
232	K	35.9	Very low	37.8	Very low	194 Å²	194	143.6 Å²	143.6	84%	0.843	76%	0.76	S	S	*	*			trans	-153.9	93.4	-146.8	-169.4	174.4	-178.2	176.2	0	117.1
233	A	40	Very low	37.9	Very low	104 Å²	104	146.3 Å²	146.3	86%	0.86	76%	0.763	S	S	*	*			trans	-154	128.6	166.7	0	0	0	0	0	111.2
234	R	36.8	Very low	38.3	Very low	219 Å²	219	146.3 Å²	146.3	83%	0.826	75%	0.754	S	S	*	*			cis	112.3	137	5.8	-162.9	-166.4	173.7	-175.4	-1.6	113.4
235	L	39.2	Very low	38.3	Very low	134 Å²	134	149.7 Å²	149.7	70%	0.702	75%	0.753	S	S	*	*			trans	95	153.1	168.3	-54.4	176.5	0	0	0	117.3
236	Q	39.9	Very low	38.3	Very low	134 Å²	134	149 Å²	149	63%	0.626	75%	0.748	S	S	*	*			cis	-171.9	125.3	-49.6	164.9	162.3	3.2	0	0	110.7
237	E	35	Very low	38.1	Very low	121 Å²	121	147 Å²	147	57%	0.565	75%	0.748	S	S	*	*			trans	56	155.8	155	-79.8	-177.1	78.8	0	0	124.1
238	R	39	Very low	38.1	Very low	208 Å²	208	145.7 Å²	145.7	79%	0.785	75%	0.75	S	S	*	*			trans	65	160.9	150.1	-77.1	160.7	151.5	132.3	-17	118.9
239	S	38.1	Very low	37.6	Very low	98 Å²	98	144.1 Å²	144.1	69%	0.685	75%	0.747	S	S	*	*			cis	178.5	143.3	-47	-97.1	0	0	0	0	109.5
240	R	38.6	Very low	37.5	Very low	230 Å²	230	141.4 Å²	141.4	87%	0.868	75%	0.751	S	S	*	*			trans	66.4	100.6	155.5	-72.2	-177.7	166.7	125	-2.6	120.8
241	S	36.8	Very low	37.3	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	76%	0.757	S	S	*	*				74.5	150	117.5	67.7	0	0	0	0	124.2
242	Q	37	Very low	37.2	Very low	176 Å²	176	135.4 Å²	135.4	82%	0.822	75%	0.748	S	S	*	*			trans	94	93.2	161.4	-59.5	-170.3	-3.4	0	0	120.1
243	T	32.2	Very low	37.4	Very low	128 Å²	128	134.2 Å²	134.2	79%	0.785	75%	0.746	S	S	*	*				-4	164.6	124.2	44	0	0	0	0	120.8
244	P	43.8	Very low	37.2	Very low	106 Å²	106	135.1 Å²	135.1	69%	0.688	74%	0.736	S	S	*	*			cis	-143.3	-162.8	-13.7	32.1	-7.2	0	0	0	115.5
245	L	37.9	Very low	37.1	Very low	151 Å²	151	130.6 Å²	130.6	79%	0.791	73%	0.733	S	S	*	*			trans	95.5	125.2	149.9	-70.7	158.3	0	0	0	122.5
246	S	35.5	Very low	37	Very low	92 Å²	92	127.6 Å²	127.6	64%	0.643	73%	0.727	S	S	*	*			trans	74	106.9	132.6	-61.7	0	0	0	0	124.7
247	T	33.1	Very low	36.9	Very low	133 Å²	133	126.4 Å²	126.4	82%	0.816	73%	0.733	S	S	*	*				77	131	115.5	-50.3	0	0	0	0	122.3
248	A	37.3	Very low	37.2	Very low	94 Å²	94	128.8 Å²	128.8	78%	0.777	74%	0.744	S	S	*	*			trans	68.3	159.6	160.9	0	0	0	0	0	118
249	A	35.5	Very low	37	Very low	83 Å²	83	122.7 Å²	122.7	69%	0.686	75%	0.746	S	S	*	*			cis	-170.8	-179.4	-29.7	0	0	0	0	0	108.8
250	V	36.4	Very low	37.1	Very low	135 Å²	135	122.7 Å²	122.7	82%	0.818	75%	0.752	S	S	*	*			trans	72.4	114.7	163	177	0	0	0	0	115
251	S	36	Very low	37.2	Very low	103 Å²	103	117.4 Å²	117.4	72%	0.72	75%	0.747	S	S	*	*				74.8	140	84.5	-138.1	0	0	0	0	113.7
252	S	37.2	Very low	37.3	Very low	96 Å²	96	120.1 Å²	120.1	67%	0.671	75%	0.753	S	S	*	*			cis	-170.3	-175.1	-9.1	-99.2	0	0	0	0	110.3
253	Q	39.6	Very low	37.2	Very low	170 Å²	170	118 Å²	118	79%	0.794	75%	0.747	S	S	*	*			trans	76	160.4	161	-50.1	-157.4	-101.1	0	0	117.2
254	D	35.4	Very low	37.5	Very low	123 Å²	123	121.6 Å²	121.6	66%	0.658	75%	0.747	S	S	*	*			cis	-174.6	169.8	-31	-92.3	-33	0	0	0	107.5
255	T	36.6	Very low	37.2	Very low	124 Å²	124	122.9 Å²	122.9	76%	0.761	75%	0.747	S	S	*	*			cis	-154.6	174.6	-4.4	7.3	0	0	0	0	109.9
256	A	36.4	Very low	37.2	Very low	70 Å²	70	125.2 Å²	125.2	58%	0.579	75%	0.751	S	S	*	*			trans	40.8	129.3	148.8	0	0	0	0	0	121.1
257	S	38.1	Very low	37.2	Very low	109 Å²	109	124.1 Å²	124.1	76%	0.762	76%	0.755	S	S	*	*				169.3	-178.7	68.5	46	0	0	0	0	110.7
258	H	39.9	Very low	37.2	Very low	172 Å²	172	122.7 Å²	122.7	80%	0.796	76%	0.756	S	S	*	*				-160.2	148.4	-53.9	-84.6	-44	0	0	0	109.9
259	G	35.9	Very low	36.9	Very low	79 Å²	79	125.2 Å²	125.2	81%	0.814	75%	0.752	S	S	*	*			trans	84.5	151.6	169.5	0	0	0	0	0	116.7
260	A	39.4	Very low	37.1	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	76%	0.755	S	S	*	*			cis	160.6	158.5	-24	0	0	0	0	0	107.3
261	P	41.7	Very low	36.8	Very low	118 Å²	118	123.7 Å²	123.7	77%	0.766	74%	0.739	S	S	*	*			trans	-125.5	174.6	-139.3	42.8	-31.9	0	0	0	116.9
262	L	38.6	Very low	36.6	Very low	161 Å²	161	126.5 Å²	126.5	84%	0.843	74%	0.741	S	S	*	*			trans	164.6	131.5	148.8	-86.4	154.4	0	0	0	105.8
263	D	35.1	Very low	36.4	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	75%	0.747	S	S	*	*			cis	106	149.3	30.6	-169.6	29.9	0	0	0	112.7
264	R	38	Very low	35.9	Very low	204 Å²	204	126.5 Å²	126.5	77%	0.77	75%	0.747	S	S	*	*			trans	74.7	102.4	168.1	-84.2	-178.5	162.3	-157.2	-4.6	121.8
265	N	38.6	Very low	36.1	Very low	132 Å²	132	129.1 Å²	129.1	71%	0.706	76%	0.76	S	S	*	*				82.3	122	113.2	-94.7	-21.5	0	0	0	123.2
266	K	37.6	Very low	35.7	Very low	201 Å²	201	126.3 Å²	126.3	87%	0.874	76%	0.755	S	S	*	*				77	117	118.4	-171.9	-175.4	-178.4	-179.4	0	120
267	G	34.2	Very low	35.9	Very low	69 Å²	69	129.1 Å²	129.1	71%	0.711	77%	0.767	S	S	*	*			trans	152.8	124.6	135.2	0	0	0	0	0	118.6
268	A	34.7	Very low	35.3	Very low	102 Å²	102	132.2 Å²	132.2	84%	0.843	77%	0.77	S	S	*	*			trans	59.9	124.6	146.2	0	0	0	0	0	121.7
269	E	30.9	Very low	35.1	Very low	148 Å²	148	132.7 Å²	132.7	69%	0.692	77%	0.772	S	S	*	*			trans	-69.7	153	151.7	-165	-117.1	-176.9	0	0	109.9	S271	E269-S271 WeakPolarHBondContact OE1-CA 3.44Å; E269-S271 PolarHBondContact OE1-N 3.36Å; E269-S271 PolarHBondContact OE2-N 2.86Å; E269-S271 PolarHBondContact OE2-OG 2.95Å
270	P	38.6	Very low	34.9	Very low	115 Å²	115	137.3 Å²	137.3	75%	0.747	77%	0.77	S	S	*	*				-147.7	119.3	118.6	34	-16.4	0	0	0	115.7
271	S	30.1	Very low	34.8	Very low	70 Å²	70	142 Å²	142	49%	0.49	78%	0.775	S	S	.	*				57.4	132.4	112.3	-88.1	0	0	0	0	122.2	E269	E269-S271 WeakPolarHBondContact OE1-CA 3.44Å; E269-S271 PolarHBondContact OE1-N 3.36Å; E269-S271 PolarHBondContact OE2-N 2.86Å; E269-S271 PolarHBondContact OE2-OG 2.95Å
272	Q	32	Very low	34.2	Very low	163 Å²	163	140.4 Å²	140.4	76%	0.762	77%	0.772	S	S	*	*			trans	86.2	160.5	144	-67.3	172.5	34.2	0	0	120.8
273	Q	33	Very low	34.1	Very low	172 Å²	172	138 Å²	138	80%	0.804	77%	0.768	S	S	*	*			trans	67.2	95.4	171.8	-66.3	158.7	48.4	0	0	113.8
274	A	28.7	Very low	34.2	Very low	94 Å²	94	142.3 Å²	142.3	78%	0.777	78%	0.775	S	S	*	*				65.5	117.3	53.7	0	0	0	0	0	113.9
275	L	40.4	Very low	33.9	Very low	178 Å²	178	138 Å²	138	93%	0.932	78%	0.776	S	S	*	*			trans	179.9	125.8	151.4	-99.6	160	0	0	0	108.7
276	G	28.5	Very low	33.8	Very low	64 Å²	64	142.6 Å²	142.6	66%	0.66	78%	0.783	S	S	*	*			trans	-81.9	173.5	162.2	0	0	0	0	0	110.8
277	P	39.9	Very low	33.8	Very low	130 Å²	130	137.6 Å²	137.6	84%	0.844	77%	0.774	S	S	*	*				-147.1	178.5	79.9	40	-24	0	0	0	115.9
278	E	26.1	Very low	33.7	Very low	173 Å²	173	142.7 Å²	142.7	81%	0.808	78%	0.779	S	S	*	*			trans	-61.5	146.1	161.8	-70.8	-178.5	62.9	0	0	112.6
279	Q	35.8	Very low	34.2	Very low	183 Å²	183	142.2 Å²	142.2	86%	0.855	77%	0.768	S	S	*	*			trans	-149.9	76.1	143.2	-152.8	162.5	-11.3	0	0	116.2
280	K	32	Very low	34.8	Very low	175 Å²	175	140.7 Å²	140.7	76%	0.761	77%	0.771	S	S	*	*				48.9	85.2	109.2	-159.9	177.4	-163.4	166.3	0	119.5
281	Q	36.9	Very low	34.8	Very low	197 Å²	197	145.3 Å²	145.3	92%	0.921	77%	0.773	S	S	*	*			trans	-165.6	115.4	148.1	-107	172.4	15.5	0	0	108.6
282	A	28.9	Very low	35.2	Very low	86 Å²	86	148.4 Å²	148.4	71%	0.711	78%	0.78	S	S	*	*			cis	89.3	75.1	13.8	0	0	0	0	0	117.2
283	S	36.5	Very low	35.5	Very low	109 Å²	109	149.7 Å²	149.7	76%	0.762	78%	0.778	S	S	*	*			trans	-168.1	150.8	153.3	-84.1	0	0	0	0	109.9
284	R	36.5	Very low	35.8	Very low	223 Å²	223	149.5 Å²	149.5	84%	0.842	77%	0.774	S	S	*	*			cis	170.2	115.7	-22.5	-111.1	169.5	178.2	-165	-0.3	105.7
285	S	31.7	Very low	36.1	Very low	114 Å²	114	153.8 Å²	153.8	80%	0.797	78%	0.775	S	S	*	*			trans	70.8	168.2	139.9	-43.3	0	0	0	0	118.3
286	R	37.6	Very low	35.7	Very low	228 Å²	228	149.2 Å²	149.2	86%	0.86	76%	0.763	S	S	*	*			cis	-161.6	156.6	9.3	-153.9	178.8	-175.7	178.7	-0.4	112.3
287	S	36	Very low	36.1	Very low	96 Å²	96	152.3 Å²	152.3	67%	0.671	77%	0.772	S	S	*	*			trans	56.4	132.5	153	44.3	0	0	0	0	120.7
288	E	33.1	Very low	35.8	Very low	177 Å²	177	149.3 Å²	149.3	83%	0.827	77%	0.765	S	S	*	*				69.2	152.1	55	-94.8	-157.7	113.6	0	0	116.6
289	P	45.2	Very low	36.2	Very low	92 Å²	92	149.7 Å²	149.7	60%	0.597	77%	0.771	S	S	*	*			cis	-137.1	-22.9	-14	25.6	-5.1	0	0	0	124.5	R291	P289-R291 PolarHBondContact O-N 2.85Å
290	P	42.7	Very low	36	Very low	116 Å²	116	145.1 Å²	145.1	75%	0.753	76%	0.759	S	S	*	*				-110.5	90.7	-117.8	35.7	-24.6	0	0	0	119
291	R	39.9	Very low	35.8	Very low	211 Å²	211	144.8 Å²	144.8	80%	0.796	76%	0.761	S	S	*	*				52	147	127	-69.5	-172	176.1	-144.7	3.6	125.7	P289	P289-R291 PolarHBondContact O-N 2.85Å
292	E	37.1	Very low	35.9	Very low	136 Å²	136	144 Å²	144	64%	0.636	76%	0.757	S	S	*	*			trans	76	146	148.6	-80.5	176.7	-121.8	0	0	118.5
293	R	39.1	Very low	35.9	Very low	189 Å²	189	147.5 Å²	147.5	71%	0.713	76%	0.764	S	S	*	*			cis	-162.2	138.4	23	-143.9	171.4	-169.5	-155.8	2.6	114.6
294	K	38.8	Very low	35.8	Very low	168 Å²	168	145.9 Å²	145.9	73%	0.73	76%	0.764	S	S	*	*			trans	57.8	153.4	157.8	-75.1	171.7	173.6	172.9	0	118
295	K	35.6	Very low	35.6	Very low	184 Å²	184	145.5 Å²	145.5	80%	0.8	77%	0.768	S	S	*	*			cis	-161.1	133.3	-9.6	-124.2	-178.1	175.2	-166	0	103.4
296	A	30.9	Very low	35.7	Very low	83 Å²	83	144 Å²	144	69%	0.686	77%	0.772	S	S	*	*				59.4	138.9	53.2	0	0	0	0	0	115.3
297	P	37.3	Very low	35.4	Very low	128 Å²	128	136.3 Å²	136.3	83%	0.831	76%	0.763	S	S	*	*			cis	-143.9	172	-49.3	39.7	-24	0	0	0	115.3
298	G	33.9	Very low	35.5	Very low	68 Å²	68	139.8 Å²	139.8	70%	0.701	77%	0.768	S	S	*	*			trans	92.4	161	133.2	0	0	0	0	0	122
299	L	35.3	Very low	35.5	Very low	180 Å²	180	139.1 Å²	139.1	94%	0.942	76%	0.763	S	S	*	*			trans	60.9	166.9	158.2	-50.1	178.8	0	0	0	118
300	S	30.4	Very low	35.1	Very low	87 Å²	87	139.4 Å²	139.4	61%	0.608	77%	0.767	S	S	*	*			cis	-178.4	151.9	-43.7	-162.1	0	0	0	0	105.4
301	E	29	Very low	35	Very low	168 Å²	168	140 Å²	140	79%	0.785	76%	0.76	S	S	*	*			trans	16.3	116.2	160.7	-61.8	166.3	102.4	0	0	121.5
302	Q	38	Very low	35	Very low	182 Å²	182	140.2 Å²	140.2	85%	0.85	76%	0.761	S	S	*	*				-176.9	132.6	115.7	-94.4	156.2	81.4	0	0	108.7
303	N	28.4	Very low	35.1	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	77%	0.765	S	S	*	*				68.9	104.3	61.9	-158.3	5.3	0	0	0	112.4
304	G	36.1	Very low	35.1	Very low	74 Å²	74	144.5 Å²	144.5	76%	0.763	78%	0.776	S	S	*	*			trans	-178.6	134.5	-179.2	0	0	0	0	0	112.8
305	K	31.3	Very low	35.1	Very low	215 Å²	215	142.9 Å²	142.9	94%	0.935	78%	0.78	S	S	*	*			trans	-113.1	151.6	-178.3	-68.5	176.8	179.9	172.7	0	111.7
306	G	33.8	Very low	35.3	Very low	84 Å²	84	139 Å²	139	87%	0.866	77%	0.773	S	S	*	*			trans	101.1	156.2	163.8	0	0	0	0	0	114.8
307	G	31.2	Very low	35.6	Very low	66 Å²	66	144 Å²	144	68%	0.68	78%	0.78	S	S	*	*			cis	156.6	140.4	-8.3	0	0	0	0	0	113.4
308	Q	37.3	Very low	35.2	Very low	168 Å²	168	142.8 Å²	142.8	79%	0.785	77%	0.774	S	S	*	*			trans	67.7	164.3	-177.8	-40.2	-169.4	6.4	0	0	113.2
309	K	34.6	Very low	35.2	Very low	164 Å²	164	145.8 Å²	145.8	71%	0.713	78%	0.778	S	S	*	*			cis	-160.7	161	3.7	-145.4	165.6	-168.6	149	0	111.1
310	S	36	Very low	35.2	Very low	98 Å²	98	143.9 Å²	143.9	69%	0.685	77%	0.774	S	S	*	*			trans	68	153	149.2	-76.6	0	0	0	0	119.1
311	E	41.2	Very low	35.2	Very low	129 Å²	129	148.1 Å²	148.1	60%	0.603	78%	0.784	S	S	*	*			cis	-156.5	-178.2	-5.8	-135.7	-160	85.8	0	0	114.4	K313	E311-K313 WeakPolarHBondContact OE1-CE 3.08Å; E311-K313 IonicContact OE1-NZ 2.63Å; E311-K313 PolarHBondContact OE1-NZ 3.28Å
312	R	39.2	Very low	35.6	Very low	215 Å²	215	146 Å²	146	81%	0.811	79%	0.785	S	S	*	*			trans	81.3	102.1	171.4	-53.8	-167.2	172.1	-166.8	-3.1	114.9
313	K	39.7	Very low	35.4	Very low	167 Å²	167	140.5 Å²	140.5	73%	0.726	78%	0.777	S	S	*	*				74.3	128.4	72.2	-69.5	160.8	176.7	153.4	0	110.8	E311	E311-K313 WeakPolarHBondContact OE1-CE 3.08Å; E311-K313 IonicContact OE1-NZ 2.63Å; E311-K313 PolarHBondContact OE1-NZ 3.28Å
314	R	39.3	Very low	35.7	Very low	248 Å²	248	142.8 Å²	142.8	94%	0.936	78%	0.782	S	S	*	*			cis	-131.8	169.9	29.7	-62.6	176.2	179.9	155.7	-0.8	115.1
315	V	38.2	Very low	35.7	Very low	134 Å²	134	142.6 Å²	142.6	81%	0.812	78%	0.781	S	S	*	*			trans	-151.1	-173.4	176.9	-131.3	0	0	0	0	105
316	P	40.8	Very low	35.9	Very low	103 Å²	103	138.8 Å²	138.8	67%	0.669	78%	0.775	S	S	*	*			cis	-141.1	-161.1	-14.3	38.6	-16.3	0	0	0	115.1
317	K	36.2	Very low	36	Very low	188 Å²	188	139.1 Å²	139.1	82%	0.817	77%	0.77	S	S	*	*			trans	83.8	98.5	146.4	-80.2	177.2	-178.4	-175.7	0	121.6
318	S	29.5	Very low	36.3	Very low	101 Å²	101	143.1 Å²	143.1	71%	0.706	78%	0.776	S	S	*	*				-15.5	148.4	127.3	55.9	0	0	0	0	119.9
319	V	34.5	Very low	36.4	Very low	131 Å²	131	141.2 Å²	141.2	79%	0.794	77%	0.767	S	S	*	*				161.4	128.4	122	154.5	0	0	0	0	113.2
320	V	34.2	Very low	36.6	Very low	140 Å²	140	142 Å²	142	85%	0.848	77%	0.766	S	S	*	*			trans	74.6	150.9	156.5	161	0	0	0	0	121.7
321	Q	30.9	Very low	36.5	Very low	177 Å²	177	142.4 Å²	142.4	83%	0.827	76%	0.757	S	S	*	*			trans	-84.2	-178.2	178.4	-75.1	-161.7	74.6	0	0	112.2
322	P	36.8	Very low	36.1	Very low	124 Å²	124	146.2 Å²	146.2	81%	0.805	77%	0.765	S	S	*	*			cis	-142.1	-163	16.7	45	-24.7	0	0	0	116.1
323	G	35.1	Very low	35.9	Very low	66 Å²	66	144.6 Å²	144.6	68%	0.68	76%	0.764	S	S	*	*			trans	132	91.4	145.3	0	0	0	0	0	119.8
324	E	33.5	Very low	35.9	Very low	206 Å²	206	141.9 Å²	141.9	96%	0.963	75%	0.754	S	S	*	*			trans	50.6	132.9	136.7	-61.4	-178.8	96.4	0	0	125.3
325	G	36.5	Very low	35.6	Very low	71 Å²	71	138.8 Å²	138.8	73%	0.732	74%	0.742	S	S	*	*			trans	112.3	135.8	143.7	0	0	0	0	0	117.8
326	T	36.1	Very low	35.5	Very low	134 Å²	134	141.5 Å²	141.5	82%	0.822	74%	0.738	S	S	*	*			cis	-162.6	145.9	-11.7	41.5	0	0	0	0	110.3
327	A	36.2	Very low	35.4	Very low	91 Å²	91	143.3 Å²	143.3	75%	0.752	74%	0.738	S	S	*	*			trans	62.9	153.8	158.6	0	0	0	0	0	120
328	D	37.6	Very low	35.2	Very low	151 Å²	151	140.2 Å²	140.2	81%	0.807	74%	0.735	S	S	*	*			cis	-171	179.8	-41	-113.7	-60.9	0	0	0	106.8
329	E	39	Very low	35.3	Very low	128 Å²	128	146.5 Å²	146.5	60%	0.598	74%	0.743	S	S	*	*			cis	-148.3	158.6	7.5	-146.1	-155.2	172.7	0	0	110.1
330	R	38.1	Very low	35.4	Very low	181 Å²	181	152.4 Å²	152.4	68%	0.683	75%	0.751	S	S	*	*			trans	65.1	168	155.9	-69.9	-176.6	-161.3	-88.7	-14.4	122.9
331	E	34.5	Very low	35.3	Very low	106 Å²	106	153.5 Å²	153.5	50%	0.495	75%	0.751	S	S	.	*			cis	-178.4	115.5	-40.5	-175.7	-178	161.2	0	0	112.4
332	R	32.5	Very low	35.4	Very low	209 Å²	209	151.8 Å²	151.8	79%	0.789	74%	0.743	S	S	*	*			trans	55.7	172.9	152.1	-60.5	173.2	174.2	123.9	-0.8	120.9
333	K	35.7	Very low	35.4	Very low	180 Å²	180	154.1 Å²	154.1	78%	0.783	74%	0.741	S	S	*	*			trans	67.6	154	163.8	-68.3	-164	161.9	-139	0	117.7
334	E	37.9	Very low	35.5	Very low	111 Å²	111	154.8 Å²	154.8	52%	0.519	75%	0.747	S	S	.	*			cis	-149.7	128.1	-26.1	-117.8	-173.6	102.1	0	0	105.5
335	R	33.3	Very low	35.6	Very low	182 Å²	182	156.4 Å²	156.4	69%	0.687	75%	0.745	S	S	*	*				74.8	132.4	91.4	-176.5	-166	-176.3	-155.7	3.1	114.6
336	R	36.6	Very low	35.3	Very low	191 Å²	191	157.2 Å²	157.2	72%	0.721	74%	0.739	S	S	*	*			trans	73.2	155.9	177	-73.5	162.3	177.3	-133.8	13.6	115.2
337	E	39.7	Very low	35	Very low	141 Å²	141	159.2 Å²	159.2	66%	0.659	74%	0.739	S	S	*	*			cis	-138.4	124.4	1.8	-145	141.2	-126.2	0	0	113.3
338	T	31.1	Very low	35.1	Very low	123 Å²	123	161.8 Å²	161.8	76%	0.755	74%	0.74	S	S	*	*			trans	-98.5	144.6	158.1	53.1	0	0	0	0	109.5
339	R	31.7	Very low	34.7	Very low	233 Å²	233	165 Å²	165	88%	0.879	74%	0.743	S	S	*	*			trans	77.7	105.3	176.8	-47.6	174.6	-177.5	-171	-0.1	115.9
340	R	37.3	Very low	34.9	Very low	255 Å²	255	164.1 Å²	164.1	96%	0.962	75%	0.748	S	S	*	*				-147.9	168	122.9	-114	173.5	-176.2	-156.1	-2.3	110.7
341	L	32	Very low	34.7	Very low	163 Å²	163	162.5 Å²	162.5	85%	0.853	75%	0.752	S	S	*	*			trans	-133	166.8	-157.8	-100.5	163.1	0	0	0	111.4
342	E	33.3	Very low	34.7	Very low	142 Å²	142	167.6 Å²	167.6	66%	0.664	77%	0.767	S	S	*	*			trans	84	138.4	154.1	-72.3	-128.7	91.1	0	0	122.4
343	K	35	Very low	34.9	Very low	173 Å²	173	164.9 Å²	164.9	75%	0.752	77%	0.768	S	S	*	*			trans	69.9	118.1	145.8	-75.2	171.8	169.7	71.8	0	121
344	G	37.4	Very low	34.8	Very low	79 Å²	79	165.5 Å²	165.5	81%	0.814	77%	0.773	S	S	*	*			trans	171.3	98.2	155.6	0	0	0	0	0	115.4
345	R	35.3	Very low	35	Very low	241 Å²	241	169.6 Å²	169.6	91%	0.909	79%	0.789	S	S	*	*			trans	-17.3	127.4	164.4	-70	177.3	-179.5	-162.9	-1.6	116.4
346	S	31.1	Very low	35.3	Very low	88 Å²	88	170.8 Å²	170.8	62%	0.615	79%	0.794	S	S	*	*				82.9	117.5	55.2	75.9	0	0	0	0	115.3
347	Q	30.5	Very low	35.5	Very low	175 Å²	175	166.7 Å²	166.7	82%	0.818	78%	0.783	S	S	*	*			trans	67.6	143.6	168.6	-68.6	170.2	-79.2	0	0	114.9
348	D	37	Very low	35.5	Very low	145 Å²	145	167.3 Å²	167.3	78%	0.775	79%	0.791	S	S	*	*			cis	-140.5	-176.7	22.1	-85.2	-59.6	0	0	0	114.5
349	Y	29.2	Very low	36.3	Very low	220 Å²	220	164 Å²	164	86%	0.863	78%	0.781	S	S	*	*			trans	-155.3	164.7	-178.1	-136.1	-101.7	0	0	0	109.1
350	P	43.5	Very low	37.4	Very low	109 Å²	109	159.1 Å²	159.1	71%	0.708	76%	0.763	S	S	*	*				-113.5	-171.4	-67.5	43.2	-30.1	0	0	0	111.8
351	D	33.8	Very low	38.5	Very low	146 Å²	146	151.4 Å²	151.4	78%	0.781	74%	0.744	S	S	*	*			trans	-161.3	157.3	138.9	-153.5	0.8	0	0	0	114.1
352	R	34.5	Very low	40.2	Very low	214 Å²	214	146.6 Å²	146.6	81%	0.808	73%	0.728	S	S	*	*			trans	56.2	97.1	162.5	-45.1	-178.3	81.8	170.3	4.4	120.6
353	L	37	Very low	42	Very low	152 Å²	152	144.8 Å²	144.8	80%	0.796	72%	0.719	S	S	*	*				-153.6	37.8	129.1	-129.5	170.9	0	0	0	115.3	K355	L353-K355 PolarHBondContact O-N 3.34Å
354	E	34.6	Very low	43.9	Very low	192 Å²	192	141.1 Å²	141.1	90%	0.897	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	89.9	174.7	-71.4	-164.7	125.6	0	0	113
355	K	40.8	Very low	45.6	Very low	198 Å²	198	143 Å²	143	86%	0.861	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.8	10.5	150.7	-124.2	-175.8	-179.7	-169.2	0	117.5	L353	L353-K355 PolarHBondContact O-N 3.34Å
356	R	39.5	Very low	47.6	Very low	207 Å²	207	136.8 Å²	136.8	78%	0.781	68%	0.675	S	S	*	*	S	Bend	trans	-132.1	13.2	-170.5	-148.1	-178.7	178.6	-166.4	-1.3	115.6
357	E	41.9	Very low	49.8	Very low	105 Å²	105	138.6 Å²	138.6	49%	0.491	67%	0.674	S	S	.	*			trans	-112.6	-16.7	-168	-52.3	-149	94.5	0	0	115.1	G359 R360 V361	E357-G359 PolarHBondContact O-N 3.09Å; E357-G359 VanDerWaalsContact O-N 3.15Å; E357-R360 WeakPolarHBondContact O-CA 3.48Å; E357-R360 PolarHBondContact O-N 2.88Å; E357-R360 IonicContact OE1-CZ 3.65Å; E357-R360 IonicContact OE1-NE 3.59Å; E357-R360 IonicContact OE1-NH2 3.18Å; E357-R360 PolarHBondContact OE1-NH2 3.12Å; E357-V361 PolarHBondContact O-N 3.25Å
358	D	40	Very low	52.1	Low	154 Å²	154	139.1 Å²	139.1	82%	0.824	67%	0.668	S	S	*	*	H	α-helix	trans	-53	-38.3	178.3	-134	-5.8	0	0	0	112.4
359	G	46.5	Very low	54	Low	54 Å²	54	138.2 Å²	138.2	56%	0.557	66%	0.658	S	S	*	*	H	α-helix	trans	-76.8	-20.7	175	0	0	0	0	0	115.2	E357	E357-G359 PolarHBondContact O-N 3.09Å; E357-G359 VanDerWaalsContact O-N 3.15Å
360	R	56.3	Low	56.3	Low	129 Å²	129	134.1 Å²	134.1	49%	0.487	65%	0.646	S	S	.	*	H	α-helix	trans	-82	-43.8	173.8	-84.1	-164.3	-69.3	-114.6	6.8	111.6	E357 A362 E363 D364	E357-R360 WeakPolarHBondContact O-CA 3.48Å; E357-R360 PolarHBondContact O-N 2.88Å; E357-R360 IonicContact OE1-CZ 3.65Å; E357-R360 IonicContact OE1-NE 3.59Å; E357-R360 IonicContact OE1-NH2 3.18Å; E357-R360 PolarHBondContact OE1-NH2 3.12Å; R360-A362 PolarHBondContact O-N 3.31Å; R360-A362 VanDerWaalsContact O-N 3.16Å; R360-E363 CarbonylContact O-C 3.6Å; R360-E363 PolarHBondContact O-N 2.99Å; R360-D364 WeakPolarHBondContact O-CB 3.08Å; R360-D364 PolarHBondContact O-N 3.06Å
361	V	60	Low	58.1	Low	93 Å²	93	135.1 Å²	135.1	56%	0.564	64%	0.641	S	S	*	*	H	α-helix	trans	-55.9	-36.5	176.7	179.1	0	0	0	0	111.4	E357 E365	E357-V361 PolarHBondContact O-N 3.25Å; V361-E365 WeakPolarHBondContact O-CB 3.41Å; V361-E365 PolarHBondContact O-N 2.96Å
362	A	67.4	Low	60.3	Low	63 Å²	63	132.3 Å²	132.3	52%	0.521	62%	0.624	S	S	.	*	H	α-helix	trans	-69.7	-37.4	175.2	0	0	0	0	0	114.2	R360 K366	R360-A362 PolarHBondContact O-N 3.31Å; R360-A362 VanDerWaalsContact O-N 3.16Å; A362-K366 VanDerWaalsContact O-CB 3.29Å; A362-K366 WeakPolarHBondContact O-CB 3.43Å; A362-K366 PolarHBondContact O-N 3.02Å
363	E	70.1	Confident	61.9	Low	104 Å²	104	130.4 Å²	130.4	49%	0.486	62%	0.618	S	S	.	*	H	α-helix	trans	-72.8	-40.6	173.3	-79.2	-77.1	88.1	0	0	111.2	R360 K366 Q367	R360-E363 CarbonylContact O-C 3.6Å; R360-E363 PolarHBondContact O-N 2.99Å; E363-K366 WeakPolarHBondContact O-CB 3.37Å; E363-K366 PolarHBondContact O-N 3.3Å; E363-K366 WeakPolarHBondContact OE1-CD 3.4Å; E363-K366 IonicContact OE1-NZ 2.63Å; E363-K366 PolarHBondContact OE1-NZ 3.23Å; E363-K366 IonicContact OE2-NZ 2.8Å; E363-Q367 VanDerWaalsContact O-CB 3.28Å; E363-Q367 WeakPolarHBondContact O-CB 3.41Å; E363-Q367 PolarHBondContact O-N 3.07Å
364	D	74.9	Confident	63.8	Low	96 Å²	96	128.3 Å²	128.3	51%	0.513	60%	0.604	S	S	.	*	H	α-helix	trans	-64.8	-42.7	176.8	-73.3	-40.2	0	0	0	111.7	R360 K366 Q367 R368	R360-D364 WeakPolarHBondContact O-CB 3.08Å; R360-D364 PolarHBondContact O-N 3.06Å; D364-K366 VanDerWaalsContact C-N 3.32Å; D364-K366 PolarHBondContact O-N 3.38Å; D364-Q367 PolarHBondContact O-N 2.84Å; D364-R368 WeakPolarHBondContact O-CB 3.35Å; D364-R368 PolarHBondContact O-N 3.28Å
365	E	73.9	Confident	65.7	Low	117 Å²	117	123 Å²	123	55%	0.547	58%	0.584	S	S	.	*	H	α-helix	trans	-64.9	-39.1	174.9	-159.5	-153	122.6	0	0	111.1	V361 K369	V361-E365 WeakPolarHBondContact O-CB 3.41Å; V361-E365 PolarHBondContact O-N 2.96Å; E365-K369 WeakPolarHBondContact O-CB 3.33Å; E365-K369 PolarHBondContact O-N 3.39Å; E365-K369 IonicContact OE1-NZ 3.75Å; E365-K369 PolarHBondContact OE1-NZ 2.96Å
366	K	77.9	Confident	67.2	Low	111 Å²	111	120.5 Å²	120.5	48%	0.483	57%	0.57	S	S	.	*	H	α-helix	trans	-64.4	-47.1	175.2	173.4	-173.7	141.7	-147.9	0	111.4	A362 E363 D364 K369 E370	A362-K366 VanDerWaalsContact O-CB 3.29Å; A362-K366 WeakPolarHBondContact O-CB 3.43Å; A362-K366 PolarHBondContact O-N 3.02Å; E363-K366 WeakPolarHBondContact O-CB 3.37Å; E363-K366 PolarHBondContact O-N 3.3Å; E363-K366 WeakPolarHBondContact OE1-CD 3.4Å; E363-K366 IonicContact OE1-NZ 2.63Å; E363-K366 PolarHBondContact OE1-NZ 3.23Å; E363-K366 IonicContact OE2-NZ 2.8Å; D364-K366 VanDerWaalsContact C-N 3.32Å; D364-K366 PolarHBondContact O-N 3.38Å; K366-K369 WeakPolarHBondContact O-CB 3.11Å; K366-K369 PolarHBondContact O-N 2.94Å; K366-E370 PolarHBondContact O-N 3.02Å
367	Q	76.5	Confident	68.7	Low	127 Å²	127	116.6 Å²	116.6	59%	0.593	56%	0.556	S	S	*	*	H	α-helix	trans	-65.5	-42.1	179.6	-174.7	167	-6.6	0	0	111.2	E363 D364 K369 E370 E371	E363-Q367 VanDerWaalsContact O-CB 3.28Å; E363-Q367 WeakPolarHBondContact O-CB 3.41Å; E363-Q367 PolarHBondContact O-N 3.07Å; D364-Q367 PolarHBondContact O-N 2.84Å; Q367-K369 VanDerWaalsContact C-N 3.27Å; Q367-K369 PolarHBondContact O-N 2.78Å; Q367-E370 PolarHBondContact O-N 3.23Å; Q367-E371 WeakPolarHBondContact O-CB 3.18Å; Q367-E371 PolarHBondContact O-N 3.45Å
368	R	79.8	Confident	70.3	Confident	185 Å²	185	120.3 Å²	120.3	70%	0.698	57%	0.565	S	S	*	*	H	α-helix	trans	-62.3	-32.7	173.5	-168.7	175.4	-168.7	-86.1	0.3	112.7	D364 E372	D364-R368 WeakPolarHBondContact O-CB 3.35Å; D364-R368 PolarHBondContact O-N 3.28Å; R368-E372 WeakPolarHBondContact O-CB 3.42Å; R368-E372 PolarHBondContact O-N 3.17Å
369	K	76	Confident	71.7	Confident	127 Å²	127	117.2 Å²	117.2	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-77.8	-33.3	177.4	-167.2	176.9	-117.4	143	0	112.2	E365 K366 Q367 Y373	E365-K369 WeakPolarHBondContact O-CB 3.33Å; E365-K369 PolarHBondContact O-N 3.39Å; E365-K369 IonicContact OE1-NZ 3.75Å; E365-K369 PolarHBondContact OE1-NZ 2.96Å; K366-K369 WeakPolarHBondContact O-CB 3.11Å; K366-K369 PolarHBondContact O-N 2.94Å; Q367-K369 VanDerWaalsContact C-N 3.27Å; Q367-K369 PolarHBondContact O-N 2.78Å; K369-Y373 WeakPolarHBondContact O-CB 3.37Å; K369-Y373 PolarHBondContact O-N 3.33Å
370	E	78.3	Confident	72.2	Confident	134 Å²	134	117.5 Å²	117.5	63%	0.626	54%	0.544	S	S	*	.	H	α-helix	trans	-71.1	-41.5	170.9	-174.6	162.7	-169.4	0	0	111.6	K366 Q367 Y373 Q374	K366-E370 PolarHBondContact O-N 3.02Å; Q367-E370 PolarHBondContact O-N 3.23Å; E370-Y373 WeakPolarHBondContact O-CB 3.29Å; E370-Y373 PolarHBondContact O-N 2.91Å; E370-Q374 PolarHBondContact O-N 3.33Å
371	E	79.7	Confident	72.9	Confident	130 Å²	130	115.9 Å²	115.9	61%	0.607	55%	0.55	S	S	*	*	H	α-helix	trans	-66.4	-38.3	173.4	-171.7	171.9	-132.6	0	0	111.9	Q367 Q374 T375	Q367-E371 WeakPolarHBondContact O-CB 3.18Å; Q367-E371 PolarHBondContact O-N 3.45Å; E371-Q374 PolarHBondContact O-N 2.86Å; E371-T375 WeakPolarHBondContact O-CB 3.42Å; E371-T375 PolarHBondContact O-N 3.06Å; E371-T375 PolarHBondContact O-OG1 2.93Å
372	E	79.8	Confident	73.1	Confident	87 Å²	87	116 Å²	116	41%	0.407	55%	0.548	S	S	.	.	H	α-helix	trans	-62.1	-42.9	170.4	-164.4	-166	151.3	0	0	111.2	R368 T375 R376	R368-E372 WeakPolarHBondContact O-CB 3.42Å; R368-E372 PolarHBondContact O-N 3.17Å; E372-T375 PolarHBondContact O-N 3.29Å; E372-R376 WeakPolarHBondContact O-CG 3.44Å; E372-R376 PolarHBondContact O-N 3.42Å; E372-R376 IonicContact OE1-CZ 2.67Å; E372-R376 IonicContact OE1-NE 3.52Å; E372-R376 PolarHBondContact OE1-NE 3.35Å; E372-R376 IonicContact OE1-NH2 3.53Å; E372-R376 PolarHBondContact OE1-NH2 3.2Å
373	Y	68.6	Low	72.9	Confident	174 Å²	174	116 Å²	116	68%	0.682	54%	0.539	S	S	*	.	H	α-helix	trans	-62.7	-45.2	177.4	-168.1	-92.8	0	0	0	111.8	K369 E370 T375 R376 Y377	K369-Y373 WeakPolarHBondContact O-CB 3.37Å; K369-Y373 PolarHBondContact O-N 3.33Å; E370-Y373 WeakPolarHBondContact O-CB 3.29Å; E370-Y373 PolarHBondContact O-N 2.91Å; Y373-T375 VanDerWaalsContact C-N 3.34Å; Y373-R376 PolarHBondContact O-N 2.97Å; Y373-Y377 PolarHBondContact O-N 2.61Å
374	Q	76.3	Confident	72.3	Confident	108 Å²	108	113.8 Å²	113.8	51%	0.505	54%	0.539	S	S	.	.	H	α-helix	trans	-71.1	-29.3	177.7	-160.2	175.5	65.3	0	0	112.5	E370 E371 Y377 R378	E370-Q374 PolarHBondContact O-N 3.33Å; E371-Q374 PolarHBondContact O-N 2.86Å; Q374-Y377 PolarHBondContact O-N 2.76Å; Q374-R378 PolarHBondContact O-N 2.78Å; Q374-R378 VanDerWaalsContact OE1-NH1 3.14Å
375	T	76.4	Confident	71.6	Confident	79 Å²	79	118.6 Å²	118.6	49%	0.485	55%	0.549	S	S	.	.	H	α-helix	trans	-68.2	-45.6	171.9	-61.2	0	0	0	0	111.1	E371 E372 Y373 Y377 R378 S379	E371-T375 WeakPolarHBondContact O-CB 3.42Å; E371-T375 PolarHBondContact O-N 3.06Å; E371-T375 PolarHBondContact O-OG1 2.93Å; E372-T375 PolarHBondContact O-N 3.29Å; Y373-T375 VanDerWaalsContact C-N 3.34Å; T375-Y377 VanDerWaalsContact C-N 3.32Å; T375-Y377 PolarHBondContact O-N 3.33Å; T375-R378 PolarHBondContact O-N 3.42Å; T375-R378 VanDerWaalsContact O-N 3.14Å; T375-S379 WeakPolarHBondContact O-CB 3.43Å; T375-S379 PolarHBondContact O-N 2.86Å; T375-S379 PolarHBondContact O-OG 3.06Å; T375-S379 VanDerWaalsContact O-OG 3.12Å
376	R	71.4	Confident	70.3	Confident	147 Å²	147	120.6 Å²	120.6	56%	0.555	55%	0.553	S	S	*	*	H	α-helix	trans	-58.7	-42.2	172.4	-71.3	177.5	-175.1	-147.5	7.8	111.7	E372 Y373 R378 S379 D380	E372-R376 WeakPolarHBondContact O-CG 3.44Å; E372-R376 PolarHBondContact O-N 3.42Å; E372-R376 IonicContact OE1-CZ 2.67Å; E372-R376 IonicContact OE1-NE 3.52Å; E372-R376 PolarHBondContact OE1-NE 3.35Å; E372-R376 IonicContact OE1-NH2 3.53Å; E372-R376 PolarHBondContact OE1-NH2 3.2Å; Y373-R376 PolarHBondContact O-N 2.97Å; R376-R378 VanDerWaalsContact C-N 3.29Å; R376-R378 PolarHBondContact O-N 3.46Å; R376-S379 WeakPolarHBondContact CA-OG 3.48Å; R376-S379 PolarHBondContact O-N 3.14Å; R376-S379 PolarHBondContact O-OG 2.88Å; R376-D380 PolarHBondContact O-N 2.92Å; R376-D380 VanDerWaalsContact O-N 3.16Å
377	Y	71.7	Confident	69.2	Low	124 Å²	124	120.9 Å²	120.9	49%	0.486	57%	0.566	S	S	.	*	H	α-helix	trans	-66.4	-28.3	177	-167.8	-94.9	0	0	0	113.3	Y373 Q374 T375 L383 A384	Y373-Y377 PolarHBondContact O-N 2.61Å; Q374-Y377 PolarHBondContact O-N 2.76Å; T375-Y377 VanDerWaalsContact C-N 3.32Å; T375-Y377 PolarHBondContact O-N 3.33Å; Y377-L383 HydrophobicContact CD2-CB 4.36Å; Y377-A384 HydrophobicContact CE2-CB 4.45Å
378	R	73.9	Confident	68.2	Low	184 Å²	184	120.7 Å²	120.7	69%	0.694	57%	0.573	S	S	*	*	H	α-helix	trans	-82.1	-28.9	171.9	-77.7	-174.8	173.8	112.7	-1.8	113.7	Q374 T375 R376	Q374-R378 PolarHBondContact O-N 2.78Å; Q374-R378 VanDerWaalsContact OE1-NH1 3.14Å; T375-R378 PolarHBondContact O-N 3.42Å; T375-R378 VanDerWaalsContact O-N 3.14Å; R376-R378 VanDerWaalsContact C-N 3.29Å; R376-R378 PolarHBondContact O-N 3.46Å
379	S	70.2	Confident	67.3	Low	89 Å²	89	120.4 Å²	120.4	62%	0.622	58%	0.577	S	S	*	*	H	α-helix	trans	-91.1	-19.8	-172.9	65.6	0	0	0	0	115.1	T375 R376	T375-S379 WeakPolarHBondContact O-CB 3.43Å; T375-S379 PolarHBondContact O-N 2.86Å; T375-S379 PolarHBondContact O-OG 3.06Å; T375-S379 VanDerWaalsContact O-OG 3.12Å; R376-S379 WeakPolarHBondContact CA-OG 3.48Å; R376-S379 PolarHBondContact O-N 3.14Å; R376-S379 PolarHBondContact O-OG 2.88Å
380	D	58	Low	66.7	Low	60 Å²	60	116.2 Å²	116.2	32%	0.321	57%	0.566	S	S	.	*			trans	-113.2	102.9	169.6	-176.1	7.2	0	0	0	112.5	R376 N382 L383	R376-D380 PolarHBondContact O-N 2.92Å; R376-D380 VanDerWaalsContact O-N 3.16Å; D380-N382 PolarHBondContact O-N 2.8Å; D380-N382 VanDerWaalsContact OD1-CB 3.27Å; D380-N382 WeakPolarHBondContact OD1-CB 2.98Å; D380-N382 PolarHBondContact OD1-N 3.21Å; D380-N382 PolarHBondContact OD1-ND2 3.44Å; D380-L383 HydrophobicContact CB-CD1 4.05Å; D380-L383 HydrophobicContact CB-CG 4.05Å; D380-L383 PolarHBondContact O-N 2.71Å; D380-L383 VanDerWaalsContact O-N 3.13Å
381	P	68.9	Low	66.2	Low	94 Å²	94	113.9 Å²	113.9	61%	0.61	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-11.7	174.4	-25.9	35.5	0	0	0	115.6
382	N	65.3	Low	65.7	Low	96 Å²	96	113.7 Å²	113.7	51%	0.513	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	-29.1	177.7	-57.2	-77.6	0	0	0	112.8	D380 A384 R385 Y386	D380-N382 PolarHBondContact O-N 2.8Å; D380-N382 VanDerWaalsContact OD1-CB 3.27Å; D380-N382 WeakPolarHBondContact OD1-CB 2.98Å; D380-N382 PolarHBondContact OD1-N 3.21Å; D380-N382 PolarHBondContact OD1-ND2 3.44Å; N382-A384 PolarHBondContact O-N 2.79Å; N382-R385 PolarHBondContact O-N 2.84Å; N382-Y386 PolarHBondContact O-N 3.49Å
383	L	63.5	Low	65.5	Low	63 Å²	63	116.3 Å²	116.3	33%	0.33	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	-31	177.4	-71	176.2	0	0	0	112.4	Y377 D380 R385 V388	Y377-L383 HydrophobicContact CD2-CB 4.36Å; D380-L383 HydrophobicContact CB-CD1 4.05Å; D380-L383 HydrophobicContact CB-CG 4.05Å; D380-L383 PolarHBondContact O-N 2.71Å; D380-L383 VanDerWaalsContact O-N 3.13Å; L383-R385 VanDerWaalsContact C-N 3.29Å; L383-R385 PolarHBondContact O-N 2.82Å; L383-V388 HydrophobicContact CD2-CG2 4.5Å
384	A	56.7	Low	65.8	Low	58 Å²	58	111.3 Å²	111.3	48%	0.479	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.5	-14.9	173	0	0	0	0	0	113.9	Y377 N382	Y377-A384 HydrophobicContact CE2-CB 4.45Å; N382-A384 PolarHBondContact O-N 2.79Å
385	R	61.2	Low	65.9	Low	196 Å²	196	112.1 Å²	112.1	74%	0.74	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-27.2	-178.7	-77	-178.6	168.3	164.7	-0.4	114.2	N382 L383	N382-R385 PolarHBondContact O-N 2.84Å; L383-R385 VanDerWaalsContact C-N 3.29Å; L383-R385 PolarHBondContact O-N 2.82Å
386	Y	45.9	Very low	66.3	Low	160 Å²	160	113.7 Å²	113.7	63%	0.627	57%	0.566	S	S	*	*	S	Bend	trans	-132	96.1	176.2	-71.8	-80.7	0	0	0	110.3	N382 V388	N382-Y386 PolarHBondContact O-N 3.49Å; Y386-V388 PolarHBondContact O-N 2.84Å
387	P	55.4	Low	66.6	Low	116 Å²	116	111.9 Å²	111.9	75%	0.753	57%	0.565	S	S	*	*			trans	-59.9	111.9	168	-20.6	32.9	0	0	0	109.2	K389	P387-K389 PolarHBondContact O-N 3.43Å
388	V	55.3	Low	67.2	Low	123 Å²	123	111.9 Å²	111.9	75%	0.745	56%	0.564	S	S	*	*			trans	-66.9	101.4	179.3	-179	0	0	0	0	108.4	L383 Y386 A390	L383-V388 HydrophobicContact CD2-CG2 4.5Å; Y386-V388 PolarHBondContact O-N 2.84Å; V388-A390 PolarHBondContact O-N 2.85Å
389	K	61.6	Low	67.6	Low	179 Å²	179	108.7 Å²	108.7	78%	0.778	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-58.7	132.6	168.4	-75.4	-179.1	176.6	175.7	0	108.3	P387	P387-K389 PolarHBondContact O-N 3.43Å
390	A	62.1	Low	68.3	Low	39 Å²	39	110.8 Å²	110.8	32%	0.322	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-52.2	138.3	171.4	0	0	0	0	0	110	V388 L392 E394	V388-A390 PolarHBondContact O-N 2.85Å; A390-L392 PolarHBondContact O-N 3.36Å; A390-E394 WeakPolarHBondContact CB-OE2 3.19Å
391	P	67.4	Low	69.6	Low	85 Å²	85	110.3 Å²	110.3	55%	0.552	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-52.9	141.5	174.4	-26.3	34.8	0	0	0	110.9	E393 E394 Q395	P391-E393 PolarHBondContact O-N 3.26Å; P391-E393 VanDerWaalsContact O-N 3.11Å; P391-E394 HydrophobicContact CB-CB 4.31Å; P391-E394 WeakPolarHBondContact O-CA 3.34Å; P391-E394 WeakPolarHBondContact O-CB 3.49Å; P391-E394 PolarHBondContact O-N 2.73Å; P391-Q395 PolarHBondContact O-N 3.44Å
392	L	70.5	Confident	70.5	Confident	126 Å²	126	115.1 Å²	115.1	66%	0.66	57%	0.569	S	S	*	*	H	α-helix	trans	-58.3	-30.1	-178.1	-173.7	136	0	0	0	112	A390 Q395 Q396	A390-L392 PolarHBondContact O-N 3.36Å; L392-Q395 PolarHBondContact O-N 3.32Å; L392-Q396 HydrophobicContact CD2-CG 4.4Å; L392-Q396 WeakPolarHBondContact O-CG 3.34Å; L392-Q396 PolarHBondContact O-N 3.21Å
393	E	74.2	Confident	71.6	Confident	142 Å²	142	114.4 Å²	114.4	66%	0.664	57%	0.567	S	S	*	*	H	α-helix	trans	-70.1	-36.3	173	-168.5	155.7	-145.5	0	0	113	P391 Q396 M397	P391-E393 PolarHBondContact O-N 3.26Å; P391-E393 VanDerWaalsContact O-N 3.11Å; E393-Q396 PolarHBondContact O-N 3.2Å; E393-M397 WeakPolarHBondContact O-CB 3.46Å; E393-M397 WeakPolarHBondContact O-CG 3.36Å; E393-M397 PolarHBondContact O-N 2.87Å
394	E	76.7	Confident	72.5	Confident	70 Å²	70	113.9 Å²	113.9	33%	0.327	57%	0.569	S	S	.	*	H	α-helix	trans	-69.4	-35.2	170.8	-156.9	-156.8	-175.7	0	0	111.2	A390 P391 M397 R398	A390-E394 WeakPolarHBondContact CB-OE2 3.19Å; P391-E394 HydrophobicContact CB-CB 4.31Å; P391-E394 WeakPolarHBondContact O-CA 3.34Å; P391-E394 WeakPolarHBondContact O-CB 3.49Å; P391-E394 PolarHBondContact O-N 2.73Å; E394-M397 PolarHBondContact O-N 2.83Å; E394-R398 WeakPolarHBondContact O-CB 3.17Å; E394-R398 WeakPolarHBondContact O-CG 3.43Å; E394-R398 PolarHBondContact O-N 3.26Å; E394-R398 IonicContact OE1-CZ 3.91Å; E394-R398 IonicContact OE1-NE 3.08Å; E394-R398 IonicContact OE1-NH1 2.78Å; E394-R398 PolarHBondContact OE1-NH1 3.3Å; E394-R398 IonicContact OE1-NH2 3.35Å; E394-R398 PolarHBondContact OE1-NH2 3.11Å; E394-R398 IonicContact OE2-CZ 3.39Å; E394-R398 IonicContact OE2-NH1 2.82Å; E394-R398 PolarHBondContact OE2-NH1 2.67Å; E394-R398 IonicContact OE2-NH2 2.69Å; E394-R398 PolarHBondContact OE2-NH2 3.47Å
395	Q	77.8	Confident	73.8	Confident	124 Å²	124	119.5 Å²	119.5	58%	0.579	58%	0.578	S	S	*	*	H	α-helix	trans	-68.3	-38	172.8	-171.8	171.3	-8.2	0	0	111.7	P391 L392 R398 M399	P391-Q395 PolarHBondContact O-N 3.44Å; L392-Q395 PolarHBondContact O-N 3.32Å; Q395-R398 PolarHBondContact O-N 3.39Å; Q395-M399 WeakPolarHBondContact O-CB 3.25Å; Q395-M399 PolarHBondContact O-N 3.37Å
396	Q	83.6	Confident	74.7	Confident	113 Å²	113	111.5 Å²	111.5	53%	0.528	55%	0.554	S	S	.	*	H	α-helix	trans	-65.5	-42.2	170.3	-79.6	-171.2	-5.4	0	0	112	L392 E393 M399 H400	L392-Q396 HydrophobicContact CD2-CG 4.4Å; L392-Q396 WeakPolarHBondContact O-CG 3.34Å; L392-Q396 PolarHBondContact O-N 3.21Å; E393-Q396 PolarHBondContact O-N 3.2Å; Q396-M399 PolarHBondContact O-N 2.9Å; Q396-H400 WeakPolarHBondContact O-CB 3.38Å; Q396-H400 PolarHBondContact O-N 3.09Å
397	M	77.9	Confident	76.4	Confident	108 Å²	108	111.9 Å²	111.9	53%	0.532	55%	0.554	S	S	.	*	H	α-helix	trans	-62.5	-43.2	173.9	-77.6	-166.2	-80.2	0	0	111.8	E393 E394 M399 H400 A401	E393-M397 WeakPolarHBondContact O-CB 3.46Å; E393-M397 WeakPolarHBondContact O-CG 3.36Å; E393-M397 PolarHBondContact O-N 2.87Å; E394-M397 PolarHBondContact O-N 2.83Å; M397-M399 PolarHBondContact O-N 3.36Å; M397-H400 PolarHBondContact O-N 3.31Å; M397-A401 WeakPolarHBondContact O-CB 3.36Å; M397-A401 PolarHBondContact O-N 3.34Å
