A0A087XEF1_POEFO Loading...

Tax1 (human T-cell leukemia virus type I) binding protein 1b

May have anti-apoptotic activity.

AlphaFold DB , UniProt , Accession A0A087XEF1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 839 aa.

						>A0A087XEF1_POEFO|A0A087XEF1
MALFLDGTLLSRNMDTSNFAHVIFQNVGKSYLPHAALDCNYTLTQFIKPHPKDWVGIFKVGWSTARDYYTFLWSPLPENYVEGTAVNRTVIFQGYYVPNDDGEFYQFCYVTHKGEIRGASTPFQFRANSPSEDELLTVEDECNSDILVVTTKAGLLEQKVEEAQREKEELLKSMALIQQEKEQLDAEKDSLQKEFEQEKESCAQLRREIQEVLHSSQALQEEKEEVKRRLEEATARIVQLEEDLIGVTQKGLQKETELDSLKDRLKKVALEKEALESHVKNERDEKELYKIHLKNRELENTKLSAELQMLKSVDVNKENTIAQFKEEVGRLQACLTEKERQYKEILAKVSPLGDMKALKEQLRQKEDQLQANQQQSSLLAAELRDASSARDRTMSELYHMKLEADALRQAKAEAQAQCVHLELVVEQMKADAKKEAAKSEEEASTDPAVVAELQREVEDLKLRLLMAAEHYKEKYKECQRLQKQVLKLSEQQGEVKKSTVPEAAAAIPASGSPDTSVPGSPGSADPMLEAIIQEKLKGISREASDRNDKYRKCKQMLMEEKERSSLFADELAKTELKLKEQLKTNESLKLQLAAAEDRYKSQVAEKGRELKELRDTFALVVREKEKLEGELQKSSSKKGDQGASEKTSLENLQTSVPLILQYPVPYAQDTPTPLLVSQSPSKLHFGNPYSISNSKDETEEEFADDQPLKLPPVGPPSWDSNVVCIQPSRNLSRPEGHEEAEENNNVNTNEQPLGTETRSSFVNDGQTPFCFDSSMDMKRCPLCEVIFPPNYDQSKFEEHVESHWKICPMCSEQFPLDCDQKVFENHVLTHFDGHPLNFD
					

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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	32.6	Very low	34.8	Very low	247 Å²	247	151.6 Å²	151.6	100%	1.217	85%	0.853	S	S	*	*				0	138	0	-61.3	169.7	-173.7	0	0	107.4
2	A	31.5	Very low	35.7	Very low	89 Å²	89	155.3 Å²	155.3	74%	0.736	84%	0.844	S	S	*	*			trans	-115.4	121.9	175.7	0	0	0	0	0	108.6
3	L	31.3	Very low	36.5	Very low	166 Å²	166	155.2 Å²	155.2	87%	0.869	84%	0.842	S	S	*	*			trans	-90.6	106.9	178.9	-68.4	172.6	0	0	0	109.3	L5	L3-L5 PolarHBondContact O-N 2.83Å
4	F	31.7	Very low	37.5	Very low	203 Å²	203	155 Å²	155	89%	0.89	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-74	117.3	162.4	-90.9	-100.6	0	0	0	108.5
5	L	38.1	Very low	38.3	Very low	165 Å²	165	149.3 Å²	149.3	86%	0.864	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-85.4	117.1	156.5	-77.6	106.1	0	0	0	107.8	L3	L3-L5 PolarHBondContact O-N 2.83Å
6	D	34.1	Very low	39.1	Very low	159 Å²	159	148.3 Å²	148.3	85%	0.85	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-79.7	138.6	170.8	-165.1	9.9	0	0	0	110.2
7	G	33	Very low	40.7	Very low	53 Å²	53	142.6 Å²	142.6	55%	0.546	78%	0.78	S	S	.	*	P	Polyproline II helix	trans	-102.8	121.2	-167.6	0	0	0	0	0	112.3	L9	G7-L9 PolarHBondContact O-N 2.99Å
8	T	33.5	Very low	42.3	Very low	144 Å²	144	140.2 Å²	140.2	88%	0.883	77%	0.766	S	S	*	*			trans	-52.9	96.8	-170.7	-42.5	0	0	0	0	114.7	L10	T8-L10 PolarHBondContact O-N 2.91Å
9	L	39.8	Very low	43.9	Very low	154 Å²	154	140.5 Å²	140.5	81%	0.806	76%	0.759	S	S	*	*			trans	-74.2	97.9	170.2	-78.5	169.7	0	0	0	111	G7	G7-L9 PolarHBondContact O-N 2.99Å
10	L	37	Very low	45.9	Very low	164 Å²	164	135.1 Å²	135.1	86%	0.859	73%	0.734	S	S	*	*			trans	-164.5	59.2	159.8	-113.8	169.1	0	0	0	115.3	T8	T8-L10 PolarHBondContact O-N 2.91Å
11	S	40.4	Very low	47.9	Very low	124 Å²	124	129.9 Å²	129.9	87%	0.867	71%	0.705	S	S	*	*			trans	-152.6	88.7	159.8	-167.2	0	0	0	0	111
12	R	45.8	Very low	50.7	Low	196 Å²	196	118.2 Å²	118.2	74%	0.74	65%	0.648	S	S	*	*			trans	-149.7	36.6	-172.2	-153.7	177.8	179.8	177.5	-0.3	113.9
13	N	45.8	Very low	53.6	Low	154 Å²	154	117.6 Å²	117.6	82%	0.824	63%	0.631	S	S	*	*	S	Bend	trans	-122.2	19.5	-174.4	-77.8	-11.8	0	0	0	113.8
14	M	50.5	Low	56.7	Low	152 Å²	152	110.7 Å²	110.7	75%	0.749	59%	0.594	S	S	*	*			trans	-117.4	-6.8	177.9	-75	-68.9	172.6	0	0	114.2	T16	M14-T16 PolarHBondContact O-N 2.73Å
15	D	49.3	Very low	59.4	Low	69 Å²	69	104.7 Å²	104.7	37%	0.369	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.5	15.5	-165.2	-52.3	-17.8	0	0	0	114.9	F46	D15-F46 HydrophobicContact CB-CE2 4.32Å; D15-F46 WeakPolarHBondContact O-CE2 3.29Å
16	T	50.5	Low	61.8	Low	134 Å²	134	103.5 Å²	103.5	82%	0.822	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.8	1.7	-173.2	57.3	0	0	0	0	114.6	M14	M14-T16 PolarHBondContact O-N 2.73Å
17	S	67.4	Low	64.5	Low	52 Å²	52	97.4 Å²	97.4	36%	0.364	53%	0.532	S	S	.	.			trans	-83.7	130.7	175.6	179.7	0	0	0	0	111.8	F19 A20 H21	S17-F19 PolarHBondContact O-N 3.22Å; S17-F19 PolarHBondContact OG-N 3.44Å; S17-A20 PolarHBondContact O-N 3.06Å; S17-H21 PolarHBondContact O-CD2 2.95Å
18	N	68.3	Low	67	Low	99 Å²	99	96.1 Å²	96.1	53%	0.529	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-22.5	175.2	-94.1	-58.3	0	0	0	114.2	H21 R117	N18-H21 WeakPolarHBondContact CA-NE2 3.32Å; N18-R117 WeakPolarHBondContact O-CD 3.24Å; N18-R117 PolarHBondContact O-NH1 3.24Å; N18-R117 VanDerWaalsContact O-NH1 3.13Å; N18-R117 PolarHBondContact OD1-NH1 3.41Å
19	F	73.3	Confident	69.5	Low	146 Å²	146	98.3 Å²	98.3	64%	0.64	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-0.4	-179.3	-56.6	-75.7	0	0	0	114.1	S17 R117 G118	S17-F19 PolarHBondContact O-N 3.22Å; S17-F19 PolarHBondContact OG-N 3.44Å; F19-R117 CarbonylContact C-O 3.55Å; F19-R117 CarbonylContact O-C 3.59Å; F19-R117 VanDerWaalsContact O-C 3.3Å; F19-G118 VanDerWaalsContact O-CA 3.24Å; F19-G118 WeakPolarHBondContact O-CA 3.47Å; F19-G118 PolarHBondContact O-N 3.05Å
20	A	83.3	Confident	71.8	Confident	32 Å²	32	92.5 Å²	92.5	26%	0.264	49%	0.488	S	S	.	.			trans	-120.1	20.3	-175.8	0	0	0	0	0	113.4	S17 V22 R117	S17-A20 PolarHBondContact O-N 3.06Å; A20-V22 PolarHBondContact O-N 2.85Å; A20-R117 CarbonylContact C-O 3.59Å
21	H	88.6	Confident	74.3	Confident	26 Å²	26	86.8 Å²	86.8	12%	0.12	46%	0.455	C	S	.	.	S	Bend	trans	-72.9	-12.5	177.2	-62.1	-160.2	0	0	0	112.5	S17 N18 T44 F46 I47 R117	S17-H21 PolarHBondContact O-CD2 2.95Å; N18-H21 WeakPolarHBondContact CA-NE2 3.32Å; H21-T44 WeakPolarHBondContact CA-OG1 3.48Å; H21-T44 VanDerWaalsContact O-CB 3.31Å; H21-T44 WeakPolarHBondContact O-CB 3.33Å; H21-T44 VanDerWaalsContact O-CG2 3.29Å; H21-T44 WeakPolarHBondContact O-CG2 3.36Å; H21-T44 PolarHBondContact O-N 2.7Å; H21-T44 PolarHBondContact O-OG1 2.65Å; H21-F46 HydrophobicContact CB-CB 4.3Å; H21-F46 PolarHBondContact CE1-O 2.71Å; H21-F46 PolarHBondContact ND1-O 2.98Å; H21-I47 HydrophobicContact CB-CB 3.93Å; H21-I47 HydrophobicContact CB-CG2 4.24Å; H21-I47 VanDerWaalsContact O-CG2 3.3Å; H21-I47 WeakPolarHBondContact O-CG2 3.27Å; H21-R117 CarbonylContact C-O 3.59Å; H21-R117 HydrophobicContact CB-CB 4.47Å; H21-R117 PolarHBondContact CE1-NH1 2.89Å; H21-R117 VanDerWaalsContact CE1-NH1 3.3Å; H21-R117 PolarHBondContact N-O 3.22Å; H21-R117 PolarHBondContact ND1-NH1 3.46Å
22	V	92	Very high	76.6	Confident	2 Å²	2	85.6 Å²	85.6	1%	0.012	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.1	167.4	-178.2	0	0	0	0	109.4	A20 Y41 T42 L43 I47 Y109 R117 G118	A20-V22 PolarHBondContact O-N 2.85Å; V22-Y41 HydrophobicContact CG1-CD2 3.71Å; V22-Y41 HydrophobicContact CG1-CG 4.2Å; V22-T42 WeakPolarHBondContact CA-O 3.39Å; V22-L43 HydrophobicContact CG1-CD2 4.46Å; V22-L43 HydrophobicContact CG2-CD2 3.82Å; V22-I47 HydrophobicContact CG2-CD1 3.86Å; V22-I47 HydrophobicContact CG2-CG2 3.98Å; V22-Y109 HydrophobicContact CB-CD1 4.37Å; V22-Y109 HydrophobicContact CB-CD2 4.29Å; V22-Y109 HydrophobicContact CB-CG 3.93Å; V22-Y109 HydrophobicContact CG1-CD2 3.77Å; V22-Y109 HydrophobicContact CG1-CE2 4.49Å; V22-Y109 HydrophobicContact CG1-CG 3.9Å; V22-Y109 HydrophobicContact CG2-CD1 3.65Å; V22-Y109 HydrophobicContact CG2-CD2 4.04Å; V22-Y109 HydrophobicContact CG2-CE1 4.01Å; V22-Y109 HydrophobicContact CG2-CE2 4.39Å; V22-Y109 HydrophobicContact CG2-CG 3.66Å; V22-R117 PolarHBondContact N-O 3.43Å; V22-G118 WeakPolarHBondContact O-CA 3.23Å
23	I	92.6	Very high	78.5	Confident	76 Å²	76	77.7 Å²	77.7	39%	0.39	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.9	-175.2	-57.7	174.3	0	0	0	108.8	Y41 T42 T44	I23-Y41 CarbonylContact O-C 3.59Å; I23-Y41 VanDerWaalsContact O-CA 3.25Å; I23-Y41 WeakPolarHBondContact O-CA 3.37Å; I23-T42 PolarHBondContact N-O 2.9Å; I23-T42 PolarHBondContact O-N 3.04Å; I23-T44 HydrophobicContact CD1-CG2 3.92Å; I23-T44 HydrophobicContact CG1-CG2 4.08Å
24	F	94.8	Very high	80.2	Confident	20 Å²	20	76.8 Å²	76.8	9%	0.088	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	132.5	175	-66.4	-82	0	0	0	110.7	V27 C39 N40 Y41 V55 F107	F24-V27 HydrophobicContact CB-CG2 3.71Å; F24-C39 VanDerWaalsContact CE1-SG 3.54Å; F24-N40 WeakPolarHBondContact CA-O 3.27Å; F24-Y41 HydrophobicContact CD1-CG 4.44Å; F24-Y41 HydrophobicContact CE1-CD1 4.22Å; F24-Y41 HydrophobicContact CE1-CG 4.21Å; F24-V55 HydrophobicContact CE1-CG1 3.83Å; F24-V55 HydrophobicContact CE1-CG2 4.33Å; F24-V55 HydrophobicContact CZ-CG1 4.05Å; F24-F107 HydrophobicContact CD1-CB 3.71Å; F24-F107 HydrophobicContact CD1-CD2 4.09Å; F24-F107 HydrophobicContact CD1-CG 4.16Å; F24-F107 HydrophobicContact CD2-CB 4.19Å; F24-F107 HydrophobicContact CE1-CB 3.45Å; F24-F107 VanDerWaalsContact CE1-CB 3.45Å; F24-F107 HydrophobicContact CE1-CG 4.17Å; F24-F107 HydrophobicContact CE2-CB 3.93Å; F24-F107 WeakPolarHBondContact CE2-O 3.28Å; F24-F107 HydrophobicContact CG-CB 4.09Å; F24-F107 HydrophobicContact CG-CD2 4.49Å; F24-F107 HydrophobicContact CZ-CB 3.56Å
25	Q	90	Very high	81.9	Confident	77 Å²	77	71.2 Å²	71.2	36%	0.36	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	151.1	-177.5	-63.6	-160.7	3.3	0	0	111.9	V27 N40 T42	Q25-V27 PolarHBondContact O-N 2.81Å; Q25-V27 VanDerWaalsContact O-N 3.16Å; Q25-N40 HydrophobicContact CB-CB 4.34Å; Q25-N40 PolarHBondContact N-O 3.36Å; Q25-T42 PolarHBondContact NE2-OG1 3.32Å
26	N	87.3	Confident	83.9	Confident	141 Å²	141	70.9 Å²	70.9	75%	0.754	39%	0.388	S	S	*	.	S	Bend	trans	50.9	38.9	172.9	-60.2	-11.6	0	0	0	114	G28	N26-G28 PolarHBondContact O-N 2.83Å
27	V	90.9	Very high	85.9	Confident	30 Å²	30	64.8 Å²	64.8	18%	0.182	35%	0.351	C	S	.	.			trans	-74.9	110.5	-179.5	-175.2	0	0	0	0	109.2	F24 Q25 Y31 F123	F24-V27 HydrophobicContact CB-CG2 3.71Å; Q25-V27 PolarHBondContact O-N 2.81Å; Q25-V27 VanDerWaalsContact O-N 3.16Å; V27-Y31 WeakPolarHBondContact CA-OH 3.38Å; V27-F123 HydrophobicContact CG1-CD1 3.61Å; V27-F123 HydrophobicContact CG1-CE1 4.11Å
28	G	86.1	Confident	87.1	Confident	26 Å²	26	66.4 Å²	66.4	27%	0.268	36%	0.355	S	S	.	.			trans	-71	152.4	179.6	0	0	0	0	0	111.9	N26 S30 Y31 F123	N26-G28 PolarHBondContact O-N 2.83Å; G28-S30 VanDerWaalsContact C-N 3.26Å; G28-S30 PolarHBondContact O-N 3.12Å; G28-Y31 PolarHBondContact N-OH 3.16Å; G28-F123 VanDerWaalsContact O-CB 3.22Å; G28-F123 WeakPolarHBondContact O-CB 3.32Å
29	K	86.8	Confident	88.3	Confident	191 Å²	191	61.7 Å²	61.7	83%	0.83	33%	0.33	S	S	*	.	S	Bend	trans	-67.5	-28.4	176.5	-63.9	-178.5	-178.8	177.8	0	112.6	F123 Q124	K29-F123 WeakPolarHBondContact O-CA 3.35Å; K29-Q124 PolarHBondContact O-N 3.32Å
30	S	87.9	Confident	89.3	Confident	31 Å²	31	57.2 Å²	57.2	22%	0.217	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	153.2	170.9	50.1	0	0	0	0	112.1	G28 Q124	G28-S30 VanDerWaalsContact C-N 3.26Å; G28-S30 PolarHBondContact O-N 3.12Å; S30-Q124 CarbonylContact C-O 3.57Å; S30-Q124 WeakPolarHBondContact CA-O 3.43Å; S30-Q124 WeakPolarHBondContact CB-O 3.46Å
31	Y	89.3	Confident	89.8	Confident	45 Å²	45	55.8 Å²	55.8	18%	0.176	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	157.9	176.7	-64.8	-76.8	0	0	0	110.7	V27 G28 L37 F123 Q124 F125 R126	V27-Y31 WeakPolarHBondContact CA-OH 3.38Å; G28-Y31 PolarHBondContact N-OH 3.16Å; Y31-L37 HydrophobicContact CD1-CD1 3.42Å; Y31-L37 VanDerWaalsContact CD1-CD1 3.42Å; Y31-L37 HydrophobicContact CD2-CD1 3.84Å; Y31-L37 HydrophobicContact CD2-CD2 4.43Å; Y31-L37 HydrophobicContact CE1-CD1 3.39Å; Y31-L37 HydrophobicContact CE2-CD1 3.82Å; Y31-L37 HydrophobicContact CG-CD1 3.63Å; Y31-F123 HydrophobicContact CD2-CB 4.18Å; Y31-F123 AromaticContact CD2-CD2 3.66Å; Y31-F123 HydrophobicContact CD2-CD2 3.66Å; Y31-F123 HydrophobicContact CD2-CE2 4.15Å; Y31-F123 AromaticContact CD2-CG 3.94Å; Y31-F123 HydrophobicContact CD2-CG 3.94Å; Y31-F123 HydrophobicContact CE2-CB 4.09Å; Y31-F123 HydrophobicContact CE2-CD1 4.07Å; Y31-F123 AromaticContact CE2-CD2 3.89Å; Y31-F123 HydrophobicContact CE2-CD2 3.89Å; Y31-F123 HydrophobicContact CE2-CE1 4.44Å; Y31-F123 HydrophobicContact CE2-CE2 4.28Å; Y31-F123 AromaticContact CE2-CG 3.77Å; Y31-F123 HydrophobicContact CE2-CG 3.77Å; Y31-Q124 PolarHBondContact N-O 2.69Å; Y31-F125 CarbonylContact O-C 3.58Å; Y31-F125 VanDerWaalsContact O-CA 3.29Å; Y31-F125 WeakPolarHBondContact O-CA 3.43Å; Y31-R126 PolarHBondContact O-N 2.96Å; Y31-R126 VanDerWaalsContact O-O 3.13Å
32	L	87.9	Confident	90	Very high	98 Å²	98	55.4 Å²	55.4	51%	0.513	30%	0.3	S	S	.	.			trans	-73.8	129.2	178.8	-65.5	176.5	0	0	0	111	A35	L32-A35 HydrophobicContact CB-CB 3.76Å; L32-A35 PolarHBondContact O-N 2.87Å
33	P	86	Confident	90	Very high	30 Å²	30	55.3 Å²	55.3	20%	0.195	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	147.4	168.4	-19.1	30.1	0	0	0	110.7	A35 D100 F125	P33-A35 PolarHBondContact O-N 2.91Å; P33-D100 HydrophobicContact CG-CB 3.93Å; P33-F125 HydrophobicContact CG-CB 4.21Å
34	H	81.2	Confident	89.8	Confident	135 Å²	135	52.5 Å²	52.5	63%	0.625	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	1.8	-178.9	-52.3	83.3	0	0	0	116.5	G94 N99	H34-G94 WeakPolarHBondContact CA-O 3.5Å; H34-G94 WeakPolarHBondContact O-CA 3.45Å; H34-N99 PolarHBondContact CE1-OD1 2.72Å; H34-N99 PolarHBondContact NE2-OD1 2.9Å
35	A	87.5	Confident	89.3	Confident	35 Å²	35	56.9 Å²	56.9	29%	0.289	31%	0.307	S	S	.	.	S	Bend	trans	-89.6	157	173.1	0	0	0	0	0	111.9	L32 P33 G94	L32-A35 HydrophobicContact CB-CB 3.76Å; L32-A35 PolarHBondContact O-N 2.87Å; P33-A35 PolarHBondContact O-N 2.91Å; A35-G94 WeakPolarHBondContact O-CA 3.25Å
36	A	89.6	Confident	89.1	Confident	62 Å²	62	57.9 Å²	57.9	51%	0.512	31%	0.31	S	S	.	.			trans	-67	138.4	169.4	0	0	0	0	0	110.4	I91 F92	A36-I91 HydrophobicContact CB-CG2 4.12Å; A36-F92 CarbonylContact C-O 3.56Å; A36-F92 WeakPolarHBondContact CA-O 3.29Å
37	L	92.4	Very high	89.1	Confident	6 Å²	6	51.8 Å²	51.8	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	108.8	-173.9	169.2	56.5	0	0	0	111	Y31 C39 I57 F92 V97 F107 F123 F125	Y31-L37 HydrophobicContact CD1-CD1 3.42Å; Y31-L37 VanDerWaalsContact CD1-CD1 3.42Å; Y31-L37 HydrophobicContact CD2-CD1 3.84Å; Y31-L37 HydrophobicContact CD2-CD2 4.43Å; Y31-L37 HydrophobicContact CE1-CD1 3.39Å; Y31-L37 HydrophobicContact CE2-CD1 3.82Å; Y31-L37 HydrophobicContact CG-CD1 3.63Å; L37-C39 PolarHBondContact O-N 2.89Å; L37-I57 HydrophobicContact CD2-CD1 4.04Å; L37-F92 HydrophobicContact CB-CB 4.22Å; L37-F92 PolarHBondContact N-O 2.88Å; L37-F92 PolarHBondContact O-N 2.87Å; L37-V97 HydrophobicContact CB-CG1 4.04Å; L37-V97 HydrophobicContact CD2-CG1 4.11Å; L37-F107 HydrophobicContact CD1-CZ 4.04Å; L37-F107 HydrophobicContact CD2-CE1 3.99Å; L37-F107 HydrophobicContact CD2-CZ 3.75Å; L37-F107 HydrophobicContact CG-CE1 4.34Å; L37-F107 HydrophobicContact CG-CZ 3.87Å; L37-F123 HydrophobicContact CD2-CE2 4.45Å; L37-F125 HydrophobicContact CD2-CE1 3.7Å; L37-F125 HydrophobicContact CD2-CZ 3.52Å
38	D	93.2	Very high	88.9	Confident	86 Å²	86	56.1 Å²	56.1	46%	0.46	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	103.7	177.4	-68	-14	0	0	0	111.1	N40 T89 I91	D38-N40 PolarHBondContact O-N 2.79Å; D38-T89 HydrophobicContact CB-CG2 4.41Å; D38-I91 WeakPolarHBondContact OD1-CG1 3.3Å; D38-I91 WeakPolarHBondContact OD1-CG2 3.15Å
39	C	93.9	Very high	89.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	100.7	174.5	-176.1	0	0	0	0	110.1	F24 L37 T89 V90 F92 F107	F24-C39 VanDerWaalsContact CE1-SG 3.54Å; L37-C39 PolarHBondContact O-N 2.89Å; C39-T89 CarbonylContact O-C 3.56Å; C39-T89 VanDerWaalsContact O-CA 3.32Å; C39-T89 WeakPolarHBondContact O-CA 3.4Å; C39-V90 HydrophobicContact CB-CG2 3.81Å; C39-V90 WeakPolarHBondContact CB-O 3.47Å; C39-V90 PolarHBondContact N-O 2.89Å; C39-V90 PolarHBondContact O-N 2.86Å; C39-F92 HydrophobicContact CB-CD2 3.96Å; C39-F92 HydrophobicContact CB-CE2 3.72Å; C39-F107 HydrophobicContact CB-CD1 4.09Å; C39-F107 HydrophobicContact CB-CE1 3.63Å; C39-F107 HydrophobicContact CB-CE2 4.12Å; C39-F107 HydrophobicContact CB-CZ 3.63Å; C39-F107 WeakPolarHBondContact SG-CD1 3.23Å; C39-F107 VanDerWaalsContact SG-CD2 3.55Å; C39-F107 VanDerWaalsContact SG-CE1 3.58Å; C39-F107 WeakPolarHBondContact SG-CG 3.23Å
40	N	94.1	Very high	89.2	Confident	53 Å²	53	49.5 Å²	49.5	28%	0.283	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	134.2	177.4	-66.6	-65.9	0	0	0	111.1	F24 Q25 D38 T89	F24-N40 WeakPolarHBondContact CA-O 3.27Å; Q25-N40 HydrophobicContact CB-CB 4.34Å; Q25-N40 PolarHBondContact N-O 3.36Å; D38-N40 PolarHBondContact O-N 2.79Å; N40-T89 WeakPolarHBondContact OD1-CB 3.14Å; N40-T89 VanDerWaalsContact OD1-CG2 3.23Å; N40-T89 WeakPolarHBondContact OD1-CG2 3.36Å; N40-T89 PolarHBondContact OD1-OG1 3.41Å
41	Y	94.1	Very high	89.3	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	150.7	178.5	58.4	-82.9	0	0	0	113.6	V22 I23 F24 L43 V55 S74 N87 R88 V90 Y109	V22-Y41 HydrophobicContact CG1-CD2 3.71Å; V22-Y41 HydrophobicContact CG1-CG 4.2Å; I23-Y41 CarbonylContact O-C 3.59Å; I23-Y41 VanDerWaalsContact O-CA 3.25Å; I23-Y41 WeakPolarHBondContact O-CA 3.37Å; F24-Y41 HydrophobicContact CD1-CG 4.44Å; F24-Y41 HydrophobicContact CE1-CD1 4.22Å; F24-Y41 HydrophobicContact CE1-CG 4.21Å; Y41-L43 HydrophobicContact CD2-CD2 4.24Å; Y41-L43 HydrophobicContact CD2-CG 4.48Å; Y41-L43 HydrophobicContact CE2-CD2 4.06Å; Y41-L43 HydrophobicContact CE2-CG 4.35Å; Y41-V55 HydrophobicContact CD1-CG2 4.19Å; Y41-V55 HydrophobicContact CE1-CG2 3.75Å; Y41-V55 HydrophobicContact CE2-CG2 4.44Å; Y41-S74 PolarHBondContact OH-OG 3.03Å; Y41-N87 CarbonylContact O-C 3.59Å; Y41-N87 WeakPolarHBondContact O-CA 3.35Å; Y41-R88 HydrophobicContact CD1-CB 4.47Å; Y41-R88 HydrophobicContact CD2-CB 3.99Å; Y41-R88 HydrophobicContact CE1-CB 3.98Å; Y41-R88 HydrophobicContact CE2-CB 3.46Å; Y41-R88 VanDerWaalsContact CE2-CB 3.46Å; Y41-R88 HydrophobicContact CE2-CG 3.95Å; Y41-R88 HydrophobicContact CG-CB 4.47Å; Y41-R88 VanDerWaalsContact CZ-CB 3.44Å; Y41-R88 PolarHBondContact N-O 2.89Å; Y41-R88 PolarHBondContact O-N 2.85Å; Y41-R88 VanDerWaalsContact O-O 3.09Å; Y41-V90 HydrophobicContact CE1-CG1 4.09Å; Y41-V90 HydrophobicContact CE1-CG2 4.12Å; Y41-Y109 HydrophobicContact CD2-CD2 4.16Å; Y41-Y109 HydrophobicContact CD2-CE2 4.18Å; Y41-Y109 AromaticContact CE2-CD2 3.97Å; Y41-Y109 HydrophobicContact CE2-CD2 3.97Å; Y41-Y109 AromaticContact CE2-CE2 3.61Å; Y41-Y109 HydrophobicContact CE2-CE2 3.61Å
42	T	92.5	Very high	89.5	Confident	17 Å²	17	56.1 Å²	56.1	10%	0.104	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119	173.6	-53.1	0	0	0	0	109.5	V22 I23 Q25 T44 A85 N87	V22-T42 WeakPolarHBondContact CA-O 3.39Å; I23-T42 PolarHBondContact N-O 2.9Å; I23-T42 PolarHBondContact O-N 3.04Å; Q25-T42 PolarHBondContact NE2-OG1 3.32Å; T42-T44 PolarHBondContact O-N 3.21Å; T42-A85 HydrophobicContact CG2-CB 4.28Å; T42-N87 WeakPolarHBondContact CB-OD1 3.28Å; T42-N87 WeakPolarHBondContact CG2-OD1 3.42Å; T42-N87 PolarHBondContact OG1-OD1 3.06Å
43	L	91.2	Very high	89.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	116.3	160.5	-58.3	171.8	0	0	0	107.1	V22 Y41 I47 P49 P77 A85 V86 R88 Y109	V22-L43 HydrophobicContact CG1-CD2 4.46Å; V22-L43 HydrophobicContact CG2-CD2 3.82Å; Y41-L43 HydrophobicContact CD2-CD2 4.24Å; Y41-L43 HydrophobicContact CD2-CG 4.48Å; Y41-L43 HydrophobicContact CE2-CD2 4.06Å; Y41-L43 HydrophobicContact CE2-CG 4.35Å; L43-I47 HydrophobicContact CB-CG2 4.24Å; L43-I47 HydrophobicContact CD2-CG2 4.38Å; L43-P49 HydrophobicContact CD1-CB 3.83Å; L43-P49 HydrophobicContact CD1-CG 3.98Å; L43-P77 HydrophobicContact CD1-CG 4.31Å; L43-A85 CarbonylContact O-C 3.3Å; L43-A85 VanDerWaalsContact O-CA 3.23Å; L43-A85 WeakPolarHBondContact O-CA 3.36Å; L43-V86 PolarHBondContact N-O 3.29Å; L43-V86 PolarHBondContact O-N 2.97Å; L43-R88 HydrophobicContact CD1-CG 3.85Å; L43-R88 HydrophobicContact CG-CG 4.24Å; L43-Y109 HydrophobicContact CD2-CE1 4.44Å; L43-Y109 HydrophobicContact CD2-CE2 3.77Å
44	T	89.3	Confident	90.3	Very high	17 Å²	17	51.4 Å²	51.4	10%	0.104	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-79.5	168.5	179	69.5	0	0	0	0	111.5	H21 I23 T42 F46 I47	H21-T44 WeakPolarHBondContact CA-OG1 3.48Å; H21-T44 VanDerWaalsContact O-CB 3.31Å; H21-T44 WeakPolarHBondContact O-CB 3.33Å; H21-T44 VanDerWaalsContact O-CG2 3.29Å; H21-T44 WeakPolarHBondContact O-CG2 3.36Å; H21-T44 PolarHBondContact O-N 2.7Å; H21-T44 PolarHBondContact O-OG1 2.65Å; I23-T44 HydrophobicContact CD1-CG2 3.92Å; I23-T44 HydrophobicContact CG1-CG2 4.08Å; T42-T44 PolarHBondContact O-N 3.21Å; T44-F46 PolarHBondContact O-N 2.71Å; T44-F46 PolarHBondContact OG1-N 2.79Å; T44-I47 PolarHBondContact O-N 2.87Å
45	Q	84.9	Confident	91	Very high	113 Å²	113	45 Å²	45	53%	0.528	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-12.9	171.5	66.4	-174.4	24.2	0	0	114.9	G83	Q45-G83 WeakPolarHBondContact CB-O 3.26Å
46	F	84.6	Confident	91.4	Very high	97 Å²	97	43.3 Å²	43.3	43%	0.425	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	0.3	-177	-52.3	-68.6	0	0	0	114.2	D15 H21 T44	D15-F46 HydrophobicContact CB-CE2 4.32Å; D15-F46 WeakPolarHBondContact O-CE2 3.29Å; H21-F46 HydrophobicContact CB-CB 4.3Å; H21-F46 PolarHBondContact CE1-O 2.71Å; H21-F46 PolarHBondContact ND1-O 2.98Å; T44-F46 PolarHBondContact O-N 2.71Å; T44-F46 PolarHBondContact OG1-N 2.79Å
47	I	87.3	Confident	91.7	Very high	13 Å²	13	40.4 Å²	40.4	7%	0.067	20%	0.197	C	C	.	.			trans	-126.8	133.9	175.2	-172.8	168.1	0	0	0	111.8	H21 V22 L43 T44 Y80 Y109 T111 R117	H21-I47 HydrophobicContact CB-CB 3.93Å; H21-I47 HydrophobicContact CB-CG2 4.24Å; H21-I47 VanDerWaalsContact O-CG2 3.3Å; H21-I47 WeakPolarHBondContact O-CG2 3.27Å; V22-I47 HydrophobicContact CG2-CD1 3.86Å; V22-I47 HydrophobicContact CG2-CG2 3.98Å; L43-I47 HydrophobicContact CB-CG2 4.24Å; L43-I47 HydrophobicContact CD2-CG2 4.38Å; T44-I47 PolarHBondContact O-N 2.87Å; I47-Y80 PolarHBondContact O-OH 2.8Å; I47-Y109 HydrophobicContact CD1-CD1 4.13Å; I47-Y109 HydrophobicContact CD1-CE1 3.71Å; I47-T111 HydrophobicContact CD1-CG2 4.06Å; I47-R117 HydrophobicContact CD1-CB 3.91Å; I47-R117 HydrophobicContact CD1-CG 4.14Å
48	K	87.6	Confident	91.9	Very high	121 Å²	121	40.1 Å²	40.1	53%	0.526	20%	0.195	S	C	.	.			trans	-93.8	109.6	167.8	-169.8	178.3	-153.5	146	0	108.5	Y80 E82	K48-Y80 HydrophobicContact CG-CE1 4.28Å; K48-E82 VanDerWaalsContact CD-OE1 3.29Å; K48-E82 WeakPolarHBondContact CD-OE1 3.32Å; K48-E82 VanDerWaalsContact CE-OE1 3.25Å; K48-E82 WeakPolarHBondContact CE-OE1 3.36Å; K48-E82 WeakPolarHBondContact CE-OE2 3.48Å; K48-E82 IonicContact NZ-OE1 2.69Å; K48-E82 PolarHBondContact NZ-OE1 3.35Å; K48-E82 IonicContact NZ-OE2 3.98Å; K48-E82 PolarHBondContact NZ-OE2 2.67Å
49	P	89.6	Confident	92	Very high	10 Å²	10	40.2 Å²	40.2	7%	0.065	19%	0.192	C	C	.	.			trans	-71	152.1	-179.2	31.4	-35.9	0	0	0	111.3	L43 D53 L76 Y80	L43-P49 HydrophobicContact CD1-CB 3.83Å; L43-P49 HydrophobicContact CD1-CG 3.98Å; P49-D53 WeakPolarHBondContact CA-OD2 3.42Å; P49-L76 HydrophobicContact CB-CD1 4.01Å; P49-L76 HydrophobicContact CG-CD1 3.96Å; P49-L76 WeakPolarHBondContact O-CD1 3.32Å; P49-Y80 HydrophobicContact CG-CD1 4.33Å; P49-Y80 HydrophobicContact CG-CD2 3.81Å; P49-Y80 HydrophobicContact CG-CE1 4.36Å; P49-Y80 HydrophobicContact CG-CE2 3.84Å; P49-Y80 HydrophobicContact CG-CG 4.07Å
50	H	89.8	Confident	92	Very high	69 Å²	69	43.1 Å²	43.1	32%	0.319	21%	0.209	S	C	.	.			trans	-139.3	148	-177.4	174.6	-93.4	0	0	0	111.1	K52 D53 H112	H50-K52 PolarHBondContact ND1-N 2.75Å; H50-K52 PolarHBondContact O-N 2.89Å; H50-D53 PolarHBondContact N-OD2 3.14Å; H50-D53 WeakPolarHBondContact O-CB 3.36Å; H50-D53 PolarHBondContact O-N 2.81Å; H50-H112 WeakPolarHBondContact CB-ND1 3.4Å; H50-H112 AromaticContact CE1-CG 3.88Å; H50-H112 AromaticContact CG-CG 3.85Å; H50-H112 AromaticContact CG-ND1 3.56Å; H50-H112 VanDerWaalsContact ND1-CB 3.32Å; H50-H112 WeakPolarHBondContact ND1-CB 3.11Å; H50-H112 AromaticContact ND1-CG 3.38Å; H50-H112 AromaticContact ND1-ND1 3.55Å
51	P	89.6	Confident	91.7	Very high	79 Å²	79	43.7 Å²	43.7	51%	0.513	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	2.4	-178.1	-26.9	36	0	0	0	117.7	L76	P51-L76 HydrophobicContact CG-CB 4.46Å; P51-L76 HydrophobicContact CG-CD2 3.96Å
52	K	92.8	Very high	91.7	Very high	135 Å²	135	47.2 Å²	47.2	59%	0.587	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.7	16.5	174.2	-58.4	-175.4	-178.7	-179.3	0	112.4	H50 W73 H112	H50-K52 PolarHBondContact ND1-N 2.75Å; H50-K52 PolarHBondContact O-N 2.89Å; K52-W73 HydrophobicContact CB-CZ3 4.07Å; K52-W73 WeakPolarHBondContact O-CZ3 3.44Å; K52-H112 HydrophobicContact CB-CB 3.75Å; K52-H112 WeakPolarHBondContact O-CA 3.38Å; K52-H112 PolarHBondContact O-N 3.42Å
53	D	95.1	Very high	91.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.			trans	-83.1	152.2	164.2	-55.9	-15.8	0	0	0	108.2	P49 H50 S74 Y109 V110 T111 H112	P49-D53 WeakPolarHBondContact CA-OD2 3.42Å; H50-D53 PolarHBondContact N-OD2 3.14Å; H50-D53 WeakPolarHBondContact O-CB 3.36Å; H50-D53 PolarHBondContact O-N 2.81Å; D53-S74 WeakPolarHBondContact O-CB 3.48Å; D53-S74 PolarHBondContact O-N 2.95Å; D53-Y109 HydrophobicContact CB-CE1 3.81Å; D53-Y109 VanDerWaalsContact CB-OH 3.27Å; D53-Y109 WeakPolarHBondContact CB-OH 3.24Å; D53-V110 CarbonylContact C-O 3.59Å; D53-V110 VanDerWaalsContact CA-O 3.28Å; D53-V110 WeakPolarHBondContact CA-O 3.16Å; D53-T111 VanDerWaalsContact OD1-CA 3.27Å; D53-T111 WeakPolarHBondContact OD1-CA 3.45Å; D53-H112 IonicContact OD1-CG 3.59Å; D53-H112 PolarHBondContact OD1-N 2.99Å; D53-H112 IonicContact OD1-ND1 2.91Å; D53-H112 PolarHBondContact OD1-ND1 2.87Å
54	W	95.9	Very high	91.4	Very high	30 Å²	30	54.3 Å²	54.3	11%	0.114	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	155.8	-171.7	53.8	-85.1	0	0	0	112.7	F58 A65 Y68 F71 L72 W73 V110	W54-F58 HydrophobicContact CH2-CE2 4.35Å; W54-F58 AromaticContact CH2-CZ 3.79Å; W54-F58 HydrophobicContact CH2-CZ 3.79Å; W54-F58 AromaticContact CZ3-CE2 3.95Å; W54-F58 HydrophobicContact CZ3-CE2 3.95Å; W54-F58 AromaticContact CZ3-CZ 3.86Å; W54-F58 HydrophobicContact CZ3-CZ 3.86Å; W54-A65 VanDerWaalsContact CH2-O 3.28Å; W54-A65 WeakPolarHBondContact CH2-O 3.43Å; W54-Y68 AromaticContact CH2-CD1 3.62Å; W54-Y68 HydrophobicContact CH2-CD1 3.62Å; W54-Y68 HydrophobicContact CH2-CE1 4.28Å; W54-Y68 HydrophobicContact CH2-CG 4.22Å; W54-Y68 HydrophobicContact CZ3-CD1 4.08Å; W54-Y68 HydrophobicContact CZ3-CG 4.24Å; W54-F71 HydrophobicContact CB-CD2 4.13Å; W54-F71 HydrophobicContact CD2-CB 4.4Å; W54-F71 HydrophobicContact CD2-CD2 4.18Å; W54-F71 HydrophobicContact CE3-CB 3.52Å; W54-F71 HydrophobicContact CE3-CD2 4.12Å; W54-F71 HydrophobicContact CE3-CG 4.12Å; W54-F71 HydrophobicContact CG-CD2 4.24Å; W54-F71 HydrophobicContact CZ3-CB 3.75Å; W54-F71 HydrophobicContact CZ3-CG 4.42Å; W54-L72 CarbonylContact C-O 3.57Å; W54-L72 WeakPolarHBondContact CA-O 3.21Å; W54-L72 WeakPolarHBondContact CB-O 3.4Å; W54-W73 HydrophobicContact CB-CE3 3.95Å; W54-W73 HydrophobicContact CB-CZ3 4.38Å; W54-W73 AromaticContact CD1-CZ3 3.8Å; W54-W73 HydrophobicContact CG-CE3 4.41Å; W54-W73 HydrophobicContact CG-CZ3 4.35Å; W54-V110 HydrophobicContact CD2-CB 3.79Å; W54-V110 HydrophobicContact CD2-CG2 3.96Å; W54-V110 HydrophobicContact CE3-CB 4.18Å; W54-V110 HydrophobicContact CE3-CG2 3.82Å; W54-V110 HydrophobicContact CG-CB 4.31Å; W54-V110 HydrophobicContact CH2-CB 4.22Å; W54-V110 HydrophobicContact CH2-CG1 4.47Å; W54-V110 HydrophobicContact CH2-CG2 3.66Å; W54-V110 HydrophobicContact CZ2-CB 3.77Å; W54-V110 HydrophobicContact CZ2-CG1 3.77Å; W54-V110 HydrophobicContact CZ2-CG2 3.75Å; W54-V110 HydrophobicContact CZ3-CB 4.4Å; W54-V110 HydrophobicContact CZ3-CG2 3.69Å; W54-V110 PolarHBondContact N-O 3.15Å; W54-V110 PolarHBondContact O-N 2.95Å
55	V	96.4	Very high	91.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.8	171.5	-180	0	0	0	0	108.2	F24 Y41 F71 L72 V90 F92 F107 C108 Y109	F24-V55 HydrophobicContact CE1-CG1 3.83Å; F24-V55 HydrophobicContact CE1-CG2 4.33Å; F24-V55 HydrophobicContact CZ-CG1 4.05Å; Y41-V55 HydrophobicContact CD1-CG2 4.19Å; Y41-V55 HydrophobicContact CE1-CG2 3.75Å; Y41-V55 HydrophobicContact CE2-CG2 4.44Å; V55-F71 CarbonylContact O-C 3.59Å; V55-F71 VanDerWaalsContact O-CA 3.29Å; V55-F71 WeakPolarHBondContact O-CA 3.41Å; V55-L72 PolarHBondContact N-O 3.43Å; V55-L72 PolarHBondContact O-N 3.13Å; V55-V90 HydrophobicContact CB-CG2 4.13Å; V55-V90 HydrophobicContact CG1-CG2 4.45Å; V55-V90 HydrophobicContact CG2-CG2 4.36Å; V55-F92 HydrophobicContact CB-CZ 4.38Å; V55-F92 HydrophobicContact CG1-CE2 4.19Å; V55-F92 HydrophobicContact CG1-CZ 4.04Å; V55-F107 HydrophobicContact CG1-CB 4.18Å; V55-F107 HydrophobicContact CG1-CD1 4.28Å; V55-C108 WeakPolarHBondContact CA-O 3.23Å; V55-Y109 HydrophobicContact CG2-CD2 3.71Å; V55-Y109 HydrophobicContact CG2-CE2 4.23Å
56	G	95.8	Very high	91.7	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	148.2	171	0	0	0	0	0	111.7	T70 F107 C108	G56-T70 CarbonylContact C-O 3.5Å; G56-T70 VanDerWaalsContact CA-O 3.27Å; G56-T70 WeakPolarHBondContact CA-O 3.27Å; G56-F107 CarbonylContact O-C 3.58Å; G56-F107 WeakPolarHBondContact O-CA 3.12Å; G56-C108 PolarHBondContact N-O 3.31Å; G56-C108 PolarHBondContact O-N 2.96Å
57	I	96.1	Very high	92.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	121.2	157.8	-61	179.7	0	0	0	106.3	L37 Y69 T70 F92 V97 Y105 F107 F125	L37-I57 HydrophobicContact CD2-CD1 4.04Å; I57-Y69 WeakPolarHBondContact O-CB 3.4Å; I57-Y69 PolarHBondContact O-N 2.81Å; I57-T70 HydrophobicContact CB-CG2 3.97Å; I57-T70 HydrophobicContact CD1-CG2 3.8Å; I57-T70 HydrophobicContact CG1-CG2 4Å; I57-T70 PolarHBondContact N-O 3.47Å; I57-F92 HydrophobicContact CD1-CB 4.27Å; I57-F92 HydrophobicContact CD1-CD1 3.88Å; I57-F92 HydrophobicContact CD1-CD2 4.06Å; I57-F92 HydrophobicContact CD1-CE1 4.2Å; I57-F92 HydrophobicContact CD1-CE2 4.36Å; I57-F92 HydrophobicContact CD1-CG 3.81Å; I57-F92 HydrophobicContact CD1-CZ 4.43Å; I57-F92 HydrophobicContact CG1-CD1 4.19Å; I57-F92 HydrophobicContact CG1-CD2 4.32Å; I57-F92 HydrophobicContact CG1-CE1 3.98Å; I57-F92 HydrophobicContact CG1-CE2 4.11Å; I57-F92 HydrophobicContact CG1-CG 4.36Å; I57-F92 HydrophobicContact CG1-CZ 3.94Å; I57-V97 HydrophobicContact CD1-CG1 4.13Å; I57-Y105 HydrophobicContact CG2-CD1 3.8Å; I57-Y105 HydrophobicContact CG2-CG 4.17Å; I57-F107 HydrophobicContact CD1-CE1 4.12Å; I57-F107 HydrophobicContact CG1-CD1 3.84Å; I57-F107 HydrophobicContact CG1-CE1 3.81Å; I57-F125 HydrophobicContact CD1-CZ 4.43Å
58	F	96	Very high	92.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.9	179	-71.5	-103.7	0	0	0	109.9	W54 W62 D67 Y105 Q106 C108 V110	W54-F58 HydrophobicContact CH2-CE2 4.35Å; W54-F58 AromaticContact CH2-CZ 3.79Å; W54-F58 HydrophobicContact CH2-CZ 3.79Å; W54-F58 AromaticContact CZ3-CE2 3.95Å; W54-F58 HydrophobicContact CZ3-CE2 3.95Å; W54-F58 AromaticContact CZ3-CZ 3.86Å; W54-F58 HydrophobicContact CZ3-CZ 3.86Å; F58-W62 HydrophobicContact CB-CB 4.33Å; F58-W62 VanDerWaalsContact CB-CD1 3.48Å; F58-W62 HydrophobicContact CB-CG 3.98Å; F58-W62 HydrophobicContact CD1-CB 3.89Å; F58-W62 HydrophobicContact CD1-CD2 4.35Å; F58-W62 AromaticContact CD1-CG 3.87Å; F58-W62 HydrophobicContact CD1-CG 3.87Å; F58-W62 HydrophobicContact CG-CG 4.24Å; F58-D67 WeakPolarHBondContact CD1-O 3.25Å; F58-Y105 CarbonylContact O-C 3.58Å; F58-Y105 VanDerWaalsContact O-CA 3.29Å; F58-Y105 WeakPolarHBondContact O-CA 3.49Å; F58-Q106 PolarHBondContact N-O 3.31Å; F58-Q106 PolarHBondContact O-N 2.84Å; F58-C108 HydrophobicContact CD2-CB 3.58Å; F58-C108 HydrophobicContact CE2-CB 3.66Å; F58-C108 HydrophobicContact CG-CB 4.45Å; F58-V110 HydrophobicContact CE2-CG2 4.16Å; F58-V110 HydrophobicContact CZ-CG2 4.11Å
59	K	95	Very high	92.7	Very high	88 Å²	88	62 Å²	62	38%	0.383	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	136.6	167	-177.7	174.1	177.3	170.6	0	109.2	G61 W62 E103 Y105	K59-G61 PolarHBondContact O-N 2.63Å; K59-W62 VanDerWaalsContact O-CD1 3.31Å; K59-W62 PolarHBondContact O-N 2.85Å; K59-E103 WeakPolarHBondContact CE-OE1 3.45Å; K59-E103 WeakPolarHBondContact CE-OE2 3.29Å; K59-E103 IonicContact NZ-OE1 3.25Å; K59-E103 PolarHBondContact NZ-OE1 2.87Å; K59-E103 IonicContact NZ-OE2 2.97Å; K59-E103 PolarHBondContact NZ-OE2 2.68Å; K59-E103 VanDerWaalsContact NZ-OE2 3.16Å; K59-Y105 HydrophobicContact CB-CD1 4.19Å; K59-Y105 HydrophobicContact CB-CE1 3.93Å
60	V	93.5	Very high	92.9	Very high	61 Å²	61	62.3 Å²	62.3	37%	0.37	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	133.6	178	174.7	0	0	0	0	109.8	F104 Q106 P122	V60-F104 HydrophobicContact CB-CB 4.16Å; V60-F104 HydrophobicContact CG2-CB 3.75Å; V60-F104 WeakPolarHBondContact CG2-O 3.43Å; V60-F104 PolarHBondContact N-O 3.16Å; V60-Q106 HydrophobicContact CG2-CG 4.16Å; V60-P122 HydrophobicContact CG2-CB 3.94Å; V60-P122 HydrophobicContact CG2-CG 3.97Å
61	G	88.8	Confident	93.2	Very high	66 Å²	66	62 Å²	62	68%	0.68	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	9	-171.6	0	0	0	0	0	115	K59	K59-G61 PolarHBondContact O-N 2.63Å
