A0A087XGE1_POEFO Loading...

Mitogen-activated protein kinase kinase kinase

Negative regulator of TLR4 signaling. Does not activate JNK1/MAPK8 pathway, p38/MAPK14, nor ERK2/MAPK1 pathways.

AlphaFold DB (A0A3B3U249), UniProt , Accession A0A087XGE1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,023 aa.

						>A0A087XGE1_POEFO|A0A087XGE1
MDVSQAASPNGEGRPGGGGTGEHAWTECPTVRSWAHSAPLCPTRSLWTAAYDYEASGEDELSLRRGDVVEVLSKDAAISGDEGWWTGKLNHRVGIFPSNYVTYQPAIYRIPATSGSAGVSEQVPSSPTQIPFSELVLEEIIGVGGFGKVYRGTWKDQEVAVKAARQDPDEDITATAASVKQEAKLFSMLQHPNIIKLEGVCLEEPNLCLVMEYARGGTLNRALTGRRIPPHILVNWAVQIARGMLYLHEEAVVPIIHRDLKSSNILLLEKIENDDIGRKTLKITDFGLAREWHKTTKMSAAGTYSWMAPEVIKSSLFSKGSDVWSYGVLLWELLTGEVPYRGIDGLAVAYGVAVNKLTLPIPSTCPEPFAKLMEECWDQDPHVRPSFSCILEQLSAIEEAVMATMPQDSFHSMQDDWRVEIQEMFDELRTKEKELRSREEELTRAALQQKSQEELLKRREQQLAEREINVLERELNILIFQLNKDKPNVKKRKGKFKRSRLKLKDGNRISLPSDFQHKITVQASPSMDKRRSLHSTSSSPPSSPTLIPRLRAIQLTQDESNRTWGRSSLFRPEEFDDVKKGIKKKGRTWGPSSVQSKERPAAAERVRPLSDGSNPWSTSLLKSQKSVPLAALFGEQVGAGREEAFPQECPDSSSKPKQLKFPNQVYIDLPLWKDETQPQSPGGSGGPGDAGVGAGSPPETPEDPCTTTSTSSTSTTPQLTPTNSLKRASARRKTDFALYGCGSLLASVVLGYDIREAIRTSAPPEECETPKEEKKKKEGLFQRATRFRRSTSPPGGRSRKEDASSNGGAAPPVNLVSMSAIMECNSTKCLLQPEAEASELNPGKAEPAVNDDNSETSRPVRAAAADSQSSKPAAETQKAEQSQSRPPEQSNHNTGTRLRRKKYTANHNTHNGPPAPPAAQRKQEKEEKPANGDAVPRQRPVSFRAKPHAWALLRGRNKSYSLGHYSGEKTAQDLSVVLSSEVGCSLLDMDTEGQKRDCTVPLCRIQSSPARPSMFELEKEFFS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.4	Very low	32.7	Very low	232 Å²	232	130.9 Å²	130.9	100%	1.143	81%	0.813	S	S	*	*				0	129.6	0	-71.1	162.4	168.5	0	0	106.2
2	D	28.8	Very low	32.5	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	83%	0.827	S	S	*	*			trans	51.5	117.5	157.8	-55.6	-19.8	0	0	0	119.5
3	V	33.4	Very low	32.2	Very low	128 Å²	128	133.2 Å²	133.2	78%	0.776	83%	0.828	S	S	*	*				80.6	130.4	65.8	162.5	0	0	0	0	111.5
4	S	35.4	Very low	32.2	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	83%	0.834	S	S	*	*			cis	-172.7	167.9	-8.2	-97	0	0	0	0	111.9
5	Q	33.4	Very low	33.2	Very low	185 Å²	185	140.1 Å²	140.1	86%	0.864	83%	0.834	S	S	*	*			trans	67.9	135.3	156.9	-74.2	171.4	11.5	0	0	118.2
6	A	31.7	Very low	32.9	Very low	99 Å²	99	136.4 Å²	136.4	82%	0.818	83%	0.834	S	S	*	*				93.3	150.8	56.3	0	0	0	0	0	112.4
7	A	29.2	Very low	32.7	Very low	101 Å²	101	133.1 Å²	133.1	84%	0.835	83%	0.834	S	S	*	*			cis	-152.6	-174.3	6	0	0	0	0	0	112.4
8	S	31.7	Very low	32.4	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	84%	0.838	S	S	*	*			trans	-72.4	174.9	-179.3	-39.2	0	0	0	0	115.5
9	P	47.3	Very low	32.3	Very low	110 Å²	110	127.8 Å²	127.8	71%	0.714	84%	0.836	S	S	*	*				-154.2	160.9	96.7	40.2	-22.5	0	0	0	118.9
10	N	29.1	Very low	32.2	Very low	166 Å²	166	129.1 Å²	129.1	89%	0.888	84%	0.841	S	S	*	*			trans	59.2	153.3	150.3	-59.5	-1.6	0	0	0	122
11	G	30.5	Very low	32	Very low	66 Å²	66	126 Å²	126	68%	0.68	83%	0.832	S	S	*	*			cis	162.8	155.3	-10.8	0	0	0	0	0	115.9
12	E	30.4	Very low	32.1	Very low	210 Å²	210	123.1 Å²	123.1	98%	0.981	82%	0.816	S	S	*	*			trans	75.9	148.8	164	-51.3	-159.9	117.1	0	0	121.5
13	G	28.7	Very low	32.2	Very low	82 Å²	82	123.8 Å²	123.8	85%	0.845	81%	0.814	S	S	*	*			trans	135.7	72	168.7	0	0	0	0	0	118.7
14	R	31.2	Very low	31.9	Very low	241 Å²	241	121.7 Å²	121.7	91%	0.909	81%	0.81	S	S	*	*			trans	-150.6	140.5	169.4	-130.5	-173.9	-170.4	-160.3	4.9	111
15	P	47.1	Very low	31.6	Very low	129 Å²	129	128 Å²	128	84%	0.838	82%	0.821	S	S	*	*				-135.2	-176.3	93.8	16.5	6.8	0	0	0	111.8
16	G	29.4	Very low	31.3	Very low	80 Å²	80	124.6 Å²	124.6	83%	0.825	81%	0.812	S	S	*	*			cis	119.3	139.8	10.6	0	0	0	0	0	110.9
17	G	28.8	Very low	31.1	Very low	81 Å²	81	127.8 Å²	127.8	84%	0.835	81%	0.81	S	S	*	*			cis	175.3	169.2	-5.2	0	0	0	0	0	112.4
18	G	28.3	Very low	30.8	Very low	88 Å²	88	128 Å²	128	91%	0.907	81%	0.805	S	S	*	*			trans	81.2	148.9	178.4	0	0	0	0	0	115.3
19	G	29.4	Very low	30.8	Very low	78 Å²	78	128 Å²	128	80%	0.804	80%	0.801	S	S	*	*			cis	123.2	134.9	2.1	0	0	0	0	0	111.6
20	T	30.7	Very low	29.8	Very low	152 Å²	152	129 Å²	129	93%	0.933	81%	0.806	S	S	*	*			cis	-118.1	-147	7.2	59.1	0	0	0	0	110.7
21	G	29.2	Very low	29.7	Very low	64 Å²	64	127 Å²	127	66%	0.66	80%	0.799	S	S	*	*			cis	176.6	175.6	2.6	0	0	0	0	0	115.5
22	E	31.4	Very low	29.4	Very low	173 Å²	173	134.4 Å²	134.4	81%	0.808	81%	0.807	S	S	*	*			trans	47.3	115.2	160.2	-56	-160	104.1	0	0	124.4
23	H	30.6	Very low	29.2	Very low	163 Å²	163	129.3 Å²	129.3	76%	0.755	79%	0.794	S	S	*	*			trans	41.6	127.5	133.6	-56.6	-66.2	0	0	0	120.9
24	A	27.5	Very low	29	Very low	83 Å²	83	137.8 Å²	137.8	69%	0.686	80%	0.801	S	S	*	*			cis	-176.1	150.3	39.9	0	0	0	0	0	114.1
25	W	27.5	Very low	28.8	Very low	224 Å²	224	129.8 Å²	129.8	85%	0.848	79%	0.786	S	S	*	*			trans	7.2	141	138.7	-50.8	100.3	0	0	0	120.5
26	T	27.1	Very low	27.9	Very low	113 Å²	113	132.3 Å²	132.3	69%	0.693	79%	0.787	S	S	*	*			cis	-174.8	177.1	-17.2	10.9	0	0	0	0	106.5
27	E	27.5	Very low	27.8	Very low	166 Å²	166	134.1 Å²	134.1	78%	0.776	79%	0.787	S	S	*	*			cis	-113.5	-122.4	2	-54.9	176.3	-179.6	0	0	110.6
28	C	23.6	Very low	27.9	Very low	106 Å²	106	135 Å²	135	72%	0.716	79%	0.786	S	S	*	*			cis	-151.7	144.7	-6	-155	0	0	0	0	108.9
29	P	32	Very low	28	Very low	112 Å²	112	136.7 Å²	136.7	73%	0.727	78%	0.781	S	S	*	*			trans	-102.2	145.5	-160.1	37	-33.4	0	0	0	116.2
30	T	25.9	Very low	28	Very low	133 Å²	133	141.3 Å²	141.3	82%	0.816	79%	0.787	S	S	*	*			trans	-161.2	143.5	154.4	-16.6	0	0	0	0	110.5
31	V	26.2	Very low	27.8	Very low	122 Å²	122	139.4 Å²	139.4	74%	0.739	78%	0.778	S	S	*	*			trans	67.1	122.1	166.4	-176.2	0	0	0	0	113.9
32	R	25.7	Very low	28.1	Very low	222 Å²	222	142 Å²	142	84%	0.838	78%	0.783	S	S	*	*				-172.5	153.9	58.6	-141.8	156.8	-150.3	175.3	5.2	112.9
33	S	26.1	Very low	28.4	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	78%	0.782	S	S	*	*			trans	26.1	110.2	138.8	-179.2	0	0	0	0	119.2
34	W	24.4	Very low	29.3	Very low	260 Å²	260	140.4 Å²	140.4	99%	0.985	78%	0.778	S	S	*	*			trans	-108.2	132.4	154.8	-88.4	24.9	0	0	0	110.4
35	A	26	Very low	31.3	Very low	73 Å²	73	138.9 Å²	138.9	60%	0.603	76%	0.762	S	S	*	*			trans	-121	147.8	173	0	0	0	0	0	109.6
36	H	28.8	Very low	33.9	Very low	182 Å²	182	132.8 Å²	132.8	84%	0.843	75%	0.745	S	S	*	*			trans	58.5	101.4	172.5	-51.8	-65.3	0	0	0	117.5
37	S	26.6	Very low	36.7	Very low	119 Å²	119	129 Å²	129	83%	0.832	72%	0.718	S	S	*	*			trans	-146.2	112.6	134.9	-77.8	0	0	0	0	108	P39	S37-P39 WeakPolarHBondContact O-CD 3.08Å
38	A	31.1	Very low	39.5	Very low	99 Å²	99	122.2 Å²	122.2	82%	0.818	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-84.6	123.6	-176.5	0	0	0	0	0	110.6
39	P	31	Very low	42.5	Very low	124 Å²	124	117.3 Å²	117.3	81%	0.805	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-78.3	138	171.6	-13	30.3	0	0	0	111.5	S37	S37-P39 WeakPolarHBondContact O-CD 3.08Å
40	L	28.1	Very low	44.6	Very low	175 Å²	175	113.3 Å²	113.3	92%	0.916	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-65.6	131.7	176.2	-63.9	154.8	0	0	0	111.3
41	C	27.6	Very low	46.7	Very low	111 Å²	111	109.8 Å²	109.8	75%	0.75	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-79.8	151.8	152.6	-80.9	0	0	0	0	108.9
42	P	36.5	Very low	49.6	Very low	119 Å²	119	107.8 Å²	107.8	77%	0.773	59%	0.589	S	S	*	*			cis	-138.2	115.2	41.8	35.3	-14.8	0	0	0	115.9	R44	P42-R44 PolarHBondContact O-N 3.13Å
43	T	36.3	Very low	52.5	Low	127 Å²	127	98.9 Å²	98.9	78%	0.779	56%	0.555	S	S	*	*			trans	-77.2	114.2	150.3	37.9	0	0	0	0	108.6	S45	T43-S45 PolarHBondContact O-N 3.34Å; T43-S45 VanDerWaalsContact O-N 3.14Å
44	R	49.9	Very low	55.5	Low	176 Å²	176	101 Å²	101	66%	0.664	55%	0.554	S	S	*	*			trans	-58	118.5	175	-67.5	167	173.8	-121.3	-2.4	109	P42 L46 E70	P42-R44 PolarHBondContact O-N 3.13Å; R44-L46 PolarHBondContact O-N 3.07Å; R44-E70 WeakPolarHBondContact CD-OE1 3.47Å; R44-E70 VanDerWaalsContact CG-OE1 3.27Å; R44-E70 WeakPolarHBondContact CG-OE1 3.3Å; R44-E70 IonicContact CZ-OE1 3.91Å; R44-E70 IonicContact NE-OE1 3.32Å; R44-E70 PolarHBondContact NE-OE1 2.98Å; R44-E70 IonicContact NH1-OE1 2.66Å; R44-E70 PolarHBondContact NH1-OE1 3.23Å; R44-E70 IonicContact NH1-OE2 3.19Å; R44-E70 PolarHBondContact NH1-OE2 2.99Å
45	S	69.8	Low	58.6	Low	50 Å²	50	90 Å²	90	35%	0.35	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	89.1	179.9	-78.4	0	0	0	0	109.8	T43 V71	T43-S45 PolarHBondContact O-N 3.34Å; T43-S45 VanDerWaalsContact O-N 3.14Å; S45-V71 WeakPolarHBondContact O-CB 3.01Å; S45-V71 PolarHBondContact O-N 2.91Å
46	L	82.7	Confident	61.2	Low	96 Å²	96	91.7 Å²	91.7	50%	0.503	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.2	172.6	-62.4	171.3	0	0	0	109.4	R44 V68 V69 E70	R44-L46 PolarHBondContact O-N 3.07Å; L46-V68 HydrophobicContact CB-CG1 3.94Å; L46-V68 HydrophobicContact CD2-CG1 4.05Å; L46-V68 HydrophobicContact CG-CG1 4.42Å; L46-V69 WeakPolarHBondContact CA-O 3.45Å; L46-E70 HydrophobicContact CD2-CB 4.03Å
47	W	85.9	Confident	63.7	Low	35 Å²	35	84.8 Å²	84.8	13%	0.133	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.9	178.6	-71	57	0	0	0	109.2	V68 V69 V71 W85 V101 T102 Y103	W47-V68 CarbonylContact O-C 3.57Å; W47-V68 WeakPolarHBondContact O-CA 3.44Å; W47-V69 PolarHBondContact N-O 2.65Å; W47-V69 PolarHBondContact O-N 2.98Å; W47-V71 HydrophobicContact CB-CG2 3.9Å; W47-V71 HydrophobicContact CD2-CG2 4.4Å; W47-V71 HydrophobicContact CG-CG2 3.62Å; W47-W85 AromaticContact CD2-CZ3 3.98Å; W47-W85 HydrophobicContact CD2-CZ3 3.98Å; W47-W85 HydrophobicContact CE3-CH2 4.14Å; W47-W85 AromaticContact CE3-CZ3 3.59Å; W47-W85 HydrophobicContact CE3-CZ3 3.59Å; W47-W85 AromaticContact CH2-CH2 3.78Å; W47-W85 HydrophobicContact CH2-CH2 3.78Å; W47-W85 HydrophobicContact CH2-CZ3 4Å; W47-W85 HydrophobicContact CZ2-CH2 4.38Å; W47-W85 HydrophobicContact CZ2-CZ3 4.35Å; W47-W85 AromaticContact CZ3-CH2 3.62Å; W47-W85 HydrophobicContact CZ3-CH2 3.62Å; W47-W85 AromaticContact CZ3-CZ3 3.59Å; W47-W85 HydrophobicContact CZ3-CZ3 3.59Å; W47-V101 HydrophobicContact CB-CB 3.99Å; W47-V101 HydrophobicContact CB-CG2 4.14Å; W47-V101 HydrophobicContact CD2-CG2 4.4Å; W47-V101 HydrophobicContact CE3-CB 4.43Å; W47-V101 HydrophobicContact CE3-CG2 3.87Å; W47-T102 CarbonylContact C-O 3.57Å; W47-T102 WeakPolarHBondContact CA-O 3.28Å; W47-T102 WeakPolarHBondContact CB-O 3.48Å; W47-Y103 HydrophobicContact CD2-CD2 4.3Å; W47-Y103 AromaticContact CE2-CD2 3.54Å; W47-Y103 VanDerWaalsContact CE3-N 3.32Å; W47-Y103 HydrophobicContact CH2-CD2 4.35Å; W47-Y103 HydrophobicContact CH2-CG 4.23Å; W47-Y103 AromaticContact CZ2-CD2 3.54Å; W47-Y103 HydrophobicContact CZ2-CD2 3.54Å; W47-Y103 HydrophobicContact CZ2-CE2 4.43Å; W47-Y103 AromaticContact CZ2-CG 3.86Å; W47-Y103 HydrophobicContact CZ2-CG 3.86Å; W47-Y103 AromaticContact NE1-CD2 3.63Å
48	T	86.4	Confident	66.3	Low	23 Å²	23	87.5 Å²	87.5	14%	0.141	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131	-178.4	-48.5	0	0	0	0	110.3	A50 D67 V101 T102 Q104	T48-A50 PolarHBondContact O-N 2.87Å; T48-D67 CarbonylContact C-O 3.53Å; T48-D67 WeakPolarHBondContact CA-O 3.47Å; T48-V101 CarbonylContact O-C 3.57Å; T48-V101 VanDerWaalsContact O-CA 3.3Å; T48-V101 WeakPolarHBondContact O-CA 3.39Å; T48-T102 PolarHBondContact N-O 3.39Å; T48-T102 PolarHBondContact O-N 2.71Å; T48-Q104 PolarHBondContact OG1-O 2.74Å
49	A	85.9	Confident	69	Low	2 Å²	2	88.7 Å²	88.7	2%	0.017	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	118	173.5	0	0	0	0	0	111	L63 R64 R65 G66 D67 Y100	A49-L63 HydrophobicContact CB-CB 3.93Å; A49-L63 HydrophobicContact CB-CD1 4.19Å; A49-R64 WeakPolarHBondContact CB-O 3.09Å; A49-R65 WeakPolarHBondContact O-CA 3.47Å; A49-G66 PolarHBondContact O-N 2.86Å; A49-D67 HydrophobicContact CB-CB 4.19Å; A49-D67 PolarHBondContact N-O 2.7Å; A49-Y100 CarbonylContact C-O 3.55Å; A49-Y100 WeakPolarHBondContact CA-O 3.16Å
50	A	75.3	Confident	71.8	Confident	28 Å²	28	83.7 Å²	83.7	23%	0.231	46%	0.462	C	S	.	.			trans	-83.9	-25.1	-178.6	0	0	0	0	0	112.8	T48 R65 Y100 T102	T48-A50 PolarHBondContact O-N 2.87Å; A50-R65 WeakPolarHBondContact O-CD 3.4Å; A50-R65 WeakPolarHBondContact O-CG 3.3Å; A50-R65 PolarHBondContact O-NE 2.91Å; A50-R65 VanDerWaalsContact O-NE 3.08Å; A50-Y100 PolarHBondContact N-O 2.93Å; A50-T102 HydrophobicContact CB-CG2 4.46Å
51	Y	71.3	Confident	74.8	Confident	59 Å²	59	75.5 Å²	75.5	23%	0.231	42%	0.419	C	S	.	.	S	Bend	trans	-138.3	159.5	-178.9	-48.2	-80.2	0	0	0	110.1	Y100 H293	Y51-Y100 HydrophobicContact CD2-CD1 4.49Å; Y51-H293 AromaticContact CE2-CD2 3.99Å; Y51-H293 AromaticContact CZ-CD2 3.8Å; Y51-H293 PolarHBondContact OH-CD2 3.48Å; Y51-H293 VanDerWaalsContact OH-CD2 3.24Å
52	D	85.3	Confident	77.8	Confident	80 Å²	80	73 Å²	73	43%	0.428	40%	0.402	S	S	.	.			trans	-72.5	139.1	170.5	-81.8	35.8	0	0	0	110.4	L63 R64 R65 Y100	D52-L63 CarbonylContact C-O 3.53Å; D52-L63 WeakPolarHBondContact CA-O 3.4Å; D52-R64 WeakPolarHBondContact OD2-CD 3.3Å; D52-R64 IonicContact OD2-CZ 3.66Å; D52-R64 IonicContact OD2-NE 3.36Å; D52-R64 IonicContact OD2-NH1 3.02Å; D52-R64 PolarHBondContact OD2-NH1 3.22Å; D52-R65 VanDerWaalsContact OD1-CB 3.29Å; D52-R65 WeakPolarHBondContact OD1-CB 3.44Å; D52-R65 PolarHBondContact OD1-N 2.63Å; D52-Y100 WeakPolarHBondContact O-CE1 3.45Å
53	Y	86.9	Confident	80.4	Confident	36 Å²	36	67.3 Å²	67.3	14%	0.141	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-135.2	134.5	175.4	-173.7	-106.9	0	0	0	109.8	E60 S62 L63 W84 P97 Y100	Y53-E60 PolarHBondContact OH-OE2 3.19Å; Y53-S62 CarbonylContact O-C 3.54Å; Y53-S62 VanDerWaalsContact O-CA 3.29Å; Y53-S62 WeakPolarHBondContact O-CA 3.33Å; Y53-L63 PolarHBondContact N-O 2.89Å; Y53-L63 PolarHBondContact O-N 2.93Å; Y53-L63 VanDerWaalsContact O-O 3.06Å; Y53-W84 HydrophobicContact CE1-CZ3 4.48Å; Y53-W84 WeakPolarHBondContact OH-CH2 3.45Å; Y53-P97 HydrophobicContact CD2-CG 4.05Å; Y53-P97 HydrophobicContact CE1-CG 4.36Å; Y53-P97 HydrophobicContact CE2-CG 3.64Å; Y53-Y100 HydrophobicContact CD2-CD1 4.08Å; Y53-Y100 AromaticContact CD2-CE1 3.88Å; Y53-Y100 HydrophobicContact CD2-CE1 3.88Å; Y53-Y100 HydrophobicContact CG-CD1 4.34Å
54	E	89.8	Confident	82.7	Confident	148 Å²	148	67.7 Å²	67.7	69%	0.692	35%	0.353	S	S	*	.			trans	-116.8	120.7	179.4	-172.1	155.5	-125.2	0	0	109.3	S56	E54-S56 PolarHBondContact O-N 2.8Å
55	A	88.4	Confident	84.2	Confident	28 Å²	28	68.5 Å²	68.5	23%	0.231	36%	0.356	C	S	.	.			trans	-61.4	128.4	-176.8	0	0	0	0	0	112.1	E60 S62	A55-E60 WeakPolarHBondContact CA-OE2 3.47Å; A55-E60 HydrophobicContact CB-CB 3.56Å; A55-S62 VanDerWaalsContact CB-OG 3.25Å; A55-S62 WeakPolarHBondContact CB-OG 3.41Å; A55-S62 PolarHBondContact N-OG 3.35Å
56	S	81	Confident	84.4	Confident	109 Å²	109	68.4 Å²	68.4	76%	0.762	36%	0.362	S	S	*	.	S	Bend	trans	-86.7	-25.6	177	95.9	0	0	0	0	113.3	E54 E60	E54-S56 PolarHBondContact O-N 2.8Å; S56-E60 WeakPolarHBondContact CB-OE1 3.42Å; S56-E60 PolarHBondContact N-OE2 2.82Å; S56-E60 PolarHBondContact OG-OE1 3.25Å
57	G	81.9	Confident	84.6	Confident	37 Å²	37	65.9 Å²	65.9	38%	0.381	35%	0.35	S	S	.	.	S	Bend	trans	-129.1	177	177.8	0	0	0	0	0	113.9	E60	G57-E60 PolarHBondContact N-OE1 2.93Å; G57-E60 PolarHBondContact O-N 3.41Å
58	E	82.2	Confident	84.7	Confident	175 Å²	175	68 Å²	68	82%	0.818	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-25.9	-178	62.2	-169.6	142.3	0	0	114.2	E60	E58-E60 VanDerWaalsContact C-N 3.28Å; E58-E60 PolarHBondContact O-N 2.85Å
59	D	86.3	Confident	84.8	Confident	124 Å²	124	66.9 Å²	66.9	66%	0.663	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.2	173.5	-61.7	-55.9	0	0	0	113.6	G94 I95	D59-G94 CarbonylContact O-C 3.5Å; D59-G94 WeakPolarHBondContact O-CA 3.34Å; D59-I95 PolarHBondContact O-N 2.88Å
60	E	91.2	Very high	85	Confident	19 Å²	19	68.1 Å²	68.1	9%	0.089	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-90.4	153.1	-177.1	-74.6	177.1	-131.5	0	0	113.2	Y53 A55 S56 G57 E58 W84 I95	Y53-E60 PolarHBondContact OH-OE2 3.19Å; A55-E60 WeakPolarHBondContact CA-OE2 3.47Å; A55-E60 HydrophobicContact CB-CB 3.56Å; S56-E60 WeakPolarHBondContact CB-OE1 3.42Å; S56-E60 PolarHBondContact N-OE2 2.82Å; S56-E60 PolarHBondContact OG-OE1 3.25Å; G57-E60 PolarHBondContact N-OE1 2.93Å; G57-E60 PolarHBondContact O-N 3.41Å; E58-E60 VanDerWaalsContact C-N 3.28Å; E58-E60 PolarHBondContact O-N 2.85Å; E60-W84 HydrophobicContact CG-CH2 4.42Å; E60-W84 HydrophobicContact CG-CZ3 4.08Å; E60-I95 CarbonylContact C-O 3.42Å; E60-I95 WeakPolarHBondContact CA-O 3.21Å; E60-I95 HydrophobicContact CG-CD1 4.46Å; E60-I95 HydrophobicContact CG-CG1 4Å
61	L	90.6	Very high	85.7	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.021	36%	0.357	C	S	.	.			trans	-112.4	100.7	-177.1	-165.4	70.6	0	0	0	110.7	L63 V69 L89 R92 I95 F96	L61-L63 HydrophobicContact CD2-CD2 4.16Å; L61-L63 HydrophobicContact CG-CD2 4.19Å; L61-L63 PolarHBondContact O-N 2.95Å; L61-V69 HydrophobicContact CD2-CG1 3.96Å; L61-L89 HydrophobicContact CD1-CB 4.13Å; L61-L89 HydrophobicContact CD2-CB 3.86Å; L61-L89 HydrophobicContact CG-CB 4.2Å; L61-R92 HydrophobicContact CD1-CB 4.01Å; L61-R92 HydrophobicContact CD1-CG 3.87Å; L61-I95 PolarHBondContact N-O 2.84Å; L61-F96 HydrophobicContact CB-CB 4.43Å; L61-F96 HydrophobicContact CB-CD1 4.26Å; L61-F96 HydrophobicContact CD2-CD1 3.84Å; L61-F96 HydrophobicContact CD2-CE1 4.29Å
62	S	90.4	Very high	86.5	Confident	57 Å²	57	69.1 Å²	69.1	40%	0.399	37%	0.37	S	S	.	.			trans	-58.2	135.7	170.4	-58	0	0	0	0	110.8	Y53 A55	Y53-S62 CarbonylContact O-C 3.54Å; Y53-S62 VanDerWaalsContact O-CA 3.29Å; Y53-S62 WeakPolarHBondContact O-CA 3.33Å; A55-S62 VanDerWaalsContact CB-OG 3.25Å; A55-S62 WeakPolarHBondContact CB-OG 3.41Å; A55-S62 PolarHBondContact N-OG 3.35Å
63	L	90.1	Very high	86.6	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-120.6	140.2	179.2	-51.3	-178.7	0	0	0	109.8	A49 D52 Y53 L61 V69 L89 F96 V101	A49-L63 HydrophobicContact CB-CB 3.93Å; A49-L63 HydrophobicContact CB-CD1 4.19Å; D52-L63 CarbonylContact C-O 3.53Å; D52-L63 WeakPolarHBondContact CA-O 3.4Å; Y53-L63 PolarHBondContact N-O 2.89Å; Y53-L63 PolarHBondContact O-N 2.93Å; Y53-L63 VanDerWaalsContact O-O 3.06Å; L61-L63 HydrophobicContact CD2-CD2 4.16Å; L61-L63 HydrophobicContact CG-CD2 4.19Å; L61-L63 PolarHBondContact O-N 2.95Å; L63-V69 HydrophobicContact CD2-CG2 3.58Å; L63-L89 HydrophobicContact CD2-CD2 4.01Å; L63-F96 HydrophobicContact CD1-CB 4.09Å; L63-F96 HydrophobicContact CD1-CD2 4.07Å; L63-F96 HydrophobicContact CD1-CG 4.12Å; L63-F96 HydrophobicContact CG-CB 4.42Å; L63-V101 HydrophobicContact CD1-CG1 3.79Å
64	R	86	Confident	86.5	Confident	135 Å²	135	69 Å²	69	51%	0.509	37%	0.369	S	S	.	.			trans	-106.8	144.2	162.1	-63.1	-63.3	179.3	-177.3	-9.2	109.5	A49 D52 G66 D67	A49-R64 WeakPolarHBondContact CB-O 3.09Å; D52-R64 WeakPolarHBondContact OD2-CD 3.3Å; D52-R64 IonicContact OD2-CZ 3.66Å; D52-R64 IonicContact OD2-NE 3.36Å; D52-R64 IonicContact OD2-NH1 3.02Å; D52-R64 PolarHBondContact OD2-NH1 3.22Å; R64-G66 PolarHBondContact O-N 3.12Å; R64-G66 VanDerWaalsContact O-N 3.1Å; R64-D67 WeakPolarHBondContact CA-OD2 3.5Å; R64-D67 WeakPolarHBondContact CB-OD2 3.36Å; R64-D67 PolarHBondContact N-OD2 2.7Å; R64-D67 VanDerWaalsContact O-CB 3.25Å; R64-D67 WeakPolarHBondContact O-CB 3.41Å; R64-D67 PolarHBondContact O-N 2.76Å
65	R	80.8	Confident	86.1	Confident	193 Å²	193	66.1 Å²	66.1	73%	0.728	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	116.5	179.5	-180	169.9	-173.6	-113.9	-5.5	111	A49 A50 D52	A49-R65 WeakPolarHBondContact O-CA 3.47Å; A50-R65 WeakPolarHBondContact O-CD 3.4Å; A50-R65 WeakPolarHBondContact O-CG 3.3Å; A50-R65 PolarHBondContact O-NE 2.91Å; A50-R65 VanDerWaalsContact O-NE 3.08Å; D52-R65 VanDerWaalsContact OD1-CB 3.29Å; D52-R65 WeakPolarHBondContact OD1-CB 3.44Å; D52-R65 PolarHBondContact OD1-N 2.63Å
66	G	74.8	Confident	85.7	Confident	47 Å²	47	66.3 Å²	66.3	49%	0.485	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.2	-12.3	-173.1	0	0	0	0	0	114.9	A49 R64	A49-G66 PolarHBondContact O-N 2.86Å; R64-G66 PolarHBondContact O-N 3.12Å; R64-G66 VanDerWaalsContact O-N 3.1Å
67	D	86.4	Confident	85.3	Confident	44 Å²	44	65.4 Å²	65.4	24%	0.235	36%	0.359	C	S	.	.			trans	-62.7	137.4	175	-79.9	-27.7	0	0	0	111.5	T48 A49 R64 L89	T48-D67 CarbonylContact C-O 3.53Å; T48-D67 WeakPolarHBondContact CA-O 3.47Å; A49-D67 HydrophobicContact CB-CB 4.19Å; A49-D67 PolarHBondContact N-O 2.7Å; R64-D67 WeakPolarHBondContact CA-OD2 3.5Å; R64-D67 WeakPolarHBondContact CB-OD2 3.36Å; R64-D67 PolarHBondContact N-OD2 2.7Å; R64-D67 VanDerWaalsContact O-CB 3.25Å; R64-D67 WeakPolarHBondContact O-CB 3.41Å; R64-D67 PolarHBondContact O-N 2.76Å; D67-L89 HydrophobicContact CB-CD1 3.88Å; D67-L89 HydrophobicContact CB-CD2 3.85Å; D67-L89 WeakPolarHBondContact OD2-CD2 3.49Å
68	V	87.1	Confident	85.1	Confident	79 Å²	79	68.8 Å²	68.8	48%	0.479	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	109.6	177.8	-176.7	0	0	0	0	109.5	L46 W47 L89	L46-V68 HydrophobicContact CB-CG1 3.94Å; L46-V68 HydrophobicContact CD2-CG1 4.05Å; L46-V68 HydrophobicContact CG-CG1 4.42Å; W47-V68 CarbonylContact O-C 3.57Å; W47-V68 WeakPolarHBondContact O-CA 3.44Å; V68-L89 WeakPolarHBondContact O-CD1 3.44Å
69	V	89.2	Confident	84.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.6	-178	-170.2	0	0	0	0	110	L46 W47 L61 L63 V71 F96 V101	L46-V69 WeakPolarHBondContact CA-O 3.45Å; W47-V69 PolarHBondContact N-O 2.65Å; W47-V69 PolarHBondContact O-N 2.98Å; L61-V69 HydrophobicContact CD2-CG1 3.96Å; L63-V69 HydrophobicContact CD2-CG2 3.58Å; V69-V71 PolarHBondContact O-N 2.79Å; V69-F96 HydrophobicContact CG1-CD1 4.31Å; V69-F96 HydrophobicContact CG1-CE1 3.61Å; V69-F96 HydrophobicContact CG1-CZ 3.92Å; V69-V101 HydrophobicContact CG2-CG1 4.29Å
70	E	90.8	Very high	84.4	Confident	28 Å²	28	57.9 Å²	57.9	13%	0.131	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	101.6	168.3	174.1	172.3	-135.4	0	0	108.6	R44 L46 L72 G87 K88	R44-E70 WeakPolarHBondContact CD-OE1 3.47Å; R44-E70 VanDerWaalsContact CG-OE1 3.27Å; R44-E70 WeakPolarHBondContact CG-OE1 3.3Å; R44-E70 IonicContact CZ-OE1 3.91Å; R44-E70 IonicContact NE-OE1 3.32Å; R44-E70 PolarHBondContact NE-OE1 2.98Å; R44-E70 IonicContact NH1-OE1 2.66Å; R44-E70 PolarHBondContact NH1-OE1 3.23Å; R44-E70 IonicContact NH1-OE2 3.19Å; R44-E70 PolarHBondContact NH1-OE2 2.99Å; L46-E70 HydrophobicContact CD2-CB 4.03Å; E70-L72 HydrophobicContact CG-CD2 4.06Å; E70-L72 PolarHBondContact O-N 2.84Å; E70-G87 CarbonylContact O-C 3.45Å; E70-G87 WeakPolarHBondContact O-CA 3.31Å; E70-K88 HydrophobicContact CB-CB 4.26Å; E70-K88 PolarHBondContact N-O 3.46Å; E70-K88 PolarHBondContact O-N 3.32Å
71	V	90.3	Very high	83.6	Confident	13 Å²	13	62.3 Å²	62.3	8%	0.079	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	120.4	177.6	-174.3	0	0	0	0	109	S45 W47 V69 K74 W85 F96	S45-V71 WeakPolarHBondContact O-CB 3.01Å; S45-V71 PolarHBondContact O-N 2.91Å; W47-V71 HydrophobicContact CB-CG2 3.9Å; W47-V71 HydrophobicContact CD2-CG2 4.4Å; W47-V71 HydrophobicContact CG-CG2 3.62Å; V69-V71 PolarHBondContact O-N 2.79Å; V71-K74 HydrophobicContact CG1-CG 4Å; V71-W85 HydrophobicContact CG1-CB 4.49Å; V71-W85 HydrophobicContact CG1-CE3 4.3Å; V71-W85 HydrophobicContact CG2-CE3 4.48Å; V71-F96 HydrophobicContact CG2-CZ 4.22Å
72	L	88	Confident	82.7	Confident	94 Å²	94	70.5 Å²	70.5	49%	0.492	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-35	-177.1	-63.7	176.5	0	0	0	112	E70 T86 K88 V93	E70-L72 HydrophobicContact CG-CD2 4.06Å; E70-L72 PolarHBondContact O-N 2.84Å; L72-T86 PolarHBondContact N-O 3.01Å; L72-K88 HydrophobicContact CD1-CB 4.08Å; L72-K88 HydrophobicContact CG-CB 4.44Å; L72-V93 HydrophobicContact CD1-CG1 3.91Å; L72-V93 HydrophobicContact CD1-CG2 4.04Å
73	S	85.4	Confident	82.1	Confident	19 Å²	19	69.8 Å²	69.8	13%	0.133	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	148	173.1	-173.2	0	0	0	0	111.8	D75 W85 T86	S73-D75 WeakPolarHBondContact OG-CB 3.34Å; S73-D75 PolarHBondContact OG-N 2.83Å; S73-D75 VanDerWaalsContact OG-N 3.09Å; S73-W85 WeakPolarHBondContact O-CB 3.48Å; S73-T86 PolarHBondContact N-O 2.68Å; S73-T86 PolarHBondContact O-N 2.63Å
74	K	86.5	Confident	82	Confident	96 Å²	96	72.7 Å²	72.7	42%	0.417	41%	0.405	S	S	.	.			trans	-112.6	1.5	169	-64.6	-166.4	169	-157.6	0	113.4	V71 W85	V71-K74 HydrophobicContact CG1-CG 4Å; K74-W85 VanDerWaalsContact CA-CD1 3.46Å; K74-W85 HydrophobicContact CB-CD2 4.43Å; K74-W85 HydrophobicContact CB-CG 4.31Å; K74-W85 HydrophobicContact CD-CD2 4.16Å; K74-W85 HydrophobicContact CD-CE3 4.49Å; K74-W85 HydrophobicContact CD-CH2 4.19Å; K74-W85 HydrophobicContact CD-CZ2 3.73Å; K74-W85 HydrophobicContact CG-CD2 3.81Å; K74-W85 HydrophobicContact CG-CE3 4.37Å; K74-W85 HydrophobicContact CG-CG 4.04Å; K74-W85 HydrophobicContact CG-CZ2 4.27Å
75	D	80.5	Confident	82.3	Confident	86 Å²	86	68.1 Å²	68.1	46%	0.46	39%	0.387	S	S	.	.			trans	-82.5	124.2	-175	-173.1	-9.6	0	0	0	110.5	S73 A77 I78 S79	S73-D75 WeakPolarHBondContact OG-CB 3.34Å; S73-D75 PolarHBondContact OG-N 2.83Å; S73-D75 VanDerWaalsContact OG-N 3.09Å; D75-A77 PolarHBondContact O-N 2.84Å; D75-A77 WeakPolarHBondContact OD1-CB 3.42Å; D75-A77 PolarHBondContact OD1-N 2.92Å; D75-I78 HydrophobicContact CB-CB 4.39Å; D75-I78 HydrophobicContact CB-CD1 4.15Å; D75-I78 HydrophobicContact CB-CG1 4.18Å; D75-I78 PolarHBondContact O-N 2.86Å; D75-S79 PolarHBondContact O-N 2.85Å; D75-S79 PolarHBondContact O-OG 3.15Å
76	A	80.7	Confident	82.8	Confident	33 Å²	33	59.9 Å²	59.9	27%	0.273	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-28.4	176.5	0	0	0	0	0	112.4	I78 S79 G80 E82	A76-I78 PolarHBondContact O-N 3.4Å; A76-S79 WeakPolarHBondContact CA-OG 3.38Å; A76-G80 CarbonylContact O-C 3.5Å; A76-G80 WeakPolarHBondContact O-CA 3.25Å; A76-G80 PolarHBondContact O-N 2.94Å; A76-E82 HydrophobicContact CB-CG 3.97Å
77	A	72.4	Confident	83.6	Confident	90 Å²	90	57.6 Å²	57.6	74%	0.744	34%	0.336	S	S	*	.	H	α-helix	trans	-69	-11.3	174	0	0	0	0	0	113.7	D75	D75-A77 PolarHBondContact O-N 2.84Å; D75-A77 WeakPolarHBondContact OD1-CB 3.42Å; D75-A77 PolarHBondContact OD1-N 2.92Å
78	I	77.1	Confident	83.8	Confident	107 Å²	107	58.8 Å²	58.8	55%	0.549	34%	0.339	S	S	.	.	H	α-helix	trans	-111.3	-31.1	179.6	-60.7	179.6	0	0	0	111.5	D75 A76	D75-I78 HydrophobicContact CB-CB 4.39Å; D75-I78 HydrophobicContact CB-CD1 4.15Å; D75-I78 HydrophobicContact CB-CG1 4.18Å; D75-I78 PolarHBondContact O-N 2.86Å; A76-I78 PolarHBondContact O-N 3.4Å
79	S	78.7	Confident	83.9	Confident	8 Å²	8	55.9 Å²	55.9	6%	0.056	32%	0.32	C	S	.	.	H	α-helix	trans	-90	-12.4	174.6	54.4	0	0	0	0	114.6	D75 A76 D81 W84	D75-S79 PolarHBondContact O-N 2.85Å; D75-S79 PolarHBondContact O-OG 3.15Å; A76-S79 WeakPolarHBondContact CA-OG 3.38Å; S79-D81 PolarHBondContact O-N 3.21Å; S79-D81 PolarHBondContact OG-O 2.86Å; S79-W84 VanDerWaalsContact CB-O 3.22Å; S79-W84 WeakPolarHBondContact CB-O 3.46Å; S79-W84 PolarHBondContact OG-O 2.82Å
80	G	75.5	Confident	83.4	Confident	62 Å²	62	62.2 Å²	62.2	64%	0.639	35%	0.354	S	S	*	.	S	Bend	trans	96.8	-35.9	175.3	0	0	0	0	0	114.5	A76	A76-G80 CarbonylContact O-C 3.5Å; A76-G80 WeakPolarHBondContact O-CA 3.25Å; A76-G80 PolarHBondContact O-N 2.94Å
81	D	73.6	Confident	82.9	Confident	112 Å²	112	69.1 Å²	69.1	60%	0.599	39%	0.386	S	S	*	.	S	Bend	trans	-137.6	150.2	-178.2	-88.6	-49.6	0	0	0	111.9	S79 W84	S79-D81 PolarHBondContact O-N 3.21Å; S79-D81 PolarHBondContact OG-O 2.86Å; D81-W84 PolarHBondContact O-N 2.89Å
82	E	73.6	Confident	82.7	Confident	176 Å²	176	75.7 Å²	75.7	82%	0.822	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	142.5	171.9	-71.2	-167.7	165.2	0	0	111.6	A76 W84	A76-E82 HydrophobicContact CB-CG 3.97Å; E82-W84 VanDerWaalsContact C-N 3.29Å; E82-W84 PolarHBondContact O-N 2.85Å
83	G	77.8	Confident	82.8	Confident	42 Å²	42	75 Å²	75	43%	0.433	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	-6.8	-176.8	0	0	0	0	0	114.9	S98	G83-S98 WeakPolarHBondContact O-CB 3.36Å; G83-S98 PolarHBondContact O-N 3.07Å; G83-S98 PolarHBondContact O-OG 3.34Å
84	W	87.7	Confident	83.1	Confident	62 Å²	62	74.4 Å²	74.4	24%	0.235	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	143.6	170.7	-66.4	80.8	0	0	0	111.5	Y53 E60 S79 D81 E82 I95 F96 P97	Y53-W84 HydrophobicContact CE1-CZ3 4.48Å; Y53-W84 WeakPolarHBondContact OH-CH2 3.45Å; E60-W84 HydrophobicContact CG-CH2 4.42Å; E60-W84 HydrophobicContact CG-CZ3 4.08Å; S79-W84 VanDerWaalsContact CB-O 3.22Å; S79-W84 WeakPolarHBondContact CB-O 3.46Å; S79-W84 PolarHBondContact OG-O 2.82Å; D81-W84 PolarHBondContact O-N 2.89Å; E82-W84 VanDerWaalsContact C-N 3.29Å; E82-W84 PolarHBondContact O-N 2.85Å; W84-I95 HydrophobicContact CD2-CD1 4.39Å; W84-I95 HydrophobicContact CE3-CB 4.15Å; W84-I95 HydrophobicContact CE3-CD1 3.89Å; W84-I95 HydrophobicContact CE3-CG1 3.94Å; W84-I95 HydrophobicContact CZ3-CD1 4.2Å; W84-I95 HydrophobicContact CZ3-CG1 4.15Å; W84-F96 WeakPolarHBondContact CA-O 3.34Å; W84-F96 VanDerWaalsContact CE3-C 3.44Å; W84-P97 HydrophobicContact CE3-CG 4.23Å; W84-P97 HydrophobicContact CH2-CG 4.24Å; W84-P97 HydrophobicContact CZ3-CG 4.06Å
85	W	91.8	Very high	83.3	Confident	39 Å²	39	71.7 Å²	71.7	15%	0.148	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	148.7	174.3	-69.5	-12.7	0	0	0	110.7	W47 V71 S73 K74 I95 F96 S98 V101	W47-W85 AromaticContact CD2-CZ3 3.98Å; W47-W85 HydrophobicContact CD2-CZ3 3.98Å; W47-W85 HydrophobicContact CE3-CH2 4.14Å; W47-W85 AromaticContact CE3-CZ3 3.59Å; W47-W85 HydrophobicContact CE3-CZ3 3.59Å; W47-W85 AromaticContact CH2-CH2 3.78Å; W47-W85 HydrophobicContact CH2-CH2 3.78Å; W47-W85 HydrophobicContact CH2-CZ3 4Å; W47-W85 HydrophobicContact CZ2-CH2 4.38Å; W47-W85 HydrophobicContact CZ2-CZ3 4.35Å; W47-W85 AromaticContact CZ3-CH2 3.62Å; W47-W85 HydrophobicContact CZ3-CH2 3.62Å; W47-W85 AromaticContact CZ3-CZ3 3.59Å; W47-W85 HydrophobicContact CZ3-CZ3 3.59Å; V71-W85 HydrophobicContact CG1-CB 4.49Å; V71-W85 HydrophobicContact CG1-CE3 4.3Å; V71-W85 HydrophobicContact CG2-CE3 4.48Å; S73-W85 WeakPolarHBondContact O-CB 3.48Å; K74-W85 VanDerWaalsContact CA-CD1 3.46Å; K74-W85 HydrophobicContact CB-CD2 4.43Å; K74-W85 HydrophobicContact CB-CG 4.31Å; K74-W85 HydrophobicContact CD-CD2 4.16Å; K74-W85 HydrophobicContact CD-CE3 4.49Å; K74-W85 HydrophobicContact CD-CH2 4.19Å; K74-W85 HydrophobicContact CD-CZ2 3.73Å; K74-W85 HydrophobicContact CG-CD2 3.81Å; K74-W85 HydrophobicContact CG-CE3 4.37Å; K74-W85 HydrophobicContact CG-CG 4.04Å; K74-W85 HydrophobicContact CG-CZ2 4.27Å; W85-I95 WeakPolarHBondContact O-CA 3.44Å; W85-F96 HydrophobicContact CB-CE2 4.03Å; W85-F96 HydrophobicContact CB-CZ 3.92Å; W85-F96 HydrophobicContact CE3-CE2 4.34Å; W85-F96 PolarHBondContact N-O 3.3Å; W85-F96 PolarHBondContact O-N 3.24Å; W85-S98 VanDerWaalsContact CD2-CB 3.41Å; W85-V101 HydrophobicContact CE3-CG2 3.89Å; W85-V101 HydrophobicContact CZ3-CG2 3.71Å
86	T	90.9	Very high	83.8	Confident	20 Å²	20	67.6 Å²	67.6	12%	0.123	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.9	174.7	-40.5	0	0	0	0	109.4	L72 S73 V93	L72-T86 PolarHBondContact N-O 3.01Å; S73-T86 PolarHBondContact N-O 2.68Å; S73-T86 PolarHBondContact O-N 2.63Å; T86-V93 HydrophobicContact CG2-CG1 4.26Å
87	G	91.5	Very high	84.2	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	-168.4	176.4	0	0	0	0	0	113.5	E70 V93 G94	E70-G87 CarbonylContact O-C 3.45Å; E70-G87 WeakPolarHBondContact O-CA 3.31Å; G87-V93 WeakPolarHBondContact O-CA 3.34Å; G87-G94 PolarHBondContact N-O 2.65Å; G87-G94 PolarHBondContact O-N 2.85Å; G87-G94 VanDerWaalsContact O-O 3.1Å
88	K	91.4	Very high	84.8	Confident	69 Å²	69	63.5 Å²	63.5	30%	0.3	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	130.4	-164.7	-174.6	-177.9	179.3	-174.1	0	112	E70 L72 R92 V93	E70-K88 HydrophobicContact CB-CB 4.26Å; E70-K88 PolarHBondContact N-O 3.46Å; E70-K88 PolarHBondContact O-N 3.32Å; L72-K88 HydrophobicContact CD1-CB 4.08Å; L72-K88 HydrophobicContact CG-CB 4.44Å; K88-R92 VanDerWaalsContact CA-O 3.24Å; K88-R92 WeakPolarHBondContact CA-O 3.36Å; K88-R92 VanDerWaalsContact CG-O 3.32Å; K88-R92 WeakPolarHBondContact CG-O 3.37Å; K88-V93 HydrophobicContact CB-CG2 4.06Å; K88-V93 HydrophobicContact CD-CG2 4Å; K88-V93 HydrophobicContact CG-CG2 3.85Å
89	L	88.4	Confident	85.2	Confident	17 Å²	17	61.9 Å²	61.9	9%	0.089	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	134	178.1	176.8	64.6	0	0	0	108.2	L61 L63 D67 V68 H91 R92	L61-L89 HydrophobicContact CD1-CB 4.13Å; L61-L89 HydrophobicContact CD2-CB 3.86Å; L61-L89 HydrophobicContact CG-CB 4.2Å; L63-L89 HydrophobicContact CD2-CD2 4.01Å; D67-L89 HydrophobicContact CB-CD1 3.88Å; D67-L89 HydrophobicContact CB-CD2 3.85Å; D67-L89 WeakPolarHBondContact OD2-CD2 3.49Å; V68-L89 WeakPolarHBondContact O-CD1 3.44Å; L89-H91 PolarHBondContact O-N 2.94Å; L89-H91 VanDerWaalsContact O-N 3.1Å; L89-R92 PolarHBondContact N-O 2.83Å; L89-R92 PolarHBondContact O-N 3.11Å
90	N	78.6	Confident	85.4	Confident	133 Å²	133	65 Å²	65	71%	0.711	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	45.1	176.7	-61.7	-34.7	0	0	0	113.7	R92	N90-R92 PolarHBondContact O-N 3.43Å; N90-R92 VanDerWaalsContact O-N 3.13Å
91	H	79.9	Confident	85.7	Confident	174 Å²	174	62.6 Å²	62.6	81%	0.806	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	-12.1	-176.7	-53.3	-95	0	0	0	117.2	L89	L89-H91 PolarHBondContact O-N 2.94Å; L89-H91 VanDerWaalsContact O-N 3.1Å
92	R	86.3	Confident	86	Confident	151 Å²	151	59.9 Å²	59.9	57%	0.57	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	138.6	168	-175.7	-179.5	-67.8	-142.8	1.5	109.9	L61 K88 L89 N90	L61-R92 HydrophobicContact CD1-CB 4.01Å; L61-R92 HydrophobicContact CD1-CG 3.87Å; K88-R92 VanDerWaalsContact CA-O 3.24Å; K88-R92 WeakPolarHBondContact CA-O 3.36Å; K88-R92 VanDerWaalsContact CG-O 3.32Å; K88-R92 WeakPolarHBondContact CG-O 3.37Å; L89-R92 PolarHBondContact N-O 2.83Å; L89-R92 PolarHBondContact O-N 3.11Å; N90-R92 PolarHBondContact O-N 3.43Å; N90-R92 VanDerWaalsContact O-N 3.13Å
93	V	90.6	Very high	85.4	Confident	79 Å²	79	59.3 Å²	59.3	48%	0.479	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	142	166.1	176.8	0	0	0	0	107.8	L72 T86 G87 K88	L72-V93 HydrophobicContact CD1-CG1 3.91Å; L72-V93 HydrophobicContact CD1-CG2 4.04Å; T86-V93 HydrophobicContact CG2-CG1 4.26Å; G87-V93 WeakPolarHBondContact O-CA 3.34Å; K88-V93 HydrophobicContact CB-CG2 4.06Å; K88-V93 HydrophobicContact CD-CG2 4Å; K88-V93 HydrophobicContact CG-CG2 3.85Å
94	G	91.2	Very high	84.3	Confident	7 Å²	7	63.9 Å²	63.9	7%	0.072	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	177.7	175.8	0	0	0	0	0	112.2	D59 G87	D59-G94 CarbonylContact O-C 3.5Å; D59-G94 WeakPolarHBondContact O-CA 3.34Å; G87-G94 PolarHBondContact N-O 2.65Å; G87-G94 PolarHBondContact O-N 2.85Å; G87-G94 VanDerWaalsContact O-O 3.1Å
95	I	91.9	Very high	82.1	Confident	39 Å²	39	64.7 Å²	64.7	20%	0.2	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	149.8	172.9	63	172.2	0	0	0	111.6	D59 E60 L61 W84 W85	D59-I95 PolarHBondContact O-N 2.88Å; E60-I95 CarbonylContact C-O 3.42Å; E60-I95 WeakPolarHBondContact CA-O 3.21Å; E60-I95 HydrophobicContact CG-CD1 4.46Å; E60-I95 HydrophobicContact CG-CG1 4Å; L61-I95 PolarHBondContact N-O 2.84Å; W84-I95 HydrophobicContact CD2-CD1 4.39Å; W84-I95 HydrophobicContact CE3-CB 4.15Å; W84-I95 HydrophobicContact CE3-CD1 3.89Å; W84-I95 HydrophobicContact CE3-CG1 3.94Å; W84-I95 HydrophobicContact CZ3-CD1 4.2Å; W84-I95 HydrophobicContact CZ3-CG1 4.15Å; W85-I95 WeakPolarHBondContact O-CA 3.44Å
96	F	90.7	Very high	79.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	160.1	172.6	57.3	-88.4	0	0	0	110	L61 L63 V69 V71 W84 W85 S98 V101	L61-F96 HydrophobicContact CB-CB 4.43Å; L61-F96 HydrophobicContact CB-CD1 4.26Å; L61-F96 HydrophobicContact CD2-CD1 3.84Å; L61-F96 HydrophobicContact CD2-CE1 4.29Å; L63-F96 HydrophobicContact CD1-CB 4.09Å; L63-F96 HydrophobicContact CD1-CD2 4.07Å; L63-F96 HydrophobicContact CD1-CG 4.12Å; L63-F96 HydrophobicContact CG-CB 4.42Å; V69-F96 HydrophobicContact CG1-CD1 4.31Å; V69-F96 HydrophobicContact CG1-CE1 3.61Å; V69-F96 HydrophobicContact CG1-CZ 3.92Å; V71-F96 HydrophobicContact CG2-CZ 4.22Å; W84-F96 WeakPolarHBondContact CA-O 3.34Å; W84-F96 VanDerWaalsContact CE3-C 3.44Å; W85-F96 HydrophobicContact CB-CE2 4.03Å; W85-F96 HydrophobicContact CB-CZ 3.92Å; W85-F96 HydrophobicContact CE3-CE2 4.34Å; W85-F96 PolarHBondContact N-O 3.3Å; W85-F96 PolarHBondContact O-N 3.24Å; F96-S98 PolarHBondContact O-N 3.32Å; F96-V101 HydrophobicContact CD2-CG1 4Å; F96-V101 HydrophobicContact CD2-CG2 4.43Å; F96-V101 HydrophobicContact CE2-CB 4.39Å; F96-V101 HydrophobicContact CE2-CG1 3.74Å; F96-V101 HydrophobicContact CE2-CG2 3.66Å
97	P	88.1	Confident	77.4	Confident	13 Å²	13	72.2 Å²	72.2	8%	0.084	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	126.6	179.6	-17.2	31.1	0	0	0	111.4	Y53 W84 N99 Y100	Y53-P97 HydrophobicContact CD2-CG 4.05Å; Y53-P97 HydrophobicContact CE1-CG 4.36Å; Y53-P97 HydrophobicContact CE2-CG 3.64Å; W84-P97 HydrophobicContact CE3-CG 4.23Å; W84-P97 HydrophobicContact CH2-CG 4.24Å; W84-P97 HydrophobicContact CZ3-CG 4.06Å; P97-N99 PolarHBondContact O-N 3.06Å; P97-N99 VanDerWaalsContact O-N 3.12Å; P97-Y100 HydrophobicContact CB-CD2 3.69Å; P97-Y100 HydrophobicContact CB-CE2 4.15Å; P97-Y100 HydrophobicContact CB-CG 4.48Å; P97-Y100 HydrophobicContact CG-CD2 4.11Å; P97-Y100 HydrophobicContact CG-CE2 4.32Å; P97-Y100 WeakPolarHBondContact O-CB 3.18Å; P97-Y100 PolarHBondContact O-N 2.89Å
98	S	86.7	Confident	75.1	Confident	23 Å²	23	78.1 Å²	78.1	16%	0.161	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-54.1	-34.2	-177	58.7	0	0	0	0	113.8	G83 W85 F96 Y100 V101	G83-S98 WeakPolarHBondContact O-CB 3.36Å; G83-S98 PolarHBondContact O-N 3.07Å; G83-S98 PolarHBondContact O-OG 3.34Å; W85-S98 VanDerWaalsContact CD2-CB 3.41Å; F96-S98 PolarHBondContact O-N 3.32Å; S98-Y100 PolarHBondContact O-N 3.1Å; S98-V101 WeakPolarHBondContact O-CG2 3.42Å; S98-V101 PolarHBondContact O-N 3.32Å
99	N	84	Confident	72.2	Confident	73 Å²	73	85.5 Å²	85.5	39%	0.39	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-77.8	-1.9	-179.3	77.2	-84.4	0	0	0	114.1	P97 H293	P97-N99 PolarHBondContact O-N 3.06Å; P97-N99 VanDerWaalsContact O-N 3.12Å; N99-H293 PolarHBondContact ND2-CE1 2.82Å
100	Y	82.6	Confident	69.7	Low	73 Å²	73	92.2 Å²	92.2	29%	0.286	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-92	-5.1	174.9	-79.8	-116.8	0	0	0	112.7	A49 A50 Y51 D52 Y53 P97 S98	A49-Y100 CarbonylContact C-O 3.55Å; A49-Y100 WeakPolarHBondContact CA-O 3.16Å; A50-Y100 PolarHBondContact N-O 2.93Å; Y51-Y100 HydrophobicContact CD2-CD1 4.49Å; D52-Y100 WeakPolarHBondContact O-CE1 3.45Å; Y53-Y100 HydrophobicContact CD2-CD1 4.08Å; Y53-Y100 AromaticContact CD2-CE1 3.88Å; Y53-Y100 HydrophobicContact CD2-CE1 3.88Å; Y53-Y100 HydrophobicContact CG-CD1 4.34Å; P97-Y100 HydrophobicContact CB-CD2 3.69Å; P97-Y100 HydrophobicContact CB-CE2 4.15Å; P97-Y100 HydrophobicContact CB-CG 4.48Å; P97-Y100 HydrophobicContact CG-CD2 4.11Å; P97-Y100 HydrophobicContact CG-CE2 4.32Å; P97-Y100 WeakPolarHBondContact O-CB 3.18Å; P97-Y100 PolarHBondContact O-N 2.89Å; S98-Y100 PolarHBondContact O-N 3.1Å
101	V	83.1	Confident	67.8	Low	12 Å²	12	91.1 Å²	91.1	7%	0.073	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	152.3	178	-61.6	0	0	0	0	112.3	W47 T48 L63 V69 W85 F96 S98	W47-V101 HydrophobicContact CB-CB 3.99Å; W47-V101 HydrophobicContact CB-CG2 4.14Å; W47-V101 HydrophobicContact CD2-CG2 4.4Å; W47-V101 HydrophobicContact CE3-CB 4.43Å; W47-V101 HydrophobicContact CE3-CG2 3.87Å; T48-V101 CarbonylContact O-C 3.57Å; T48-V101 VanDerWaalsContact O-CA 3.3Å; T48-V101 WeakPolarHBondContact O-CA 3.39Å; L63-V101 HydrophobicContact CD1-CG1 3.79Å; V69-V101 HydrophobicContact CG2-CG1 4.29Å; W85-V101 HydrophobicContact CE3-CG2 3.89Å; W85-V101 HydrophobicContact CZ3-CG2 3.71Å; F96-V101 HydrophobicContact CD2-CG1 4Å; F96-V101 HydrophobicContact CD2-CG2 4.43Å; F96-V101 HydrophobicContact CE2-CB 4.39Å; F96-V101 HydrophobicContact CE2-CG1 3.74Å; F96-V101 HydrophobicContact CE2-CG2 3.66Å; S98-V101 WeakPolarHBondContact O-CG2 3.42Å; S98-V101 PolarHBondContact O-N 3.32Å
102	T	79.4	Confident	65.5	Low	56 Å²	56	88 Å²	88	34%	0.344	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.5	177.1	-177.7	0	0	0	0	112.4	W47 T48 A50	W47-T102 CarbonylContact C-O 3.57Å; W47-T102 WeakPolarHBondContact CA-O 3.28Å; W47-T102 WeakPolarHBondContact CB-O 3.48Å; T48-T102 PolarHBondContact N-O 3.39Å; T48-T102 PolarHBondContact O-N 2.71Å; A50-T102 HydrophobicContact CB-CG2 4.46Å
103	Y	60.4	Low	63.1	Low	164 Å²	164	87 Å²	87	64%	0.643	47%	0.467	S	S	*	.	S	Bend	trans	-76	-21.4	-175.7	-172.3	-129.9	0	0	0	113.5	W47	W47-Y103 HydrophobicContact CD2-CD2 4.3Å; W47-Y103 AromaticContact CE2-CD2 3.54Å; W47-Y103 VanDerWaalsContact CE3-N 3.32Å; W47-Y103 HydrophobicContact CH2-CD2 4.35Å; W47-Y103 HydrophobicContact CH2-CG 4.23Å; W47-Y103 AromaticContact CZ2-CD2 3.54Å; W47-Y103 HydrophobicContact CZ2-CD2 3.54Å; W47-Y103 HydrophobicContact CZ2-CE2 4.43Å; W47-Y103 AromaticContact CZ2-CG 3.86Å; W47-Y103 HydrophobicContact CZ2-CG 3.86Å; W47-Y103 AromaticContact NE1-CD2 3.63Å
104	Q	55.2	Low	60.5	Low	138 Å²	138	89.5 Å²	89.5	65%	0.645	49%	0.488	S	S	*	.	S	Bend	trans	-87.2	137.1	178.7	-72.4	-173.1	-4.9	0	0	111.5	T48 A106	T48-Q104 PolarHBondContact OG1-O 2.74Å; Q104-A106 PolarHBondContact O-N 2.82Å
105	P	42.5	Very low	57.5	Low	79 Å²	79	92.8 Å²	92.8	51%	0.513	52%	0.522	S	S	.	.			trans	-70	99.1	160.6	30.2	-30.9	0	0	0	107.7	I107	P105-I107 PolarHBondContact O-N 3.36Å
106	A	40.8	Very low	54.9	Low	82 Å²	82	97.2 Å²	97.2	68%	0.678	56%	0.556	S	S	*	*	S	Bend	trans	-69.1	15.9	-173.8	0	0	0	0	0	114.9	Q104	Q104-A106 PolarHBondContact O-N 2.82Å
107	I	41.5	Very low	52.1	Low	135 Å²	135	101.5 Å²	101.5	69%	0.692	59%	0.592	S	S	*	*	S	Bend	trans	-136.7	102.7	171	-59.3	-178.3	0	0	0	107.3	P105	P105-I107 PolarHBondContact O-N 3.36Å
108	Y	43.6	Very low	49.8	Very low	123 Å²	123	105 Å²	105	48%	0.482	63%	0.631	S	S	.	*			trans	52.9	105.3	169.2	-49.5	-55.2	0	0	0	120.2	E121	Y108-E121 HydrophobicContact CE1-CG 4.48Å; Y108-E121 HydrophobicContact CE2-CG 4.29Å; Y108-E121 VanDerWaalsContact CE2-OE1 3.3Å; Y108-E121 WeakPolarHBondContact CE2-OE1 3.45Å
109	R	32	Very low	47.1	Very low	224 Å²	224	110.5 Å²	110.5	85%	0.845	66%	0.663	S	S	*	*				-153.4	111.5	129.2	-146.4	176.3	-64.5	178.9	1.9	113.3
110	I	34.5	Very low	44.7	Very low	158 Å²	158	112 Å²	112	81%	0.81	68%	0.679	S	S	*	*			trans	-99.1	153.9	166.2	-73.7	176.8	0	0	0	108.1
111	P	38.2	Very low	42.3	Very low	110 Å²	110	115.1 Å²	115.1	71%	0.714	70%	0.696	S	S	*	*			trans	-60.8	141.4	-170.7	-26.9	36.8	0	0	0	114.9	T113	P111-T113 PolarHBondContact O-N 2.66Å
112	A	31.8	Very low	39.9	Very low	110 Å²	110	121.5 Å²	121.5	91%	0.909	73%	0.725	S	S	*	*			trans	-80.5	83.4	177.4	0	0	0	0	0	111.6
113	T	35.9	Very low	38.2	Very low	128 Å²	128	124.1 Å²	124.1	79%	0.785	74%	0.741	S	S	*	*			trans	-118	126.5	163.9	51.3	0	0	0	0	110	P111 G115	P111-T113 PolarHBondContact O-N 2.66Å; T113-G115 PolarHBondContact O-N 3.31Å
114	S	35.7	Very low	37.6	Very low	132 Å²	132	121.5 Å²	121.5	92%	0.923	74%	0.744	S	S	*	*			trans	-65.4	123.5	-168.2	53.1	0	0	0	0	114.7
115	G	28.8	Very low	37.5	Very low	76 Å²	76	118.1 Å²	118.1	78%	0.784	74%	0.735	S	S	*	*			trans	-174.8	122.6	167.9	0	0	0	0	0	110.9	T113	T113-G115 PolarHBondContact O-N 3.31Å
116	S	37.7	Very low	38.7	Very low	132 Å²	132	118.9 Å²	118.9	92%	0.923	74%	0.743	S	S	*	*			trans	-95	117.6	-171.2	-173.8	0	0	0	0	113.1
117	A	32.8	Very low	40.6	Very low	90 Å²	90	116.1 Å²	116.1	74%	0.744	72%	0.718	S	S	*	*			trans	-162.2	137.1	150.2	0	0	0	0	0	109
118	G	38.7	Very low	42.9	Very low	87 Å²	87	113.3 Å²	113.3	90%	0.897	71%	0.707	S	S	*	*			trans	-76.6	125.8	-177.1	0	0	0	0	0	113
119	V	30.9	Very low	45.2	Very low	138 Å²	138	114.2 Å²	114.2	84%	0.836	72%	0.716	S	S	*	*			trans	-117.2	131.5	162.8	178.9	0	0	0	0	107	E121	V119-E121 PolarHBondContact O-N 3.48Å
120	S	31.8	Very low	48.1	Very low	105 Å²	105	103.7 Å²	103.7	73%	0.734	68%	0.676	S	S	*	*			trans	-63.2	133.5	178.1	-173.1	0	0	0	0	110.4	Q122	S120-Q122 PolarHBondContact O-N 2.93Å
121	E	32.8	Very low	50.9	Low	139 Å²	139	98.1 Å²	98.1	65%	0.65	65%	0.651	S	S	*	*			trans	-53.1	126.2	166.9	-71.7	177.2	143	0	0	109.7	Y108 V119	Y108-E121 HydrophobicContact CE1-CG 4.48Å; Y108-E121 HydrophobicContact CE2-CG 4.29Å; Y108-E121 VanDerWaalsContact CE2-OE1 3.3Å; Y108-E121 WeakPolarHBondContact CE2-OE1 3.45Å; V119-E121 PolarHBondContact O-N 3.48Å
122	Q	33.8	Very low	53.5	Low	146 Å²	146	95.8 Å²	95.8	68%	0.682	63%	0.629	S	S	*	*			trans	-109.1	119	164.6	-70.9	-161	0.5	0	0	109.1	S120	S120-Q122 PolarHBondContact O-N 2.93Å
123	V	42.5	Very low	56.5	Low	111 Å²	111	95.9 Å²	95.9	67%	0.673	62%	0.623	S	S	*	*			trans	-49.5	144.3	153.2	176	0	0	0	0	108	S125	V123-S125 WeakPolarHBondContact O-CA 3.22Å; V123-S125 PolarHBondContact O-N 3.24Å
124	P	48.4	Very low	59.3	Low	109 Å²	109	93.4 Å²	93.4	71%	0.708	60%	0.603	S	S	*	*	S	Bend	trans	-46.1	110	176.1	17.7	-33.4	0	0	0	110.3
125	S	53.7	Low	62.1	Low	66 Å²	66	87.8 Å²	87.8	46%	0.462	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-74.1	138.2	-159	39.7	0	0	0	0	110.5	V123	V123-S125 WeakPolarHBondContact O-CA 3.22Å; V123-S125 PolarHBondContact O-N 3.24Å
126	S	66.7	Low	65.3	Low	95 Å²	95	88.6 Å²	88.6	66%	0.664	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-54	133.8	164.6	54.1	0	0	0	0	108.4	T128	S126-T128 PolarHBondContact O-N 2.92Å
127	P	81.4	Confident	68	Low	24 Å²	24	85.2 Å²	85.2	16%	0.156	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-52.4	136.7	-174.3	18.8	-31.3	0	0	0	111.3	Q129 A183 L197 V200	P127-Q129 PolarHBondContact O-N 3.4Å; P127-A183 HydrophobicContact CG-CB 4.05Å; P127-L197 HydrophobicContact CB-CD2 4.25Å; P127-V200 HydrophobicContact CB-CG1 4.22Å; P127-V200 HydrophobicContact CB-CG2 3.98Å; P127-V200 HydrophobicContact CG-CG2 4.05Å
128	T	89.2	Confident	71	Confident	77 Å²	77	85 Å²	85	47%	0.472	51%	0.507	S	S	.	.			trans	-49.6	112.9	-179.7	-44.9	0	0	0	0	109.6	S126 I130 W154 E198 G199 V200	S126-T128 PolarHBondContact O-N 2.92Å; T128-I130 HydrophobicContact CG2-CG1 4.41Å; T128-I130 PolarHBondContact O-N 2.88Å; T128-W154 HydrophobicContact CG2-CH2 4.42Å; T128-E198 WeakPolarHBondContact CB-O 3.38Å; T128-E198 PolarHBondContact OG1-O 3.4Å; T128-G199 CarbonylContact O-C 3.59Å; T128-G199 WeakPolarHBondContact O-CA 3.36Å; T128-V200 PolarHBondContact O-N 3.27Å