398	R	84.9	Confident	77.6	Confident	125 Å²	125	111.9 Å²	111.9	47%	0.472	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-39	172.8	-74.7	-174.8	-177.2	115.9	0.8	112.4	E394 Q395 R402	E394-R398 WeakPolarHBondContact O-CB 3.17Å; E394-R398 WeakPolarHBondContact O-CG 3.43Å; E394-R398 PolarHBondContact O-N 3.26Å; E394-R398 IonicContact OE1-CZ 3.91Å; E394-R398 IonicContact OE1-NE 3.08Å; E394-R398 IonicContact OE1-NH1 2.78Å; E394-R398 PolarHBondContact OE1-NH1 3.3Å; E394-R398 IonicContact OE1-NH2 3.35Å; E394-R398 PolarHBondContact OE1-NH2 3.11Å; E394-R398 IonicContact OE2-CZ 3.39Å; E394-R398 IonicContact OE2-NH1 2.82Å; E394-R398 PolarHBondContact OE2-NH1 2.67Å; E394-R398 IonicContact OE2-NH2 2.69Å; E394-R398 PolarHBondContact OE2-NH2 3.47Å; Q395-R398 PolarHBondContact O-N 3.39Å; R398-R402 WeakPolarHBondContact O-CB 3.36Å; R398-R402 VanDerWaalsContact O-CG 3.29Å; R398-R402 WeakPolarHBondContact O-CG 3.46Å; R398-R402 PolarHBondContact O-N 2.82Å
399	M	81.8	Confident	78.6	Confident	116 Å²	116	111.3 Å²	111.3	57%	0.571	53%	0.533	S	S	*	.	H	α-helix	trans	-64.7	-48.7	174.2	-170.1	-153	-61.4	0	0	110.9	Q395 Q396 M397 A401 R402 V403	Q395-M399 WeakPolarHBondContact O-CB 3.25Å; Q395-M399 PolarHBondContact O-N 3.37Å; Q396-M399 PolarHBondContact O-N 2.9Å; M397-M399 PolarHBondContact O-N 3.36Å; M399-A401 VanDerWaalsContact C-N 3.34Å; M399-A401 PolarHBondContact O-N 2.97Å; M399-R402 PolarHBondContact O-N 3.35Å; M399-V403 HydrophobicContact CG-CG2 4.48Å; M399-V403 WeakPolarHBondContact O-CB 3.39Å; M399-V403 WeakPolarHBondContact O-CG2 3.44Å; M399-V403 PolarHBondContact O-N 3.13Å
400	H	84.7	Confident	79.4	Confident	133 Å²	133	111.1 Å²	111.1	62%	0.616	53%	0.528	S	S	*	.	H	α-helix	trans	-65.6	-36.3	-179.8	-170.3	-99.3	0	0	0	111.8	Q396 M397 S404	Q396-H400 WeakPolarHBondContact O-CB 3.38Å; Q396-H400 PolarHBondContact O-N 3.09Å; M397-H400 PolarHBondContact O-N 3.31Å; H400-S404 WeakPolarHBondContact O-CB 3.27Å; H400-S404 PolarHBondContact O-N 2.78Å; H400-S404 PolarHBondContact O-OG 3.2Å
401	A	86.3	Confident	79.9	Confident	50 Å²	50	117.8 Å²	117.8	41%	0.413	55%	0.545	S	S	.	.	H	α-helix	trans	-66.8	-42.5	172	0	0	0	0	0	111.9	M397 M399 S404 R405	M397-A401 WeakPolarHBondContact O-CB 3.36Å; M397-A401 PolarHBondContact O-N 3.34Å; M399-A401 VanDerWaalsContact C-N 3.34Å; M399-A401 PolarHBondContact O-N 2.97Å; A401-S404 PolarHBondContact O-N 3Å; A401-R405 WeakPolarHBondContact O-CG 3.32Å; A401-R405 PolarHBondContact O-N 2.71Å
402	R	87.3	Confident	79.9	Confident	196 Å²	196	119.9 Å²	119.9	74%	0.74	55%	0.546	S	S	*	.	H	α-helix	trans	-63.5	-43.8	173	-78	178.3	178	-163.1	-0.3	112.2	R398 M399 S404 R405 A406	R398-R402 WeakPolarHBondContact O-CB 3.36Å; R398-R402 VanDerWaalsContact O-CG 3.29Å; R398-R402 WeakPolarHBondContact O-CG 3.46Å; R398-R402 PolarHBondContact O-N 2.82Å; M399-R402 PolarHBondContact O-N 3.35Å; R402-S404 VanDerWaalsContact C-N 3.33Å; R402-R405 PolarHBondContact O-N 3.04Å; R402-A406 VanDerWaalsContact O-CB 3.25Å; R402-A406 WeakPolarHBondContact O-CB 3.34Å; R402-A406 PolarHBondContact O-N 3.12Å
403	V	87.8	Confident	79.3	Confident	80 Å²	80	117.2 Å²	117.2	49%	0.485	54%	0.539	S	S	.	.	H	α-helix	trans	-66.5	-36.2	175.7	170.5	0	0	0	0	111.1	M399 R407	M399-V403 HydrophobicContact CG-CG2 4.48Å; M399-V403 WeakPolarHBondContact O-CB 3.39Å; M399-V403 WeakPolarHBondContact O-CG2 3.44Å; M399-V403 PolarHBondContact O-N 3.13Å; V403-R407 WeakPolarHBondContact O-CB 3.32Å; V403-R407 PolarHBondContact O-N 3.38Å
404	S	82.5	Confident	78.2	Confident	53 Å²	53	116.6 Å²	116.6	37%	0.371	54%	0.54	S	S	.	.	H	α-helix	trans	-69	-42.7	175.5	-63.2	0	0	0	0	111.8	H400 A401 R402 R407 H408	H400-S404 WeakPolarHBondContact O-CB 3.27Å; H400-S404 PolarHBondContact O-N 2.78Å; H400-S404 PolarHBondContact O-OG 3.2Å; A401-S404 PolarHBondContact O-N 3Å; R402-S404 VanDerWaalsContact C-N 3.33Å; S404-R407 PolarHBondContact O-N 2.83Å; S404-H408 VanDerWaalsContact O-CB 3.27Å; S404-H408 WeakPolarHBondContact O-CB 3.42Å; S404-H408 PolarHBondContact O-N 3.06Å
405	R	83.9	Confident	76.7	Confident	175 Å²	175	119 Å²	119	66%	0.66	56%	0.559	S	S	*	*	H	α-helix	trans	-61.2	-53.9	170.4	-74.9	-169.1	-173	-162.5	2.9	111.1	A401 R402 R407 H408 E409	A401-R405 WeakPolarHBondContact O-CG 3.32Å; A401-R405 PolarHBondContact O-N 2.71Å; R402-R405 PolarHBondContact O-N 3.04Å; R405-R407 PolarHBondContact O-N 2.86Å; R405-H408 CarbonylContact O-C 3.57Å; R405-H408 WeakPolarHBondContact O-CA 3.41Å; R405-H408 WeakPolarHBondContact O-CB 3.46Å; R405-H408 PolarHBondContact O-N 3.48Å; R405-E409 WeakPolarHBondContact O-CB 3.49Å; R405-E409 WeakPolarHBondContact O-CG 3.34Å; R405-E409 PolarHBondContact O-N 2.81Å
406	A	80.8	Confident	74.9	Confident	29 Å²	29	117.1 Å²	117.1	24%	0.24	57%	0.565	C	S	.	*	H	α-helix	trans	-65.9	-10.2	179.3	0	0	0	0	0	114.9	R402 E409 R410	R402-A406 VanDerWaalsContact O-CB 3.25Å; R402-A406 WeakPolarHBondContact O-CB 3.34Å; R402-A406 PolarHBondContact O-N 3.12Å; A406-E409 WeakPolarHBondContact CA-OE2 3.34Å; A406-E409 PolarHBondContact N-OE2 2.62Å; A406-R410 WeakPolarHBondContact O-CB 3.15Å; A406-R410 PolarHBondContact O-NE 2.79Å
407	R	80.8	Confident	73	Confident	168 Å²	168	119.8 Å²	119.8	63%	0.634	58%	0.582	S	S	*	*	H	α-helix	trans	-97	-28.5	169.4	177.1	-178.4	-105	-172.9	-2.5	112.3	V403 S404 R405 R411	V403-R407 WeakPolarHBondContact O-CB 3.32Å; V403-R407 PolarHBondContact O-N 3.38Å; S404-R407 PolarHBondContact O-N 2.83Å; R405-R407 PolarHBondContact O-N 2.86Å; R407-R411 WeakPolarHBondContact O-CB 3.48Å; R407-R411 WeakPolarHBondContact O-CD 3.29Å; R407-R411 WeakPolarHBondContact O-CG 3.32Å; R407-R411 PolarHBondContact O-N 3.36Å
408	H	81.7	Confident	71.3	Confident	115 Å²	115	119 Å²	119	53%	0.532	59%	0.585	S	S	.	*	H	α-helix	trans	-74.3	-50.5	171.7	176.9	67.1	0	0	0	109.9	S404 R405 R410 R411 H412	S404-H408 VanDerWaalsContact O-CB 3.27Å; S404-H408 WeakPolarHBondContact O-CB 3.42Å; S404-H408 PolarHBondContact O-N 3.06Å; R405-H408 CarbonylContact O-C 3.57Å; R405-H408 WeakPolarHBondContact O-CA 3.41Å; R405-H408 WeakPolarHBondContact O-CB 3.46Å; R405-H408 PolarHBondContact O-N 3.48Å; H408-R410 PolarHBondContact O-N 2.93Å; H408-R411 CarbonylContact O-C 3.56Å; H408-R411 WeakPolarHBondContact O-CA 3.33Å; H408-R411 WeakPolarHBondContact O-CB 3.43Å; H408-R411 PolarHBondContact O-N 2.79Å; H408-H412 AromaticContact CE1-CD2 3.26Å; H408-H412 PolarHBondContact CE1-CD2 2.87Å; H408-H412 AromaticContact CE1-NE2 3.21Å; H408-H412 PolarHBondContact CE1-NE2 3.29Å; H408-H412 AromaticContact CG-CD2 3.98Å; H408-H412 AromaticContact ND1-CD2 3.32Å; H408-H412 PolarHBondContact ND1-CD2 2.85Å; H408-H412 VanDerWaalsContact ND1-CD2 3.32Å; H408-H412 AromaticContact ND1-NE2 3.44Å; H408-H412 PolarHBondContact ND1-NE2 3.41Å; H408-H412 AromaticContact NE2-CD2 3.9Å; H408-H412 PolarHBondContact O-CD2 3.48Å; H408-H412 VanDerWaalsContact O-CD2 3.23Å; H408-H412 PolarHBondContact O-N 3.23Å
409	E	76.2	Confident	69.1	Low	112 Å²	112	120.8 Å²	120.8	52%	0.523	60%	0.598	S	S	.	*	H	α-helix	trans	-51.2	-51.7	170.1	-69.7	155.4	-177.4	0	0	110.4	R405 A406 R411 H412 S413	R405-E409 WeakPolarHBondContact O-CB 3.49Å; R405-E409 WeakPolarHBondContact O-CG 3.34Å; R405-E409 PolarHBondContact O-N 2.81Å; A406-E409 WeakPolarHBondContact CA-OE2 3.34Å; A406-E409 PolarHBondContact N-OE2 2.62Å; E409-R411 PolarHBondContact O-N 3.27Å; E409-R411 VanDerWaalsContact O-N 3.07Å; E409-H412 CarbonylContact O-C 3.59Å; E409-H412 PolarHBondContact O-N 2.76Å; E409-S413 PolarHBondContact O-N 3.36Å; E409-S413 PolarHBondContact O-OG 3.11Å
410	R	79.1	Confident	67.1	Low	175 Å²	175	122 Å²	122	66%	0.66	61%	0.612	S	S	*	*	H	α-helix	trans	-67.3	-2.2	172.9	-83.9	-173.8	-82.2	-155.3	-10	116.6	A406 H408 S413	A406-R410 WeakPolarHBondContact O-CB 3.15Å; A406-R410 PolarHBondContact O-NE 2.79Å; H408-R410 PolarHBondContact O-N 2.93Å; R410-S413 WeakPolarHBondContact CA-OG 3.37Å
411	R	72.6	Confident	64.8	Low	179 Å²	179	124.2 Å²	124.2	68%	0.675	62%	0.623	S	S	*	*	H	α-helix	trans	-105.5	-8.7	169.8	-79.1	171.7	172.5	-123.4	-6.2	112.7	R407 H408 E409	R407-R411 WeakPolarHBondContact O-CB 3.48Å; R407-R411 WeakPolarHBondContact O-CD 3.29Å; R407-R411 WeakPolarHBondContact O-CG 3.32Å; R407-R411 PolarHBondContact O-N 3.36Å; H408-R411 CarbonylContact O-C 3.56Å; H408-R411 WeakPolarHBondContact O-CA 3.33Å; H408-R411 WeakPolarHBondContact O-CB 3.43Å; H408-R411 PolarHBondContact O-N 2.79Å; E409-R411 PolarHBondContact O-N 3.27Å; E409-R411 VanDerWaalsContact O-N 3.07Å
412	H	66	Low	62.4	Low	128 Å²	128	126.1 Å²	126.1	59%	0.593	64%	0.639	S	S	*	*	H	α-helix	trans	-118	-10.6	178.7	-73.4	-79.6	0	0	0	112.8	H408 E409	H408-H412 AromaticContact CE1-CD2 3.26Å; H408-H412 PolarHBondContact CE1-CD2 2.87Å; H408-H412 AromaticContact CE1-NE2 3.21Å; H408-H412 PolarHBondContact CE1-NE2 3.29Å; H408-H412 AromaticContact CG-CD2 3.98Å; H408-H412 AromaticContact ND1-CD2 3.32Å; H408-H412 PolarHBondContact ND1-CD2 2.85Å; H408-H412 VanDerWaalsContact ND1-CD2 3.32Å; H408-H412 AromaticContact ND1-NE2 3.44Å; H408-H412 PolarHBondContact ND1-NE2 3.41Å; H408-H412 AromaticContact NE2-CD2 3.9Å; H408-H412 PolarHBondContact O-CD2 3.48Å; H408-H412 VanDerWaalsContact O-CD2 3.23Å; H408-H412 PolarHBondContact O-N 3.23Å; E409-H412 CarbonylContact O-C 3.59Å; E409-H412 PolarHBondContact O-N 2.76Å
413	S	59.1	Low	60	Low	71 Å²	71	121.3 Å²	121.3	50%	0.497	64%	0.64	S	S	.	*	S	Bend	trans	-71.7	-31.6	165.9	53.1	0	0	0	0	112.9	E409 R410 V415	E409-S413 PolarHBondContact O-N 3.36Å; E409-S413 PolarHBondContact O-OG 3.11Å; R410-S413 WeakPolarHBondContact CA-OG 3.37Å; S413-V415 VanDerWaalsContact C-N 3.31Å; S413-V415 PolarHBondContact O-N 2.81Å
414	D	49.8	Very low	57.5	Low	129 Å²	129	122.5 Å²	122.5	69%	0.69	66%	0.659	S	S	*	*	S	Bend	trans	-95.5	21.3	-166.9	-60.8	13.4	0	0	0	112.3
415	V	46.9	Very low	55.3	Low	120 Å²	120	124.3 Å²	124.3	73%	0.727	68%	0.677	S	S	*	*			trans	-134.8	75.7	-179.5	-171.8	0	0	0	0	110.1	S413	S413-V415 VanDerWaalsContact C-N 3.31Å; S413-V415 PolarHBondContact O-N 2.81Å
416	A	39.7	Very low	53.1	Low	85 Å²	85	122.1 Å²	122.1	70%	0.702	68%	0.683	S	S	*	*			trans	-143.7	81.8	179.4	0	0	0	0	0	113.8
417	L	42.4	Very low	50.9	Low	168 Å²	168	126 Å²	126	88%	0.88	71%	0.708	S	S	*	*			trans	68.4	-179.9	150.1	-52.8	-175.3	0	0	0	115.9
418	P	42.7	Very low	48.8	Very low	92 Å²	92	122.1 Å²	122.1	60%	0.597	71%	0.712	S	S	*	*			cis	-138.4	-177.9	1.9	44.6	-27.5	0	0	0	118.5
419	H	39.6	Very low	46.6	Very low	163 Å²	163	124.7 Å²	124.7	76%	0.755	72%	0.724	S	S	*	*			trans	68.6	158.1	157.7	-59.9	-45.2	0	0	0	119.4
420	T	38.3	Very low	44.5	Very low	140 Å²	140	124.7 Å²	124.7	86%	0.859	73%	0.732	S	S	*	*			cis	-140.1	-157.8	-5.3	-8.2	0	0	0	0	112.4
421	E	37.1	Very low	42.3	Very low	180 Å²	180	122.7 Å²	122.7	84%	0.841	74%	0.74	S	S	*	*			trans	-146.9	-150.6	-165.8	-141.1	-123	68.1	0	0	114.1
422	A	36.8	Very low	40.2	Very low	91 Å²	91	118.9 Å²	118.9	75%	0.752	75%	0.747	S	S	*	*			trans	92.8	134.9	-179.9	0	0	0	0	0	116.4
423	A	36.3	Very low	38.6	Very low	94 Å²	94	116.4 Å²	116.4	78%	0.777	76%	0.756	S	S	*	*			cis	-151.4	-170.9	4.1	0	0	0	0	0	110
424	A	36.2	Very low	37.5	Very low	106 Å²	106	123 Å²	123	88%	0.876	78%	0.775	S	S	*	*			cis	-151.9	-105.7	13	0	0	0	0	0	114.8
425	A	36.2	Very low	36.4	Very low	90 Å²	90	128.9 Å²	128.9	74%	0.744	79%	0.788	S	S	*	*			trans	-152	-179.2	-163.4	0	0	0	0	0	111.6
426	V	37.7	Very low	35.8	Very low	129 Å²	129	127.2 Å²	127.2	78%	0.782	79%	0.787	S	S	*	*			cis	-159.8	145.2	37.7	175.8	0	0	0	0	112.5
427	S	35	Very low	35.5	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	79%	0.793	S	S	*	*			trans	57.6	143.1	162.6	-64.4	0	0	0	0	120.5
428	A	36.6	Very low	35	Very low	88 Å²	88	128.8 Å²	128.8	73%	0.727	78%	0.783	S	S	*	*			cis	80.1	138.6	36.8	0	0	0	0	0	113.7
429	E	33.6	Very low	34.7	Very low	168 Å²	168	131 Å²	131	79%	0.785	80%	0.795	S	S	*	*			cis	-161.9	170	3.2	-139.4	-177.3	145	0	0	113
430	T	32.8	Very low	34.7	Very low	112 Å²	112	127.5 Å²	127.5	69%	0.687	79%	0.794	S	S	*	*			trans	55.4	120.8	154	43.7	0	0	0	0	125.4
431	T	32.2	Very low	34.6	Very low	133 Å²	133	132.1 Å²	132.1	82%	0.816	80%	0.795	S	S	*	*			trans	55.2	124.4	140.8	29.9	0	0	0	0	126.2
432	A	30.4	Very low	34.7	Very low	100 Å²	100	129.5 Å²	129.5	83%	0.826	79%	0.791	S	S	*	*				68.2	105.1	127.8	0	0	0	0	0	123.9
433	G	31.1	Very low	34.8	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	79%	0.785	S	S	*	*				118.5	145.3	122.7	0	0	0	0	0	120.8
434	K	35.6	Very low	35.4	Very low	209 Å²	209	131.1 Å²	131.1	91%	0.909	79%	0.789	S	S	*	*			trans	71.6	95.1	157.3	-58.5	177.3	-177.8	173.2	0	121
435	R	27	Very low	36.1	Very low	253 Å²	253	130.7 Å²	130.7	96%	0.955	78%	0.777	S	S	*	*				40.5	100.7	119.8	-172.7	-169.2	-174.8	178	2.3	119.6
436	A	34	Very low	36.2	Very low	85 Å²	85	134.7 Å²	134.7	70%	0.702	78%	0.78	S	S	*	*			trans	-162.9	133.4	141.8	0	0	0	0	0	113.9
437	Q	34	Very low	36.5	Very low	179 Å²	179	134.5 Å²	134.5	84%	0.836	78%	0.784	S	S	*	*				25.2	144.4	125	-55.1	-173.3	47.3	0	0	120
438	T	31	Very low	37.1	Very low	107 Å²	107	134 Å²	134	66%	0.656	78%	0.778	S	S	*	*			cis	-172.4	160.1	3.3	14	0	0	0	0	111.5
439	T	37.4	Very low	37.1	Very low	138 Å²	138	141.2 Å²	141.2	85%	0.847	79%	0.787	S	S	*	*			trans	61.2	151.6	158.8	49.4	0	0	0	0	118.4
440	A	38.7	Very low	37.3	Very low	89 Å²	89	137.8 Å²	137.8	74%	0.736	79%	0.787	S	S	*	*			cis	-163.6	-172.5	-14.2	0	0	0	0	0	105.9
441	R	36.7	Very low	37.5	Very low	237 Å²	237	144.4 Å²	144.4	89%	0.894	80%	0.8	S	S	*	*			cis	-162.9	172.8	-0.4	-134.7	-179	-174.4	172.7	1.3	104.2
442	V	39.2	Very low	37.8	Very low	125 Å²	125	142 Å²	142	76%	0.758	79%	0.793	S	S	*	*			cis	-155.8	178.5	0.5	72.7	0	0	0	0	108.4
443	S	39.7	Very low	38.6	Very low	90 Å²	90	143.3 Å²	143.3	63%	0.629	79%	0.794	S	S	*	*			trans	-85.7	179.3	-174.2	-34.7	0	0	0	0	115.6
444	P	47.4	Very low	38.9	Very low	130 Å²	130	144.7 Å²	144.7	84%	0.844	80%	0.797	S	S	*	*				-117.9	169.9	94.4	-5.8	26.4	0	0	0	115.3
445	P	52.5	Low	39.1	Very low	96 Å²	96	138.9 Å²	138.9	62%	0.623	79%	0.788	S	S	*	*			trans	-128.9	157.4	-147.1	42.8	-29.5	0	0	0	119.9
446	E	38.2	Very low	39.6	Very low	175 Å²	175	135.6 Å²	135.6	82%	0.818	78%	0.784	S	S	*	*			trans	51.6	137.1	132.6	-63.3	178.8	95	0	0	125.7
447	S	43.7	Very low	40.4	Very low	124 Å²	124	136.3 Å²	136.3	87%	0.867	78%	0.781	S	S	*	*				-158.9	138.8	112.1	-166.1	0	0	0	0	112.4
448	P	47.6	Very low	41	Very low	99 Å²	99	133.4 Å²	133.4	64%	0.643	78%	0.778	S	S	*	*			trans	-137.2	167.1	-165.5	43	-27.2	0	0	0	119.3
449	R	37.2	Very low	41.2	Very low	241 Å²	241	132.7 Å²	132.7	91%	0.909	78%	0.783	S	S	*	*			trans	179.8	129	148.1	-99.2	161.1	180	-167.1	-0.8	108.8
450	A	37.4	Very low	41.2	Very low	96 Å²	96	134.1 Å²	134.1	79%	0.793	78%	0.78	S	S	*	*				67.8	133	62.2	0	0	0	0	0	113.3
451	R	35.8	Very low	41.3	Very low	250 Å²	250	138.2 Å²	138.2	94%	0.943	78%	0.783	S	S	*	*			cis	-154.8	-174.6	12.6	-138	-177.3	-173.9	-177.6	2.4	107.9
452	A	39.8	Very low	41.3	Very low	83 Å²	83	130.1 Å²	130.1	69%	0.686	77%	0.774	S	S	*	*			cis	-159.6	175.9	3.2	0	0	0	0	0	111.2
453	P	47.4	Very low	41.6	Very low	128 Å²	128	130.5 Å²	130.5	83%	0.831	78%	0.779	S	S	*	*			trans	-125.9	-167.6	-174	43.9	-30.8	0	0	0	117
454	A	36.7	Very low	42.2	Very low	104 Å²	104	132 Å²	132	86%	0.86	79%	0.787	S	S	*	*			trans	106	156.5	171.7	0	0	0	0	0	115.7
455	A	39.4	Very low	42.4	Very low	87 Å²	87	131.6 Å²	131.6	72%	0.719	78%	0.784	S	S	*	*			cis	-153	138.6	0.2	0	0	0	0	0	110.6
456	Q	38.4	Very low	42.4	Very low	184 Å²	184	132.8 Å²	132.8	86%	0.86	79%	0.792	S	S	*	*				101.1	152.2	95.8	-80.5	-80.9	-47.4	0	0	116.8
457	P	49.5	Very low	42.4	Very low	101 Å²	101	136.1 Å²	136.1	66%	0.656	80%	0.797	S	S	*	*			trans	-112.5	-155	-169.6	44.5	-30.1	0	0	0	112.2
458	P	48.1	Very low	42.3	Very low	118 Å²	118	135.7 Å²	135.7	77%	0.766	79%	0.791	S	S	*	*			cis	-142.7	-153.2	2.1	45.2	-23.1	0	0	0	116.7
459	A	33.8	Very low	42	Very low	91 Å²	91	135.2 Å²	135.2	75%	0.752	80%	0.795	S	S	*	*			trans	80.9	151.4	166.7	0	0	0	0	0	117.5
460	E	38.6	Very low	42.3	Very low	168 Å²	168	129.7 Å²	129.7	79%	0.785	79%	0.791	S	S	*	*			cis	-132.8	176.3	14.8	-77.5	-172.9	135.8	0	0	115.8
461	H	39.7	Very low	42.4	Very low	175 Å²	175	128.7 Å²	128.7	81%	0.81	79%	0.79	S	S	*	*			trans	-30	163.3	174.3	-43.9	-51.7	0	0	0	120.8
462	G	37.4	Very low	42.9	Very low	68 Å²	68	123 Å²	123	70%	0.701	79%	0.786	S	S	*	*			cis	-166	-141.5	15.3	0	0	0	0	0	116.6
463	P	46.1	Very low	42.8	Very low	133 Å²	133	123.3 Å²	123.3	86%	0.864	79%	0.788	S	S	*	*				-105.7	177.1	-128.4	-3.3	26.8	0	0	0	120.5
464	P	51	Low	42.4	Very low	121 Å²	121	125 Å²	125	79%	0.786	79%	0.785	S	S	*	*			trans	-106.9	-172.5	-164.4	45.5	-38.9	0	0	0	115.9
465	P	52.5	Low	43	Very low	121 Å²	121	125.6 Å²	125.6	79%	0.786	78%	0.78	S	S	*	*			trans	-105	170.1	-155.3	41	-38	0	0	0	118.2
466	P	51.2	Low	43.2	Very low	122 Å²	122	126.5 Å²	126.5	79%	0.792	78%	0.778	S	S	*	*			trans	-120.3	118.7	174.1	37.4	-23.5	0	0	0	116.8
467	R	39.9	Very low	43.3	Very low	244 Å²	244	124.7 Å²	124.7	92%	0.921	77%	0.77	S	S	*	*				42.5	165.6	121.5	-78	-173	-176.6	-97.9	-1.2	123.6
468	P	41.2	Very low	43.2	Very low	115 Å²	115	125.9 Å²	125.9	75%	0.747	78%	0.778	S	S	*	*			trans	-127.2	-163.1	-140.4	48.1	-37.3	0	0	0	117.2
469	A	40.3	Very low	42.6	Very low	89 Å²	89	129.6 Å²	129.6	74%	0.736	78%	0.776	S	S	*	*			trans	107.5	169.7	160.6	0	0	0	0	0	116.7
470	P	43.7	Very low	42.6	Very low	125 Å²	125	131.7 Å²	131.7	81%	0.812	78%	0.78	S	S	*	*				-141.5	145.4	-59	38.4	-22.6	0	0	0	117.8
471	G	40.7	Very low	42.6	Very low	76 Å²	76	129.3 Å²	129.3	78%	0.784	78%	0.779	S	S	*	*			trans	64.8	-170.5	153.9	0	0	0	0	0	119.1
472	P	45.5	Very low	42.3	Very low	130 Å²	130	128.9 Å²	128.9	84%	0.844	78%	0.777	S	S	*	*			cis	-137.6	-176.7	-11.2	42.9	-26	0	0	0	116.6
473	A	37.4	Very low	42.5	Very low	89 Å²	89	129.9 Å²	129.9	74%	0.736	77%	0.771	S	S	*	*			trans	68.7	119.2	159.8	0	0	0	0	0	120.5
474	E	39.2	Very low	41.8	Very low	165 Å²	165	129.5 Å²	129.5	77%	0.771	76%	0.761	S	S	*	*				58.7	142.8	66.7	-73.1	-67.6	122.6	0	0	114.7
475	P	49.7	Very low	41.1	Very low	115 Å²	115	133.2 Å²	133.2	75%	0.747	76%	0.759	S	S	*	*			cis	-142.1	-151.2	36.1	48.9	-27.8	0	0	0	114.8
476	P	44	Very low	40.5	Very low	107 Å²	107	134.7 Å²	134.7	70%	0.695	75%	0.753	S	S	*	*				-134.6	-166.7	-115.3	37.1	-11.7	0	0	0	117.5
477	E	39.1	Very low	39.8	Very low	146 Å²	146	136.9 Å²	136.9	68%	0.682	75%	0.753	S	S	*	*			trans	-57.2	164.5	176.5	-68.8	-168.9	97.9	0	0	116.6
478	P	48.9	Very low	39.7	Very low	126 Å²	126	129 Å²	129	82%	0.818	75%	0.748	S	S	*	*				-141	104.2	116.6	36.4	-22.5	0	0	0	117.4
479	R	34.7	Very low	39.6	Very low	195 Å²	195	134.5 Å²	134.5	74%	0.736	75%	0.754	S	S	*	*				27.4	125	123.1	-57.4	-179.2	179	-169.7	0.4	121.8
480	V	34	Very low	39.7	Very low	136 Å²	136	137.1 Å²	137.1	82%	0.824	76%	0.755	S	S	*	*				64.1	154	120.6	173.7	0	0	0	0	118.8
481	P	38.3	Very low	39.5	Very low	117 Å²	117	138.3 Å²	138.3	76%	0.76	75%	0.754	S	S	*	*			cis	-128.5	-174.5	3.1	32.7	-10.1	0	0	0	116.9
482	E	34.3	Very low	39.4	Very low	166 Å²	166	140.4 Å²	140.4	78%	0.776	75%	0.754	S	S	*	*			trans	-73.4	-161	153.3	-129.7	-142.3	130.1	0	0	110.6
483	P	40	Very low	39.4	Very low	89 Å²	89	137.6 Å²	137.6	58%	0.578	75%	0.749	S	S	*	*			cis	-139.9	-165.6	-4.3	25.1	2.8	0	0	0	115.7
484	L	32.4	Very low	39.5	Very low	125 Å²	125	139.5 Å²	139.5	65%	0.654	76%	0.757	S	S	*	*			trans	84.9	131.6	135.2	-97.7	171.5	0	0	0	122.6
485	R	35.8	Very low	39.4	Very low	199 Å²	199	135.8 Å²	135.8	75%	0.751	76%	0.755	S	S	*	*			trans	85.2	145.9	153.4	-60.8	173.3	178	174.6	2.3	117.4
486	K	40	Very low	38.7	Very low	152 Å²	152	136.7 Å²	136.7	66%	0.661	76%	0.758	S	S	*	*			cis	-164.6	160.9	-6.4	-116.4	169.1	168.7	-158.2	0	111.3
487	Q	38	Very low	38.6	Very low	169 Å²	169	139 Å²	139	79%	0.79	76%	0.763	S	S	*	*			trans	29.6	136.1	145.7	-59.8	165.6	-83.3	0	0	119.7
488	G	36.6	Very low	38.5	Very low	79 Å²	79	138.2 Å²	138.2	81%	0.814	76%	0.763	S	S	*	*			cis	-167.8	-174.8	5.4	0	0	0	0	0	108.2
489	R	39.1	Very low	37.9	Very low	230 Å²	230	143 Å²	143	87%	0.868	77%	0.765	S	S	*	*				-173.8	167.6	54.9	-159.5	175.5	-166.6	-93.3	6.3	108.8
490	L	41.5	Very low	38	Very low	143 Å²	143	143.4 Å²	143.4	75%	0.749	77%	0.772	S	S	*	*			trans	-30.9	153.5	171.6	-45.2	171.3	0	0	0	115.8
491	D	40.7	Very low	38.1	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	77%	0.769	S	S	*	*			cis	-163.5	158.4	36.1	-153.3	28.9	0	0	0	112.7
492	P	38.8	Very low	38.1	Very low	119 Å²	119	145.8 Å²	145.8	77%	0.773	78%	0.776	S	S	*	*			trans	-121.9	157.9	-170.3	40.9	-29.2	0	0	0	117.4
493	G	44.6	Very low	38.3	Very low	72 Å²	72	148 Å²	148	74%	0.742	78%	0.778	S	S	*	*			trans	-176.1	135.5	166.1	0	0	0	0	0	117.4
494	S	40.8	Very low	38.2	Very low	128 Å²	128	150.4 Å²	150.4	90%	0.895	78%	0.781	S	S	*	*			trans	67.6	134.5	170.7	-55.5	0	0	0	0	118.2
495	A	36.7	Very low	38.2	Very low	88 Å²	88	153.4 Å²	153.4	73%	0.727	79%	0.789	S	S	*	*			cis	-160.3	167.8	-13.2	0	0	0	0	0	110.7
496	V	35.5	Very low	38.5	Very low	134 Å²	134	147.9 Å²	147.9	81%	0.812	79%	0.786	S	S	*	*			trans	63.9	101	169.8	-169.1	0	0	0	0	116.6
497	L	40.9	Very low	38.5	Very low	154 Å²	154	148.7 Å²	148.7	81%	0.806	79%	0.792	S	S	*	*			trans	173.5	138.1	135.1	-95.3	163.1	0	0	0	112.6
498	L	36.4	Very low	38.2	Very low	131 Å²	131	145.9 Å²	145.9	69%	0.686	79%	0.791	S	S	*	*			trans	46.8	131.9	152.2	-104.5	65.6	0	0	0	123.7
499	R	36.4	Very low	38.5	Very low	225 Å²	225	150.3 Å²	150.3	85%	0.849	79%	0.792	S	S	*	*			trans	78.8	108.6	147.7	-61.6	170.3	-179.7	165.7	0.7	120.9
500	K	36.8	Very low	39.1	Very low	205 Å²	205	146.3 Å²	146.3	89%	0.891	79%	0.788	S	S	*	*				-152.9	132.7	127	-94.2	159.9	-175.1	174.2	0	105.7
501	A	37.5	Very low	38.9	Very low	91 Å²	91	150.2 Å²	150.2	75%	0.752	79%	0.792	S	S	*	*			cis	91.1	121.1	26.7	0	0	0	0	0	114.8
502	K	37.7	Very low	38.7	Very low	212 Å²	212	148.7 Å²	148.7	92%	0.922	79%	0.785	S	S	*	*			trans	72.5	114.1	162.4	-166.4	179.7	-173.8	177.8	0	117.9
503	R	38.2	Very low	38.7	Very low	212 Å²	212	149 Å²	149	80%	0.8	78%	0.78	S	S	*	*				170.8	157.2	115.2	-166.5	156.8	-176.2	-166	-14.2	112
504	E	37.1	Very low	38.5	Very low	139 Å²	139	150.5 Å²	150.5	65%	0.65	78%	0.779	S	S	*	*			trans	-4.3	139.6	173.4	-69.2	160.3	106.3	0	0	119.8
505	K	33.5	Very low	38.7	Very low	188 Å²	188	152.1 Å²	152.1	82%	0.817	78%	0.776	S	S	*	*			cis	70.9	77.8	48.9	-160.9	-158.9	173.6	-168.1	0	114.5
506	A	41.2	Very low	38.5	Very low	84 Å²	84	152.6 Å²	152.6	69%	0.694	78%	0.775	S	S	*	*			trans	-139.3	123	147.3	0	0	0	0	0	105
507	E	40.6	Very low	38.7	Very low	169 Å²	169	151 Å²	151	79%	0.79	77%	0.769	S	S	*	*				66.2	108.6	75.6	-67.4	179.5	140.1	0	0	111.4
508	S	32.1	Very low	38.7	Very low	110 Å²	110	150.6 Å²	150.6	77%	0.769	77%	0.768	S	S	*	*				88.2	72.3	62	178.5	0	0	0	0	113
509	M	43.4	Very low	38.6	Very low	171 Å²	171	152.7 Å²	152.7	84%	0.842	77%	0.774	S	S	*	*			trans	-169.4	142.1	156.7	-82.9	-140.9	-61.4	0	0	108
510	L	51.2	Low	38.8	Very low	147 Å²	147	148 Å²	148	77%	0.77	78%	0.776	S	S	*	*			cis	-126.4	143.8	-33	-56.7	107.4	0	0	0	104.7
511	R	37	Very low	38.7	Very low	224 Å²	224	147.5 Å²	147.5	85%	0.845	78%	0.777	S	S	*	*			cis	64.8	137.8	44.9	-132.9	-163.8	-178.9	147.4	3.9	113.8
512	N	37.1	Very low	39	Very low	120 Å²	120	148.7 Å²	148.7	64%	0.642	78%	0.779	S	S	*	*			trans	72.4	145.6	169.9	-57.7	28.6	0	0	0	115.6
513	D	37.2	Very low	39.1	Very low	125 Å²	125	144.7 Å²	144.7	67%	0.668	77%	0.773	S	S	*	*			cis	-167.2	-176.1	-18.5	-102.8	-29.6	0	0	0	108.4
514	S	41.7	Very low	39.4	Very low	103 Å²	103	146.3 Å²	146.3	72%	0.72	78%	0.779	S	S	*	*			trans	70.1	131.1	145.4	-75.9	0	0	0	0	119.2
515	L	45	Very low	40	Very low	162 Å²	162	145.1 Å²	145.1	85%	0.848	78%	0.783	S	S	*	*			cis	-143.7	163.2	-3	-91.4	174.6	0	0	0	110.5
516	S	32.6	Very low	40.8	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	78%	0.78	S	S	*	*			trans	-90.3	-177.9	168.9	61.1	0	0	0	0	112.4
517	S	38.4	Very low	41.5	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	79%	0.785	S	S	*	*			trans	88.4	91.9	157.8	-46.9	0	0	0	0	118.3
518	D	41	Very low	42.3	Very low	147 Å²	147	141.1 Å²	141.1	79%	0.786	79%	0.786	S	S	*	*				-167.1	139.2	100.1	-98.9	-11.9	0	0	0	108
519	Q	34	Very low	43.1	Very low	174 Å²	174	145.1 Å²	145.1	81%	0.813	79%	0.79	S	S	*	*			cis	66.5	84.8	43.6	-65.2	-149.3	68.9	0	0	115.3
520	S	40.8	Very low	43.7	Very low	127 Å²	127	143.5 Å²	143.5	89%	0.888	79%	0.792	S	S	*	*			trans	-162.8	136.2	137.6	29.1	0	0	0	0	111.1
521	E	36.3	Very low	43.4	Very low	195 Å²	195	145 Å²	145	91%	0.911	80%	0.795	S	S	*	*			trans	-92.2	136.7	175.8	-66	176.4	69.6	0	0	110.7
522	S	42	Very low	43.6	Very low	115 Å²	115	145.5 Å²	145.5	80%	0.804	80%	0.797	S	S	*	*			trans	-154.8	92.8	156.3	69.5	0	0	0	0	113.2
523	V	40.7	Very low	44.3	Very low	129 Å²	129	145.8 Å²	145.8	78%	0.782	81%	0.805	S	S	*	*			trans	-11.7	124.6	158.9	-176.4	0	0	0	0	116.8
524	R	45.3	Very low	44.5	Very low	245 Å²	245	149.2 Å²	149.2	93%	0.925	81%	0.814	S	S	*	*			trans	-131.2	126.6	143.8	-85.5	-167.2	172.2	-176.1	0.1	110.5
525	P	49.3	Very low	44.5	Very low	114 Å²	114	156.1 Å²	156.1	74%	0.74	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-83.3	158.6	-171	33.1	-36.5	0	0	0	113.8
526	S	49	Very low	44.4	Very low	109 Å²	109	152.4 Å²	152.4	76%	0.762	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-62.5	146.2	168.6	-61.2	0	0	0	0	112
527	P	57.8	Low	44.8	Very low	123 Å²	123	151.1 Å²	151.1	80%	0.799	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-64.4	136.7	179.2	26	-34.2	0	0	0	111.9
528	P	56.8	Low	45	Very low	125 Å²	125	156.1 Å²	156.1	81%	0.812	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-74.9	155.9	-173.6	29.9	-35.7	0	0	0	113.4
529	K	49.2	Very low	45	Very low	195 Å²	195	158.6 Å²	158.6	85%	0.848	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-81.8	145.3	173.5	-63.9	175	-177.8	172.5	0	110.7	H531	K529-H531 PolarHBondContact O-N 3.29Å
530	P	56.3	Low	45.4	Very low	136 Å²	136	159.4 Å²	159.4	88%	0.883	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-64.2	131.3	170.8	-18	31.3	0	0	0	111.1
531	H	44.6	Very low	45.4	Very low	179 Å²	179	160.5 Å²	160.5	83%	0.829	82%	0.821	S	S	*	*			trans	-111.3	140.5	177.1	-153.5	-77.1	0	0	0	110.6	K529	K529-H531 PolarHBondContact O-N 3.29Å
532	R	40.2	Very low	45.8	Very low	235 Å²	235	158.7 Å²	158.7	89%	0.887	82%	0.815	S	S	*	*			trans	-71.2	135.4	171.7	-80.5	179.3	167.3	173.1	-4.8	110.4
533	P	52.7	Low	45.8	Very low	125 Å²	125	158 Å²	158	81%	0.812	81%	0.81	S	S	*	*			trans	-94.1	150.7	160.8	35.4	-31.2	0	0	0	111.5
534	K	41.5	Very low	46	Very low	197 Å²	197	158.1 Å²	158.1	86%	0.857	81%	0.811	S	S	*	*			trans	-155.7	135.3	168	-173.2	169.3	-177.5	174.2	0	111.2
535	R	41	Very low	45.8	Very low	249 Å²	249	151.6 Å²	151.6	94%	0.94	80%	0.803	S	S	*	*			trans	67.3	146.2	-177.4	-72.8	179.3	166.4	-174.6	-4.8	115.4
536	G	42.2	Very low	45.3	Very low	83 Å²	83	151.2 Å²	151.2	86%	0.856	80%	0.803	S	S	*	*			trans	-171.4	-118.1	-173.9	0	0	0	0	0	109.4
537	G	41.9	Very low	45.3	Very low	72 Å²	72	150.4 Å²	150.4	74%	0.742	80%	0.797	S	S	*	*			trans	109.9	155.5	159.5	0	0	0	0	0	116.9
538	K	42.1	Very low	45	Very low	205 Å²	205	151.9 Å²	151.9	89%	0.891	79%	0.793	S	S	*	*			trans	65.4	137.6	-178.5	-61.9	171.2	-179.8	173.1	0	113.1
539	R	41.4	Very low	45	Very low	198 Å²	198	153.8 Å²	153.8	75%	0.747	79%	0.791	S	S	*	*			cis	-165.2	147.5	17.3	-136.9	177.6	178.2	-155.1	2.5	109
540	R	41.9	Very low	44.8	Very low	191 Å²	191	153.7 Å²	153.7	72%	0.721	79%	0.794	S	S	*	*			trans	44.2	132.2	152.5	-66.5	175	176.4	-168.9	-4	118.3
541	Q	42.1	Very low	44.1	Very low	150 Å²	150	150.2 Å²	150.2	70%	0.701	78%	0.783	S	S	*	*			cis	-161.6	-167.9	11.4	-130.5	155.5	-101.5	0	0	107.1
542	M	44.4	Very low	43.6	Very low	157 Å²	157	148.5 Å²	148.5	77%	0.773	79%	0.785	S	S	*	*			cis	-153.2	171	6.1	39.2	-88	-176.3	0	0	112
543	S	41	Very low	43.3	Very low	102 Å²	102	142.4 Å²	142.4	71%	0.713	78%	0.778	S	S	*	*			trans	-8.4	152.8	150.8	-24.4	0	0	0	0	120.2
544	V	45.3	Very low	42.6	Very low	131 Å²	131	142.7 Å²	142.7	79%	0.794	78%	0.778	S	S	*	*			cis	-139.8	158.1	12	-79.8	0	0	0	0	113.6
545	S	41.1	Very low	42.7	Very low	107 Å²	107	139.2 Å²	139.2	75%	0.748	78%	0.775	S	S	*	*			trans	8	150.8	148	-42.4	0	0	0	0	121
546	S	39.9	Very low	42.3	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	77%	0.769	S	S	*	*			cis	-158.6	-169.1	14.9	-133.7	0	0	0	0	109.7
547	S	48	Very low	42	Very low	93 Å²	93	141.8 Å²	141.8	65%	0.65	77%	0.768	S	S	*	*			cis	-156.9	-157	2.1	-122.8	0	0	0	0	110.6
548	E	52.4	Low	41.5	Very low	153 Å²	153	143.1 Å²	143.1	72%	0.715	76%	0.762	S	S	*	*			trans	-92.6	-178.7	-178.9	57.8	-99.2	83.3	0	0	114.4
549	E	56.5	Low	41	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	75%	0.753	S	S	*	*			cis	-151.4	172.1	16.6	60.6	-149.7	82.6	0	0	115.3
550	E	44.6	Very low	40.7	Very low	193 Å²	193	133.6 Å²	133.6	90%	0.902	75%	0.751	S	S	*	*			trans	7.4	150.8	168.1	-52.9	-171.5	143.9	0	0	122.7
551	G	41.8	Very low	40.4	Very low	63 Å²	63	133.3 Å²	133.3	65%	0.649	76%	0.758	S	S	*	*			cis	-169.8	153.3	1.1	0	0	0	0	0	109.7
552	V	33.2	Very low	40.3	Very low	143 Å²	143	132.6 Å²	132.6	87%	0.867	76%	0.759	S	S	*	*				58.8	117.8	76.3	176.9	0	0	0	0	112.2
553	S	34	Very low	40.5	Very low	108 Å²	108	131.1 Å²	131.1	76%	0.755	76%	0.758	S	S	*	*			cis	-164.2	164.3	-0.9	-99.8	0	0	0	0	112.5
554	T	38.3	Very low	41	Very low	130 Å²	130	132.7 Å²	132.7	80%	0.798	75%	0.754	S	S	*	*			trans	-74.3	155.3	161.1	55	0	0	0	0	111.5
555	P	42.8	Very low	41.1	Very low	124 Å²	124	132.4 Å²	132.4	81%	0.805	75%	0.747	S	S	*	*				-152.7	-160.7	94.5	42.4	-23.2	0	0	0	116
556	E	34.1	Very low	41.3	Very low	175 Å²	175	133.2 Å²	133.2	82%	0.818	74%	0.739	S	S	*	*			trans	-85.4	-170.5	-167.9	-51.8	165.2	106	0	0	115
557	Y	35.5	Very low	41.5	Very low	211 Å²	211	132 Å²	132	83%	0.827	73%	0.731	S	S	*	*			trans	72.7	149.2	170.7	-96.4	-130.3	0	0	0	116.2
558	T	31.3	Very low	41	Very low	100 Å²	100	136.6 Å²	136.6	61%	0.613	74%	0.742	S	S	*	*			cis	-167.4	155.6	-23.4	17.3	0	0	0	0	109.5
559	S	30.9	Very low	40.2	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	75%	0.749	S	S	*	*			trans	42.4	130.2	139.1	-153.3	0	0	0	0	121.6
560	C	36.7	Very low	39.3	Very low	104 Å²	104	134.2 Å²	134.2	70%	0.703	75%	0.754	S	S	*	*			trans	68.5	159.6	162.3	-58.2	0	0	0	0	115.7
561	E	35.5	Very low	39.2	Very low	185 Å²	185	129.8 Å²	129.8	86%	0.864	74%	0.744	S	S	*	*			cis	-141.7	163.8	-5.4	32.8	-137.8	72.8	0	0	112.7
562	D	39.9	Very low	39.1	Very low	135 Å²	135	134 Å²	134	72%	0.722	75%	0.747	S	S	*	*			trans	-54.2	145.6	170.5	171.8	38.8	0	0	0	115.3	E564	D562-E564 PolarHBondContact OD1-N 2.82Å
563	V	48.1	Very low	39.4	Very low	126 Å²	126	136.2 Å²	136.2	76%	0.764	75%	0.745	S	S	*	*			trans	-153.3	113.7	136.9	177.3	0	0	0	0	109.8
564	E	51.3	Low	39.6	Very low	134 Å²	134	134.3 Å²	134.3	63%	0.626	74%	0.742	S	S	*	*			trans	9.1	142.3	141.3	-52.9	176	109.1	0	0	121.2	D562	D562-E564 PolarHBondContact OD1-N 2.82Å
565	L	47.6	Very low	39.6	Very low	125 Å²	125	135.6 Å²	135.6	65%	0.654	74%	0.744	S	S	*	*				-169.5	82.4	117.2	-103	163.5	0	0	0	113.5	K909	L565-K909 PolarHBondContact O-NZ 3.4Å
566	E	45.6	Very low	39.5	Very low	125 Å²	125	136.4 Å²	136.4	58%	0.584	74%	0.741	S	S	*	*			trans	38.3	129.8	137.6	-63.5	-162.4	89.4	0	0	122.6	K909	E566-K909 PolarHBondContact O-NZ 3.12Å
567	S	42.5	Very low	39.6	Very low	80 Å²	80	134.5 Å²	134.5	56%	0.559	74%	0.737	S	S	*	*			trans	68.5	164.2	132.9	-57.1	0	0	0	0	118.2
568	E	38.9	Very low	39.6	Very low	190 Å²	190	134.8 Å²	134.8	89%	0.888	74%	0.738	S	S	*	*			cis	-131.1	159.9	17.2	-62.5	159.1	105.6	0	0	113.8
569	S	34.1	Very low	39.7	Very low	122 Å²	122	141 Å²	141	85%	0.853	75%	0.75	S	S	*	*			trans	-120	146.9	-179.7	-56.8	0	0	0	0	110.9
570	V	38.3	Very low	39.9	Very low	145 Å²	145	143.7 Å²	143.7	88%	0.879	76%	0.756	S	S	*	*			trans	-136	131.7	166.6	-171	0	0	0	0	110.5
571	S	42	Very low	39.6	Very low	100 Å²	100	144 Å²	144	70%	0.699	75%	0.751	S	S	*	*			trans	-43.8	167.9	164	-83.3	0	0	0	0	114.4
572	E	40.7	Very low	39.6	Very low	151 Å²	151	140.2 Å²	140.2	71%	0.706	74%	0.742	S	S	*	*			cis	162.6	169.7	-6.4	-179.8	-169.3	111.2	0	0	105
573	K	40.3	Very low	39.5	Very low	190 Å²	190	137.9 Å²	137.9	83%	0.826	74%	0.742	S	S	*	*			trans	86.1	141.1	153.8	-146.8	160.1	-171.5	157.8	0	117.3
574	G	37.8	Very low	39	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	74%	0.735	S	S	*	*			trans	95	79	-168.2	0	0	0	0	0	111.3
575	D	37.4	Very low	38.2	Very low	157 Å²	157	141 Å²	141	84%	0.84	75%	0.746	S	S	*	*			cis	67.1	100.1	48.5	-168.7	23	0	0	0	113.8
576	L	41.2	Very low	37.4	Very low	142 Å²	142	143.7 Å²	143.7	74%	0.743	75%	0.754	S	S	*	*			trans	-173.6	133	134.1	-170.7	60.1	0	0	0	111.5	Y578	L576-Y578 HydrophobicContact CD2-CD2 4.24Å; L576-Y578 HydrophobicContact CD2-CE2 4.04Å; L576-Y578 HydrophobicContact CG-CD2 4.44Å
577	D	35.1	Very low	36.6	Very low	134 Å²	134	143.6 Å²	143.6	72%	0.717	77%	0.767	S	S	*	*			trans	-68.6	132.3	170.5	-93.8	-48	0	0	0	113.2
578	Y	37.1	Very low	36.1	Very low	217 Å²	217	149.2 Å²	149.2	85%	0.851	78%	0.776	S	S	*	*			trans	-153	64.2	154.2	-94.2	-67.9	0	0	0	111.9	L576	L576-Y578 HydrophobicContact CD2-CD2 4.24Å; L576-Y578 HydrophobicContact CD2-CE2 4.04Å; L576-Y578 HydrophobicContact CG-CD2 4.44Å
579	W	33	Very low	35.7	Very low	232 Å²	232	146.9 Å²	146.9	88%	0.879	77%	0.765	S	S	*	*			trans	-93.3	158.2	158.1	-83.5	96	0	0	0	110.6
580	L	35.4	Very low	35.5	Very low	156 Å²	156	147.6 Å²	147.6	82%	0.817	77%	0.765	S	S	*	*			trans	75	89.5	169.2	-57	155.3	0	0	0	117.6
581	D	30.8	Very low	35.5	Very low	111 Å²	111	146.2 Å²	146.2	59%	0.594	76%	0.762	S	S	*	*			trans	-123.8	107.3	132.3	-178.2	1.7	0	0	0	109.4	A583	D581-A583 VanDerWaalsContact C-N 3.28Å; D581-A583 PolarHBondContact O-N 3.45Å; D581-A583 VanDerWaalsContact OD1-CB 3.23Å; D581-A583 WeakPolarHBondContact OD1-CB 3.19Å; D581-A583 PolarHBondContact OD1-N 3.05Å
582	P	35.6	Very low	35.2	Very low	105 Å²	105	146.4 Å²	146.4	68%	0.682	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-72	-6.2	177.8	-20.6	34.5	0	0	0	116.2	T584	P582-T584 PolarHBondContact O-N 2.76Å
583	A	35.9	Very low	35	Very low	86 Å²	86	146.7 Å²	146.7	71%	0.711	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-85.5	-4.2	-161.9	0	0	0	0	0	117	D581	D581-A583 VanDerWaalsContact C-N 3.28Å; D581-A583 PolarHBondContact O-N 3.45Å; D581-A583 VanDerWaalsContact OD1-CB 3.23Å; D581-A583 WeakPolarHBondContact OD1-CB 3.19Å; D581-A583 PolarHBondContact OD1-N 3.05Å
584	T	38.2	Very low	34.9	Very low	103 Å²	103	142.6 Å²	142.6	63%	0.632	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-90.8	-1.2	-162.7	47.5	0	0	0	0	116.9	P582 H586	P582-T584 PolarHBondContact O-N 2.76Å; T584-H586 VanDerWaalsContact C-N 3.33Å; T584-H586 PolarHBondContact O-N 3.11Å
585	W	34.1	Very low	35.4	Very low	223 Å²	223	143.6 Å²	143.6	85%	0.845	76%	0.757	S	S	*	*			trans	-80.8	23.5	-162	-87.5	78.5	0	0	0	118.3
586	H	31	Very low	36.3	Very low	180 Å²	180	142.3 Å²	142.3	83%	0.833	75%	0.746	S	S	*	*			trans	-142.4	77.1	-179.9	-73	-29.7	0	0	0	115.7	T584	T584-H586 VanDerWaalsContact C-N 3.33Å; T584-H586 PolarHBondContact O-N 3.11Å
587	S	29.4	Very low	38	Very low	123 Å²	123	138.3 Å²	138.3	86%	0.86	73%	0.728	S	S	*	*			trans	179.9	144.3	139	-88.3	0	0	0	0	116.3
588	R	31.1	Very low	40.5	Very low	199 Å²	199	133 Å²	133	75%	0.751	70%	0.701	S	S	*	*			trans	48.3	108.4	154.5	-75.3	-171.7	171.9	-100.8	-0.6	121.9
589	E	31.1	Very low	43	Very low	140 Å²	140	125.2 Å²	125.2	65%	0.654	68%	0.676	S	S	*	*				68.3	139.4	121.3	-64.2	161.9	156	0	0	122.1
590	T	30.8	Very low	45.7	Very low	137 Å²	137	117.8 Å²	117.8	84%	0.84	65%	0.648	S	S	*	*			trans	62.2	73.5	158.9	36.9	0	0	0	0	119.3
591	S	36.5	Very low	48.2	Very low	117 Å²	117	116 Å²	116	82%	0.818	64%	0.635	S	S	*	*			trans	-167.7	158.1	131.8	-87	0	0	0	0	111.3
592	P	36.7	Very low	50.9	Low	103 Å²	103	115.2 Å²	115.2	67%	0.669	64%	0.636	S	S	*	*			trans	-104.1	129	-146.3	38.2	-35.3	0	0	0	115.5	S594	P592-S594 PolarHBondContact O-N 2.78Å
593	I	37.4	Very low	53.3	Low	157 Å²	157	111.2 Å²	111.2	81%	0.805	61%	0.61	S	S	*	*			trans	-80.2	68.2	168.5	-49.9	175.3	0	0	0	108.5
594	S	37.7	Very low	55.5	Low	105 Å²	105	116.4 Å²	116.4	73%	0.734	62%	0.617	S	S	*	*			trans	-93.9	4.2	-156.5	66.1	0	0	0	0	117.5	P592	P592-S594 PolarHBondContact O-N 2.78Å