62	W	93.3	Very high	93.5	Very high	76 Å²	76	60.6 Å²	60.6	29%	0.288	30%	0.304	S	S	.	.			trans	-51.3	145.7	166.3	60.2	-96.1	0	0	0	111.9	F58 K59 D67 I116	F58-W62 HydrophobicContact CB-CB 4.33Å; F58-W62 VanDerWaalsContact CB-CD1 3.48Å; F58-W62 HydrophobicContact CB-CG 3.98Å; F58-W62 HydrophobicContact CD1-CB 3.89Å; F58-W62 HydrophobicContact CD1-CD2 4.35Å; F58-W62 AromaticContact CD1-CG 3.87Å; F58-W62 HydrophobicContact CD1-CG 3.87Å; F58-W62 HydrophobicContact CG-CG 4.24Å; K59-W62 VanDerWaalsContact O-CD1 3.31Å; K59-W62 PolarHBondContact O-N 2.85Å; W62-D67 HydrophobicContact CB-CB 4Å; W62-I116 HydrophobicContact CE3-CD1 4.01Å; W62-I116 HydrophobicContact CH2-CD1 3.38Å; W62-I116 HydrophobicContact CH2-CG2 4.32Å; W62-I116 HydrophobicContact CZ2-CD1 4.13Å; W62-I116 HydrophobicContact CZ3-CD1 3.31Å
63	S	87.3	Confident	93.6	Very high	103 Å²	103	60.9 Å²	60.9	72%	0.72	30%	0.301	S	S	*	.			trans	-112.2	-26.3	-178.7	-66	0	0	0	0	113	D67	S63-D67 WeakPolarHBondContact CA-OD2 3.43Å; S63-D67 PolarHBondContact N-OD2 3.05Å
64	T	90.6	Very high	93.6	Very high	63 Å²	63	61 Å²	61	39%	0.387	30%	0.302	S	S	.	.	S	Bend	trans	-139.2	160.2	-179.9	87.4	0	0	0	0	112.3	R66 D67	T64-R66 PolarHBondContact O-N 2.91Å; T64-R66 WeakPolarHBondContact OG1-CB 3.44Å; T64-R66 PolarHBondContact OG1-N 2.89Å; T64-D67 PolarHBondContact N-OD2 2.96Å; T64-D67 WeakPolarHBondContact O-CB 3.29Å; T64-D67 VanDerWaalsContact O-CG 3.26Å; T64-D67 PolarHBondContact O-N 3.4Å; T64-D67 PolarHBondContact OG1-OD1 2.84Å
65	A	90	Very high	93.2	Very high	24 Å²	24	62.7 Å²	62.7	20%	0.198	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	7.3	171.3	0	0	0	0	0	114.5	W54 V110 I116	W54-A65 VanDerWaalsContact CH2-O 3.28Å; W54-A65 WeakPolarHBondContact CH2-O 3.43Å; A65-V110 HydrophobicContact CB-CG1 3.86Å; A65-I116 HydrophobicContact CB-CD1 4.18Å; A65-I116 HydrophobicContact CB-CG1 4.34Å
66	R	90.6	Very high	92.7	Very high	216 Å²	216	66.5 Å²	66.5	82%	0.815	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-12.4	170.3	-54.6	-179.5	-175.8	175.6	2.7	112.6	T64 Y68	T64-R66 PolarHBondContact O-N 2.91Å; T64-R66 WeakPolarHBondContact OG1-CB 3.44Å; T64-R66 PolarHBondContact OG1-N 2.89Å; R66-Y68 PolarHBondContact O-N 3.3Å; R66-Y68 VanDerWaalsContact O-N 3.12Å
67	D	93.1	Very high	92	Very high	68 Å²	68	67 Å²	67	36%	0.364	34%	0.34	S	S	.	.			trans	-88.9	29.7	-169.8	-44.1	-8.1	0	0	0	111.4	F58 W62 S63 T64	F58-D67 WeakPolarHBondContact CD1-O 3.25Å; W62-D67 HydrophobicContact CB-CB 4Å; S63-D67 WeakPolarHBondContact CA-OD2 3.43Å; S63-D67 PolarHBondContact N-OD2 3.05Å; T64-D67 PolarHBondContact N-OD2 2.96Å; T64-D67 WeakPolarHBondContact O-CB 3.29Å; T64-D67 VanDerWaalsContact O-CG 3.26Å; T64-D67 PolarHBondContact O-N 3.4Å; T64-D67 PolarHBondContact OG1-OD1 2.84Å
68	Y	93.7	Very high	91.1	Very high	101 Å²	101	76 Å²	76	40%	0.396	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	144.9	179.5	64.5	-97.5	0	0	0	110.6	W54 R66 F71	W54-Y68 AromaticContact CH2-CD1 3.62Å; W54-Y68 HydrophobicContact CH2-CD1 3.62Å; W54-Y68 HydrophobicContact CH2-CE1 4.28Å; W54-Y68 HydrophobicContact CH2-CG 4.22Å; W54-Y68 HydrophobicContact CZ3-CD1 4.08Å; W54-Y68 HydrophobicContact CZ3-CG 4.24Å; R66-Y68 PolarHBondContact O-N 3.3Å; R66-Y68 VanDerWaalsContact O-N 3.12Å; Y68-F71 HydrophobicContact CD2-CB 4.36Å; Y68-F71 HydrophobicContact CD2-CD1 4Å; Y68-F71 AromaticContact CE2-CD1 3.53Å; Y68-F71 HydrophobicContact CE2-CD1 3.53Å; Y68-F71 HydrophobicContact CE2-CE1 4.09Å; Y68-F71 HydrophobicContact CE2-CG 4.47Å; Y68-F71 AromaticContact CZ-CD1 3.85Å
69	Y	93.2	Very high	90	Very high	113 Å²	113	83.1 Å²	83.1	44%	0.443	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-49.2	169.5	-172.9	-82.4	0	0	0	110.4	I57 P98 Y105	I57-Y69 WeakPolarHBondContact O-CB 3.4Å; I57-Y69 PolarHBondContact O-N 2.81Å; Y69-P98 HydrophobicContact CD1-CG 3.82Å; Y69-P98 HydrophobicContact CD2-CG 4.1Å; Y69-P98 HydrophobicContact CE1-CB 4.37Å; Y69-P98 HydrophobicContact CE1-CG 3.81Å; Y69-P98 HydrophobicContact CE2-CB 4.31Å; Y69-P98 HydrophobicContact CE2-CG 4.07Å; Y69-P98 HydrophobicContact CG-CG 3.98Å; Y69-Y105 AromaticContact CD2-CE1 3.91Å; Y69-Y105 HydrophobicContact CD2-CE1 3.91Å; Y69-Y105 HydrophobicContact CG-CE1 4.22Å
70	T	94.2	Very high	89.3	Confident	16 Å²	16	81.2 Å²	81.2	10%	0.098	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	162.7	174.2	-171.7	0	0	0	0	109.8	G56 I57 F92 Y96	G56-T70 CarbonylContact C-O 3.5Å; G56-T70 VanDerWaalsContact CA-O 3.27Å; G56-T70 WeakPolarHBondContact CA-O 3.27Å; I57-T70 HydrophobicContact CB-CG2 3.97Å; I57-T70 HydrophobicContact CD1-CG2 3.8Å; I57-T70 HydrophobicContact CG1-CG2 4Å; I57-T70 PolarHBondContact N-O 3.47Å; T70-F92 HydrophobicContact CG2-CD1 3.7Å; T70-F92 HydrophobicContact CG2-CE1 3.88Å; T70-Y96 WeakPolarHBondContact CB-O 3.49Å; T70-Y96 WeakPolarHBondContact CG2-O 3.4Å
71	F	95.9	Very high	88.6	Confident	64 Å²	64	82.6 Å²	82.6	28%	0.281	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	156.9	177.6	80.5	-76.1	0	0	0	113.2	W54 V55 Y68 W73	W54-F71 HydrophobicContact CB-CD2 4.13Å; W54-F71 HydrophobicContact CD2-CB 4.4Å; W54-F71 HydrophobicContact CD2-CD2 4.18Å; W54-F71 HydrophobicContact CE3-CB 3.52Å; W54-F71 HydrophobicContact CE3-CD2 4.12Å; W54-F71 HydrophobicContact CE3-CG 4.12Å; W54-F71 HydrophobicContact CG-CD2 4.24Å; W54-F71 HydrophobicContact CZ3-CB 3.75Å; W54-F71 HydrophobicContact CZ3-CG 4.42Å; V55-F71 CarbonylContact O-C 3.59Å; V55-F71 VanDerWaalsContact O-CA 3.29Å; V55-F71 WeakPolarHBondContact O-CA 3.41Å; Y68-F71 HydrophobicContact CD2-CB 4.36Å; Y68-F71 HydrophobicContact CD2-CD1 4Å; Y68-F71 AromaticContact CE2-CD1 3.53Å; Y68-F71 HydrophobicContact CE2-CD1 3.53Å; Y68-F71 HydrophobicContact CE2-CE1 4.09Å; Y68-F71 HydrophobicContact CE2-CG 4.47Å; Y68-F71 AromaticContact CZ-CD1 3.85Å; F71-W73 HydrophobicContact CE2-CD2 4.29Å; F71-W73 AromaticContact CE2-CE2 3.83Å; F71-W73 HydrophobicContact CE2-CH2 4.39Å; F71-W73 AromaticContact CE2-CZ2 3.91Å; F71-W73 HydrophobicContact CE2-CZ2 3.91Å; F71-W73 HydrophobicContact CZ-CZ2 4.44Å
72	L	96.3	Very high	88.1	Confident	48 Å²	48	85.5 Å²	85.5	25%	0.251	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	140.1	170.2	-67.5	173.5	0	0	0	109.8	W54 V55 V90 I91 F92	W54-L72 CarbonylContact C-O 3.57Å; W54-L72 WeakPolarHBondContact CA-O 3.21Å; W54-L72 WeakPolarHBondContact CB-O 3.4Å; V55-L72 PolarHBondContact N-O 3.43Å; V55-L72 PolarHBondContact O-N 3.13Å; L72-V90 HydrophobicContact CB-CB 4.37Å; L72-V90 HydrophobicContact CD1-CB 4.09Å; L72-V90 HydrophobicContact CD1-CG2 4.38Å; L72-I91 WeakPolarHBondContact CD1-O 3.44Å; L72-F92 HydrophobicContact CB-CE1 4.25Å; L72-F92 HydrophobicContact CB-CZ 4.44Å; L72-F92 HydrophobicContact CD1-CD1 3.73Å; L72-F92 HydrophobicContact CD1-CD2 4.32Å; L72-F92 HydrophobicContact CD1-CE1 3.91Å; L72-F92 HydrophobicContact CD1-CE2 4.48Å; L72-F92 HydrophobicContact CD1-CG 3.95Å; L72-F92 HydrophobicContact CD1-CZ 4.28Å; L72-F92 HydrophobicContact CG-CD1 3.93Å; L72-F92 HydrophobicContact CG-CE1 3.76Å; L72-F92 HydrophobicContact CG-CZ 4.34Å
73	W	95.8	Very high	87.2	Confident	142 Å²	142	83.7 Å²	83.7	54%	0.538	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	137.7	173.8	-61.4	107.8	0	0	0	110.9	K52 W54 F71 P75	K52-W73 HydrophobicContact CB-CZ3 4.07Å; K52-W73 WeakPolarHBondContact O-CZ3 3.44Å; W54-W73 HydrophobicContact CB-CE3 3.95Å; W54-W73 HydrophobicContact CB-CZ3 4.38Å; W54-W73 AromaticContact CD1-CZ3 3.8Å; W54-W73 HydrophobicContact CG-CE3 4.41Å; W54-W73 HydrophobicContact CG-CZ3 4.35Å; F71-W73 HydrophobicContact CE2-CD2 4.29Å; F71-W73 AromaticContact CE2-CE2 3.83Å; F71-W73 HydrophobicContact CE2-CH2 4.39Å; F71-W73 AromaticContact CE2-CZ2 3.91Å; F71-W73 HydrophobicContact CE2-CZ2 3.91Å; F71-W73 HydrophobicContact CZ-CZ2 4.44Å; W73-P75 VanDerWaalsContact O-CD 3.26Å; W73-P75 WeakPolarHBondContact O-CD 3.36Å
74	S	93.1	Very high	86.9	Confident	3 Å²	3	81.6 Å²	81.6	2%	0.021	40%	0.403	C	S	.	.			trans	-72.8	114.2	175.7	170.1	0	0	0	0	109	Y41 D53 L76 Y109	Y41-S74 PolarHBondContact OH-OG 3.03Å; D53-S74 WeakPolarHBondContact O-CB 3.48Å; D53-S74 PolarHBondContact O-N 2.95Å; S74-L76 PolarHBondContact O-N 3.22Å; S74-L76 VanDerWaalsContact O-N 3.16Å; S74-Y109 WeakPolarHBondContact CB-OH 3.29Å; S74-Y109 WeakPolarHBondContact OG-CE2 3.5Å; S74-Y109 PolarHBondContact OG-OH 3.33Å
75	P	89.6	Confident	86.6	Confident	65 Å²	65	81.9 Å²	81.9	42%	0.422	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-65.1	118.9	-178.9	-20.7	34.1	0	0	0	110.7	W73 V90	W73-P75 VanDerWaalsContact O-CD 3.26Å; W73-P75 WeakPolarHBondContact O-CD 3.36Å; P75-V90 HydrophobicContact CG-CG1 4.23Å
76	L	84.9	Confident	86.6	Confident	80 Å²	80	81.9 Å²	81.9	42%	0.419	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-62.1	129.8	177.2	-172.6	74	0	0	0	109.3	P49 P51 S74 E78	P49-L76 HydrophobicContact CB-CD1 4.01Å; P49-L76 HydrophobicContact CG-CD1 3.96Å; P49-L76 WeakPolarHBondContact O-CD1 3.32Å; P51-L76 HydrophobicContact CG-CB 4.46Å; P51-L76 HydrophobicContact CG-CD2 3.96Å; S74-L76 PolarHBondContact O-N 3.22Å; S74-L76 VanDerWaalsContact O-N 3.16Å; L76-E78 PolarHBondContact O-N 2.8Å
77	P	82.1	Confident	86.6	Confident	10 Å²	10	76.1 Å²	76.1	7%	0.065	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-67.8	123.5	174.9	-12.3	25.8	0	0	0	110.8	L43 N79 Y80 V86	L43-P77 HydrophobicContact CD1-CG 4.31Å; P77-N79 PolarHBondContact O-N 2.89Å; P77-N79 VanDerWaalsContact O-N 3.15Å; P77-Y80 HydrophobicContact CG-CD2 4.28Å; P77-Y80 WeakPolarHBondContact O-CB 3.41Å; P77-Y80 PolarHBondContact O-N 2.9Å; P77-Y80 VanDerWaalsContact O-N 3.14Å; P77-V86 HydrophobicContact CB-CG1 4.3Å; P77-V86 HydrophobicContact CG-CG1 3.97Å
78	E	76.9	Confident	86.5	Confident	190 Å²	190	76.6 Å²	76.6	89%	0.888	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.2	-177.1	-60.8	178.3	153.2	0	0	113.3	L76	L76-E78 PolarHBondContact O-N 2.8Å
79	N	73	Confident	86.4	Confident	148 Å²	148	75 Å²	75	79%	0.791	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	42.9	177.8	-63.7	-64	0	0	0	111.8	P77 V81	P77-N79 PolarHBondContact O-N 2.89Å; P77-N79 VanDerWaalsContact O-N 3.15Å; N79-V81 PolarHBondContact O-N 2.85Å
80	Y	79.3	Confident	86.4	Confident	48 Å²	48	70 Å²	70	19%	0.188	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-66.8	122.9	178.8	178.2	-100.7	0	0	0	112.3	I47 K48 P49 P77 E82 V86	I47-Y80 PolarHBondContact O-OH 2.8Å; K48-Y80 HydrophobicContact CG-CE1 4.28Å; P49-Y80 HydrophobicContact CG-CD1 4.33Å; P49-Y80 HydrophobicContact CG-CD2 3.81Å; P49-Y80 HydrophobicContact CG-CE1 4.36Å; P49-Y80 HydrophobicContact CG-CE2 3.84Å; P49-Y80 HydrophobicContact CG-CG 4.07Å; P77-Y80 HydrophobicContact CG-CD2 4.28Å; P77-Y80 WeakPolarHBondContact O-CB 3.41Å; P77-Y80 PolarHBondContact O-N 2.9Å; P77-Y80 VanDerWaalsContact O-N 3.14Å; Y80-E82 HydrophobicContact CE1-CB 4.09Å; Y80-V86 HydrophobicContact CD2-CG2 4.2Å; Y80-V86 HydrophobicContact CE2-CG2 4.45Å
81	V	79.4	Confident	86.4	Confident	91 Å²	91	73.1 Å²	73.1	55%	0.552	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-103.6	125.1	170.5	-179.9	0	0	0	0	109.1	N79 G83 T84	N79-V81 PolarHBondContact O-N 2.85Å; V81-G83 PolarHBondContact O-N 3.06Å; V81-T84 HydrophobicContact CB-CG2 3.82Å; V81-T84 HydrophobicContact CG1-CG2 3.94Å; V81-T84 WeakPolarHBondContact O-CB 3.5Å; V81-T84 PolarHBondContact O-N 3.2Å; V81-T84 PolarHBondContact O-OG1 2.87Å
82	E	76.9	Confident	86.4	Confident	126 Å²	126	70.1 Å²	70.1	59%	0.589	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	130.6	-177	-171	157.1	-152.2	0	0	111.7	K48 Y80	K48-E82 VanDerWaalsContact CD-OE1 3.29Å; K48-E82 WeakPolarHBondContact CD-OE1 3.32Å; K48-E82 VanDerWaalsContact CE-OE1 3.25Å; K48-E82 WeakPolarHBondContact CE-OE1 3.36Å; K48-E82 WeakPolarHBondContact CE-OE2 3.48Å; K48-E82 IonicContact NZ-OE1 2.69Å; K48-E82 PolarHBondContact NZ-OE1 3.35Å; K48-E82 IonicContact NZ-OE2 3.98Å; K48-E82 PolarHBondContact NZ-OE2 2.67Å; Y80-E82 HydrophobicContact CE1-CB 4.09Å
83	G	74.6	Confident	86.1	Confident	39 Å²	39	71.8 Å²	71.8	40%	0.402	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-0.9	-172.6	0	0	0	0	0	115.4	Q45 V81	Q45-G83 WeakPolarHBondContact CB-O 3.26Å; V81-G83 PolarHBondContact O-N 3.06Å
84	T	82	Confident	85.6	Confident	59 Å²	59	65.6 Å²	65.6	36%	0.362	36%	0.362	S	S	.	.			trans	-90.1	144.3	170.8	64.4	0	0	0	0	111.9	V81	V81-T84 HydrophobicContact CB-CG2 3.82Å; V81-T84 HydrophobicContact CG1-CG2 3.94Å; V81-T84 WeakPolarHBondContact O-CB 3.5Å; V81-T84 PolarHBondContact O-N 3.2Å; V81-T84 PolarHBondContact O-OG1 2.87Å
85	A	85.1	Confident	85.4	Confident	68 Å²	68	73.4 Å²	73.4	56%	0.562	39%	0.392	S	S	*	.			trans	-84.6	131.2	172.4	0	0	0	0	0	110.3	T42 L43	T42-A85 HydrophobicContact CG2-CB 4.28Å; L43-A85 CarbonylContact O-C 3.3Å; L43-A85 VanDerWaalsContact O-CA 3.23Å; L43-A85 WeakPolarHBondContact O-CA 3.36Å
86	V	88.8	Confident	85.3	Confident	24 Å²	24	75.8 Å²	75.8	15%	0.145	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	119.6	-171.1	-178.8	0	0	0	0	111.1	L43 P77 Y80	L43-V86 PolarHBondContact N-O 3.29Å; L43-V86 PolarHBondContact O-N 2.97Å; P77-V86 HydrophobicContact CB-CG1 4.3Å; P77-V86 HydrophobicContact CG-CG1 3.97Å; Y80-V86 HydrophobicContact CD2-CG2 4.2Å; Y80-V86 HydrophobicContact CE2-CG2 4.45Å
87	N	90.4	Very high	85.5	Confident	96 Å²	96	72.3 Å²	72.3	51%	0.513	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	139.6	171	-67.9	-11.7	0	0	0	110.9	Y41 T42	Y41-N87 CarbonylContact O-C 3.59Å; Y41-N87 WeakPolarHBondContact O-CA 3.35Å; T42-N87 WeakPolarHBondContact CB-OD1 3.28Å; T42-N87 WeakPolarHBondContact CG2-OD1 3.42Å; T42-N87 PolarHBondContact OG1-OD1 3.06Å
88	R	91.2	Very high	85.9	Confident	78 Å²	78	71.8 Å²	71.8	29%	0.294	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158.6	177.1	-67.8	-66.8	88.9	170	2.9	109.1	Y41 L43	Y41-R88 HydrophobicContact CD1-CB 4.47Å; Y41-R88 HydrophobicContact CD2-CB 3.99Å; Y41-R88 HydrophobicContact CE1-CB 3.98Å; Y41-R88 HydrophobicContact CE2-CB 3.46Å; Y41-R88 VanDerWaalsContact CE2-CB 3.46Å; Y41-R88 HydrophobicContact CE2-CG 3.95Å; Y41-R88 HydrophobicContact CG-CB 4.47Å; Y41-R88 VanDerWaalsContact CZ-CB 3.44Å; Y41-R88 PolarHBondContact N-O 2.89Å; Y41-R88 PolarHBondContact O-N 2.85Å; Y41-R88 VanDerWaalsContact O-O 3.09Å; L43-R88 HydrophobicContact CD1-CG 3.85Å; L43-R88 HydrophobicContact CG-CG 4.24Å
89	T	92.3	Very high	86.4	Confident	66 Å²	66	66.6 Å²	66.6	41%	0.405	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142	173.9	-49.4	0	0	0	0	108.7	D38 C39 N40 I91	D38-T89 HydrophobicContact CB-CG2 4.41Å; C39-T89 CarbonylContact O-C 3.56Å; C39-T89 VanDerWaalsContact O-CA 3.32Å; C39-T89 WeakPolarHBondContact O-CA 3.4Å; N40-T89 WeakPolarHBondContact OD1-CB 3.14Å; N40-T89 VanDerWaalsContact OD1-CG2 3.23Å; N40-T89 WeakPolarHBondContact OD1-CG2 3.36Å; N40-T89 PolarHBondContact OD1-OG1 3.41Å; T89-I91 HydrophobicContact CG2-CG1 4.49Å
90	V	93.6	Very high	87	Confident	9 Å²	9	64.1 Å²	64.1	6%	0.055	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139	163.5	-63.5	0	0	0	0	109.4	C39 Y41 V55 L72 P75 F92	C39-V90 HydrophobicContact CB-CG2 3.81Å; C39-V90 WeakPolarHBondContact CB-O 3.47Å; C39-V90 PolarHBondContact N-O 2.89Å; C39-V90 PolarHBondContact O-N 2.86Å; Y41-V90 HydrophobicContact CE1-CG1 4.09Å; Y41-V90 HydrophobicContact CE1-CG2 4.12Å; V55-V90 HydrophobicContact CB-CG2 4.13Å; V55-V90 HydrophobicContact CG1-CG2 4.45Å; V55-V90 HydrophobicContact CG2-CG2 4.36Å; L72-V90 HydrophobicContact CB-CB 4.37Å; L72-V90 HydrophobicContact CD1-CB 4.09Å; L72-V90 HydrophobicContact CD1-CG2 4.38Å; P75-V90 HydrophobicContact CG-CG1 4.23Å; V90-F92 HydrophobicContact CG2-CD2 4.38Å; V90-F92 HydrophobicContact CG2-CE2 3.74Å; V90-F92 HydrophobicContact CG2-CZ 4.23Å
91	I	94.1	Very high	87.4	Confident	82 Å²	82	65.3 Å²	65.3	42%	0.421	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	104.5	-174.3	-52.7	-175.7	0	0	0	108.6	A36 D38 L72 T89 Q93	A36-I91 HydrophobicContact CB-CG2 4.12Å; D38-I91 WeakPolarHBondContact OD1-CG1 3.3Å; D38-I91 WeakPolarHBondContact OD1-CG2 3.15Å; L72-I91 WeakPolarHBondContact CD1-O 3.44Å; T89-I91 HydrophobicContact CG2-CG1 4.49Å; I91-Q93 PolarHBondContact O-N 2.81Å
92	F	94.2	Very high	87.6	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	117	172.3	-68.1	-87.3	0	0	0	108.7	A36 L37 C39 V55 I57 T70 L72 V90 V97 F107	A36-F92 CarbonylContact C-O 3.56Å; A36-F92 WeakPolarHBondContact CA-O 3.29Å; L37-F92 HydrophobicContact CB-CB 4.22Å; L37-F92 PolarHBondContact N-O 2.88Å; L37-F92 PolarHBondContact O-N 2.87Å; C39-F92 HydrophobicContact CB-CD2 3.96Å; C39-F92 HydrophobicContact CB-CE2 3.72Å; V55-F92 HydrophobicContact CB-CZ 4.38Å; V55-F92 HydrophobicContact CG1-CE2 4.19Å; V55-F92 HydrophobicContact CG1-CZ 4.04Å; I57-F92 HydrophobicContact CD1-CB 4.27Å; I57-F92 HydrophobicContact CD1-CD1 3.88Å; I57-F92 HydrophobicContact CD1-CD2 4.06Å; I57-F92 HydrophobicContact CD1-CE1 4.2Å; I57-F92 HydrophobicContact CD1-CE2 4.36Å; I57-F92 HydrophobicContact CD1-CG 3.81Å; I57-F92 HydrophobicContact CD1-CZ 4.43Å; I57-F92 HydrophobicContact CG1-CD1 4.19Å; I57-F92 HydrophobicContact CG1-CD2 4.32Å; I57-F92 HydrophobicContact CG1-CE1 3.98Å; I57-F92 HydrophobicContact CG1-CE2 4.11Å; I57-F92 HydrophobicContact CG1-CG 4.36Å; I57-F92 HydrophobicContact CG1-CZ 3.94Å; T70-F92 HydrophobicContact CG2-CD1 3.7Å; T70-F92 HydrophobicContact CG2-CE1 3.88Å; L72-F92 HydrophobicContact CB-CE1 4.25Å; L72-F92 HydrophobicContact CB-CZ 4.44Å; L72-F92 HydrophobicContact CD1-CD1 3.73Å; L72-F92 HydrophobicContact CD1-CD2 4.32Å; L72-F92 HydrophobicContact CD1-CE1 3.91Å; L72-F92 HydrophobicContact CD1-CE2 4.48Å; L72-F92 HydrophobicContact CD1-CG 3.95Å; L72-F92 HydrophobicContact CD1-CZ 4.28Å; L72-F92 HydrophobicContact CG-CD1 3.93Å; L72-F92 HydrophobicContact CG-CE1 3.76Å; L72-F92 HydrophobicContact CG-CZ 4.34Å; V90-F92 HydrophobicContact CG2-CD2 4.38Å; V90-F92 HydrophobicContact CG2-CE2 3.74Å; V90-F92 HydrophobicContact CG2-CZ 4.23Å; F92-V97 HydrophobicContact CB-CG1 3.79Å; F92-F107 AromaticContact CD2-CE1 3.91Å; F92-F107 HydrophobicContact CD2-CE1 3.91Å; F92-F107 AromaticContact CE2-CD1 3.96Å; F92-F107 HydrophobicContact CE2-CD1 3.96Å; F92-F107 AromaticContact CE2-CE1 3.69Å; F92-F107 HydrophobicContact CE2-CE1 3.69Å
93	Q	92	Very high	88.4	Confident	84 Å²	84	60.4 Å²	60.4	39%	0.393	33%	0.328	S	S	.	.			trans	-68.9	147.7	179.1	-63.8	-62.3	-35.9	0	0	110.9	I91 Y95 Y96	I91-Q93 PolarHBondContact O-N 2.81Å; Q93-Y95 HydrophobicContact CB-CD1 4.03Å; Q93-Y95 HydrophobicContact CB-CE1 3.51Å; Q93-Y95 HydrophobicContact CB-CE2 4.38Å; Q93-Y95 HydrophobicContact CG-CE1 4.19Å; Q93-Y95 PolarHBondContact O-N 2.85Å; Q93-Y96 HydrophobicContact CB-CD2 4.08Å; Q93-Y96 WeakPolarHBondContact O-CB 3.39Å; Q93-Y96 PolarHBondContact O-N 2.83Å
94	G	85.2	Confident	89.2	Confident	11 Å²	11	63.2 Å²	63.2	11%	0.113	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.3	-170.8	0	0	0	0	0	116.1	H34 A35 Y96 V97	H34-G94 WeakPolarHBondContact CA-O 3.5Å; H34-G94 WeakPolarHBondContact O-CA 3.45Å; A35-G94 WeakPolarHBondContact O-CA 3.25Å; G94-Y96 VanDerWaalsContact C-N 3.31Å; G94-V97 WeakPolarHBondContact O-CG2 3.41Å
95	Y	87.4	Confident	89.9	Confident	167 Å²	167	60.8 Å²	60.8	66%	0.655	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	3.3	174.7	56.8	-92.5	0	0	0	114	Q93	Q93-Y95 HydrophobicContact CB-CD1 4.03Å; Q93-Y95 HydrophobicContact CB-CE1 3.51Å; Q93-Y95 HydrophobicContact CB-CE2 4.38Å; Q93-Y95 HydrophobicContact CG-CE1 4.19Å; Q93-Y95 PolarHBondContact O-N 2.85Å
96	Y	87.8	Confident	90.3	Very high	115 Å²	115	58.8 Å²	58.8	45%	0.451	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-11.4	173.4	-68.8	-44.9	0	0	0	113.7	T70 Q93 G94	T70-Y96 WeakPolarHBondContact CB-O 3.49Å; T70-Y96 WeakPolarHBondContact CG2-O 3.4Å; Q93-Y96 HydrophobicContact CB-CD2 4.08Å; Q93-Y96 WeakPolarHBondContact O-CB 3.39Å; Q93-Y96 PolarHBondContact O-N 2.83Å; G94-Y96 VanDerWaalsContact C-N 3.31Å
97	V	89.7	Confident	90.7	Very high	7 Å²	7	57.7 Å²	57.7	4%	0.042	29%	0.286	C	S	.	.	S	Bend	trans	-86.5	154.5	177.4	-58.8	0	0	0	0	111.3	L37 I57 F92 G94 F125	L37-V97 HydrophobicContact CB-CG1 4.04Å; L37-V97 HydrophobicContact CD2-CG1 4.11Å; I57-V97 HydrophobicContact CD1-CG1 4.13Å; F92-V97 HydrophobicContact CB-CG1 3.79Å; G94-V97 WeakPolarHBondContact O-CG2 3.41Å; V97-F125 HydrophobicContact CB-CD1 4.25Å; V97-F125 HydrophobicContact CB-CE1 3.58Å; V97-F125 HydrophobicContact CB-CZ 3.87Å; V97-F125 HydrophobicContact CG1-CE1 4.05Å; V97-F125 HydrophobicContact CG1-CZ 4.25Å; V97-F125 HydrophobicContact CG2-CD1 4.18Å; V97-F125 HydrophobicContact CG2-CE1 3.89Å
98	P	89.4	Confident	91	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.262	C	S	.	.			trans	-55	157.6	171.2	-25.1	31.3	0	0	0	114.9	Y69 Y105 F125	Y69-P98 HydrophobicContact CD1-CG 3.82Å; Y69-P98 HydrophobicContact CD2-CG 4.1Å; Y69-P98 HydrophobicContact CE1-CB 4.37Å; Y69-P98 HydrophobicContact CE1-CG 3.81Å; Y69-P98 HydrophobicContact CE2-CB 4.31Å; Y69-P98 HydrophobicContact CE2-CG 4.07Å; Y69-P98 HydrophobicContact CG-CG 3.98Å; P98-Y105 HydrophobicContact CB-CD2 4.13Å; P98-Y105 HydrophobicContact CB-CE1 4.24Å; P98-Y105 HydrophobicContact CB-CE2 3.51Å; P98-Y105 HydrophobicContact CG-CD1 3.81Å; P98-Y105 HydrophobicContact CG-CD2 3.88Å; P98-Y105 HydrophobicContact CG-CE1 3.5Å; P98-Y105 HydrophobicContact CG-CE2 3.57Å; P98-Y105 HydrophobicContact CG-CG 3.99Å; P98-F125 HydrophobicContact CB-CD2 3.66Å; P98-F125 HydrophobicContact CB-CE2 4.03Å; P98-F125 HydrophobicContact CB-CG 4.24Å; P98-F125 VanDerWaalsContact CD-CE2 3.49Å; P98-F125 HydrophobicContact CG-CD2 3.84Å; P98-F125 HydrophobicContact CG-CE2 3.67Å; P98-F125 HydrophobicContact CG-CZ 4.44Å
99	N	87.6	Confident	91.2	Very high	80 Å²	80	49.4 Å²	49.4	43%	0.428	25%	0.248	S	C	.	.			trans	-82.1	178.7	170.4	-70.6	-34.8	0	0	0	111	H34 D101	H34-N99 PolarHBondContact CE1-OD1 2.72Å; H34-N99 PolarHBondContact NE2-OD1 2.9Å; N99-D101 PolarHBondContact O-N 2.82Å
100	D	86.6	Confident	91.3	Very high	96 Å²	96	46.3 Å²	46.3	51%	0.513	23%	0.229	S	C	.	.	S	Bend	trans	-72.1	80.4	164.1	-156.1	-24.5	0	0	0	109.7	P33 F125 R126	P33-D100 HydrophobicContact CG-CB 3.93Å; D100-F125 VanDerWaalsContact CA-O 3.24Å; D100-F125 WeakPolarHBondContact CA-O 3.41Å; D100-F125 WeakPolarHBondContact CB-O 3.22Å; D100-F125 VanDerWaalsContact CG-O 3.29Å; D100-R126 VanDerWaalsContact OD2-CA 3.23Å; D100-R126 WeakPolarHBondContact OD2-CA 3.41Å; D100-R126 VanDerWaalsContact OD2-CB 3.23Å; D100-R126 WeakPolarHBondContact OD2-CB 3.1Å
101	D	87	Confident	91.3	Very high	74 Å²	74	46.4 Å²	46.4	40%	0.396	23%	0.229	S	C	.	.			trans	-100.7	0.4	176.3	61.6	10.8	0	0	0	112.3	N99 E103 Y105	N99-D101 PolarHBondContact O-N 2.82Å; D101-E103 HydrophobicContact CB-CG 4.47Å; D101-E103 PolarHBondContact O-N 3.47Å; D101-E103 VanDerWaalsContact OD1-CB 3.29Å; D101-E103 WeakPolarHBondContact OD1-CB 3.29Å; D101-E103 PolarHBondContact OD1-N 3.3Å; D101-Y105 PolarHBondContact OD2-OH 2.86Å
102	G	84.3	Confident	91.2	Very high	38 Å²	38	46.7 Å²	46.7	39%	0.392	23%	0.229	S	C	.	.	S	Bend	trans	73.3	-2.4	-175.3	0	0	0	0	0	115.1	Q124	G102-Q124 PolarHBondContact O-NE2 2.87Å
103	E	92.4	Very high	91.1	Very high	76 Å²	76	53.5 Å²	53.5	36%	0.355	26%	0.258	S	S	.	.			trans	-82.3	153.8	-174	-63.3	-73.4	-165.3	0	0	112.3	K59 D101 Y105	K59-E103 WeakPolarHBondContact CE-OE1 3.45Å; K59-E103 WeakPolarHBondContact CE-OE2 3.29Å; K59-E103 IonicContact NZ-OE1 3.25Å; K59-E103 PolarHBondContact NZ-OE1 2.87Å; K59-E103 IonicContact NZ-OE2 2.97Å; K59-E103 PolarHBondContact NZ-OE2 2.68Å; K59-E103 VanDerWaalsContact NZ-OE2 3.16Å; D101-E103 HydrophobicContact CB-CG 4.47Å; D101-E103 PolarHBondContact O-N 3.47Å; D101-E103 VanDerWaalsContact OD1-CB 3.29Å; D101-E103 WeakPolarHBondContact OD1-CB 3.29Å; D101-E103 PolarHBondContact OD1-N 3.3Å; E103-Y105 HydrophobicContact CB-CD2 4.48Å; E103-Y105 HydrophobicContact CB-CE2 3.78Å
104	F	92.9	Very high	90.9	Very high	98 Å²	98	51.6 Å²	51.6	43%	0.43	26%	0.261	S	S	.	.			trans	-91.9	132	174.8	-73.7	-89.5	0	0	0	110.9	V60 P122 Q124	V60-F104 HydrophobicContact CB-CB 4.16Å; V60-F104 HydrophobicContact CG2-CB 3.75Å; V60-F104 WeakPolarHBondContact CG2-O 3.43Å; V60-F104 PolarHBondContact N-O 3.16Å; F104-P122 HydrophobicContact CB-CB 4.32Å; F104-P122 HydrophobicContact CD1-CB 3.99Å; F104-Q124 HydrophobicContact CD1-CG 3.69Å; F104-Q124 HydrophobicContact CD2-CG 4.4Å; F104-Q124 HydrophobicContact CE1-CG 3.55Å; F104-Q124 HydrophobicContact CE2-CG 4.28Å; F104-Q124 HydrophobicContact CG-CG 4.13Å; F104-Q124 HydrophobicContact CZ-CG 3.87Å
105	Y	95.6	Very high	91.1	Very high	8 Å²	8	54.3 Å²	54.3	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	156.1	178.4	-68.6	-85.5	0	0	0	111	I57 F58 K59 Y69 P98 D101 E103 P122 F123 F125	I57-Y105 HydrophobicContact CG2-CD1 3.8Å; I57-Y105 HydrophobicContact CG2-CG 4.17Å; F58-Y105 CarbonylContact O-C 3.58Å; F58-Y105 VanDerWaalsContact O-CA 3.29Å; F58-Y105 WeakPolarHBondContact O-CA 3.49Å; K59-Y105 HydrophobicContact CB-CD1 4.19Å; K59-Y105 HydrophobicContact CB-CE1 3.93Å; Y69-Y105 AromaticContact CD2-CE1 3.91Å; Y69-Y105 HydrophobicContact CD2-CE1 3.91Å; Y69-Y105 HydrophobicContact CG-CE1 4.22Å; P98-Y105 HydrophobicContact CB-CD2 4.13Å; P98-Y105 HydrophobicContact CB-CE1 4.24Å; P98-Y105 HydrophobicContact CB-CE2 3.51Å; P98-Y105 HydrophobicContact CG-CD1 3.81Å; P98-Y105 HydrophobicContact CG-CD2 3.88Å; P98-Y105 HydrophobicContact CG-CE1 3.5Å; P98-Y105 HydrophobicContact CG-CE2 3.57Å; P98-Y105 HydrophobicContact CG-CG 3.99Å; D101-Y105 PolarHBondContact OD2-OH 2.86Å; E103-Y105 HydrophobicContact CB-CD2 4.48Å; E103-Y105 HydrophobicContact CB-CE2 3.78Å; Y105-P122 CarbonylContact O-C 3.38Å; Y105-P122 VanDerWaalsContact O-CA 3.29Å; Y105-P122 WeakPolarHBondContact O-CA 3.02Å; Y105-F123 PolarHBondContact N-O 2.9Å; Y105-F123 WeakPolarHBondContact O-CD1 3.49Å; Y105-F123 PolarHBondContact O-N 3.31Å; Y105-F125 AromaticContact CD2-CD2 3.9Å; Y105-F125 HydrophobicContact CD2-CD2 3.9Å; Y105-F125 HydrophobicContact CD2-CE2 4.07Å; Y105-F125 HydrophobicContact CE2-CD2 4.42Å; Y105-F125 HydrophobicContact CG-CD2 4.49Å; Y105-F125 HydrophobicContact CG-CE2 4.2Å
106	Q	94.9	Very high	91.4	Very high	25 Å²	25	47.5 Å²	47.5	12%	0.117	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	146.2	175.1	53.4	175.5	87.9	0	0	110.2	F58 V60 C108 S120	F58-Q106 PolarHBondContact N-O 3.31Å; F58-Q106 PolarHBondContact O-N 2.84Å; V60-Q106 HydrophobicContact CG2-CG 4.16Å; Q106-C108 PolarHBondContact NE2-SG 3.18Å; Q106-S120 WeakPolarHBondContact CA-OG 3.29Å
107	F	96.6	Very high	91.6	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.009	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	139.2	167.2	-56.6	-65.7	0	0	0	109.6	F24 L37 C39 V55 G56 I57 F92 A119 S120 F123	F24-F107 HydrophobicContact CD1-CB 3.71Å; F24-F107 HydrophobicContact CD1-CD2 4.09Å; F24-F107 HydrophobicContact CD1-CG 4.16Å; F24-F107 HydrophobicContact CD2-CB 4.19Å; F24-F107 HydrophobicContact CE1-CB 3.45Å; F24-F107 VanDerWaalsContact CE1-CB 3.45Å; F24-F107 HydrophobicContact CE1-CG 4.17Å; F24-F107 HydrophobicContact CE2-CB 3.93Å; F24-F107 WeakPolarHBondContact CE2-O 3.28Å; F24-F107 HydrophobicContact CG-CB 4.09Å; F24-F107 HydrophobicContact CG-CD2 4.49Å; F24-F107 HydrophobicContact CZ-CB 3.56Å; L37-F107 HydrophobicContact CD1-CZ 4.04Å; L37-F107 HydrophobicContact CD2-CE1 3.99Å; L37-F107 HydrophobicContact CD2-CZ 3.75Å; L37-F107 HydrophobicContact CG-CE1 4.34Å; L37-F107 HydrophobicContact CG-CZ 3.87Å; C39-F107 HydrophobicContact CB-CD1 4.09Å; C39-F107 HydrophobicContact CB-CE1 3.63Å; C39-F107 HydrophobicContact CB-CE2 4.12Å; C39-F107 HydrophobicContact CB-CZ 3.63Å; C39-F107 WeakPolarHBondContact SG-CD1 3.23Å; C39-F107 VanDerWaalsContact SG-CD2 3.55Å; C39-F107 VanDerWaalsContact SG-CE1 3.58Å; C39-F107 WeakPolarHBondContact SG-CG 3.23Å; V55-F107 HydrophobicContact CG1-CB 4.18Å; V55-F107 HydrophobicContact CG1-CD1 4.28Å; G56-F107 CarbonylContact O-C 3.58Å; G56-F107 WeakPolarHBondContact O-CA 3.12Å; I57-F107 HydrophobicContact CD1-CE1 4.12Å; I57-F107 HydrophobicContact CG1-CD1 3.84Å; I57-F107 HydrophobicContact CG1-CE1 3.81Å; F92-F107 AromaticContact CD2-CE1 3.91Å; F92-F107 HydrophobicContact CD2-CE1 3.91Å; F92-F107 AromaticContact CE2-CD1 3.96Å; F92-F107 HydrophobicContact CE2-CD1 3.96Å; F92-F107 AromaticContact CE2-CE1 3.69Å; F92-F107 HydrophobicContact CE2-CE1 3.69Å; F107-A119 CarbonylContact O-C 3.59Å; F107-A119 WeakPolarHBondContact O-CA 3.29Å; F107-S120 PolarHBondContact N-OG 2.93Å; F107-S120 PolarHBondContact O-N 3.42Å; F107-F123 HydrophobicContact CD1-CE1 4.47Å; F107-F123 HydrophobicContact CD1-CZ 4.1Å; F107-F123 AromaticContact CD2-CE1 3.57Å; F107-F123 HydrophobicContact CD2-CE1 3.57Å; F107-F123 AromaticContact CD2-CZ 3.97Å; F107-F123 HydrophobicContact CD2-CZ 3.97Å; F107-F123 HydrophobicContact CE1-CE1 4.48Å; F107-F123 AromaticContact CE1-CZ 3.9Å; F107-F123 HydrophobicContact CE1-CZ 3.9Å; F107-F123 AromaticContact CE2-CE1 3.59Å; F107-F123 HydrophobicContact CE2-CE1 3.59Å; F107-F123 AromaticContact CE2-CZ 3.77Å; F107-F123 HydrophobicContact CE2-CZ 3.77Å; F107-F123 HydrophobicContact CG-CE1 4.04Å; F107-F123 HydrophobicContact CG-CZ 4.13Å; F107-F123 HydrophobicContact CZ-CE1 4.07Å; F107-F123 AromaticContact CZ-CZ 3.75Å; F107-F123 HydrophobicContact CZ-CZ 3.75Å
108	C	95.6	Very high	91.7	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135	168.6	-55.2	0	0	0	0	110.3	V55 G56 F58 Q106 I116 G118	V55-C108 WeakPolarHBondContact CA-O 3.23Å; G56-C108 PolarHBondContact N-O 3.31Å; G56-C108 PolarHBondContact O-N 2.96Å; F58-C108 HydrophobicContact CD2-CB 3.58Å; F58-C108 HydrophobicContact CE2-CB 3.66Å; F58-C108 HydrophobicContact CG-CB 4.45Å; Q106-C108 PolarHBondContact NE2-SG 3.18Å; C108-I116 HydrophobicContact CB-CG2 4.16Å; C108-G118 CarbonylContact C-O 3.6Å; C108-G118 VanDerWaalsContact CA-O 3.29Å; C108-G118 WeakPolarHBondContact CA-O 3.31Å
109	Y	95.5	Very high	91.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120.3	175.2	-167.6	-82.8	0	0	0	109.7	V22 Y41 L43 I47 D53 V55 S74 I116 R117 G118	V22-Y109 HydrophobicContact CB-CD1 4.37Å; V22-Y109 HydrophobicContact CB-CD2 4.29Å; V22-Y109 HydrophobicContact CB-CG 3.93Å; V22-Y109 HydrophobicContact CG1-CD2 3.77Å; V22-Y109 HydrophobicContact CG1-CE2 4.49Å; V22-Y109 HydrophobicContact CG1-CG 3.9Å; V22-Y109 HydrophobicContact CG2-CD1 3.65Å; V22-Y109 HydrophobicContact CG2-CD2 4.04Å; V22-Y109 HydrophobicContact CG2-CE1 4.01Å; V22-Y109 HydrophobicContact CG2-CE2 4.39Å; V22-Y109 HydrophobicContact CG2-CG 3.66Å; Y41-Y109 HydrophobicContact CD2-CD2 4.16Å; Y41-Y109 HydrophobicContact CD2-CE2 4.18Å; Y41-Y109 AromaticContact CE2-CD2 3.97Å; Y41-Y109 HydrophobicContact CE2-CD2 3.97Å; Y41-Y109 AromaticContact CE2-CE2 3.61Å; Y41-Y109 HydrophobicContact CE2-CE2 3.61Å; L43-Y109 HydrophobicContact CD2-CE1 4.44Å; L43-Y109 HydrophobicContact CD2-CE2 3.77Å; I47-Y109 HydrophobicContact CD1-CD1 4.13Å; I47-Y109 HydrophobicContact CD1-CE1 3.71Å; D53-Y109 HydrophobicContact CB-CE1 3.81Å; D53-Y109 VanDerWaalsContact CB-OH 3.27Å; D53-Y109 WeakPolarHBondContact CB-OH 3.24Å; V55-Y109 HydrophobicContact CG2-CD2 3.71Å; V55-Y109 HydrophobicContact CG2-CE2 4.23Å; S74-Y109 WeakPolarHBondContact CB-OH 3.29Å; S74-Y109 WeakPolarHBondContact OG-CE2 3.5Å; S74-Y109 PolarHBondContact OG-OH 3.33Å; Y109-I116 CarbonylContact O-C 3.57Å; Y109-I116 WeakPolarHBondContact O-CA 3.39Å; Y109-R117 HydrophobicContact CD1-CB 4.44Å; Y109-R117 PolarHBondContact O-N 2.98Å; Y109-G118 PolarHBondContact N-O 2.91Å
110	V	94.9	Very high	92.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.5	-176.3	-163.3	0	0	0	0	109.5	D53 W54 F58 A65 I116	D53-V110 CarbonylContact C-O 3.59Å; D53-V110 VanDerWaalsContact CA-O 3.28Å; D53-V110 WeakPolarHBondContact CA-O 3.16Å; W54-V110 HydrophobicContact CD2-CB 3.79Å; W54-V110 HydrophobicContact CD2-CG2 3.96Å; W54-V110 HydrophobicContact CE3-CB 4.18Å; W54-V110 HydrophobicContact CE3-CG2 3.82Å; W54-V110 HydrophobicContact CG-CB 4.31Å; W54-V110 HydrophobicContact CH2-CB 4.22Å; W54-V110 HydrophobicContact CH2-CG1 4.47Å; W54-V110 HydrophobicContact CH2-CG2 3.66Å; W54-V110 HydrophobicContact CZ2-CB 3.77Å; W54-V110 HydrophobicContact CZ2-CG1 3.77Å; W54-V110 HydrophobicContact CZ2-CG2 3.75Å; W54-V110 HydrophobicContact CZ3-CB 4.4Å; W54-V110 HydrophobicContact CZ3-CG2 3.69Å; W54-V110 PolarHBondContact N-O 3.15Å; W54-V110 PolarHBondContact O-N 2.95Å; F58-V110 HydrophobicContact CE2-CG2 4.16Å; F58-V110 HydrophobicContact CZ-CG2 4.11Å; A65-V110 HydrophobicContact CB-CG1 3.86Å; V110-I116 HydrophobicContact CG1-CG1 4.31Å; V110-I116 HydrophobicContact CG2-CG1 4.16Å