129	Q	91.7	Very high	73.6	Confident	142 Å²	142	86.3 Å²	86.3	66%	0.664	49%	0.489	S	S	*	.	B	Isolated β-bridge	trans	-77.1	122.6	175.3	-70.5	-177.9	56.2	0	0	108.5	P127 V200	P127-Q129 PolarHBondContact O-N 3.4Å; Q129-V200 WeakPolarHBondContact CA-O 3.4Å
130	I	93.3	Very high	76.7	Confident	3 Å²	3	84.1 Å²	84.1	2%	0.015	47%	0.472	C	S	.	.			trans	-111.5	116	-179.4	-60.5	173.3	0	0	0	107	T128 E134 L135 W154 V200 C201 V210	T128-I130 HydrophobicContact CG2-CG1 4.41Å; T128-I130 PolarHBondContact O-N 2.88Å; I130-E134 HydrophobicContact CG2-CB 4.09Å; I130-L135 HydrophobicContact CG2-CD1 4.41Å; I130-L135 HydrophobicContact CG2-CD2 3.87Å; I130-L135 HydrophobicContact CG2-CG 3.95Å; I130-W154 HydrophobicContact CD1-CD2 3.93Å; I130-W154 HydrophobicContact CD1-CE3 4.21Å; I130-W154 HydrophobicContact CD1-CH2 3.84Å; I130-W154 HydrophobicContact CD1-CZ2 3.53Å; I130-W154 HydrophobicContact CD1-CZ3 4.18Å; I130-W154 HydrophobicContact CG1-CH2 4.24Å; I130-W154 HydrophobicContact CG1-CZ2 3.59Å; I130-V200 PolarHBondContact N-O 3.03Å; I130-C201 WeakPolarHBondContact O-CB 3.42Å; I130-C201 PolarHBondContact O-SG 2.83Å; I130-V210 HydrophobicContact CD1-CB 3.96Å; I130-V210 HydrophobicContact CD1-CG1 4.1Å; I130-V210 HydrophobicContact CD1-CG2 3.99Å
131	P	93.3	Very high	79.6	Confident	41 Å²	41	81.7 Å²	81.7	27%	0.266	45%	0.45	S	S	.	.			trans	-58.8	138.3	171.8	-21.8	32.9	0	0	0	110	S133 E134 E203	P131-S133 PolarHBondContact O-N 3.27Å; P131-E134 HydrophobicContact CB-CG 4.47Å; P131-E134 HydrophobicContact CG-CG 4.44Å; P131-E134 PolarHBondContact O-N 3.1Å; P131-E203 WeakPolarHBondContact CA-OE2 3.48Å
132	F	93.4	Very high	82.2	Confident	60 Å²	60	76.1 Å²	76.1	26%	0.263	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-60.5	-26.4	-176.1	-171.4	-105.2	0	0	0	112.3	E134 L135 L137 E203 N206	F132-E134 VanDerWaalsContact C-N 3.26Å; F132-E134 PolarHBondContact O-N 2.89Å; F132-L135 HydrophobicContact CD2-CD1 4.24Å; F132-L135 PolarHBondContact O-N 2.89Å; F132-L135 VanDerWaalsContact O-N 3.13Å; F132-L137 HydrophobicContact CE2-CD1 4.11Å; F132-L137 HydrophobicContact CZ-CD1 3.81Å; F132-L137 HydrophobicContact CZ-CG 4.45Å; F132-E203 PolarHBondContact N-OE2 3.05Å; F132-N206 HydrophobicContact CB-CB 4.17Å; F132-N206 HydrophobicContact CD1-CB 4.11Å; F132-N206 HydrophobicContact CD2-CB 3.48Å; F132-N206 VanDerWaalsContact CD2-CB 3.48Å; F132-N206 HydrophobicContact CE1-CB 4.39Å; F132-N206 HydrophobicContact CE2-CB 3.81Å; F132-N206 HydrophobicContact CG-CB 3.64Å; F132-N206 HydrophobicContact CZ-CB 4.25Å
133	S	93.4	Very high	84.6	Confident	113 Å²	113	74.5 Å²	74.5	79%	0.79	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-67.5	-15.8	174.8	53.4	0	0	0	0	115.1	P131 L135	P131-S133 PolarHBondContact O-N 3.27Å; S133-L135 VanDerWaalsContact C-N 3.35Å
134	E	94.6	Very high	86.1	Confident	76 Å²	76	71.4 Å²	71.4	36%	0.355	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-83.1	-10.2	170.9	-64	-168.3	176.3	0	0	113	I130 P131 F132 W154 K155	I130-E134 HydrophobicContact CG2-CB 4.09Å; P131-E134 HydrophobicContact CB-CG 4.47Å; P131-E134 HydrophobicContact CG-CG 4.44Å; P131-E134 PolarHBondContact O-N 3.1Å; F132-E134 VanDerWaalsContact C-N 3.26Å; F132-E134 PolarHBondContact O-N 2.89Å; E134-W154 PolarHBondContact OE2-NE1 3.45Å; E134-K155 IonicContact OE1-NZ 2.92Å; E134-K155 WeakPolarHBondContact OE2-CE 3.06Å; E134-K155 IonicContact OE2-NZ 3.59Å; E134-K155 PolarHBondContact OE2-NZ 2.97Å
135	L	95.3	Very high	87.3	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.073	42%	0.417	C	S	.	.			trans	-99.6	112.8	-174.5	-62.4	177.9	0	0	0	111.8	I130 F132 S133 L137 W154 V161 V210	I130-L135 HydrophobicContact CG2-CD1 4.41Å; I130-L135 HydrophobicContact CG2-CD2 3.87Å; I130-L135 HydrophobicContact CG2-CG 3.95Å; F132-L135 HydrophobicContact CD2-CD1 4.24Å; F132-L135 PolarHBondContact O-N 2.89Å; F132-L135 VanDerWaalsContact O-N 3.13Å; S133-L135 VanDerWaalsContact C-N 3.35Å; L135-L137 PolarHBondContact O-N 3.46Å; L135-W154 HydrophobicContact CD2-CB 3.91Å; L135-W154 HydrophobicContact CD2-CG 4.05Å; L135-V161 HydrophobicContact CD1-CG1 4.35Å; L135-V161 HydrophobicContact CD1-CG2 4.49Å; L135-V210 HydrophobicContact CD1-CG2 3.84Å; L135-V210 HydrophobicContact CD2-CG1 4.25Å; L135-V210 HydrophobicContact CD2-CG2 4.06Å
136	V	95.8	Very high	88.2	Confident	93 Å²	93	69 Å²	69	56%	0.564	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	98.6	170.4	-177.1	0	0	0	0	108.6	G152 T153	V136-G152 CarbonylContact O-C 3.43Å; V136-G152 WeakPolarHBondContact O-CA 3.37Å; V136-T153 PolarHBondContact N-O 2.72Å; V136-T153 PolarHBondContact O-N 2.68Å
137	L	95.6	Very high	89	Confident	60 Å²	60	65.2 Å²	65.2	31%	0.314	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	137.8	174.4	-56.4	-173.4	0	0	0	111.2	F132 L135 Y150 V161	F132-L137 HydrophobicContact CE2-CD1 4.11Å; F132-L137 HydrophobicContact CZ-CD1 3.81Å; F132-L137 HydrophobicContact CZ-CG 4.45Å; L135-L137 PolarHBondContact O-N 3.46Å; L137-Y150 HydrophobicContact CD1-CD2 4.39Å; L137-Y150 HydrophobicContact CD1-CG 4.38Å; L137-V161 HydrophobicContact CD2-CB 3.82Å; L137-V161 HydrophobicContact CD2-CG1 3.97Å; L137-V161 HydrophobicContact CD2-CG2 3.77Å
138	E	94.5	Very high	89.4	Confident	86 Å²	86	69 Å²	69	40%	0.402	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-94	-176.1	-62.5	173.2	-154.5	0	0	111.6	R151 T153	E138-R151 WeakPolarHBondContact CB-O 3.33Å; E138-R151 PolarHBondContact N-O 2.96Å; E138-R151 IonicContact OE2-CZ 3.88Å; E138-R151 IonicContact OE2-NH1 3.64Å; E138-R151 PolarHBondContact OE2-NH1 3.3Å; E138-R151 IonicContact OE2-NH2 2.72Å; E138-T153 PolarHBondContact OE1-OG1 3.49Å
139	E	94.6	Very high	89.6	Confident	114 Å²	114	67.1 Å²	67.1	53%	0.533	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	150.1	-177.1	65.2	179.5	176.4	0	0	112.5	I141 Y150 R151	E139-I141 HydrophobicContact CG-CG2 4.17Å; E139-I141 PolarHBondContact O-N 2.92Å; E139-Y150 CarbonylContact O-C 3.53Å; E139-Y150 VanDerWaalsContact O-CA 3.3Å; E139-Y150 WeakPolarHBondContact O-CA 3.25Å; E139-R151 HydrophobicContact CG-CB 4.2Å; E139-R151 PolarHBondContact O-N 2.86Å
140	I	94.7	Very high	89.8	Confident	93 Å²	93	62.7 Å²	62.7	48%	0.477	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	113.6	174.6	-63.6	169.5	0	0	0	108.4	G142 V143 Y150	I140-G142 WeakPolarHBondContact CG2-O 3.44Å; I140-V143 HydrophobicContact CG2-CG2 3.5Å; I140-Y150 HydrophobicContact CD1-CE1 3.95Å; I140-Y150 HydrophobicContact CG1-CD1 3.56Å; I140-Y150 HydrophobicContact CG1-CE1 3.37Å; I140-Y150 HydrophobicContact CG1-CG 4.49Å
141	I	92.5	Very high	90	Very high	54 Å²	54	65.4 Å²	65.4	28%	0.277	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-20.8	179.5	58.3	177.3	0	0	0	112.8	E139 V149 R151 A160 Y213	E139-I141 HydrophobicContact CG-CG2 4.17Å; E139-I141 PolarHBondContact O-N 2.92Å; I141-V149 HydrophobicContact CD1-CG1 4.1Å; I141-V149 HydrophobicContact CG1-CG1 4.07Å; I141-V149 HydrophobicContact CG1-CG2 4.44Å; I141-V149 VanDerWaalsContact CG1-O 3.3Å; I141-V149 WeakPolarHBondContact CG1-O 3.4Å; I141-V149 PolarHBondContact N-O 3.34Å; I141-R151 HydrophobicContact CD1-CB 4.4Å; I141-R151 HydrophobicContact CG2-CB 3.76Å; I141-A160 HydrophobicContact CD1-CB 4.42Å; I141-Y213 HydrophobicContact CD1-CD2 4.2Å; I141-Y213 HydrophobicContact CD1-CE2 3.76Å
142	G	87.1	Confident	90.1	Very high	22 Å²	22	63.5 Å²	63.5	23%	0.227	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	150.7	175.6	0	0	0	0	0	113.8	I140 V149	I140-G142 WeakPolarHBondContact CG2-O 3.44Å; G142-V149 PolarHBondContact N-O 2.73Å; G142-V149 VanDerWaalsContact N-O 3.07Å; G142-V149 PolarHBondContact O-N 2.87Å
143	V	84.8	Confident	90.3	Very high	111 Å²	111	62.2 Å²	62.2	67%	0.673	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	133.3	174.7	-175.5	0	0	0	0	107.6	I140 K148	I140-V143 HydrophobicContact CG2-CG2 3.5Å; V143-K148 HydrophobicContact CG1-CG 4.39Å; V143-K148 HydrophobicContact CG2-CG 4.43Å
144	G	75.2	Confident	90.4	Very high	47 Å²	47	58 Å²	58	49%	0.485	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	-169.7	-179.2	0	0	0	0	0	112.5	F146 G147	G144-F146 PolarHBondContact O-N 2.74Å; G144-G147 PolarHBondContact N-O 3.47Å; G144-G147 PolarHBondContact O-N 2.64Å; G144-G147 VanDerWaalsContact O-N 3.1Å; G144-G147 VanDerWaalsContact O-O 3.12Å
145	G	71.9	Confident	90.3	Very high	60 Å²	60	60.3 Å²	60.3	62%	0.619	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-30.6	-179.1	0	0	0	0	0	113.9	G147 R165	G145-G147 VanDerWaalsContact C-N 3.26Å; G145-G147 PolarHBondContact O-N 3.46Å; G145-R165 VanDerWaalsContact O-CD 3.23Å; G145-R165 WeakPolarHBondContact O-CD 3.42Å
146	F	72.4	Confident	90.2	Very high	64 Å²	64	67.3 Å²	67.3	28%	0.281	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	10.9	179.6	-45.6	-63.2	0	0	0	114.3	G144 D285 L288	G144-F146 PolarHBondContact O-N 2.74Å; F146-D285 WeakPolarHBondContact CD2-OD2 3.3Å; F146-L288 HydrophobicContact CE1-CD1 4.08Å; F146-L288 HydrophobicContact CE1-CD2 3.89Å; F146-L288 HydrophobicContact CE1-CG 3.61Å; F146-L288 HydrophobicContact CZ-CD1 3.66Å; F146-L288 HydrophobicContact CZ-CD2 4.33Å; F146-L288 HydrophobicContact CZ-CG 3.62Å
147	G	83.8	Confident	90.1	Very high	15 Å²	15	68.5 Å²	68.5	16%	0.155	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	110.2	-143.2	176.4	0	0	0	0	0	113.8	G144 G145	G144-G147 PolarHBondContact N-O 3.47Å; G144-G147 PolarHBondContact O-N 2.64Å; G144-G147 VanDerWaalsContact O-N 3.1Å; G144-G147 VanDerWaalsContact O-O 3.12Å; G145-G147 VanDerWaalsContact C-N 3.26Å; G145-G147 PolarHBondContact O-N 3.46Å
148	K	90.6	Very high	90.1	Very high	103 Å²	103	68.2 Å²	68.2	45%	0.448	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.7	-176.7	-65.6	172.1	-174.2	163.9	0	109.3	V143 Y150 A163	V143-K148 HydrophobicContact CG1-CG 4.39Å; V143-K148 HydrophobicContact CG2-CG 4.43Å; K148-Y150 HydrophobicContact CB-CE2 3.75Å; K148-Y150 WeakPolarHBondContact CD-OH 3.26Å; K148-A163 PolarHBondContact N-O 2.85Å; K148-A163 PolarHBondContact O-N 3.14Å
149	V	93.7	Very high	90.3	Very high	39 Å²	39	64.2 Å²	64.2	24%	0.236	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.8	173.7	176.2	0	0	0	0	110.4	I141 G142 A160 V161 K162	I141-V149 HydrophobicContact CD1-CG1 4.1Å; I141-V149 HydrophobicContact CG1-CG1 4.07Å; I141-V149 HydrophobicContact CG1-CG2 4.44Å; I141-V149 VanDerWaalsContact CG1-O 3.3Å; I141-V149 WeakPolarHBondContact CG1-O 3.4Å; I141-V149 PolarHBondContact N-O 3.34Å; G142-V149 PolarHBondContact N-O 2.73Å; G142-V149 VanDerWaalsContact N-O 3.07Å; G142-V149 PolarHBondContact O-N 2.87Å; V149-A160 HydrophobicContact CG1-CB 4.31Å; V149-V161 VanDerWaalsContact CA-O 3.3Å; V149-V161 WeakPolarHBondContact CA-O 3.41Å; V149-K162 HydrophobicContact CB-CB 4.38Å
150	Y	95.5	Very high	90.4	Very high	49 Å²	49	59.3 Å²	59.3	19%	0.192	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	146.6	-176.8	-56.7	-100.9	0	0	0	109.8	L137 E139 I140 K148 A160 V161 A163	L137-Y150 HydrophobicContact CD1-CD2 4.39Å; L137-Y150 HydrophobicContact CD1-CG 4.38Å; E139-Y150 CarbonylContact O-C 3.53Å; E139-Y150 VanDerWaalsContact O-CA 3.3Å; E139-Y150 WeakPolarHBondContact O-CA 3.25Å; I140-Y150 HydrophobicContact CD1-CE1 3.95Å; I140-Y150 HydrophobicContact CG1-CD1 3.56Å; I140-Y150 HydrophobicContact CG1-CE1 3.37Å; I140-Y150 HydrophobicContact CG1-CG 4.49Å; K148-Y150 HydrophobicContact CB-CE2 3.75Å; K148-Y150 WeakPolarHBondContact CD-OH 3.26Å; Y150-A160 WeakPolarHBondContact O-CA 3.48Å; Y150-V161 PolarHBondContact N-O 2.89Å; Y150-V161 PolarHBondContact O-N 2.73Å; Y150-A163 HydrophobicContact CD2-CB 4.48Å; Y150-A163 HydrophobicContact CE2-CB 3.94Å
151	R	96.8	Very high	90.4	Very high	60 Å²	60	55 Å²	55	23%	0.226	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	143.4	154.1	178.8	171.1	175	-94.9	-10.8	107.6	E138 E139 I141 E158 Y213	E138-R151 WeakPolarHBondContact CB-O 3.33Å; E138-R151 PolarHBondContact N-O 2.96Å; E138-R151 IonicContact OE2-CZ 3.88Å; E138-R151 IonicContact OE2-NH1 3.64Å; E138-R151 PolarHBondContact OE2-NH1 3.3Å; E138-R151 IonicContact OE2-NH2 2.72Å; E139-R151 HydrophobicContact CG-CB 4.2Å; E139-R151 PolarHBondContact O-N 2.86Å; I141-R151 HydrophobicContact CD1-CB 4.4Å; I141-R151 HydrophobicContact CG2-CB 3.76Å; R151-E158 IonicContact CZ-OE1 2.71Å; R151-E158 IonicContact NE-OE1 3.6Å; R151-E158 PolarHBondContact NE-OE1 3.19Å; R151-E158 VanDerWaalsContact NE-OE1 3.12Å; R151-E158 IonicContact NH2-OE1 2.67Å; R151-E158 PolarHBondContact NH2-OE1 3.08Å; R151-Y213 HydrophobicContact CB-CE2 4.23Å; R151-Y213 HydrophobicContact CG-CD2 4.4Å; R151-Y213 HydrophobicContact CG-CE1 4.48Å; R151-Y213 HydrophobicContact CG-CE2 4.13Å
152	G	96.1	Very high	90.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	-177.3	174.1	0	0	0	0	0	112	V136 V159	V136-G152 CarbonylContact O-C 3.43Å; V136-G152 WeakPolarHBondContact O-CA 3.37Å; G152-V159 PolarHBondContact N-O 2.97Å; G152-V159 PolarHBondContact O-N 3.33Å
153	T	96.7	Very high	90.6	Very high	33 Å²	33	53.5 Å²	53.5	20%	0.202	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	134.4	178.8	-63.5	0	0	0	0	110.3	V136 E138 Q157	V136-T153 PolarHBondContact N-O 2.72Å; V136-T153 PolarHBondContact O-N 2.68Å; E138-T153 PolarHBondContact OE1-OG1 3.49Å; T153-Q157 WeakPolarHBondContact CA-O 3.33Å
154	W	95.8	Very high	90.6	Very high	26 Å²	26	49.3 Å²	49.3	10%	0.098	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	123.3	172.2	178.9	58.9	0	0	0	108.9	T128 I130 E134 L135 D156 Q157 V159 E198	T128-W154 HydrophobicContact CG2-CH2 4.42Å; I130-W154 HydrophobicContact CD1-CD2 3.93Å; I130-W154 HydrophobicContact CD1-CE3 4.21Å; I130-W154 HydrophobicContact CD1-CH2 3.84Å; I130-W154 HydrophobicContact CD1-CZ2 3.53Å; I130-W154 HydrophobicContact CD1-CZ3 4.18Å; I130-W154 HydrophobicContact CG1-CH2 4.24Å; I130-W154 HydrophobicContact CG1-CZ2 3.59Å; E134-W154 PolarHBondContact OE2-NE1 3.45Å; L135-W154 HydrophobicContact CD2-CB 3.91Å; L135-W154 HydrophobicContact CD2-CG 4.05Å; W154-D156 VanDerWaalsContact C-N 3.25Å; W154-D156 PolarHBondContact O-N 3.5Å; W154-Q157 PolarHBondContact N-O 2.93Å; W154-Q157 WeakPolarHBondContact O-CB 3.22Å; W154-Q157 PolarHBondContact O-N 2.82Å; W154-V159 HydrophobicContact CB-CG1 4.11Å; W154-V159 HydrophobicContact CB-CG2 3.99Å; W154-E198 HydrophobicContact CZ3-CB 4.15Å
155	K	93.4	Very high	90.9	Very high	124 Å²	124	53.2 Å²	53.2	54%	0.539	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	47.4	-179.8	-67.1	170.4	179.8	146.3	0	112.8	E134 Q157	E134-K155 IonicContact OE1-NZ 2.92Å; E134-K155 WeakPolarHBondContact OE2-CE 3.06Å; E134-K155 IonicContact OE2-NZ 3.59Å; E134-K155 PolarHBondContact OE2-NZ 2.97Å; K155-Q157 PolarHBondContact O-N 2.69Å
156	D	92	Very high	90.9	Very high	161 Å²	161	56.4 Å²	56.4	86%	0.861	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	16.2	-176.6	-54.7	-43.7	0	0	0	115.8	W154	W154-D156 VanDerWaalsContact C-N 3.25Å; W154-D156 PolarHBondContact O-N 3.5Å
157	Q	94.4	Very high	91	Very high	117 Å²	117	55.5 Å²	55.5	55%	0.547	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	139.6	173.5	-59.1	-172.8	-4.6	0	0	111.6	T153 W154 K155	T153-Q157 WeakPolarHBondContact CA-O 3.33Å; W154-Q157 PolarHBondContact N-O 2.93Å; W154-Q157 WeakPolarHBondContact O-CB 3.22Å; W154-Q157 PolarHBondContact O-N 2.82Å; K155-Q157 PolarHBondContact O-N 2.69Å
158	E	96.4	Very high	90.3	Very high	54 Å²	54	60.7 Å²	60.7	25%	0.252	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	127.5	174.8	-65.3	-177.2	105.5	0	0	111.2	R151 Y213 R215	R151-E158 IonicContact CZ-OE1 2.71Å; R151-E158 IonicContact NE-OE1 3.6Å; R151-E158 PolarHBondContact NE-OE1 3.19Å; R151-E158 VanDerWaalsContact NE-OE1 3.12Å; R151-E158 IonicContact NH2-OE1 2.67Å; R151-E158 PolarHBondContact NH2-OE1 3.08Å; E158-Y213 HydrophobicContact CB-CD1 3.99Å; E158-Y213 HydrophobicContact CB-CG 4.26Å; E158-Y213 WeakPolarHBondContact O-CB 3.24Å; E158-R215 IonicContact OE2-CZ 3.11Å; E158-R215 IonicContact OE2-NE 3.78Å; E158-R215 PolarHBondContact OE2-NE 3.05Å; E158-R215 IonicContact OE2-NH2 3.73Å; E158-R215 PolarHBondContact OE2-NH2 3.41Å
159	V	96.9	Very high	89.5	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.4	-179.5	-68.7	0	0	0	0	112	G152 W154 V161 V210 M211	G152-V159 PolarHBondContact N-O 2.97Å; G152-V159 PolarHBondContact O-N 3.33Å; W154-V159 HydrophobicContact CB-CG1 4.11Å; W154-V159 HydrophobicContact CB-CG2 3.99Å; V159-V161 HydrophobicContact CG2-CG2 4.01Å; V159-V210 HydrophobicContact CB-CG1 3.76Å; V159-V210 HydrophobicContact CG1-CG1 3.86Å; V159-V210 HydrophobicContact CG2-CG1 3.97Å; V159-M211 CarbonylContact C-O 3.55Å; V159-M211 WeakPolarHBondContact CA-O 3.5Å; V159-M211 WeakPolarHBondContact CB-O 3.49Å
160	A	97	Very high	88.5	Confident	11 Å²	11	66.5 Å²	66.5	9%	0.091	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118	167.2	0	0	0	0	0	109.3	I141 V149 Y150 M211 Y213	I141-A160 HydrophobicContact CD1-CB 4.42Å; V149-A160 HydrophobicContact CG1-CB 4.31Å; Y150-A160 WeakPolarHBondContact O-CA 3.48Å; A160-M211 HydrophobicContact CB-CB 4.45Å; A160-M211 HydrophobicContact CB-CE 4.24Å; A160-M211 PolarHBondContact N-O 3.36Å; A160-M211 PolarHBondContact O-N 3.48Å; A160-Y213 HydrophobicContact CB-CD2 4.39Å
161	V	95.3	Very high	87.7	Confident	1 Å²	1	69 Å²	69	1%	0.006	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	104.1	-178.4	-175.3	0	0	0	0	109.7	L135 L137 V149 Y150 V159 A163 C208 L209 V210	L135-V161 HydrophobicContact CD1-CG1 4.35Å; L135-V161 HydrophobicContact CD1-CG2 4.49Å; L137-V161 HydrophobicContact CD2-CB 3.82Å; L137-V161 HydrophobicContact CD2-CG1 3.97Å; L137-V161 HydrophobicContact CD2-CG2 3.77Å; V149-V161 VanDerWaalsContact CA-O 3.3Å; V149-V161 WeakPolarHBondContact CA-O 3.41Å; Y150-V161 PolarHBondContact N-O 2.89Å; Y150-V161 PolarHBondContact O-N 2.73Å; V159-V161 HydrophobicContact CG2-CG2 4.01Å; V161-A163 PolarHBondContact O-N 3.37Å; V161-C208 HydrophobicContact CG1-CB 3.74Å; V161-C208 VanDerWaalsContact CG1-SG 3.57Å; V161-L209 CarbonylContact C-O 3.43Å; V161-L209 WeakPolarHBondContact CA-O 3.47Å; V161-V210 HydrophobicContact CG2-CG1 4.45Å; V161-V210 HydrophobicContact CG2-CG2 4.45Å
162	K	93.2	Very high	86.7	Confident	20 Å²	20	70.2 Å²	70.2	9%	0.087	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	98.2	173.6	175.2	-177.8	168.8	-175.4	0	108.5	V149 E182 C208 L209 M211 D285	V149-K162 HydrophobicContact CB-CB 4.38Å; K162-E182 IonicContact NZ-OE1 3.62Å; K162-E182 PolarHBondContact NZ-OE1 3.06Å; K162-E182 IonicContact NZ-OE2 2.84Å; K162-C208 CarbonylContact O-C 3.6Å; K162-C208 WeakPolarHBondContact O-CA 3.37Å; K162-C208 WeakPolarHBondContact O-CB 3.36Å; K162-L209 HydrophobicContact CB-CB 4.44Å; K162-L209 HydrophobicContact CD-CD1 4.46Å; K162-L209 PolarHBondContact N-O 2.95Å; K162-L209 PolarHBondContact O-N 3.17Å; K162-M211 HydrophobicContact CB-CE 3.67Å; K162-D285 IonicContact NZ-OD1 3.44Å; K162-D285 PolarHBondContact NZ-OD1 3.35Å
163	A	91.3	Very high	86	Confident	25 Å²	25	74.3 Å²	74.3	21%	0.207	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.3	171.7	0	0	0	0	0	109.9	K148 Y150 V161 C208	K148-A163 PolarHBondContact N-O 2.85Å; K148-A163 PolarHBondContact O-N 3.14Å; Y150-A163 HydrophobicContact CD2-CB 4.48Å; Y150-A163 HydrophobicContact CE2-CB 3.94Å; V161-A163 PolarHBondContact O-N 3.37Å; A163-C208 HydrophobicContact CB-CB 4.39Å
164	A	85	Confident	85.1	Confident	23 Å²	23	75.4 Å²	75.4	19%	0.19	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-60.6	152.8	179.5	0	0	0	0	0	111.6	Q166 T175 V179 L207	A164-Q166 PolarHBondContact O-N 3.2Å; A164-T175 HydrophobicContact CB-CG2 4.37Å; A164-V179 HydrophobicContact CB-CG2 3.64Å; A164-L207 HydrophobicContact CB-CB 4.05Å; A164-L207 WeakPolarHBondContact CB-O 3.42Å; A164-L207 PolarHBondContact N-O 3.16Å
165	R	80.4	Confident	84.3	Confident	129 Å²	129	74.9 Å²	74.9	49%	0.487	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-71.9	117.7	170.2	-176.8	166.2	177.2	-109.1	-4.9	108.7	G145 D167	G145-R165 VanDerWaalsContact O-CD 3.23Å; G145-R165 WeakPolarHBondContact O-CD 3.42Å; R165-D167 IonicContact CZ-OD1 3.92Å; R165-D167 IonicContact CZ-OD2 2.67Å; R165-D167 IonicContact NE-OD1 3.52Å; R165-D167 PolarHBondContact NE-OD1 3.38Å; R165-D167 IonicContact NE-OD2 3.6Å; R165-D167 IonicContact NH1-OD1 3.61Å; R165-D167 IonicContact NH1-OD2 3.7Å; R165-D167 PolarHBondContact NH1-OD2 3.39Å; R165-D167 IonicContact NH2-OD1 3.9Å; R165-D167 PolarHBondContact NH2-OD1 3.16Å; R165-D167 IonicContact NH2-OD2 3.33Å; R165-D167 PolarHBondContact NH2-OD2 2.94Å
166	Q	73	Confident	83.7	Confident	127 Å²	127	69.8 Å²	69.8	59%	0.593	38%	0.378	S	S	*	.			trans	-90.3	109.6	164.5	-65.9	166.3	-6	0	0	107.2	A164 P205	A164-Q166 PolarHBondContact O-N 3.2Å; Q166-P205 PolarHBondContact NE2-O 3.38Å
167	D	73.3	Confident	83.2	Confident	46 Å²	46	65 Å²	65	25%	0.246	36%	0.36	C	S	.	.			trans	-91.2	137.4	160	-87.6	-17.5	0	0	0	108.8	R165 D169 E170	R165-D167 IonicContact CZ-OD1 3.92Å; R165-D167 IonicContact CZ-OD2 2.67Å; R165-D167 IonicContact NE-OD1 3.52Å; R165-D167 PolarHBondContact NE-OD1 3.38Å; R165-D167 IonicContact NE-OD2 3.6Å; R165-D167 IonicContact NH1-OD1 3.61Å; R165-D167 IonicContact NH1-OD2 3.7Å; R165-D167 PolarHBondContact NH1-OD2 3.39Å; R165-D167 IonicContact NH2-OD1 3.9Å; R165-D167 PolarHBondContact NH2-OD1 3.16Å; R165-D167 IonicContact NH2-OD2 3.33Å; R165-D167 PolarHBondContact NH2-OD2 2.94Å; D167-D169 PolarHBondContact O-N 3.46Å; D167-E170 HydrophobicContact CB-CB 4.27Å; D167-E170 HydrophobicContact CB-CG 4.2Å; D167-E170 PolarHBondContact O-N 3.29Å
168	P	69.8	Low	82.5	Confident	123 Å²	123	62.3 Å²	62.3	80%	0.799	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.8	-179.8	31.1	-36.2	0	0	0	113.1
169	D	73.3	Confident	81.9	Confident	157 Å²	157	60.2 Å²	60.2	84%	0.84	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-5.3	179.8	-51.7	-63.4	0	0	0	112.9	D167	D167-D169 PolarHBondContact O-N 3.46Å
170	E	72.9	Confident	81.3	Confident	107 Å²	107	66.4 Å²	66.4	50%	0.5	37%	0.372	S	S	.	.	S	Bend	trans	-92.5	147.8	171.6	-80.4	-160.9	155.3	0	0	111.8	D167 I172 T175	D167-E170 HydrophobicContact CB-CB 4.27Å; D167-E170 HydrophobicContact CB-CG 4.2Å; D167-E170 PolarHBondContact O-N 3.29Å; E170-I172 PolarHBondContact O-N 3.5Å; E170-T175 PolarHBondContact OE2-OG1 2.8Å
171	D	78.4	Confident	80.4	Confident	101 Å²	101	69.2 Å²	69.2	54%	0.54	38%	0.383	S	S	.	.			trans	-70.7	117.1	169.7	-173.4	-30.8	0	0	0	109.9	T173 A174 T175	D171-T173 VanDerWaalsContact CG-OG1 3.25Å; D171-T173 PolarHBondContact O-N 3.38Å; D171-T173 VanDerWaalsContact O-N 3.1Å; D171-T173 VanDerWaalsContact OD1-CB 3.31Å; D171-T173 WeakPolarHBondContact OD1-CB 3.23Å; D171-T173 WeakPolarHBondContact OD1-CG2 3.24Å; D171-T173 PolarHBondContact OD1-N 2.73Å; D171-T173 PolarHBondContact OD1-OG1 2.73Å; D171-T173 PolarHBondContact OD2-OG1 3.37Å; D171-A174 HydrophobicContact CB-CB 4.18Å; D171-A174 WeakPolarHBondContact O-CA 3.46Å; D171-A174 WeakPolarHBondContact O-CB 3.32Å; D171-A174 PolarHBondContact O-N 2.86Å; D171-T175 PolarHBondContact O-N 3.43Å; D171-T175 PolarHBondContact O-OG1 3.21Å
172	I	76.5	Confident	79.9	Confident	86 Å²	86	70.3 Å²	70.3	44%	0.441	39%	0.388	S	S	.	.	H	α-helix	trans	-53.5	-33.6	179.8	-57.8	175.3	0	0	0	111.3	E170 A174 T175 A176 E204	E170-I172 PolarHBondContact O-N 3.5Å; I172-A174 VanDerWaalsContact C-N 3.35Å; I172-T175 PolarHBondContact O-N 3.05Å; I172-A176 WeakPolarHBondContact O-CB 3.3Å; I172-A176 PolarHBondContact O-N 3.18Å; I172-E204 HydrophobicContact CG2-CG 3.89Å
173	T	80.6	Confident	79.5	Confident	86 Å²	86	69.4 Å²	69.4	53%	0.528	38%	0.384	S	S	.	.	H	α-helix	trans	-70.4	-31.4	178.4	72.3	0	0	0	0	112.3	D171 A177	D171-T173 VanDerWaalsContact CG-OG1 3.25Å; D171-T173 PolarHBondContact O-N 3.38Å; D171-T173 VanDerWaalsContact O-N 3.1Å; D171-T173 VanDerWaalsContact OD1-CB 3.31Å; D171-T173 WeakPolarHBondContact OD1-CB 3.23Å; D171-T173 WeakPolarHBondContact OD1-CG2 3.24Å; D171-T173 PolarHBondContact OD1-N 2.73Å; D171-T173 PolarHBondContact OD1-OG1 2.73Å; D171-T173 PolarHBondContact OD2-OG1 3.37Å; T173-A177 WeakPolarHBondContact O-CB 3.32Å; T173-A177 PolarHBondContact O-N 3.26Å
174	A	79.3	Confident	79.2	Confident	56 Å²	56	74 Å²	74	46%	0.463	40%	0.399	S	S	.	.	H	α-helix	trans	-72.4	-40.8	172.1	0	0	0	0	0	111.1	D171 I172 A176 A177 S178	D171-A174 HydrophobicContact CB-CB 4.18Å; D171-A174 WeakPolarHBondContact O-CA 3.46Å; D171-A174 WeakPolarHBondContact O-CB 3.32Å; D171-A174 PolarHBondContact O-N 2.86Å; I172-A174 VanDerWaalsContact C-N 3.35Å; A174-A176 PolarHBondContact O-N 2.94Å; A174-A177 PolarHBondContact O-N 2.98Å; A174-S178 WeakPolarHBondContact O-CB 3.08Å; A174-S178 PolarHBondContact O-N 2.91Å
175	T	77.8	Confident	78.9	Confident	16 Å²	16	73.4 Å²	73.4	10%	0.098	39%	0.393	C	S	.	.	H	α-helix	trans	-59.4	-45.8	171.2	-43.4	0	0	0	0	110.8	A164 E170 D171 I172 A177 S178 V179 L207	A164-T175 HydrophobicContact CB-CG2 4.37Å; E170-T175 PolarHBondContact OE2-OG1 2.8Å; D171-T175 PolarHBondContact O-N 3.43Å; D171-T175 PolarHBondContact O-OG1 3.21Å; I172-T175 PolarHBondContact O-N 3.05Å; T175-A177 PolarHBondContact O-N 3.16Å; T175-S178 WeakPolarHBondContact O-CB 3.4Å; T175-S178 PolarHBondContact O-N 2.82Å; T175-V179 WeakPolarHBondContact O-CG2 3.44Å; T175-V179 PolarHBondContact O-N 2.95Å; T175-L207 HydrophobicContact CG2-CD1 4.15Å
176	A	81.1	Confident	79.2	Confident	17 Å²	17	67.5 Å²	67.5	14%	0.14	37%	0.371	C	S	.	.	H	α-helix	trans	-62.4	-41.4	176.7	0	0	0	0	0	112.6	I172 A174 K180 L207	I172-A176 WeakPolarHBondContact O-CB 3.3Å; I172-A176 PolarHBondContact O-N 3.18Å; A174-A176 PolarHBondContact O-N 2.94Å; A176-K180 WeakPolarHBondContact O-CB 3.44Å; A176-K180 PolarHBondContact O-N 3.07Å; A176-L207 HydrophobicContact CB-CD1 3.86Å; A176-L207 HydrophobicContact CB-CD2 3.98Å
177	A	81.4	Confident	79.8	Confident	59 Å²	59	63.4 Å²	63.4	49%	0.488	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-40.7	174.4	0	0	0	0	0	112.2	T173 A174 T175 K180 Q181	T173-A177 WeakPolarHBondContact O-CB 3.32Å; T173-A177 PolarHBondContact O-N 3.26Å; A174-A177 PolarHBondContact O-N 2.98Å; T175-A177 PolarHBondContact O-N 3.16Å; A177-K180 PolarHBondContact O-N 3.28Å; A177-Q181 PolarHBondContact O-N 2.85Å
178	S	80.1	Confident	80.3	Confident	61 Å²	61	63.5 Å²	63.5	43%	0.427	36%	0.356	S	S	.	.	H	α-helix	trans	-62.9	-51.5	175.7	-169.5	0	0	0	0	111.7	A174 T175 K180 Q181 E182	A174-S178 WeakPolarHBondContact O-CB 3.08Å; A174-S178 PolarHBondContact O-N 2.91Å; T175-S178 WeakPolarHBondContact O-CB 3.4Å; T175-S178 PolarHBondContact O-N 2.82Å; S178-K180 VanDerWaalsContact C-N 3.31Å; S178-K180 PolarHBondContact O-N 2.97Å; S178-Q181 PolarHBondContact O-N 3.37Å; S178-Q181 VanDerWaalsContact O-N 3.08Å; S178-E182 PolarHBondContact O-N 3.06Å
179	V	83.2	Confident	81.1	Confident	10 Å²	10	58.4 Å²	58.4	6%	0.061	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-41.2	176.9	174	0	0	0	0	111.2	A164 T175 Q181 E182 A183 L202 L207 L209	A164-V179 HydrophobicContact CB-CG2 3.64Å; T175-V179 WeakPolarHBondContact O-CG2 3.44Å; T175-V179 PolarHBondContact O-N 2.95Å; V179-Q181 VanDerWaalsContact C-N 3.3Å; V179-Q181 PolarHBondContact O-N 3.26Å; V179-E182 PolarHBondContact O-N 2.69Å; V179-A183 WeakPolarHBondContact O-CB 3.43Å; V179-A183 PolarHBondContact O-N 3.01Å; V179-L202 HydrophobicContact CG1-CD2 3.95Å; V179-L207 HydrophobicContact CG2-CB 4.47Å; V179-L209 HydrophobicContact CG1-CD2 3.99Å
180	K	84.4	Confident	81.9	Confident	134 Å²	134	59 Å²	59	58%	0.583	32%	0.32	S	S	*	.	H	α-helix	trans	-65.6	-30.5	177	-172.4	173.3	-175.9	173.1	0	112.9	A176 A177 S178 K184 L202	A176-K180 WeakPolarHBondContact O-CB 3.44Å; A176-K180 PolarHBondContact O-N 3.07Å; A177-K180 PolarHBondContact O-N 3.28Å; S178-K180 VanDerWaalsContact C-N 3.31Å; S178-K180 PolarHBondContact O-N 2.97Å; K180-K184 VanDerWaalsContact O-CB 3.32Å; K180-K184 WeakPolarHBondContact O-CB 3.31Å; K180-K184 PolarHBondContact O-N 2.67Å; K180-K184 VanDerWaalsContact O-N 3.14Å; K180-L202 HydrophobicContact CB-CD1 4.39Å; K180-L202 HydrophobicContact CB-CD2 4.31Å; K180-L202 HydrophobicContact CD-CD1 4.29Å; K180-L202 HydrophobicContact CG-CD1 4.09Å
181	Q	78.9	Confident	83	Confident	69 Å²	69	55.7 Å²	55.7	32%	0.322	30%	0.304	S	S	.	.	H	α-helix	trans	-80.8	-37.7	174.6	179.1	60.2	25.9	0	0	112.4	A177 S178 V179 K184 L185 E291	A177-Q181 PolarHBondContact O-N 2.85Å; S178-Q181 PolarHBondContact O-N 3.37Å; S178-Q181 VanDerWaalsContact O-N 3.08Å; V179-Q181 VanDerWaalsContact C-N 3.3Å; V179-Q181 PolarHBondContact O-N 3.26Å; Q181-K184 PolarHBondContact O-N 3.17Å; Q181-L185 PolarHBondContact O-N 2.85Å; Q181-L185 VanDerWaalsContact O-N 3.16Å; Q181-E291 PolarHBondContact NE2-OE1 2.81Å
182	E	83.9	Confident	83.8	Confident	25 Å²	25	54.8 Å²	54.8	12%	0.117	30%	0.304	C	S	.	.	H	α-helix	trans	-58	-52.2	169.1	-175.3	178.2	166.6	0	0	109.6	K162 S178 V179 K184 L185 F186 L209 G287	K162-E182 IonicContact NZ-OE1 3.62Å; K162-E182 PolarHBondContact NZ-OE1 3.06Å; K162-E182 IonicContact NZ-OE2 2.84Å; S178-E182 PolarHBondContact O-N 3.06Å; V179-E182 PolarHBondContact O-N 2.69Å; E182-K184 VanDerWaalsContact C-N 3.32Å; E182-K184 PolarHBondContact O-N 2.87Å; E182-L185 PolarHBondContact O-N 2.99Å; E182-F186 VanDerWaalsContact O-CB 3.24Å; E182-F186 WeakPolarHBondContact O-CB 3.28Å; E182-F186 PolarHBondContact O-N 2.8Å; E182-L209 HydrophobicContact CG-CD1 3.89Å; E182-L209 VanDerWaalsContact OE1-CD1 3.28Å; E182-L209 WeakPolarHBondContact OE1-CD1 3.33Å; E182-G287 WeakPolarHBondContact OE1-CA 3.4Å; E182-G287 PolarHBondContact OE1-N 2.95Å
183	A	86.2	Confident	84.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-52.8	-43.9	176	0	0	0	0	0	113.6	P127 V179 F186 S187 V200 L209	P127-A183 HydrophobicContact CG-CB 4.05Å; V179-A183 WeakPolarHBondContact O-CB 3.43Å; V179-A183 PolarHBondContact O-N 3.01Å; A183-F186 PolarHBondContact O-N 2.82Å; A183-S187 VanDerWaalsContact O-CB 3.32Å; A183-S187 WeakPolarHBondContact O-CB 3.36Å; A183-S187 PolarHBondContact O-N 3.28Å; A183-S187 PolarHBondContact O-OG 3.18Å; A183-V200 HydrophobicContact CB-CG1 3.68Å; A183-L209 HydrophobicContact CB-CD2 3.92Å
184	K	82.9	Confident	85.5	Confident	121 Å²	121	47.2 Å²	47.2	53%	0.526	26%	0.261	S	S	.	.	H	α-helix	trans	-69	-35.8	-179	-179.6	-175.3	173.8	-172.1	0	113.1	K180 Q181 E182 S187	K180-K184 VanDerWaalsContact O-CB 3.32Å; K180-K184 WeakPolarHBondContact O-CB 3.31Å; K180-K184 PolarHBondContact O-N 2.67Å; K180-K184 VanDerWaalsContact O-N 3.14Å; Q181-K184 PolarHBondContact O-N 3.17Å; E182-K184 VanDerWaalsContact C-N 3.32Å; E182-K184 PolarHBondContact O-N 2.87Å; K184-S187 PolarHBondContact O-OG 3.42Å
185	L	79.6	Confident	86.3	Confident	12 Å²	12	44.7 Å²	44.7	6%	0.063	24%	0.24	C	C	.	.	H	α-helix	trans	-70.3	-45.3	173.3	-68.3	178	0	0	0	110.3	Q181 E182 S187 M188 E291	Q181-L185 PolarHBondContact O-N 2.85Å; Q181-L185 VanDerWaalsContact O-N 3.16Å; E182-L185 PolarHBondContact O-N 2.99Å; L185-S187 PolarHBondContact O-N 2.97Å; L185-M188 HydrophobicContact CD2-CE 4.09Å; L185-M188 PolarHBondContact O-N 3.29Å; L185-E291 HydrophobicContact CD1-CG 4.26Å; L185-E291 HydrophobicContact CD2-CG 3.53Å
186	F	87.1	Confident	87.1	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-68.9	-34.1	-174.7	-162.1	178.9	0	0	0	112.7	E182 A183 M188 L189 I195 L197 L209 M211 F286	E182-F186 VanDerWaalsContact O-CB 3.24Å; E182-F186 WeakPolarHBondContact O-CB 3.28Å; E182-F186 PolarHBondContact O-N 2.8Å; A183-F186 PolarHBondContact O-N 2.82Å; F186-M188 PolarHBondContact O-N 3.42Å; F186-L189 HydrophobicContact CD2-CD1 4.12Å; F186-L189 WeakPolarHBondContact O-CB 3.44Å; F186-L189 PolarHBondContact O-N 2.83Å; F186-I195 HydrophobicContact CE2-CG2 4.03Å; F186-I195 VanDerWaalsContact CE2-O 3.31Å; F186-I195 WeakPolarHBondContact CE2-O 3.3Å; F186-I195 HydrophobicContact CZ-CG2 3.61Å; F186-L197 HydrophobicContact CB-CD2 4.21Å; F186-L197 HydrophobicContact CD1-CB 4.38Å; F186-L197 HydrophobicContact CD1-CD1 3.92Å; F186-L197 HydrophobicContact CD1-CD2 4.47Å; F186-L197 HydrophobicContact CD1-CG 4.5Å; F186-L197 HydrophobicContact CD2-CB 4.18Å; F186-L197 HydrophobicContact CE1-CD1 4.08Å; F186-L197 HydrophobicContact CE2-CB 4.36Å; F186-L197 HydrophobicContact CG-CB 4.19Å; F186-L197 HydrophobicContact CG-CD1 4.47Å; F186-L197 HydrophobicContact CG-CD2 4.32Å; F186-L209 HydrophobicContact CD1-CD1 4.19Å; F186-L209 HydrophobicContact CE1-CD1 4.45Å; F186-M211 HydrophobicContact CE1-CG 4.1Å; F186-M211 HydrophobicContact CE1-SD 3.79Å; F186-M211 HydrophobicContact CZ-CG 4.19Å; F186-M211 HydrophobicContact CZ-SD 3.94Å; F186-F286 HydrophobicContact CD1-CD2 4.34Å; F186-F286 AromaticContact CD2-CD2 3.87Å; F186-F286 HydrophobicContact CD2-CD2 3.87Å; F186-F286 HydrophobicContact CD2-CE2 4.24Å; F186-F286 AromaticContact CE1-CD2 4Å; F186-F286 HydrophobicContact CE1-CD2 4Å; F186-F286 AromaticContact CE2-CD2 3.45Å; F186-F286 HydrophobicContact CE2-CD2 3.45Å; F186-F286 VanDerWaalsContact CE2-CD2 3.45Å; F186-F286 AromaticContact CE2-CE2 3.59Å; F186-F286 HydrophobicContact CE2-CE2 3.59Å; F186-F286 HydrophobicContact CE2-CG 4.48Å; F186-F286 HydrophobicContact CG-CD2 4.3Å; F186-F286 AromaticContact CZ-CD2 3.53Å; F186-F286 HydrophobicContact CZ-CD2 3.53Å; F186-F286 AromaticContact CZ-CE2 3.93Å; F186-F286 HydrophobicContact CZ-CE2 3.93Å
187	S	85.6	Confident	87.6	Confident	42 Å²	42	48.7 Å²	48.7	29%	0.294	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-9.2	176.4	75.4	0	0	0	0	114.6	A183 K184 L185	A183-S187 VanDerWaalsContact O-CB 3.32Å; A183-S187 WeakPolarHBondContact O-CB 3.36Å; A183-S187 PolarHBondContact O-N 3.28Å; A183-S187 PolarHBondContact O-OG 3.18Å; K184-S187 PolarHBondContact O-OG 3.42Å; L185-S187 PolarHBondContact O-N 2.97Å
188	M	82.5	Confident	88.2	Confident	48 Å²	48	47.5 Å²	47.5	24%	0.236	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-0.6	172.1	-60.2	-173.1	-64.7	0	0	112.9	L185 F186 V252	L185-M188 HydrophobicContact CD2-CE 4.09Å; L185-M188 PolarHBondContact O-N 3.29Å; F186-M188 PolarHBondContact O-N 3.42Å; M188-V252 HydrophobicContact SD-CG1 4.39Å
189	L	88.3	Confident	88.8	Confident	15 Å²	15	44.6 Å²	44.6	8%	0.079	22%	0.218	C	C	.	.			trans	-97.7	120.4	-176.6	-55.5	-177.3	0	0	0	111.5	F186 I194 Y246 L247 A251 I255 F286	F186-L189 HydrophobicContact CD2-CD1 4.12Å; F186-L189 WeakPolarHBondContact O-CB 3.44Å; F186-L189 PolarHBondContact O-N 2.83Å; L189-I194 HydrophobicContact CB-CG2 4.31Å; L189-Y246 HydrophobicContact CB-CE1 4.34Å; L189-Y246 HydrophobicContact CD2-CE1 4.03Å; L189-L247 HydrophobicContact CD1-CD2 3.78Å; L189-L247 HydrophobicContact CD2-CD2 3.98Å; L189-L247 HydrophobicContact CG-CD2 4.49Å; L189-A251 HydrophobicContact CD2-CB 4.16Å; L189-I255 HydrophobicContact CD2-CD1 3.89Å; L189-F286 HydrophobicContact CD1-CD1 4.14Å; L189-F286 HydrophobicContact CD1-CE1 3.94Å; L189-F286 HydrophobicContact CD1-CZ 4.17Å
190	Q	90.1	Very high	89.3	Confident	171 Å²	171	44.1 Å²	44.1	80%	0.799	22%	0.215	S	C	*	.			trans	-143.9	97.1	177	-170.9	177	21.3	0	0	110.7	Y246	Q190-Y246 PolarHBondContact N-OH 2.92Å
191	H	94.4	Very high	89.7	Confident	36 Å²	36	37.8 Å²	37.8	17%	0.167	19%	0.188	C	C	.	.			trans	-150.1	142.8	177	176.1	-92.9	0	0	0	109.3	N193 I194 Y246	H191-N193 PolarHBondContact CE1-OD1 3.07Å; H191-N193 PolarHBondContact ND1-N 2.8Å; H191-N193 VanDerWaalsContact ND1-N 3.16Å; H191-N193 PolarHBondContact O-N 2.83Å; H191-N193 VanDerWaalsContact O-N 3.16Å; H191-I194 HydrophobicContact CB-CB 4.35Å; H191-I194 HydrophobicContact CB-CG1 3.86Å; H191-I194 PolarHBondContact O-N 2.88Å; H191-Y246 HydrophobicContact CB-CD1 3.55Å; H191-Y246 HydrophobicContact CB-CD2 3.81Å; H191-Y246 HydrophobicContact CB-CE1 3.82Å; H191-Y246 HydrophobicContact CB-CE2 4.08Å; H191-Y246 HydrophobicContact CB-CG 3.55Å; H191-Y246 AromaticContact CD2-CD2 3.97Å; H191-Y246 AromaticContact CD2-CG 3.91Å; H191-Y246 AromaticContact CG-CG 3.73Å
192	P	95.7	Very high	90.1	Very high	83 Å²	83	36.6 Å²	36.6	54%	0.539	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-37.2	-176.1	18.4	-33.7	0	0	0	114.1	I194 K282	P192-I194 VanDerWaalsContact C-N 3.33Å; P192-K282 VanDerWaalsContact O-CE 3.23Å; P192-K282 WeakPolarHBondContact O-CE 3.45Å; P192-K282 WeakPolarHBondContact O-CG 3.47Å; P192-K282 PolarHBondContact O-NZ 3.49Å
193	N	97.4	Very high	90.2	Very high	10 Å²	10	40 Å²	40	5%	0.053	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	16	179.2	-55.6	109.5	0	0	0	114.7	H191 Q239 L281 K282 I283	H191-N193 PolarHBondContact CE1-OD1 3.07Å; H191-N193 PolarHBondContact ND1-N 2.8Å; H191-N193 VanDerWaalsContact ND1-N 3.16Å; H191-N193 PolarHBondContact O-N 2.83Å; H191-N193 VanDerWaalsContact O-N 3.16Å; N193-Q239 VanDerWaalsContact CB-O 3.24Å; N193-Q239 WeakPolarHBondContact CB-O 3.46Å; N193-Q239 VanDerWaalsContact CG-O 3.28Å; N193-Q239 WeakPolarHBondContact ND2-CB 3.41Å; N193-Q239 PolarHBondContact ND2-OE1 2.63Å; N193-L281 VanDerWaalsContact CA-O 3.24Å; N193-L281 WeakPolarHBondContact CA-O 3.35Å; N193-L281 WeakPolarHBondContact CB-O 3.42Å; N193-L281 PolarHBondContact ND2-O 3.14Å; N193-K282 WeakPolarHBondContact O-CA 3.27Å; N193-I283 PolarHBondContact O-N 3.04Å
194	I	96.3	Very high	90.1	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.015	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-112.2	143.1	168.3	-58.5	-60.6	0	0	0	107.9	L189 H191 P192 Y246 L247 K282 I283 F286	L189-I194 HydrophobicContact CB-CG2 4.31Å; H191-I194 HydrophobicContact CB-CB 4.35Å; H191-I194 HydrophobicContact CB-CG1 3.86Å; H191-I194 PolarHBondContact O-N 2.88Å; P192-I194 VanDerWaalsContact C-N 3.33Å; I194-Y246 HydrophobicContact CG1-CD1 4.02Å; I194-Y246 HydrophobicContact CG1-CE1 4.47Å; I194-L247 HydrophobicContact CD1-CD1 3.9Å; I194-L247 HydrophobicContact CD1-CD2 4.17Å; I194-L247 HydrophobicContact CD1-CG 3.94Å; I194-K282 PolarHBondContact O-NZ 3.18Å; I194-I283 HydrophobicContact CD1-CB 3.95Å; I194-I283 HydrophobicContact CD1-CD1 4.05Å; I194-I283 HydrophobicContact CD1-CG1 4.22Å; I194-F286 HydrophobicContact CD1-CZ 4.27Å; I194-F286 HydrophobicContact CG2-CE2 4Å; I194-F286 HydrophobicContact CG2-CZ 3.77Å
195	I	95.8	Very high	90.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-69.5	135.1	172.5	-157.4	70.6	0	0	0	109.1	F186 M211 E212 A214 L266 K282 I283 F286	F186-I195 HydrophobicContact CE2-CG2 4.03Å; F186-I195 VanDerWaalsContact CE2-O 3.31Å; F186-I195 WeakPolarHBondContact CE2-O 3.3Å; F186-I195 HydrophobicContact CZ-CG2 3.61Å; I195-M211 HydrophobicContact CG2-SD 4.43Å; I195-E212 HydrophobicContact CD1-CG 3.43Å; I195-E212 VanDerWaalsContact CD1-CG 3.43Å; I195-E212 HydrophobicContact CG1-CG 3.89Å; I195-A214 HydrophobicContact CD1-CB 4.1Å; I195-L266 HydrophobicContact CD1-CD1 4.06Å; I195-L266 HydrophobicContact CG1-CD1 4.45Å; I195-K282 HydrophobicContact CB-CB 4.36Å; I195-K282 HydrophobicContact CD1-CB 4.12Å; I195-K282 HydrophobicContact CD1-CD 3.93Å; I195-I283 WeakPolarHBondContact CB-O 3.49Å; I195-I283 WeakPolarHBondContact CG2-O 3.34Å; I195-I283 PolarHBondContact N-O 2.82Å; I195-F286 HydrophobicContact CG2-CE2 4.3Å
196	K	93.4	Very high	90.6	Very high	96 Å²	96	45.1 Å²	45.1	42%	0.417	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-84.1	134.1	-177.2	179	173.4	167.2	-122.7	0	111.1	E198 M211 E212	K196-E198 WeakPolarHBondContact CD-OE1 3.36Å; K196-E198 WeakPolarHBondContact CE-OE1 3.23Å; K196-E198 IonicContact NZ-OE1 2.82Å; K196-E198 PolarHBondContact NZ-OE1 3.39Å; K196-E198 IonicContact NZ-OE2 2.74Å; K196-E198 PolarHBondContact NZ-OE2 3.2Å; K196-M211 CarbonylContact O-C 3.59Å; K196-M211 WeakPolarHBondContact O-CA 3.38Å; K196-M211 WeakPolarHBondContact O-CB 3.47Å; K196-E212 HydrophobicContact CB-CB 4.46Å; K196-E212 HydrophobicContact CB-CG 4.28Å; K196-E212 VanDerWaalsContact CB-OE1 3.3Å; K196-E212 WeakPolarHBondContact CB-OE1 3.23Å; K196-E212 PolarHBondContact N-OE1 3.3Å; K196-E212 PolarHBondContact O-N 2.81Å
197	L	93.5	Very high	90.7	Very high	21 Å²	21	45.3 Å²	45.3	11%	0.11	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	123.9	163.7	-171.5	75.3	0	0	0	109	P127 F186 G199 V200 L209 V210 M211	P127-L197 HydrophobicContact CB-CD2 4.25Å; F186-L197 HydrophobicContact CB-CD2 4.21Å; F186-L197 HydrophobicContact CD1-CB 4.38Å; F186-L197 HydrophobicContact CD1-CD1 3.92Å; F186-L197 HydrophobicContact CD1-CD2 4.47Å; F186-L197 HydrophobicContact CD1-CG 4.5Å; F186-L197 HydrophobicContact CD2-CB 4.18Å; F186-L197 HydrophobicContact CE1-CD1 4.08Å; F186-L197 HydrophobicContact CE2-CB 4.36Å; F186-L197 HydrophobicContact CG-CB 4.19Å; F186-L197 HydrophobicContact CG-CD1 4.47Å; F186-L197 HydrophobicContact CG-CD2 4.32Å; L197-G199 WeakPolarHBondContact CD1-O 3.45Å; L197-V200 HydrophobicContact CD1-CG1 4.21Å; L197-V200 HydrophobicContact CD2-CG1 4.14Å; L197-L209 HydrophobicContact CD1-CB 4.04Å; L197-V210 WeakPolarHBondContact CD1-O 3.37Å; L197-M211 HydrophobicContact CD1-CG 4.16Å
198	E	93.5	Very high	91.1	Very high	34 Å²	34	43.4 Å²	43.4	16%	0.159	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-34.8	174.6	-62.8	-58.7	155.5	0	0	111.6	T128 W154 K196 V210	T128-E198 WeakPolarHBondContact CB-O 3.38Å; T128-E198 PolarHBondContact OG1-O 3.4Å; W154-E198 HydrophobicContact CZ3-CB 4.15Å; K196-E198 WeakPolarHBondContact CD-OE1 3.36Å; K196-E198 WeakPolarHBondContact CE-OE1 3.23Å; K196-E198 IonicContact NZ-OE1 2.82Å; K196-E198 PolarHBondContact NZ-OE1 3.39Å; K196-E198 IonicContact NZ-OE2 2.74Å; K196-E198 PolarHBondContact NZ-OE2 3.2Å; E198-V210 HydrophobicContact CB-CG1 4.47Å; E198-V210 PolarHBondContact N-O 2.89Å
199	G	92.3	Very high	91.6	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.5	-170.4	177.9	0	0	0	0	0	112.8	T128 L197 V210	T128-G199 CarbonylContact O-C 3.59Å; T128-G199 WeakPolarHBondContact O-CA 3.36Å; L197-G199 WeakPolarHBondContact CD1-O 3.45Å; G199-V210 PolarHBondContact N-O 3.46Å; G199-V210 WeakPolarHBondContact O-CA 3.49Å; G199-V210 WeakPolarHBondContact O-CB 3.45Å; G199-V210 PolarHBondContact O-N 3.48Å
200	V	93.4	Very high	91.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.3	-176.9	-60.6	0	0	0	0	111.4	P127 T128 Q129 I130 A183 L197 L202 C208 L209	P127-V200 HydrophobicContact CB-CG1 4.22Å; P127-V200 HydrophobicContact CB-CG2 3.98Å; P127-V200 HydrophobicContact CG-CG2 4.05Å; T128-V200 PolarHBondContact O-N 3.27Å; Q129-V200 WeakPolarHBondContact CA-O 3.4Å; I130-V200 PolarHBondContact N-O 3.03Å; A183-V200 HydrophobicContact CB-CG1 3.68Å; L197-V200 HydrophobicContact CD1-CG1 4.21Å; L197-V200 HydrophobicContact CD2-CG1 4.14Å; V200-L202 HydrophobicContact CG2-CD1 4.23Å; V200-L202 HydrophobicContact CG2-CG 4.04Å; V200-C208 CarbonylContact C-O 3.54Å; V200-C208 WeakPolarHBondContact CA-O 3.45Å; V200-L209 HydrophobicContact CB-CD2 4.29Å; V200-L209 HydrophobicContact CG1-CD2 3.43Å; V200-L209 VanDerWaalsContact CG1-CD2 3.43Å
201	C	92.6	Very high	92.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.9	162.9	-160.4	0	0	0	0	108.9	I130 C208	I130-C201 WeakPolarHBondContact O-CB 3.42Å; I130-C201 PolarHBondContact O-SG 2.83Å; C201-C208 WeakPolarHBondContact CB-SG 3.46Å; C201-C208 PolarHBondContact N-O 2.83Å; C201-C208 PolarHBondContact O-N 2.54Å
202	L	88.4	Confident	92.2	Very high	44 Å²	44	32.7 Å²	32.7	23%	0.23	17%	0.17	C	C	.	.			trans	-117.5	16.3	175.2	-60	176	0	0	0	111	V179 K180 V200	V179-L202 HydrophobicContact CG1-CD2 3.95Å; K180-L202 HydrophobicContact CB-CD1 4.39Å; K180-L202 HydrophobicContact CB-CD2 4.31Å; K180-L202 HydrophobicContact CD-CD1 4.29Å; K180-L202 HydrophobicContact CG-CD1 4.09Å; V200-L202 HydrophobicContact CG2-CD1 4.23Å; V200-L202 HydrophobicContact CG2-CG 4.04Å
203	E	85.6	Confident	92.2	Very high	95 Å²	95	31.1 Å²	31.1	44%	0.444	15%	0.153	S	C	.	.	S	Bend	trans	-83.1	114.7	177.5	-59.1	178.3	147.7	0	0	109	P131 F132 N206	P131-E203 WeakPolarHBondContact CA-OE2 3.48Å; F132-E203 PolarHBondContact N-OE2 3.05Å; E203-N206 CarbonylContact O-C 3.46Å; E203-N206 WeakPolarHBondContact O-CA 3.36Å; E203-N206 PolarHBondContact O-N 3.16Å
204	E	83.1	Confident	92.2	Very high	111 Å²	111	31 Å²	31	52%	0.519	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	139.9	176.2	-70.4	178.7	-159.5	0	0	111.2	I172 L207	I172-E204 HydrophobicContact CG2-CG 3.89Å; E204-L207 HydrophobicContact CG-CD2 4.38Å
205	P	84.4	Confident	92.1	Very high	70 Å²	70	38 Å²	38	46%	0.455	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86.1	-4.3	2.3	36	-37.3	0	0	0	114.4	Q166 L207	Q166-P205 PolarHBondContact NE2-O 3.38Å; P205-L207 VanDerWaalsContact C-N 3.28Å; P205-L207 PolarHBondContact O-N 2.92Å
206	N	88.6	Confident	92	Very high	61 Å²	61	38.9 Å²	38.9	33%	0.326	19%	0.19	S	C	.	.			trans	-85.6	50.8	-164.1	-56.1	-57.1	0	0	0	114.1	F132 E203 C208	F132-N206 HydrophobicContact CB-CB 4.17Å; F132-N206 HydrophobicContact CD1-CB 4.11Å; F132-N206 HydrophobicContact CD2-CB 3.48Å; F132-N206 VanDerWaalsContact CD2-CB 3.48Å; F132-N206 HydrophobicContact CE1-CB 4.39Å; F132-N206 HydrophobicContact CE2-CB 3.81Å; F132-N206 HydrophobicContact CG-CB 3.64Å; F132-N206 HydrophobicContact CZ-CB 4.25Å; E203-N206 CarbonylContact O-C 3.46Å; E203-N206 WeakPolarHBondContact O-CA 3.36Å; E203-N206 PolarHBondContact O-N 3.16Å; N206-C208 PolarHBondContact O-N 2.96Å
207	L	90.5	Very high	92	Very high	7 Å²	7	35.4 Å²	35.4	4%	0.037	18%	0.182	C	C	.	.			trans	-62.2	116.5	177.2	-56.9	174.3	0	0	0	111.1	A164 T175 A176 V179 E204 P205	A164-L207 HydrophobicContact CB-CB 4.05Å; A164-L207 WeakPolarHBondContact CB-O 3.42Å; A164-L207 PolarHBondContact N-O 3.16Å; T175-L207 HydrophobicContact CG2-CD1 4.15Å; A176-L207 HydrophobicContact CB-CD1 3.86Å; A176-L207 HydrophobicContact CB-CD2 3.98Å; V179-L207 HydrophobicContact CG2-CB 4.47Å; E204-L207 HydrophobicContact CG-CD2 4.38Å; P205-L207 VanDerWaalsContact C-N 3.28Å; P205-L207 PolarHBondContact O-N 2.92Å
208	C	92.6	Very high	92	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	154.4	179.6	72.1	0	0	0	0	115.2	V161 K162 A163 V200 C201 N206	V161-C208 HydrophobicContact CG1-CB 3.74Å; V161-C208 VanDerWaalsContact CG1-SG 3.57Å; K162-C208 CarbonylContact O-C 3.6Å; K162-C208 WeakPolarHBondContact O-CA 3.37Å; K162-C208 WeakPolarHBondContact O-CB 3.36Å; A163-C208 HydrophobicContact CB-CB 4.39Å; V200-C208 CarbonylContact C-O 3.54Å; V200-C208 WeakPolarHBondContact CA-O 3.45Å; C201-C208 WeakPolarHBondContact CB-SG 3.46Å; C201-C208 PolarHBondContact N-O 2.83Å; C201-C208 PolarHBondContact O-N 2.54Å; N206-C208 PolarHBondContact O-N 2.96Å