595	S	47.5	Very low	57.4	Low	89 Å²	89	117 Å²	117	62%	0.622	61%	0.613	S	S	*	*	S	Bend	trans	-93	-27.7	-166.2	56.2	0	0	0	0	116.2
596	H	57.1	Low	59.5	Low	130 Å²	130	108.6 Å²	108.6	60%	0.602	60%	0.595	S	S	*	*			trans	-120.3	129.4	-172.3	-69.9	-55.9	0	0	0	112.8	V598	H596-V598 PolarHBondContact O-N 2.91Å
597	P	77	Confident	62	Low	57 Å²	57	103.6 Å²	103.6	37%	0.37	58%	0.575	S	S	.	*	S	Bend	trans	-75.4	-7	179.9	32.7	-36.7	0	0	0	113.2	I614 V660	P597-I614 PolarHBondContact O-N 2.89Å; P597-V660 HydrophobicContact CB-CG1 4.03Å; P597-V660 HydrophobicContact CG-CG1 3.94Å
598	V	87.1	Confident	64.8	Low	24 Å²	24	100.6 Å²	100.6	15%	0.145	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.8	174.9	174.1	0	0	0	0	108.8	H596 W600 R612 V613 V660	H596-V598 PolarHBondContact O-N 2.91Å; V598-W600 VanDerWaalsContact CG1-NE1 3.26Å; V598-R612 WeakPolarHBondContact CA-O 3.33Å; V598-V613 HydrophobicContact CG1-CG2 4.27Å; V598-V613 HydrophobicContact CG2-CB 4.45Å; V598-V613 HydrophobicContact CG2-CG1 4.11Å; V598-V613 HydrophobicContact CG2-CG2 4.12Å; V598-V660 WeakPolarHBondContact CG2-O 3.18Å
599	T	89.3	Confident	67.6	Low	53 Å²	53	92.3 Å²	92.3	33%	0.325	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.5	168.9	54.9	0	0	0	0	109.4	G611 R612	T599-G611 CarbonylContact O-C 3.54Å; T599-G611 VanDerWaalsContact O-CA 3.24Å; T599-G611 WeakPolarHBondContact O-CA 3.39Å; T599-R612 PolarHBondContact N-O 2.87Å; T599-R612 PolarHBondContact O-N 3.04Å
600	W	89.9	Confident	70.5	Confident	76 Å²	76	87.9 Å²	87.9	29%	0.288	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134	176.2	-69.6	93.7	0	0	0	109.6	V598 L609 I610 G611 V702 R704	V598-W600 VanDerWaalsContact CG1-NE1 3.26Å; W600-L609 HydrophobicContact CB-CD2 4.47Å; W600-L609 HydrophobicContact CE3-CB 4.06Å; W600-I610 CarbonylContact C-O 3.49Å; W600-I610 WeakPolarHBondContact CA-O 3.38Å; W600-G611 VanDerWaalsContact CZ3-CA 3.45Å; W600-V702 HydrophobicContact CH2-CG2 3.48Å; W600-V702 VanDerWaalsContact CH2-CG2 3.48Å; W600-V702 HydrophobicContact CZ2-CG2 4.28Å; W600-V702 HydrophobicContact CZ3-CG2 4Å; W600-R704 HydrophobicContact CH2-CG 4.34Å; W600-R704 VanDerWaalsContact CZ2-CZ 3.46Å; W600-R704 HydrophobicContact CZ3-CG 3.87Å
601	Q	88.1	Confident	73.5	Confident	117 Å²	117	81.4 Å²	81.4	55%	0.547	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.8	-179.7	-67	-178	-23.4	0	0	109.5	I610	Q601-I610 PolarHBondContact N-O 3.48Å; Q601-I610 PolarHBondContact O-N 3.3Å
602	P	88.1	Confident	76.2	Confident	95 Å²	95	81.7 Å²	81.7	62%	0.617	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	143.2	170.5	-22.9	34.2	0	0	0	111	L609	P602-L609 HydrophobicContact CG-CD2 4.28Å
603	S	85.4	Confident	79	Confident	21 Å²	21	76.8 Å²	76.8	15%	0.147	41%	0.407	C	S	.	.			trans	-66.9	156.8	168.9	-158.5	0	0	0	0	110	E605 G606 R608	S603-E605 WeakPolarHBondContact CB-OE2 3.45Å; S603-E605 PolarHBondContact O-N 3.19Å; S603-E605 VanDerWaalsContact O-N 3.11Å; S603-E605 PolarHBondContact OG-OE2 3.31Å; S603-G606 PolarHBondContact O-N 2.88Å; S603-R608 WeakPolarHBondContact CB-O 2.99Å; S603-R608 PolarHBondContact N-O 3.47Å
604	K	81.8	Confident	81.6	Confident	195 Å²	195	71.8 Å²	71.8	85%	0.848	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.8	177.2	64.3	-170.7	179.2	-170.5	0	113.6
605	E	78.8	Confident	84.1	Confident	116 Å²	116	66.8 Å²	66.8	54%	0.542	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-14.3	174.1	-59.7	81.3	-175.9	0	0	114	S603 D607	S603-E605 WeakPolarHBondContact CB-OE2 3.45Å; S603-E605 PolarHBondContact O-N 3.19Å; S603-E605 VanDerWaalsContact O-N 3.11Å; S603-E605 PolarHBondContact OG-OE2 3.31Å; E605-D607 VanDerWaalsContact C-N 3.26Å; E605-D607 PolarHBondContact O-N 3.11Å
606	G	77.3	Confident	86.1	Confident	47 Å²	47	65.3 Å²	65.3	49%	0.485	33%	0.331	S	S	.	.	S	Bend	trans	71.9	6.3	-179	0	0	0	0	0	116.4	S603 I706	S603-G606 PolarHBondContact O-N 2.88Å; G606-I706 VanDerWaalsContact O-CD1 3.31Å; G606-I706 WeakPolarHBondContact O-CD1 3.39Å
607	D	83.9	Confident	87.5	Confident	74 Å²	74	62.1 Å²	62.1	40%	0.396	32%	0.316	S	S	.	.	S	Bend	trans	-92.6	-27.6	179.9	77.3	-40.4	0	0	0	113.8	E605 I706	E605-D607 VanDerWaalsContact C-N 3.26Å; E605-D607 PolarHBondContact O-N 3.11Å; D607-I706 WeakPolarHBondContact O-CB 3.47Å; D607-I706 PolarHBondContact O-N 2.86Å
608	R	87.8	Confident	87.7	Confident	61 Å²	61	68.6 Å²	68.6	23%	0.23	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.3	-172	-73	158	-164.7	-101.4	-7.9	112.3	S603 E668 R704 I706	S603-R608 WeakPolarHBondContact CB-O 2.99Å; S603-R608 PolarHBondContact N-O 3.47Å; R608-E668 IonicContact NH1-OE2 3.73Å; R608-R704 CarbonylContact C-O 3.56Å; R608-R704 VanDerWaalsContact CA-O 3.28Å; R608-R704 WeakPolarHBondContact CA-O 3.48Å; R608-I706 WeakPolarHBondContact O-CD1 3.41Å
609	L	90.4	Very high	87.4	Confident	24 Å²	24	70.4 Å²	70.4	13%	0.126	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.4	167.6	-85.4	155.7	0	0	0	109.3	W600 P602 S703 R704 I706 I709	W600-L609 HydrophobicContact CB-CD2 4.47Å; W600-L609 HydrophobicContact CE3-CB 4.06Å; P602-L609 HydrophobicContact CG-CD2 4.28Å; L609-S703 VanDerWaalsContact O-CA 3.28Å; L609-S703 WeakPolarHBondContact O-CA 3.4Å; L609-R704 HydrophobicContact CB-CG 4.31Å; L609-R704 PolarHBondContact N-O 2.9Å; L609-R704 PolarHBondContact O-N 2.84Å; L609-I706 HydrophobicContact CB-CG1 4.39Å; L609-I706 HydrophobicContact CD1-CG1 3.77Å; L609-I706 HydrophobicContact CG-CD1 4.16Å; L609-I706 HydrophobicContact CG-CG1 3.64Å; L609-I709 HydrophobicContact CD1-CD1 3.35Å; L609-I709 HydrophobicContact CD1-CG1 4.31Å
610	I	92.2	Very high	86.3	Confident	48 Å²	48	74.4 Å²	74.4	25%	0.246	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.7	175	-58.3	176.1	0	0	0	108	W600 Q601 L670 I701 V702	W600-I610 CarbonylContact C-O 3.49Å; W600-I610 WeakPolarHBondContact CA-O 3.38Å; Q601-I610 PolarHBondContact N-O 3.48Å; Q601-I610 PolarHBondContact O-N 3.3Å; I610-L670 HydrophobicContact CG2-CD1 4.49Å; I610-I701 HydrophobicContact CG2-CG2 3.56Å; I610-V702 CarbonylContact C-O 3.38Å; I610-V702 WeakPolarHBondContact CA-O 3.26Å
611	G	93.2	Very high	85.1	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124	178.5	0	0	0	0	0	111.2	T599 W600 I701 V702	T599-G611 CarbonylContact O-C 3.54Å; T599-G611 VanDerWaalsContact O-CA 3.24Å; T599-G611 WeakPolarHBondContact O-CA 3.39Å; W600-G611 VanDerWaalsContact CZ3-CA 3.45Å; G611-I701 CarbonylContact O-C 3.55Å; G611-I701 WeakPolarHBondContact O-CA 3.36Å; G611-V702 PolarHBondContact N-O 3.47Å; G611-V702 WeakPolarHBondContact O-CG2 3.48Å; G611-V702 PolarHBondContact O-N 2.61Å
612	R	94.4	Very high	83.9	Confident	123 Å²	123	71.7 Å²	71.7	46%	0.464	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.3	166.6	-55.9	-167	-177.5	-156.6	-0	108.9	V598 T599 I701	V598-R612 WeakPolarHBondContact CA-O 3.33Å; T599-R612 PolarHBondContact N-O 2.87Å; T599-R612 PolarHBondContact O-N 3.04Å; R612-I701 HydrophobicContact CG-CD1 4.1Å; R612-I701 HydrophobicContact CG-CG1 4.09Å; R612-I701 HydrophobicContact CG-CG2 4.46Å
613	V	94.2	Very high	82.4	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	122.7	-167.6	175.9	0	0	0	0	110.5	V598 L615 L663 E699 I700 V702	V598-V613 HydrophobicContact CG1-CG2 4.27Å; V598-V613 HydrophobicContact CG2-CB 4.45Å; V598-V613 HydrophobicContact CG2-CG1 4.11Å; V598-V613 HydrophobicContact CG2-CG2 4.12Å; V613-L615 HydrophobicContact CG1-CD2 3.8Å; V613-L615 HydrophobicContact CG1-CG 3.99Å; V613-L663 HydrophobicContact CB-CD2 4.35Å; V613-L663 HydrophobicContact CG1-CD1 4.22Å; V613-L663 HydrophobicContact CG1-CD2 4.29Å; V613-L663 HydrophobicContact CG1-CG 4.23Å; V613-L663 HydrophobicContact CG2-CD2 3.88Å; V613-E699 CarbonylContact O-C 3.1Å; V613-E699 WeakPolarHBondContact O-CA 3.44Å; V613-I700 PolarHBondContact N-O 3.39Å; V613-I700 PolarHBondContact O-N 3.14Å; V613-V702 HydrophobicContact CG2-CG2 4.46Å
614	I	92.9	Very high	81.2	Confident	52 Å²	52	85.6 Å²	85.6	27%	0.267	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	104.9	-172.4	-61.3	177.9	0	0	0	109.2	P597 Q697 E699	P597-I614 PolarHBondContact O-N 2.89Å; I614-Q697 HydrophobicContact CG2-CG 3.91Å; I614-E699 HydrophobicContact CG1-CB 4.46Å; I614-E699 HydrophobicContact CG1-CG 4.14Å
615	L	90.7	Very high	79.9	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	105.6	-176.3	-56.2	-177.6	0	0	0	111.7	V613 L629 L631 A657 V660 L663 Q697 V698 I700	V613-L615 HydrophobicContact CG1-CD2 3.8Å; V613-L615 HydrophobicContact CG1-CG 3.99Å; L615-L629 HydrophobicContact CB-CD2 3.7Å; L615-L629 HydrophobicContact CD1-CB 4.39Å; L615-L629 HydrophobicContact CD1-CD1 4.49Å; L615-L629 HydrophobicContact CD1-CD2 4.1Å; L615-L631 HydrophobicContact CD1-CD2 4.07Å; L615-A657 HydrophobicContact CD1-CB 4.16Å; L615-V660 HydrophobicContact CD2-CB 4.31Å; L615-V660 HydrophobicContact CD2-CG1 4.42Å; L615-L663 HydrophobicContact CD1-CD1 4.25Å; L615-Q697 CarbonylContact O-C 3.5Å; L615-Q697 WeakPolarHBondContact O-CA 3.33Å; L615-V698 PolarHBondContact N-O 2.84Å; L615-V698 PolarHBondContact O-N 2.87Å; L615-I700 HydrophobicContact CD1-CD1 4Å
616	N	88.6	Confident	78.6	Confident	58 Å²	58	75.1 Å²	75.1	31%	0.31	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	117.8	173.7	-175	-12	0	0	0	111	R618 T619 L656 P696	N616-R618 PolarHBondContact O-N 2.86Å; N616-R618 VanDerWaalsContact OD1-CB 3.32Å; N616-R618 WeakPolarHBondContact OD1-CB 3.36Å; N616-R618 PolarHBondContact OD1-N 2.77Å; N616-T619 WeakPolarHBondContact O-CB 3.18Å; N616-T619 PolarHBondContact O-N 2.83Å; N616-T619 PolarHBondContact O-OG1 3.16Å; N616-L656 WeakPolarHBondContact O-CD1 3.47Å; N616-P696 PolarHBondContact OD1-O 2.67Å
617	K	86.6	Confident	77.5	Confident	64 Å²	64	78 Å²	78	28%	0.278	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.8	-179.9	-60.4	174.1	-169.6	150.6	0	113.4	T619 L629 S692 K693 E695 P696	K617-T619 VanDerWaalsContact C-N 3.35Å; K617-L629 HydrophobicContact CG-CD2 3.76Å; K617-L629 HydrophobicContact CG-CG 4.5Å; K617-S692 PolarHBondContact NZ-O 2.94Å; K617-K693 PolarHBondContact NZ-O 2.95Å; K617-E695 WeakPolarHBondContact CD-O 3.33Å; K617-E695 WeakPolarHBondContact CE-O 3.46Å; K617-E695 PolarHBondContact NZ-O 2.9Å; K617-P696 WeakPolarHBondContact CB-O 3.45Å; K617-P696 PolarHBondContact N-O 3.1Å
618	R	81.3	Confident	77	Confident	193 Å²	193	80.4 Å²	80.4	73%	0.728	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-13.7	176.8	-58.4	-178	176.2	173.1	0.6	112.7	N616 T620 P696	N616-R618 PolarHBondContact O-N 2.86Å; N616-R618 VanDerWaalsContact OD1-CB 3.32Å; N616-R618 WeakPolarHBondContact OD1-CB 3.36Å; N616-R618 PolarHBondContact OD1-N 2.77Å; R618-T620 PolarHBondContact O-N 3.33Å; R618-P696 HydrophobicContact CG-CB 4.37Å
619	T	79.5	Confident	76.9	Confident	62 Å²	62	78.5 Å²	78.5	38%	0.38	42%	0.418	S	S	.	.	S	Bend	trans	-60.9	124.2	178.5	-62.6	0	0	0	0	111	N616 K617 M621 L656	N616-T619 WeakPolarHBondContact O-CB 3.18Å; N616-T619 PolarHBondContact O-N 2.83Å; N616-T619 PolarHBondContact O-OG1 3.16Å; K617-T619 VanDerWaalsContact C-N 3.35Å; T619-M621 HydrophobicContact CG2-SD 4.43Å; T619-M621 PolarHBondContact O-N 2.66Å; T619-L656 HydrophobicContact CG2-CD2 4.02Å
620	T	66.3	Low	76.8	Confident	136 Å²	136	78 Å²	78	83%	0.834	42%	0.418	S	S	*	.			trans	-76.4	92.4	-175.4	51.2	0	0	0	0	111.8	R618	R618-T620 PolarHBondContact O-N 3.33Å
621	M	66.2	Low	76.8	Confident	42 Å²	42	77.1 Å²	77.1	21%	0.207	41%	0.413	C	S	.	.			trans	-72.8	157.3	175.2	-65	-56.9	-72.4	0	0	112.8	T619 G654 L656 V659	T619-M621 HydrophobicContact CG2-SD 4.43Å; T619-M621 PolarHBondContact O-N 2.66Å; M621-G654 WeakPolarHBondContact CE-O 3.33Å; M621-L656 HydrophobicContact CG-CD2 3.72Å; M621-L656 HydrophobicContact CG-CG 3.82Å; M621-L656 HydrophobicContact SD-CD2 3.5Å; M621-L656 WeakPolarHBondContact SD-CD2 3.34Å; M621-L656 HydrophobicContact SD-CG 4.1Å; M621-V659 HydrophobicContact CE-CB 3.83Å; M621-V659 HydrophobicContact CE-CG1 4.15Å; M621-V659 HydrophobicContact CE-CG2 3.92Å
622	P	61.6	Low	76.8	Confident	94 Å²	94	83 Å²	83	61%	0.61	44%	0.439	S	S	*	.			trans	-51.1	144.5	168.1	-27.4	36.3	0	0	0	112.2	E624 S625	P622-E624 PolarHBondContact O-N 3.49Å; P622-S625 WeakPolarHBondContact O-CB 3.36Å; P622-S625 PolarHBondContact O-N 2.96Å
623	K	58	Low	76.8	Confident	213 Å²	213	78 Å²	78	93%	0.926	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-11.9	-159.9	-164.5	173.1	179	-179.8	0	116.6
624	E	58.5	Low	76.7	Confident	195 Å²	195	80.3 Å²	80.3	91%	0.911	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-20.8	178.5	-51.4	-161.9	179.4	0	0	112.1	P622 G626	P622-E624 PolarHBondContact O-N 3.49Å; E624-G626 PolarHBondContact O-N 3.34Å; E624-G626 VanDerWaalsContact O-N 3.12Å
625	S	56.3	Low	76.5	Confident	33 Å²	33	78 Å²	78	23%	0.231	43%	0.425	C	S	.	.	S	Bend	trans	-83.8	83	176.5	-58.1	0	0	0	0	110.8	P622 G654	P622-S625 WeakPolarHBondContact O-CB 3.36Å; P622-S625 PolarHBondContact O-N 2.96Å; S625-G654 WeakPolarHBondContact CB-O 3.39Å; S625-G654 PolarHBondContact OG-O 2.98Å
626	G	50.5	Low	76.2	Confident	58 Å²	58	79.5 Å²	79.5	60%	0.598	44%	0.441	S	S	*	.			trans	-54.1	147.1	178.2	0	0	0	0	0	113.4	E624 L628	E624-G626 PolarHBondContact O-N 3.34Å; E624-G626 VanDerWaalsContact O-N 3.12Å; G626-L628 PolarHBondContact O-N 2.87Å
627	A	54.4	Low	76	Confident	108 Å²	108	81.6 Å²	81.6	89%	0.893	45%	0.447	S	S	*	.	S	Bend	trans	-66.4	55.9	-162.9	0	0	0	0	0	116.9
628	L	73.9	Confident	75.9	Confident	125 Å²	125	84.1 Å²	84.1	65%	0.654	46%	0.461	S	S	*	.	S	Bend	trans	-129.2	149.8	173.5	-67.5	166.9	0	0	0	107.8	G626 G630	G626-L628 PolarHBondContact O-N 2.87Å; L628-G630 PolarHBondContact O-N 3.36Å
629	L	85.8	Confident	75.9	Confident	21 Å²	21	75.6 Å²	75.6	11%	0.11	43%	0.431	C	S	.	.			trans	-52.1	-34.6	177.4	-62.6	179.2	0	0	0	112.5	L615 K617 L631 S655 L656 A657 W672 V698	L615-L629 HydrophobicContact CB-CD2 3.7Å; L615-L629 HydrophobicContact CD1-CB 4.39Å; L615-L629 HydrophobicContact CD1-CD1 4.49Å; L615-L629 HydrophobicContact CD1-CD2 4.1Å; K617-L629 HydrophobicContact CG-CD2 3.76Å; K617-L629 HydrophobicContact CG-CG 4.5Å; L629-L631 HydrophobicContact CB-CD2 4.35Å; L629-L631 HydrophobicContact CB-CG 4.45Å; L629-S655 PolarHBondContact O-OG 3.46Å; L629-L656 HydrophobicContact CD2-CD1 4.31Å; L629-L656 PolarHBondContact O-N 2.62Å; L629-A657 VanDerWaalsContact O-CB 3.22Å; L629-A657 WeakPolarHBondContact O-CB 3.22Å; L629-A657 PolarHBondContact O-N 3.06Å; L629-W672 HydrophobicContact CD1-CH2 4.25Å; L629-W672 HydrophobicContact CD1-CZ2 4.43Å; L629-V698 HydrophobicContact CD1-CB 4.25Å; L629-V698 HydrophobicContact CD1-CG2 4.07Å
630	G	88.3	Confident	75.8	Confident	12 Å²	12	79.8 Å²	79.8	12%	0.124	45%	0.451	C	S	.	.			trans	95.5	-4.6	171.1	0	0	0	0	0	115.4	L628 K652	L628-G630 PolarHBondContact O-N 3.36Å; G630-K652 WeakPolarHBondContact O-CB 3.48Å; G630-K652 WeakPolarHBondContact O-CG 3.46Å; G630-K652 PolarHBondContact O-N 3.07Å
631	L	92.2	Very high	76.2	Confident	30 Å²	30	79.9 Å²	79.9	16%	0.157	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	158.7	172.3	67.7	91.7	0	0	0	112.6	L615 L629 V633 K650 V651 A657 L663 W672 I700	L615-L631 HydrophobicContact CD1-CD2 4.07Å; L629-L631 HydrophobicContact CB-CD2 4.35Å; L629-L631 HydrophobicContact CB-CG 4.45Å; L631-V633 HydrophobicContact CD1-CG2 3.43Å; L631-V633 VanDerWaalsContact CD1-CG2 3.43Å; L631-K650 CarbonylContact C-O 3.59Å; L631-K650 WeakPolarHBondContact CA-O 3.46Å; L631-V651 HydrophobicContact CB-CG2 4.39Å; L631-A657 HydrophobicContact CB-CB 3.87Å; L631-A657 HydrophobicContact CD2-CB 3.95Å; L631-A657 HydrophobicContact CG-CB 4.36Å; L631-L663 HydrophobicContact CD2-CD1 3.77Å; L631-W672 HydrophobicContact CD1-CH2 3.99Å; L631-W672 HydrophobicContact CD1-CZ3 3.92Å; L631-W672 HydrophobicContact CD2-CH2 4.45Å; L631-W672 HydrophobicContact CD2-CZ3 4.4Å; L631-I700 HydrophobicContact CD2-CD1 3.71Å
632	K	93.2	Very high	76.9	Confident	125 Å²	125	80.5 Å²	80.5	54%	0.543	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	110.1	166.6	-178.1	-172.6	175.5	-177.8	0	110.4	T649 K650	K632-T649 PolarHBondContact O-N 2.82Å; K632-T649 PolarHBondContact O-OG1 2.78Å; K632-K650 HydrophobicContact CB-CB 4.43Å; K632-K650 PolarHBondContact N-O 3.11Å
633	V	93.8	Very high	78	Confident	17 Å²	17	84.1 Å²	84.1	10%	0.103	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	152.2	169.2	-163.2	0	0	0	0	110.5	L631 A646 F647 V669 W672 V685 I689	L631-V633 HydrophobicContact CD1-CG2 3.43Å; L631-V633 VanDerWaalsContact CD1-CG2 3.43Å; V633-A646 HydrophobicContact CG1-CB 3.83Å; V633-F647 CarbonylContact C-O 3.6Å; V633-F647 VanDerWaalsContact CA-O 3.3Å; V633-F647 WeakPolarHBondContact CA-O 3.16Å; V633-V669 HydrophobicContact CG1-CG2 4.07Å; V633-V669 HydrophobicContact CG2-CG2 4.32Å; V633-W672 HydrophobicContact CG2-CE3 4.45Å; V633-W672 HydrophobicContact CG2-CZ3 3.84Å; V633-V685 HydrophobicContact CG1-CG1 4.11Å; V633-I689 HydrophobicContact CB-CD1 3.63Å; V633-I689 HydrophobicContact CG1-CD1 4.26Å; V633-I689 HydrophobicContact CG2-CD1 3.73Å
634	V	91.8	Very high	79.5	Confident	49 Å²	49	76.5 Å²	76.5	30%	0.297	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	118	164.1	173.6	0	0	0	0	108.7	A646 F647 T649	V634-A646 WeakPolarHBondContact O-CA 3.43Å; V634-F647 PolarHBondContact N-O 3.04Å; V634-F647 PolarHBondContact O-N 3.08Å; V634-T649 HydrophobicContact CB-CG2 3.78Å; V634-T649 HydrophobicContact CG2-CG2 3.56Å
635	G	90	Very high	81	Confident	3 Å²	3	67.2 Å²	67.2	3%	0.031	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	170.8	173.2	0	0	0	0	0	113.5	K637 N682	G635-K637 VanDerWaalsContact C-N 3.3Å; G635-K637 PolarHBondContact O-N 3.3Å; G635-N682 PolarHBondContact O-ND2 3.39Å
636	G	84.2	Confident	82.8	Confident	32 Å²	32	65.6 Å²	65.6	33%	0.33	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.1	20.1	174.8	0	0	0	0	0	115.6	G645	G636-G645 PolarHBondContact N-O 3.17Å
637	K	84.6	Confident	84.9	Confident	102 Å²	102	63.9 Å²	63.9	44%	0.443	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	134.6	168.6	-178.7	-168.9	162	-146.3	0	108.3	G635 T639 G645 F647	G635-K637 VanDerWaalsContact C-N 3.3Å; G635-K637 PolarHBondContact O-N 3.3Å; K637-T639 PolarHBondContact O-N 3.5Å; K637-G645 PolarHBondContact N-O 2.88Å; K637-G645 PolarHBondContact O-N 2.63Å; K637-F647 HydrophobicContact CB-CD2 3.78Å; K637-F647 HydrophobicContact CB-CE2 3.96Å; K637-F647 HydrophobicContact CD-CD2 3.63Å; K637-F647 HydrophobicContact CD-CE2 3.8Å; K637-F647 HydrophobicContact CD-CG 4.02Å; K637-F647 HydrophobicContact CD-CZ 4.35Å; K637-F647 HydrophobicContact CG-CD2 4.15Å; K637-F647 HydrophobicContact CG-CE2 4.1Å
638	M	83.1	Confident	86.8	Confident	117 Å²	117	58.8 Å²	58.8	58%	0.576	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	132.9	175	-153.4	69.9	75.8	0	0	110.8	G642 R643 L644	M638-G642 VanDerWaalsContact SD-C 3.52Å; M638-R643 CarbonylContact C-O 3.59Å; M638-R643 WeakPolarHBondContact CA-O 3.42Å; M638-L644 HydrophobicContact CE-CD2 4.32Å; M638-L644 HydrophobicContact SD-CD2 4.21Å
639	T	82.7	Confident	87.8	Confident	14 Å²	14	55.7 Å²	55.7	9%	0.086	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-83.7	166.4	169.5	67.4	0	0	0	0	110.4	K637 L641 G642 R643 F647 E668	K637-T639 PolarHBondContact O-N 3.5Å; T639-L641 PolarHBondContact O-N 3.34Å; T639-L641 PolarHBondContact OG1-N 2.94Å; T639-G642 PolarHBondContact O-N 2.93Å; T639-R643 WeakPolarHBondContact CG2-O 3.43Å; T639-R643 PolarHBondContact N-O 3.45Å; T639-R643 PolarHBondContact OG1-N 2.91Å; T639-R643 PolarHBondContact OG1-O 3.32Å; T639-F647 HydrophobicContact CG2-CE2 4.13Å; T639-F647 HydrophobicContact CG2-CZ 3.97Å; T639-E668 WeakPolarHBondContact CG2-OE1 3.38Å
640	D	76.6	Confident	88.1	Confident	149 Å²	149	62 Å²	62	80%	0.797	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.9	176	-42.4	-62.2	0	0	0	112.2	G642	D640-G642 VanDerWaalsContact C-N 3.26Å; D640-G642 PolarHBondContact O-N 2.88Å
641	L	75.5	Confident	88.3	Confident	138 Å²	138	63.2 Å²	63.2	72%	0.723	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	9.1	174.7	-56.7	179.1	0	0	0	113.4	T639 R643	T639-L641 PolarHBondContact O-N 3.34Å; T639-L641 PolarHBondContact OG1-N 2.94Å; L641-R643 VanDerWaalsContact C-N 3.29Å; L641-R643 PolarHBondContact O-N 3.38Å
642	G	79.8	Confident	88.2	Confident	55 Å²	55	68.2 Å²	68.2	57%	0.567	35%	0.35	S	S	*	.	S	Bend	trans	69.4	20.9	177.4	0	0	0	0	0	114.8	M638 T639 D640	M638-G642 VanDerWaalsContact SD-C 3.52Å; T639-G642 PolarHBondContact O-N 2.93Å; D640-G642 VanDerWaalsContact C-N 3.26Å; D640-G642 PolarHBondContact O-N 2.88Å
643	R	85.3	Confident	88	Confident	170 Å²	170	71 Å²	71	64%	0.642	36%	0.363	S	S	*	.	S	Bend	trans	-107.1	156.8	176.8	-60.2	-175.5	-177.8	-167.2	-0.5	110.2	M638 T639 L641	M638-R643 CarbonylContact C-O 3.59Å; M638-R643 WeakPolarHBondContact CA-O 3.42Å; T639-R643 WeakPolarHBondContact CG2-O 3.43Å; T639-R643 PolarHBondContact N-O 3.45Å; T639-R643 PolarHBondContact OG1-N 2.91Å; T639-R643 PolarHBondContact OG1-O 3.32Å; L641-R643 VanDerWaalsContact C-N 3.29Å; L641-R643 PolarHBondContact O-N 3.38Å
644	L	89.2	Confident	87.6	Confident	53 Å²	53	71.3 Å²	71.3	28%	0.277	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	139.4	165.6	-59.5	-176.5	0	0	0	109.3	M638 G679 T681	M638-L644 HydrophobicContact CE-CD2 4.32Å; M638-L644 HydrophobicContact SD-CD2 4.21Å; L644-G679 PolarHBondContact O-N 2.99Å; L644-T681 HydrophobicContact CD1-CG2 4.41Å
645	G	90	Very high	87.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160.6	176.5	0	0	0	0	0	111.7	G636 K637	G636-G645 PolarHBondContact N-O 3.17Å; K637-G645 PolarHBondContact N-O 2.88Å; K637-G645 PolarHBondContact O-N 2.63Å
646	A	94.5	Very high	87.4	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.4	176.7	0	0	0	0	0	109.6	V633 V634 E668 V669 L677 V685	V633-A646 HydrophobicContact CG1-CB 3.83Å; V634-A646 WeakPolarHBondContact O-CA 3.43Å; A646-E668 CarbonylContact O-C 3.49Å; A646-V669 HydrophobicContact CB-CB 4.22Å; A646-V669 PolarHBondContact O-N 3.27Å; A646-L677 HydrophobicContact CB-CB 3.78Å; A646-L677 HydrophobicContact CB-CD1 3.64Å; A646-L677 HydrophobicContact CB-CG 4.38Å; A646-V685 HydrophobicContact CB-CG1 4.1Å; A646-V685 HydrophobicContact CB-CG2 3.98Å
647	F	94.4	Very high	87.8	Confident	21 Å²	21	68.1 Å²	68.1	9%	0.092	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.9	-173.6	-69.2	-98.2	0	0	0	111.9	V633 V634 K637 T639 T649 D667 E668	V633-F647 CarbonylContact C-O 3.6Å; V633-F647 VanDerWaalsContact CA-O 3.3Å; V633-F647 WeakPolarHBondContact CA-O 3.16Å; V634-F647 PolarHBondContact N-O 3.04Å; V634-F647 PolarHBondContact O-N 3.08Å; K637-F647 HydrophobicContact CB-CD2 3.78Å; K637-F647 HydrophobicContact CB-CE2 3.96Å; K637-F647 HydrophobicContact CD-CD2 3.63Å; K637-F647 HydrophobicContact CD-CE2 3.8Å; K637-F647 HydrophobicContact CD-CG 4.02Å; K637-F647 HydrophobicContact CD-CZ 4.35Å; K637-F647 HydrophobicContact CG-CD2 4.15Å; K637-F647 HydrophobicContact CG-CE2 4.1Å; T639-F647 HydrophobicContact CG2-CE2 4.13Å; T639-F647 HydrophobicContact CG2-CZ 3.97Å; F647-T649 PolarHBondContact O-N 3.41Å; F647-D667 WeakPolarHBondContact CA-O 3.18Å; F647-E668 HydrophobicContact CD1-CB 4.07Å; F647-E668 HydrophobicContact CD1-CG 4.46Å; F647-E668 HydrophobicContact CE1-CB 3.84Å; F647-E668 HydrophobicContact CE1-CG 4.08Å; F647-E668 HydrophobicContact CZ-CB 4.39Å; F647-E668 HydrophobicContact CZ-CG 4.13Å
648	I	94.6	Very high	88.1	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.01	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	115.7	169.5	-56.4	-171.3	0	0	0	108.2	V651 L663 R664 A665 G666 D667 V669 V702	I648-V651 HydrophobicContact CG2-CG2 3.49Å; I648-V651 VanDerWaalsContact CG2-CG2 3.49Å; I648-L663 HydrophobicContact CD1-CB 3.95Å; I648-L663 HydrophobicContact CD1-CD1 3.95Å; I648-L663 HydrophobicContact CD1-CD2 4.05Å; I648-L663 HydrophobicContact CD1-CG 4.21Å; I648-R664 WeakPolarHBondContact CB-O 3.42Å; I648-R664 WeakPolarHBondContact CG2-O 3.34Å; I648-A665 CarbonylContact O-C 3.5Å; I648-A665 WeakPolarHBondContact O-CA 3.46Å; I648-G666 PolarHBondContact O-N 3.47Å; I648-D667 HydrophobicContact CB-CB 4.29Å; I648-D667 HydrophobicContact CD1-CB 4.01Å; I648-D667 HydrophobicContact CG1-CB 4.17Å; I648-D667 PolarHBondContact N-O 2.73Å; I648-V669 HydrophobicContact CD1-CG2 4.27Å; I648-V669 HydrophobicContact CG1-CG2 3.73Å; I648-V702 HydrophobicContact CD1-CG1 4.17Å
649	T	93.2	Very high	88.3	Confident	59 Å²	59	63.9 Å²	63.9	36%	0.362	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-25.8	-175.6	57.8	0	0	0	0	113.8	K632 V634 F647	K632-T649 PolarHBondContact O-N 2.82Å; K632-T649 PolarHBondContact O-OG1 2.78Å; V634-T649 HydrophobicContact CB-CG2 3.78Å; V634-T649 HydrophobicContact CG2-CG2 3.56Å; F647-T649 PolarHBondContact O-N 3.41Å
650	K	93	Very high	88.6	Confident	155 Å²	155	65 Å²	65	67%	0.674	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.6	145.5	173.1	-64.5	-161.7	176.1	-153.8	0	109.8	L631 K632	L631-K650 CarbonylContact C-O 3.59Å; L631-K650 WeakPolarHBondContact CA-O 3.46Å; K632-K650 HydrophobicContact CB-CB 4.43Å; K632-K650 PolarHBondContact N-O 3.11Å
651	V	93.2	Very high	89.1	Confident	36 Å²	36	57.9 Å²	57.9	22%	0.218	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.2	167.2	-177.9	0	0	0	0	107.8	L631 I648 A657 D658 L663	L631-V651 HydrophobicContact CB-CG2 4.39Å; I648-V651 HydrophobicContact CG2-CG2 3.49Å; I648-V651 VanDerWaalsContact CG2-CG2 3.49Å; V651-A657 HydrophobicContact CG1-CB 3.92Å; V651-D658 HydrophobicContact CG1-CB 3.93Å; V651-L663 HydrophobicContact CG2-CB 4.33Å
652	K	90.5	Very high	89.8	Confident	135 Å²	135	56.2 Å²	56.2	59%	0.587	29%	0.287	S	S	*	.			trans	-84.8	121.5	178	-74.1	-176.5	178.3	-174.3	0	110.5	G630 G654 S655 D658	G630-K652 WeakPolarHBondContact O-CB 3.48Å; G630-K652 WeakPolarHBondContact O-CG 3.46Å; G630-K652 PolarHBondContact O-N 3.07Å; K652-G654 PolarHBondContact O-N 2.94Å; K652-S655 WeakPolarHBondContact O-CB 3.37Å; K652-S655 PolarHBondContact O-N 2.69Å; K652-S655 PolarHBondContact O-OG 2.74Å; K652-D658 WeakPolarHBondContact O-CB 3.47Å
653	K	88	Confident	90.5	Very high	185 Å²	185	53.8 Å²	53.8	80%	0.804	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	132.2	172.1	-159.9	157.8	-170.5	157	0	110.7	D658	K653-D658 WeakPolarHBondContact CA-OD2 3.42Å
654	G	84.8	Confident	90.8	Very high	23 Å²	23	51.4 Å²	51.4	24%	0.237	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-1.1	-175	0	0	0	0	0	116.2	M621 S625 K652 D658	M621-G654 WeakPolarHBondContact CE-O 3.33Å; S625-G654 WeakPolarHBondContact CB-O 3.39Å; S625-G654 PolarHBondContact OG-O 2.98Å; K652-G654 PolarHBondContact O-N 2.94Å; G654-D658 PolarHBondContact N-OD2 2.87Å
655	S	89.4	Confident	90.9	Very high	8 Å²	8	52 Å²	52	6%	0.056	26%	0.264	C	S	.	.	S	Bend	trans	-84	172.1	179.1	70.5	0	0	0	0	113.5	L629 K652 A657 D658 V659	L629-S655 PolarHBondContact O-OG 3.46Å; K652-S655 WeakPolarHBondContact O-CB 3.37Å; K652-S655 PolarHBondContact O-N 2.69Å; K652-S655 PolarHBondContact O-OG 2.74Å; S655-A657 VanDerWaalsContact C-N 3.3Å; S655-A657 PolarHBondContact O-N 3.37Å; S655-D658 PolarHBondContact O-N 3.35Å; S655-V659 WeakPolarHBondContact O-CB 3.43Å; S655-V659 WeakPolarHBondContact O-CG2 3.48Å; S655-V659 PolarHBondContact O-N 2.93Å
656	L	89.8	Confident	90.9	Very high	9 Å²	9	54.6 Å²	54.6	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-41.9	176.9	-73.7	165.6	0	0	0	112.2	N616 T619 M621 L629 D658 V660 G661	N616-L656 WeakPolarHBondContact O-CD1 3.47Å; T619-L656 HydrophobicContact CG2-CD2 4.02Å; M621-L656 HydrophobicContact CG-CD2 3.72Å; M621-L656 HydrophobicContact CG-CG 3.82Å; M621-L656 HydrophobicContact SD-CD2 3.5Å; M621-L656 WeakPolarHBondContact SD-CD2 3.34Å; M621-L656 HydrophobicContact SD-CG 4.1Å; L629-L656 HydrophobicContact CD2-CD1 4.31Å; L629-L656 PolarHBondContact O-N 2.62Å; L656-D658 VanDerWaalsContact C-N 3.26Å; L656-D658 PolarHBondContact O-N 2.58Å; L656-V660 HydrophobicContact CD2-CG2 4Å; L656-V660 WeakPolarHBondContact O-CA 3.22Å; L656-V660 WeakPolarHBondContact O-CB 3.21Å; L656-V660 PolarHBondContact O-N 2.84Å; L656-G661 PolarHBondContact O-N 3.31Å
657	A	92.1	Very high	90.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.8	-29.8	178.7	0	0	0	0	0	113.7	L615 L629 L631 V651 S655 G661 H662 L663	L615-A657 HydrophobicContact CD1-CB 4.16Å; L629-A657 VanDerWaalsContact O-CB 3.22Å; L629-A657 WeakPolarHBondContact O-CB 3.22Å; L629-A657 PolarHBondContact O-N 3.06Å; L631-A657 HydrophobicContact CB-CB 3.87Å; L631-A657 HydrophobicContact CD2-CB 3.95Å; L631-A657 HydrophobicContact CG-CB 4.36Å; V651-A657 HydrophobicContact CG1-CB 3.92Å; S655-A657 VanDerWaalsContact C-N 3.3Å; S655-A657 PolarHBondContact O-N 3.37Å; A657-G661 CarbonylContact O-C 3.58Å; A657-G661 WeakPolarHBondContact O-CA 3.5Å; A657-H662 PolarHBondContact O-N 3.16Å; A657-H662 VanDerWaalsContact O-N 3.1Å; A657-L663 HydrophobicContact CB-CD1 4.14Å; A657-L663 WeakPolarHBondContact O-CB 3.48Å; A657-L663 PolarHBondContact O-N 3.34Å
658	D	90.9	Very high	90.8	Very high	55 Å²	55	54.8 Å²	54.8	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-83.2	-59.4	178.4	-179.4	52.4	0	0	0	110.9	V651 K652 K653 G654 S655 L656 H662	V651-D658 HydrophobicContact CG1-CB 3.93Å; K652-D658 WeakPolarHBondContact O-CB 3.47Å; K653-D658 WeakPolarHBondContact CA-OD2 3.42Å; G654-D658 PolarHBondContact N-OD2 2.87Å; S655-D658 PolarHBondContact O-N 3.35Å; L656-D658 VanDerWaalsContact C-N 3.26Å; L656-D658 PolarHBondContact O-N 2.58Å; D658-H662 WeakPolarHBondContact O-CA 3.46Å; D658-H662 PolarHBondContact O-N 3.21Å; D658-H662 PolarHBondContact O-ND1 2.91Å; D658-H662 VanDerWaalsContact O-ND1 3.07Å
659	V	87.8	Confident	90.9	Very high	75 Å²	75	54.7 Å²	54.7	46%	0.455	29%	0.292	S	S	.	.	H	α-helix	trans	-76.9	-38.4	-170.2	179.5	0	0	0	0	112.9	M621 S655 H662	M621-V659 HydrophobicContact CE-CB 3.83Å; M621-V659 HydrophobicContact CE-CG1 4.15Å; M621-V659 HydrophobicContact CE-CG2 3.92Å; S655-V659 WeakPolarHBondContact O-CB 3.43Å; S655-V659 WeakPolarHBondContact O-CG2 3.48Å; S655-V659 PolarHBondContact O-N 2.93Å; V659-H662 PolarHBondContact O-CE1 3.06Å
660	V	87.7	Confident	90.9	Very high	36 Å²	36	54 Å²	54	22%	0.218	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-39.7	179.1	-176.3	0	0	0	0	110.9	P597 V598 L615 L656	P597-V660 HydrophobicContact CB-CG1 4.03Å; P597-V660 HydrophobicContact CG-CG1 3.94Å; V598-V660 WeakPolarHBondContact CG2-O 3.18Å; L615-V660 HydrophobicContact CD2-CB 4.31Å; L615-V660 HydrophobicContact CD2-CG1 4.42Å; L656-V660 HydrophobicContact CD2-CG2 4Å; L656-V660 WeakPolarHBondContact O-CA 3.22Å; L656-V660 WeakPolarHBondContact O-CB 3.21Å; L656-V660 PolarHBondContact O-N 2.84Å
661	G	87.5	Confident	91	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-22.7	-172.7	0	0	0	0	0	116.5	L656 A657 L663	L656-G661 PolarHBondContact O-N 3.31Å; A657-G661 CarbonylContact O-C 3.58Å; A657-G661 WeakPolarHBondContact O-CA 3.5Å; G661-L663 PolarHBondContact O-N 3.3Å; G661-L663 VanDerWaalsContact O-N 3.1Å
662	H	90.4	Very high	91.1	Very high	104 Å²	104	48.7 Å²	48.7	48%	0.481	26%	0.261	S	S	.	.			trans	49.6	33.1	-172.5	-51.2	-32.8	0	0	0	113.5	A657 D658 V659 R704	A657-H662 PolarHBondContact O-N 3.16Å; A657-H662 VanDerWaalsContact O-N 3.1Å; D658-H662 WeakPolarHBondContact O-CA 3.46Å; D658-H662 PolarHBondContact O-N 3.21Å; D658-H662 PolarHBondContact O-ND1 2.91Å; D658-H662 VanDerWaalsContact O-ND1 3.07Å; V659-H662 PolarHBondContact O-CE1 3.06Å; H662-R704 PolarHBondContact O-NH2 2.9Å
663	L	93.5	Very high	91.2	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.243	C	C	.	.			trans	-77.3	140.5	177.2	-63.8	177.2	0	0	0	109.7	V613 L615 L631 I648 V651 A657 G661 D667 I700 V702	V613-L663 HydrophobicContact CB-CD2 4.35Å; V613-L663 HydrophobicContact CG1-CD1 4.22Å; V613-L663 HydrophobicContact CG1-CD2 4.29Å; V613-L663 HydrophobicContact CG1-CG 4.23Å; V613-L663 HydrophobicContact CG2-CD2 3.88Å; L615-L663 HydrophobicContact CD1-CD1 4.25Å; L631-L663 HydrophobicContact CD2-CD1 3.77Å; I648-L663 HydrophobicContact CD1-CB 3.95Å; I648-L663 HydrophobicContact CD1-CD1 3.95Å; I648-L663 HydrophobicContact CD1-CD2 4.05Å; I648-L663 HydrophobicContact CD1-CG 4.21Å; V651-L663 HydrophobicContact CG2-CB 4.33Å; A657-L663 HydrophobicContact CB-CD1 4.14Å; A657-L663 WeakPolarHBondContact O-CB 3.48Å; A657-L663 PolarHBondContact O-N 3.34Å; G661-L663 PolarHBondContact O-N 3.3Å; G661-L663 VanDerWaalsContact O-N 3.1Å; L663-D667 WeakPolarHBondContact CA-OD2 3.47Å; L663-I700 HydrophobicContact CD1-CD1 4.22Å; L663-V702 HydrophobicContact CD2-CB 4.48Å; L663-V702 HydrophobicContact CD2-CG1 3.88Å; L663-V702 HydrophobicContact CD2-CG2 3.82Å
664	R	91.6	Very high	91.3	Very high	119 Å²	119	37.9 Å²	37.9	45%	0.449	23%	0.231	S	C	.	.			trans	-118.5	155.1	-177.4	-66.8	-179.7	-179.7	-104.1	-0.2	110.2	I648 G666 D667 S886	I648-R664 WeakPolarHBondContact CB-O 3.42Å; I648-R664 WeakPolarHBondContact CG2-O 3.34Å; R664-G666 PolarHBondContact O-N 2.85Å; R664-D667 PolarHBondContact N-OD2 2.85Å; R664-D667 PolarHBondContact O-N 2.96Å; R664-S886 PolarHBondContact NH1-O 2.8Å
665	A	91.7	Very high	91.7	Very high	66 Å²	66	41.1 Å²	41.1	55%	0.545	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	131.2	164.9	0	0	0	0	0	108.4	I648	I648-A665 CarbonylContact O-C 3.5Å; I648-A665 WeakPolarHBondContact O-CA 3.46Å
666	G	90.6	Very high	91.9	Very high	55 Å²	55	45.1 Å²	45.1	57%	0.567	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.2	-31.1	-171.2	0	0	0	0	0	113.7	I648 R664 E668	I648-G666 PolarHBondContact O-N 3.47Å; R664-G666 PolarHBondContact O-N 2.85Å; G666-E668 PolarHBondContact O-N 3.11Å
667	D	93.7	Very high	92	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	26%	0.262	C	S	.	.			trans	-54.2	129.8	178.5	-70.1	-19.6	0	0	0	111.5	F647 I648 L663 R664 V702 R704	F647-D667 WeakPolarHBondContact CA-O 3.18Å; I648-D667 HydrophobicContact CB-CB 4.29Å; I648-D667 HydrophobicContact CD1-CB 4.01Å; I648-D667 HydrophobicContact CG1-CB 4.17Å; I648-D667 PolarHBondContact N-O 2.73Å; L663-D667 WeakPolarHBondContact CA-OD2 3.47Å; R664-D667 PolarHBondContact N-OD2 2.85Å; R664-D667 PolarHBondContact O-N 2.96Å; D667-V702 HydrophobicContact CB-CB 4.28Å; D667-V702 HydrophobicContact CB-CG1 4.38Å; D667-R704 VanDerWaalsContact CG-NH2 3.3Å; D667-R704 IonicContact OD1-CZ 3.81Å; D667-R704 VanDerWaalsContact OD1-CZ 3.31Å; D667-R704 IonicContact OD1-NE 2.75Å; D667-R704 PolarHBondContact OD1-NE 3.46Å; D667-R704 IonicContact OD1-NH2 2.87Å; D667-R704 PolarHBondContact OD1-NH2 3.21Å; D667-R704 IonicContact OD2-CZ 3.02Å; D667-R704 IonicContact OD2-NE 3.68Å; D667-R704 IonicContact OD2-NH2 2.73Å; D667-R704 PolarHBondContact OD2-NH2 2.88Å
668	E	93.8	Very high	91.9	Very high	21 Å²	21	47.4 Å²	47.4	10%	0.098	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.4	172	-176.2	173.7	-178.5	0	0	109.4	R608 T639 A646 F647 G666 L670 V702 S703	R608-E668 IonicContact NH1-OE2 3.73Å; T639-E668 WeakPolarHBondContact CG2-OE1 3.38Å; A646-E668 CarbonylContact O-C 3.49Å; F647-E668 HydrophobicContact CD1-CB 4.07Å; F647-E668 HydrophobicContact CD1-CG 4.46Å; F647-E668 HydrophobicContact CE1-CB 3.84Å; F647-E668 HydrophobicContact CE1-CG 4.08Å; F647-E668 HydrophobicContact CZ-CB 4.39Å; F647-E668 HydrophobicContact CZ-CG 4.13Å; G666-E668 PolarHBondContact O-N 3.11Å; E668-L670 HydrophobicContact CG-CD2 4.44Å; E668-L670 PolarHBondContact O-N 2.85Å; E668-V702 CarbonylContact O-C 3.49Å; E668-V702 WeakPolarHBondContact O-CA 3.42Å; E668-S703 PolarHBondContact N-O 3.04Å; E668-S703 PolarHBondContact O-N 2.85Å
669	V	95.3	Very high	91.8	Very high	0 Å²	0	47 Å²	47	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	115	177.3	-172.4	0	0	0	0	109.1	V633 A646 I648 E671 W672 L677 I700 I701 V702	V633-V669 HydrophobicContact CG1-CG2 4.07Å; V633-V669 HydrophobicContact CG2-CG2 4.32Å; A646-V669 HydrophobicContact CB-CB 4.22Å; A646-V669 PolarHBondContact O-N 3.27Å; I648-V669 HydrophobicContact CD1-CG2 4.27Å; I648-V669 HydrophobicContact CG1-CG2 3.73Å; V669-E671 WeakPolarHBondContact CG1-O 3.4Å; V669-W672 HydrophobicContact CG1-CE3 4.43Å; V669-L677 HydrophobicContact CB-CD1 4.05Å; V669-L677 HydrophobicContact CG1-CD1 3.63Å; V669-L677 HydrophobicContact CG1-CG 4.41Å; V669-I700 HydrophobicContact CG1-CG2 3.68Å; V669-I701 CarbonylContact C-O 3.44Å; V669-V702 HydrophobicContact CG2-CG1 4.17Å