111	T	93.3	Very high	92.5	Very high	11 Å²	11	42.9 Å²	42.9	7%	0.067	24%	0.236	C	C	.	.			trans	-81.4	165.2	176.1	59.8	0	0	0	0	112.3	I47 D53 K113 G114 E115 R117	I47-T111 HydrophobicContact CD1-CG2 4.06Å; D53-T111 VanDerWaalsContact OD1-CA 3.27Å; D53-T111 WeakPolarHBondContact OD1-CA 3.45Å; T111-K113 PolarHBondContact O-N 2.67Å; T111-G114 PolarHBondContact O-N 3.03Å; T111-E115 PolarHBondContact N-O 2.8Å; T111-E115 WeakPolarHBondContact OG1-CB 3.16Å; T111-E115 PolarHBondContact OG1-N 3.33Å; T111-E115 PolarHBondContact OG1-O 2.69Å; T111-R117 HydrophobicContact CG2-CB 4.39Å; T111-R117 HydrophobicContact CG2-CG 3.59Å
112	H	92.6	Very high	92.8	Very high	88 Å²	88	42.4 Å²	42.4	41%	0.407	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-12.7	169.7	66	-83.7	0	0	0	115.1	H50 K52 D53	H50-H112 WeakPolarHBondContact CB-ND1 3.4Å; H50-H112 AromaticContact CE1-CG 3.88Å; H50-H112 AromaticContact CG-CG 3.85Å; H50-H112 AromaticContact CG-ND1 3.56Å; H50-H112 VanDerWaalsContact ND1-CB 3.32Å; H50-H112 WeakPolarHBondContact ND1-CB 3.11Å; H50-H112 AromaticContact ND1-CG 3.38Å; H50-H112 AromaticContact ND1-ND1 3.55Å; K52-H112 HydrophobicContact CB-CB 3.75Å; K52-H112 WeakPolarHBondContact O-CA 3.38Å; K52-H112 PolarHBondContact O-N 3.42Å; D53-H112 IonicContact OD1-CG 3.59Å; D53-H112 PolarHBondContact OD1-N 2.99Å; D53-H112 IonicContact OD1-ND1 2.91Å; D53-H112 PolarHBondContact OD1-ND1 2.87Å
113	K	91.1	Very high	93.2	Very high	144 Å²	144	40.6 Å²	40.6	63%	0.626	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-8.2	172.5	-62.5	-178.4	179.9	178.2	0	113.4	T111 E115	T111-K113 PolarHBondContact O-N 2.67Å; K113-E115 VanDerWaalsContact C-N 3.31Å; K113-E115 HydrophobicContact CB-CG 4.01Å; K113-E115 WeakPolarHBondContact CD-OE1 3.49Å; K113-E115 IonicContact NZ-OE1 3.98Å
114	G	87.9	Confident	93.2	Very high	43 Å²	43	38.5 Å²	38.5	44%	0.443	21%	0.209	S	C	.	.	S	Bend	trans	82.4	2.3	-169.3	0	0	0	0	0	114.3	T111	T111-G114 PolarHBondContact O-N 3.03Å
115	E	90.9	Very high	93	Very high	69 Å²	69	33.9 Å²	33.9	32%	0.322	19%	0.188	S	C	.	.			trans	-75.7	130.6	175.8	-54.8	168.3	-160.5	0	0	110.1	T111 K113 R117	T111-E115 PolarHBondContact N-O 2.8Å; T111-E115 WeakPolarHBondContact OG1-CB 3.16Å; T111-E115 PolarHBondContact OG1-N 3.33Å; T111-E115 PolarHBondContact OG1-O 2.69Å; K113-E115 VanDerWaalsContact C-N 3.31Å; K113-E115 HydrophobicContact CB-CG 4.01Å; K113-E115 WeakPolarHBondContact CD-OE1 3.49Å; K113-E115 IonicContact NZ-OE1 3.98Å; E115-R117 IonicContact OE2-CZ 3.72Å; E115-R117 VanDerWaalsContact OE2-CZ 3.25Å; E115-R117 IonicContact OE2-NE 3.75Å; E115-R117 PolarHBondContact OE2-NE 2.8Å; E115-R117 IonicContact OE2-NH2 3.14Å; E115-R117 PolarHBondContact OE2-NH2 3.16Å
116	I	92.3	Very high	92.5	Very high	24 Å²	24	39.1 Å²	39.1	12%	0.123	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	124.5	174.8	-62.6	173.3	0	0	0	108.9	W62 A65 C108 Y109 V110	W62-I116 HydrophobicContact CE3-CD1 4.01Å; W62-I116 HydrophobicContact CH2-CD1 3.38Å; W62-I116 HydrophobicContact CH2-CG2 4.32Å; W62-I116 HydrophobicContact CZ2-CD1 4.13Å; W62-I116 HydrophobicContact CZ3-CD1 3.31Å; A65-I116 HydrophobicContact CB-CD1 4.18Å; A65-I116 HydrophobicContact CB-CG1 4.34Å; C108-I116 HydrophobicContact CB-CG2 4.16Å; Y109-I116 CarbonylContact O-C 3.57Å; Y109-I116 WeakPolarHBondContact O-CA 3.39Å; V110-I116 HydrophobicContact CG1-CG1 4.31Å; V110-I116 HydrophobicContact CG2-CG1 4.16Å
117	R	92.6	Very high	91.6	Very high	47 Å²	47	41.1 Å²	41.1	18%	0.177	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	1.4	-169.1	-66.6	-58.6	-164	148	-3.6	114.5	N18 F19 A20 H21 V22 I47 Y109 T111 E115	N18-R117 WeakPolarHBondContact O-CD 3.24Å; N18-R117 PolarHBondContact O-NH1 3.24Å; N18-R117 VanDerWaalsContact O-NH1 3.13Å; N18-R117 PolarHBondContact OD1-NH1 3.41Å; F19-R117 CarbonylContact C-O 3.55Å; F19-R117 CarbonylContact O-C 3.59Å; F19-R117 VanDerWaalsContact O-C 3.3Å; A20-R117 CarbonylContact C-O 3.59Å; H21-R117 CarbonylContact C-O 3.59Å; H21-R117 HydrophobicContact CB-CB 4.47Å; H21-R117 PolarHBondContact CE1-NH1 2.89Å; H21-R117 VanDerWaalsContact CE1-NH1 3.3Å; H21-R117 PolarHBondContact N-O 3.22Å; H21-R117 PolarHBondContact ND1-NH1 3.46Å; V22-R117 PolarHBondContact N-O 3.43Å; I47-R117 HydrophobicContact CD1-CB 3.91Å; I47-R117 HydrophobicContact CD1-CG 4.14Å; Y109-R117 HydrophobicContact CD1-CB 4.44Å; Y109-R117 PolarHBondContact O-N 2.98Å; T111-R117 HydrophobicContact CG2-CB 4.39Å; T111-R117 HydrophobicContact CG2-CG 3.59Å; E115-R117 IonicContact OE2-CZ 3.72Å; E115-R117 VanDerWaalsContact OE2-CZ 3.25Å; E115-R117 IonicContact OE2-NE 3.75Å; E115-R117 PolarHBondContact OE2-NE 2.8Å; E115-R117 IonicContact OE2-NH2 3.14Å; E115-R117 PolarHBondContact OE2-NH2 3.16Å
118	G	92.1	Very high	89.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	146.7	174.1	0	0	0	0	0	110.6	F19 V22 C108 Y109	F19-G118 VanDerWaalsContact O-CA 3.24Å; F19-G118 WeakPolarHBondContact O-CA 3.47Å; F19-G118 PolarHBondContact O-N 3.05Å; V22-G118 WeakPolarHBondContact O-CA 3.23Å; C108-G118 CarbonylContact C-O 3.6Å; C108-G118 VanDerWaalsContact CA-O 3.29Å; C108-G118 WeakPolarHBondContact CA-O 3.31Å; Y109-G118 PolarHBondContact N-O 2.91Å
119	A	93.6	Very high	87.7	Confident	51 Å²	51	52.4 Å²	52.4	42%	0.421	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.8	173.4	0	0	0	0	0	110.4	F107	F107-A119 CarbonylContact O-C 3.59Å; F107-A119 WeakPolarHBondContact O-CA 3.29Å
120	S	94.4	Very high	85.6	Confident	13 Å²	13	58.8 Å²	58.8	9%	0.091	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-84.9	167.5	177.7	76	0	0	0	0	112.8	Q106 F107	Q106-S120 WeakPolarHBondContact CA-OG 3.29Å; F107-S120 PolarHBondContact N-OG 2.93Å; F107-S120 PolarHBondContact O-N 3.42Å
121	T	92.1	Very high	83.2	Confident	89 Å²	89	63.4 Å²	63.4	55%	0.546	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-58.2	146.8	156.4	47.5	0	0	0	0	110.5
122	P	93.6	Very high	81.3	Confident	64 Å²	64	72.4 Å²	72.4	42%	0.416	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-63.6	149.4	173.2	-26.5	36.7	0	0	0	114.3	V60 F104 Y105	V60-P122 HydrophobicContact CG2-CB 3.94Å; V60-P122 HydrophobicContact CG2-CG 3.97Å; F104-P122 HydrophobicContact CB-CB 4.32Å; F104-P122 HydrophobicContact CD1-CB 3.99Å; Y105-P122 CarbonylContact O-C 3.38Å; Y105-P122 VanDerWaalsContact O-CA 3.29Å; Y105-P122 WeakPolarHBondContact O-CA 3.02Å
123	F	92.9	Very high	79.3	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	42%	0.422	C	S	.	.	B	Isolated β-bridge	trans	-145.1	159.5	176.4	53.3	-98.9	0	0	0	111.4	V27 G28 K29 Y31 L37 Y105 F107 F125	V27-F123 HydrophobicContact CG1-CD1 3.61Å; V27-F123 HydrophobicContact CG1-CE1 4.11Å; G28-F123 VanDerWaalsContact O-CB 3.22Å; G28-F123 WeakPolarHBondContact O-CB 3.32Å; K29-F123 WeakPolarHBondContact O-CA 3.35Å; Y31-F123 HydrophobicContact CD2-CB 4.18Å; Y31-F123 AromaticContact CD2-CD2 3.66Å; Y31-F123 HydrophobicContact CD2-CD2 3.66Å; Y31-F123 HydrophobicContact CD2-CE2 4.15Å; Y31-F123 AromaticContact CD2-CG 3.94Å; Y31-F123 HydrophobicContact CD2-CG 3.94Å; Y31-F123 HydrophobicContact CE2-CB 4.09Å; Y31-F123 HydrophobicContact CE2-CD1 4.07Å; Y31-F123 AromaticContact CE2-CD2 3.89Å; Y31-F123 HydrophobicContact CE2-CD2 3.89Å; Y31-F123 HydrophobicContact CE2-CE1 4.44Å; Y31-F123 HydrophobicContact CE2-CE2 4.28Å; Y31-F123 AromaticContact CE2-CG 3.77Å; Y31-F123 HydrophobicContact CE2-CG 3.77Å; L37-F123 HydrophobicContact CD2-CE2 4.45Å; Y105-F123 PolarHBondContact N-O 2.9Å; Y105-F123 WeakPolarHBondContact O-CD1 3.49Å; Y105-F123 PolarHBondContact O-N 3.31Å; F107-F123 HydrophobicContact CD1-CE1 4.47Å; F107-F123 HydrophobicContact CD1-CZ 4.1Å; F107-F123 AromaticContact CD2-CE1 3.57Å; F107-F123 HydrophobicContact CD2-CE1 3.57Å; F107-F123 AromaticContact CD2-CZ 3.97Å; F107-F123 HydrophobicContact CD2-CZ 3.97Å; F107-F123 HydrophobicContact CE1-CE1 4.48Å; F107-F123 AromaticContact CE1-CZ 3.9Å; F107-F123 HydrophobicContact CE1-CZ 3.9Å; F107-F123 AromaticContact CE2-CE1 3.59Å; F107-F123 HydrophobicContact CE2-CE1 3.59Å; F107-F123 AromaticContact CE2-CZ 3.77Å; F107-F123 HydrophobicContact CE2-CZ 3.77Å; F107-F123 HydrophobicContact CG-CE1 4.04Å; F107-F123 HydrophobicContact CG-CZ 4.13Å; F107-F123 HydrophobicContact CZ-CE1 4.07Å; F107-F123 AromaticContact CZ-CZ 3.75Å; F107-F123 HydrophobicContact CZ-CZ 3.75Å; F123-F125 HydrophobicContact CD2-CE2 4.04Å; F123-F125 HydrophobicContact CD2-CZ 4.32Å; F123-F125 AromaticContact CE2-CE2 3.65Å; F123-F125 HydrophobicContact CE2-CE2 3.65Å; F123-F125 AromaticContact CE2-CZ 3.76Å; F123-F125 HydrophobicContact CE2-CZ 3.76Å
124	Q	91.9	Very high	77.5	Confident	33 Å²	33	74.7 Å²	74.7	15%	0.154	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	155.7	174.3	-63.2	-178.1	-60.7	0	0	111.3	K29 S30 Y31 G102 F104	K29-Q124 PolarHBondContact O-N 3.32Å; S30-Q124 CarbonylContact C-O 3.57Å; S30-Q124 WeakPolarHBondContact CA-O 3.43Å; S30-Q124 WeakPolarHBondContact CB-O 3.46Å; Y31-Q124 PolarHBondContact N-O 2.69Å; G102-Q124 PolarHBondContact O-NE2 2.87Å; F104-Q124 HydrophobicContact CD1-CG 3.69Å; F104-Q124 HydrophobicContact CD2-CG 4.4Å; F104-Q124 HydrophobicContact CE1-CG 3.55Å; F104-Q124 HydrophobicContact CE2-CG 4.28Å; F104-Q124 HydrophobicContact CG-CG 4.13Å; F104-Q124 HydrophobicContact CZ-CG 3.87Å
125	F	89.1	Confident	75.5	Confident	1 Å²	1	78.3 Å²	78.3	0%	0.004	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	112.2	166.6	-70.1	-89.3	0	0	0	108.6	Y31 P33 L37 I57 V97 P98 D100 Y105 F123	Y31-F125 CarbonylContact O-C 3.58Å; Y31-F125 VanDerWaalsContact O-CA 3.29Å; Y31-F125 WeakPolarHBondContact O-CA 3.43Å; P33-F125 HydrophobicContact CG-CB 4.21Å; L37-F125 HydrophobicContact CD2-CE1 3.7Å; L37-F125 HydrophobicContact CD2-CZ 3.52Å; I57-F125 HydrophobicContact CD1-CZ 4.43Å; V97-F125 HydrophobicContact CB-CD1 4.25Å; V97-F125 HydrophobicContact CB-CE1 3.58Å; V97-F125 HydrophobicContact CB-CZ 3.87Å; V97-F125 HydrophobicContact CG1-CE1 4.05Å; V97-F125 HydrophobicContact CG1-CZ 4.25Å; V97-F125 HydrophobicContact CG2-CD1 4.18Å; V97-F125 HydrophobicContact CG2-CE1 3.89Å; P98-F125 HydrophobicContact CB-CD2 3.66Å; P98-F125 HydrophobicContact CB-CE2 4.03Å; P98-F125 HydrophobicContact CB-CG 4.24Å; P98-F125 VanDerWaalsContact CD-CE2 3.49Å; P98-F125 HydrophobicContact CG-CD2 3.84Å; P98-F125 HydrophobicContact CG-CE2 3.67Å; P98-F125 HydrophobicContact CG-CZ 4.44Å; D100-F125 VanDerWaalsContact CA-O 3.24Å; D100-F125 WeakPolarHBondContact CA-O 3.41Å; D100-F125 WeakPolarHBondContact CB-O 3.22Å; D100-F125 VanDerWaalsContact CG-O 3.29Å; Y105-F125 AromaticContact CD2-CD2 3.9Å; Y105-F125 HydrophobicContact CD2-CD2 3.9Å; Y105-F125 HydrophobicContact CD2-CE2 4.07Å; Y105-F125 HydrophobicContact CE2-CD2 4.42Å; Y105-F125 HydrophobicContact CG-CD2 4.49Å; Y105-F125 HydrophobicContact CG-CE2 4.2Å; F123-F125 HydrophobicContact CD2-CE2 4.04Å; F123-F125 HydrophobicContact CD2-CZ 4.32Å; F123-F125 AromaticContact CE2-CE2 3.65Å; F123-F125 HydrophobicContact CE2-CE2 3.65Å; F123-F125 AromaticContact CE2-CZ 3.76Å; F123-F125 HydrophobicContact CE2-CZ 3.76Å
126	R	84.8	Confident	73.7	Confident	118 Å²	118	78.1 Å²	78.1	45%	0.445	44%	0.438	S	S	.	.			trans	-158.9	154.8	179.1	63.7	-179.3	-164.3	172.7	12.4	112.9	Y31 D100	Y31-R126 PolarHBondContact O-N 2.96Å; Y31-R126 VanDerWaalsContact O-O 3.13Å; D100-R126 VanDerWaalsContact OD2-CA 3.23Å; D100-R126 WeakPolarHBondContact OD2-CA 3.41Å; D100-R126 VanDerWaalsContact OD2-CB 3.23Å; D100-R126 WeakPolarHBondContact OD2-CB 3.1Å
127	A	75.9	Confident	71.9	Confident	66 Å²	66	81.5 Å²	81.5	55%	0.545	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-80.1	146.3	172.9	0	0	0	0	0	111.8	S129	A127-S129 PolarHBondContact O-N 3.21Å
128	N	61	Low	70.4	Confident	135 Å²	135	81.3 Å²	81.3	72%	0.722	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-76.9	117.6	175.3	-72.1	2.9	0	0	0	110.5
129	S	49.4	Very low	68.6	Low	105 Å²	105	89 Å²	89	73%	0.734	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-84.4	133.9	169.3	54.9	0	0	0	0	111.3	A127	A127-S129 PolarHBondContact O-N 3.21Å
130	P	51.1	Low	66.7	Low	133 Å²	133	91.1 Å²	91.1	86%	0.864	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-74.4	153.1	172.1	32.1	-34.6	0	0	0	111.8
131	S	45.5	Very low	65	Low	97 Å²	97	99.6 Å²	99.6	68%	0.678	54%	0.543	S	S	*	.			trans	-140.7	127.5	-178	55	0	0	0	0	111.4	D133	S131-D133 WeakPolarHBondContact O-CB 3.47Å; S131-D133 PolarHBondContact O-N 2.79Å
132	E	52	Low	63.1	Low	201 Å²	201	99.8 Å²	99.8	94%	0.939	55%	0.547	S	S	*	.	S	Bend	trans	34	-3.2	158.7	-61.5	-172.6	131.2	0	0	123.1	E134	E132-E134 PolarHBondContact O-N 2.7Å
133	D	50.8	Low	61.3	Low	115 Å²	115	104.7 Å²	104.7	62%	0.615	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	22.8	-163.3	-154.9	65.9	0	0	0	115.4	S131 K152	S131-D133 WeakPolarHBondContact O-CB 3.47Å; S131-D133 PolarHBondContact O-N 2.79Å; D133-K152 PolarHBondContact O-NZ 3.22Å; D133-K152 IonicContact OD2-NZ 2.7Å; D133-K152 PolarHBondContact OD2-NZ 3.06Å
134	E	52.7	Low	59	Low	164 Å²	164	108.1 Å²	108.1	77%	0.766	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-12.9	-169.7	-161.7	161.6	-137.1	0	0	114.6	E132	E132-E134 PolarHBondContact O-N 2.7Å
135	L	47.6	Very low	57.2	Low	119 Å²	119	115.1 Å²	115.1	62%	0.623	63%	0.632	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.9	134.2	170.7	-72.7	170.4	0	0	0	110.2	V149	L135-V149 HydrophobicContact CD2-CG1 4.26Å
136	L	52.4	Low	55.6	Low	65 Å²	65	120.9 Å²	120.9	34%	0.34	66%	0.661	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.5	127	176.8	-65.2	177.2	0	0	0	109.7	K152	L136-K152 HydrophobicContact CD1-CD 4.26Å; L136-K152 HydrophobicContact CD1-CG 3.91Å
137	T	54.3	Low	54.1	Low	96 Å²	96	120.4 Å²	120.4	59%	0.589	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.6	126	164.2	49.8	0	0	0	0	109.1	V149	T137-V149 HydrophobicContact CG2-CG2 4.3Å
138	V	60.7	Low	53.4	Low	43 Å²	43	120.6 Å²	120.6	26%	0.261	66%	0.661	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	130.4	174.2	-171.5	0	0	0	0	108	V148 L155	V138-V148 PolarHBondContact N-O 2.88Å; V138-V148 PolarHBondContact O-N 3.01Å; V138-L155 HydrophobicContact CG1-CD1 4.32Å; V138-L155 HydrophobicContact CG2-CD1 3.94Å; V138-L155 HydrophobicContact CG2-CD2 3.54Å; V138-L155 HydrophobicContact CG2-CG 4.29Å
139	E	54.2	Low	53.3	Low	161 Å²	161	118.7 Å²	118.7	75%	0.752	66%	0.655	S	S	*	*			trans	-82.9	125.5	169.5	-66	175.5	172.5	0	0	107.7	L147	E139-L147 HydrophobicContact CG-CD2 3.93Å
140	D	54.8	Low	54	Low	96 Å²	96	115.8 Å²	115.8	51%	0.513	63%	0.633	S	S	.	*			trans	-77.4	128.8	174.7	-175.7	-7.5	0	0	0	108.7	C142	D140-C142 PolarHBondContact O-N 2.94Å; D140-C142 PolarHBondContact OD1-N 3.3Å
141	E	58.2	Low	54.8	Low	190 Å²	190	113.8 Å²	113.8	89%	0.888	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-8.8	-175.6	-61.1	-171.4	164	0	0	112.7	N143	E141-N143 PolarHBondContact O-N 3.46Å
142	C	52.2	Low	56	Low	93 Å²	93	112.6 Å²	112.6	63%	0.628	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	54.3	175.6	-68.9	0	0	0	0	114.6	D140 S144	D140-C142 PolarHBondContact O-N 2.94Å; D140-C142 PolarHBondContact OD1-N 3.3Å; C142-S144 PolarHBondContact O-N 3.39Å; C142-S144 PolarHBondContact O-OG 3.18Å
143	N	54.6	Low	57.1	Low	168 Å²	168	106.3 Å²	106.3	90%	0.898	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	33	60.6	162.5	-88.7	8.6	0	0	0	115.8	E141	E141-N143 PolarHBondContact O-N 3.46Å
144	S	46.3	Very low	58.2	Low	72 Å²	72	102.3 Å²	102.3	50%	0.503	57%	0.569	S	S	.	*			trans	-133	135.3	180	-64.8	0	0	0	0	110.5	C142 I146	C142-S144 PolarHBondContact O-N 3.39Å; C142-S144 PolarHBondContact O-OG 3.18Å; S144-I146 PolarHBondContact O-N 3Å
145	D	53.7	Low	59.5	Low	180 Å²	180	96 Å²	96	96%	0.963	54%	0.54	S	S	*	.	S	Bend	trans	-72.1	42.1	178.6	-70.5	-42.9	0	0	0	113
146	I	56.2	Low	61.1	Low	121 Å²	121	95.4 Å²	95.4	62%	0.621	54%	0.537	S	S	*	.			trans	-130.7	95.1	-171.6	-55	179.8	0	0	0	109.1	S144 V148	S144-I146 PolarHBondContact O-N 3Å; I146-V148 PolarHBondContact O-N 3.32Å
147	L	52.4	Low	62.6	Low	108 Å²	108	99.3 Å²	99.3	57%	0.565	55%	0.554	S	S	*	*			trans	-72	114.7	171.3	-76.6	141.1	0	0	0	110.1	E139	E139-L147 HydrophobicContact CG-CD2 3.93Å
148	V	61.1	Low	64.1	Low	70 Å²	70	99.8 Å²	99.8	42%	0.424	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.6	178	-169.8	0	0	0	0	109.4	V138 I146 T150	V138-V148 PolarHBondContact N-O 2.88Å; V138-V148 PolarHBondContact O-N 3.01Å; I146-V148 PolarHBondContact O-N 3.32Å; V148-T150 HydrophobicContact CG1-CG2 3.8Å; V148-T150 PolarHBondContact O-N 3.47Å
149	V	59.3	Low	65.3	Low	96 Å²	96	103.7 Å²	103.7	58%	0.582	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.4	104.3	173.9	-176.3	0	0	0	0	108.6	L135 T137	L135-V149 HydrophobicContact CD2-CG1 4.26Å; T137-V149 HydrophobicContact CG2-CG2 4.3Å
150	T	64.1	Low	66.9	Low	44 Å²	44	99.8 Å²	99.8	27%	0.27	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	160	176.9	61.4	0	0	0	0	110.8	V148	V148-T150 HydrophobicContact CG1-CG2 3.8Å; V148-T150 PolarHBondContact O-N 3.47Å
151	T	66.7	Low	68.6	Low	90 Å²	90	100.7 Å²	100.7	55%	0.552	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.2	141.2	170.3	58.8	0	0	0	0	109.6	A153 G154 L155	T151-A153 PolarHBondContact O-N 3.49Å; T151-G154 PolarHBondContact O-N 3.48Å; T151-L155 PolarHBondContact O-N 2.95Å
152	K	71.2	Confident	70.2	Confident	72 Å²	72	94.6 Å²	94.6	31%	0.313	52%	0.523	S	S	.	.	H	α-helix	trans	-51.5	-30.8	179.1	-162.7	168	-166.6	168.9	0	112.7	D133 L136 L156	D133-K152 PolarHBondContact O-NZ 3.22Å; D133-K152 IonicContact OD2-NZ 2.7Å; D133-K152 PolarHBondContact OD2-NZ 3.06Å; L136-K152 HydrophobicContact CD1-CD 4.26Å; L136-K152 HydrophobicContact CD1-CG 3.91Å; K152-L156 WeakPolarHBondContact O-CD1 3.22Å; K152-L156 WeakPolarHBondContact O-CG 3.24Å; K152-L156 PolarHBondContact O-N 3.33Å
153	A	75	Confident	71.9	Confident	69 Å²	69	92.7 Å²	92.7	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-67.5	-50.2	174.9	0	0	0	0	0	113.6	T151 L155 L156 E157	T151-A153 PolarHBondContact O-N 3.49Å; A153-L155 PolarHBondContact O-N 3.46Å; A153-L156 PolarHBondContact O-N 3.1Å; A153-E157 PolarHBondContact O-N 3.28Å
154	G	75.1	Confident	73.6	Confident	32 Å²	32	90 Å²	90	33%	0.33	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-37.2	-176.5	0	0	0	0	0	113.2	T151 L156 E157 Q158	T151-G154 PolarHBondContact O-N 3.48Å; G154-L156 VanDerWaalsContact C-N 3.33Å; G154-L156 PolarHBondContact O-N 2.96Å; G154-E157 PolarHBondContact O-N 3.24Å; G154-Q158 PolarHBondContact O-N 3.09Å
155	L	79.8	Confident	75.9	Confident	31 Å²	31	91.9 Å²	91.9	16%	0.162	49%	0.491	C	S	.	.	H	α-helix	trans	-62.9	-39.6	173.1	-178.7	65.1	0	0	0	112.3	V138 T151 A153 K159	V138-L155 HydrophobicContact CG1-CD1 4.32Å; V138-L155 HydrophobicContact CG2-CD1 3.94Å; V138-L155 HydrophobicContact CG2-CD2 3.54Å; V138-L155 HydrophobicContact CG2-CG 4.29Å; T151-L155 PolarHBondContact O-N 2.95Å; A153-L155 PolarHBondContact O-N 3.46Å; L155-K159 WeakPolarHBondContact O-CG 3.26Å; L155-K159 PolarHBondContact O-N 2.89Å; L155-K159 VanDerWaalsContact O-N 3.1Å
156	L	80.6	Confident	77.8	Confident	106 Å²	106	89.3 Å²	89.3	56%	0.555	47%	0.474	S	S	*	.	H	α-helix	trans	-70.4	-35.4	176.6	-72.5	170.6	0	0	0	111.7	K152 A153 G154 K159 V160	K152-L156 WeakPolarHBondContact O-CD1 3.22Å; K152-L156 WeakPolarHBondContact O-CG 3.24Å; K152-L156 PolarHBondContact O-N 3.33Å; A153-L156 PolarHBondContact O-N 3.1Å; G154-L156 VanDerWaalsContact C-N 3.33Å; G154-L156 PolarHBondContact O-N 2.96Å; L156-K159 PolarHBondContact O-N 3Å; L156-V160 WeakPolarHBondContact O-CB 3.35Å; L156-V160 VanDerWaalsContact O-CG2 3.24Å; L156-V160 WeakPolarHBondContact O-CG2 3.4Å; L156-V160 PolarHBondContact O-N 3.46Å
157	E	83.8	Confident	79.6	Confident	148 Å²	148	89.9 Å²	89.9	69%	0.692	47%	0.471	S	S	*	.	H	α-helix	trans	-64	-48.1	175.2	-169.4	163.1	-145.3	0	0	111.4	A153 G154 K159 V160 E161	A153-E157 PolarHBondContact O-N 3.28Å; G154-E157 PolarHBondContact O-N 3.24Å; E157-K159 PolarHBondContact O-N 3.34Å; E157-V160 PolarHBondContact O-N 3.34Å; E157-E161 PolarHBondContact O-N 3.02Å
158	Q	85.4	Confident	81.5	Confident	106 Å²	106	90 Å²	90	50%	0.495	47%	0.469	S	S	.	.	H	α-helix	trans	-57.6	-48.6	173.7	179.1	-179.6	-14.3	0	0	112	G154 V160 E161 E162	G154-Q158 PolarHBondContact O-N 3.09Å; Q158-V160 VanDerWaalsContact C-N 3.27Å; Q158-V160 PolarHBondContact O-N 2.72Å; Q158-E161 PolarHBondContact O-N 3.48Å; Q158-E161 VanDerWaalsContact O-N 3.09Å; Q158-E162 WeakPolarHBondContact CG-OE1 3.43Å; Q158-E162 PolarHBondContact NE2-OE1 3.38Å; Q158-E162 PolarHBondContact O-N 2.99Å
159	K	86.7	Confident	83.2	Confident	124 Å²	124	92.6 Å²	92.6	54%	0.539	48%	0.477	S	S	.	.	H	α-helix	trans	-66.9	-26.5	179.9	-71.7	-166.2	176.7	-157.3	0	113.3	L155 L156 E157 A163	L155-K159 WeakPolarHBondContact O-CG 3.26Å; L155-K159 PolarHBondContact O-N 2.89Å; L155-K159 VanDerWaalsContact O-N 3.1Å; L156-K159 PolarHBondContact O-N 3Å; E157-K159 PolarHBondContact O-N 3.34Å; K159-A163 VanDerWaalsContact O-CB 3.26Å; K159-A163 WeakPolarHBondContact O-CB 3.16Å; K159-A163 PolarHBondContact O-N 3.29Å
160	V	88.8	Confident	84.9	Confident	79 Å²	79	93.3 Å²	93.3	48%	0.479	48%	0.477	S	S	.	.	H	α-helix	trans	-72.1	-39.1	170.7	165.5	0	0	0	0	111.2	L156 E157 Q158 Q164	L156-V160 WeakPolarHBondContact O-CB 3.35Å; L156-V160 VanDerWaalsContact O-CG2 3.24Å; L156-V160 WeakPolarHBondContact O-CG2 3.4Å; L156-V160 PolarHBondContact O-N 3.46Å; E157-V160 PolarHBondContact O-N 3.34Å; Q158-V160 VanDerWaalsContact C-N 3.27Å; Q158-V160 PolarHBondContact O-N 2.72Å; V160-Q164 WeakPolarHBondContact O-CB 3.22Å; V160-Q164 WeakPolarHBondContact O-CG 3.4Å; V160-Q164 PolarHBondContact O-N 2.94Å
161	E	90.2	Very high	86.4	Confident	115 Å²	115	95.8 Å²	95.8	54%	0.537	49%	0.488	S	S	.	.	H	α-helix	trans	-67.4	-42.5	175.7	-158.5	-160	132.7	0	0	111.9	E157 Q158 Q164 R165	E157-E161 PolarHBondContact O-N 3.02Å; Q158-E161 PolarHBondContact O-N 3.48Å; Q158-E161 VanDerWaalsContact O-N 3.09Å; E161-Q164 PolarHBondContact O-N 3.21Å; E161-R165 WeakPolarHBondContact O-CB 3.31Å; E161-R165 PolarHBondContact O-N 3.38Å; E161-R165 IonicContact OE1-CZ 2.65Å; E161-R165 IonicContact OE1-NH2 3.16Å; E161-R165 PolarHBondContact OE1-NH2 2.96Å
162	E	91.1	Very high	87.8	Confident	63 Å²	63	96.8 Å²	96.8	29%	0.294	49%	0.485	S	S	.	.	H	α-helix	trans	-59.9	-50.2	173.6	-75.6	161.6	179.8	0	0	111.5	Q158 Q164 R165 E166	Q158-E162 WeakPolarHBondContact CG-OE1 3.43Å; Q158-E162 PolarHBondContact NE2-OE1 3.38Å; Q158-E162 PolarHBondContact O-N 2.99Å; E162-Q164 VanDerWaalsContact C-N 3.25Å; E162-Q164 PolarHBondContact O-N 3.01Å; E162-R165 WeakPolarHBondContact O-CB 3.4Å; E162-R165 PolarHBondContact O-N 3.16Å; E162-E166 PolarHBondContact O-N 3.43Å
163	A	88.8	Confident	89	Confident	52 Å²	52	96 Å²	96	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-27.2	176.3	0	0	0	0	0	113.4	K159 K167	K159-A163 VanDerWaalsContact O-CB 3.26Å; K159-A163 WeakPolarHBondContact O-CB 3.16Å; K159-A163 PolarHBondContact O-N 3.29Å; A163-K167 WeakPolarHBondContact O-CB 3.23Å; A163-K167 PolarHBondContact O-N 3.08Å; A163-K167 VanDerWaalsContact O-N 3.08Å
164	Q	89.6	Confident	89.9	Confident	112 Å²	112	98.7 Å²	98.7	52%	0.523	49%	0.49	S	S	.	.	H	α-helix	trans	-71.7	-40	170.9	-77.6	174.6	16.6	0	0	111.8	V160 E161 E162 K167 E168	V160-Q164 WeakPolarHBondContact O-CB 3.22Å; V160-Q164 WeakPolarHBondContact O-CG 3.4Å; V160-Q164 PolarHBondContact O-N 2.94Å; E161-Q164 PolarHBondContact O-N 3.21Å; E162-Q164 VanDerWaalsContact C-N 3.25Å; E162-Q164 PolarHBondContact O-N 3.01Å; Q164-K167 PolarHBondContact O-N 2.82Å; Q164-E168 PolarHBondContact O-N 3.05Å
165	R	94	Very high	90.9	Very high	112 Å²	112	100 Å²	100	42%	0.423	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-48.8	176.9	-156.8	-178.3	-53.8	117.2	3.5	111.4	E161 E162 K167 E168 E169	E161-R165 WeakPolarHBondContact O-CB 3.31Å; E161-R165 PolarHBondContact O-N 3.38Å; E161-R165 IonicContact OE1-CZ 2.65Å; E161-R165 IonicContact OE1-NH2 3.16Å; E161-R165 PolarHBondContact OE1-NH2 2.96Å; E162-R165 WeakPolarHBondContact O-CB 3.4Å; E162-R165 PolarHBondContact O-N 3.16Å; R165-K167 VanDerWaalsContact C-N 3.34Å; R165-K167 PolarHBondContact O-N 2.89Å; R165-E168 PolarHBondContact O-N 2.92Å; R165-E168 VanDerWaalsContact O-N 3.16Å; R165-E169 PolarHBondContact O-N 2.96Å
166	E	93.7	Very high	91.8	Very high	126 Å²	126	103.4 Å²	103.4	59%	0.589	52%	0.515	S	S	*	.	H	α-helix	trans	-56.9	-46	172.4	-71.6	-178.4	169.9	0	0	111.6	E162 E168 E169 L170	E162-E166 PolarHBondContact O-N 3.43Å; E166-E168 VanDerWaalsContact C-N 3.31Å; E166-E168 PolarHBondContact O-N 2.78Å; E166-E169 PolarHBondContact O-N 2.85Å; E166-L170 WeakPolarHBondContact O-CB 3.36Å; E166-L170 VanDerWaalsContact O-CG 3.28Å; E166-L170 WeakPolarHBondContact O-CG 3.38Å; E166-L170 PolarHBondContact O-N 3.39Å
167	K	93.5	Very high	92.5	Very high	132 Å²	132	103 Å²	103	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-59.2	-40.7	176.4	175.7	-170.3	171.2	-166.2	0	112.1	A163 Q164 R165 L171	A163-K167 WeakPolarHBondContact O-CB 3.23Å; A163-K167 PolarHBondContact O-N 3.08Å; A163-K167 VanDerWaalsContact O-N 3.08Å; Q164-K167 PolarHBondContact O-N 2.82Å; R165-K167 VanDerWaalsContact C-N 3.34Å; R165-K167 PolarHBondContact O-N 2.89Å; K167-L171 HydrophobicContact CG-CD1 4.15Å; K167-L171 WeakPolarHBondContact O-CB 3.48Å; K167-L171 VanDerWaalsContact O-CG 3.23Å; K167-L171 WeakPolarHBondContact O-CG 3.31Å; K167-L171 PolarHBondContact O-N 2.78Å
168	E	94.2	Very high	93	Very high	112 Å²	112	100.1 Å²	100.1	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-67	-39.6	175.8	-81.4	-161.7	-165.2	0	0	113	Q164 R165 E166 L171 K172	Q164-E168 PolarHBondContact O-N 3.05Å; R165-E168 PolarHBondContact O-N 2.92Å; R165-E168 VanDerWaalsContact O-N 3.16Å; E166-E168 VanDerWaalsContact C-N 3.31Å; E166-E168 PolarHBondContact O-N 2.78Å; E168-L171 PolarHBondContact O-N 3.25Å; E168-K172 VanDerWaalsContact O-CD 3.31Å; E168-K172 WeakPolarHBondContact O-CD 3.39Å; E168-K172 WeakPolarHBondContact O-CG 3.45Å; E168-K172 PolarHBondContact O-N 2.91Å; E168-K172 IonicContact OE2-NZ 2.71Å; E168-K172 PolarHBondContact OE2-NZ 3.44Å
169	E	95.7	Very high	93.6	Very high	123 Å²	123	100 Å²	100	58%	0.575	50%	0.499	S	S	*	.	H	α-helix	trans	-68.7	-40.1	176.8	-70.8	-178.2	-178.6	0	0	111.8	R165 E166 L171 K172 S173	R165-E169 PolarHBondContact O-N 2.96Å; E166-E169 PolarHBondContact O-N 2.85Å; E169-L171 VanDerWaalsContact C-N 3.35Å; E169-L171 PolarHBondContact O-N 3.28Å; E169-K172 PolarHBondContact O-N 3.02Å; E169-S173 WeakPolarHBondContact O-CB 3.25Å; E169-S173 PolarHBondContact O-N 3.35Å
170	L	95.4	Very high	94	Very high	112 Å²	112	99.6 Å²	99.6	59%	0.586	50%	0.499	S	S	*	.	H	α-helix	trans	-62.1	-39.4	170.7	-72	169.7	0	0	0	112	E166 S173 M174	E166-L170 WeakPolarHBondContact O-CB 3.36Å; E166-L170 VanDerWaalsContact O-CG 3.28Å; E166-L170 WeakPolarHBondContact O-CG 3.38Å; E166-L170 PolarHBondContact O-N 3.39Å; L170-S173 PolarHBondContact O-N 3.47Å; L170-M174 WeakPolarHBondContact O-CB 3.3Å; L170-M174 VanDerWaalsContact O-CG 3.31Å; L170-M174 WeakPolarHBondContact O-CG 3.36Å; L170-M174 PolarHBondContact O-N 2.95Å
171	L	95.6	Very high	94.3	Very high	96 Å²	96	101.1 Å²	101.1	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-39	174.3	-76.7	168.5	0	0	0	112.3	K167 E168 E169 A175	K167-L171 HydrophobicContact CG-CD1 4.15Å; K167-L171 WeakPolarHBondContact O-CB 3.48Å; K167-L171 VanDerWaalsContact O-CG 3.23Å; K167-L171 WeakPolarHBondContact O-CG 3.31Å; K167-L171 PolarHBondContact O-N 2.78Å; E168-L171 PolarHBondContact O-N 3.25Å; E169-L171 VanDerWaalsContact C-N 3.35Å; E169-L171 PolarHBondContact O-N 3.28Å; L171-A175 WeakPolarHBondContact O-CB 3.34Å; L171-A175 PolarHBondContact O-N 2.94Å
172	K	96.6	Very high	94.6	Very high	111 Å²	111	101.2 Å²	101.2	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-64.4	-43.5	173.5	-68.4	155.8	-164	159	0	110.8	E168 E169 A175 L176	E168-K172 VanDerWaalsContact O-CD 3.31Å; E168-K172 WeakPolarHBondContact O-CD 3.39Å; E168-K172 WeakPolarHBondContact O-CG 3.45Å; E168-K172 PolarHBondContact O-N 2.91Å; E168-K172 IonicContact OE2-NZ 2.71Å; E168-K172 PolarHBondContact OE2-NZ 3.44Å; E169-K172 PolarHBondContact O-N 3.02Å; K172-A175 PolarHBondContact O-N 2.94Å; K172-L176 WeakPolarHBondContact O-CG 3.22Å; K172-L176 PolarHBondContact O-N 3.34Å; K172-L176 VanDerWaalsContact O-N 3.1Å
173	S	96.2	Very high	94.9	Very high	54 Å²	54	103.6 Å²	103.6	38%	0.378	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-45.9	175.2	178.9	0	0	0	0	112.4	E169 L170 A175 L176 I177	E169-S173 WeakPolarHBondContact O-CB 3.25Å; E169-S173 PolarHBondContact O-N 3.35Å; L170-S173 PolarHBondContact O-N 3.47Å; S173-A175 VanDerWaalsContact C-N 3.31Å; S173-A175 PolarHBondContact O-N 3.39Å; S173-L176 PolarHBondContact O-N 2.93Å; S173-I177 WeakPolarHBondContact O-CG1 3.28Å; S173-I177 PolarHBondContact O-N 3.39Å
174	M	93.8	Very high	95.3	Very high	127 Å²	127	106.4 Å²	106.4	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-60	-38.8	174.8	-77.3	-177.4	66	0	0	112.5	L170 Q178	L170-M174 WeakPolarHBondContact O-CB 3.3Å; L170-M174 VanDerWaalsContact O-CG 3.31Å; L170-M174 WeakPolarHBondContact O-CG 3.36Å; L170-M174 PolarHBondContact O-N 2.95Å; M174-Q178 VanDerWaalsContact O-CB 3.26Å; M174-Q178 WeakPolarHBondContact O-CB 3.35Å; M174-Q178 PolarHBondContact O-N 3.26Å
175	A	96.3	Very high	95.5	Very high	59 Å²	59	104.2 Å²	104.2	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-65.8	-41.3	176.9	0	0	0	0	0	112.2	L171 K172 S173 Q178 Q179	L171-A175 WeakPolarHBondContact O-CB 3.34Å; L171-A175 PolarHBondContact O-N 2.94Å; K172-A175 PolarHBondContact O-N 2.94Å; S173-A175 VanDerWaalsContact C-N 3.31Å; S173-A175 PolarHBondContact O-N 3.39Å; A175-Q178 PolarHBondContact O-N 2.98Å; A175-Q179 WeakPolarHBondContact O-CB 3.46Å; A175-Q179 PolarHBondContact O-N 2.85Å
176	L	97.1	Very high	95.7	Very high	102 Å²	102	101.8 Å²	101.8	53%	0.534	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-47.8	174.9	-69.9	170.9	0	0	0	111.7	K172 S173 Q178 Q179 E180	K172-L176 WeakPolarHBondContact O-CG 3.22Å; K172-L176 PolarHBondContact O-N 3.34Å; K172-L176 VanDerWaalsContact O-N 3.1Å; S173-L176 PolarHBondContact O-N 2.93Å; L176-Q178 VanDerWaalsContact C-N 3.28Å; L176-Q178 PolarHBondContact O-N 3.1Å; L176-Q179 WeakPolarHBondContact O-CB 3.26Å; L176-Q179 PolarHBondContact O-N 2.82Å; L176-Q179 VanDerWaalsContact O-N 3.09Å; L176-E180 WeakPolarHBondContact O-CG 3.42Å; L176-E180 PolarHBondContact O-N 3.24Å
177	I	95.8	Very high	95.8	Very high	99 Å²	99	101.2 Å²	101.2	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-36.6	178	-67.1	165.5	0	0	0	111.3	S173 K181	S173-I177 WeakPolarHBondContact O-CG1 3.28Å; S173-I177 PolarHBondContact O-N 3.39Å; I177-K181 VanDerWaalsContact O-CB 3.3Å; I177-K181 WeakPolarHBondContact O-CB 3.38Å; I177-K181 PolarHBondContact O-N 2.84Å
178	Q	94.9	Very high	95.9	Very high	87 Å²	87	100.1 Å²	100.1	41%	0.407	51%	0.506	S	S	.	.	H	α-helix	trans	-67.4	-39.2	174.3	179.7	59.8	29.8	0	0	111.8	M174 A175 L176 K181 E182	M174-Q178 VanDerWaalsContact O-CB 3.26Å; M174-Q178 WeakPolarHBondContact O-CB 3.35Å; M174-Q178 PolarHBondContact O-N 3.26Å; A175-Q178 PolarHBondContact O-N 2.98Å; L176-Q178 VanDerWaalsContact C-N 3.28Å; L176-Q178 PolarHBondContact O-N 3.1Å; Q178-K181 PolarHBondContact O-N 3.27Å; Q178-E182 PolarHBondContact NE2-OE1 3.06Å; Q178-E182 WeakPolarHBondContact O-CG 3.41Å; Q178-E182 PolarHBondContact O-N 3.01Å
179	Q	97.1	Very high	96	Very high	103 Å²	103	98.7 Å²	98.7	48%	0.481	50%	0.502	S	S	.	.	H	α-helix	trans	-66.7	-44	175	-177	179.6	-2.5	0	0	112.3	A175 L176 K181 E182 Q183	A175-Q179 WeakPolarHBondContact O-CB 3.46Å; A175-Q179 PolarHBondContact O-N 2.85Å; L176-Q179 WeakPolarHBondContact O-CB 3.26Å; L176-Q179 PolarHBondContact O-N 2.82Å; L176-Q179 VanDerWaalsContact O-N 3.09Å; Q179-K181 VanDerWaalsContact C-N 3.32Å; Q179-K181 PolarHBondContact O-N 3.37Å; Q179-E182 PolarHBondContact O-N 3.25Å; Q179-Q183 WeakPolarHBondContact O-CG 3.34Å; Q179-Q183 PolarHBondContact O-N 3.13Å
180	E	96.6	Very high	96	Very high	115 Å²	115	95.4 Å²	95.4	54%	0.537	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-42.5	174	-73	176.7	168.7	0	0	111	L176 Q183 L184	L176-E180 WeakPolarHBondContact O-CG 3.42Å; L176-E180 PolarHBondContact O-N 3.24Å; E180-Q183 PolarHBondContact O-N 2.91Å; E180-L184 WeakPolarHBondContact O-CG 3.46Å; E180-L184 PolarHBondContact O-N 2.84Å
181	K	94.9	Very high	96.1	Very high	112 Å²	112	94.6 Å²	94.6	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-61.5	-45.9	174.4	-172.9	-159.9	165.6	-159.6	0	111.9	I177 Q178 Q179 Q183 L184 D185	I177-K181 VanDerWaalsContact O-CB 3.3Å; I177-K181 WeakPolarHBondContact O-CB 3.38Å; I177-K181 PolarHBondContact O-N 2.84Å; Q178-K181 PolarHBondContact O-N 3.27Å; Q179-K181 VanDerWaalsContact C-N 3.32Å; Q179-K181 PolarHBondContact O-N 3.37Å; K181-Q183 VanDerWaalsContact C-N 3.27Å; K181-Q183 PolarHBondContact O-N 3.34Å; K181-L184 PolarHBondContact O-N 2.97Å; K181-D185 VanDerWaalsContact CE-OD2 3.25Å; K181-D185 WeakPolarHBondContact CE-OD2 3.17Å; K181-D185 IonicContact NZ-OD2 2.63Å; K181-D185 WeakPolarHBondContact O-CB 3.46Å; K181-D185 PolarHBondContact O-N 2.91Å