209	L	93.1	Very high	92.1	Very high	3 Å²	3	34 Å²	34	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.7	169.2	-52.8	-179.4	0	0	0	110	V161 K162 V179 E182 A183 F186 L197 V200	V161-L209 CarbonylContact C-O 3.43Å; V161-L209 WeakPolarHBondContact CA-O 3.47Å; K162-L209 HydrophobicContact CB-CB 4.44Å; K162-L209 HydrophobicContact CD-CD1 4.46Å; K162-L209 PolarHBondContact N-O 2.95Å; K162-L209 PolarHBondContact O-N 3.17Å; V179-L209 HydrophobicContact CG1-CD2 3.99Å; E182-L209 HydrophobicContact CG-CD1 3.89Å; E182-L209 VanDerWaalsContact OE1-CD1 3.28Å; E182-L209 WeakPolarHBondContact OE1-CD1 3.33Å; A183-L209 HydrophobicContact CB-CD2 3.92Å; F186-L209 HydrophobicContact CD1-CD1 4.19Å; F186-L209 HydrophobicContact CE1-CD1 4.45Å; L197-L209 HydrophobicContact CD1-CB 4.04Å; V200-L209 HydrophobicContact CB-CD2 4.29Å; V200-L209 HydrophobicContact CG1-CD2 3.43Å; V200-L209 VanDerWaalsContact CG1-CD2 3.43Å
210	V	94.9	Very high	92.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.9	-179.1	-173	0	0	0	0	108.7	I130 L135 V159 V161 L197 E198 G199	I130-V210 HydrophobicContact CD1-CB 3.96Å; I130-V210 HydrophobicContact CD1-CG1 4.1Å; I130-V210 HydrophobicContact CD1-CG2 3.99Å; L135-V210 HydrophobicContact CD1-CG2 3.84Å; L135-V210 HydrophobicContact CD2-CG1 4.25Å; L135-V210 HydrophobicContact CD2-CG2 4.06Å; V159-V210 HydrophobicContact CB-CG1 3.76Å; V159-V210 HydrophobicContact CG1-CG1 3.86Å; V159-V210 HydrophobicContact CG2-CG1 3.97Å; V161-V210 HydrophobicContact CG2-CG1 4.45Å; V161-V210 HydrophobicContact CG2-CG2 4.45Å; L197-V210 WeakPolarHBondContact CD1-O 3.37Å; E198-V210 HydrophobicContact CB-CG1 4.47Å; E198-V210 PolarHBondContact N-O 2.89Å; G199-V210 PolarHBondContact N-O 3.46Å; G199-V210 WeakPolarHBondContact O-CA 3.49Å; G199-V210 WeakPolarHBondContact O-CB 3.45Å; G199-V210 PolarHBondContact O-N 3.48Å
211	M	95.4	Very high	92	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.039	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	163.2	-171.9	-57.6	166.6	-69.3	0	0	111.2	V159 A160 K162 F186 I195 K196 L197	V159-M211 CarbonylContact C-O 3.55Å; V159-M211 WeakPolarHBondContact CA-O 3.5Å; V159-M211 WeakPolarHBondContact CB-O 3.49Å; A160-M211 HydrophobicContact CB-CB 4.45Å; A160-M211 HydrophobicContact CB-CE 4.24Å; A160-M211 PolarHBondContact N-O 3.36Å; A160-M211 PolarHBondContact O-N 3.48Å; K162-M211 HydrophobicContact CB-CE 3.67Å; F186-M211 HydrophobicContact CE1-CG 4.1Å; F186-M211 HydrophobicContact CE1-SD 3.79Å; F186-M211 HydrophobicContact CZ-CG 4.19Å; F186-M211 HydrophobicContact CZ-SD 3.94Å; I195-M211 HydrophobicContact CG2-SD 4.43Å; K196-M211 CarbonylContact O-C 3.59Å; K196-M211 WeakPolarHBondContact O-CA 3.38Å; K196-M211 WeakPolarHBondContact O-CB 3.47Å; L197-M211 HydrophobicContact CD1-CG 4.16Å
212	E	95.5	Very high	91.9	Very high	35 Å²	35	44.5 Å²	44.5	16%	0.164	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	142	171.5	76.1	-174.9	125.6	0	0	111.5	I195 K196 A214 L268 K282	I195-E212 HydrophobicContact CD1-CG 3.43Å; I195-E212 VanDerWaalsContact CD1-CG 3.43Å; I195-E212 HydrophobicContact CG1-CG 3.89Å; K196-E212 HydrophobicContact CB-CB 4.46Å; K196-E212 HydrophobicContact CB-CG 4.28Å; K196-E212 VanDerWaalsContact CB-OE1 3.3Å; K196-E212 WeakPolarHBondContact CB-OE1 3.23Å; K196-E212 PolarHBondContact N-OE1 3.3Å; K196-E212 PolarHBondContact O-N 2.81Å; E212-A214 PolarHBondContact O-N 2.83Å; E212-L268 WeakPolarHBondContact OE2-CD1 3.35Å; E212-K282 WeakPolarHBondContact OE1-CD 3.18Å; E212-K282 VanDerWaalsContact OE1-CE 3.25Å; E212-K282 WeakPolarHBondContact OE1-CE 3.35Å; E212-K282 IonicContact OE1-NZ 3.62Å; E212-K282 PolarHBondContact OE1-NZ 3.38Å; E212-K282 WeakPolarHBondContact OE2-CE 3.24Å; E212-K282 IonicContact OE2-NZ 2.65Å
213	Y	96.6	Very high	92.1	Very high	49 Å²	49	43 Å²	43	19%	0.192	21%	0.212	C	C	.	.			trans	-87.3	108.5	-179.8	-178	-115.5	0	0	0	112.7	I141 R151 E158 A160 R215	I141-Y213 HydrophobicContact CD1-CD2 4.2Å; I141-Y213 HydrophobicContact CD1-CE2 3.76Å; R151-Y213 HydrophobicContact CB-CE2 4.23Å; R151-Y213 HydrophobicContact CG-CD2 4.4Å; R151-Y213 HydrophobicContact CG-CE1 4.48Å; R151-Y213 HydrophobicContact CG-CE2 4.13Å; E158-Y213 HydrophobicContact CB-CD1 3.99Å; E158-Y213 HydrophobicContact CB-CG 4.26Å; E158-Y213 WeakPolarHBondContact O-CB 3.24Å; A160-Y213 HydrophobicContact CB-CD2 4.39Å; Y213-R215 HydrophobicContact CD1-CG 3.86Å; Y213-R215 HydrophobicContact CE1-CG 3.95Å; Y213-R215 PolarHBondContact O-N 3.26Å
214	A	96.4	Very high	92.1	Very high	8 Å²	8	43 Å²	43	7%	0.066	22%	0.219	C	C	.	.			trans	-80	103.7	177.1	0	0	0	0	0	112.1	I195 E212 G216 G217 L266 L267	I195-A214 HydrophobicContact CD1-CB 4.1Å; E212-A214 PolarHBondContact O-N 2.83Å; A214-G216 VanDerWaalsContact C-N 3.33Å; A214-G216 PolarHBondContact O-N 3.35Å; A214-G217 PolarHBondContact O-N 3.2Å; A214-L266 HydrophobicContact CB-CB 3.64Å; A214-L266 HydrophobicContact CB-CD1 3.84Å; A214-L266 HydrophobicContact CB-CG 4.34Å; A214-L267 CarbonylContact C-O 3.56Å; A214-L267 WeakPolarHBondContact CB-O 3.41Å
215	R	94.6	Very high	91.7	Very high	149 Å²	149	41.7 Å²	41.7	56%	0.562	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.4	-168.7	-61.7	-179.7	175.2	127.8	-1.1	115	E158 Y213 L268 K270	E158-R215 IonicContact OE2-CZ 3.11Å; E158-R215 IonicContact OE2-NE 3.78Å; E158-R215 PolarHBondContact OE2-NE 3.05Å; E158-R215 IonicContact OE2-NH2 3.73Å; E158-R215 PolarHBondContact OE2-NH2 3.41Å; Y213-R215 HydrophobicContact CD1-CG 3.86Å; Y213-R215 HydrophobicContact CE1-CG 3.95Å; Y213-R215 PolarHBondContact O-N 3.26Å; R215-L268 PolarHBondContact N-O 2.93Å; R215-K270 HydrophobicContact CB-CB 4.16Å
216	G	92.6	Very high	91.7	Very high	22 Å²	22	42.4 Å²	42.4	23%	0.227	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.1	175.2	0	0	0	0	0	114.3	A214 L267 E269	A214-G216 VanDerWaalsContact C-N 3.33Å; A214-G216 PolarHBondContact O-N 3.35Å; G216-L267 VanDerWaalsContact CA-O 3.26Å; G216-L267 WeakPolarHBondContact CA-O 3.25Å; G216-L267 PolarHBondContact N-O 3.03Å; G216-E269 WeakPolarHBondContact CA-O 3.32Å
217	G	93.4	Very high	91.6	Very high	23 Å²	23	45.9 Å²	45.9	24%	0.237	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.3	-158.9	-177.4	0	0	0	0	0	113.1	A214 L266 L267	A214-G217 PolarHBondContact O-N 3.2Å; G217-L266 CarbonylContact O-C 3.55Å; G217-L266 VanDerWaalsContact O-CA 3.3Å; G217-L266 WeakPolarHBondContact O-CA 3.48Å; G217-L267 PolarHBondContact O-N 2.68Å
218	T	94.4	Very high	91.5	Very high	25 Å²	25	45.7 Å²	45.7	15%	0.153	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	143.4	-171.5	55.7	0	0	0	0	113.5	N220 R221 A222 S263 I265 L266	T218-N220 VanDerWaalsContact C-N 3.3Å; T218-N220 VanDerWaalsContact CB-OD1 3.27Å; T218-N220 WeakPolarHBondContact CB-OD1 3.49Å; T218-N220 PolarHBondContact O-N 2.81Å; T218-N220 PolarHBondContact OG1-OD1 2.73Å; T218-R221 WeakPolarHBondContact O-CB 3.36Å; T218-R221 PolarHBondContact O-N 3.08Å; T218-R221 WeakPolarHBondContact OG1-CD 3.46Å; T218-R221 WeakPolarHBondContact OG1-CG 3.32Å; T218-A222 PolarHBondContact O-N 3.21Å; T218-A222 VanDerWaalsContact O-N 3.17Å; T218-S263 VanDerWaalsContact CG2-O 3.28Å; T218-S263 WeakPolarHBondContact CG2-O 3.43Å; T218-I265 CarbonylContact C-O 3.58Å; T218-I265 WeakPolarHBondContact CA-O 3.47Å; T218-L266 HydrophobicContact CG2-CD2 3.66Å
219	L	95	Very high	91.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.3	-38.8	-179.3	174.3	62.4	0	0	0	112.8	R221 A222 L223 W236 I240 S262 I265 L267 L281 L329 L333	L219-R221 VanDerWaalsContact C-N 3.26Å; L219-R221 PolarHBondContact O-N 3.1Å; L219-A222 WeakPolarHBondContact O-CA 3.34Å; L219-A222 WeakPolarHBondContact O-CB 3.46Å; L219-A222 PolarHBondContact O-N 3.02Å; L219-L223 HydrophobicContact CD1-CD1 4.07Å; L219-L223 HydrophobicContact CD1-CG 4.02Å; L219-L223 HydrophobicContact CG-CD1 3.88Å; L219-L223 HydrophobicContact CG-CG 4.32Å; L219-L223 WeakPolarHBondContact O-CG 3.27Å; L219-L223 PolarHBondContact O-N 2.84Å; L219-W236 HydrophobicContact CD1-CE3 3.51Å; L219-W236 HydrophobicContact CD1-CH2 4.49Å; L219-W236 HydrophobicContact CD1-CZ3 3.49Å; L219-W236 VanDerWaalsContact CD1-CZ3 3.49Å; L219-I240 HydrophobicContact CD2-CD1 3.99Å; L219-S262 WeakPolarHBondContact CB-O 3.08Å; L219-S262 PolarHBondContact N-O 3.48Å; L219-I265 HydrophobicContact CB-CB 3.84Å; L219-I265 HydrophobicContact CB-CG2 4.11Å; L219-I265 HydrophobicContact CD2-CB 3.93Å; L219-I265 HydrophobicContact CD2-CG1 4.14Å; L219-I265 HydrophobicContact CD2-CG2 3.98Å; L219-I265 PolarHBondContact N-O 3.38Å; L219-L267 HydrophobicContact CB-CD1 4.2Å; L219-L267 HydrophobicContact CD1-CD1 4.27Å; L219-L281 HydrophobicContact CD1-CD2 4.37Å; L219-L281 HydrophobicContact CD2-CD2 4.44Å; L219-L329 HydrophobicContact CD2-CD2 4.16Å; L219-L333 HydrophobicContact CD1-CD2 4.14Å; L219-L333 HydrophobicContact CD2-CD2 4.09Å
220	N	93.2	Very high	91	Very high	50 Å²	50	46.8 Å²	46.8	27%	0.267	24%	0.244	S	C	.	.	H	α-helix	trans	-59.9	-33.4	175.2	64.7	-3.2	0	0	0	113.8	T218 T224 S262	T218-N220 VanDerWaalsContact C-N 3.3Å; T218-N220 VanDerWaalsContact CB-OD1 3.27Å; T218-N220 WeakPolarHBondContact CB-OD1 3.49Å; T218-N220 PolarHBondContact O-N 2.81Å; T218-N220 PolarHBondContact OG1-OD1 2.73Å; N220-T224 WeakPolarHBondContact O-CB 3.5Å; N220-T224 PolarHBondContact O-N 2.71Å; N220-T224 PolarHBondContact O-OG1 2.94Å; N220-S262 WeakPolarHBondContact CB-OG 3.29Å; N220-S262 PolarHBondContact N-O 3.49Å
221	R	91.4	Very high	90.6	Very high	169 Å²	169	49.8 Å²	49.8	64%	0.638	26%	0.258	S	S	*	.	H	α-helix	trans	-78.1	-22.3	173.7	-67.5	177.7	-176	175.2	5.2	112.5	T218 L219 R226	T218-R221 WeakPolarHBondContact O-CB 3.36Å; T218-R221 PolarHBondContact O-N 3.08Å; T218-R221 WeakPolarHBondContact OG1-CD 3.46Å; T218-R221 WeakPolarHBondContact OG1-CG 3.32Å; L219-R221 VanDerWaalsContact C-N 3.26Å; L219-R221 PolarHBondContact O-N 3.1Å; R221-R226 PolarHBondContact O-NH1 2.86Å
222	A	91.1	Very high	90.4	Very high	4 Å²	4	50.4 Å²	50.4	3%	0.033	26%	0.261	C	S	.	.	H	α-helix	trans	-75.2	-46	171.7	0	0	0	0	0	111.4	T218 L219 R226 W236 L267 I271	T218-A222 PolarHBondContact O-N 3.21Å; T218-A222 VanDerWaalsContact O-N 3.17Å; L219-A222 WeakPolarHBondContact O-CA 3.34Å; L219-A222 WeakPolarHBondContact O-CB 3.46Å; L219-A222 PolarHBondContact O-N 3.02Å; A222-R226 WeakPolarHBondContact O-CD 3.18Å; A222-R226 PolarHBondContact O-NH1 3.36Å; A222-W236 HydrophobicContact CB-CH2 4.28Å; A222-W236 HydrophobicContact CB-CZ3 4.46Å; A222-L267 HydrophobicContact CB-CD1 4.02Å; A222-L267 HydrophobicContact CB-CD2 3.99Å; A222-I271 HydrophobicContact CB-CD1 4.18Å
223	L	90.9	Very high	90.2	Very high	13 Å²	13	49 Å²	49	7%	0.068	25%	0.254	C	S	.	.	H	α-helix	trans	-65.1	-44.4	177.3	-71.4	165.7	0	0	0	112.7	L219 G225 R226 I228 L233 E332 L333	L219-L223 HydrophobicContact CD1-CD1 4.07Å; L219-L223 HydrophobicContact CD1-CG 4.02Å; L219-L223 HydrophobicContact CG-CD1 3.88Å; L219-L223 HydrophobicContact CG-CG 4.32Å; L219-L223 WeakPolarHBondContact O-CG 3.27Å; L219-L223 PolarHBondContact O-N 2.84Å; L223-G225 PolarHBondContact O-N 2.99Å; L223-R226 PolarHBondContact O-N 3.2Å; L223-I228 HydrophobicContact CD2-CD1 3.98Å; L223-L233 HydrophobicContact CD2-CD2 4.1Å; L223-E332 HydrophobicContact CD1-CB 4.41Å; L223-L333 HydrophobicContact CD1-CD2 4.42Å; L223-L333 HydrophobicContact CD2-CD2 4.25Å
224	T	86	Confident	90	Very high	94 Å²	94	46.6 Å²	46.6	58%	0.577	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	112.7	-176.4	-61.6	0	0	0	0	111.5	N220	N220-T224 WeakPolarHBondContact O-CB 3.5Å; N220-T224 PolarHBondContact O-N 2.71Å; N220-T224 PolarHBondContact O-OG1 2.94Å
225	G	74.9	Confident	89.8	Confident	84 Å²	84	49 Å²	49	87%	0.866	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	14.1	172.1	0	0	0	0	0	116.2	L223	L223-G225 PolarHBondContact O-N 2.99Å
226	R	84.8	Confident	89.9	Confident	84 Å²	84	42 Å²	42	32%	0.317	23%	0.23	S	C	.	.			trans	-115.7	145.3	174.2	-66.6	-173.4	-170.9	73.5	1.5	112	R221 A222 L223 I228	R221-R226 PolarHBondContact O-NH1 2.86Å; A222-R226 WeakPolarHBondContact O-CD 3.18Å; A222-R226 PolarHBondContact O-NH1 3.36Å; L223-R226 PolarHBondContact O-N 3.2Å; R226-I228 HydrophobicContact CB-CG1 4.15Å
227	R	85.3	Confident	90.1	Very high	134 Å²	134	41 Å²	41	51%	0.506	22%	0.22	S	C	.	.			trans	-89.3	109.2	166.8	-70.4	-173	-174.6	-122.5	-14.9	107.8	D415	R227-D415 IonicContact CZ-OD1 3.63Å; R227-D415 IonicContact CZ-OD2 3.15Å; R227-D415 IonicContact NH1-OD1 3.67Å; R227-D415 IonicContact NH1-OD2 2.7Å; R227-D415 PolarHBondContact NH1-OD2 2.86Å; R227-D415 IonicContact NH2-OD1 2.74Å; R227-D415 PolarHBondContact NH2-OD1 2.93Å; R227-D415 IonicContact NH2-OD2 2.7Å; R227-D415 PolarHBondContact NH2-OD2 2.99Å
228	I	89.2	Confident	90.2	Very high	3 Å²	3	40 Å²	40	2%	0.015	21%	0.209	C	C	.	.			trans	-105.4	121.4	-176.8	-52.5	-166.7	0	0	0	108.3	L223 R226 I232 L233 W236 I276	L223-I228 HydrophobicContact CD2-CD1 3.98Å; R226-I228 HydrophobicContact CB-CG1 4.15Å; I228-I232 HydrophobicContact CG2-CB 4Å; I228-I232 HydrophobicContact CG2-CG2 4.11Å; I228-L233 HydrophobicContact CB-CD1 4.47Å; I228-L233 HydrophobicContact CB-CD2 3.9Å; I228-L233 HydrophobicContact CB-CG 4.1Å; I228-L233 HydrophobicContact CD1-CD2 4.41Å; I228-L233 HydrophobicContact CG2-CD2 3.71Å; I228-L233 HydrophobicContact CG2-CG 3.84Å; I228-W236 HydrophobicContact CD1-CE3 4.41Å; I228-W236 HydrophobicContact CD1-CH2 3.68Å; I228-W236 HydrophobicContact CD1-CZ3 3.44Å; I228-W236 VanDerWaalsContact CD1-CZ3 3.44Å; I228-I276 HydrophobicContact CG1-CD1 4.39Å; I228-I276 HydrophobicContact CG2-CG2 4.1Å
229	P	88.3	Confident	90.3	Very high	22 Å²	22	39.8 Å²	39.8	14%	0.143	21%	0.206	C	C	.	.			trans	-55.4	142.7	178.9	-28.4	35.1	0	0	0	112.8	H231 I232 L233	P229-H231 VanDerWaalsContact C-N 3.29Å; P229-H231 VanDerWaalsContact CB-CE1 3.46Å; P229-H231 WeakPolarHBondContact CB-CE1 3.33Å; P229-H231 PolarHBondContact O-N 3.05Å; P229-I232 HydrophobicContact CB-CD1 4.45Å; P229-I232 HydrophobicContact CB-CG1 4.33Å; P229-I232 HydrophobicContact CG-CD1 4.25Å; P229-I232 PolarHBondContact O-N 2.92Å; P229-L233 PolarHBondContact O-N 3.29Å
230	P	87.3	Confident	90.5	Very high	7 Å²	7	39.9 Å²	39.9	5%	0.045	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-34.7	-170.6	22.1	-32.9	0	0	0	113.4	I232 L233 V234 V401 F410	P230-I232 VanDerWaalsContact C-N 3.27Å; P230-I232 PolarHBondContact O-N 2.98Å; P230-L233 PolarHBondContact O-N 2.83Å; P230-V234 WeakPolarHBondContact O-CG2 3.45Å; P230-V234 PolarHBondContact O-N 3.35Å; P230-V401 HydrophobicContact CB-CG1 3.99Å; P230-V401 HydrophobicContact CG-CG1 4.39Å; P230-F410 HydrophobicContact CB-CB 4.36Å; P230-F410 HydrophobicContact CB-CD1 3.86Å; P230-F410 HydrophobicContact CB-CD2 3.83Å; P230-F410 HydrophobicContact CB-CE1 4.08Å; P230-F410 HydrophobicContact CB-CE2 4.06Å; P230-F410 HydrophobicContact CB-CG 3.73Å; P230-F410 HydrophobicContact CB-CZ 4.18Å; P230-F410 HydrophobicContact CG-CB 3.91Å; P230-F410 HydrophobicContact CG-CD1 3.99Å; P230-F410 HydrophobicContact CG-CD2 4.32Å; P230-F410 HydrophobicContact CG-CG 3.8Å
231	H	86.3	Confident	90.7	Very high	63 Å²	63	37.5 Å²	37.5	29%	0.292	19%	0.194	S	C	.	.	H	α-helix	trans	-63.7	-30.4	175.6	69.4	-91	0	0	0	113	P229 N235 M402	P229-H231 VanDerWaalsContact C-N 3.29Å; P229-H231 VanDerWaalsContact CB-CE1 3.46Å; P229-H231 WeakPolarHBondContact CB-CE1 3.33Å; P229-H231 PolarHBondContact O-N 3.05Å; H231-N235 WeakPolarHBondContact O-CB 3.47Å; H231-N235 PolarHBondContact O-N 3.3Å; H231-M402 HydrophobicContact CB-SD 3.53Å; H231-M402 VanDerWaalsContact CB-SD 3.53Å
232	I	91.1	Very high	91	Very high	20 Å²	20	35.1 Å²	35.1	10%	0.103	19%	0.185	C	C	.	.	H	α-helix	trans	-75.8	-37.9	174.9	-54.3	-175	0	0	0	110.2	I228 P229 P230 N235 W236 I276	I228-I232 HydrophobicContact CG2-CB 4Å; I228-I232 HydrophobicContact CG2-CG2 4.11Å; P229-I232 HydrophobicContact CB-CD1 4.45Å; P229-I232 HydrophobicContact CB-CG1 4.33Å; P229-I232 HydrophobicContact CG-CD1 4.25Å; P229-I232 PolarHBondContact O-N 2.92Å; P230-I232 VanDerWaalsContact C-N 3.27Å; P230-I232 PolarHBondContact O-N 2.98Å; I232-N235 PolarHBondContact O-N 3.35Å; I232-W236 HydrophobicContact CG2-CD2 4.11Å; I232-W236 HydrophobicContact CG2-CG 4.25Å; I232-W236 HydrophobicContact CG2-CZ2 4.05Å; I232-W236 VanDerWaalsContact CG2-NE1 3.34Å; I232-W236 WeakPolarHBondContact O-CB 3.32Å; I232-W236 VanDerWaalsContact O-CD1 3.29Å; I232-W236 VanDerWaalsContact O-CG 3.23Å; I232-W236 PolarHBondContact O-N 3.34Å; I232-I276 HydrophobicContact CD1-CB 4.42Å; I232-I276 HydrophobicContact CD1-CG2 4.28Å; I232-I276 HydrophobicContact CG2-CG2 4.22Å
233	L	92.2	Very high	91.3	Very high	5 Å²	5	35 Å²	35	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-42.1	174.7	-65.7	173.4	0	0	0	112.2	L223 I228 P229 P230 W236 A237 L333 F410	L223-L233 HydrophobicContact CD2-CD2 4.1Å; I228-L233 HydrophobicContact CB-CD1 4.47Å; I228-L233 HydrophobicContact CB-CD2 3.9Å; I228-L233 HydrophobicContact CB-CG 4.1Å; I228-L233 HydrophobicContact CD1-CD2 4.41Å; I228-L233 HydrophobicContact CG2-CD2 3.71Å; I228-L233 HydrophobicContact CG2-CG 3.84Å; P229-L233 PolarHBondContact O-N 3.29Å; P230-L233 PolarHBondContact O-N 2.83Å; L233-W236 HydrophobicContact CD2-CE3 4.43Å; L233-W236 PolarHBondContact O-N 3.12Å; L233-A237 WeakPolarHBondContact O-CB 3.47Å; L233-A237 PolarHBondContact O-N 3.24Å; L233-L333 WeakPolarHBondContact CD1-O 3.41Å; L233-L333 HydrophobicContact CD2-CB 4.37Å; L233-L333 HydrophobicContact CD2-CD2 4.08Å; L233-L333 WeakPolarHBondContact CD2-O 3.44Å; L233-F410 HydrophobicContact CD1-CE1 3.67Å; L233-F410 HydrophobicContact CD1-CZ 3.65Å
234	V	92.3	Very high	91.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-49.5	171.2	175.3	0	0	0	0	110.6	P230 W236 A237 V238 F369 I397 E398	P230-V234 WeakPolarHBondContact O-CG2 3.45Å; P230-V234 PolarHBondContact O-N 3.35Å; V234-W236 VanDerWaalsContact C-N 3.27Å; V234-W236 PolarHBondContact O-N 3.01Å; V234-A237 WeakPolarHBondContact O-CB 3.19Å; V234-A237 PolarHBondContact O-N 2.85Å; V234-A237 VanDerWaalsContact O-N 3.16Å; V234-V238 HydrophobicContact CG1-CG2 4.36Å; V234-V238 WeakPolarHBondContact O-CG2 3.27Å; V234-V238 PolarHBondContact O-N 3.09Å; V234-F369 HydrophobicContact CG2-CE1 4.43Å; V234-F369 HydrophobicContact CG2-CZ 3.72Å; V234-I397 HydrophobicContact CG2-CG2 4.27Å; V234-E398 HydrophobicContact CG1-CB 3.64Å; V234-E398 HydrophobicContact CG1-CG 3.82Å
235	N	92.5	Very high	92.2	Very high	59 Å²	59	31 Å²	31	32%	0.316	16%	0.159	S	C	.	.	H	α-helix	trans	-59.7	-38.4	179.3	-171.4	-95.2	0	0	0	112.5	H231 I232 V238 Q239	H231-N235 WeakPolarHBondContact O-CB 3.47Å; H231-N235 PolarHBondContact O-N 3.3Å; I232-N235 PolarHBondContact O-N 3.35Å; N235-V238 PolarHBondContact O-N 3.36Å; N235-Q239 WeakPolarHBondContact O-CB 3.46Å; N235-Q239 WeakPolarHBondContact O-CG 3.45Å; N235-Q239 PolarHBondContact O-N 2.76Å; N235-Q239 PolarHBondContact OD1-NE2 2.95Å
236	W	95.9	Very high	93.2	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-67.5	-42.4	175.4	-74.4	8.9	0	0	0	112.1	L219 A222 I228 I232 L233 V234 V238 Q239 I240 L267 I276 L281 L333	L219-W236 HydrophobicContact CD1-CE3 3.51Å; L219-W236 HydrophobicContact CD1-CH2 4.49Å; L219-W236 HydrophobicContact CD1-CZ3 3.49Å; L219-W236 VanDerWaalsContact CD1-CZ3 3.49Å; A222-W236 HydrophobicContact CB-CH2 4.28Å; A222-W236 HydrophobicContact CB-CZ3 4.46Å; I228-W236 HydrophobicContact CD1-CE3 4.41Å; I228-W236 HydrophobicContact CD1-CH2 3.68Å; I228-W236 HydrophobicContact CD1-CZ3 3.44Å; I228-W236 VanDerWaalsContact CD1-CZ3 3.44Å; I232-W236 HydrophobicContact CG2-CD2 4.11Å; I232-W236 HydrophobicContact CG2-CG 4.25Å; I232-W236 HydrophobicContact CG2-CZ2 4.05Å; I232-W236 VanDerWaalsContact CG2-NE1 3.34Å; I232-W236 WeakPolarHBondContact O-CB 3.32Å; I232-W236 VanDerWaalsContact O-CD1 3.29Å; I232-W236 VanDerWaalsContact O-CG 3.23Å; I232-W236 PolarHBondContact O-N 3.34Å; L233-W236 HydrophobicContact CD2-CE3 4.43Å; L233-W236 PolarHBondContact O-N 3.12Å; V234-W236 VanDerWaalsContact C-N 3.27Å; V234-W236 PolarHBondContact O-N 3.01Å; W236-V238 PolarHBondContact O-N 3.41Å; W236-Q239 PolarHBondContact O-N 3.27Å; W236-I240 WeakPolarHBondContact O-CG1 3.4Å; W236-I240 PolarHBondContact O-N 3.41Å; W236-L267 HydrophobicContact CH2-CD2 4.01Å; W236-L267 HydrophobicContact CZ2-CD2 4Å; W236-I276 HydrophobicContact CH2-CG2 3.86Å; W236-I276 HydrophobicContact CZ2-CG2 3.64Å; W236-L281 HydrophobicContact CB-CD2 3.55Å; W236-L281 VanDerWaalsContact CD1-CD1 3.5Å; W236-L281 HydrophobicContact CD2-CD1 3.9Å; W236-L281 HydrophobicContact CD2-CD2 3.96Å; W236-L281 HydrophobicContact CE3-CD2 4.38Å; W236-L281 HydrophobicContact CG-CD1 3.75Å; W236-L281 HydrophobicContact CG-CD2 3.6Å; W236-L281 HydrophobicContact CG-CG 4.36Å; W236-L281 HydrophobicContact CZ2-CD1 4.46Å; W236-L333 HydrophobicContact CB-CD2 4.16Å; W236-L333 HydrophobicContact CE3-CD2 3.96Å
237	A	96.6	Very high	93.6	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-59	-45.9	173	0	0	0	0	0	111.5	L233 V234 I240 A241 Y326 L330 L333 L394	L233-A237 WeakPolarHBondContact O-CB 3.47Å; L233-A237 PolarHBondContact O-N 3.24Å; V234-A237 WeakPolarHBondContact O-CB 3.19Å; V234-A237 PolarHBondContact O-N 2.85Å; V234-A237 VanDerWaalsContact O-N 3.16Å; A237-I240 PolarHBondContact O-N 3.44Å; A237-A241 WeakPolarHBondContact O-CB 3.42Å; A237-A241 PolarHBondContact O-N 2.86Å; A237-Y326 WeakPolarHBondContact CB-OH 3.37Å; A237-Y326 PolarHBondContact O-OH 3.36Å; A237-L330 HydrophobicContact CB-CD1 4.08Å; A237-L333 HydrophobicContact CB-CD1 3.88Å; A237-L394 HydrophobicContact CB-CD1 4.34Å; A237-L394 HydrophobicContact CB-CD2 4.07Å
238	V	96.1	Very high	93.9	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.012	8%	0.084	C	C	.	.	H	α-helix	trans	-62.1	-42.7	175.8	168.4	0	0	0	0	111.8	V234 N235 W236 A241 R242 L391 L394	V234-V238 HydrophobicContact CG1-CG2 4.36Å; V234-V238 WeakPolarHBondContact O-CG2 3.27Å; V234-V238 PolarHBondContact O-N 3.09Å; N235-V238 PolarHBondContact O-N 3.36Å; W236-V238 PolarHBondContact O-N 3.41Å; V238-A241 PolarHBondContact O-N 3.17Å; V238-R242 WeakPolarHBondContact O-CG 3.39Å; V238-R242 PolarHBondContact O-N 3.26Å; V238-L391 HydrophobicContact CB-CD2 4.42Å; V238-L391 HydrophobicContact CG1-CD2 3.95Å; V238-L394 HydrophobicContact CG2-CB 3.69Å; V238-L394 HydrophobicContact CG2-CD1 4.15Å; V238-L394 HydrophobicContact CG2-CG 4.47Å
239	Q	97.1	Very high	94	Very high	20 Å²	20	22.2 Å²	22.2	9%	0.093	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-43.2	176.8	-80.6	-170.2	66.1	0	0	112.5	N193 N235 W236 G243 K279 L281	N193-Q239 VanDerWaalsContact CB-O 3.24Å; N193-Q239 WeakPolarHBondContact CB-O 3.46Å; N193-Q239 VanDerWaalsContact CG-O 3.28Å; N193-Q239 WeakPolarHBondContact ND2-CB 3.41Å; N193-Q239 PolarHBondContact ND2-OE1 2.63Å; N235-Q239 WeakPolarHBondContact O-CB 3.46Å; N235-Q239 WeakPolarHBondContact O-CG 3.45Å; N235-Q239 PolarHBondContact O-N 2.76Å; N235-Q239 PolarHBondContact OD1-NE2 2.95Å; W236-Q239 PolarHBondContact O-N 3.27Å; Q239-G243 PolarHBondContact O-N 3.38Å; Q239-K279 PolarHBondContact NE2-O 2.81Å; Q239-L281 HydrophobicContact CB-CB 4.25Å
240	I	98.1	Very high	93.9	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-66.1	-45.7	176	-62.3	163.8	0	0	0	110.4	L219 W236 A237 R242 G243 M244 I265 L281 I283 Y326 L329 L333	L219-I240 HydrophobicContact CD2-CD1 3.99Å; W236-I240 WeakPolarHBondContact O-CG1 3.4Å; W236-I240 PolarHBondContact O-N 3.41Å; A237-I240 PolarHBondContact O-N 3.44Å; I240-R242 VanDerWaalsContact C-N 3.32Å; I240-R242 PolarHBondContact O-N 3.01Å; I240-G243 PolarHBondContact O-N 3.38Å; I240-G243 VanDerWaalsContact O-N 3.13Å; I240-M244 PolarHBondContact O-N 2.94Å; I240-I265 HydrophobicContact CD1-CD1 4.37Å; I240-I265 HydrophobicContact CD1-CG1 4.14Å; I240-I265 HydrophobicContact CD1-CG2 4.19Å; I240-I265 HydrophobicContact CG1-CD1 4.15Å; I240-I265 HydrophobicContact CG1-CG1 4.39Å; I240-I265 HydrophobicContact CG1-CG2 4.11Å; I240-I265 HydrophobicContact CG2-CD1 4.06Å; I240-L281 HydrophobicContact CD1-CD2 4.07Å; I240-L281 HydrophobicContact CG1-CD2 4.1Å; I240-I283 HydrophobicContact CG2-CD1 4.42Å; I240-Y326 HydrophobicContact CB-CE2 4.06Å; I240-Y326 HydrophobicContact CG2-CD2 3.87Å; I240-Y326 HydrophobicContact CG2-CE2 3.78Å; I240-L329 HydrophobicContact CG2-CD1 4.2Å; I240-L333 HydrophobicContact CD1-CD1 4.25Å
241	A	98.1	Very high	93.8	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.3	-34.8	-180	0	0	0	0	0	112.7	A237 V238 M244 L245 Y326 F387 I390 L391 L394	A237-A241 WeakPolarHBondContact O-CB 3.42Å; A237-A241 PolarHBondContact O-N 2.86Å; V238-A241 PolarHBondContact O-N 3.17Å; A241-M244 PolarHBondContact O-N 3.34Å; A241-L245 WeakPolarHBondContact O-CB 3.47Å; A241-L245 PolarHBondContact O-N 2.94Å; A241-Y326 HydrophobicContact CB-CE2 4.05Å; A241-F387 HydrophobicContact CB-CD1 4.14Å; A241-I390 HydrophobicContact CB-CG2 4.17Å; A241-L391 HydrophobicContact CB-CD2 3.66Å; A241-L391 HydrophobicContact CB-CG 3.88Å; A241-L394 HydrophobicContact CB-CD1 4.12Å
242	R	97.9	Very high	93.5	Very high	120 Å²	120	29.3 Å²	29.3	45%	0.453	14%	0.144	S	C	.	.	H	α-helix	trans	-63.9	-44.6	170.5	-73.6	175.6	-173.5	169.2	5.6	112.3	V238 I240 M244 L245 Y246 L391	V238-R242 WeakPolarHBondContact O-CG 3.39Å; V238-R242 PolarHBondContact O-N 3.26Å; I240-R242 VanDerWaalsContact C-N 3.32Å; I240-R242 PolarHBondContact O-N 3.01Å; R242-M244 VanDerWaalsContact C-N 3.3Å; R242-M244 PolarHBondContact O-N 3.37Å; R242-L245 PolarHBondContact O-N 3.13Å; R242-Y246 PolarHBondContact O-N 3.38Å; R242-L391 HydrophobicContact CG-CD1 3.9Å; R242-L391 HydrophobicContact CG-CD2 3.79Å
243	G	97.2	Very high	93	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.5	-41.2	174.1	0	0	0	0	0	112.6	Q239 I240 L247	Q239-G243 PolarHBondContact O-N 3.38Å; I240-G243 PolarHBondContact O-N 3.38Å; I240-G243 VanDerWaalsContact O-N 3.13Å; G243-L247 WeakPolarHBondContact O-CG 3.38Å; G243-L247 PolarHBondContact O-N 3.04Å
244	M	97.8	Very high	92.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-72.4	-39.3	177.4	-71.3	-55.1	-48.8	0	0	113.7	I240 A241 R242 Y246 L247 H248 H257 L260 I283 D322 F387	I240-M244 PolarHBondContact O-N 2.94Å; A241-M244 PolarHBondContact O-N 3.34Å; R242-M244 VanDerWaalsContact C-N 3.3Å; R242-M244 PolarHBondContact O-N 3.37Å; M244-Y246 VanDerWaalsContact C-N 3.3Å; M244-Y246 PolarHBondContact O-N 3.39Å; M244-L247 HydrophobicContact CE-CD1 4.3Å; M244-L247 PolarHBondContact O-N 3.5Å; M244-L247 HydrophobicContact SD-CD1 3.89Å; M244-H248 WeakPolarHBondContact CE-NE2 3.39Å; M244-H248 WeakPolarHBondContact O-CB 3.32Å; M244-H248 PolarHBondContact O-N 2.72Å; M244-H257 HydrophobicContact CE-CB 4.04Å; M244-H257 HydrophobicContact SD-CB 4.26Å; M244-L260 HydrophobicContact CE-CD2 4.33Å; M244-L260 HydrophobicContact CG-CD1 4.44Å; M244-L260 HydrophobicContact CG-CD2 3.89Å; M244-L260 HydrophobicContact SD-CD1 3.89Å; M244-L260 HydrophobicContact SD-CD2 3.78Å; M244-L260 HydrophobicContact SD-CG 4.39Å; M244-I283 HydrophobicContact CG-CD1 3.77Å; M244-I283 HydrophobicContact SD-CD1 3.67Å; M244-D322 HydrophobicContact CE-CB 3.79Å; M244-D322 WeakPolarHBondContact CE-OD2 3.14Å; M244-F387 HydrophobicContact CB-CD1 3.57Å; M244-F387 HydrophobicContact CB-CD2 3.71Å; M244-F387 HydrophobicContact CB-CE1 3.48Å; M244-F387 VanDerWaalsContact CB-CE1 3.48Å; M244-F387 HydrophobicContact CB-CE2 3.64Å; M244-F387 HydrophobicContact CB-CG 3.68Å; M244-F387 HydrophobicContact CB-CZ 3.52Å; M244-F387 HydrophobicContact CE-CE2 3.99Å; M244-F387 HydrophobicContact CE-CZ 4.23Å; M244-F387 HydrophobicContact CG-CD1 4.42Å; M244-F387 HydrophobicContact CG-CE1 3.86Å; M244-F387 HydrophobicContact CG-CE2 4.21Å; M244-F387 HydrophobicContact CG-CZ 3.74Å
245	L	96.8	Very high	92.5	Very high	24 Å²	24	31.3 Å²	31.3	13%	0.126	16%	0.157	C	C	.	.	H	α-helix	trans	-56.3	-47	171.9	177.6	61.6	0	0	0	110.7	A241 R242 L247 H248 E249 F387 L391	A241-L245 WeakPolarHBondContact O-CB 3.47Å; A241-L245 PolarHBondContact O-N 2.94Å; R242-L245 PolarHBondContact O-N 3.13Å; L245-L247 PolarHBondContact O-N 2.9Å; L245-H248 PolarHBondContact O-N 2.99Å; L245-H248 VanDerWaalsContact O-N 3.12Å; L245-E249 HydrophobicContact CD1-CB 3.98Å; L245-E249 HydrophobicContact CD1-CG 4.15Å; L245-E249 VanDerWaalsContact CD1-OE2 3.32Å; L245-E249 WeakPolarHBondContact CD1-OE2 3.4Å; L245-E249 PolarHBondContact O-N 2.93Å; L245-F387 HydrophobicContact CB-CB 3.92Å; L245-F387 HydrophobicContact CD1-CB 4.37Å; L245-L391 HydrophobicContact CB-CD1 4.18Å; L245-L391 HydrophobicContact CD2-CD1 3.73Å
246	Y	95.8	Very high	92.4	Very high	23 Å²	23	28.6 Å²	28.6	9%	0.09	14%	0.143	C	C	.	.	I	π-helix	trans	-55.1	-49.9	176.9	171.8	-96.9	0	0	0	111.9	L189 Q190 H191 I194 R242 M244 H248 E250 A251	L189-Y246 HydrophobicContact CB-CE1 4.34Å; L189-Y246 HydrophobicContact CD2-CE1 4.03Å; Q190-Y246 PolarHBondContact N-OH 2.92Å; H191-Y246 HydrophobicContact CB-CD1 3.55Å; H191-Y246 HydrophobicContact CB-CD2 3.81Å; H191-Y246 HydrophobicContact CB-CE1 3.82Å; H191-Y246 HydrophobicContact CB-CE2 4.08Å; H191-Y246 HydrophobicContact CB-CG 3.55Å; H191-Y246 AromaticContact CD2-CD2 3.97Å; H191-Y246 AromaticContact CD2-CG 3.91Å; H191-Y246 AromaticContact CG-CG 3.73Å; I194-Y246 HydrophobicContact CG1-CD1 4.02Å; I194-Y246 HydrophobicContact CG1-CE1 4.47Å; R242-Y246 PolarHBondContact O-N 3.38Å; M244-Y246 VanDerWaalsContact C-N 3.3Å; M244-Y246 PolarHBondContact O-N 3.39Å; Y246-H248 VanDerWaalsContact C-N 3.28Å; Y246-H248 PolarHBondContact O-N 3.43Å; Y246-E250 HydrophobicContact CD2-CB 3.77Å; Y246-E250 WeakPolarHBondContact CD2-OE2 3.46Å; Y246-E250 HydrophobicContact CE2-CB 4.35Å; Y246-E250 PolarHBondContact O-N 3.06Å; Y246-E250 VanDerWaalsContact O-N 3.09Å; Y246-A251 HydrophobicContact CE1-CB 4.25Å; Y246-A251 WeakPolarHBondContact O-CB 3.43Å; Y246-A251 PolarHBondContact O-N 2.92Å
247	L	93.3	Very high	92.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.142	C	C	.	.	I	π-helix	trans	-62	-34.5	178.1	-65.9	170.2	0	0	0	113	L189 I194 G243 M244 L245 I255 F286	L189-L247 HydrophobicContact CD1-CD2 3.78Å; L189-L247 HydrophobicContact CD2-CD2 3.98Å; L189-L247 HydrophobicContact CG-CD2 4.49Å; I194-L247 HydrophobicContact CD1-CD1 3.9Å; I194-L247 HydrophobicContact CD1-CD2 4.17Å; I194-L247 HydrophobicContact CD1-CG 3.94Å; G243-L247 WeakPolarHBondContact O-CG 3.38Å; G243-L247 PolarHBondContact O-N 3.04Å; M244-L247 HydrophobicContact CE-CD1 4.3Å; M244-L247 PolarHBondContact O-N 3.5Å; M244-L247 HydrophobicContact SD-CD1 3.89Å; L245-L247 PolarHBondContact O-N 2.9Å; L247-I255 PolarHBondContact O-N 3.31Å; L247-F286 HydrophobicContact CD1-CE1 3.87Å; L247-F286 HydrophobicContact CD1-CZ 4.43Å; L247-F286 HydrophobicContact CD2-CE1 3.81Å; L247-F286 HydrophobicContact CD2-CZ 4.39Å
248	H	92.8	Very high	92	Very high	4 Å²	4	29 Å²	29	2%	0.019	14%	0.144	C	C	.	.	I	π-helix	trans	-86.8	-31.5	-173.4	-82.1	-152.8	0	0	0	114.1	M244 L245 Y246 I255 K319 D322 F387	M244-H248 WeakPolarHBondContact CE-NE2 3.39Å; M244-H248 WeakPolarHBondContact O-CB 3.32Å; M244-H248 PolarHBondContact O-N 2.72Å; L245-H248 PolarHBondContact O-N 2.99Å; L245-H248 VanDerWaalsContact O-N 3.12Å; Y246-H248 VanDerWaalsContact C-N 3.28Å; Y246-H248 PolarHBondContact O-N 3.43Å; H248-I255 PolarHBondContact CD2-O 2.91Å; H248-I255 VanDerWaalsContact CD2-O 3.3Å; H248-K319 HydrophobicContact CB-CD 4.21Å; H248-K319 VanDerWaalsContact CE1-CA 3.49Å; H248-K319 WeakPolarHBondContact CE1-CA 3.35Å; H248-K319 WeakPolarHBondContact ND1-CG 3.48Å; H248-K319 WeakPolarHBondContact O-CE 3.39Å; H248-K319 PolarHBondContact O-NZ 3.34Å; H248-D322 IonicContact CD2-OD2 3.21Å; H248-D322 IonicContact CE1-OD2 3.38Å; H248-D322 IonicContact NE2-OD2 3.41Å; H248-D322 PolarHBondContact NE2-OD2 2.97Å; H248-F387 AromaticContact CE1-CD2 3.77Å; H248-F387 AromaticContact CE1-CE2 3.54Å; H248-F387 AromaticContact ND1-CD2 3.55Å; H248-F387 AromaticContact ND1-CE2 3.83Å
249	E	90.1	Very high	91.7	Very high	93 Å²	93	29.2 Å²	29.2	44%	0.435	15%	0.145	S	C	.	.	I	π-helix	trans	-134.5	-26.2	-166.7	-69.7	173.3	-154.8	0	0	114.7	L245 K319 S388	L245-E249 HydrophobicContact CD1-CB 3.98Å; L245-E249 HydrophobicContact CD1-CG 4.15Å; L245-E249 VanDerWaalsContact CD1-OE2 3.32Å; L245-E249 WeakPolarHBondContact CD1-OE2 3.4Å; L245-E249 PolarHBondContact O-N 2.93Å; E249-K319 IonicContact OE1-NZ 3.82Å; E249-S388 PolarHBondContact OE2-OG 3.5Å
250	E	86.9	Confident	91.6	Very high	121 Å²	121	28.2 Å²	28.2	57%	0.565	14%	0.14	S	C	*	.	I	π-helix	trans	-106.8	-22.7	-173.6	-49.9	-177.9	161.4	0	0	114.1	Y246	Y246-E250 HydrophobicContact CD2-CB 3.77Å; Y246-E250 WeakPolarHBondContact CD2-OE2 3.46Å; Y246-E250 HydrophobicContact CE2-CB 4.35Å; Y246-E250 PolarHBondContact O-N 3.06Å; Y246-E250 VanDerWaalsContact O-N 3.09Å
251	A	84.1	Confident	91.5	Very high	10 Å²	10	29 Å²	29	8%	0.083	14%	0.144	C	C	.	.	S	Bend	trans	-68	151.2	179.2	0	0	0	0	0	112.6	L189 Y246 V253	L189-A251 HydrophobicContact CD2-CB 4.16Å; Y246-A251 HydrophobicContact CE1-CB 4.25Å; Y246-A251 WeakPolarHBondContact O-CB 3.43Å; Y246-A251 PolarHBondContact O-N 2.92Å; A251-V253 PolarHBondContact O-N 3.16Å
252	V	80.5	Confident	91.3	Very high	111 Å²	111	29.1 Å²	29.1	67%	0.673	14%	0.144	S	C	*	.	S	Bend	trans	-52.3	-30.9	-176.7	-176.9	0	0	0	0	113.2	M188	M188-V252 HydrophobicContact SD-CG1 4.39Å
253	V	81.2	Confident	91.1	Very high	23 Å²	23	25.2 Å²	25.2	14%	0.139	14%	0.135	C	C	.	.	S	Bend	trans	-135.1	132.3	165.7	-176.6	0	0	0	0	107.4	A251 I255 E291	A251-V253 PolarHBondContact O-N 3.16Å; V253-I255 WeakPolarHBondContact O-CG1 3.27Å; V253-I255 PolarHBondContact O-N 3.5Å; V253-E291 HydrophobicContact CG1-CB 3.91Å; V253-E291 HydrophobicContact CG1-CG 3.82Å
254	P	86	Confident	91	Very high	38 Å²	38	25.8 Å²	25.8	25%	0.247	14%	0.138	C	C	.	.			trans	-57.8	129.3	174.3	-27.4	36.2	0	0	0	111.8	E291 W292	P254-E291 WeakPolarHBondContact O-CA 3.49Å; P254-W292 HydrophobicContact CB-CB 4.07Å; P254-W292 PolarHBondContact O-N 2.79Å
255	I	88.6	Confident	91	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.031	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.5	-174.4	-76.7	155.8	0	0	0	109.9	L189 L247 H248 V253 A289 R290	L189-I255 HydrophobicContact CD2-CD1 3.89Å; L247-I255 PolarHBondContact O-N 3.31Å; H248-I255 PolarHBondContact CD2-O 2.91Å; H248-I255 VanDerWaalsContact CD2-O 3.3Å; V253-I255 WeakPolarHBondContact O-CG1 3.27Å; V253-I255 PolarHBondContact O-N 3.5Å; I255-A289 HydrophobicContact CG2-CB 3.96Å; I255-R290 WeakPolarHBondContact CA-O 3.48Å
256	I	90.5	Very high	90.9	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.5	169.8	-45.6	-174.2	0	0	0	108.2	R258 A289 R290 W292 T295 F317 D322	I256-R258 HydrophobicContact CB-CG 4.2Å; I256-R258 HydrophobicContact CG2-CG 3.85Å; I256-A289 WeakPolarHBondContact O-CA 3.31Å; I256-A289 WeakPolarHBondContact O-CB 3.47Å; I256-R290 PolarHBondContact N-O 3.27Å; I256-R290 PolarHBondContact O-N 3Å; I256-W292 HydrophobicContact CD1-CE3 3.56Å; I256-W292 HydrophobicContact CD1-CZ3 4.01Å; I256-W292 HydrophobicContact CG1-CE3 3.98Å; I256-T295 HydrophobicContact CD1-CG2 3.48Å; I256-T295 VanDerWaalsContact CD1-CG2 3.48Å; I256-T295 HydrophobicContact CG1-CG2 4.31Å; I256-F317 HydrophobicContact CD1-CB 4.46Å; I256-D322 WeakPolarHBondContact CA-OD2 3.45Å; I256-D322 WeakPolarHBondContact CG2-OD1 3.43Å; I256-D322 VanDerWaalsContact CG2-OD2 3.26Å; I256-D322 WeakPolarHBondContact CG2-OD2 3.38Å
257	H	92.3	Very high	91	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.			trans	-76.6	-38.3	-178.8	-165.8	-85.6	0	0	0	112.7	M244 D259 L260 I283 T284 F286 D322	M244-H257 HydrophobicContact CE-CB 4.04Å; M244-H257 HydrophobicContact SD-CB 4.26Å; H257-D259 PolarHBondContact CE1-O 2.95Å; H257-D259 VanDerWaalsContact ND1-C 3.32Å; H257-D259 PolarHBondContact ND1-O 2.83Å; H257-D259 PolarHBondContact O-N 3.43Å; H257-L260 HydrophobicContact CB-CB 4.47Å; H257-L260 PolarHBondContact ND1-N 3.18Å; H257-I283 VanDerWaalsContact NE2-CG2 3.33Å; H257-I283 WeakPolarHBondContact NE2-CG2 3.39Å; H257-T284 PolarHBondContact CE1-O 3.39Å; H257-T284 PolarHBondContact NE2-O 3.43Å; H257-F286 AromaticContact CD2-CE1 3.7Å; H257-D322 PolarHBondContact N-OD1 3.47Å; H257-D322 PolarHBondContact N-OD2 2.9Å
258	R	90.7	Very high	91.1	Very high	12 Å²	12	27.1 Å²	27.1	5%	0.045	15%	0.147	C	C	.	.	S	Bend	trans	66.6	-23.2	177.1	-54.5	-164.6	-176.2	-179.8	-0.8	117.4	I256 L288 T295 M298 F317 D322	I256-R258 HydrophobicContact CB-CG 4.2Å; I256-R258 HydrophobicContact CG2-CG 3.85Å; R258-L288 HydrophobicContact CB-CB 4.12Å; R258-L288 VanDerWaalsContact CD-O 3.27Å; R258-L288 WeakPolarHBondContact CD-O 3.36Å; R258-T295 VanDerWaalsContact NH2-CG2 3.28Å; R258-M298 PolarHBondContact NH1-SD 2.74Å; R258-F317 HydrophobicContact CB-CD1 3.61Å; R258-F317 HydrophobicContact CB-CE1 3.69Å; R258-F317 HydrophobicContact CB-CG 4.42Å; R258-F317 VanDerWaalsContact CD-CG 3.49Å; R258-F317 HydrophobicContact CG-CB 4.07Å; R258-F317 HydrophobicContact CG-CD1 3.49Å; R258-F317 VanDerWaalsContact CG-CD1 3.49Å; R258-F317 HydrophobicContact CG-CE1 4.03Å; R258-F317 HydrophobicContact CG-CG 3.84Å; R258-D322 PolarHBondContact N-OD1 3.22Å
259	D	90.4	Very high	91.2	Very high	5 Å²	5	29.7 Å²	29.7	3%	0.027	16%	0.159	C	C	.	.			trans	-135.9	52.3	178.8	-171.5	40.4	0	0	0	111.2	H257 K261 N264 L288 G302 T303	H257-D259 PolarHBondContact CE1-O 2.95Å; H257-D259 VanDerWaalsContact ND1-C 3.32Å; H257-D259 PolarHBondContact ND1-O 2.83Å; H257-D259 PolarHBondContact O-N 3.43Å; D259-K261 IonicContact OD1-NZ 3.12Å; D259-K261 PolarHBondContact OD1-NZ 3.06Å; D259-K261 WeakPolarHBondContact OD2-CE 3.42Å; D259-K261 IonicContact OD2-NZ 2.76Å; D259-K261 PolarHBondContact OD2-NZ 2.92Å; D259-N264 PolarHBondContact O-ND2 3.5Å; D259-N264 PolarHBondContact OD2-ND2 2.87Å; D259-N264 VanDerWaalsContact OD2-ND2 3.07Å; D259-L288 HydrophobicContact CB-CD1 4.04Å; D259-G302 WeakPolarHBondContact OD1-CA 3.27Å; D259-T303 PolarHBondContact OD1-N 3.03Å
260	L	95.4	Very high	91.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.			trans	-79.8	118.3	179.7	179.7	66.7	0	0	0	110.1	M244 H257 I265 I283 S325 L329	M244-L260 HydrophobicContact CE-CD2 4.33Å; M244-L260 HydrophobicContact CG-CD1 4.44Å; M244-L260 HydrophobicContact CG-CD2 3.89Å; M244-L260 HydrophobicContact SD-CD1 3.89Å; M244-L260 HydrophobicContact SD-CD2 3.78Å; M244-L260 HydrophobicContact SD-CG 4.39Å; H257-L260 HydrophobicContact CB-CB 4.47Å; H257-L260 PolarHBondContact ND1-N 3.18Å; L260-I265 HydrophobicContact CD1-CD1 3.95Å; L260-I283 HydrophobicContact CD1-CG2 4.24Å; L260-S325 WeakPolarHBondContact O-CB 3.34Å; L260-L329 HydrophobicContact CD1-CD1 3.87Å; L260-L329 HydrophobicContact CD2-CD1 4.22Å; L260-L329 HydrophobicContact CG-CD1 3.68Å
261	K	94.4	Very high	91.3	Very high	19 Å²	19	26.3 Å²	26.3	8%	0.083	14%	0.142	C	C	.	.	S	Bend	trans	-163.6	163.6	-174.5	60.9	-171.2	-177.6	-144.9	0	112.3	D259 S263 N264 I265 T303 W306	D259-K261 IonicContact OD1-NZ 3.12Å; D259-K261 PolarHBondContact OD1-NZ 3.06Å; D259-K261 WeakPolarHBondContact OD2-CE 3.42Å; D259-K261 IonicContact OD2-NZ 2.76Å; D259-K261 PolarHBondContact OD2-NZ 2.92Å; K261-S263 WeakPolarHBondContact CD-OG 3.36Å; K261-S263 WeakPolarHBondContact CE-OG 3.31Å; K261-S263 WeakPolarHBondContact CG-OG 3.48Å; K261-S263 PolarHBondContact O-N 3.03Å; K261-N264 WeakPolarHBondContact CE-ND2 3.14Å; K261-N264 WeakPolarHBondContact CE-OD1 3.39Å; K261-N264 HydrophobicContact CG-CB 4.04Å; K261-N264 CarbonylContact O-C 3.59Å; K261-N264 WeakPolarHBondContact O-CA 3.45Å; K261-N264 PolarHBondContact O-N 3.02Å; K261-I265 PolarHBondContact O-N 3.23Å; K261-T303 PolarHBondContact NZ-OG1 2.98Å; K261-W306 HydrophobicContact CB-CD2 3.72Å; K261-W306 HydrophobicContact CB-CE3 4.43Å; K261-W306 HydrophobicContact CB-CG 3.73Å; K261-W306 HydrophobicContact CB-CZ2 4.32Å
262	S	94.8	Very high	91.4	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.007	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-12.6	-178.5	60.8	0	0	0	0	116.4	L219 N220 L329 E332	L219-S262 WeakPolarHBondContact CB-O 3.08Å; L219-S262 PolarHBondContact N-O 3.48Å; N220-S262 WeakPolarHBondContact CB-OG 3.29Å; N220-S262 PolarHBondContact N-O 3.49Å; S262-L329 VanDerWaalsContact N-CD2 3.35Å; S262-E332 VanDerWaalsContact CB-CD 3.47Å; S262-E332 WeakPolarHBondContact CB-OE1 3.39Å; S262-E332 VanDerWaalsContact CB-OE2 3.23Å; S262-E332 WeakPolarHBondContact CB-OE2 3.39Å; S262-E332 PolarHBondContact OG-OE1 2.92Å; S262-E332 PolarHBondContact OG-OE2 3.49Å
263	S	92.9	Very high	91.3	Very high	38 Å²	38	33.3 Å²	33.3	27%	0.266	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-20.9	169.6	21.7	0	0	0	0	113.2	T218 K261	T218-S263 VanDerWaalsContact CG2-O 3.28Å; T218-S263 WeakPolarHBondContact CG2-O 3.43Å; K261-S263 WeakPolarHBondContact CD-OG 3.36Å; K261-S263 WeakPolarHBondContact CE-OG 3.31Å; K261-S263 WeakPolarHBondContact CG-OG 3.48Å; K261-S263 PolarHBondContact O-N 3.03Å
264	N	95.3	Very high	91.2	Very high	12 Å²	12	37.9 Å²	37.9	6%	0.064	19%	0.194	C	C	.	.	S	Bend	trans	-102.9	13.8	179.6	-66.5	6	0	0	0	111.9	D259 K261 T284	D259-N264 PolarHBondContact O-ND2 3.5Å; D259-N264 PolarHBondContact OD2-ND2 2.87Å; D259-N264 VanDerWaalsContact OD2-ND2 3.07Å; K261-N264 WeakPolarHBondContact CE-ND2 3.14Å; K261-N264 WeakPolarHBondContact CE-OD1 3.39Å; K261-N264 HydrophobicContact CG-CB 4.04Å; K261-N264 CarbonylContact O-C 3.59Å; K261-N264 WeakPolarHBondContact O-CA 3.45Å; K261-N264 PolarHBondContact O-N 3.02Å; N264-T284 HydrophobicContact CB-CG2 4.46Å; N264-T284 WeakPolarHBondContact O-CG2 3.26Å; N264-T284 PolarHBondContact O-N 2.88Å
265	I	97.5	Very high	91.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.4	165	-48.8	-60.5	0	0	0	108	T218 L219 I240 L260 K261 L281 I283 L329	T218-I265 CarbonylContact C-O 3.58Å; T218-I265 WeakPolarHBondContact CA-O 3.47Å; L219-I265 HydrophobicContact CB-CB 3.84Å; L219-I265 HydrophobicContact CB-CG2 4.11Å; L219-I265 HydrophobicContact CD2-CB 3.93Å; L219-I265 HydrophobicContact CD2-CG1 4.14Å; L219-I265 HydrophobicContact CD2-CG2 3.98Å; L219-I265 PolarHBondContact N-O 3.38Å; I240-I265 HydrophobicContact CD1-CD1 4.37Å; I240-I265 HydrophobicContact CD1-CG1 4.14Å; I240-I265 HydrophobicContact CD1-CG2 4.19Å; I240-I265 HydrophobicContact CG1-CD1 4.15Å; I240-I265 HydrophobicContact CG1-CG1 4.39Å; I240-I265 HydrophobicContact CG1-CG2 4.11Å; I240-I265 HydrophobicContact CG2-CD1 4.06Å; L260-I265 HydrophobicContact CD1-CD1 3.95Å; K261-I265 PolarHBondContact O-N 3.23Å; I265-L281 HydrophobicContact CG2-CB 4.09Å; I265-L281 HydrophobicContact CG2-CD2 4.01Å; I265-L281 HydrophobicContact CG2-CG 4.09Å; I265-I283 HydrophobicContact CD1-CB 4.36Å; I265-I283 HydrophobicContact CD1-CG1 3.86Å; I265-I283 HydrophobicContact CD1-CG2 4.33Å; I265-L329 HydrophobicContact CD1-CD1 4.24Å; I265-L329 HydrophobicContact CG1-CD1 4.16Å; I265-L329 HydrophobicContact CG1-CD2 4.18Å
266	L	96.6	Very high	90.9	Very high	28 Å²	28	40.8 Å²	40.8	15%	0.147	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	149.3	179.7	-55	-179.6	0	0	0	111.4	I195 A214 G217 T218 L281 K282 T284	I195-L266 HydrophobicContact CD1-CD1 4.06Å; I195-L266 HydrophobicContact CG1-CD1 4.45Å; A214-L266 HydrophobicContact CB-CB 3.64Å; A214-L266 HydrophobicContact CB-CD1 3.84Å; A214-L266 HydrophobicContact CB-CG 4.34Å; G217-L266 CarbonylContact O-C 3.55Å; G217-L266 VanDerWaalsContact O-CA 3.3Å; G217-L266 WeakPolarHBondContact O-CA 3.48Å; T218-L266 HydrophobicContact CG2-CD2 3.66Å; L266-L281 CarbonylContact O-C 3.47Å; L266-L281 WeakPolarHBondContact O-CA 3.5Å; L266-K282 PolarHBondContact N-O 3.4Å; L266-K282 PolarHBondContact O-N 3.46Å; L266-T284 HydrophobicContact CD1-CG2 3.75Å; L266-T284 HydrophobicContact CD2-CG2 4.14Å; L266-T284 HydrophobicContact CG-CG2 3.65Å
267	L	96.3	Very high	90.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121.3	168	-76.6	72.4	0	0	0	108.6	A214 G216 G217 L219 A222 W236 I271 K279 L281	A214-L267 CarbonylContact C-O 3.56Å; A214-L267 WeakPolarHBondContact CB-O 3.41Å; G216-L267 VanDerWaalsContact CA-O 3.26Å; G216-L267 WeakPolarHBondContact CA-O 3.25Å; G216-L267 PolarHBondContact N-O 3.03Å; G217-L267 PolarHBondContact O-N 2.68Å; L219-L267 HydrophobicContact CB-CD1 4.2Å; L219-L267 HydrophobicContact CD1-CD1 4.27Å; A222-L267 HydrophobicContact CB-CD1 4.02Å; A222-L267 HydrophobicContact CB-CD2 3.99Å; W236-L267 HydrophobicContact CH2-CD2 4.01Å; W236-L267 HydrophobicContact CZ2-CD2 4Å; L267-I271 HydrophobicContact CD2-CD1 3.81Å; L267-I271 HydrophobicContact CD2-CG1 4.13Å; L267-K279 HydrophobicContact CD2-CB 4.4Å; L267-L281 HydrophobicContact CG-CD1 4.16Å
268	L	95.4	Very high	89.9	Confident	47 Å²	47	53.4 Å²	53.4	25%	0.246	26%	0.261	C	S	.	.	S	Bend	trans	-64.1	-48.8	-177.6	-179.9	63.2	0	0	0	111.6	E212 R215 T280 K282	E212-L268 WeakPolarHBondContact OE2-CD1 3.35Å; R215-L268 PolarHBondContact N-O 2.93Å; L268-T280 PolarHBondContact N-O 3.31Å; L268-K282 HydrophobicContact CB-CD 4.25Å; L268-K282 HydrophobicContact CD1-CD 4.19Å
269	E	94.8	Very high	90.1	Very high	58 Å²	58	53.4 Å²	53.4	27%	0.271	26%	0.262	S	S	.	.	S	Bend	trans	-92.5	146.1	179.5	-41.5	78.3	-178.1	0	0	110.7	G216 K279 T280	G216-E269 WeakPolarHBondContact CA-O 3.32Å; E269-K279 HydrophobicContact CB-CD 3.9Å; E269-K279 WeakPolarHBondContact OE2-CA 3.18Å; E269-T280 WeakPolarHBondContact OE1-CB 3.49Å; E269-T280 PolarHBondContact OE1-N 3.42Å; E269-T280 PolarHBondContact OE1-OG1 3.5Å; E269-T280 PolarHBondContact OE2-N 3.01Å
270	K	91.5	Very high	90.4	Very high	117 Å²	117	55 Å²	55	51%	0.509	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-71.1	138.6	176.2	-174.8	-179.6	164.6	-156.7	0	110.4	R215 E272 K279	R215-K270 HydrophobicContact CB-CB 4.16Å; K270-E272 HydrophobicContact CB-CG 4.3Å; K270-E272 HydrophobicContact CD-CG 3.89Å; K270-E272 WeakPolarHBondContact CD-OE1 3.45Å; K270-E272 VanDerWaalsContact CE-OE1 3.25Å; K270-E272 WeakPolarHBondContact CE-OE1 3.06Å; K270-E272 HydrophobicContact CG-CG 3.88Å; K270-E272 IonicContact NZ-OE1 3.33Å; K270-E272 PolarHBondContact NZ-OE1 3.48Å; K270-E272 PolarHBondContact O-N 3.1Å; K270-K279 WeakPolarHBondContact O-CE 3.49Å
271	I	88.6	Confident	90.5	Very high	27 Å²	27	55.1 Å²	55.1	14%	0.138	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-76.2	117.7	166.1	-59.6	171.3	0	0	0	107.4	A222 L267 I276	A222-I271 HydrophobicContact CB-CD1 4.18Å; L267-I271 HydrophobicContact CD2-CD1 3.81Å; L267-I271 HydrophobicContact CD2-CG1 4.13Å; I271-I276 HydrophobicContact CD1-CG1 4.42Å; I271-I276 HydrophobicContact CG2-CG1 4.02Å