670	L	93.8	Very high	91.9	Very high	43 Å²	43	44 Å²	44	23%	0.225	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-42.8	177.3	-59.4	-176.4	0	0	0	111.7	I610 E668 P676 L677 P678 I701	I610-L670 HydrophobicContact CG2-CD1 4.49Å; E668-L670 HydrophobicContact CG-CD2 4.44Å; E668-L670 PolarHBondContact O-N 2.85Å; L670-P676 WeakPolarHBondContact O-CA 3.48Å; L670-L677 PolarHBondContact O-N 3.45Å; L670-P678 HydrophobicContact CD2-CG 3.94Å; L670-P678 WeakPolarHBondContact O-CD 3.39Å; L670-I701 HydrophobicContact CB-CG2 4.32Å; L670-I701 HydrophobicContact CD1-CG2 4.44Å; L670-I701 PolarHBondContact N-O 3.08Å
671	E	95	Very high	92.1	Very high	76 Å²	76	44.6 Å²	44.6	36%	0.355	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.1	179.2	-60.7	178.4	-153.3	0	0	111.6	V669 K675 I700 I701	V669-E671 WeakPolarHBondContact CG1-O 3.4Å; E671-K675 CarbonylContact C-O 3.57Å; E671-K675 WeakPolarHBondContact CA-O 3.45Å; E671-I700 WeakPolarHBondContact O-CA 3.41Å; E671-I701 HydrophobicContact CB-CB 3.98Å; E671-I701 HydrophobicContact CB-CD1 4.31Å; E671-I701 HydrophobicContact CB-CG1 4.07Å; E671-I701 HydrophobicContact CG-CB 4.47Å; E671-I701 HydrophobicContact CG-CD1 4.4Å; E671-I701 PolarHBondContact N-O 2.86Å; E671-I701 VanDerWaalsContact N-O 3.15Å; E671-I701 PolarHBondContact O-N 3.02Å
672	W	95	Very high	92.3	Very high	5 Å²	5	48.5 Å²	48.5	2%	0.019	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	112.3	176.1	-175.6	-73.4	0	0	0	109	L629 L631 V633 V669 G674 K675 L677 I688 I689 S692 V698 I700	L629-W672 HydrophobicContact CD1-CH2 4.25Å; L629-W672 HydrophobicContact CD1-CZ2 4.43Å; L631-W672 HydrophobicContact CD1-CH2 3.99Å; L631-W672 HydrophobicContact CD1-CZ3 3.92Å; L631-W672 HydrophobicContact CD2-CH2 4.45Å; L631-W672 HydrophobicContact CD2-CZ3 4.4Å; V633-W672 HydrophobicContact CG2-CE3 4.45Å; V633-W672 HydrophobicContact CG2-CZ3 3.84Å; V669-W672 HydrophobicContact CG1-CE3 4.43Å; W672-G674 VanDerWaalsContact C-N 3.27Å; W672-G674 PolarHBondContact O-N 2.94Å; W672-K675 PolarHBondContact N-O 3.19Å; W672-K675 WeakPolarHBondContact O-CB 3.42Å; W672-K675 PolarHBondContact O-N 2.61Å; W672-L677 HydrophobicContact CB-CD1 4.04Å; W672-L677 HydrophobicContact CB-CD2 4.35Å; W672-L677 HydrophobicContact CB-CG 4.27Å; W672-I688 HydrophobicContact CB-CG2 4.07Å; W672-I688 HydrophobicContact CG-CG2 4Å; W672-I689 HydrophobicContact CD2-CG1 4.02Å; W672-I689 HydrophobicContact CE3-CG1 4.26Å; W672-I689 HydrophobicContact CH2-CG1 4.16Å; W672-I689 HydrophobicContact CH2-CG2 4.39Å; W672-I689 HydrophobicContact CZ2-CB 4.31Å; W672-I689 HydrophobicContact CZ2-CG1 3.88Å; W672-I689 HydrophobicContact CZ2-CG2 4.06Å; W672-I689 HydrophobicContact CZ3-CG1 4.33Å; W672-S692 VanDerWaalsContact NE1-CB 3.29Å; W672-S692 PolarHBondContact NE1-OG 3.4Å; W672-V698 HydrophobicContact CD2-CG1 4.15Å; W672-V698 HydrophobicContact CH2-CG1 4.31Å; W672-V698 HydrophobicContact CZ2-CG1 3.73Å; W672-I700 HydrophobicContact CD2-CG1 4.43Å; W672-I700 HydrophobicContact CE3-CD1 3.98Å; W672-I700 HydrophobicContact CE3-CG1 3.92Å; W672-I700 HydrophobicContact CE3-CG2 4.1Å; W672-I700 HydrophobicContact CH2-CD1 4.03Å; W672-I700 HydrophobicContact CZ3-CD1 3.55Å; W672-I700 HydrophobicContact CZ3-CG1 4.04Å; W672-I700 HydrophobicContact CZ3-CG2 4.5Å
673	N	92.7	Very high	92.4	Very high	40 Å²	40	50.2 Å²	50.2	21%	0.214	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	46.2	-170.5	-67.3	-3.4	0	0	0	112.7	K675 S692 E695 V698 E699	N673-K675 PolarHBondContact O-N 2.86Å; N673-S692 WeakPolarHBondContact ND2-CB 3.37Å; N673-E695 PolarHBondContact ND2-OE1 3.33Å; N673-E695 PolarHBondContact ND2-OE2 2.63Å; N673-V698 VanDerWaalsContact OD1-CA 3.26Å; N673-V698 WeakPolarHBondContact OD1-CA 3.39Å; N673-V698 WeakPolarHBondContact OD1-CG1 3.22Å; N673-E699 PolarHBondContact N-O 2.93Å; N673-E699 PolarHBondContact OD1-N 2.81Å; N673-E699 PolarHBondContact OD1-O 3.33Å
674	G	91	Very high	92.4	Very high	53 Å²	53	54.6 Å²	54.6	55%	0.546	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	1.4	-177.4	0	0	0	0	0	115.4	W672	W672-G674 VanDerWaalsContact C-N 3.27Å; W672-G674 PolarHBondContact O-N 2.94Å
675	K	92.8	Very high	92.5	Very high	90 Å²	90	49 Å²	49	39%	0.391	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120	172	-58.5	-170.1	177.9	-168.9	0	109.6	E671 W672 N673 I688 E691	E671-K675 CarbonylContact C-O 3.57Å; E671-K675 WeakPolarHBondContact CA-O 3.45Å; W672-K675 PolarHBondContact N-O 3.19Å; W672-K675 WeakPolarHBondContact O-CB 3.42Å; W672-K675 PolarHBondContact O-N 2.61Å; N673-K675 PolarHBondContact O-N 2.86Å; K675-I688 HydrophobicContact CB-CD1 4.16Å; K675-I688 HydrophobicContact CB-CG2 4.23Å; K675-I688 HydrophobicContact CD-CD1 4.25Å; K675-I688 HydrophobicContact CD-CG1 3.86Å; K675-I688 HydrophobicContact CD-CG2 4.06Å; K675-E691 IonicContact NZ-OE2 3.2Å; K675-E691 PolarHBondContact NZ-OE2 2.95Å
676	P	92.4	Very high	92.5	Very high	92 Å²	92	52.7 Å²	52.7	60%	0.597	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	138.5	177.7	28.5	-34.3	0	0	0	111.1	L670	L670-P676 WeakPolarHBondContact O-CA 3.48Å
677	L	92.8	Very high	92.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.298	C	S	.	.			trans	-104.9	-20.9	177.4	-54.2	-168.2	0	0	0	115.5	A646 V669 L670 W672 G679 A680 V685 I688	A646-L677 HydrophobicContact CB-CB 3.78Å; A646-L677 HydrophobicContact CB-CD1 3.64Å; A646-L677 HydrophobicContact CB-CG 4.38Å; V669-L677 HydrophobicContact CB-CD1 4.05Å; V669-L677 HydrophobicContact CG1-CD1 3.63Å; V669-L677 HydrophobicContact CG1-CG 4.41Å; L670-L677 PolarHBondContact O-N 3.45Å; W672-L677 HydrophobicContact CB-CD1 4.04Å; W672-L677 HydrophobicContact CB-CD2 4.35Å; W672-L677 HydrophobicContact CB-CG 4.27Å; L677-G679 PolarHBondContact O-N 3.21Å; L677-A680 WeakPolarHBondContact O-CB 3.43Å; L677-A680 PolarHBondContact O-N 3.41Å; L677-V685 HydrophobicContact CB-CG2 4.44Å; L677-V685 HydrophobicContact CD1-CG1 4.31Å; L677-V685 HydrophobicContact CD1-CG2 4.42Å; L677-V685 HydrophobicContact CD2-CG2 4.32Å; L677-I688 HydrophobicContact CD2-CB 4.47Å; L677-I688 HydrophobicContact CD2-CD1 3.55Å; L677-I688 HydrophobicContact CD2-CG2 4.15Å
678	P	89.9	Confident	92.6	Very high	58 Å²	58	54.7 Å²	54.7	38%	0.377	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	124.2	169.5	-29.4	36.9	0	0	0	111.9	L670	L670-P678 HydrophobicContact CD2-CG 3.94Å; L670-P678 WeakPolarHBondContact O-CD 3.39Å
679	G	89	Confident	92.5	Very high	47 Å²	47	55.7 Å²	55.7	49%	0.485	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.8	-21.8	-170.7	0	0	0	0	0	114.2	L644 L677	L644-G679 PolarHBondContact O-N 2.99Å; L677-G679 PolarHBondContact O-N 3.21Å
680	A	89.6	Confident	92.3	Very high	12 Å²	12	59.3 Å²	59.3	10%	0.099	33%	0.327	C	S	.	.			trans	-74.4	141.2	-172.8	0	0	0	0	0	113.7	L677 E684 V685	L677-A680 WeakPolarHBondContact O-CB 3.43Å; L677-A680 PolarHBondContact O-N 3.41Å; A680-E684 HydrophobicContact CB-CB 4.12Å; A680-V685 HydrophobicContact CB-CG2 3.74Å
681	T	91.1	Very high	92.1	Very high	48 Å²	48	62.2 Å²	62.2	29%	0.294	34%	0.339	S	S	.	.			trans	-67.5	170.1	173.3	61.1	0	0	0	0	112.3	L644 E683 E684 V685	L644-T681 HydrophobicContact CD1-CG2 4.41Å; T681-E683 VanDerWaalsContact C-N 3.28Å; T681-E683 PolarHBondContact O-N 3.17Å; T681-E684 VanDerWaalsContact CB-OE2 3.28Å; T681-E684 WeakPolarHBondContact CB-OE2 3.49Å; T681-E684 VanDerWaalsContact CG2-OE2 3.3Å; T681-E684 WeakPolarHBondContact CG2-OE2 3.33Å; T681-E684 PolarHBondContact N-OE2 2.82Å; T681-E684 WeakPolarHBondContact OG1-CB 3.25Å; T681-E684 VanDerWaalsContact OG1-CD 3.28Å; T681-E684 VanDerWaalsContact OG1-CG 3.29Å; T681-E684 WeakPolarHBondContact OG1-CG 3.49Å; T681-E684 PolarHBondContact OG1-N 2.91Å; T681-E684 VanDerWaalsContact OG1-N 3.14Å; T681-E684 PolarHBondContact OG1-OE2 3.25Å; T681-V685 VanDerWaalsContact O-CG2 3.3Å; T681-V685 WeakPolarHBondContact O-CG2 3.34Å; T681-V685 PolarHBondContact O-N 3.18Å; T681-V685 VanDerWaalsContact O-N 3.14Å
682	N	92.6	Very high	91.9	Very high	82 Å²	82	58.8 Å²	58.8	44%	0.439	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-36.7	174.5	-165.5	-100.4	0	0	0	112	G635 Y686	G635-N682 PolarHBondContact O-ND2 3.39Å; N682-Y686 WeakPolarHBondContact O-CB 3.33Å; N682-Y686 PolarHBondContact O-N 3.46Å
683	E	92.8	Very high	91.5	Very high	139 Å²	139	64.3 Å²	64.3	65%	0.65	35%	0.348	S	S	*	.	H	α-helix	trans	-68.7	-45.3	177.6	-70.8	118.7	-126.8	0	0	112.6	T681 Y686 N687	T681-E683 VanDerWaalsContact C-N 3.28Å; T681-E683 PolarHBondContact O-N 3.17Å; E683-Y686 WeakPolarHBondContact O-CB 3.48Å; E683-Y686 PolarHBondContact O-N 2.86Å; E683-N687 WeakPolarHBondContact O-CB 3.23Å; E683-N687 PolarHBondContact O-N 2.77Å; E683-N687 PolarHBondContact O-ND2 2.8Å
684	E	92.5	Very high	91.2	Very high	96 Å²	96	67.8 Å²	67.8	45%	0.449	38%	0.375	S	S	.	.	H	α-helix	trans	-62.9	-44.8	177.1	-71.8	160.3	133.9	0	0	111.7	A680 T681 Y686 N687 I688	A680-E684 HydrophobicContact CB-CB 4.12Å; T681-E684 VanDerWaalsContact CB-OE2 3.28Å; T681-E684 WeakPolarHBondContact CB-OE2 3.49Å; T681-E684 VanDerWaalsContact CG2-OE2 3.3Å; T681-E684 WeakPolarHBondContact CG2-OE2 3.33Å; T681-E684 PolarHBondContact N-OE2 2.82Å; T681-E684 WeakPolarHBondContact OG1-CB 3.25Å; T681-E684 VanDerWaalsContact OG1-CD 3.28Å; T681-E684 VanDerWaalsContact OG1-CG 3.29Å; T681-E684 WeakPolarHBondContact OG1-CG 3.49Å; T681-E684 PolarHBondContact OG1-N 2.91Å; T681-E684 VanDerWaalsContact OG1-N 3.14Å; T681-E684 PolarHBondContact OG1-OE2 3.25Å; E684-Y686 VanDerWaalsContact C-N 3.3Å; E684-Y686 PolarHBondContact O-N 3.2Å; E684-N687 PolarHBondContact O-N 2.88Å; E684-I688 VanDerWaalsContact O-CG1 3.31Å; E684-I688 WeakPolarHBondContact O-CG1 3.41Å; E684-I688 PolarHBondContact O-N 2.82Å
685	V	93.9	Very high	91	Very high	3 Å²	3	69 Å²	69	2%	0.018	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-38.2	174.8	173.2	0	0	0	0	111.2	V633 A646 L677 A680 T681 I689	V633-V685 HydrophobicContact CG1-CG1 4.11Å; A646-V685 HydrophobicContact CB-CG1 4.1Å; A646-V685 HydrophobicContact CB-CG2 3.98Å; L677-V685 HydrophobicContact CB-CG2 4.44Å; L677-V685 HydrophobicContact CD1-CG1 4.31Å; L677-V685 HydrophobicContact CD1-CG2 4.42Å; L677-V685 HydrophobicContact CD2-CG2 4.32Å; A680-V685 HydrophobicContact CB-CG2 3.74Å; T681-V685 VanDerWaalsContact O-CG2 3.3Å; T681-V685 WeakPolarHBondContact O-CG2 3.34Å; T681-V685 PolarHBondContact O-N 3.18Å; T681-V685 VanDerWaalsContact O-N 3.14Å; V685-I689 HydrophobicContact CG1-CD1 3.77Å; V685-I689 WeakPolarHBondContact O-CB 3.48Å; V685-I689 WeakPolarHBondContact O-CD1 3.47Å; V685-I689 VanDerWaalsContact O-CG1 3.22Å; V685-I689 WeakPolarHBondContact O-CG1 3.25Å; V685-I689 PolarHBondContact O-N 3.01Å
686	Y	92.4	Very high	90.7	Very high	142 Å²	142	67.4 Å²	67.4	56%	0.557	37%	0.365	S	S	*	.	H	α-helix	trans	-64	-43.4	174.1	-178.4	-90.5	0	0	0	112	N682 E683 E684 I689 L690	N682-Y686 WeakPolarHBondContact O-CB 3.33Å; N682-Y686 PolarHBondContact O-N 3.46Å; E683-Y686 WeakPolarHBondContact O-CB 3.48Å; E683-Y686 PolarHBondContact O-N 2.86Å; E684-Y686 VanDerWaalsContact C-N 3.3Å; E684-Y686 PolarHBondContact O-N 3.2Å; Y686-I689 PolarHBondContact O-N 2.81Å; Y686-L690 HydrophobicContact CE1-CD2 4.01Å; Y686-L690 WeakPolarHBondContact O-CB 3.24Å; Y686-L690 PolarHBondContact O-N 2.94Å
687	N	93	Very high	90.5	Very high	78 Å²	78	67.6 Å²	67.6	42%	0.417	36%	0.359	S	S	.	.	H	α-helix	trans	-66.2	-45.4	-179.7	-69.2	-20.7	0	0	0	111.8	E683 E684 I689 L690 E691	E683-N687 WeakPolarHBondContact O-CB 3.23Å; E683-N687 PolarHBondContact O-N 2.77Å; E683-N687 PolarHBondContact O-ND2 2.8Å; E684-N687 PolarHBondContact O-N 2.88Å; N687-I689 VanDerWaalsContact C-N 3.33Å; N687-I689 PolarHBondContact O-N 3.1Å; N687-L690 WeakPolarHBondContact O-CA 3.24Å; N687-L690 WeakPolarHBondContact O-CB 3.28Å; N687-L690 PolarHBondContact O-N 3.34Å; N687-E691 WeakPolarHBondContact O-CG 3.35Å; N687-E691 PolarHBondContact O-N 3.21Å
688	I	92.9	Very high	90.5	Very high	24 Å²	24	67.7 Å²	67.7	12%	0.123	36%	0.359	C	S	.	.	H	α-helix	trans	-59.1	-43.7	176.2	-69	167	0	0	0	111.3	W672 K675 L677 E684 L690 S692	W672-I688 HydrophobicContact CB-CG2 4.07Å; W672-I688 HydrophobicContact CG-CG2 4Å; K675-I688 HydrophobicContact CB-CD1 4.16Å; K675-I688 HydrophobicContact CB-CG2 4.23Å; K675-I688 HydrophobicContact CD-CD1 4.25Å; K675-I688 HydrophobicContact CD-CG1 3.86Å; K675-I688 HydrophobicContact CD-CG2 4.06Å; L677-I688 HydrophobicContact CD2-CB 4.47Å; L677-I688 HydrophobicContact CD2-CD1 3.55Å; L677-I688 HydrophobicContact CD2-CG2 4.15Å; E684-I688 VanDerWaalsContact O-CG1 3.31Å; E684-I688 WeakPolarHBondContact O-CG1 3.41Å; E684-I688 PolarHBondContact O-N 2.82Å; I688-L690 VanDerWaalsContact C-N 3.31Å; I688-L690 PolarHBondContact O-N 3.18Å; I688-S692 PolarHBondContact O-N 2.95Å; I688-S692 VanDerWaalsContact O-N 3.16Å
689	I	92.1	Very high	90.7	Very high	41 Å²	41	68.5 Å²	68.5	21%	0.21	36%	0.358	C	S	.	.	H	α-helix	trans	-71.4	-26.4	176.5	-65.3	169	0	0	0	111.9	V633 W672 V685 Y686 N687 S692 K693	V633-I689 HydrophobicContact CB-CD1 3.63Å; V633-I689 HydrophobicContact CG1-CD1 4.26Å; V633-I689 HydrophobicContact CG2-CD1 3.73Å; W672-I689 HydrophobicContact CD2-CG1 4.02Å; W672-I689 HydrophobicContact CE3-CG1 4.26Å; W672-I689 HydrophobicContact CH2-CG1 4.16Å; W672-I689 HydrophobicContact CH2-CG2 4.39Å; W672-I689 HydrophobicContact CZ2-CB 4.31Å; W672-I689 HydrophobicContact CZ2-CG1 3.88Å; W672-I689 HydrophobicContact CZ2-CG2 4.06Å; W672-I689 HydrophobicContact CZ3-CG1 4.33Å; V685-I689 HydrophobicContact CG1-CD1 3.77Å; V685-I689 WeakPolarHBondContact O-CB 3.48Å; V685-I689 WeakPolarHBondContact O-CD1 3.47Å; V685-I689 VanDerWaalsContact O-CG1 3.22Å; V685-I689 WeakPolarHBondContact O-CG1 3.25Å; V685-I689 PolarHBondContact O-N 3.01Å; Y686-I689 PolarHBondContact O-N 2.81Å; N687-I689 VanDerWaalsContact C-N 3.33Å; N687-I689 PolarHBondContact O-N 3.1Å; I689-S692 PolarHBondContact O-OG 2.96Å; I689-K693 WeakPolarHBondContact O-CG 3.44Å
690	L	91.4	Very high	91	Very high	76 Å²	76	66.2 Å²	66.2	40%	0.398	33%	0.334	S	S	.	.	H	α-helix	trans	-74	-46.8	176.3	175.9	63.7	0	0	0	111.6	Y686 N687 I688 K693	Y686-L690 HydrophobicContact CE1-CD2 4.01Å; Y686-L690 WeakPolarHBondContact O-CB 3.24Å; Y686-L690 PolarHBondContact O-N 2.94Å; N687-L690 WeakPolarHBondContact O-CA 3.24Å; N687-L690 WeakPolarHBondContact O-CB 3.28Å; N687-L690 PolarHBondContact O-N 3.34Å; I688-L690 VanDerWaalsContact C-N 3.31Å; I688-L690 PolarHBondContact O-N 3.18Å; L690-K693 HydrophobicContact CD1-CD 4.04Å; L690-K693 WeakPolarHBondContact O-CB 3.33Å; L690-K693 WeakPolarHBondContact O-CG 3.36Å; L690-K693 PolarHBondContact O-N 3.07Å
691	E	90.2	Very high	91.3	Very high	105 Å²	105	66.2 Å²	66.2	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-57.2	-49.4	175.1	-72.2	167.3	-174.7	0	0	111	K675 N687 K693 S694	K675-E691 IonicContact NZ-OE2 3.2Å; K675-E691 PolarHBondContact NZ-OE2 2.95Å; N687-E691 WeakPolarHBondContact O-CG 3.35Å; N687-E691 PolarHBondContact O-N 3.21Å; E691-K693 PolarHBondContact O-N 3.09Å; E691-S694 PolarHBondContact O-OG 2.95Å
692	S	89.7	Confident	91.4	Very high	4 Å²	4	63.9 Å²	63.9	3%	0.028	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	1.3	-177.2	81.7	0	0	0	0	114.5	K617 W672 N673 I688 I689 E695	K617-S692 PolarHBondContact NZ-O 2.94Å; W672-S692 VanDerWaalsContact NE1-CB 3.29Å; W672-S692 PolarHBondContact NE1-OG 3.4Å; N673-S692 WeakPolarHBondContact ND2-CB 3.37Å; I688-S692 PolarHBondContact O-N 2.95Å; I688-S692 VanDerWaalsContact O-N 3.16Å; I689-S692 PolarHBondContact O-OG 2.96Å; S692-E695 WeakPolarHBondContact CA-OE1 3.49Å
693	K	86.7	Confident	91.4	Very high	121 Å²	121	60.3 Å²	60.3	53%	0.526	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-36.9	180	-72.7	-179.5	-170.5	160.2	0	112.5	K617 I689 L690 E691	K617-K693 PolarHBondContact NZ-O 2.95Å; I689-K693 WeakPolarHBondContact O-CG 3.44Å; L690-K693 HydrophobicContact CD1-CD 4.04Å; L690-K693 WeakPolarHBondContact O-CB 3.33Å; L690-K693 WeakPolarHBondContact O-CG 3.36Å; L690-K693 PolarHBondContact O-N 3.07Å; E691-K693 PolarHBondContact O-N 3.09Å
694	S	85.7	Confident	91.4	Very high	112 Å²	112	55 Å²	55	78%	0.783	27%	0.274	S	S	*	.	S	Bend	trans	-72.5	-27.2	-179	46.1	0	0	0	0	113.7	E691	E691-S694 PolarHBondContact O-OG 2.95Å
695	E	86.5	Confident	91	Very high	79 Å²	79	53.4 Å²	53.4	37%	0.369	27%	0.272	S	S	.	.	S	Bend	trans	-63.7	141.1	179.6	-63.5	178.2	-116.7	0	0	111.8	K617 N673 S692 Q697	K617-E695 WeakPolarHBondContact CD-O 3.33Å; K617-E695 WeakPolarHBondContact CE-O 3.46Å; K617-E695 PolarHBondContact NZ-O 2.9Å; N673-E695 PolarHBondContact ND2-OE1 3.33Å; N673-E695 PolarHBondContact ND2-OE2 2.63Å; S692-E695 WeakPolarHBondContact CA-OE1 3.49Å; E695-Q697 WeakPolarHBondContact CB-O 3.43Å; E695-Q697 PolarHBondContact O-N 2.79Å
696	P	86.5	Confident	90.2	Very high	56 Å²	56	56 Å²	56	36%	0.364	29%	0.285	S	S	.	.	S	Bend	trans	-71.6	-18	-179.9	30.7	-35.9	0	0	0	113.1	N616 K617 R618	N616-P696 PolarHBondContact OD1-O 2.67Å; K617-P696 WeakPolarHBondContact CB-O 3.45Å; K617-P696 PolarHBondContact N-O 3.1Å; R618-P696 HydrophobicContact CG-CB 4.37Å
697	Q	89.2	Confident	88.9	Confident	97 Å²	97	52.5 Å²	52.5	45%	0.453	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153.6	-170.9	-172.9	171	6	0	0	107.7	I614 L615 E695	I614-Q697 HydrophobicContact CG2-CG 3.91Å; L615-Q697 CarbonylContact O-C 3.5Å; L615-Q697 WeakPolarHBondContact O-CA 3.33Å; E695-Q697 WeakPolarHBondContact CB-O 3.43Å; E695-Q697 PolarHBondContact O-N 2.79Å
698	V	92.8	Very high	87	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	125.9	173.1	178.7	0	0	0	0	108.1	L615 L629 W672 N673 I700	L615-V698 PolarHBondContact N-O 2.84Å; L615-V698 PolarHBondContact O-N 2.87Å; L629-V698 HydrophobicContact CD1-CB 4.25Å; L629-V698 HydrophobicContact CD1-CG2 4.07Å; W672-V698 HydrophobicContact CD2-CG1 4.15Å; W672-V698 HydrophobicContact CH2-CG1 4.31Å; W672-V698 HydrophobicContact CZ2-CG1 3.73Å; N673-V698 VanDerWaalsContact OD1-CA 3.26Å; N673-V698 WeakPolarHBondContact OD1-CA 3.39Å; N673-V698 WeakPolarHBondContact OD1-CG1 3.22Å; V698-I700 HydrophobicContact CG1-CD1 4.19Å; V698-I700 HydrophobicContact CG1-CG1 3.74Å
699	E	94.5	Very high	85.1	Confident	75 Å²	75	57.6 Å²	57.6	35%	0.35	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.4	169.5	-176.7	169.3	-167.1	0	0	109.2	V613 I614 N673	V613-E699 CarbonylContact O-C 3.1Å; V613-E699 WeakPolarHBondContact O-CA 3.44Å; I614-E699 HydrophobicContact CG1-CB 4.46Å; I614-E699 HydrophobicContact CG1-CG 4.14Å; N673-E699 PolarHBondContact N-O 2.93Å; N673-E699 PolarHBondContact OD1-N 2.81Å; N673-E699 PolarHBondContact OD1-O 3.33Å
700	I	95.1	Very high	82.9	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.1	-176.9	-48.1	175.8	0	0	0	107.1	V613 L615 L631 L663 V669 E671 W672 V698 V702	V613-I700 PolarHBondContact N-O 3.39Å; V613-I700 PolarHBondContact O-N 3.14Å; L615-I700 HydrophobicContact CD1-CD1 4Å; L631-I700 HydrophobicContact CD2-CD1 3.71Å; L663-I700 HydrophobicContact CD1-CD1 4.22Å; V669-I700 HydrophobicContact CG1-CG2 3.68Å; E671-I700 WeakPolarHBondContact O-CA 3.41Å; W672-I700 HydrophobicContact CD2-CG1 4.43Å; W672-I700 HydrophobicContact CE3-CD1 3.98Å; W672-I700 HydrophobicContact CE3-CG1 3.92Å; W672-I700 HydrophobicContact CE3-CG2 4.1Å; W672-I700 HydrophobicContact CH2-CD1 4.03Å; W672-I700 HydrophobicContact CZ3-CD1 3.55Å; W672-I700 HydrophobicContact CZ3-CG1 4.04Å; W672-I700 HydrophobicContact CZ3-CG2 4.5Å; V698-I700 HydrophobicContact CG1-CD1 4.19Å; V698-I700 HydrophobicContact CG1-CG1 3.74Å; I700-V702 HydrophobicContact CG2-CG1 3.86Å
701	I	95	Very high	80.4	Confident	11 Å²	11	68.5 Å²	68.5	6%	0.056	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	125.6	167.9	-52	-170.3	0	0	0	107.9	I610 G611 R612 V669 L670 E671	I610-I701 HydrophobicContact CG2-CG2 3.56Å; G611-I701 CarbonylContact O-C 3.55Å; G611-I701 WeakPolarHBondContact O-CA 3.36Å; R612-I701 HydrophobicContact CG-CD1 4.1Å; R612-I701 HydrophobicContact CG-CG1 4.09Å; R612-I701 HydrophobicContact CG-CG2 4.46Å; V669-I701 CarbonylContact C-O 3.44Å; L670-I701 HydrophobicContact CB-CG2 4.32Å; L670-I701 HydrophobicContact CD1-CG2 4.44Å; L670-I701 PolarHBondContact N-O 3.08Å; E671-I701 HydrophobicContact CB-CB 3.98Å; E671-I701 HydrophobicContact CB-CD1 4.31Å; E671-I701 HydrophobicContact CB-CG1 4.07Å; E671-I701 HydrophobicContact CG-CB 4.47Å; E671-I701 HydrophobicContact CG-CD1 4.4Å; E671-I701 PolarHBondContact N-O 2.86Å; E671-I701 VanDerWaalsContact N-O 3.15Å; E671-I701 PolarHBondContact O-N 3.02Å
702	V	94.8	Very high	78	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	160.8	179.8	-67.7	0	0	0	0	111.4	W600 I610 G611 V613 I648 L663 D667 E668 V669 I700	W600-V702 HydrophobicContact CH2-CG2 3.48Å; W600-V702 VanDerWaalsContact CH2-CG2 3.48Å; W600-V702 HydrophobicContact CZ2-CG2 4.28Å; W600-V702 HydrophobicContact CZ3-CG2 4Å; I610-V702 CarbonylContact C-O 3.38Å; I610-V702 WeakPolarHBondContact CA-O 3.26Å; G611-V702 PolarHBondContact N-O 3.47Å; G611-V702 WeakPolarHBondContact O-CG2 3.48Å; G611-V702 PolarHBondContact O-N 2.61Å; V613-V702 HydrophobicContact CG2-CG2 4.46Å; I648-V702 HydrophobicContact CD1-CG1 4.17Å; L663-V702 HydrophobicContact CD2-CB 4.48Å; L663-V702 HydrophobicContact CD2-CG1 3.88Å; L663-V702 HydrophobicContact CD2-CG2 3.82Å; D667-V702 HydrophobicContact CB-CB 4.28Å; D667-V702 HydrophobicContact CB-CG1 4.38Å; E668-V702 CarbonylContact O-C 3.49Å; E668-V702 WeakPolarHBondContact O-CA 3.42Å; V669-V702 HydrophobicContact CG2-CG1 4.17Å; I700-V702 HydrophobicContact CG2-CG1 3.86Å
703	S	92.6	Very high	75.5	Confident	7 Å²	7	75.8 Å²	75.8	5%	0.049	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.2	166	73.5	0	0	0	0	112.3	L609 E668	L609-S703 VanDerWaalsContact O-CA 3.28Å; L609-S703 WeakPolarHBondContact O-CA 3.4Å; E668-S703 PolarHBondContact N-O 3.04Å; E668-S703 PolarHBondContact O-N 2.85Å
704	R	91	Very high	73.2	Confident	27 Å²	27	79 Å²	79	10%	0.102	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	151.4	173.5	58.4	175.4	64.1	141.5	-1.3	110.1	W600 R608 L609 H662 D667	W600-R704 HydrophobicContact CH2-CG 4.34Å; W600-R704 VanDerWaalsContact CZ2-CZ 3.46Å; W600-R704 HydrophobicContact CZ3-CG 3.87Å; R608-R704 CarbonylContact C-O 3.56Å; R608-R704 VanDerWaalsContact CA-O 3.28Å; R608-R704 WeakPolarHBondContact CA-O 3.48Å; L609-R704 HydrophobicContact CB-CG 4.31Å; L609-R704 PolarHBondContact N-O 2.9Å; L609-R704 PolarHBondContact O-N 2.84Å; H662-R704 PolarHBondContact O-NH2 2.9Å; D667-R704 VanDerWaalsContact CG-NH2 3.3Å; D667-R704 IonicContact OD1-CZ 3.81Å; D667-R704 VanDerWaalsContact OD1-CZ 3.31Å; D667-R704 IonicContact OD1-NE 2.75Å; D667-R704 PolarHBondContact OD1-NE 3.46Å; D667-R704 IonicContact OD1-NH2 2.87Å; D667-R704 PolarHBondContact OD1-NH2 3.21Å; D667-R704 IonicContact OD2-CZ 3.02Å; D667-R704 IonicContact OD2-NE 3.68Å; D667-R704 IonicContact OD2-NH2 2.73Å; D667-R704 PolarHBondContact OD2-NH2 2.88Å
705	P	85.8	Confident	70.7	Confident	62 Å²	62	78 Å²	78	40%	0.403	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	149.1	177.5	29.7	-35.7	0	0	0	111.4	G707 D708	P705-G707 VanDerWaalsContact C-N 3.25Å; P705-G707 PolarHBondContact O-N 2.88Å; P705-D708 WeakPolarHBondContact CG-OD2 3.03Å
706	I	75.9	Confident	68	Low	57 Å²	57	79.5 Å²	79.5	29%	0.292	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-71.1	-19.8	179.4	-81.9	165.6	0	0	0	112.8	G606 D607 R608 L609 D708 I709	G606-I706 VanDerWaalsContact O-CD1 3.31Å; G606-I706 WeakPolarHBondContact O-CD1 3.39Å; D607-I706 WeakPolarHBondContact O-CB 3.47Å; D607-I706 PolarHBondContact O-N 2.86Å; R608-I706 WeakPolarHBondContact O-CD1 3.41Å; L609-I706 HydrophobicContact CB-CG1 4.39Å; L609-I706 HydrophobicContact CD1-CG1 3.77Å; L609-I706 HydrophobicContact CG-CD1 4.16Å; L609-I706 HydrophobicContact CG-CG1 3.64Å; I706-D708 PolarHBondContact O-N 2.84Å; I706-I709 PolarHBondContact O-N 3.35Å
707	G	64.7	Low	65.5	Low	70 Å²	70	85 Å²	85	72%	0.722	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-63	-22.8	-179.5	0	0	0	0	0	115.5	P705 I709	P705-G707 VanDerWaalsContact C-N 3.25Å; P705-G707 PolarHBondContact O-N 2.88Å; G707-I709 VanDerWaalsContact C-N 3.27Å; G707-I709 PolarHBondContact O-N 2.78Å
708	D	54.9	Low	63	Low	125 Å²	125	85 Å²	85	67%	0.668	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-86.1	5.5	-176.2	-60.9	-21.6	0	0	0	113.4	P705 I706	P705-D708 WeakPolarHBondContact CG-OD2 3.03Å; I706-D708 PolarHBondContact O-N 2.84Å
709	I	52	Low	60.2	Low	83 Å²	83	91 Å²	91	43%	0.426	51%	0.511	S	S	.	.	S	Bend	trans	-107.8	124.5	173.5	-59.1	-166.3	0	0	0	108.9	L609 I706 G707 R711	L609-I709 HydrophobicContact CD1-CD1 3.35Å; L609-I709 HydrophobicContact CD1-CG1 4.31Å; I706-I709 PolarHBondContact O-N 3.35Å; G707-I709 VanDerWaalsContact C-N 3.27Å; G707-I709 PolarHBondContact O-N 2.78Å; I709-R711 PolarHBondContact O-N 3.08Å
710	P	45.6	Very low	57.5	Low	114 Å²	114	94.8 Å²	94.8	74%	0.74	53%	0.532	S	S	*	.			trans	-56	115.7	167.1	-21.1	32.2	0	0	0	108.6	I712	P710-I712 PolarHBondContact O-N 2.9Å
711	R	39.5	Very low	54.5	Low	233 Å²	233	103.7 Å²	103.7	88%	0.879	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-52.1	117.5	173.5	-80.3	-172.4	173.6	119.4	-3.3	107.8	I709 P713	I709-R711 PolarHBondContact O-N 3.08Å; R711-P713 VanDerWaalsContact O-CD 3.29Å; R711-P713 WeakPolarHBondContact O-CD 3.48Å; R711-P713 VanDerWaalsContact O-N 3.15Å
712	I	38.7	Very low	51.8	Low	148 Å²	148	108.8 Å²	108.8	76%	0.759	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-55.1	119.9	163.4	-59.8	172.9	0	0	0	105	P710 E714	P710-I712 PolarHBondContact O-N 2.9Å; I712-E714 PolarHBondContact O-N 2.85Å
713	P	38.5	Very low	48.9	Very low	113 Å²	113	114 Å²	114	73%	0.734	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-56.7	128	173.9	-22.7	34	0	0	0	107.9	R711 S715	R711-P713 VanDerWaalsContact O-CD 3.29Å; R711-P713 WeakPolarHBondContact O-CD 3.48Å; R711-P713 VanDerWaalsContact O-N 3.15Å; P713-S715 PolarHBondContact O-N 3.12Å
714	E	37.3	Very low	46.1	Very low	190 Å²	190	119.3 Å²	119.3	89%	0.888	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-55	136.5	-174.4	-67.9	-176.3	149.2	0	0	110.3	I712 S716	I712-E714 PolarHBondContact O-N 2.85Å; E714-S716 PolarHBondContact O-N 2.82Å
715	S	33.9	Very low	43.6	Very low	90 Å²	90	123.4 Å²	123.4	63%	0.629	72%	0.717	S	S	*	*	S	Bend	trans	-64.8	109	-161.9	51.2	0	0	0	0	112.3	P713 H717	P713-S715 PolarHBondContact O-N 3.12Å; S715-H717 PolarHBondContact O-CD2 2.66Å; S715-H717 PolarHBondContact O-N 2.9Å
716	S	29	Very low	41.2	Very low	110 Å²	110	125.6 Å²	125.6	77%	0.769	73%	0.733	S	S	*	*			trans	48.4	66.1	148.2	59.8	0	0	0	0	116	E714	E714-S716 PolarHBondContact O-N 2.82Å
717	H	34	Very low	39.4	Very low	172 Å²	172	131.7 Å²	131.7	80%	0.796	76%	0.758	S	S	*	*			trans	-112.4	126.7	158.6	-69.6	-69.7	0	0	0	109.7	S715	S715-H717 PolarHBondContact O-CD2 2.66Å; S715-H717 PolarHBondContact O-N 2.9Å
718	P	37.1	Very low	38.1	Very low	96 Å²	96	135.1 Å²	135.1	62%	0.623	76%	0.755	S	S	*	*			trans	-74.7	149.7	179.7	31.3	-34.7	0	0	0	111.1	L720	P718-L720 PolarHBondContact O-N 3.14Å
719	P	33.5	Very low	37.6	Very low	129 Å²	129	134.5 Å²	134.5	84%	0.838	76%	0.761	S	S	*	*			trans	-71.8	97.7	172.8	30.1	-33.1	0	0	0	109.8	E721	P719-E721 PolarHBondContact O-N 3.45Å
720	L	39.5	Very low	36.9	Very low	154 Å²	154	138 Å²	138	81%	0.806	78%	0.775	S	S	*	*			trans	-81.6	106.9	169	-69	179.5	0	0	0	109.4	P718 S722	P718-L720 PolarHBondContact O-N 3.14Å; L720-S722 PolarHBondContact O-N 3.14Å
721	E	31.4	Very low	36.6	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.874	78%	0.776	S	S	*	*			trans	-63.8	130	166.2	-61.6	-164.9	124.1	0	0	109.9	P719	P719-E721 PolarHBondContact O-N 3.45Å
722	S	37.4	Very low	36.7	Very low	117 Å²	117	138 Å²	138	82%	0.818	78%	0.775	S	S	*	*			trans	-152.3	79.1	172.4	-78	0	0	0	0	110.9	L720	L720-S722 PolarHBondContact O-N 3.14Å
723	S	33.8	Very low	36.7	Very low	110 Å²	110	139.8 Å²	139.8	77%	0.769	78%	0.78	S	S	*	*			trans	-12.9	138.8	156.6	-48	0	0	0	0	118.2
724	S	34.7	Very low	36.7	Very low	119 Å²	119	145.9 Å²	145.9	83%	0.832	79%	0.789	S	S	*	*				151.4	170.8	106.7	62.3	0	0	0	0	114.3
725	S	37.3	Very low	36.7	Very low	112 Å²	112	141.7 Å²	141.7	78%	0.783	78%	0.778	S	S	*	*			trans	67.8	89.3	175	-162.2	0	0	0	0	116.4
726	S	36.7	Very low	36.7	Very low	108 Å²	108	143 Å²	143	76%	0.755	79%	0.787	S	S	*	*				79.6	106.7	64.9	-171.1	0	0	0	0	114.9
727	F	38	Very low	37.2	Very low	185 Å²	185	145.8 Å²	145.8	81%	0.811	79%	0.791	S	S	*	*				-168.1	154.2	100.8	-174.6	-120.7	0	0	0	111.1
728	E	37	Very low	37.2	Very low	142 Å²	142	142.9 Å²	142.9	66%	0.664	79%	0.791	S	S	*	*			trans	-84.2	147.5	179.4	-65.1	170	59.1	0	0	112.9
729	S	44.4	Very low	37.4	Very low	112 Å²	112	145.1 Å²	145.1	78%	0.783	80%	0.802	S	S	*	*			trans	-164	81.6	145.1	-85.8	0	0	0	0	112.9
730	Q	38	Very low	37.5	Very low	156 Å²	156	146.2 Å²	146.2	73%	0.729	80%	0.799	S	S	*	*			trans	27.2	128.8	138.1	-61.8	-169.1	8.7	0	0	121.4
731	K	37.8	Very low	37.2	Very low	172 Å²	172	144.6 Å²	144.6	75%	0.748	80%	0.801	S	S	*	*				72.1	96.7	122.5	-172	-171	-179	-178	0	118.4
732	M	43.4	Very low	37.5	Very low	177 Å²	177	140.8 Å²	140.8	87%	0.872	79%	0.792	S	S	*	*				-165.3	147.5	95	-92.6	-160.6	-170.6	0	0	112.2
733	E	38.6	Very low	37.4	Very low	185 Å²	185	141.5 Å²	141.5	86%	0.864	79%	0.792	S	S	*	*			trans	-90	128.4	174.7	-179.4	-169.2	155.2	0	0	110.4
734	R	38	Very low	37.5	Very low	241 Å²	241	141.6 Å²	141.6	91%	0.909	79%	0.793	S	S	*	*			trans	-160.4	115.3	163.8	-152.2	171.3	-172.3	165.9	2.8	112.7
735	P	38	Very low	37.6	Very low	102 Å²	102	142.9 Å²	142.9	66%	0.662	80%	0.798	S	S	*	*			trans	-89.3	157.6	-179.9	33.5	-34.3	0	0	0	114.2
736	S	33.9	Very low	37.5	Very low	118 Å²	118	141.2 Å²	141.2	83%	0.825	80%	0.799	S	S	*	*			trans	59.1	113.5	162.8	63	0	0	0	0	120.2
737	I	38.4	Very low	37.4	Very low	167 Å²	167	140.2 Å²	140.2	86%	0.856	80%	0.797	S	S	*	*				-154.5	154.8	115.9	-160	164.1	0	0	0	109.6
738	S	35.1	Very low	37.4	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	80%	0.804	S	S	*	*			trans	-124.7	119.2	-176.4	49	0	0	0	0	112.8
739	V	39.8	Very low	37.4	Very low	142 Å²	142	142 Å²	142	86%	0.861	81%	0.81	S	S	*	*			trans	-141.6	152.6	164.7	-172.4	0	0	0	0	108.6
740	I	36.2	Very low	36.9	Very low	152 Å²	152	143.5 Å²	143.5	78%	0.779	81%	0.809	S	S	*	*			trans	-100.3	141.5	-161.7	-60.1	156.7	0	0	0	112.2
741	S	33.6	Very low	36.7	Very low	120 Å²	120	140.2 Å²	140.2	84%	0.839	81%	0.809	S	S	*	*			trans	-110.2	118.5	157.2	-69.6	0	0	0	0	109.9
742	P	37.6	Very low	36.7	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	81%	0.808	S	S	*	*			trans	-85.8	176.9	178.9	34.8	-35.4	0	0	0	112.7
743	T	35.9	Very low	37	Very low	133 Å²	133	137 Å²	137	82%	0.816	80%	0.804	S	S	*	*			trans	89.4	59.3	168.7	-32	0	0	0	0	116.8
744	S	35	Very low	37.8	Very low	112 Å²	112	133 Å²	133	78%	0.783	79%	0.792	S	S	*	*			trans	-157.7	125.4	153.8	-80	0	0	0	0	109.9	G746	S744-G746 PolarHBondContact O-N 2.9Å
745	P	37.5	Very low	38.8	Very low	145 Å²	145	127.6 Å²	127.6	94%	0.942	78%	0.78	S	S	*	*			trans	-81.9	56.2	-173.3	34.1	-36.4	0	0	0	113
746	G	34.9	Very low	40.4	Very low	77 Å²	77	124 Å²	124	79%	0.794	76%	0.757	S	S	*	*			trans	-99.9	47.7	179.4	0	0	0	0	0	113.9	S744	S744-G746 PolarHBondContact O-N 2.9Å
747	A	34.2	Very low	43.1	Very low	87 Å²	87	118.5 Å²	118.5	72%	0.719	72%	0.719	S	S	*	*			trans	-147.8	87.7	-172.3	0	0	0	0	0	114.5
748	L	38.4	Very low	45.8	Very low	183 Å²	183	113.5 Å²	113.5	96%	0.958	69%	0.692	S	S	*	*			trans	-136.1	66	150.6	-87.3	-177.8	0	0	0	109.7
749	K	37.6	Very low	48.8	Very low	182 Å²	182	108.1 Å²	108.1	79%	0.791	65%	0.654	S	S	*	*			trans	-99	160.3	153	-76.4	-170.6	171.4	-174.5	0	108.9
750	D	33.4	Very low	51.5	Low	143 Å²	143	101.6 Å²	101.6	77%	0.765	62%	0.615	S	S	*	*			trans	60.9	53.6	156.1	-47.6	-35.5	0	0	0	117.3
751	A	34.5	Very low	54.5	Low	88 Å²	88	94.3 Å²	94.3	73%	0.727	58%	0.578	S	S	*	*	S	Bend		-75.9	125.1	124.8	0	0	0	0	0	106.6	Q753	A751-Q753 PolarHBondContact O-N 2.98Å
752	P	36.9	Very low	57.5	Low	111 Å²	111	90.9 Å²	90.9	72%	0.721	55%	0.548	S	S	*	.			trans	-60.9	111.9	179.4	-23.4	33.6	0	0	0	110	V754	P752-V754 VanDerWaalsContact C-N 3.29Å; P752-V754 PolarHBondContact O-N 3.18Å
753	Q	49.6	Very low	60.4	Low	171 Å²	171	85.9 Å²	85.9	80%	0.799	52%	0.515	S	S	*	.			trans	-62.5	103.1	156.2	-70.2	-173.4	4.1	0	0	105.2	A751 L755	A751-Q753 PolarHBondContact O-N 2.98Å; Q753-L755 VanDerWaalsContact C-N 3.26Å; Q753-L755 PolarHBondContact O-N 3.34Å
754	V	54.8	Low	63.2	Low	100 Å²	100	84.1 Å²	84.1	61%	0.606	49%	0.493	S	S	*	.			trans	-67.4	94.5	179	-176.6	0	0	0	0	106.3	P752 P756 P783	P752-V754 VanDerWaalsContact C-N 3.29Å; P752-V754 PolarHBondContact O-N 3.18Å; V754-P756 WeakPolarHBondContact O-CD 3.33Å; V754-P783 HydrophobicContact CG1-CB 3.79Å
755	L	58.8	Low	66.2	Low	127 Å²	127	80.9 Å²	80.9	67%	0.665	46%	0.464	S	S	*	.			trans	-56.9	122.6	-174.4	-65	177.1	0	0	0	108.1	Q753 G757	Q753-L755 VanDerWaalsContact C-N 3.26Å; Q753-L755 PolarHBondContact O-N 3.34Å; L755-G757 PolarHBondContact O-N 2.83Å
756	P	72.9	Confident	68.9	Low	28 Å²	28	75.5 Å²	75.5	18%	0.182	43%	0.427	C	S	.	.			trans	-59.9	130.2	168	29.5	-35.9	0	0	0	107.1	V754 L880 T882	V754-P756 WeakPolarHBondContact O-CD 3.33Å; P756-L880 HydrophobicContact CB-CB 3.84Å; P756-L880 HydrophobicContact CG-CB 4.4Å; P756-L880 WeakPolarHBondContact CG-O 3.24Å; P756-T882 HydrophobicContact CG-CG2 4.25Å
757	G	90.2	Very high	71.7	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.01	42%	0.423	C	S	.	.			trans	-65.6	-164.8	-164.2	0	0	0	0	0	115.8	L755 T780 D781 L880	L755-G757 PolarHBondContact O-N 2.83Å; G757-T780 CarbonylContact C-O 3.48Å; G757-T780 WeakPolarHBondContact CA-O 3.24Å; G757-D781 VanDerWaalsContact CA-O 3.31Å; G757-D781 WeakPolarHBondContact CA-O 3.28Å; G757-L880 WeakPolarHBondContact O-CB 3.14Å; G757-L880 WeakPolarHBondContact O-CD1 3.5Å; G757-L880 WeakPolarHBondContact O-CG 3.39Å; G757-L880 PolarHBondContact O-N 2.63Å
758	Q	95.3	Very high	74.6	Confident	62 Å²	62	81 Å²	81	29%	0.29	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	143	-173.9	-56.9	-175	85	0	0	110.7	A779 T780 D781 W877 K879	Q758-A779 CarbonylContact O-C 3.48Å; Q758-A779 WeakPolarHBondContact O-CA 3.35Å; Q758-A779 VanDerWaalsContact O-CB 3.31Å; Q758-A779 WeakPolarHBondContact O-CB 3.46Å; Q758-T780 PolarHBondContact N-O 2.92Å; Q758-T780 PolarHBondContact O-N 3.05Å; Q758-D781 PolarHBondContact NE2-OD2 2.92Å; Q758-D781 VanDerWaalsContact NE2-OD2 3.17Å; Q758-W877 HydrophobicContact CB-CE3 3.79Å; Q758-W877 HydrophobicContact CB-CZ3 4.18Å; Q758-K879 HydrophobicContact CG-CG 4.28Å
759	L	97.2	Very high	77.2	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122.5	178.6	-174.8	72.8	0	0	0	109.8	V761 V776 A779 V795 W822 I843 V845 I862 Y878	L759-V761 HydrophobicContact CD2-CG2 3.71Å; L759-V761 HydrophobicContact CG-CG2 3.79Å; L759-V776 HydrophobicContact CD1-CG1 4.37Å; L759-A779 HydrophobicContact CD1-CB 3.89Å; L759-V795 HydrophobicContact CD1-CG2 4.12Å; L759-V795 HydrophobicContact CD2-CG1 4.44Å; L759-W822 HydrophobicContact CD1-CE3 4.4Å; L759-W822 HydrophobicContact CD1-CH2 4.29Å; L759-W822 HydrophobicContact CD1-CZ3 3.57Å; L759-I843 HydrophobicContact CD2-CG2 3.51Å; L759-V845 HydrophobicContact CD1-CG2 4.49Å; L759-V845 HydrophobicContact CD2-CG2 4.23Å; L759-I862 HydrophobicContact CB-CD1 3.67Å; L759-I862 HydrophobicContact CD2-CD1 3.78Å; L759-I862 HydrophobicContact CG-CD1 4.34Å; L759-Y878 PolarHBondContact N-O 3.15Å; L759-Y878 PolarHBondContact O-N 2.89Å
760	S	97.7	Very high	80	Confident	4 Å²	4	69 Å²	69	3%	0.028	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	119.6	173	-175.9	0	0	0	0	110.3	L777 Q778 H876	S760-L777 PolarHBondContact O-N 3.34Å; S760-L777 VanDerWaalsContact O-N 3.08Å; S760-Q778 PolarHBondContact N-O 2.98Å; S760-H876 WeakPolarHBondContact CA-O 3.42Å