182	E	96.4	Very high	96.1	Very high	116 Å²	116	94.7 Å²	94.7	54%	0.542	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-34	177.8	-76.7	171.1	-162.8	0	0	112.3	Q178 Q179 A186	Q178-E182 PolarHBondContact NE2-OE1 3.06Å; Q178-E182 WeakPolarHBondContact O-CG 3.41Å; Q178-E182 PolarHBondContact O-N 3.01Å; Q179-E182 PolarHBondContact O-N 3.25Å; E182-A186 VanDerWaalsContact O-CB 3.31Å; E182-A186 WeakPolarHBondContact O-CB 3.46Å; E182-A186 PolarHBondContact O-N 3.4Å; E182-A186 VanDerWaalsContact O-N 3.13Å
183	Q	96.9	Very high	96.1	Very high	114 Å²	114	94.8 Å²	94.8	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-68	-45.5	171.7	-71.8	174.9	0.5	0	0	112.1	Q179 E180 K181 A186 E187	Q179-Q183 WeakPolarHBondContact O-CG 3.34Å; Q179-Q183 PolarHBondContact O-N 3.13Å; E180-Q183 PolarHBondContact O-N 2.91Å; K181-Q183 VanDerWaalsContact C-N 3.27Å; K181-Q183 PolarHBondContact O-N 3.34Å; Q183-A186 PolarHBondContact O-N 3.3Å; Q183-E187 WeakPolarHBondContact O-CB 3.48Å; Q183-E187 PolarHBondContact O-N 2.84Å
184	L	96.4	Very high	96.1	Very high	110 Å²	110	96.8 Å²	96.8	58%	0.576	49%	0.49	S	S	*	.	H	α-helix	trans	-67.5	-38.2	178.9	-72	169	0	0	0	113	E180 K181 A186 K188	E180-L184 WeakPolarHBondContact O-CG 3.46Å; E180-L184 PolarHBondContact O-N 2.84Å; K181-L184 PolarHBondContact O-N 2.97Å; L184-A186 VanDerWaalsContact C-N 3.33Å; L184-K188 WeakPolarHBondContact O-CB 3.38Å; L184-K188 PolarHBondContact O-N 3.23Å
185	D	95.2	Very high	96.2	Very high	67 Å²	67	97.4 Å²	97.4	36%	0.358	49%	0.49	S	S	.	.	H	α-helix	trans	-65.3	-37.3	172.8	-87.9	-40.7	0	0	0	110.7	K181 K188 D189	K181-D185 VanDerWaalsContact CE-OD2 3.25Å; K181-D185 WeakPolarHBondContact CE-OD2 3.17Å; K181-D185 IonicContact NZ-OD2 2.63Å; K181-D185 WeakPolarHBondContact O-CB 3.46Å; K181-D185 PolarHBondContact O-N 2.91Å; D185-K188 IonicContact OD1-NZ 2.79Å; D185-D189 WeakPolarHBondContact O-CB 3.45Å; D185-D189 PolarHBondContact O-N 2.84Å
186	A	96.8	Very high	96.1	Very high	61 Å²	61	98.9 Å²	98.9	50%	0.504	49%	0.486	S	S	.	.	H	α-helix	trans	-71.3	-39.4	175.6	0	0	0	0	0	113.7	E182 Q183 L184 D189 S190	E182-A186 VanDerWaalsContact O-CB 3.31Å; E182-A186 WeakPolarHBondContact O-CB 3.46Å; E182-A186 PolarHBondContact O-N 3.4Å; E182-A186 VanDerWaalsContact O-N 3.13Å; Q183-A186 PolarHBondContact O-N 3.3Å; L184-A186 VanDerWaalsContact C-N 3.33Å; A186-D189 PolarHBondContact O-N 3.03Å; A186-S190 PolarHBondContact O-N 3.49Å
187	E	96.8	Very high	96.1	Very high	114 Å²	114	100.2 Å²	100.2	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-63	-47.5	174.2	-177.1	-179.2	-179.5	0	0	110.6	Q183 D189 S190 L191	Q183-E187 WeakPolarHBondContact O-CB 3.48Å; Q183-E187 PolarHBondContact O-N 2.84Å; E187-D189 VanDerWaalsContact C-N 3.3Å; E187-D189 PolarHBondContact O-N 2.97Å; E187-S190 WeakPolarHBondContact O-CA 3.49Å; E187-S190 WeakPolarHBondContact O-CB 3.29Å; E187-S190 PolarHBondContact O-N 3.09Å; E187-L191 HydrophobicContact CG-CD1 4.06Å; E187-L191 HydrophobicContact CG-CG 4.49Å; E187-L191 WeakPolarHBondContact O-CG 3.31Å; E187-L191 PolarHBondContact O-N 3.37Å
188	K	94.3	Very high	96	Very high	109 Å²	109	101.1 Å²	101.1	47%	0.474	49%	0.492	S	S	.	.	H	α-helix	trans	-55.8	-43.2	172.8	169.7	173.9	147.8	-85.6	0	112.2	L184 D185 S190 L191 Q192	L184-K188 WeakPolarHBondContact O-CB 3.38Å; L184-K188 PolarHBondContact O-N 3.23Å; D185-K188 IonicContact OD1-NZ 2.79Å; K188-S190 VanDerWaalsContact C-N 3.28Å; K188-S190 PolarHBondContact O-N 2.75Å; K188-L191 PolarHBondContact O-N 2.89Å; K188-Q192 WeakPolarHBondContact O-CB 3.3Å; K188-Q192 PolarHBondContact O-N 3.01Å
189	D	96.4	Very high	96.1	Very high	82 Å²	82	103.5 Å²	103.5	44%	0.439	50%	0.501	S	S	.	.	H	α-helix	trans	-69.6	-20.4	176.2	-91.3	25.3	0	0	0	113.3	D185 A186 E187 K193	D185-D189 WeakPolarHBondContact O-CB 3.45Å; D185-D189 PolarHBondContact O-N 2.84Å; A186-D189 PolarHBondContact O-N 3.03Å; E187-D189 VanDerWaalsContact C-N 3.3Å; E187-D189 PolarHBondContact O-N 2.97Å; D189-K193 WeakPolarHBondContact O-CD 3.32Å; D189-K193 VanDerWaalsContact O-CG 3.29Å; D189-K193 WeakPolarHBondContact O-CG 3.41Å; D189-K193 PolarHBondContact O-NZ 2.93Å
190	S	96.9	Very high	96.1	Very high	54 Å²	54	105.6 Å²	105.6	38%	0.378	51%	0.511	S	S	.	.	H	α-helix	trans	-78.7	-54.1	169	-160.4	0	0	0	0	110.6	A186 E187 K188 Q192 K193 E194	A186-S190 PolarHBondContact O-N 3.49Å; E187-S190 WeakPolarHBondContact O-CA 3.49Å; E187-S190 WeakPolarHBondContact O-CB 3.29Å; E187-S190 PolarHBondContact O-N 3.09Å; K188-S190 VanDerWaalsContact C-N 3.28Å; K188-S190 PolarHBondContact O-N 2.75Å; S190-Q192 PolarHBondContact O-N 3.49Å; S190-K193 WeakPolarHBondContact O-CA 3.41Å; S190-K193 WeakPolarHBondContact O-CB 3.32Å; S190-K193 PolarHBondContact O-N 2.91Å; S190-E194 WeakPolarHBondContact CB-OE1 3.44Å; S190-E194 PolarHBondContact O-N 2.91Å; S190-E194 PolarHBondContact OG-OE1 3.47Å
191	L	96.4	Very high	96.1	Very high	94 Å²	94	102.4 Å²	102.4	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-56.5	-35.6	179.8	-69.6	171.8	0	0	0	112.5	E187 K188 F195	E187-L191 HydrophobicContact CG-CD1 4.06Å; E187-L191 HydrophobicContact CG-CG 4.49Å; E187-L191 WeakPolarHBondContact O-CG 3.31Å; E187-L191 PolarHBondContact O-N 3.37Å; K188-L191 PolarHBondContact O-N 2.89Å; L191-F195 VanDerWaalsContact O-CB 3.32Å; L191-F195 WeakPolarHBondContact O-CB 3.48Å; L191-F195 PolarHBondContact O-N 3.43Å
192	Q	95.7	Very high	96	Very high	99 Å²	99	99.1 Å²	99.1	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-70.3	-36	174.8	-176.6	164.9	-24.4	0	0	112.7	K188 S190 F195 E196	K188-Q192 WeakPolarHBondContact O-CB 3.3Å; K188-Q192 PolarHBondContact O-N 3.01Å; S190-Q192 PolarHBondContact O-N 3.49Å; Q192-F195 PolarHBondContact O-N 3.31Å; Q192-E196 WeakPolarHBondContact CG-OE1 3.43Å; Q192-E196 PolarHBondContact NE2-OE1 3.43Å; Q192-E196 WeakPolarHBondContact O-CB 3.4Å; Q192-E196 VanDerWaalsContact O-CG 3.3Å; Q192-E196 WeakPolarHBondContact O-CG 3.48Å; Q192-E196 PolarHBondContact O-N 2.91Å
193	K	96.8	Very high	96	Very high	113 Å²	113	96 Å²	96	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-68.2	-39.8	174	-68.3	176.3	-168.4	91.9	0	111.4	D189 S190 E196 Q197	D189-K193 WeakPolarHBondContact O-CD 3.32Å; D189-K193 VanDerWaalsContact O-CG 3.29Å; D189-K193 WeakPolarHBondContact O-CG 3.41Å; D189-K193 PolarHBondContact O-NZ 2.93Å; S190-K193 WeakPolarHBondContact O-CA 3.41Å; S190-K193 WeakPolarHBondContact O-CB 3.32Å; S190-K193 PolarHBondContact O-N 2.91Å; K193-E196 PolarHBondContact O-N 2.92Å; K193-Q197 WeakPolarHBondContact O-CB 3.48Å; K193-Q197 VanDerWaalsContact O-CG 3.32Å; K193-Q197 WeakPolarHBondContact O-CG 3.46Å; K193-Q197 PolarHBondContact O-N 2.99Å
194	E	96.4	Very high	96	Very high	95 Å²	95	94.9 Å²	94.9	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-63	-43.7	174.8	-69.3	159.5	-132.8	0	0	111	S190 E196 Q197 E198	S190-E194 WeakPolarHBondContact CB-OE1 3.44Å; S190-E194 PolarHBondContact O-N 2.91Å; S190-E194 PolarHBondContact OG-OE1 3.47Å; E194-E196 PolarHBondContact O-N 3.18Å; E194-Q197 PolarHBondContact O-N 2.65Å; E194-E198 WeakPolarHBondContact O-CB 3.45Å; E194-E198 PolarHBondContact O-N 3.09Å
195	F	95.4	Very high	96	Very high	140 Å²	140	93.8 Å²	93.8	61%	0.614	48%	0.475	S	S	*	.	H	α-helix	trans	-62.8	-39.4	172.9	175.8	-100.2	0	0	0	113	L191 Q192 K199	L191-F195 VanDerWaalsContact O-CB 3.32Å; L191-F195 WeakPolarHBondContact O-CB 3.48Å; L191-F195 PolarHBondContact O-N 3.43Å; Q192-F195 PolarHBondContact O-N 3.31Å; F195-K199 HydrophobicContact CE1-CD 4.47Å; F195-K199 WeakPolarHBondContact O-CB 3.32Å; F195-K199 PolarHBondContact O-N 3.02Å
196	E	95.8	Very high	96	Very high	90 Å²	90	99 Å²	99	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-67.8	-40.5	176.4	-75.9	170.2	-167.5	0	0	111.6	Q192 K193 E194 K199 E200	Q192-E196 WeakPolarHBondContact CG-OE1 3.43Å; Q192-E196 PolarHBondContact NE2-OE1 3.43Å; Q192-E196 WeakPolarHBondContact O-CB 3.4Å; Q192-E196 VanDerWaalsContact O-CG 3.3Å; Q192-E196 WeakPolarHBondContact O-CG 3.48Å; Q192-E196 PolarHBondContact O-N 2.91Å; K193-E196 PolarHBondContact O-N 2.92Å; E194-E196 PolarHBondContact O-N 3.18Å; E196-K199 PolarHBondContact O-N 3.48Å; E196-E200 WeakPolarHBondContact O-CG 3.15Å; E196-E200 PolarHBondContact O-N 2.89Å
197	Q	96.2	Very high	96	Very high	130 Å²	130	102 Å²	102	61%	0.607	49%	0.488	S	S	*	.	H	α-helix	trans	-64.9	-46	173.7	-73	174	16.8	0	0	112.7	K193 E194 K199 E200 S201	K193-Q197 WeakPolarHBondContact O-CB 3.48Å; K193-Q197 VanDerWaalsContact O-CG 3.32Å; K193-Q197 WeakPolarHBondContact O-CG 3.46Å; K193-Q197 PolarHBondContact O-N 2.99Å; E194-Q197 PolarHBondContact O-N 2.65Å; Q197-K199 VanDerWaalsContact C-N 3.28Å; Q197-K199 PolarHBondContact O-N 2.85Å; Q197-E200 PolarHBondContact O-N 3.15Å; Q197-E200 VanDerWaalsContact O-N 3.16Å; Q197-S201 WeakPolarHBondContact O-CB 3.47Å; Q197-S201 PolarHBondContact O-N 3Å
198	E	94.4	Very high	96	Very high	119 Å²	119	100.4 Å²	100.4	56%	0.556	48%	0.481	S	S	*	.	H	α-helix	trans	-66.1	-33.4	178	-177.7	51.5	-144.3	0	0	111.7	E194 S201 C202	E194-E198 WeakPolarHBondContact O-CB 3.45Å; E194-E198 PolarHBondContact O-N 3.09Å; E198-S201 WeakPolarHBondContact O-CB 3.42Å; E198-S201 PolarHBondContact O-N 3.31Å; E198-C202 VanDerWaalsContact O-CB 3.28Å; E198-C202 WeakPolarHBondContact O-CB 3.46Å; E198-C202 PolarHBondContact O-N 2.84Å
199	K	96.1	Very high	96	Very high	137 Å²	137	100.2 Å²	100.2	60%	0.596	48%	0.483	S	S	*	.	H	α-helix	trans	-65.8	-39.1	171.9	178.2	-174.1	171.6	-164.5	0	112.3	F195 E196 Q197 A203	F195-K199 HydrophobicContact CE1-CD 4.47Å; F195-K199 WeakPolarHBondContact O-CB 3.32Å; F195-K199 PolarHBondContact O-N 3.02Å; E196-K199 PolarHBondContact O-N 3.48Å; Q197-K199 VanDerWaalsContact C-N 3.28Å; Q197-K199 PolarHBondContact O-N 2.85Å; K199-A203 VanDerWaalsContact O-CB 3.32Å; K199-A203 WeakPolarHBondContact O-CB 3.49Å; K199-A203 PolarHBondContact O-N 2.85Å
200	E	96.6	Very high	96.1	Very high	146 Å²	146	101.2 Å²	101.2	68%	0.682	49%	0.486	S	S	*	.	H	α-helix	trans	-68.6	-42.5	173.5	-74	-173.4	168.2	0	0	111.9	E196 Q197 A203 Q204	E196-E200 WeakPolarHBondContact O-CG 3.15Å; E196-E200 PolarHBondContact O-N 2.89Å; Q197-E200 PolarHBondContact O-N 3.15Å; Q197-E200 VanDerWaalsContact O-N 3.16Å; E200-A203 CarbonylContact O-C 3.49Å; E200-A203 PolarHBondContact O-N 3.16Å; E200-A203 VanDerWaalsContact O-N 3.15Å; E200-Q204 PolarHBondContact O-N 2.98Å
201	S	96.4	Very high	96.1	Very high	49 Å²	49	104.6 Å²	104.6	34%	0.343	50%	0.495	S	S	.	.	H	α-helix	trans	-54.8	-52.1	171.2	176.2	0	0	0	0	111.6	Q197 E198 A203 Q204 L205	Q197-S201 WeakPolarHBondContact O-CB 3.47Å; Q197-S201 PolarHBondContact O-N 3Å; E198-S201 WeakPolarHBondContact O-CB 3.42Å; E198-S201 PolarHBondContact O-N 3.31Å; S201-A203 VanDerWaalsContact C-N 3.29Å; S201-A203 PolarHBondContact O-N 3.41Å; S201-Q204 WeakPolarHBondContact O-CA 3.47Å; S201-Q204 WeakPolarHBondContact O-CB 3.46Å; S201-Q204 PolarHBondContact O-N 2.89Å; S201-L205 WeakPolarHBondContact O-CG 3.38Å; S201-L205 PolarHBondContact O-N 2.75Å
202	C	93.3	Very high	96.1	Very high	42 Å²	42	104.6 Å²	104.6	28%	0.284	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-35.7	176.2	-168.8	0	0	0	0	112.3	E198 Q204 R206	E198-C202 VanDerWaalsContact O-CB 3.28Å; E198-C202 WeakPolarHBondContact O-CB 3.46Å; E198-C202 PolarHBondContact O-N 2.84Å; C202-Q204 VanDerWaalsContact C-N 3.34Å; C202-R206 WeakPolarHBondContact O-CB 3.49Å; C202-R206 WeakPolarHBondContact O-CD 3.36Å; C202-R206 WeakPolarHBondContact O-CG 3.49Å; C202-R206 PolarHBondContact O-N 3.45Å; C202-R206 VanDerWaalsContact O-N 3.11Å; C202-R206 PolarHBondContact SG-NE 3.42Å
203	A	96.5	Very high	96.2	Very high	50 Å²	50	105.3 Å²	105.3	41%	0.413	51%	0.505	S	S	.	.	H	α-helix	trans	-74	-21.8	174.8	0	0	0	0	0	113.6	K199 E200 S201 R207	K199-A203 VanDerWaalsContact O-CB 3.32Å; K199-A203 WeakPolarHBondContact O-CB 3.49Å; K199-A203 PolarHBondContact O-N 2.85Å; E200-A203 CarbonylContact O-C 3.49Å; E200-A203 PolarHBondContact O-N 3.16Å; E200-A203 VanDerWaalsContact O-N 3.15Å; S201-A203 VanDerWaalsContact C-N 3.29Å; S201-A203 PolarHBondContact O-N 3.41Å; A203-R207 WeakPolarHBondContact O-CG 3.28Å; A203-R207 PolarHBondContact O-NE 3.32Å; A203-R207 VanDerWaalsContact O-NE 3.09Å
204	Q	97	Very high	96.2	Very high	92 Å²	92	106.3 Å²	106.3	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-78.2	-52.8	169.5	176.5	163.7	-25.2	0	0	111.6	E200 S201 C202 R206 R207 E208	E200-Q204 PolarHBondContact O-N 2.98Å; S201-Q204 WeakPolarHBondContact O-CA 3.47Å; S201-Q204 WeakPolarHBondContact O-CB 3.46Å; S201-Q204 PolarHBondContact O-N 2.89Å; C202-Q204 VanDerWaalsContact C-N 3.34Å; Q204-R206 PolarHBondContact O-N 3.08Å; Q204-R207 WeakPolarHBondContact O-CA 3.15Å; Q204-R207 WeakPolarHBondContact O-CB 3.43Å; Q204-R207 PolarHBondContact O-N 3.05Å; Q204-E208 HydrophobicContact CG-CG 4.37Å; Q204-E208 WeakPolarHBondContact CG-OE1 3.44Å; Q204-E208 PolarHBondContact NE2-OE1 2.75Å; Q204-E208 PolarHBondContact O-N 2.83Å
205	L	96.2	Very high	96.2	Very high	87 Å²	87	104.7 Å²	104.7	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-55.7	-36.8	178.2	-69.7	169.9	0	0	0	112	S201 R207 E208 I209	S201-L205 WeakPolarHBondContact O-CG 3.38Å; S201-L205 PolarHBondContact O-N 2.75Å; L205-R207 PolarHBondContact O-N 3.32Å; L205-E208 PolarHBondContact O-N 3.45Å; L205-I209 WeakPolarHBondContact O-CB 3.41Å; L205-I209 WeakPolarHBondContact O-CD1 3.45Å; L205-I209 WeakPolarHBondContact O-CG1 3.18Å; L205-I209 PolarHBondContact O-N 3.16Å
206	R	95.9	Very high	96	Very high	175 Å²	175	101.6 Å²	101.6	66%	0.66	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-37.2	173.2	-74.7	168.5	-165.7	-132.2	3.1	113.7	C202 Q204 Q210	C202-R206 WeakPolarHBondContact O-CB 3.49Å; C202-R206 WeakPolarHBondContact O-CD 3.36Å; C202-R206 WeakPolarHBondContact O-CG 3.49Å; C202-R206 PolarHBondContact O-N 3.45Å; C202-R206 VanDerWaalsContact O-N 3.11Å; C202-R206 PolarHBondContact SG-NE 3.42Å; Q204-R206 PolarHBondContact O-N 3.08Å; R206-Q210 WeakPolarHBondContact O-CB 3.41Å; R206-Q210 PolarHBondContact O-N 3.45Å; R206-Q210 VanDerWaalsContact O-N 3.08Å
207	R	96.9	Very high	96.1	Very high	126 Å²	126	102.5 Å²	102.5	48%	0.475	51%	0.511	S	S	.	.	H	α-helix	trans	-70.6	-46	176	-72.4	178.1	-70.3	117.5	-9.5	110.6	A203 Q204 L205 I209 Q210 E211	A203-R207 WeakPolarHBondContact O-CG 3.28Å; A203-R207 PolarHBondContact O-NE 3.32Å; A203-R207 VanDerWaalsContact O-NE 3.09Å; Q204-R207 WeakPolarHBondContact O-CA 3.15Å; Q204-R207 WeakPolarHBondContact O-CB 3.43Å; Q204-R207 PolarHBondContact O-N 3.05Å; L205-R207 PolarHBondContact O-N 3.32Å; R207-I209 PolarHBondContact O-N 3.11Å; R207-Q210 CarbonylContact O-C 3.49Å; R207-Q210 WeakPolarHBondContact O-CA 3.46Å; R207-Q210 WeakPolarHBondContact O-CB 3.19Å; R207-Q210 PolarHBondContact O-N 3.48Å; R207-E211 WeakPolarHBondContact O-CG 3.5Å; R207-E211 PolarHBondContact O-N 2.89Å
208	E	97	Very high	96.1	Very high	80 Å²	80	98.4 Å²	98.4	37%	0.374	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-44	177.5	-68.1	172.1	-174.1	0	0	111.5	Q204 L205 Q210 E211 V212	Q204-E208 HydrophobicContact CG-CG 4.37Å; Q204-E208 WeakPolarHBondContact CG-OE1 3.44Å; Q204-E208 PolarHBondContact NE2-OE1 2.75Å; Q204-E208 PolarHBondContact O-N 2.83Å; L205-E208 PolarHBondContact O-N 3.45Å; E208-Q210 VanDerWaalsContact C-N 3.32Å; E208-Q210 PolarHBondContact O-N 2.88Å; E208-E211 PolarHBondContact O-N 2.88Å; E208-V212 WeakPolarHBondContact O-CB 3.42Å; E208-V212 VanDerWaalsContact O-CG2 3.29Å; E208-V212 WeakPolarHBondContact O-CG2 3.26Å; E208-V212 PolarHBondContact O-N 2.78Å
209	I	94.7	Very high	96.2	Very high	104 Å²	104	98.2 Å²	98.2	53%	0.533	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-41.4	172.3	-70.9	164.5	0	0	0	111.2	L205 R207 V212 L213	L205-I209 WeakPolarHBondContact O-CB 3.41Å; L205-I209 WeakPolarHBondContact O-CD1 3.45Å; L205-I209 WeakPolarHBondContact O-CG1 3.18Å; L205-I209 PolarHBondContact O-N 3.16Å; R207-I209 PolarHBondContact O-N 3.11Å; I209-V212 PolarHBondContact O-N 2.98Å; I209-L213 HydrophobicContact CG2-CD1 4.01Å; I209-L213 WeakPolarHBondContact O-CB 3.35Å; I209-L213 VanDerWaalsContact O-CG 3.26Å; I209-L213 WeakPolarHBondContact O-CG 3.42Å; I209-L213 PolarHBondContact O-N 3.29Å
210	Q	96.8	Very high	96.2	Very high	104 Å²	104	95.4 Å²	95.4	49%	0.486	49%	0.49	S	S	.	.	H	α-helix	trans	-68.8	-37.9	178.6	-171.9	173.8	4.2	0	0	112.6	R206 R207 E208 L213 H214	R206-Q210 WeakPolarHBondContact O-CB 3.41Å; R206-Q210 PolarHBondContact O-N 3.45Å; R206-Q210 VanDerWaalsContact O-N 3.08Å; R207-Q210 CarbonylContact O-C 3.49Å; R207-Q210 WeakPolarHBondContact O-CA 3.46Å; R207-Q210 WeakPolarHBondContact O-CB 3.19Å; R207-Q210 PolarHBondContact O-N 3.48Å; E208-Q210 VanDerWaalsContact C-N 3.32Å; E208-Q210 PolarHBondContact O-N 2.88Å; Q210-L213 PolarHBondContact O-N 3.45Å; Q210-H214 WeakPolarHBondContact CG-NE2 3.39Å; Q210-H214 PolarHBondContact NE2-NE2 3.18Å; Q210-H214 PolarHBondContact O-CD2 2.9Å; Q210-H214 PolarHBondContact O-N 2.93Å
211	E	97.2	Very high	96.2	Very high	124 Å²	124	93.6 Å²	93.6	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-68.2	-38.4	174.7	-71.8	170.5	-153.3	0	0	111.7	R207 E208 H214 S215	R207-E211 WeakPolarHBondContact O-CG 3.5Å; R207-E211 PolarHBondContact O-N 2.89Å; E208-E211 PolarHBondContact O-N 2.88Å; E211-H214 PolarHBondContact O-N 3.41Å; E211-S215 WeakPolarHBondContact O-CB 3.15Å; E211-S215 PolarHBondContact O-N 3.47Å; E211-S215 PolarHBondContact O-OG 2.94Å
212	V	97.3	Very high	96.2	Very high	95 Å²	95	97.7 Å²	97.7	58%	0.576	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-39.5	171.3	170.1	0	0	0	0	111.5	E208 I209 S215 S216	E208-V212 WeakPolarHBondContact O-CB 3.42Å; E208-V212 VanDerWaalsContact O-CG2 3.29Å; E208-V212 WeakPolarHBondContact O-CG2 3.26Å; E208-V212 PolarHBondContact O-N 2.78Å; I209-V212 PolarHBondContact O-N 2.98Å; V212-S215 WeakPolarHBondContact CA-OG 3.29Å; V212-S215 PolarHBondContact O-OG 3.13Å; V212-S215 VanDerWaalsContact O-OG 3.13Å; V212-S216 WeakPolarHBondContact O-CB 3.44Å; V212-S216 PolarHBondContact O-N 2.98Å
213	L	96.8	Very high	96.3	Very high	113 Å²	113	102 Å²	102	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-65.4	-45.1	174.9	-75.5	168.5	0	0	0	112.1	I209 Q210 S216 Q217	I209-L213 HydrophobicContact CG2-CD1 4.01Å; I209-L213 WeakPolarHBondContact O-CB 3.35Å; I209-L213 VanDerWaalsContact O-CG 3.26Å; I209-L213 WeakPolarHBondContact O-CG 3.42Å; I209-L213 PolarHBondContact O-N 3.29Å; Q210-L213 PolarHBondContact O-N 3.45Å; L213-S216 PolarHBondContact O-N 2.95Å; L213-Q217 PolarHBondContact O-N 3.48Å
214	H	96.9	Very high	96.3	Very high	135 Å²	135	105 Å²	105	63%	0.625	52%	0.515	S	S	*	.	H	α-helix	trans	-65.5	-40.6	177.7	-75.2	-51.3	0	0	0	112.6	Q210 E211 Q217 A218	Q210-H214 WeakPolarHBondContact CG-NE2 3.39Å; Q210-H214 PolarHBondContact NE2-NE2 3.18Å; Q210-H214 PolarHBondContact O-CD2 2.9Å; Q210-H214 PolarHBondContact O-N 2.93Å; E211-H214 PolarHBondContact O-N 3.41Å; H214-Q217 PolarHBondContact O-N 3.38Å; H214-A218 PolarHBondContact O-N 2.88Å
215	S	96	Very high	96.3	Very high	60 Å²	60	103.2 Å²	103.2	42%	0.42	51%	0.507	S	S	.	.	H	α-helix	trans	-69.5	-37.9	175.4	52.8	0	0	0	0	112.5	E211 V212 A218 L219	E211-S215 WeakPolarHBondContact O-CB 3.15Å; E211-S215 PolarHBondContact O-N 3.47Å; E211-S215 PolarHBondContact O-OG 2.94Å; V212-S215 WeakPolarHBondContact CA-OG 3.29Å; V212-S215 PolarHBondContact O-OG 3.13Å; V212-S215 VanDerWaalsContact O-OG 3.13Å; S215-A218 PolarHBondContact O-N 3.46Å; S215-L219 VanDerWaalsContact O-CD1 3.26Å; S215-L219 WeakPolarHBondContact O-CD1 3.45Å; S215-L219 PolarHBondContact O-N 3.41Å
216	S	92.8	Very high	96.4	Very high	75 Å²	75	103.3 Å²	103.3	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-41.8	172.3	-174.4	0	0	0	0	112.1	V212 L213 L219 Q220	V212-S216 WeakPolarHBondContact O-CB 3.44Å; V212-S216 PolarHBondContact O-N 2.98Å; L213-S216 PolarHBondContact O-N 2.95Å; S216-L219 PolarHBondContact O-N 2.8Å; S216-Q220 PolarHBondContact O-N 2.69Å
217	Q	96.6	Very high	96.4	Very high	109 Å²	109	100.5 Å²	100.5	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-62.3	-47.5	173.1	-175.5	-178.1	-28.5	0	0	111.3	L213 H214 L219 Q220 E221	L213-Q217 PolarHBondContact O-N 3.48Å; H214-Q217 PolarHBondContact O-N 3.38Å; Q217-L219 VanDerWaalsContact C-N 3.35Å; Q217-L219 PolarHBondContact O-N 2.9Å; Q217-Q220 PolarHBondContact O-N 2.97Å; Q217-Q220 VanDerWaalsContact O-N 3.09Å; Q217-E221 WeakPolarHBondContact CG-OE1 3.15Å; Q217-E221 PolarHBondContact NE2-OE1 2.92Å; Q217-E221 WeakPolarHBondContact O-CG 3.5Å; Q217-E221 PolarHBondContact O-N 2.91Å
218	A	96.8	Very high	96.5	Very high	45 Å²	45	100.1 Å²	100.1	37%	0.372	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-41.6	177.9	0	0	0	0	0	112.5	H214 S215 Q220 E221 E222	H214-A218 PolarHBondContact O-N 2.88Å; S215-A218 PolarHBondContact O-N 3.46Å; A218-Q220 VanDerWaalsContact C-N 3.33Å; A218-Q220 PolarHBondContact O-N 2.73Å; A218-E221 PolarHBondContact O-N 3.36Å; A218-E222 PolarHBondContact O-N 3.09Å
219	L	96.2	Very high	96.5	Very high	114 Å²	114	103 Å²	103	60%	0.597	51%	0.509	S	S	*	.	H	α-helix	trans	-64.8	-34.4	174.2	-95.8	76.3	0	0	0	112.6	S215 S216 Q217 K223	S215-L219 VanDerWaalsContact O-CD1 3.26Å; S215-L219 WeakPolarHBondContact O-CD1 3.45Å; S215-L219 PolarHBondContact O-N 3.41Å; S216-L219 PolarHBondContact O-N 2.8Å; Q217-L219 VanDerWaalsContact C-N 3.35Å; Q217-L219 PolarHBondContact O-N 2.9Å; L219-K223 WeakPolarHBondContact O-CB 3.43Å; L219-K223 PolarHBondContact O-N 3.31Å
220	Q	95.8	Very high	96.6	Very high	78 Å²	78	103.4 Å²	103.4	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-69.7	-39.5	174.8	178.4	63	24.4	0	0	111.3	S216 Q217 A218 K223 E224	S216-Q220 PolarHBondContact O-N 2.69Å; Q217-Q220 PolarHBondContact O-N 2.97Å; Q217-Q220 VanDerWaalsContact O-N 3.09Å; A218-Q220 VanDerWaalsContact C-N 3.33Å; A218-Q220 PolarHBondContact O-N 2.73Å; Q220-K223 PolarHBondContact O-N 2.78Å; Q220-E224 PolarHBondContact NE2-OE1 3.46Å; Q220-E224 WeakPolarHBondContact O-CG 3.49Å; Q220-E224 PolarHBondContact O-N 3.46Å
221	E	97.1	Very high	96.6	Very high	108 Å²	108	103.3 Å²	103.3	51%	0.505	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-44.3	173.6	-70.3	173.8	-161.7	0	0	111.6	Q217 A218 K223 E224 E225	Q217-E221 WeakPolarHBondContact CG-OE1 3.15Å; Q217-E221 PolarHBondContact NE2-OE1 2.92Å; Q217-E221 WeakPolarHBondContact O-CG 3.5Å; Q217-E221 PolarHBondContact O-N 2.91Å; A218-E221 PolarHBondContact O-N 3.36Å; E221-K223 PolarHBondContact O-N 3.47Å; E221-E224 PolarHBondContact O-N 2.98Å; E221-E225 WeakPolarHBondContact O-CB 3.48Å; E221-E225 PolarHBondContact O-N 3.31Å
222	E	96.6	Very high	96.6	Very high	135 Å²	135	100.9 Å²	100.9	63%	0.631	50%	0.5	S	S	*	.	H	α-helix	trans	-62.9	-39.1	173.5	-74.1	-164	144.5	0	0	112.5	A218 E225 V226	A218-E222 PolarHBondContact O-N 3.09Å; E222-E225 PolarHBondContact O-N 2.95Å; E222-V226 WeakPolarHBondContact O-CB 3.4Å; E222-V226 WeakPolarHBondContact O-CG2 3.3Å; E222-V226 PolarHBondContact O-N 3.07Å
223	K	94.8	Very high	96.6	Very high	134 Å²	134	98.1 Å²	98.1	58%	0.583	49%	0.487	S	S	*	.	H	α-helix	trans	-65.5	-39.6	176.3	169.9	-177.9	158.5	-155.5	0	112.4	L219 Q220 E221 V226 K227	L219-K223 WeakPolarHBondContact O-CB 3.43Å; L219-K223 PolarHBondContact O-N 3.31Å; Q220-K223 PolarHBondContact O-N 2.78Å; E221-K223 PolarHBondContact O-N 3.47Å; K223-V226 PolarHBondContact O-N 3.02Å; K223-K227 WeakPolarHBondContact O-CB 3.26Å; K223-K227 PolarHBondContact O-N 3.06Å
224	E	97.1	Very high	96.5	Very high	113 Å²	113	96.1 Å²	96.1	53%	0.528	48%	0.48	S	S	.	.	H	α-helix	trans	-67.5	-39	174	-75.4	178.3	-158.4	0	0	111.6	Q220 E221 K227 R228	Q220-E224 PolarHBondContact NE2-OE1 3.46Å; Q220-E224 WeakPolarHBondContact O-CG 3.49Å; Q220-E224 PolarHBondContact O-N 3.46Å; E221-E224 PolarHBondContact O-N 2.98Å; E224-K227 PolarHBondContact O-N 3.2Å; E224-R228 WeakPolarHBondContact O-CB 3.36Å; E224-R228 PolarHBondContact O-N 3.4Å
225	E	97.6	Very high	96.6	Very high	53 Å²	53	92.7 Å²	92.7	25%	0.248	47%	0.474	C	S	.	.	H	α-helix	trans	-64.7	-40.7	173	173.6	61.3	-174.7	0	0	112.6	E221 E222 R228 R229	E221-E225 WeakPolarHBondContact O-CB 3.48Å; E221-E225 PolarHBondContact O-N 3.31Å; E222-E225 PolarHBondContact O-N 2.95Å; E225-R228 PolarHBondContact O-N 2.91Å; E225-R228 IonicContact OE1-CZ 2.71Å; E225-R228 IonicContact OE1-NH2 2.91Å; E225-R228 PolarHBondContact OE1-NH2 3.18Å; E225-R228 IonicContact OE2-CZ 2.62Å; E225-R228 IonicContact OE2-NE 2.69Å; E225-R228 PolarHBondContact OE2-NE 3.45Å; E225-R228 IonicContact OE2-NH2 3.93Å; E225-R228 PolarHBondContact OE2-NH2 2.84Å; E225-R229 VanDerWaalsContact CG-NH2 3.27Å; E225-R229 VanDerWaalsContact O-CG 3.28Å; E225-R229 WeakPolarHBondContact O-CG 3.13Å; E225-R229 PolarHBondContact O-N 3.02Å; E225-R229 IonicContact OE1-CZ 2.66Å; E225-R229 IonicContact OE1-NE 2.73Å; E225-R229 PolarHBondContact OE1-NE 2.71Å; E225-R229 IonicContact OE1-NH2 2.63Å; E225-R229 PolarHBondContact OE1-NH2 2.64Å
226	V	97.2	Very high	96.7	Very high	89 Å²	89	96 Å²	96	54%	0.539	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-41.3	173.4	168.1	0	0	0	0	111.2	E222 K223 R229 L230	E222-V226 WeakPolarHBondContact O-CB 3.4Å; E222-V226 WeakPolarHBondContact O-CG2 3.3Å; E222-V226 PolarHBondContact O-N 3.07Å; K223-V226 PolarHBondContact O-N 3.02Å; V226-R229 PolarHBondContact O-N 2.92Å; V226-L230 WeakPolarHBondContact O-CB 3.42Å; V226-L230 PolarHBondContact O-N 3.48Å
227	K	97.1	Very high	96.8	Very high	117 Å²	117	96.9 Å²	96.9	51%	0.509	48%	0.476	S	S	.	.	H	α-helix	trans	-59.7	-45.9	174.1	-179.8	177	178.1	-69.4	0	111.4	K223 E224 R229 L230 E231	K223-K227 WeakPolarHBondContact O-CB 3.26Å; K223-K227 PolarHBondContact O-N 3.06Å; E224-K227 PolarHBondContact O-N 3.2Å; K227-R229 PolarHBondContact O-N 3.28Å; K227-L230 WeakPolarHBondContact O-CB 3.43Å; K227-L230 PolarHBondContact O-N 3.4Å; K227-E231 WeakPolarHBondContact CE-OE1 3.33Å; K227-E231 IonicContact NZ-OE1 3.18Å; K227-E231 PolarHBondContact NZ-OE1 3.5Å; K227-E231 IonicContact NZ-OE2 2.73Å; K227-E231 WeakPolarHBondContact O-CG 3.46Å; K227-E231 PolarHBondContact O-N 2.99Å
228	R	97.9	Very high	96.9	Very high	117 Å²	117	94.9 Å²	94.9	44%	0.442	47%	0.471	S	S	.	.	H	α-helix	trans	-59.7	-45.5	175.5	-174.4	179.1	69.8	93.2	-11.2	112	E224 E225 L230 E231 E232	E224-R228 WeakPolarHBondContact O-CB 3.36Å; E224-R228 PolarHBondContact O-N 3.4Å; E225-R228 PolarHBondContact O-N 2.91Å; E225-R228 IonicContact OE1-CZ 2.71Å; E225-R228 IonicContact OE1-NH2 2.91Å; E225-R228 PolarHBondContact OE1-NH2 3.18Å; E225-R228 IonicContact OE2-CZ 2.62Å; E225-R228 IonicContact OE2-NE 2.69Å; E225-R228 PolarHBondContact OE2-NE 3.45Å; E225-R228 IonicContact OE2-NH2 3.93Å; E225-R228 PolarHBondContact OE2-NH2 2.84Å; R228-L230 VanDerWaalsContact C-N 3.31Å; R228-L230 PolarHBondContact O-N 3.24Å; R228-E231 PolarHBondContact O-N 3.17Å; R228-E232 IonicContact CZ-OE1 3.47Å; R228-E232 IonicContact NH1-OE1 3.62Å; R228-E232 PolarHBondContact NH1-OE1 3.13Å; R228-E232 WeakPolarHBondContact O-CG 3.45Å; R228-E232 PolarHBondContact O-N 3.16Å
229	R	97.8	Very high	96.9	Very high	140 Å²	140	98.2 Å²	98.2	53%	0.528	48%	0.479	S	S	.	.	H	α-helix	trans	-62.7	-36.2	176.2	-70.7	170.5	-170.1	173.5	7	112.7	E225 V226 K227 A233	E225-R229 VanDerWaalsContact CG-NH2 3.27Å; E225-R229 VanDerWaalsContact O-CG 3.28Å; E225-R229 WeakPolarHBondContact O-CG 3.13Å; E225-R229 PolarHBondContact O-N 3.02Å; E225-R229 IonicContact OE1-CZ 2.66Å; E225-R229 IonicContact OE1-NE 2.73Å; E225-R229 PolarHBondContact OE1-NE 2.71Å; E225-R229 IonicContact OE1-NH2 2.63Å; E225-R229 PolarHBondContact OE1-NH2 2.64Å; V226-R229 PolarHBondContact O-N 2.92Å; K227-R229 PolarHBondContact O-N 3.28Å; R229-A233 WeakPolarHBondContact O-CB 3.41Å; R229-A233 PolarHBondContact O-N 3.22Å
230	L	95.6	Very high	96.9	Very high	113 Å²	113	98.4 Å²	98.4	59%	0.592	48%	0.48	S	S	*	.	H	α-helix	trans	-67.1	-45.7	174.4	-179.5	62.3	0	0	0	111.2	V226 K227 R228 E232 A233 T234	V226-L230 WeakPolarHBondContact O-CB 3.42Å; V226-L230 PolarHBondContact O-N 3.48Å; K227-L230 WeakPolarHBondContact O-CB 3.43Å; K227-L230 PolarHBondContact O-N 3.4Å; R228-L230 VanDerWaalsContact C-N 3.31Å; R228-L230 PolarHBondContact O-N 3.24Å; L230-E232 PolarHBondContact O-N 2.96Å; L230-A233 WeakPolarHBondContact O-CA 3.48Å; L230-A233 WeakPolarHBondContact O-CB 3.45Å; L230-A233 PolarHBondContact O-N 3.29Å; L230-T234 PolarHBondContact O-N 3.45Å; L230-T234 PolarHBondContact O-OG1 3.32Å
231	E	96.9	Very high	96.9	Very high	103 Å²	103	99.7 Å²	99.7	48%	0.481	49%	0.486	S	S	.	.	H	α-helix	trans	-59.9	-44.3	175.7	-72.6	166.9	176.4	0	0	111.7	K227 R228 A233 T234 A235	K227-E231 WeakPolarHBondContact CE-OE1 3.33Å; K227-E231 IonicContact NZ-OE1 3.18Å; K227-E231 PolarHBondContact NZ-OE1 3.5Å; K227-E231 IonicContact NZ-OE2 2.73Å; K227-E231 WeakPolarHBondContact O-CG 3.46Å; K227-E231 PolarHBondContact O-N 2.99Å; R228-E231 PolarHBondContact O-N 3.17Å; E231-A233 VanDerWaalsContact C-N 3.3Å; E231-A233 PolarHBondContact O-N 2.97Å; E231-T234 PolarHBondContact O-N 3.34Å; E231-A235 WeakPolarHBondContact O-CB 3.37Å; E231-A235 PolarHBondContact O-N 3.14Å
232	E	97.9	Very high	96.9	Very high	73 Å²	73	100.8 Å²	100.8	34%	0.341	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-32.9	172.4	-69.6	172.7	-163.9	0	0	113	R228 L230 R236	R228-E232 IonicContact CZ-OE1 3.47Å; R228-E232 IonicContact NH1-OE1 3.62Å; R228-E232 PolarHBondContact NH1-OE1 3.13Å; R228-E232 WeakPolarHBondContact O-CG 3.45Å; R228-E232 PolarHBondContact O-N 3.16Å; L230-E232 PolarHBondContact O-N 2.96Å; E232-R236 VanDerWaalsContact C-NH2 3.35Å; E232-R236 VanDerWaalsContact CB-NH2 3.28Å; E232-R236 WeakPolarHBondContact O-CG 3.47Å; E232-R236 PolarHBondContact O-N 3.37Å; E232-R236 PolarHBondContact O-NE 3.49Å; E232-R236 PolarHBondContact O-NH2 3.31Å; E232-R236 IonicContact OE2-NH2 3.34Å
233	A	96.4	Very high	96.9	Very high	36 Å²	36	98.7 Å²	98.7	30%	0.298	48%	0.484	S	S	.	.	H	α-helix	trans	-71.3	-46.4	176	0	0	0	0	0	111.3	R229 L230 E231 A235 R236 I237	R229-A233 WeakPolarHBondContact O-CB 3.41Å; R229-A233 PolarHBondContact O-N 3.22Å; L230-A233 WeakPolarHBondContact O-CA 3.48Å; L230-A233 WeakPolarHBondContact O-CB 3.45Å; L230-A233 PolarHBondContact O-N 3.29Å; E231-A233 VanDerWaalsContact C-N 3.3Å; E231-A233 PolarHBondContact O-N 2.97Å; A233-A235 PolarHBondContact O-N 2.66Å; A233-R236 PolarHBondContact O-N 2.71Å; A233-R236 VanDerWaalsContact O-N 3.17Å; A233-I237 WeakPolarHBondContact O-CG1 3.28Å; A233-I237 PolarHBondContact O-N 3.43Å
234	T	96.1	Very high	97	Very high	72 Å²	72	97.5 Å²	97.5	44%	0.442	48%	0.483	S	S	.	.	H	α-helix	trans	-60	-44	175.3	-58.2	0	0	0	0	111.5	L230 E231 R236 I237 V238	L230-T234 PolarHBondContact O-N 3.45Å; L230-T234 PolarHBondContact O-OG1 3.32Å; E231-T234 PolarHBondContact O-N 3.34Å; T234-R236 VanDerWaalsContact C-N 3.29Å; T234-R236 PolarHBondContact O-N 2.99Å; T234-I237 PolarHBondContact O-N 3.38Å; T234-I237 VanDerWaalsContact O-N 3.1Å; T234-V238 WeakPolarHBondContact O-CG2 3.4Å; T234-V238 PolarHBondContact O-N 3Å
235	A	97.6	Very high	97	Very high	62 Å²	62	97.5 Å²	97.5	51%	0.512	49%	0.486	S	S	.	.	H	α-helix	trans	-60.1	-38.3	175.6	0	0	0	0	0	112.6	E231 A233 Q239	E231-A235 WeakPolarHBondContact O-CB 3.37Å; E231-A235 PolarHBondContact O-N 3.14Å; A233-A235 PolarHBondContact O-N 2.66Å; A235-Q239 WeakPolarHBondContact O-CB 3.43Å; A235-Q239 PolarHBondContact O-N 2.86Å
236	R	97.9	Very high	97	Very high	131 Å²	131	95.8 Å²	95.8	49%	0.494	48%	0.482	S	S	.	.	H	α-helix	trans	-69.6	-33.2	173.9	-77.9	173.5	-73.1	-155.3	-5	112.9	E232 A233 T234 L240	E232-R236 VanDerWaalsContact C-NH2 3.35Å; E232-R236 VanDerWaalsContact CB-NH2 3.28Å; E232-R236 WeakPolarHBondContact O-CG 3.47Å; E232-R236 PolarHBondContact O-N 3.37Å; E232-R236 PolarHBondContact O-NE 3.49Å; E232-R236 PolarHBondContact O-NH2 3.31Å; E232-R236 IonicContact OE2-NH2 3.34Å; A233-R236 PolarHBondContact O-N 2.71Å; A233-R236 VanDerWaalsContact O-N 3.17Å; T234-R236 VanDerWaalsContact C-N 3.29Å; T234-R236 PolarHBondContact O-N 2.99Å; R236-L240 WeakPolarHBondContact O-CB 3.32Å; R236-L240 VanDerWaalsContact O-CG 3.24Å; R236-L240 WeakPolarHBondContact O-CG 3.48Å; R236-L240 PolarHBondContact O-N 3.36Å
237	I	96.6	Very high	96.9	Very high	92 Å²	92	95.8 Å²	95.8	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-51.3	173.8	-69.5	165.6	0	0	0	109.8	A233 T234 Q239 L240 E241	A233-I237 WeakPolarHBondContact O-CG1 3.28Å; A233-I237 PolarHBondContact O-N 3.43Å; T234-I237 PolarHBondContact O-N 3.38Å; T234-I237 VanDerWaalsContact O-N 3.1Å; I237-Q239 VanDerWaalsContact C-N 3.31Å; I237-Q239 PolarHBondContact O-N 2.91Å; I237-L240 CarbonylContact O-C 3.59Å; I237-L240 PolarHBondContact O-N 2.9Å; I237-E241 HydrophobicContact CG2-CG 4.39Å; I237-E241 WeakPolarHBondContact O-CG 3.34Å; I237-E241 PolarHBondContact O-N 2.93Å