272	E	85.5	Confident	90.6	Very high	104 Å²	104	54.9 Å²	54.9	49%	0.486	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-126.7	140	177.3	-60.1	-158.1	140.4	0	0	110	K270 D274 D275	K270-E272 HydrophobicContact CB-CG 4.3Å; K270-E272 HydrophobicContact CD-CG 3.89Å; K270-E272 WeakPolarHBondContact CD-OE1 3.45Å; K270-E272 VanDerWaalsContact CE-OE1 3.25Å; K270-E272 WeakPolarHBondContact CE-OE1 3.06Å; K270-E272 HydrophobicContact CG-CG 3.88Å; K270-E272 IonicContact NZ-OE1 3.33Å; K270-E272 PolarHBondContact NZ-OE1 3.48Å; K270-E272 PolarHBondContact O-N 3.1Å; E272-D274 PolarHBondContact O-N 3.28Å; E272-D274 VanDerWaalsContact O-N 3.11Å; E272-D275 WeakPolarHBondContact O-CB 3.38Å; E272-D275 PolarHBondContact O-N 3.32Å
273	N	79.3	Confident	90.8	Very high	164 Å²	164	54.9 Å²	54.9	88%	0.877	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	30.8	-177.7	-48.3	-54	0	0	0	114	D275	N273-D275 PolarHBondContact O-N 3.17Å
274	D	78.6	Confident	90.8	Very high	119 Å²	119	53.9 Å²	53.9	64%	0.636	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	23.6	-171.8	-61.3	-49.3	0	0	0	115.4	E272 I276	E272-D274 PolarHBondContact O-N 3.28Å; E272-D274 VanDerWaalsContact O-N 3.11Å; D274-I276 PolarHBondContact O-N 2.72Å
275	D	84.9	Confident	90.3	Very high	90 Å²	90	54.8 Å²	54.8	48%	0.481	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-69	94.7	160.9	171.8	43.4	0	0	0	110	E272 N273 G277 K279	E272-D275 WeakPolarHBondContact O-CB 3.38Å; E272-D275 PolarHBondContact O-N 3.32Å; N273-D275 PolarHBondContact O-N 3.17Å; D275-G277 VanDerWaalsContact C-N 3.32Å; D275-G277 WeakPolarHBondContact OD1-CA 3.43Å; D275-G277 PolarHBondContact OD1-N 2.81Å; D275-K279 WeakPolarHBondContact O-CE 3.44Å; D275-K279 PolarHBondContact O-NZ 2.81Å; D275-K279 IonicContact OD1-NZ 3.84Å; D275-K279 IonicContact OD2-NZ 2.63Å; D275-K279 PolarHBondContact OD2-NZ 2.76Å
276	I	84.3	Confident	89.5	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.077	27%	0.27	C	S	.	.			trans	-88.7	-4.9	173.3	-57	166.4	0	0	0	110.4	I228 I232 W236 I271 D274 K279	I228-I276 HydrophobicContact CG1-CD1 4.39Å; I228-I276 HydrophobicContact CG2-CG2 4.1Å; I232-I276 HydrophobicContact CD1-CB 4.42Å; I232-I276 HydrophobicContact CD1-CG2 4.28Å; I232-I276 HydrophobicContact CG2-CG2 4.22Å; W236-I276 HydrophobicContact CH2-CG2 3.86Å; W236-I276 HydrophobicContact CZ2-CG2 3.64Å; I271-I276 HydrophobicContact CD1-CG1 4.42Å; I271-I276 HydrophobicContact CG2-CG1 4.02Å; D274-I276 PolarHBondContact O-N 2.72Å; I276-K279 WeakPolarHBondContact O-CG 3.3Å
277	G	78.4	Confident	88.3	Confident	20 Å²	20	54.2 Å²	54.2	21%	0.206	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	150	180	0	0	0	0	0	113.4	D275 K279	D275-G277 VanDerWaalsContact C-N 3.32Å; D275-G277 WeakPolarHBondContact OD1-CA 3.43Å; D275-G277 PolarHBondContact OD1-N 2.81Å; G277-K279 VanDerWaalsContact C-N 3.32Å; G277-K279 PolarHBondContact O-N 3.5Å; G277-K279 PolarHBondContact O-NZ 2.97Å
278	R	83	Confident	87.2	Confident	245 Å²	245	55.7 Å²	55.7	93%	0.925	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	44.5	171.6	-49.5	-174	77.9	100.6	1.4	114.7
279	K	93.9	Very high	86.3	Confident	12 Å²	12	53.7 Å²	53.7	5%	0.052	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-94.3	137.2	174.1	-56.8	-64.6	176.4	-81.7	0	111	Q239 L267 E269 K270 D275 I276 G277	Q239-K279 PolarHBondContact NE2-O 2.81Å; L267-K279 HydrophobicContact CD2-CB 4.4Å; E269-K279 HydrophobicContact CB-CD 3.9Å; E269-K279 WeakPolarHBondContact OE2-CA 3.18Å; K270-K279 WeakPolarHBondContact O-CE 3.49Å; D275-K279 WeakPolarHBondContact O-CE 3.44Å; D275-K279 PolarHBondContact O-NZ 2.81Å; D275-K279 IonicContact OD1-NZ 3.84Å; D275-K279 IonicContact OD2-NZ 2.63Å; D275-K279 PolarHBondContact OD2-NZ 2.76Å; I276-K279 WeakPolarHBondContact O-CG 3.3Å; G277-K279 VanDerWaalsContact C-N 3.32Å; G277-K279 PolarHBondContact O-N 3.5Å; G277-K279 PolarHBondContact O-NZ 2.97Å
280	T	96.6	Very high	85.6	Confident	39 Å²	39	53.8 Å²	53.8	24%	0.239	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-93.3	119.2	179	-49.9	0	0	0	0	109.7	L268 E269	L268-T280 PolarHBondContact N-O 3.31Å; E269-T280 WeakPolarHBondContact OE1-CB 3.49Å; E269-T280 PolarHBondContact OE1-N 3.42Å; E269-T280 PolarHBondContact OE1-OG1 3.5Å; E269-T280 PolarHBondContact OE2-N 3.01Å
281	L	97.6	Very high	84.8	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134.7	177.1	-85.4	64.2	0	0	0	110.3	N193 L219 W236 Q239 I240 I265 L266 L267	N193-L281 VanDerWaalsContact CA-O 3.24Å; N193-L281 WeakPolarHBondContact CA-O 3.35Å; N193-L281 WeakPolarHBondContact CB-O 3.42Å; N193-L281 PolarHBondContact ND2-O 3.14Å; L219-L281 HydrophobicContact CD1-CD2 4.37Å; L219-L281 HydrophobicContact CD2-CD2 4.44Å; W236-L281 HydrophobicContact CB-CD2 3.55Å; W236-L281 VanDerWaalsContact CD1-CD1 3.5Å; W236-L281 HydrophobicContact CD2-CD1 3.9Å; W236-L281 HydrophobicContact CD2-CD2 3.96Å; W236-L281 HydrophobicContact CE3-CD2 4.38Å; W236-L281 HydrophobicContact CG-CD1 3.75Å; W236-L281 HydrophobicContact CG-CD2 3.6Å; W236-L281 HydrophobicContact CG-CG 4.36Å; W236-L281 HydrophobicContact CZ2-CD1 4.46Å; Q239-L281 HydrophobicContact CB-CB 4.25Å; I240-L281 HydrophobicContact CD1-CD2 4.07Å; I240-L281 HydrophobicContact CG1-CD2 4.1Å; I265-L281 HydrophobicContact CG2-CB 4.09Å; I265-L281 HydrophobicContact CG2-CD2 4.01Å; I265-L281 HydrophobicContact CG2-CG 4.09Å; L266-L281 CarbonylContact O-C 3.47Å; L266-L281 WeakPolarHBondContact O-CA 3.5Å; L267-L281 HydrophobicContact CG-CD1 4.16Å
282	K	97.7	Very high	83.8	Confident	15 Å²	15	52.1 Å²	52.1	7%	0.065	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	125.9	-177.2	-78.1	173.1	169.4	-83.6	0	111.7	P192 N193 I194 I195 E212 L266 L268	P192-K282 VanDerWaalsContact O-CE 3.23Å; P192-K282 WeakPolarHBondContact O-CE 3.45Å; P192-K282 WeakPolarHBondContact O-CG 3.47Å; P192-K282 PolarHBondContact O-NZ 3.49Å; N193-K282 WeakPolarHBondContact O-CA 3.27Å; I194-K282 PolarHBondContact O-NZ 3.18Å; I195-K282 HydrophobicContact CB-CB 4.36Å; I195-K282 HydrophobicContact CD1-CB 4.12Å; I195-K282 HydrophobicContact CD1-CD 3.93Å; E212-K282 WeakPolarHBondContact OE1-CD 3.18Å; E212-K282 VanDerWaalsContact OE1-CE 3.25Å; E212-K282 WeakPolarHBondContact OE1-CE 3.35Å; E212-K282 IonicContact OE1-NZ 3.62Å; E212-K282 PolarHBondContact OE1-NZ 3.38Å; E212-K282 WeakPolarHBondContact OE2-CE 3.24Å; E212-K282 IonicContact OE2-NZ 2.65Å; L266-K282 PolarHBondContact N-O 3.4Å; L266-K282 PolarHBondContact O-N 3.46Å; L268-K282 HydrophobicContact CB-CD 4.25Å; L268-K282 HydrophobicContact CD1-CD 4.19Å
283	I	97.4	Very high	82.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.4	173.9	-49.2	-179.8	0	0	0	109.3	N193 I194 I195 I240 M244 H257 L260 I265 F286	N193-I283 PolarHBondContact O-N 3.04Å; I194-I283 HydrophobicContact CD1-CB 3.95Å; I194-I283 HydrophobicContact CD1-CD1 4.05Å; I194-I283 HydrophobicContact CD1-CG1 4.22Å; I195-I283 WeakPolarHBondContact CB-O 3.49Å; I195-I283 WeakPolarHBondContact CG2-O 3.34Å; I195-I283 PolarHBondContact N-O 2.82Å; I240-I283 HydrophobicContact CG2-CD1 4.42Å; M244-I283 HydrophobicContact CG-CD1 3.77Å; M244-I283 HydrophobicContact SD-CD1 3.67Å; H257-I283 VanDerWaalsContact NE2-CG2 3.33Å; H257-I283 WeakPolarHBondContact NE2-CG2 3.39Å; L260-I283 HydrophobicContact CD1-CG2 4.24Å; I265-I283 HydrophobicContact CD1-CB 4.36Å; I265-I283 HydrophobicContact CD1-CG1 3.86Å; I265-I283 HydrophobicContact CD1-CG2 4.33Å; I283-F286 HydrophobicContact CG2-CZ 4.44Å
284	T	93.4	Very high	81.4	Confident	16 Å²	16	48.8 Å²	48.8	10%	0.098	23%	0.23	C	C	.	.			trans	-138.5	174	-177.5	-166.5	0	0	0	0	112.6	H257 N264 L266	H257-T284 PolarHBondContact CE1-O 3.39Å; H257-T284 PolarHBondContact NE2-O 3.43Å; N264-T284 HydrophobicContact CB-CG2 4.46Å; N264-T284 WeakPolarHBondContact O-CG2 3.26Å; N264-T284 PolarHBondContact O-N 2.88Å; L266-T284 HydrophobicContact CD1-CG2 3.75Å; L266-T284 HydrophobicContact CD2-CG2 4.14Å; L266-T284 HydrophobicContact CG-CG2 3.65Å
285	D	84.8	Confident	80.5	Confident	31 Å²	31	45.2 Å²	45.2	17%	0.166	21%	0.212	C	C	.	.			trans	67.8	59.5	175.2	-153.5	7.4	0	0	0	116.3	F146 K162 G287	F146-D285 WeakPolarHBondContact CD2-OD2 3.3Å; K162-D285 IonicContact NZ-OD1 3.44Å; K162-D285 PolarHBondContact NZ-OD1 3.35Å; D285-G287 PolarHBondContact O-N 2.99Å
286	F	81.3	Confident	78.9	Confident	9 Å²	9	46 Å²	46	4%	0.039	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	16.1	175.1	-61.6	-82.9	0	0	0	115.1	F186 L189 I194 I195 L247 H257 I283 L288 A289	F186-F286 HydrophobicContact CD1-CD2 4.34Å; F186-F286 AromaticContact CD2-CD2 3.87Å; F186-F286 HydrophobicContact CD2-CD2 3.87Å; F186-F286 HydrophobicContact CD2-CE2 4.24Å; F186-F286 AromaticContact CE1-CD2 4Å; F186-F286 HydrophobicContact CE1-CD2 4Å; F186-F286 AromaticContact CE2-CD2 3.45Å; F186-F286 HydrophobicContact CE2-CD2 3.45Å; F186-F286 VanDerWaalsContact CE2-CD2 3.45Å; F186-F286 AromaticContact CE2-CE2 3.59Å; F186-F286 HydrophobicContact CE2-CE2 3.59Å; F186-F286 HydrophobicContact CE2-CG 4.48Å; F186-F286 HydrophobicContact CG-CD2 4.3Å; F186-F286 AromaticContact CZ-CD2 3.53Å; F186-F286 HydrophobicContact CZ-CD2 3.53Å; F186-F286 AromaticContact CZ-CE2 3.93Å; F186-F286 HydrophobicContact CZ-CE2 3.93Å; L189-F286 HydrophobicContact CD1-CD1 4.14Å; L189-F286 HydrophobicContact CD1-CE1 3.94Å; L189-F286 HydrophobicContact CD1-CZ 4.17Å; I194-F286 HydrophobicContact CD1-CZ 4.27Å; I194-F286 HydrophobicContact CG2-CE2 4Å; I194-F286 HydrophobicContact CG2-CZ 3.77Å; I195-F286 HydrophobicContact CG2-CE2 4.3Å; L247-F286 HydrophobicContact CD1-CE1 3.87Å; L247-F286 HydrophobicContact CD1-CZ 4.43Å; L247-F286 HydrophobicContact CD2-CE1 3.81Å; L247-F286 HydrophobicContact CD2-CZ 4.39Å; H257-F286 AromaticContact CD2-CE1 3.7Å; I283-F286 HydrophobicContact CG2-CZ 4.44Å; F286-L288 VanDerWaalsContact C-N 3.32Å; F286-L288 PolarHBondContact O-N 3.35Å; F286-A289 HydrophobicContact CB-CB 3.87Å; F286-A289 HydrophobicContact CD1-CB 3.78Å; F286-A289 HydrophobicContact CG-CB 4.33Å; F286-A289 WeakPolarHBondContact O-CB 3.49Å; F286-A289 PolarHBondContact O-N 3.09Å
287	G	70.6	Confident	77.4	Confident	8 Å²	8	52.5 Å²	52.5	8%	0.082	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-37.8	-176.9	0	0	0	0	0	114	E182 D285 R290	E182-G287 WeakPolarHBondContact OE1-CA 3.4Å; E182-G287 PolarHBondContact OE1-N 2.95Å; D285-G287 PolarHBondContact O-N 2.99Å; G287-R290 PolarHBondContact O-NH1 3.24Å; G287-R290 PolarHBondContact O-NH2 2.83Å
288	L	73.7	Confident	76.2	Confident	30 Å²	30	55.3 Å²	55.3	16%	0.157	26%	0.257	C	S	.	.	S	Bend	trans	-92	-9.7	172.5	-66.6	178.6	0	0	0	113.6	F146 R258 D259 F286 A301	F146-L288 HydrophobicContact CE1-CD1 4.08Å; F146-L288 HydrophobicContact CE1-CD2 3.89Å; F146-L288 HydrophobicContact CE1-CG 3.61Å; F146-L288 HydrophobicContact CZ-CD1 3.66Å; F146-L288 HydrophobicContact CZ-CD2 4.33Å; F146-L288 HydrophobicContact CZ-CG 3.62Å; R258-L288 HydrophobicContact CB-CB 4.12Å; R258-L288 VanDerWaalsContact CD-O 3.27Å; R258-L288 WeakPolarHBondContact CD-O 3.36Å; D259-L288 HydrophobicContact CB-CD1 4.04Å; F286-L288 VanDerWaalsContact C-N 3.32Å; F286-L288 PolarHBondContact O-N 3.35Å; L288-A301 HydrophobicContact CD1-CB 3.72Å; L288-A301 HydrophobicContact CD2-CB 3.92Å
289	A	77.4	Confident	74.8	Confident	5 Å²	5	48.8 Å²	48.8	4%	0.041	25%	0.248	C	C	.	.			trans	-68	139	-174.5	0	0	0	0	0	111.4	I255 I256 F286	I255-A289 HydrophobicContact CG2-CB 3.96Å; I256-A289 WeakPolarHBondContact O-CA 3.31Å; I256-A289 WeakPolarHBondContact O-CB 3.47Å; F286-A289 HydrophobicContact CB-CB 3.87Å; F286-A289 HydrophobicContact CD1-CB 3.78Å; F286-A289 HydrophobicContact CG-CB 4.33Å; F286-A289 WeakPolarHBondContact O-CB 3.49Å; F286-A289 PolarHBondContact O-N 3.09Å
290	R	78.9	Confident	72.9	Confident	61 Å²	61	50.5 Å²	50.5	23%	0.23	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	153.9	-177.4	-62.5	-65.2	179.2	-89.2	3.3	110.7	I255 I256 G287 W292	I255-R290 WeakPolarHBondContact CA-O 3.48Å; I256-R290 PolarHBondContact N-O 3.27Å; I256-R290 PolarHBondContact O-N 3Å; G287-R290 PolarHBondContact O-NH1 3.24Å; G287-R290 PolarHBondContact O-NH2 2.83Å; R290-W292 PolarHBondContact O-N 3.26Å
291	E	75.1	Confident	70.7	Confident	18 Å²	18	50.1 Å²	50.1	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	133	168.5	-57.2	169.3	-130.7	0	0	110.3	Q181 L185 V253 P254 H293 K294	Q181-E291 PolarHBondContact NE2-OE1 2.81Å; L185-E291 HydrophobicContact CD1-CG 4.26Å; L185-E291 HydrophobicContact CD2-CG 3.53Å; V253-E291 HydrophobicContact CG1-CB 3.91Å; V253-E291 HydrophobicContact CG1-CG 3.82Å; P254-E291 WeakPolarHBondContact O-CA 3.49Å; E291-H293 VanDerWaalsContact C-N 3.31Å; E291-H293 PolarHBondContact O-N 3.47Å; E291-K294 HydrophobicContact CB-CB 4.4Å; E291-K294 HydrophobicContact CB-CD 4.25Å; E291-K294 HydrophobicContact CB-CG 4.42Å; E291-K294 HydrophobicContact CG-CD 4.46Å; E291-K294 PolarHBondContact O-N 2.86Å; E291-K294 IonicContact OE1-NZ 2.63Å; E291-K294 PolarHBondContact OE1-NZ 3.49Å; E291-K294 WeakPolarHBondContact OE2-CD 3.4Å; E291-K294 VanDerWaalsContact OE2-CE 3.27Å; E291-K294 WeakPolarHBondContact OE2-CE 3.17Å; E291-K294 IonicContact OE2-NZ 2.65Å; E291-K294 PolarHBondContact OE2-NZ 2.91Å
292	W	66.5	Low	69.1	Low	91 Å²	91	51.3 Å²	51.3	35%	0.345	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-50.6	-46.8	-179	164.8	-95.4	0	0	0	112.5	P254 I256 R290 K294 T295 K319	P254-W292 HydrophobicContact CB-CB 4.07Å; P254-W292 PolarHBondContact O-N 2.79Å; I256-W292 HydrophobicContact CD1-CE3 3.56Å; I256-W292 HydrophobicContact CD1-CZ3 4.01Å; I256-W292 HydrophobicContact CG1-CE3 3.98Å; R290-W292 PolarHBondContact O-N 3.26Å; W292-K294 PolarHBondContact O-N 2.8Å; W292-K294 VanDerWaalsContact O-N 3.09Å; W292-T295 WeakPolarHBondContact O-CG2 3.37Å; W292-T295 PolarHBondContact O-N 3.3Å; W292-T295 PolarHBondContact O-OG1 2.89Å; W292-K319 HydrophobicContact CE3-CG 4.05Å; W292-K319 HydrophobicContact CZ3-CB 4.46Å; W292-K319 HydrophobicContact CZ3-CG 4.02Å
293	H	58.6	Low	68.3	Low	77 Å²	77	53.2 Å²	53.2	36%	0.356	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-72.5	-2.8	-177.6	-56.9	-79.4	0	0	0	114.6	Y51 N99 E291	Y51-H293 AromaticContact CE2-CD2 3.99Å; Y51-H293 AromaticContact CZ-CD2 3.8Å; Y51-H293 PolarHBondContact OH-CD2 3.48Å; Y51-H293 VanDerWaalsContact OH-CD2 3.24Å; N99-H293 PolarHBondContact ND2-CE1 2.82Å; E291-H293 VanDerWaalsContact C-N 3.31Å; E291-H293 PolarHBondContact O-N 3.47Å
294	K	57.6	Low	68	Low	121 Å²	121	56.5 Å²	56.5	53%	0.526	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-110.4	16.3	179.2	-67.7	176.2	179.4	152.9	0	112.8	E291 W292 T296	E291-K294 HydrophobicContact CB-CB 4.4Å; E291-K294 HydrophobicContact CB-CD 4.25Å; E291-K294 HydrophobicContact CB-CG 4.42Å; E291-K294 HydrophobicContact CG-CD 4.46Å; E291-K294 PolarHBondContact O-N 2.86Å; E291-K294 IonicContact OE1-NZ 2.63Å; E291-K294 PolarHBondContact OE1-NZ 3.49Å; E291-K294 WeakPolarHBondContact OE2-CD 3.4Å; E291-K294 VanDerWaalsContact OE2-CE 3.27Å; E291-K294 WeakPolarHBondContact OE2-CE 3.17Å; E291-K294 IonicContact OE2-NZ 2.65Å; E291-K294 PolarHBondContact OE2-NZ 2.91Å; W292-K294 PolarHBondContact O-N 2.8Å; W292-K294 VanDerWaalsContact O-N 3.09Å; K294-T296 VanDerWaalsContact C-N 3.3Å; K294-T296 PolarHBondContact O-N 2.77Å
295	T	58.1	Low	67.9	Low	44 Å²	44	56.8 Å²	56.8	27%	0.27	31%	0.307	S	S	.	.			trans	-83.1	68.4	179	60.7	0	0	0	0	112.3	I256 R258 W292	I256-T295 HydrophobicContact CD1-CG2 3.48Å; I256-T295 VanDerWaalsContact CD1-CG2 3.48Å; I256-T295 HydrophobicContact CG1-CG2 4.31Å; R258-T295 VanDerWaalsContact NH2-CG2 3.28Å; W292-T295 WeakPolarHBondContact O-CG2 3.37Å; W292-T295 PolarHBondContact O-N 3.3Å; W292-T295 PolarHBondContact O-OG1 2.89Å
296	T	52.9	Low	68.4	Low	105 Å²	105	56.5 Å²	56.5	64%	0.644	30%	0.304	S	S	*	.			trans	-66.6	161.9	158.1	49.2	0	0	0	0	110.4	K294 M298	K294-T296 VanDerWaalsContact C-N 3.3Å; K294-T296 PolarHBondContact O-N 2.77Å; T296-M298 PolarHBondContact O-N 2.67Å
297	K	52	Low	69	Low	152 Å²	152	56.5 Å²	56.5	66%	0.661	30%	0.304	S	S	*	.			trans	-57.8	120.6	170.3	-69.1	-178	176	179.3	0	109	L316	K297-L316 HydrophobicContact CG-CD2 4.02Å
298	M	53.3	Low	70.2	Confident	80 Å²	80	56.1 Å²	56.1	39%	0.394	30%	0.3	S	S	.	.			trans	-127.9	160.9	178.9	-69.8	-179.2	71.7	0	0	109.4	R258 T296 S315	R258-M298 PolarHBondContact NH1-SD 2.74Å; T296-M298 PolarHBondContact O-N 2.67Å; M298-S315 WeakPolarHBondContact O-CB 3.47Å; M298-S315 PolarHBondContact O-OG 3.47Å
299	S	53.2	Low	71.1	Confident	107 Å²	107	54.7 Å²	54.7	75%	0.748	29%	0.293	S	S	*	.			trans	-43.9	138.2	-178.2	-45.4	0	0	0	0	113.4	A301	S299-A301 PolarHBondContact O-N 2.88Å
300	A	53.3	Low	71.8	Confident	49 Å²	49	55.4 Å²	55.4	41%	0.405	30%	0.295	S	S	.	.			trans	-59.1	110.1	177.4	0	0	0	0	0	110.3
301	A	51.6	Low	72.3	Confident	31 Å²	31	52.7 Å²	52.7	26%	0.256	29%	0.285	S	S	.	.			trans	-143.5	151.7	-175.6	0	0	0	0	0	109.9	L288 S299	L288-A301 HydrophobicContact CD1-CB 3.72Å; L288-A301 HydrophobicContact CD2-CB 3.92Å; S299-A301 PolarHBondContact O-N 2.88Å
302	G	62.8	Low	73	Confident	27 Å²	27	52.7 Å²	52.7	28%	0.278	29%	0.286	S	S	.	.	S	Bend	trans	116	174.4	-166.2	0	0	0	0	0	111	D259	D259-G302 WeakPolarHBondContact OD1-CA 3.27Å
303	T	82.5	Confident	74	Confident	55 Å²	55	54.2 Å²	54.2	34%	0.337	30%	0.295	S	S	.	.			trans	-99.1	116.2	179	-52.8	0	0	0	0	111.1	D259 K261 S305 W306	D259-T303 PolarHBondContact OD1-N 3.03Å; K261-T303 PolarHBondContact NZ-OG1 2.98Å; T303-S305 VanDerWaalsContact C-N 3.28Å; T303-S305 PolarHBondContact O-N 3.35Å; T303-W306 HydrophobicContact CG2-CE3 3.62Å; T303-W306 HydrophobicContact CG2-CZ3 3.47Å; T303-W306 VanDerWaalsContact CG2-CZ3 3.47Å; T303-W306 PolarHBondContact O-N 2.83Å
304	Y	89.8	Confident	75.2	Confident	69 Å²	69	52.5 Å²	52.5	27%	0.271	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-46	-39.6	-168.1	-66.2	-51.2	0	0	0	116.4	W306 M307 G345 A349	Y304-W306 PolarHBondContact O-N 3.09Å; Y304-W306 VanDerWaalsContact O-N 3.15Å; Y304-M307 HydrophobicContact CD1-CE 4.39Å; Y304-M307 HydrophobicContact CD1-SD 3.59Å; Y304-M307 VanDerWaalsContact CD1-SD 3.59Å; Y304-M307 HydrophobicContact CE1-SD 4.21Å; Y304-M307 HydrophobicContact CG-SD 4.4Å; Y304-M307 PolarHBondContact O-N 2.74Å; Y304-M307 VanDerWaalsContact O-N 3.09Å; Y304-G345 WeakPolarHBondContact CB-O 3.32Å; Y304-G345 WeakPolarHBondContact CD2-O 3.21Å; Y304-A349 HydrophobicContact CD1-CB 3.57Å; Y304-A349 HydrophobicContact CD2-CB 4.19Å; Y304-A349 HydrophobicContact CE1-CB 4.01Å; Y304-A349 HydrophobicContact CG-CB 3.68Å
305	S	93.1	Very high	76.5	Confident	22 Å²	22	47.8 Å²	47.8	15%	0.154	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-62	-19.6	179.5	-53	0	0	0	0	115.2	T303	T303-S305 VanDerWaalsContact C-N 3.28Å; T303-S305 PolarHBondContact O-N 3.35Å
306	W	95.3	Very high	77.8	Confident	26 Å²	26	49.8 Å²	49.8	10%	0.098	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-105.9	-4.6	176.6	-65.7	-101.1	0	0	0	113	K261 T303 Y304 S325 V328 E332 P339	K261-W306 HydrophobicContact CB-CD2 3.72Å; K261-W306 HydrophobicContact CB-CE3 4.43Å; K261-W306 HydrophobicContact CB-CG 3.73Å; K261-W306 HydrophobicContact CB-CZ2 4.32Å; T303-W306 HydrophobicContact CG2-CE3 3.62Å; T303-W306 HydrophobicContact CG2-CZ3 3.47Å; T303-W306 VanDerWaalsContact CG2-CZ3 3.47Å; T303-W306 PolarHBondContact O-N 2.83Å; Y304-W306 PolarHBondContact O-N 3.09Å; Y304-W306 VanDerWaalsContact O-N 3.15Å; W306-S325 WeakPolarHBondContact O-CA 3.49Å; W306-S325 PolarHBondContact O-OG 3.47Å; W306-V328 HydrophobicContact CD2-CG1 4.32Å; W306-V328 HydrophobicContact CG-CB 4.35Å; W306-V328 HydrophobicContact CG-CG1 3.88Å; W306-E332 WeakPolarHBondContact CZ2-OE1 3.46Å; W306-E332 PolarHBondContact NE1-OE2 3.15Å; W306-P339 HydrophobicContact CH2-CG 4.37Å; W306-P339 HydrophobicContact CZ2-CG 3.85Å
307	M	93.8	Very high	79.4	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.039	25%	0.254	C	S	.	.			trans	-83.5	136.1	-173.3	-68.8	172.1	71.7	0	0	112	Y304 V311 I312 W324	Y304-M307 HydrophobicContact CD1-CE 4.39Å; Y304-M307 HydrophobicContact CD1-SD 3.59Å; Y304-M307 VanDerWaalsContact CD1-SD 3.59Å; Y304-M307 HydrophobicContact CE1-SD 4.21Å; Y304-M307 HydrophobicContact CG-SD 4.4Å; Y304-M307 PolarHBondContact O-N 2.74Å; Y304-M307 VanDerWaalsContact O-N 3.09Å; M307-V311 HydrophobicContact CE-CB 4.46Å; M307-V311 HydrophobicContact CE-CG1 3.6Å; M307-I312 HydrophobicContact CB-CD1 4.03Å; M307-I312 HydrophobicContact CB-CG1 3.8Å; M307-I312 HydrophobicContact CE-CG1 4.37Å; M307-W324 PolarHBondContact O-NE1 3.05Å; M307-W324 VanDerWaalsContact O-NE1 3.17Å
308	A	94.1	Very high	81.2	Confident	1 Å²	1	39 Å²	39	1%	0.008	23%	0.229	C	C	.	.			trans	-73.1	151.8	177.1	0	0	0	0	0	112.1	E310 V311 I312 W324	A308-E310 VanDerWaalsContact C-N 3.27Å; A308-E310 WeakPolarHBondContact CB-OE1 3.32Å; A308-E310 WeakPolarHBondContact CB-OE2 3.2Å; A308-E310 PolarHBondContact O-N 3.3Å; A308-V311 HydrophobicContact CB-CG2 4.16Å; A308-V311 WeakPolarHBondContact O-CB 3.42Å; A308-V311 PolarHBondContact O-N 3.07Å; A308-I312 PolarHBondContact O-N 3.44Å; A308-I312 VanDerWaalsContact O-N 3.1Å; A308-W324 HydrophobicContact CB-CB 3.71Å; A308-W324 HydrophobicContact CB-CD2 3.96Å; A308-W324 HydrophobicContact CB-CE3 4.48Å; A308-W324 HydrophobicContact CB-CG 3.57Å
309	P	93.1	Very high	83.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-32.6	-174.4	23.5	-34.1	0	0	0	113.3	I312 K313 W324 V352	P309-I312 PolarHBondContact O-N 2.82Å; P309-K313 WeakPolarHBondContact O-CB 3.37Å; P309-K313 VanDerWaalsContact O-CD 3.25Å; P309-K313 WeakPolarHBondContact O-CD 3.49Å; P309-K313 WeakPolarHBondContact O-CG 3.47Å; P309-K313 PolarHBondContact O-N 2.87Å; P309-W324 VanDerWaalsContact CD-CZ3 3.47Å; P309-W324 HydrophobicContact CG-CE3 4.37Å; P309-W324 HydrophobicContact CG-CH2 4.11Å; P309-W324 HydrophobicContact CG-CZ3 3.9Å; P309-V352 HydrophobicContact CB-CG1 4.21Å
310	E	91.5	Very high	85.1	Confident	19 Å²	19	33.5 Å²	33.5	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-71.7	-28.8	174.8	71.9	-75.5	178	0	0	113.5	A308 S314 S315 L316 S321 P381 R384	A308-E310 VanDerWaalsContact C-N 3.27Å; A308-E310 WeakPolarHBondContact CB-OE1 3.32Å; A308-E310 WeakPolarHBondContact CB-OE2 3.2Å; A308-E310 PolarHBondContact O-N 3.3Å; E310-S314 PolarHBondContact O-N 2.76Å; E310-S314 VanDerWaalsContact O-N 3.11Å; E310-S314 PolarHBondContact O-OG 2.99Å; E310-S315 PolarHBondContact O-N 3.01Å; E310-L316 PolarHBondContact O-N 3.33Å; E310-S321 WeakPolarHBondContact OE1-CB 3.43Å; E310-P381 HydrophobicContact CG-CB 4.48Å; E310-P381 HydrophobicContact CG-CG 4.25Å; E310-R384 IonicContact OE1-CZ 3.99Å; E310-R384 IonicContact OE1-NH1 3.45Å; E310-R384 PolarHBondContact OE1-NH1 3.13Å; E310-R384 IonicContact OE1-NH2 2.59Å; E310-R384 IonicContact OE2-CZ 3.32Å; E310-R384 IonicContact OE2-NH1 2.59Å; E310-R384 PolarHBondContact OE2-NH1 3.48Å; E310-R384 IonicContact OE2-NH2 3.69Å; E310-R384 PolarHBondContact OE2-NH2 3.16Å
311	V	90.9	Very high	87	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.024	17%	0.173	C	C	.	.	H	α-helix	trans	-71.4	-41.7	172.9	-176.1	0	0	0	0	109.9	M307 A308 S315 F317 S321	M307-V311 HydrophobicContact CE-CB 4.46Å; M307-V311 HydrophobicContact CE-CG1 3.6Å; A308-V311 HydrophobicContact CB-CG2 4.16Å; A308-V311 WeakPolarHBondContact O-CB 3.42Å; A308-V311 PolarHBondContact O-N 3.07Å; V311-S315 WeakPolarHBondContact O-CA 3.44Å; V311-S315 PolarHBondContact O-N 3.06Å; V311-F317 HydrophobicContact CG1-CD1 3.84Å; V311-F317 HydrophobicContact CG1-CE1 3.34Å; V311-F317 HydrophobicContact CG1-CE2 4.11Å; V311-F317 HydrophobicContact CG1-CG 4.43Å; V311-F317 HydrophobicContact CG1-CZ 3.5Å; V311-F317 HydrophobicContact CG2-CD1 4.04Å; V311-F317 HydrophobicContact CG2-CE1 4.35Å; V311-S321 VanDerWaalsContact CG2-CB 3.5Å
312	I	88.5	Confident	89.1	Confident	19 Å²	19	29.9 Å²	29.9	10%	0.097	16%	0.161	C	C	.	.	H	α-helix	trans	-69.2	-41.8	179.4	-58.3	160.1	0	0	0	111.3	M307 A308 P309 A349 V352 A353	M307-I312 HydrophobicContact CB-CD1 4.03Å; M307-I312 HydrophobicContact CB-CG1 3.8Å; M307-I312 HydrophobicContact CE-CG1 4.37Å; A308-I312 PolarHBondContact O-N 3.44Å; A308-I312 VanDerWaalsContact O-N 3.1Å; P309-I312 PolarHBondContact O-N 2.82Å; I312-A349 HydrophobicContact CG2-CB 4.07Å; I312-V352 HydrophobicContact CD1-CB 4.07Å; I312-V352 HydrophobicContact CD1-CG1 3.87Å; I312-A353 HydrophobicContact CB-CB 4.34Å; I312-A353 HydrophobicContact CG2-CB 3.91Å
313	K	88.1	Confident	90.8	Very high	122 Å²	122	28.8 Å²	28.8	53%	0.53	15%	0.149	S	C	.	.	H	α-helix	trans	-71.9	-40	-178.6	-72.6	162.4	-170.2	165.9	0	114.3	P309 A353	P309-K313 WeakPolarHBondContact O-CB 3.37Å; P309-K313 VanDerWaalsContact O-CD 3.25Å; P309-K313 WeakPolarHBondContact O-CD 3.49Å; P309-K313 WeakPolarHBondContact O-CG 3.47Å; P309-K313 PolarHBondContact O-N 2.87Å; K313-A353 WeakPolarHBondContact CE-O 3.48Å; K313-A353 HydrophobicContact CG-CB 4.13Å; K313-A353 PolarHBondContact NZ-O 3.1Å; K313-A353 VanDerWaalsContact NZ-O 3.13Å
314	S	84.1	Confident	91.5	Very high	41 Å²	41	26.3 Å²	26.3	29%	0.287	13%	0.133	S	C	.	.	H	α-helix	trans	-147.9	6.8	-161.3	47.7	0	0	0	0	114.3	E310 L316	E310-S314 PolarHBondContact O-N 2.76Å; E310-S314 VanDerWaalsContact O-N 3.11Å; E310-S314 PolarHBondContact O-OG 2.99Å; S314-L316 PolarHBondContact O-N 3.43Å; S314-L316 WeakPolarHBondContact OG-CD1 3.35Å
315	S	85.3	Confident	91.9	Very high	23 Å²	23	23.4 Å²	23.4	16%	0.161	12%	0.123	C	C	.	.			trans	52.8	35.5	178.9	-45	0	0	0	0	113.6	M298 E310 V311 F317	M298-S315 WeakPolarHBondContact O-CB 3.47Å; M298-S315 PolarHBondContact O-OG 3.47Å; E310-S315 PolarHBondContact O-N 3.01Å; V311-S315 WeakPolarHBondContact O-CA 3.44Å; V311-S315 PolarHBondContact O-N 3.06Å; S315-F317 WeakPolarHBondContact O-CD2 3.47Å; S315-F317 PolarHBondContact O-N 3.41Å
316	L	84.6	Confident	92.1	Very high	85 Å²	85	22.3 Å²	22.3	45%	0.445	12%	0.115	S	C	.	.			trans	-88.2	90.1	176.3	-63.5	179.5	0	0	0	109.7	K297 E310 S314	K297-L316 HydrophobicContact CG-CD2 4.02Å; E310-L316 PolarHBondContact O-N 3.33Å; S314-L316 PolarHBondContact O-N 3.43Å; S314-L316 WeakPolarHBondContact OG-CD1 3.35Å
317	F	86.1	Confident	92.3	Very high	13 Å²	13	21.1 Å²	21.1	6%	0.057	11%	0.111	C	C	.	.			trans	-75.9	131.3	173.4	-64.9	-86.3	0	0	0	110.7	I256 R258 V311 S315	I256-F317 HydrophobicContact CD1-CB 4.46Å; R258-F317 HydrophobicContact CB-CD1 3.61Å; R258-F317 HydrophobicContact CB-CE1 3.69Å; R258-F317 HydrophobicContact CB-CG 4.42Å; R258-F317 VanDerWaalsContact CD-CG 3.49Å; R258-F317 HydrophobicContact CG-CB 4.07Å; R258-F317 HydrophobicContact CG-CD1 3.49Å; R258-F317 VanDerWaalsContact CG-CD1 3.49Å; R258-F317 HydrophobicContact CG-CE1 4.03Å; R258-F317 HydrophobicContact CG-CG 3.84Å; V311-F317 HydrophobicContact CG1-CD1 3.84Å; V311-F317 HydrophobicContact CG1-CE1 3.34Å; V311-F317 HydrophobicContact CG1-CE2 4.11Å; V311-F317 HydrophobicContact CG1-CG 4.43Å; V311-F317 HydrophobicContact CG1-CZ 3.5Å; V311-F317 HydrophobicContact CG2-CD1 4.04Å; V311-F317 HydrophobicContact CG2-CE1 4.35Å; S315-F317 WeakPolarHBondContact O-CD2 3.47Å; S315-F317 PolarHBondContact O-N 3.41Å
318	S	90.1	Very high	92.4	Very high	18 Å²	18	20.8 Å²	20.8	13%	0.126	11%	0.109	C	C	.	.			trans	-142.2	172	-177.5	72.5	0	0	0	0	112	G320 S321 D322	S318-G320 VanDerWaalsContact C-N 3.25Å; S318-G320 PolarHBondContact O-N 3.15Å; S318-G320 PolarHBondContact OG-N 3.38Å; S318-S321 PolarHBondContact N-OG 3.32Å; S318-S321 PolarHBondContact O-N 3.13Å; S318-S321 VanDerWaalsContact O-N 3.07Å; S318-S321 PolarHBondContact O-OG 2.84Å; S318-S321 PolarHBondContact OG-N 3.14Å; S318-D322 PolarHBondContact O-N 3.11Å
319	K	93.4	Very high	92.6	Very high	66 Å²	66	20.7 Å²	20.7	29%	0.287	11%	0.109	S	C	.	.	H	α-helix	trans	-58	-43.6	168.3	-70.8	-167.4	168.7	-169.6	0	110.2	H248 E249 W292 S321 D322 V323	H248-K319 HydrophobicContact CB-CD 4.21Å; H248-K319 VanDerWaalsContact CE1-CA 3.49Å; H248-K319 WeakPolarHBondContact CE1-CA 3.35Å; H248-K319 WeakPolarHBondContact ND1-CG 3.48Å; H248-K319 WeakPolarHBondContact O-CE 3.39Å; H248-K319 PolarHBondContact O-NZ 3.34Å; E249-K319 IonicContact OE1-NZ 3.82Å; W292-K319 HydrophobicContact CE3-CG 4.05Å; W292-K319 HydrophobicContact CZ3-CB 4.46Å; W292-K319 HydrophobicContact CZ3-CG 4.02Å; K319-S321 PolarHBondContact O-N 2.98Å; K319-D322 PolarHBondContact O-N 3.27Å; K319-D322 VanDerWaalsContact O-N 3.13Å; K319-V323 WeakPolarHBondContact O-CG2 3.26Å; K319-V323 PolarHBondContact O-N 2.84Å
320	G	94.9	Very high	92.7	Very high	6 Å²	6	20.8 Å²	20.8	6%	0.062	11%	0.109	C	C	.	.	H	α-helix	trans	-58.3	-29.2	173.4	0	0	0	0	0	113.9	S318 V323 W324 R384	S318-G320 VanDerWaalsContact C-N 3.25Å; S318-G320 PolarHBondContact O-N 3.15Å; S318-G320 PolarHBondContact OG-N 3.38Å; G320-V323 PolarHBondContact O-N 2.88Å; G320-W324 PolarHBondContact O-N 2.65Å; G320-R384 VanDerWaalsContact C-NH1 3.25Å; G320-R384 VanDerWaalsContact O-CD 3.26Å; G320-R384 WeakPolarHBondContact O-CD 3.46Å; G320-R384 PolarHBondContact O-NH1 2.98Å
321	S	94.3	Very high	93	Very high	4 Å²	4	19.9 Å²	19.9	3%	0.028	11%	0.105	C	C	.	.	H	α-helix	trans	-74.3	-35.8	175.4	71.4	0	0	0	0	112.7	E310 V311 S318 K319 V323 W324 S325	E310-S321 WeakPolarHBondContact OE1-CB 3.43Å; V311-S321 VanDerWaalsContact CG2-CB 3.5Å; S318-S321 PolarHBondContact N-OG 3.32Å; S318-S321 PolarHBondContact O-N 3.13Å; S318-S321 VanDerWaalsContact O-N 3.07Å; S318-S321 PolarHBondContact O-OG 2.84Å; S318-S321 PolarHBondContact OG-N 3.14Å; K319-S321 PolarHBondContact O-N 2.98Å; S321-V323 VanDerWaalsContact C-N 3.32Å; S321-W324 PolarHBondContact O-N 3.48Å; S321-S325 PolarHBondContact O-N 3.42Å; S321-S325 VanDerWaalsContact O-N 3.16Å; S321-S325 PolarHBondContact O-OG 3.18Å; S321-S325 VanDerWaalsContact O-OG 3.05Å
322	D	96	Very high	93.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-67.2	-34.7	169.6	-72.6	-18.6	0	0	0	111	M244 H248 I256 H257 R258 S318 K319 S325 Y326 F387	M244-D322 HydrophobicContact CE-CB 3.79Å; M244-D322 WeakPolarHBondContact CE-OD2 3.14Å; H248-D322 IonicContact CD2-OD2 3.21Å; H248-D322 IonicContact CE1-OD2 3.38Å; H248-D322 IonicContact NE2-OD2 3.41Å; H248-D322 PolarHBondContact NE2-OD2 2.97Å; I256-D322 WeakPolarHBondContact CA-OD2 3.45Å; I256-D322 WeakPolarHBondContact CG2-OD1 3.43Å; I256-D322 VanDerWaalsContact CG2-OD2 3.26Å; I256-D322 WeakPolarHBondContact CG2-OD2 3.38Å; H257-D322 PolarHBondContact N-OD1 3.47Å; H257-D322 PolarHBondContact N-OD2 2.9Å; R258-D322 PolarHBondContact N-OD1 3.22Å; S318-D322 PolarHBondContact O-N 3.11Å; K319-D322 PolarHBondContact O-N 3.27Å; K319-D322 VanDerWaalsContact O-N 3.13Å; D322-S325 WeakPolarHBondContact O-CB 3.28Å; D322-S325 PolarHBondContact O-N 3.34Å; D322-Y326 WeakPolarHBondContact O-CB 3.41Å; D322-Y326 PolarHBondContact O-N 3Å; D322-F387 HydrophobicContact CB-CE2 4.33Å
323	V	98.1	Very high	93.5	Very high	3 Å²	3	19.3 Å²	19.3	2%	0.018	10%	0.102	C	C	.	.	H	α-helix	trans	-65.4	-41.3	175.4	169.9	0	0	0	0	112	K319 G320 S321 S325 Y326 G327 C376 R384 P385 F387 I390	K319-V323 WeakPolarHBondContact O-CG2 3.26Å; K319-V323 PolarHBondContact O-N 2.84Å; G320-V323 PolarHBondContact O-N 2.88Å; S321-V323 VanDerWaalsContact C-N 3.32Å; V323-S325 VanDerWaalsContact C-N 3.34Å; V323-S325 PolarHBondContact O-N 2.87Å; V323-Y326 CarbonylContact O-C 3.55Å; V323-Y326 WeakPolarHBondContact O-CA 3.49Å; V323-Y326 WeakPolarHBondContact O-CB 3.23Å; V323-Y326 PolarHBondContact O-N 2.91Å; V323-Y326 VanDerWaalsContact O-N 3.14Å; V323-G327 PolarHBondContact O-N 3.37Å; V323-C376 HydrophobicContact CG1-CB 4.11Å; V323-R384 HydrophobicContact CG1-CB 3.95Å; V323-P385 WeakPolarHBondContact CG2-O 3.34Å; V323-F387 HydrophobicContact CG2-CD2 4.02Å; V323-F387 HydrophobicContact CG2-CE2 3.54Å; V323-F387 HydrophobicContact CG2-CZ 3.9Å; V323-I390 HydrophobicContact CG1-CD1 3.94Å; V323-I390 HydrophobicContact CG2-CD1 4.21Å
324	W	97.5	Very high	93.6	Very high	4 Å²	4	13.8 Å²	13.8	2%	0.015	8%	0.078	C	C	.	.	H	α-helix	trans	-58.7	-46.6	171.6	175.4	-72.4	0	0	0	111.5	M307 A308 P309 G320 S321 Y326 G327 V328 V352 C376 W377	M307-W324 PolarHBondContact O-NE1 3.05Å; M307-W324 VanDerWaalsContact O-NE1 3.17Å; A308-W324 HydrophobicContact CB-CB 3.71Å; A308-W324 HydrophobicContact CB-CD2 3.96Å; A308-W324 HydrophobicContact CB-CE3 4.48Å; A308-W324 HydrophobicContact CB-CG 3.57Å; P309-W324 VanDerWaalsContact CD-CZ3 3.47Å; P309-W324 HydrophobicContact CG-CE3 4.37Å; P309-W324 HydrophobicContact CG-CH2 4.11Å; P309-W324 HydrophobicContact CG-CZ3 3.9Å; G320-W324 PolarHBondContact O-N 2.65Å; S321-W324 PolarHBondContact O-N 3.48Å; W324-Y326 VanDerWaalsContact C-N 3.26Å; W324-Y326 PolarHBondContact O-N 3.07Å; W324-G327 PolarHBondContact O-N 2.85Å; W324-G327 VanDerWaalsContact O-N 3.13Å; W324-V328 PolarHBondContact O-N 3.07Å; W324-V328 VanDerWaalsContact O-N 3.15Å; W324-V352 HydrophobicContact CH2-CG1 4.19Å; W324-V352 HydrophobicContact CZ2-CG1 3.65Å; W324-C376 WeakPolarHBondContact CA-O 3.43Å; W324-W377 AromaticContact CD2-CD1 3.8Å; W324-W377 HydrophobicContact CE3-CB 4.19Å; W324-W377 HydrophobicContact CE3-CG 4.48Å; W324-W377 HydrophobicContact CH2-CB 4.29Å; W324-W377 HydrophobicContact CZ3-CB 3.95Å; W324-W377 VanDerWaalsContact CZ3-O 3.23Å; W324-W377 WeakPolarHBondContact CZ3-O 3.27Å; W324-W377 PolarHBondContact O-NE1 3.26Å
325	S	97.3	Very high	94	Very high	7 Å²	7	11.9 Å²	11.9	5%	0.049	6%	0.064	C	C	.	.	H	α-helix	trans	-61.5	-34.2	175.3	-57	0	0	0	0	112.4	L260 W306 S321 D322 V323 V328 L329	L260-S325 WeakPolarHBondContact O-CB 3.34Å; W306-S325 WeakPolarHBondContact O-CA 3.49Å; W306-S325 PolarHBondContact O-OG 3.47Å; S321-S325 PolarHBondContact O-N 3.42Å; S321-S325 VanDerWaalsContact O-N 3.16Å; S321-S325 PolarHBondContact O-OG 3.18Å; S321-S325 VanDerWaalsContact O-OG 3.05Å; D322-S325 WeakPolarHBondContact O-CB 3.28Å; D322-S325 PolarHBondContact O-N 3.34Å; V323-S325 VanDerWaalsContact C-N 3.34Å; V323-S325 PolarHBondContact O-N 2.87Å; S325-V328 PolarHBondContact O-N 2.94Å; S325-L329 PolarHBondContact O-N 3.14Å
326	Y	98.2	Very high	94.3	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67.7	-39.3	172.1	-179.2	-93.6	0	0	0	112.8	A237 I240 A241 D322 V323 W324 V328 L329 L330 F387 I390 L394	A237-Y326 WeakPolarHBondContact CB-OH 3.37Å; A237-Y326 PolarHBondContact O-OH 3.36Å; I240-Y326 HydrophobicContact CB-CE2 4.06Å; I240-Y326 HydrophobicContact CG2-CD2 3.87Å; I240-Y326 HydrophobicContact CG2-CE2 3.78Å; A241-Y326 HydrophobicContact CB-CE2 4.05Å; D322-Y326 WeakPolarHBondContact O-CB 3.41Å; D322-Y326 PolarHBondContact O-N 3Å; V323-Y326 CarbonylContact O-C 3.55Å; V323-Y326 WeakPolarHBondContact O-CA 3.49Å; V323-Y326 WeakPolarHBondContact O-CB 3.23Å; V323-Y326 PolarHBondContact O-N 2.91Å; V323-Y326 VanDerWaalsContact O-N 3.14Å; W324-Y326 VanDerWaalsContact C-N 3.26Å; W324-Y326 PolarHBondContact O-N 3.07Å; Y326-V328 VanDerWaalsContact C-N 3.27Å; Y326-V328 PolarHBondContact O-N 3.03Å; Y326-L329 CarbonylContact O-C 3.5Å; Y326-L329 WeakPolarHBondContact O-CA 3.42Å; Y326-L329 VanDerWaalsContact O-CB 3.32Å; Y326-L329 WeakPolarHBondContact O-CB 3.29Å; Y326-L329 PolarHBondContact O-N 2.9Å; Y326-L329 VanDerWaalsContact O-N 3.11Å; Y326-L330 PolarHBondContact O-N 2.87Å; Y326-F387 HydrophobicContact CD1-CE1 4.15Å; Y326-F387 AromaticContact CD2-CE1 3.78Å; Y326-F387 HydrophobicContact CD2-CE1 3.78Å; Y326-F387 HydrophobicContact CD2-CZ 4.5Å; Y326-F387 HydrophobicContact CE2-CE1 4.43Å; Y326-F387 AromaticContact CG-CE1 3.62Å; Y326-F387 HydrophobicContact CG-CE1 3.62Å; Y326-F387 HydrophobicContact CG-CZ 4.17Å; Y326-I390 HydrophobicContact CD1-CD1 4.27Å; Y326-I390 HydrophobicContact CD1-CG2 4.28Å; Y326-I390 HydrophobicContact CE1-CG2 3.61Å; Y326-L394 VanDerWaalsContact OH-CD1 3.26Å; Y326-L394 WeakPolarHBondContact OH-CD1 3.18Å
327	G	97.7	Very high	94.6	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-58.2	-39.7	172.3	0	0	0	0	0	112.4	V323 W324 L330 W331 W377	V323-G327 PolarHBondContact O-N 3.37Å; W324-G327 PolarHBondContact O-N 2.85Å; W324-G327 VanDerWaalsContact O-N 3.13Å; G327-L330 PolarHBondContact O-N 3.02Å; G327-W331 PolarHBondContact O-N 2.83Å; G327-W331 VanDerWaalsContact O-N 3.07Å; G327-W377 WeakPolarHBondContact O-CZ2 3.29Å
328	V	97.4	Very high	94.9	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.006	7%	0.068	C	C	.	.	H	α-helix	trans	-65.3	-42.6	172.7	179	0	0	0	0	111.7	W306 W324 S325 Y326 L330 W331 E332 P339 L359 W377	W306-V328 HydrophobicContact CD2-CG1 4.32Å; W306-V328 HydrophobicContact CG-CB 4.35Å; W306-V328 HydrophobicContact CG-CG1 3.88Å; W324-V328 PolarHBondContact O-N 3.07Å; W324-V328 VanDerWaalsContact O-N 3.15Å; S325-V328 PolarHBondContact O-N 2.94Å; Y326-V328 VanDerWaalsContact C-N 3.27Å; Y326-V328 PolarHBondContact O-N 3.03Å; V328-L330 VanDerWaalsContact C-N 3.31Å; V328-L330 PolarHBondContact O-N 3.37Å; V328-W331 WeakPolarHBondContact O-CB 3.34Å; V328-W331 PolarHBondContact O-N 2.69Å; V328-E332 WeakPolarHBondContact O-CG 3.38Å; V328-E332 PolarHBondContact O-N 3.01Å; V328-P339 HydrophobicContact CG1-CB 4.04Å; V328-P339 HydrophobicContact CG1-CG 3.67Å; V328-L359 HydrophobicContact CB-CD1 4.3Å; V328-L359 HydrophobicContact CG1-CD1 3.85Å; V328-L359 HydrophobicContact CG2-CD1 4.02Å; V328-W377 HydrophobicContact CG2-CZ2 4.29Å
329	L	96.9	Very high	95.1	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59.6	-38.3	172.7	-97.3	173.2	0	0	0	113.2	L219 I240 L260 S262 I265 S325 Y326 E332 L333	L219-L329 HydrophobicContact CD2-CD2 4.16Å; I240-L329 HydrophobicContact CG2-CD1 4.2Å; L260-L329 HydrophobicContact CD1-CD1 3.87Å; L260-L329 HydrophobicContact CD2-CD1 4.22Å; L260-L329 HydrophobicContact CG-CD1 3.68Å; S262-L329 VanDerWaalsContact N-CD2 3.35Å; I265-L329 HydrophobicContact CD1-CD1 4.24Å; I265-L329 HydrophobicContact CG1-CD1 4.16Å; I265-L329 HydrophobicContact CG1-CD2 4.18Å; S325-L329 PolarHBondContact O-N 3.14Å; Y326-L329 CarbonylContact O-C 3.5Å; Y326-L329 WeakPolarHBondContact O-CA 3.42Å; Y326-L329 VanDerWaalsContact O-CB 3.32Å; Y326-L329 WeakPolarHBondContact O-CB 3.29Å; Y326-L329 PolarHBondContact O-N 2.9Å; Y326-L329 VanDerWaalsContact O-N 3.11Å; L329-E332 PolarHBondContact O-N 3.46Å; L329-L333 WeakPolarHBondContact O-CG 3.48Å; L329-L333 PolarHBondContact O-N 3.36Å
330	L	96.4	Very high	95	Very high	2 Å²	2	8.3 Å²	8.3	1%	0.01	5%	0.051	C	C	.	.	H	α-helix	trans	-66.4	-40.9	177.4	-176.7	60	0	0	0	111	A237 Y326 G327 V328 L333 L334 F369 L372 M373	A237-L330 HydrophobicContact CB-CD1 4.08Å; Y326-L330 PolarHBondContact O-N 2.87Å; G327-L330 PolarHBondContact O-N 3.02Å; V328-L330 VanDerWaalsContact C-N 3.31Å; V328-L330 PolarHBondContact O-N 3.37Å; L330-L333 PolarHBondContact O-N 3.47Å; L330-L334 HydrophobicContact CD1-CD1 4.28Å; L330-L334 HydrophobicContact CD1-CG 4.45Å; L330-L334 HydrophobicContact CG-CD1 4.08Å; L330-L334 WeakPolarHBondContact O-CB 3.49Å; L330-L334 VanDerWaalsContact O-CG 3.29Å; L330-L334 WeakPolarHBondContact O-CG 3.21Å; L330-L334 PolarHBondContact O-N 3.31Å; L330-F369 HydrophobicContact CD1-CD1 4.21Å; L330-F369 HydrophobicContact CD1-CE1 4.22Å; L330-L372 HydrophobicContact CD2-CB 4.4Å; L330-L372 HydrophobicContact CD2-CD2 3.76Å; L330-L372 HydrophobicContact CD2-CG 3.89Å; L330-M373 HydrophobicContact CB-CG 4.41Å; L330-M373 HydrophobicContact CD2-CG 3.84Å; L330-M373 HydrophobicContact CG-CG 4.12Å
331	W	96.3	Very high	94.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.9	-42.4	171.9	-174.1	94.5	0	0	0	112.2	G327 V328 L334 T335 E337 P339 L359 P360 M373 W377 I421 F425	G327-W331 PolarHBondContact O-N 2.83Å; G327-W331 VanDerWaalsContact O-N 3.07Å; V328-W331 WeakPolarHBondContact O-CB 3.34Å; V328-W331 PolarHBondContact O-N 2.69Å; W331-L334 PolarHBondContact O-N 3.28Å; W331-T335 HydrophobicContact CD2-CG2 4.14Å; W331-T335 HydrophobicContact CG-CG2 4.42Å; W331-T335 HydrophobicContact CZ2-CG2 4.32Å; W331-T335 WeakPolarHBondContact O-CB 3.46Å; W331-T335 WeakPolarHBondContact O-CG2 3.46Å; W331-T335 PolarHBondContact O-N 3.1Å; W331-T335 PolarHBondContact O-OG1 3.32Å; W331-E337 HydrophobicContact CH2-CB 3.79Å; W331-E337 HydrophobicContact CZ3-CB 3.98Å; W331-P339 HydrophobicContact CE3-CG 4.25Å; W331-P339 HydrophobicContact CZ3-CG 4.18Å; W331-L359 HydrophobicContact CB-CD1 4.26Å; W331-L359 HydrophobicContact CD2-CB 4.31Å; W331-L359 HydrophobicContact CD2-CD1 3.88Å; W331-L359 HydrophobicContact CD2-CD2 4.39Å; W331-L359 HydrophobicContact CD2-CG 4.42Å; W331-L359 HydrophobicContact CE3-CD1 4.02Å; W331-L359 HydrophobicContact CE3-CD2 4.4Å; W331-L359 HydrophobicContact CG-CB 4.31Å; W331-L359 HydrophobicContact CG-CD1 4Å; W331-L359 HydrophobicContact CH2-CD2 4.22Å; W331-L359 HydrophobicContact CZ2-CD2 4.17Å; W331-L359 HydrophobicContact CZ3-CD2 4.33Å; W331-P360 PolarHBondContact NE1-O 3.47Å; W331-M373 HydrophobicContact CB-SD 3.8Å; W331-M373 HydrophobicContact CG-SD 4.35Å; W331-W377 HydrophobicContact CB-CH2 3.98Å; W331-W377 HydrophobicContact CB-CZ2 4.11Å; W331-W377 AromaticContact CD1-CH2 3.91Å; W331-W377 HydrophobicContact CG-CH2 4.15Å; W331-I421 HydrophobicContact CH2-CD1 4.43Å; W331-I421 HydrophobicContact CH2-CG2 4.02Å; W331-I421 HydrophobicContact CZ2-CD1 3.73Å; W331-I421 HydrophobicContact CZ2-CG1 4.14Å; W331-I421 HydrophobicContact CZ2-CG2 3.83Å; W331-F425 HydrophobicContact CH2-CE2 4.14Å; W331-F425 AromaticContact CH2-CZ 3.93Å; W331-F425 HydrophobicContact CH2-CZ 3.93Å; W331-F425 HydrophobicContact CZ2-CZ 4.14Å
332	E	95.5	Very high	94.4	Very high	9 Å²	9	16.1 Å²	16.1	4%	0.042	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-42.7	174.2	-71.3	-173.5	95.1	0	0	112.5	L223 S262 W306 V328 L329 G336 P339	L223-E332 HydrophobicContact CD1-CB 4.41Å; S262-E332 VanDerWaalsContact CB-CD 3.47Å; S262-E332 WeakPolarHBondContact CB-OE1 3.39Å; S262-E332 VanDerWaalsContact CB-OE2 3.23Å; S262-E332 WeakPolarHBondContact CB-OE2 3.39Å; S262-E332 PolarHBondContact OG-OE1 2.92Å; S262-E332 PolarHBondContact OG-OE2 3.49Å; W306-E332 WeakPolarHBondContact CZ2-OE1 3.46Å; W306-E332 PolarHBondContact NE1-OE2 3.15Å; V328-E332 WeakPolarHBondContact O-CG 3.38Å; V328-E332 PolarHBondContact O-N 3.01Å; L329-E332 PolarHBondContact O-N 3.46Å; E332-G336 VanDerWaalsContact O-CA 3.27Å; E332-G336 WeakPolarHBondContact O-CA 3.5Å; E332-G336 PolarHBondContact O-N 2.87Å; E332-P339 HydrophobicContact CG-CG 3.5Å
333	L	94.2	Very high	93.9	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-62.1	-47.9	176.6	-76.6	169.4	0	0	0	111.4	L219 L223 L233 W236 A237 I240 L329 L330	L219-L333 HydrophobicContact CD1-CD2 4.14Å; L219-L333 HydrophobicContact CD2-CD2 4.09Å; L223-L333 HydrophobicContact CD1-CD2 4.42Å; L223-L333 HydrophobicContact CD2-CD2 4.25Å; L233-L333 WeakPolarHBondContact CD1-O 3.41Å; L233-L333 HydrophobicContact CD2-CB 4.37Å; L233-L333 HydrophobicContact CD2-CD2 4.08Å; L233-L333 WeakPolarHBondContact CD2-O 3.44Å; W236-L333 HydrophobicContact CB-CD2 4.16Å; W236-L333 HydrophobicContact CE3-CD2 3.96Å; A237-L333 HydrophobicContact CB-CD1 3.88Å; I240-L333 HydrophobicContact CD1-CD1 4.25Å; L329-L333 WeakPolarHBondContact O-CG 3.48Å; L329-L333 PolarHBondContact O-N 3.36Å; L330-L333 PolarHBondContact O-N 3.47Å
334	L	91.6	Very high	93.4	Very high	5 Å²	5	22 Å²	22	3%	0.026	13%	0.127	C	C	.	.	H	α-helix	trans	-68.6	-42	-175.5	-72	168	0	0	0	113	L330 W331 F369 M373 Q414	L330-L334 HydrophobicContact CD1-CD1 4.28Å; L330-L334 HydrophobicContact CD1-CG 4.45Å; L330-L334 HydrophobicContact CG-CD1 4.08Å; L330-L334 WeakPolarHBondContact O-CB 3.49Å; L330-L334 VanDerWaalsContact O-CG 3.29Å; L330-L334 WeakPolarHBondContact O-CG 3.21Å; L330-L334 PolarHBondContact O-N 3.31Å; W331-L334 PolarHBondContact O-N 3.28Å; L334-F369 HydrophobicContact CD1-CB 3.82Å; L334-F369 HydrophobicContact CD1-CD1 3.81Å; L334-F369 HydrophobicContact CD1-CE1 4.44Å; L334-F369 HydrophobicContact CD1-CG 3.85Å; L334-F369 HydrophobicContact CD2-CD1 3.94Å; L334-F369 HydrophobicContact CD2-CD2 3.9Å; L334-F369 HydrophobicContact CD2-CE1 3.84Å; L334-F369 HydrophobicContact CD2-CE2 3.82Å; L334-F369 HydrophobicContact CD2-CG 3.95Å; L334-F369 HydrophobicContact CD2-CZ 3.76Å; L334-F369 HydrophobicContact CG-CD1 4.38Å; L334-M373 HydrophobicContact CD1-CE 3.86Å; L334-M373 HydrophobicContact CD1-SD 4.02Å; L334-Q414 PolarHBondContact O-NE2 3.2Å
335	T	91.6	Very high	92.9	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-90.7	-33.5	-174.3	62.8	0	0	0	0	112.8	W331 E337 R418 I421	W331-T335 HydrophobicContact CD2-CG2 4.14Å; W331-T335 HydrophobicContact CG-CG2 4.42Å; W331-T335 HydrophobicContact CZ2-CG2 4.32Å; W331-T335 WeakPolarHBondContact O-CB 3.46Å; W331-T335 WeakPolarHBondContact O-CG2 3.46Å; W331-T335 PolarHBondContact O-N 3.1Å; W331-T335 PolarHBondContact O-OG1 3.32Å; T335-E337 PolarHBondContact O-N 3.19Å; T335-E337 PolarHBondContact OG1-N 3.34Å; T335-R418 PolarHBondContact O-NE 2.84Å; T335-R418 PolarHBondContact O-NH2 2.85Å; T335-I421 HydrophobicContact CG2-CD1 3.41Å; T335-I421 VanDerWaalsContact CG2-CD1 3.41Å
336	G	91.3	Very high	92.4	Very high	18 Å²	18	25.4 Å²	25.4	19%	0.186	15%	0.151	C	C	.	.			trans	70.9	9.8	-164.4	0	0	0	0	0	113.8	E332	E332-G336 VanDerWaalsContact O-CA 3.27Å; E332-G336 WeakPolarHBondContact O-CA 3.5Å; E332-G336 PolarHBondContact O-N 2.87Å
337	E	91.9	Very high	91.9	Very high	39 Å²	39	26.8 Å²	26.8	18%	0.182	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-95.6	164.3	-177.6	-81.1	-57	146	0	0	113.9	W331 T335 R418	W331-E337 HydrophobicContact CH2-CB 3.79Å; W331-E337 HydrophobicContact CZ3-CB 3.98Å; T335-E337 PolarHBondContact O-N 3.19Å; T335-E337 PolarHBondContact OG1-N 3.34Å; E337-R418 HydrophobicContact CG-CG 3.98Å
338	V	92.2	Very high	91.5	Very high	63 Å²	63	26.9 Å²	26.9	38%	0.382	16%	0.163	S	C	.	.	P	Polyproline II helix	trans	-87.9	126.8	178.2	179.3	0	0	0	0	110.1	Y340 R341	V338-Y340 PolarHBondContact O-N 3.41Å; V338-R341 HydrophobicContact CB-CB 4.26Å; V338-R341 HydrophobicContact CB-CG 4.35Å; V338-R341 WeakPolarHBondContact O-CB 3.5Å; V338-R341 PolarHBondContact O-N 3.29Å