761	V	97.9	Very high	82.9	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.7	179.7	-171.1	0	0	0	0	109.2	L759 L763 V774 N775 I843 H876 Y878	L759-V761 HydrophobicContact CD2-CG2 3.71Å; L759-V761 HydrophobicContact CG-CG2 3.79Å; V761-L763 HydrophobicContact CG1-CD2 3.68Å; V761-L763 HydrophobicContact CG1-CG 4.13Å; V761-V774 HydrophobicContact CG1-CG1 3.99Å; V761-N775 WeakPolarHBondContact CA-O 3.46Å; V761-I843 HydrophobicContact CG1-CD1 4.22Å; V761-I843 HydrophobicContact CG2-CD1 4.12Å; V761-H876 PolarHBondContact N-O 3.16Å; V761-H876 PolarHBondContact O-N 2.9Å; V761-Y878 HydrophobicContact CB-CD2 4.06Å; V761-Y878 HydrophobicContact CB-CE2 3.99Å; V761-Y878 HydrophobicContact CG2-CD2 4.2Å
762	K	97.5	Very high	85.9	Confident	48 Å²	48	60.8 Å²	60.8	21%	0.209	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.8	174.6	162.9	167.9	155.9	114.7	0	108.6	N775 L777 D873 E874 P875	K762-N775 HydrophobicContact CB-CB 3.91Å; K762-N775 HydrophobicContact CG-CB 4.24Å; K762-N775 PolarHBondContact N-O 2.76Å; K762-N775 WeakPolarHBondContact O-CB 3.07Å; K762-N775 PolarHBondContact O-N 2.86Å; K762-L777 HydrophobicContact CB-CD1 3.98Å; K762-D873 WeakPolarHBondContact CD-O 3.44Å; K762-D873 WeakPolarHBondContact CE-O 3.34Å; K762-D873 WeakPolarHBondContact CE-OD1 3.12Å; K762-D873 VanDerWaalsContact CE-OD2 3.25Å; K762-D873 WeakPolarHBondContact CE-OD2 3.44Å; K762-D873 WeakPolarHBondContact CG-O 3.44Å; K762-D873 WeakPolarHBondContact CG-OD1 3.46Å; K762-D873 PolarHBondContact NZ-O 3.37Å; K762-D873 IonicContact NZ-OD1 3.15Å; K762-D873 PolarHBondContact NZ-OD1 3.3Å; K762-D873 IonicContact NZ-OD2 2.81Å; K762-D873 PolarHBondContact NZ-OD2 2.98Å; K762-E874 WeakPolarHBondContact CA-O 3.33Å; K762-P875 HydrophobicContact CB-CB 4.35Å
763	L	97.7	Very high	88.8	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.3	-173.4	-59	176.8	0	0	0	110.6	V761 V774 L841 I864 L870 L871 D873	V761-L763 HydrophobicContact CG1-CD2 3.68Å; V761-L763 HydrophobicContact CG1-CG 4.13Å; L763-V774 HydrophobicContact CD2-CB 4.14Å; L763-V774 HydrophobicContact CD2-CG1 3.81Å; L763-V774 HydrophobicContact CD2-CG2 3.89Å; L763-L841 HydrophobicContact CD2-CD2 3.82Å; L763-I864 HydrophobicContact CD1-CD1 3.99Å; L763-I864 HydrophobicContact CD1-CG2 4.32Å; L763-L870 WeakPolarHBondContact CB-O 3.21Å; L763-L871 HydrophobicContact CB-CD2 3.78Å; L763-L871 HydrophobicContact CD1-CD2 4.38Å; L763-L871 CarbonylContact O-C 3.27Å; L763-L871 WeakPolarHBondContact O-CA 3.36Å; L763-D873 WeakPolarHBondContact O-CA 3.43Å; L763-D873 PolarHBondContact O-N 2.8Å
764	W	95.9	Very high	91.1	Very high	96 Å²	96	47.6 Å²	47.6	36%	0.364	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	152.4	171.1	64.5	-79.5	0	0	0	112.6	D766 I773 D873	W764-D766 HydrophobicContact CE3-CB 4.37Å; W764-D766 HydrophobicContact CZ3-CB 3.89Å; W764-I773 HydrophobicContact CD2-CB 3.97Å; W764-I773 HydrophobicContact CD2-CD1 3.8Å; W764-I773 HydrophobicContact CD2-CG1 4.14Å; W764-I773 HydrophobicContact CE3-CD1 3.79Å; W764-I773 HydrophobicContact CG-CB 4.1Å; W764-I773 HydrophobicContact CH2-CD1 3.83Å; W764-I773 HydrophobicContact CH2-CG1 4.12Å; W764-I773 HydrophobicContact CZ2-CB 4Å; W764-I773 HydrophobicContact CZ2-CD1 3.84Å; W764-I773 HydrophobicContact CZ2-CG1 3.66Å; W764-I773 HydrophobicContact CZ2-CG2 4.08Å; W764-I773 HydrophobicContact CZ3-CD1 3.81Å; W764-I773 PolarHBondContact N-O 3.49Å; W764-I773 VanDerWaalsContact N-O 3.12Å; W764-I773 VanDerWaalsContact NE1-CG2 3.27Å; W764-I773 PolarHBondContact O-N 3.45Å; W764-D873 HydrophobicContact CB-CB 3.79Å; W764-D873 HydrophobicContact CG-CB 4.28Å
765	Y	96.9	Very high	93.1	Very high	43 Å²	43	43.8 Å²	43.8	17%	0.169	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	110.3	-179.2	172.8	-112.5	0	0	0	111.7	K767 Q771 V831 R833 F836	Y765-K767 HydrophobicContact CD1-CB 4.26Å; Y765-K767 HydrophobicContact CE1-CB 3.8Å; Y765-K767 PolarHBondContact O-N 2.99Å; Y765-K767 VanDerWaalsContact O-N 3.08Å; Y765-Q771 VanDerWaalsContact CD2-O 3.23Å; Y765-Q771 WeakPolarHBondContact CD2-O 3.49Å; Y765-V831 HydrophobicContact CE2-CG1 4.33Å; Y765-V831 WeakPolarHBondContact CE2-O 3.21Å; Y765-V831 PolarHBondContact OH-O 2.85Å; Y765-R833 HydrophobicContact CE1-CB 4Å; Y765-R833 PolarHBondContact OH-N 2.92Å; Y765-F836 HydrophobicContact CD1-CZ 4.02Å; Y765-F836 HydrophobicContact CD2-CE1 4.23Å; Y765-F836 AromaticContact CD2-CZ 3.64Å; Y765-F836 HydrophobicContact CD2-CZ 3.64Å; Y765-F836 HydrophobicContact CE1-CZ 4.24Å; Y765-F836 HydrophobicContact CE2-CE1 4.1Å; Y765-F836 AromaticContact CE2-CZ 3.88Å; Y765-F836 HydrophobicContact CE2-CZ 3.88Å; Y765-F836 HydrophobicContact CG-CE2 4.46Å; Y765-F836 AromaticContact CG-CZ 3.71Å; Y765-F836 HydrophobicContact CG-CZ 3.71Å
766	D	95.5	Very high	95	Very high	32 Å²	32	37.7 Å²	37.7	17%	0.171	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	98.4	168.6	171.7	16.4	0	0	0	109.8	W764 V768 G769 H770 Q771 I773	W764-D766 HydrophobicContact CE3-CB 4.37Å; W764-D766 HydrophobicContact CZ3-CB 3.89Å; D766-V768 PolarHBondContact O-N 2.81Å; D766-V768 WeakPolarHBondContact OD1-CA 3.47Å; D766-V768 WeakPolarHBondContact OD1-CB 3.16Å; D766-V768 PolarHBondContact OD1-N 3.04Å; D766-G769 PolarHBondContact OD1-N 2.94Å; D766-G769 WeakPolarHBondContact OD2-CA 3.36Å; D766-G769 PolarHBondContact OD2-N 2.87Å; D766-H770 WeakPolarHBondContact O-CA 3.45Å; D766-H770 PolarHBondContact O-N 3.3Å; D766-Q771 HydrophobicContact CB-CB 4.12Å; D766-Q771 PolarHBondContact N-O 2.95Å; D766-Q771 PolarHBondContact O-N 2.83Å; D766-Q771 VanDerWaalsContact O-N 3.11Å; D766-Q771 PolarHBondContact OD2-NE2 3.29Å; D766-I773 HydrophobicContact CB-CD1 3.91Å
767	K	93	Very high	96.2	Very high	161 Å²	161	38.1 Å²	38.1	70%	0.7	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.3	175.6	69.1	-173.5	178.8	-173.2	0	114.1	Y765 H770	Y765-K767 HydrophobicContact CD1-CB 4.26Å; Y765-K767 HydrophobicContact CE1-CB 3.8Å; Y765-K767 PolarHBondContact O-N 2.99Å; Y765-K767 VanDerWaalsContact O-N 3.08Å; K767-H770 PolarHBondContact O-CE1 2.86Å; K767-H770 VanDerWaalsContact O-CE1 3.31Å; K767-H770 PolarHBondContact O-ND1 2.95Å; K767-H770 VanDerWaalsContact O-ND1 3.11Å
768	V	94.1	Very high	96.5	Very high	120 Å²	120	40.2 Å²	40.2	73%	0.727	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-48.8	-174	-175.3	0	0	0	0	111.2	D766 H770	D766-V768 PolarHBondContact O-N 2.81Å; D766-V768 WeakPolarHBondContact OD1-CA 3.47Å; D766-V768 WeakPolarHBondContact OD1-CB 3.16Å; D766-V768 PolarHBondContact OD1-N 3.04Å; V768-H770 VanDerWaalsContact C-N 3.31Å
769	G	93.6	Very high	96.6	Very high	39 Å²	39	37.3 Å²	37.3	40%	0.402	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.9	174.8	0	0	0	0	0	114.5	D766 Q771	D766-G769 PolarHBondContact OD1-N 2.94Å; D766-G769 WeakPolarHBondContact OD2-CA 3.36Å; D766-G769 PolarHBondContact OD2-N 2.87Å; G769-Q771 WeakPolarHBondContact O-CG 3.42Å
770	H	95.9	Very high	96.5	Very high	74 Å²	74	38.4 Å²	38.4	34%	0.343	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	57.4	-173	-59.9	-22.5	0	0	0	111.3	D766 K767 V768 H830 V831 H832	D766-H770 WeakPolarHBondContact O-CA 3.45Å; D766-H770 PolarHBondContact O-N 3.3Å; K767-H770 PolarHBondContact O-CE1 2.86Å; K767-H770 VanDerWaalsContact O-CE1 3.31Å; K767-H770 PolarHBondContact O-ND1 2.95Å; K767-H770 VanDerWaalsContact O-ND1 3.11Å; V768-H770 VanDerWaalsContact C-N 3.31Å; H770-H830 PolarHBondContact O-N 2.75Å; H770-V831 CarbonylContact C-O 3.6Å; H770-V831 VanDerWaalsContact C-O 3.27Å; H770-V831 WeakPolarHBondContact CA-O 3.4Å; H770-V831 WeakPolarHBondContact CB-O 2.98Å; H770-V831 PolarHBondContact O-N 2.81Å; H770-H832 AromaticContact CD2-CD2 3.58Å; H770-H832 AromaticContact CD2-NE2 3.65Å; H770-H832 AromaticContact CG-CD2 3.97Å
771	Q	96.2	Very high	96.2	Very high	58 Å²	58	42.9 Å²	42.9	27%	0.271	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.6	-175.3	-42.4	-177.1	91	0	0	110.6	Y765 D766 G769 I773 V827 Y828	Y765-Q771 VanDerWaalsContact CD2-O 3.23Å; Y765-Q771 WeakPolarHBondContact CD2-O 3.49Å; D766-Q771 HydrophobicContact CB-CB 4.12Å; D766-Q771 PolarHBondContact N-O 2.95Å; D766-Q771 PolarHBondContact O-N 2.83Å; D766-Q771 VanDerWaalsContact O-N 3.11Å; D766-Q771 PolarHBondContact OD2-NE2 3.29Å; G769-Q771 WeakPolarHBondContact O-CG 3.42Å; Q771-I773 HydrophobicContact CB-CD1 3.83Å; Q771-I773 WeakPolarHBondContact O-CD1 3.12Å; Q771-V827 HydrophobicContact CB-CG1 4.01Å; Q771-V827 HydrophobicContact CG-CG1 4.45Å; Q771-Y828 VanDerWaalsContact CA-O 3.28Å; Q771-Y828 WeakPolarHBondContact CA-O 3.28Å
772	L	96.8	Very high	96	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	130	160.2	178.2	70.4	0	0	0	108.2	V774 F799 Y828 V831 L866 L871	L772-V774 HydrophobicContact CD2-CG2 4.22Å; L772-V774 HydrophobicContact CG-CG2 4.16Å; L772-F799 HydrophobicContact CD2-CD2 4.18Å; L772-F799 HydrophobicContact CD2-CE2 3.63Å; L772-Y828 HydrophobicContact CD2-CD2 4.4Å; L772-Y828 PolarHBondContact N-O 2.95Å; L772-Y828 PolarHBondContact O-N 3.38Å; L772-V831 HydrophobicContact CB-CB 4.37Å; L772-V831 HydrophobicContact CB-CG1 4.04Å; L772-V831 HydrophobicContact CB-CG2 4.31Å; L772-L866 HydrophobicContact CD2-CD1 4.28Å; L772-L866 HydrophobicContact CD2-CD2 3.67Å; L772-L871 HydrophobicContact CD1-CD2 3.73Å
773	I	97.2	Very high	95.6	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134.9	177.5	-56.1	81.7	0	0	0	108.6	W764 D766 Q771 T825 F826 V827	W764-I773 HydrophobicContact CD2-CB 3.97Å; W764-I773 HydrophobicContact CD2-CD1 3.8Å; W764-I773 HydrophobicContact CD2-CG1 4.14Å; W764-I773 HydrophobicContact CE3-CD1 3.79Å; W764-I773 HydrophobicContact CG-CB 4.1Å; W764-I773 HydrophobicContact CH2-CD1 3.83Å; W764-I773 HydrophobicContact CH2-CG1 4.12Å; W764-I773 HydrophobicContact CZ2-CB 4Å; W764-I773 HydrophobicContact CZ2-CD1 3.84Å; W764-I773 HydrophobicContact CZ2-CG1 3.66Å; W764-I773 HydrophobicContact CZ2-CG2 4.08Å; W764-I773 HydrophobicContact CZ3-CD1 3.81Å; W764-I773 PolarHBondContact N-O 3.49Å; W764-I773 VanDerWaalsContact N-O 3.12Å; W764-I773 VanDerWaalsContact NE1-CG2 3.27Å; W764-I773 PolarHBondContact O-N 3.45Å; D766-I773 HydrophobicContact CB-CD1 3.91Å; Q771-I773 HydrophobicContact CB-CD1 3.83Å; Q771-I773 WeakPolarHBondContact O-CD1 3.12Å; I773-T825 HydrophobicContact CG2-CG2 3.56Å; I773-F826 WeakPolarHBondContact CA-O 3.25Å; I773-V827 HydrophobicContact CG1-CG1 4.33Å; I773-V827 HydrophobicContact CG1-CG2 4.1Å; I773-V827 HydrophobicContact CG2-CG2 4.34Å
774	V	97.9	Very high	95.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	110.9	-172.4	-177.6	0	0	0	0	108.9	V761 L763 L772 V776 M797 T825 F826 Y828 L841	V761-V774 HydrophobicContact CG1-CG1 3.99Å; L763-V774 HydrophobicContact CD2-CB 4.14Å; L763-V774 HydrophobicContact CD2-CG1 3.81Å; L763-V774 HydrophobicContact CD2-CG2 3.89Å; L772-V774 HydrophobicContact CD2-CG2 4.22Å; L772-V774 HydrophobicContact CG-CG2 4.16Å; V774-V776 HydrophobicContact CG1-CG2 4.29Å; V774-M797 HydrophobicContact CB-CE 4.27Å; V774-M797 HydrophobicContact CG1-CE 3.78Å; V774-M797 HydrophobicContact CG1-SD 3.74Å; V774-T825 CarbonylContact O-C 3.58Å; V774-F826 PolarHBondContact N-O 2.75Å; V774-F826 PolarHBondContact O-N 3.43Å; V774-Y828 HydrophobicContact CG2-CD2 4.18Å; V774-Y828 HydrophobicContact CG2-CE2 3.98Å; V774-L841 HydrophobicContact CB-CD2 4.43Å; V774-L841 HydrophobicContact CG1-CD2 3.87Å; V774-L841 HydrophobicContact CG2-CD1 4.38Å; V774-L841 HydrophobicContact CG2-CD2 3.63Å
775	N	97.6	Very high	94.9	Very high	19 Å²	19	42 Å²	42	10%	0.102	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	106.5	174.4	-71.2	-32.5	0	0	0	109.2	V761 K762 L777 T825	V761-N775 WeakPolarHBondContact CA-O 3.46Å; K762-N775 HydrophobicContact CB-CB 3.91Å; K762-N775 HydrophobicContact CG-CB 4.24Å; K762-N775 PolarHBondContact N-O 2.76Å; K762-N775 WeakPolarHBondContact O-CB 3.07Å; K762-N775 PolarHBondContact O-N 2.86Å; N775-L777 HydrophobicContact CB-CD2 4.07Å; N775-L777 PolarHBondContact O-N 2.79Å; N775-T825 WeakPolarHBondContact OD1-CA 3.45Å; N775-T825 VanDerWaalsContact OD1-CB 3.22Å; N775-T825 WeakPolarHBondContact OD1-CB 3.42Å; N775-T825 VanDerWaalsContact OD1-CG2 3.28Å; N775-T825 WeakPolarHBondContact OD1-CG2 3.4Å; N775-T825 PolarHBondContact OD1-OG1 3.48Å
776	V	98.1	Very high	94.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	107	172.1	-177.1	0	0	0	0	107.8	L759 V774 V795 M797 T811 W822 N823 Q824 F826	L759-V776 HydrophobicContact CD1-CG1 4.37Å; V774-V776 HydrophobicContact CG1-CG2 4.29Å; V776-V795 HydrophobicContact CG1-CB 4.11Å; V776-V795 HydrophobicContact CG1-CG1 4.27Å; V776-V795 HydrophobicContact CG1-CG2 3.75Å; V776-M797 HydrophobicContact CG2-CE 3.87Å; V776-M797 HydrophobicContact CG2-SD 3.57Å; V776-M797 VanDerWaalsContact CG2-SD 3.57Å; V776-T811 HydrophobicContact CB-CG2 4Å; V776-T811 HydrophobicContact CG1-CG2 3.91Å; V776-T811 HydrophobicContact CG2-CG2 4.4Å; V776-W822 HydrophobicContact CG1-CD2 4.44Å; V776-W822 HydrophobicContact CG1-CE3 3.89Å; V776-W822 HydrophobicContact CG1-CZ3 4.44Å; V776-N823 WeakPolarHBondContact O-CA 3.29Å; V776-N823 PolarHBondContact O-N 2.92Å; V776-Q824 PolarHBondContact N-O 2.77Å; V776-Q824 PolarHBondContact O-N 3.27Å; V776-F826 HydrophobicContact CB-CE2 4.42Å; V776-F826 HydrophobicContact CG2-CD2 4.2Å; V776-F826 HydrophobicContact CG2-CE2 3.99Å
777	L	97.4	Very high	93.7	Very high	36 Å²	36	49.4 Å²	49.4	19%	0.188	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-74.6	-169.4	-59.6	178.7	0	0	0	111.2	S760 K762 N775 W822 N823 P875	S760-L777 PolarHBondContact O-N 3.34Å; S760-L777 VanDerWaalsContact O-N 3.08Å; K762-L777 HydrophobicContact CB-CD1 3.98Å; N775-L777 HydrophobicContact CB-CD2 4.07Å; N775-L777 PolarHBondContact O-N 2.79Å; L777-W822 PolarHBondContact O-N 2.63Å; L777-N823 PolarHBondContact O-N 3.19Å; L777-N823 PolarHBondContact O-OD1 3.1Å; L777-P875 HydrophobicContact CD1-CB 3.55Å
778	Q	97.3	Very high	93.2	Very high	46 Å²	46	44.7 Å²	44.7	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	162	-175	61.5	-177.7	7.1	0	0	111.6	S760 P820 K821 W877	S760-Q778 PolarHBondContact N-O 2.98Å; Q778-P820 CarbonylContact C-O 3.5Å; Q778-P820 WeakPolarHBondContact CA-O 3.49Å; Q778-P820 WeakPolarHBondContact CB-O 3.42Å; Q778-K821 HydrophobicContact CB-CB 4.28Å; Q778-K821 HydrophobicContact CB-CG 3.92Å; Q778-W877 HydrophobicContact CG-CH2 3.84Å; Q778-W877 HydrophobicContact CG-CZ2 4.43Å
779	A	97	Very high	92.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	157.1	164	0	0	0	0	0	111.1	Q758 L759 L782 E819 P820 W822	Q758-A779 CarbonylContact O-C 3.48Å; Q758-A779 WeakPolarHBondContact O-CA 3.35Å; Q758-A779 VanDerWaalsContact O-CB 3.31Å; Q758-A779 WeakPolarHBondContact O-CB 3.46Å; L759-A779 HydrophobicContact CD1-CB 3.89Å; A779-L782 HydrophobicContact CB-CD1 4.02Å; A779-L782 HydrophobicContact CB-CD2 4.06Å; A779-L782 HydrophobicContact CB-CG 4.04Å; A779-E819 CarbonylContact O-C 3.58Å; A779-E819 VanDerWaalsContact O-CA 3.23Å; A779-E819 WeakPolarHBondContact O-CA 3.46Å; A779-P820 HydrophobicContact CB-CG 3.89Å; A779-P820 PolarHBondContact N-O 2.96Å; A779-W822 HydrophobicContact CB-CH2 4.05Å; A779-W822 HydrophobicContact CB-CZ3 3.88Å
780	T	95.2	Very high	92.2	Very high	24 Å²	24	45.8 Å²	45.8	15%	0.147	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	169.2	172.2	54.6	0	0	0	0	109.7	G757 Q758 L782 E819 W877	G757-T780 CarbonylContact C-O 3.48Å; G757-T780 WeakPolarHBondContact CA-O 3.24Å; Q758-T780 PolarHBondContact N-O 2.92Å; Q758-T780 PolarHBondContact O-N 3.05Å; T780-L782 PolarHBondContact O-N 3.38Å; T780-E819 HydrophobicContact CG2-CG 4.46Å; T780-W877 HydrophobicContact CG2-CH2 3.7Å; T780-W877 HydrophobicContact CG2-CZ3 4.15Å
781	D	92.4	Very high	92	Very high	97 Å²	97	42.6 Å²	42.6	52%	0.519	24%	0.239	S	C	.	.	S	Bend	trans	56.4	22.4	174.4	-47.7	-48.8	0	0	0	114.7	G757 Q758	G757-D781 VanDerWaalsContact CA-O 3.31Å; G757-D781 WeakPolarHBondContact CA-O 3.28Å; Q758-D781 PolarHBondContact NE2-OD2 2.92Å; Q758-D781 VanDerWaalsContact NE2-OD2 3.17Å
782	L	92.9	Very high	92	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-67.1	133.3	-178.9	-64.7	-175.9	0	0	0	110.7	A779 T780 P793 L818 P820 V845 L859 L880	A779-L782 HydrophobicContact CB-CD1 4.02Å; A779-L782 HydrophobicContact CB-CD2 4.06Å; A779-L782 HydrophobicContact CB-CG 4.04Å; T780-L782 PolarHBondContact O-N 3.38Å; L782-P793 HydrophobicContact CD1-CB 3.77Å; L782-P793 HydrophobicContact CD1-CG 4.02Å; L782-L818 WeakPolarHBondContact CB-O 3.23Å; L782-L818 WeakPolarHBondContact CD1-O 3.41Å; L782-L818 VanDerWaalsContact CG-O 3.29Å; L782-L818 WeakPolarHBondContact CG-O 3.45Å; L782-P820 HydrophobicContact CD1-CG 3.84Å; L782-V845 HydrophobicContact CD2-CG1 4.4Å; L782-L859 HydrophobicContact CD1-CD1 4.34Å; L782-L880 HydrophobicContact CD2-CD1 3.65Å
783	P	89	Confident	91.9	Very high	22 Å²	22	40.5 Å²	40.5	14%	0.143	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-61.1	133.6	-177.1	23.2	-33.6	0	0	0	111	V754 R791 L859	V754-P783 HydrophobicContact CG1-CB 3.79Å; P783-R791 WeakPolarHBondContact O-CG 3.36Å; P783-R791 PolarHBondContact O-NE 3.5Å; P783-L859 HydrophobicContact CG-CD2 4.36Å
784	P	89	Confident	92	Very high	69 Å²	69	41 Å²	41	45%	0.448	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-64.6	170.4	172.6	28.6	-34.9	0	0	0	111.4	R791 L818	P784-R791 PolarHBondContact O-NE 2.85Å; P784-R791 PolarHBondContact O-NH2 2.81Å; P784-L818 HydrophobicContact CB-CD1 4.29Å; P784-L818 HydrophobicContact CB-CD2 4.49Å
785	R	89.4	Confident	92	Very high	33 Å²	33	41 Å²	41	13%	0.125	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-72.2	154.5	169.6	-68	180	176.6	-154.6	2	110.2	D787 G788 R789 D847 Q848	R785-D787 WeakPolarHBondContact CB-OD1 3.28Å; R785-D787 PolarHBondContact O-N 3.18Å; R785-D787 VanDerWaalsContact O-N 3.15Å; R785-G788 WeakPolarHBondContact O-CA 3.37Å; R785-G788 PolarHBondContact O-N 3.08Å; R785-R789 VanDerWaalsContact CB-O 3.32Å; R785-R789 WeakPolarHBondContact CB-O 3.44Å; R785-R789 WeakPolarHBondContact CG-O 3.31Å; R785-R789 PolarHBondContact N-O 2.82Å; R785-D847 IonicContact CZ-OD1 3.65Å; R785-D847 IonicContact CZ-OD2 2.61Å; R785-D847 IonicContact NE-OD1 2.67Å; R785-D847 IonicContact NE-OD2 2.95Å; R785-D847 PolarHBondContact NE-OD2 2.73Å; R785-D847 IonicContact NH2-OD1 3.33Å; R785-D847 PolarHBondContact NH2-OD1 2.74Å; R785-D847 IonicContact NH2-OD2 3.83Å; R785-D847 PolarHBondContact NH2-OD2 2.8Å; R785-Q848 PolarHBondContact NH2-O 2.76Å; R785-Q848 VanDerWaalsContact NH2-O 3.1Å
786	V	84.3	Confident	91.9	Very high	157 Å²	157	42.4 Å²	42.4	95%	0.952	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.5	174.7	-62.9	0	0	0	0	113.8	G788	V786-G788 VanDerWaalsContact C-N 3.33Å
787	D	83.5	Confident	91.9	Very high	74 Å²	74	42.5 Å²	42.5	40%	0.396	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	11.6	172.8	70	-4.6	0	0	0	113.3	R785 R789	R785-D787 WeakPolarHBondContact CB-OD1 3.28Å; R785-D787 PolarHBondContact O-N 3.18Å; R785-D787 VanDerWaalsContact O-N 3.15Å; D787-R789 HydrophobicContact CB-CG 4.49Å; D787-R789 VanDerWaalsContact CG-CG 3.5Å; D787-R789 PolarHBondContact O-N 3.22Å; D787-R789 VanDerWaalsContact O-N 3.15Å; D787-R789 WeakPolarHBondContact OD1-CB 3.22Å; D787-R789 WeakPolarHBondContact OD1-CG 3.29Å; D787-R789 PolarHBondContact OD1-N 3.17Å; D787-R789 WeakPolarHBondContact OD2-CD 3.3Å; D787-R789 WeakPolarHBondContact OD2-CG 3.47Å; D787-R789 IonicContact OD2-CZ 2.86Å; D787-R789 VanDerWaalsContact OD2-CZ 3.24Å; D787-R789 IonicContact OD2-NE 3.72Å; D787-R789 PolarHBondContact OD2-NE 3.49Å; D787-R789 IonicContact OD2-NH1 3.39Å; D787-R789 PolarHBondContact OD2-NH1 3.31Å
788	G	82	Confident	91.9	Very high	62 Å²	62	42.2 Å²	42.2	64%	0.639	23%	0.234	S	C	*	.	S	Bend	trans	70.2	-0.7	-177.1	0	0	0	0	0	114.7	R785 V786	R785-G788 WeakPolarHBondContact O-CA 3.37Å; R785-G788 PolarHBondContact O-N 3.08Å; V786-G788 VanDerWaalsContact C-N 3.33Å
789	R	84.7	Confident	91.9	Very high	135 Å²	135	40.8 Å²	40.8	51%	0.509	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-78.9	146	-176.1	-60.1	-177.2	-172.7	137.2	-9.3	111.2	R785 D787	R785-R789 VanDerWaalsContact CB-O 3.32Å; R785-R789 WeakPolarHBondContact CB-O 3.44Å; R785-R789 WeakPolarHBondContact CG-O 3.31Å; R785-R789 PolarHBondContact N-O 2.82Å; D787-R789 HydrophobicContact CB-CG 4.49Å; D787-R789 VanDerWaalsContact CG-CG 3.5Å; D787-R789 PolarHBondContact O-N 3.22Å; D787-R789 VanDerWaalsContact O-N 3.15Å; D787-R789 WeakPolarHBondContact OD1-CB 3.22Å; D787-R789 WeakPolarHBondContact OD1-CG 3.29Å; D787-R789 PolarHBondContact OD1-N 3.17Å; D787-R789 WeakPolarHBondContact OD2-CD 3.3Å; D787-R789 WeakPolarHBondContact OD2-CG 3.47Å; D787-R789 IonicContact OD2-CZ 2.86Å; D787-R789 VanDerWaalsContact OD2-CZ 3.24Å; D787-R789 IonicContact OD2-NE 3.72Å; D787-R789 PolarHBondContact OD2-NE 3.49Å; D787-R789 IonicContact OD2-NH1 3.39Å; D787-R789 PolarHBondContact OD2-NH1 3.31Å
790	P	82.9	Confident	91.8	Very high	47 Å²	47	41.9 Å²	41.9	31%	0.305	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-70.2	142	179.2	29.3	-36.6	0	0	0	111.7	K816 R850	P790-K816 HydrophobicContact CB-CB 4.22Å; P790-K816 HydrophobicContact CG-CB 3.79Å; P790-K816 HydrophobicContact CG-CG 4.2Å; P790-R850 PolarHBondContact O-NH2 3.03Å
791	R	91.7	Very high	91.8	Very high	6 Å²	6	45.6 Å²	45.6	2%	0.023	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-62.9	158.6	178.1	-60.8	-68.2	-177.6	177.5	3.7	112.4	P783 P784 P793 K816 L817 L818 D847 E857 L859	P783-R791 WeakPolarHBondContact O-CG 3.36Å; P783-R791 PolarHBondContact O-NE 3.5Å; P784-R791 PolarHBondContact O-NE 2.85Å; P784-R791 PolarHBondContact O-NH2 2.81Å; R791-P793 VanDerWaalsContact C-CD 3.42Å; R791-P793 WeakPolarHBondContact O-CD 3.34Å; R791-K816 CarbonylContact O-C 3.56Å; R791-K816 WeakPolarHBondContact O-CA 3.41Å; R791-K816 PolarHBondContact O-N 2.69Å; R791-L817 PolarHBondContact O-N 2.84Å; R791-L818 HydrophobicContact CB-CD2 3.99Å; R791-L818 HydrophobicContact CG-CD2 3.55Å; R791-D847 VanDerWaalsContact CD-CG 3.45Å; R791-D847 WeakPolarHBondContact CD-OD2 3.19Å; R791-D847 IonicContact CZ-OD2 3.57Å; R791-D847 IonicContact NE-OD2 3.24Å; R791-D847 IonicContact NH1-OD2 3.12Å; R791-D847 PolarHBondContact NH1-OD2 2.88Å; R791-E857 IonicContact CZ-OE1 3.37Å; R791-E857 VanDerWaalsContact CZ-OE1 3.3Å; R791-E857 IonicContact CZ-OE2 3.72Å; R791-E857 IonicContact NH1-OE1 3.3Å; R791-E857 PolarHBondContact NH1-OE1 3.29Å; R791-E857 IonicContact NH1-OE2 2.84Å; R791-E857 PolarHBondContact NH1-OE2 3.23Å; R791-E857 IonicContact NH2-OE1 3.72Å; R791-E857 PolarHBondContact NH2-OE1 2.99Å; R791-E857 IonicContact NH2-OE2 3.93Å; R791-L859 HydrophobicContact CG-CD1 4.48Å
792	N	94.8	Very high	91.8	Very high	14 Å²	14	44 Å²	44	8%	0.075	25%	0.249	C	C	.	.			trans	-116.2	72.1	164	-50	-58.9	0	0	0	110.2	T813 V814 K815 K816 D847 Q848	N792-T813 HydrophobicContact CB-CG2 3.96Å; N792-T813 VanDerWaalsContact O-CG2 3.28Å; N792-T813 WeakPolarHBondContact O-CG2 3.27Å; N792-V814 CarbonylContact C-O 3.53Å; N792-V814 WeakPolarHBondContact CA-O 3.42Å; N792-V814 WeakPolarHBondContact CB-O 3.19Å; N792-K815 WeakPolarHBondContact OD1-CA 3.46Å; N792-K816 PolarHBondContact OD1-N 3.4Å; N792-D847 PolarHBondContact N-OD1 3.02Å; N792-Q848 HydrophobicContact CB-CB 4.36Å; N792-Q848 WeakPolarHBondContact CB-O 2.92Å; N792-Q848 PolarHBondContact ND2-O 3.42Å; N792-Q848 PolarHBondContact O-N 2.83Å
793	P	96.6	Very high	91.8	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	147.4	-168.5	31.1	-38.4	0	0	0	113.9	L782 R791 V814 L817 P820 W822 W846 L859	L782-P793 HydrophobicContact CD1-CB 3.77Å; L782-P793 HydrophobicContact CD1-CG 4.02Å; R791-P793 VanDerWaalsContact C-CD 3.42Å; R791-P793 WeakPolarHBondContact O-CD 3.34Å; P793-V814 WeakPolarHBondContact CD-O 3.31Å; P793-V814 PolarHBondContact O-N 2.87Å; P793-L817 VanDerWaalsContact CD-O 3.23Å; P793-L817 WeakPolarHBondContact CD-O 3.3Å; P793-L817 WeakPolarHBondContact CG-O 3.44Å; P793-P820 HydrophobicContact CB-CG 4.07Å; P793-P820 HydrophobicContact CG-CB 3.57Å; P793-P820 HydrophobicContact CG-CG 3.46Å; P793-P820 VanDerWaalsContact CG-CG 3.46Å; P793-W822 HydrophobicContact CB-CZ2 4.11Å; P793-W822 HydrophobicContact CG-CZ2 4.41Å; P793-W846 CarbonylContact C-O 3.59Å; P793-W846 VanDerWaalsContact CA-O 3.27Å; P793-W846 WeakPolarHBondContact CA-O 3.16Å; P793-L859 HydrophobicContact CB-CD1 4.43Å
794	Y	97.4	Very high	91.9	Very high	16 Å²	16	51.7 Å²	51.7	6%	0.063	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	156.6	165.9	67.3	-90.6	0	0	0	111	K796 R810 T813 W846 Q848 S856	Y794-K796 HydrophobicContact CE2-CB 4.31Å; Y794-R810 HydrophobicContact CD2-CG 3.85Å; Y794-R810 HydrophobicContact CE2-CG 4.33Å; Y794-R810 VanDerWaalsContact CE2-NE 3.33Å; Y794-R810 VanDerWaalsContact CG-NH2 3.3Å; Y794-T813 HydrophobicContact CD1-CG2 4.35Å; Y794-W846 HydrophobicContact CD1-CB 4.09Å; Y794-W846 WeakPolarHBondContact CD1-O 3.28Å; Y794-W846 HydrophobicContact CD2-CB 4.14Å; Y794-W846 HydrophobicContact CE1-CB 3.57Å; Y794-W846 HydrophobicContact CE2-CB 3.61Å; Y794-W846 AromaticContact CE2-CD1 3.92Å; Y794-W846 AromaticContact CE2-CG 3.85Å; Y794-W846 HydrophobicContact CE2-CG 3.85Å; Y794-W846 HydrophobicContact CG-CB 4.37Å; Y794-W846 AromaticContact CZ-CG 3.83Å; Y794-W846 PolarHBondContact N-O 3.26Å; Y794-W846 PolarHBondContact O-N 3.07Å; Y794-Q848 HydrophobicContact CD1-CB 3.96Å; Y794-Q848 HydrophobicContact CE1-CB 3.85Å; Y794-Q848 HydrophobicContact CE1-CG 4.5Å; Y794-S856 VanDerWaalsContact OH-CB 3.28Å; Y794-S856 WeakPolarHBondContact OH-CB 3.29Å; Y794-S856 PolarHBondContact OH-OG 2.75Å
795	V	97.9	Very high	92.1	Very high	1 Å²	1	53 Å²	53	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	143.8	175.4	-171	0	0	0	0	109.6	L759 V776 M797 R810 T811 W822 I843 T844 V845	L759-V795 HydrophobicContact CD1-CG2 4.12Å; L759-V795 HydrophobicContact CD2-CG1 4.44Å; V776-V795 HydrophobicContact CG1-CB 4.11Å; V776-V795 HydrophobicContact CG1-CG1 4.27Å; V776-V795 HydrophobicContact CG1-CG2 3.75Å; V795-M797 HydrophobicContact CG1-CG 4.06Å; V795-R810 CarbonylContact O-C 3.51Å; V795-R810 VanDerWaalsContact O-CA 3.24Å; V795-R810 WeakPolarHBondContact O-CA 3.31Å; V795-R810 VanDerWaalsContact O-CG 3.29Å; V795-R810 WeakPolarHBondContact O-CG 3.41Å; V795-T811 HydrophobicContact CB-CG2 4Å; V795-T811 HydrophobicContact CG2-CG2 4.45Å; V795-T811 PolarHBondContact N-OG1 3.45Å; V795-T811 PolarHBondContact O-N 2.97Å; V795-W822 HydrophobicContact CG2-CD2 4.15Å; V795-W822 HydrophobicContact CG2-CE3 3.91Å; V795-W822 HydrophobicContact CG2-CH2 3.38Å; V795-W822 HydrophobicContact CG2-CZ2 3.66Å; V795-W822 HydrophobicContact CG2-CZ3 3.53Å; V795-I843 HydrophobicContact CG1-CG2 3.46Å; V795-I843 VanDerWaalsContact CG1-CG2 3.46Å; V795-T844 CarbonylContact C-O 3.56Å; V795-T844 WeakPolarHBondContact CA-O 3.2Å; V795-V845 HydrophobicContact CG2-CG2 4.25Å
796	K	97.2	Very high	92.2	Very high	48 Å²	48	58.7 Å²	58.7	21%	0.209	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.6	178.5	170.5	-163.6	168.4	-147	0	107.8	Y794 R809 T844	Y794-K796 HydrophobicContact CE2-CB 4.31Å; K796-R809 WeakPolarHBondContact CA-O 3.35Å; K796-T844 PolarHBondContact N-O 2.82Å; K796-T844 PolarHBondContact O-N 2.99Å; K796-T844 PolarHBondContact O-OG1 2.65Å
797	M	97.5	Very high	92.7	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	151.4	-173.4	-50.3	-172.6	-63.3	0	0	112.1	V774 V776 V795 K808 R809 F826 L841 E842 I843	V774-M797 HydrophobicContact CB-CE 4.27Å; V774-M797 HydrophobicContact CG1-CE 3.78Å; V774-M797 HydrophobicContact CG1-SD 3.74Å; V776-M797 HydrophobicContact CG2-CE 3.87Å; V776-M797 HydrophobicContact CG2-SD 3.57Å; V776-M797 VanDerWaalsContact CG2-SD 3.57Å; V795-M797 HydrophobicContact CG1-CG 4.06Å; M797-K808 CarbonylContact O-C 3.42Å; M797-K808 WeakPolarHBondContact O-CA 3.12Å; M797-R809 HydrophobicContact CB-CB 4.38Å; M797-R809 HydrophobicContact CE-CB 3.87Å; M797-R809 HydrophobicContact CE-CG 4.41Å; M797-R809 PolarHBondContact N-O 3.26Å; M797-R809 PolarHBondContact O-N 3.1Å; M797-F826 HydrophobicContact CE-CB 4.11Å; M797-F826 HydrophobicContact CE-CD2 3.31Å; M797-F826 HydrophobicContact CE-CE2 3.81Å; M797-F826 HydrophobicContact CE-CG 3.85Å; M797-L841 HydrophobicContact CB-CD1 4.45Å; M797-E842 CarbonylContact C-O 3.41Å; M797-E842 WeakPolarHBondContact CA-O 3.47Å; M797-E842 WeakPolarHBondContact CB-O 3.46Å; M797-I843 HydrophobicContact CG-CB 4.37Å; M797-I843 HydrophobicContact CG-CG1 4.14Å; M797-I843 HydrophobicContact CG-CG2 4.08Å; M797-I843 HydrophobicContact SD-CD1 4.19Å; M797-I843 HydrophobicContact SD-CG1 4.02Å; M797-I843 HydrophobicContact SD-CG2 4.31Å
798	Y	97.7	Very high	93.3	Very high	30 Å²	30	51.7 Å²	51.7	12%	0.118	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144	168.3	-68.3	-78.3	0	0	0	111.5	R803 S807 K808 E842	Y798-R803 HydrophobicContact CG-CG 4.43Å; Y798-S807 WeakPolarHBondContact CA-O 3.38Å; Y798-K808 HydrophobicContact CD1-CB 3.89Å; Y798-K808 HydrophobicContact CD1-CG 4.25Å; Y798-K808 HydrophobicContact CE1-CB 3.63Å; Y798-K808 HydrophobicContact CE1-CD 3.81Å; Y798-K808 HydrophobicContact CE1-CG 3.66Å; Y798-E842 WeakPolarHBondContact CD2-OE1 3.39Å; Y798-E842 PolarHBondContact N-O 3.4Å; Y798-E842 PolarHBondContact O-N 2.87Å
799	F	96.5	Very high	94.1	Very high	15 Å²	15	51.9 Å²	51.9	7%	0.066	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	92.9	173.9	-169.3	-106.8	0	0	0	110.4	L772 D802 S807 Y828 V831 L866	L772-F799 HydrophobicContact CD2-CD2 4.18Å; L772-F799 HydrophobicContact CD2-CE2 3.63Å; F799-D802 PolarHBondContact O-N 2.9Å; F799-D802 VanDerWaalsContact O-O 3.1Å; F799-S807 PolarHBondContact N-O 3.19Å; F799-Y828 HydrophobicContact CB-CD1 3.95Å; F799-Y828 HydrophobicContact CB-CD2 4.44Å; F799-Y828 HydrophobicContact CB-CE1 3.81Å; F799-Y828 HydrophobicContact CB-CE2 4.28Å; F799-Y828 HydrophobicContact CB-CG 4.27Å; F799-Y828 AromaticContact CD2-CD2 3.9Å; F799-Y828 HydrophobicContact CD2-CD2 3.9Å; F799-Y828 HydrophobicContact CD2-CE2 4.21Å; F799-Y828 HydrophobicContact CD2-CG 4.11Å; F799-Y828 HydrophobicContact CG-CD1 4.27Å; F799-Y828 HydrophobicContact CG-CD2 4.35Å; F799-Y828 HydrophobicContact CG-CG 4.16Å; F799-V831 HydrophobicContact CE1-CG2 3.6Å; F799-V831 HydrophobicContact CE2-CG1 4.43Å; F799-V831 HydrophobicContact CE2-CG2 4.09Å; F799-V831 HydrophobicContact CZ-CB 4.14Å; F799-V831 HydrophobicContact CZ-CG1 3.73Å; F799-V831 HydrophobicContact CZ-CG2 3.31Å; F799-L866 HydrophobicContact CE2-CD1 3.51Å; F799-L866 HydrophobicContact CZ-CD1 3.76Å
800	L	96.2	Very high	94.7	Very high	24 Å²	24	50.8 Å²	50.8	13%	0.126	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	152.3	-171.5	-64.4	-172.2	0	0	0	112.6	D802 R803 R839 M840 E842 L863	L800-D802 VanDerWaalsContact C-N 3.34Å; L800-R803 HydrophobicContact CD2-CG 3.52Å; L800-R839 WeakPolarHBondContact O-CA 3.48Å; L800-M840 HydrophobicContact CB-CB 4.19Å; L800-M840 HydrophobicContact CD1-CB 4.32Å; L800-M840 HydrophobicContact CD1-SD 4.49Å; L800-M840 PolarHBondContact N-O 2.87Å; L800-E842 HydrophobicContact CD1-CB 4Å; L800-E842 WeakPolarHBondContact CD2-OE2 3.45Å; L800-E842 HydrophobicContact CG-CB 4.08Å; L800-L863 HydrophobicContact CD1-CD2 4.25Å
801	P	95	Very high	95.4	Very high	102 Å²	102	48.9 Å²	48.9	66%	0.662	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	cis	-79	-1.9	4.8	32.6	-37.3	0	0	0	115.1	R803	P801-R803 PolarHBondContact O-N 3.4Å
802	D	91.2	Very high	95.6	Very high	62 Å²	62	56.5 Å²	56.5	33%	0.332	26%	0.261	S	S	.	.			trans	-72	116.3	179.2	-175.2	15.4	0	0	0	111	F799 L800 S804 S807	F799-D802 PolarHBondContact O-N 2.9Å; F799-D802 VanDerWaalsContact O-O 3.1Å; L800-D802 VanDerWaalsContact C-N 3.34Å; D802-S804 WeakPolarHBondContact OD1-CA 3.49Å; D802-S804 WeakPolarHBondContact OD1-CB 3.38Å; D802-S804 PolarHBondContact OD1-N 2.63Å; D802-S804 PolarHBondContact OD1-OG 2.91Å; D802-S804 PolarHBondContact OD2-OG 2.93Å; D802-S807 VanDerWaalsContact C-OG 3.26Å; D802-S807 VanDerWaalsContact O-CB 3.25Å; D802-S807 WeakPolarHBondContact O-CB 3.38Å; D802-S807 PolarHBondContact O-OG 2.84Å; D802-S807 WeakPolarHBondContact OD2-CB 3.46Å
803	R	92.5	Very high	95.7	Very high	153 Å²	153	57.9 Å²	57.9	58%	0.577	27%	0.27	S	S	*	.			trans	-106.7	24.2	169.4	-75	-176	162.9	179.5	-2.2	112.5	Y798 L800 P801 E842	Y798-R803 HydrophobicContact CG-CG 4.43Å; L800-R803 HydrophobicContact CD2-CG 3.52Å; P801-R803 PolarHBondContact O-N 3.4Å; R803-E842 IonicContact CZ-OE2 3.33Å; R803-E842 IonicContact NE-OE2 3.1Å; R803-E842 PolarHBondContact NE-OE2 2.95Å; R803-E842 VanDerWaalsContact NH2-CD 3.31Å; R803-E842 IonicContact NH2-OE1 3.21Å; R803-E842 IonicContact NH2-OE2 3.94Å; R803-E842 PolarHBondContact NH2-OE2 3.44Å
804	S	92.7	Very high	95.6	Very high	36 Å²	36	59.2 Å²	59.2	25%	0.252	28%	0.279	S	S	.	.	S	Bend	trans	-73.4	172.1	170.3	80.6	0	0	0	0	112.3	D802 K806 S807 K808	D802-S804 WeakPolarHBondContact OD1-CA 3.49Å; D802-S804 WeakPolarHBondContact OD1-CB 3.38Å; D802-S804 PolarHBondContact OD1-N 2.63Å; D802-S804 PolarHBondContact OD1-OG 2.91Å; D802-S804 PolarHBondContact OD2-OG 2.93Å; S804-K806 PolarHBondContact O-N 3.28Å; S804-K806 WeakPolarHBondContact OG-CB 3.15Å; S804-K806 PolarHBondContact OG-N 3.02Å; S804-K806 VanDerWaalsContact OG-N 3.11Å; S804-S807 PolarHBondContact O-OG 3.02Å; S804-S807 VanDerWaalsContact O-OG 3.05Å; S804-K808 PolarHBondContact O-N 3.12Å
805	D	92.3	Very high	95.4	Very high	96 Å²	96	66.5 Å²	66.5	51%	0.513	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-4.8	174	-57.5	-83	0	0	0	112.9	K808 R1160	D805-K808 WeakPolarHBondContact OD1-CD 3.49Å; D805-K808 IonicContact OD1-NZ 3.31Å; D805-K808 PolarHBondContact OD1-NZ 2.91Å; D805-R1160 IonicContact OD2-NH2 2.61Å; D805-R1160 PolarHBondContact OD2-NH2 3.44Å
806	K	92	Very high	95.1	Very high	153 Å²	153	72.9 Å²	72.9	67%	0.665	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-40.6	173.4	-173.3	-169.4	175.5	-170.9	0	112.1	S804 K808 R809	S804-K806 PolarHBondContact O-N 3.28Å; S804-K806 WeakPolarHBondContact OG-CB 3.15Å; S804-K806 PolarHBondContact OG-N 3.02Å; S804-K806 VanDerWaalsContact OG-N 3.11Å; K806-K808 VanDerWaalsContact C-N 3.32Å; K806-R809 PolarHBondContact O-NH1 2.92Å
807	S	94.2	Very high	94.9	Very high	5 Å²	5	74.8 Å²	74.8	4%	0.035	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.7	177.3	61.1	0	0	0	0	113.5	Y798 F799 D802 S804 Y828	Y798-S807 WeakPolarHBondContact CA-O 3.38Å; F799-S807 PolarHBondContact N-O 3.19Å; D802-S807 VanDerWaalsContact C-OG 3.26Å; D802-S807 VanDerWaalsContact O-CB 3.25Å; D802-S807 WeakPolarHBondContact O-CB 3.38Å; D802-S807 PolarHBondContact O-OG 2.84Å; D802-S807 WeakPolarHBondContact OD2-CB 3.46Å; S804-S807 PolarHBondContact O-OG 3.02Å; S804-S807 VanDerWaalsContact O-OG 3.05Å; S807-Y828 VanDerWaalsContact O-CE1 3.23Å; S807-Y828 WeakPolarHBondContact O-CE1 3.36Å; S807-Y828 PolarHBondContact O-OH 3.18Å
808	K	96.9	Very high	94.6	Very high	79 Å²	79	77.5 Å²	77.5	34%	0.343	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	138.3	-178.3	-172.1	172.4	171.6	178.4	0	112.4	M797 Y798 S804 D805 K806	M797-K808 CarbonylContact O-C 3.42Å; M797-K808 WeakPolarHBondContact O-CA 3.12Å; Y798-K808 HydrophobicContact CD1-CB 3.89Å; Y798-K808 HydrophobicContact CD1-CG 4.25Å; Y798-K808 HydrophobicContact CE1-CB 3.63Å; Y798-K808 HydrophobicContact CE1-CD 3.81Å; Y798-K808 HydrophobicContact CE1-CG 3.66Å; S804-K808 PolarHBondContact O-N 3.12Å; D805-K808 WeakPolarHBondContact OD1-CD 3.49Å; D805-K808 IonicContact OD1-NZ 3.31Å; D805-K808 PolarHBondContact OD1-NZ 2.91Å; K806-K808 VanDerWaalsContact C-N 3.32Å