238	V	97.4	Very high	96.8	Very high	68 Å²	68	94.2 Å²	94.2	41%	0.412	48%	0.483	S	S	.	.	H	α-helix	trans	-57.5	-43.2	177.8	175.1	0	0	0	0	111.4	T234 L240 E241 E242	T234-V238 WeakPolarHBondContact O-CG2 3.4Å; T234-V238 PolarHBondContact O-N 3Å; V238-L240 VanDerWaalsContact C-N 3.34Å; V238-L240 PolarHBondContact O-N 3.47Å; V238-E241 WeakPolarHBondContact O-CB 3.36Å; V238-E241 PolarHBondContact O-N 3.34Å; V238-E242 WeakPolarHBondContact O-CG 3.22Å; V238-E242 PolarHBondContact O-N 3.36Å
239	Q	97.3	Very high	96.7	Very high	115 Å²	115	95.3 Å²	95.3	54%	0.537	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-39.4	175.6	-173	178.7	2.7	0	0	112.6	A235 I237 E242 D243	A235-Q239 WeakPolarHBondContact O-CB 3.43Å; A235-Q239 PolarHBondContact O-N 2.86Å; I237-Q239 VanDerWaalsContact C-N 3.31Å; I237-Q239 PolarHBondContact O-N 2.91Å; Q239-E242 PolarHBondContact O-N 2.68Å; Q239-D243 WeakPolarHBondContact O-CB 3.32Å; Q239-D243 PolarHBondContact O-N 3.4Å
240	L	96.3	Very high	96.6	Very high	117 Å²	117	94.9 Å²	94.9	61%	0.613	50%	0.495	S	S	*	.	H	α-helix	trans	-71.3	-30	176.6	-72.3	169.5	0	0	0	112.6	R236 I237 V238 L244	R236-L240 WeakPolarHBondContact O-CB 3.32Å; R236-L240 VanDerWaalsContact O-CG 3.24Å; R236-L240 WeakPolarHBondContact O-CG 3.48Å; R236-L240 PolarHBondContact O-N 3.36Å; I237-L240 CarbonylContact O-C 3.59Å; I237-L240 PolarHBondContact O-N 2.9Å; V238-L240 VanDerWaalsContact C-N 3.34Å; V238-L240 PolarHBondContact O-N 3.47Å; L240-L244 WeakPolarHBondContact O-CB 3.47Å; L240-L244 PolarHBondContact O-N 3.38Å
241	E	95.6	Very high	96.6	Very high	105 Å²	105	91.4 Å²	91.4	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-68.1	-44.4	171.3	-70	171.7	161.3	0	0	111	I237 V238 L244 I245	I237-E241 HydrophobicContact CG2-CG 4.39Å; I237-E241 WeakPolarHBondContact O-CG 3.34Å; I237-E241 PolarHBondContact O-N 2.93Å; V238-E241 WeakPolarHBondContact O-CB 3.36Å; V238-E241 PolarHBondContact O-N 3.34Å; E241-L244 PolarHBondContact O-N 2.96Å; E241-I245 WeakPolarHBondContact O-CD1 3.36Å; E241-I245 VanDerWaalsContact O-CG1 3.26Å; E241-I245 WeakPolarHBondContact O-CG1 3.45Å; E241-I245 PolarHBondContact O-N 3.45Å
242	E	97.2	Very high	96.6	Very high	131 Å²	131	91.6 Å²	91.6	61%	0.612	49%	0.49	S	S	*	.	H	α-helix	trans	-60.4	-46	172.7	-72.5	-178.7	173.7	0	0	112.2	V238 Q239 L244 I245 G246	V238-E242 WeakPolarHBondContact O-CG 3.22Å; V238-E242 PolarHBondContact O-N 3.36Å; Q239-E242 PolarHBondContact O-N 2.68Å; E242-L244 PolarHBondContact O-N 2.84Å; E242-I245 PolarHBondContact O-N 2.93Å; E242-G246 PolarHBondContact O-N 3.3Å
243	D	97.3	Very high	96.5	Very high	92 Å²	92	93.3 Å²	93.3	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-39.1	175.5	-92.7	-34.4	0	0	0	111.7	Q239 G246 V247	Q239-D243 WeakPolarHBondContact O-CB 3.32Å; Q239-D243 PolarHBondContact O-N 3.4Å; D243-G246 CarbonylContact O-C 3.59Å; D243-G246 PolarHBondContact O-N 3.08Å; D243-V247 WeakPolarHBondContact O-CB 3.33Å; D243-V247 VanDerWaalsContact O-CG2 3.31Å; D243-V247 WeakPolarHBondContact O-CG2 3.39Å; D243-V247 PolarHBondContact O-N 3.02Å
244	L	96.1	Very high	96.4	Very high	109 Å²	109	97.3 Å²	97.3	57%	0.571	51%	0.509	S	S	*	.	H	α-helix	trans	-66.5	-40.7	176.2	-179.2	61.7	0	0	0	112	L240 E241 E242 G246 V247 T248	L240-L244 WeakPolarHBondContact O-CB 3.47Å; L240-L244 PolarHBondContact O-N 3.38Å; E241-L244 PolarHBondContact O-N 2.96Å; E242-L244 PolarHBondContact O-N 2.84Å; L244-G246 VanDerWaalsContact C-N 3.34Å; L244-V247 PolarHBondContact O-N 3.36Å; L244-T248 HydrophobicContact CD1-CG2 4.2Å; L244-T248 WeakPolarHBondContact O-CB 3.49Å; L244-T248 WeakPolarHBondContact O-CG2 3.47Å; L244-T248 PolarHBondContact O-N 3.3Å; L244-T248 PolarHBondContact O-OG1 2.93Å
245	I	97.1	Very high	96.3	Very high	112 Å²	112	99.4 Å²	99.4	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-61.5	-45	171.4	-69.6	163.3	0	0	0	109.7	E241 E242 V247 T248 Q249	E241-I245 WeakPolarHBondContact O-CD1 3.36Å; E241-I245 VanDerWaalsContact O-CG1 3.26Å; E241-I245 WeakPolarHBondContact O-CG1 3.45Å; E241-I245 PolarHBondContact O-N 3.45Å; E242-I245 PolarHBondContact O-N 2.93Å; I245-V247 VanDerWaalsContact C-N 3.35Å; I245-V247 PolarHBondContact O-N 3.28Å; I245-T248 WeakPolarHBondContact CA-OG1 3.24Å; I245-T248 PolarHBondContact O-N 2.89Å; I245-T248 PolarHBondContact O-OG1 3.22Å; I245-T248 VanDerWaalsContact O-OG1 3.08Å; I245-Q249 VanDerWaalsContact O-CB 3.3Å; I245-Q249 WeakPolarHBondContact O-CB 3.15Å; I245-Q249 PolarHBondContact O-N 3.15Å
246	G	96.9	Very high	96.2	Very high	17 Å²	17	100.4 Å²	100.4	18%	0.175	51%	0.514	C	S	.	.	H	α-helix	trans	-63.4	-34.9	176.7	0	0	0	0	0	113.9	E242 D243 L244 K250	E242-G246 PolarHBondContact O-N 3.3Å; D243-G246 CarbonylContact O-C 3.59Å; D243-G246 PolarHBondContact O-N 3.08Å; L244-G246 VanDerWaalsContact C-N 3.34Å; G246-K250 WeakPolarHBondContact O-CD 3.47Å; G246-K250 WeakPolarHBondContact O-CE 3.41Å; G246-K250 WeakPolarHBondContact O-CG 3.41Å; G246-K250 PolarHBondContact O-N 2.85Å
247	V	96.6	Very high	96.1	Very high	90 Å²	90	97.7 Å²	97.7	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-75.6	-44.1	175.9	167.3	0	0	0	0	111.5	D243 L244 I245 K250 G251	D243-V247 WeakPolarHBondContact O-CB 3.33Å; D243-V247 VanDerWaalsContact O-CG2 3.31Å; D243-V247 WeakPolarHBondContact O-CG2 3.39Å; D243-V247 PolarHBondContact O-N 3.02Å; L244-V247 PolarHBondContact O-N 3.36Å; I245-V247 VanDerWaalsContact C-N 3.35Å; I245-V247 PolarHBondContact O-N 3.28Å; V247-K250 PolarHBondContact O-N 3.21Å; V247-G251 PolarHBondContact O-N 2.94Å
248	T	93.8	Very high	96	Very high	84 Å²	84	97.7 Å²	97.7	52%	0.515	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-39.4	178.7	49.9	0	0	0	0	111.9	L244 I245 K250 G251 L252	L244-T248 HydrophobicContact CD1-CG2 4.2Å; L244-T248 WeakPolarHBondContact O-CB 3.49Å; L244-T248 WeakPolarHBondContact O-CG2 3.47Å; L244-T248 PolarHBondContact O-N 3.3Å; L244-T248 PolarHBondContact O-OG1 2.93Å; I245-T248 WeakPolarHBondContact CA-OG1 3.24Å; I245-T248 PolarHBondContact O-N 2.89Å; I245-T248 PolarHBondContact O-OG1 3.22Å; I245-T248 VanDerWaalsContact O-OG1 3.08Å; T248-K250 PolarHBondContact O-N 2.88Å; T248-G251 PolarHBondContact O-N 3.02Å; T248-L252 PolarHBondContact O-N 3.39Å
249	Q	96.1	Very high	95.9	Very high	139 Å²	139	97.7 Å²	97.7	65%	0.65	51%	0.505	S	S	*	.	H	α-helix	trans	-61.5	-43.3	172.6	-169.3	-175.6	33.3	0	0	112.2	I245 G251 L252 Q253	I245-Q249 VanDerWaalsContact O-CB 3.3Å; I245-Q249 WeakPolarHBondContact O-CB 3.15Å; I245-Q249 PolarHBondContact O-N 3.15Å; Q249-G251 VanDerWaalsContact C-N 3.32Å; Q249-G251 PolarHBondContact O-N 3.43Å; Q249-L252 PolarHBondContact O-N 2.84Å; Q249-Q253 PolarHBondContact O-N 3.45Å
250	K	96.6	Very high	95.8	Very high	131 Å²	131	95.2 Å²	95.2	57%	0.57	50%	0.5	S	S	*	.	H	α-helix	trans	-63.7	-37.3	173.7	-71.6	162.9	-164.1	157	0	111.8	G246 V247 T248 Q253 K254	G246-K250 WeakPolarHBondContact O-CD 3.47Å; G246-K250 WeakPolarHBondContact O-CE 3.41Å; G246-K250 WeakPolarHBondContact O-CG 3.41Å; G246-K250 PolarHBondContact O-N 2.85Å; V247-K250 PolarHBondContact O-N 3.21Å; T248-K250 PolarHBondContact O-N 2.88Å; K250-Q253 PolarHBondContact O-N 3.25Å; K250-K254 WeakPolarHBondContact O-CG 3.5Å; K250-K254 PolarHBondContact O-N 2.93Å
251	G	95.8	Very high	95.8	Very high	40 Å²	40	94.2 Å²	94.2	41%	0.412	50%	0.495	S	S	.	.	H	α-helix	trans	-59.3	-52.7	173.5	0	0	0	0	0	112	V247 T248 Q249 Q253 K254 E255	V247-G251 PolarHBondContact O-N 2.94Å; T248-G251 PolarHBondContact O-N 3.02Å; Q249-G251 VanDerWaalsContact C-N 3.32Å; Q249-G251 PolarHBondContact O-N 3.43Å; G251-Q253 VanDerWaalsContact C-N 3.3Å; G251-Q253 PolarHBondContact O-N 2.91Å; G251-K254 CarbonylContact O-C 3.6Å; G251-K254 WeakPolarHBondContact O-CA 3.36Å; G251-K254 PolarHBondContact O-N 3.36Å; G251-E255 PolarHBondContact O-N 2.9Å
252	L	95.9	Very high	95.8	Very high	107 Å²	107	94 Å²	94	56%	0.56	49%	0.492	S	S	*	.	H	α-helix	trans	-60.9	-36.9	176.9	-174.8	66	0	0	0	112.4	T248 Q249 K254 E255 T256	T248-L252 PolarHBondContact O-N 3.39Å; Q249-L252 PolarHBondContact O-N 2.84Å; L252-K254 VanDerWaalsContact C-N 3.34Å; L252-E255 PolarHBondContact O-N 3.19Å; L252-T256 WeakPolarHBondContact O-CG2 3.26Å; L252-T256 PolarHBondContact O-N 2.9Å; L252-T256 PolarHBondContact O-OG1 3.37Å
253	Q	95.3	Very high	95.8	Very high	110 Å²	110	92 Å²	92	51%	0.514	49%	0.486	S	S	.	.	H	α-helix	trans	-63.2	-39.2	172.4	-171.7	178.5	6.1	0	0	111.8	Q249 K250 G251 T256 E257	Q249-Q253 PolarHBondContact O-N 3.45Å; K250-Q253 PolarHBondContact O-N 3.25Å; G251-Q253 VanDerWaalsContact C-N 3.3Å; G251-Q253 PolarHBondContact O-N 2.91Å; Q253-T256 WeakPolarHBondContact CA-OG1 3.5Å; Q253-T256 PolarHBondContact O-OG1 3.26Å; Q253-T256 VanDerWaalsContact O-OG1 3.08Å; Q253-E257 WeakPolarHBondContact O-CB 3.49Å; Q253-E257 WeakPolarHBondContact O-CG 3.38Å; Q253-E257 PolarHBondContact O-N 3.26Å
254	K	95.9	Very high	95.7	Very high	119 Å²	119	95.8 Å²	95.8	52%	0.517	49%	0.493	S	S	.	.	H	α-helix	trans	-75	-29.8	176	-66.4	-42	-173.1	-171.3	0	113.9	K250 G251 L252 E257 L258	K250-K254 WeakPolarHBondContact O-CG 3.5Å; K250-K254 PolarHBondContact O-N 2.93Å; G251-K254 CarbonylContact O-C 3.6Å; G251-K254 WeakPolarHBondContact O-CA 3.36Å; G251-K254 PolarHBondContact O-N 3.36Å; L252-K254 VanDerWaalsContact C-N 3.34Å; K254-E257 VanDerWaalsContact CD-OE2 3.31Å; K254-E257 WeakPolarHBondContact CD-OE2 3.47Å; K254-E257 IonicContact NZ-OE1 2.64Å; K254-E257 PolarHBondContact NZ-OE1 3.32Å; K254-E257 IonicContact NZ-OE2 3.16Å; K254-E257 PolarHBondContact NZ-OE2 3.3Å; K254-L258 WeakPolarHBondContact O-CB 3.48Å; K254-L258 PolarHBondContact O-N 2.87Å
255	E	94.2	Very high	95.7	Very high	116 Å²	116	96.6 Å²	96.6	54%	0.542	50%	0.497	S	S	.	.	H	α-helix	trans	-66.7	-46.8	171.3	-173.9	162.8	-143.2	0	0	111.5	G251 L252 L258 D259	G251-E255 PolarHBondContact O-N 2.9Å; L252-E255 PolarHBondContact O-N 3.19Å; E255-L258 CarbonylContact O-C 3.52Å; E255-L258 PolarHBondContact O-N 3.39Å; E255-L258 VanDerWaalsContact O-N 3.16Å; E255-D259 PolarHBondContact O-N 3.37Å
256	T	94.3	Very high	95.7	Very high	84 Å²	84	97 Å²	97	52%	0.515	50%	0.495	S	S	.	.	H	α-helix	trans	-67.4	-37.6	176.6	49.8	0	0	0	0	113.3	L252 Q253 L258 S260	L252-T256 WeakPolarHBondContact O-CG2 3.26Å; L252-T256 PolarHBondContact O-N 2.9Å; L252-T256 PolarHBondContact O-OG1 3.37Å; Q253-T256 WeakPolarHBondContact CA-OG1 3.5Å; Q253-T256 PolarHBondContact O-OG1 3.26Å; Q253-T256 VanDerWaalsContact O-OG1 3.08Å; T256-L258 VanDerWaalsContact C-N 3.35Å; T256-S260 PolarHBondContact O-N 2.69Å
257	E	96	Very high	95.6	Very high	74 Å²	74	102.2 Å²	102.2	35%	0.346	51%	0.513	S	S	.	.	H	α-helix	trans	-57.3	-47.7	167.1	-81.4	175.7	-144.7	0	0	111.2	Q253 K254 S260 L261	Q253-E257 WeakPolarHBondContact O-CB 3.49Å; Q253-E257 WeakPolarHBondContact O-CG 3.38Å; Q253-E257 PolarHBondContact O-N 3.26Å; K254-E257 VanDerWaalsContact CD-OE2 3.31Å; K254-E257 WeakPolarHBondContact CD-OE2 3.47Å; K254-E257 IonicContact NZ-OE1 2.64Å; K254-E257 PolarHBondContact NZ-OE1 3.32Å; K254-E257 IonicContact NZ-OE2 3.16Å; K254-E257 PolarHBondContact NZ-OE2 3.3Å; E257-S260 PolarHBondContact O-N 2.76Å; E257-S260 PolarHBondContact O-OG 3.46Å; E257-L261 WeakPolarHBondContact O-CG 3.36Å; E257-L261 PolarHBondContact O-N 3.13Å
258	L	94.8	Very high	95.6	Very high	91 Å²	91	102.2 Å²	102.2	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-66.6	-36.4	-177.5	179.4	146.6	0	0	0	112.4	K254 E255 T256 L261 K262	K254-L258 WeakPolarHBondContact O-CB 3.48Å; K254-L258 PolarHBondContact O-N 2.87Å; E255-L258 CarbonylContact O-C 3.52Å; E255-L258 PolarHBondContact O-N 3.39Å; E255-L258 VanDerWaalsContact O-N 3.16Å; T256-L258 VanDerWaalsContact C-N 3.35Å; L258-L261 WeakPolarHBondContact O-CB 3.31Å; L258-L261 PolarHBondContact O-N 3.02Å; L258-K262 HydrophobicContact CD2-CD 4.29Å; L258-K262 HydrophobicContact CD2-CG 4.46Å; L258-K262 WeakPolarHBondContact O-CG 3.43Å; L258-K262 PolarHBondContact O-N 3.08Å
259	D	95.4	Very high	95.7	Very high	69 Å²	69	100 Å²	100	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-68.8	-39.5	172.7	-82.7	-2.2	0	0	0	112.4	E255 L261 K262 D263	E255-D259 PolarHBondContact O-N 3.37Å; D259-L261 PolarHBondContact O-N 2.97Å; D259-K262 WeakPolarHBondContact O-CB 3.5Å; D259-K262 PolarHBondContact O-N 2.85Å; D259-K262 VanDerWaalsContact O-N 3.11Å; D259-K262 VanDerWaalsContact OD1-CD 3.31Å; D259-K262 WeakPolarHBondContact OD1-CD 3.47Å; D259-K262 WeakPolarHBondContact OD1-CE 3.36Å; D259-K262 IonicContact OD1-NZ 2.69Å; D259-K262 PolarHBondContact OD1-NZ 3.3Å; D259-D263 PolarHBondContact O-N 3.06Å
260	S	95.5	Very high	95.6	Very high	62 Å²	62	98.8 Å²	98.8	43%	0.434	50%	0.5	S	S	.	.	H	α-helix	trans	-59.9	-32.7	171.4	85.7	0	0	0	0	112.2	T256 E257 R264	T256-S260 PolarHBondContact O-N 2.69Å; E257-S260 PolarHBondContact O-N 2.76Å; E257-S260 PolarHBondContact O-OG 3.46Å; S260-R264 WeakPolarHBondContact O-CB 3.42Å; S260-R264 VanDerWaalsContact O-CG 3.25Å; S260-R264 WeakPolarHBondContact O-CG 3.4Å; S260-R264 PolarHBondContact O-N 3.02Å; S260-R264 VanDerWaalsContact O-N 3.09Å
261	L	96.1	Very high	95.6	Very high	97 Å²	97	96.6 Å²	96.6	51%	0.508	49%	0.492	S	S	.	.	H	α-helix	trans	-75.7	-37.8	174.3	-68.2	172.2	0	0	0	112.3	E257 L258 D259 D263 L265	E257-L261 WeakPolarHBondContact O-CG 3.36Å; E257-L261 PolarHBondContact O-N 3.13Å; L258-L261 WeakPolarHBondContact O-CB 3.31Å; L258-L261 PolarHBondContact O-N 3.02Å; D259-L261 PolarHBondContact O-N 2.97Å; L261-D263 VanDerWaalsContact C-N 3.34Å; L261-D263 PolarHBondContact O-N 3.37Å; L261-L265 VanDerWaalsContact O-CB 3.31Å; L261-L265 WeakPolarHBondContact O-CB 3.48Å; L261-L265 PolarHBondContact O-N 3.43Å
262	K	95.6	Very high	95.6	Very high	101 Å²	101	100 Å²	100	44%	0.439	50%	0.496	S	S	.	.	H	α-helix	trans	-57.1	-47.4	170.3	-72.4	176.9	-170.5	145.8	0	110.7	L258 D259 L265 K266	L258-K262 HydrophobicContact CD2-CD 4.29Å; L258-K262 HydrophobicContact CD2-CG 4.46Å; L258-K262 WeakPolarHBondContact O-CG 3.43Å; L258-K262 PolarHBondContact O-N 3.08Å; D259-K262 WeakPolarHBondContact O-CB 3.5Å; D259-K262 PolarHBondContact O-N 2.85Å; D259-K262 VanDerWaalsContact O-N 3.11Å; D259-K262 VanDerWaalsContact OD1-CD 3.31Å; D259-K262 WeakPolarHBondContact OD1-CD 3.47Å; D259-K262 WeakPolarHBondContact OD1-CE 3.36Å; D259-K262 IonicContact OD1-NZ 2.69Å; D259-K262 PolarHBondContact OD1-NZ 3.3Å; K262-L265 CarbonylContact O-C 3.59Å; K262-L265 WeakPolarHBondContact O-CB 3.49Å; K262-L265 PolarHBondContact O-N 3.26Å; K262-L265 VanDerWaalsContact O-N 3.15Å; K262-K266 WeakPolarHBondContact O-CG 3.25Å; K262-K266 PolarHBondContact O-N 3.22Å
263	D	96.1	Very high	95.6	Very high	89 Å²	89	100.5 Å²	100.5	48%	0.476	50%	0.495	S	S	.	.	H	α-helix	trans	-71.3	-36.6	-176.6	-77.5	-6.4	0	0	0	112.8	D259 L261 L265 K266 K267	D259-D263 PolarHBondContact O-N 3.06Å; L261-D263 VanDerWaalsContact C-N 3.34Å; L261-D263 PolarHBondContact O-N 3.37Å; D263-L265 VanDerWaalsContact C-N 3.3Å; D263-L265 PolarHBondContact O-N 3.5Å; D263-K266 PolarHBondContact O-N 2.89Å; D263-K266 WeakPolarHBondContact OD1-CD 3.45Å; D263-K266 VanDerWaalsContact OD1-CE 3.31Å; D263-K266 WeakPolarHBondContact OD1-CE 3.45Å; D263-K266 IonicContact OD1-NZ 2.61Å; D263-K266 PolarHBondContact OD1-NZ 3.28Å; D263-K267 PolarHBondContact O-N 2.92Å
264	R	96.4	Very high	95.6	Very high	170 Å²	170	98.1 Å²	98.1	64%	0.642	49%	0.494	S	S	*	.	H	α-helix	trans	-60.1	-40.2	167.3	-74.6	174.1	64	-161.8	-2	111.9	S260 K267 V268	S260-R264 WeakPolarHBondContact O-CB 3.42Å; S260-R264 VanDerWaalsContact O-CG 3.25Å; S260-R264 WeakPolarHBondContact O-CG 3.4Å; S260-R264 PolarHBondContact O-N 3.02Å; S260-R264 VanDerWaalsContact O-N 3.09Å; R264-K267 PolarHBondContact O-N 3.21Å; R264-V268 WeakPolarHBondContact O-CG2 3.47Å; R264-V268 PolarHBondContact O-N 3.28Å
265	L	95.1	Very high	95.6	Very high	127 Å²	127	97.9 Å²	97.9	67%	0.665	50%	0.498	S	S	*	.	H	α-helix	trans	-69.7	-39.4	178	-173.6	139.3	0	0	0	112.3	L261 K262 D263 V268 A269	L261-L265 VanDerWaalsContact O-CB 3.31Å; L261-L265 WeakPolarHBondContact O-CB 3.48Å; L261-L265 PolarHBondContact O-N 3.43Å; K262-L265 CarbonylContact O-C 3.59Å; K262-L265 WeakPolarHBondContact O-CB 3.49Å; K262-L265 PolarHBondContact O-N 3.26Å; K262-L265 VanDerWaalsContact O-N 3.15Å; D263-L265 VanDerWaalsContact C-N 3.3Å; D263-L265 PolarHBondContact O-N 3.5Å; L265-V268 PolarHBondContact O-N 3.29Å; L265-A269 WeakPolarHBondContact O-CB 3.43Å; L265-A269 PolarHBondContact O-N 3.06Å
266	K	96.5	Very high	95.6	Very high	121 Å²	121	97.4 Å²	97.4	53%	0.526	50%	0.496	S	S	.	.	H	α-helix	trans	-57.5	-46.6	169.3	-68	171.5	-163.9	164.3	0	111	K262 D263 A269 L270	K262-K266 WeakPolarHBondContact O-CG 3.25Å; K262-K266 PolarHBondContact O-N 3.22Å; D263-K266 PolarHBondContact O-N 2.89Å; D263-K266 WeakPolarHBondContact OD1-CD 3.45Å; D263-K266 VanDerWaalsContact OD1-CE 3.31Å; D263-K266 WeakPolarHBondContact OD1-CE 3.45Å; D263-K266 IonicContact OD1-NZ 2.61Å; D263-K266 PolarHBondContact OD1-NZ 3.28Å; K266-A269 WeakPolarHBondContact O-CB 3.38Å; K266-A269 PolarHBondContact O-N 2.74Å; K266-L270 WeakPolarHBondContact O-CG 3.36Å; K266-L270 PolarHBondContact O-N 2.89Å
267	K	96.5	Very high	95.7	Very high	126 Å²	126	96.3 Å²	96.3	55%	0.548	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-46.4	178.7	-172	173.7	-173.7	-84.6	0	111.9	D263 R264 A269 L270 E271	D263-K267 PolarHBondContact O-N 2.92Å; R264-K267 PolarHBondContact O-N 3.21Å; K267-A269 VanDerWaalsContact C-N 3.3Å; K267-A269 PolarHBondContact O-N 3.46Å; K267-L270 PolarHBondContact O-N 3.31Å; K267-E271 IonicContact NZ-OE1 2.7Å; K267-E271 PolarHBondContact NZ-OE1 2.87Å; K267-E271 WeakPolarHBondContact O-CB 3.35Å; K267-E271 WeakPolarHBondContact O-CG 3.47Å; K267-E271 PolarHBondContact O-N 3.42Å
268	V	96	Very high	95.7	Very high	90 Å²	90	97.9 Å²	97.9	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-32.8	176.7	171.4	0	0	0	0	111.9	R264 L265 K272	R264-V268 WeakPolarHBondContact O-CG2 3.47Å; R264-V268 PolarHBondContact O-N 3.28Å; L265-V268 PolarHBondContact O-N 3.29Å; V268-K272 VanDerWaalsContact O-CB 3.28Å; V268-K272 WeakPolarHBondContact O-CB 3.35Å; V268-K272 PolarHBondContact O-N 2.89Å
269	A	94.9	Very high	95.7	Very high	38 Å²	38	96.8 Å²	96.8	31%	0.314	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-45.4	172.7	0	0	0	0	0	112	L265 K266 K267 K272 E273	L265-A269 WeakPolarHBondContact O-CB 3.43Å; L265-A269 PolarHBondContact O-N 3.06Å; K266-A269 WeakPolarHBondContact O-CB 3.38Å; K266-A269 PolarHBondContact O-N 2.74Å; K267-A269 VanDerWaalsContact C-N 3.3Å; K267-A269 PolarHBondContact O-N 3.46Å; A269-K272 WeakPolarHBondContact O-CB 3.44Å; A269-K272 PolarHBondContact O-N 3.47Å; A269-E273 WeakPolarHBondContact O-CG 3.27Å; A269-E273 PolarHBondContact O-N 3.15Å
270	L	95.8	Very high	95.7	Very high	113 Å²	113	99.3 Å²	99.3	59%	0.592	50%	0.503	S	S	*	.	H	α-helix	trans	-64.9	-39.7	175.5	-67.8	170.5	0	0	0	112.4	K266 K267 K272 E273 A274	K266-L270 WeakPolarHBondContact O-CG 3.36Å; K266-L270 PolarHBondContact O-N 2.89Å; K267-L270 PolarHBondContact O-N 3.31Å; L270-K272 VanDerWaalsContact C-N 3.34Å; L270-E273 PolarHBondContact O-N 3.43Å; L270-A274 WeakPolarHBondContact O-CB 3.49Å; L270-A274 PolarHBondContact O-N 3.39Å
271	E	95.8	Very high	95.7	Very high	85 Å²	85	100 Å²	100	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-62.9	-40.2	173.2	-73.6	170.6	173.8	0	0	111.5	K267 L275	K267-E271 IonicContact NZ-OE1 2.7Å; K267-E271 PolarHBondContact NZ-OE1 2.87Å; K267-E271 WeakPolarHBondContact O-CB 3.35Å; K267-E271 WeakPolarHBondContact O-CG 3.47Å; K267-E271 PolarHBondContact O-N 3.42Å; E271-L275 WeakPolarHBondContact O-CB 3.43Å; E271-L275 VanDerWaalsContact O-CG 3.29Å; E271-L275 WeakPolarHBondContact O-CG 3.42Å; E271-L275 PolarHBondContact O-N 3.43Å
272	K	95.3	Very high	95.6	Very high	111 Å²	111	100.6 Å²	100.6	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-48.1	173.2	176.6	-172.7	175.6	-77.6	0	111.8	V268 A269 L270 A274 L275 E276	V268-K272 VanDerWaalsContact O-CB 3.28Å; V268-K272 WeakPolarHBondContact O-CB 3.35Å; V268-K272 PolarHBondContact O-N 2.89Å; A269-K272 WeakPolarHBondContact O-CB 3.44Å; A269-K272 PolarHBondContact O-N 3.47Å; L270-K272 VanDerWaalsContact C-N 3.34Å; K272-A274 VanDerWaalsContact C-N 3.33Å; K272-A274 PolarHBondContact O-N 2.96Å; K272-L275 PolarHBondContact O-N 2.86Å; K272-E276 VanDerWaalsContact CE-OE1 3.26Å; K272-E276 WeakPolarHBondContact CE-OE1 3.42Å; K272-E276 HydrophobicContact CG-CG 4.43Å; K272-E276 IonicContact NZ-OE1 3.2Å; K272-E276 PolarHBondContact NZ-OE1 3.05Å; K272-E276 IonicContact NZ-OE2 3.09Å; K272-E276 PolarHBondContact NZ-OE2 3.33Å; K272-E276 WeakPolarHBondContact O-CB 3.44Å; K272-E276 WeakPolarHBondContact O-CG 3.48Å; K272-E276 PolarHBondContact O-N 3.37Å
273	E	96.1	Very high	95.5	Very high	118 Å²	118	103.8 Å²	103.8	55%	0.551	51%	0.512	S	S	*	.	H	α-helix	trans	-62.8	-39.8	179.4	-74.6	172	-171.6	0	0	111.7	A269 L270 E276 S277	A269-E273 WeakPolarHBondContact O-CG 3.27Å; A269-E273 PolarHBondContact O-N 3.15Å; L270-E273 PolarHBondContact O-N 3.43Å; E273-E276 PolarHBondContact O-N 3.4Å; E273-S277 VanDerWaalsContact O-CB 3.32Å; E273-S277 WeakPolarHBondContact O-CB 3.5Å; E273-S277 PolarHBondContact O-N 2.88Å
274	A	96.1	Very high	95.5	Very high	59 Å²	59	103.6 Å²	103.6	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-42.2	173.2	0	0	0	0	0	112.3	L270 K272 S277 H278	L270-A274 WeakPolarHBondContact O-CB 3.49Å; L270-A274 PolarHBondContact O-N 3.39Å; K272-A274 VanDerWaalsContact C-N 3.33Å; K272-A274 PolarHBondContact O-N 2.96Å; A274-S277 PolarHBondContact O-N 2.83Å; A274-H278 WeakPolarHBondContact O-CB 3.33Å; A274-H278 PolarHBondContact O-N 3.48Å
275	L	95	Very high	95.4	Very high	114 Å²	114	100.2 Å²	100.2	60%	0.597	50%	0.502	S	S	*	.	H	α-helix	trans	-69.1	-38.6	175.5	-73.5	169.9	0	0	0	112.6	E271 K272 S277 H278 V279	E271-L275 WeakPolarHBondContact O-CB 3.43Å; E271-L275 VanDerWaalsContact O-CG 3.29Å; E271-L275 WeakPolarHBondContact O-CG 3.42Å; E271-L275 PolarHBondContact O-N 3.43Å; K272-L275 PolarHBondContact O-N 2.86Å; L275-S277 VanDerWaalsContact C-N 3.33Å; L275-H278 PolarHBondContact O-N 3.37Å; L275-V279 WeakPolarHBondContact O-CB 3.48Å; L275-V279 VanDerWaalsContact O-CG2 3.28Å; L275-V279 WeakPolarHBondContact O-CG2 3.41Å; L275-V279 PolarHBondContact O-N 3.1Å
276	E	94.8	Very high	95.4	Very high	106 Å²	106	101.5 Å²	101.5	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-65.4	-37.5	174.3	-76.3	178.3	155.5	0	0	111.4	K272 E273 K280	K272-E276 VanDerWaalsContact CE-OE1 3.26Å; K272-E276 WeakPolarHBondContact CE-OE1 3.42Å; K272-E276 HydrophobicContact CG-CG 4.43Å; K272-E276 IonicContact NZ-OE1 3.2Å; K272-E276 PolarHBondContact NZ-OE1 3.05Å; K272-E276 IonicContact NZ-OE2 3.09Å; K272-E276 PolarHBondContact NZ-OE2 3.33Å; K272-E276 WeakPolarHBondContact O-CB 3.44Å; K272-E276 WeakPolarHBondContact O-CG 3.48Å; K272-E276 PolarHBondContact O-N 3.37Å; E273-E276 PolarHBondContact O-N 3.4Å; E276-K280 WeakPolarHBondContact O-CB 3.32Å; E276-K280 PolarHBondContact O-N 3.01Å
277	S	95.6	Very high	95.4	Very high	62 Å²	62	99.5 Å²	99.5	43%	0.434	50%	0.495	S	S	.	.	H	α-helix	trans	-63.8	-47.6	171.4	-171.4	0	0	0	0	112	E273 A274 L275 V279 K280 N281	E273-S277 VanDerWaalsContact O-CB 3.32Å; E273-S277 WeakPolarHBondContact O-CB 3.5Å; E273-S277 PolarHBondContact O-N 2.88Å; A274-S277 PolarHBondContact O-N 2.83Å; L275-S277 VanDerWaalsContact C-N 3.33Å; S277-V279 PolarHBondContact O-N 3.27Å; S277-K280 WeakPolarHBondContact O-CB 3.47Å; S277-K280 PolarHBondContact O-N 2.7Å; S277-K280 VanDerWaalsContact O-N 3.11Å; S277-N281 VanDerWaalsContact O-CG 3.32Å; S277-N281 PolarHBondContact O-N 2.91Å; S277-N281 PolarHBondContact O-OD1 3.13Å
278	H	95.3	Very high	95.3	Very high	107 Å²	107	97.8 Å²	97.8	50%	0.495	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-44	175.8	-170	-35.4	0	0	0	112.1	A274 L275 K280 N281 E282	A274-H278 WeakPolarHBondContact O-CB 3.33Å; A274-H278 PolarHBondContact O-N 3.48Å; L275-H278 PolarHBondContact O-N 3.37Å; H278-K280 PolarHBondContact O-N 2.99Å; H278-N281 PolarHBondContact O-N 2.78Å; H278-E282 IonicContact CE1-OE1 3.71Å; H278-E282 PolarHBondContact CE1-OE1 3.03Å; H278-E282 WeakPolarHBondContact ND1-CG 3.33Å; H278-E282 IonicContact ND1-OE1 2.72Å; H278-E282 WeakPolarHBondContact O-CB 3.44Å; H278-E282 VanDerWaalsContact O-CG 3.29Å; H278-E282 WeakPolarHBondContact O-CG 3.31Å; H278-E282 PolarHBondContact O-N 2.89Å
279	V	95.1	Very high	95.3	Very high	68 Å²	68	101.4 Å²	101.4	41%	0.412	50%	0.496	S	S	.	.	H	α-helix	trans	-67.3	-25.8	176.7	167.3	0	0	0	0	111.8	L275 S277 R283	L275-V279 WeakPolarHBondContact O-CB 3.48Å; L275-V279 VanDerWaalsContact O-CG2 3.28Å; L275-V279 WeakPolarHBondContact O-CG2 3.41Å; L275-V279 PolarHBondContact O-N 3.1Å; S277-V279 PolarHBondContact O-N 3.27Å; V279-R283 WeakPolarHBondContact O-CD 3.36Å; V279-R283 VanDerWaalsContact O-CG 3.23Å; V279-R283 WeakPolarHBondContact O-CG 3.41Å; V279-R283 PolarHBondContact O-N 2.96Å; V279-R283 PolarHBondContact O-NE 3.32Å
280	K	95.4	Very high	95.3	Very high	121 Å²	121	104.2 Å²	104.2	53%	0.526	50%	0.501	S	S	.	.	H	α-helix	trans	-72.1	-50.2	170.1	-171	-162.2	169	-154.4	0	111.1	E276 S277 H278 E282 R283 D284	E276-K280 WeakPolarHBondContact O-CB 3.32Å; E276-K280 PolarHBondContact O-N 3.01Å; S277-K280 WeakPolarHBondContact O-CB 3.47Å; S277-K280 PolarHBondContact O-N 2.7Å; S277-K280 VanDerWaalsContact O-N 3.11Å; H278-K280 PolarHBondContact O-N 2.99Å; K280-E282 VanDerWaalsContact C-N 3.31Å; K280-E282 PolarHBondContact O-N 3.01Å; K280-R283 WeakPolarHBondContact O-CA 3.43Å; K280-R283 WeakPolarHBondContact O-CB 3.45Å; K280-R283 PolarHBondContact O-N 2.91Å; K280-D284 VanDerWaalsContact CE-OD2 3.27Å; K280-D284 WeakPolarHBondContact CE-OD2 3.43Å; K280-D284 IonicContact NZ-OD2 2.71Å; K280-D284 PolarHBondContact O-N 2.98Å
281	N	95.4	Very high	95.3	Very high	78 Å²	78	102.4 Å²	102.4	42%	0.417	49%	0.491	S	S	.	.	H	α-helix	trans	-56.5	-45.4	179.6	-63.6	-11.5	0	0	0	111.4	S277 H278 R283 D284 E285	S277-N281 VanDerWaalsContact O-CG 3.32Å; S277-N281 PolarHBondContact O-N 2.91Å; S277-N281 PolarHBondContact O-OD1 3.13Å; H278-N281 PolarHBondContact O-N 2.78Å; N281-R283 VanDerWaalsContact C-N 3.27Å; N281-R283 PolarHBondContact O-N 3.39Å; N281-D284 PolarHBondContact O-N 3.08Å; N281-D284 VanDerWaalsContact O-N 3.13Å; N281-E285 WeakPolarHBondContact O-CB 3.36Å; N281-E285 WeakPolarHBondContact O-CG 3.5Å; N281-E285 PolarHBondContact O-N 3.22Å
282	E	94.5	Very high	95.3	Very high	109 Å²	109	103.4 Å²	103.4	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-57.3	-33.9	173.5	-74.3	-80.7	163.3	0	0	113.6	H278 K280 K286	H278-E282 IonicContact CE1-OE1 3.71Å; H278-E282 PolarHBondContact CE1-OE1 3.03Å; H278-E282 WeakPolarHBondContact ND1-CG 3.33Å; H278-E282 IonicContact ND1-OE1 2.72Å; H278-E282 WeakPolarHBondContact O-CB 3.44Å; H278-E282 VanDerWaalsContact O-CG 3.29Å; H278-E282 WeakPolarHBondContact O-CG 3.31Å; H278-E282 PolarHBondContact O-N 2.89Å; K280-E282 VanDerWaalsContact C-N 3.31Å; K280-E282 PolarHBondContact O-N 3.01Å; E282-K286 WeakPolarHBondContact O-CB 3.5Å; E282-K286 PolarHBondContact O-N 3.37Å
283	R	94.8	Very high	95.2	Very high	167 Å²	167	102.9 Å²	102.9	63%	0.63	50%	0.498	S	S	*	.	H	α-helix	trans	-74.6	-42.2	174.6	-69.4	167	-164.8	-173.8	6.3	111.7	V279 K280 N281 K286 E287	V279-R283 WeakPolarHBondContact O-CD 3.36Å; V279-R283 VanDerWaalsContact O-CG 3.23Å; V279-R283 WeakPolarHBondContact O-CG 3.41Å; V279-R283 PolarHBondContact O-N 2.96Å; V279-R283 PolarHBondContact O-NE 3.32Å; K280-R283 WeakPolarHBondContact O-CA 3.43Å; K280-R283 WeakPolarHBondContact O-CB 3.45Å; K280-R283 PolarHBondContact O-N 2.91Å; N281-R283 VanDerWaalsContact C-N 3.27Å; N281-R283 PolarHBondContact O-N 3.39Å; R283-K286 PolarHBondContact O-N 2.91Å; R283-E287 PolarHBondContact O-N 3.3Å
284	D	94.9	Very high	95.2	Very high	85 Å²	85	102.7 Å²	102.7	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-67.6	-41.6	-178.5	-66.6	-15	0	0	0	110	K280 N281 E287 L288	K280-D284 VanDerWaalsContact CE-OD2 3.27Å; K280-D284 WeakPolarHBondContact CE-OD2 3.43Å; K280-D284 IonicContact NZ-OD2 2.71Å; K280-D284 PolarHBondContact O-N 2.98Å; N281-D284 PolarHBondContact O-N 3.08Å; N281-D284 VanDerWaalsContact O-N 3.13Å; D284-E287 PolarHBondContact O-N 3.07Å; D284-L288 WeakPolarHBondContact O-CB 3.41Å; D284-L288 PolarHBondContact O-N 3.5Å
285	E	94.8	Very high	95.1	Very high	100 Å²	100	104.3 Å²	104.3	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-44.6	169.3	-74.1	-175.9	-152.1	0	0	112.3	N281 E287 L288 Y289	N281-E285 WeakPolarHBondContact O-CB 3.36Å; N281-E285 WeakPolarHBondContact O-CG 3.5Å; N281-E285 PolarHBondContact O-N 3.22Å; E285-E287 VanDerWaalsContact C-N 3.33Å; E285-E287 PolarHBondContact O-N 2.96Å; E285-L288 CarbonylContact O-C 3.58Å; E285-L288 WeakPolarHBondContact O-CB 3.44Å; E285-L288 PolarHBondContact O-N 2.9Å; E285-L288 VanDerWaalsContact O-N 3.16Å; E285-Y289 HydrophobicContact CB-CE2 4.47Å; E285-Y289 WeakPolarHBondContact O-CD2 3.36Å; E285-Y289 PolarHBondContact O-N 3.03Å
286	K	95	Very high	95.1	Very high	154 Å²	154	107.8 Å²	107.8	67%	0.67	50%	0.501	S	S	*	.	H	α-helix	trans	-61.9	-38	176.8	179.3	175.4	-179.7	174.5	0	112.8	E282 R283 K290	E282-K286 WeakPolarHBondContact O-CB 3.5Å; E282-K286 PolarHBondContact O-N 3.37Å; R283-K286 PolarHBondContact O-N 2.91Å; K286-K290 VanDerWaalsContact O-CB 3.31Å; K286-K290 WeakPolarHBondContact O-CB 3.47Å; K286-K290 PolarHBondContact O-N 2.9Å
287	E	95.7	Very high	95	Very high	78 Å²	78	107.8 Å²	107.8	36%	0.364	50%	0.501	S	S	.	.	H	α-helix	trans	-71	-37	174.3	-167.1	60.4	-147.5	0	0	111.2	R283 D284 E285 K290 I291	R283-E287 PolarHBondContact O-N 3.3Å; D284-E287 PolarHBondContact O-N 3.07Å; E285-E287 VanDerWaalsContact C-N 3.33Å; E285-E287 PolarHBondContact O-N 2.96Å; E287-K290 CarbonylContact O-C 3.55Å; E287-K290 WeakPolarHBondContact O-CB 3.25Å; E287-K290 PolarHBondContact O-N 2.96Å; E287-K290 IonicContact OE1-NZ 2.72Å; E287-K290 PolarHBondContact OE1-NZ 2.61Å; E287-K290 IonicContact OE2-NZ 3.09Å; E287-K290 PolarHBondContact OE2-NZ 2.79Å; E287-I291 HydrophobicContact CG-CD1 4.41Å; E287-I291 WeakPolarHBondContact O-CG1 3.43Å; E287-I291 PolarHBondContact O-N 3.37Å
288	L	95.7	Very high	95	Very high	91 Å²	91	109.1 Å²	109.1	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-46.3	172.2	-178.2	61.1	0	0	0	111.9	D284 E285 K290 I291 H292	D284-L288 WeakPolarHBondContact O-CB 3.41Å; D284-L288 PolarHBondContact O-N 3.5Å; E285-L288 CarbonylContact O-C 3.58Å; E285-L288 WeakPolarHBondContact O-CB 3.44Å; E285-L288 PolarHBondContact O-N 2.9Å; E285-L288 VanDerWaalsContact O-N 3.16Å; L288-K290 VanDerWaalsContact C-N 3.3Å; L288-K290 PolarHBondContact O-N 2.66Å; L288-I291 WeakPolarHBondContact O-CB 3.48Å; L288-I291 PolarHBondContact O-N 3.42Å; L288-I291 VanDerWaalsContact O-N 3.14Å; L288-H292 PolarHBondContact O-CD2 2.87Å; L288-H292 PolarHBondContact O-N 3.26Å
289	Y	94.8	Very high	94.9	Very high	165 Å²	165	109.4 Å²	109.4	65%	0.647	50%	0.504	S	S	*	.	H	α-helix	trans	-60	-38.2	172.7	-77.4	-60.2	0	0	0	112.4	E285 H292 L293	E285-Y289 HydrophobicContact CB-CE2 4.47Å; E285-Y289 WeakPolarHBondContact O-CD2 3.36Å; E285-Y289 PolarHBondContact O-N 3.03Å; Y289-H292 PolarHBondContact O-N 2.93Å; Y289-L293 WeakPolarHBondContact O-CB 3.33Å; Y289-L293 PolarHBondContact O-N 3.28Å
290	K	96.1	Very high	94.8	Very high	97 Å²	97	111 Å²	111	42%	0.422	51%	0.511	S	S	.	.	H	α-helix	trans	-67.9	-31.7	175	170.5	164.3	162.8	-94.6	0	112.8	K286 E287 L288 K294	K286-K290 VanDerWaalsContact O-CB 3.31Å; K286-K290 WeakPolarHBondContact O-CB 3.47Å; K286-K290 PolarHBondContact O-N 2.9Å; E287-K290 CarbonylContact O-C 3.55Å; E287-K290 WeakPolarHBondContact O-CB 3.25Å; E287-K290 PolarHBondContact O-N 2.96Å; E287-K290 IonicContact OE1-NZ 2.72Å; E287-K290 PolarHBondContact OE1-NZ 2.61Å; E287-K290 IonicContact OE2-NZ 3.09Å; E287-K290 PolarHBondContact OE2-NZ 2.79Å; L288-K290 VanDerWaalsContact C-N 3.3Å; L288-K290 PolarHBondContact O-N 2.66Å; K290-K294 WeakPolarHBondContact O-CG 3.16Å; K290-K294 PolarHBondContact O-N 2.99Å
291	I	96	Very high	94.8	Very high	75 Å²	75	109.6 Å²	109.6	39%	0.385	51%	0.512	S	S	.	.	H	α-helix	trans	-70.6	-45.2	169.7	-69.3	162.7	0	0	0	110.6	E287 L288 L293 K294 N295	E287-I291 HydrophobicContact CG-CD1 4.41Å; E287-I291 WeakPolarHBondContact O-CG1 3.43Å; E287-I291 PolarHBondContact O-N 3.37Å; L288-I291 WeakPolarHBondContact O-CB 3.48Å; L288-I291 PolarHBondContact O-N 3.42Å; L288-I291 VanDerWaalsContact O-N 3.14Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 PolarHBondContact O-N 2.93Å; I291-K294 PolarHBondContact O-N 3.27Å; I291-N295 WeakPolarHBondContact O-CB 3.38Å; I291-N295 VanDerWaalsContact O-CG 3.28Å; I291-N295 PolarHBondContact O-N 3.06Å; I291-N295 PolarHBondContact O-ND2 2.96Å
292	H	93.9	Very high	94.8	Very high	107 Å²	107	111.6 Å²	111.6	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-60.4	-40.8	175.6	-75.3	-64.2	0	0	0	112.6	L288 Y289 N295 R296	L288-H292 PolarHBondContact O-CD2 2.87Å; L288-H292 PolarHBondContact O-N 3.26Å; Y289-H292 PolarHBondContact O-N 2.93Å; H292-N295 PolarHBondContact O-N 3.46Å; H292-R296 WeakPolarHBondContact O-CB 3.36Å; H292-R296 PolarHBondContact O-N 3.5Å