339	P	93.8	Very high	91.1	Very high	5 Å²	5	27 Å²	27	3%	0.032	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	125.3	178.9	-30.5	39.1	0	0	0	112.7	W306 V328 W331 E332 R341 L359	W306-P339 HydrophobicContact CH2-CG 4.37Å; W306-P339 HydrophobicContact CZ2-CG 3.85Å; V328-P339 HydrophobicContact CG1-CB 4.04Å; V328-P339 HydrophobicContact CG1-CG 3.67Å; W331-P339 HydrophobicContact CE3-CG 4.25Å; W331-P339 HydrophobicContact CZ3-CG 4.18Å; E332-P339 HydrophobicContact CG-CG 3.5Å; P339-R341 VanDerWaalsContact C-N 3.3Å; P339-R341 PolarHBondContact O-N 3.23Å; P339-L359 HydrophobicContact CB-CD1 4.23Å; P339-L359 HydrophobicContact CB-CD2 4.1Å
340	Y	91.8	Very high	90.7	Very high	6 Å²	6	32.4 Å²	32.4	2%	0.024	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	38.4	-178.1	-50.3	-70.2	0	0	0	114.6	V338 G342 I343 V348 L357 L359 F425	V338-Y340 PolarHBondContact O-N 3.41Å; Y340-G342 PolarHBondContact O-N 3.33Å; Y340-I343 WeakPolarHBondContact O-CB 3.27Å; Y340-I343 PolarHBondContact O-N 2.96Å; Y340-V348 HydrophobicContact CD1-CG2 4.35Å; Y340-V348 HydrophobicContact CD2-CB 4.42Å; Y340-V348 HydrophobicContact CD2-CG1 3.46Å; Y340-V348 VanDerWaalsContact CD2-CG1 3.46Å; Y340-V348 HydrophobicContact CD2-CG2 4Å; Y340-V348 HydrophobicContact CE2-CG1 3.67Å; Y340-V348 HydrophobicContact CG-CG1 4Å; Y340-V348 HydrophobicContact CG-CG2 3.71Å; Y340-L357 HydrophobicContact CD1-CD1 4.23Å; Y340-L357 HydrophobicContact CD1-CD2 3.89Å; Y340-L357 HydrophobicContact CD1-CG 4.08Å; Y340-L357 HydrophobicContact CE1-CD1 3.99Å; Y340-L357 HydrophobicContact CE1-CD2 3.79Å; Y340-L357 HydrophobicContact CE1-CG 3.58Å; Y340-L359 HydrophobicContact CD1-CD2 3.78Å; Y340-L359 HydrophobicContact CD2-CD2 4.02Å; Y340-L359 HydrophobicContact CE1-CD2 3.62Å; Y340-L359 HydrophobicContact CE1-CG 3.95Å; Y340-L359 HydrophobicContact CE2-CD2 3.88Å; Y340-L359 HydrophobicContact CE2-CG 4.01Å; Y340-L359 HydrophobicContact CG-CD2 3.99Å; Y340-L359 PolarHBondContact OH-N 2.85Å; Y340-F425 HydrophobicContact CD1-CE1 4.25Å
341	R	90.7	Very high	90.4	Very high	117 Å²	117	32.8 Å²	32.8	44%	0.442	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.2	107.4	-173.9	-170.8	-179.1	-179.8	85.6	4.9	114.1	V338 P339 F425	V338-R341 HydrophobicContact CB-CB 4.26Å; V338-R341 HydrophobicContact CB-CG 4.35Å; V338-R341 WeakPolarHBondContact O-CB 3.5Å; V338-R341 PolarHBondContact O-N 3.29Å; P339-R341 VanDerWaalsContact C-N 3.3Å; P339-R341 PolarHBondContact O-N 3.23Å; R341-F425 HydrophobicContact CB-CD2 3.94Å; R341-F425 HydrophobicContact CB-CE2 3.97Å
342	G	85.9	Confident	90.1	Very high	57 Å²	57	32.9 Å²	32.9	59%	0.588	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	16.3	174	0	0	0	0	0	115.2	Y340 R429	Y340-G342 PolarHBondContact O-N 3.33Å; G342-R429 WeakPolarHBondContact O-CD 3.21Å
343	I	86.5	Confident	89.8	Confident	29 Å²	29	33.1 Å²	33.1	15%	0.149	19%	0.194	C	C	.	.	S	Bend	trans	-90.1	150.5	159	-51.9	178.7	0	0	0	107.4	Y340 A347 V348 F425 L428 R429	Y340-I343 WeakPolarHBondContact O-CB 3.27Å; Y340-I343 PolarHBondContact O-N 2.96Å; I343-A347 HydrophobicContact CG2-CB 4.44Å; I343-V348 HydrophobicContact CB-CG2 4.06Å; I343-V348 HydrophobicContact CG2-CG2 3.82Å; I343-F425 HydrophobicContact CD1-CD1 4.15Å; I343-L428 HydrophobicContact CD1-CB 4.14Å; I343-L428 HydrophobicContact CD1-CD1 4.13Å; I343-R429 HydrophobicContact CG1-CG 4.03Å
344	D	86.4	Confident	89.6	Confident	96 Å²	96	35.5 Å²	35.5	51%	0.513	21%	0.209	S	C	.	.			trans	-68.9	144.7	176	174.2	67.6	0	0	0	112.7	L346 A347 V348	D344-L346 WeakPolarHBondContact OD2-CA 3.48Å; D344-L346 WeakPolarHBondContact OD2-CB 3.39Å; D344-L346 PolarHBondContact OD2-N 3.49Å; D344-A347 HydrophobicContact CB-CB 4Å; D344-A347 PolarHBondContact O-N 3.08Å; D344-A347 PolarHBondContact OD2-N 3.33Å; D344-V348 VanDerWaalsContact O-CG2 3.31Å; D344-V348 WeakPolarHBondContact O-CG2 3.27Å; D344-V348 PolarHBondContact O-N 2.99Å
345	G	86.7	Confident	89.4	Confident	28 Å²	28	39.5 Å²	39.5	29%	0.289	23%	0.23	S	C	.	.	H	α-helix	trans	-67.5	-35.1	-175.7	0	0	0	0	0	114.6	Y304 A349	Y304-G345 WeakPolarHBondContact CB-O 3.32Å; Y304-G345 WeakPolarHBondContact CD2-O 3.21Å; G345-A349 WeakPolarHBondContact O-CB 3.39Å; G345-A349 PolarHBondContact O-N 3.07Å
346	L	87.1	Confident	89	Confident	56 Å²	56	46 Å²	46	29%	0.293	26%	0.258	S	S	.	.	H	α-helix	trans	-75.9	-36.7	175.8	-174.3	64.4	0	0	0	110.5	D344 V348 A349 Y350 E1018	D344-L346 WeakPolarHBondContact OD2-CA 3.48Å; D344-L346 WeakPolarHBondContact OD2-CB 3.39Å; D344-L346 PolarHBondContact OD2-N 3.49Å; L346-V348 VanDerWaalsContact C-N 3.33Å; L346-V348 PolarHBondContact O-N 3.29Å; L346-A349 PolarHBondContact O-N 2.85Å; L346-Y350 WeakPolarHBondContact O-CB 3.25Å; L346-Y350 PolarHBondContact O-N 3.47Å; L346-E1018 HydrophobicContact CD2-CG 4.11Å
347	A	87.7	Confident	88.7	Confident	29 Å²	29	46 Å²	46	24%	0.24	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-39.6	170.9	0	0	0	0	0	112.3	I343 D344 G351	I343-A347 HydrophobicContact CG2-CB 4.44Å; D344-A347 HydrophobicContact CB-CB 4Å; D344-A347 PolarHBondContact O-N 3.08Å; D344-A347 PolarHBondContact OD2-N 3.33Å; A347-G351 PolarHBondContact O-N 3.14Å
348	V	89.9	Confident	88.6	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-51.5	171.2	167.6	0	0	0	0	110.8	Y340 I343 D344 L346 Y350 G351 V352 L357	Y340-V348 HydrophobicContact CD1-CG2 4.35Å; Y340-V348 HydrophobicContact CD2-CB 4.42Å; Y340-V348 HydrophobicContact CD2-CG1 3.46Å; Y340-V348 VanDerWaalsContact CD2-CG1 3.46Å; Y340-V348 HydrophobicContact CD2-CG2 4Å; Y340-V348 HydrophobicContact CE2-CG1 3.67Å; Y340-V348 HydrophobicContact CG-CG1 4Å; Y340-V348 HydrophobicContact CG-CG2 3.71Å; I343-V348 HydrophobicContact CB-CG2 4.06Å; I343-V348 HydrophobicContact CG2-CG2 3.82Å; D344-V348 VanDerWaalsContact O-CG2 3.31Å; D344-V348 WeakPolarHBondContact O-CG2 3.27Å; D344-V348 PolarHBondContact O-N 2.99Å; L346-V348 VanDerWaalsContact C-N 3.33Å; L346-V348 PolarHBondContact O-N 3.29Å; V348-Y350 VanDerWaalsContact C-N 3.35Å; V348-Y350 PolarHBondContact O-N 3.28Å; V348-G351 PolarHBondContact O-N 3.34Å; V348-G351 VanDerWaalsContact O-N 3.14Å; V348-V352 HydrophobicContact CG1-CG2 4.31Å; V348-V352 WeakPolarHBondContact O-CG2 3.29Å; V348-V352 PolarHBondContact O-N 2.99Å; V348-L357 HydrophobicContact CB-CD2 4.31Å; V348-L357 HydrophobicContact CG1-CD2 4.4Å; V348-L357 HydrophobicContact CG2-CD2 4.07Å
349	A	88.6	Confident	88.6	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-55.1	-49.7	-179.9	0	0	0	0	0	111.7	Y304 I312 G345 L346 A353	Y304-A349 HydrophobicContact CD1-CB 3.57Å; Y304-A349 HydrophobicContact CD2-CB 4.19Å; Y304-A349 HydrophobicContact CE1-CB 4.01Å; Y304-A349 HydrophobicContact CG-CB 3.68Å; I312-A349 HydrophobicContact CG2-CB 4.07Å; G345-A349 WeakPolarHBondContact O-CB 3.39Å; G345-A349 PolarHBondContact O-N 3.07Å; L346-A349 PolarHBondContact O-N 2.85Å; A349-A353 VanDerWaalsContact O-CB 3.26Å; A349-A353 WeakPolarHBondContact O-CB 3.48Å; A349-A353 PolarHBondContact O-N 3.46Å
350	Y	88.9	Confident	88.6	Confident	114 Å²	114	45.2 Å²	45.2	45%	0.447	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-45.1	176.4	179.9	-105.5	0	0	0	111.9	L346 V348 V352 A353 V354 L1017	L346-Y350 WeakPolarHBondContact O-CB 3.25Å; L346-Y350 PolarHBondContact O-N 3.47Å; V348-Y350 VanDerWaalsContact C-N 3.35Å; V348-Y350 PolarHBondContact O-N 3.28Å; Y350-V352 PolarHBondContact O-N 2.85Å; Y350-A353 PolarHBondContact O-N 2.97Å; Y350-V354 HydrophobicContact CD2-CG1 4.07Å; Y350-V354 HydrophobicContact CE1-CG1 4.24Å; Y350-V354 HydrophobicContact CE1-CG2 4.31Å; Y350-V354 HydrophobicContact CE2-CG1 3.64Å; Y350-V354 WeakPolarHBondContact O-CG2 3.17Å; Y350-V354 PolarHBondContact O-N 3.43Å; Y350-L1017 HydrophobicContact CE2-CD1 4.25Å
351	G	89.6	Confident	88.6	Confident	10 Å²	10	46.9 Å²	46.9	10%	0.103	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-44.7	-179.8	0	0	0	0	0	113.8	A347 V348 N355 K356 L357	A347-G351 PolarHBondContact O-N 3.14Å; V348-G351 PolarHBondContact O-N 3.34Å; V348-G351 VanDerWaalsContact O-N 3.14Å; G351-N355 PolarHBondContact O-N 3.49Å; G351-K356 PolarHBondContact O-N 3.12Å; G351-L357 PolarHBondContact O-N 3.33Å
352	V	91.3	Very high	88.7	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.018	24%	0.242	C	C	.	.	H	α-helix	trans	-65.5	-47.5	174.1	171.9	0	0	0	0	110	P309 I312 W324 V348 Y350 V354 N355 L357	P309-V352 HydrophobicContact CB-CG1 4.21Å; I312-V352 HydrophobicContact CD1-CB 4.07Å; I312-V352 HydrophobicContact CD1-CG1 3.87Å; W324-V352 HydrophobicContact CH2-CG1 4.19Å; W324-V352 HydrophobicContact CZ2-CG1 3.65Å; V348-V352 HydrophobicContact CG1-CG2 4.31Å; V348-V352 WeakPolarHBondContact O-CG2 3.29Å; V348-V352 PolarHBondContact O-N 2.99Å; Y350-V352 PolarHBondContact O-N 2.85Å; V352-V354 PolarHBondContact O-N 2.96Å; V352-N355 PolarHBondContact O-N 2.87Å; V352-L357 WeakPolarHBondContact CG2-O 3.35Å
353	A	88.6	Confident	88.8	Confident	14 Å²	14	43.5 Å²	43.5	12%	0.116	25%	0.246	C	C	.	.	H	α-helix	trans	-58.7	-43.5	178.9	0	0	0	0	0	112.6	I312 K313 A349 Y350 N355	I312-A353 HydrophobicContact CB-CB 4.34Å; I312-A353 HydrophobicContact CG2-CB 3.91Å; K313-A353 WeakPolarHBondContact CE-O 3.48Å; K313-A353 HydrophobicContact CG-CB 4.13Å; K313-A353 PolarHBondContact NZ-O 3.1Å; K313-A353 VanDerWaalsContact NZ-O 3.13Å; A349-A353 VanDerWaalsContact O-CB 3.26Å; A349-A353 WeakPolarHBondContact O-CB 3.48Å; A349-A353 PolarHBondContact O-N 3.46Å; Y350-A353 PolarHBondContact O-N 2.97Å; A353-N355 PolarHBondContact O-N 3.13Å
354	V	88.9	Confident	88.9	Confident	52 Å²	52	45.5 Å²	45.5	32%	0.315	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	10.4	178.6	-54.9	0	0	0	0	114.2	Y350 V352 K356	Y350-V354 HydrophobicContact CD2-CG1 4.07Å; Y350-V354 HydrophobicContact CE1-CG1 4.24Å; Y350-V354 HydrophobicContact CE1-CG2 4.31Å; Y350-V354 HydrophobicContact CE2-CG1 3.64Å; Y350-V354 WeakPolarHBondContact O-CG2 3.17Å; Y350-V354 PolarHBondContact O-N 3.43Å; V352-V354 PolarHBondContact O-N 2.96Å; V354-K356 HydrophobicContact CG2-CB 4.08Å; V354-K356 HydrophobicContact CG2-CD 3.64Å; V354-K356 HydrophobicContact CG2-CG 3.86Å; V354-K356 PolarHBondContact O-N 2.99Å
355	N	87.1	Confident	89	Confident	88 Å²	88	41.7 Å²	41.7	47%	0.471	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	54.7	-176.6	-165.9	19.9	0	0	0	113.2	G351 V352 A353	G351-N355 PolarHBondContact O-N 3.49Å; V352-N355 PolarHBondContact O-N 2.87Å; A353-N355 PolarHBondContact O-N 3.13Å
356	K	83.9	Confident	89.1	Confident	137 Å²	137	41.9 Å²	41.9	60%	0.596	24%	0.236	S	C	*	.			trans	-128	-4.6	174.6	-66.9	175.6	-154.7	153.1	0	113.5	G351 V354	G351-K356 PolarHBondContact O-N 3.12Å; V354-K356 HydrophobicContact CG2-CB 4.08Å; V354-K356 HydrophobicContact CG2-CD 3.64Å; V354-K356 HydrophobicContact CG2-CG 3.86Å; V354-K356 PolarHBondContact O-N 2.99Å
357	L	86	Confident	89.2	Confident	18 Å²	18	46.8 Å²	46.8	9%	0.094	26%	0.258	C	S	.	.			trans	-137.6	123.8	179.7	-174.3	68.6	0	0	0	108.5	Y340 V348 G351 V352 L428	Y340-L357 HydrophobicContact CD1-CD1 4.23Å; Y340-L357 HydrophobicContact CD1-CD2 3.89Å; Y340-L357 HydrophobicContact CD1-CG 4.08Å; Y340-L357 HydrophobicContact CE1-CD1 3.99Å; Y340-L357 HydrophobicContact CE1-CD2 3.79Å; Y340-L357 HydrophobicContact CE1-CG 3.58Å; V348-L357 HydrophobicContact CB-CD2 4.31Å; V348-L357 HydrophobicContact CG1-CD2 4.4Å; V348-L357 HydrophobicContact CG2-CD2 4.07Å; G351-L357 PolarHBondContact O-N 3.33Å; V352-L357 WeakPolarHBondContact CG2-O 3.35Å; L357-L428 HydrophobicContact CD1-CD1 3.79Å; L357-L428 HydrophobicContact CD1-CD2 4.03Å
358	T	89.3	Confident	89.4	Confident	67 Å²	67	48.4 Å²	48.4	41%	0.411	27%	0.266	S	S	.	.			trans	-131.5	166	167.6	49.3	0	0	0	0	107.2
359	L	92.9	Very high	89.5	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-70.6	136	171	-72.6	168.3	0	0	0	109.3	V328 W331 P339 Y340 I361 W377 F425	V328-L359 HydrophobicContact CB-CD1 4.3Å; V328-L359 HydrophobicContact CG1-CD1 3.85Å; V328-L359 HydrophobicContact CG2-CD1 4.02Å; W331-L359 HydrophobicContact CB-CD1 4.26Å; W331-L359 HydrophobicContact CD2-CB 4.31Å; W331-L359 HydrophobicContact CD2-CD1 3.88Å; W331-L359 HydrophobicContact CD2-CD2 4.39Å; W331-L359 HydrophobicContact CD2-CG 4.42Å; W331-L359 HydrophobicContact CE3-CD1 4.02Å; W331-L359 HydrophobicContact CE3-CD2 4.4Å; W331-L359 HydrophobicContact CG-CB 4.31Å; W331-L359 HydrophobicContact CG-CD1 4Å; W331-L359 HydrophobicContact CH2-CD2 4.22Å; W331-L359 HydrophobicContact CZ2-CD2 4.17Å; W331-L359 HydrophobicContact CZ3-CD2 4.33Å; P339-L359 HydrophobicContact CB-CD1 4.23Å; P339-L359 HydrophobicContact CB-CD2 4.1Å; Y340-L359 HydrophobicContact CD1-CD2 3.78Å; Y340-L359 HydrophobicContact CD2-CD2 4.02Å; Y340-L359 HydrophobicContact CE1-CD2 3.62Å; Y340-L359 HydrophobicContact CE1-CG 3.95Å; Y340-L359 HydrophobicContact CE2-CD2 3.88Å; Y340-L359 HydrophobicContact CE2-CG 4.01Å; Y340-L359 HydrophobicContact CG-CD2 3.99Å; Y340-L359 PolarHBondContact OH-N 2.85Å; L359-I361 PolarHBondContact O-N 3.2Å; L359-W377 HydrophobicContact CB-CH2 3.69Å; L359-W377 HydrophobicContact CB-CZ2 4.22Å; L359-W377 HydrophobicContact CB-CZ3 4.14Å; L359-W377 HydrophobicContact CD1-CH2 4.17Å; L359-W377 HydrophobicContact CD1-CZ2 3.95Å; L359-F425 HydrophobicContact CD2-CZ 4.2Å
360	P	91.9	Very high	89.7	Confident	21 Å²	21	49.2 Å²	49.2	14%	0.136	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-72	125.4	177.1	28.8	-32.6	0	0	0	110	W331 I421 M424 F425	W331-P360 PolarHBondContact NE1-O 3.47Å; P360-I421 HydrophobicContact CG-CG1 4.47Å; P360-M424 HydrophobicContact CB-CE 3.52Å; P360-M424 HydrophobicContact CB-SD 3.47Å; P360-M424 WeakPolarHBondContact CB-SD 3.27Å; P360-M424 HydrophobicContact CG-CB 4.36Å; P360-M424 HydrophobicContact CG-CE 4.03Å; P360-M424 HydrophobicContact CG-SD 4.25Å; P360-F425 HydrophobicContact CG-CE1 4.22Å
361	I	93.6	Very high	90	Very high	41 Å²	41	48.3 Å²	48.3	21%	0.21	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-82.3	123.8	168.5	-59.8	176.3	0	0	0	107.1	L359 C365 A370 M373 E374 W377	L359-I361 PolarHBondContact O-N 3.2Å; I361-C365 HydrophobicContact CG2-CB 3.81Å; I361-A370 HydrophobicContact CG2-CB 3.81Å; I361-M373 HydrophobicContact CD1-CB 4.01Å; I361-M373 HydrophobicContact CD1-CE 4.28Å; I361-M373 HydrophobicContact CG1-CE 4.07Å; I361-M373 HydrophobicContact CG2-CE 3.92Å; I361-E374 HydrophobicContact CD1-CG 3.66Å; I361-W377 HydrophobicContact CD1-CZ3 4.06Å; I361-W377 HydrophobicContact CG1-CZ3 3.87Å
362	P	91.6	Very high	90.3	Very high	6 Å²	6	47.9 Å²	47.9	4%	0.039	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-60.5	143.8	-178.3	-26	35.2	0	0	0	113.1	T364 C365 W417 E420 I421	P362-T364 PolarHBondContact O-N 2.65Å; P362-C365 HydrophobicContact CB-CB 4.47Å; P362-C365 WeakPolarHBondContact O-CB 3.43Å; P362-C365 PolarHBondContact O-N 3.42Å; P362-W417 HydrophobicContact CB-CB 3.95Å; P362-W417 HydrophobicContact CB-CD2 4.09Å; P362-W417 HydrophobicContact CB-CG 3.49Å; P362-W417 VanDerWaalsContact CB-CG 3.49Å; P362-W417 HydrophobicContact CG-CB 3.78Å; P362-W417 HydrophobicContact CG-CD2 4.1Å; P362-W417 HydrophobicContact CG-CG 3.66Å; P362-E420 WeakPolarHBondContact CA-OE1 3.38Å; P362-I421 HydrophobicContact CG-CD1 3.88Å; P362-I421 HydrophobicContact CG-CG1 4.2Å
363	S	88	Confident	90.6	Very high	97 Å²	97	47.8 Å²	47.8	68%	0.678	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.6	-175.1	66.8	0	0	0	0	115.4	E420	S363-E420 WeakPolarHBondContact CB-OE2 3.24Å; S363-E420 PolarHBondContact N-OE1 2.99Å; S363-E420 PolarHBondContact N-OE2 2.81Å; S363-E420 PolarHBondContact OG-OE2 2.97Å
364	T	88.7	Confident	90.9	Very high	71 Å²	71	53 Å²	53	44%	0.436	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	16.4	178.1	57.7	0	0	0	0	113.3	P362 M413 W417	P362-T364 PolarHBondContact O-N 2.65Å; T364-M413 WeakPolarHBondContact O-CE 3.25Å; T364-W417 PolarHBondContact OG1-NE1 2.89Å
365	C	89.6	Confident	91.3	Very high	16 Å²	16	53.4 Å²	53.4	11%	0.108	29%	0.285	C	S	.	.	S	Bend	trans	-61.6	136	170.5	-164.4	0	0	0	0	110.2	I361 P362 E367 W417	I361-C365 HydrophobicContact CG2-CB 3.81Å; P362-C365 HydrophobicContact CB-CB 4.47Å; P362-C365 WeakPolarHBondContact O-CB 3.43Å; P362-C365 PolarHBondContact O-N 3.42Å; C365-E367 PolarHBondContact O-N 3.27Å; C365-W417 HydrophobicContact CB-CZ2 4.47Å
366	P	88.8	Confident	91.8	Very high	31 Å²	31	49.2 Å²	49.2	20%	0.201	26%	0.263	C	S	.	.			trans	-59.9	129.4	178.2	-22.8	32.9	0	0	0	111.5	P368 F369 A370 M405	P366-P368 VanDerWaalsContact C-N 3.31Å; P366-P368 VanDerWaalsContact O-N 3.09Å; P366-F369 HydrophobicContact CB-CD2 4.15Å; P366-F369 HydrophobicContact CG-CD2 4.16Å; P366-F369 PolarHBondContact O-N 3.46Å; P366-A370 PolarHBondContact O-N 3.21Å; P366-A370 VanDerWaalsContact O-N 3.14Å; P366-M405 HydrophobicContact CG-CE 3.89Å; P366-M405 HydrophobicContact CG-SD 4.23Å
367	E	89.4	Confident	92.5	Very high	160 Å²	160	43.7 Å²	43.7	75%	0.748	24%	0.238	S	C	*	.	H	α-helix	trans	-45.3	-42.4	-175	178.9	-178.4	-174.6	0	0	114.6	C365 F369 A370 K371	C365-E367 PolarHBondContact O-N 3.27Å; E367-F369 VanDerWaalsContact C-N 3.35Å; E367-F369 PolarHBondContact O-N 3.07Å; E367-A370 PolarHBondContact O-N 3.45Å; E367-K371 VanDerWaalsContact O-CB 3.31Å; E367-K371 WeakPolarHBondContact O-CB 3.25Å; E367-K371 PolarHBondContact O-N 2.96Å
368	P	91.3	Very high	92.9	Very high	62 Å²	62	45.9 Å²	45.9	40%	0.403	25%	0.25	S	S	.	.	H	α-helix	trans	-61	-36.6	176.5	-26.7	37.4	0	0	0	114.7	P366 L372 I397	P366-P368 VanDerWaalsContact C-N 3.31Å; P366-P368 VanDerWaalsContact O-N 3.09Å; P368-L372 VanDerWaalsContact O-CB 3.31Å; P368-L372 WeakPolarHBondContact O-CB 3.11Å; P368-L372 PolarHBondContact O-N 3.37Å; P368-L372 VanDerWaalsContact O-N 3.13Å; P368-I397 HydrophobicContact CB-CD1 3.76Å; P368-I397 HydrophobicContact CB-CG1 3.57Å
369	F	91.6	Very high	93.1	Very high	6 Å²	6	45.6 Å²	45.6	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-74.9	-40.6	175.9	-77.3	-63.6	0	0	0	111.7	V234 L330 L334 P366 E367 L372 M373 I397 V401	V234-F369 HydrophobicContact CG2-CE1 4.43Å; V234-F369 HydrophobicContact CG2-CZ 3.72Å; L330-F369 HydrophobicContact CD1-CD1 4.21Å; L330-F369 HydrophobicContact CD1-CE1 4.22Å; L334-F369 HydrophobicContact CD1-CB 3.82Å; L334-F369 HydrophobicContact CD1-CD1 3.81Å; L334-F369 HydrophobicContact CD1-CE1 4.44Å; L334-F369 HydrophobicContact CD1-CG 3.85Å; L334-F369 HydrophobicContact CD2-CD1 3.94Å; L334-F369 HydrophobicContact CD2-CD2 3.9Å; L334-F369 HydrophobicContact CD2-CE1 3.84Å; L334-F369 HydrophobicContact CD2-CE2 3.82Å; L334-F369 HydrophobicContact CD2-CG 3.95Å; L334-F369 HydrophobicContact CD2-CZ 3.76Å; L334-F369 HydrophobicContact CG-CD1 4.38Å; P366-F369 HydrophobicContact CB-CD2 4.15Å; P366-F369 HydrophobicContact CG-CD2 4.16Å; P366-F369 PolarHBondContact O-N 3.46Å; E367-F369 VanDerWaalsContact C-N 3.35Å; E367-F369 PolarHBondContact O-N 3.07Å; F369-L372 PolarHBondContact O-N 3.11Å; F369-M373 WeakPolarHBondContact O-CE 3.47Å; F369-M373 WeakPolarHBondContact O-CG 3.34Å; F369-M373 PolarHBondContact O-N 3.44Å; F369-I397 HydrophobicContact CD1-CD1 4.25Å; F369-I397 HydrophobicContact CD1-CG2 4.32Å; F369-I397 HydrophobicContact CD2-CG2 4.32Å; F369-I397 HydrophobicContact CE1-CD1 4.5Å; F369-I397 HydrophobicContact CE1-CG2 3.74Å; F369-I397 HydrophobicContact CE2-CG2 3.74Å; F369-I397 HydrophobicContact CZ-CG2 3.44Å; F369-I397 VanDerWaalsContact CZ-CG2 3.44Å; F369-V401 HydrophobicContact CE2-CG2 4.02Å; F369-V401 HydrophobicContact CZ-CG2 4.5Å
370	A	93.6	Very high	93.1	Very high	16 Å²	16	48.9 Å²	48.9	13%	0.132	26%	0.262	C	S	.	.	H	α-helix	trans	-57.6	-53.2	176.1	0	0	0	0	0	110.5	I361 P366 E367 L372 M373 E374	I361-A370 HydrophobicContact CG2-CB 3.81Å; P366-A370 PolarHBondContact O-N 3.21Å; P366-A370 VanDerWaalsContact O-N 3.14Å; E367-A370 PolarHBondContact O-N 3.45Å; A370-L372 PolarHBondContact O-N 3.32Å; A370-M373 PolarHBondContact O-N 3.32Å; A370-M373 VanDerWaalsContact O-N 3.16Å; A370-E374 WeakPolarHBondContact O-CG 3.42Å; A370-E374 PolarHBondContact O-N 2.89Å
371	K	94.8	Very high	93.1	Very high	95 Å²	95	49.2 Å²	49.2	41%	0.413	26%	0.264	S	S	.	.	H	α-helix	trans	-58.1	-42.9	177.2	-177.4	174.7	174.5	-65.2	0	112.8	E367 M373 E374 E375	E367-K371 VanDerWaalsContact O-CB 3.31Å; E367-K371 WeakPolarHBondContact O-CB 3.25Å; E367-K371 PolarHBondContact O-N 2.96Å; K371-M373 PolarHBondContact O-N 2.97Å; K371-E374 PolarHBondContact O-N 3.37Å; K371-E375 WeakPolarHBondContact CE-OE1 3.26Å; K371-E375 IonicContact NZ-OE1 3.31Å; K371-E375 PolarHBondContact NZ-OE1 2.97Å; K371-E375 IonicContact NZ-OE2 3.45Å; K371-E375 WeakPolarHBondContact O-CB 3.41Å; K371-E375 WeakPolarHBondContact O-CG 3.48Å; K371-E375 PolarHBondContact O-N 3.07Å
372	L	96	Very high	93.1	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-36.7	177.6	-178.4	58.7	0	0	0	112.4	L330 P368 F369 A370 C376 I390 Q393 L394 I397	L330-L372 HydrophobicContact CD2-CB 4.4Å; L330-L372 HydrophobicContact CD2-CD2 3.76Å; L330-L372 HydrophobicContact CD2-CG 3.89Å; P368-L372 VanDerWaalsContact O-CB 3.31Å; P368-L372 WeakPolarHBondContact O-CB 3.11Å; P368-L372 PolarHBondContact O-N 3.37Å; P368-L372 VanDerWaalsContact O-N 3.13Å; F369-L372 PolarHBondContact O-N 3.11Å; A370-L372 PolarHBondContact O-N 3.32Å; L372-C376 PolarHBondContact O-N 3.12Å; L372-C376 VanDerWaalsContact O-N 3.12Å; L372-C376 PolarHBondContact O-SG 3.1Å; L372-I390 HydrophobicContact CD1-CG1 4.2Å; L372-Q393 HydrophobicContact CD1-CB 4.34Å; L372-L394 HydrophobicContact CD2-CD2 3.77Å; L372-L394 HydrophobicContact CD2-CG 3.97Å; L372-I397 HydrophobicContact CD2-CD1 4.16Å
373	M	96.7	Very high	93.3	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-69	-42	173.1	-72.2	-176.5	-69.2	0	0	111.9	L330 W331 L334 I361 F369 A370 K371 C376 W377	L330-M373 HydrophobicContact CB-CG 4.41Å; L330-M373 HydrophobicContact CD2-CG 3.84Å; L330-M373 HydrophobicContact CG-CG 4.12Å; W331-M373 HydrophobicContact CB-SD 3.8Å; W331-M373 HydrophobicContact CG-SD 4.35Å; L334-M373 HydrophobicContact CD1-CE 3.86Å; L334-M373 HydrophobicContact CD1-SD 4.02Å; I361-M373 HydrophobicContact CD1-CB 4.01Å; I361-M373 HydrophobicContact CD1-CE 4.28Å; I361-M373 HydrophobicContact CG1-CE 4.07Å; I361-M373 HydrophobicContact CG2-CE 3.92Å; F369-M373 WeakPolarHBondContact O-CE 3.47Å; F369-M373 WeakPolarHBondContact O-CG 3.34Å; F369-M373 PolarHBondContact O-N 3.44Å; A370-M373 PolarHBondContact O-N 3.32Å; A370-M373 VanDerWaalsContact O-N 3.16Å; K371-M373 PolarHBondContact O-N 2.97Å; M373-C376 PolarHBondContact O-N 3.33Å; M373-W377 HydrophobicContact CB-CE3 4.25Å; M373-W377 HydrophobicContact CB-CH2 4.09Å; M373-W377 HydrophobicContact CB-CZ3 3.97Å; M373-W377 HydrophobicContact CG-CH2 4.39Å; M373-W377 PolarHBondContact O-N 2.99Å; M373-W377 VanDerWaalsContact O-N 3.09Å; M373-W377 HydrophobicContact SD-CH2 4.11Å
374	E	95.9	Very high	93.7	Very high	123 Å²	123	55.4 Å²	55.4	58%	0.575	29%	0.286	S	S	*	.	H	α-helix	trans	-60.3	-46.1	175.4	-71.3	176.6	170.7	0	0	111.9	I361 A370 K371 C376 W377 D378	I361-E374 HydrophobicContact CD1-CG 3.66Å; A370-E374 WeakPolarHBondContact O-CG 3.42Å; A370-E374 PolarHBondContact O-N 2.89Å; K371-E374 PolarHBondContact O-N 3.37Å; E374-C376 VanDerWaalsContact C-N 3.32Å; E374-C376 PolarHBondContact O-N 2.67Å; E374-W377 CarbonylContact O-C 3.45Å; E374-W377 PolarHBondContact O-N 3.22Å; E374-D378 PolarHBondContact O-N 3.28Å
375	E	97	Very high	94.1	Very high	62 Å²	62	52.8 Å²	52.8	29%	0.29	27%	0.27	S	S	.	.	H	α-helix	trans	-62.4	-35.8	175.3	-75.8	177.7	-174.5	0	0	112.7	K371 W377 P385 Q393	K371-E375 WeakPolarHBondContact CE-OE1 3.26Å; K371-E375 IonicContact NZ-OE1 3.31Å; K371-E375 PolarHBondContact NZ-OE1 2.97Å; K371-E375 IonicContact NZ-OE2 3.45Å; K371-E375 WeakPolarHBondContact O-CB 3.41Å; K371-E375 WeakPolarHBondContact O-CG 3.48Å; K371-E375 PolarHBondContact O-N 3.07Å; E375-W377 VanDerWaalsContact C-N 3.25Å; E375-W377 PolarHBondContact O-N 2.97Å; E375-P385 HydrophobicContact CB-CG 4.1Å; E375-P385 VanDerWaalsContact O-CD 3.25Å; E375-P385 WeakPolarHBondContact O-CD 3.19Å; E375-Q393 PolarHBondContact OE2-NE2 3.48Å
376	C	97.8	Very high	94.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-70.2	-21.1	173.2	-68	0	0	0	0	113.1	V323 W324 L372 M373 E374 R384	V323-C376 HydrophobicContact CG1-CB 4.11Å; W324-C376 WeakPolarHBondContact CA-O 3.43Å; L372-C376 PolarHBondContact O-N 3.12Å; L372-C376 VanDerWaalsContact O-N 3.12Å; L372-C376 PolarHBondContact O-SG 3.1Å; M373-C376 PolarHBondContact O-N 3.33Å; E374-C376 VanDerWaalsContact C-N 3.32Å; E374-C376 PolarHBondContact O-N 2.67Å; C376-R384 WeakPolarHBondContact O-CD 3.39Å
377	W	97.1	Very high	94.9	Very high	21 Å²	21	53 Å²	53	8%	0.08	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	19.8	-176.9	-62.1	-28.6	0	0	0	114.4	W324 G327 V328 W331 L359 I361 M373 E374 E375	W324-W377 AromaticContact CD2-CD1 3.8Å; W324-W377 HydrophobicContact CE3-CB 4.19Å; W324-W377 HydrophobicContact CE3-CG 4.48Å; W324-W377 HydrophobicContact CH2-CB 4.29Å; W324-W377 HydrophobicContact CZ3-CB 3.95Å; W324-W377 VanDerWaalsContact CZ3-O 3.23Å; W324-W377 WeakPolarHBondContact CZ3-O 3.27Å; W324-W377 PolarHBondContact O-NE1 3.26Å; G327-W377 WeakPolarHBondContact O-CZ2 3.29Å; V328-W377 HydrophobicContact CG2-CZ2 4.29Å; W331-W377 HydrophobicContact CB-CH2 3.98Å; W331-W377 HydrophobicContact CB-CZ2 4.11Å; W331-W377 AromaticContact CD1-CH2 3.91Å; W331-W377 HydrophobicContact CG-CH2 4.15Å; L359-W377 HydrophobicContact CB-CH2 3.69Å; L359-W377 HydrophobicContact CB-CZ2 4.22Å; L359-W377 HydrophobicContact CB-CZ3 4.14Å; L359-W377 HydrophobicContact CD1-CH2 4.17Å; L359-W377 HydrophobicContact CD1-CZ2 3.95Å; I361-W377 HydrophobicContact CD1-CZ3 4.06Å; I361-W377 HydrophobicContact CG1-CZ3 3.87Å; M373-W377 HydrophobicContact CB-CE3 4.25Å; M373-W377 HydrophobicContact CB-CH2 4.09Å; M373-W377 HydrophobicContact CB-CZ3 3.97Å; M373-W377 HydrophobicContact CG-CH2 4.39Å; M373-W377 PolarHBondContact O-N 2.99Å; M373-W377 VanDerWaalsContact O-N 3.09Å; M373-W377 HydrophobicContact SD-CH2 4.11Å; E374-W377 CarbonylContact O-C 3.45Å; E374-W377 PolarHBondContact O-N 3.22Å; E375-W377 VanDerWaalsContact C-N 3.25Å; E375-W377 PolarHBondContact O-N 2.97Å
378	D	96	Very high	95.3	Very high	64 Å²	64	47.2 Å²	47.2	34%	0.342	25%	0.249	S	C	.	.			trans	-57.8	146.1	169.5	-159.5	-67.2	0	0	0	110.9	E374 D380 V383 R384	E374-D378 PolarHBondContact O-N 3.28Å; D378-D380 VanDerWaalsContact C-N 3.3Å; D378-D380 PolarHBondContact OD1-N 2.98Å; D378-V383 HydrophobicContact CB-CB 4.43Å; D378-V383 HydrophobicContact CB-CG1 4.39Å; D378-R384 HydrophobicContact CB-CG 4.1Å; D378-R384 VanDerWaalsContact O-CZ 3.26Å; D378-R384 PolarHBondContact O-NE 3.43Å; D378-R384 PolarHBondContact O-NH2 2.92Å
379	Q	93.3	Very high	95.5	Very high	61 Å²	61	46.2 Å²	46.2	29%	0.285	24%	0.244	S	C	.	.	S	Bend	trans	-72.5	-24	178.9	-65.6	-61.9	-72.7	0	0	112.6
380	D	91.8	Very high	95.8	Very high	72 Å²	72	46 Å²	46	39%	0.385	24%	0.242	S	C	.	.	S	Bend	trans	-91.6	115.2	172.2	-168.7	-25.3	0	0	0	110.6	D378 H382 V383	D378-D380 VanDerWaalsContact C-N 3.3Å; D378-D380 PolarHBondContact OD1-N 2.98Å; D380-H382 PolarHBondContact O-N 3.28Å; D380-H382 VanDerWaalsContact O-N 3.1Å; D380-H382 WeakPolarHBondContact OD1-CB 3.49Å; D380-H382 IonicContact OD1-CD2 2.73Å; D380-H382 PolarHBondContact OD1-CD2 3.46Å; D380-H382 VanDerWaalsContact OD1-CD2 3.32Å; D380-H382 IonicContact OD1-CG 2.73Å; D380-H382 PolarHBondContact OD1-N 2.97Å; D380-V383 HydrophobicContact CB-CB 4.24Å; D380-V383 HydrophobicContact CB-CG2 3.83Å; D380-V383 PolarHBondContact O-N 3.26Å; D380-V383 VanDerWaalsContact O-N 3.14Å
381	P	93.3	Very high	96	Very high	29 Å²	29	46.1 Å²	46.1	19%	0.188	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-10.8	178.2	29.3	-36.7	0	0	0	114.4	E310	E310-P381 HydrophobicContact CG-CB 4.48Å; E310-P381 HydrophobicContact CG-CG 4.25Å
382	H	92.4	Very high	96	Very high	167 Å²	167	48.3 Å²	48.3	77%	0.773	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-17	175.7	-60.8	-80.6	0	0	0	113.7	D380	D380-H382 PolarHBondContact O-N 3.28Å; D380-H382 VanDerWaalsContact O-N 3.1Å; D380-H382 WeakPolarHBondContact OD1-CB 3.49Å; D380-H382 IonicContact OD1-CD2 2.73Å; D380-H382 PolarHBondContact OD1-CD2 3.46Å; D380-H382 VanDerWaalsContact OD1-CD2 3.32Å; D380-H382 IonicContact OD1-CG 2.73Å; D380-H382 PolarHBondContact OD1-N 2.97Å
383	V	95.6	Very high	95.9	Very high	92 Å²	92	50.2 Å²	50.2	56%	0.558	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-25.4	176.9	176.2	0	0	0	0	111.7	D378 D380	D378-V383 HydrophobicContact CB-CB 4.43Å; D378-V383 HydrophobicContact CB-CG1 4.39Å; D380-V383 HydrophobicContact CB-CB 4.24Å; D380-V383 HydrophobicContact CB-CG2 3.83Å; D380-V383 PolarHBondContact O-N 3.26Å; D380-V383 VanDerWaalsContact O-N 3.14Å
384	R	97.3	Very high	95.8	Very high	15 Å²	15	50.1 Å²	50.1	6%	0.057	26%	0.261	C	S	.	.	S	Bend	trans	-59.5	140.3	178.4	-60.6	177.1	-164.2	146.3	13.3	111.7	E310 G320 V323 C376 D378	E310-R384 IonicContact OE1-CZ 3.99Å; E310-R384 IonicContact OE1-NH1 3.45Å; E310-R384 PolarHBondContact OE1-NH1 3.13Å; E310-R384 IonicContact OE1-NH2 2.59Å; E310-R384 IonicContact OE2-CZ 3.32Å; E310-R384 IonicContact OE2-NH1 2.59Å; E310-R384 PolarHBondContact OE2-NH1 3.48Å; E310-R384 IonicContact OE2-NH2 3.69Å; E310-R384 PolarHBondContact OE2-NH2 3.16Å; G320-R384 VanDerWaalsContact C-NH1 3.25Å; G320-R384 VanDerWaalsContact O-CD 3.26Å; G320-R384 WeakPolarHBondContact O-CD 3.46Å; G320-R384 PolarHBondContact O-NH1 2.98Å; V323-R384 HydrophobicContact CG1-CB 3.95Å; C376-R384 WeakPolarHBondContact O-CD 3.39Å; D378-R384 HydrophobicContact CB-CG 4.1Å; D378-R384 VanDerWaalsContact O-CZ 3.26Å; D378-R384 PolarHBondContact O-NE 3.43Å; D378-R384 PolarHBondContact O-NH2 2.92Å
385	P	97.5	Very high	95.6	Very high	16 Å²	16	46.8 Å²	46.8	10%	0.104	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-69	148.8	-173.8	27.6	-34.7	0	0	0	112.7	V323 E375 C389 I390	V323-P385 WeakPolarHBondContact CG2-O 3.34Å; E375-P385 HydrophobicContact CB-CG 4.1Å; E375-P385 VanDerWaalsContact O-CD 3.25Å; E375-P385 WeakPolarHBondContact O-CD 3.19Å; P385-C389 HydrophobicContact CB-CB 4.17Å; P385-I390 HydrophobicContact CB-CG1 4.08Å; P385-I390 HydrophobicContact CG-CD1 4.21Å; P385-I390 HydrophobicContact CG-CG1 3.85Å
386	S	97.2	Very high	95.2	Very high	50 Å²	50	46.7 Å²	46.7	35%	0.35	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-68.6	157.5	171.4	65.8	0	0	0	0	111.5	S388 C389 I390	S386-S388 WeakPolarHBondContact CB-OG 3.36Å; S386-S388 PolarHBondContact O-N 3.14Å; S386-S388 PolarHBondContact OG-OG 3.38Å; S386-C389 PolarHBondContact O-N 2.96Å; S386-C389 PolarHBondContact OG-N 3.29Å; S386-C389 VanDerWaalsContact OG-N 3.15Å; S386-I390 WeakPolarHBondContact O-CG1 3.43Å; S386-I390 PolarHBondContact O-N 3.17Å
387	F	97.8	Very high	94.7	Very high	1 Å²	1	47 Å²	47	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-25.7	174.2	-79.2	-73.9	0	0	0	113.4	A241 M244 L245 H248 D322 V323 Y326 I390 L391	A241-F387 HydrophobicContact CB-CD1 4.14Å; M244-F387 HydrophobicContact CB-CD1 3.57Å; M244-F387 HydrophobicContact CB-CD2 3.71Å; M244-F387 HydrophobicContact CB-CE1 3.48Å; M244-F387 VanDerWaalsContact CB-CE1 3.48Å; M244-F387 HydrophobicContact CB-CE2 3.64Å; M244-F387 HydrophobicContact CB-CG 3.68Å; M244-F387 HydrophobicContact CB-CZ 3.52Å; M244-F387 HydrophobicContact CE-CE2 3.99Å; M244-F387 HydrophobicContact CE-CZ 4.23Å; M244-F387 HydrophobicContact CG-CD1 4.42Å; M244-F387 HydrophobicContact CG-CE1 3.86Å; M244-F387 HydrophobicContact CG-CE2 4.21Å; M244-F387 HydrophobicContact CG-CZ 3.74Å; L245-F387 HydrophobicContact CB-CB 3.92Å; L245-F387 HydrophobicContact CD1-CB 4.37Å; H248-F387 AromaticContact CE1-CD2 3.77Å; H248-F387 AromaticContact CE1-CE2 3.54Å; H248-F387 AromaticContact ND1-CD2 3.55Å; H248-F387 AromaticContact ND1-CE2 3.83Å; D322-F387 HydrophobicContact CB-CE2 4.33Å; V323-F387 HydrophobicContact CG2-CD2 4.02Å; V323-F387 HydrophobicContact CG2-CE2 3.54Å; V323-F387 HydrophobicContact CG2-CZ 3.9Å; Y326-F387 HydrophobicContact CD1-CE1 4.15Å; Y326-F387 AromaticContact CD2-CE1 3.78Å; Y326-F387 HydrophobicContact CD2-CE1 3.78Å; Y326-F387 HydrophobicContact CD2-CZ 4.5Å; Y326-F387 HydrophobicContact CE2-CE1 4.43Å; Y326-F387 AromaticContact CG-CE1 3.62Å; Y326-F387 HydrophobicContact CG-CE1 3.62Å; Y326-F387 HydrophobicContact CG-CZ 4.17Å; F387-I390 HydrophobicContact CD1-CD1 3.98Å; F387-I390 HydrophobicContact CE1-CD1 4.15Å; F387-I390 HydrophobicContact CG-CD1 4.46Å; F387-L391 WeakPolarHBondContact O-CB 3.38Å; F387-L391 WeakPolarHBondContact O-CD1 3.46Å; F387-L391 VanDerWaalsContact O-CG 3.28Å; F387-L391 WeakPolarHBondContact O-CG 3.39Å; F387-L391 PolarHBondContact O-N 3.44Å; F387-L391 VanDerWaalsContact O-N 3.07Å
388	S	96.6	Very high	94.2	Very high	38 Å²	38	49 Å²	49	27%	0.266	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-50.6	169	28.1	0	0	0	0	111.8	E249 S386 L391 E392	E249-S388 PolarHBondContact OE2-OG 3.5Å; S386-S388 WeakPolarHBondContact CB-OG 3.36Å; S386-S388 PolarHBondContact O-N 3.14Å; S386-S388 PolarHBondContact OG-OG 3.38Å; S388-L391 PolarHBondContact O-N 2.74Å; S388-E392 PolarHBondContact O-N 2.9Å
389	C	96.9	Very high	93.5	Very high	42 Å²	42	53.4 Å²	53.4	28%	0.284	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-40.3	175.3	-178.7	0	0	0	0	112.6	P385 S386 L391 E392 Q393	P385-C389 HydrophobicContact CB-CB 4.17Å; S386-C389 PolarHBondContact O-N 2.96Å; S386-C389 PolarHBondContact OG-N 3.29Å; S386-C389 VanDerWaalsContact OG-N 3.15Å; C389-L391 VanDerWaalsContact C-N 3.26Å; C389-L391 PolarHBondContact O-N 2.82Å; C389-E392 PolarHBondContact O-N 3.41Å; C389-Q393 WeakPolarHBondContact O-CG 3.32Å; C389-Q393 PolarHBondContact O-N 2.94Å
390	I	97.8	Very high	92.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.7	-40.3	175.2	-68.6	167.9	0	0	0	110.7	A241 V323 Y326 L372 P385 S386 F387 Q393 L394	A241-I390 HydrophobicContact CB-CG2 4.17Å; V323-I390 HydrophobicContact CG1-CD1 3.94Å; V323-I390 HydrophobicContact CG2-CD1 4.21Å; Y326-I390 HydrophobicContact CD1-CD1 4.27Å; Y326-I390 HydrophobicContact CD1-CG2 4.28Å; Y326-I390 HydrophobicContact CE1-CG2 3.61Å; L372-I390 HydrophobicContact CD1-CG1 4.2Å; P385-I390 HydrophobicContact CB-CG1 4.08Å; P385-I390 HydrophobicContact CG-CD1 4.21Å; P385-I390 HydrophobicContact CG-CG1 3.85Å; S386-I390 WeakPolarHBondContact O-CG1 3.43Å; S386-I390 PolarHBondContact O-N 3.17Å; F387-I390 HydrophobicContact CD1-CD1 3.98Å; F387-I390 HydrophobicContact CE1-CD1 4.15Å; F387-I390 HydrophobicContact CG-CD1 4.46Å; I390-Q393 PolarHBondContact O-N 2.84Å; I390-L394 HydrophobicContact CG2-CD1 3.68Å; I390-L394 HydrophobicContact CG2-CG 4.29Å; I390-L394 WeakPolarHBondContact O-CB 3.17Å; I390-L394 WeakPolarHBondContact O-CD1 3.39Å; I390-L394 WeakPolarHBondContact O-CG 3.38Å; I390-L394 PolarHBondContact O-N 3.4Å
391	L	96.5	Very high	92.1	Very high	20 Å²	20	49.7 Å²	49.7	11%	0.105	28%	0.28	C	S	.	.	H	α-helix	trans	-69.4	-36	177.7	-76.8	166.2	0	0	0	113.3	V238 A241 R242 L245 F387 S388 C389 S395	V238-L391 HydrophobicContact CB-CD2 4.42Å; V238-L391 HydrophobicContact CG1-CD2 3.95Å; A241-L391 HydrophobicContact CB-CD2 3.66Å; A241-L391 HydrophobicContact CB-CG 3.88Å; R242-L391 HydrophobicContact CG-CD1 3.9Å; R242-L391 HydrophobicContact CG-CD2 3.79Å; L245-L391 HydrophobicContact CB-CD1 4.18Å; L245-L391 HydrophobicContact CD2-CD1 3.73Å; F387-L391 WeakPolarHBondContact O-CB 3.38Å; F387-L391 WeakPolarHBondContact O-CD1 3.46Å; F387-L391 VanDerWaalsContact O-CG 3.28Å; F387-L391 WeakPolarHBondContact O-CG 3.39Å; F387-L391 PolarHBondContact O-N 3.44Å; F387-L391 VanDerWaalsContact O-N 3.07Å; S388-L391 PolarHBondContact O-N 2.74Å; C389-L391 VanDerWaalsContact C-N 3.26Å; C389-L391 PolarHBondContact O-N 2.82Å; L391-S395 WeakPolarHBondContact O-CB 3.36Å; L391-S395 PolarHBondContact O-N 3.26Å; L391-S395 PolarHBondContact O-OG 2.97Å
392	E	95	Very high	90.9	Very high	141 Å²	141	54.6 Å²	54.6	66%	0.659	30%	0.302	S	S	*	.	H	α-helix	trans	-62.9	-47.8	172.1	-67.3	175.5	167.1	0	0	110.9	S388 C389 S395 A396	S388-E392 PolarHBondContact O-N 2.9Å; C389-E392 PolarHBondContact O-N 3.41Å; E392-S395 PolarHBondContact O-N 3Å; E392-A396 PolarHBondContact O-N 3.33Å
393	Q	95.3	Very high	89.9	Confident	39 Å²	39	50.8 Å²	50.8	18%	0.182	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-47.2	176.3	-67.6	-163.3	62	0	0	111.9	L372 E375 C389 I390 S395 A396 I397	L372-Q393 HydrophobicContact CD1-CB 4.34Å; E375-Q393 PolarHBondContact OE2-NE2 3.48Å; C389-Q393 WeakPolarHBondContact O-CG 3.32Å; C389-Q393 PolarHBondContact O-N 2.94Å; I390-Q393 PolarHBondContact O-N 2.84Å; Q393-S395 VanDerWaalsContact C-N 3.28Å; Q393-S395 PolarHBondContact O-N 2.9Å; Q393-A396 PolarHBondContact O-N 3.3Å; Q393-I397 VanDerWaalsContact O-CG1 3.25Å; Q393-I397 WeakPolarHBondContact O-CG1 3.32Å; Q393-I397 PolarHBondContact O-N 2.78Å
394	L	94.4	Very high	88.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-32.2	178.1	-72.4	166.6	0	0	0	113.2	A237 V238 A241 Y326 L372 I390 I397 E398	A237-L394 HydrophobicContact CB-CD1 4.34Å; A237-L394 HydrophobicContact CB-CD2 4.07Å; V238-L394 HydrophobicContact CG2-CB 3.69Å; V238-L394 HydrophobicContact CG2-CD1 4.15Å; V238-L394 HydrophobicContact CG2-CG 4.47Å; A241-L394 HydrophobicContact CB-CD1 4.12Å; Y326-L394 VanDerWaalsContact OH-CD1 3.26Å; Y326-L394 WeakPolarHBondContact OH-CD1 3.18Å; L372-L394 HydrophobicContact CD2-CD2 3.77Å; L372-L394 HydrophobicContact CD2-CG 3.97Å; I390-L394 HydrophobicContact CG2-CD1 3.68Å; I390-L394 HydrophobicContact CG2-CG 4.29Å; I390-L394 WeakPolarHBondContact O-CB 3.17Å; I390-L394 WeakPolarHBondContact O-CD1 3.39Å; I390-L394 WeakPolarHBondContact O-CG 3.38Å; I390-L394 PolarHBondContact O-N 3.4Å; L394-I397 PolarHBondContact O-N 3.35Å; L394-E398 PolarHBondContact O-N 3.15Å
395	S	90.5	Very high	87.5	Confident	52 Å²	52	52.3 Å²	52.3	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-68.4	-43.8	176.9	-56.9	0	0	0	0	111.1	L391 E392 Q393 I397 E398 E399	L391-S395 WeakPolarHBondContact O-CB 3.36Å; L391-S395 PolarHBondContact O-N 3.26Å; L391-S395 PolarHBondContact O-OG 2.97Å; E392-S395 PolarHBondContact O-N 3Å; Q393-S395 VanDerWaalsContact C-N 3.28Å; Q393-S395 PolarHBondContact O-N 2.9Å; S395-I397 VanDerWaalsContact C-N 3.27Å; S395-I397 PolarHBondContact O-N 3.43Å; S395-E398 WeakPolarHBondContact O-CB 3.47Å; S395-E398 PolarHBondContact O-N 3.4Å; S395-E399 PolarHBondContact O-N 3.27Å
396	A	89.4	Confident	86.5	Confident	60 Å²	60	55.6 Å²	55.6	50%	0.496	33%	0.33	S	S	.	.	H	α-helix	trans	-63.9	-32.9	172.7	0	0	0	0	0	112.5	E392 Q393 A400	E392-A396 PolarHBondContact O-N 3.33Å; Q393-A396 PolarHBondContact O-N 3.3Å; A396-A400 WeakPolarHBondContact O-CB 3.43Å; A396-A400 PolarHBondContact O-N 2.82Å; A396-A400 VanDerWaalsContact O-N 3.1Å
397	I	87.8	Confident	85.3	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.036	33%	0.333	C	S	.	.	H	α-helix	trans	-68.5	-39.5	172.9	-67.8	170.2	0	0	0	111.4	V234 P368 F369 L372 Q393 L394 S395 E399 A400 V401	V234-I397 HydrophobicContact CG2-CG2 4.27Å; P368-I397 HydrophobicContact CB-CD1 3.76Å; P368-I397 HydrophobicContact CB-CG1 3.57Å; F369-I397 HydrophobicContact CD1-CD1 4.25Å; F369-I397 HydrophobicContact CD1-CG2 4.32Å; F369-I397 HydrophobicContact CD2-CG2 4.32Å; F369-I397 HydrophobicContact CE1-CD1 4.5Å; F369-I397 HydrophobicContact CE1-CG2 3.74Å; F369-I397 HydrophobicContact CE2-CG2 3.74Å; F369-I397 HydrophobicContact CZ-CG2 3.44Å; F369-I397 VanDerWaalsContact CZ-CG2 3.44Å; L372-I397 HydrophobicContact CD2-CD1 4.16Å; Q393-I397 VanDerWaalsContact O-CG1 3.25Å; Q393-I397 WeakPolarHBondContact O-CG1 3.32Å; Q393-I397 PolarHBondContact O-N 2.78Å; L394-I397 PolarHBondContact O-N 3.35Å; S395-I397 VanDerWaalsContact C-N 3.27Å; S395-I397 PolarHBondContact O-N 3.43Å; I397-E399 PolarHBondContact O-N 2.98Å; I397-A400 PolarHBondContact O-N 3.38Å; I397-V401 HydrophobicContact CG2-CG2 3.79Å; I397-V401 VanDerWaalsContact O-CB 3.27Å; I397-V401 WeakPolarHBondContact O-CB 3.33Å; I397-V401 WeakPolarHBondContact O-CG2 3.45Å; I397-V401 PolarHBondContact O-N 3.39Å
398	E	84.9	Confident	84.1	Confident	64 Å²	64	63.9 Å²	63.9	30%	0.299	37%	0.367	S	S	.	.	H	α-helix	trans	-58.8	-47.3	176.9	-162.4	166.1	-158.7	0	0	111.1	V234 L394 S395 M402	V234-E398 HydrophobicContact CG1-CB 3.64Å; V234-E398 HydrophobicContact CG1-CG 3.82Å; L394-E398 PolarHBondContact O-N 3.15Å; S395-E398 WeakPolarHBondContact O-CB 3.47Å; S395-E398 PolarHBondContact O-N 3.4Å; E398-M402 VanDerWaalsContact O-CB 3.27Å; E398-M402 WeakPolarHBondContact O-CB 3.36Å; E398-M402 WeakPolarHBondContact O-CG 3.44Å; E398-M402 PolarHBondContact O-N 2.95Å; E398-M402 VanDerWaalsContact O-N 3.08Å
399	E	82.1	Confident	83.4	Confident	156 Å²	156	64.8 Å²	64.8	73%	0.729	37%	0.374	S	S	*	.	H	α-helix	trans	-61.1	-48.4	175.3	-65.8	-174.1	170.2	0	0	112.2	S395 I397 A403	S395-E399 PolarHBondContact O-N 3.27Å; I397-E399 PolarHBondContact O-N 2.98Å; E399-A403 WeakPolarHBondContact O-CB 3.49Å; E399-A403 PolarHBondContact O-N 2.93Å; E399-A403 VanDerWaalsContact O-N 3.12Å
400	A	80.8	Confident	82.8	Confident	45 Å²	45	62.9 Å²	62.9	37%	0.372	36%	0.361	S	S	.	.	H	α-helix	trans	-65.5	-44.1	-178.2	0	0	0	0	0	112.8	A396 I397 A403 T404	A396-A400 WeakPolarHBondContact O-CB 3.43Å; A396-A400 PolarHBondContact O-N 2.82Å; A396-A400 VanDerWaalsContact O-N 3.1Å; I397-A400 PolarHBondContact O-N 3.38Å; A400-A403 PolarHBondContact O-N 3.44Å; A400-T404 WeakPolarHBondContact O-CB 3.31Å; A400-T404 WeakPolarHBondContact O-CG2 3.39Å; A400-T404 PolarHBondContact O-N 2.98Å; A400-T404 VanDerWaalsContact O-N 3.14Å; A400-T404 PolarHBondContact O-OG1 3.25Å
401	V	74.6	Confident	82.2	Confident	10 Å²	10	63.9 Å²	63.9	6%	0.061	37%	0.365	C	S	.	.	H	α-helix	trans	-65.4	-44.7	179.6	168.9	0	0	0	0	110.8	P230 F369 I397 A403 T404 M405	P230-V401 HydrophobicContact CB-CG1 3.99Å; P230-V401 HydrophobicContact CG-CG1 4.39Å; F369-V401 HydrophobicContact CE2-CG2 4.02Å; F369-V401 HydrophobicContact CZ-CG2 4.5Å; I397-V401 HydrophobicContact CG2-CG2 3.79Å; I397-V401 VanDerWaalsContact O-CB 3.27Å; I397-V401 WeakPolarHBondContact O-CB 3.33Å; I397-V401 WeakPolarHBondContact O-CG2 3.45Å; I397-V401 PolarHBondContact O-N 3.39Å; V401-A403 PolarHBondContact O-N 3.37Å; V401-T404 PolarHBondContact O-N 3.39Å; V401-M405 HydrophobicContact CG1-CE 4.07Å; V401-M405 HydrophobicContact CG2-CE 4.07Å; V401-M405 PolarHBondContact O-N 3.11Å; V401-M405 VanDerWaalsContact O-N 3.07Å
402	M	69.2	Low	81.8	Confident	132 Å²	132	66 Å²	66	65%	0.65	38%	0.381	S	S	*	.	H	α-helix	trans	-63.6	-29.4	177.4	-73.2	-71.2	-75.1	0	0	113	H231 E398	H231-M402 HydrophobicContact CB-SD 3.53Å; H231-M402 VanDerWaalsContact CB-SD 3.53Å; E398-M402 VanDerWaalsContact O-CB 3.27Å; E398-M402 WeakPolarHBondContact O-CB 3.36Å; E398-M402 WeakPolarHBondContact O-CG 3.44Å; E398-M402 PolarHBondContact O-N 2.95Å; E398-M402 VanDerWaalsContact O-N 3.08Å
403	A	71.4	Confident	81.4	Confident	86 Å²	86	61.1 Å²	61.1	71%	0.711	36%	0.36	S	S	*	.	H	α-helix	trans	-82.8	-23	177.5	0	0	0	0	0	114.5	E399 A400 V401	E399-A403 WeakPolarHBondContact O-CB 3.49Å; E399-A403 PolarHBondContact O-N 2.93Å; E399-A403 VanDerWaalsContact O-N 3.12Å; A400-A403 PolarHBondContact O-N 3.44Å; V401-A403 PolarHBondContact O-N 3.37Å
404	T	71.3	Confident	81.1	Confident	100 Å²	100	59.5 Å²	59.5	61%	0.613	35%	0.352	S	S	*	.	H	α-helix	trans	-124.2	-23.7	-164.4	60	0	0	0	0	116.8	A400 V401 P406	A400-T404 WeakPolarHBondContact O-CB 3.31Å; A400-T404 WeakPolarHBondContact O-CG2 3.39Å; A400-T404 PolarHBondContact O-N 2.98Å; A400-T404 VanDerWaalsContact O-N 3.14Å; A400-T404 PolarHBondContact O-OG1 3.25Å; V401-T404 PolarHBondContact O-N 3.39Å; T404-P406 WeakPolarHBondContact O-CD 3.5Å
405	M	71	Confident	80.9	Confident	39 Å²	39	62 Å²	62	19%	0.192	37%	0.365	C	S	.	.			trans	-115.7	108.6	-171.9	-71.4	-151.3	-69.2	0	0	114.5	P366 V401 F410 M413	P366-M405 HydrophobicContact CG-CE 3.89Å; P366-M405 HydrophobicContact CG-SD 4.23Å; V401-M405 HydrophobicContact CG1-CE 4.07Å; V401-M405 HydrophobicContact CG2-CE 4.07Å; V401-M405 PolarHBondContact O-N 3.11Å; V401-M405 VanDerWaalsContact O-N 3.07Å; M405-F410 HydrophobicContact CE-CD2 4.05Å; M405-M413 HydrophobicContact SD-CE 4.36Å
406	P	75.1	Confident	80.9	Confident	86 Å²	86	63.9 Å²	63.9	56%	0.558	37%	0.371	S	S	*	.			trans	-60.6	142	164.6	-21.7	33.7	0	0	0	111.9	T404 D408 S409 F410	T404-P406 WeakPolarHBondContact O-CD 3.5Å; P406-D408 VanDerWaalsContact C-N 3.31Å; P406-D408 PolarHBondContact O-N 3.04Å; P406-S409 WeakPolarHBondContact O-CB 3.42Å; P406-S409 PolarHBondContact O-N 3.19Å; P406-S409 VanDerWaalsContact O-N 3.1Å; P406-F410 PolarHBondContact O-N 3.12Å
407	Q	72.2	Confident	81.1	Confident	90 Å²	90	61.1 Å²	61.1	42%	0.421	35%	0.348	S	S	.	.	H	α-helix	trans	-60.1	-38.4	-173.9	-58.1	-175.4	16.1	0	0	112.9	S409 F410 H411	Q407-S409 VanDerWaalsContact C-N 3.34Å; Q407-S409 PolarHBondContact O-N 3.21Å; Q407-F410 PolarHBondContact O-N 2.87Å; Q407-H411 PolarHBondContact O-N 2.97Å; Q407-H411 PolarHBondContact O-ND1 3.38Å
408	D	73.6	Confident	81.3	Confident	134 Å²	134	63.4 Å²	63.4	72%	0.717	36%	0.356	S	S	*	.	H	α-helix	trans	-67.7	-34	178.8	-58	-51.7	0	0	0	112.6	P406 H411 S412	P406-D408 VanDerWaalsContact C-N 3.31Å; P406-D408 PolarHBondContact O-N 3.04Å; D408-H411 PolarHBondContact O-N 2.99Å; D408-S412 PolarHBondContact O-N 2.89Å
409	S	81.2	Confident	81.6	Confident	57 Å²	57	64.3 Å²	64.3	40%	0.399	37%	0.366	S	S	.	.	H	α-helix	trans	-65.7	-44	174.4	-165.9	0	0	0	0	110.8	P406 Q407 H411 S412 M413	P406-S409 WeakPolarHBondContact O-CB 3.42Å; P406-S409 PolarHBondContact O-N 3.19Å; P406-S409 VanDerWaalsContact O-N 3.1Å; Q407-S409 VanDerWaalsContact C-N 3.34Å; Q407-S409 PolarHBondContact O-N 3.21Å; S409-H411 PolarHBondContact O-N 3.16Å; S409-S412 PolarHBondContact O-N 3.45Å; S409-M413 VanDerWaalsContact O-CG 3.32Å; S409-M413 WeakPolarHBondContact O-CG 3.19Å; S409-M413 PolarHBondContact O-N 2.98Å