809	R	97.4	Very high	94.5	Very high	65 Å²	65	81.4 Å²	81.4	25%	0.245	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	158.3	167.8	-59	-67	-178.9	-91.2	-2.4	110	K796 M797 K806 F826 V827 Y828	K796-R809 WeakPolarHBondContact CA-O 3.35Å; M797-R809 HydrophobicContact CB-CB 4.38Å; M797-R809 HydrophobicContact CE-CB 3.87Å; M797-R809 HydrophobicContact CE-CG 4.41Å; M797-R809 PolarHBondContact N-O 3.26Å; M797-R809 PolarHBondContact O-N 3.1Å; K806-R809 PolarHBondContact O-NH1 2.92Å; R809-F826 HydrophobicContact CB-CB 4.46Å; R809-F826 HydrophobicContact CB-CD1 3.79Å; R809-F826 HydrophobicContact CB-CE1 4.04Å; R809-F826 HydrophobicContact CB-CG 4.04Å; R809-F826 HydrophobicContact CG-CB 4.01Å; R809-F826 HydrophobicContact CG-CD1 3.95Å; R809-F826 HydrophobicContact CG-CG 4.09Å; R809-V827 PolarHBondContact NH2-O 3.01Å; R809-Y828 HydrophobicContact CG-CE1 3.71Å; R809-Y828 VanDerWaalsContact CG-OH 3.24Å; R809-Y828 WeakPolarHBondContact CG-OH 3.35Å
810	R	97.3	Very high	94.4	Very high	112 Å²	112	80.7 Å²	80.7	42%	0.423	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	138	176.8	-167.1	-167.4	169.1	176.8	-3.7	110.2	Y794 V795 T813 F826	Y794-R810 HydrophobicContact CD2-CG 3.85Å; Y794-R810 HydrophobicContact CE2-CG 4.33Å; Y794-R810 VanDerWaalsContact CE2-NE 3.33Å; Y794-R810 VanDerWaalsContact CG-NH2 3.3Å; V795-R810 CarbonylContact O-C 3.51Å; V795-R810 VanDerWaalsContact O-CA 3.24Å; V795-R810 WeakPolarHBondContact O-CA 3.31Å; V795-R810 VanDerWaalsContact O-CG 3.29Å; V795-R810 WeakPolarHBondContact O-CG 3.41Å; R810-T813 PolarHBondContact NH2-OG1 2.83Å; R810-T813 VanDerWaalsContact NH2-OG1 3.08Å; R810-F826 WeakPolarHBondContact O-CE1 3.44Å; R810-F826 WeakPolarHBondContact O-CZ 3.4Å
811	T	98	Very high	94.5	Very high	7 Å²	7	85.8 Å²	85.8	4%	0.043	40%	0.402	C	S	.	.			trans	-79.8	166.8	171.3	63	0	0	0	0	112.3	V776 V795 W822 Q824 F826	V776-T811 HydrophobicContact CB-CG2 4Å; V776-T811 HydrophobicContact CG1-CG2 3.91Å; V776-T811 HydrophobicContact CG2-CG2 4.4Å; V795-T811 HydrophobicContact CB-CG2 4Å; V795-T811 HydrophobicContact CG2-CG2 4.45Å; V795-T811 PolarHBondContact N-OG1 3.45Å; V795-T811 PolarHBondContact O-N 2.97Å; T811-W822 VanDerWaalsContact CB-CD1 3.46Å; T811-W822 HydrophobicContact CG2-CB 4.11Å; T811-W822 HydrophobicContact CG2-CD2 4.42Å; T811-W822 HydrophobicContact CG2-CG 3.97Å; T811-W822 VanDerWaalsContact OG1-CD1 3.28Å; T811-W822 PolarHBondContact OG1-NE1 2.95Å; T811-W822 VanDerWaalsContact OG1-NE1 3.12Å; T811-Q824 VanDerWaalsContact CA-OE1 3.29Å; T811-Q824 HydrophobicContact CG2-CB 4.31Å; T811-F826 HydrophobicContact CG2-CE2 3.75Å; T811-F826 HydrophobicContact CG2-CZ 3.81Å
812	K	96.6	Very high	94.6	Very high	166 Å²	166	82.2 Å²	82.2	72%	0.722	38%	0.375	S	S	*	.			trans	-61	139.9	166.5	-63.6	175.4	-176.7	171.4	0	110.3	V814 W822	K812-V814 PolarHBondContact O-N 3.02Å; K812-W822 PolarHBondContact O-NE1 3.28Å
813	T	96	Very high	94.9	Very high	44 Å²	44	84.6 Å²	84.6	27%	0.27	39%	0.388	S	S	.	.			trans	-70.9	115	171	-51.1	0	0	0	0	110.1	N792 Y794 R810 Q848	N792-T813 HydrophobicContact CB-CG2 3.96Å; N792-T813 VanDerWaalsContact O-CG2 3.28Å; N792-T813 WeakPolarHBondContact O-CG2 3.27Å; Y794-T813 HydrophobicContact CD1-CG2 4.35Å; R810-T813 PolarHBondContact NH2-OG1 2.83Å; R810-T813 VanDerWaalsContact NH2-OG1 3.08Å; T813-Q848 HydrophobicContact CG2-CB 3.65Å; T813-Q848 PolarHBondContact OG1-OE1 3.2Å
814	V	95.7	Very high	95.1	Very high	28 Å²	28	79.7 Å²	79.7	17%	0.17	37%	0.371	C	S	.	.			trans	-80.5	140.6	171	176	0	0	0	0	107.6	N792 P793 K812 L817 P820	N792-V814 CarbonylContact C-O 3.53Å; N792-V814 WeakPolarHBondContact CA-O 3.42Å; N792-V814 WeakPolarHBondContact CB-O 3.19Å; P793-V814 WeakPolarHBondContact CD-O 3.31Å; P793-V814 PolarHBondContact O-N 2.87Å; K812-V814 PolarHBondContact O-N 3.02Å; V814-L817 HydrophobicContact CG1-CB 4.09Å; V814-L817 HydrophobicContact CG1-CD1 3.71Å; V814-L817 HydrophobicContact CG1-CG 4.34Å; V814-P820 HydrophobicContact CB-CB 3.88Å; V814-P820 HydrophobicContact CG1-CB 3.99Å; V814-P820 HydrophobicContact CG2-CB 4Å
815	K	93.4	Very high	95.3	Very high	168 Å²	168	81.9 Å²	81.9	73%	0.73	38%	0.383	S	S	*	.			trans	-104.8	138.9	-174	-65.1	-178.9	-178.8	178.3	0	111.5	N792 L817	N792-K815 WeakPolarHBondContact OD1-CA 3.46Å; K815-L817 VanDerWaalsContact C-N 3.35Å; K815-L817 PolarHBondContact O-N 2.78Å
816	K	91.4	Very high	95.6	Very high	136 Å²	136	78.2 Å²	78.2	59%	0.591	36%	0.363	S	S	*	.	S	Bend	trans	51.8	40.5	172.7	-56.9	-177.9	-178.1	177.7	0	115.1	P790 R791 N792	P790-K816 HydrophobicContact CB-CB 4.22Å; P790-K816 HydrophobicContact CG-CB 3.79Å; P790-K816 HydrophobicContact CG-CG 4.2Å; R791-K816 CarbonylContact O-C 3.56Å; R791-K816 WeakPolarHBondContact O-CA 3.41Å; R791-K816 PolarHBondContact O-N 2.69Å; N792-K816 PolarHBondContact OD1-N 3.4Å
817	L	92.1	Very high	95.8	Very high	87 Å²	87	73.6 Å²	73.6	46%	0.455	35%	0.347	S	S	.	.			trans	-134.6	142.2	177.5	-74	173.7	0	0	0	111.8	R791 P793 V814 K815	R791-L817 PolarHBondContact O-N 2.84Å; P793-L817 VanDerWaalsContact CD-O 3.23Å; P793-L817 WeakPolarHBondContact CD-O 3.3Å; P793-L817 WeakPolarHBondContact CG-O 3.44Å; V814-L817 HydrophobicContact CG1-CB 4.09Å; V814-L817 HydrophobicContact CG1-CD1 3.71Å; V814-L817 HydrophobicContact CG1-CG 4.34Å; K815-L817 VanDerWaalsContact C-N 3.35Å; K815-L817 PolarHBondContact O-N 2.78Å
818	L	91.7	Very high	95.9	Very high	60 Å²	60	73.7 Å²	73.7	31%	0.314	35%	0.347	S	S	.	.	S	Bend	trans	-91.9	-20.1	168.8	-54.3	-176.8	0	0	0	111.9	L782 P784 R791 P820	L782-L818 WeakPolarHBondContact CB-O 3.23Å; L782-L818 WeakPolarHBondContact CD1-O 3.41Å; L782-L818 VanDerWaalsContact CG-O 3.29Å; L782-L818 WeakPolarHBondContact CG-O 3.45Å; P784-L818 HydrophobicContact CB-CD1 4.29Å; P784-L818 HydrophobicContact CB-CD2 4.49Å; R791-L818 HydrophobicContact CB-CD2 3.99Å; R791-L818 HydrophobicContact CG-CD2 3.55Å; L818-P820 WeakPolarHBondContact O-CD 3.28Å
819	E	94.5	Very high	95.8	Very high	112 Å²	112	73 Å²	73	52%	0.523	35%	0.352	S	S	.	.	S	Bend	trans	-113.4	70.2	175.1	-57.6	-168	135.2	0	0	111.3	A779 T780	A779-E819 CarbonylContact O-C 3.58Å; A779-E819 VanDerWaalsContact O-CA 3.23Å; A779-E819 WeakPolarHBondContact O-CA 3.46Å; T780-E819 HydrophobicContact CG2-CG 4.46Å
820	P	96.1	Very high	95.4	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.37	C	S	.	.			trans	-71.4	136.7	-178.5	31.5	-38.1	0	0	0	111.9	Q778 A779 L782 P793 V814 L818 W822	Q778-P820 CarbonylContact C-O 3.5Å; Q778-P820 WeakPolarHBondContact CA-O 3.49Å; Q778-P820 WeakPolarHBondContact CB-O 3.42Å; A779-P820 HydrophobicContact CB-CG 3.89Å; A779-P820 PolarHBondContact N-O 2.96Å; L782-P820 HydrophobicContact CD1-CG 3.84Å; P793-P820 HydrophobicContact CB-CG 4.07Å; P793-P820 HydrophobicContact CG-CB 3.57Å; P793-P820 HydrophobicContact CG-CG 3.46Å; P793-P820 VanDerWaalsContact CG-CG 3.46Å; V814-P820 HydrophobicContact CB-CB 3.88Å; V814-P820 HydrophobicContact CG1-CB 3.99Å; V814-P820 HydrophobicContact CG2-CB 4Å; L818-P820 WeakPolarHBondContact O-CD 3.28Å; P820-W822 HydrophobicContact CB-CD2 4.38Å; P820-W822 HydrophobicContact CB-CH2 3.85Å; P820-W822 HydrophobicContact CB-CZ2 3.66Å; P820-W822 HydrophobicContact CB-CZ3 4.26Å; P820-W822 HydrophobicContact CG-CE3 4.42Å; P820-W822 HydrophobicContact CG-CH2 3.23Å; P820-W822 HydrophobicContact CG-CZ2 3.53Å; P820-W822 HydrophobicContact CG-CZ3 3.72Å
821	K	97.2	Very high	95.3	Very high	131 Å²	131	71.1 Å²	71.1	57%	0.57	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.6	168.4	-48	-161.7	-176.2	-147.4	0	108.8	Q778	Q778-K821 HydrophobicContact CB-CB 4.28Å; Q778-K821 HydrophobicContact CB-CG 3.92Å
822	W	97.8	Very high	95.2	Very high	27 Å²	27	73.4 Å²	73.4	10%	0.102	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-39.5	-179.7	-64.3	-74.5	0	0	0	112.4	L759 V776 L777 A779 P793 V795 T811 K812 P820 Q824	L759-W822 HydrophobicContact CD1-CE3 4.4Å; L759-W822 HydrophobicContact CD1-CH2 4.29Å; L759-W822 HydrophobicContact CD1-CZ3 3.57Å; V776-W822 HydrophobicContact CG1-CD2 4.44Å; V776-W822 HydrophobicContact CG1-CE3 3.89Å; V776-W822 HydrophobicContact CG1-CZ3 4.44Å; L777-W822 PolarHBondContact O-N 2.63Å; A779-W822 HydrophobicContact CB-CH2 4.05Å; A779-W822 HydrophobicContact CB-CZ3 3.88Å; P793-W822 HydrophobicContact CB-CZ2 4.11Å; P793-W822 HydrophobicContact CG-CZ2 4.41Å; V795-W822 HydrophobicContact CG2-CD2 4.15Å; V795-W822 HydrophobicContact CG2-CE3 3.91Å; V795-W822 HydrophobicContact CG2-CH2 3.38Å; V795-W822 HydrophobicContact CG2-CZ2 3.66Å; V795-W822 HydrophobicContact CG2-CZ3 3.53Å; T811-W822 VanDerWaalsContact CB-CD1 3.46Å; T811-W822 HydrophobicContact CG2-CB 4.11Å; T811-W822 HydrophobicContact CG2-CD2 4.42Å; T811-W822 HydrophobicContact CG2-CG 3.97Å; T811-W822 VanDerWaalsContact OG1-CD1 3.28Å; T811-W822 PolarHBondContact OG1-NE1 2.95Å; T811-W822 VanDerWaalsContact OG1-NE1 3.12Å; K812-W822 PolarHBondContact O-NE1 3.28Å; P820-W822 HydrophobicContact CB-CD2 4.38Å; P820-W822 HydrophobicContact CB-CH2 3.85Å; P820-W822 HydrophobicContact CB-CZ2 3.66Å; P820-W822 HydrophobicContact CB-CZ3 4.26Å; P820-W822 HydrophobicContact CG-CE3 4.42Å; P820-W822 HydrophobicContact CG-CH2 3.23Å; P820-W822 HydrophobicContact CG-CZ2 3.53Å; P820-W822 HydrophobicContact CG-CZ3 3.72Å; W822-Q824 HydrophobicContact CB-CB 4.37Å; W822-Q824 PolarHBondContact O-N 3.15Å
823	N	96.3	Very high	95	Very high	111 Å²	111	71.6 Å²	71.6	59%	0.594	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	42.3	48.9	-175.7	-64.9	-13.1	0	0	0	112.6	V776 L777	V776-N823 WeakPolarHBondContact O-CA 3.29Å; V776-N823 PolarHBondContact O-N 2.92Å; L777-N823 PolarHBondContact O-N 3.19Å; L777-N823 PolarHBondContact O-OD1 3.1Å
824	Q	97.3	Very high	94.8	Very high	51 Å²	51	78.7 Å²	78.7	24%	0.238	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.3	-169.6	-169.1	172.6	-13.5	0	0	111.9	V776 T811 W822 F826	V776-Q824 PolarHBondContact N-O 2.77Å; V776-Q824 PolarHBondContact O-N 3.27Å; T811-Q824 VanDerWaalsContact CA-OE1 3.29Å; T811-Q824 HydrophobicContact CG2-CB 4.31Å; W822-Q824 HydrophobicContact CB-CB 4.37Å; W822-Q824 PolarHBondContact O-N 3.15Å; Q824-F826 HydrophobicContact CB-CE2 4.13Å; Q824-F826 HydrophobicContact CB-CZ 4.26Å; Q824-F826 HydrophobicContact CG-CE1 4.11Å; Q824-F826 HydrophobicContact CG-CE2 3.88Å; Q824-F826 HydrophobicContact CG-CZ 3.61Å; Q824-F826 VanDerWaalsContact NE2-CE1 3.29Å; Q824-F826 VanDerWaalsContact NE2-CZ 3.31Å; Q824-F826 WeakPolarHBondContact O-CD2 3.06Å; Q824-F826 WeakPolarHBondContact O-CE2 3.3Å
825	T	97.4	Very high	94.7	Very high	81 Å²	81	78.7 Å²	78.7	50%	0.497	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	139.2	173.6	-51.8	0	0	0	0	112	I773 V774 N775	I773-T825 HydrophobicContact CG2-CG2 3.56Å; V774-T825 CarbonylContact O-C 3.58Å; N775-T825 WeakPolarHBondContact OD1-CA 3.45Å; N775-T825 VanDerWaalsContact OD1-CB 3.22Å; N775-T825 WeakPolarHBondContact OD1-CB 3.42Å; N775-T825 VanDerWaalsContact OD1-CG2 3.28Å; N775-T825 WeakPolarHBondContact OD1-CG2 3.4Å; N775-T825 PolarHBondContact OD1-OG1 3.48Å
826	F	97.6	Very high	94.8	Very high	20 Å²	20	70.7 Å²	70.7	9%	0.088	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143.9	169.7	-56.5	-82.8	0	0	0	110.7	I773 V774 V776 M797 R809 R810 T811 Q824	I773-F826 WeakPolarHBondContact CA-O 3.25Å; V774-F826 PolarHBondContact N-O 2.75Å; V774-F826 PolarHBondContact O-N 3.43Å; V776-F826 HydrophobicContact CB-CE2 4.42Å; V776-F826 HydrophobicContact CG2-CD2 4.2Å; V776-F826 HydrophobicContact CG2-CE2 3.99Å; M797-F826 HydrophobicContact CE-CB 4.11Å; M797-F826 HydrophobicContact CE-CD2 3.31Å; M797-F826 HydrophobicContact CE-CE2 3.81Å; M797-F826 HydrophobicContact CE-CG 3.85Å; R809-F826 HydrophobicContact CB-CB 4.46Å; R809-F826 HydrophobicContact CB-CD1 3.79Å; R809-F826 HydrophobicContact CB-CE1 4.04Å; R809-F826 HydrophobicContact CB-CG 4.04Å; R809-F826 HydrophobicContact CG-CB 4.01Å; R809-F826 HydrophobicContact CG-CD1 3.95Å; R809-F826 HydrophobicContact CG-CG 4.09Å; R810-F826 WeakPolarHBondContact O-CE1 3.44Å; R810-F826 WeakPolarHBondContact O-CZ 3.4Å; T811-F826 HydrophobicContact CG2-CE2 3.75Å; T811-F826 HydrophobicContact CG2-CZ 3.81Å; Q824-F826 HydrophobicContact CB-CE2 4.13Å; Q824-F826 HydrophobicContact CB-CZ 4.26Å; Q824-F826 HydrophobicContact CG-CE1 4.11Å; Q824-F826 HydrophobicContact CG-CE2 3.88Å; Q824-F826 HydrophobicContact CG-CZ 3.61Å; Q824-F826 VanDerWaalsContact NE2-CE1 3.29Å; Q824-F826 VanDerWaalsContact NE2-CZ 3.31Å; Q824-F826 WeakPolarHBondContact O-CD2 3.06Å; Q824-F826 WeakPolarHBondContact O-CE2 3.3Å
827	V	96.7	Very high	94.9	Very high	55 Å²	55	72 Å²	72	33%	0.333	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.4	-179.8	-175	0	0	0	0	110.7	Q771 I773 R809	Q771-V827 HydrophobicContact CB-CG1 4.01Å; Q771-V827 HydrophobicContact CG-CG1 4.45Å; I773-V827 HydrophobicContact CG1-CG1 4.33Å; I773-V827 HydrophobicContact CG1-CG2 4.1Å; I773-V827 HydrophobicContact CG2-CG2 4.34Å; R809-V827 PolarHBondContact NH2-O 3.01Å
828	Y	96.4	Very high	94.9	Very high	8 Å²	8	75.4 Å²	75.4	3%	0.031	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	107.3	168	-61.5	-68.1	0	0	0	109.3	Q771 L772 V774 F799 S807 R809 V831 L841	Q771-Y828 VanDerWaalsContact CA-O 3.28Å; Q771-Y828 WeakPolarHBondContact CA-O 3.28Å; L772-Y828 HydrophobicContact CD2-CD2 4.4Å; L772-Y828 PolarHBondContact N-O 2.95Å; L772-Y828 PolarHBondContact O-N 3.38Å; V774-Y828 HydrophobicContact CG2-CD2 4.18Å; V774-Y828 HydrophobicContact CG2-CE2 3.98Å; F799-Y828 HydrophobicContact CB-CD1 3.95Å; F799-Y828 HydrophobicContact CB-CD2 4.44Å; F799-Y828 HydrophobicContact CB-CE1 3.81Å; F799-Y828 HydrophobicContact CB-CE2 4.28Å; F799-Y828 HydrophobicContact CB-CG 4.27Å; F799-Y828 AromaticContact CD2-CD2 3.9Å; F799-Y828 HydrophobicContact CD2-CD2 3.9Å; F799-Y828 HydrophobicContact CD2-CE2 4.21Å; F799-Y828 HydrophobicContact CD2-CG 4.11Å; F799-Y828 HydrophobicContact CG-CD1 4.27Å; F799-Y828 HydrophobicContact CG-CD2 4.35Å; F799-Y828 HydrophobicContact CG-CG 4.16Å; S807-Y828 VanDerWaalsContact O-CE1 3.23Å; S807-Y828 WeakPolarHBondContact O-CE1 3.36Å; S807-Y828 PolarHBondContact O-OH 3.18Å; R809-Y828 HydrophobicContact CG-CE1 3.71Å; R809-Y828 VanDerWaalsContact CG-OH 3.24Å; R809-Y828 WeakPolarHBondContact CG-OH 3.35Å; Y828-V831 VanDerWaalsContact O-CG2 3.24Å; Y828-V831 WeakPolarHBondContact O-CG2 3.46Å; Y828-L841 HydrophobicContact CE2-CD1 3.75Å
829	S	93.9	Very high	95.1	Very high	64 Å²	64	75.4 Å²	75.4	45%	0.448	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	158.7	178.8	-41.5	0	0	0	0	112.3	V831	S829-V831 VanDerWaalsContact C-N 3.33Å
830	H	91.1	Very high	95.1	Very high	136 Å²	136	71.1 Å²	71.1	63%	0.63	33%	0.326	S	S	*	.	S	Bend	trans	67.4	28.2	-174.6	-40.8	-75.4	0	0	0	114.5	H770 H832	H770-H830 PolarHBondContact O-N 2.75Å; H830-H832 PolarHBondContact O-CE1 2.88Å; H830-H832 PolarHBondContact O-ND1 2.87Å
831	V	94.8	Very high	95.2	Very high	2 Å²	2	71.1 Å²	71.1	1%	0.012	33%	0.326	C	S	.	.			trans	-91.6	117.2	175.8	175.3	0	0	0	0	108.1	Y765 H770 L772 F799 Y828 S829 F836	Y765-V831 HydrophobicContact CE2-CG1 4.33Å; Y765-V831 WeakPolarHBondContact CE2-O 3.21Å; Y765-V831 PolarHBondContact OH-O 2.85Å; H770-V831 CarbonylContact C-O 3.6Å; H770-V831 VanDerWaalsContact C-O 3.27Å; H770-V831 WeakPolarHBondContact CA-O 3.4Å; H770-V831 WeakPolarHBondContact CB-O 2.98Å; H770-V831 PolarHBondContact O-N 2.81Å; L772-V831 HydrophobicContact CB-CB 4.37Å; L772-V831 HydrophobicContact CB-CG1 4.04Å; L772-V831 HydrophobicContact CB-CG2 4.31Å; F799-V831 HydrophobicContact CE1-CG2 3.6Å; F799-V831 HydrophobicContact CE2-CG1 4.43Å; F799-V831 HydrophobicContact CE2-CG2 4.09Å; F799-V831 HydrophobicContact CZ-CB 4.14Å; F799-V831 HydrophobicContact CZ-CG1 3.73Å; F799-V831 HydrophobicContact CZ-CG2 3.31Å; Y828-V831 VanDerWaalsContact O-CG2 3.24Å; Y828-V831 WeakPolarHBondContact O-CG2 3.46Å; S829-V831 VanDerWaalsContact C-N 3.33Å; V831-F836 HydrophobicContact CG1-CE1 3.76Å
832	H	94.3	Very high	95.2	Very high	54 Å²	54	65.3 Å²	65.3	25%	0.25	30%	0.301	C	S	.	.			trans	-108.4	140.8	-177.9	-55.5	82	0	0	0	110.8	H770 H830 R834 D835 F836	H770-H832 AromaticContact CD2-CD2 3.58Å; H770-H832 AromaticContact CD2-NE2 3.65Å; H770-H832 AromaticContact CG-CD2 3.97Å; H830-H832 PolarHBondContact O-CE1 2.88Å; H830-H832 PolarHBondContact O-ND1 2.87Å; H832-R834 HydrophobicContact CB-CG 4.13Å; H832-R834 PolarHBondContact O-N 2.8Å; H832-D835 IonicContact ND1-OD2 2.78Å; H832-D835 WeakPolarHBondContact O-CB 3.33Å; H832-D835 PolarHBondContact O-N 2.78Å; H832-F836 VanDerWaalsContact O-CD1 3.25Å; H832-F836 WeakPolarHBondContact O-CD1 3.46Å; H832-F836 WeakPolarHBondContact O-CE1 3.2Å
833	R	92.4	Very high	95.1	Very high	128 Å²	128	64 Å²	64	48%	0.483	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-54.8	-28.4	-179.3	-172.8	56.5	178.1	101.5	-16	114.6	Y765 D835 F836	Y765-R833 HydrophobicContact CE1-CB 4Å; Y765-R833 PolarHBondContact OH-N 2.92Å; R833-D835 VanDerWaalsContact C-N 3.35Å; R833-F836 VanDerWaalsContact CD-CD2 3.41Å; R833-F836 VanDerWaalsContact NH1-CD2 3.32Å; R833-F836 WeakPolarHBondContact O-CG 3.32Å
834	R	93.2	Very high	95.1	Very high	194 Å²	194	58.9 Å²	58.9	73%	0.732	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-67.5	-32.5	175.8	75.6	-172.4	175.9	-167.6	-6.4	112.9	H832 F836	H832-R834 HydrophobicContact CB-CG 4.13Å; H832-R834 PolarHBondContact O-N 2.8Å; R834-F836 PolarHBondContact O-N 3.02Å
835	D	93.2	Very high	95.1	Very high	27 Å²	27	56.5 Å²	56.5	14%	0.144	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-78.3	-7.8	-174.7	-51.5	2.6	0	0	0	111.9	H832 R833 R837 E838 R839	H832-D835 IonicContact ND1-OD2 2.78Å; H832-D835 WeakPolarHBondContact O-CB 3.33Å; H832-D835 PolarHBondContact O-N 2.78Å; R833-D835 VanDerWaalsContact C-N 3.35Å; D835-R837 PolarHBondContact O-N 3.49Å; D835-R837 VanDerWaalsContact O-N 3.16Å; D835-E838 PolarHBondContact O-N 3.13Å; D835-R839 HydrophobicContact CB-CG 4.31Å; D835-R839 WeakPolarHBondContact O-CG 3.24Å; D835-R839 IonicContact OD2-CZ 2.76Å; D835-R839 IonicContact OD2-NE 3.02Å; D835-R839 PolarHBondContact OD2-NE 2.92Å; D835-R839 VanDerWaalsContact OD2-NE 3.11Å; D835-R839 IonicContact OD2-NH2 2.84Å; D835-R839 PolarHBondContact OD2-NH2 3.44Å
836	F	94.7	Very high	95	Very high	1 Å²	1	55.1 Å²	55.1	0%	0.004	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62.2	-26.9	-167.9	-80.4	24.2	0	0	0	113.9	Y765 V831 H832 R833 R834 E838 L866 E867 L871	Y765-F836 HydrophobicContact CD1-CZ 4.02Å; Y765-F836 HydrophobicContact CD2-CE1 4.23Å; Y765-F836 AromaticContact CD2-CZ 3.64Å; Y765-F836 HydrophobicContact CD2-CZ 3.64Å; Y765-F836 HydrophobicContact CE1-CZ 4.24Å; Y765-F836 HydrophobicContact CE2-CE1 4.1Å; Y765-F836 AromaticContact CE2-CZ 3.88Å; Y765-F836 HydrophobicContact CE2-CZ 3.88Å; Y765-F836 HydrophobicContact CG-CE2 4.46Å; Y765-F836 AromaticContact CG-CZ 3.71Å; Y765-F836 HydrophobicContact CG-CZ 3.71Å; V831-F836 HydrophobicContact CG1-CE1 3.76Å; H832-F836 VanDerWaalsContact O-CD1 3.25Å; H832-F836 WeakPolarHBondContact O-CD1 3.46Å; H832-F836 WeakPolarHBondContact O-CE1 3.2Å; R833-F836 VanDerWaalsContact CD-CD2 3.41Å; R833-F836 VanDerWaalsContact NH1-CD2 3.32Å; R833-F836 WeakPolarHBondContact O-CG 3.32Å; R834-F836 PolarHBondContact O-N 3.02Å; F836-E838 PolarHBondContact O-N 2.67Å; F836-L866 HydrophobicContact CB-CB 3.89Å; F836-L866 HydrophobicContact CD1-CB 4.22Å; F836-L866 HydrophobicContact CD1-CD1 4.34Å; F836-L866 HydrophobicContact CD2-CB 3.92Å; F836-L866 WeakPolarHBondContact CD2-O 3.46Å; F836-L866 HydrophobicContact CG-CB 3.75Å; F836-E867 HydrophobicContact CB-CB 4.48Å; F836-E867 PolarHBondContact O-N 3.3Å; F836-L871 HydrophobicContact CD2-CD1 4.28Å; F836-L871 HydrophobicContact CE2-CD1 3.47Å; F836-L871 VanDerWaalsContact CE2-CD1 3.47Å; F836-L871 HydrophobicContact CZ-CD1 4.24Å
837	R	94	Very high	94.8	Very high	164 Å²	164	54.3 Å²	54.3	62%	0.619	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-68.1	-22.9	177.7	-38	-161.7	-176.9	-106.8	-7.4	113.4	D835 E867	D835-R837 PolarHBondContact O-N 3.49Å; D835-R837 VanDerWaalsContact O-N 3.16Å; R837-E867 WeakPolarHBondContact CB-OE2 3.42Å; R837-E867 WeakPolarHBondContact CD-OE2 3.23Å; R837-E867 WeakPolarHBondContact CG-OE2 3.44Å; R837-E867 IonicContact CZ-OE1 3.71Å; R837-E867 IonicContact NE-OE1 3.3Å; R837-E867 IonicContact NH1-OE1 3.77Å; R837-E867 PolarHBondContact NH1-OE1 2.94Å; R837-E867 IonicContact NH1-OE2 2.65Å; R837-E867 IonicContact NH2-OE1 2.74Å
838	E	93.3	Very high	94.7	Very high	158 Å²	158	55.2 Å²	55.2	74%	0.738	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-110.9	9.3	-173.5	-62.4	178.6	-167.8	0	0	111.9	D835 F836	D835-E838 PolarHBondContact O-N 3.13Å; F836-E838 PolarHBondContact O-N 2.67Å
839	R	94.2	Very high	94.2	Very high	59 Å²	59	55.9 Å²	55.9	22%	0.223	25%	0.246	C	C	.	.			trans	-132.2	139.6	-171.7	-68.4	-176.8	-176.4	-65.9	-0.9	111.7	L800 D835 L866	L800-R839 WeakPolarHBondContact O-CA 3.48Å; D835-R839 HydrophobicContact CB-CG 4.31Å; D835-R839 WeakPolarHBondContact O-CG 3.24Å; D835-R839 IonicContact OD2-CZ 2.76Å; D835-R839 IonicContact OD2-NE 3.02Å; D835-R839 PolarHBondContact OD2-NE 2.92Å; D835-R839 VanDerWaalsContact OD2-NE 3.11Å; D835-R839 IonicContact OD2-NH2 2.84Å; D835-R839 PolarHBondContact OD2-NH2 3.44Å; R839-L866 HydrophobicContact CB-CD1 3.58Å; R839-L866 HydrophobicContact CB-CG 4.21Å; R839-L866 WeakPolarHBondContact O-CG 3.4Å; R839-L866 PolarHBondContact O-N 2.85Å; R839-L866 VanDerWaalsContact O-N 3.14Å
840	M	96.1	Very high	93.4	Very high	22 Å²	22	58.9 Å²	58.9	11%	0.108	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	156.7	173.3	-51.4	175.8	86.6	0	0	110.4	L800 L863 I864 E865 L890	L800-M840 HydrophobicContact CB-CB 4.19Å; L800-M840 HydrophobicContact CD1-CB 4.32Å; L800-M840 HydrophobicContact CD1-SD 4.49Å; L800-M840 PolarHBondContact N-O 2.87Å; M840-L863 HydrophobicContact CE-CB 3.8Å; M840-L863 HydrophobicContact CE-CD2 4.13Å; M840-L863 HydrophobicContact CE-CG 4.41Å; M840-L863 HydrophobicContact SD-CD2 4.35Å; M840-I864 CarbonylContact C-O 3.59Å; M840-I864 WeakPolarHBondContact CA-O 3.27Å; M840-I864 WeakPolarHBondContact CB-O 3.23Å; M840-E865 HydrophobicContact CE-CG 3.81Å; M840-E865 HydrophobicContact CG-CG 4.45Å; M840-L890 HydrophobicContact CE-CD2 3.72Å; M840-L890 HydrophobicContact CE-CG 4.27Å; M840-L890 HydrophobicContact CG-CD1 4.03Å; M840-L890 HydrophobicContact CG-CD2 4.42Å; M840-L890 HydrophobicContact SD-CD1 3.66Å; M840-L890 HydrophobicContact SD-CD2 3.71Å; M840-L890 HydrophobicContact SD-CG 3.64Å
841	L	97.1	Very high	93	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	109.7	164.2	-176.5	63	0	0	0	108.5	L763 V774 M797 Y828 I843 I864 L866	L763-L841 HydrophobicContact CD2-CD2 3.82Å; V774-L841 HydrophobicContact CB-CD2 4.43Å; V774-L841 HydrophobicContact CG1-CD2 3.87Å; V774-L841 HydrophobicContact CG2-CD1 4.38Å; V774-L841 HydrophobicContact CG2-CD2 3.63Å; M797-L841 HydrophobicContact CB-CD1 4.45Å; Y828-L841 HydrophobicContact CE2-CD1 3.75Å; L841-I843 HydrophobicContact CD2-CD1 3.84Å; L841-I843 HydrophobicContact CD2-CG1 4.19Å; L841-I843 HydrophobicContact CG-CD1 4.04Å; L841-I843 HydrophobicContact CG-CG1 3.82Å; L841-I864 HydrophobicContact CB-CB 4.41Å; L841-I864 PolarHBondContact N-O 2.99Å; L841-I864 PolarHBondContact O-N 2.97Å; L841-L866 HydrophobicContact CB-CD2 4.43Å
842	E	96.8	Very high	91.8	Very high	10 Å²	10	64.8 Å²	64.8	5%	0.047	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.7	171.5	176.2	-169.5	140.5	0	0	108.2	M797 Y798 L800 R803 T844 L863	M797-E842 CarbonylContact C-O 3.41Å; M797-E842 WeakPolarHBondContact CA-O 3.47Å; M797-E842 WeakPolarHBondContact CB-O 3.46Å; Y798-E842 WeakPolarHBondContact CD2-OE1 3.39Å; Y798-E842 PolarHBondContact N-O 3.4Å; Y798-E842 PolarHBondContact O-N 2.87Å; L800-E842 HydrophobicContact CD1-CB 4Å; L800-E842 WeakPolarHBondContact CD2-OE2 3.45Å; L800-E842 HydrophobicContact CG-CB 4.08Å; R803-E842 IonicContact CZ-OE2 3.33Å; R803-E842 IonicContact NE-OE2 3.1Å; R803-E842 PolarHBondContact NE-OE2 2.95Å; R803-E842 VanDerWaalsContact NH2-CD 3.31Å; R803-E842 IonicContact NH2-OE1 3.21Å; R803-E842 IonicContact NH2-OE2 3.94Å; R803-E842 PolarHBondContact NH2-OE2 3.44Å; E842-T844 HydrophobicContact CG-CG2 4.16Å; E842-L863 HydrophobicContact CB-CD2 3.96Å; E842-L863 HydrophobicContact CG-CD2 4.2Å
843	I	97.1	Very high	91	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	120.9	179.8	-52.6	-176.8	0	0	0	108.3	L759 V761 V795 M797 L841 E861 I862 I864	L759-I843 HydrophobicContact CD2-CG2 3.51Å; V761-I843 HydrophobicContact CG1-CD1 4.22Å; V761-I843 HydrophobicContact CG2-CD1 4.12Å; V795-I843 HydrophobicContact CG1-CG2 3.46Å; V795-I843 VanDerWaalsContact CG1-CG2 3.46Å; M797-I843 HydrophobicContact CG-CB 4.37Å; M797-I843 HydrophobicContact CG-CG1 4.14Å; M797-I843 HydrophobicContact CG-CG2 4.08Å; M797-I843 HydrophobicContact SD-CD1 4.19Å; M797-I843 HydrophobicContact SD-CG1 4.02Å; M797-I843 HydrophobicContact SD-CG2 4.31Å; L841-I843 HydrophobicContact CD2-CD1 3.84Å; L841-I843 HydrophobicContact CD2-CG1 4.19Å; L841-I843 HydrophobicContact CG-CD1 4.04Å; L841-I843 HydrophobicContact CG-CG1 3.82Å; I843-E861 CarbonylContact O-C 3.53Å; I843-E861 VanDerWaalsContact O-CA 3.31Å; I843-E861 WeakPolarHBondContact O-CA 3.04Å; I843-I862 HydrophobicContact CB-CB 4.34Å; I843-I862 PolarHBondContact N-O 3.47Å; I843-I862 PolarHBondContact O-N 2.92Å; I843-I864 HydrophobicContact CD1-CD1 3.93Å
844	T	96	Very high	90.4	Very high	3 Å²	3	67.5 Å²	67.5	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.2	-176	59	0	0	0	0	110.6	V795 K796 E842 W846 F858 E861	V795-T844 CarbonylContact C-O 3.56Å; V795-T844 WeakPolarHBondContact CA-O 3.2Å; K796-T844 PolarHBondContact N-O 2.82Å; K796-T844 PolarHBondContact O-N 2.99Å; K796-T844 PolarHBondContact O-OG1 2.65Å; E842-T844 HydrophobicContact CG-CG2 4.16Å; T844-W846 VanDerWaalsContact CB-NE1 3.29Å; T844-W846 PolarHBondContact OG1-NE1 2.91Å; T844-F858 HydrophobicContact CG2-CE2 4.43Å; T844-E861 HydrophobicContact CG2-CB 3.87Å
845	V	96.4	Very high	90	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.3	-179	-173	0	0	0	0	109.6	L759 L782 V795 L859 G860 L880	L759-V845 HydrophobicContact CD1-CG2 4.49Å; L759-V845 HydrophobicContact CD2-CG2 4.23Å; L782-V845 HydrophobicContact CD2-CG1 4.4Å; V795-V845 HydrophobicContact CG2-CG2 4.25Å; V845-L859 HydrophobicContact CB-CB 4.41Å; V845-L859 HydrophobicContact CG1-CB 4.25Å; V845-L859 HydrophobicContact CG1-CD1 4.26Å; V845-L859 PolarHBondContact O-N 2.87Å; V845-G860 PolarHBondContact N-O 3.48Å; V845-G860 PolarHBondContact O-N 3.22Å; V845-L880 HydrophobicContact CB-CD1 4.31Å; V845-L880 HydrophobicContact CB-CD2 4.19Å; V845-L880 HydrophobicContact CG2-CD1 4.16Å; V845-L880 HydrophobicContact CG2-CD2 3.5Å; V845-L880 HydrophobicContact CG2-CG 4.49Å
846	W	95.5	Very high	90	Very high	53 Å²	53	67.8 Å²	67.8	20%	0.201	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	141.1	-170.3	-61.9	79.9	0	0	0	110.8	P793 Y794 T844 S856 E857 F858	P793-W846 CarbonylContact C-O 3.59Å; P793-W846 VanDerWaalsContact CA-O 3.27Å; P793-W846 WeakPolarHBondContact CA-O 3.16Å; Y794-W846 HydrophobicContact CD1-CB 4.09Å; Y794-W846 WeakPolarHBondContact CD1-O 3.28Å; Y794-W846 HydrophobicContact CD2-CB 4.14Å; Y794-W846 HydrophobicContact CE1-CB 3.57Å; Y794-W846 HydrophobicContact CE2-CB 3.61Å; Y794-W846 AromaticContact CE2-CD1 3.92Å; Y794-W846 AromaticContact CE2-CG 3.85Å; Y794-W846 HydrophobicContact CE2-CG 3.85Å; Y794-W846 HydrophobicContact CG-CB 4.37Å; Y794-W846 AromaticContact CZ-CG 3.83Å; Y794-W846 PolarHBondContact N-O 3.26Å; Y794-W846 PolarHBondContact O-N 3.07Å; T844-W846 VanDerWaalsContact CB-NE1 3.29Å; T844-W846 PolarHBondContact OG1-NE1 2.91Å; W846-S856 WeakPolarHBondContact CZ3-O 3.46Å; W846-E857 CarbonylContact C-O 3.47Å; W846-E857 WeakPolarHBondContact CA-O 3.13Å; W846-F858 HydrophobicContact CE3-CB 4.11Å; W846-F858 HydrophobicContact CH2-CB 4.23Å; W846-F858 HydrophobicContact CH2-CD2 4.04Å; W846-F858 AromaticContact CZ2-CD2 3.86Å; W846-F858 HydrophobicContact CZ2-CD2 3.86Å; W846-F858 HydrophobicContact CZ3-CB 3.89Å; W846-F858 HydrophobicContact CZ3-CD2 4.44Å
847	D	94.7	Very high	89.8	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.011	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	124.1	167.5	-175.8	9.5	0	0	0	109.9	R785 R791 N792 S856 E857 L859	R785-D847 IonicContact CZ-OD1 3.65Å; R785-D847 IonicContact CZ-OD2 2.61Å; R785-D847 IonicContact NE-OD1 2.67Å; R785-D847 IonicContact NE-OD2 2.95Å; R785-D847 PolarHBondContact NE-OD2 2.73Å; R785-D847 IonicContact NH2-OD1 3.33Å; R785-D847 PolarHBondContact NH2-OD1 2.74Å; R785-D847 IonicContact NH2-OD2 3.83Å; R785-D847 PolarHBondContact NH2-OD2 2.8Å; R791-D847 VanDerWaalsContact CD-CG 3.45Å; R791-D847 WeakPolarHBondContact CD-OD2 3.19Å; R791-D847 IonicContact CZ-OD2 3.57Å; R791-D847 IonicContact NE-OD2 3.24Å; R791-D847 IonicContact NH1-OD2 3.12Å; R791-D847 PolarHBondContact NH1-OD2 2.88Å; N792-D847 PolarHBondContact N-OD1 3.02Å; D847-S856 WeakPolarHBondContact O-CA 3.47Å; D847-S856 WeakPolarHBondContact O-CB 3.45Å; D847-E857 HydrophobicContact CB-CB 4.25Å; D847-E857 PolarHBondContact N-O 2.78Å; D847-E857 PolarHBondContact O-N 2.84Å; D847-L859 HydrophobicContact CB-CD1 4.11Å; D847-L859 HydrophobicContact CB-CD2 4.12Å; D847-L859 HydrophobicContact CB-CG 4.19Å
848	Q	93.8	Very high	89.8	Confident	75 Å²	75	67.2 Å²	67.2	35%	0.35	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-81.5	126.6	170.7	-165.8	166.7	-24.2	0	0	110.4	R785 N792 Y794 T813	R785-Q848 PolarHBondContact NH2-O 2.76Å; R785-Q848 VanDerWaalsContact NH2-O 3.1Å; N792-Q848 HydrophobicContact CB-CB 4.36Å; N792-Q848 WeakPolarHBondContact CB-O 2.92Å; N792-Q848 PolarHBondContact ND2-O 3.42Å; N792-Q848 PolarHBondContact O-N 2.83Å; Y794-Q848 HydrophobicContact CD1-CB 3.96Å; Y794-Q848 HydrophobicContact CE1-CB 3.85Å; Y794-Q848 HydrophobicContact CE1-CG 4.5Å; T813-Q848 HydrophobicContact CG2-CB 3.65Å; T813-Q848 PolarHBondContact OG1-OE1 3.2Å
849	P	85.9	Confident	89.7	Confident	22 Å²	22	60 Å²	60	14%	0.143	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-66.4	171.6	178.4	-21.2	36.4	0	0	0	112.4	E854 E855	P849-E854 HydrophobicContact CB-CB 3.35Å; P849-E854 HydrophobicContact CB-CG 4.26Å; P849-E854 WeakPolarHBondContact CB-OE2 3.44Å; P849-E854 HydrophobicContact CG-CB 3.66Å; P849-E855 WeakPolarHBondContact CG-O 3.37Å
850	R	77.6	Confident	89.7	Confident	126 Å²	126	57.2 Å²	57.2	48%	0.475	28%	0.275	S	S	.	.	S	Bend	trans	-91.5	-29.4	-179.6	-65.4	-175.8	-172.2	178.3	4.6	111.3	P790 E854	P790-R850 PolarHBondContact O-NH2 3.03Å; R850-E854 PolarHBondContact N-OE2 2.81Å
851	V	81	Confident	89.6	Confident	72 Å²	72	57.2 Å²	57.2	44%	0.436	28%	0.275	S	S	.	.	S	Bend	trans	-85.6	142.7	168.1	-168.8	0	0	0	0	108	D853 E854	V851-D853 VanDerWaalsContact C-N 3.26Å; V851-D853 HydrophobicContact CG1-CB 4.28Å; V851-D853 PolarHBondContact O-N 3.35Å; V851-E854 HydrophobicContact CB-CB 4.41Å; V851-E854 HydrophobicContact CB-CG 3.85Å; V851-E854 WeakPolarHBondContact CB-OE2 3.48Å; V851-E854 HydrophobicContact CG2-CG 4.33Å; V851-E854 WeakPolarHBondContact CG2-OE2 3.16Å; V851-E854 PolarHBondContact N-OE2 2.87Å; V851-E854 VanDerWaalsContact N-OE2 3.17Å
852	Q	71.5	Confident	89.5	Confident	190 Å²	190	57.5 Å²	57.5	89%	0.888	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-19.8	-179	-175.9	168.4	-9.1	0	0	112.9
853	D	76.3	Confident	89.4	Confident	140 Å²	140	60.5 Å²	60.5	75%	0.749	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-6.6	-177.4	-44.9	-62.7	0	0	0	113.2	V851	V851-D853 VanDerWaalsContact C-N 3.26Å; V851-D853 HydrophobicContact CG1-CB 4.28Å; V851-D853 PolarHBondContact O-N 3.35Å
854	E	79.8	Confident	89.4	Confident	100 Å²	100	60.9 Å²	60.9	47%	0.467	29%	0.294	S	S	.	.	S	Bend	trans	-81.9	141	172.6	-75	167.4	157.7	0	0	110.2	P849 R850 V851	P849-E854 HydrophobicContact CB-CB 3.35Å; P849-E854 HydrophobicContact CB-CG 4.26Å; P849-E854 WeakPolarHBondContact CB-OE2 3.44Å; P849-E854 HydrophobicContact CG-CB 3.66Å; R850-E854 PolarHBondContact N-OE2 2.81Å; V851-E854 HydrophobicContact CB-CB 4.41Å; V851-E854 HydrophobicContact CB-CG 3.85Å; V851-E854 WeakPolarHBondContact CB-OE2 3.48Å; V851-E854 HydrophobicContact CG2-CG 4.33Å; V851-E854 WeakPolarHBondContact CG2-OE2 3.16Å; V851-E854 PolarHBondContact N-OE2 2.87Å; V851-E854 VanDerWaalsContact N-OE2 3.17Å
855	E	85.7	Confident	89.4	Confident	187 Å²	187	64.3 Å²	64.3	87%	0.874	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-76.3	144.8	176	-61.5	-166.2	143.8	0	0	112.1	P849 E857	P849-E855 WeakPolarHBondContact CG-O 3.37Å; E855-E857 PolarHBondContact O-N 2.74Å
856	S	91.9	Very high	89.3	Confident	40 Å²	40	64.3 Å²	64.3	28%	0.28	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-64.9	123.8	177.1	-62.7	0	0	0	0	112.2	Y794 W846 D847	Y794-S856 VanDerWaalsContact OH-CB 3.28Å; Y794-S856 WeakPolarHBondContact OH-CB 3.29Å; Y794-S856 PolarHBondContact OH-OG 2.75Å; W846-S856 WeakPolarHBondContact CZ3-O 3.46Å; D847-S856 WeakPolarHBondContact O-CA 3.47Å; D847-S856 WeakPolarHBondContact O-CB 3.45Å
857	E	91.4	Very high	89.3	Confident	91 Å²	91	65.3 Å²	65.3	43%	0.425	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	132.7	176	-164.5	-175.5	139	0	0	109.8	R791 W846 D847 E855	R791-E857 IonicContact CZ-OE1 3.37Å; R791-E857 VanDerWaalsContact CZ-OE1 3.3Å; R791-E857 IonicContact CZ-OE2 3.72Å; R791-E857 IonicContact NH1-OE1 3.3Å; R791-E857 PolarHBondContact NH1-OE1 3.29Å; R791-E857 IonicContact NH1-OE2 2.84Å; R791-E857 PolarHBondContact NH1-OE2 3.23Å; R791-E857 IonicContact NH2-OE1 3.72Å; R791-E857 PolarHBondContact NH2-OE1 2.99Å; R791-E857 IonicContact NH2-OE2 3.93Å; W846-E857 CarbonylContact C-O 3.47Å; W846-E857 WeakPolarHBondContact CA-O 3.13Å; D847-E857 HydrophobicContact CB-CB 4.25Å; D847-E857 PolarHBondContact N-O 2.78Å; D847-E857 PolarHBondContact O-N 2.84Å; E855-E857 PolarHBondContact O-N 2.74Å
858	F	93.1	Very high	89.2	Confident	61 Å²	61	69.9 Å²	69.9	27%	0.268	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	129.5	177.4	172.9	-92.1	0	0	0	110.1	T844 W846 G860 E861 H883	T844-F858 HydrophobicContact CG2-CE2 4.43Å; W846-F858 HydrophobicContact CE3-CB 4.11Å; W846-F858 HydrophobicContact CH2-CB 4.23Å; W846-F858 HydrophobicContact CH2-CD2 4.04Å; W846-F858 AromaticContact CZ2-CD2 3.86Å; W846-F858 HydrophobicContact CZ2-CD2 3.86Å; W846-F858 HydrophobicContact CZ3-CB 3.89Å; W846-F858 HydrophobicContact CZ3-CD2 4.44Å; F858-G860 VanDerWaalsContact CE1-CA 3.41Å; F858-G860 VanDerWaalsContact CZ-CA 3.42Å; F858-E861 HydrophobicContact CE2-CB 4.01Å; F858-E861 HydrophobicContact CZ-CB 3.78Å; F858-E861 HydrophobicContact CZ-CG 3.96Å; F858-H883 HydrophobicContact CE1-CB 3.72Å; F858-H883 HydrophobicContact CE2-CB 4.44Å; F858-H883 HydrophobicContact CZ-CB 3.62Å
859	L	92.2	Very high	89.2	Confident	8 Å²	8	67.2 Å²	67.2	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-16.5	-179.5	-57.6	-175.6	0	0	0	113.6	L782 P783 R791 P793 V845 D847	L782-L859 HydrophobicContact CD1-CD1 4.34Å; P783-L859 HydrophobicContact CG-CD2 4.36Å; R791-L859 HydrophobicContact CG-CD1 4.48Å; P793-L859 HydrophobicContact CB-CD1 4.43Å; V845-L859 HydrophobicContact CB-CB 4.41Å; V845-L859 HydrophobicContact CG1-CB 4.25Å; V845-L859 HydrophobicContact CG1-CD1 4.26Å; V845-L859 PolarHBondContact O-N 2.87Å; D847-L859 HydrophobicContact CB-CD1 4.11Å; D847-L859 HydrophobicContact CB-CD2 4.12Å; D847-L859 HydrophobicContact CB-CG 4.19Å
860	G	92.8	Very high	89.5	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.8	166.1	177.2	0	0	0	0	0	113.9	V845 F858 Q881	V845-G860 PolarHBondContact N-O 3.48Å; V845-G860 PolarHBondContact O-N 3.22Å; F858-G860 VanDerWaalsContact CE1-CA 3.41Å; F858-G860 VanDerWaalsContact CZ-CA 3.42Å; G860-Q881 CarbonylContact C-O 3.49Å; G860-Q881 WeakPolarHBondContact CA-O 3.18Å
861	E	94.8	Very high	90.3	Very high	21 Å²	21	66.3 Å²	66.3	10%	0.098	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	159.9	177.9	68.9	-171.9	168.1	0	0	113.8	I843 T844 F858 Q881 H883	I843-E861 CarbonylContact O-C 3.53Å; I843-E861 VanDerWaalsContact O-CA 3.31Å; I843-E861 WeakPolarHBondContact O-CA 3.04Å; T844-E861 HydrophobicContact CG2-CB 3.87Å; F858-E861 HydrophobicContact CE2-CB 4.01Å; F858-E861 HydrophobicContact CZ-CB 3.78Å; F858-E861 HydrophobicContact CZ-CG 3.96Å; E861-Q881 PolarHBondContact N-O 3.19Å; E861-Q881 PolarHBondContact O-N 2.81Å; E861-H883 WeakPolarHBondContact OE1-CA 3.28Å; E861-H883 WeakPolarHBondContact OE1-CB 3.24Å; E861-H883 IonicContact OE1-CD2 3.33Å; E861-H883 PolarHBondContact OE1-CD2 2.8Å; E861-H883 IonicContact OE1-CG 2.93Å; E861-H883 IonicContact OE2-CD2 2.61Å