293	L	95	Very high	94.8	Very high	100 Å²	100	110.7 Å²	110.7	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-52.2	175.4	-178.2	61.1	0	0	0	111	Y289 I291 N295 R296 E297	Y289-L293 WeakPolarHBondContact O-CB 3.33Å; Y289-L293 PolarHBondContact O-N 3.28Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 PolarHBondContact O-N 2.93Å; L293-N295 VanDerWaalsContact C-N 3.3Å; L293-N295 PolarHBondContact O-N 3.42Å; L293-R296 PolarHBondContact O-N 3.22Å; L293-R296 VanDerWaalsContact O-N 3.1Å; L293-E297 HydrophobicContact CD1-CG 4.45Å; L293-E297 WeakPolarHBondContact O-CG 3.49Å; L293-E297 PolarHBondContact O-N 2.7Å
294	K	95.3	Very high	94.7	Very high	114 Å²	114	105.5 Å²	105.5	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-56.8	-40.9	175.7	-75.9	176.4	174.7	-175.7	0	113.2	K290 I291 E297 L298	K290-K294 WeakPolarHBondContact O-CG 3.16Å; K290-K294 PolarHBondContact O-N 2.99Å; I291-K294 PolarHBondContact O-N 3.27Å; K294-E297 PolarHBondContact O-N 3.08Å; K294-L298 VanDerWaalsContact O-CB 3.26Å; K294-L298 WeakPolarHBondContact O-CB 3.37Å; K294-L298 PolarHBondContact O-N 3.13Å
295	N	94.1	Very high	94.7	Very high	93 Å²	93	103.8 Å²	103.8	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-40.3	177.6	-73.8	-17.5	0	0	0	111.4	I291 H292 L293 L298 E299	I291-N295 WeakPolarHBondContact O-CB 3.38Å; I291-N295 VanDerWaalsContact O-CG 3.28Å; I291-N295 PolarHBondContact O-N 3.06Å; I291-N295 PolarHBondContact O-ND2 2.96Å; H292-N295 PolarHBondContact O-N 3.46Å; L293-N295 VanDerWaalsContact C-N 3.3Å; L293-N295 PolarHBondContact O-N 3.42Å; N295-L298 PolarHBondContact O-N 3.15Å; N295-E299 WeakPolarHBondContact O-CB 3.43Å; N295-E299 PolarHBondContact O-N 3.14Å
296	R	94.1	Very high	94.7	Very high	187 Å²	187	103.6 Å²	103.6	71%	0.706	50%	0.501	S	S	*	.	H	α-helix	trans	-71	-34.4	176.4	-170.4	178	179.3	116.6	-0.4	112.8	H292 L293 N300	H292-R296 WeakPolarHBondContact O-CB 3.36Å; H292-R296 PolarHBondContact O-N 3.5Å; L293-R296 PolarHBondContact O-N 3.22Å; L293-R296 VanDerWaalsContact O-N 3.1Å; R296-N300 VanDerWaalsContact O-CB 3.3Å; R296-N300 WeakPolarHBondContact O-CB 3.47Å; R296-N300 PolarHBondContact O-N 2.72Å
297	E	94.1	Very high	94.6	Very high	105 Å²	105	100.9 Å²	100.9	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-42.7	170.3	-71.3	168.9	164.1	0	0	111.2	L293 K294 N300 T301	L293-E297 HydrophobicContact CD1-CG 4.45Å; L293-E297 WeakPolarHBondContact O-CG 3.49Å; L293-E297 PolarHBondContact O-N 2.7Å; K294-E297 PolarHBondContact O-N 3.08Å; E297-N300 PolarHBondContact O-N 3.36Å; E297-T301 PolarHBondContact O-N 3.5Å; E297-T301 PolarHBondContact O-OG1 3.34Å
298	L	94.1	Very high	94.5	Very high	90 Å²	90	104 Å²	104	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-69.7	-34.3	177.3	-172.5	148.9	0	0	0	112.4	K294 N295 T301 K302	K294-L298 VanDerWaalsContact O-CB 3.26Å; K294-L298 WeakPolarHBondContact O-CB 3.37Å; K294-L298 PolarHBondContact O-N 3.13Å; N295-L298 PolarHBondContact O-N 3.15Å; L298-T301 WeakPolarHBondContact CA-OG1 3.43Å; L298-T301 PolarHBondContact O-OG1 3.29Å; L298-T301 VanDerWaalsContact O-OG1 3.05Å; L298-K302 HydrophobicContact CD2-CD 4.09Å; L298-K302 VanDerWaalsContact CD2-CE 3.48Å; L298-K302 WeakPolarHBondContact O-CG 3.46Å; L298-K302 PolarHBondContact O-N 2.93Å; L298-K302 VanDerWaalsContact O-N 3.12Å
299	E	93.8	Very high	94.4	Very high	114 Å²	114	105.3 Å²	105.3	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-42.1	169.1	-175.7	175.7	-144.3	0	0	111.6	N295 T301 K302 L303	N295-E299 WeakPolarHBondContact O-CB 3.43Å; N295-E299 PolarHBondContact O-N 3.14Å; E299-T301 PolarHBondContact O-N 3.3Å; E299-K302 WeakPolarHBondContact O-CB 3.22Å; E299-K302 PolarHBondContact O-N 2.85Å; E299-L303 HydrophobicContact CG-CD1 4.1Å; E299-L303 WeakPolarHBondContact O-CG 3.5Å; E299-L303 PolarHBondContact O-N 2.94Å
300	N	93.3	Very high	94.3	Very high	101 Å²	101	102.5 Å²	102.5	54%	0.54	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-39.7	176.5	-167.9	-57.9	0	0	0	112.2	R296 E297 L303 S304	R296-N300 VanDerWaalsContact O-CB 3.3Å; R296-N300 WeakPolarHBondContact O-CB 3.47Å; R296-N300 PolarHBondContact O-N 2.72Å; E297-N300 PolarHBondContact O-N 3.36Å; N300-L303 PolarHBondContact O-N 3.17Å; N300-S304 VanDerWaalsContact O-CB 3.24Å; N300-S304 WeakPolarHBondContact O-CB 3.46Å; N300-S304 PolarHBondContact O-N 2.84Å; N300-S304 PolarHBondContact O-OG 3.17Å; N300-S304 PolarHBondContact OD1-OG 3.48Å
301	T	94.9	Very high	94.2	Very high	91 Å²	91	105 Å²	105	56%	0.558	52%	0.519	S	S	*	.	H	α-helix	trans	-68.1	-36.4	174.9	54.1	0	0	0	0	112.6	E297 L298 E299 S304 A305	E297-T301 PolarHBondContact O-N 3.5Å; E297-T301 PolarHBondContact O-OG1 3.34Å; L298-T301 WeakPolarHBondContact CA-OG1 3.43Å; L298-T301 PolarHBondContact O-OG1 3.29Å; L298-T301 VanDerWaalsContact O-OG1 3.05Å; E299-T301 PolarHBondContact O-N 3.3Å; T301-S304 PolarHBondContact O-N 2.86Å; T301-A305 WeakPolarHBondContact O-CB 3.21Å; T301-A305 PolarHBondContact O-N 2.88Å
302	K	95.9	Very high	93.9	Very high	120 Å²	120	104.4 Å²	104.4	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-59.8	-54.8	169.5	-75.4	169.8	175.5	172.4	0	111.9	L298 E299 S304 A305 E306	L298-K302 HydrophobicContact CD2-CD 4.09Å; L298-K302 VanDerWaalsContact CD2-CE 3.48Å; L298-K302 WeakPolarHBondContact O-CG 3.46Å; L298-K302 PolarHBondContact O-N 2.93Å; L298-K302 VanDerWaalsContact O-N 3.12Å; E299-K302 WeakPolarHBondContact O-CB 3.22Å; E299-K302 PolarHBondContact O-N 2.85Å; K302-S304 PolarHBondContact O-N 2.92Å; K302-A305 WeakPolarHBondContact O-CB 3.29Å; K302-A305 PolarHBondContact O-N 3.44Å; K302-E306 WeakPolarHBondContact O-CG 3.38Å; K302-E306 PolarHBondContact O-N 2.86Å
303	L	94.3	Very high	93.9	Very high	91 Å²	91	102.7 Å²	102.7	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-35.5	179.3	-69.3	171	0	0	0	111.9	E299 N300 E306 L307	E299-L303 HydrophobicContact CG-CD1 4.1Å; E299-L303 WeakPolarHBondContact O-CG 3.5Å; E299-L303 PolarHBondContact O-N 2.94Å; N300-L303 PolarHBondContact O-N 3.17Å; L303-E306 PolarHBondContact O-N 2.88Å; L303-L307 WeakPolarHBondContact O-CB 3.41Å; L303-L307 VanDerWaalsContact O-CG 3.24Å; L303-L307 WeakPolarHBondContact O-CG 3.44Å; L303-L307 PolarHBondContact O-N 3.38Å
304	S	93.6	Very high	93.7	Very high	58 Å²	58	102 Å²	102	41%	0.406	52%	0.516	S	S	.	.	H	α-helix	trans	-66.8	-39.8	174.1	-65	0	0	0	0	112.5	N300 T301 K302 L307 Q308	N300-S304 VanDerWaalsContact O-CB 3.24Å; N300-S304 WeakPolarHBondContact O-CB 3.46Å; N300-S304 PolarHBondContact O-N 2.84Å; N300-S304 PolarHBondContact O-OG 3.17Å; N300-S304 PolarHBondContact OD1-OG 3.48Å; T301-S304 PolarHBondContact O-N 2.86Å; K302-S304 PolarHBondContact O-N 2.92Å; S304-L307 PolarHBondContact O-N 3.44Å; S304-Q308 WeakPolarHBondContact O-CB 3.29Å; S304-Q308 PolarHBondContact O-N 3.3Å
305	A	94.1	Very high	93.6	Very high	48 Å²	48	100.5 Å²	100.5	40%	0.397	52%	0.516	S	S	.	.	H	α-helix	trans	-69.1	-40.7	174.4	0	0	0	0	0	112	T301 K302 Q308 M309	T301-A305 WeakPolarHBondContact O-CB 3.21Å; T301-A305 PolarHBondContact O-N 2.88Å; K302-A305 WeakPolarHBondContact O-CB 3.29Å; K302-A305 PolarHBondContact O-N 3.44Å; A305-Q308 WeakPolarHBondContact O-CB 3.49Å; A305-Q308 PolarHBondContact O-N 2.89Å; A305-Q308 VanDerWaalsContact O-N 3.13Å; A305-M309 WeakPolarHBondContact O-CG 3.48Å; A305-M309 PolarHBondContact O-N 3.44Å
306	E	94.3	Very high	93.4	Very high	96 Å²	96	100.9 Å²	100.9	45%	0.449	52%	0.518	S	S	.	.	H	α-helix	trans	-61	-43.6	172.5	-73	171.5	-152.3	0	0	111.5	K302 L303 Q308 M309 L310	K302-E306 WeakPolarHBondContact O-CG 3.38Å; K302-E306 PolarHBondContact O-N 2.86Å; L303-E306 PolarHBondContact O-N 2.88Å; E306-Q308 VanDerWaalsContact C-N 3.3Å; E306-Q308 PolarHBondContact O-N 2.9Å; E306-M309 HydrophobicContact CG-CE 4.38Å; E306-M309 PolarHBondContact O-N 2.8Å; E306-L310 WeakPolarHBondContact O-CB 3.46Å; E306-L310 WeakPolarHBondContact O-CG 3.29Å; E306-L310 PolarHBondContact O-N 3.3Å
307	L	93.4	Very high	93.3	Very high	97 Å²	97	97 Å²	97	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-33.5	172.3	-76.3	169.7	0	0	0	112.6	L303 S304 K311	L303-L307 WeakPolarHBondContact O-CB 3.41Å; L303-L307 VanDerWaalsContact O-CG 3.24Å; L303-L307 WeakPolarHBondContact O-CG 3.44Å; L303-L307 PolarHBondContact O-N 3.38Å; S304-L307 PolarHBondContact O-N 3.44Å; L307-K311 WeakPolarHBondContact O-CB 3.31Å; L307-K311 VanDerWaalsContact O-CG 3.24Å; L307-K311 WeakPolarHBondContact O-CG 3.26Å; L307-K311 PolarHBondContact O-N 3.36Å
308	Q	93.2	Very high	93.2	Very high	144 Å²	144	97.9 Å²	97.9	67%	0.673	51%	0.51	S	S	*	.	H	α-helix	trans	-70.8	-39.6	174.6	-172.3	174.4	-3.3	0	0	111.9	S304 A305 E306 K311 S312	S304-Q308 WeakPolarHBondContact O-CB 3.29Å; S304-Q308 PolarHBondContact O-N 3.3Å; A305-Q308 WeakPolarHBondContact O-CB 3.49Å; A305-Q308 PolarHBondContact O-N 2.89Å; A305-Q308 VanDerWaalsContact O-N 3.13Å; E306-Q308 VanDerWaalsContact C-N 3.3Å; E306-Q308 PolarHBondContact O-N 2.9Å; Q308-K311 PolarHBondContact O-N 2.77Å; Q308-S312 PolarHBondContact O-N 3.04Å
309	M	94	Very high	93.1	Very high	119 Å²	119	97.6 Å²	97.6	59%	0.586	51%	0.51	S	S	*	.	H	α-helix	trans	-66.7	-41.8	172.2	-68.1	-164.4	-61.5	0	0	112	A305 E306 K311 S312 V313	A305-M309 WeakPolarHBondContact O-CG 3.48Å; A305-M309 PolarHBondContact O-N 3.44Å; E306-M309 HydrophobicContact CG-CE 4.38Å; E306-M309 PolarHBondContact O-N 2.8Å; M309-K311 VanDerWaalsContact C-N 3.32Å; M309-K311 PolarHBondContact O-N 3.37Å; M309-S312 PolarHBondContact O-N 2.99Å; M309-S312 PolarHBondContact O-OG 2.97Å; M309-V313 WeakPolarHBondContact O-CB 3.49Å; M309-V313 WeakPolarHBondContact O-CG2 3.36Å; M309-V313 PolarHBondContact O-N 3.25Å
310	L	92.5	Very high	92.9	Very high	105 Å²	105	95 Å²	95	55%	0.55	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-43	174.5	-81.4	161.8	0	0	0	110.9	E306 V313 D314	E306-L310 WeakPolarHBondContact O-CB 3.46Å; E306-L310 WeakPolarHBondContact O-CG 3.29Å; E306-L310 PolarHBondContact O-N 3.3Å; L310-V313 PolarHBondContact O-N 2.96Å; L310-D314 WeakPolarHBondContact O-CB 3.39Å; L310-D314 PolarHBondContact O-N 2.72Å
311	K	93.7	Very high	92.8	Very high	149 Å²	149	93.7 Å²	93.7	65%	0.648	49%	0.494	S	S	*	.	H	α-helix	trans	-62.5	-39.7	174	-77.2	170.7	-178.9	178	0	113.2	L307 Q308 M309 D314 V315	L307-K311 WeakPolarHBondContact O-CB 3.31Å; L307-K311 VanDerWaalsContact O-CG 3.24Å; L307-K311 WeakPolarHBondContact O-CG 3.26Å; L307-K311 PolarHBondContact O-N 3.36Å; Q308-K311 PolarHBondContact O-N 2.77Å; M309-K311 VanDerWaalsContact C-N 3.32Å; M309-K311 PolarHBondContact O-N 3.37Å; K311-D314 PolarHBondContact O-N 2.94Å; K311-V315 WeakPolarHBondContact O-CB 3.4Å; K311-V315 WeakPolarHBondContact O-CG2 3.24Å; K311-V315 PolarHBondContact O-N 3.28Å
312	S	91.2	Very high	92.6	Very high	63 Å²	63	91.7 Å²	91.7	44%	0.441	49%	0.487	S	S	.	.	H	α-helix	trans	-71.3	-35.4	176.8	68.2	0	0	0	0	112.2	Q308 M309 D314 N316	Q308-S312 PolarHBondContact O-N 3.04Å; M309-S312 PolarHBondContact O-N 2.99Å; M309-S312 PolarHBondContact O-OG 2.97Å; S312-D314 VanDerWaalsContact C-N 3.35Å; S312-N316 WeakPolarHBondContact O-CB 3.46Å; S312-N316 VanDerWaalsContact O-CG 3.23Å; S312-N316 PolarHBondContact O-N 3.41Å; S312-N316 PolarHBondContact O-OD1 3.4Å
313	V	93.3	Very high	92.2	Very high	72 Å²	72	91.8 Å²	91.8	44%	0.436	49%	0.489	S	S	.	.	H	α-helix	trans	-63.5	-39.7	169.7	168.7	0	0	0	0	111.3	M309 L310 N316 K317	M309-V313 WeakPolarHBondContact O-CB 3.49Å; M309-V313 WeakPolarHBondContact O-CG2 3.36Å; M309-V313 PolarHBondContact O-N 3.25Å; L310-V313 PolarHBondContact O-N 2.96Å; V313-N316 PolarHBondContact O-N 2.83Å; V313-K317 WeakPolarHBondContact O-CG 3.43Å; V313-K317 PolarHBondContact O-N 3.31Å
314	D	90.2	Very high	92	Very high	85 Å²	85	93.9 Å²	93.9	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-72.8	-38	179	-129.4	47.1	0	0	0	112.5	L310 K311 S312 N316 K317 E318	L310-D314 WeakPolarHBondContact O-CB 3.39Å; L310-D314 PolarHBondContact O-N 2.72Å; K311-D314 PolarHBondContact O-N 2.94Å; S312-D314 VanDerWaalsContact C-N 3.35Å; D314-N316 VanDerWaalsContact C-N 3.3Å; D314-N316 PolarHBondContact O-N 2.92Å; D314-K317 CarbonylContact O-C 3.5Å; D314-K317 WeakPolarHBondContact O-CB 3.49Å; D314-K317 PolarHBondContact O-N 3.37Å; D314-K317 IonicContact OD1-NZ 3.26Å; D314-K317 PolarHBondContact OD1-NZ 3.14Å; D314-K317 VanDerWaalsContact OD1-NZ 3.09Å; D314-E318 WeakPolarHBondContact O-CB 3.44Å; D314-E318 WeakPolarHBondContact O-CG 3.23Å; D314-E318 PolarHBondContact O-N 3.42Å
315	V	92.8	Very high	91.8	Very high	83 Å²	83	97.7 Å²	97.7	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-61.4	-39.1	168.5	168.1	0	0	0	0	111.2	K311 E318 N319	K311-V315 WeakPolarHBondContact O-CB 3.4Å; K311-V315 WeakPolarHBondContact O-CG2 3.24Å; K311-V315 PolarHBondContact O-N 3.28Å; V315-E318 PolarHBondContact O-N 3.27Å; V315-N319 WeakPolarHBondContact O-CB 3.45Å; V315-N319 VanDerWaalsContact O-CG 3.24Å; V315-N319 PolarHBondContact O-N 2.96Å; V315-N319 PolarHBondContact O-ND2 3.44Å; V315-N319 VanDerWaalsContact O-ND2 3.13Å
316	N	91.1	Very high	91.6	Very high	100 Å²	100	102.6 Å²	102.6	54%	0.535	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-40.9	173.6	-75.1	-4.4	0	0	0	111.7	S312 V313 D314 N319 T320	S312-N316 WeakPolarHBondContact O-CB 3.46Å; S312-N316 VanDerWaalsContact O-CG 3.23Å; S312-N316 PolarHBondContact O-N 3.41Å; S312-N316 PolarHBondContact O-OD1 3.4Å; V313-N316 PolarHBondContact O-N 2.83Å; D314-N316 VanDerWaalsContact C-N 3.3Å; D314-N316 PolarHBondContact O-N 2.92Å; N316-N319 PolarHBondContact O-N 2.87Å; N316-T320 PolarHBondContact O-N 2.94Å; N316-T320 PolarHBondContact O-OG1 2.82Å
317	K	92.2	Very high	91.2	Very high	107 Å²	107	101.3 Å²	101.3	47%	0.465	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-43.8	172.6	-70.3	172.4	-163.6	156.1	0	112.1	V313 D314 N319 T320 I321	V313-K317 WeakPolarHBondContact O-CG 3.43Å; V313-K317 PolarHBondContact O-N 3.31Å; D314-K317 CarbonylContact O-C 3.5Å; D314-K317 WeakPolarHBondContact O-CB 3.49Å; D314-K317 PolarHBondContact O-N 3.37Å; D314-K317 IonicContact OD1-NZ 3.26Å; D314-K317 PolarHBondContact OD1-NZ 3.14Å; D314-K317 VanDerWaalsContact OD1-NZ 3.09Å; K317-N319 VanDerWaalsContact C-N 3.31Å; K317-N319 PolarHBondContact O-N 3.47Å; K317-T320 CarbonylContact O-C 3.6Å; K317-T320 PolarHBondContact O-N 3.33Å; K317-I321 HydrophobicContact CB-CD1 4.45Å; K317-I321 VanDerWaalsContact O-CB 3.24Å; K317-I321 WeakPolarHBondContact O-CB 3.37Å; K317-I321 WeakPolarHBondContact O-CD1 3.48Å; K317-I321 WeakPolarHBondContact O-CG1 3.49Å; K317-I321 PolarHBondContact O-N 3.18Å
318	E	92.1	Very high	90.9	Very high	122 Å²	122	100.3 Å²	100.3	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-57.7	-44.2	175	-80.9	-98.7	99.8	0	0	110.7	D314 V315 I321 A322	D314-E318 WeakPolarHBondContact O-CB 3.44Å; D314-E318 WeakPolarHBondContact O-CG 3.23Å; D314-E318 PolarHBondContact O-N 3.42Å; V315-E318 PolarHBondContact O-N 3.27Å; E318-I321 CarbonylContact O-C 3.52Å; E318-I321 PolarHBondContact O-N 3.42Å; E318-A322 WeakPolarHBondContact O-CB 3.42Å; E318-A322 PolarHBondContact O-N 3.02Å
319	N	90.8	Very high	90.5	Very high	85 Å²	85	95.1 Å²	95.1	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-44.2	173.8	-73	-34	0	0	0	112.2	V315 N316 K317 I321 A322 Q323	V315-N319 WeakPolarHBondContact O-CB 3.45Å; V315-N319 VanDerWaalsContact O-CG 3.24Å; V315-N319 PolarHBondContact O-N 2.96Å; V315-N319 PolarHBondContact O-ND2 3.44Å; V315-N319 VanDerWaalsContact O-ND2 3.13Å; N316-N319 PolarHBondContact O-N 2.87Å; K317-N319 VanDerWaalsContact C-N 3.31Å; K317-N319 PolarHBondContact O-N 3.47Å; N319-I321 VanDerWaalsContact C-N 3.34Å; N319-A322 WeakPolarHBondContact O-CB 3.11Å; N319-A322 PolarHBondContact O-N 3.43Å; N319-Q323 WeakPolarHBondContact O-CG 3.24Å; N319-Q323 PolarHBondContact O-N 3.45Å
320	T	91	Very high	90.2	Very high	58 Å²	58	96.7 Å²	96.7	36%	0.356	50%	0.495	S	S	.	.	H	α-helix	trans	-66.9	-35.2	175.5	-56.2	0	0	0	0	112	N316 K317 Q323 F324	N316-T320 PolarHBondContact O-N 2.94Å; N316-T320 PolarHBondContact O-OG1 2.82Å; K317-T320 CarbonylContact O-C 3.6Å; K317-T320 PolarHBondContact O-N 3.33Å; T320-Q323 PolarHBondContact O-N 2.9Å; T320-F324 HydrophobicContact CG2-CD2 3.88Å; T320-F324 HydrophobicContact CG2-CE2 3.52Å; T320-F324 HydrophobicContact CG2-CZ 4.09Å; T320-F324 WeakPolarHBondContact O-CB 3.38Å; T320-F324 VanDerWaalsContact O-CD2 3.3Å; T320-F324 WeakPolarHBondContact O-CD2 3.27Å; T320-F324 WeakPolarHBondContact O-CG 3.16Å; T320-F324 PolarHBondContact O-N 3.35Å
321	I	89.9	Confident	89.8	Confident	74 Å²	74	95.5 Å²	95.5	38%	0.379	49%	0.488	S	S	.	.	H	α-helix	trans	-71	-33.3	173.7	-72.8	164.1	0	0	0	110.4	K317 E318 N319 F324 K325	K317-I321 HydrophobicContact CB-CD1 4.45Å; K317-I321 VanDerWaalsContact O-CB 3.24Å; K317-I321 WeakPolarHBondContact O-CB 3.37Å; K317-I321 WeakPolarHBondContact O-CD1 3.48Å; K317-I321 WeakPolarHBondContact O-CG1 3.49Å; K317-I321 PolarHBondContact O-N 3.18Å; E318-I321 CarbonylContact O-C 3.52Å; E318-I321 PolarHBondContact O-N 3.42Å; N319-I321 VanDerWaalsContact C-N 3.34Å; I321-F324 CarbonylContact O-C 3.53Å; I321-F324 PolarHBondContact O-N 3.48Å; I321-K325 HydrophobicContact CG2-CD 3.89Å; I321-K325 VanDerWaalsContact CG2-CE 3.43Å; I321-K325 HydrophobicContact CG2-CG 4.32Å; I321-K325 VanDerWaalsContact O-CB 3.25Å; I321-K325 WeakPolarHBondContact O-CB 3.31Å; I321-K325 WeakPolarHBondContact O-CD 3.49Å; I321-K325 WeakPolarHBondContact O-CG 3.45Å; I321-K325 PolarHBondContact O-N 3.02Å
322	A	90.4	Very high	89.2	Confident	50 Å²	50	93.9 Å²	93.9	41%	0.413	48%	0.483	S	S	.	.	H	α-helix	trans	-67.5	-45.6	172.5	0	0	0	0	0	110.8	E318 N319 F324 K325 E326	E318-A322 WeakPolarHBondContact O-CB 3.42Å; E318-A322 PolarHBondContact O-N 3.02Å; N319-A322 WeakPolarHBondContact O-CB 3.11Å; N319-A322 PolarHBondContact O-N 3.43Å; A322-F324 PolarHBondContact O-N 3.18Å; A322-K325 CarbonylContact O-C 3.49Å; A322-K325 PolarHBondContact O-N 3.06Å; A322-K325 VanDerWaalsContact O-N 3.12Å; A322-E326 WeakPolarHBondContact O-CB 3.32Å; A322-E326 PolarHBondContact O-N 3.36Å
323	Q	88.6	Confident	88.7	Confident	121 Å²	121	93.6 Å²	93.6	57%	0.565	49%	0.485	S	S	*	.	H	α-helix	trans	-58.6	-44.4	171	-70.7	168.6	1.6	0	0	111.6	N319 T320 E326 E327	N319-Q323 WeakPolarHBondContact O-CG 3.24Å; N319-Q323 PolarHBondContact O-N 3.45Å; T320-Q323 PolarHBondContact O-N 2.9Å; Q323-E326 PolarHBondContact O-N 3.05Å; Q323-E327 VanDerWaalsContact O-CB 3.25Å; Q323-E327 WeakPolarHBondContact O-CB 3.49Å; Q323-E327 PolarHBondContact O-N 3.47Å
324	F	89.4	Confident	88.1	Confident	136 Å²	136	93.4 Å²	93.4	60%	0.596	49%	0.486	S	S	*	.	H	α-helix	trans	-69.9	-27.1	174.4	-70.8	-37.3	0	0	0	113.4	T320 I321 A322 V328	T320-F324 HydrophobicContact CG2-CD2 3.88Å; T320-F324 HydrophobicContact CG2-CE2 3.52Å; T320-F324 HydrophobicContact CG2-CZ 4.09Å; T320-F324 WeakPolarHBondContact O-CB 3.38Å; T320-F324 VanDerWaalsContact O-CD2 3.3Å; T320-F324 WeakPolarHBondContact O-CD2 3.27Å; T320-F324 WeakPolarHBondContact O-CG 3.16Å; T320-F324 PolarHBondContact O-N 3.35Å; I321-F324 CarbonylContact O-C 3.53Å; I321-F324 PolarHBondContact O-N 3.48Å; A322-F324 PolarHBondContact O-N 3.18Å; F324-V328 WeakPolarHBondContact O-CA 3.39Å; F324-V328 WeakPolarHBondContact O-CB 3.2Å; F324-V328 WeakPolarHBondContact O-CG2 3.22Å; F324-V328 PolarHBondContact O-N 3.42Å
325	K	90.3	Very high	87.5	Confident	138 Å²	138	94.3 Å²	94.3	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-74.5	-34.6	172.2	-79.3	164.5	180	168.2	0	111.7	I321 A322 G329	I321-K325 HydrophobicContact CG2-CD 3.89Å; I321-K325 VanDerWaalsContact CG2-CE 3.43Å; I321-K325 HydrophobicContact CG2-CG 4.32Å; I321-K325 VanDerWaalsContact O-CB 3.25Å; I321-K325 WeakPolarHBondContact O-CB 3.31Å; I321-K325 WeakPolarHBondContact O-CD 3.49Å; I321-K325 WeakPolarHBondContact O-CG 3.45Å; I321-K325 PolarHBondContact O-N 3.02Å; A322-K325 CarbonylContact O-C 3.49Å; A322-K325 PolarHBondContact O-N 3.06Å; A322-K325 VanDerWaalsContact O-N 3.12Å; K325-G329 WeakPolarHBondContact O-CA 3.31Å; K325-G329 PolarHBondContact O-N 3.17Å
326	E	88.8	Confident	86.7	Confident	150 Å²	150	94.2 Å²	94.2	70%	0.701	49%	0.49	S	S	*	.	H	α-helix	trans	-69.7	-46.4	171.6	-176.7	178.3	-172	0	0	110.7	A322 Q323 G329 R330	A322-E326 WeakPolarHBondContact O-CB 3.32Å; A322-E326 PolarHBondContact O-N 3.36Å; Q323-E326 PolarHBondContact O-N 3.05Å; E326-G329 CarbonylContact O-C 3.53Å; E326-G329 WeakPolarHBondContact O-CA 3.24Å; E326-G329 PolarHBondContact O-N 2.94Å; E326-G329 VanDerWaalsContact O-N 3.13Å; E326-R330 WeakPolarHBondContact O-CB 3.47Å; E326-R330 PolarHBondContact O-N 2.93Å
327	E	87.6	Confident	85.8	Confident	70 Å²	70	93.3 Å²	93.3	33%	0.327	48%	0.482	S	S	.	.	H	α-helix	trans	-65	-42.5	175.7	175.4	60	-172.7	0	0	111.7	Q323 R330 L331	Q323-E327 VanDerWaalsContact O-CB 3.25Å; Q323-E327 WeakPolarHBondContact O-CB 3.49Å; Q323-E327 PolarHBondContact O-N 3.47Å; E327-R330 PolarHBondContact O-N 3.27Å; E327-R330 IonicContact OE1-CZ 2.89Å; E327-R330 IonicContact OE1-NE 2.69Å; E327-R330 IonicContact OE1-NH2 3.69Å; E327-R330 PolarHBondContact OE1-NH2 2.99Å; E327-R330 IonicContact OE2-CZ 2.77Å; E327-R330 IonicContact OE2-NE 3.6Å; E327-R330 PolarHBondContact OE2-NE 2.97Å; E327-R330 IonicContact OE2-NH2 2.73Å; E327-R330 PolarHBondContact OE2-NH2 3.1Å; E327-L331 HydrophobicContact CG-CD1 4.06Å; E327-L331 VanDerWaalsContact O-CB 3.27Å; E327-L331 WeakPolarHBondContact O-CB 3.25Å; E327-L331 VanDerWaalsContact O-CG 3.24Å; E327-L331 WeakPolarHBondContact O-CG 3.31Å; E327-L331 PolarHBondContact O-N 2.9Å
328	V	85.8	Confident	84.6	Confident	75 Å²	75	93.2 Å²	93.2	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-42.6	168.9	166.6	0	0	0	0	109.8	F324 R330 L331 Q332	F324-V328 WeakPolarHBondContact O-CA 3.39Å; F324-V328 WeakPolarHBondContact O-CB 3.2Å; F324-V328 WeakPolarHBondContact O-CG2 3.22Å; F324-V328 PolarHBondContact O-N 3.42Å; V328-R330 VanDerWaalsContact C-N 3.3Å; V328-R330 PolarHBondContact O-N 3.41Å; V328-L331 CarbonylContact O-C 3.5Å; V328-L331 PolarHBondContact O-N 3.06Å; V328-Q332 WeakPolarHBondContact O-CA 3.41Å; V328-Q332 WeakPolarHBondContact O-CB 3.37Å; V328-Q332 PolarHBondContact O-N 3.36Å
329	G	85.9	Confident	83.4	Confident	36 Å²	36	91.3 Å²	91.3	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-59.1	-38.4	175.2	0	0	0	0	0	113.1	K325 E326 Q332 A333	K325-G329 WeakPolarHBondContact O-CA 3.31Å; K325-G329 PolarHBondContact O-N 3.17Å; E326-G329 CarbonylContact O-C 3.53Å; E326-G329 WeakPolarHBondContact O-CA 3.24Å; E326-G329 PolarHBondContact O-N 2.94Å; E326-G329 VanDerWaalsContact O-N 3.13Å; G329-Q332 CarbonylContact O-C 3.43Å; G329-Q332 PolarHBondContact O-N 2.94Å; G329-A333 WeakPolarHBondContact O-CB 3.2Å; G329-A333 PolarHBondContact O-N 3.05Å
330	R	86.7	Confident	82	Confident	152 Å²	152	94.1 Å²	94.1	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-70.6	-45	174.6	-171	-175.3	73.3	87.4	0.2	111.7	E326 E327 V328 Q332 C334	E326-R330 WeakPolarHBondContact O-CB 3.47Å; E326-R330 PolarHBondContact O-N 2.93Å; E327-R330 PolarHBondContact O-N 3.27Å; E327-R330 IonicContact OE1-CZ 2.89Å; E327-R330 IonicContact OE1-NE 2.69Å; E327-R330 IonicContact OE1-NH2 3.69Å; E327-R330 PolarHBondContact OE1-NH2 2.99Å; E327-R330 IonicContact OE2-CZ 2.77Å; E327-R330 IonicContact OE2-NE 3.6Å; E327-R330 PolarHBondContact OE2-NE 2.97Å; E327-R330 IonicContact OE2-NH2 2.73Å; E327-R330 PolarHBondContact OE2-NH2 3.1Å; V328-R330 VanDerWaalsContact C-N 3.3Å; V328-R330 PolarHBondContact O-N 3.41Å; R330-Q332 PolarHBondContact O-N 3.11Å; R330-C334 WeakPolarHBondContact O-CB 3.28Å; R330-C334 PolarHBondContact O-N 3.2Å
331	L	83.7	Confident	80.3	Confident	79 Å²	79	93.9 Å²	93.9	41%	0.414	47%	0.472	S	S	.	.	H	α-helix	trans	-68.9	-22.2	173.6	-71.7	173	0	0	0	112.5	E327 V328 C334 L335	E327-L331 HydrophobicContact CG-CD1 4.06Å; E327-L331 VanDerWaalsContact O-CB 3.27Å; E327-L331 WeakPolarHBondContact O-CB 3.25Å; E327-L331 VanDerWaalsContact O-CG 3.24Å; E327-L331 WeakPolarHBondContact O-CG 3.31Å; E327-L331 PolarHBondContact O-N 2.9Å; V328-L331 CarbonylContact O-C 3.5Å; V328-L331 PolarHBondContact O-N 3.06Å; L331-C334 CarbonylContact O-C 3.02Å; L331-L335 WeakPolarHBondContact O-CA 3.31Å; L331-L335 WeakPolarHBondContact O-CB 3.37Å; L331-L335 PolarHBondContact O-N 3.4Å
332	Q	81.9	Confident	78.1	Confident	115 Å²	115	96.1 Å²	96.1	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-93.4	-27.8	179.4	-166.7	167.7	25.8	0	0	111.3	V328 G329 R330 L335 T336	V328-Q332 WeakPolarHBondContact O-CA 3.41Å; V328-Q332 WeakPolarHBondContact O-CB 3.37Å; V328-Q332 PolarHBondContact O-N 3.36Å; G329-Q332 CarbonylContact O-C 3.43Å; G329-Q332 PolarHBondContact O-N 2.94Å; R330-Q332 PolarHBondContact O-N 3.11Å; Q332-L335 CarbonylContact O-C 3.5Å; Q332-L335 PolarHBondContact O-N 2.9Å; Q332-T336 WeakPolarHBondContact O-CB 3.14Å; Q332-T336 VanDerWaalsContact O-CG2 3.28Å; Q332-T336 WeakPolarHBondContact O-CG2 3.5Å; Q332-T336 PolarHBondContact O-N 2.84Å; Q332-T336 PolarHBondContact O-OG1 2.97Å
333	A	80.9	Confident	76.3	Confident	57 Å²	57	101 Å²	101	47%	0.471	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-48.8	157.4	0	0	0	0	0	109.5	G329 L335 T336 E337	G329-A333 WeakPolarHBondContact O-CB 3.2Å; G329-A333 PolarHBondContact O-N 3.05Å; A333-L335 VanDerWaalsContact C-N 3.32Å; A333-L335 PolarHBondContact O-N 3.31Å; A333-T336 WeakPolarHBondContact CA-OG1 3.32Å; A333-T336 PolarHBondContact O-N 3.16Å; A333-T336 PolarHBondContact O-OG1 3.04Å; A333-E337 WeakPolarHBondContact O-CB 3.47Å; A333-E337 PolarHBondContact O-N 3.25Å
334	C	80.4	Confident	74.4	Confident	69 Å²	69	102.4 Å²	102.4	47%	0.466	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-36.1	173.1	-166.1	0	0	0	0	112.6	R330 L331 K338	R330-C334 WeakPolarHBondContact O-CB 3.28Å; R330-C334 PolarHBondContact O-N 3.2Å; L331-C334 CarbonylContact O-C 3.02Å; C334-K338 VanDerWaalsContact O-CB 3.31Å; C334-K338 WeakPolarHBondContact O-CB 3.33Å; C334-K338 VanDerWaalsContact O-CG 3.28Å; C334-K338 WeakPolarHBondContact O-CG 3.36Å; C334-K338 PolarHBondContact O-N 3.31Å
335	L	77	Confident	72.3	Confident	103 Å²	103	101.4 Å²	101.4	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-80.5	-22.1	175.7	-97	167.2	0	0	0	113.4	L331 Q332 A333 K338 E339	L331-L335 WeakPolarHBondContact O-CA 3.31Å; L331-L335 WeakPolarHBondContact O-CB 3.37Å; L331-L335 PolarHBondContact O-N 3.4Å; Q332-L335 CarbonylContact O-C 3.5Å; Q332-L335 PolarHBondContact O-N 2.9Å; A333-L335 VanDerWaalsContact C-N 3.32Å; A333-L335 PolarHBondContact O-N 3.31Å; L335-K338 HydrophobicContact CD2-CB 4.33Å; L335-K338 CarbonylContact O-C 3.58Å; L335-E339 WeakPolarHBondContact O-CA 3.26Å; L335-E339 WeakPolarHBondContact O-CB 3.25Å; L335-E339 WeakPolarHBondContact O-CG 3.14Å; L335-E339 PolarHBondContact O-N 2.81Å
336	T	76.8	Confident	69.8	Low	81 Å²	81	99.1 Å²	99.1	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-79.1	-30.6	167.7	54	0	0	0	0	111.6	Q332 A333 R340	Q332-T336 WeakPolarHBondContact O-CB 3.14Å; Q332-T336 VanDerWaalsContact O-CG2 3.28Å; Q332-T336 WeakPolarHBondContact O-CG2 3.5Å; Q332-T336 PolarHBondContact O-N 2.84Å; Q332-T336 PolarHBondContact O-OG1 2.97Å; A333-T336 WeakPolarHBondContact CA-OG1 3.32Å; A333-T336 PolarHBondContact O-N 3.16Å; A333-T336 PolarHBondContact O-OG1 3.04Å; T336-R340 VanDerWaalsContact O-CB 3.31Å; T336-R340 WeakPolarHBondContact O-CB 3.3Å; T336-R340 PolarHBondContact O-N 3.42Å
337	E	71.9	Confident	67.5	Low	81 Å²	81	96.1 Å²	96.1	38%	0.379	49%	0.49	S	S	.	.	H	α-helix	trans	-70.2	-39.3	167.4	171	52.2	-157.1	0	0	111	A333 R340 Q341	A333-E337 WeakPolarHBondContact O-CB 3.47Å; A333-E337 PolarHBondContact O-N 3.25Å; E337-R340 WeakPolarHBondContact O-CB 3.43Å; E337-R340 PolarHBondContact O-N 2.93Å; E337-R340 IonicContact OE1-CZ 2.67Å; E337-R340 IonicContact OE1-NE 3.91Å; E337-R340 IonicContact OE1-NH2 2.68Å; E337-R340 PolarHBondContact OE1-NH2 3.36Å; E337-R340 IonicContact OE2-CZ 2.68Å; E337-R340 IonicContact OE2-NE 3.59Å; E337-R340 PolarHBondContact OE2-NE 2.9Å; E337-R340 IonicContact OE2-NH2 3.73Å; E337-R340 PolarHBondContact OE2-NH2 3.37Å; E337-Q341 VanDerWaalsContact O-CG 3.31Å; E337-Q341 WeakPolarHBondContact O-CG 3.27Å; E337-Q341 PolarHBondContact O-N 3.49Å; E337-Q341 PolarHBondContact O-NE2 2.91Å; E337-Q341 PolarHBondContact OE1-NE2 2.87Å
338	K	67.8	Low	65	Low	106 Å²	106	101.2 Å²	101.2	46%	0.461	51%	0.511	S	S	.	.	H	α-helix	trans	-71.7	-35.3	170.7	-73.6	-78	163.2	-163.5	0	112.3	C334 L335 R340 Q341 Y342	C334-K338 VanDerWaalsContact O-CB 3.31Å; C334-K338 WeakPolarHBondContact O-CB 3.33Å; C334-K338 VanDerWaalsContact O-CG 3.28Å; C334-K338 WeakPolarHBondContact O-CG 3.36Å; C334-K338 PolarHBondContact O-N 3.31Å; L335-K338 HydrophobicContact CD2-CB 4.33Å; L335-K338 CarbonylContact O-C 3.58Å; K338-R340 VanDerWaalsContact C-N 3.33Å; K338-Q341 CarbonylContact O-C 3.57Å; K338-Q341 WeakPolarHBondContact O-CA 3.42Å; K338-Q341 VanDerWaalsContact O-CB 3.23Å; K338-Q341 WeakPolarHBondContact O-CB 3.49Å; K338-Q341 PolarHBondContact O-N 2.86Å; K338-Y342 WeakPolarHBondContact O-CA 3.36Å; K338-Y342 WeakPolarHBondContact O-CB 3.43Å; K338-Y342 PolarHBondContact O-N 2.87Å
339	E	65.2	Low	62.6	Low	81 Å²	81	104.1 Å²	104.1	38%	0.379	53%	0.529	S	S	.	.	H	α-helix	trans	-74.6	-21.6	172.6	-83.2	-172.5	-177.4	0	0	112.3	L335 Y342 K343	L335-E339 WeakPolarHBondContact O-CA 3.26Å; L335-E339 WeakPolarHBondContact O-CB 3.25Å; L335-E339 WeakPolarHBondContact O-CG 3.14Å; L335-E339 PolarHBondContact O-N 2.81Å; E339-Y342 PolarHBondContact O-N 3.27Å; E339-K343 VanDerWaalsContact O-CB 3.26Å; E339-K343 WeakPolarHBondContact O-CB 3.29Å; E339-K343 WeakPolarHBondContact O-CG 3.23Å; E339-K343 PolarHBondContact O-N 2.92Å; E339-K343 VanDerWaalsContact OE2-CE 3.28Å; E339-K343 WeakPolarHBondContact OE2-CE 3.49Å; E339-K343 IonicContact OE2-NZ 3.96Å; E339-K343 PolarHBondContact OE2-NZ 3.33Å
340	R	62.3	Low	59.9	Low	144 Å²	144	107 Å²	107	54%	0.543	54%	0.543	S	S	.	.	H	α-helix	trans	-61.8	-40.2	162	-168.4	-172.6	62.3	67.6	-1.5	109.2	T336 E337 K338	T336-R340 VanDerWaalsContact O-CB 3.31Å; T336-R340 WeakPolarHBondContact O-CB 3.3Å; T336-R340 PolarHBondContact O-N 3.42Å; E337-R340 WeakPolarHBondContact O-CB 3.43Å; E337-R340 PolarHBondContact O-N 2.93Å; E337-R340 IonicContact OE1-CZ 2.67Å; E337-R340 IonicContact OE1-NE 3.91Å; E337-R340 IonicContact OE1-NH2 2.68Å; E337-R340 PolarHBondContact OE1-NH2 3.36Å; E337-R340 IonicContact OE2-CZ 2.68Å; E337-R340 IonicContact OE2-NE 3.59Å; E337-R340 PolarHBondContact OE2-NE 2.9Å; E337-R340 IonicContact OE2-NH2 3.73Å; E337-R340 PolarHBondContact OE2-NH2 3.37Å; K338-R340 VanDerWaalsContact C-N 3.33Å
341	Q	56	Low	58.9	Low	53 Å²	53	105.2 Å²	105.2	25%	0.248	55%	0.551	C	S	.	*	T	Hydrogen-bonded Turn	trans	-82.5	-1.8	171.3	-52.5	161.9	25.6	0	0	114.2	E337 K338 I345	E337-Q341 VanDerWaalsContact O-CG 3.31Å; E337-Q341 WeakPolarHBondContact O-CG 3.27Å; E337-Q341 PolarHBondContact O-N 3.49Å; E337-Q341 PolarHBondContact O-NE2 2.91Å; E337-Q341 PolarHBondContact OE1-NE2 2.87Å; K338-Q341 CarbonylContact O-C 3.57Å; K338-Q341 WeakPolarHBondContact O-CA 3.42Å; K338-Q341 VanDerWaalsContact O-CB 3.23Å; K338-Q341 WeakPolarHBondContact O-CB 3.49Å; K338-Q341 PolarHBondContact O-N 2.86Å; Q341-I345 WeakPolarHBondContact O-CD1 3.42Å; Q341-I345 WeakPolarHBondContact O-CG1 3.22Å
342	Y	43.8	Very low	56.8	Low	121 Å²	121	109.6 Å²	109.6	48%	0.475	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.4	-16.5	-172.8	-136.2	-103.7	0	0	0	114.2	K338 E339 I345 L346	K338-Y342 WeakPolarHBondContact O-CA 3.36Å; K338-Y342 WeakPolarHBondContact O-CB 3.43Å; K338-Y342 PolarHBondContact O-N 2.87Å; E339-Y342 PolarHBondContact O-N 3.27Å; Y342-I345 HydrophobicContact CD2-CB 4.18Å; Y342-I345 HydrophobicContact CD2-CD1 4.04Å; Y342-I345 HydrophobicContact CD2-CG2 4.4Å; Y342-I345 HydrophobicContact CE2-CB 4.47Å; Y342-I345 HydrophobicContact CE2-CD1 4.31Å; Y342-I345 HydrophobicContact CE2-CG2 4.2Å; Y342-I345 HydrophobicContact CG-CB 4.34Å; Y342-I345 PolarHBondContact O-N 3.44Å; Y342-L346 HydrophobicContact CD1-CB 3.69Å; Y342-L346 HydrophobicContact CD1-CD2 4.11Å; Y342-L346 HydrophobicContact CD1-CG 4.39Å; Y342-L346 HydrophobicContact CE1-CB 3.98Å; Y342-L346 HydrophobicContact CE1-CD1 4.22Å; Y342-L346 HydrophobicContact CE1-CD2 4.09Å; Y342-L346 HydrophobicContact CE1-CG 4.32Å; Y342-L346 WeakPolarHBondContact O-CA 3.37Å; Y342-L346 WeakPolarHBondContact O-CB 3.37Å; Y342-L346 PolarHBondContact O-N 2.92Å
343	K	51.2	Low	54.8	Low	152 Å²	152	107.6 Å²	107.6	66%	0.661	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-21.6	154.5	-71.5	166.1	-179	147.2	0	110.3	E339 I345	E339-K343 VanDerWaalsContact O-CB 3.26Å; E339-K343 WeakPolarHBondContact O-CB 3.29Å; E339-K343 WeakPolarHBondContact O-CG 3.23Å; E339-K343 PolarHBondContact O-N 2.92Å; E339-K343 VanDerWaalsContact OE2-CE 3.28Å; E339-K343 WeakPolarHBondContact OE2-CE 3.49Å; E339-K343 IonicContact OE2-NZ 3.96Å; E339-K343 PolarHBondContact OE2-NZ 3.33Å; K343-I345 VanDerWaalsContact C-N 3.32Å