410	F	84.4	Confident	82.2	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.009	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-42.9	175.7	178.9	-98.9	0	0	0	111.8	P230 L233 M405 P406 Q407 S412 M413 Q414 W417	P230-F410 HydrophobicContact CB-CB 4.36Å; P230-F410 HydrophobicContact CB-CD1 3.86Å; P230-F410 HydrophobicContact CB-CD2 3.83Å; P230-F410 HydrophobicContact CB-CE1 4.08Å; P230-F410 HydrophobicContact CB-CE2 4.06Å; P230-F410 HydrophobicContact CB-CG 3.73Å; P230-F410 HydrophobicContact CB-CZ 4.18Å; P230-F410 HydrophobicContact CG-CB 3.91Å; P230-F410 HydrophobicContact CG-CD1 3.99Å; P230-F410 HydrophobicContact CG-CD2 4.32Å; P230-F410 HydrophobicContact CG-CG 3.8Å; L233-F410 HydrophobicContact CD1-CE1 3.67Å; L233-F410 HydrophobicContact CD1-CZ 3.65Å; M405-F410 HydrophobicContact CE-CD2 4.05Å; P406-F410 PolarHBondContact O-N 3.12Å; Q407-F410 PolarHBondContact O-N 2.87Å; F410-S412 PolarHBondContact O-N 2.84Å; F410-M413 PolarHBondContact O-N 3.5Å; F410-Q414 VanDerWaalsContact O-CB 3.31Å; F410-Q414 WeakPolarHBondContact O-CB 3.36Å; F410-Q414 PolarHBondContact O-N 3.5Å; F410-W417 HydrophobicContact CD2-CH2 4.43Å; F410-W417 AromaticContact CE2-CH2 3.92Å; F410-W417 HydrophobicContact CE2-CH2 3.92Å; F410-W417 AromaticContact CE2-CZ3 3.95Å; F410-W417 HydrophobicContact CE2-CZ3 3.95Å; F410-W417 HydrophobicContact CZ-CZ3 4.34Å
411	H	86.2	Confident	82.8	Confident	21 Å²	21	57 Å²	57	10%	0.097	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-35.8	177.2	-64.8	142.9	0	0	0	113.1	Q407 D408 S409 Q414 D415	Q407-H411 PolarHBondContact O-N 2.97Å; Q407-H411 PolarHBondContact O-ND1 3.38Å; D408-H411 PolarHBondContact O-N 2.99Å; S409-H411 PolarHBondContact O-N 3.16Å; H411-Q414 PolarHBondContact O-N 3.49Å; H411-D415 VanDerWaalsContact O-CG 3.24Å; H411-D415 PolarHBondContact O-N 3.06Å
412	S	88.1	Confident	83.6	Confident	64 Å²	64	59.8 Å²	59.8	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-64.4	-50.3	173	-166.7	0	0	0	0	111.1	D408 S409 F410 Q414 D415 D416	D408-S412 PolarHBondContact O-N 2.89Å; S409-S412 PolarHBondContact O-N 3.45Å; F410-S412 PolarHBondContact O-N 2.84Å; S412-Q414 VanDerWaalsContact C-N 3.25Å; S412-Q414 PolarHBondContact O-N 3.28Å; S412-D415 WeakPolarHBondContact O-CB 3.39Å; S412-D415 PolarHBondContact O-N 2.62Å; S412-D416 PolarHBondContact O-N 3.03Å
413	M	87	Confident	84.7	Confident	40 Å²	40	59.7 Å²	59.7	20%	0.197	33%	0.334	C	S	.	.	H	α-helix	trans	-57.6	-40.3	176.9	-69.1	164	59.6	0	0	111.4	T364 M405 S409 F410 D415 D416 W417	T364-M413 WeakPolarHBondContact O-CE 3.25Å; M405-M413 HydrophobicContact SD-CE 4.36Å; S409-M413 VanDerWaalsContact O-CG 3.32Å; S409-M413 WeakPolarHBondContact O-CG 3.19Å; S409-M413 PolarHBondContact O-N 2.98Å; F410-M413 PolarHBondContact O-N 3.5Å; M413-D415 PolarHBondContact O-N 2.87Å; M413-D416 PolarHBondContact O-N 3.14Å; M413-W417 HydrophobicContact CB-CZ2 4.03Å; M413-W417 HydrophobicContact CE-CZ2 3.79Å; M413-W417 WeakPolarHBondContact O-CB 3.44Å; M413-W417 PolarHBondContact O-N 3.29Å; M413-W417 PolarHBondContact O-NE1 3.18Å
414	Q	88.7	Confident	85.5	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.019	31%	0.313	C	S	.	.	H	α-helix	trans	-68.2	-31.6	176.7	-160.3	-172.2	54.9	0	0	113	L334 F410 H411 S412 W417 R418	L334-Q414 PolarHBondContact O-NE2 3.2Å; F410-Q414 VanDerWaalsContact O-CB 3.31Å; F410-Q414 WeakPolarHBondContact O-CB 3.36Å; F410-Q414 PolarHBondContact O-N 3.5Å; H411-Q414 PolarHBondContact O-N 3.49Å; S412-Q414 VanDerWaalsContact C-N 3.25Å; S412-Q414 PolarHBondContact O-N 3.28Å; Q414-W417 HydrophobicContact CB-CE3 4.3Å; Q414-W417 HydrophobicContact CG-CE3 4.23Å; Q414-R418 WeakPolarHBondContact O-CG 3.44Å; Q414-R418 PolarHBondContact O-N 3.36Å; Q414-R418 PolarHBondContact O-NH1 3.1Å
415	D	89.6	Confident	86.4	Confident	52 Å²	52	53.5 Å²	53.5	28%	0.278	28%	0.284	S	S	.	.	H	α-helix	trans	-67.5	-44.4	170.8	-68.8	-34.2	0	0	0	111	R227 H411 S412 M413 R418 V419	R227-D415 IonicContact CZ-OD1 3.63Å; R227-D415 IonicContact CZ-OD2 3.15Å; R227-D415 IonicContact NH1-OD1 3.67Å; R227-D415 IonicContact NH1-OD2 2.7Å; R227-D415 PolarHBondContact NH1-OD2 2.86Å; R227-D415 IonicContact NH2-OD1 2.74Å; R227-D415 PolarHBondContact NH2-OD1 2.93Å; R227-D415 IonicContact NH2-OD2 2.7Å; R227-D415 PolarHBondContact NH2-OD2 2.99Å; H411-D415 VanDerWaalsContact O-CG 3.24Å; H411-D415 PolarHBondContact O-N 3.06Å; S412-D415 WeakPolarHBondContact O-CB 3.39Å; S412-D415 PolarHBondContact O-N 2.62Å; M413-D415 PolarHBondContact O-N 2.87Å; D415-R418 PolarHBondContact O-N 2.97Å; D415-R418 IonicContact OD1-NH1 2.68Å; D415-R418 PolarHBondContact OD1-NH1 2.67Å; D415-V419 PolarHBondContact O-N 2.74Å
416	D	91.4	Very high	87.3	Confident	93 Å²	93	55 Å²	55	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-61.9	-43.6	176.5	-62.8	-41.9	0	0	0	111.4	S412 M413 R418 V419 E420	S412-D416 PolarHBondContact O-N 3.03Å; M413-D416 PolarHBondContact O-N 3.14Å; D416-R418 VanDerWaalsContact C-N 3.29Å; D416-R418 PolarHBondContact O-N 3.28Å; D416-V419 WeakPolarHBondContact O-CB 3.43Å; D416-V419 PolarHBondContact O-N 3.46Å; D416-V419 VanDerWaalsContact O-N 3.1Å; D416-E420 PolarHBondContact O-N 2.84Å
417	W	92.9	Very high	88	Confident	1 Å²	1	56 Å²	56	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-58.6	-36.8	176.5	-64.1	-12.7	0	0	0	112.8	P362 T364 C365 F410 M413 Q414 V419 E420 I421	P362-W417 HydrophobicContact CB-CB 3.95Å; P362-W417 HydrophobicContact CB-CD2 4.09Å; P362-W417 HydrophobicContact CB-CG 3.49Å; P362-W417 VanDerWaalsContact CB-CG 3.49Å; P362-W417 HydrophobicContact CG-CB 3.78Å; P362-W417 HydrophobicContact CG-CD2 4.1Å; P362-W417 HydrophobicContact CG-CG 3.66Å; T364-W417 PolarHBondContact OG1-NE1 2.89Å; C365-W417 HydrophobicContact CB-CZ2 4.47Å; F410-W417 HydrophobicContact CD2-CH2 4.43Å; F410-W417 AromaticContact CE2-CH2 3.92Å; F410-W417 HydrophobicContact CE2-CH2 3.92Å; F410-W417 AromaticContact CE2-CZ3 3.95Å; F410-W417 HydrophobicContact CE2-CZ3 3.95Å; F410-W417 HydrophobicContact CZ-CZ3 4.34Å; M413-W417 HydrophobicContact CB-CZ2 4.03Å; M413-W417 HydrophobicContact CE-CZ2 3.79Å; M413-W417 WeakPolarHBondContact O-CB 3.44Å; M413-W417 PolarHBondContact O-N 3.29Å; M413-W417 PolarHBondContact O-NE1 3.18Å; Q414-W417 HydrophobicContact CB-CE3 4.3Å; Q414-W417 HydrophobicContact CG-CE3 4.23Å; W417-V419 VanDerWaalsContact C-N 3.31Å; W417-V419 PolarHBondContact O-N 2.93Å; W417-E420 PolarHBondContact O-N 2.99Å; W417-I421 HydrophobicContact CB-CD1 4.47Å; W417-I421 VanDerWaalsContact O-CB 3.29Å; W417-I421 WeakPolarHBondContact O-CB 3.32Å; W417-I421 WeakPolarHBondContact O-CD1 3.38Å; W417-I421 WeakPolarHBondContact O-CG1 3.34Å; W417-I421 PolarHBondContact O-N 3.5Å
418	R	90.9	Very high	88.7	Confident	56 Å²	56	54.5 Å²	54.5	21%	0.211	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-36.6	176.9	-72.2	177.2	-168.7	106.9	9.9	112.1	T335 E337 Q414 D415 D416 Q422	T335-R418 PolarHBondContact O-NE 2.84Å; T335-R418 PolarHBondContact O-NH2 2.85Å; E337-R418 HydrophobicContact CG-CG 3.98Å; Q414-R418 WeakPolarHBondContact O-CG 3.44Å; Q414-R418 PolarHBondContact O-N 3.36Å; Q414-R418 PolarHBondContact O-NH1 3.1Å; D415-R418 PolarHBondContact O-N 2.97Å; D415-R418 IonicContact OD1-NH1 2.68Å; D415-R418 PolarHBondContact OD1-NH1 2.67Å; D416-R418 VanDerWaalsContact C-N 3.29Å; D416-R418 PolarHBondContact O-N 3.28Å; R418-Q422 VanDerWaalsContact O-CB 3.23Å; R418-Q422 WeakPolarHBondContact O-CB 3.34Å; R418-Q422 PolarHBondContact O-N 3.46Å
419	V	92.6	Very high	89.3	Confident	83 Å²	83	51.5 Å²	51.5	50%	0.503	26%	0.263	S	S	.	.	H	α-helix	trans	-67.6	-50.1	174.7	-176.8	0	0	0	0	109.6	D415 D416 W417 I421 Q422 E423	D415-V419 PolarHBondContact O-N 2.74Å; D416-V419 WeakPolarHBondContact O-CB 3.43Å; D416-V419 PolarHBondContact O-N 3.46Å; D416-V419 VanDerWaalsContact O-N 3.1Å; W417-V419 VanDerWaalsContact C-N 3.31Å; W417-V419 PolarHBondContact O-N 2.93Å; V419-I421 PolarHBondContact O-N 3.06Å; V419-Q422 PolarHBondContact O-N 2.8Å; V419-E423 HydrophobicContact CG1-CG 4.43Å; V419-E423 WeakPolarHBondContact O-CG 3.15Å; V419-E423 PolarHBondContact O-N 2.94Å
420	E	94.1	Very high	89.6	Confident	46 Å²	46	52.7 Å²	52.7	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-55	-48.3	178.5	-145.8	-164.2	113.3	0	0	111.7	P362 S363 D416 W417 E423 M424	P362-E420 WeakPolarHBondContact CA-OE1 3.38Å; S363-E420 WeakPolarHBondContact CB-OE2 3.24Å; S363-E420 PolarHBondContact N-OE1 2.99Å; S363-E420 PolarHBondContact N-OE2 2.81Å; S363-E420 PolarHBondContact OG-OE2 2.97Å; D416-E420 PolarHBondContact O-N 2.84Å; W417-E420 PolarHBondContact O-N 2.99Å; E420-E423 PolarHBondContact O-N 2.67Å; E420-M424 HydrophobicContact CB-CE 4.19Å; E420-M424 HydrophobicContact CG-CE 3.87Å; E420-M424 WeakPolarHBondContact O-CB 3.38Å; E420-M424 WeakPolarHBondContact O-CE 3.25Å; E420-M424 WeakPolarHBondContact O-CG 3.38Å; E420-M424 PolarHBondContact O-N 3.36Å; E420-M424 WeakPolarHBondContact OE1-CE 3.48Å
421	I	92.6	Very high	89.6	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-42.5	178.5	-70.4	163.7	0	0	0	111.5	W331 T335 P360 P362 W417 V419 M424 F425	W331-I421 HydrophobicContact CH2-CD1 4.43Å; W331-I421 HydrophobicContact CH2-CG2 4.02Å; W331-I421 HydrophobicContact CZ2-CD1 3.73Å; W331-I421 HydrophobicContact CZ2-CG1 4.14Å; W331-I421 HydrophobicContact CZ2-CG2 3.83Å; T335-I421 HydrophobicContact CG2-CD1 3.41Å; T335-I421 VanDerWaalsContact CG2-CD1 3.41Å; P360-I421 HydrophobicContact CG-CG1 4.47Å; P362-I421 HydrophobicContact CG-CD1 3.88Å; P362-I421 HydrophobicContact CG-CG1 4.2Å; W417-I421 HydrophobicContact CB-CD1 4.47Å; W417-I421 VanDerWaalsContact O-CB 3.29Å; W417-I421 WeakPolarHBondContact O-CB 3.32Å; W417-I421 WeakPolarHBondContact O-CD1 3.38Å; W417-I421 WeakPolarHBondContact O-CG1 3.34Å; W417-I421 PolarHBondContact O-N 3.5Å; V419-I421 PolarHBondContact O-N 3.06Å; I421-M424 PolarHBondContact O-N 3.03Å; I421-F425 HydrophobicContact CG2-CD2 3.74Å; I421-F425 HydrophobicContact CG2-CE2 3.34Å; I421-F425 HydrophobicContact CG2-CZ 3.85Å; I421-F425 WeakPolarHBondContact O-CG 3.19Å; I421-F425 PolarHBondContact O-N 3.35Å
422	Q	91.8	Very high	89.5	Confident	69 Å²	69	58.3 Å²	58.3	32%	0.322	29%	0.293	S	S	.	.	H	α-helix	trans	-68.7	-37.4	180	-174	59	88.3	0	0	111.6	R418 V419 F425 D426	R418-Q422 VanDerWaalsContact O-CB 3.23Å; R418-Q422 WeakPolarHBondContact O-CB 3.34Å; R418-Q422 PolarHBondContact O-N 3.46Å; V419-Q422 PolarHBondContact O-N 2.8Å; Q422-F425 PolarHBondContact O-N 2.88Å; Q422-D426 PolarHBondContact NE2-OD1 3.41Å; Q422-D426 WeakPolarHBondContact O-CB 3.5Å; Q422-D426 PolarHBondContact O-N 2.84Å
423	E	91.9	Very high	89.3	Confident	129 Å²	129	61 Å²	61	60%	0.603	30%	0.297	S	S	*	.	H	α-helix	trans	-64.4	-42.8	172.3	-71.7	-175.5	169.6	0	0	111.4	V419 E420 F425 D426 E427	V419-E423 HydrophobicContact CG1-CG 4.43Å; V419-E423 WeakPolarHBondContact O-CG 3.15Å; V419-E423 PolarHBondContact O-N 2.94Å; E420-E423 PolarHBondContact O-N 2.67Å; E423-F425 PolarHBondContact O-N 2.78Å; E423-D426 PolarHBondContact O-N 2.84Å; E423-D426 VanDerWaalsContact O-N 3.14Å; E423-E427 PolarHBondContact O-N 3.38Å
424	M	89.6	Confident	89.3	Confident	55 Å²	55	63.8 Å²	63.8	27%	0.271	31%	0.309	S	S	.	.	H	α-helix	trans	-64.6	-38.8	175.5	-74.4	-173.8	-80.2	0	0	113.3	P360 E420 I421 D426 E427 L428	P360-M424 HydrophobicContact CB-CE 3.52Å; P360-M424 HydrophobicContact CB-SD 3.47Å; P360-M424 WeakPolarHBondContact CB-SD 3.27Å; P360-M424 HydrophobicContact CG-CB 4.36Å; P360-M424 HydrophobicContact CG-CE 4.03Å; P360-M424 HydrophobicContact CG-SD 4.25Å; E420-M424 HydrophobicContact CB-CE 4.19Å; E420-M424 HydrophobicContact CG-CE 3.87Å; E420-M424 WeakPolarHBondContact O-CB 3.38Å; E420-M424 WeakPolarHBondContact O-CE 3.25Å; E420-M424 WeakPolarHBondContact O-CG 3.38Å; E420-M424 PolarHBondContact O-N 3.36Å; E420-M424 WeakPolarHBondContact OE1-CE 3.48Å; I421-M424 PolarHBondContact O-N 3.03Å; M424-D426 VanDerWaalsContact C-N 3.33Å; M424-E427 PolarHBondContact O-N 2.66Å; M424-L428 WeakPolarHBondContact O-CG 3.27Å; M424-L428 PolarHBondContact O-N 3.29Å
425	F	90.6	Very high	89	Confident	1 Å²	1	68.8 Å²	68.8	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-69.1	-29.6	171.6	-67.8	-28.7	0	0	0	112.4	W331 Y340 R341 I343 L359 P360 I421 Q422 E423 L428 R429	W331-F425 HydrophobicContact CH2-CE2 4.14Å; W331-F425 AromaticContact CH2-CZ 3.93Å; W331-F425 HydrophobicContact CH2-CZ 3.93Å; W331-F425 HydrophobicContact CZ2-CZ 4.14Å; Y340-F425 HydrophobicContact CD1-CE1 4.25Å; R341-F425 HydrophobicContact CB-CD2 3.94Å; R341-F425 HydrophobicContact CB-CE2 3.97Å; I343-F425 HydrophobicContact CD1-CD1 4.15Å; L359-F425 HydrophobicContact CD2-CZ 4.2Å; P360-F425 HydrophobicContact CG-CE1 4.22Å; I421-F425 HydrophobicContact CG2-CD2 3.74Å; I421-F425 HydrophobicContact CG2-CE2 3.34Å; I421-F425 HydrophobicContact CG2-CZ 3.85Å; I421-F425 WeakPolarHBondContact O-CG 3.19Å; I421-F425 PolarHBondContact O-N 3.35Å; Q422-F425 PolarHBondContact O-N 2.88Å; E423-F425 PolarHBondContact O-N 2.78Å; F425-L428 HydrophobicContact CD1-CD1 4.11Å; F425-L428 PolarHBondContact O-N 2.91Å; F425-R429 WeakPolarHBondContact O-CB 3.25Å; F425-R429 WeakPolarHBondContact O-CG 3.47Å; F425-R429 PolarHBondContact O-N 3.38Å
426	D	89.5	Confident	88.6	Confident	72 Å²	72	70.9 Å²	70.9	39%	0.385	34%	0.34	S	S	.	.	H	α-helix	trans	-73.4	-37.5	174.3	-80.4	26.4	0	0	0	112.2	Q422 E423 M424 R429 T430	Q422-D426 PolarHBondContact NE2-OD1 3.41Å; Q422-D426 WeakPolarHBondContact O-CB 3.5Å; Q422-D426 PolarHBondContact O-N 2.84Å; E423-D426 PolarHBondContact O-N 2.84Å; E423-D426 VanDerWaalsContact O-N 3.14Å; M424-D426 VanDerWaalsContact C-N 3.33Å; D426-R429 PolarHBondContact O-N 2.88Å; D426-R429 IonicContact OD1-CZ 2.73Å; D426-R429 IonicContact OD1-NE 2.69Å; D426-R429 IonicContact OD1-NH2 2.82Å; D426-R429 PolarHBondContact OD1-NH2 2.88Å; D426-R429 IonicContact OD2-NH2 3.97Å; D426-T430 WeakPolarHBondContact O-CB 3.43Å; D426-T430 WeakPolarHBondContact O-CG2 3.44Å; D426-T430 PolarHBondContact O-N 3.44Å; D426-T430 PolarHBondContact O-OG1 3.49Å
427	E	88.7	Confident	88.5	Confident	107 Å²	107	69.6 Å²	69.6	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-60.4	-45.4	167.9	-81.9	-154.2	-171.5	0	0	112	E423 M424 T430 K431	E423-E427 PolarHBondContact O-N 3.38Å; M424-E427 PolarHBondContact O-N 2.66Å; E427-T430 WeakPolarHBondContact CA-OG1 2.73Å; E427-T430 PolarHBondContact O-N 3.32Å; E427-T430 PolarHBondContact O-OG1 2.93Å; E427-K431 WeakPolarHBondContact O-CB 3.47Å; E427-K431 VanDerWaalsContact O-CD 3.32Å; E427-K431 WeakPolarHBondContact O-CD 3.08Å; E427-K431 WeakPolarHBondContact O-CG 3.11Å; E427-K431 PolarHBondContact O-N 3.31Å; E427-K431 WeakPolarHBondContact OE2-CE 3.26Å; E427-K431 IonicContact OE2-NZ 2.8Å; E427-K431 PolarHBondContact OE2-NZ 2.96Å
428	L	86.8	Confident	88.1	Confident	57 Å²	57	75.7 Å²	75.7	30%	0.298	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-46.8	176.8	-77.3	164.8	0	0	0	111.2	I343 L357 M424 F425 T430 K431 E432	I343-L428 HydrophobicContact CD1-CB 4.14Å; I343-L428 HydrophobicContact CD1-CD1 4.13Å; L357-L428 HydrophobicContact CD1-CD1 3.79Å; L357-L428 HydrophobicContact CD1-CD2 4.03Å; M424-L428 WeakPolarHBondContact O-CG 3.27Å; M424-L428 PolarHBondContact O-N 3.29Å; F425-L428 HydrophobicContact CD1-CD1 4.11Å; F425-L428 PolarHBondContact O-N 2.91Å; L428-T430 VanDerWaalsContact C-N 3.32Å; L428-T430 PolarHBondContact O-N 2.95Å; L428-K431 PolarHBondContact O-N 3.05Å; L428-E432 VanDerWaalsContact O-CB 3.27Å; L428-E432 WeakPolarHBondContact O-CB 3.48Å; L428-E432 PolarHBondContact O-N 3.25Å
429	R	86.4	Confident	87.9	Confident	71 Å²	71	75.9 Å²	75.9	27%	0.268	36%	0.364	S	S	.	.	H	α-helix	trans	-69.6	-23.6	179.5	-67.5	-177.1	-52.4	165.2	-0.8	113.9	G342 I343 F425 D426 K433	G342-R429 WeakPolarHBondContact O-CD 3.21Å; I343-R429 HydrophobicContact CG1-CG 4.03Å; F425-R429 WeakPolarHBondContact O-CB 3.25Å; F425-R429 WeakPolarHBondContact O-CG 3.47Å; F425-R429 PolarHBondContact O-N 3.38Å; D426-R429 PolarHBondContact O-N 2.88Å; D426-R429 IonicContact OD1-CZ 2.73Å; D426-R429 IonicContact OD1-NE 2.69Å; D426-R429 IonicContact OD1-NH2 2.82Å; D426-R429 PolarHBondContact OD1-NH2 2.88Å; D426-R429 IonicContact OD2-NH2 3.97Å; R429-K433 VanDerWaalsContact O-CD 3.27Å; R429-K433 WeakPolarHBondContact O-CD 3.33Å; R429-K433 WeakPolarHBondContact O-CG 3.32Å; R429-K433 PolarHBondContact O-N 2.88Å
430	T	87.4	Confident	87.9	Confident	82 Å²	82	77 Å²	77	50%	0.503	36%	0.364	S	S	.	.	H	α-helix	trans	-81.1	-43.3	172.7	46.2	0	0	0	0	111.7	D426 E427 L428 E432 K433 E434	D426-T430 WeakPolarHBondContact O-CB 3.43Å; D426-T430 WeakPolarHBondContact O-CG2 3.44Å; D426-T430 PolarHBondContact O-N 3.44Å; D426-T430 PolarHBondContact O-OG1 3.49Å; E427-T430 WeakPolarHBondContact CA-OG1 2.73Å; E427-T430 PolarHBondContact O-N 3.32Å; E427-T430 PolarHBondContact O-OG1 2.93Å; L428-T430 VanDerWaalsContact C-N 3.32Å; L428-T430 PolarHBondContact O-N 2.95Å; T430-E432 VanDerWaalsContact C-N 3.31Å; T430-E432 PolarHBondContact O-N 3.13Å; T430-K433 PolarHBondContact O-N 2.95Å; T430-E434 PolarHBondContact O-N 3.23Å
431	K	84.5	Confident	87.9	Confident	99 Å²	99	80.8 Å²	80.8	43%	0.43	38%	0.382	S	S	.	.	H	α-helix	trans	-59.7	-40.7	172.6	-68.3	162.5	-167.7	170.2	0	111.8	E427 L428 E434 L435	E427-K431 WeakPolarHBondContact O-CB 3.47Å; E427-K431 VanDerWaalsContact O-CD 3.32Å; E427-K431 WeakPolarHBondContact O-CD 3.08Å; E427-K431 WeakPolarHBondContact O-CG 3.11Å; E427-K431 PolarHBondContact O-N 3.31Å; E427-K431 WeakPolarHBondContact OE2-CE 3.26Å; E427-K431 IonicContact OE2-NZ 2.8Å; E427-K431 PolarHBondContact OE2-NZ 2.96Å; L428-K431 PolarHBondContact O-N 3.05Å; K431-E434 PolarHBondContact O-N 3.4Å; K431-L435 WeakPolarHBondContact O-CB 3.32Å; K431-L435 VanDerWaalsContact O-CG 3.29Å; K431-L435 WeakPolarHBondContact O-CG 3.29Å; K431-L435 PolarHBondContact O-N 3.06Å
432	E	84.3	Confident	87.8	Confident	42 Å²	42	86.9 Å²	86.9	20%	0.196	41%	0.414	C	S	.	.	H	α-helix	trans	-62.7	-45.4	176.6	-165.7	-133.2	136.4	0	0	112.3	L428 T430 L435 R436	L428-E432 VanDerWaalsContact O-CB 3.27Å; L428-E432 WeakPolarHBondContact O-CB 3.48Å; L428-E432 PolarHBondContact O-N 3.25Å; T430-E432 VanDerWaalsContact C-N 3.31Å; T430-E432 PolarHBondContact O-N 3.13Å; E432-L435 PolarHBondContact O-N 3.32Å; E432-R436 PolarHBondContact O-N 2.9Å; E432-R436 IonicContact OE1-CZ 2.66Å; E432-R436 IonicContact OE1-NE 2.85Å; E432-R436 PolarHBondContact OE1-NE 3.14Å; E432-R436 IonicContact OE1-NH2 2.68Å; E432-R436 PolarHBondContact OE1-NH2 2.95Å; E432-R436 IonicContact OE2-NH2 3.51Å
433	K	85.1	Confident	88	Confident	122 Å²	122	87 Å²	87	53%	0.53	42%	0.42	S	S	.	.	H	α-helix	trans	-63.7	-39	174.1	-72.1	166.7	-170.1	168.6	0	112.4	R429 T430 S437	R429-K433 VanDerWaalsContact O-CD 3.27Å; R429-K433 WeakPolarHBondContact O-CD 3.33Å; R429-K433 WeakPolarHBondContact O-CG 3.32Å; R429-K433 PolarHBondContact O-N 2.88Å; T430-K433 PolarHBondContact O-N 2.95Å; K433-S437 WeakPolarHBondContact O-CB 3.23Å; K433-S437 PolarHBondContact O-N 2.89Å
434	E	86.7	Confident	88.2	Confident	97 Å²	97	86.7 Å²	86.7	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-64.2	-45.1	175.6	-172	-176.7	-158.1	0	0	111.2	T430 K431 S437 R438	T430-E434 PolarHBondContact O-N 3.23Å; K431-E434 PolarHBondContact O-N 3.4Å; E434-S437 PolarHBondContact O-N 2.8Å; E434-R438 VanDerWaalsContact O-CG 3.32Å; E434-R438 WeakPolarHBondContact O-CG 3.25Å; E434-R438 PolarHBondContact O-N 3.1Å; E434-R438 IonicContact OE1-CZ 2.68Å; E434-R438 IonicContact OE1-NE 2.92Å; E434-R438 PolarHBondContact OE1-NE 3.49Å; E434-R438 IonicContact OE1-NH2 2.71Å; E434-R438 PolarHBondContact OE1-NH2 2.91Å; E434-R438 IonicContact OE2-CZ 2.81Å; E434-R438 IonicContact OE2-NH2 2.73Å; E434-R438 PolarHBondContact OE2-NH2 3.27Å
435	L	81.8	Confident	88.4	Confident	109 Å²	109	86.4 Å²	86.4	57%	0.571	42%	0.419	S	S	*	.	H	α-helix	trans	-59.7	-47.3	176.5	-73.8	169.4	0	0	0	111.6	K431 E432 S437 R438 E439	K431-L435 WeakPolarHBondContact O-CB 3.32Å; K431-L435 VanDerWaalsContact O-CG 3.29Å; K431-L435 WeakPolarHBondContact O-CG 3.29Å; K431-L435 PolarHBondContact O-N 3.06Å; E432-L435 PolarHBondContact O-N 3.32Å; L435-S437 PolarHBondContact O-N 3.14Å; L435-R438 PolarHBondContact O-N 2.86Å; L435-E439 WeakPolarHBondContact O-CB 3.37Å; L435-E439 PolarHBondContact O-N 3.02Å
436	R	81.3	Confident	88.7	Confident	96 Å²	96	89 Å²	89	36%	0.362	44%	0.441	S	S	.	.	H	α-helix	trans	-61	-41.7	175.6	-73	-167.1	-85.1	126.4	-16.2	112.4	E432 R438 E439 E440 M1014	E432-R436 PolarHBondContact O-N 2.9Å; E432-R436 IonicContact OE1-CZ 2.66Å; E432-R436 IonicContact OE1-NE 2.85Å; E432-R436 PolarHBondContact OE1-NE 3.14Å; E432-R436 IonicContact OE1-NH2 2.68Å; E432-R436 PolarHBondContact OE1-NH2 2.95Å; E432-R436 IonicContact OE2-NH2 3.51Å; R436-R438 PolarHBondContact O-N 3.37Å; R436-E439 PolarHBondContact O-N 3.19Å; R436-E440 PolarHBondContact O-N 3.09Å; R436-M1014 HydrophobicContact CG-CE 4.14Å
437	S	88.6	Confident	89	Confident	66 Å²	66	90.8 Å²	90.8	46%	0.462	45%	0.45	S	S	.	.	H	α-helix	trans	-60.7	-41.6	175	-173.7	0	0	0	0	112.7	K433 E434 L435 E441	K433-S437 WeakPolarHBondContact O-CB 3.23Å; K433-S437 PolarHBondContact O-N 2.89Å; E434-S437 PolarHBondContact O-N 2.8Å; L435-S437 PolarHBondContact O-N 3.14Å; S437-E441 PolarHBondContact O-N 3.42Å
438	R	84.4	Confident	89.3	Confident	130 Å²	130	92.3 Å²	92.3	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-68.8	-37.8	175.7	-68.6	172	-179.7	-165.1	5.1	112.2	E434 L435 R436 E441 L442	E434-R438 VanDerWaalsContact O-CG 3.32Å; E434-R438 WeakPolarHBondContact O-CG 3.25Å; E434-R438 PolarHBondContact O-N 3.1Å; E434-R438 IonicContact OE1-CZ 2.68Å; E434-R438 IonicContact OE1-NE 2.92Å; E434-R438 PolarHBondContact OE1-NE 3.49Å; E434-R438 IonicContact OE1-NH2 2.71Å; E434-R438 PolarHBondContact OE1-NH2 2.91Å; E434-R438 IonicContact OE2-CZ 2.81Å; E434-R438 IonicContact OE2-NH2 2.73Å; E434-R438 PolarHBondContact OE2-NH2 3.27Å; L435-R438 PolarHBondContact O-N 2.86Å; R436-R438 PolarHBondContact O-N 3.37Å; R438-E441 PolarHBondContact O-N 2.92Å; R438-L442 WeakPolarHBondContact O-CB 3.46Å; R438-L442 VanDerWaalsContact O-CG 3.32Å; R438-L442 WeakPolarHBondContact O-CG 3.41Å; R438-L442 PolarHBondContact O-N 2.78Å
439	E	88	Confident	89.8	Confident	60 Å²	60	96 Å²	96	28%	0.28	47%	0.472	S	S	.	.	H	α-helix	trans	-64.1	-43.6	175.8	-173.4	176	177.5	0	0	111.4	L435 R436 L442 T443 S1013 M1014	L435-E439 WeakPolarHBondContact O-CB 3.37Å; L435-E439 PolarHBondContact O-N 3.02Å; R436-E439 PolarHBondContact O-N 3.19Å; E439-L442 PolarHBondContact O-N 2.91Å; E439-T443 WeakPolarHBondContact O-CB 3.43Å; E439-T443 PolarHBondContact O-N 3.39Å; E439-T443 PolarHBondContact O-OG1 3.38Å; E439-S1013 VanDerWaalsContact OE1-CA 3.25Å; E439-S1013 WeakPolarHBondContact OE1-CA 3.4Å; E439-S1013 VanDerWaalsContact OE1-CB 3.27Å; E439-S1013 WeakPolarHBondContact OE1-CB 3.34Å; E439-M1014 PolarHBondContact OE1-N 3.21Å
440	E	91.8	Very high	90.3	Very high	107 Å²	107	98.8 Å²	98.8	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-41.5	171.7	-71.2	-175.5	-136.1	0	0	112.2	R436 T443 R444	R436-E440 PolarHBondContact O-N 3.09Å; E440-T443 PolarHBondContact O-N 3.43Å; E440-R444 VanDerWaalsContact CB-NH2 3.3Å; E440-R444 WeakPolarHBondContact O-CB 3.31Å; E440-R444 VanDerWaalsContact O-CG 3.25Å; E440-R444 WeakPolarHBondContact O-CG 3.46Å; E440-R444 PolarHBondContact O-N 2.59Å; E440-R444 IonicContact OE2-CZ 2.9Å; E440-R444 IonicContact OE2-NH2 2.66Å; E440-R444 PolarHBondContact OE2-NH2 2.59Å
441	E	94.6	Very high	90.7	Very high	125 Å²	125	98.4 Å²	98.4	58%	0.584	49%	0.488	S	S	*	.	H	α-helix	trans	-63.6	-45.3	178	-174.5	171.9	-160.1	0	0	112.2	S437 R438 T443 R444 A445	S437-E441 PolarHBondContact O-N 3.42Å; R438-E441 PolarHBondContact O-N 2.92Å; E441-T443 VanDerWaalsContact C-N 3.31Å; E441-T443 PolarHBondContact O-N 3.32Å; E441-R444 PolarHBondContact O-N 3.22Å; E441-A445 WeakPolarHBondContact O-CB 3.38Å; E441-A445 PolarHBondContact O-N 2.9Å
442	L	90.8	Very high	91.3	Very high	129 Å²	129	99.7 Å²	99.7	68%	0.675	50%	0.495	S	S	*	.	H	α-helix	trans	-59.7	-41.7	173.5	-72.4	169.6	0	0	0	111.7	R438 E439 A445 A446	R438-L442 WeakPolarHBondContact O-CB 3.46Å; R438-L442 VanDerWaalsContact O-CG 3.32Å; R438-L442 WeakPolarHBondContact O-CG 3.41Å; R438-L442 PolarHBondContact O-N 2.78Å; E439-L442 PolarHBondContact O-N 2.91Å; L442-A445 PolarHBondContact O-N 3.19Å; L442-A446 WeakPolarHBondContact O-CB 3.37Å; L442-A446 PolarHBondContact O-N 3.32Å
443	T	94.8	Very high	91.9	Very high	72 Å²	72	103.7 Å²	103.7	44%	0.442	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-44.7	176.8	-59.6	0	0	0	0	111.6	E439 E440 E441 A445 A446 L447	E439-T443 WeakPolarHBondContact O-CB 3.43Å; E439-T443 PolarHBondContact O-N 3.39Å; E439-T443 PolarHBondContact O-OG1 3.38Å; E440-T443 PolarHBondContact O-N 3.43Å; E441-T443 VanDerWaalsContact C-N 3.31Å; E441-T443 PolarHBondContact O-N 3.32Å; T443-A445 VanDerWaalsContact C-N 3.34Å; T443-A445 PolarHBondContact O-N 2.59Å; T443-A446 PolarHBondContact O-N 3.13Å; T443-L447 HydrophobicContact CG2-CD1 4.4Å; T443-L447 WeakPolarHBondContact O-CG 3.06Å; T443-L447 PolarHBondContact O-N 3.3Å
444	R	95.8	Very high	92.5	Very high	121 Å²	121	101.6 Å²	101.6	46%	0.457	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-40.4	174.6	-69.7	177.8	-134.4	124.3	-8.2	111.5	E440 E441 L447 Q448	E440-R444 VanDerWaalsContact CB-NH2 3.3Å; E440-R444 WeakPolarHBondContact O-CB 3.31Å; E440-R444 VanDerWaalsContact O-CG 3.25Å; E440-R444 WeakPolarHBondContact O-CG 3.46Å; E440-R444 PolarHBondContact O-N 2.59Å; E440-R444 IonicContact OE2-CZ 2.9Å; E440-R444 IonicContact OE2-NH2 2.66Å; E440-R444 PolarHBondContact OE2-NH2 2.59Å; E441-R444 PolarHBondContact O-N 3.22Å; R444-L447 PolarHBondContact O-N 3.49Å; R444-Q448 WeakPolarHBondContact O-CG 3.31Å; R444-Q448 PolarHBondContact O-N 3.48Å
445	A	95.2	Very high	93	Very high	49 Å²	49	102.6 Å²	102.6	41%	0.405	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-42.9	176.6	0	0	0	0	0	112.3	E441 L442 T443 L447 Q448 Q449	E441-A445 WeakPolarHBondContact O-CB 3.38Å; E441-A445 PolarHBondContact O-N 2.9Å; L442-A445 PolarHBondContact O-N 3.19Å; T443-A445 VanDerWaalsContact C-N 3.34Å; T443-A445 PolarHBondContact O-N 2.59Å; A445-L447 PolarHBondContact O-N 3.03Å; A445-Q448 PolarHBondContact O-N 3.45Å; A445-Q449 WeakPolarHBondContact O-CB 3.46Å; A445-Q449 PolarHBondContact O-N 2.92Å
446	A	95.6	Very high	93.7	Very high	56 Å²	56	102.5 Å²	102.5	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-41.2	176.1	0	0	0	0	0	112.3	L442 T443 Q449 K450	L442-A446 WeakPolarHBondContact O-CB 3.37Å; L442-A446 PolarHBondContact O-N 3.32Å; T443-A446 PolarHBondContact O-N 3.13Å; A446-Q449 PolarHBondContact O-N 3.39Å; A446-K450 WeakPolarHBondContact O-CB 3.39Å; A446-K450 PolarHBondContact O-N 2.89Å
447	L	96.8	Very high	94.5	Very high	110 Å²	110	104.7 Å²	104.7	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-64.2	-39.8	174.2	-71.1	171.7	0	0	0	112.4	T443 R444 A445 S451	T443-L447 HydrophobicContact CG2-CD1 4.4Å; T443-L447 WeakPolarHBondContact O-CG 3.06Å; T443-L447 PolarHBondContact O-N 3.3Å; R444-L447 PolarHBondContact O-N 3.49Å; A445-L447 PolarHBondContact O-N 3.03Å; L447-S451 WeakPolarHBondContact O-CB 3.43Å; L447-S451 PolarHBondContact O-N 3.24Å
448	Q	95.5	Very high	94.9	Very high	139 Å²	139	108 Å²	108	65%	0.65	53%	0.527	S	S	*	.	H	α-helix	trans	-64.6	-44.6	173.9	-72.6	175.8	28.3	0	0	111.8	R444 A445 S451 Q452	R444-Q448 WeakPolarHBondContact O-CG 3.31Å; R444-Q448 PolarHBondContact O-N 3.48Å; A445-Q448 PolarHBondContact O-N 3.45Å; Q448-S451 PolarHBondContact O-N 2.91Å; Q448-Q452 WeakPolarHBondContact O-CB 3.34Å; Q448-Q452 PolarHBondContact O-N 3.48Å
449	Q	96	Very high	95.5	Very high	133 Å²	133	107.6 Å²	107.6	62%	0.621	53%	0.526	S	S	*	.	H	α-helix	trans	-60.4	-45.7	176.7	-178.1	176.6	-15.7	0	0	111.5	A445 A446 S451 Q452 E453	A445-Q449 WeakPolarHBondContact O-CB 3.46Å; A445-Q449 PolarHBondContact O-N 2.92Å; A446-Q449 PolarHBondContact O-N 3.39Å; Q449-S451 PolarHBondContact O-N 3.01Å; Q449-Q452 PolarHBondContact O-N 3.3Å; Q449-E453 PolarHBondContact O-N 2.92Å
450	K	97	Very high	95.9	Very high	130 Å²	130	111.3 Å²	111.3	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-60.8	-43.7	176.1	-175.4	178.8	177.9	-179.7	0	112.1	A446 Q452 E453 E454	A446-K450 WeakPolarHBondContact O-CB 3.39Å; A446-K450 PolarHBondContact O-N 2.89Å; K450-Q452 VanDerWaalsContact C-N 3.34Å; K450-Q452 PolarHBondContact O-N 3.27Å; K450-E453 PolarHBondContact O-N 3.47Å; K450-E454 PolarHBondContact O-N 3.37Å
451	S	97.3	Very high	96.1	Very high	75 Å²	75	112.9 Å²	112.9	52%	0.524	55%	0.551	S	S	.	*	H	α-helix	trans	-62.9	-39.2	175.9	-174.9	0	0	0	0	112.3	L447 Q448 Q449 L455	L447-S451 WeakPolarHBondContact O-CB 3.43Å; L447-S451 PolarHBondContact O-N 3.24Å; Q448-S451 PolarHBondContact O-N 2.91Å; Q449-S451 PolarHBondContact O-N 3.01Å; S451-L455 WeakPolarHBondContact O-CB 3.44Å; S451-L455 PolarHBondContact O-N 2.88Å
452	Q	95.9	Very high	96.2	Very high	126 Å²	126	111 Å²	111	59%	0.589	54%	0.542	S	S	*	.	H	α-helix	trans	-66.9	-40.5	173.9	-174.8	175.5	-1.9	0	0	112.1	Q448 Q449 K450 L455 L456	Q448-Q452 WeakPolarHBondContact O-CB 3.34Å; Q448-Q452 PolarHBondContact O-N 3.48Å; Q449-Q452 PolarHBondContact O-N 3.3Å; K450-Q452 VanDerWaalsContact C-N 3.34Å; K450-Q452 PolarHBondContact O-N 3.27Å; Q452-L455 PolarHBondContact O-N 3.24Å; Q452-L456 HydrophobicContact CG-CD1 4.29Å; Q452-L456 WeakPolarHBondContact O-CB 3.49Å; Q452-L456 VanDerWaalsContact O-CG 3.31Å; Q452-L456 WeakPolarHBondContact O-CG 3.22Å; Q452-L456 PolarHBondContact O-N 2.88Å
453	E	96.8	Very high	96.5	Very high	125 Å²	125	108.6 Å²	108.6	58%	0.584	53%	0.53	S	S	*	.	H	α-helix	trans	-62.5	-46.1	174.8	-170.3	-175.1	150.9	0	0	111.4	Q449 K450 L455 L456 K457	Q449-E453 PolarHBondContact O-N 2.92Å; K450-E453 PolarHBondContact O-N 3.47Å; E453-L455 VanDerWaalsContact C-N 3.31Å; E453-L455 PolarHBondContact O-N 3.48Å; E453-L456 PolarHBondContact O-N 3.45Å; E453-K457 WeakPolarHBondContact O-CB 3.46Å; E453-K457 PolarHBondContact O-N 3.33Å
454	E	97.2	Very high	96.6	Very high	79 Å²	79	107.3 Å²	107.3	37%	0.369	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-40.1	174.2	-75.1	-174.1	-151.9	0	0	112.6	K450 K457 R458	K450-E454 PolarHBondContact O-N 3.37Å; E454-K457 PolarHBondContact O-N 2.94Å; E454-R458 WeakPolarHBondContact O-CB 3.32Å; E454-R458 VanDerWaalsContact O-CG 3.31Å; E454-R458 WeakPolarHBondContact O-CG 3.49Å; E454-R458 PolarHBondContact O-N 3.22Å; E454-R458 IonicContact OE2-CZ 2.63Å; E454-R458 IonicContact OE2-NH1 3.15Å; E454-R458 PolarHBondContact OE2-NH1 2.98Å; E454-R458 IonicContact OE2-NH2 3.79Å; E454-R458 PolarHBondContact OE2-NH2 3Å
455	L	97.5	Very high	96.7	Very high	117 Å²	117	107 Å²	107	61%	0.613	53%	0.53	S	S	*	.	H	α-helix	trans	-65.5	-41.4	176.5	-177.2	64.4	0	0	0	111.7	S451 Q452 E453 R459	S451-L455 WeakPolarHBondContact O-CB 3.44Å; S451-L455 PolarHBondContact O-N 2.88Å; Q452-L455 PolarHBondContact O-N 3.24Å; E453-L455 VanDerWaalsContact C-N 3.31Å; E453-L455 PolarHBondContact O-N 3.48Å; L455-R459 WeakPolarHBondContact O-CB 3.46Å; L455-R459 PolarHBondContact O-N 3.3Å
456	L	96.9	Very high	96.7	Very high	108 Å²	108	111.6 Å²	111.6	57%	0.565	54%	0.537	S	S	*	.	H	α-helix	trans	-64.7	-43.5	174.9	-72.7	170.7	0	0	0	111.4	Q452 E453 R459 E460	Q452-L456 HydrophobicContact CG-CD1 4.29Å; Q452-L456 WeakPolarHBondContact O-CB 3.49Å; Q452-L456 VanDerWaalsContact O-CG 3.31Å; Q452-L456 WeakPolarHBondContact O-CG 3.22Å; Q452-L456 PolarHBondContact O-N 2.88Å; E453-L456 PolarHBondContact O-N 3.45Å; L456-R459 CarbonylContact O-C 3.52Å; L456-R459 WeakPolarHBondContact O-CA 3.49Å; L456-R459 WeakPolarHBondContact O-CB 3.33Å; L456-R459 PolarHBondContact O-N 3.09Å; L456-E460 PolarHBondContact O-N 2.83Å
457	K	97.8	Very high	96.7	Very high	141 Å²	141	114.9 Å²	114.9	61%	0.613	54%	0.543	S	S	*	.	H	α-helix	trans	-63.3	-43.5	177.3	-170.5	172.8	-175.2	172.9	0	112.5	E453 E454 R459 E460 Q461	E453-K457 WeakPolarHBondContact O-CB 3.46Å; E453-K457 PolarHBondContact O-N 3.33Å; E454-K457 PolarHBondContact O-N 2.94Å; K457-R459 PolarHBondContact O-N 3.46Å; K457-E460 PolarHBondContact O-N 3.43Å; K457-Q461 PolarHBondContact O-N 2.7Å
458	R	97.3	Very high	96.7	Very high	135 Å²	135	114.9 Å²	114.9	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-60.4	-35.1	170.4	-72.5	176	-173.2	110.6	8.7	111.5	E454 Q462	E454-R458 WeakPolarHBondContact O-CB 3.32Å; E454-R458 VanDerWaalsContact O-CG 3.31Å; E454-R458 WeakPolarHBondContact O-CG 3.49Å; E454-R458 PolarHBondContact O-N 3.22Å; E454-R458 IonicContact OE2-CZ 2.63Å; E454-R458 IonicContact OE2-NH1 3.15Å; E454-R458 PolarHBondContact OE2-NH1 2.98Å; E454-R458 IonicContact OE2-NH2 3.79Å; E454-R458 PolarHBondContact OE2-NH2 3Å; R458-Q462 WeakPolarHBondContact O-CG 3.37Å; R458-Q462 PolarHBondContact O-N 3.45Å
459	R	96.8	Very high	96.7	Very high	123 Å²	123	111.1 Å²	111.1	46%	0.464	53%	0.526	S	S	.	.	H	α-helix	trans	-74.8	-38.5	178.6	-175.5	52.9	168.4	-163.9	-5.2	113.1	L455 L456 K457 Q462 L463	L455-R459 WeakPolarHBondContact O-CB 3.46Å; L455-R459 PolarHBondContact O-N 3.3Å; L456-R459 CarbonylContact O-C 3.52Å; L456-R459 WeakPolarHBondContact O-CA 3.49Å; L456-R459 WeakPolarHBondContact O-CB 3.33Å; L456-R459 PolarHBondContact O-N 3.09Å; K457-R459 PolarHBondContact O-N 3.46Å; R459-Q462 PolarHBondContact O-N 3.31Å; R459-L463 WeakPolarHBondContact O-CG 3.39Å; R459-L463 PolarHBondContact O-N 2.99Å; R459-L463 VanDerWaalsContact O-N 3.11Å
460	E	96.6	Very high	96.7	Very high	137 Å²	137	108.2 Å²	108.2	64%	0.64	52%	0.518	S	S	*	.	H	α-helix	trans	-61.5	-46.2	173	-176.2	174.8	-154.9	0	0	110.7	L456 K457 Q462 L463 A464	L456-E460 PolarHBondContact O-N 2.83Å; K457-E460 PolarHBondContact O-N 3.43Å; E460-Q462 VanDerWaalsContact C-N 3.34Å; E460-Q462 PolarHBondContact O-N 3.45Å; E460-L463 WeakPolarHBondContact O-CA 3.42Å; E460-L463 WeakPolarHBondContact O-CB 3.34Å; E460-L463 PolarHBondContact O-N 3.48Å; E460-A464 PolarHBondContact O-N 3.45Å
461	Q	96.9	Very high	96.6	Very high	141 Å²	141	107.2 Å²	107.2	66%	0.659	52%	0.518	S	S	*	.	H	α-helix	trans	-57.1	-44.4	174.1	-171	178.2	8.6	0	0	112.3	K457 L463 A464 E465	K457-Q461 PolarHBondContact O-N 2.7Å; Q461-L463 PolarHBondContact O-N 2.66Å; Q461-A464 PolarHBondContact O-N 3.16Å; Q461-E465 WeakPolarHBondContact O-CB 3.5Å; Q461-E465 PolarHBondContact O-N 3.31Å
462	Q	96.8	Very high	96.5	Very high	84 Å²	84	108.7 Å²	108.7	39%	0.393	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-24.7	174	-75.6	176.4	5.7	0	0	114.1	R458 R459 E460 R466	R458-Q462 WeakPolarHBondContact O-CG 3.37Å; R458-Q462 PolarHBondContact O-N 3.45Å; R459-Q462 PolarHBondContact O-N 3.31Å; E460-Q462 VanDerWaalsContact C-N 3.34Å; E460-Q462 PolarHBondContact O-N 3.45Å; Q462-R466 WeakPolarHBondContact O-CD 3.38Å; Q462-R466 WeakPolarHBondContact O-CG 3.43Å; Q462-R466 PolarHBondContact O-N 3.38Å; Q462-R466 PolarHBondContact O-NE 3.25Å
463	L	96.6	Very high	96.5	Very high	80 Å²	80	110.3 Å²	110.3	42%	0.419	52%	0.517	S	S	.	.	H	α-helix	trans	-81.5	-46.3	176.3	-70.7	169.1	0	0	0	110.3	R459 E460 Q461 E465 R466 E467	R459-L463 WeakPolarHBondContact O-CG 3.39Å; R459-L463 PolarHBondContact O-N 2.99Å; R459-L463 VanDerWaalsContact O-N 3.11Å; E460-L463 WeakPolarHBondContact O-CA 3.42Å; E460-L463 WeakPolarHBondContact O-CB 3.34Å; E460-L463 PolarHBondContact O-N 3.48Å; Q461-L463 PolarHBondContact O-N 2.66Å; L463-E465 VanDerWaalsContact C-N 3.32Å; L463-E465 PolarHBondContact O-N 3.36Å; L463-R466 WeakPolarHBondContact O-CA 3.31Å; L463-R466 WeakPolarHBondContact O-CB 3.46Å; L463-R466 PolarHBondContact O-N 3.18Å; L463-E467 WeakPolarHBondContact O-CG 3.37Å; L463-E467 PolarHBondContact O-N 2.84Å
464	A	96.8	Very high	96.4	Very high	45 Å²	45	109.5 Å²	109.5	37%	0.372	51%	0.513	S	S	.	.	H	α-helix	trans	-58.2	-42	174.2	0	0	0	0	0	112.4	E460 Q461 R466 E467 I468	E460-A464 PolarHBondContact O-N 3.45Å; Q461-A464 PolarHBondContact O-N 3.16Å; A464-R466 VanDerWaalsContact C-N 3.3Å; A464-R466 PolarHBondContact O-N 3.37Å; A464-E467 PolarHBondContact O-N 3.16Å; A464-I468 VanDerWaalsContact O-CG1 3.31Å; A464-I468 WeakPolarHBondContact O-CG1 3.47Å; A464-I468 PolarHBondContact O-N 3.04Å
465	E	96.6	Very high	96.2	Very high	115 Å²	115	110.5 Å²	110.5	54%	0.537	52%	0.521	S	S	.	.	H	α-helix	trans	-58.9	-39.8	173.7	-173.2	-167.3	174.6	0	0	112.2	Q461 L463 N469	Q461-E465 WeakPolarHBondContact O-CB 3.5Å; Q461-E465 PolarHBondContact O-N 3.31Å; L463-E465 VanDerWaalsContact C-N 3.32Å; L463-E465 PolarHBondContact O-N 3.36Å; E465-N469 WeakPolarHBondContact O-CB 3.31Å; E465-N469 PolarHBondContact O-N 3.02Å; E465-N469 PolarHBondContact O-ND2 3.39Å
466	R	96.1	Very high	95.9	Very high	145 Å²	145	109 Å²	109	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-71.2	-38.3	177.2	-71.7	165.9	-174.1	-136.6	-7.8	112.2	Q462 L463 A464 N469 V470	Q462-R466 WeakPolarHBondContact O-CD 3.38Å; Q462-R466 WeakPolarHBondContact O-CG 3.43Å; Q462-R466 PolarHBondContact O-N 3.38Å; Q462-R466 PolarHBondContact O-NE 3.25Å; L463-R466 WeakPolarHBondContact O-CA 3.31Å; L463-R466 WeakPolarHBondContact O-CB 3.46Å; L463-R466 PolarHBondContact O-N 3.18Å; A464-R466 VanDerWaalsContact C-N 3.3Å; A464-R466 PolarHBondContact O-N 3.37Å; R466-N469 WeakPolarHBondContact O-CB 3.3Å; R466-N469 PolarHBondContact O-N 2.94Å; R466-V470 WeakPolarHBondContact O-CG2 3.47Å; R466-V470 PolarHBondContact O-N 2.83Å
467	E	96.3	Very high	95.7	Very high	125 Å²	125	108.4 Å²	108.4	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-63.3	-44.3	175	-72.6	171.2	-173.3	0	0	110.6	L463 A464 N469 V470 L471	L463-E467 WeakPolarHBondContact O-CG 3.37Å; L463-E467 PolarHBondContact O-N 2.84Å; A464-E467 PolarHBondContact O-N 3.16Å; E467-N469 PolarHBondContact O-N 3.01Å; E467-V470 PolarHBondContact O-N 2.93Å; E467-L471 WeakPolarHBondContact O-CB 3.12Å; E467-L471 VanDerWaalsContact O-CG 3.29Å; E467-L471 WeakPolarHBondContact O-CG 3.48Å; E467-L471 PolarHBondContact O-N 2.86Å
468	I	95.9	Very high	95.2	Very high	110 Å²	110	106.7 Å²	106.7	56%	0.564	51%	0.506	S	S	*	.	H	α-helix	trans	-58.1	-48.4	171.8	-67.3	163.9	0	0	0	110.9	A464 V470 L471 E472	A464-I468 VanDerWaalsContact O-CG1 3.31Å; A464-I468 WeakPolarHBondContact O-CG1 3.47Å; A464-I468 PolarHBondContact O-N 3.04Å; I468-V470 VanDerWaalsContact C-N 3.28Å; I468-V470 PolarHBondContact O-N 3.22Å; I468-L471 PolarHBondContact O-N 3.49Å; I468-E472 WeakPolarHBondContact O-CB 3.14Å; I468-E472 PolarHBondContact O-N 2.89Å
469	N	95.6	Very high	94.7	Very high	60 Å²	60	104 Å²	104	32%	0.321	50%	0.501	S	S	.	.	H	α-helix	trans	-60	-33.1	176.7	-92.6	-99.8	0	0	0	113.5	E465 R466 E467 R473	E465-N469 WeakPolarHBondContact O-CB 3.31Å; E465-N469 PolarHBondContact O-N 3.02Å; E465-N469 PolarHBondContact O-ND2 3.39Å; R466-N469 WeakPolarHBondContact O-CB 3.3Å; R466-N469 PolarHBondContact O-N 2.94Å; E467-N469 PolarHBondContact O-N 3.01Å; N469-R473 VanDerWaalsContact O-CD 3.29Å; N469-R473 WeakPolarHBondContact O-CD 3.38Å; N469-R473 WeakPolarHBondContact O-CG 3.49Å; N469-R473 PolarHBondContact O-N 2.93Å; N469-R473 PolarHBondContact O-NE 3.26Å
470	V	96.4	Very high	94.1	Very high	72 Å²	72	104.3 Å²	104.3	44%	0.436	51%	0.506	S	S	.	.	H	α-helix	trans	-74.6	-48.1	176.2	168	0	0	0	0	110.3	R466 E467 I468 E472 R473 E474	R466-V470 WeakPolarHBondContact O-CG2 3.47Å; R466-V470 PolarHBondContact O-N 2.83Å; E467-V470 PolarHBondContact O-N 2.93Å; I468-V470 VanDerWaalsContact C-N 3.28Å; I468-V470 PolarHBondContact O-N 3.22Å; V470-E472 VanDerWaalsContact C-N 3.29Å; V470-E472 PolarHBondContact O-N 3.05Å; V470-R473 WeakPolarHBondContact O-CB 3.41Å; V470-R473 PolarHBondContact O-N 2.91Å; V470-R473 VanDerWaalsContact O-N 3.09Å; V470-E474 HydrophobicContact CG1-CG 4.46Å; V470-E474 WeakPolarHBondContact O-CG 3.41Å; V470-E474 PolarHBondContact O-N 3.17Å
471	L	95.5	Very high	93.3	Very high	108 Å²	108	103.6 Å²	103.6	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-59.9	-37.9	177.1	-70.1	169.9	0	0	0	112.1	E467 I468 E474 L475	E467-L471 WeakPolarHBondContact O-CB 3.12Å; E467-L471 VanDerWaalsContact O-CG 3.29Å; E467-L471 WeakPolarHBondContact O-CG 3.48Å; E467-L471 PolarHBondContact O-N 2.86Å; I468-L471 PolarHBondContact O-N 3.49Å; L471-E474 PolarHBondContact O-N 3.27Å; L471-L475 WeakPolarHBondContact O-CB 3.37Å; L471-L475 PolarHBondContact O-N 3.2Å
472	E	95.1	Very high	92.3	Very high	107 Å²	107	104 Å²	104	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-41.8	174.5	-164.7	-158.4	153.4	0	0	111.6	I468 V470 L475 N476	I468-E472 WeakPolarHBondContact O-CB 3.14Å; I468-E472 PolarHBondContact O-N 2.89Å; V470-E472 VanDerWaalsContact C-N 3.29Å; V470-E472 PolarHBondContact O-N 3.05Å; E472-L475 PolarHBondContact O-N 3.22Å; E472-N476 WeakPolarHBondContact O-CB 3.47Å; E472-N476 PolarHBondContact O-N 3.46Å; E472-N476 PolarHBondContact O-ND2 3.32Å
473	R	94.4	Very high	91.2	Very high	160 Å²	160	105.9 Å²	105.9	60%	0.604	52%	0.522	S	S	*	.	H	α-helix	trans	-67.4	-42.5	176.5	-69.9	166	-167.5	-167.6	3.5	111.6	N469 V470 N476 I477	N469-R473 VanDerWaalsContact O-CD 3.29Å; N469-R473 WeakPolarHBondContact O-CD 3.38Å; N469-R473 WeakPolarHBondContact O-CG 3.49Å; N469-R473 PolarHBondContact O-N 2.93Å; N469-R473 PolarHBondContact O-NE 3.26Å; V470-R473 WeakPolarHBondContact O-CB 3.41Å; V470-R473 PolarHBondContact O-N 2.91Å; V470-R473 VanDerWaalsContact O-N 3.09Å; R473-N476 PolarHBondContact O-N 2.87Å; R473-I477 WeakPolarHBondContact O-CB 3.49Å; R473-I477 WeakPolarHBondContact O-CD1 3.49Å; R473-I477 WeakPolarHBondContact O-CG1 3.39Å; R473-I477 PolarHBondContact O-N 3.48Å
474	E	94.5	Very high	89.6	Confident	108 Å²	108	107.8 Å²	107.8	51%	0.505	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-42.5	175.6	-70.9	-176.6	174.6	0	0	111.6	V470 L471 I477 L478	V470-E474 HydrophobicContact CG1-CG 4.46Å; V470-E474 WeakPolarHBondContact O-CG 3.41Å; V470-E474 PolarHBondContact O-N 3.17Å; L471-E474 PolarHBondContact O-N 3.27Å; E474-I477 PolarHBondContact O-N 2.99Å; E474-L478 WeakPolarHBondContact O-CB 3.33Å; E474-L478 VanDerWaalsContact O-CG 3.32Å; E474-L478 WeakPolarHBondContact O-CG 3.46Å; E474-L478 PolarHBondContact O-N 3.37Å
475	L	92.9	Very high	88.1	Confident	100 Å²	100	113.2 Å²	113.2	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-62.2	-45.7	174.4	-179.7	61.9	0	0	0	111.8	L471 E472 I477 L478 I479	L471-L475 WeakPolarHBondContact O-CB 3.37Å; L471-L475 PolarHBondContact O-N 3.2Å; E472-L475 PolarHBondContact O-N 3.22Å; L475-I477 VanDerWaalsContact C-N 3.32Å; L475-I477 PolarHBondContact O-N 3.43Å; L475-L478 PolarHBondContact O-N 3.23Å; L475-I479 HydrophobicContact CD1-CD1 4.16Å; L475-I479 HydrophobicContact CD1-CG1 4.38Å; L475-I479 HydrophobicContact CG-CD1 3.92Å; L475-I479 VanDerWaalsContact O-CG1 3.28Å; L475-I479 WeakPolarHBondContact O-CG1 3.21Å; L475-I479 PolarHBondContact O-N 3.38Å
476	N	93.1	Very high	86.2	Confident	86 Å²	86	117 Å²	117	46%	0.46	56%	0.564	S	S	.	*	H	α-helix	trans	-61.7	-39.2	175.1	-81.8	-51.1	0	0	0	112.1	E472 R473 F480	E472-N476 WeakPolarHBondContact O-CB 3.47Å; E472-N476 PolarHBondContact O-N 3.46Å; E472-N476 PolarHBondContact O-ND2 3.32Å; R473-N476 PolarHBondContact O-N 2.87Å; N476-F480 WeakPolarHBondContact O-CB 3.49Å; N476-F480 PolarHBondContact O-N 2.95Å
477	I	90.9	Very high	84.4	Confident	94 Å²	94	115.5 Å²	115.5	48%	0.482	57%	0.573	S	S	.	*	H	α-helix	trans	-64.5	-42.1	173.4	-72.7	164.4	0	0	0	111.1	R473 E474 L475 F480 Q481	R473-I477 WeakPolarHBondContact O-CB 3.49Å; R473-I477 WeakPolarHBondContact O-CD1 3.49Å; R473-I477 WeakPolarHBondContact O-CG1 3.39Å; R473-I477 PolarHBondContact O-N 3.48Å; E474-I477 PolarHBondContact O-N 2.99Å; L475-I477 VanDerWaalsContact C-N 3.32Å; L475-I477 PolarHBondContact O-N 3.43Å; I477-F480 PolarHBondContact O-N 3.26Å; I477-Q481 VanDerWaalsContact CG2-NE2 3.26Å; I477-Q481 WeakPolarHBondContact O-CG 3.34Å; I477-Q481 PolarHBondContact O-N 3.38Å
478	L	87.8	Confident	82.5	Confident	105 Å²	105	116.8 Å²	116.8	55%	0.55	58%	0.584	S	S	.	*	H	α-helix	trans	-64.6	-45	176.5	-74.9	167.5	0	0	0	111.7	E474 L475 F480 Q481 L482	E474-L478 WeakPolarHBondContact O-CB 3.33Å; E474-L478 VanDerWaalsContact O-CG 3.32Å; E474-L478 WeakPolarHBondContact O-CG 3.46Å; E474-L478 PolarHBondContact O-N 3.37Å; L475-L478 PolarHBondContact O-N 3.23Å; L478-F480 VanDerWaalsContact C-N 3.34Å; L478-F480 PolarHBondContact O-N 3.41Å; L478-Q481 PolarHBondContact O-N 2.93Å; L478-L482 WeakPolarHBondContact O-CB 3.38Å; L478-L482 PolarHBondContact O-N 2.88Å
479	I	87.2	Confident	80.8	Confident	78 Å²	78	117.3 Å²	117.3	40%	0.4	59%	0.592	S	S	.	*	H	α-helix	trans	-58.9	-45.5	174.5	-69.4	165.3	0	0	0	110.3	L475 Q481 L482 N483	L475-I479 HydrophobicContact CD1-CD1 4.16Å; L475-I479 HydrophobicContact CD1-CG1 4.38Å; L475-I479 HydrophobicContact CG-CD1 3.92Å; L475-I479 VanDerWaalsContact O-CG1 3.28Å; L475-I479 WeakPolarHBondContact O-CG1 3.21Å; L475-I479 PolarHBondContact O-N 3.38Å; I479-Q481 VanDerWaalsContact C-N 3.32Å; I479-Q481 PolarHBondContact O-N 3.04Å; I479-L482 PolarHBondContact O-N 3.5Å; I479-N483 VanDerWaalsContact O-CB 3.3Å; I479-N483 WeakPolarHBondContact O-CB 3.29Å; I479-N483 VanDerWaalsContact O-CG 3.29Å; I479-N483 PolarHBondContact O-N 3.38Å
480	F	83.2	Confident	79	Confident	130 Å²	130	123.5 Å²	123.5	57%	0.57	62%	0.616	S	S	*	*	H	α-helix	trans	-67.2	-28.2	177.4	-177.6	-115.2	0	0	0	113.8	N476 I477 L478 K484	N476-F480 WeakPolarHBondContact O-CB 3.49Å; N476-F480 PolarHBondContact O-N 2.95Å; I477-F480 PolarHBondContact O-N 3.26Å; L478-F480 VanDerWaalsContact C-N 3.34Å; L478-F480 PolarHBondContact O-N 3.41Å; F480-K484 VanDerWaalsContact CE1-CE 3.48Å; F480-K484 VanDerWaalsContact CZ-CE 3.42Å; F480-K484 WeakPolarHBondContact O-CG 3.49Å
481	Q	79.9	Confident	77.3	Confident	123 Å²	123	129.8 Å²	129.8	58%	0.575	64%	0.638	S	S	*	*	H	α-helix	trans	-76.2	-38	171.7	-74.4	-179.6	43.6	0	0	112.4	I477 L478 I479 K484	I477-Q481 VanDerWaalsContact CG2-NE2 3.26Å; I477-Q481 WeakPolarHBondContact O-CG 3.34Å; I477-Q481 PolarHBondContact O-N 3.38Å; L478-Q481 PolarHBondContact O-N 2.93Å; I479-Q481 VanDerWaalsContact C-N 3.32Å; I479-Q481 PolarHBondContact O-N 3.04Å; Q481-K484 PolarHBondContact O-N 3.4Å
482	L	77.1	Confident	75.4	Confident	148 Å²	148	136.4 Å²	136.4	78%	0.775	66%	0.655	S	S	*	*	H	α-helix	trans	-74.2	-34.1	-178.6	-155.9	153.9	0	0	0	111.4	L478 I479 K484	L478-L482 WeakPolarHBondContact O-CB 3.38Å; L478-L482 PolarHBondContact O-N 2.88Å; I479-L482 PolarHBondContact O-N 3.5Å; L482-K484 PolarHBondContact O-N 3.32Å
483	N	72.5	Confident	73.4	Confident	124 Å²	124	141.5 Å²	141.5	66%	0.663	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	5.1	173.2	-66.8	-11.9	0	0	0	114	I479	I479-N483 VanDerWaalsContact O-CB 3.3Å; I479-N483 WeakPolarHBondContact O-CB 3.29Å; I479-N483 VanDerWaalsContact O-CG 3.29Å; I479-N483 PolarHBondContact O-N 3.38Å