862	I	95	Very high	90.9	Very high	7 Å²	7	66.9 Å²	66.9	4%	0.036	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	131.8	174.5	-65.9	146.2	0	0	0	106.8	L759 I843 I864 Y878 L880	L759-I862 HydrophobicContact CB-CD1 3.67Å; L759-I862 HydrophobicContact CD2-CD1 3.78Å; L759-I862 HydrophobicContact CG-CD1 4.34Å; I843-I862 HydrophobicContact CB-CB 4.34Å; I843-I862 PolarHBondContact N-O 3.47Å; I843-I862 PolarHBondContact O-N 2.92Å; I862-I864 HydrophobicContact CG2-CD1 4.08Å; I862-I864 HydrophobicContact CG2-CG1 3.67Å; I862-Y878 HydrophobicContact CG2-CD1 4.02Å; I862-Y878 HydrophobicContact CG2-CG 4.03Å; I862-L880 HydrophobicContact CD1-CD2 3.58Å; I862-L880 HydrophobicContact CD1-CG 4.34Å; I862-L880 HydrophobicContact CG1-CD2 4Å
863	L	95.5	Very high	92.1	Very high	72 Å²	72	60.3 Å²	60.3	38%	0.377	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	119	174.6	-80.1	166.1	0	0	0	108.7	L800 M840 E842	L800-L863 HydrophobicContact CD1-CD2 4.25Å; M840-L863 HydrophobicContact CE-CB 3.8Å; M840-L863 HydrophobicContact CE-CD2 4.13Å; M840-L863 HydrophobicContact CE-CG 4.41Å; M840-L863 HydrophobicContact SD-CD2 4.35Å; E842-L863 HydrophobicContact CB-CD2 3.96Å; E842-L863 HydrophobicContact CG-CD2 4.2Å
864	I	96.1	Very high	93	Very high	9 Å²	9	58.9 Å²	58.9	5%	0.046	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	113.9	-178.6	-45.2	-179	0	0	0	109.2	L763 M840 L841 I843 I862 A869 Y878	L763-I864 HydrophobicContact CD1-CD1 3.99Å; L763-I864 HydrophobicContact CD1-CG2 4.32Å; M840-I864 CarbonylContact C-O 3.59Å; M840-I864 WeakPolarHBondContact CA-O 3.27Å; M840-I864 WeakPolarHBondContact CB-O 3.23Å; L841-I864 HydrophobicContact CB-CB 4.41Å; L841-I864 PolarHBondContact N-O 2.99Å; L841-I864 PolarHBondContact O-N 2.97Å; I843-I864 HydrophobicContact CD1-CD1 3.93Å; I862-I864 HydrophobicContact CG2-CD1 4.08Å; I862-I864 HydrophobicContact CG2-CG1 3.67Å; I864-A869 HydrophobicContact CG2-CB 3.81Å; I864-Y878 HydrophobicContact CD1-CD1 4.2Å; I864-Y878 HydrophobicContact CD1-CD2 4.39Å; I864-Y878 HydrophobicContact CD1-CE1 3.81Å; I864-Y878 HydrophobicContact CD1-CE2 4Å; I864-Y878 HydrophobicContact CD1-CG 4.49Å; I864-Y878 HydrophobicContact CG1-CD1 4.48Å; I864-Y878 HydrophobicContact CG1-CE1 4.2Å
865	E	95.9	Very high	93.8	Very high	74 Å²	74	56.9 Å²	56.9	35%	0.346	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	130.4	170.2	-66.4	173.3	174.6	0	0	110.1	M840 E867 T868 A869 L890	M840-E865 HydrophobicContact CE-CG 3.81Å; M840-E865 HydrophobicContact CG-CG 4.45Å; E865-E867 VanDerWaalsContact C-N 3.27Å; E865-E867 PolarHBondContact O-N 3Å; E865-T868 WeakPolarHBondContact CB-OG1 3.46Å; E865-T868 PolarHBondContact O-N 2.81Å; E865-T868 PolarHBondContact OE2-OG1 3.08Å; E865-A869 VanDerWaalsContact O-CB 3.31Å; E865-A869 WeakPolarHBondContact O-CB 3.31Å; E865-A869 PolarHBondContact O-N 2.88Å; E865-L890 HydrophobicContact CG-CD2 3.98Å; E865-L890 VanDerWaalsContact OE1-CD2 3.24Å; E865-L890 WeakPolarHBondContact OE1-CD2 3.41Å
866	L	95.8	Very high	94.3	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-20.9	-177.6	-58.8	-177.4	0	0	0	113.2	L772 F799 F836 R839 L841	L772-L866 HydrophobicContact CD2-CD1 4.28Å; L772-L866 HydrophobicContact CD2-CD2 3.67Å; F799-L866 HydrophobicContact CE2-CD1 3.51Å; F799-L866 HydrophobicContact CZ-CD1 3.76Å; F836-L866 HydrophobicContact CB-CB 3.89Å; F836-L866 HydrophobicContact CD1-CB 4.22Å; F836-L866 HydrophobicContact CD1-CD1 4.34Å; F836-L866 HydrophobicContact CD2-CB 3.92Å; F836-L866 WeakPolarHBondContact CD2-O 3.46Å; F836-L866 HydrophobicContact CG-CB 3.75Å; R839-L866 HydrophobicContact CB-CD1 3.58Å; R839-L866 HydrophobicContact CB-CG 4.21Å; R839-L866 WeakPolarHBondContact O-CG 3.4Å; R839-L866 PolarHBondContact O-N 2.85Å; R839-L866 VanDerWaalsContact O-N 3.14Å; L841-L866 HydrophobicContact CB-CD2 4.43Å
867	E	94.7	Very high	94.5	Very high	74 Å²	74	54 Å²	54	35%	0.346	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-35.5	177.2	177.5	150.8	-137.6	0	0	112.7	F836 R837 E865	F836-E867 HydrophobicContact CB-CB 4.48Å; F836-E867 PolarHBondContact O-N 3.3Å; R837-E867 WeakPolarHBondContact CB-OE2 3.42Å; R837-E867 WeakPolarHBondContact CD-OE2 3.23Å; R837-E867 WeakPolarHBondContact CG-OE2 3.44Å; R837-E867 IonicContact CZ-OE1 3.71Å; R837-E867 IonicContact NE-OE1 3.3Å; R837-E867 IonicContact NH1-OE1 3.77Å; R837-E867 PolarHBondContact NH1-OE1 2.94Å; R837-E867 IonicContact NH1-OE2 2.65Å; R837-E867 IonicContact NH2-OE1 2.74Å; E865-E867 VanDerWaalsContact C-N 3.27Å; E865-E867 PolarHBondContact O-N 3Å
868	T	93.5	Very high	94.7	Very high	98 Å²	98	51.8 Å²	51.8	60%	0.601	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-4.8	-177.9	54.3	0	0	0	0	113.7	E865	E865-T868 WeakPolarHBondContact CB-OG1 3.46Å; E865-T868 PolarHBondContact O-N 2.81Å; E865-T868 PolarHBondContact OE2-OG1 3.08Å
869	A	92.8	Very high	94.8	Very high	18 Å²	18	56.2 Å²	56.2	15%	0.149	28%	0.279	C	S	.	.			trans	-57.1	138.7	177.1	0	0	0	0	0	113.1	I864 E865 L871	I864-A869 HydrophobicContact CG2-CB 3.81Å; E865-A869 VanDerWaalsContact O-CB 3.31Å; E865-A869 WeakPolarHBondContact O-CB 3.31Å; E865-A869 PolarHBondContact O-N 2.88Å; A869-L871 HydrophobicContact CB-CD1 4.33Å; A869-L871 HydrophobicContact CB-CD2 3.95Å; A869-L871 HydrophobicContact CB-CG 3.88Å; A869-L871 PolarHBondContact O-N 2.96Å
870	L	92.8	Very high	94.9	Very high	87 Å²	87	56.2 Å²	56.2	46%	0.455	28%	0.279	S	S	.	.			trans	-73.2	116.7	163.6	-57.5	175.2	0	0	0	107.4	L763 H876	L763-L870 WeakPolarHBondContact CB-O 3.21Å; L870-H876 VanDerWaalsContact CD1-CD2 3.43Å; L870-H876 WeakPolarHBondContact CD1-CD2 3.36Å; L870-H876 WeakPolarHBondContact CD1-NE2 3.42Å
871	L	94.7	Very high	94.7	Very high	43 Å²	43	61.4 Å²	61.4	23%	0.225	30%	0.303	C	S	.	.			trans	-127.3	33.5	-171.1	-64.2	174.9	0	0	0	111	L763 L772 F836 A869	L763-L871 HydrophobicContact CB-CD2 3.78Å; L763-L871 HydrophobicContact CD1-CD2 4.38Å; L763-L871 CarbonylContact O-C 3.27Å; L763-L871 WeakPolarHBondContact O-CA 3.36Å; L772-L871 HydrophobicContact CD1-CD2 3.73Å; F836-L871 HydrophobicContact CD2-CD1 4.28Å; F836-L871 HydrophobicContact CE2-CD1 3.47Å; F836-L871 VanDerWaalsContact CE2-CD1 3.47Å; F836-L871 HydrophobicContact CZ-CD1 4.24Å; A869-L871 HydrophobicContact CB-CD1 4.33Å; A869-L871 HydrophobicContact CB-CD2 3.95Å; A869-L871 HydrophobicContact CB-CG 3.88Å; A869-L871 PolarHBondContact O-N 2.96Å
872	D	93	Very high	94	Very high	83 Å²	83	64.9 Å²	64.9	44%	0.444	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-3.9	-173.4	42.8	28.7	0	0	0	113.9	E874 H876	D872-E874 VanDerWaalsContact C-N 3.34Å; D872-E874 PolarHBondContact OD1-N 3.22Å; D872-H876 IonicContact OD1-CE1 3.76Å; D872-H876 PolarHBondContact OD1-CE1 2.78Å; D872-H876 IonicContact OD1-ND1 3.96Å; D872-H876 IonicContact OD2-CE1 2.76Å; D872-H876 PolarHBondContact OD2-CE1 3.24Å; D872-H876 VanDerWaalsContact OD2-CE1 3.3Å
873	D	95.6	Very high	92.5	Very high	52 Å²	52	69.7 Å²	69.7	28%	0.278	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	66.3	23.7	-166.6	-156.1	40.5	0	0	0	114.4	K762 L763 W764	K762-D873 WeakPolarHBondContact CD-O 3.44Å; K762-D873 WeakPolarHBondContact CE-O 3.34Å; K762-D873 WeakPolarHBondContact CE-OD1 3.12Å; K762-D873 VanDerWaalsContact CE-OD2 3.25Å; K762-D873 WeakPolarHBondContact CE-OD2 3.44Å; K762-D873 WeakPolarHBondContact CG-O 3.44Å; K762-D873 WeakPolarHBondContact CG-OD1 3.46Å; K762-D873 PolarHBondContact NZ-O 3.37Å; K762-D873 IonicContact NZ-OD1 3.15Å; K762-D873 PolarHBondContact NZ-OD1 3.3Å; K762-D873 IonicContact NZ-OD2 2.81Å; K762-D873 PolarHBondContact NZ-OD2 2.98Å; L763-D873 WeakPolarHBondContact O-CA 3.43Å; L763-D873 PolarHBondContact O-N 2.8Å; W764-D873 HydrophobicContact CB-CB 3.79Å; W764-D873 HydrophobicContact CG-CB 4.28Å
874	E	96	Very high	90.3	Very high	110 Å²	110	70.7 Å²	70.7	51%	0.514	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	153.1	174.7	-71.7	-56.3	141.7	0	0	113.8	K762 D872 H876	K762-E874 WeakPolarHBondContact CA-O 3.33Å; D872-E874 VanDerWaalsContact C-N 3.34Å; D872-E874 PolarHBondContact OD1-N 3.22Å; E874-H876 PolarHBondContact O-N 2.98Å; E874-H876 PolarHBondContact O-ND1 2.83Å
875	P	96.5	Very high	87.8	Confident	59 Å²	59	79.3 Å²	79.3	38%	0.383	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	97.4	-172.4	33.9	-34.2	0	0	0	112.5	K762 L777	K762-P875 HydrophobicContact CB-CB 4.35Å; L777-P875 HydrophobicContact CD1-CB 3.55Å
876	H	96.6	Very high	85.1	Confident	51 Å²	51	78.3 Å²	78.3	24%	0.236	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	135.3	-176.5	-73.9	89.5	0	0	0	112.7	S760 V761 L870 D872 E874 Y878	S760-H876 WeakPolarHBondContact CA-O 3.42Å; V761-H876 PolarHBondContact N-O 3.16Å; V761-H876 PolarHBondContact O-N 2.9Å; L870-H876 VanDerWaalsContact CD1-CD2 3.43Å; L870-H876 WeakPolarHBondContact CD1-CD2 3.36Å; L870-H876 WeakPolarHBondContact CD1-NE2 3.42Å; D872-H876 IonicContact OD1-CE1 3.76Å; D872-H876 PolarHBondContact OD1-CE1 2.78Å; D872-H876 IonicContact OD1-ND1 3.96Å; D872-H876 IonicContact OD2-CE1 2.76Å; D872-H876 PolarHBondContact OD2-CE1 3.24Å; D872-H876 VanDerWaalsContact OD2-CE1 3.3Å; E874-H876 PolarHBondContact O-N 2.98Å; E874-H876 PolarHBondContact O-ND1 2.83Å; H876-Y878 HydrophobicContact CB-CD2 4.37Å; H876-Y878 HydrophobicContact CB-CE2 3.58Å; H876-Y878 WeakPolarHBondContact O-CD2 3.18Å
877	W	96.4	Very high	82.4	Confident	116 Å²	116	80.5 Å²	80.5	44%	0.439	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	115.5	174.8	-73.4	103.4	0	0	0	110.9	Q758 Q778 T780	Q758-W877 HydrophobicContact CB-CE3 3.79Å; Q758-W877 HydrophobicContact CB-CZ3 4.18Å; Q778-W877 HydrophobicContact CG-CH2 3.84Å; Q778-W877 HydrophobicContact CG-CZ2 4.43Å; T780-W877 HydrophobicContact CG2-CH2 3.7Å; T780-W877 HydrophobicContact CG2-CZ3 4.15Å
878	Y	95.9	Very high	79.9	Confident	44 Å²	44	83.6 Å²	83.6	17%	0.173	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.3	174.4	-62.1	-89.2	0	0	0	109.2	L759 V761 I862 I864 H876 L880	L759-Y878 PolarHBondContact N-O 3.15Å; L759-Y878 PolarHBondContact O-N 2.89Å; V761-Y878 HydrophobicContact CB-CD2 4.06Å; V761-Y878 HydrophobicContact CB-CE2 3.99Å; V761-Y878 HydrophobicContact CG2-CD2 4.2Å; I862-Y878 HydrophobicContact CG2-CD1 4.02Å; I862-Y878 HydrophobicContact CG2-CG 4.03Å; I864-Y878 HydrophobicContact CD1-CD1 4.2Å; I864-Y878 HydrophobicContact CD1-CD2 4.39Å; I864-Y878 HydrophobicContact CD1-CE1 3.81Å; I864-Y878 HydrophobicContact CD1-CE2 4Å; I864-Y878 HydrophobicContact CD1-CG 4.49Å; I864-Y878 HydrophobicContact CG1-CD1 4.48Å; I864-Y878 HydrophobicContact CG1-CE1 4.2Å; H876-Y878 HydrophobicContact CB-CD2 4.37Å; H876-Y878 HydrophobicContact CB-CE2 3.58Å; H876-Y878 WeakPolarHBondContact O-CD2 3.18Å; Y878-L880 PolarHBondContact O-N 2.77Å
879	K	94.7	Very high	77.1	Confident	154 Å²	154	83.6 Å²	83.6	67%	0.67	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	130.2	169.6	-63.8	-178.3	-179.9	-178.9	0	108.7	Q758	Q758-K879 HydrophobicContact CG-CG 4.28Å
880	L	94	Very high	74.6	Confident	7 Å²	7	86.4 Å²	86.4	4%	0.037	44%	0.443	C	S	.	.			trans	-64.8	154.3	169.6	-66.7	168.5	0	0	0	109.6	P756 G757 L782 V845 I862 Y878	P756-L880 HydrophobicContact CB-CB 3.84Å; P756-L880 HydrophobicContact CG-CB 4.4Å; P756-L880 WeakPolarHBondContact CG-O 3.24Å; G757-L880 WeakPolarHBondContact O-CB 3.14Å; G757-L880 WeakPolarHBondContact O-CD1 3.5Å; G757-L880 WeakPolarHBondContact O-CG 3.39Å; G757-L880 PolarHBondContact O-N 2.63Å; L782-L880 HydrophobicContact CD2-CD1 3.65Å; V845-L880 HydrophobicContact CB-CD1 4.31Å; V845-L880 HydrophobicContact CB-CD2 4.19Å; V845-L880 HydrophobicContact CG2-CD1 4.16Å; V845-L880 HydrophobicContact CG2-CD2 3.5Å; V845-L880 HydrophobicContact CG2-CG 4.49Å; I862-L880 HydrophobicContact CD1-CD2 3.58Å; I862-L880 HydrophobicContact CD1-CG 4.34Å; I862-L880 HydrophobicContact CG1-CD2 4Å; Y878-L880 PolarHBondContact O-N 2.77Å
881	Q	88.9	Confident	72	Confident	110 Å²	110	87.4 Å²	87.4	51%	0.514	46%	0.455	S	S	.	.	B	Isolated β-bridge	trans	-121.8	143.2	174.6	-58.9	-177.4	13.1	0	0	108.8	G860 E861	G860-Q881 CarbonylContact C-O 3.49Å; G860-Q881 WeakPolarHBondContact CA-O 3.18Å; E861-Q881 PolarHBondContact N-O 3.19Å; E861-Q881 PolarHBondContact O-N 2.81Å
882	T	79.5	Confident	69.4	Low	94 Å²	94	92.5 Å²	92.5	58%	0.577	48%	0.477	S	S	*	.			trans	-70	133.3	166.5	43.8	0	0	0	0	108.7	P756 D884	P756-T882 HydrophobicContact CG-CG2 4.25Å; T882-D884 VanDerWaalsContact C-N 3.32Å; T882-D884 PolarHBondContact O-N 3.49Å
883	H	64.2	Low	66.5	Low	108 Å²	108	94.1 Å²	94.1	50%	0.5	49%	0.492	S	S	.	.			trans	-69.2	90.8	178.1	174.9	-70.3	0	0	0	109.8	F858 E861	F858-H883 HydrophobicContact CE1-CB 3.72Å; F858-H883 HydrophobicContact CE2-CB 4.44Å; F858-H883 HydrophobicContact CZ-CB 3.62Å; E861-H883 WeakPolarHBondContact OE1-CA 3.28Å; E861-H883 WeakPolarHBondContact OE1-CB 3.24Å; E861-H883 IonicContact OE1-CD2 3.33Å; E861-H883 PolarHBondContact OE1-CD2 2.8Å; E861-H883 IonicContact OE1-CG 2.93Å; E861-H883 IonicContact OE2-CD2 2.61Å
884	D	48.8	Very low	63.5	Low	92 Å²	92	95 Å²	95	49%	0.492	50%	0.503	S	S	.	.			trans	-81.4	127.6	169.2	-142	33.9	0	0	0	107.4	T882 S886 S887	T882-D884 VanDerWaalsContact C-N 3.32Å; T882-D884 PolarHBondContact O-N 3.49Å; D884-S886 VanDerWaalsContact CG-OG 3.25Å; D884-S886 PolarHBondContact O-N 3.07Å; D884-S886 VanDerWaalsContact OD2-CB 3.23Å; D884-S886 WeakPolarHBondContact OD2-CB 3.28Å; D884-S886 PolarHBondContact OD2-OG 3.39Å; D884-S887 PolarHBondContact O-N 2.76Å; D884-S887 VanDerWaalsContact O-N 3.08Å; D884-S887 PolarHBondContact O-OG 2.83Å
885	E	43.6	Very low	61.3	Low	190 Å²	190	94.6 Å²	94.6	89%	0.888	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-8.9	176.4	-60.4	-158.9	99.1	0	0	112.2
886	S	38.5	Very low	58.8	Low	54 Å²	54	100.8 Å²	100.8	38%	0.378	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-27	176	-26.5	0	0	0	0	115.4	R664 D884 L888	R664-S886 PolarHBondContact NH1-O 2.8Å; D884-S886 VanDerWaalsContact CG-OG 3.25Å; D884-S886 PolarHBondContact O-N 3.07Å; D884-S886 VanDerWaalsContact OD2-CB 3.23Å; D884-S886 WeakPolarHBondContact OD2-CB 3.28Å; D884-S886 PolarHBondContact OD2-OG 3.39Å; S886-L888 PolarHBondContact O-N 2.76Å
887	S	39.5	Very low	56.1	Low	47 Å²	47	105.2 Å²	105.2	33%	0.329	55%	0.553	S	S	.	*	S	Bend	trans	-86.8	105.7	-165.1	38.9	0	0	0	0	113.2	D884	D884-S887 PolarHBondContact O-N 2.76Å; D884-S887 VanDerWaalsContact O-N 3.08Å; D884-S887 PolarHBondContact O-OG 2.83Å
888	L	41.7	Very low	53.5	Low	138 Å²	138	104.9 Å²	104.9	72%	0.723	57%	0.566	S	S	*	*			trans	56.2	91.5	160.5	-52.9	-176.7	0	0	0	117.6	S886	S886-L888 PolarHBondContact O-N 2.76Å
889	P	35.4	Very low	50.9	Low	99 Å²	99	112.5 Å²	112.5	64%	0.643	59%	0.594	S	S	*	*	P	Polyproline II helix		-59.5	140.1	129	31.9	-32.4	0	0	0	109.1
890	L	39.9	Very low	48.4	Very low	77 Å²	77	116.4 Å²	116.4	40%	0.403	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-51.8	143.5	169.9	-81.6	176.3	0	0	0	110.7	M840 E865 Q892	M840-L890 HydrophobicContact CE-CD2 3.72Å; M840-L890 HydrophobicContact CE-CG 4.27Å; M840-L890 HydrophobicContact CG-CD1 4.03Å; M840-L890 HydrophobicContact CG-CD2 4.42Å; M840-L890 HydrophobicContact SD-CD1 3.66Å; M840-L890 HydrophobicContact SD-CD2 3.71Å; M840-L890 HydrophobicContact SD-CG 3.64Å; E865-L890 HydrophobicContact CG-CD2 3.98Å; E865-L890 VanDerWaalsContact OE1-CD2 3.24Å; E865-L890 WeakPolarHBondContact OE1-CD2 3.41Å; L890-Q892 PolarHBondContact O-N 2.89Å; L890-Q892 VanDerWaalsContact O-N 3.09Å
891	P	37.7	Very low	45.6	Very low	108 Å²	108	123.6 Å²	123.6	70%	0.701	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-57.8	116.5	160.3	-15.5	29.2	0	0	0	108
892	Q	41.4	Very low	43.3	Very low	150 Å²	150	126.3 Å²	126.3	70%	0.701	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-63.8	130.7	164.5	-160.9	-175.4	53.7	0	0	106.5	L890 S894	L890-Q892 PolarHBondContact O-N 2.89Å; L890-Q892 VanDerWaalsContact O-N 3.09Å; Q892-S894 PolarHBondContact O-N 2.98Å
893	P	32	Very low	41.1	Very low	116 Å²	116	129.1 Å²	129.1	75%	0.753	66%	0.66	S	S	*	*			trans	-56.3	114	177.6	21.9	-33.2	0	0	0	108.7	P895	P893-P895 WeakPolarHBondContact O-CD 3.5Å
894	S	31.8	Very low	39.7	Very low	72 Å²	72	126.6 Å²	126.6	50%	0.503	66%	0.664	S	S	.	*			trans	-51.9	122.9	-161.9	-63.5	0	0	0	0	112	Q892 F896 M897	Q892-S894 PolarHBondContact O-N 2.98Å; S894-F896 PolarHBondContact O-N 3.39Å; S894-M897 PolarHBondContact O-N 2.99Å
895	P	50.5	Low	39.1	Very low	100 Å²	100	130.7 Å²	130.7	65%	0.649	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-14.7	172	-25.7	35.1	0	0	0	113.7	P893	P893-P895 WeakPolarHBondContact O-CD 3.5Å
896	F	43.2	Very low	38.8	Very low	190 Å²	190	126.2 Å²	126.2	83%	0.833	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	25.2	178.3	-62.9	-82.7	0	0	0	113.4	S894 P898	S894-F896 PolarHBondContact O-N 3.39Å; F896-P898 WeakPolarHBondContact O-CD 3.35Å
897	M	41.3	Very low	38.8	Very low	143 Å²	143	126.9 Å²	126.9	70%	0.704	67%	0.674	S	S	*	*			trans	-89.6	104.7	155.1	-90.9	-73.3	157.2	0	0	108.1	S894 R899	S894-M897 PolarHBondContact O-N 2.99Å; M897-R899 PolarHBondContact O-N 3.03Å
898	P	42.2	Very low	38.6	Very low	110 Å²	110	129 Å²	129	71%	0.714	69%	0.689	S	S	*	*			trans	-62.4	108.8	164.2	-9.5	25.6	0	0	0	105.8	F896 R900	F896-P898 WeakPolarHBondContact O-CD 3.35Å; P898-R900 PolarHBondContact O-N 3.14Å
899	R	40.6	Very low	38.5	Very low	204 Å²	204	128 Å²	128	77%	0.77	68%	0.679	S	S	*	*			trans	-54.9	110	175.3	-168.6	-176.6	-150.7	154.8	5.9	106.5	M897 H901	M897-R899 PolarHBondContact O-N 3.03Å; R899-H901 VanDerWaalsContact C-N 3.3Å; R899-H901 PolarHBondContact O-N 3.02Å
900	R	40.8	Very low	39	Very low	235 Å²	235	132.2 Å²	132.2	89%	0.887	69%	0.687	S	S	*	*			trans	-57.5	102.3	171.6	-74.6	-169.8	-177.1	-168	2.1	106.1	P898 I902	P898-R900 PolarHBondContact O-N 3.14Å; R900-I902 PolarHBondContact O-N 3.16Å; R900-I902 VanDerWaalsContact O-N 3.1Å
901	H	37.2	Very low	39	Very low	158 Å²	158	135.4 Å²	135.4	73%	0.731	70%	0.704	S	S	*	*			trans	-60.4	116.7	167.7	-104	-105.3	0	0	0	105.4	R899 H903	R899-H901 VanDerWaalsContact C-N 3.3Å; R899-H901 PolarHBondContact O-N 3.02Å; H901-H903 HydrophobicContact CB-CB 4.4Å; H901-H903 PolarHBondContact O-N 3.41Å
902	I	39.3	Very low	39.1	Very low	167 Å²	167	137.6 Å²	137.6	86%	0.856	71%	0.705	S	S	*	*			trans	-69.2	88.7	161.9	-63	176	0	0	0	104	R900	R900-I902 PolarHBondContact O-N 3.16Å; R900-I902 VanDerWaalsContact O-N 3.1Å
903	H	34.5	Very low	39.2	Very low	153 Å²	153	140.9 Å²	140.9	71%	0.708	71%	0.711	S	S	*	*			trans	-102.6	71.9	-179.9	-173.8	23.3	0	0	0	108.4	H901	H901-H903 HydrophobicContact CB-CB 4.4Å; H901-H903 PolarHBondContact O-N 3.41Å
904	G	34.2	Very low	39.5	Very low	55 Å²	55	140.1 Å²	140.1	57%	0.567	71%	0.708	S	S	*	*			trans	-93.9	136.2	138.5	0	0	0	0	0	107
905	E	36.1	Very low	39.8	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	72%	0.717	S	S	*	*	S	Bend	cis	-146.1	157.3	-1.2	-67.2	170.8	98.9	0	0	109.3
906	S	38	Very low	39.2	Very low	95 Å²	95	149.3 Å²	149.3	66%	0.664	73%	0.725	S	S	*	*			trans	56.7	148.2	153.2	-145.6	0	0	0	0	121.3
907	S	36.8	Very low	39	Very low	68 Å²	68	148.2 Å²	148.2	48%	0.476	73%	0.726	S	S	.	*			cis	-153.3	144.9	-43.9	-172.8	0	0	0	0	110.6
908	S	35.5	Very low	38.8	Very low	93 Å²	93	145.8 Å²	145.8	65%	0.65	72%	0.723	S	S	*	*			trans	4.6	136.3	147.9	-37.4	0	0	0	0	120.3
909	K	41.4	Very low	38.5	Very low	116 Å²	116	147.4 Å²	147.4	50%	0.504	73%	0.726	S	S	.	*				177.3	129.3	104.1	-92.7	149.2	-170.2	174.9	0	114.1	L565 E566	L565-K909 PolarHBondContact O-NZ 3.4Å; E566-K909 PolarHBondContact O-NZ 3.12Å
910	K	44.8	Very low	38.3	Very low	188 Å²	188	142.4 Å²	142.4	82%	0.817	72%	0.722	S	S	*	*			trans	61.6	138.7	147.7	-57.4	169.7	-176.1	175.5	0	116.5
911	L	40.6	Very low	38.2	Very low	144 Å²	144	138.8 Å²	138.8	75%	0.754	72%	0.72	S	S	*	*			cis	-132.9	133.5	16.1	-68.2	165.1	0	0	0	108.2
912	Q	40.1	Very low	38.4	Very low	154 Å²	154	138.4 Å²	138.4	72%	0.72	72%	0.723	S	S	*	*				94.3	128.4	60.8	-170.5	-178.4	0.3	0	0	113.2
913	R	41.6	Very low	38.4	Very low	218 Å²	218	134.6 Å²	134.6	82%	0.823	71%	0.71	S	S	*	*			trans	65.1	121.8	-179.3	-87.7	174.1	164	139.6	-3	115.4
914	S	38.3	Very low	39.1	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	71%	0.714	S	S	*	*			cis	72.7	135.3	26.2	101.2	0	0	0	0	114.7
915	Q	38.7	Very low	39.7	Very low	150 Å²	150	141.5 Å²	141.5	70%	0.701	73%	0.725	S	S	*	*			cis	-166.3	139.9	-5.6	-138.7	-170.1	13.3	0	0	111.2
916	R	37.5	Very low	40.2	Very low	216 Å²	216	142.3 Å²	142.3	82%	0.815	73%	0.729	S	S	*	*			trans	64.1	170.7	169.1	-48	-169.9	-169.2	-130.2	1.3	112.7
917	I	40	Very low	41	Very low	166 Å²	166	143.7 Å²	143.7	85%	0.851	73%	0.734	S	S	*	*			cis	-133.9	169.8	27.4	-66.1	155.5	0	0	0	110.7
918	S	37.4	Very low	41.5	Very low	92 Å²	92	147.6 Å²	147.6	64%	0.643	75%	0.749	S	S	*	*			trans	-81	174.3	-176.4	-49	0	0	0	0	115.6
919	D	34.7	Very low	41.9	Very low	144 Å²	144	150.4 Å²	150.4	77%	0.77	76%	0.757	S	S	*	*			trans	86.4	113.4	145	-60.1	-42.9	0	0	0	121.9
920	S	36.4	Very low	42.1	Very low	99 Å²	99	147.9 Å²	147.9	69%	0.692	76%	0.764	S	S	*	*			trans	73.4	136.6	134.2	-51.3	0	0	0	0	122.1
921	D	39.1	Very low	41.9	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	77%	0.769	S	S	*	*			trans	60.3	161.2	170.3	-51.1	-42.2	0	0	0	114.4
922	I	42.5	Very low	42	Very low	151 Å²	151	143.7 Å²	143.7	77%	0.774	76%	0.764	S	S	*	*			cis	-145.1	173.3	17.2	-176.9	54.5	0	0	0	109.4
923	S	38.8	Very low	42.1	Very low	86 Å²	86	143 Å²	143	60%	0.601	77%	0.77	S	S	*	*			trans	-67.2	152.6	167.3	52.6	0	0	0	0	113.2
924	D	49.4	Very low	42.3	Very low	145 Å²	145	138.7 Å²	138.7	78%	0.775	77%	0.768	S	S	*	*				-166.7	-176.9	100.9	-135.4	-37.1	0	0	0	113.1
925	Y	46.6	Very low	42.7	Very low	208 Å²	208	139.3 Å²	139.3	82%	0.816	77%	0.77	S	S	*	*			trans	-64.6	146.3	-179.5	-89.6	-117.3	0	0	0	115.2
926	E	46.9	Very low	43.1	Very low	196 Å²	196	137.6 Å²	137.6	92%	0.916	77%	0.772	S	S	*	*			trans	-77.7	113	153.6	-76.6	-179.9	97	0	0	110
927	V	53.9	Low	43.5	Very low	125 Å²	125	134.3 Å²	134.3	76%	0.758	78%	0.775	S	S	*	*			trans	-141.2	93.7	156	-175.7	0	0	0	0	109.6
928	D	46.5	Very low	43.5	Very low	150 Å²	150	129.3 Å²	129.3	80%	0.802	77%	0.765	S	S	*	*			trans	49.8	157.1	145.1	-124.8	-10.4	0	0	0	123.9
929	D	44	Very low	43.5	Very low	152 Å²	152	135.5 Å²	135.5	81%	0.813	78%	0.775	S	S	*	*			trans	56.6	112	163.6	-88	-35.6	0	0	0	121.8
930	G	46.4	Very low	43.7	Very low	63 Å²	63	139.4 Å²	139.4	65%	0.649	78%	0.779	S	S	*	*				113.5	99.9	122.4	0	0	0	0	0	120
931	I	40.4	Very low	43.6	Very low	179 Å²	179	139.3 Å²	139.3	92%	0.918	79%	0.785	S	S	*	*			trans	37.5	120.7	134.8	-47.1	158.8	0	0	0	117.5
932	G	42.7	Very low	43.3	Very low	64 Å²	64	137.6 Å²	137.6	66%	0.66	79%	0.785	S	S	*	*			cis	152.3	172.6	7	0	0	0	0	0	111.1
933	V	41.5	Very low	43.1	Very low	139 Å²	139	135.1 Å²	135.1	84%	0.842	79%	0.787	S	S	*	*			trans	75.8	97	164.9	-168.9	0	0	0	0	120
934	V	45.8	Very low	43.2	Very low	129 Å²	129	141.1 Å²	141.1	78%	0.782	80%	0.796	S	S	*	*			trans	58.5	113.6	132.9	-173.6	0	0	0	0	122.5
935	P	46.7	Very low	42.8	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	79%	0.792	S	S	*	*			trans	-99.2	-163.2	156.4	42.6	-35.4	0	0	0	111.1
936	P	48.8	Very low	42.5	Very low	114 Å²	114	134.7 Å²	134.7	74%	0.74	78%	0.777	S	S	*	*			cis	-140.3	-166	2.2	45.4	-26.4	0	0	0	115.6
937	V	45.1	Very low	42.2	Very low	147 Å²	147	134.4 Å²	134.4	89%	0.891	77%	0.773	S	S	*	*			trans	174.5	141.3	140.5	143.7	0	0	0	0	113.2
938	G	40.4	Very low	41.5	Very low	61 Å²	61	132.5 Å²	132.5	63%	0.629	77%	0.77	S	S	*	*			trans	117.2	93.1	139.6	0	0	0	0	0	123.9
939	Y	37.5	Very low	41.2	Very low	221 Å²	221	131.3 Å²	131.3	87%	0.867	77%	0.768	S	S	*	*			trans	57.9	134.2	134.8	-71.4	-73	0	0	0	127.2
940	R	39.2	Very low	41.1	Very low	226 Å²	226	129.6 Å²	129.6	85%	0.853	76%	0.764	S	S	*	*			trans	76.5	100.4	140.9	-72.2	-178.9	-174.7	-121.8	3.7	124.1
941	A	32.8	Very low	40.8	Very low	98 Å²	98	133.5 Å²	133.5	81%	0.81	77%	0.769	S	S	*	*				54	122	113.1	0	0	0	0	0	125.2
942	S	34.1	Very low	41	Very low	123 Å²	123	130.4 Å²	130.4	86%	0.86	76%	0.759	S	S	*	*			trans	70.9	94.9	130.6	-179.1	0	0	0	0	122.9
943	A	37.8	Very low	41.2	Very low	98 Å²	98	133.5 Å²	133.5	81%	0.81	76%	0.764	S	S	*	*			trans	179.9	170.7	140.1	0	0	0	0	0	109.6
944	R	40.7	Very low	41.4	Very low	212 Å²	212	132.8 Å²	132.8	80%	0.8	76%	0.763	S	S	*	*			cis	-179.9	146.7	-40.3	-166.9	-178.2	-172.4	-136	16.2	106.3
945	E	40.7	Very low	41.4	Very low	148 Å²	148	133.6 Å²	133.6	69%	0.692	76%	0.758	S	S	*	*			trans	66.2	163.9	171.5	-73.3	157.2	88.2	0	0	115.6
946	S	39.9	Very low	41.1	Very low	71 Å²	71	136 Å²	136	50%	0.497	76%	0.759	S	S	.	*			cis	-160.5	147.9	15.3	-142.3	0	0	0	0	114.2
947	K	41.5	Very low	40.8	Very low	190 Å²	190	136.3 Å²	136.3	83%	0.826	75%	0.751	S	S	*	*			trans	67.3	141.1	153.4	-62.5	144.9	-169.4	153.6	0	118.6
948	A	38.1	Very low	40.6	Very low	84 Å²	84	139.1 Å²	139.1	69%	0.694	75%	0.745	S	S	*	*			cis	-157.2	-152.9	-11.4	0	0	0	0	0	108.1
949	T	41	Very low	40.3	Very low	125 Å²	125	141.9 Å²	141.9	77%	0.767	75%	0.75	S	S	*	*			cis	-163.9	172.6	11.1	-19.6	0	0	0	0	111.3
950	T	41.9	Very low	40.5	Very low	117 Å²	117	137.6 Å²	137.6	72%	0.718	75%	0.747	S	S	*	*			trans	4.4	142	142.4	-63.7	0	0	0	0	120
951	L	40.8	Very low	40.4	Very low	145 Å²	145	135.7 Å²	135.7	76%	0.759	75%	0.748	S	S	*	*			cis	-166	-153.5	-15.4	-94.2	-170.5	0	0	0	106.9
952	T	43.3	Very low	40.7	Very low	114 Å²	114	139.3 Å²	139.3	70%	0.699	75%	0.747	S	S	*	*				-175.2	175.6	-89.6	-66.2	0	0	0	0	110.6
953	V	46.6	Very low	40.9	Very low	128 Å²	128	144.2 Å²	144.2	78%	0.776	75%	0.747	S	S	*	*			trans	121.9	130.5	155.5	174.5	0	0	0	0	112.5
954	P	45.6	Very low	40.8	Very low	125 Å²	125	144.2 Å²	144.2	81%	0.812	74%	0.741	S	S	*	*			cis	-111.8	-150.9	10.1	43.7	-34.5	0	0	0	115.1
955	E	46.5	Very low	40.5	Very low	146 Å²	146	145.1 Å²	145.1	68%	0.682	75%	0.745	S	S	*	*			trans	-146.1	158.2	178.2	-160.9	-79.4	121.1	0	0	109.8	Q957	E955-Q957 WeakPolarHBondContact OE1-CA 3.21Å
956	Q	41.8	Very low	40.1	Very low	163 Å²	163	143.1 Å²	143.1	76%	0.762	75%	0.747	S	S	*	*			trans	165.4	134.2	150.5	-93.3	-174.3	-0.3	0	0	110.7
957	Q	41.5	Very low	40	Very low	121 Å²	121	145.9 Å²	145.9	57%	0.565	76%	0.761	S	S	*	*			cis	-162.7	128.2	-7.5	-172.2	168.4	-70.4	0	0	113.6	E955	E955-Q957 WeakPolarHBondContact OE1-CA 3.21Å
958	R	41.5	Very low	40	Very low	205 Å²	205	142.4 Å²	142.4	77%	0.774	76%	0.76	S	S	*	*			trans	62.3	135.9	163.2	-66.3	169.9	-173.5	-160.7	-0.9	118.6
959	T	34.3	Very low	40.3	Very low	119 Å²	119	143 Å²	143	73%	0.73	76%	0.757	S	S	*	*			cis	85.3	125.2	12.7	83.1	0	0	0	0	119.7
960	T	41.9	Very low	40.3	Very low	132 Å²	132	145.6 Å²	145.6	81%	0.81	76%	0.76	S	S	*	*				175.5	154	124.6	28.8	0	0	0	0	113.2
961	H	35.6	Very low	40.4	Very low	186 Å²	186	151 Å²	151	86%	0.861	77%	0.768	S	S	*	*			trans	-121.1	123.5	177.4	-101.8	-98.9	0	0	0	111
962	H	39.8	Very low	40.8	Very low	173 Å²	173	146.9 Å²	146.9	80%	0.801	76%	0.76	S	S	*	*			trans	-146.9	133	159.7	-69.2	-78.2	0	0	0	107.7
963	R	38.6	Very low	40.6	Very low	226 Å²	226	148.5 Å²	148.5	85%	0.853	76%	0.764	S	S	*	*			cis	91.4	93.5	42.3	-155.9	-178.5	-158.3	-174	8.4	113.7
964	S	34.7	Very low	40.5	Very low	99 Å²	99	148.8 Å²	148.8	69%	0.692	76%	0.761	S	S	*	*			trans	79.6	128	143.7	-61.2	0	0	0	0	123
965	R	35.7	Very low	40.2	Very low	230 Å²	230	151.1 Å²	151.1	87%	0.868	76%	0.762	S	S	*	*			trans	74.5	121.4	139.8	-72.8	179.5	176.4	-96.3	0.4	121.2
966	S	32.5	Very low	39.8	Very low	106 Å²	106	147.6 Å²	147.6	74%	0.741	76%	0.764	S	S	*	*			trans	55.5	127.1	138.4	61.2	0	0	0	0	121.3
967	V	36.6	Very low	39.6	Very low	130 Å²	130	150.1 Å²	150.1	79%	0.788	77%	0.767	S	S	*	*				-179.7	134.8	102.1	151.2	0	0	0	0	109.2
968	S	42.6	Very low	39.5	Very low	117 Å²	117	149.5 Å²	149.5	82%	0.818	77%	0.773	S	S	*	*			trans	-106.7	148.7	165.3	-55.4	0	0	0	0	109.6
969	P	43.1	Very low	39.2	Very low	97 Å²	97	150.4 Å²	150.4	63%	0.63	78%	0.776	S	S	*	*			trans	-147.7	133.9	138.7	29.6	-10.3	0	0	0	116.1
970	H	42	Very low	39.5	Very low	178 Å²	178	149.1 Å²	149.1	82%	0.824	77%	0.772	S	S	*	*			trans	56.9	147.9	130.5	-57.7	-48.9	0	0	0	121.2
971	R	44.6	Very low	39.3	Very low	232 Å²	232	153.8 Å²	153.8	88%	0.875	78%	0.775	S	S	*	*			cis	-138.5	173.6	-0.3	-65.2	-169.8	170.4	159.2	-2.8	108.6
972	G	47.3	Very low	39.7	Very low	58 Å²	58	152 Å²	152	60%	0.598	77%	0.771	S	S	*	*			cis	-158.3	158	-1.5	0	0	0	0	0	108.7
973	D	39.7	Very low	40.1	Very low	148 Å²	148	149.1 Å²	149.1	79%	0.791	77%	0.767	S	S	*	*				64.2	124.2	89.8	-55.6	-58.6	0	0	0	112
974	D	44.6	Very low	40.3	Very low	133 Å²	133	144.8 Å²	144.8	71%	0.711	76%	0.761	S	S	*	*			cis	-138.8	-169.9	44.3	-148.1	-85.2	0	0	0	115.6
975	Q	40.6	Very low	40.8	Very low	175 Å²	175	145 Å²	145	82%	0.818	76%	0.758	S	S	*	*			trans	-74.3	168.6	-164.3	-59.9	157.9	81.3	0	0	115
976	G	36.3	Very low	41.1	Very low	71 Å²	71	139.3 Å²	139.3	73%	0.732	75%	0.751	S	S	*	*			cis	152.4	167.5	-6.3	0	0	0	0	0	114
977	R	39.3	Very low	41.4	Very low	217 Å²	217	140.5 Å²	140.5	82%	0.819	75%	0.748	S	S	*	*			trans	79.6	138.6	164.9	-148.1	175.4	-147.9	-70.7	-2.6	119.3
978	P	39.4	Very low	41.4	Very low	107 Å²	107	141.1 Å²	141.1	70%	0.695	74%	0.743	S	S	*	*			trans	-106.1	152.3	-177.8	38.9	-35.2	0	0	0	116.1
979	R	34.5	Very low	41.1	Very low	225 Å²	225	145 Å²	145	85%	0.849	74%	0.739	S	S	*	*			trans	160.5	155.6	162.5	-92.9	157	-174.4	-172.4	0.1	107.8
980	S	40.6	Very low	40.6	Very low	91 Å²	91	144.7 Å²	144.7	64%	0.636	74%	0.74	S	S	*	*			cis	-174	146.5	-7.4	47.5	0	0	0	0	112.9
981	R	36.8	Very low	40.4	Very low	230 Å²	230	143.2 Å²	143.2	87%	0.868	74%	0.737	S	S	*	*			trans	64.3	127.9	157.2	-63.3	169.4	-174	-107	0	117
982	L	45.7	Very low	39.9	Very low	149 Å²	149	138.3 Å²	138.3	78%	0.78	73%	0.728	S	S	*	*				64.3	139.5	62.7	-68.6	-178.7	0	0	0	113.3
983	P	47.3	Very low	39.4	Very low	112 Å²	112	144 Å²	144	73%	0.727	74%	0.739	S	S	*	*			cis	-135	-172.2	44.2	36.9	-16.9	0	0	0	115
984	N	43.5	Very low	39.5	Very low	136 Å²	136	143.5 Å²	143.5	73%	0.727	74%	0.735	S	S	*	*			cis	-150.2	146.4	-9.9	-115.5	9.7	0	0	0	106.5
985	V	44.4	Very low	39.3	Very low	103 Å²	103	145.7 Å²	145.7	62%	0.624	74%	0.741	S	S	*	*			cis	77.2	140.4	44.5	174.4	0	0	0	0	112.6
986	P	42.9	Very low	39.4	Very low	110 Å²	110	142.1 Å²	142.1	71%	0.714	73%	0.732	S	S	*	*			cis	-114.2	174	4.1	40.2	-26.2	0	0	0	114.3
987	L	38.1	Very low	39.1	Very low	132 Å²	132	144.2 Å²	144.2	69%	0.691	73%	0.731	S	S	*	*			cis	74	154.5	31.1	-111.9	61.8	0	0	0	113.1
988	Q	36.5	Very low	38.7	Very low	143 Å²	143	143.6 Å²	143.6	67%	0.668	73%	0.729	S	S	*	*			cis	-166	157.6	22.2	-153.1	165.2	-61.1	0	0	112.4
989	R	35.2	Very low	38.4	Very low	198 Å²	198	148.5 Å²	148.5	75%	0.747	73%	0.734	S	S	*	*			trans	26.4	132.6	144.5	-70.1	179.9	167.5	90.4	4.9	121.1
990	S	33.6	Very low	38.4	Very low	91 Å²	91	142.9 Å²	142.9	64%	0.636	73%	0.729	S	S	*	*			cis	90	145	47.9	82.9	0	0	0	0	115.9
991	L	38.1	Very low	38	Very low	147 Å²	147	149.2 Å²	149.2	77%	0.77	74%	0.739	S	S	*	*			trans	92.3	129.9	168.3	-60.5	-179.4	0	0	0	119.7
992	D	33.2	Very low	38	Very low	128 Å²	128	143.6 Å²	143.6	68%	0.684	73%	0.734	S	S	*	*			trans	63.7	106.3	133.3	-51.3	-17.8	0	0	0	123.7
993	E	37.1	Very low	37.7	Very low	179 Å²	179	141.3 Å²	141.3	84%	0.836	73%	0.729	S	S	*	*				73.3	174.8	118.6	-152.4	171.7	-153.2	0	0	119.9
994	I	41.5	Very low	37	Very low	137 Å²	137	141.8 Å²	141.8	70%	0.703	73%	0.729	S	S	*	*			trans	76.4	76.3	166.1	-43.4	-176	0	0	0	116.9
995	H	41.7	Very low	36.5	Very low	179 Å²	179	144.8 Å²	144.8	83%	0.829	73%	0.731	S	S	*	*				67.9	167.5	125.3	-90.9	-101.3	0	0	0	118.8
996	P	41.9	Very low	36.2	Very low	99 Å²	99	146.1 Å²	146.1	64%	0.643	73%	0.73	S	S	*	*			trans	-134.3	-154.3	-137.3	42.6	-23.4	0	0	0	114.7
997	T	29.4	Very low	35.9	Very low	116 Å²	116	148.2 Å²	148.2	71%	0.712	73%	0.73	S	S	*	*			trans	99	149.5	161.8	80	0	0	0	0	118.1
998	R	31.5	Very low	35.8	Very low	204 Å²	204	148.4 Å²	148.4	77%	0.77	73%	0.731	S	S	*	*			trans	71.1	114.7	164.3	-69.2	173.8	174.8	-109.1	-1.8	115.4
999	R	33.6	Very low	35.8	Very low	210 Å²	210	145.5 Å²	145.5	79%	0.792	73%	0.732	S	S	*	*				62.8	126.1	85.7	-66.8	-179.8	-176.4	-149.1	2.8	110.7
1000	S	34.2	Very low	36	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	73%	0.725	S	S	*	*			cis	-153.3	133	43	-63.3	0	0	0	0	111.2
1001	R	31.7	Very low	36.2	Very low	225 Å²	225	146.5 Å²	146.5	85%	0.849	74%	0.735	S	S	*	*				55.4	99.9	95.9	-68.3	-172.7	167.9	-142	-3.6	117.7
1002	S	37	Very low	36.3	Very low	111 Å²	111	144.4 Å²	144.4	78%	0.776	73%	0.732	S	S	*	*				68	-173.4	128.7	-45	0	0	0	0	115.9
1003	P	40.3	Very low	36.6	Very low	102 Å²	102	146 Å²	146	66%	0.662	74%	0.74	S	S	*	*			cis	-140.5	165	-3.8	41.1	-22.7	0	0	0	118.3
1004	T	31.2	Very low	36.7	Very low	121 Å²	121	141.3 Å²	141.3	74%	0.742	73%	0.732	S	S	*	*			trans	65.3	164.6	146.3	53.5	0	0	0	0	119
1005	R	32.5	Very low	36.6	Very low	199 Å²	199	141 Å²	141	75%	0.751	73%	0.732	S	S	*	*			cis	-166.8	-179.2	-4.9	-123	167.7	180	-137.1	7.3	110.7
1006	H	39.6	Very low	36.4	Very low	132 Å²	132	138.9 Å²	138.9	61%	0.611	72%	0.722	S	S	*	*			trans	77.9	120.1	161.9	-71	-62.3	0	0	0	116.7
1007	H	36.4	Very low	36.2	Very low	154 Å²	154	144 Å²	144	71%	0.713	73%	0.729	S	S	*	*				76.4	142.4	73.4	-82.2	-116.1	0	0	0	112.2
1008	D	35.5	Very low	36.7	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	73%	0.728	S	S	*	*			cis	-158.5	171.7	11.1	-140.7	-43.7	0	0	0	114
1009	A	37.6	Very low	37.1	Very low	82 Å²	82	143.4 Å²	143.4	68%	0.678	73%	0.728	S	S	*	*			trans	64.1	152.5	148	0	0	0	0	0	123
1010	S	37.6	Very low	37.4	Very low	85 Å²	85	139.6 Å²	139.6	59%	0.594	72%	0.719	S	S	*	*			cis	-171.3	163.9	-27.7	64.8	0	0	0	0	112.5
1011	R	38.9	Very low	37.8	Very low	226 Å²	226	138.7 Å²	138.7	85%	0.853	72%	0.718	S	S	*	*			trans	77.4	146.2	159.3	-61.9	157.5	-162.2	-91.3	-2.3	117.8
1012	S	40.2	Very low	38.1	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	71%	0.711	S	S	*	*			cis	-178.4	164.6	-14.5	56.9	0	0	0	0	108.6
1013	L	39.9	Very low	38	Very low	160 Å²	160	134.2 Å²	134.2	84%	0.838	71%	0.705	S	S	*	*			cis	-161.3	170	3.5	-153.1	70.1	0	0	0	109.7
1014	A	39	Very low	37.7	Very low	82 Å²	82	137.6 Å²	137.6	68%	0.678	71%	0.712	S	S	*	*			trans	60.6	136.9	142.3	0	0	0	0	0	122.2
1015	D	39.9	Very low	37.7	Very low	130 Å²	130	142.1 Å²	142.1	70%	0.695	72%	0.717	S	S	*	*			cis	-160.8	159.4	-15.7	-140.3	-8.6	0	0	0	115.9
1016	H	37.6	Very low	37.6	Very low	135 Å²	135	136.7 Å²	136.7	63%	0.625	71%	0.709	S	S	*	*			trans	44.8	140.1	146.9	-82.8	24.9	0	0	0	122
1017	R	37.8	Very low	37.3	Very low	207 Å²	207	135.4 Å²	135.4	78%	0.781	72%	0.715	S	S	*	*			cis	-164.6	148.7	9.1	-133.6	175.3	-163.8	-160.2	4.1	113.8
1018	S	38.7	Very low	37.1	Very low	98 Å²	98	136.4 Å²	136.4	69%	0.685	72%	0.72	S	S	*	*			trans	43.6	136.9	133.7	175.4	0	0	0	0	120.8
1019	R	40.8	Very low	37.3	Very low	209 Å²	209	135 Å²	135	79%	0.789	72%	0.719	S	S	*	*			cis	-173.5	164	1.4	-107.2	-174.1	170.6	-143.9	-2.2	105.9
1020	H	38.2	Very low	37	Very low	129 Å²	129	137.1 Å²	137.1	60%	0.597	72%	0.718	S	S	*	*			cis	-140.4	-148.9	-8.9	-145.2	-143	0	0	0	105.8	E1022	H1020-E1022 IonicContact CE1-OE2 2.68Å; H1020-E1022 PolarHBondContact CE1-OE2 2.87Å; H1020-E1022 VanDerWaalsContact CE1-OE2 3.23Å; H1020-E1022 IonicContact ND1-OE2 3.23Å; H1020-E1022 PolarHBondContact ND1-OE2 3.27Å
1021	A	44.2	Very low	36.8	Very low	87 Å²	87	142.8 Å²	142.8	72%	0.719	73%	0.727	S	S	*	*			cis	-152.3	175.7	8.7	0	0	0	0	0	114
1022	E	37	Very low	36.6	Very low	150 Å²	150	138 Å²	138	70%	0.701	72%	0.723	S	S	*	*			trans	-59.3	168.8	165.2	-70.6	154	101.9	0	0	115.2	H1020	H1020-E1022 IonicContact CE1-OE2 2.68Å; H1020-E1022 PolarHBondContact CE1-OE2 2.87Å; H1020-E1022 VanDerWaalsContact CE1-OE2 3.23Å; H1020-E1022 IonicContact ND1-OE2 3.23Å; H1020-E1022 PolarHBondContact ND1-OE2 3.27Å
1023	S	35	Very low	36.4	Very low	92 Å²	92	140.7 Å²	140.7	64%	0.643	72%	0.724	S	S	*	*			cis	177.9	169.9	-18.2	66.3	0	0	0	0	106.4