344	E	49.3	Very low	53	Low	152 Å²	152	112.5 Å²	112.5	71%	0.71	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-23.2	166.1	-162.7	164.9	-138.5	0	0	112.8
345	I	45.3	Very low	51.3	Low	115 Å²	115	117.3 Å²	117.3	59%	0.59	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	-36.4	-174.8	-64.8	176.1	0	0	0	113.2	Q341 Y342 K343 A347	Q341-I345 WeakPolarHBondContact O-CD1 3.42Å; Q341-I345 WeakPolarHBondContact O-CG1 3.22Å; Y342-I345 HydrophobicContact CD2-CB 4.18Å; Y342-I345 HydrophobicContact CD2-CD1 4.04Å; Y342-I345 HydrophobicContact CD2-CG2 4.4Å; Y342-I345 HydrophobicContact CE2-CB 4.47Å; Y342-I345 HydrophobicContact CE2-CD1 4.31Å; Y342-I345 HydrophobicContact CE2-CG2 4.2Å; Y342-I345 HydrophobicContact CG-CB 4.34Å; Y342-I345 PolarHBondContact O-N 3.44Å; K343-I345 VanDerWaalsContact C-N 3.32Å; I345-A347 PolarHBondContact O-N 3.22Å
346	L	38.3	Very low	50.1	Low	89 Å²	89	121.4 Å²	121.4	47%	0.466	63%	0.633	S	S	.	*			trans	-105.8	51.1	-168.6	-161.2	72.3	0	0	0	112.5	Y342 K348	Y342-L346 HydrophobicContact CD1-CB 3.69Å; Y342-L346 HydrophobicContact CD1-CD2 4.11Å; Y342-L346 HydrophobicContact CD1-CG 4.39Å; Y342-L346 HydrophobicContact CE1-CB 3.98Å; Y342-L346 HydrophobicContact CE1-CD1 4.22Å; Y342-L346 HydrophobicContact CE1-CD2 4.09Å; Y342-L346 HydrophobicContact CE1-CG 4.32Å; Y342-L346 WeakPolarHBondContact O-CA 3.37Å; Y342-L346 WeakPolarHBondContact O-CB 3.37Å; Y342-L346 PolarHBondContact O-N 2.92Å; L346-K348 PolarHBondContact O-N 2.92Å
347	A	39.7	Very low	49	Very low	88 Å²	88	122 Å²	122	73%	0.727	65%	0.646	S	S	*	*			trans	-68.1	17.1	163.2	0	0	0	0	0	113.2	I345	I345-A347 PolarHBondContact O-N 3.22Å
348	K	36.2	Very low	48.1	Very low	177 Å²	177	125 Å²	125	77%	0.77	67%	0.665	S	S	*	*	S	Bend	trans	-148.3	65.6	-167	-62	-170.9	179.9	178.6	0	113.8	L346	L346-K348 PolarHBondContact O-N 2.92Å
349	V	34.2	Very low	47.6	Very low	136 Å²	136	128.9 Å²	128.9	82%	0.824	68%	0.681	S	S	*	*			trans	45.1	152.1	133	-174.4	0	0	0	0	121.2
350	S	29.8	Very low	47.4	Very low	96 Å²	96	130.2 Å²	130.2	67%	0.671	69%	0.687	S	S	*	*			trans	-114	-132.9	-170.7	-48.8	0	0	0	0	115.1
351	P	65.7	Low	47.2	Very low	115 Å²	115	130 Å²	130	75%	0.747	69%	0.693	S	S	*	*				-133.1	-142.6	-104.3	41.2	-20.2	0	0	0	115.8
352	L	38.9	Very low	47.5	Very low	171 Å²	171	133.4 Å²	133.4	90%	0.895	71%	0.712	S	S	*	*			trans	82.7	154.2	-179.8	-90.8	66.4	0	0	0	116.9
353	G	41.3	Very low	48.7	Very low	72 Å²	72	135 Å²	135	74%	0.742	72%	0.717	S	S	*	*			cis	-176.8	173.9	-0.9	0	0	0	0	0	111.6
354	D	42.3	Very low	49.5	Very low	160 Å²	160	134 Å²	134	86%	0.856	72%	0.715	S	S	*	*			trans	-141.4	149.2	-167.8	-153.6	-14.5	0	0	0	114.4
355	M	44.4	Very low	50.7	Low	171 Å²	171	134 Å²	134	84%	0.842	71%	0.713	S	S	*	*			trans	-161.8	95.7	-179.4	-164	-163.1	85.1	0	0	114.9
356	K	51.8	Low	51.9	Low	188 Å²	188	134.6 Å²	134.6	82%	0.817	71%	0.713	S	S	*	*			trans	-137.3	-22.2	169.7	-80.8	-175.5	178.6	171.7	0	117.5	L358	K356-L358 VanDerWaalsContact C-N 3.29Å; K356-L358 PolarHBondContact O-N 3.3Å; K356-L358 VanDerWaalsContact O-N 3.15Å
357	A	54.3	Low	53.7	Low	93 Å²	93	135.3 Å²	135.3	77%	0.769	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-64.4	-23.4	-166.9	0	0	0	0	0	116	K359	A357-K359 VanDerWaalsContact C-N 3.35Å; A357-K359 PolarHBondContact O-N 2.88Å
358	L	53.1	Low	55.2	Low	146 Å²	146	137.4 Å²	137.4	76%	0.764	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-75.8	-13.6	-165.6	-145.9	74.4	0	0	0	115.3	K356	K356-L358 VanDerWaalsContact C-N 3.29Å; K356-L358 PolarHBondContact O-N 3.3Å; K356-L358 VanDerWaalsContact O-N 3.15Å
359	K	56.9	Low	57.1	Low	187 Å²	187	134.2 Å²	134.2	81%	0.813	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-82.1	-28.9	-174.9	-82	-167.5	171.4	-172	0	115.1	A357	A357-K359 VanDerWaalsContact C-N 3.35Å; A357-K359 PolarHBondContact O-N 2.88Å
360	E	61.4	Low	59.1	Low	108 Å²	108	133.8 Å²	133.8	51%	0.505	69%	0.692	S	S	.	*	H	α-helix	trans	-76.5	-30.1	-173.6	-162.7	60.2	-150.4	0	0	112.7	L362 R363	E360-L362 VanDerWaalsContact C-N 3.27Å; E360-L362 PolarHBondContact O-N 2.89Å; E360-R363 IonicContact OE1-NH1 3.09Å
361	Q	58.2	Low	61.2	Low	140 Å²	140	131.8 Å²	131.8	65%	0.654	68%	0.681	S	S	*	*	H	α-helix	trans	-68	-23.4	-178.1	-69.8	-174.6	-19.4	0	0	114
362	L	62.3	Low	61.5	Low	124 Å²	124	131.3 Å²	131.3	65%	0.649	67%	0.672	S	S	*	*	H	α-helix	trans	-70.7	-49	-178.4	-172.2	65.1	0	0	0	111.1	E360 Q364 K365	E360-L362 VanDerWaalsContact C-N 3.27Å; E360-L362 PolarHBondContact O-N 2.89Å; L362-Q364 VanDerWaalsContact C-N 3.31Å; L362-Q364 PolarHBondContact O-N 3.01Å; L362-K365 PolarHBondContact O-N 3.2Å
363	R	67.9	Low	63.2	Low	155 Å²	155	129.3 Å²	129.3	59%	0.585	66%	0.658	S	S	*	*	H	α-helix	trans	-55.2	-43.1	-178.1	179.8	-177.3	171	-160.3	0.1	112.8	E360 K365 E366	E360-R363 IonicContact OE1-NH1 3.09Å; R363-K365 PolarHBondContact O-N 3.35Å; R363-E366 PolarHBondContact O-N 2.9Å; R363-E366 VanDerWaalsContact O-N 3.15Å
364	Q	69.3	Low	64.8	Low	131 Å²	131	132 Å²	132	61%	0.612	65%	0.651	S	S	*	*	H	α-helix	trans	-64	-10.8	-179.4	-66.8	-174.1	-10.8	0	0	114.5	L362	L362-Q364 VanDerWaalsContact C-N 3.31Å; L362-Q364 PolarHBondContact O-N 3.01Å
365	K	72.6	Confident	66.5	Low	153 Å²	153	130.3 Å²	130.3	67%	0.665	64%	0.638	S	S	*	*	H	α-helix	trans	-97.3	-18.4	176.6	-66.1	-56.8	-173.1	-174.1	0	114.1	L362 R363	L362-K365 PolarHBondContact O-N 3.2Å; R363-K365 PolarHBondContact O-N 3.35Å
366	E	72.4	Confident	67.9	Low	127 Å²	127	125.9 Å²	125.9	59%	0.593	62%	0.624	S	S	*	*	H	α-helix	trans	-76.4	-47.1	178.5	-63.9	176.3	121.7	0	0	110.5	R363 Q368 L369 Q370	R363-E366 PolarHBondContact O-N 2.9Å; R363-E366 VanDerWaalsContact O-N 3.15Å; E366-Q368 VanDerWaalsContact C-N 3.26Å; E366-Q368 PolarHBondContact O-N 3.5Å; E366-L369 WeakPolarHBondContact O-CB 3.43Å; E366-L369 PolarHBondContact O-N 3.4Å; E366-L369 VanDerWaalsContact O-N 3.11Å; E366-Q370 PolarHBondContact O-N 3.47Å
367	D	74.4	Confident	69.3	Low	104 Å²	104	120.6 Å²	120.6	56%	0.556	61%	0.611	S	S	*	*	H	α-helix	trans	-56	-39.7	176.3	-62.1	-29	0	0	0	112.3	L369 Q370	D367-L369 VanDerWaalsContact C-N 3.31Å; D367-L369 PolarHBondContact O-N 3.02Å; D367-Q370 PolarHBondContact O-N 3.44Å
368	Q	72.8	Confident	70.4	Confident	132 Å²	132	121.6 Å²	121.6	62%	0.617	60%	0.603	S	S	*	*	H	α-helix	trans	-66	-30.6	-179.1	-170.5	71.8	83.5	0	0	113.1	E366	E366-Q368 VanDerWaalsContact C-N 3.26Å; E366-Q368 PolarHBondContact O-N 3.5Å
369	L	76.1	Confident	71.8	Confident	110 Å²	110	119.4 Å²	119.4	58%	0.576	59%	0.591	S	S	*	*	H	α-helix	trans	-73.1	-38.5	179.9	-174.4	67.5	0	0	0	111.3	E366 D367 N372 Q373	E366-L369 WeakPolarHBondContact O-CB 3.43Å; E366-L369 PolarHBondContact O-N 3.4Å; E366-L369 VanDerWaalsContact O-N 3.11Å; D367-L369 VanDerWaalsContact C-N 3.31Å; D367-L369 PolarHBondContact O-N 3.02Å; L369-N372 PolarHBondContact O-N 2.81Å; L369-Q373 PolarHBondContact O-N 3.45Å
370	Q	74.4	Confident	72.7	Confident	127 Å²	127	112.6 Å²	112.6	59%	0.593	57%	0.569	S	S	*	*	H	α-helix	trans	-69.1	-38.2	-173.6	-158.2	173	42.4	0	0	112.4	E366 D367 N372 Q373 Q374	E366-Q370 PolarHBondContact O-N 3.47Å; D367-Q370 PolarHBondContact O-N 3.44Å; Q370-N372 VanDerWaalsContact C-N 3.33Å; Q370-N372 PolarHBondContact O-N 2.93Å; Q370-Q373 PolarHBondContact O-N 2.89Å; Q370-Q374 PolarHBondContact O-N 3.33Å
371	A	73.8	Confident	73.6	Confident	54 Å²	54	108.7 Å²	108.7	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-61.6	-39.7	173.4	0	0	0	0	0	112.6	Q373 Q374 Q375	A371-Q373 VanDerWaalsContact C-N 3.33Å; A371-Q373 PolarHBondContact O-N 3.22Å; A371-Q374 PolarHBondContact O-N 2.69Å; A371-Q375 PolarHBondContact O-N 2.87Å
372	N	73.4	Confident	74.9	Confident	105 Å²	105	107.9 Å²	107.9	56%	0.561	55%	0.552	S	S	*	*	H	α-helix	trans	-69.3	-32.2	-177.6	-150.6	-4.6	0	0	0	111.9	L369 Q370 Q375 S376	L369-N372 PolarHBondContact O-N 2.81Å; Q370-N372 VanDerWaalsContact C-N 3.33Å; Q370-N372 PolarHBondContact O-N 2.93Å; N372-Q375 PolarHBondContact O-N 2.97Å; N372-S376 PolarHBondContact O-N 2.83Å
373	Q	73.3	Confident	75.9	Confident	128 Å²	128	108.2 Å²	108.2	60%	0.598	55%	0.554	S	S	*	*	H	α-helix	trans	-65.9	-35.2	172.4	-70.4	-179.9	-15.7	0	0	112.8	L369 Q370 A371 S376 S377	L369-Q373 PolarHBondContact O-N 3.45Å; Q370-Q373 PolarHBondContact O-N 2.89Å; A371-Q373 VanDerWaalsContact C-N 3.33Å; A371-Q373 PolarHBondContact O-N 3.22Å; Q373-S376 PolarHBondContact O-N 2.98Å; Q373-S377 PolarHBondContact O-N 3.07Å
374	Q	75.9	Confident	76.6	Confident	130 Å²	130	108.3 Å²	108.3	61%	0.607	55%	0.554	S	S	*	*	H	α-helix	trans	-70.9	-37.7	176.5	-67.2	-179.4	-7.9	0	0	112.3	Q370 A371 S376 S377	Q370-Q374 PolarHBondContact O-N 3.33Å; A371-Q374 PolarHBondContact O-N 2.69Å; Q374-S376 VanDerWaalsContact C-N 3.28Å; Q374-S376 PolarHBondContact O-N 2.88Å; Q374-S377 PolarHBondContact O-N 3.23Å; Q374-S377 PolarHBondContact O-OG 3.43Å
375	Q	78.6	Confident	77.3	Confident	124 Å²	124	107.1 Å²	107.1	58%	0.579	55%	0.552	S	S	*	*	H	α-helix	trans	-62.6	-36.8	175.5	-172.2	173.2	-3.6	0	0	112.1	A371 N372 S377 L379	A371-Q375 PolarHBondContact O-N 2.87Å; N372-Q375 PolarHBondContact O-N 2.97Å; Q375-S377 PolarHBondContact O-N 2.73Å; Q375-L379 PolarHBondContact O-N 3.22Å
376	S	74	Confident	77.7	Confident	78 Å²	78	102.7 Å²	102.7	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-64.9	-35.3	178.1	-170.7	0	0	0	0	113.5	N372 Q373 Q374 A380	N372-S376 PolarHBondContact O-N 2.83Å; Q373-S376 PolarHBondContact O-N 2.98Å; Q374-S376 VanDerWaalsContact C-N 3.28Å; Q374-S376 PolarHBondContact O-N 2.88Å; S376-A380 WeakPolarHBondContact O-CB 3.33Å; S376-A380 PolarHBondContact O-N 3.32Å
377	S	79.3	Confident	78.2	Confident	76 Å²	76	98.8 Å²	98.8	53%	0.531	53%	0.531	S	S	.	.	H	α-helix	trans	-74.2	-29.3	-178.2	69.2	0	0	0	0	113.6	Q373 Q374 Q375 A381	Q373-S377 PolarHBondContact O-N 3.07Å; Q374-S377 PolarHBondContact O-N 3.23Å; Q374-S377 PolarHBondContact O-OG 3.43Å; Q375-S377 PolarHBondContact O-N 2.73Å; S377-A381 PolarHBondContact O-N 3.18Å
378	L	79.1	Confident	78.7	Confident	115 Å²	115	95.8 Å²	95.8	60%	0.602	52%	0.518	S	S	*	.	H	α-helix	trans	-69	-49.9	174.6	-67.4	172.1	0	0	0	111.5	A380 A381 E382	L378-A380 PolarHBondContact O-N 3.41Å; L378-A381 WeakPolarHBondContact O-CA 3.3Å; L378-A381 WeakPolarHBondContact O-CB 3.44Å; L378-A381 PolarHBondContact O-N 2.67Å; L378-E382 PolarHBondContact O-N 2.68Å
379	L	82.1	Confident	79.1	Confident	100 Å²	100	91.7 Å²	91.7	52%	0.524	51%	0.506	S	S	.	.	H	α-helix	trans	-57.8	-36.2	175.2	-66.6	169.8	0	0	0	111.9	Q375 A381 L383	Q375-L379 PolarHBondContact O-N 3.22Å; L379-A381 VanDerWaalsContact C-N 3.28Å; L379-A381 PolarHBondContact O-N 3.5Å; L379-L383 WeakPolarHBondContact O-CB 3.3Å; L379-L383 PolarHBondContact O-N 3.3Å; L379-L383 VanDerWaalsContact O-N 3.12Å
380	A	75.8	Confident	79.6	Confident	43 Å²	43	93.9 Å²	93.9	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-69.5	-21	174.6	0	0	0	0	0	113.7	S376 L378 R384	S376-A380 WeakPolarHBondContact O-CB 3.33Å; S376-A380 PolarHBondContact O-N 3.32Å; L378-A380 PolarHBondContact O-N 3.41Å; A380-R384 WeakPolarHBondContact O-CG 3.46Å; A380-R384 VanDerWaalsContact O-CZ 3.29Å; A380-R384 PolarHBondContact O-NH1 3.41Å
381	A	79.8	Confident	80.2	Confident	27 Å²	27	91.5 Å²	91.5	22%	0.223	50%	0.499	C	S	.	.	H	α-helix	trans	-80.6	-50.1	171.9	0	0	0	0	0	111.4	S377 L378 L379 L383 R384 D385	S377-A381 PolarHBondContact O-N 3.18Å; L378-A381 WeakPolarHBondContact O-CA 3.3Å; L378-A381 WeakPolarHBondContact O-CB 3.44Å; L378-A381 PolarHBondContact O-N 2.67Å; L379-A381 VanDerWaalsContact C-N 3.28Å; L379-A381 PolarHBondContact O-N 3.5Å; A381-L383 PolarHBondContact O-N 3.08Å; A381-R384 WeakPolarHBondContact O-CB 3.4Å; A381-R384 PolarHBondContact O-N 2.87Å; A381-D385 PolarHBondContact O-N 3.01Å
382	E	85.9	Confident	80.8	Confident	122 Å²	122	95.9 Å²	95.9	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-52.7	-41	176.7	-67.1	171	-178.9	0	0	111.9	L378 R384 D385 A386	L378-E382 PolarHBondContact O-N 2.68Å; E382-R384 PolarHBondContact O-N 3.18Å; E382-D385 PolarHBondContact O-N 3.36Å; E382-A386 VanDerWaalsContact O-CB 3.31Å; E382-A386 WeakPolarHBondContact O-CB 3.1Å; E382-A386 PolarHBondContact O-N 2.92Å
383	L	82.2	Confident	81.4	Confident	131 Å²	131	94.2 Å²	94.2	69%	0.686	50%	0.497	S	S	*	.	H	α-helix	trans	-65.4	-33.7	177	-173.7	67.7	0	0	0	113.5	L379 A381 S387	L379-L383 WeakPolarHBondContact O-CB 3.3Å; L379-L383 PolarHBondContact O-N 3.3Å; L379-L383 VanDerWaalsContact O-N 3.12Å; A381-L383 PolarHBondContact O-N 3.08Å; L383-S387 PolarHBondContact O-N 3.43Å; L383-S387 VanDerWaalsContact O-N 3.12Å
384	R	83.3	Confident	82.1	Confident	157 Å²	157	93.8 Å²	93.8	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-71.4	-43.7	175	-69.8	-174.5	-57.4	-96	6	111	A380 A381 E382 A386 S387 S388	A380-R384 WeakPolarHBondContact O-CG 3.46Å; A380-R384 VanDerWaalsContact O-CZ 3.29Å; A380-R384 PolarHBondContact O-NH1 3.41Å; A381-R384 WeakPolarHBondContact O-CB 3.4Å; A381-R384 PolarHBondContact O-N 2.87Å; E382-R384 PolarHBondContact O-N 3.18Å; R384-A386 VanDerWaalsContact C-N 3.34Å; R384-A386 PolarHBondContact O-N 2.88Å; R384-S387 PolarHBondContact O-N 3.02Å; R384-S388 PolarHBondContact O-N 2.86Å
385	D	84.2	Confident	82.6	Confident	106 Å²	106	91.4 Å²	91.4	57%	0.567	49%	0.494	S	S	*	.	H	α-helix	trans	-64.8	-41.8	180	-66	-22.5	0	0	0	110.6	A381 E382 S388 A389	A381-D385 PolarHBondContact O-N 3.01Å; E382-D385 PolarHBondContact O-N 3.36Å; D385-S388 PolarHBondContact O-N 3.2Å; D385-S388 PolarHBondContact O-OG 2.81Å; D385-A389 PolarHBondContact O-N 2.86Å
386	A	81.3	Confident	83.1	Confident	60 Å²	60	90.9 Å²	90.9	50%	0.496	49%	0.492	S	S	.	.	H	α-helix	trans	-59.9	-43.6	172.5	0	0	0	0	0	113.1	E382 R384 A389 R390	E382-A386 VanDerWaalsContact O-CB 3.31Å; E382-A386 WeakPolarHBondContact O-CB 3.1Å; E382-A386 PolarHBondContact O-N 2.92Å; R384-A386 VanDerWaalsContact C-N 3.34Å; R384-A386 PolarHBondContact O-N 2.88Å; A386-A389 PolarHBondContact O-N 3.46Å; A386-R390 PolarHBondContact O-N 2.84Å
387	S	81.9	Confident	83.7	Confident	45 Å²	45	92.4 Å²	92.4	32%	0.315	49%	0.493	S	S	.	.	H	α-helix	trans	-60.9	-46.5	172.8	-164.9	0	0	0	0	110.9	L383 R384 A389 R390 D391	L383-S387 PolarHBondContact O-N 3.43Å; L383-S387 VanDerWaalsContact O-N 3.12Å; R384-S387 PolarHBondContact O-N 3.02Å; S387-A389 PolarHBondContact O-N 2.96Å; S387-R390 WeakPolarHBondContact O-CB 3.49Å; S387-R390 PolarHBondContact O-N 3.07Å; S387-R390 VanDerWaalsContact O-N 3.13Å; S387-R390 PolarHBondContact OG-NH2 2.84Å; S387-D391 WeakPolarHBondContact O-CB 3.04Å; S387-D391 PolarHBondContact O-N 3.34Å; S387-D391 PolarHBondContact OG-OD2 3.47Å
388	S	84.5	Confident	84.2	Confident	41 Å²	41	95.9 Å²	95.9	29%	0.287	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-28	-179.8	84.6	0	0	0	0	113.5	R384 D385 R392	R384-S388 PolarHBondContact O-N 2.86Å; D385-S388 PolarHBondContact O-N 3.2Å; D385-S388 PolarHBondContact O-OG 2.81Å; S388-R392 WeakPolarHBondContact O-CB 3.47Å; S388-R392 WeakPolarHBondContact O-CG 3.24Å; S388-R392 PolarHBondContact O-N 2.95Å; S388-R392 PolarHBondContact O-NE 3.26Å; S388-R392 PolarHBondContact OG-NH2 3Å
389	A	83.1	Confident	84.7	Confident	46 Å²	46	96.2 Å²	96.2	38%	0.38	49%	0.494	S	S	.	.	H	α-helix	trans	-77.5	-42.1	175.2	0	0	0	0	0	111.7	D385 A386 S387 D391 R392 T393	D385-A389 PolarHBondContact O-N 2.86Å; A386-A389 PolarHBondContact O-N 3.46Å; S387-A389 PolarHBondContact O-N 2.96Å; A389-D391 VanDerWaalsContact C-N 3.32Å; A389-D391 PolarHBondContact O-N 3.34Å; A389-R392 PolarHBondContact O-N 2.9Å; A389-T393 WeakPolarHBondContact O-CG2 3.29Å; A389-T393 PolarHBondContact O-N 3.32Å; A389-T393 PolarHBondContact O-OG1 3.24Å
390	R	85.4	Confident	85	Confident	157 Å²	157	97.1 Å²	97.1	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-58.8	-44.4	171.4	-175.4	-159.4	67.7	-171.3	-6.1	111.4	A386 S387 T393 M394	A386-R390 PolarHBondContact O-N 2.84Å; S387-R390 WeakPolarHBondContact O-CB 3.49Å; S387-R390 PolarHBondContact O-N 3.07Å; S387-R390 VanDerWaalsContact O-N 3.13Å; S387-R390 PolarHBondContact OG-NH2 2.84Å; R390-T393 WeakPolarHBondContact CA-OG1 3.42Å; R390-T393 PolarHBondContact O-N 3.11Å; R390-T393 PolarHBondContact O-OG1 3.17Å; R390-T393 VanDerWaalsContact O-OG1 3.05Å; R390-M394 WeakPolarHBondContact O-CB 3.46Å; R390-M394 PolarHBondContact O-N 3.28Å
391	D	86.7	Confident	85.7	Confident	77 Å²	77	101.1 Å²	101.1	41%	0.412	51%	0.506	S	S	.	.	H	α-helix	trans	-73	-33.3	-173.8	-58.8	-26.2	0	0	0	111.2	S387 A389 S395	S387-D391 WeakPolarHBondContact O-CB 3.04Å; S387-D391 PolarHBondContact O-N 3.34Å; S387-D391 PolarHBondContact OG-OD2 3.47Å; A389-D391 VanDerWaalsContact C-N 3.32Å; A389-D391 PolarHBondContact O-N 3.34Å; D391-S395 PolarHBondContact O-N 2.96Å
392	R	86.4	Confident	86.2	Confident	146 Å²	146	104 Å²	104	55%	0.551	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-54	168	-82	177.6	-82.5	174.7	-8.3	112.6	S388 A389 M394 S395 E396	S388-R392 WeakPolarHBondContact O-CB 3.47Å; S388-R392 WeakPolarHBondContact O-CG 3.24Å; S388-R392 PolarHBondContact O-N 2.95Å; S388-R392 PolarHBondContact O-NE 3.26Å; S388-R392 PolarHBondContact OG-NH2 3Å; A389-R392 PolarHBondContact O-N 2.9Å; R392-M394 PolarHBondContact O-N 3.48Å; R392-S395 WeakPolarHBondContact O-CA 3.28Å; R392-S395 WeakPolarHBondContact O-CB 3.36Å; R392-S395 PolarHBondContact O-N 3.08Å; R392-E396 WeakPolarHBondContact O-CG 3.46Å; R392-E396 PolarHBondContact O-N 3.45Å
393	T	87.1	Confident	86.4	Confident	69 Å²	69	102.7 Å²	102.7	42%	0.423	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-30.5	-179.9	47.7	0	0	0	0	112.9	A389 R390 E396 L397	A389-T393 WeakPolarHBondContact O-CG2 3.29Å; A389-T393 PolarHBondContact O-N 3.32Å; A389-T393 PolarHBondContact O-OG1 3.24Å; R390-T393 WeakPolarHBondContact CA-OG1 3.42Å; R390-T393 PolarHBondContact O-N 3.11Å; R390-T393 PolarHBondContact O-OG1 3.17Å; R390-T393 VanDerWaalsContact O-OG1 3.05Å; T393-E396 PolarHBondContact O-N 3.42Å; T393-L397 WeakPolarHBondContact O-CB 3.45Å; T393-L397 VanDerWaalsContact O-CG 3.3Å; T393-L397 WeakPolarHBondContact O-CG 3.29Å; T393-L397 PolarHBondContact O-N 3.23Å
394	M	86.6	Confident	86.5	Confident	119 Å²	119	98.1 Å²	98.1	59%	0.586	49%	0.492	S	S	*	.	H	α-helix	trans	-68.1	-38.2	171.3	-167.9	92.1	-60.6	0	0	112.5	R390 R392 L397 Y398	R390-M394 WeakPolarHBondContact O-CB 3.46Å; R390-M394 PolarHBondContact O-N 3.28Å; R392-M394 PolarHBondContact O-N 3.48Å; M394-L397 HydrophobicContact CE-CB 4.36Å; M394-L397 HydrophobicContact CE-CD1 3.78Å; M394-Y398 WeakPolarHBondContact O-CB 3.42Å; M394-Y398 PolarHBondContact O-N 3.09Å
395	S	87.6	Confident	86.7	Confident	80 Å²	80	93.7 Å²	93.7	56%	0.559	48%	0.481	S	S	*	.	H	α-helix	trans	-66.5	-39.5	173.8	-167.6	0	0	0	0	112.2	D391 R392 Y398 H399	D391-S395 PolarHBondContact O-N 2.96Å; R392-S395 WeakPolarHBondContact O-CA 3.28Å; R392-S395 WeakPolarHBondContact O-CB 3.36Å; R392-S395 PolarHBondContact O-N 3.08Å; S395-Y398 PolarHBondContact O-N 2.96Å; S395-H399 PolarHBondContact O-N 3.49Å
396	E	88.2	Confident	87.1	Confident	113 Å²	113	91.3 Å²	91.3	53%	0.528	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-45.3	175.9	-69.8	158.5	-167.1	0	0	111.3	R392 T393 Y398 H399 M400	R392-E396 WeakPolarHBondContact O-CG 3.46Å; R392-E396 PolarHBondContact O-N 3.45Å; T393-E396 PolarHBondContact O-N 3.42Å; E396-Y398 VanDerWaalsContact C-N 3.3Å; E396-Y398 PolarHBondContact O-N 3.41Å; E396-H399 PolarHBondContact O-N 3.16Å; E396-M400 WeakPolarHBondContact O-CG 3.43Å; E396-M400 PolarHBondContact O-N 2.98Å
397	L	88.1	Confident	87.4	Confident	110 Å²	110	94 Å²	94	58%	0.576	48%	0.481	S	S	*	.	H	α-helix	trans	-62.7	-34.4	173.9	-74.9	168.7	0	0	0	112.8	T393 M394 K401	T393-L397 WeakPolarHBondContact O-CB 3.45Å; T393-L397 VanDerWaalsContact O-CG 3.3Å; T393-L397 WeakPolarHBondContact O-CG 3.29Å; T393-L397 PolarHBondContact O-N 3.23Å; M394-L397 HydrophobicContact CE-CB 4.36Å; M394-L397 HydrophobicContact CE-CD1 3.78Å; L397-K401 WeakPolarHBondContact O-CB 3.46Å; L397-K401 PolarHBondContact O-N 3.4Å
398	Y	89.4	Confident	87.7	Confident	150 Å²	150	99.1 Å²	99.1	59%	0.588	49%	0.493	S	S	*	.	H	α-helix	trans	-67.7	-42.3	173.9	-176	-103.4	0	0	0	111.9	M394 S395 E396 K401 L402	M394-Y398 WeakPolarHBondContact O-CB 3.42Å; M394-Y398 PolarHBondContact O-N 3.09Å; S395-Y398 PolarHBondContact O-N 2.96Å; E396-Y398 VanDerWaalsContact C-N 3.3Å; E396-Y398 PolarHBondContact O-N 3.41Å; Y398-K401 PolarHBondContact O-N 2.86Å; Y398-L402 HydrophobicContact CD1-CD1 4.03Å; Y398-L402 HydrophobicContact CE1-CD1 3.55Å; Y398-L402 HydrophobicContact CE1-CG 4.22Å; Y398-L402 PolarHBondContact O-N 2.96Å
399	H	89.8	Confident	88	Confident	122 Å²	122	102.9 Å²	102.9	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-49.1	173.9	-168.3	-71.9	0	0	0	111.8	S395 E396 K401 L402 E403	S395-H399 PolarHBondContact O-N 3.49Å; E396-H399 PolarHBondContact O-N 3.16Å; H399-K401 PolarHBondContact O-N 3.01Å; H399-L402 PolarHBondContact O-N 2.92Å; H399-L402 VanDerWaalsContact O-N 3.11Å; H399-E403 IonicContact CE1-OE2 3.44Å; H399-E403 IonicContact ND1-OE2 3.94Å; H399-E403 WeakPolarHBondContact O-CB 3.37Å; H399-E403 PolarHBondContact O-N 2.8Å
400	M	87.9	Confident	88.3	Confident	118 Å²	118	103 Å²	103	58%	0.581	51%	0.508	S	S	*	.	H	α-helix	trans	-57.8	-34.6	176.1	-71.9	-121.6	71.6	0	0	112.4	E396 A404	E396-M400 WeakPolarHBondContact O-CG 3.43Å; E396-M400 PolarHBondContact O-N 2.98Å; M400-A404 VanDerWaalsContact O-CB 3.27Å; M400-A404 WeakPolarHBondContact O-CB 3.43Å; M400-A404 PolarHBondContact O-N 3.16Å
401	K	90.1	Very high	88.4	Confident	128 Å²	128	101.9 Å²	101.9	56%	0.557	51%	0.507	S	S	*	.	H	α-helix	trans	-67.2	-48.5	173.9	-171.8	-169.9	170.9	-166.2	0	111.7	L397 Y398 H399 E403 A404 D405	L397-K401 WeakPolarHBondContact O-CB 3.46Å; L397-K401 PolarHBondContact O-N 3.4Å; Y398-K401 PolarHBondContact O-N 2.86Å; H399-K401 PolarHBondContact O-N 3.01Å; K401-E403 VanDerWaalsContact C-N 3.29Å; K401-E403 PolarHBondContact O-N 3.37Å; K401-A404 PolarHBondContact O-N 2.83Å; K401-D405 VanDerWaalsContact CE-OD2 3.29Å; K401-D405 WeakPolarHBondContact CE-OD2 3.32Å; K401-D405 WeakPolarHBondContact O-CB 3.32Å; K401-D405 VanDerWaalsContact O-CG 3.28Å; K401-D405 PolarHBondContact O-N 3.23Å
402	L	90.6	Very high	88.4	Confident	88 Å²	88	100.9 Å²	100.9	46%	0.461	51%	0.509	S	S	.	.	H	α-helix	trans	-59.2	-41.7	177.9	-71.1	175.1	0	0	0	111.8	Y398 H399 D405 A406	Y398-L402 HydrophobicContact CD1-CD1 4.03Å; Y398-L402 HydrophobicContact CE1-CD1 3.55Å; Y398-L402 HydrophobicContact CE1-CG 4.22Å; Y398-L402 PolarHBondContact O-N 2.96Å; H399-L402 PolarHBondContact O-N 2.92Å; H399-L402 VanDerWaalsContact O-N 3.11Å; L402-D405 PolarHBondContact O-N 3Å; L402-A406 WeakPolarHBondContact O-CB 3.47Å; L402-A406 PolarHBondContact O-N 3.49Å
403	E	90.6	Very high	88.6	Confident	93 Å²	93	98.3 Å²	98.3	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-64.9	-43.5	176.2	-172	173.5	-178.4	0	0	111.9	H399 K401 D405 A406 L407	H399-E403 IonicContact CE1-OE2 3.44Å; H399-E403 IonicContact ND1-OE2 3.94Å; H399-E403 WeakPolarHBondContact O-CB 3.37Å; H399-E403 PolarHBondContact O-N 2.8Å; K401-E403 VanDerWaalsContact C-N 3.29Å; K401-E403 PolarHBondContact O-N 3.37Å; E403-D405 VanDerWaalsContact C-N 3.35Å; E403-D405 PolarHBondContact O-N 3.29Å; E403-A406 PolarHBondContact O-N 2.97Å; E403-L407 WeakPolarHBondContact O-CB 3.45Å; E403-L407 WeakPolarHBondContact O-CG 3.4Å; E403-L407 PolarHBondContact O-N 3.16Å
404	A	82.8	Confident	88.4	Confident	35 Å²	35	97.2 Å²	97.2	29%	0.289	50%	0.501	S	S	.	.	H	α-helix	trans	-66.2	-34.2	174	0	0	0	0	0	112.9	M400 K401 R408	M400-A404 VanDerWaalsContact O-CB 3.27Å; M400-A404 WeakPolarHBondContact O-CB 3.43Å; M400-A404 PolarHBondContact O-N 3.16Å; K401-A404 PolarHBondContact O-N 2.83Å; A404-R408 WeakPolarHBondContact O-CG 3.4Å; A404-R408 PolarHBondContact O-N 3.49Å; A404-R408 PolarHBondContact O-NH1 2.81Å
405	D	89.4	Confident	88.4	Confident	65 Å²	65	96.9 Å²	96.9	35%	0.348	50%	0.498	S	S	.	.	H	α-helix	trans	-72.2	-38.9	176.5	-69.9	-16.9	0	0	0	110.4	K401 L402 E403 R408 Q409	K401-D405 VanDerWaalsContact CE-OD2 3.29Å; K401-D405 WeakPolarHBondContact CE-OD2 3.32Å; K401-D405 WeakPolarHBondContact O-CB 3.32Å; K401-D405 VanDerWaalsContact O-CG 3.28Å; K401-D405 PolarHBondContact O-N 3.23Å; L402-D405 PolarHBondContact O-N 3Å; E403-D405 VanDerWaalsContact C-N 3.35Å; E403-D405 PolarHBondContact O-N 3.29Å; D405-R408 WeakPolarHBondContact O-CB 3.49Å; D405-R408 PolarHBondContact O-N 2.88Å; D405-R408 IonicContact OD1-CZ 3.93Å; D405-R408 IonicContact OD1-NH1 3.41Å; D405-R408 PolarHBondContact OD1-NH1 3.18Å; D405-Q409 PolarHBondContact O-N 3.46Å
406	A	90.5	Very high	88.4	Confident	55 Å²	55	95.9 Å²	95.9	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-41.7	170.8	0	0	0	0	0	112.6	L402 E403 R408 Q409 A410	L402-A406 WeakPolarHBondContact O-CB 3.47Å; L402-A406 PolarHBondContact O-N 3.49Å; E403-A406 PolarHBondContact O-N 2.97Å; A406-R408 VanDerWaalsContact C-N 3.32Å; A406-R408 PolarHBondContact O-N 2.9Å; A406-Q409 PolarHBondContact O-N 2.92Å; A406-A410 WeakPolarHBondContact O-CB 3.47Å; A406-A410 PolarHBondContact O-N 2.89Å
407	L	89.1	Confident	88.4	Confident	117 Å²	117	96.4 Å²	96.4	61%	0.613	50%	0.497	S	S	*	.	H	α-helix	trans	-65.7	-32.6	174.2	-73.7	169.7	0	0	0	112.6	E403 K411	E403-L407 WeakPolarHBondContact O-CB 3.45Å; E403-L407 WeakPolarHBondContact O-CG 3.4Å; E403-L407 PolarHBondContact O-N 3.16Å; L407-K411 WeakPolarHBondContact O-CB 3.39Å; L407-K411 PolarHBondContact O-N 2.94Å
408	R	88.8	Confident	87.9	Confident	152 Å²	152	94.3 Å²	94.3	57%	0.574	49%	0.492	S	S	*	.	H	α-helix	trans	-68	-40.3	170.9	-74.2	179.3	-161.4	94.6	-18.9	111.8	A404 D405 A406 K411 A412	A404-R408 WeakPolarHBondContact O-CG 3.4Å; A404-R408 PolarHBondContact O-N 3.49Å; A404-R408 PolarHBondContact O-NH1 2.81Å; D405-R408 WeakPolarHBondContact O-CB 3.49Å; D405-R408 PolarHBondContact O-N 2.88Å; D405-R408 IonicContact OD1-CZ 3.93Å; D405-R408 IonicContact OD1-NH1 3.41Å; D405-R408 PolarHBondContact OD1-NH1 3.18Å; A406-R408 VanDerWaalsContact C-N 3.32Å; A406-R408 PolarHBondContact O-N 2.9Å; R408-K411 PolarHBondContact O-N 3.37Å; R408-A412 WeakPolarHBondContact O-CB 3.36Å; R408-A412 PolarHBondContact O-N 2.88Å
409	Q	90.8	Very high	87.9	Confident	121 Å²	121	90.9 Å²	90.9	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-63.6	-50.7	174.7	179.3	175.6	-19.9	0	0	111.1	D405 A406 K411 A412 E413	D405-Q409 PolarHBondContact O-N 3.46Å; A406-Q409 PolarHBondContact O-N 2.92Å; Q409-K411 VanDerWaalsContact C-N 3.25Å; Q409-K411 PolarHBondContact O-N 3.08Å; Q409-A412 CarbonylContact O-C 3.57Å; Q409-A412 WeakPolarHBondContact O-CA 3.19Å; Q409-A412 WeakPolarHBondContact O-CB 3.3Å; Q409-A412 PolarHBondContact O-N 3.32Å; Q409-E413 HydrophobicContact CG-CG 4.39Å; Q409-E413 VanDerWaalsContact CG-OE1 3.28Å; Q409-E413 WeakPolarHBondContact CG-OE1 3.49Å; Q409-E413 PolarHBondContact NE2-OE1 3.26Å; Q409-E413 WeakPolarHBondContact O-CG 3.41Å; Q409-E413 PolarHBondContact O-N 3.3Å
410	A	87.9	Confident	87.7	Confident	49 Å²	49	90.8 Å²	90.8	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-58.6	-36.4	176.7	0	0	0	0	0	112.3	A406 A414	A406-A410 WeakPolarHBondContact O-CB 3.47Å; A406-A410 PolarHBondContact O-N 2.89Å; A410-A414 VanDerWaalsContact O-CB 3.29Å; A410-A414 WeakPolarHBondContact O-CB 3.4Å; A410-A414 PolarHBondContact O-N 3.49Å
411	K	87	Confident	87.6	Confident	133 Å²	133	90.3 Å²	90.3	58%	0.578	49%	0.485	S	S	*	.	H	α-helix	trans	-64.3	-45	170.8	-177.1	-175.9	174	-176	0	112	L407 R408 Q409 E413 A414 Q415	L407-K411 WeakPolarHBondContact O-CB 3.39Å; L407-K411 PolarHBondContact O-N 2.94Å; R408-K411 PolarHBondContact O-N 3.37Å; Q409-K411 VanDerWaalsContact C-N 3.25Å; Q409-K411 PolarHBondContact O-N 3.08Å; K411-E413 VanDerWaalsContact C-N 3.34Å; K411-A414 PolarHBondContact O-N 3.48Å; K411-Q415 VanDerWaalsContact CE-OE1 3.3Å; K411-Q415 HydrophobicContact CG-CG 4.42Å; K411-Q415 WeakPolarHBondContact O-CB 3.41Å; K411-Q415 VanDerWaalsContact O-CG 3.3Å; K411-Q415 WeakPolarHBondContact O-CG 3.31Å; K411-Q415 PolarHBondContact O-N 2.94Å
412	A	88.4	Confident	87.2	Confident	55 Å²	55	90 Å²	90	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-64.7	-38.9	178.7	0	0	0	0	0	111.9	R408 Q409 Q415 A416	R408-A412 WeakPolarHBondContact O-CB 3.36Å; R408-A412 PolarHBondContact O-N 2.88Å; Q409-A412 CarbonylContact O-C 3.57Å; Q409-A412 WeakPolarHBondContact O-CA 3.19Å; Q409-A412 WeakPolarHBondContact O-CB 3.3Å; Q409-A412 PolarHBondContact O-N 3.32Å; A412-Q415 PolarHBondContact O-N 2.83Å; A412-A416 WeakPolarHBondContact O-CB 3.48Å; A412-A416 PolarHBondContact O-N 3.41Å
413	E	89.2	Confident	86.9	Confident	93 Å²	93	91.3 Å²	91.3	44%	0.435	49%	0.492	S	S	.	.	H	α-helix	trans	-65	-44.6	173.4	-71.1	170.4	-175.5	0	0	111.4	Q409 K411 Q415 A416 Q417	Q409-E413 HydrophobicContact CG-CG 4.39Å; Q409-E413 VanDerWaalsContact CG-OE1 3.28Å; Q409-E413 WeakPolarHBondContact CG-OE1 3.49Å; Q409-E413 PolarHBondContact NE2-OE1 3.26Å; Q409-E413 WeakPolarHBondContact O-CG 3.41Å; Q409-E413 PolarHBondContact O-N 3.3Å; K411-E413 VanDerWaalsContact C-N 3.34Å; E413-Q415 PolarHBondContact O-N 3.44Å; E413-A416 PolarHBondContact O-N 2.9Å; E413-Q417 VanDerWaalsContact O-CG 3.29Å; E413-Q417 WeakPolarHBondContact O-CG 3.47Å; E413-Q417 PolarHBondContact O-N 3.14Å
414	A	84.3	Confident	86.6	Confident	46 Å²	46	89.4 Å²	89.4	38%	0.38	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-39.1	173.5	0	0	0	0	0	112.4	A410 K411 Q417 C418	A410-A414 VanDerWaalsContact O-CB 3.29Å; A410-A414 WeakPolarHBondContact O-CB 3.4Å; A410-A414 PolarHBondContact O-N 3.49Å; K411-A414 PolarHBondContact O-N 3.48Å; A414-Q417 PolarHBondContact O-N 3.41Å; A414-C418 PolarHBondContact O-N 3.01Å; A414-C418 PolarHBondContact O-SG 3.28Å
415	Q	86.5	Confident	86.4	Confident	111 Å²	111	91 Å²	91	52%	0.519	49%	0.493	S	S	.	.	H	α-helix	trans	-67.4	-38	174.5	-72.8	-176	-83.9	0	0	111.9	K411 A412 E413 Q417 C418 V419	K411-Q415 VanDerWaalsContact CE-OE1 3.3Å; K411-Q415 HydrophobicContact CG-CG 4.42Å; K411-Q415 WeakPolarHBondContact O-CB 3.41Å; K411-Q415 VanDerWaalsContact O-CG 3.3Å; K411-Q415 WeakPolarHBondContact O-CG 3.31Å; K411-Q415 PolarHBondContact O-N 2.94Å; A412-Q415 PolarHBondContact O-N 2.83Å; E413-Q415 PolarHBondContact O-N 3.44Å; Q415-Q417 VanDerWaalsContact C-N 3.33Å; Q415-C418 PolarHBondContact O-N 3.34Å; Q415-V419 WeakPolarHBondContact O-CG2 3.49Å; Q415-V419 PolarHBondContact O-N 2.8Å
416	A	87.7	Confident	86	Confident	60 Å²	60	93 Å²	93	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-36.1	172.3	0	0	0	0	0	111.9	A412 E413 H420	A412-A416 WeakPolarHBondContact O-CB 3.48Å; A412-A416 PolarHBondContact O-N 3.41Å; E413-A416 PolarHBondContact O-N 2.9Å; A416-H420 VanDerWaalsContact O-CB 3.25Å; A416-H420 WeakPolarHBondContact O-CB 3.49Å; A416-H420 PolarHBondContact O-N 3.01Å
417	Q	87.6	Confident	85.7	Confident	123 Å²	123	95 Å²	95	58%	0.575	50%	0.5	S	S	*	.	H	α-helix	trans	-67.1	-40	171.9	-71.8	169.4	19.7	0	0	111.9	E413 A414 Q415 H420 L421	E413-Q417 VanDerWaalsContact O-CG 3.29Å; E413-Q417 WeakPolarHBondContact O-CG 3.47Å; E413-Q417 PolarHBondContact O-N 3.14Å; A414-Q417 PolarHBondContact O-N 3.41Å; Q415-Q417 VanDerWaalsContact C-N 3.33Å; Q417-H420 PolarHBondContact O-N 3.47Å; Q417-L421 WeakPolarHBondContact O-CB 3.25Å; Q417-L421 VanDerWaalsContact O-CG 3.28Å; Q417-L421 WeakPolarHBondContact O-CG 3.46Å; Q417-L421 PolarHBondContact O-N 2.99Å
418	C	77.8	Confident	85.2	Confident	67 Å²	67	95.5 Å²	95.5	45%	0.453	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-49.8	171.9	-70.1	0	0	0	0	111.5	A414 Q415 H420 L421 E422	A414-C418 PolarHBondContact O-N 3.01Å; A414-C418 PolarHBondContact O-SG 3.28Å; Q415-C418 PolarHBondContact O-N 3.34Å; C418-H420 VanDerWaalsContact C-N 3.29Å; C418-H420 PolarHBondContact O-N 3.07Å; C418-L421 CarbonylContact O-C 3.49Å; C418-L421 PolarHBondContact O-N 3.37Å; C418-L421 VanDerWaalsContact O-N 3.14Å; C418-E422 WeakPolarHBondContact O-CB 3.28Å; C418-E422 VanDerWaalsContact O-CG 3.32Å; C418-E422 WeakPolarHBondContact O-CG 3.43Å; C418-E422 PolarHBondContact O-N 3.4Å
419	V	88	Confident	84.5	Confident	77 Å²	77	93 Å²	93	47%	0.467	49%	0.494	S	S	.	.	H	α-helix	trans	-63.8	-34.4	177.5	172.3	0	0	0	0	111.7	Q415 L423	Q415-V419 WeakPolarHBondContact O-CG2 3.49Å; Q415-V419 PolarHBondContact O-N 2.8Å; V419-L423 HydrophobicContact CG1-CD1 4.3Å; V419-L423 WeakPolarHBondContact O-CB 3.34Å; V419-L423 WeakPolarHBondContact O-CG 3.24Å; V419-L423 PolarHBondContact O-N 3.43Å