484	K	64.8	Low	71.3	Confident	121 Å²	121	136.9 Å²	136.9	53%	0.526	68%	0.678	S	S	.	*	S	Bend	trans	-92.2	113.7	170.9	-90	177	176.8	178.8	0	110.7	F480 Q481 L482 K486	F480-K484 VanDerWaalsContact CE1-CE 3.48Å; F480-K484 VanDerWaalsContact CZ-CE 3.42Å; F480-K484 WeakPolarHBondContact O-CG 3.49Å; Q481-K484 PolarHBondContact O-N 3.4Å; L482-K484 PolarHBondContact O-N 3.32Å; K484-K486 PolarHBondContact O-N 3.36Å
485	D	63.6	Low	69.6	Low	158 Å²	158	141.9 Å²	141.9	85%	0.845	70%	0.698	S	S	*	*			trans	-49.6	135.8	169.3	-86.9	-46.6	0	0	0	111.8
486	K	58.5	Low	67.5	Low	195 Å²	195	146.6 Å²	146.6	85%	0.848	71%	0.714	S	S	*	*			trans	-57.9	121.6	179.1	-72.7	175.4	179.2	170	0	109.1	K484 N488	K484-K486 PolarHBondContact O-N 3.36Å; K486-N488 PolarHBondContact O-N 3.05Å
487	P	56.7	Low	65.4	Low	114 Å²	114	151.9 Å²	151.9	74%	0.74	73%	0.733	S	S	*	*			trans	-60.1	114.3	-174.5	22.2	-32.9	0	0	0	110.1	V489	P487-V489 WeakPolarHBondContact O-CG2 3.45Å; P487-V489 PolarHBondContact O-N 3.42Å
488	N	56.9	Low	63.5	Low	151 Å²	151	159.2 Å²	159.2	81%	0.807	76%	0.755	S	S	*	*			trans	-78.8	85	-167.6	-166	-15.7	0	0	0	111	K486 K490	K486-N488 PolarHBondContact O-N 3.05Å; N488-K490 PolarHBondContact O-N 3.07Å
489	V	60.9	Low	61.5	Low	121 Å²	121	159.5 Å²	159.5	73%	0.733	77%	0.766	S	S	*	*			trans	-67.5	93.3	-173.8	-168.4	0	0	0	0	111.1	P487 K491	P487-V489 WeakPolarHBondContact O-CG2 3.45Å; P487-V489 PolarHBondContact O-N 3.42Å; V489-K491 PolarHBondContact O-N 3.02Å
490	K	56.8	Low	59.8	Low	191 Å²	191	166.7 Å²	166.7	83%	0.83	79%	0.788	S	S	*	*			trans	-56.3	105.4	173.5	-69.6	-176.5	178.9	178.6	0	110.4	N488 R492	N488-K490 PolarHBondContact O-N 3.07Å; K490-R492 PolarHBondContact O-N 3.49Å
491	K	61.6	Low	57.9	Low	204 Å²	204	167.9 Å²	167.9	89%	0.887	80%	0.799	S	S	*	*			trans	-59.7	92.7	-176.7	-66.3	178.8	179.7	175.6	0	112.1	V489 K493	V489-K491 PolarHBondContact O-N 3.02Å; K491-K493 PolarHBondContact O-N 3.32Å
492	R	54.4	Low	56.5	Low	246 Å²	246	170.9 Å²	170.9	93%	0.928	81%	0.811	S	S	*	*			trans	-68.3	115	171.8	-90.4	-176.4	164	170.3	-4.3	110.5	K490 G494	K490-R492 PolarHBondContact O-N 3.49Å; R492-G494 VanDerWaalsContact C-N 3.34Å; R492-G494 PolarHBondContact O-N 3.2Å
493	K	53.8	Low	54.9	Low	214 Å²	214	171 Å²	171	93%	0.93	81%	0.811	S	S	*	*			trans	-68.9	83.6	170.8	-74.9	-177.4	175.3	177.3	0	110.9	K491	K491-K493 PolarHBondContact O-N 3.32Å
494	G	49.7	Very low	53.6	Low	63 Å²	63	173.3 Å²	173.3	65%	0.649	82%	0.815	S	S	*	*			trans	-82.3	111.1	173.7	0	0	0	0	0	112.7	R492 F496	R492-G494 VanDerWaalsContact C-N 3.34Å; R492-G494 PolarHBondContact O-N 3.2Å; G494-F496 VanDerWaalsContact C-N 3.26Å; G494-F496 PolarHBondContact O-N 3.45Å
495	K	58.9	Low	52.6	Low	214 Å²	214	174.1 Å²	174.1	93%	0.93	83%	0.825	S	S	*	*			trans	-77.6	63.8	175.4	-70.1	-174.9	178.1	178.8	0	112.4	K497	K495-K497 PolarHBondContact O-N 3.18Å
496	F	48.4	Very low	51.8	Low	199 Å²	199	170 Å²	170	87%	0.873	82%	0.82	S	S	*	*			trans	-80.8	114.7	173.1	-99	-89.6	0	0	0	111.8	G494	G494-F496 VanDerWaalsContact C-N 3.26Å; G494-F496 PolarHBondContact O-N 3.45Å
497	K	49.9	Very low	51.4	Low	196 Å²	196	168.7 Å²	168.7	85%	0.852	82%	0.822	S	S	*	*			trans	-66.8	129.5	170.1	-67	-177.2	178.4	179.8	0	109	K495 S499	K495-K497 PolarHBondContact O-N 3.18Å; K497-S499 PolarHBondContact O-N 3.11Å
498	R	50.1	Low	51.1	Low	248 Å²	248	175 Å²	175	94%	0.936	83%	0.832	S	S	*	*			trans	-73.5	85.6	174.3	-76.5	178.8	164.1	178.8	-6.1	111.1
499	S	47.3	Very low	50.4	Low	112 Å²	112	176.1 Å²	176.1	78%	0.783	84%	0.836	S	S	*	*			trans	-69	142.6	158.2	52.6	0	0	0	0	109.5	K497 L501	K497-S499 PolarHBondContact O-N 3.11Å; S499-L501 PolarHBondContact O-N 2.97Å; S499-L501 VanDerWaalsContact O-N 3.16Å
500	R	50.3	Low	49.7	Very low	228 Å²	228	175.4 Å²	175.4	86%	0.86	84%	0.836	S	S	*	*			trans	-87.3	83.2	-166.3	-65	159.9	76	-168.9	5.7	111.3	K502	R500-K502 PolarHBondContact O-N 3.06Å
501	L	44.2	Very low	49.4	Very low	155 Å²	155	173.6 Å²	173.6	81%	0.812	84%	0.835	S	S	*	*			trans	-80.7	95.5	162.6	-158.9	81	0	0	0	109.4	S499 L503	S499-L501 PolarHBondContact O-N 2.97Å; S499-L501 VanDerWaalsContact O-N 3.16Å; L501-L503 HydrophobicContact CD2-CD1 4.45Å; L501-L503 PolarHBondContact O-N 2.8Å
502	K	50.1	Low	48.8	Very low	187 Å²	187	168.7 Å²	168.7	81%	0.813	82%	0.824	S	S	*	*			trans	-80.4	87.1	166.2	-83.7	-158.1	173.6	-168	0	109.2	R500	R500-K502 PolarHBondContact O-N 3.06Å
503	L	43.7	Very low	48.7	Very low	150 Å²	150	162.5 Å²	162.5	79%	0.785	82%	0.818	S	S	*	*			trans	-76.6	118	151.8	-128.3	78.2	0	0	0	107.4	L501	L501-L503 HydrophobicContact CD2-CD1 4.45Å; L501-L503 PolarHBondContact O-N 2.8Å
504	K	44.1	Very low	48.6	Very low	173 Å²	173	159.3 Å²	159.3	75%	0.752	81%	0.811	S	S	*	*			trans	-90.8	153.5	164.7	-148.1	-169.2	176.9	-161.2	0	107.2
505	D	45.2	Very low	48.4	Very low	137 Å²	137	163.7 Å²	163.7	73%	0.733	81%	0.812	S	S	*	*	S	Bend	trans	67.2	119.9	172.1	-45.7	-38.4	0	0	0	114.7
506	G	45.5	Very low	48	Very low	71 Å²	71	161.5 Å²	161.5	73%	0.732	81%	0.805	S	S	*	*			trans	-102.1	-170.5	-171	0	0	0	0	0	114.8
507	N	50.4	Low	48.2	Very low	168 Å²	168	157.9 Å²	157.9	90%	0.898	79%	0.791	S	S	*	*			trans	63.4	48	167.5	-65.7	14.7	0	0	0	117.4
508	R	49.9	Very low	48.6	Very low	248 Å²	248	156.6 Å²	156.6	94%	0.936	79%	0.786	S	S	*	*			trans	-134.2	77.1	146.7	-74	-164.6	175.8	-166.1	-1	111.7
509	I	42.3	Very low	48.7	Very low	174 Å²	174	149.6 Å²	149.6	89%	0.892	77%	0.766	S	S	*	*			trans	-81.8	109.6	155.8	-55.4	176.6	0	0	0	105.6
510	S	48.1	Very low	49.3	Very low	106 Å²	106	147.2 Å²	147.2	74%	0.741	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-68.9	135.6	174.8	49.7	0	0	0	0	110.5
511	L	48.6	Very low	49.1	Very low	153 Å²	153	140.6 Å²	140.6	80%	0.801	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-60.1	152.7	163.6	-68.4	166.9	0	0	0	109.8	S513	L511-S513 PolarHBondContact O-N 3.47Å
512	P	49.5	Very low	49.4	Very low	101 Å²	101	138.8 Å²	138.8	66%	0.656	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-54.9	135.3	173.8	-24.5	34.8	0	0	0	111.2	D514	P512-D514 PolarHBondContact O-N 3.08Å
513	S	53.3	Low	49	Very low	116 Å²	116	132.2 Å²	132.2	81%	0.811	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-18.9	-165.2	-162.9	0	0	0	0	114.9	L511	L511-S513 PolarHBondContact O-N 3.47Å
514	D	50.9	Low	49	Very low	146 Å²	146	128.9 Å²	128.9	78%	0.781	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	7.4	-163.1	-45.2	-58.9	0	0	0	113.5	P512 Q516	P512-D514 PolarHBondContact O-N 3.08Å; D514-Q516 PolarHBondContact O-N 2.94Å
515	F	46.5	Very low	49.3	Very low	156 Å²	156	125.8 Å²	125.8	68%	0.684	69%	0.686	S	S	*	*			trans	-89.3	86.7	-174.3	-154.6	-90.8	0	0	0	113.1	H517	F515-H517 AromaticContact CD1-CD2 3.81Å; F515-H517 AromaticContact CD1-NE2 3.59Å; F515-H517 AromaticContact CE1-NE2 3.83Å; F515-H517 PolarHBondContact O-N 3.35Å
516	Q	50.3	Low	49.1	Very low	167 Å²	167	124.1 Å²	124.1	78%	0.78	69%	0.685	S	S	*	*			trans	-73.6	106.6	-179.2	-67.5	-173.3	-5.6	0	0	113.6	D514 K518	D514-Q516 PolarHBondContact O-N 2.94Å; Q516-K518 PolarHBondContact O-N 3.09Å
517	H	51.3	Low	48.9	Very low	124 Å²	124	128.9 Å²	128.9	57%	0.574	69%	0.69	S	S	*	*			trans	-76.2	104.4	166.5	-75.5	-100.3	0	0	0	111.1	F515 I519 T520	F515-H517 AromaticContact CD1-CD2 3.81Å; F515-H517 AromaticContact CD1-NE2 3.59Å; F515-H517 AromaticContact CE1-NE2 3.83Å; F515-H517 PolarHBondContact O-N 3.35Å; H517-I519 PolarHBondContact O-N 3.49Å; H517-T520 HydrophobicContact CB-CG2 4.28Å
518	K	59	Low	48.2	Very low	169 Å²	169	127.7 Å²	127.7	74%	0.735	68%	0.684	S	S	*	*	S	Bend	trans	-71	-14.5	177	-69.5	-169.9	174.9	-175.2	0	114.8	Q516	Q516-K518 PolarHBondContact O-N 3.09Å
519	I	52.4	Low	47.8	Very low	101 Å²	101	125.2 Å²	125.2	52%	0.518	68%	0.68	S	S	.	*			trans	-137	124.7	172.6	-59.7	176.3	0	0	0	107.2	H517 V521 A552	H517-I519 PolarHBondContact O-N 3.49Å; I519-V521 HydrophobicContact CG2-CG2 4.22Å; I519-A552 HydrophobicContact CG2-CB 3.61Å
520	T	60	Low	47.5	Very low	62 Å²	62	128.6 Å²	128.6	38%	0.38	68%	0.681	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105	137.3	164.8	44.4	0	0	0	0	109.5	H517 A552 I553	H517-T520 HydrophobicContact CB-CG2 4.28Å; T520-A552 WeakPolarHBondContact O-CA 3.34Å; T520-I553 PolarHBondContact N-O 3.36Å; T520-I553 PolarHBondContact O-N 2.85Å
521	V	46.4	Very low	46.9	Very low	88 Å²	88	134.8 Å²	134.8	53%	0.533	69%	0.688	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109	109.7	-178.7	-180	0	0	0	0	107.9	I519 L550 R551	I519-V521 HydrophobicContact CG2-CG2 4.22Å; V521-L550 HydrophobicContact CG1-CB 3.64Å; V521-L550 HydrophobicContact CG1-CD1 3.99Å; V521-L550 HydrophobicContact CG1-CD2 4.26Å; V521-L550 HydrophobicContact CG1-CG 4.17Å; V521-R551 WeakPolarHBondContact CA-O 3.29Å
522	Q	49.3	Very low	46.1	Very low	117 Å²	117	132.9 Å²	132.9	55%	0.547	69%	0.688	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.7	136.9	-176	-157.8	173.4	13.3	0	0	110.5	R551	Q522-R551 PolarHBondContact N-O 3.38Å; Q522-R551 PolarHBondContact O-N 3.42Å; Q522-R551 VanDerWaalsContact O-N 3.12Å
523	A	42.6	Very low	45.6	Very low	49 Å²	49	134.5 Å²	134.5	41%	0.405	69%	0.69	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.2	134	165.3	0	0	0	0	0	109.1	L550	A523-L550 HydrophobicContact CB-CD2 4.21Å
524	S	43	Very low	44.6	Very low	81 Å²	81	137.5 Å²	137.5	57%	0.566	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-55.7	129.9	177.8	-53.9	0	0	0	0	111.5	S526	S524-S526 PolarHBondContact O-N 3.3Å
525	P	50.2	Low	43.8	Very low	108 Å²	108	136.4 Å²	136.4	70%	0.701	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-59.9	122.6	174.7	-25	35	0	0	0	112	M527	P525-M527 PolarHBondContact O-N 2.77Å
526	S	42.2	Very low	43.2	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	71%	0.707	S	S	*	*			trans	-75.6	104.4	177.1	51.9	0	0	0	0	110.9	S524 D528	S524-S526 PolarHBondContact O-N 3.3Å; S526-D528 PolarHBondContact O-N 2.88Å
527	M	40.7	Very low	42.5	Very low	171 Å²	171	133.9 Å²	133.9	84%	0.842	71%	0.709	S	S	*	*			trans	-81.1	51.4	-178.4	-80.6	-60.3	-55.9	0	0	113.9	P525 K529	P525-M527 PolarHBondContact O-N 2.77Å; M527-K529 PolarHBondContact O-N 2.91Å; M527-K529 VanDerWaalsContact O-N 3.14Å
528	D	36	Very low	41.6	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	72%	0.719	S	S	*	*			trans	-82.3	84.4	175.1	-81.9	-63.7	0	0	0	112	S526	S526-D528 PolarHBondContact O-N 2.88Å
529	K	41.2	Very low	40.6	Very low	197 Å²	197	130.9 Å²	130.9	86%	0.857	72%	0.723	S	S	*	*			trans	-160.2	59.3	168.3	-121.6	166.7	-168.7	176	0	117.4	M527	M527-K529 PolarHBondContact O-N 2.91Å; M527-K529 VanDerWaalsContact O-N 3.14Å
530	R	36.2	Very low	40.3	Very low	244 Å²	244	131.7 Å²	131.7	92%	0.921	74%	0.735	S	S	*	*			trans	-149.7	120.5	145.6	-164.2	163	-73.5	-132.3	2.3	112.6
531	R	35.7	Very low	39.4	Very low	236 Å²	236	134.9 Å²	134.9	89%	0.891	76%	0.757	S	S	*	*			trans	-78.2	130.6	167.4	176.2	-171.2	-81.5	-166.4	-5.7	108.6
532	S	30.6	Very low	38.9	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	77%	0.771	S	S	*	*			trans	-141	169.3	158.5	-160.8	0	0	0	0	108.9
533	L	40.4	Very low	38.1	Very low	136 Å²	136	135.9 Å²	135.9	71%	0.712	78%	0.78	S	S	*	*			trans	-104.8	-179.8	-163.3	-69.5	165.6	0	0	0	113.4
534	H	32.8	Very low	38	Very low	179 Å²	179	139.1 Å²	139.1	83%	0.829	80%	0.797	S	S	*	*			trans	83.3	120.8	173.3	-44.5	-69	0	0	0	115.3
535	S	33.3	Very low	37.8	Very low	122 Å²	122	141.9 Å²	141.9	85%	0.853	81%	0.811	S	S	*	*			trans	-133.2	128.2	-178.1	-52.5	0	0	0	0	110.1
536	T	33.7	Very low	37.6	Very low	152 Å²	152	144.7 Å²	144.7	93%	0.933	82%	0.819	S	S	*	*			trans	-136.8	146.4	156.1	46.6	0	0	0	0	107.6
537	S	34.6	Very low	37.8	Very low	119 Å²	119	146.9 Å²	146.9	83%	0.832	82%	0.822	S	S	*	*			trans	-138.5	129.1	-160.1	56.7	0	0	0	0	113.5
538	S	32.8	Very low	38.1	Very low	113 Å²	113	143 Å²	143	79%	0.79	81%	0.809	S	S	*	*			trans	-156.8	156.3	159.1	58.3	0	0	0	0	111.1
539	S	39.1	Very low	38.4	Very low	117 Å²	117	146.8 Å²	146.8	82%	0.818	81%	0.813	S	S	*	*	S	Bend	trans	76.7	146.1	-177.2	-54.3	0	0	0	0	116.3
540	P	44.8	Very low	38.9	Very low	117 Å²	117	142.9 Å²	142.9	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-93.9	155.8	-152.9	35.9	-37.3	0	0	0	115.6
541	P	42	Very low	39.5	Very low	129 Å²	129	139.9 Å²	139.9	84%	0.838	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-78.2	133.9	175	31.8	-34.2	0	0	0	112.9
542	S	36.3	Very low	40.1	Very low	119 Å²	119	132 Å²	132	83%	0.832	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-70.6	162.4	170.3	-55.5	0	0	0	0	112.9
543	S	32.9	Very low	41.1	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-51.7	146.4	-179.4	-50.4	0	0	0	0	114.6	T545	S543-T545 PolarHBondContact O-N 3.31Å
544	P	38.8	Very low	41.4	Very low	117 Å²	117	131 Å²	131	76%	0.76	76%	0.756	S	S	*	*			trans	-74.1	111.2	-169.2	28.8	-35.9	0	0	0	113.9	L546	P544-L546 VanDerWaalsContact C-N 3.34Å; P544-L546 PolarHBondContact O-N 3.18Å
545	T	40.5	Very low	42.2	Very low	140 Å²	140	129 Å²	129	86%	0.859	75%	0.751	S	S	*	*			trans	-81.2	73.2	171.7	51.5	0	0	0	0	112.2	S543 I547	S543-T545 PolarHBondContact O-N 3.31Å; T545-I547 VanDerWaalsContact C-N 3.3Å; T545-I547 PolarHBondContact O-N 2.93Å
546	L	45.5	Very low	42.5	Very low	166 Å²	166	129.2 Å²	129.2	87%	0.869	75%	0.747	S	S	*	*			trans	-87.4	57.5	174.3	-92.4	169.6	0	0	0	112.8	P544	P544-L546 VanDerWaalsContact C-N 3.34Å; P544-L546 PolarHBondContact O-N 3.18Å
547	I	45.8	Very low	42.8	Very low	147 Å²	147	129.7 Å²	129.7	75%	0.754	74%	0.738	S	S	*	*	S	Bend	trans	-135.8	118.5	166.6	-54.3	179.4	0	0	0	108.6	T545 R549	T545-I547 VanDerWaalsContact C-N 3.3Å; T545-I547 PolarHBondContact O-N 2.93Å; I547-R549 PolarHBondContact O-N 3.37Å
548	P	46.4	Very low	42.8	Very low	89 Å²	89	131.7 Å²	131.7	58%	0.578	74%	0.74	S	S	*	*			trans	-67.6	125.6	176	27.7	-33	0	0	0	110.1	L550	P548-L550 PolarHBondContact O-N 3.33Å
549	R	43.8	Very low	42.9	Very low	223 Å²	223	133.9 Å²	133.9	84%	0.842	74%	0.737	S	S	*	*			trans	-65.5	107.8	174	-88.2	-174	166.9	122.6	-4.6	110	I547	I547-R549 PolarHBondContact O-N 3.37Å
550	L	50.6	Low	42.7	Very low	115 Å²	115	133.2 Å²	133.2	60%	0.602	73%	0.733	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.8	127.4	172.7	-61.2	-177.8	0	0	0	110	V521 A523 P548	V521-L550 HydrophobicContact CG1-CB 3.64Å; V521-L550 HydrophobicContact CG1-CD1 3.99Å; V521-L550 HydrophobicContact CG1-CD2 4.26Å; V521-L550 HydrophobicContact CG1-CG 4.17Å; A523-L550 HydrophobicContact CB-CD2 4.21Å; P548-L550 PolarHBondContact O-N 3.33Å
551	R	48.4	Very low	42.1	Very low	181 Å²	181	133.5 Å²	133.5	68%	0.683	73%	0.728	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.3	129.5	166.2	-74.6	-166.2	-178.8	-165	3.3	110	V521 Q522	V521-R551 WeakPolarHBondContact CA-O 3.29Å; Q522-R551 PolarHBondContact N-O 3.38Å; Q522-R551 PolarHBondContact O-N 3.42Å; Q522-R551 VanDerWaalsContact O-N 3.12Å
552	A	49.2	Very low	42	Very low	72 Å²	72	137.6 Å²	137.6	60%	0.595	73%	0.727	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.7	127.1	160.8	0	0	0	0	0	108.8	I519 T520	I519-A552 HydrophobicContact CG2-CB 3.61Å; T520-A552 WeakPolarHBondContact O-CA 3.34Å
553	I	50.7	Low	41.9	Very low	76 Å²	76	137.4 Å²	137.4	39%	0.39	72%	0.721	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.8	126.8	172	-58.4	176.8	0	0	0	107.5	T520	T520-I553 PolarHBondContact N-O 3.36Å; T520-I553 PolarHBondContact O-N 2.85Å
554	Q	48.2	Very low	41.9	Very low	151 Å²	151	144.8 Å²	144.8	71%	0.706	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-96.9	119.5	168.6	-178.9	176.7	-8.4	0	0	107.7	T556	Q554-T556 PolarHBondContact O-N 2.96Å
555	L	48.5	Very low	41.5	Very low	138 Å²	138	142.6 Å²	142.6	72%	0.723	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-75.3	117.6	174.5	-70.3	167	0	0	0	109
556	T	40.3	Very low	41	Very low	126 Å²	126	147 Å²	147	77%	0.773	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-79.4	137.4	167.9	45.1	0	0	0	0	109.9	Q554 D558	Q554-T556 PolarHBondContact O-N 2.96Å; T556-D558 PolarHBondContact O-N 3.2Å
557	Q	40.2	Very low	40.2	Very low	161 Å²	161	143.6 Å²	143.6	75%	0.752	72%	0.722	S	S	*	*			trans	-68.5	114.1	176.5	173.2	172.4	-39.7	0	0	109.8	E559	Q557-E559 HydrophobicContact CG-CG 4.07Å; Q557-E559 PolarHBondContact NE2-OE1 2.95Å
558	D	34.1	Very low	39.4	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	72%	0.718	S	S	*	*			trans	-93.7	103.1	179.8	-151.6	7.2	0	0	0	108.8	T556	T556-D558 PolarHBondContact O-N 3.2Å
559	E	34.2	Very low	38.6	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.743	73%	0.732	S	S	*	*			trans	-84.3	123.1	-172.1	-62.3	-155.5	142.3	0	0	111.8	Q557	Q557-E559 HydrophobicContact CG-CG 4.07Å; Q557-E559 PolarHBondContact NE2-OE1 2.95Å
560	S	34.8	Very low	37.9	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	74%	0.737	S	S	*	*			trans	-124.6	132.3	173.6	68	0	0	0	0	112.7
561	N	33.4	Very low	36.7	Very low	123 Å²	123	149.2 Å²	149.2	66%	0.658	75%	0.747	S	S	*	*			trans	83.7	93.7	166	-64.1	-71.7	0	0	0	120.9
562	R	40.2	Very low	36.6	Very low	214 Å²	214	144.7 Å²	144.7	81%	0.808	74%	0.741	S	S	*	*				105.1	94.7	113.9	-72.3	171.4	-168.8	-139.4	-3.6	120.4
563	T	33.8	Very low	35.6	Very low	116 Å²	116	150.5 Å²	150.5	71%	0.712	76%	0.756	S	S	*	*				53.5	122.8	113.9	-34.6	0	0	0	0	120.8
564	W	31.5	Very low	34.6	Very low	261 Å²	261	155 Å²	155	99%	0.989	78%	0.775	S	S	*	*				-174.2	153.8	122.4	-85	112.8	0	0	0	109.2
565	G	31.6	Very low	33.6	Very low	71 Å²	71	156.9 Å²	156.9	73%	0.732	78%	0.781	S	S	*	*			trans	117.2	38	153.9	0	0	0	0	0	123.8
566	R	30.5	Very low	32.8	Very low	234 Å²	234	156.4 Å²	156.4	88%	0.883	78%	0.779	S	S	*	*			trans	28	138.4	140	-152.4	-176.1	-153.7	-102.4	8.2	122.8
567	S	28.6	Very low	32.4	Very low	93 Å²	93	157.8 Å²	157.8	65%	0.65	78%	0.782	S	S	*	*			trans	74.4	154	151.7	-102	0	0	0	0	119.8
568	S	29.3	Very low	32.1	Very low	96 Å²	96	155.1 Å²	155.1	67%	0.671	78%	0.777	S	S	*	*			cis	-173.6	144.5	-29.3	42	0	0	0	0	112.1
569	L	29.2	Very low	32	Very low	167 Å²	167	156 Å²	156	87%	0.874	77%	0.773	S	S	*	*			trans	32.7	124.8	153	-62.6	172.1	0	0	0	121.2
570	F	28.1	Very low	31.9	Very low	217 Å²	217	158.5 Å²	158.5	95%	0.952	78%	0.781	S	S	*	*			trans	-158.5	155.5	139.4	-111	-73.1	0	0	0	113.1
571	R	24.9	Very low	31.8	Very low	213 Å²	213	157.3 Å²	157.3	80%	0.804	79%	0.785	S	S	*	*			trans	-168.5	163.6	177	-160.8	-123.4	177.9	-159.9	-7.6	107.3
572	P	46.9	Very low	31.7	Very low	86 Å²	86	158.8 Å²	158.8	56%	0.558	79%	0.791	S	S	*	*			cis	-108.7	-179.2	-33.7	38.9	-26.5	0	0	0	112.2
573	E	29.1	Very low	31.3	Very low	193 Å²	193	157.5 Å²	157.5	90%	0.902	79%	0.792	S	S	*	*				-165.6	176.4	116.5	-118.1	174.7	164.5	0	0	111.5
574	E	29.6	Very low	31.4	Very low	170 Å²	170	160.9 Å²	160.9	79%	0.794	80%	0.796	S	S	*	*			trans	-114.9	149.2	-168.6	-59.6	168.4	163.1	0	0	110.6
575	F	26.8	Very low	31.5	Very low	192 Å²	192	158.5 Å²	158.5	84%	0.842	79%	0.793	S	S	*	*				-173.5	179.5	128.1	-123.9	-103.3	0	0	0	114.4
576	D	31.4	Very low	31.5	Very low	127 Å²	127	158.9 Å²	158.9	68%	0.679	80%	0.797	S	S	*	*			trans	-86.2	157.7	-154.9	-75.7	-51.3	0	0	0	119.8
577	D	32.7	Very low	31.7	Very low	156 Å²	156	158.5 Å²	158.5	83%	0.834	80%	0.796	S	S	*	*			trans	66.7	173.6	142.2	-123.1	-33.5	0	0	0	123.8
578	V	32.8	Very low	32	Very low	105 Å²	105	160.8 Å²	160.8	64%	0.636	81%	0.805	S	S	*	*			trans	89	88.9	161.2	-162.8	0	0	0	0	119.2
579	K	31.6	Very low	32	Very low	180 Å²	180	167.8 Å²	167.8	78%	0.783	82%	0.818	S	S	*	*			trans	67.8	144.2	136.8	-64.9	174.2	-176.7	163.7	0	121.7
580	K	34	Very low	32.2	Very low	211 Å²	211	163.1 Å²	163.1	92%	0.917	81%	0.809	S	S	*	*			trans	66.6	128.1	157.1	-66.5	165.9	178.1	-179.5	0	117.2
581	G	31	Very low	32.7	Very low	78 Å²	78	158.5 Å²	158.5	80%	0.804	80%	0.801	S	S	*	*			trans	177	62.3	173.5	0	0	0	0	0	116.6	K583	G581-K583 PolarHBondContact O-N 3.41Å
582	I	32.2	Very low	32.9	Very low	154 Å²	154	153.6 Å²	153.6	79%	0.79	80%	0.8	S	S	*	*			trans	-63.2	124.1	179.1	-47.5	165.5	0	0	0	111.5
583	K	32.5	Very low	32.3	Very low	188 Å²	188	155.2 Å²	155.2	82%	0.817	81%	0.813	S	S	*	*			trans	154.4	108.5	142.1	-82.9	149.4	-164	173.5	0	110	G581	G581-K583 PolarHBondContact O-N 3.41Å
584	K	35.5	Very low	32.4	Very low	186 Å²	186	152.4 Å²	152.4	81%	0.809	81%	0.809	S	S	*	*				75.3	108.4	80.7	-83.3	-172.6	175.1	176	0	115.7
585	K	32.8	Very low	32.4	Very low	211 Å²	211	153.8 Å²	153.8	92%	0.917	82%	0.815	S	S	*	*			trans	71.5	140.5	153.7	-57.7	-175	174.8	-170.9	0	117.9
586	G	32.5	Very low	32.5	Very low	79 Å²	79	150.1 Å²	150.1	81%	0.814	81%	0.814	S	S	*	*			trans	162.7	26.3	172.6	0	0	0	0	0	118.8
587	R	34.2	Very low	32.4	Very low	227 Å²	227	154 Å²	154	86%	0.857	82%	0.824	S	S	*	*			trans	-87.3	121.9	168.1	-77.7	-160.7	-167.2	-83.7	6.5	110.8
588	T	35.4	Very low	32.3	Very low	140 Å²	140	153.6 Å²	153.6	86%	0.859	82%	0.817	S	S	*	*			trans	-139.7	147.3	151.9	29	0	0	0	0	108.6
589	W	29	Very low	32.3	Very low	244 Å²	244	158 Å²	158	92%	0.924	82%	0.823	S	S	*	*			trans	-97.4	148.9	-172.7	-70.8	76.1	0	0	0	112
590	G	33.9	Very low	32.9	Very low	68 Å²	68	154.5 Å²	154.5	70%	0.701	82%	0.818	S	S	*	*			trans	-153.6	148.2	167.9	0	0	0	0	0	109.7
591	P	37.8	Very low	32.8	Very low	120 Å²	120	149.3 Å²	149.3	78%	0.779	81%	0.814	S	S	*	*			trans	-117.7	157.4	-150.1	40.2	-30.8	0	0	0	117.6
592	S	29.5	Very low	32.8	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	81%	0.814	S	S	*	*			trans	87.5	166.2	145	82.9	0	0	0	0	121.2
593	S	33.3	Very low	33.1	Very low	120 Å²	120	147.3 Å²	147.3	84%	0.839	81%	0.813	S	S	*	*			trans	77.6	130.7	-177.7	76.9	0	0	0	0	116.9
594	V	31.6	Very low	33.2	Very low	133 Å²	133	147.7 Å²	147.7	81%	0.806	82%	0.818	S	S	*	*			trans	-111	137.1	-173.6	173.4	0	0	0	0	108.9
595	Q	30.1	Very low	33.1	Very low	199 Å²	199	150.2 Å²	150.2	93%	0.93	82%	0.822	S	S	*	*			trans	-155.3	142.5	143.5	-114.3	165	44.5	0	0	111.1
596	S	29.5	Very low	33.1	Very low	116 Å²	116	146.9 Å²	146.9	81%	0.811	82%	0.82	S	S	*	*			trans	-108.1	154	-168.2	45.4	0	0	0	0	112.2
597	K	29.5	Very low	33	Very low	207 Å²	207	153.6 Å²	153.6	90%	0.9	82%	0.82	S	S	*	*			trans	-148.7	126.5	165.8	-161.7	168.9	-177	175.5	0	110.3
598	E	29.4	Very low	32.9	Very low	148 Å²	148	148.5 Å²	148.5	69%	0.692	82%	0.816	S	S	*	*			trans	-67.3	165.4	173.1	-44.8	172.2	99.2	0	0	110.4
599	R	32.7	Very low	32.6	Very low	198 Å²	198	150.3 Å²	150.3	75%	0.747	82%	0.82	S	S	*	*			cis	-161.5	-177.7	32.9	-96.2	-164.7	-178	81	25.1	108.3
600	P	44.3	Very low	32.7	Very low	107 Å²	107	144.1 Å²	144.1	70%	0.695	81%	0.814	S	S	*	*			cis	-134.1	179.5	-35.3	37.4	-20.9	0	0	0	113.3
601	A	32.5	Very low	32.5	Very low	101 Å²	101	148.9 Å²	148.9	84%	0.835	82%	0.823	S	S	*	*			trans	58.3	139.4	148.5	0	0	0	0	0	120
602	A	31.2	Very low	32.1	Very low	95 Å²	95	146.2 Å²	146.2	79%	0.785	82%	0.817	S	S	*	*			cis	-157.8	-172.6	5.1	0	0	0	0	0	111.2
603	A	36.9	Very low	32	Very low	95 Å²	95	146 Å²	146	79%	0.785	82%	0.816	S	S	*	*			trans	68.2	70.1	162.6	0	0	0	0	0	118.7
604	E	35.1	Very low	32.2	Very low	196 Å²	196	148.2 Å²	148.2	92%	0.916	82%	0.818	S	S	*	*				42.2	98.6	119.4	-167.9	167.7	-137.6	0	0	119.5
605	R	34	Very low	32.3	Very low	239 Å²	239	147.5 Å²	147.5	90%	0.902	82%	0.816	S	S	*	*			trans	-152.6	129.3	142.7	-135.8	172.4	-169.6	158.6	4.6	111.3
606	V	33.6	Very low	32.1	Very low	142 Å²	142	149.9 Å²	149.9	86%	0.861	82%	0.817	S	S	*	*			trans	-64.7	137	-179.1	179.4	0	0	0	0	110.5
607	R	28.9	Very low	32.1	Very low	220 Å²	220	149 Å²	149	83%	0.83	81%	0.811	S	S	*	*			trans	-108.8	144.5	167.4	-72.5	-177.7	177	161.5	0.2	109.8
608	P	32.8	Very low	32	Very low	119 Å²	119	145.4 Å²	145.4	77%	0.773	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-67.4	149.7	162.9	31.5	-34.2	0	0	0	110.1
609	L	30.1	Very low	31.8	Very low	179 Å²	179	143.5 Å²	143.5	94%	0.937	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-94.4	138.5	168.8	-74	171.3	0	0	0	109.8
610	S	30.1	Very low	31.7	Very low	113 Å²	113	141.5 Å²	141.5	79%	0.79	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-103.2	138.6	173.2	-59.5	0	0	0	0	110.9
611	D	30.3	Very low	31	Very low	169 Å²	169	145.2 Å²	145.2	90%	0.904	83%	0.826	S	S	*	*			trans	56.6	136.5	142.9	-153.8	-1.5	0	0	0	119.7
612	G	28.1	Very low	30.8	Very low	63 Å²	63	150.1 Å²	150.1	65%	0.649	83%	0.829	S	S	*	*			trans	-168.2	35.2	-161.2	0	0	0	0	0	116.9
613	S	29.2	Very low	30.7	Very low	108 Å²	108	150.4 Å²	150.4	76%	0.755	83%	0.825	S	S	*	*			trans	67.5	125.9	164.1	66	0	0	0	0	120
614	N	36.3	Very low	30.2	Very low	165 Å²	165	155.2 Å²	155.2	88%	0.882	83%	0.831	S	S	*	*			trans	-71.8	153.8	162.7	-81.1	-20.7	0	0	0	112.1
615	P	34.3	Very low	29.9	Very low	118 Å²	118	154.6 Å²	154.6	77%	0.766	83%	0.825	S	S	*	*			trans	-136.1	121.8	136.7	34.8	-21.1	0	0	0	114.5
616	W	26.4	Very low	29.7	Very low	249 Å²	249	148.1 Å²	148.1	94%	0.943	82%	0.817	S	S	*	*			trans	62.2	151.5	157.5	-126.2	-86.7	0	0	0	120.6
617	S	28.6	Very low	29.5	Very low	98 Å²	98	147.8 Å²	147.8	69%	0.685	82%	0.815	S	S	*	*			trans	-104.4	178	-178.8	-51.2	0	0	0	0	112.7
618	T	27.2	Very low	30.5	Very low	131 Å²	131	142.6 Å²	142.6	80%	0.804	81%	0.809	S	S	*	*			trans	95.7	110	158.7	73.6	0	0	0	0	119.5
619	S	24.8	Very low	30.2	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	82%	0.816	S	S	*	*				100.1	153	126.4	-142.8	0	0	0	0	121
620	L	30.8	Very low	30	Very low	156 Å²	156	140.9 Å²	140.9	82%	0.817	81%	0.806	S	S	*	*			trans	64.1	84.9	166.7	-53.8	-173.2	0	0	0	118.2	K622	L620-K622 PolarHBondContact O-N 3.45Å
621	L	29.9	Very low	29.9	Very low	186 Å²	186	139.4 Å²	139.4	97%	0.974	80%	0.801	S	S	*	*			trans	-68	118.5	154.2	-155.7	78.9	0	0	0	109.4
622	K	27.5	Very low	29.8	Very low	204 Å²	204	139.9 Å²	139.9	89%	0.887	80%	0.802	S	S	*	*			trans	-149	122.2	167.9	-147.6	168.4	-172	175.3	0	113.5	L620	L620-K622 PolarHBondContact O-N 3.45Å
623	S	30.6	Very low	29.9	Very low	100 Å²	100	146 Å²	146	70%	0.699	81%	0.811	S	S	*	*			trans	-37	141.2	178.3	176.6	0	0	0	0	118.1
624	Q	26.8	Very low	29.8	Very low	196 Å²	196	144 Å²	144	92%	0.916	81%	0.808	S	S	*	*				-151.4	175.9	125.9	-114.1	-178.4	8.4	0	0	112.6
625	K	28.6	Very low	29.3	Very low	184 Å²	184	144.4 Å²	144.4	80%	0.8	80%	0.804	S	S	*	*			trans	-116.7	175.1	-160.4	-66.6	-175.6	175	-176.2	0	114.6
626	S	28.6	Very low	29	Very low	103 Å²	103	146.7 Å²	146.7	72%	0.72	81%	0.805	S	S	*	*			trans	69	108.9	154.4	41.7	0	0	0	0	118.6
627	V	30.2	Very low	29.2	Very low	135 Å²	135	141.8 Å²	141.8	82%	0.818	80%	0.802	S	S	*	*				67.7	141.7	57.9	-144.6	0	0	0	0	113.9
628	P	49.7	Very low	29.1	Very low	111 Å²	111	140.5 Å²	140.5	72%	0.721	80%	0.804	S	S	*	*			cis	-124.7	-175	-34.7	35.9	-19.6	0	0	0	112.6
629	L	26.1	Very low	29.3	Very low	174 Å²	174	139.5 Å²	139.5	91%	0.911	81%	0.809	S	S	*	*			trans	-145.9	157.5	143.9	-142.2	101.5	0	0	0	110.9
630	A	26	Very low	29.3	Very low	87 Å²	87	138.1 Å²	138.1	72%	0.719	81%	0.812	S	S	*	*			trans	-135.4	171.9	-173.5	0	0	0	0	0	112.4
631	A	28.7	Very low	29.3	Very low	83 Å²	83	140.7 Å²	140.7	69%	0.686	81%	0.811	S	S	*	*			trans	69.5	119.8	170.6	0	0	0	0	0	118.3	F633	A631-F633 HydrophobicContact CB-CD2 4.49Å; A631-F633 HydrophobicContact CB-CE2 4.19Å
632	L	27.3	Very low	29.1	Very low	179 Å²	179	138.8 Å²	138.8	94%	0.937	80%	0.797	S	S	*	*				-141.3	146	127.1	-113.2	166.7	0	0	0	108.8
633	F	30.4	Very low	29.1	Very low	191 Å²	191	137.5 Å²	137.5	84%	0.838	79%	0.794	S	S	*	*			trans	-105.6	164.6	-170.4	-75.1	-110.9	0	0	0	111.3	A631	A631-F633 HydrophobicContact CB-CD2 4.49Å; A631-F633 HydrophobicContact CB-CE2 4.19Å
634	G	26.5	Very low	28.8	Very low	66 Å²	66	137.1 Å²	137.1	68%	0.68	80%	0.798	S	S	*	*			trans	168.7	115.8	153.3	0	0	0	0	0	117.1
635	E	25.8	Very low	28.7	Very low	173 Å²	173	137.5 Å²	137.5	81%	0.808	80%	0.796	S	S	*	*			trans	69.7	145.3	151.6	-54.2	-158.5	103.2	0	0	119.6
636	Q	29.3	Very low	30	Very low	166 Å²	166	133.8 Å²	133.8	78%	0.776	79%	0.791	S	S	*	*			cis	-144.7	176.3	-6.9	-131.7	-177.6	46	0	0	112.6
637	V	29.9	Very low	29.9	Very low	146 Å²	146	136.5 Å²	136.5	89%	0.885	79%	0.793	S	S	*	*			trans	-124.8	146.1	-164	167.7	0	0	0	0	112.7
638	G	26.4	Very low	29.6	Very low	72 Å²	72	137.1 Å²	137.1	74%	0.742	79%	0.787	S	S	*	*			trans	170	150	152.3	0	0	0	0	0	113.4
639	A	31	Very low	28.8	Very low	109 Å²	109	137.7 Å²	137.7	90%	0.901	79%	0.792	S	S	*	*			cis	-163.4	144.7	-20.4	0	0	0	0	0	108.7
640	G	25.4	Very low	29.7	Very low	80 Å²	80	134.8 Å²	134.8	83%	0.825	78%	0.783	S	S	*	*			trans	171.6	157	179.4	0	0	0	0	0	112.7
641	R	30.1	Very low	29.7	Very low	210 Å²	210	137.9 Å²	137.9	79%	0.792	79%	0.788	S	S	*	*			trans	-129.6	157	-170.2	-96.5	-178.5	166.2	-123.3	-4.8	112.7
642	E	27.5	Very low	29.8	Very low	145 Å²	145	138.9 Å²	138.9	68%	0.678	79%	0.79	S	S	*	*			trans	64.8	148.8	155.9	-79.3	123.6	-145.7	0	0	117.2
643	E	26	Very low	29.8	Very low	177 Å²	177	135.1 Å²	135.1	83%	0.827	78%	0.779	S	S	*	*			cis	-148.6	166.6	11.1	-145.6	176.1	-156.6	0	0	113.9
644	A	24.8	Very low	29.8	Very low	93 Å²	93	131.8 Å²	131.8	77%	0.769	78%	0.779	S	S	*	*			trans	52.3	118.8	151.9	0	0	0	0	0	124
645	F	23.9	Very low	29.9	Very low	203 Å²	203	138 Å²	138	89%	0.89	79%	0.787	S	S	*	*			trans	-86.3	-172.1	147	-90.6	-76.8	0	0	0	110.2
646	P	57	Low	30.5	Very low	107 Å²	107	136 Å²	136	70%	0.695	79%	0.789	S	S	*	*			cis	-129.6	-173.4	-38.9	37.1	-20.9	0	0	0	111.9
647	Q	26.1	Very low	30.4	Very low	160 Å²	160	137.1 Å²	137.1	75%	0.748	79%	0.791	S	S	*	*			trans	171.7	146.3	135.8	-97.7	-172.8	-43	0	0	110.7
648	E	24.2	Very low	30.3	Very low	148 Å²	148	138.7 Å²	138.7	69%	0.692	79%	0.789	S	S	*	*			cis	-157.7	148.7	-16.1	-149.8	161.3	-119	0	0	110.9
649	C	33.2	Very low	30.3	Very low	122 Å²	122	143.2 Å²	143.2	82%	0.824	80%	0.795	S	S	*	*			trans	-120.9	151.2	156.4	-56.4	0	0	0	0	106.5
650	P	44.3	Very low	30.1	Very low	114 Å²	114	145.4 Å²	145.4	74%	0.74	79%	0.785	S	S	*	*				-146.8	-179.8	93.5	39.8	-22.8	0	0	0	112.1
651	D	25.8	Very low	30.1	Very low	151 Å²	151	150.1 Å²	150.1	81%	0.807	78%	0.783	S	S	*	*			cis	-140.2	-163.7	13.2	-153.7	36.5	0	0	0	107.8
652	S	30.6	Very low	30.4	Very low	104 Å²	104	146.1 Å²	146.1	73%	0.727	78%	0.784	S	S	*	*			cis	-149.8	-151.9	12.1	75.5	0	0	0	0	114.7
653	S	28.5	Very low	30.3	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	79%	0.787	S	S	*	*			trans	-117.1	141.7	-157.5	64.8	0	0	0	0	115.2
654	S	28.8	Very low	30.4	Very low	121 Å²	121	145.7 Å²	145.7	85%	0.846	79%	0.786	S	S	*	*				-176.1	165.5	113.6	45.7	0	0	0	0	111.9
655	K	30.6	Very low	30.4	Very low	197 Å²	197	148 Å²	148	86%	0.857	79%	0.79	S	S	*	*			trans	-115.8	160.8	-178.9	-64.8	169.1	-179.5	164	0	109.8
656	P	37.1	Very low	30.4	Very low	129 Å²	129	146.8 Å²	146.8	84%	0.838	78%	0.781	S	S	*	*				-144.8	-170.2	108	36.1	-19.9	0	0	0	114.6
657	K	27.6	Very low	29.1	Very low	191 Å²	191	148.9 Å²	148.9	83%	0.83	79%	0.785	S	S	*	*			trans	-130.2	148.6	177.8	-73.9	-175.6	175.4	-176.9	0	112
658	Q	28.3	Very low	29.1	Very low	179 Å²	179	146.2 Å²	146.2	84%	0.836	78%	0.776	S	S	*	*			trans	45.7	129.8	149.2	-71	-175.9	-33.5	0	0	121.7
659	L	26.5	Very low	29.3	Very low	166 Å²	166	147.1 Å²	147.1	87%	0.869	79%	0.785	S	S	*	*				-164.2	-178.3	121.8	-106.6	163.7	0	0	0	112.7
660	K	25.8	Very low	29.3	Very low	156 Å²	156	146.4 Å²	146.4	68%	0.678	78%	0.778	S	S	*	*			trans	-96.5	153.8	-163.8	-55.2	168.1	-173.5	175.5	0	113.3
661	F	26.1	Very low	28.4	Very low	179 Å²	179	149.4 Å²	149.4	79%	0.785	79%	0.787	S	S	*	*				157.2	-173.5	94.1	-88.3	-64	0	0	0	108.3
662	P	35.4	Very low	28.6	Very low	126 Å²	126	153.9 Å²	153.9	82%	0.818	79%	0.793	S	S	*	*				-123	-138.7	-54.6	39.8	-22.9	0	0	0	112.6
663	N	25.6	Very low	28.3	Very low	140 Å²	140	158.7 Å²	158.7	75%	0.749	80%	0.801	S	S	*	*			trans	-106.3	156.7	-159.8	-95.1	-17.5	0	0	0	117.1
664	Q	27.6	Very low	28.2	Very low	172 Å²	172	161 Å²	161	80%	0.804	81%	0.805	S	S	*	*			trans	59.2	130.8	143.5	-69.7	171.7	-18.6	0	0	122
665	V	26.4	Very low	28	Very low	141 Å²	141	163.1 Å²	163.1	86%	0.855	80%	0.802	S	S	*	*				-176.2	161.2	110.2	147	0	0	0	0	110.1
666	Y	23.9	Very low	27.8	Very low	179 Å²	179	159.7 Å²	159.7	70%	0.702	80%	0.798	S	S	*	*			trans	-122.2	130.7	-179.9	171.1	-76.3	0	0	0	109.5	D668	Y666-D668 VanDerWaalsContact CE1-OD1 3.26Å; Y666-D668 WeakPolarHBondContact CE1-OD1 3.42Å; Y666-D668 WeakPolarHBondContact CE1-OD2 3.46Å; Y666-D668 VanDerWaalsContact CZ-OD1 3.27Å; Y666-D668 PolarHBondContact OH-OD1 3Å
667	I	28.6	Very low	27.3	Very low	151 Å²	151	162.1 Å²	162.1	77%	0.774	80%	0.797	S	S	*	*			trans	-143.7	139.7	162.2	-71.1	-168.4	0	0	0	109.4
668	D	25.6	Very low	27.9	Very low	104 Å²	104	157.5 Å²	157.5	56%	0.556	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72.9	163	-179.3	-52.9	-78.8	0	0	0	114.6	Y666	Y666-D668 VanDerWaalsContact CE1-OD1 3.26Å; Y666-D668 WeakPolarHBondContact CE1-OD1 3.42Å; Y666-D668 WeakPolarHBondContact CE1-OD2 3.46Å; Y666-D668 VanDerWaalsContact CZ-OD1 3.27Å; Y666-D668 PolarHBondContact OH-OD1 3Å
669	L	29.7	Very low	27.9	Very low	167 Å²	167	157.7 Å²	157.7	87%	0.874	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.8	137.5	163.4	-92.9	67.7	0	0	0	110.4
670	P	32.8	Very low	27.8	Very low	107 Å²	107	155.1 Å²	155.1	70%	0.695	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81.5	144.3	173.9	33.1	-33.8	0	0	0	112
671	L	25.4	Very low	28.3	Very low	176 Å²	176	153.8 Å²	153.8	92%	0.921	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-78.6	130.7	163.3	-93.9	155.8	0	0	0	109.9
672	W	28.7	Very low	28.4	Very low	246 Å²	246	149.1 Å²	149.1	93%	0.932	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-76.8	153.7	171.6	-69.7	-37.2	0	0	0	112
673	K	24.5	Very low	28	Very low	205 Å²	205	146.8 Å²	146.8	89%	0.891	79%	0.792	S	S	*	*			trans	-137.6	125.2	164.5	-174.7	-178.1	-179.6	-173.6	0	106.7
674	D	26.2	Very low	28	Very low	149 Å²	149	146 Å²	146	80%	0.797	80%	0.798	S	S	*	*			trans	-101	141.4	-176.4	-166.2	6.7	0	0	0	110.8
675	E	25	Very low	28	Very low	166 Å²	166	141.8 Å²	141.8	78%	0.776	80%	0.8	S	S	*	*			trans	-176.2	145.6	135.3	-112.4	-164.8	116.4	0	0	112.8
676	T	27	Very low	27.9	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	80%	0.796	S	S	*	*			trans	72.5	107.6	158.5	57.7	0	0	0	0	121
677	Q	27.1	Very low	28.9	Very low	179 Å²	179	136.4 Å²	136.4	84%	0.836	80%	0.804	S	S	*	*			trans	-39.9	177	146.1	-97.7	-174.2	20.4	0	0	117
678	P	38.8	Very low	28.8	Very low	95 Å²	95	133 Å²	133	62%	0.617	81%	0.806	S	S	*	*			cis	-138.9	-170.2	-4	24.9	1.1	0	0	0	115.8
679	Q	28.5	Very low	28.9	Very low	183 Å²	183	135.8 Å²	135.8	86%	0.855	82%	0.821	S	S	*	*			trans	88.3	101.1	155.4	-50.2	-162.4	9.8	0	0	120
680	S	24.9	Very low	28.8	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	82%	0.818	S	S	*	*			trans	-66.9	161.2	148.5	-27.5	0	0	0	0	110.5
681	P	37.4	Very low	28.6	Very low	128 Å²	128	130.5 Å²	130.5	83%	0.831	82%	0.817	S	S	*	*				-151.3	145.7	68.3	38.4	-18.7	0	0	0	118.6
682	G	26.8	Very low	28.9	Very low	81 Å²	81	129.7 Å²	129.7	84%	0.835	82%	0.819	S	S	*	*			trans	71.4	172.6	139.7	0	0	0	0	0	119.9
683	G	27.4	Very low	28.9	Very low	76 Å²	76	121.3 Å²	121.3	78%	0.784	81%	0.809	S	S	*	*			trans	105.4	73.4	158.7	0	0	0	0	0	117.6
684	S	26.3	Very low	29.2	Very low	125 Å²	125	116.9 Å²	116.9	87%	0.874	81%	0.811	S	S	*	*			trans	-30.9	135.8	157.3	51.3	0	0	0	0	118.4
685	G	26.9	Very low	29.3	Very low	82 Å²	82	113.7 Å²	113.7	85%	0.845	81%	0.812	S	S	*	*			trans	95.9	134.6	143.4	0	0	0	0	0	118.5
686	G	25.4	Very low	29.5	Very low	75 Å²	75	111.4 Å²	111.4	77%	0.773	82%	0.815	S	S	*	*			trans	-100.6	-153.3	156	0	0	0	0	0	110.6
687	P	44.7	Very low	30.3	Very low	132 Å²	132	111.1 Å²	111.1	86%	0.857	82%	0.815	S	S	*	*			cis	-135.5	159.4	-0.4	40.8	-24.7	0	0	0	116.1
688	G	25.7	Very low	31.6	Very low	81 Å²	81	107.6 Å²	107.6	84%	0.835	81%	0.808	S	S	*	*			trans	65	-176.4	165.8	0	0	0	0	0	116.2
689	D	27.4	Very low	31.1	Very low	161 Å²	161	111.5 Å²	111.5	86%	0.861	82%	0.818	S	S	*	*			cis	-160	143.5	-30	-177.2	25.2	0	0	0	108.3
690	A	28.6	Very low	31.4	Very low	98 Å²	98	108.6 Å²	108.6	81%	0.81	81%	0.813	S	S	*	*			trans	53.9	160.3	-179.5	0	0	0	0	0	118.2
691	G	27.1	Very low	32.2	Very low	65 Å²	65	107.9 Å²	107.9	67%	0.67	81%	0.805	S	S	*	*			cis	160.5	109.7	-15	0	0	0	0	0	114.9
692	V	32.2	Very low	31.8	Very low	160 Å²	160	109.7 Å²	109.7	97%	0.97	80%	0.803	S	S	*	*			trans	66.2	139.3	158.9	-166.5	0	0	0	0	117.5
693	G	28.3	Very low	31.8	Very low	69 Å²	69	113.1 Å²	113.1	71%	0.711	80%	0.802	S	S	*	*			cis	154.6	158.7	-7.2	0	0	0	0	0	112.9
694	A	31.2	Very low	32.4	Very low	113 Å²	113	114.4 Å²	114.4	93%	0.934	80%	0.796	S	S	*	*			trans	-167.1	144	169.2	0	0	0	0	0	112.4
695	G	29.1	Very low	32.4	Very low	81 Å²	81	113.6 Å²	113.6	84%	0.835	79%	0.79	S	S	*	*			trans	125.8	140.7	164.2	0	0	0	0	0	117.3
696	S	28.8	Very low	32.3	Very low	119 Å²	119	115.2 Å²	115.2	83%	0.832	78%	0.783	S	S	*	*			trans	-110.7	179	174	-31.1	0	0	0	0	110.2
697	P	43.7	Very low	32.4	Very low	118 Å²	118	117.1 Å²	117.1	77%	0.766	78%	0.78	S	S	*	*			cis	-130.9	-155	-5.4	36	-12.1	0	0	0	112.1
698	P	53.8	Low	31.4	Very low	106 Å²	106	116.5 Å²	116.5	69%	0.688	77%	0.774	S	S	*	*				-132.9	176.3	-71	42.7	-27.2	0	0	0	116.7
699	E	29.5	Very low	31.3	Very low	177 Å²	177	117.1 Å²	117.1	83%	0.827	77%	0.766	S	S	*	*			trans	71.2	142.3	161.8	-51.2	-166.7	172.5	0	0	120.6
700	T	33.3	Very low	31.2	Very low	121 Å²	121	115.4 Å²	115.4	74%	0.742	76%	0.761	S	S	*	*			cis	-170.1	171.1	-26.1	38.7	0	0	0	0	108.3
701	P	43.1	Very low	31.1	Very low	97 Å²	97	115.4 Å²	115.4	63%	0.63	76%	0.755	S	S	*	*			cis	-134.8	171	-36.2	38	-20.8	0	0	0	115.9
702	E	27.7	Very low	31.2	Very low	166 Å²	166	117.2 Å²	117.2	78%	0.776	76%	0.758	S	S	*	*			trans	63.7	108.3	143.8	-73.5	156	-128.4	0	0	124.3
703	D	28	Very low	31	Very low	153 Å²	153	115.8 Å²	115.8	82%	0.818	75%	0.749	S	S	*	*				53.7	158.1	110.1	-75.6	13.4	0	0	0	124.2
704	P	38.8	Very low	31	Very low	103 Å²	103	117.2 Å²	117.2	67%	0.669	75%	0.748	S	S	*	*			cis	-142.2	-171	-35.4	41.1	-23.4	0	0	0	114.6
705	C	26.3	Very low	30.9	Very low	109 Å²	109	118.2 Å²	118.2	74%	0.736	74%	0.743	S	S	*	*			trans	75.4	110.5	151.4	-71.9	0	0	0	0	123.2
706	T	25.5	Very low	31.2	Very low	116 Å²	116	120.7 Å²	120.7	71%	0.712	74%	0.742	S	S	*	*				48.1	154.2	114.5	-6.6	0	0	0	0	124.4
707	T	28.2	Very low	31.7	Very low	114 Å²	114	120.5 Å²	120.5	70%	0.699	74%	0.738	S	S	*	*			trans	74.1	116.2	150.1	39.5	0	0	0	0	121.1
708	T	23.2	Very low	31	Very low	120 Å²	120	122.6 Å²	122.6	74%	0.736	74%	0.738	S	S	*	*				29.7	126.5	105.4	-30.4	0	0	0	0	118
709	S	23.9	Very low	29.8	Very low	94 Å²	94	125.1 Å²	125.1	66%	0.657	75%	0.745	S	S	*	*				160.2	129.2	113.7	-70	0	0	0	0	115.3
710	T	25	Very low	30	Very low	124 Å²	124	122.8 Å²	122.8	76%	0.761	74%	0.743	S	S	*	*			trans	54.6	133.4	136.1	63.7	0	0	0	0	123.9
711	S	27.6	Very low	30.2	Very low	98 Å²	98	122.3 Å²	122.3	69%	0.685	74%	0.742	S	S	*	*			trans	71.1	98.9	132.6	65.2	0	0	0	0	121.7
712	S	28.3	Very low	29.6	Very low	104 Å²	104	123.6 Å²	123.6	73%	0.727	75%	0.748	S	S	*	*				52.5	143.3	101.8	-48.2	0	0	0	0	122.8
713	T	27.4	Very low	29.8	Very low	129 Å²	129	123 Å²	123	79%	0.791	75%	0.75	S	S	*	*			trans	89.6	160.7	152.7	77.1	0	0	0	0	120.4
714	S	28.3	Very low	29.9	Very low	99 Å²	99	120.1 Å²	120.1	69%	0.692	74%	0.742	S	S	*	*			trans	62.5	96.2	174.2	59.3	0	0	0	0	116.9
715	T	30.4	Very low	29.7	Very low	134 Å²	134	122.3 Å²	122.3	82%	0.822	75%	0.747	S	S	*	*				77.1	124.6	79	58.7	0	0	0	0	116.1
716	T	34.1	Very low	30.1	Very low	134 Å²	134	126.1 Å²	126.1	82%	0.822	75%	0.751	S	S	*	*			trans	-43.2	152.5	168.6	11.3	0	0	0	0	114.9
717	P	40.5	Very low	30.5	Very low	115 Å²	115	132.3 Å²	132.3	75%	0.747	76%	0.762	S	S	*	*				-155.7	158.9	76.7	41.7	-22	0	0	0	120.3
718	Q	28	Very low	30.9	Very low	162 Å²	162	132 Å²	132	76%	0.757	77%	0.77	S	S	*	*			trans	46.9	131.2	137.4	-63.9	-71.3	4.3	0	0	124.5
719	L	29.7	Very low	31.7	Very low	159 Å²	159	131.7 Å²	131.7	83%	0.832	77%	0.773	S	S	*	*			trans	75.2	153.9	145.5	-71.3	163.4	0	0	0	121.3
720	T	32.5	Very low	32.7	Very low	127 Å²	127	131.5 Å²	131.5	78%	0.779	78%	0.777	S	S	*	*			trans	-112.2	159.7	-165.4	51.7	0	0	0	0	112.8
721	P	38.7	Very low	33.6	Very low	112 Å²	112	135.6 Å²	135.6	73%	0.727	78%	0.778	S	S	*	*				-152.9	152	100	38.7	-20.4	0	0	0	118.6
722	T	30.7	Very low	34.4	Very low	123 Å²	123	141.9 Å²	141.9	76%	0.755	79%	0.787	S	S	*	*			trans	55.4	118.3	145.9	56.2	0	0	0	0	124.2
723	N	30.3	Very low	35.3	Very low	155 Å²	155	145.9 Å²	145.9	83%	0.829	79%	0.792	S	S	*	*			trans	66.6	144.4	144.8	-92.6	-42	0	0	0	119.7
724	S	31.3	Very low	36.5	Very low	92 Å²	92	143.6 Å²	143.6	64%	0.643	78%	0.778	S	S	*	*			cis	-157.2	169	4.1	-149.9	0	0	0	0	114.4
725	L	34.2	Very low	37.3	Very low	149 Å²	149	143.5 Å²	143.5	78%	0.78	77%	0.769	S	S	*	*			trans	76.8	134.2	156.2	-78.5	161.1	0	0	0	123
726	K	34.6	Very low	38.1	Very low	188 Å²	188	145.6 Å²	145.6	82%	0.817	77%	0.767	S	S	*	*			trans	73	77.1	151.7	-66.7	177.2	179.5	-179.9	0	121.2
727	R	33.2	Very low	39.1	Very low	247 Å²	247	142 Å²	142	93%	0.932	75%	0.752	S	S	*	*				-158.3	116	117.5	-135	172.3	-69.3	-175.4	-0.6	111.4
728	A	36.5	Very low	39.9	Very low	106 Å²	106	142.6 Å²	142.6	88%	0.876	75%	0.748	S	S	*	*			trans	-150.3	92.5	-176.2	0	0	0	0	0	112.2
729	S	41.4	Very low	41.2	Very low	115 Å²	115	144.2 Å²	144.2	80%	0.804	75%	0.748	S	S	*	*			trans	-145.8	-17.8	177	51.1	0	0	0	0	114.9
730	A	43.8	Very low	42.6	Very low	89 Å²	89	138.4 Å²	138.4	74%	0.736	73%	0.727	S	S	*	*	S	Bend	trans	-89.9	-22.4	-171.5	0	0	0	0	0	116.2
731	R	44.2	Very low	44.2	Very low	210 Å²	210	136 Å²	136	79%	0.792	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-13.1	-170.6	-95	-172.2	177.7	178.8	-0.9	116.7	K733 T734	R731-K733 VanDerWaalsContact C-N 3.32Å; R731-K733 PolarHBondContact O-N 2.95Å; R731-T734 PolarHBondContact O-OG1 3.2Å; R731-T734 VanDerWaalsContact O-OG1 3.08Å
732	R	44.6	Very low	45.7	Very low	231 Å²	231	132.5 Å²	132.5	87%	0.872	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-10	-172.8	-75.1	-172.9	176.8	177.2	-0.6	115.5
733	K	46.9	Very low	47.3	Very low	188 Å²	188	130 Å²	130	82%	0.817	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-30.1	179.8	-71.2	-168.8	173.8	-171.4	0	113.9	R731	R731-K733 VanDerWaalsContact C-N 3.32Å; R731-K733 PolarHBondContact O-N 2.95Å
734	T	52.6	Low	49	Very low	81 Å²	81	127.6 Å²	127.6	50%	0.497	67%	0.673	S	S	.	*	H	α-helix	trans	-70.7	-43.8	179.1	43.9	0	0	0	0	112.3	R731 F736 A737 L738	R731-T734 PolarHBondContact O-OG1 3.2Å; R731-T734 VanDerWaalsContact O-OG1 3.08Å; T734-F736 VanDerWaalsContact C-N 3.29Å; T734-F736 PolarHBondContact O-N 2.89Å; T734-A737 PolarHBondContact O-N 3.35Å; T734-L738 PolarHBondContact O-N 3.27Å
735	D	45.1	Very low	50.8	Low	97 Å²	97	129 Å²	129	52%	0.519	67%	0.672	S	S	.	*	H	α-helix	trans	-71.8	-28.7	-168.5	-55	1	0	0	0	111.3	Y739	D735-Y739 PolarHBondContact O-N 3.41Å; D735-Y739 VanDerWaalsContact O-N 3.09Å
736	F	46.6	Very low	52.2	Low	177 Å²	177	124.1 Å²	124.1	78%	0.776	65%	0.654	S	S	*	*	H	α-helix	trans	-71.7	-38.1	177.1	-152.7	-90.1	0	0	0	112.3	T734 Y739 G740	T734-F736 VanDerWaalsContact C-N 3.29Å; T734-F736 PolarHBondContact O-N 2.89Å; F736-Y739 PolarHBondContact O-N 3.4Å; F736-G740 PolarHBondContact O-N 3.46Å
737	A	55.8	Low	53.8	Low	60 Å²	60	116.7 Å²	116.7	50%	0.496	63%	0.626	S	S	.	*	H	α-helix	trans	-65.4	-43.7	175	0	0	0	0	0	111.4	T734 Y739 G740 C741	T734-A737 PolarHBondContact O-N 3.35Å; A737-Y739 VanDerWaalsContact C-N 3.33Å; A737-Y739 PolarHBondContact O-N 2.95Å; A737-G740 PolarHBondContact O-N 2.84Å; A737-C741 PolarHBondContact O-N 2.85Å; A737-C741 PolarHBondContact O-SG 3.19Å; A737-C741 VanDerWaalsContact O-SG 3.35Å
738	L	58.1	Low	55.3	Low	127 Å²	127	109.9 Å²	109.9	67%	0.665	61%	0.611	S	S	*	*	H	α-helix	trans	-63.1	-37.5	175.9	-69.9	170.6	0	0	0	112.4	T734 G742	T734-L738 PolarHBondContact O-N 3.27Å; L738-G742 PolarHBondContact O-N 2.93Å
739	Y	55	Low	56.6	Low	195 Å²	195	110.8 Å²	110.8	77%	0.765	61%	0.606	S	S	*	*	H	α-helix	trans	-67.1	-39.1	174.2	-140.4	-89.7	0	0	0	112.1	D735 F736 A737 G742 S743	D735-Y739 PolarHBondContact O-N 3.41Å; D735-Y739 VanDerWaalsContact O-N 3.09Å; F736-Y739 PolarHBondContact O-N 3.4Å; A737-Y739 VanDerWaalsContact C-N 3.33Å; A737-Y739 PolarHBondContact O-N 2.95Å; Y739-G742 PolarHBondContact O-N 2.88Å; Y739-S743 WeakPolarHBondContact O-CB 3.3Å; Y739-S743 PolarHBondContact O-N 3.44Å
740	G	59.3	Low	58	Low	37 Å²	37	112 Å²	112	38%	0.381	60%	0.603	S	S	.	*	H	α-helix	trans	-59.4	-52.4	173	0	0	0	0	0	112.4	F736 A737 G742 S743 L744	F736-G740 PolarHBondContact O-N 3.46Å; A737-G740 PolarHBondContact O-N 2.84Å; G740-G742 VanDerWaalsContact C-N 3.34Å; G740-G742 PolarHBondContact O-N 3.43Å; G740-S743 PolarHBondContact O-N 2.92Å; G740-L744 PolarHBondContact O-N 2.83Å
741	C	65.3	Low	58.5	Low	76 Å²	76	111.3 Å²	111.3	51%	0.514	60%	0.603	S	S	.	*	H	α-helix	trans	-60.1	-41.6	177.2	-63.7	0	0	0	0	112.5	A737 L744 L745	A737-C741 PolarHBondContact O-N 2.85Å; A737-C741 PolarHBondContact O-SG 3.19Å; A737-C741 VanDerWaalsContact O-SG 3.35Å; C741-L744 PolarHBondContact O-N 3.44Å; C741-L745 WeakPolarHBondContact O-CG 3.34Å; C741-L745 PolarHBondContact O-N 2.9Å; C741-L745 VanDerWaalsContact O-N 3.08Å
742	G	70.7	Confident	59.3	Low	40 Å²	40	109.4 Å²	109.4	41%	0.412	60%	0.598	S	S	.	*	H	α-helix	trans	-62.8	-40.6	175.7	0	0	0	0	0	113	L738 Y739 G740 A746	L738-G742 PolarHBondContact O-N 2.93Å; Y739-G742 PolarHBondContact O-N 2.88Å; G740-G742 VanDerWaalsContact C-N 3.34Å; G740-G742 PolarHBondContact O-N 3.43Å; G742-A746 WeakPolarHBondContact O-CB 3.32Å; G742-A746 PolarHBondContact O-N 2.97Å
743	S	64.6	Low	60.1	Low	71 Å²	71	103 Å²	103	50%	0.497	58%	0.581	S	S	.	*	H	α-helix	trans	-68.5	-37.8	176.6	-165.1	0	0	0	0	112.5	Y739 G740 A746 S747	Y739-S743 WeakPolarHBondContact O-CB 3.3Å; Y739-S743 PolarHBondContact O-N 3.44Å; G740-S743 PolarHBondContact O-N 2.92Å; S743-A746 PolarHBondContact O-N 3.29Å; S743-S747 PolarHBondContact O-N 3.09Å; S743-S747 PolarHBondContact O-OG 3.25Å
744	L	65.9	Low	60.7	Low	103 Å²	103	97 Å²	97	54%	0.539	56%	0.557	S	S	.	*	H	α-helix	trans	-64.8	-45.9	178.1	-121.3	158.9	0	0	0	111.4	G740 C741 A746 S747 V748 I754	G740-L744 PolarHBondContact O-N 2.83Å; C741-L744 PolarHBondContact O-N 3.44Å; L744-A746 VanDerWaalsContact C-N 3.33Å; L744-A746 PolarHBondContact O-N 3.21Å; L744-S747 PolarHBondContact O-N 3.44Å; L744-V748 WeakPolarHBondContact O-CG2 3.28Å; L744-V748 PolarHBondContact O-N 2.8Å; L744-I754 HydrophobicContact CD2-CD1 3.54Å; L744-I754 HydrophobicContact CG-CD1 4.44Å
745	L	68.7	Low	60.6	Low	121 Å²	121	103 Å²	103	63%	0.634	57%	0.571	S	S	*	*	H	α-helix	trans	-63.2	-38.5	175	-70	169	0	0	0	112	C741 V748 V749	C741-L745 WeakPolarHBondContact O-CG 3.34Å; C741-L745 PolarHBondContact O-N 2.9Å; C741-L745 VanDerWaalsContact O-N 3.08Å; L745-V748 PolarHBondContact O-N 3.43Å; L745-V749 WeakPolarHBondContact O-CG2 3.44Å; L745-V749 PolarHBondContact O-N 3.37Å