1024	Q	33.8	Very low	36.3	Very low	174 Å²	174	142.2 Å²	142.2	81%	0.813	72%	0.718	S	S	*	*			cis	-155.2	168	-9.8	-130	162.3	10.2	0	0	110.8
1025	Y	31.6	Very low	36.2	Very low	215 Å²	215	145.5 Å²	145.5	84%	0.843	72%	0.719	S	S	*	*			trans	-34.4	169.3	158	-77.8	-128.2	0	0	0	117.2
1026	S	30.3	Very low	35.9	Very low	85 Å²	85	143 Å²	143	59%	0.594	73%	0.725	S	S	*	*			cis	-179	163.7	-19.7	-89	0	0	0	0	110.4
1027	S	32.8	Very low	35.9	Very low	105 Å²	105	142 Å²	142	73%	0.734	73%	0.733	S	S	*	*			trans	64.4	137.2	141.3	60	0	0	0	0	123.6
1028	E	32.8	Very low	36.2	Very low	176 Å²	176	137.8 Å²	137.8	82%	0.822	73%	0.732	S	S	*	*			trans	79.6	158.5	147.1	-69.7	-62.4	87.2	0	0	120.6
1029	P	40	Very low	36.1	Very low	106 Å²	106	138.6 Å²	138.6	69%	0.688	73%	0.733	S	S	*	*			trans	-132.2	-163.4	-139	46.7	-32	0	0	0	116.4
1030	D	30.2	Very low	36.1	Very low	125 Å²	125	137.5 Å²	137.5	67%	0.668	74%	0.737	S	S	*	*			trans	107.6	139.5	155.8	-154.5	24.3	0	0	0	119
1031	R	34.3	Very low	36.1	Very low	204 Å²	204	136.6 Å²	136.6	77%	0.77	75%	0.745	S	S	*	*			trans	62.9	136	158.8	-87.2	159.1	-143.5	-133.2	-6.6	125.2
1032	T	35.1	Very low	36.2	Very low	126 Å²	126	137.9 Å²	137.9	77%	0.773	75%	0.747	S	S	*	*			trans	81.1	87.2	140.3	47.4	0	0	0	0	123
1033	H	35.2	Very low	36.8	Very low	160 Å²	160	136 Å²	136	74%	0.741	75%	0.747	S	S	*	*				54.6	97.9	100.8	-177.7	-77.6	0	0	0	120.1
1034	R	37.6	Very low	36.9	Very low	192 Å²	192	135.5 Å²	135.5	73%	0.725	75%	0.749	S	S	*	*				-173.1	130.6	116.5	-110.8	-149.4	168.5	-156	-3.9	116.1
1035	Q	36.4	Very low	37.1	Very low	150 Å²	150	134 Å²	134	70%	0.701	75%	0.746	S	S	*	*			trans	35.9	134.1	135.1	-61.9	-178.6	-10.7	0	0	122.6
1036	G	34.9	Very low	37.2	Very low	79 Å²	79	129.3 Å²	129.3	81%	0.814	74%	0.74	S	S	*	*			trans	176.4	44.5	168	0	0	0	0	0	118.7
1037	S	37.7	Very low	37.4	Very low	114 Å²	114	129.6 Å²	129.6	80%	0.797	74%	0.742	S	S	*	*			trans	-79.3	-177.6	173.7	-27.9	0	0	0	0	112.5
1038	P	44.1	Very low	37.5	Very low	117 Å²	117	134.4 Å²	134.4	76%	0.76	75%	0.75	S	S	*	*			cis	-118.7	-137.8	-10.4	24.1	1.5	0	0	0	111.4
1039	T	36	Very low	37.7	Very low	115 Å²	115	130 Å²	130	71%	0.706	75%	0.751	S	S	*	*			cis	-167.3	168.5	12.7	-20.6	0	0	0	0	113.1
1040	Q	41.7	Very low	37.4	Very low	187 Å²	187	129.7 Å²	129.7	87%	0.874	75%	0.752	S	S	*	*			trans	82.9	145.8	156.9	-68.4	-173.4	19.5	0	0	121.5
1041	S	37.3	Very low	37.7	Very low	109 Å²	109	134.4 Å²	134.4	76%	0.762	76%	0.76	S	S	*	*			trans	-169.9	-169.2	-166.6	58.4	0	0	0	0	108.4
1042	P	47	Very low	38	Very low	115 Å²	115	136.9 Å²	136.9	75%	0.747	77%	0.77	S	S	*	*			cis	-111.5	-87.1	-30.5	14.2	9.4	0	0	0	113
1043	P	49.6	Very low	38	Very low	109 Å²	109	134 Å²	134	71%	0.708	77%	0.765	S	S	*	*				-125.7	-179.1	-67.5	40.8	-26	0	0	0	116.8
1044	A	37.3	Very low	38.2	Very low	83 Å²	83	137.1 Å²	137.1	69%	0.686	77%	0.771	S	S	*	*			trans	84	122.9	142.8	0	0	0	0	0	124.1
1045	D	38.1	Very low	38	Very low	142 Å²	142	135.3 Å²	135.3	76%	0.759	77%	0.77	S	S	*	*				86.8	99.4	127	-61.8	-5	0	0	0	126.5
1046	T	33.4	Very low	38.4	Very low	117 Å²	117	136.1 Å²	136.1	72%	0.718	78%	0.779	S	S	*	*				66.7	109.8	123.6	64.9	0	0	0	0	124.4
1047	S	33	Very low	38.8	Very low	90 Å²	90	138.3 Å²	138.3	63%	0.629	78%	0.778	S	S	*	*				87.9	150.4	115.6	78.3	0	0	0	0	123.8
1048	F	35.4	Very low	38.7	Very low	207 Å²	207	141.2 Å²	141.2	91%	0.908	78%	0.779	S	S	*	*			trans	62.4	144.9	168.8	-56.4	-74.3	0	0	0	119.5
1049	G	37.2	Very low	38.4	Very low	82 Å²	82	141 Å²	141	85%	0.845	78%	0.775	S	S	*	*			trans	169.1	58.8	-179.3	0	0	0	0	0	118.9
1050	S	32.8	Very low	38.6	Very low	101 Å²	101	141.5 Å²	141.5	71%	0.706	78%	0.781	S	S	*	*			trans	-62.3	128.9	-172.6	-166.3	0	0	0	0	118.6
1051	R	38.5	Very low	38.3	Very low	223 Å²	223	138 Å²	138	84%	0.842	77%	0.772	S	S	*	*			trans	73	154	145.1	-68.7	169.5	-176.6	-126.7	3.4	122.9
1052	R	38.5	Very low	38.4	Very low	256 Å²	256	144.5 Å²	144.5	97%	0.966	78%	0.78	S	S	*	*			trans	83	140.3	168.5	-49.8	178.9	-170.7	-122.9	3.3	115.3
1053	G	35.5	Very low	37.8	Very low	66 Å²	66	144.6 Å²	144.6	68%	0.68	78%	0.783	S	S	*	*			cis	153.1	151.5	-13.6	0	0	0	0	0	114.4
1054	R	40.2	Very low	36.9	Very low	226 Å²	226	143.2 Å²	143.2	85%	0.853	79%	0.789	S	S	*	*			trans	76.6	152.8	-177.8	-53	173	176.5	-91.5	1.9	114.3
1055	Q	32.8	Very low	36.9	Very low	153 Å²	153	143.1 Å²	143.1	72%	0.715	78%	0.783	S	S	*	*			cis	-156.8	140.7	-14.5	-122.1	169.5	-78.6	0	0	109.8
1056	L	44.7	Very low	36.9	Very low	168 Å²	168	144.2 Å²	144.2	88%	0.88	79%	0.787	S	S	*	*			trans	-146	160.5	163.6	-86.5	-175.1	0	0	0	110.3
1057	P	43.9	Very low	37.3	Very low	124 Å²	124	144.1 Å²	144.1	81%	0.805	78%	0.779	S	S	*	*			trans	-83	-178.1	-153.1	32.1	-37.1	0	0	0	116.9
1058	Q	35.8	Very low	37.8	Very low	175 Å²	175	147.6 Å²	147.6	82%	0.818	79%	0.785	S	S	*	*			trans	-129.1	133.6	-146.7	-116.5	-168.3	27	0	0	114.9
1059	V	38.5	Very low	38.1	Very low	112 Å²	112	141.8 Å²	141.8	68%	0.679	78%	0.775	S	S	*	*			trans	58.2	165.3	153.7	-99.8	0	0	0	0	118.6	V1061	V1059-V1061 HydrophobicContact CG1-CG2 4.29Å
1060	P	39.2	Very low	38.6	Very low	126 Å²	126	141 Å²	141	82%	0.818	76%	0.756	S	S	*	*			cis	-105.2	150.9	19.1	9.5	14.1	0	0	0	117
1061	V	35.5	Very low	39.5	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.685	75%	0.745	S	S	*	*			trans	-87.3	136	168.4	173.9	0	0	0	0	110	V1059	V1059-V1061 HydrophobicContact CG1-CG2 4.29Å
1062	R	39.9	Very low	40.4	Very low	247 Å²	247	135.1 Å²	135.1	93%	0.932	74%	0.737	S	S	*	*			trans	-134.6	146	151.6	-79.2	-162.5	162.4	-178.3	-5	110.9
1063	S	33.5	Very low	41.5	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	72%	0.721	S	S	*	*			trans	-111.4	158	-169.9	-50.4	0	0	0	0	111.7
1064	G	32	Very low	42.7	Very low	80 Å²	80	129.6 Å²	129.6	83%	0.825	71%	0.711	S	S	*	*			trans	105.4	148.2	178	0	0	0	0	0	112.7
1065	S	36.4	Very low	43.7	Very low	81 Å²	81	123.9 Å²	123.9	57%	0.566	69%	0.694	S	S	*	*			cis	-141.1	155.6	-4.9	-167.2	0	0	0	0	111.4	E1067	S1065-E1067 VanDerWaalsContact CB-OE2 3.26Å; S1065-E1067 WeakPolarHBondContact CB-OE2 3.34Å; S1065-E1067 PolarHBondContact O-N 3.43Å; S1065-E1067 VanDerWaalsContact O-N 3.17Å; S1065-E1067 PolarHBondContact OG-OE2 3.49Å
1066	I	39.2	Very low	44.9	Very low	165 Å²	165	126.4 Å²	126.4	85%	0.846	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	18.7	-171.9	-157.8	163.8	0	0	0	113.4
1067	E	41.1	Very low	45.7	Very low	116 Å²	116	121.5 Å²	121.5	54%	0.542	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.7	-27.1	-160.2	-69.7	170.3	108.9	0	0	114.9	S1065 A1069 S1070 L1071	S1065-E1067 VanDerWaalsContact CB-OE2 3.26Å; S1065-E1067 WeakPolarHBondContact CB-OE2 3.34Å; S1065-E1067 PolarHBondContact O-N 3.43Å; S1065-E1067 VanDerWaalsContact O-N 3.17Å; S1065-E1067 PolarHBondContact OG-OE2 3.49Å; E1067-A1069 VanDerWaalsContact C-N 3.31Å; E1067-A1069 PolarHBondContact O-N 2.97Å; E1067-S1070 WeakPolarHBondContact O-CB 3.38Å; E1067-S1070 PolarHBondContact O-N 2.71Å; E1067-L1071 HydrophobicContact CB-CD1 4.46Å; E1067-L1071 PolarHBondContact O-N 2.81Å
1068	Q	43.1	Very low	46.7	Very low	162 Å²	162	123.3 Å²	123.3	76%	0.757	67%	0.665	S	S	*	*	H	α-helix	trans	-63.7	-32.5	-171.6	-67.4	-172.7	-2.1	0	0	113.9
1069	A	42.8	Very low	47.7	Very low	85 Å²	85	120.7 Å²	120.7	70%	0.702	65%	0.653	S	S	*	*	H	α-helix	trans	-75.6	-27.6	174.2	0	0	0	0	0	113.3	E1067	E1067-A1069 VanDerWaalsContact C-N 3.31Å; E1067-A1069 PolarHBondContact O-N 2.97Å
1070	S	47.1	Very low	48.3	Very low	65 Å²	65	122.6 Å²	122.6	46%	0.455	66%	0.656	S	S	.	*	H	α-helix	trans	-72.1	-45.8	172.7	-162.9	0	0	0	0	110.3	E1067 V1072 V1073 E1074	E1067-S1070 WeakPolarHBondContact O-CB 3.38Å; E1067-S1070 PolarHBondContact O-N 2.71Å; S1070-V1072 VanDerWaalsContact C-N 3.32Å; S1070-V1072 PolarHBondContact O-N 3.32Å; S1070-V1073 PolarHBondContact O-N 2.87Å; S1070-V1073 VanDerWaalsContact O-N 3.08Å; S1070-E1074 VanDerWaalsContact O-CB 3.3Å; S1070-E1074 WeakPolarHBondContact O-CB 3.33Å; S1070-E1074 PolarHBondContact O-N 2.82Å
1071	L	51.5	Low	49	Very low	91 Å²	91	123.3 Å²	123.3	48%	0.476	65%	0.647	S	S	.	*	H	α-helix	trans	-54.3	-40.2	-174.9	-80.6	166.6	0	0	0	113.7	E1067 V1073 E1074 E1075	E1067-L1071 HydrophobicContact CB-CD1 4.46Å; E1067-L1071 PolarHBondContact O-N 2.81Å; L1071-V1073 PolarHBondContact O-N 2.95Å; L1071-E1074 PolarHBondContact O-N 2.92Å; L1071-E1075 WeakPolarHBondContact O-CA 3.19Å; L1071-E1075 WeakPolarHBondContact O-CB 3.45Å; L1071-E1075 PolarHBondContact O-N 3.33Å
1072	V	57.6	Low	49.8	Very low	111 Å²	111	124.2 Å²	124.2	67%	0.673	65%	0.645	S	S	*	*	H	α-helix	trans	-69.5	-34.9	-179.7	-178.2	0	0	0	0	112.8	S1070 R1076	S1070-V1072 VanDerWaalsContact C-N 3.32Å; S1070-V1072 PolarHBondContact O-N 3.32Å; V1072-R1076 WeakPolarHBondContact O-CB 3.09Å; V1072-R1076 PolarHBondContact O-N 3Å
1073	V	61.5	Low	50.2	Low	101 Å²	101	121.8 Å²	121.8	61%	0.612	64%	0.641	S	S	*	*	H	α-helix	trans	-78.7	-39.7	176.5	179	0	0	0	0	110.7	S1070 L1071 T1077	S1070-V1073 PolarHBondContact O-N 2.87Å; S1070-V1073 VanDerWaalsContact O-N 3.08Å; L1071-V1073 PolarHBondContact O-N 2.95Å; V1073-T1077 WeakPolarHBondContact O-CB 3.32Å; V1073-T1077 PolarHBondContact O-N 3.15Å; V1073-T1077 VanDerWaalsContact O-N 3.1Å; V1073-T1077 PolarHBondContact O-OG1 3.44Å
1074	E	61.3	Low	50.9	Low	105 Å²	105	121.8 Å²	121.8	49%	0.491	64%	0.636	S	S	.	*	H	α-helix	trans	-68.1	-43	178	-169.4	170.1	160	0	0	111.4	S1070 L1071 T1077 R1078	S1070-E1074 VanDerWaalsContact O-CB 3.3Å; S1070-E1074 WeakPolarHBondContact O-CB 3.33Å; S1070-E1074 PolarHBondContact O-N 2.82Å; L1071-E1074 PolarHBondContact O-N 2.92Å; E1074-T1077 CarbonylContact O-C 3.55Å; E1074-T1077 WeakPolarHBondContact O-CA 3.47Å; E1074-T1077 VanDerWaalsContact O-CB 3.31Å; E1074-T1077 WeakPolarHBondContact O-CB 3.39Å; E1074-T1077 PolarHBondContact O-N 2.96Å; E1074-T1077 VanDerWaalsContact O-N 3.1Å; E1074-R1078 VanDerWaalsContact O-CB 3.31Å; E1074-R1078 WeakPolarHBondContact O-CB 3.33Å; E1074-R1078 PolarHBondContact O-N 3.28Å
1075	E	61	Low	51.5	Low	105 Å²	105	124.2 Å²	124.2	49%	0.491	63%	0.626	S	S	.	*	H	α-helix	trans	-66.4	-40.8	177.5	-175.2	168.9	172.3	0	0	111.9	L1071 T1077 R1078 Q1079	L1071-E1075 WeakPolarHBondContact O-CA 3.19Å; L1071-E1075 WeakPolarHBondContact O-CB 3.45Å; L1071-E1075 PolarHBondContact O-N 3.33Å; E1075-T1077 PolarHBondContact O-N 2.9Å; E1075-R1078 CarbonylContact O-C 3.38Å; E1075-R1078 WeakPolarHBondContact O-CA 3.15Å; E1075-R1078 PolarHBondContact O-N 3.48Å; E1075-Q1079 HydrophobicContact CG-CG 4.29Å; E1075-Q1079 WeakPolarHBondContact O-CG 3.02Å; E1075-Q1079 PolarHBondContact O-N 2.88Å; E1075-Q1079 PolarHBondContact OE1-NE2 2.67Å
1076	R	57.3	Low	51.6	Low	206 Å²	206	131.6 Å²	131.6	78%	0.777	64%	0.641	S	S	*	*	H	α-helix	trans	-60.7	-34.1	172.1	-162.8	170.9	-170.4	147.6	3	111.7	V1072 M1080	V1072-R1076 WeakPolarHBondContact O-CB 3.09Å; V1072-R1076 PolarHBondContact O-N 3Å; R1076-M1080 WeakPolarHBondContact O-CB 3.38Å; R1076-M1080 PolarHBondContact O-N 2.85Å
1077	T	62	Low	51.6	Low	66 Å²	66	133 Å²	133	41%	0.405	64%	0.641	S	S	.	*	H	α-helix	trans	-73.9	-32.7	172.8	-54.3	0	0	0	0	112.3	V1073 E1074 E1075 K1081	V1073-T1077 WeakPolarHBondContact O-CB 3.32Å; V1073-T1077 PolarHBondContact O-N 3.15Å; V1073-T1077 VanDerWaalsContact O-N 3.1Å; V1073-T1077 PolarHBondContact O-OG1 3.44Å; E1074-T1077 CarbonylContact O-C 3.55Å; E1074-T1077 WeakPolarHBondContact O-CA 3.47Å; E1074-T1077 VanDerWaalsContact O-CB 3.31Å; E1074-T1077 WeakPolarHBondContact O-CB 3.39Å; E1074-T1077 PolarHBondContact O-N 2.96Å; E1074-T1077 VanDerWaalsContact O-N 3.1Å; E1075-T1077 PolarHBondContact O-N 2.9Å; T1077-K1081 HydrophobicContact CG2-CD 4.43Å; T1077-K1081 WeakPolarHBondContact O-CB 3.32Å; T1077-K1081 WeakPolarHBondContact O-CG 3.29Å; T1077-K1081 PolarHBondContact O-N 2.78Å
1078	R	63.8	Low	51.4	Low	161 Å²	161	136.2 Å²	136.2	61%	0.608	65%	0.654	S	S	*	*	H	α-helix	trans	-74.3	-44.6	-179.8	-159.3	171.9	-175.9	179.5	0.7	110.9	E1074 E1075 M1080 K1081 M1082	E1074-R1078 VanDerWaalsContact O-CB 3.31Å; E1074-R1078 WeakPolarHBondContact O-CB 3.33Å; E1074-R1078 PolarHBondContact O-N 3.28Å; E1075-R1078 CarbonylContact O-C 3.38Å; E1075-R1078 WeakPolarHBondContact O-CA 3.15Å; E1075-R1078 PolarHBondContact O-N 3.48Å; R1078-M1080 VanDerWaalsContact C-N 3.33Å; R1078-M1080 PolarHBondContact O-N 3.15Å; R1078-K1081 PolarHBondContact O-N 3.38Å; R1078-M1082 HydrophobicContact CG-SD 4.43Å; R1078-M1082 WeakPolarHBondContact O-CB 3.39Å; R1078-M1082 WeakPolarHBondContact O-CG 3.31Å; R1078-M1082 PolarHBondContact O-N 2.86Å
1079	Q	57.4	Low	51.2	Low	120 Å²	120	136.4 Å²	136.4	56%	0.561	65%	0.654	S	S	*	*	H	α-helix	trans	-59.4	-42.9	171.4	-68.5	-175.3	12.7	0	0	111.4	E1075 K1081 M1082 K1083	E1075-Q1079 HydrophobicContact CG-CG 4.29Å; E1075-Q1079 WeakPolarHBondContact O-CG 3.02Å; E1075-Q1079 PolarHBondContact O-N 2.88Å; E1075-Q1079 PolarHBondContact OE1-NE2 2.67Å; Q1079-K1081 VanDerWaalsContact C-N 3.32Å; Q1079-K1081 PolarHBondContact O-N 3.02Å; Q1079-M1082 PolarHBondContact O-N 2.89Å; Q1079-K1083 PolarHBondContact O-N 3.33Å; Q1079-K1083 VanDerWaalsContact O-N 3.16Å
1080	M	50.4	Low	50.8	Low	152 Å²	152	139.3 Å²	139.3	75%	0.749	66%	0.664	S	S	*	*	H	α-helix	trans	-68.3	-29	177.2	-160.8	167.8	-173.2	0	0	113	R1076 R1078	R1076-M1080 WeakPolarHBondContact O-CB 3.38Å; R1076-M1080 PolarHBondContact O-N 2.85Å; R1078-M1080 VanDerWaalsContact C-N 3.33Å; R1078-M1080 PolarHBondContact O-N 3.15Å
1081	K	55	Low	50.2	Low	142 Å²	142	143.4 Å²	143.4	62%	0.617	69%	0.686	S	S	*	*	H	α-helix	trans	-76.8	-42.3	171	-77	174.6	178.5	177.8	0	113.2	T1077 R1078 Q1079 K1083 V1084 H1085	T1077-K1081 HydrophobicContact CG2-CD 4.43Å; T1077-K1081 WeakPolarHBondContact O-CB 3.32Å; T1077-K1081 WeakPolarHBondContact O-CG 3.29Å; T1077-K1081 PolarHBondContact O-N 2.78Å; R1078-K1081 PolarHBondContact O-N 3.38Å; Q1079-K1081 VanDerWaalsContact C-N 3.32Å; Q1079-K1081 PolarHBondContact O-N 3.02Å; K1081-K1083 PolarHBondContact O-N 2.94Å; K1081-V1084 CarbonylContact O-C 3.59Å; K1081-V1084 WeakPolarHBondContact O-CA 3.48Å; K1081-V1084 PolarHBondContact O-N 2.9Å; K1081-H1085 WeakPolarHBondContact O-CB 3.15Å; K1081-H1085 PolarHBondContact O-N 2.85Å
1082	M	51.1	Low	49.4	Very low	132 Å²	132	142.4 Å²	142.4	65%	0.65	70%	0.698	S	S	*	*	H	α-helix	trans	-64.5	-28.7	-179.9	-71.3	-177.8	82.3	0	0	112.2	R1078 Q1079 V1084	R1078-M1082 HydrophobicContact CG-SD 4.43Å; R1078-M1082 WeakPolarHBondContact O-CB 3.39Å; R1078-M1082 WeakPolarHBondContact O-CG 3.31Å; R1078-M1082 PolarHBondContact O-N 2.86Å; Q1079-M1082 PolarHBondContact O-N 2.89Å; M1082-V1084 PolarHBondContact O-N 2.86Å
1083	K	49.6	Very low	48.3	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	71%	0.711	S	S	*	*	H	α-helix	trans	-75.9	-5.1	172.1	-133	166.6	-172.3	170.8	0	114.7	Q1079 K1081	Q1079-K1083 PolarHBondContact O-N 3.33Å; Q1079-K1083 VanDerWaalsContact O-N 3.16Å; K1081-K1083 PolarHBondContact O-N 2.94Å
1084	V	48.1	Very low	46.9	Very low	115 Å²	115	141.7 Å²	141.7	70%	0.697	71%	0.712	S	S	*	*	H	α-helix	trans	-112.1	-28.9	174.6	177	0	0	0	0	111.6	K1081 M1082	K1081-V1084 CarbonylContact O-C 3.59Å; K1081-V1084 WeakPolarHBondContact O-CA 3.48Å; K1081-V1084 PolarHBondContact O-N 2.9Å; M1082-V1084 PolarHBondContact O-N 2.86Å
1085	H	43.8	Very low	45.5	Very low	132 Å²	132	142.5 Å²	142.5	61%	0.611	73%	0.729	S	S	*	*	H	α-helix	trans	-85.6	-7.5	-175.8	-148.2	-64.7	0	0	0	114.8	K1081 F1087	K1081-H1085 WeakPolarHBondContact O-CB 3.15Å; K1081-H1085 PolarHBondContact O-N 2.85Å; H1085-F1087 VanDerWaalsContact C-N 3.25Å; H1085-F1087 PolarHBondContact O-N 3.03Å
1086	R	39.3	Very low	44.3	Very low	236 Å²	236	142.9 Å²	142.9	89%	0.891	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-0.7	179.2	-166.4	164.3	179.5	147	2.2	114.4
1087	F	38.6	Very low	43.2	Very low	194 Å²	194	141.3 Å²	141.3	85%	0.851	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	13.9	-174.5	-157.5	-104.1	0	0	0	114.2	H1085	H1085-F1087 VanDerWaalsContact C-N 3.25Å; H1085-F1087 PolarHBondContact O-N 3.03Å
1088	K	38.2	Very low	41.9	Very low	184 Å²	184	146 Å²	146	80%	0.8	76%	0.762	S	S	*	*	S	Bend	trans	-158.2	59.6	-174.6	-145.4	175.5	-172.4	-176.2	0	116.6
1089	Q	37	Very low	40.5	Very low	166 Å²	166	146.4 Å²	146.4	78%	0.776	78%	0.775	S	S	*	*			trans	-172.4	95.9	159.4	-110.5	161.5	1.9	0	0	112.5
1090	T	34.6	Very low	39.3	Very low	146 Å²	146	146.9 Å²	146.9	90%	0.896	78%	0.782	S	S	*	*			trans	-176.3	125.3	147.7	11.8	0	0	0	0	108
1091	T	35	Very low	38.5	Very low	151 Å²	151	148 Å²	148	93%	0.926	78%	0.784	S	S	*	*			trans	-144.7	129.7	-175	43.6	0	0	0	0	109.9
1092	G	34.8	Very low	37.5	Very low	70 Å²	70	149.4 Å²	149.4	72%	0.722	79%	0.794	S	S	*	*			trans	146.9	114	169.4	0	0	0	0	0	114.2
1093	S	34.6	Very low	36.7	Very low	137 Å²	137	152.1 Å²	152.1	96%	0.958	81%	0.805	S	S	*	*			trans	46.2	139.6	148.2	-48	0	0	0	0	121.4
1094	G	32.2	Very low	35.7	Very low	60 Å²	60	154.6 Å²	154.6	62%	0.619	81%	0.81	S	S	*	*			cis	162.2	157.8	-3.4	0	0	0	0	0	112.3
1095	S	33.1	Very low	35.1	Very low	122 Å²	122	154.3 Å²	154.3	85%	0.853	81%	0.814	S	S	*	*			trans	61	123.5	179.4	41.1	0	0	0	0	117
1096	S	34.7	Very low	34.8	Very low	113 Å²	113	156.2 Å²	156.2	79%	0.79	82%	0.82	S	S	*	*				76.8	135.5	78.7	-154.9	0	0	0	0	112.5
1097	Q	34.7	Very low	34.6	Very low	172 Å²	172	155.7 Å²	155.7	80%	0.804	82%	0.82	S	S	*	*			cis	-142.5	175.4	20.2	-167.8	169.7	-5.5	0	0	112.4
1098	E	34.1	Very low	34.5	Very low	166 Å²	166	153.2 Å²	153.2	78%	0.776	82%	0.815	S	S	*	*			trans	-81.2	164.5	-174.7	-58.8	151.1	117.9	0	0	115.6
1099	L	34.1	Very low	34.5	Very low	168 Å²	168	151.8 Å²	151.8	88%	0.88	82%	0.815	S	S	*	*			trans	142.8	149.1	152	-80.4	167.1	0	0	0	110.2
1100	D	33.6	Very low	34.5	Very low	131 Å²	131	152.8 Å²	152.8	70%	0.701	82%	0.819	S	S	*	*			cis	-161.1	150.1	-45.1	-149.8	-34.9	0	0	0	108.1
1101	H	32.9	Very low	34.6	Very low	174 Å²	174	152.8 Å²	152.8	81%	0.806	81%	0.807	S	S	*	*			trans	58.3	170.5	161.2	-118.4	-106.6	0	0	0	122.7
1102	E	34	Very low	34.7	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	79%	0.791	S	S	*	*			trans	63.1	72.7	166.1	-58.7	-149.8	100.2	0	0	121.7
1103	Q	33.1	Very low	34.9	Very low	189 Å²	189	156.5 Å²	156.5	88%	0.883	80%	0.798	S	S	*	*			trans	-157	95.6	131.1	-123.7	175.8	62.7	0	0	113.7
1104	Y	29.5	Very low	34.8	Very low	247 Å²	247	159 Å²	159	97%	0.969	79%	0.788	S	S	*	*			trans	-130	58.8	172.2	-130.3	-81.2	0	0	0	111.7
1105	S	34.9	Very low	35	Very low	110 Å²	110	165 Å²	165	77%	0.769	79%	0.792	S	S	*	*			trans	-151.9	162.9	174	-168.9	0	0	0	0	111.2
1106	K	38.1	Very low	35	Very low	171 Å²	171	164.1 Å²	164.1	74%	0.743	79%	0.786	S	S	*	*			trans	64.2	83.1	171.9	-163.2	-177.3	-175.7	-179.6	0	116.5
1107	Y	34.9	Very low	35.3	Very low	225 Å²	225	164.5 Å²	164.5	88%	0.882	79%	0.787	S	S	*	*				-147.6	79.4	114.3	-112	-71.3	0	0	0	111.6
1108	N	35.6	Very low	35.4	Very low	142 Å²	142	163.2 Å²	163.2	76%	0.759	79%	0.786	S	S	*	*			trans	-137.7	97.7	167.2	-175.2	1.9	0	0	0	106.9
1109	I	39.9	Very low	35.3	Very low	154 Å²	154	162.5 Å²	162.5	79%	0.79	79%	0.788	S	S	*	*			trans	-177.7	93	162.6	-88.8	143.8	0	0	0	105.6
1110	H	36.6	Very low	35.4	Very low	187 Å²	187	159.5 Å²	159.5	87%	0.866	79%	0.787	S	S	*	*				-156.2	115.3	122.3	-149.2	-79.2	0	0	0	107.6
1111	K	37.3	Very low	35.4	Very low	147 Å²	147	158.6 Å²	158.6	64%	0.639	79%	0.791	S	S	*	*			trans	-141.5	163.1	-172.9	-167.8	-176.1	160	-70.5	0	107.8
1112	D	36.3	Very low	35.6	Very low	111 Å²	111	154 Å²	154	59%	0.594	78%	0.783	S	S	*	*			trans	73.5	77.8	167.7	-57.5	-46.6	0	0	0	117.1
1113	Q	38.1	Very low	35.8	Very low	188 Å²	188	155.2 Å²	155.2	88%	0.879	79%	0.786	S	S	*	*				-153.8	123.8	110.9	-98.8	147.6	85.6	0	0	108.8
1114	Y	33.4	Very low	35.8	Very low	189 Å²	189	150.8 Å²	150.8	74%	0.741	78%	0.775	S	S	*	*				69.2	123.4	77	-135.5	-120.8	0	0	0	111.2
1115	R	37	Very low	36.3	Very low	185 Å²	185	144.7 Å²	144.7	70%	0.698	77%	0.769	S	S	*	*			cis	-153.7	157.1	9.1	-154.8	-170.4	-148.8	-168.9	6.3	110.3
1116	S	31.9	Very low	36.3	Very low	104 Å²	104	146.4 Å²	146.4	73%	0.727	77%	0.77	S	S	*	*			trans	-84.5	146.1	166.3	51.2	0	0	0	0	111.9
1117	C	42.6	Very low	36.4	Very low	121 Å²	121	143.4 Å²	143.4	82%	0.818	77%	0.77	S	S	*	*			trans	-145.3	119.7	159	-78.5	0	0	0	0	108.7
1118	D	34.8	Very low	36.5	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	77%	0.765	S	S	*	*			trans	-111.4	157.2	172.5	-108	-53.7	0	0	0	110.1
1119	N	33	Very low	36.8	Very low	151 Å²	151	140.3 Å²	140.3	81%	0.807	77%	0.774	S	S	*	*			trans	56.5	98	159.8	-62.7	-46.9	0	0	0	120.4
1120	A	35.4	Very low	36.6	Very low	104 Å²	104	137.7 Å²	137.7	86%	0.86	77%	0.769	S	S	*	*				178.1	153.8	126.1	0	0	0	0	0	109.3
1121	S	33.7	Very low	36.7	Very low	113 Å²	113	136 Å²	136	79%	0.79	77%	0.767	S	S	*	*			cis	167.7	142.9	-20	180	0	0	0	0	105.1
1122	A	36.9	Very low	36.9	Very low	77 Å²	77	135.5 Å²	135.5	64%	0.636	78%	0.775	S	S	*	*			trans	71.7	130.4	163.7	0	0	0	0	0	120.8
1123	K	39.9	Very low	37	Very low	199 Å²	199	135 Å²	135	87%	0.865	78%	0.781	S	S	*	*			trans	73.1	147.5	155.7	-58.9	158.3	-176	178.3	0	117.3
1124	S	33.2	Very low	36.9	Very low	95 Å²	95	130.6 Å²	130.6	66%	0.664	78%	0.777	S	S	*	*			cis	-175.9	144.4	-21.2	48.3	0	0	0	0	109.3
1125	S	38.1	Very low	37.3	Very low	120 Å²	120	129.8 Å²	129.8	84%	0.839	78%	0.783	S	S	*	*			trans	65.1	162.4	160.9	-67.6	0	0	0	0	116.8
1126	D	35.7	Very low	37.1	Very low	146 Å²	146	126 Å²	126	78%	0.781	79%	0.785	S	S	*	*			cis	-166.7	-177.2	-30.8	-165.3	6.8	0	0	0	108.1
1127	S	39.3	Very low	37.5	Very low	107 Å²	107	133 Å²	133	75%	0.748	80%	0.796	S	S	*	*			trans	79.3	136.5	164.5	71.3	0	0	0	0	120.2
1128	D	37.1	Very low	37.4	Very low	148 Å²	148	131.6 Å²	131.6	79%	0.791	79%	0.793	S	S	*	*			trans	-80.5	164.6	179.9	-50.6	-94.8	0	0	0	114.7
1129	V	43.3	Very low	37.4	Very low	154 Å²	154	129.9 Å²	129.9	93%	0.933	79%	0.792	S	S	*	*			trans	-147.2	134.2	144.4	-113.4	0	0	0	0	110.8
1130	S	35.5	Very low	37.4	Very low	99 Å²	99	128 Å²	128	69%	0.692	79%	0.791	S	S	*	*			trans	-101	159	-173.6	-48.5	0	0	0	0	113.4
1131	D	38	Very low	37.5	Very low	153 Å²	153	130 Å²	130	82%	0.818	79%	0.792	S	S	*	*			trans	57.2	141.3	155.2	-70.9	-54.2	0	0	0	121.3
1132	V	42	Very low	37.6	Very low	135 Å²	135	129.8 Å²	129.8	82%	0.818	79%	0.791	S	S	*	*				-171.9	120.7	118.1	142.4	0	0	0	0	112.4
1133	S	37.3	Very low	37.7	Very low	101 Å²	101	137.4 Å²	137.4	71%	0.706	80%	0.803	S	S	*	*			trans	28.3	108.8	146.2	-50.5	0	0	0	0	122.6
1134	A	37	Very low	37.7	Very low	96 Å²	96	135 Å²	135	79%	0.793	80%	0.799	S	S	*	*				26.5	128.5	116.3	0	0	0	0	0	121.6
1135	I	40.7	Very low	37.7	Very low	171 Å²	171	135.6 Å²	135.6	88%	0.877	80%	0.803	S	S	*	*			trans	-135.7	132.1	148.4	-54.5	178.7	0	0	0	109.1
1136	S	33.4	Very low	37.4	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	80%	0.802	S	S	*	*			trans	-128.4	140.6	176.8	-64	0	0	0	0	111.3
1137	R	40.7	Very low	37.4	Very low	252 Å²	252	135.8 Å²	135.8	95%	0.951	81%	0.81	S	S	*	*			trans	-171.2	155.1	156.9	-113.7	160.6	-178.1	-177.8	-0.6	114.9
1138	A	40.6	Very low	37	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	81%	0.812	S	S	*	*			trans	61.4	106.7	172.4	0	0	0	0	0	116
1139	S	34.1	Very low	36.9	Very low	110 Å²	110	138.9 Å²	138.9	77%	0.769	82%	0.817	S	S	*	*			cis	101.4	119.9	18.8	-52.5	0	0	0	0	115.8
1140	S	34.3	Very low	36.5	Very low	111 Å²	111	139.4 Å²	139.4	78%	0.776	81%	0.811	S	S	*	*			trans	66.4	118.1	151.3	-51.1	0	0	0	0	118.5
1141	T	37.8	Very low	36.4	Very low	145 Å²	145	140.7 Å²	140.7	89%	0.89	82%	0.82	S	S	*	*				-169.4	157.8	69	32	0	0	0	0	112.4
1142	S	34.3	Very low	36.2	Very low	110 Å²	110	142 Å²	142	77%	0.769	82%	0.822	S	S	*	*			trans	-153.9	144.4	176	57.4	0	0	0	0	111.1
1143	R	39.3	Very low	35.8	Very low	237 Å²	237	145 Å²	145	89%	0.894	83%	0.827	S	S	*	*			trans	-171.3	151.6	169.2	-116.4	158.5	-155	-106.3	-0.2	116.1
1144	L	40.4	Very low	35.5	Very low	149 Å²	149	145.4 Å²	145.4	78%	0.78	83%	0.829	S	S	*	*			trans	78.4	80	159.2	-57.1	177.3	0	0	0	121.2
1145	S	33.6	Very low	35.4	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	83%	0.831	S	S	*	*				41.3	119.2	107.3	-47.8	0	0	0	0	123.3
1146	S	31.8	Very low	35.3	Very low	117 Å²	117	151 Å²	151	82%	0.818	83%	0.827	S	S	*	*				27.2	133.8	127.3	-49.4	0	0	0	0	123.6
1147	T	34.6	Very low	35.6	Very low	153 Å²	153	152.1 Å²	152.1	94%	0.939	83%	0.832	S	S	*	*			trans	-156.3	168.1	139.1	17.8	0	0	0	0	109.4
1148	S	31.4	Very low	35.6	Very low	113 Å²	113	152 Å²	152	79%	0.79	83%	0.831	S	S	*	*			trans	-131.1	151.2	-167.6	54.2	0	0	0	0	114.2
1149	F	35.9	Very low	35.4	Very low	207 Å²	207	150.4 Å²	150.4	91%	0.908	82%	0.823	S	S	*	*			trans	-159.6	163.4	144.5	-142.7	-103.4	0	0	0	112.7
1150	M	33.7	Very low	35.8	Very low	164 Å²	164	154.7 Å²	154.7	81%	0.808	82%	0.822	S	S	*	*			trans	-102.6	151	-175.4	-64.8	172.1	59.9	0	0	113.2
1151	S	34.6	Very low	36	Very low	126 Å²	126	155.7 Å²	155.7	88%	0.881	82%	0.818	S	S	*	*			trans	-174.8	157	139.4	-83.4	0	0	0	0	111.3
1152	E	32.7	Very low	36	Very low	182 Å²	182	154 Å²	154	85%	0.85	81%	0.811	S	S	*	*			trans	-83.7	141.6	-169.5	-59.8	158.2	87.3	0	0	114.3
1153	Q	33.6	Very low	36.5	Very low	197 Å²	197	152.4 Å²	152.4	92%	0.921	80%	0.801	S	S	*	*			trans	-161.9	147.5	133.5	-115.3	161.8	72.7	0	0	113.6
1154	S	31.2	Very low	36.9	Very low	109 Å²	109	147.1 Å²	147.1	76%	0.762	79%	0.789	S	S	*	*			trans	-68.4	128.6	-167.2	57.8	0	0	0	0	116
1155	E	35.5	Very low	37.4	Very low	178 Å²	178	143.5 Å²	143.5	83%	0.832	77%	0.773	S	S	*	*			trans	-131.5	159.9	160.4	-87.4	-103.9	75.5	0	0	111
1156	R	37.1	Very low	38.2	Very low	207 Å²	207	144.4 Å²	144.4	78%	0.781	77%	0.769	S	S	*	*			trans	-105.8	144.3	-157.7	-61.7	173.9	176	85.8	-1.9	113.9	R1158	R1156-R1158 PolarHBondContact O-N 3.23Å
1157	P	41.1	Very low	39.3	Very low	130 Å²	130	142.3 Å²	142.3	84%	0.844	75%	0.752	S	S	*	*			trans	-69.6	116.8	174.7	28.7	-34.1	0	0	0	111.6	G1159	P1157-G1159 PolarHBondContact O-N 3.34Å; P1157-G1159 VanDerWaalsContact O-N 3.1Å
1158	R	39.7	Very low	40.3	Very low	250 Å²	250	140.8 Å²	140.8	94%	0.943	74%	0.737	S	S	*	*			trans	-81.5	79	171.6	-66.6	-170.5	-174.8	-168.4	3.9	110.9	R1156	R1156-R1158 PolarHBondContact O-N 3.23Å
1159	G	36.7	Very low	41.4	Very low	56 Å²	56	140.8 Å²	140.8	58%	0.577	73%	0.728	S	S	*	*			trans	-61.7	152.2	171.1	0	0	0	0	0	112.7	P1157 I1161	P1157-G1159 PolarHBondContact O-N 3.34Å; P1157-G1159 VanDerWaalsContact O-N 3.1Å; G1159-I1161 PolarHBondContact O-N 2.98Å
1160	R	42	Very low	42.4	Very low	201 Å²	201	136.8 Å²	136.8	76%	0.758	71%	0.713	S	S	*	*			trans	-65.8	102.3	176.2	-78.2	177.2	167.9	158.8	-8	110.5	D805 S1162	D805-R1160 IonicContact OD2-NH2 2.61Å; D805-R1160 PolarHBondContact OD2-NH2 3.44Å; R1160-S1162 PolarHBondContact O-N 3.43Å
1161	I	39.1	Very low	43.5	Very low	132 Å²	132	134.5 Å²	134.5	68%	0.677	70%	0.702	S	S	*	*			trans	-86.9	89.3	173.6	-55.8	175.4	0	0	0	108.9	G1159 T1165	G1159-I1161 PolarHBondContact O-N 2.98Å; I1161-T1165 HydrophobicContact CG2-CG2 3.81Å
1162	S	38.7	Very low	44.5	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	68%	0.679	S	S	*	*			trans	-147.9	51.1	-177.9	-170.1	0	0	0	0	114.1	R1160	R1160-S1162 PolarHBondContact O-N 3.43Å
1163	S	45	Very low	45.4	Very low	78 Å²	78	127.3 Å²	127.3	55%	0.545	67%	0.666	S	S	.	*	S	Bend	trans	-162.6	-52.3	162.5	56.4	0	0	0	0	110.6	T1165 L1166 V1167	S1163-T1165 VanDerWaalsContact C-N 3.31Å; S1163-T1165 PolarHBondContact O-N 2.58Å; S1163-L1166 WeakPolarHBondContact O-CB 3.23Å; S1163-L1166 PolarHBondContact O-N 3.18Å; S1163-V1167 PolarHBondContact O-N 2.77Å; S1163-V1167 VanDerWaalsContact O-N 3.12Å
1164	L	47.8	Very low	46.3	Very low	126 Å²	126	121.5 Å²	121.5	66%	0.66	65%	0.645	S	S	*	*	H	α-helix	trans	-59.2	-33.4	-178.3	-79	164.4	0	0	0	114.3	L1168	L1164-L1168 WeakPolarHBondContact O-CB 3.11Å; L1164-L1168 PolarHBondContact O-N 3.11Å
1165	T	50.4	Low	46.9	Very low	72 Å²	72	122.1 Å²	122.1	44%	0.442	63%	0.631	S	S	.	*	H	α-helix	trans	-69.2	-32.5	173.7	26.2	0	0	0	0	113.1	I1161 S1163 L1169	I1161-T1165 HydrophobicContact CG2-CG2 3.81Å; S1163-T1165 VanDerWaalsContact C-N 3.31Å; S1163-T1165 PolarHBondContact O-N 2.58Å; T1165-L1169 PolarHBondContact O-N 3.11Å
1166	L	50.1	Low	47.6	Very low	126 Å²	126	121.6 Å²	121.6	66%	0.66	63%	0.626	S	S	*	*	H	α-helix	trans	-70.8	-44.3	175.6	-156.6	78.4	0	0	0	110	S1163 L1168 L1169 M1170	S1163-L1166 WeakPolarHBondContact O-CB 3.23Å; S1163-L1166 PolarHBondContact O-N 3.18Å; L1166-L1168 VanDerWaalsContact C-N 3.35Å; L1166-L1168 PolarHBondContact O-N 2.91Å; L1166-L1169 PolarHBondContact O-N 2.89Å; L1166-M1170 WeakPolarHBondContact O-CB 3.5Å; L1166-M1170 WeakPolarHBondContact O-CG 3.43Å; L1166-M1170 PolarHBondContact O-N 3.38Å
1167	V	55.3	Low	48.2	Very low	74 Å²	74	119.7 Å²	119.7	45%	0.448	62%	0.624	S	S	.	*	H	α-helix	trans	-60.3	-43	173.7	178.8	0	0	0	0	111.3	S1163 L1169 M1170 M1171	S1163-V1167 PolarHBondContact O-N 2.77Å; S1163-V1167 VanDerWaalsContact O-N 3.12Å; V1167-L1169 PolarHBondContact O-N 3.12Å; V1167-M1170 PolarHBondContact O-N 3.24Å; V1167-M1171 HydrophobicContact CG1-CE 4.11Å; V1167-M1171 HydrophobicContact CG1-CG 4.48Å; V1167-M1171 HydrophobicContact CG1-SD 4.03Å; V1167-M1171 WeakPolarHBondContact O-CB 3.49Å; V1167-M1171 WeakPolarHBondContact O-CG 3.42Å; V1167-M1171 PolarHBondContact O-N 3.23Å
1168	L	55.4	Low	48.7	Very low	121 Å²	121	117.4 Å²	117.4	63%	0.634	61%	0.608	S	S	*	*	H	α-helix	trans	-65.6	-35.1	176.1	-87.4	162.7	0	0	0	113.3	L1164 L1166 A1172	L1164-L1168 WeakPolarHBondContact O-CB 3.11Å; L1164-L1168 PolarHBondContact O-N 3.11Å; L1166-L1168 VanDerWaalsContact C-N 3.35Å; L1166-L1168 PolarHBondContact O-N 2.91Å; L1168-A1172 WeakPolarHBondContact O-CB 3.31Å; L1168-A1172 PolarHBondContact O-N 3.01Å
1169	L	54.8	Low	49.1	Very low	113 Å²	113	112.2 Å²	112.2	59%	0.592	59%	0.594	S	S	*	*	H	α-helix	trans	-69.4	-45.1	171.2	-108.8	92.1	0	0	0	111.7	T1165 L1166 V1167 M1171 A1172 L1173	T1165-L1169 PolarHBondContact O-N 3.11Å; L1166-L1169 PolarHBondContact O-N 2.89Å; V1167-L1169 PolarHBondContact O-N 3.12Å; L1169-M1171 VanDerWaalsContact C-N 3.27Å; L1169-M1171 PolarHBondContact O-N 3.36Å; L1169-A1172 PolarHBondContact O-N 3.47Å; L1169-L1173 WeakPolarHBondContact O-CG 3.39Å; L1169-L1173 PolarHBondContact O-N 3.41Å
1170	M	56.8	Low	49.8	Very low	122 Å²	122	116.8 Å²	116.8	60%	0.601	60%	0.598	S	S	*	*	H	α-helix	trans	-62.1	-33.7	-179.9	-64.5	-98.8	73.5	0	0	112	L1166 V1167 L1173 P1174	L1166-M1170 WeakPolarHBondContact O-CB 3.5Å; L1166-M1170 WeakPolarHBondContact O-CG 3.43Å; L1166-M1170 PolarHBondContact O-N 3.38Å; V1167-M1170 PolarHBondContact O-N 3.24Å; M1170-L1173 HydrophobicContact CE-CD1 4.22Å; M1170-P1174 WeakPolarHBondContact O-CD 3.29Å
1171	M	55.4	Low	50.3	Low	116 Å²	116	110.7 Å²	110.7	57%	0.571	59%	0.586	S	S	*	*	H	α-helix	trans	-82.3	-27.4	174.1	-69.9	-177	170.1	0	0	113.8	V1167 L1169	V1167-M1171 HydrophobicContact CG1-CE 4.11Å; V1167-M1171 HydrophobicContact CG1-CG 4.48Å; V1167-M1171 HydrophobicContact CG1-SD 4.03Å; V1167-M1171 WeakPolarHBondContact O-CB 3.49Å; V1167-M1171 WeakPolarHBondContact O-CG 3.42Å; V1167-M1171 PolarHBondContact O-N 3.23Å; L1169-M1171 VanDerWaalsContact C-N 3.27Å; L1169-M1171 PolarHBondContact O-N 3.36Å
1172	A	55.6	Low	50.8	Low	50 Å²	50	114.5 Å²	114.5	41%	0.413	59%	0.592	S	S	.	*	H	α-helix	trans	-77.8	-24.3	177.9	0	0	0	0	0	114	L1168 L1169 K1176	L1168-A1172 WeakPolarHBondContact O-CB 3.31Å; L1168-A1172 PolarHBondContact O-N 3.01Å; L1169-A1172 PolarHBondContact O-N 3.47Å; A1172-K1176 PolarHBondContact O-N 3.23Å
1173	L	52.8	Low	51.2	Low	107 Å²	107	116.4 Å²	116.4	56%	0.56	59%	0.593	S	S	*	*	H	α-helix	trans	-65.5	-52.9	178.7	-75.6	166.2	0	0	0	113.9	L1169 M1170 Y1175 K1176 F1177	L1169-L1173 WeakPolarHBondContact O-CG 3.39Å; L1169-L1173 PolarHBondContact O-N 3.41Å; M1170-L1173 HydrophobicContact CE-CD1 4.22Å; L1173-Y1175 VanDerWaalsContact C-N 3.34Å; L1173-Y1175 PolarHBondContact O-N 3.39Å; L1173-K1176 PolarHBondContact O-N 2.95Å; L1173-F1177 PolarHBondContact O-N 3.47Å
1174	P	51.4	Low	51	Low	75 Å²	75	123.6 Å²	123.6	49%	0.487	62%	0.615	S	S	.	*	H	α-helix	trans	-64.8	-37.3	176.5	25	-33.5	0	0	0	112.1	M1170 K1176 F1177 V1178	M1170-P1174 WeakPolarHBondContact O-CD 3.29Å; P1174-K1176 VanDerWaalsContact C-N 3.26Å; P1174-K1176 PolarHBondContact O-N 2.81Å; P1174-F1177 WeakPolarHBondContact O-CB 3.41Å; P1174-F1177 PolarHBondContact O-N 3.17Å; P1174-V1178 PolarHBondContact O-N 2.91Å; P1174-V1178 VanDerWaalsContact O-N 3.07Å
1175	Y	44	Very low	51.2	Low	122 Å²	122	123.5 Å²	123.5	48%	0.478	61%	0.613	S	S	.	*	H	α-helix	trans	-57.5	-37.4	175.9	-110.6	-87.1	0	0	0	113	W201 L1173 F1177 Q1179	W201-Y1175 HydrophobicContact CH2-CE2 4.33Å; W201-Y1175 AromaticContact CH2-CZ 3.78Å; W201-Y1175 WeakPolarHBondContact CH2-OH 3.48Å; W201-Y1175 HydrophobicContact CZ2-CE2 4.45Å; L1173-Y1175 VanDerWaalsContact C-N 3.34Å; L1173-Y1175 PolarHBondContact O-N 3.39Å; Y1175-F1177 VanDerWaalsContact C-N 3.31Å; Y1175-Q1179 WeakPolarHBondContact O-CB 3.23Å; Y1175-Q1179 PolarHBondContact O-N 3.3Å
1176	K	50.9	Low	51.2	Low	167 Å²	167	126.2 Å²	126.2	73%	0.726	62%	0.622	S	S	*	*	H	α-helix	trans	-76.7	-13.2	175.6	-81.6	-165.8	170.4	-166.6	0	114.7	A1172 L1173 P1174	A1172-K1176 PolarHBondContact O-N 3.23Å; L1173-K1176 PolarHBondContact O-N 2.95Å; P1174-K1176 VanDerWaalsContact C-N 3.26Å; P1174-K1176 PolarHBondContact O-N 2.81Å
1177	F	48.5	Very low	51.3	Low	167 Å²	167	126.2 Å²	126.2	73%	0.732	62%	0.619	S	S	*	*	H	α-helix	trans	-84.7	-53.7	173.3	-150.6	-100.1	0	0	0	109.9	L1173 P1174 Y1175 Q1179 K1180 S1181	L1173-F1177 PolarHBondContact O-N 3.47Å; P1174-F1177 WeakPolarHBondContact O-CB 3.41Å; P1174-F1177 PolarHBondContact O-N 3.17Å; Y1175-F1177 VanDerWaalsContact C-N 3.31Å; F1177-Q1179 VanDerWaalsContact C-N 3.28Å; F1177-Q1179 PolarHBondContact O-N 3.33Å; F1177-K1180 PolarHBondContact O-N 2.98Å; F1177-S1181 PolarHBondContact O-N 3.01Å
1178	V	52.5	Low	51	Low	82 Å²	82	129.2 Å²	129.2	50%	0.497	63%	0.629	S	S	.	*	H	α-helix	trans	-61.1	-33.2	-180	179.5	0	0	0	0	112.7	P1174 K1180 S1181	P1174-V1178 PolarHBondContact O-N 2.91Å; P1174-V1178 VanDerWaalsContact O-N 3.07Å; V1178-K1180 PolarHBondContact O-N 2.68Å; V1178-S1181 PolarHBondContact O-OG 3.37Å
1179	Q	49	Very low	50.8	Low	141 Å²	141	129.8 Å²	129.8	66%	0.659	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-2.7	176	-158.2	168.9	17.9	0	0	113.7	Y1175 F1177	Y1175-Q1179 WeakPolarHBondContact O-CB 3.23Å; Y1175-Q1179 PolarHBondContact O-N 3.3Å; F1177-Q1179 VanDerWaalsContact C-N 3.28Å; F1177-Q1179 PolarHBondContact O-N 3.33Å
1180	K	51.1	Low	50.5	Low	152 Å²	152	130.9 Å²	130.9	66%	0.661	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-22.9	173.3	-140.2	-175.2	-176.9	-161.9	0	113.1	F1177 V1178 R1182 F1184	F1177-K1180 PolarHBondContact O-N 2.98Å; V1178-K1180 PolarHBondContact O-N 2.68Å; K1180-R1182 VanDerWaalsContact C-N 3.27Å; K1180-R1182 PolarHBondContact O-N 3.4Å; K1180-F1184 PolarHBondContact O-N 2.9Å
1181	S	51.6	Low	50.1	Low	73 Å²	73	131.5 Å²	131.5	51%	0.51	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.8	35.9	167.9	61.3	0	0	0	0	112.8	F1177 V1178	F1177-S1181 PolarHBondContact O-N 3.01Å; V1178-S1181 PolarHBondContact O-OG 3.37Å
1182	R	49.9	Very low	49.6	Very low	213 Å²	213	132.7 Å²	132.7	80%	0.804	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.3	28.3	163.5	-72.7	-167.1	171.7	-168.3	-2.8	110.1	K1180 F1184	K1180-R1182 VanDerWaalsContact C-N 3.27Å; K1180-R1182 PolarHBondContact O-N 3.4Å; R1182-F1184 WeakPolarHBondContact CA-OXT 3.39Å; R1182-F1184 PolarHBondContact N-OXT 3.47Å; R1182-F1184 VanDerWaalsContact N-OXT 3.12Å
1183	L	47.4	Very low	49.2	Very low	148 Å²	148	139.6 Å²	139.6	78%	0.775	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.9	-18.1	-175.1	-88.4	175.9	0	0	0	111.2
1184	F	40.8	Very low	48.8	Very low	228 Å²	228	142.5 Å²	142.5	100%	1	67%	0.666	S	S	*	*				-97	0	122	-70.5	-101.5	0	0	0	108.1	K1180 R1182	K1180-F1184 PolarHBondContact O-N 2.9Å; R1182-F1184 WeakPolarHBondContact CA-OXT 3.39Å; R1182-F1184 PolarHBondContact N-OXT 3.47Å; R1182-F1184 VanDerWaalsContact N-OXT 3.12Å

Retrieved 1,184 of 1,184 residues in 1868.8 ms (Link to these results)

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