746	A	63.8	Low	60.7	Low	47 Å²	47	105.5 Å²	105.5	39%	0.388	58%	0.579	S	S	.	*	H	α-helix	trans	-64	-41.6	175.5	0	0	0	0	0	112.6	G742 S743 L744 V748 V749 L750	G742-A746 WeakPolarHBondContact O-CB 3.32Å; G742-A746 PolarHBondContact O-N 2.97Å; S743-A746 PolarHBondContact O-N 3.29Å; L744-A746 VanDerWaalsContact C-N 3.33Å; L744-A746 PolarHBondContact O-N 3.21Å; A746-V748 PolarHBondContact O-N 3.4Å; A746-V749 PolarHBondContact O-N 3.34Å; A746-L750 WeakPolarHBondContact O-CB 3.22Å; A746-L750 VanDerWaalsContact O-CG 3.3Å; A746-L750 WeakPolarHBondContact O-CG 3.42Å; A746-L750 PolarHBondContact O-N 2.86Å
747	S	67.7	Low	60.9	Low	33 Å²	33	99.6 Å²	99.6	23%	0.231	56%	0.563	C	S	.	*	H	α-helix	trans	-62.2	-41.5	176.6	-62.7	0	0	0	0	112.6	S743 L744 L750 G751 Y752	S743-S747 PolarHBondContact O-N 3.09Å; S743-S747 PolarHBondContact O-OG 3.25Å; L744-S747 PolarHBondContact O-N 3.44Å; S747-L750 PolarHBondContact O-N 3.18Å; S747-G751 PolarHBondContact O-N 3.25Å; S747-G751 VanDerWaalsContact O-N 3.16Å; S747-Y752 PolarHBondContact O-N 3.35Å
748	V	65.2	Low	60.5	Low	103 Å²	103	102.2 Å²	102.2	62%	0.624	57%	0.567	S	S	*	*	H	α-helix	trans	-66	-44.7	177.5	174.4	0	0	0	0	111.3	L744 L745 A746 L750 G751	L744-V748 WeakPolarHBondContact O-CG2 3.28Å; L744-V748 PolarHBondContact O-N 2.8Å; L745-V748 PolarHBondContact O-N 3.43Å; A746-V748 PolarHBondContact O-N 3.4Å; V748-L750 PolarHBondContact O-N 2.63Å; V748-G751 PolarHBondContact O-N 3.29Å; V748-G751 VanDerWaalsContact O-N 3.16Å
749	V	63.5	Low	59.6	Low	126 Å²	126	106.7 Å²	106.7	76%	0.764	58%	0.575	S	S	*	*	H	α-helix	trans	-66.4	-24.2	178.3	171	0	0	0	0	112.6	L745 A746	L745-V749 WeakPolarHBondContact O-CG2 3.44Å; L745-V749 PolarHBondContact O-N 3.37Å; A746-V749 PolarHBondContact O-N 3.34Å
750	L	70.1	Confident	59	Low	141 Å²	141	103 Å²	103	74%	0.738	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	3.8	176.4	-65.7	173.2	0	0	0	113.9	A746 S747 V748 Y752	A746-L750 WeakPolarHBondContact O-CB 3.22Å; A746-L750 VanDerWaalsContact O-CG 3.3Å; A746-L750 WeakPolarHBondContact O-CG 3.42Å; A746-L750 PolarHBondContact O-N 2.86Å; S747-L750 PolarHBondContact O-N 3.18Å; V748-L750 PolarHBondContact O-N 2.63Å; L750-Y752 VanDerWaalsContact C-N 3.35Å; L750-Y752 PolarHBondContact O-N 3.24Å
751	G	55.3	Low	57.8	Low	73 Å²	73	105.5 Å²	105.5	75%	0.753	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	68	28.1	176.8	0	0	0	0	0	114.8	S747 V748	S747-G751 PolarHBondContact O-N 3.25Å; S747-G751 VanDerWaalsContact O-N 3.16Å; V748-G751 PolarHBondContact O-N 3.29Å; V748-G751 VanDerWaalsContact O-N 3.16Å
752	Y	60.5	Low	56.2	Low	171 Å²	171	106.1 Å²	106.1	67%	0.671	60%	0.595	S	S	*	*			trans	-91.9	120.2	-174	-142.6	-83.2	0	0	0	111.3	S747 L750 I754	S747-Y752 PolarHBondContact O-N 3.35Å; L750-Y752 VanDerWaalsContact C-N 3.35Å; L750-Y752 PolarHBondContact O-N 3.24Å; Y752-I754 PolarHBondContact O-N 3.3Å
753	D	62.5	Low	54.4	Low	96 Å²	96	109.9 Å²	109.9	51%	0.513	61%	0.612	S	S	.	*			trans	-74.5	114.2	-179	-168	-7	0	0	0	111.9	R755	D753-R755 VanDerWaalsContact C-N 3.28Å; D753-R755 PolarHBondContact O-N 3.39Å; D753-R755 WeakPolarHBondContact OD1-CB 3.19Å; D753-R755 PolarHBondContact OD1-N 3.29Å
754	I	57.7	Low	52.9	Low	63 Å²	63	112.4 Å²	112.4	32%	0.323	63%	0.627	S	S	.	*	H	α-helix	trans	-72.2	-23	-179.1	-58.9	176	0	0	0	111.2	L744 Y752 E756 I758	L744-I754 HydrophobicContact CD2-CD1 3.54Å; L744-I754 HydrophobicContact CG-CD1 4.44Å; Y752-I754 PolarHBondContact O-N 3.3Å; I754-E756 VanDerWaalsContact C-N 3.34Å; I754-E756 PolarHBondContact O-N 3Å; I754-I758 HydrophobicContact CG2-CD1 4.01Å; I754-I758 WeakPolarHBondContact O-CG1 3.32Å; I754-I758 PolarHBondContact O-N 3.34Å
755	R	51.9	Low	51.1	Low	207 Å²	207	116.9 Å²	116.9	78%	0.781	65%	0.646	S	S	*	*	H	α-helix	trans	-69.6	-29.6	179	-68.7	-179.9	160.6	-173.7	-6.3	113.1	D753	D753-R755 VanDerWaalsContact C-N 3.28Å; D753-R755 PolarHBondContact O-N 3.39Å; D753-R755 WeakPolarHBondContact OD1-CB 3.19Å; D753-R755 PolarHBondContact OD1-N 3.29Å
756	E	46.5	Very low	49.1	Very low	148 Å²	148	120.6 Å²	120.6	69%	0.692	66%	0.659	S	S	*	*	H	α-helix	trans	-75.6	-41.4	178.2	-164.6	167.2	-130.1	0	0	111.3	I754 I758 R759	I754-E756 VanDerWaalsContact C-N 3.34Å; I754-E756 PolarHBondContact O-N 3Å; E756-I758 PolarHBondContact O-N 3.42Å; E756-R759 PolarHBondContact O-N 3.43Å
757	A	50	Low	47.2	Very low	53 Å²	53	123.9 Å²	123.9	44%	0.438	68%	0.679	S	S	.	*	H	α-helix	trans	-60.8	-43.2	178.3	0	0	0	0	0	113.1	R759 T760	A757-R759 VanDerWaalsContact C-N 3.27Å; A757-R759 PolarHBondContact O-N 3.08Å; A757-T760 PolarHBondContact O-N 3.33Å; A757-T760 PolarHBondContact O-OG1 3Å
758	I	47.3	Very low	45.1	Very low	116 Å²	116	131 Å²	131	60%	0.595	71%	0.708	S	S	*	*	H	α-helix	trans	-65.7	-31	179.2	-65.5	169.7	0	0	0	111.6	I754 E756 T760 S761	I754-I758 HydrophobicContact CG2-CD1 4.01Å; I754-I758 WeakPolarHBondContact O-CG1 3.32Å; I754-I758 PolarHBondContact O-N 3.34Å; E756-I758 PolarHBondContact O-N 3.42Å; I758-T760 PolarHBondContact O-N 3.19Å; I758-S761 PolarHBondContact O-N 2.87Å; I758-S761 PolarHBondContact O-OG 3.03Å
759	R	39.9	Very low	43.1	Very low	220 Å²	220	132 Å²	132	83%	0.83	72%	0.715	S	S	*	*	H	α-helix	trans	-70.4	-14.4	177.9	-167.3	174.8	-76.1	169.6	-6	113.1	E756 A757	E756-R759 PolarHBondContact O-N 3.43Å; A757-R759 VanDerWaalsContact C-N 3.27Å; A757-R759 PolarHBondContact O-N 3.08Å
760	T	41.9	Very low	42.3	Very low	119 Å²	119	130.9 Å²	130.9	73%	0.73	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	5.1	178.9	59.4	0	0	0	0	115	A757 I758	A757-T760 PolarHBondContact O-N 3.33Å; A757-T760 PolarHBondContact O-OG1 3Å; I758-T760 PolarHBondContact O-N 3.19Å
761	S	35.8	Very low	40.2	Very low	89 Å²	89	132.3 Å²	132.3	62%	0.622	71%	0.71	S	S	*	*			trans	-118.6	43.4	-175.2	66.9	0	0	0	0	114.7	I758	I758-S761 PolarHBondContact O-N 2.87Å; I758-S761 PolarHBondContact O-OG 3.03Å
762	A	31	Very low	38.9	Very low	88 Å²	88	135.6 Å²	135.6	73%	0.727	71%	0.706	S	S	*	*			trans	-118	117.1	170.1	0	0	0	0	0	110.3
763	P	32.5	Very low	37.5	Very low	119 Å²	119	133.5 Å²	133.5	77%	0.773	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-81.2	159.1	173.5	34.1	-33.9	0	0	0	111.6
764	P	33.7	Very low	35.9	Very low	124 Å²	124	135.5 Å²	135.5	81%	0.805	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-82.1	152.4	-177.9	33.7	-35.7	0	0	0	113
765	E	27.5	Very low	34.5	Very low	198 Å²	198	140.1 Å²	140.1	93%	0.925	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-96.8	122.1	152.6	-71.1	-158.7	148.3	0	0	109.6
766	E	26.9	Very low	33.6	Very low	198 Å²	198	138.9 Å²	138.9	93%	0.925	72%	0.724	S	S	*	*			trans	-149.9	149.7	148.2	-143.8	171.1	-137	0	0	108.2
767	C	23.7	Very low	32.9	Very low	117 Å²	117	138.6 Å²	138.6	79%	0.791	72%	0.721	S	S	*	*			trans	-98.2	127	-165.8	-169.5	0	0	0	0	112.2
768	E	24.3	Very low	31.9	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	73%	0.734	S	S	*	*				175.5	-176.8	119.5	-95.3	-166.3	-177.8	0	0	112.1
769	T	23.3	Very low	31	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	74%	0.743	S	S	*	*			trans	-127.2	-173	-169.6	75.5	0	0	0	0	110.5
770	P	47.1	Very low	30.7	Very low	103 Å²	103	139.1 Å²	139.1	67%	0.669	75%	0.747	S	S	*	*			cis	-131.5	174.9	-19.9	28.2	-7.3	0	0	0	113.6
771	K	24.6	Very low	30	Very low	171 Å²	171	142.2 Å²	142.2	74%	0.743	75%	0.75	S	S	*	*				162.9	137.8	118.7	-92.2	175.2	165.1	-107.8	0	117.6
772	E	29.5	Very low	29.9	Very low	141 Å²	141	145.8 Å²	145.8	66%	0.659	76%	0.757	S	S	*	*			trans	57	122.2	137	-67.9	-178.1	97.6	0	0	124.9
773	E	29.3	Very low	29.7	Very low	127 Å²	127	152.1 Å²	152.1	59%	0.593	76%	0.762	S	S	*	*				75.4	103.7	125.7	-65.1	-94.9	97.9	0	0	122.6
774	K	28.7	Very low	29.5	Very low	138 Å²	138	150 Å²	150	60%	0.6	76%	0.755	S	S	*	*				75.5	124.3	122.2	-76.5	-178.6	-175.8	131	0	122.7
775	K	30.3	Very low	29.2	Very low	160 Å²	160	150 Å²	150	70%	0.696	75%	0.753	S	S	*	*				83	119.5	129.2	-72.4	169.8	-179.6	168.3	0	121.1
776	K	32.5	Very low	29.3	Very low	181 Å²	181	151.9 Å²	151.9	79%	0.787	75%	0.751	S	S	*	*			trans	72	158.2	132.6	-66.8	-177.9	177.5	-173.2	0	116.6
777	K	32.1	Very low	29.2	Very low	142 Å²	142	152.2 Å²	152.2	62%	0.617	75%	0.75	S	S	*	*			cis	-148.4	161.6	-0.4	-138.2	-171.9	-177.5	-133	0	110.6
778	E	29	Very low	29.4	Very low	151 Å²	151	158 Å²	158	71%	0.706	76%	0.755	S	S	*	*			trans	21.2	125.5	148	-72.6	151.1	-147.1	0	0	120.6
779	G	28.3	Very low	29.6	Very low	78 Å²	78	159.5 Å²	159.5	80%	0.804	75%	0.753	S	S	*	*			trans	-93.1	-178.2	157.6	0	0	0	0	0	112.8
780	L	32	Very low	30	Very low	171 Å²	171	158 Å²	158	90%	0.895	75%	0.747	S	S	*	*			trans	-148.4	151	168.8	-166.5	58.9	0	0	0	112.3
781	F	28.6	Very low	29	Very low	185 Å²	185	159.3 Å²	159.3	81%	0.811	75%	0.754	S	S	*	*			trans	-67.9	149.4	173	-70.8	-108.5	0	0	0	111.8
782	Q	33.3	Very low	29.3	Very low	164 Å²	164	156.7 Å²	156.7	77%	0.766	76%	0.757	S	S	*	*				178.7	138.9	98	-96.1	-165.6	84.1	0	0	116.8
783	R	27	Very low	30.9	Very low	221 Å²	221	155.6 Å²	155.6	83%	0.834	76%	0.762	S	S	*	*			trans	34.9	127.4	136	-97.5	-175.3	176.1	126.6	-1.2	122.1
784	A	28.5	Very low	31.8	Very low	74 Å²	74	155.3 Å²	155.3	61%	0.612	77%	0.772	S	S	*	*				98.8	103	114.6	0	0	0	0	0	122.6
785	T	26.8	Very low	31.6	Very low	125 Å²	125	152.5 Å²	152.5	77%	0.767	78%	0.782	S	S	*	*				80.6	148.2	125.8	68.1	0	0	0	0	122.9
786	R	28.6	Very low	31.5	Very low	236 Å²	236	148.5 Å²	148.5	89%	0.891	79%	0.786	S	S	*	*			trans	97	111.5	154.7	-69.1	177.2	179.3	178.7	0.3	120.3
787	F	26	Very low	31.5	Very low	205 Å²	205	152 Å²	152	90%	0.899	79%	0.794	S	S	*	*			trans	-35.4	142.2	155.1	-66.8	-100.8	0	0	0	116.7
788	R	27.1	Very low	31.5	Very low	238 Å²	238	150.7 Å²	150.7	90%	0.898	80%	0.803	S	S	*	*				-171.6	165.2	105.3	-94.2	178.5	-174.2	-141.1	2.3	108.4
789	R	28.3	Very low	31.6	Very low	215 Å²	215	154.5 Å²	154.5	81%	0.811	81%	0.81	S	S	*	*			cis	160.5	112.4	-28.9	-172.7	-158.7	-154.9	-137.4	7.9	105.6
790	S	31.9	Very low	31.8	Very low	91 Å²	91	157.2 Å²	157.2	64%	0.636	80%	0.8	S	S	*	*			trans	53.3	137	156.7	63.9	0	0	0	0	119.6
791	T	27.3	Very low	31.6	Very low	132 Å²	132	155.8 Å²	155.8	81%	0.81	79%	0.789	S	S	*	*				-174.8	160.1	66.7	38.6	0	0	0	0	112.9
792	S	30.1	Very low	31.7	Very low	115 Å²	115	154.1 Å²	154.1	80%	0.804	79%	0.788	S	S	*	*			trans	-102.2	-170.8	166.2	-26.7	0	0	0	0	110.9
793	P	63.6	Low	31.5	Very low	119 Å²	119	150.4 Å²	150.4	77%	0.773	79%	0.786	S	S	*	*			cis	-117.7	-138.4	-13.4	43.4	-26.7	0	0	0	109.4
794	P	46.9	Very low	31.7	Very low	121 Å²	121	145.3 Å²	145.3	79%	0.786	78%	0.784	S	S	*	*			cis	-121	-164.7	-29.1	41.5	-24.9	0	0	0	111.7
795	G	26.1	Very low	31.7	Very low	79 Å²	79	147.3 Å²	147.3	81%	0.814	79%	0.794	S	S	*	*			cis	123.6	98.2	-14.8	0	0	0	0	0	117.2
796	G	28.3	Very low	31.8	Very low	76 Å²	76	149.4 Å²	149.4	78%	0.784	80%	0.8	S	S	*	*			trans	163	114.2	163.8	0	0	0	0	0	120.8
797	R	31.6	Very low	31.7	Very low	255 Å²	255	142 Å²	142	96%	0.962	80%	0.797	S	S	*	*			trans	51	131.6	148.5	-61	-177.4	174.5	-169.2	-2.1	123.7
798	S	31.3	Very low	31.7	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	80%	0.796	S	S	*	*				178.2	139.1	116.3	60.6	0	0	0	0	112.7
799	R	31.6	Very low	31.7	Very low	231 Å²	231	129.7 Å²	129.7	87%	0.872	79%	0.792	S	S	*	*				66.1	148	111.7	-77.5	-168	165.5	176.7	-3.6	118.1
800	K	31.8	Very low	31.8	Very low	135 Å²	135	124.2 Å²	124.2	59%	0.587	79%	0.793	S	S	*	*			cis	-178.4	148.8	-9.3	-178.6	-171.6	-172.3	-123.1	0	110.4
801	E	29.4	Very low	32.4	Very low	141 Å²	141	125.8 Å²	125.8	66%	0.659	80%	0.801	S	S	*	*			trans	59.7	163.1	159	-81.6	159.8	-176.1	0	0	120.2
802	D	29.5	Very low	33.3	Very low	150 Å²	150	124.7 Å²	124.7	80%	0.802	80%	0.796	S	S	*	*			cis	-166.1	173.5	-40.2	-132.9	-47.7	0	0	0	112.9
803	A	30.6	Very low	33.3	Very low	86 Å²	86	124.7 Å²	124.7	71%	0.711	79%	0.791	S	S	*	*			trans	71.8	101	155.5	0	0	0	0	0	124.4
804	S	29.5	Very low	31.8	Very low	115 Å²	115	125.7 Å²	125.7	80%	0.804	79%	0.79	S	S	*	*				50	122.1	125.6	-160.7	0	0	0	0	124.6
805	S	28.8	Very low	31	Very low	115 Å²	115	126.4 Å²	126.4	80%	0.804	79%	0.787	S	S	*	*				174.5	160.1	104.5	46.3	0	0	0	0	115.8
806	N	28.6	Very low	31.1	Very low	170 Å²	170	129 Å²	129	91%	0.909	79%	0.787	S	S	*	*			trans	-34	155.8	-174.3	-62	-11.6	0	0	0	121.2
807	G	27.8	Very low	31	Very low	80 Å²	80	130.9 Å²	130.9	83%	0.825	79%	0.787	S	S	*	*			trans	171.2	-7.7	143.1	0	0	0	0	0	125.7
808	G	25.8	Very low	30.8	Very low	85 Å²	85	126.7 Å²	126.7	88%	0.876	78%	0.781	S	S	*	*			trans	77	167.5	178.8	0	0	0	0	0	116.2
809	A	27.6	Very low	30.7	Very low	99 Å²	99	126.7 Å²	126.7	82%	0.818	78%	0.781	S	S	*	*			cis	-157.8	154.1	-5.8	0	0	0	0	0	112.4
810	A	30.5	Very low	30.6	Very low	101 Å²	101	119.9 Å²	119.9	84%	0.835	77%	0.774	S	S	*	*			trans	63.7	166.8	175.9	0	0	0	0	0	116.7
811	P	43.5	Very low	30.5	Very low	123 Å²	123	121.7 Å²	121.7	80%	0.799	79%	0.788	S	S	*	*			cis	-115.3	-176.2	-6.2	41.7	-28.1	0	0	0	113.9
812	P	45.9	Very low	30.4	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	80%	0.797	S	S	*	*			trans	-116.2	173.8	-163.1	41.3	-32.3	0	0	0	118.2
813	V	30.4	Very low	30.4	Very low	116 Å²	116	124.6 Å²	124.6	70%	0.703	80%	0.799	S	S	*	*			trans	62.3	110.1	162	-67.1	0	0	0	0	119.1
814	N	33.3	Very low	30.5	Very low	139 Å²	139	126.8 Å²	126.8	74%	0.743	81%	0.808	S	S	*	*				94.4	151.9	86.5	-75.2	-0.2	0	0	0	112.7
815	L	29.4	Very low	30.3	Very low	136 Å²	136	129.1 Å²	129.1	71%	0.712	81%	0.811	S	S	*	*			cis	-163.3	134.1	-16.9	-115.5	170.3	0	0	0	108.1
816	V	27.5	Very low	30.3	Very low	135 Å²	135	128.7 Å²	128.7	82%	0.818	81%	0.808	S	S	*	*			trans	-148.6	129.9	151	-176.6	0	0	0	0	108.6
817	S	27.5	Very low	30.5	Very low	114 Å²	114	125.8 Å²	125.8	80%	0.797	80%	0.797	S	S	*	*			trans	-149.5	152.9	162.6	-87.9	0	0	0	0	109.4
818	M	27	Very low	30.6	Very low	168 Å²	168	131.1 Å²	131.1	83%	0.828	80%	0.797	S	S	*	*			trans	-143.9	170.6	-169.9	-100.9	-68.2	-71.8	0	0	111
819	S	28.8	Very low	30.7	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	79%	0.79	S	S	*	*			trans	74.4	159.9	-179.6	87.1	0	0	0	0	114.5
820	A	30.3	Very low	30.7	Very low	88 Å²	88	134.6 Å²	134.6	73%	0.727	79%	0.788	S	S	*	*			cis	-151.6	167.1	0.6	0	0	0	0	0	110.3
821	I	28.9	Very low	30.5	Very low	173 Å²	173	137.7 Å²	137.7	89%	0.887	79%	0.79	S	S	*	*			trans	-141.4	124.1	161.4	-55.2	179.6	0	0	0	109.9
822	M	27.8	Very low	29.5	Very low	171 Å²	171	140.3 Å²	140.3	84%	0.842	79%	0.792	S	S	*	*			trans	-160.8	136.1	148.4	-162	159.1	64.5	0	0	110.5
823	E	30	Very low	29.7	Very low	181 Å²	181	139.7 Å²	139.7	85%	0.846	79%	0.787	S	S	*	*			trans	13.6	149.4	164.3	-57.9	-176.6	143.1	0	0	123.4
824	C	30.8	Very low	29.4	Very low	132 Å²	132	143 Å²	143	89%	0.892	80%	0.795	S	S	*	*			trans	-145.2	159.6	174.9	-80	0	0	0	0	111.4
825	N	27	Very low	29.1	Very low	164 Å²	164	140.3 Å²	140.3	88%	0.877	79%	0.792	S	S	*	*			trans	-151.7	128.1	-171.6	-135.1	-28.8	0	0	0	114.4
826	S	29.1	Very low	28.9	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	80%	0.801	S	S	*	*			trans	64.5	147.1	163.1	-140.3	0	0	0	0	118
827	T	30.9	Very low	28.8	Very low	109 Å²	109	140 Å²	140	67%	0.669	79%	0.791	S	S	*	*			cis	-166.3	150.1	47.3	47.4	0	0	0	0	114.8
828	K	30.9	Very low	28.7	Very low	192 Å²	192	139.7 Å²	139.7	84%	0.835	79%	0.789	S	S	*	*			trans	66.5	152	148.3	-71.5	177.7	-178.8	-179.9	0	118.7
829	C	27.2	Very low	28.6	Very low	106 Å²	106	139.1 Å²	139.1	72%	0.716	78%	0.784	S	S	*	*			cis	-162	168	1.2	-127.4	0	0	0	0	113.3
830	L	28.6	Very low	28.3	Very low	150 Å²	150	139.8 Å²	139.8	79%	0.785	78%	0.778	S	S	*	*			trans	83.3	115.4	156.8	-68.1	164.8	0	0	0	122.3
831	L	26.4	Very low	28.2	Very low	167 Å²	167	142.4 Å²	142.4	87%	0.874	78%	0.78	S	S	*	*			trans	79.3	143.2	138.3	-62.4	175.9	0	0	0	123.6
832	Q	22	Very low	29.3	Very low	178 Å²	178	139.2 Å²	139.2	83%	0.832	77%	0.771	S	S	*	*			trans	-109.1	-179.6	173.3	-111.3	-174.7	-27.5	0	0	108.2
833	P	49.6	Very low	29.2	Very low	95 Å²	95	134.4 Å²	134.4	62%	0.617	77%	0.765	S	S	*	*			cis	-138.2	-171.3	-20.4	31.8	-9.5	0	0	0	113.8
834	E	24.1	Very low	29	Very low	185 Å²	185	136 Å²	136	86%	0.864	77%	0.769	S	S	*	*			trans	81.8	159.1	134.1	-107.3	173.2	-161.5	0	0	124.6
835	A	27.5	Very low	28.8	Very low	83 Å²	83	134.1 Å²	134.1	69%	0.686	76%	0.763	S	S	*	*			trans	80.2	126.5	154.2	0	0	0	0	0	120.9
836	E	25.5	Very low	28.9	Very low	191 Å²	191	134.2 Å²	134.2	89%	0.893	76%	0.758	S	S	*	*				17.7	153.6	121.9	-63.9	-167.2	157.6	0	0	120.5
837	A	25.6	Very low	29.6	Very low	73 Å²	73	134.5 Å²	134.5	60%	0.603	76%	0.757	S	S	*	*			cis	-177.7	170.3	-17.2	0	0	0	0	0	106.2
838	S	24.8	Very low	29.4	Very low	108 Å²	108	133 Å²	133	76%	0.755	76%	0.756	S	S	*	*			trans	63.3	176.1	160.7	-61.3	0	0	0	0	113.8
839	E	24.1	Very low	29.2	Very low	157 Å²	157	129.4 Å²	129.4	73%	0.734	75%	0.75	S	S	*	*			cis	-147.9	164.7	-33.2	-117.9	-176.4	149.4	0	0	109.3
840	L	24.4	Very low	29.2	Very low	127 Å²	127	130.7 Å²	130.7	67%	0.665	75%	0.749	S	S	*	*			trans	47.8	108.2	142	-65.2	168.8	0	0	0	121.3
841	N	28.3	Very low	29.3	Very low	142 Å²	142	130.5 Å²	130.5	76%	0.759	75%	0.749	S	S	*	*				80.3	179.7	112.3	-130.3	16.5	0	0	0	116.3
842	P	50.2	Low	29.6	Very low	107 Å²	107	128.7 Å²	128.7	70%	0.695	74%	0.741	S	S	*	*				-137.4	162.6	-100	43.4	-27	0	0	0	118.3
843	G	25.8	Very low	30	Very low	70 Å²	70	126.4 Å²	126.4	72%	0.722	73%	0.734	S	S	*	*			trans	93.8	175.1	133.8	0	0	0	0	0	118.5
844	K	26.9	Very low	29.2	Very low	214 Å²	214	126.4 Å²	126.4	93%	0.93	74%	0.736	S	S	*	*			trans	70.1	142.7	-171.8	-64	177.4	179.9	175.7	0	114.6
845	A	26.1	Very low	29.5	Very low	92 Å²	92	126.1 Å²	126.1	76%	0.76	74%	0.735	S	S	*	*			cis	-160.7	160.4	-16.2	0	0	0	0	0	111.8
846	E	28.5	Very low	29.8	Very low	167 Å²	167	128.2 Å²	128.2	78%	0.78	74%	0.739	S	S	*	*			trans	-50.3	159.2	148.7	-83	-80.3	140.7	0	0	111.3
847	P	45.3	Very low	30.1	Very low	111 Å²	111	123.6 Å²	123.6	72%	0.721	73%	0.728	S	S	*	*			cis	-152.1	177.5	40.5	44.8	-25.1	0	0	0	120.2
848	A	26.3	Very low	30.5	Very low	78 Å²	78	131 Å²	131	65%	0.645	74%	0.74	S	S	*	*			trans	80.2	147.8	141.6	0	0	0	0	0	118.7
849	V	26.9	Very low	31.7	Very low	116 Å²	116	131.6 Å²	131.6	70%	0.703	74%	0.742	S	S	*	*			cis	-162.3	174	-6.7	116.6	0	0	0	0	110.4
850	N	27.3	Very low	31.9	Very low	133 Å²	133	130 Å²	130	71%	0.711	74%	0.742	S	S	*	*			trans	93.8	114.8	179.2	-50.7	-44.2	0	0	0	113
851	D	30	Very low	32	Very low	146 Å²	146	135.3 Å²	135.3	78%	0.781	75%	0.754	S	S	*	*				87.8	132.3	54.2	-67.7	-3.3	0	0	0	111
852	D	31.7	Very low	32.1	Very low	130 Å²	130	132.4 Å²	132.4	70%	0.695	75%	0.749	S	S	*	*			cis	-157.2	167.1	9.8	-163.1	9.6	0	0	0	113.5
853	N	30.6	Very low	31	Very low	129 Å²	129	131.8 Å²	131.8	69%	0.69	75%	0.753	S	S	*	*			trans	74.3	141.3	162.7	-67.3	-68.4	0	0	0	120.9
854	S	32.3	Very low	31.2	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	76%	0.759	S	S	*	*			cis	-160.1	143.6	-12.4	48.9	0	0	0	0	113.5
855	E	31.6	Very low	31.4	Very low	178 Å²	178	127 Å²	127	83%	0.832	75%	0.746	S	S	*	*			trans	35.8	146.8	149.5	-57.7	-155.9	108.4	0	0	122.9
856	T	32.8	Very low	31.6	Very low	127 Å²	127	130 Å²	130	78%	0.779	75%	0.75	S	S	*	*			cis	-143.4	-173.2	5.6	-7.7	0	0	0	0	110.8
857	S	32.7	Very low	31.6	Very low	94 Å²	94	126.1 Å²	126.1	66%	0.657	74%	0.741	S	S	*	*			trans	-162.2	174.5	-176	59.6	0	0	0	0	115.7
858	R	33.3	Very low	30.9	Very low	228 Å²	228	129.6 Å²	129.6	86%	0.86	75%	0.748	S	S	*	*			trans	100.3	164.3	157.2	-65.4	167.2	173.4	-169.6	0.5	119.5
859	P	49.8	Very low	31	Very low	121 Å²	121	130.4 Å²	130.4	79%	0.786	75%	0.749	S	S	*	*			cis	-113.3	-152.3	-13.5	22.4	2	0	0	0	110.6
860	V	28.4	Very low	31	Very low	123 Å²	123	129.8 Å²	129.8	75%	0.745	75%	0.75	S	S	*	*			cis	-146.8	121.4	6.1	-173.9	0	0	0	0	105.9
861	R	28	Very low	31.1	Very low	240 Å²	240	133.1 Å²	133.1	91%	0.906	76%	0.757	S	S	*	*				49.1	145.5	93.7	-80	-167.4	161.5	178.9	-5.2	117.5
862	A	28.8	Very low	32.3	Very low	81 Å²	81	131.6 Å²	131.6	67%	0.669	76%	0.756	S	S	*	*			cis	-174.8	167.8	-14	0	0	0	0	0	112.9
863	A	29	Very low	32.3	Very low	93 Å²	93	130 Å²	130	77%	0.769	76%	0.761	S	S	*	*			trans	62.7	123.9	142.5	0	0	0	0	0	120.4
864	A	29.7	Very low	32.4	Very low	102 Å²	102	128.3 Å²	128.3	84%	0.843	76%	0.764	S	S	*	*				89.5	150.2	77.7	0	0	0	0	0	113
865	A	30.2	Very low	32.2	Very low	81 Å²	81	132.2 Å²	132.2	67%	0.669	77%	0.772	S	S	*	*			cis	-161.3	-178.5	-7.7	0	0	0	0	0	110.3
866	D	29.7	Very low	32	Very low	157 Å²	157	128.8 Å²	128.8	84%	0.84	76%	0.763	S	S	*	*			trans	65.8	160.6	158.6	-68.5	-26.8	0	0	0	120.5
867	S	29.9	Very low	32	Very low	84 Å²	84	131.3 Å²	131.3	59%	0.587	77%	0.766	S	S	*	*			cis	-169.4	156.5	-31.8	65.2	0	0	0	0	111.4
868	Q	29.5	Very low	31.6	Very low	185 Å²	185	137 Å²	137	86%	0.864	78%	0.779	S	S	*	*			trans	57.9	164.3	152.9	-67.4	176.3	30.9	0	0	119.8
869	S	28.4	Very low	31.5	Very low	95 Å²	95	130.6 Å²	130.6	66%	0.664	78%	0.775	S	S	*	*			cis	-162.6	174.7	-30.8	61.9	0	0	0	0	112.2
870	S	27.1	Very low	30.3	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	78%	0.779	S	S	*	*			trans	53.2	107.2	156.6	60.8	0	0	0	0	124.4
871	K	30	Very low	30.4	Very low	202 Å²	202	136.8 Å²	136.8	88%	0.878	79%	0.785	S	S	*	*				23.4	162.7	106.9	-86.2	-178.1	-179	180	0	121.4
872	P	55.7	Low	30.3	Very low	114 Å²	114	130.7 Å²	130.7	74%	0.74	78%	0.779	S	S	*	*			cis	-145.6	170.9	-6.6	37.9	-16.7	0	0	0	120
873	A	31.3	Very low	30.4	Very low	97 Å²	97	136.2 Å²	136.2	80%	0.802	79%	0.791	S	S	*	*			trans	74.5	151.5	139.7	0	0	0	0	0	125.8
874	A	31.6	Very low	30.3	Very low	93 Å²	93	137.1 Å²	137.1	77%	0.769	79%	0.792	S	S	*	*			trans	70.5	152.8	159.9	0	0	0	0	0	119.7
875	E	28.4	Very low	30.4	Very low	179 Å²	179	143.5 Å²	143.5	84%	0.836	79%	0.794	S	S	*	*			cis	-158.7	158.8	-18.7	-117	-167.7	134	0	0	114.5
876	T	27.7	Very low	31.6	Very low	105 Å²	105	143.1 Å²	143.1	64%	0.644	79%	0.785	S	S	*	*			trans	11.4	118.3	151.3	-49.2	0	0	0	0	124.6
877	Q	32.2	Very low	32.6	Very low	180 Å²	180	141.9 Å²	141.9	84%	0.841	79%	0.786	S	S	*	*			trans	34.3	127.1	140.3	-54.2	177.4	4.9	0	0	123.9
878	K	25.7	Very low	32.8	Very low	215 Å²	215	144.5 Å²	144.5	94%	0.935	79%	0.788	S	S	*	*				-167.4	-174.9	115	-109.9	173.8	-178.5	177	0	112.8
879	A	29.8	Very low	33	Very low	92 Å²	92	142.8 Å²	142.8	76%	0.76	78%	0.78	S	S	*	*			trans	-136.4	178.6	-152	0	0	0	0	0	117.1
880	E	26.3	Very low	33.2	Very low	187 Å²	187	142.5 Å²	142.5	87%	0.874	78%	0.778	S	S	*	*			trans	91.1	159	164.9	-58.3	-163.8	145.8	0	0	120.4
881	Q	29.7	Very low	33.5	Very low	188 Å²	188	143.4 Å²	143.4	88%	0.879	78%	0.775	S	S	*	*			trans	73.4	145.9	-178.3	-57	-171.7	17.4	0	0	116.8
882	S	25.4	Very low	33.6	Very low	112 Å²	112	140.9 Å²	140.9	78%	0.783	77%	0.766	S	S	*	*			cis	-162.2	170.4	-20.2	58.6	0	0	0	0	110.6
883	Q	31.9	Very low	32.5	Very low	197 Å²	197	141.5 Å²	141.5	92%	0.921	76%	0.763	S	S	*	*			trans	-111.3	151.8	-175.5	-75.4	-173.7	-15	0	0	115.7
884	S	27	Very low	32.4	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	76%	0.761	S	S	*	*			trans	-164.4	147	158.4	59.2	0	0	0	0	109.8
885	R	31	Very low	32.1	Very low	236 Å²	236	142 Å²	142	89%	0.891	76%	0.763	S	S	*	*			cis	-156.8	172.1	-6.3	-116.6	-172.2	172.5	-121.8	-2.8	109.1
886	P	56.2	Low	32.1	Very low	74 Å²	74	139.9 Å²	139.9	48%	0.481	76%	0.762	S	S	.	*			trans	-87.8	171.6	-169.6	39.8	-38.9	0	0	0	113	E888	P886-E888 HydrophobicContact CB-CG 4.1Å
887	P	50.8	Low	31.9	Very low	131 Å²	131	145.8 Å²	145.8	85%	0.851	77%	0.773	S	S	*	*				-94.2	-154.4	62.8	-21.4	38.7	0	0	0	119.9
888	E	32.4	Very low	31.6	Very low	139 Å²	139	144.1 Å²	144.1	65%	0.65	77%	0.769	S	S	*	*				-163.2	175.4	-129.8	-90.1	166.7	66.3	0	0	108.9	P886	P886-E888 HydrophobicContact CB-CG 4.1Å
889	Q	34.4	Very low	31.6	Very low	149 Å²	149	143.7 Å²	143.7	70%	0.696	76%	0.761	S	S	*	*			cis	-163.1	174.3	3.6	-125.4	-173.2	79.2	0	0	105.8
890	S	32.6	Very low	31.4	Very low	89 Å²	89	149.1 Å²	149.1	62%	0.622	76%	0.762	S	S	*	*			cis	-163.8	172.8	-8.6	84.8	0	0	0	0	106.9
891	N	32.5	Very low	31.5	Very low	122 Å²	122	148.5 Å²	148.5	65%	0.652	76%	0.757	S	S	*	*			cis	-159.2	165.9	-6.1	-122.1	-15.1	0	0	0	112.1
892	H	34	Very low	31.5	Very low	149 Å²	149	148.1 Å²	148.1	69%	0.69	75%	0.752	S	S	*	*			trans	-8.9	156.6	150.1	-66.7	-57.9	0	0	0	121.9
893	N	31.9	Very low	31.6	Very low	126 Å²	126	151.4 Å²	151.4	67%	0.674	75%	0.749	S	S	*	*			cis	-160.2	167.2	10.9	-129.3	-3.2	0	0	0	117.4
894	T	29.3	Very low	31.6	Very low	122 Å²	122	147.9 Å²	147.9	75%	0.748	74%	0.74	S	S	*	*			trans	4.4	148.1	152.1	58.5	0	0	0	0	122.4
895	G	25.3	Very low	31.9	Very low	79 Å²	79	147 Å²	147	81%	0.814	74%	0.74	S	S	*	*				140.6	140.6	129.5	0	0	0	0	0	117.7
896	T	27.3	Very low	32.3	Very low	134 Å²	134	142.3 Å²	142.3	82%	0.822	73%	0.733	S	S	*	*			trans	-88	162.3	179.7	56.3	0	0	0	0	114.1
897	R	25.1	Very low	31.5	Very low	229 Å²	229	146.1 Å²	146.1	86%	0.864	74%	0.744	S	S	*	*			trans	85.2	145.8	147.1	-92.3	-178.8	177.6	-166.8	2	121.1
898	L	25.5	Very low	30.9	Very low	145 Å²	145	146.2 Å²	146.2	76%	0.759	74%	0.737	S	S	*	*			trans	95	120.9	146.8	-75.9	159.9	0	0	0	122.6
899	R	25	Very low	31.3	Very low	206 Å²	206	144.5 Å²	144.5	78%	0.777	74%	0.736	S	S	*	*			trans	69.5	111	137	-88.6	-176.7	168	-175.7	-1.3	122.3
900	R	25.1	Very low	31.4	Very low	206 Å²	206	144.6 Å²	144.6	78%	0.777	74%	0.736	S	S	*	*				75.6	90.3	107.7	-163.9	-173	-145.9	-159.4	6.4	119.6
901	K	28.6	Very low	31.4	Very low	175 Å²	175	147.6 Å²	147.6	76%	0.761	75%	0.746	S	S	*	*				54.9	112.2	116.6	-177.3	-172.7	-173.7	174	0	118.5
902	K	30.4	Very low	31.3	Very low	180 Å²	180	144.7 Å²	144.7	78%	0.783	74%	0.744	S	S	*	*				179.6	131.1	120.1	-96.4	-148.7	176.3	-178.3	0	115.9
903	Y	27.6	Very low	33	Very low	181 Å²	181	143.6 Å²	143.6	71%	0.71	75%	0.751	S	S	*	*			trans	58.2	111.8	131.8	-77.1	-106.1	0	0	0	124.9
904	T	31.5	Very low	34.4	Very low	122 Å²	122	143.1 Å²	143.1	75%	0.748	75%	0.754	S	S	*	*				56.5	130.3	122.8	63	0	0	0	0	124.4
905	A	34.1	Very low	34.6	Very low	94 Å²	94	141.4 Å²	141.4	78%	0.777	75%	0.753	S	S	*	*				137.9	121.9	115.6	0	0	0	0	0	117.8
906	N	39.3	Very low	36.6	Very low	136 Å²	136	143.2 Å²	143.2	73%	0.727	75%	0.75	S	S	*	*			trans	-3.4	149.3	154.7	-52.8	-0.7	0	0	0	120.8
907	H	38.3	Very low	38.4	Very low	155 Å²	155	142.9 Å²	142.9	72%	0.718	75%	0.75	S	S	*	*				-174.9	146.1	73.1	-99.1	-76.4	0	0	0	116.2
908	N	39.3	Very low	38.7	Very low	132 Å²	132	136.6 Å²	136.6	71%	0.706	75%	0.747	S	S	*	*			trans	42.4	163.6	130.4	-66.4	17.8	0	0	0	123.3
909	T	40.9	Very low	39.1	Very low	103 Å²	103	133.3 Å²	133.3	63%	0.632	74%	0.741	S	S	*	*			cis	-156.6	174.4	17.1	-19.9	0	0	0	0	115.3
910	H	35	Very low	39.4	Very low	152 Å²	152	130.6 Å²	130.6	70%	0.704	74%	0.737	S	S	*	*			trans	96.1	143.8	163.9	-56.8	-60.8	0	0	0	115.9
911	N	34.2	Very low	39.6	Very low	152 Å²	152	130.3 Å²	130.3	81%	0.813	74%	0.736	S	S	*	*			cis	-155.2	173.5	-11.5	-102	-8.8	0	0	0	107.6
912	G	28.8	Very low	39.7	Very low	61 Å²	61	129.4 Å²	129.4	63%	0.629	73%	0.732	S	S	*	*			cis	-176	-171.4	3.8	0	0	0	0	0	111.7
913	P	70.1	Confident	39.6	Very low	126 Å²	126	127.2 Å²	127.2	82%	0.818	72%	0.724	S	S	*	*			trans	-87.8	179	178.9	38	-36.8	0	0	0	113.1
914	P	61.6	Low	39.6	Very low	116 Å²	116	125.9 Å²	125.9	75%	0.753	73%	0.725	S	S	*	*			cis	-117.7	-172.6	2.6	45.5	-32.3	0	0	0	112.4
915	A	34.8	Very low	39.3	Very low	86 Å²	86	127.3 Å²	127.3	71%	0.711	72%	0.72	S	S	*	*			cis	74.8	160.9	16.9	0	0	0	0	0	116.4
916	P	67.1	Low	39	Very low	117 Å²	117	129.8 Å²	129.8	76%	0.76	72%	0.716	S	S	*	*			cis	-120.3	176.2	-4.7	41.8	-27.8	0	0	0	113.5
917	P	63.7	Low	38.4	Very low	127 Å²	127	129.6 Å²	129.6	83%	0.825	71%	0.711	S	S	*	*			cis	-118.8	-159.1	13.3	41.4	-23.7	0	0	0	112.1
918	A	31.7	Very low	38	Very low	96 Å²	96	129.7 Å²	129.7	79%	0.793	71%	0.709	S	S	*	*			cis	-145.7	-95.2	9.2	0	0	0	0	0	116.5
919	A	33.7	Very low	38.7	Very low	77 Å²	77	129.4 Å²	129.4	64%	0.636	71%	0.714	S	S	*	*			trans	-170.5	168.2	-145.1	0	0	0	0	0	111.6
920	Q	31.1	Very low	38.3	Very low	148 Å²	148	128.7 Å²	128.7	69%	0.692	72%	0.719	S	S	*	*			cis	-167.8	170.7	-17.2	-101.2	175.2	104.1	0	0	105.8
921	R	29.9	Very low	38	Very low	201 Å²	201	129.6 Å²	129.6	76%	0.758	73%	0.729	S	S	*	*			cis	-156.3	171.2	9.6	-134.1	178.9	-147.8	-178.1	9.6	112.4
922	K	30.1	Very low	37.7	Very low	156 Å²	156	125.6 Å²	125.6	68%	0.678	72%	0.724	S	S	*	*			trans	-17.5	161.6	145.2	-74.1	170.6	139.3	-117.9	0	118.8
923	Q	28.5	Very low	37.8	Very low	133 Å²	133	130.9 Å²	130.9	62%	0.621	74%	0.738	S	S	*	*			cis	-160.6	-172.4	18.4	-133.3	160.9	-59.2	0	0	117
924	E	27.1	Very low	35.7	Very low	154 Å²	154	129 Å²	129	72%	0.72	73%	0.733	S	S	*	*			trans	-47.4	-175.6	173.7	-69.8	145.9	164.6	0	0	119.1
925	K	26.3	Very low	34.1	Very low	151 Å²	151	130.2 Å²	130.2	66%	0.657	74%	0.738	S	S	*	*			cis	157.1	124.9	-34.8	-177.6	175.5	-175.3	-88.9	0	110.6
926	E	26.5	Very low	34.6	Very low	147 Å²	147	131 Å²	131	69%	0.687	74%	0.736	S	S	*	*			trans	64.1	166.4	161.2	-75.5	167.7	-168.2	0	0	119.1
927	E	27.7	Very low	32.7	Very low	132 Å²	132	136.4 Å²	136.4	62%	0.617	74%	0.741	S	S	*	*			cis	-156.7	157.9	-2.6	-133.2	-160.3	172.3	0	0	115.2
928	K	30.2	Very low	30.8	Very low	156 Å²	156	138 Å²	138	68%	0.678	74%	0.738	S	S	*	*			trans	61.1	163.2	151.9	-83	-170	-174.4	77.8	0	121.1
929	P	54.1	Low	30.6	Very low	126 Å²	126	144.2 Å²	144.2	82%	0.818	74%	0.74	S	S	*	*			cis	-110.8	-144.2	7.5	28.1	-4.8	0	0	0	112.7
930	A	32	Very low	30.8	Very low	89 Å²	89	145.5 Å²	145.5	74%	0.736	74%	0.742	S	S	*	*			cis	-157.2	-148.4	9.4	0	0	0	0	0	114.2
931	N	28.8	Very low	30.5	Very low	171 Å²	171	144.1 Å²	144.1	91%	0.914	74%	0.744	S	S	*	*			trans	-83.5	164.6	-173	-60.2	-10.1	0	0	0	114.3
932	G	28.2	Very low	30.4	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	74%	0.741	S	S	*	*			cis	173.1	171.9	-5.4	0	0	0	0	0	115.4
933	D	29.7	Very low	30.2	Very low	171 Å²	171	140.5 Å²	140.5	91%	0.914	75%	0.746	S	S	*	*			trans	74.6	141.3	161.9	-69.4	-37.2	0	0	0	126.4
934	A	26.8	Very low	30.1	Very low	88 Å²	88	145.2 Å²	145.2	73%	0.727	76%	0.759	S	S	*	*			trans	67.4	97.9	149.6	0	0	0	0	0	125.2
935	V	29	Very low	30	Very low	140 Å²	140	142.6 Å²	142.6	85%	0.848	76%	0.763	S	S	*	*				35.7	139.4	107.3	177.1	0	0	0	0	119.6
936	P	44.3	Very low	30.3	Very low	103 Å²	103	144.6 Å²	144.6	67%	0.669	77%	0.772	S	S	*	*			cis	-139.2	156	16.4	34.2	-13	0	0	0	120.1
937	R	27.3	Very low	31.1	Very low	230 Å²	230	142.8 Å²	142.8	87%	0.868	77%	0.773	S	S	*	*			trans	62.9	155.8	144.3	-73.8	-178.3	175.2	171.4	0.3	119.7
938	Q	24.3	Very low	31.1	Very low	162 Å²	162	144.9 Å²	144.9	76%	0.757	78%	0.782	S	S	*	*			cis	-147.5	149.1	7.9	-145.7	167.7	4.7	0	0	114.9
939	R	27.3	Very low	31	Very low	225 Å²	225	140.7 Å²	140.7	85%	0.849	78%	0.777	S	S	*	*			trans	-147.8	136.5	156.9	-163.7	-159.5	-81.3	179.1	-5.8	107
940	P	38	Very low	29.9	Very low	105 Å²	105	146.1 Å²	146.1	68%	0.682	78%	0.781	S	S	*	*				-142.6	153.7	108	27.2	-6.4	0	0	0	111.9
941	V	25	Very low	29.6	Very low	119 Å²	119	146.3 Å²	146.3	72%	0.721	78%	0.783	S	S	*	*				64.4	113.2	58.7	-175.1	0	0	0	0	114.3
942	S	26.7	Very low	29.7	Very low	101 Å²	101	144.9 Å²	144.9	71%	0.706	77%	0.774	S	S	*	*				178.7	151.6	114.4	66.8	0	0	0	0	117.4
943	F	26	Very low	29.7	Very low	179 Å²	179	148.7 Å²	148.7	79%	0.785	78%	0.778	S	S	*	*			trans	45.9	134.5	150.6	-68.2	-59.6	0	0	0	127
944	R	26	Very low	29.6	Very low	233 Å²	233	151.9 Å²	151.9	88%	0.879	78%	0.777	S	S	*	*			trans	36.7	143.3	135.3	-72.3	175.1	171.7	176.4	-3.3	120.2
945	A	25	Very low	29.6	Very low	98 Å²	98	151.1 Å²	151.1	81%	0.81	78%	0.778	S	S	*	*			cis	-149	-177.2	31.2	0	0	0	0	0	115.8
946	K	33.4	Very low	29.5	Very low	193 Å²	193	155.3 Å²	155.3	84%	0.839	78%	0.779	S	S	*	*			trans	-125.9	162.8	169.9	-106.5	-176.4	-179.6	-175.1	0	107.4
947	P	42.3	Very low	28.7	Very low	110 Å²	110	155.8 Å²	155.8	71%	0.714	78%	0.776	S	S	*	*			cis	-113.4	-156.7	43.4	44.8	-37.1	0	0	0	112.4
948	H	28.1	Very low	28.7	Very low	175 Å²	175	153 Å²	153	81%	0.81	77%	0.77	S	S	*	*			cis	-134.3	-132.5	0.9	-147.8	-72.6	0	0	0	113.6
949	A	29.7	Very low	28.8	Very low	69 Å²	69	150 Å²	150	57%	0.57	77%	0.767	S	S	*	*			trans	-162	139.9	-157.6	0	0	0	0	0	117.4
950	W	29.3	Very low	28.7	Very low	240 Å²	240	150.6 Å²	150.6	91%	0.909	77%	0.771	S	S	*	*			trans	43.9	114.5	131.3	-70.6	73.1	0	0	0	123.5
951	A	26.4	Very low	28.2	Very low	93 Å²	93	150.9 Å²	150.9	77%	0.769	78%	0.775	S	S	*	*			trans	-164.6	123.8	134	0	0	0	0	0	107
952	L	30.3	Very low	28.3	Very low	140 Å²	140	153.2 Å²	153.2	73%	0.733	78%	0.783	S	S	*	*				95.7	101	55.3	-83.5	175.3	0	0	0	115.1
953	L	29.5	Very low	28.3	Very low	148 Å²	148	152.1 Å²	152.1	78%	0.775	79%	0.788	S	S	*	*			trans	68.4	138.5	141.2	-76.8	173.4	0	0	0	123.9
954	R	26.8	Very low	28.3	Very low	238 Å²	238	152.2 Å²	152.2	90%	0.898	79%	0.79	S	S	*	*			trans	66	129.3	155.7	-68.5	-165	-70	-157.7	-0.1	119.8
955	G	26.3	Very low	28.2	Very low	73 Å²	73	151.8 Å²	151.8	75%	0.753	79%	0.79	S	S	*	*				135.6	90	119.2	0	0	0	0	0	119.7
956	R	28	Very low	28.4	Very low	227 Å²	227	151.9 Å²	151.9	86%	0.857	79%	0.785	S	S	*	*				50.3	120.6	119	-173.5	175.7	179.6	-179.2	1.3	119.9
957	N	26.3	Very low	28	Very low	113 Å²	113	146.4 Å²	146.4	60%	0.604	78%	0.784	S	S	*	*			trans	89.1	127.2	143.3	-79.3	5.4	0	0	0	123.2
958	K	27.9	Very low	27.5	Very low	171 Å²	171	150 Å²	150	74%	0.743	79%	0.79	S	S	*	*				82.8	129	128.2	-76.6	-176.9	175.7	-167.4	0	121.8
959	S	26.7	Very low	27.6	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	79%	0.79	S	S	*	*			trans	56.9	129.7	136.5	64.4	0	0	0	0	121.1
960	Y	25.9	Very low	27.6	Very low	236 Å²	236	153.4 Å²	153.4	93%	0.925	80%	0.801	S	S	*	*			trans	-126.1	122.4	155.1	-19.8	-69.8	0	0	0	108.6
961	S	26.5	Very low	27.5	Very low	111 Å²	111	145.5 Å²	145.5	78%	0.776	79%	0.787	S	S	*	*			trans	-141.1	146.9	161.3	-172.8	0	0	0	0	107.1
962	L	28.3	Very low	27.6	Very low	169 Å²	169	150.1 Å²	150.1	89%	0.885	79%	0.793	S	S	*	*			trans	24.7	117.8	168.7	-108.9	64.9	0	0	0	119.4
963	G	24.7	Very low	27.5	Very low	78 Å²	78	150.6 Å²	150.6	80%	0.804	80%	0.796	S	S	*	*			trans	-162.2	136.7	166.8	0	0	0	0	0	112.7
964	H	26.3	Very low	27.3	Very low	180 Å²	180	150.5 Å²	150.5	83%	0.833	80%	0.796	S	S	*	*			trans	-101.5	-178	-178.4	-89.9	-115	0	0	0	112.7
965	Y	25.2	Very low	27.2	Very low	224 Å²	224	143.6 Å²	143.6	88%	0.878	78%	0.784	S	S	*	*			trans	91.2	143.6	168.1	-71.3	-107.5	0	0	0	117.5
966	S	27.9	Very low	27.3	Very low	101 Å²	101	146.9 Å²	146.9	71%	0.706	79%	0.789	S	S	*	*			cis	-177.8	144.9	-37.1	51.3	0	0	0	0	110.2
967	G	26.7	Very low	27.2	Very low	78 Å²	78	141.5 Å²	141.5	80%	0.804	78%	0.781	S	S	*	*			trans	88.1	155.6	156.1	0	0	0	0	0	117.1
968	E	30.2	Very low	27.2	Very low	184 Å²	184	143.3 Å²	143.3	86%	0.86	79%	0.79	S	S	*	*			cis	-163.8	139.5	-11.7	-162.7	175	-140.2	0	0	111.5
969	K	31.2	Very low	26.9	Very low	186 Å²	186	140 Å²	140	81%	0.809	79%	0.789	S	S	*	*			trans	178.2	114.5	140.2	-102.5	162.2	-174.3	176	0	113.6
970	T	29.3	Very low	26.9	Very low	130 Å²	130	139.8 Å²	139.8	80%	0.798	79%	0.787	S	S	*	*			trans	42.2	131.8	133.6	56.8	0	0	0	0	120.5
971	A	27.3	Very low	26.9	Very low	75 Å²	75	136.3 Å²	136.3	62%	0.62	78%	0.779	S	S	*	*			cis	-164.9	166.5	4	0	0	0	0	0	112.5
972	Q	29	Very low	26.9	Very low	190 Å²	190	137.2 Å²	137.2	89%	0.888	78%	0.78	S	S	*	*			trans	47.2	120.6	147.7	-68	156	-12.3	0	0	117.9
973	D	27.1	Very low	26.8	Very low	149 Å²	149	132.3 Å²	132.3	80%	0.797	77%	0.77	S	S	*	*				-151.7	-179.3	65.7	-145.4	-18.2	0	0	0	115.2
974	L	26.6	Very low	26.8	Very low	146 Å²	146	134.9 Å²	134.9	76%	0.764	78%	0.775	S	S	*	*			trans	-68.6	136.3	-172.5	-65.1	156.6	0	0	0	113
975	S	23.8	Very low	27	Very low	94 Å²	94	131.5 Å²	131.5	66%	0.657	77%	0.771	S	S	*	*			cis	85.2	116.5	48.8	91.2	0	0	0	0	115.4
976	V	28.1	Very low	27.2	Very low	141 Å²	141	128.5 Å²	128.5	86%	0.855	77%	0.769	S	S	*	*			trans	164.4	151.2	152.1	144.8	0	0	0	0	109.1
977	V	26.8	Very low	27.3	Very low	115 Å²	115	130.6 Å²	130.6	70%	0.697	77%	0.772	S	S	*	*			cis	-172.8	131	-46.5	121.7	0	0	0	0	108.5
978	L	25.3	Very low	27.4	Very low	151 Å²	151	134.1 Å²	134.1	79%	0.791	77%	0.772	S	S	*	*			trans	61.5	128	154.3	-65.9	177.7	0	0	0	124.7
979	S	23.1	Very low	27.6	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	77%	0.765	S	S	*	*				92.7	149.1	122.5	-71.8	0	0	0	0	124.4
980	S	25.8	Very low	27.7	Very low	96 Å²	96	129.1 Å²	129.1	67%	0.671	76%	0.757	S	S	*	*			trans	71.4	144.4	154.7	-70.4	0	0	0	0	119.1
981	E	26.3	Very low	27.9	Very low	164 Å²	164	128.3 Å²	128.3	77%	0.766	75%	0.752	S	S	*	*			cis	-166.3	-170.5	-18.8	-124.6	165.2	132.4	0	0	110.6
982	V	26.9	Very low	28.1	Very low	129 Å²	129	134.1 Å²	134.1	78%	0.782	77%	0.767	S	S	*	*			trans	-13.6	139.4	154.2	-175	0	0	0	0	115
983	G	24.9	Very low	28.1	Very low	67 Å²	67	128.7 Å²	128.7	69%	0.691	76%	0.762	S	S	*	*			cis	136.4	-159.1	17	0	0	0	0	0	109.8
984	C	25.6	Very low	28.4	Very low	132 Å²	132	129.8 Å²	129.8	89%	0.892	76%	0.762	S	S	*	*			trans	66.3	126.4	172.6	-89.2	0	0	0	0	120.5
985	S	29.6	Very low	28.5	Very low	108 Å²	108	132.5 Å²	132.5	76%	0.755	77%	0.768	S	S	*	*			trans	-78.4	149.5	150.6	169.3	0	0	0	0	110.3
986	L	28.9	Very low	28.8	Very low	161 Å²	161	138 Å²	138	84%	0.843	77%	0.774	S	S	*	*				-162	168.9	122.1	-157.4	47.2	0	0	0	112.1
987	L	30	Very low	29	Very low	146 Å²	146	138.7 Å²	138.7	76%	0.764	77%	0.773	S	S	*	*			trans	-87.6	156	-178.9	-60.3	162.6	0	0	0	112.9
988	D	29.3	Very low	29.1	Very low	151 Å²	151	139.2 Å²	139.2	81%	0.807	78%	0.78	S	S	*	*				179.4	162	127.2	-95.7	-9.9	0	0	0	108.7
989	M	34.5	Very low	29.4	Very low	143 Å²	143	138.1 Å²	138.1	70%	0.704	78%	0.78	S	S	*	*			cis	-164.2	-171	-42.2	-157.4	172.5	61.6	0	0	105.7
990	D	33.9	Very low	29.8	Very low	123 Å²	123	139.5 Å²	139.5	66%	0.658	78%	0.784	S	S	*	*			trans	72.1	137.5	157.9	-77.9	-28.7	0	0	0	121
991	T	32.4	Very low	30.2	Very low	112 Å²	112	140.4 Å²	140.4	69%	0.687	79%	0.788	S	S	*	*			cis	-160.5	161.2	-29.9	-5.8	0	0	0	0	111.3
992	E	31.7	Very low	30.4	Very low	198 Å²	198	140.5 Å²	140.5	93%	0.925	79%	0.792	S	S	*	*			trans	59	156.3	154.9	-65.7	-157.7	113.4	0	0	121.8
993	G	30.5	Very low	30.6	Very low	76 Å²	76	140.8 Å²	140.8	78%	0.784	80%	0.799	S	S	*	*			trans	157.1	24.8	174.4	0	0	0	0	0	118.5	K995	G993-K995 PolarHBondContact O-N 3.12Å
994	Q	31.6	Very low	30.7	Very low	171 Å²	171	148.2 Å²	148.2	80%	0.799	81%	0.806	S	S	*	*			trans	-62.5	130.2	-178.5	-71.1	-171.4	10.7	0	0	113.5
995	K	30.2	Very low	31.3	Very low	203 Å²	203	150 Å²	150	88%	0.883	81%	0.805	S	S	*	*			trans	-135.8	134.2	142.2	-83.3	-166.3	176.3	176.6	0	111.7	G993	G993-K995 PolarHBondContact O-N 3.12Å
996	R	30.4	Very low	31.2	Very low	209 Å²	209	153.1 Å²	153.1	79%	0.789	81%	0.807	S	S	*	*			trans	-90.9	139.8	167.6	-60.8	169.4	175.8	153.3	-2.6	108.2
997	D	31.4	Very low	31.5	Very low	157 Å²	157	150.9 Å²	150.9	84%	0.84	81%	0.805	S	S	*	*			trans	-146	124	151.4	-98.9	-47.4	0	0	0	109.6
998	C	28.9	Very low	31.8	Very low	126 Å²	126	148.8 Å²	148.8	85%	0.851	80%	0.803	S	S	*	*			trans	-102.5	107.9	-177.4	-59.4	0	0	0	0	109.5
999	T	30.8	Very low	32.4	Very low	127 Å²	127	147.4 Å²	147.4	78%	0.779	80%	0.802	S	S	*	*			trans	-130.9	124.3	172	-58.7	0	0	0	0	110.1
1000	V	33.1	Very low	32.9	Very low	131 Å²	131	145 Å²	145	79%	0.794	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-92.1	120.7	-179.1	-179.5	0	0	0	0	110
1001	P	33.6	Very low	33.3	Very low	115 Å²	115	148.9 Å²	148.9	75%	0.747	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-78.2	139.4	166.6	31.9	-32	0	0	0	110.7
1002	L	29.6	Very low	33.7	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.1	158.7	178.5	-76.4	159.6	0	0	0	112.5	R1004	L1002-R1004 PolarHBondContact O-N 3.03Å
1003	C	31.3	Very low	34.3	Very low	136 Å²	136	138.7 Å²	138.7	92%	0.919	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-46.3	124.4	-173.5	-52.1	0	0	0	0	113.9
1004	R	28	Very low	34.6	Very low	223 Å²	223	139 Å²	139	84%	0.842	75%	0.747	S	S	*	*			trans	-126	118.5	161.8	-153.3	179.9	-150.5	127.8	2.1	107.9	L1002 Q1006	L1002-R1004 PolarHBondContact O-N 3.03Å; R1004-Q1006 PolarHBondContact O-N 2.9Å
1005	I	36.7	Very low	34.9	Very low	170 Å²	170	138.3 Å²	138.3	87%	0.872	74%	0.741	S	S	*	*			trans	-63	119.2	173.5	-65.2	165.3	0	0	0	107.2
1006	Q	29.3	Very low	35.1	Very low	172 Å²	172	133.7 Å²	133.7	80%	0.804	72%	0.722	S	S	*	*			trans	-106.4	145.9	164.8	-75.9	-172.2	-29.9	0	0	108.9	R1004	R1004-Q1006 PolarHBondContact O-N 2.9Å
1007	S	33.9	Very low	35.8	Very low	114 Å²	114	126.5 Å²	126.5	80%	0.797	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-63.9	159.7	177.5	45.6	0	0	0	0	111.8
1008	S	36.6	Very low	36.2	Very low	102 Å²	102	123.8 Å²	123.8	71%	0.713	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-51.8	152.9	169.5	55	0	0	0	0	111.9
1009	P	42.4	Very low	36.4	Very low	122 Å²	122	125.6 Å²	125.6	79%	0.792	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-57	157.2	168.7	26.8	-34.9	0	0	0	111.1
1010	A	44.3	Very low	36.6	Very low	94 Å²	94	125.9 Å²	125.9	78%	0.777	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-66.1	167.5	171.1	0	0	0	0	0	110.8
1011	R	43.8	Very low	36.7	Very low	204 Å²	204	125 Å²	125	77%	0.77	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-62.5	140.5	164.3	-70.9	179.9	174.5	144.8	1.2	108.8
1012	P	40.2	Very low	36.6	Very low	63 Å²	63	127.7 Å²	127.7	41%	0.409	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-61.3	153.8	170.3	27.9	-34.5	0	0	0	110.4	E1016 L1017	P1012-E1016 HydrophobicContact CB-CB 4.12Å; P1012-L1017 HydrophobicContact CG-CD2 4.02Å; P1012-L1017 HydrophobicContact CG-CG 4.14Å
1013	S	43.2	Very low	36.7	Very low	32 Å²	32	127.4 Å²	127.4	22%	0.224	67%	0.665	C	S	.	*	P	Polyproline II helix	trans	-70.6	160.6	174.7	61.8	0	0	0	0	111.7	E439 F1015 E1016 L1017	E439-S1013 VanDerWaalsContact OE1-CA 3.25Å; E439-S1013 WeakPolarHBondContact OE1-CA 3.4Å; E439-S1013 VanDerWaalsContact OE1-CB 3.27Å; E439-S1013 WeakPolarHBondContact OE1-CB 3.34Å; S1013-F1015 PolarHBondContact O-N 3.05Å; S1013-E1016 WeakPolarHBondContact CB-OE2 3.49Å; S1013-E1016 PolarHBondContact N-OE2 2.96Å; S1013-E1016 PolarHBondContact O-N 3.24Å; S1013-E1016 WeakPolarHBondContact OG-CG 3.5Å; S1013-E1016 PolarHBondContact OG-N 2.9Å; S1013-E1016 PolarHBondContact OG-OE2 3.35Å; S1013-L1017 PolarHBondContact O-N 3.25Å
1014	M	38.3	Very low	37	Very low	84 Å²	84	127 Å²	127	41%	0.414	65%	0.652	S	S	.	*	H	α-helix	trans	-56.7	-35.4	177.4	-168.5	-169.6	-66.5	0	0	112.1	R436 E439 L1017 E1018	R436-M1014 HydrophobicContact CG-CE 4.14Å; E439-M1014 PolarHBondContact OE1-N 3.21Å; M1014-L1017 PolarHBondContact O-N 3.26Å; M1014-E1018 PolarHBondContact O-N 2.94Å
1015	F	36.2	Very low	37.4	Very low	155 Å²	155	121.9 Å²	121.9	68%	0.68	64%	0.642	S	S	*	*	H	α-helix	trans	-76.3	-18.3	178.6	-82.3	-77.4	0	0	0	114.9	S1013 E1018	S1013-F1015 PolarHBondContact O-N 3.05Å; F1015-E1018 WeakPolarHBondContact CD1-OE2 3.48Å
1016	E	36.1	Very low	37.5	Very low	106 Å²	106	119.2 Å²	119.2	50%	0.495	63%	0.63	S	S	.	*	H	α-helix	trans	-80.8	-35.3	171.5	-76.2	161.5	133.7	0	0	110.8	P1012 S1013 E1018 K1019 E1020	P1012-E1016 HydrophobicContact CB-CB 4.12Å; S1013-E1016 WeakPolarHBondContact CB-OE2 3.49Å; S1013-E1016 PolarHBondContact N-OE2 2.96Å; S1013-E1016 PolarHBondContact O-N 3.24Å; S1013-E1016 WeakPolarHBondContact OG-CG 3.5Å; S1013-E1016 PolarHBondContact OG-N 2.9Å; S1013-E1016 PolarHBondContact OG-OE2 3.35Å; E1016-E1018 VanDerWaalsContact C-N 3.34Å; E1016-E1018 PolarHBondContact O-N 2.88Å; E1016-K1019 WeakPolarHBondContact O-CA 3.26Å; E1016-K1019 WeakPolarHBondContact O-CB 3.41Å; E1016-K1019 PolarHBondContact O-N 2.98Å; E1016-E1020 PolarHBondContact O-N 3.27Å
1017	L	43.8	Very low	38	Very low	58 Å²	58	116.1 Å²	116.1	30%	0.304	62%	0.62	S	S	.	*	H	α-helix	trans	-62.9	-36.2	174.7	-70.6	166.7	0	0	0	112.5	Y350 P1012 S1013 M1014 K1019 E1020 F1021	Y350-L1017 HydrophobicContact CE2-CD1 4.25Å; P1012-L1017 HydrophobicContact CG-CD2 4.02Å; P1012-L1017 HydrophobicContact CG-CG 4.14Å; S1013-L1017 PolarHBondContact O-N 3.25Å; M1014-L1017 PolarHBondContact O-N 3.26Å; L1017-K1019 PolarHBondContact O-N 2.99Å; L1017-K1019 VanDerWaalsContact O-N 3.14Å; L1017-E1020 PolarHBondContact O-N 3.44Å; L1017-F1021 WeakPolarHBondContact O-CB 3.35Å; L1017-F1021 PolarHBondContact O-N 3Å
1018	E	40.8	Very low	38.2	Very low	101 Å²	101	116.3 Å²	116.3	47%	0.472	61%	0.608	S	S	.	*	H	α-helix	trans	-59.5	-20.7	170.9	-75.4	-168	135.4	0	0	113.8	L346 M1014 F1015 E1016	L346-E1018 HydrophobicContact CD2-CG 4.11Å; M1014-E1018 PolarHBondContact O-N 2.94Å; F1015-E1018 WeakPolarHBondContact CD1-OE2 3.48Å; E1016-E1018 VanDerWaalsContact C-N 3.34Å; E1016-E1018 PolarHBondContact O-N 2.88Å
1019	K	32	Very low	38.3	Very low	163 Å²	163	117.2 Å²	117.2	71%	0.709	60%	0.601	S	S	*	*	H	α-helix	trans	-97.3	-42.6	178.1	-105.7	-179.3	173.7	-179.1	0	113.1	E1016 L1017 F1021 F1022 S1023	E1016-K1019 WeakPolarHBondContact O-CA 3.26Å; E1016-K1019 WeakPolarHBondContact O-CB 3.41Å; E1016-K1019 PolarHBondContact O-N 2.98Å; L1017-K1019 PolarHBondContact O-N 2.99Å; L1017-K1019 VanDerWaalsContact O-N 3.14Å; K1019-F1021 VanDerWaalsContact C-N 3.3Å; K1019-F1021 PolarHBondContact O-N 3.14Å; K1019-F1022 PolarHBondContact O-N 3.16Å; K1019-S1023 PolarHBondContact O-N 3.24Å; K1019-S1023 PolarHBondContact O-OG 3.19Å
1020	E	34.9	Very low	38	Very low	133 Å²	133	116.9 Å²	116.9	62%	0.621	59%	0.588	S	S	*	*	H	α-helix	trans	-73.1	-20.4	178.3	-67	-170.8	147.4	0	0	112.9	E1016 L1017 F1022	E1016-E1020 PolarHBondContact O-N 3.27Å; L1017-E1020 PolarHBondContact O-N 3.44Å; E1020-F1022 VanDerWaalsContact C-N 3.32Å
1021	F	36.2	Very low	37.5	Very low	112 Å²	112	118.6 Å²	118.6	49%	0.491	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.4	-7.2	175.4	-157.3	-96.8	0	0	0	114	L1017 K1019	L1017-F1021 WeakPolarHBondContact O-CB 3.35Å; L1017-F1021 PolarHBondContact O-N 3Å; K1019-F1021 VanDerWaalsContact C-N 3.3Å; K1019-F1021 PolarHBondContact O-N 3.14Å
1022	F	31.9	Very low	37	Very low	173 Å²	173	111.5 Å²	111.5	76%	0.759	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	22.4	176.1	-74.8	-74.5	0	0	0	112.6	K1019 E1020	K1019-F1022 PolarHBondContact O-N 3.16Å; E1020-F1022 VanDerWaalsContact C-N 3.32Å
1023	S	30.8	Very low	36.7	Very low	158 Å²	158	115.9 Å²	115.9	100%	1.105	57%	0.57	S	S	*	*			trans	-122.9	0	176	-57.1	0	0	0	0	111.6	K1019	K1019-S1023 PolarHBondContact O-N 3.24Å; K1019-S1023 PolarHBondContact O-OG 3.19Å

Retrieved 1,023 of 1,023 residues in 450.6 ms (Link to these results)

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