420	H	87.5	Confident	83.8	Confident	120 Å²	120	89 Å²	89	56%	0.556	48%	0.482	S	S	*	.	H	α-helix	trans	-67.5	-42	172.8	-179.1	54	0	0	0	112	A416 Q417 C418 L423 V424	A416-H420 VanDerWaalsContact O-CB 3.25Å; A416-H420 WeakPolarHBondContact O-CB 3.49Å; A416-H420 PolarHBondContact O-N 3.01Å; Q417-H420 PolarHBondContact O-N 3.47Å; C418-H420 VanDerWaalsContact C-N 3.29Å; C418-H420 PolarHBondContact O-N 3.07Å; H420-L423 PolarHBondContact O-N 2.69Å; H420-V424 WeakPolarHBondContact O-CB 3.38Å; H420-V424 VanDerWaalsContact O-CG2 3.28Å; H420-V424 WeakPolarHBondContact O-CG2 3.14Å; H420-V424 PolarHBondContact O-N 3.18Å
421	L	84.3	Confident	83.1	Confident	109 Å²	109	89.4 Å²	89.4	57%	0.571	48%	0.477	S	S	*	.	H	α-helix	trans	-67.5	-36.1	174.8	-74.2	167.5	0	0	0	112.1	Q417 C418 V424 V425	Q417-L421 WeakPolarHBondContact O-CB 3.25Å; Q417-L421 VanDerWaalsContact O-CG 3.28Å; Q417-L421 WeakPolarHBondContact O-CG 3.46Å; Q417-L421 PolarHBondContact O-N 2.99Å; C418-L421 CarbonylContact O-C 3.49Å; C418-L421 PolarHBondContact O-N 3.37Å; C418-L421 VanDerWaalsContact O-N 3.14Å; L421-V424 PolarHBondContact O-N 3Å; L421-V425 WeakPolarHBondContact O-CB 3.31Å; L421-V425 VanDerWaalsContact O-CG2 3.25Å; L421-V425 WeakPolarHBondContact O-CG2 3.5Å; L421-V425 PolarHBondContact O-N 3.43Å
422	E	81.9	Confident	82.1	Confident	122 Å²	122	86 Å²	86	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-63.8	-45.1	171.5	-74	167.2	176.2	0	0	110.9	C418 V425 E426	C418-E422 WeakPolarHBondContact O-CB 3.28Å; C418-E422 VanDerWaalsContact O-CG 3.32Å; C418-E422 WeakPolarHBondContact O-CG 3.43Å; C418-E422 PolarHBondContact O-N 3.4Å; E422-V425 PolarHBondContact O-N 3.39Å; E422-E426 PolarHBondContact O-N 2.96Å
423	L	85.1	Confident	81	Confident	115 Å²	115	90.9 Å²	90.9	60%	0.602	49%	0.485	S	S	*	.	H	α-helix	trans	-63.5	-38.6	172.8	-81.7	167.2	0	0	0	112.7	V419 H420 Q427	V419-L423 HydrophobicContact CG1-CD1 4.3Å; V419-L423 WeakPolarHBondContact O-CB 3.34Å; V419-L423 WeakPolarHBondContact O-CG 3.24Å; V419-L423 PolarHBondContact O-N 3.43Å; H420-L423 PolarHBondContact O-N 2.69Å; L423-Q427 WeakPolarHBondContact O-CB 3.43Å; L423-Q427 PolarHBondContact O-N 2.95Å
424	V	84.6	Confident	79.8	Confident	53 Å²	53	91.7 Å²	91.7	32%	0.321	49%	0.487	S	S	.	.	H	α-helix	trans	-67.6	-36.6	173.8	167.7	0	0	0	0	110.8	H420 L421 Q427 M428	H420-V424 WeakPolarHBondContact O-CB 3.38Å; H420-V424 VanDerWaalsContact O-CG2 3.28Å; H420-V424 WeakPolarHBondContact O-CG2 3.14Å; H420-V424 PolarHBondContact O-N 3.18Å; L421-V424 PolarHBondContact O-N 3Å; V424-Q427 PolarHBondContact O-N 3.44Å; V424-M428 HydrophobicContact CG1-CG 4.37Å; V424-M428 HydrophobicContact CG1-SD 4Å; V424-M428 VanDerWaalsContact O-CB 3.26Å; V424-M428 WeakPolarHBondContact O-CB 3.07Å; V424-M428 WeakPolarHBondContact O-CG 3.5Å; V424-M428 PolarHBondContact O-N 3.3Å
425	V	78.9	Confident	78.5	Confident	69 Å²	69	94.2 Å²	94.2	42%	0.418	49%	0.491	S	S	.	.	H	α-helix	trans	-70	-41	175	163.8	0	0	0	0	111.6	L421 E422 M428 K429	L421-V425 WeakPolarHBondContact O-CB 3.31Å; L421-V425 VanDerWaalsContact O-CG2 3.25Å; L421-V425 WeakPolarHBondContact O-CG2 3.5Å; L421-V425 PolarHBondContact O-N 3.43Å; E422-V425 PolarHBondContact O-N 3.39Å; V425-M428 PolarHBondContact O-N 3.38Å; V425-K429 HydrophobicContact CG1-CD 4.17Å; V425-K429 WeakPolarHBondContact O-CB 3.47Å; V425-K429 VanDerWaalsContact O-CG 3.22Å; V425-K429 WeakPolarHBondContact O-CG 3.44Å; V425-K429 PolarHBondContact O-N 2.69Å
426	E	80.7	Confident	76.9	Confident	105 Å²	105	90.9 Å²	90.9	49%	0.491	48%	0.482	S	S	.	.	H	α-helix	trans	-69.5	-35.1	173.3	-68.9	-50.4	132.3	0	0	112.1	E422 K429 A430	E422-E426 PolarHBondContact O-N 2.96Å; E426-K429 PolarHBondContact O-N 3.5Å; E426-K429 WeakPolarHBondContact OE1-CD 3.45Å; E426-K429 IonicContact OE1-NZ 2.77Å; E426-K429 PolarHBondContact OE1-NZ 3.09Å; E426-K429 WeakPolarHBondContact OE2-CD 3.37Å; E426-A430 VanDerWaalsContact O-CB 3.29Å; E426-A430 WeakPolarHBondContact O-CB 3.25Å; E426-A430 PolarHBondContact O-N 3.25Å
427	Q	83.2	Confident	75.3	Confident	98 Å²	98	91 Å²	91	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-64.8	-45.3	170.7	-176.4	63.7	37.7	0	0	110.9	L423 V424 K429 A430 D431	L423-Q427 WeakPolarHBondContact O-CB 3.43Å; L423-Q427 PolarHBondContact O-N 2.95Å; V424-Q427 PolarHBondContact O-N 3.44Å; Q427-K429 VanDerWaalsContact C-N 3.31Å; Q427-K429 PolarHBondContact O-N 2.93Å; Q427-A430 PolarHBondContact O-N 3.26Å; Q427-A430 VanDerWaalsContact O-N 3.15Å; Q427-D431 VanDerWaalsContact NE2-CG 3.27Å; Q427-D431 PolarHBondContact NE2-OD1 3.16Å; Q427-D431 VanDerWaalsContact NE2-OD1 3.17Å; Q427-D431 PolarHBondContact NE2-OD2 3.25Å; Q427-D431 WeakPolarHBondContact O-CB 3.31Å; Q427-D431 PolarHBondContact O-N 3.41Å
428	M	78.2	Confident	73.4	Confident	127 Å²	127	90.7 Å²	90.7	63%	0.626	48%	0.48	S	S	*	.	H	α-helix	trans	-65.2	-31.5	174.5	-75.3	178.3	73	0	0	112.3	V424 V425 A432	V424-M428 HydrophobicContact CG1-CG 4.37Å; V424-M428 HydrophobicContact CG1-SD 4Å; V424-M428 VanDerWaalsContact O-CB 3.26Å; V424-M428 WeakPolarHBondContact O-CB 3.07Å; V424-M428 WeakPolarHBondContact O-CG 3.5Å; V424-M428 PolarHBondContact O-N 3.3Å; V425-M428 PolarHBondContact O-N 3.38Å; M428-A432 WeakPolarHBondContact O-CA 3.35Å; M428-A432 WeakPolarHBondContact O-CB 3.22Å; M428-A432 PolarHBondContact O-N 3.28Å
429	K	75.3	Confident	71.8	Confident	100 Å²	100	90 Å²	90	44%	0.435	48%	0.476	S	S	.	.	H	α-helix	trans	-71.3	-37.9	169.9	-74.6	165.5	-177.2	174.7	0	112	V425 E426 Q427 K433	V425-K429 HydrophobicContact CG1-CD 4.17Å; V425-K429 WeakPolarHBondContact O-CB 3.47Å; V425-K429 VanDerWaalsContact O-CG 3.22Å; V425-K429 WeakPolarHBondContact O-CG 3.44Å; V425-K429 PolarHBondContact O-N 2.69Å; E426-K429 PolarHBondContact O-N 3.5Å; E426-K429 WeakPolarHBondContact OE1-CD 3.45Å; E426-K429 IonicContact OE1-NZ 2.77Å; E426-K429 PolarHBondContact OE1-NZ 3.09Å; E426-K429 WeakPolarHBondContact OE2-CD 3.37Å; Q427-K429 VanDerWaalsContact C-N 3.31Å; Q427-K429 PolarHBondContact O-N 2.93Å; K429-K433 VanDerWaalsContact O-CB 3.31Å; K429-K433 WeakPolarHBondContact O-CB 3.26Å; K429-K433 VanDerWaalsContact O-CG 3.23Å; K429-K433 WeakPolarHBondContact O-CG 3.29Å; K429-K433 PolarHBondContact O-N 3.04Å
430	A	74.8	Confident	69.6	Low	37 Å²	37	94.3 Å²	94.3	31%	0.306	49%	0.491	S	S	.	.	H	α-helix	trans	-69.2	-40.1	177	0	0	0	0	0	111.3	E426 Q427 K433 K434	E426-A430 VanDerWaalsContact O-CB 3.29Å; E426-A430 WeakPolarHBondContact O-CB 3.25Å; E426-A430 PolarHBondContact O-N 3.25Å; Q427-A430 PolarHBondContact O-N 3.26Å; Q427-A430 VanDerWaalsContact O-N 3.15Å; A430-K433 PolarHBondContact O-N 2.93Å; A430-K434 WeakPolarHBondContact O-CG 3.39Å; A430-K434 PolarHBondContact O-N 3.06Å
431	D	73.8	Confident	67.7	Low	57 Å²	57	97 Å²	97	31%	0.305	50%	0.504	S	S	.	.	H	α-helix	trans	-76.8	-36	176.2	-65.7	-24.9	0	0	0	111.2	Q427 K433 K434 E435	Q427-D431 VanDerWaalsContact NE2-CG 3.27Å; Q427-D431 PolarHBondContact NE2-OD1 3.16Å; Q427-D431 VanDerWaalsContact NE2-OD1 3.17Å; Q427-D431 PolarHBondContact NE2-OD2 3.25Å; Q427-D431 WeakPolarHBondContact O-CB 3.31Å; Q427-D431 PolarHBondContact O-N 3.41Å; D431-K433 VanDerWaalsContact C-N 3.27Å; D431-K433 PolarHBondContact O-N 3.11Å; D431-K434 CarbonylContact O-C 3.54Å; D431-K434 PolarHBondContact O-N 2.85Å; D431-K434 VanDerWaalsContact O-N 3.1Å; D431-K434 IonicContact OD1-NZ 2.72Å; D431-K434 PolarHBondContact OD1-NZ 2.62Å; D431-E435 WeakPolarHBondContact O-CG 3.35Å; D431-E435 PolarHBondContact O-N 3.08Å
432	A	65.6	Low	65.9	Low	62 Å²	62	100.9 Å²	100.9	51%	0.512	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-29.7	167.4	0	0	0	0	0	112.6	M428 A436	M428-A432 WeakPolarHBondContact O-CA 3.35Å; M428-A432 WeakPolarHBondContact O-CB 3.22Å; M428-A432 PolarHBondContact O-N 3.28Å; A432-A436 WeakPolarHBondContact O-CB 3.37Å; A432-A436 PolarHBondContact O-N 3.44Å
433	K	66.6	Low	63.8	Low	158 Å²	158	97.5 Å²	97.5	69%	0.687	51%	0.512	S	S	*	.	H	α-helix	trans	-72.2	-33.7	169.5	-80.2	173.7	177.7	-178.4	0	112.8	K429 A430 D431 A437	K429-K433 VanDerWaalsContact O-CB 3.31Å; K429-K433 WeakPolarHBondContact O-CB 3.26Å; K429-K433 VanDerWaalsContact O-CG 3.23Å; K429-K433 WeakPolarHBondContact O-CG 3.29Å; K429-K433 PolarHBondContact O-N 3.04Å; A430-K433 PolarHBondContact O-N 2.93Å; D431-K433 VanDerWaalsContact C-N 3.27Å; D431-K433 PolarHBondContact O-N 3.11Å; K433-A437 WeakPolarHBondContact O-CB 3.41Å; K433-A437 PolarHBondContact O-N 3.48Å
434	K	62.6	Low	62.1	Low	110 Å²	110	98.4 Å²	98.4	48%	0.478	53%	0.527	S	S	.	.	H	α-helix	trans	-72.4	-41.4	173.1	-69.8	168.7	-160.9	156.8	0	112.1	A430 D431 A436 A437 K438	A430-K434 WeakPolarHBondContact O-CG 3.39Å; A430-K434 PolarHBondContact O-N 3.06Å; D431-K434 CarbonylContact O-C 3.54Å; D431-K434 PolarHBondContact O-N 2.85Å; D431-K434 VanDerWaalsContact O-N 3.1Å; D431-K434 IonicContact OD1-NZ 2.72Å; D431-K434 PolarHBondContact OD1-NZ 2.62Å; K434-A436 VanDerWaalsContact C-N 3.34Å; K434-A437 CarbonylContact O-C 3.51Å; K434-A437 PolarHBondContact O-N 2.82Å; K434-K438 WeakPolarHBondContact O-CG 3.39Å; K434-K438 PolarHBondContact O-N 2.87Å
435	E	57.9	Low	60.2	Low	99 Å²	99	101.4 Å²	101.4	46%	0.463	55%	0.546	S	S	.	.	H	α-helix	trans	-73.3	-27.7	174.4	-59.1	-44.3	131.2	0	0	111.3	D431 K438 S439	D431-E435 WeakPolarHBondContact O-CG 3.35Å; D431-E435 PolarHBondContact O-N 3.08Å; E435-K438 VanDerWaalsContact CD-NZ 3.28Å; E435-K438 PolarHBondContact O-N 3.35Å; E435-K438 IonicContact OE1-NZ 2.88Å; E435-K438 PolarHBondContact OE1-NZ 3.04Å; E435-K438 WeakPolarHBondContact OE2-CD 3.26Å; E435-K438 IonicContact OE2-NZ 3.7Å; E435-K438 PolarHBondContact OE2-NZ 3.2Å; E435-K438 VanDerWaalsContact OE2-NZ 3.1Å; E435-S439 WeakPolarHBondContact O-CB 3.36Å; E435-S439 PolarHBondContact O-N 3.12Å; E435-S439 PolarHBondContact O-OG 3.29Å
436	A	53.4	Low	59	Low	41 Å²	41	102.7 Å²	102.7	34%	0.339	55%	0.55	S	S	.	*	H	α-helix	trans	-60.4	-53.9	164.1	0	0	0	0	0	110.4	A432 K434 K438 S439 E440	A432-A436 WeakPolarHBondContact O-CB 3.37Å; A432-A436 PolarHBondContact O-N 3.44Å; K434-A436 VanDerWaalsContact C-N 3.34Å; A436-K438 PolarHBondContact O-N 2.84Å; A436-K438 VanDerWaalsContact O-N 3.12Å; A436-S439 WeakPolarHBondContact CA-OG 3.4Å; A436-S439 CarbonylContact O-C 3.57Å; A436-S439 WeakPolarHBondContact O-CA 3.43Å; A436-S439 PolarHBondContact O-N 2.95Å; A436-S439 PolarHBondContact O-OG 3.06Å; A436-E440 WeakPolarHBondContact O-CG 3.44Å; A436-E440 PolarHBondContact O-N 3.49Å
437	A	52.8	Low	57.9	Low	61 Å²	61	102.6 Å²	102.6	50%	0.504	56%	0.559	S	S	.	*	H	α-helix	trans	-64.9	-12.6	178.4	0	0	0	0	0	115	K433 K434	K433-A437 WeakPolarHBondContact O-CB 3.41Å; K433-A437 PolarHBondContact O-N 3.48Å; K434-A437 CarbonylContact O-C 3.51Å; K434-A437 PolarHBondContact O-N 2.82Å
438	K	48.8	Very low	56.7	Low	118 Å²	118	100.5 Å²	100.5	51%	0.513	56%	0.558	S	S	.	*	H	α-helix	trans	-94.4	-35.8	167.2	-72.1	161.8	165.1	-175.1	0	112.3	K434 E435 A436 E440 E441 E442	K434-K438 WeakPolarHBondContact O-CG 3.39Å; K434-K438 PolarHBondContact O-N 2.87Å; E435-K438 VanDerWaalsContact CD-NZ 3.28Å; E435-K438 PolarHBondContact O-N 3.35Å; E435-K438 IonicContact OE1-NZ 2.88Å; E435-K438 PolarHBondContact OE1-NZ 3.04Å; E435-K438 WeakPolarHBondContact OE2-CD 3.26Å; E435-K438 IonicContact OE2-NZ 3.7Å; E435-K438 PolarHBondContact OE2-NZ 3.2Å; E435-K438 VanDerWaalsContact OE2-NZ 3.1Å; A436-K438 PolarHBondContact O-N 2.84Å; A436-K438 VanDerWaalsContact O-N 3.12Å; K438-E440 PolarHBondContact O-N 3.04Å; K438-E441 WeakPolarHBondContact O-CA 3.37Å; K438-E441 WeakPolarHBondContact O-CB 3.37Å; K438-E441 PolarHBondContact O-N 3.38Å; K438-E442 PolarHBondContact O-N 3.1Å
439	S	44	Very low	55.9	Low	53 Å²	53	98.2 Å²	98.2	37%	0.371	55%	0.552	S	S	.	*	H	α-helix	trans	-67.8	-23.6	173.3	74	0	0	0	0	112	E435 A436 E441 E442 A443	E435-S439 WeakPolarHBondContact O-CB 3.36Å; E435-S439 PolarHBondContact O-N 3.12Å; E435-S439 PolarHBondContact O-OG 3.29Å; A436-S439 WeakPolarHBondContact CA-OG 3.4Å; A436-S439 CarbonylContact O-C 3.57Å; A436-S439 WeakPolarHBondContact O-CA 3.43Å; A436-S439 PolarHBondContact O-N 2.95Å; A436-S439 PolarHBondContact O-OG 3.06Å; S439-E441 PolarHBondContact O-N 3.42Å; S439-E442 PolarHBondContact O-N 2.89Å; S439-A443 CarbonylContact O-C 3.53Å; S439-A443 WeakPolarHBondContact O-CA 3.5Å; S439-A443 WeakPolarHBondContact O-CB 3.4Å; S439-A443 PolarHBondContact O-N 3.29Å
440	E	42.3	Very low	55.2	Low	167 Å²	167	97.2 Å²	97.2	78%	0.78	55%	0.554	S	S	*	*	H	α-helix	trans	-66.7	-10.9	166.3	-73.4	176.5	155.5	0	0	112.9	A436 K438	A436-E440 WeakPolarHBondContact O-CG 3.44Å; A436-E440 PolarHBondContact O-N 3.49Å; K438-E440 PolarHBondContact O-N 3.04Å
441	E	46.6	Very low	54.9	Low	177 Å²	177	97.8 Å²	97.8	83%	0.827	56%	0.558	S	S	*	*	H	α-helix	trans	-106.2	-14.1	172.4	-159.4	165.7	-156.5	0	0	113.5	K438 S439	K438-E441 WeakPolarHBondContact O-CA 3.37Å; K438-E441 WeakPolarHBondContact O-CB 3.37Å; K438-E441 PolarHBondContact O-N 3.38Å; S439-E441 PolarHBondContact O-N 3.42Å
442	E	46.2	Very low	54.7	Low	190 Å²	190	99.8 Å²	99.8	89%	0.888	57%	0.566	S	S	*	*	H	α-helix	trans	-136.8	3.1	-178.1	-112.2	-176.3	-177.2	0	0	117.1	K438 S439	K438-E442 PolarHBondContact O-N 3.1Å; S439-E442 PolarHBondContact O-N 2.89Å
443	A	38.5	Very low	54.8	Low	51 Å²	51	101.5 Å²	101.5	42%	0.421	57%	0.566	S	S	.	*			trans	-137.8	73.1	-179.5	0	0	0	0	0	112.5	S439 T445	S439-A443 CarbonylContact O-C 3.53Å; S439-A443 WeakPolarHBondContact O-CA 3.5Å; S439-A443 WeakPolarHBondContact O-CB 3.4Å; S439-A443 PolarHBondContact O-N 3.29Å; A443-T445 PolarHBondContact O-N 2.71Å; A443-T445 PolarHBondContact O-OG1 2.66Å
444	S	48.6	Very low	54.8	Low	133 Å²	133	99.9 Å²	99.9	93%	0.93	56%	0.561	S	S	*	*			trans	-60.4	93.8	177.1	59	0	0	0	0	112.2
445	T	45.5	Very low	55.6	Low	116 Å²	116	101.9 Å²	101.9	71%	0.712	57%	0.565	S	S	*	*			trans	-105.1	120.1	173.4	-44.1	0	0	0	0	107.7	A443 P447	A443-T445 PolarHBondContact O-N 2.71Å; A443-T445 PolarHBondContact O-OG1 2.66Å; T445-P447 WeakPolarHBondContact O-CD 3.28Å
446	D	53.7	Low	56.6	Low	96 Å²	96	102.5 Å²	102.5	51%	0.513	57%	0.568	S	S	.	*			trans	-62.8	123.4	-162.5	-167.6	-24.1	0	0	0	113.2	A448 V449	D446-A448 PolarHBondContact O-N 2.77Å; D446-A448 VanDerWaalsContact O-N 3.1Å; D446-A448 VanDerWaalsContact OD1-CB 3.24Å; D446-A448 WeakPolarHBondContact OD1-CB 3.43Å; D446-A448 PolarHBondContact OD1-N 2.89Å; D446-V449 HydrophobicContact CB-CG2 4.27Å; D446-V449 PolarHBondContact O-N 3.46Å
447	P	58	Low	57.8	Low	104 Å²	104	104.1 Å²	104.1	68%	0.675	57%	0.573	S	S	*	*	H	α-helix	trans	-52.5	-28.3	172.8	-27.7	35.9	0	0	0	114.3	T445 V449 V450 A451	T445-P447 WeakPolarHBondContact O-CD 3.28Å; P447-V449 VanDerWaalsContact C-N 3.33Å; P447-V449 PolarHBondContact O-N 3.45Å; P447-V450 PolarHBondContact O-N 3.46Å; P447-A451 PolarHBondContact O-N 2.9Å
448	A	58.5	Low	59	Low	53 Å²	53	107.2 Å²	107.2	44%	0.438	58%	0.578	S	S	.	*	H	α-helix	trans	-59.6	-41.2	176.5	0	0	0	0	0	112.2	D446 V450 A451 E452	D446-A448 PolarHBondContact O-N 2.77Å; D446-A448 VanDerWaalsContact O-N 3.1Å; D446-A448 VanDerWaalsContact OD1-CB 3.24Å; D446-A448 WeakPolarHBondContact OD1-CB 3.43Å; D446-A448 PolarHBondContact OD1-N 2.89Å; A448-V450 PolarHBondContact O-N 3.25Å; A448-A451 PolarHBondContact O-N 3.48Å; A448-E452 WeakPolarHBondContact O-CB 3.37Å; A448-E452 PolarHBondContact O-N 3.1Å
449	V	60.8	Low	60.8	Low	80 Å²	80	104.8 Å²	104.8	49%	0.485	57%	0.57	S	S	.	*	H	α-helix	trans	-68.6	-36.1	-178.8	179.4	0	0	0	0	111.3	D446 P447 E452 L453	D446-V449 HydrophobicContact CB-CG2 4.27Å; D446-V449 PolarHBondContact O-N 3.46Å; P447-V449 VanDerWaalsContact C-N 3.33Å; P447-V449 PolarHBondContact O-N 3.45Å; V449-E452 PolarHBondContact O-N 3.38Å; V449-L453 HydrophobicContact CG1-CD1 4.27Å; V449-L453 WeakPolarHBondContact O-CG 3.32Å; V449-L453 PolarHBondContact O-N 2.91Å
450	V	60.6	Low	62.8	Low	79 Å²	79	106.3 Å²	106.3	48%	0.479	57%	0.573	S	S	.	*	H	α-helix	trans	-68.1	-41.6	175.2	-178.1	0	0	0	0	110.7	P447 A448 Q454	P447-V450 PolarHBondContact O-N 3.46Å; A448-V450 PolarHBondContact O-N 3.25Å; V450-Q454 VanDerWaalsContact O-CG 3.28Å; V450-Q454 WeakPolarHBondContact O-CG 3.44Å; V450-Q454 PolarHBondContact O-N 2.96Å; V450-Q454 VanDerWaalsContact O-N 3.08Å
451	A	68.5	Low	64.7	Low	48 Å²	48	103.5 Å²	103.5	40%	0.397	56%	0.559	S	S	.	*	H	α-helix	trans	-67.3	-36.3	175.3	0	0	0	0	0	112.6	P447 A448 Q454 R455	P447-A451 PolarHBondContact O-N 2.9Å; A448-A451 PolarHBondContact O-N 3.48Å; A451-Q454 PolarHBondContact O-N 2.99Å; A451-R455 WeakPolarHBondContact O-CB 3.43Å; A451-R455 PolarHBondContact O-N 3.34Å
452	E	69.3	Low	66.6	Low	100 Å²	100	99.9 Å²	99.9	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-62.4	-50.8	175.7	-166.7	113.6	-94.9	0	0	111.4	A448 V449 Q454 R455 E456	A448-E452 WeakPolarHBondContact O-CB 3.37Å; A448-E452 PolarHBondContact O-N 3.1Å; V449-E452 PolarHBondContact O-N 3.38Å; E452-Q454 VanDerWaalsContact C-N 3.3Å; E452-Q454 PolarHBondContact O-N 2.83Å; E452-R455 WeakPolarHBondContact O-CB 3.26Å; E452-R455 PolarHBondContact O-N 2.97Å; E452-R455 VanDerWaalsContact O-N 3.12Å; E452-R455 IonicContact OE1-CZ 3.63Å; E452-R455 IonicContact OE1-NH1 3.84Å; E452-R455 PolarHBondContact OE1-NH1 2.91Å; E452-R455 IonicContact OE1-NH2 2.96Å; E452-R455 PolarHBondContact OE1-NH2 2.93Å; E452-E456 PolarHBondContact O-N 3.16Å
453	L	68.1	Low	68.4	Low	98 Å²	98	97.7 Å²	97.7	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-62.9	-34.8	176.7	-72.6	168.6	0	0	0	112.5	V449 V457	V449-L453 HydrophobicContact CG1-CD1 4.27Å; V449-L453 WeakPolarHBondContact O-CG 3.32Å; V449-L453 PolarHBondContact O-N 2.91Å; L453-V457 WeakPolarHBondContact O-CB 3.4Å; L453-V457 VanDerWaalsContact O-CG2 3.26Å; L453-V457 WeakPolarHBondContact O-CG2 3.48Å; L453-V457 PolarHBondContact O-N 3.35Å
454	Q	66.8	Low	70.7	Confident	124 Å²	124	101.2 Å²	101.2	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-65.2	-44.6	172.3	-74.4	173.5	7.3	0	0	111.4	V450 A451 E452 E456 V457 E458	V450-Q454 VanDerWaalsContact O-CG 3.28Å; V450-Q454 WeakPolarHBondContact O-CG 3.44Å; V450-Q454 PolarHBondContact O-N 2.96Å; V450-Q454 VanDerWaalsContact O-N 3.08Å; A451-Q454 PolarHBondContact O-N 2.99Å; E452-Q454 VanDerWaalsContact C-N 3.3Å; E452-Q454 PolarHBondContact O-N 2.83Å; Q454-E456 PolarHBondContact O-N 3.24Å; Q454-V457 PolarHBondContact O-N 2.63Å; Q454-E458 WeakPolarHBondContact O-CG 3.44Å; Q454-E458 PolarHBondContact O-N 2.73Å
455	R	79.4	Confident	72.5	Confident	151 Å²	151	100.1 Å²	100.1	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-61	-43.5	176.9	-149.7	-165.1	-41.9	120.6	4.8	112	A451 E452 E458 D459	A451-R455 WeakPolarHBondContact O-CB 3.43Å; A451-R455 PolarHBondContact O-N 3.34Å; E452-R455 WeakPolarHBondContact O-CB 3.26Å; E452-R455 PolarHBondContact O-N 2.97Å; E452-R455 VanDerWaalsContact O-N 3.12Å; E452-R455 IonicContact OE1-CZ 3.63Å; E452-R455 IonicContact OE1-NH1 3.84Å; E452-R455 PolarHBondContact OE1-NH1 2.91Å; E452-R455 IonicContact OE1-NH2 2.96Å; E452-R455 PolarHBondContact OE1-NH2 2.93Å; R455-E458 PolarHBondContact O-N 3.01Å; R455-E458 VanDerWaalsContact O-N 3.16Å; R455-D459 PolarHBondContact O-N 2.93Å
456	E	78.9	Confident	74.5	Confident	113 Å²	113	100.4 Å²	100.4	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-39.5	177.3	-170.2	174.2	-137	0	0	111.7	E452 Q454 E458 D459 L460	E452-E456 PolarHBondContact O-N 3.16Å; Q454-E456 PolarHBondContact O-N 3.24Å; E456-E458 VanDerWaalsContact C-N 3.27Å; E456-E458 PolarHBondContact O-N 3.44Å; E456-D459 PolarHBondContact O-N 2.87Å; E456-L460 HydrophobicContact CG-CD1 4.31Å; E456-L460 WeakPolarHBondContact O-CB 3.41Å; E456-L460 VanDerWaalsContact O-CG 3.25Å; E456-L460 WeakPolarHBondContact O-CG 3.28Å; E456-L460 PolarHBondContact O-N 3.45Å
457	V	77.6	Confident	75.9	Confident	74 Å²	74	98.5 Å²	98.5	45%	0.448	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-31.1	171.6	162.9	0	0	0	0	112.2	L453 Q454 K461	L453-V457 WeakPolarHBondContact O-CB 3.4Å; L453-V457 VanDerWaalsContact O-CG2 3.26Å; L453-V457 WeakPolarHBondContact O-CG2 3.48Å; L453-V457 PolarHBondContact O-N 3.35Å; Q454-V457 PolarHBondContact O-N 2.63Å; V457-K461 VanDerWaalsContact O-CG 3.22Å; V457-K461 WeakPolarHBondContact O-CG 3.38Å; V457-K461 PolarHBondContact O-N 2.88Å; V457-K461 VanDerWaalsContact O-N 3.1Å
458	E	78.5	Confident	77	Confident	127 Å²	127	95.7 Å²	95.7	59%	0.593	50%	0.5	S	S	*	.	H	α-helix	trans	-79.6	-39.1	175.7	-63.9	-154.9	151.2	0	0	113.9	Q454 R455 E456 L460 K461 L462	Q454-E458 WeakPolarHBondContact O-CG 3.44Å; Q454-E458 PolarHBondContact O-N 2.73Å; R455-E458 PolarHBondContact O-N 3.01Å; R455-E458 VanDerWaalsContact O-N 3.16Å; E456-E458 VanDerWaalsContact C-N 3.27Å; E456-E458 PolarHBondContact O-N 3.44Å; E458-L460 VanDerWaalsContact C-N 3.33Å; E458-L460 PolarHBondContact O-N 2.83Å; E458-K461 HydrophobicContact CG-CD 4.49Å; E458-K461 WeakPolarHBondContact O-CB 3.4Å; E458-K461 PolarHBondContact O-N 3.29Å; E458-K461 IonicContact OE1-NZ 2.63Å; E458-L462 WeakPolarHBondContact O-CB 3.4Å; E458-L462 PolarHBondContact O-N 3.38Å
459	D	85.9	Confident	78.2	Confident	66 Å²	66	98.7 Å²	98.7	35%	0.353	51%	0.505	S	S	.	.	H	α-helix	trans	-59.4	-43.3	168.5	171	50.9	0	0	0	111.4	R455 E456 K461 L462 R463	R455-D459 PolarHBondContact O-N 2.93Å; E456-D459 PolarHBondContact O-N 2.87Å; D459-K461 PolarHBondContact O-N 2.81Å; D459-L462 PolarHBondContact O-N 3.47Å; D459-R463 VanDerWaalsContact O-CB 3.26Å; D459-R463 WeakPolarHBondContact O-CB 3.26Å; D459-R463 PolarHBondContact O-N 3.42Å; D459-R463 IonicContact OD1-CZ 3.68Å; D459-R463 IonicContact OD1-NE 3.95Å; D459-R463 IonicContact OD1-NH2 3.88Å; D459-R463 PolarHBondContact OD1-NH2 2.76Å; D459-R463 IonicContact OD2-CZ 3.54Å; D459-R463 IonicContact OD2-NH1 2.67Å; D459-R463 PolarHBondContact OD2-NH1 3.4Å; D459-R463 IonicContact OD2-NH2 2.66Å; D459-R463 PolarHBondContact OD2-NH2 2.84Å
460	L	86.4	Confident	79.2	Confident	85 Å²	85	100.2 Å²	100.2	45%	0.445	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-40.7	174.6	-74.2	169.3	0	0	0	112.6	E456 E458 L464	E456-L460 HydrophobicContact CG-CD1 4.31Å; E456-L460 WeakPolarHBondContact O-CB 3.41Å; E456-L460 VanDerWaalsContact O-CG 3.25Å; E456-L460 WeakPolarHBondContact O-CG 3.28Å; E456-L460 PolarHBondContact O-N 3.45Å; E458-L460 VanDerWaalsContact C-N 3.33Å; E458-L460 PolarHBondContact O-N 2.83Å; L460-L464 WeakPolarHBondContact O-CB 3.37Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.31Å; L460-L464 PolarHBondContact O-N 3.17Å
461	K	81.6	Confident	80.4	Confident	108 Å²	108	104.7 Å²	104.7	47%	0.47	52%	0.516	S	S	.	.	H	α-helix	trans	-61.7	-46	172.5	-73.1	164.7	-165.1	160.4	0	111.4	V457 E458 D459 L464 L465	V457-K461 VanDerWaalsContact O-CG 3.22Å; V457-K461 WeakPolarHBondContact O-CG 3.38Å; V457-K461 PolarHBondContact O-N 2.88Å; V457-K461 VanDerWaalsContact O-N 3.1Å; E458-K461 HydrophobicContact CG-CD 4.49Å; E458-K461 WeakPolarHBondContact O-CB 3.4Å; E458-K461 PolarHBondContact O-N 3.29Å; E458-K461 IonicContact OE1-NZ 2.63Å; D459-K461 PolarHBondContact O-N 2.81Å; K461-L464 PolarHBondContact O-N 3.26Å; K461-L465 WeakPolarHBondContact O-CG 3.47Å; K461-L465 PolarHBondContact O-N 2.7Å
462	L	86.8	Confident	81.3	Confident	101 Å²	101	107.6 Å²	107.6	53%	0.529	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-44.3	-179.8	-177.6	61.4	0	0	0	111.3	E458 D459 L464 L465 M466	E458-L462 WeakPolarHBondContact O-CB 3.4Å; E458-L462 PolarHBondContact O-N 3.38Å; D459-L462 PolarHBondContact O-N 3.47Å; L462-L464 VanDerWaalsContact C-N 3.35Å; L462-L464 PolarHBondContact O-N 2.78Å; L462-L465 WeakPolarHBondContact O-CB 3.41Å; L462-L465 PolarHBondContact O-N 3.42Å; L462-M466 WeakPolarHBondContact O-CG 3.38Å; L462-M466 PolarHBondContact O-N 2.87Å
463	R	84.4	Confident	82.1	Confident	144 Å²	144	108.5 Å²	108.5	54%	0.543	52%	0.524	S	S	.	.	H	α-helix	trans	-63.6	-38.1	176.9	-163.7	169.9	-65	156.1	5.7	112.1	D459 A467	D459-R463 VanDerWaalsContact O-CB 3.26Å; D459-R463 WeakPolarHBondContact O-CB 3.26Å; D459-R463 PolarHBondContact O-N 3.42Å; D459-R463 IonicContact OD1-CZ 3.68Å; D459-R463 IonicContact OD1-NE 3.95Å; D459-R463 IonicContact OD1-NH2 3.88Å; D459-R463 PolarHBondContact OD1-NH2 2.76Å; D459-R463 IonicContact OD2-CZ 3.54Å; D459-R463 IonicContact OD2-NH1 2.67Å; D459-R463 PolarHBondContact OD2-NH1 3.4Å; D459-R463 IonicContact OD2-NH2 2.66Å; D459-R463 PolarHBondContact OD2-NH2 2.84Å; R463-A467 WeakPolarHBondContact O-CB 3.29Å; R463-A467 PolarHBondContact O-N 3.19Å
464	L	87.4	Confident	82.8	Confident	125 Å²	125	108.3 Å²	108.3	65%	0.654	52%	0.519	S	S	*	.	H	α-helix	trans	-67	-39.2	171.7	-77.3	168.3	0	0	0	112.8	L460 K461 L462 A467 A468	L460-L464 WeakPolarHBondContact O-CB 3.37Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.31Å; L460-L464 PolarHBondContact O-N 3.17Å; K461-L464 PolarHBondContact O-N 3.26Å; L462-L464 VanDerWaalsContact C-N 3.35Å; L462-L464 PolarHBondContact O-N 2.78Å; L464-A467 PolarHBondContact O-N 2.91Å; L464-A468 WeakPolarHBondContact O-CB 3.35Å; L464-A468 PolarHBondContact O-N 3.41Å
465	L	85.6	Confident	83.7	Confident	110 Å²	110	109.1 Å²	109.1	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-62.3	-50.4	174.4	-77.3	166.5	0	0	0	111.1	K461 L462 A467 A468 E469	K461-L465 WeakPolarHBondContact O-CG 3.47Å; K461-L465 PolarHBondContact O-N 2.7Å; L462-L465 WeakPolarHBondContact O-CB 3.41Å; L462-L465 PolarHBondContact O-N 3.42Å; L465-A467 VanDerWaalsContact C-N 3.32Å; L465-A467 PolarHBondContact O-N 3.44Å; L465-A468 CarbonylContact O-C 3.5Å; L465-A468 WeakPolarHBondContact O-CB 3.4Å; L465-A468 PolarHBondContact O-N 3.03Å; L465-A468 VanDerWaalsContact O-N 3.08Å; L465-E469 WeakPolarHBondContact O-CG 3.29Å; L465-E469 PolarHBondContact O-N 3.09Å
466	M	87.4	Confident	84.1	Confident	123 Å²	123	108.1 Å²	108.1	61%	0.606	52%	0.518	S	S	*	.	H	α-helix	trans	-59	-41.4	176.7	-67.7	-179.7	74.5	0	0	112.2	L462 A468 E469 H470	L462-M466 WeakPolarHBondContact O-CG 3.38Å; L462-M466 PolarHBondContact O-N 2.87Å; M466-A468 PolarHBondContact O-N 2.83Å; M466-E469 PolarHBondContact O-N 2.97Å; M466-H470 PolarHBondContact O-N 3.26Å
467	A	83.7	Confident	84.4	Confident	56 Å²	56	106.1 Å²	106.1	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-40.7	174.4	0	0	0	0	0	112.3	R463 L464 L465 Y471	R463-A467 WeakPolarHBondContact O-CB 3.29Å; R463-A467 PolarHBondContact O-N 3.19Å; L464-A467 PolarHBondContact O-N 2.91Å; L465-A467 VanDerWaalsContact C-N 3.32Å; L465-A467 PolarHBondContact O-N 3.44Å; A467-Y471 WeakPolarHBondContact O-CB 3.49Å; A467-Y471 PolarHBondContact O-N 3.37Å
468	A	81.6	Confident	84.5	Confident	44 Å²	44	106.3 Å²	106.3	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-67.3	-33.2	175.3	0	0	0	0	0	112.5	L464 L465 M466 K472	L464-A468 WeakPolarHBondContact O-CB 3.35Å; L464-A468 PolarHBondContact O-N 3.41Å; L465-A468 CarbonylContact O-C 3.5Å; L465-A468 WeakPolarHBondContact O-CB 3.4Å; L465-A468 PolarHBondContact O-N 3.03Å; L465-A468 VanDerWaalsContact O-N 3.08Å; M466-A468 PolarHBondContact O-N 2.83Å; A468-K472 VanDerWaalsContact O-CG 3.28Å; A468-K472 WeakPolarHBondContact O-CG 3.31Å; A468-K472 PolarHBondContact O-N 3.45Å
469	E	83.4	Confident	84.7	Confident	116 Å²	116	103.4 Å²	103.4	54%	0.542	50%	0.498	S	S	.	.	H	α-helix	trans	-70.4	-47.3	173.9	-62	-145.9	125.8	0	0	112.3	L465 M466 Y471 K472 E473	L465-E469 WeakPolarHBondContact O-CG 3.29Å; L465-E469 PolarHBondContact O-N 3.09Å; M466-E469 PolarHBondContact O-N 2.97Å; E469-Y471 PolarHBondContact O-N 3.41Å; E469-K472 CarbonylContact O-C 3.55Å; E469-K472 WeakPolarHBondContact O-CA 3.33Å; E469-K472 WeakPolarHBondContact O-CB 3.47Å; E469-K472 PolarHBondContact O-N 3.15Å; E469-K472 IonicContact OE1-NZ 3.68Å; E469-E473 WeakPolarHBondContact O-CG 3.36Å; E469-E473 PolarHBondContact O-N 2.87Å
470	H	81.9	Confident	84.7	Confident	112 Å²	112	107.2 Å²	107.2	52%	0.519	51%	0.508	S	S	.	.	H	α-helix	trans	-59.8	-34.4	173.3	-177.3	-119.6	0	0	0	111.8	M466 E473 K474	M466-H470 PolarHBondContact O-N 3.26Å; H470-E473 PolarHBondContact O-N 3.25Å; H470-K474 WeakPolarHBondContact O-CG 3.34Å; H470-K474 PolarHBondContact O-N 3.45Å
471	Y	85.9	Confident	84.5	Confident	173 Å²	173	107 Å²	107	68%	0.678	51%	0.506	S	S	*	.	H	α-helix	trans	-66.6	-41.3	171.2	-167.7	-88.8	0	0	0	112.7	A467 E469 E473 K474 Y475	A467-Y471 WeakPolarHBondContact O-CB 3.49Å; A467-Y471 PolarHBondContact O-N 3.37Å; E469-Y471 PolarHBondContact O-N 3.41Å; Y471-E473 VanDerWaalsContact C-N 3.28Å; Y471-E473 PolarHBondContact O-N 2.9Å; Y471-K474 PolarHBondContact O-N 2.95Å; Y471-Y475 WeakPolarHBondContact O-CB 3.49Å; Y471-Y475 PolarHBondContact O-N 3.4Å
472	K	87.2	Confident	84.2	Confident	109 Å²	109	108 Å²	108	47%	0.474	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-38.4	171.6	-68.5	163.8	-163	163.3	0	111.1	A468 E469 Y475 K476	A468-K472 VanDerWaalsContact O-CG 3.28Å; A468-K472 WeakPolarHBondContact O-CG 3.31Å; A468-K472 PolarHBondContact O-N 3.45Å; E469-K472 CarbonylContact O-C 3.55Å; E469-K472 WeakPolarHBondContact O-CA 3.33Å; E469-K472 WeakPolarHBondContact O-CB 3.47Å; E469-K472 PolarHBondContact O-N 3.15Å; E469-K472 IonicContact OE1-NZ 3.68Å; K472-Y475 PolarHBondContact O-N 2.92Å; K472-K476 VanDerWaalsContact O-CG 3.29Å; K472-K476 WeakPolarHBondContact O-CG 3.23Å; K472-K476 PolarHBondContact O-N 3.24Å
473	E	85.9	Confident	84	Confident	119 Å²	119	108.7 Å²	108.7	56%	0.556	51%	0.512	S	S	*	.	H	α-helix	trans	-69.1	-45.4	176.6	-63.5	-146.1	122.2	0	0	112.6	E469 H470 Y471 Y475 K476 E477	E469-E473 WeakPolarHBondContact O-CG 3.36Å; E469-E473 PolarHBondContact O-N 2.87Å; H470-E473 PolarHBondContact O-N 3.25Å; Y471-E473 VanDerWaalsContact C-N 3.28Å; Y471-E473 PolarHBondContact O-N 2.9Å; E473-Y475 VanDerWaalsContact C-N 3.27Å; E473-Y475 PolarHBondContact O-N 3.25Å; E473-K476 WeakPolarHBondContact O-CB 3.48Å; E473-K476 PolarHBondContact O-N 2.72Å; E473-K476 VanDerWaalsContact O-N 3.14Å; E473-E477 PolarHBondContact O-N 3.07Å
474	K	83.6	Confident	83.7	Confident	95 Å²	95	106.4 Å²	106.4	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-35.7	172.7	-72.7	-72.9	158.6	-163.9	0	111.9	H470 Y471 E477 C478	H470-K474 WeakPolarHBondContact O-CG 3.34Å; H470-K474 PolarHBondContact O-N 3.45Å; Y471-K474 PolarHBondContact O-N 2.95Å; K474-E477 IonicContact NZ-OE2 2.64Å; K474-E477 PolarHBondContact NZ-OE2 3.04Å; K474-E477 PolarHBondContact O-N 2.99Å; K474-C478 WeakPolarHBondContact O-CB 3.14Å; K474-C478 PolarHBondContact O-N 2.9Å; K474-C478 PolarHBondContact O-SG 2.99Å
475	Y	84.8	Confident	83.1	Confident	141 Å²	141	105 Å²	105	55%	0.553	50%	0.504	S	S	*	.	H	α-helix	trans	-65.1	-44.3	171.6	-179.1	-94.2	0	0	0	112.5	Y471 K472 E473 E477 C478 Q479	Y471-Y475 WeakPolarHBondContact O-CB 3.49Å; Y471-Y475 PolarHBondContact O-N 3.4Å; K472-Y475 PolarHBondContact O-N 2.92Å; E473-Y475 VanDerWaalsContact C-N 3.27Å; E473-Y475 PolarHBondContact O-N 3.25Å; Y475-E477 VanDerWaalsContact C-N 3.31Å; Y475-E477 PolarHBondContact O-N 3.46Å; Y475-C478 PolarHBondContact O-N 2.83Å; Y475-Q479 WeakPolarHBondContact O-CB 3.28Å; Y475-Q479 PolarHBondContact O-N 2.65Å
476	K	87.5	Confident	82.6	Confident	129 Å²	129	104.1 Å²	104.1	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-58.5	-43.1	172.2	-69.4	166	-167.5	168	0	111	K472 E473 Q479 R480	K472-K476 VanDerWaalsContact O-CG 3.29Å; K472-K476 WeakPolarHBondContact O-CG 3.23Å; K472-K476 PolarHBondContact O-N 3.24Å; E473-K476 WeakPolarHBondContact O-CB 3.48Å; E473-K476 PolarHBondContact O-N 2.72Å; E473-K476 VanDerWaalsContact O-N 3.14Å; K476-Q479 PolarHBondContact O-N 2.73Å; K476-R480 WeakPolarHBondContact O-CB 3.19Å; K476-R480 PolarHBondContact O-N 3Å
477	E	85.8	Confident	81.9	Confident	72 Å²	72	104.6 Å²	104.6	34%	0.336	50%	0.498	S	S	.	.	H	α-helix	trans	-64	-48.7	177.3	-177.7	171.4	-138.5	0	0	111.8	E473 K474 Y475 Q479 R480 L481	E473-E477 PolarHBondContact O-N 3.07Å; K474-E477 IonicContact NZ-OE2 2.64Å; K474-E477 PolarHBondContact NZ-OE2 3.04Å; K474-E477 PolarHBondContact O-N 2.99Å; Y475-E477 VanDerWaalsContact C-N 3.31Å; Y475-E477 PolarHBondContact O-N 3.46Å; E477-Q479 VanDerWaalsContact C-N 3.32Å; E477-Q479 PolarHBondContact O-N 3.45Å; E477-R480 CarbonylContact O-C 3.58Å; E477-R480 WeakPolarHBondContact O-CA 3.34Å; E477-R480 WeakPolarHBondContact O-CB 3.44Å; E477-R480 PolarHBondContact O-N 3.26Å; E477-L481 HydrophobicContact CG-CD1 4.05Å; E477-L481 HydrophobicContact CG-CG 4.43Å; E477-L481 WeakPolarHBondContact O-CB 3.43Å; E477-L481 WeakPolarHBondContact O-CG 3.23Å; E477-L481 PolarHBondContact O-N 2.61Å
478	C	80.1	Confident	81.3	Confident	77 Å²	77	106.7 Å²	106.7	52%	0.52	50%	0.501	S	S	.	.	H	α-helix	trans	-57.8	-42.3	174	-73.2	0	0	0	0	111.9	K474 Y475 R480 L481 Q482	K474-C478 WeakPolarHBondContact O-CB 3.14Å; K474-C478 PolarHBondContact O-N 2.9Å; K474-C478 PolarHBondContact O-SG 2.99Å; Y475-C478 PolarHBondContact O-N 2.83Å; C478-R480 VanDerWaalsContact C-N 3.32Å; C478-R480 PolarHBondContact O-N 3Å; C478-L481 PolarHBondContact O-N 3.27Å; C478-Q482 VanDerWaalsContact O-CB 3.26Å; C478-Q482 WeakPolarHBondContact O-CB 3.45Å; C478-Q482 PolarHBondContact O-N 3.43Å
479	Q	82.1	Confident	80.3	Confident	67 Å²	67	107.7 Å²	107.7	31%	0.313	51%	0.505	S	S	.	.	H	α-helix	trans	-66.7	-34.1	175.6	-162	-164.2	99.3	0	0	112.1	Y475 K476 E477 K483	Y475-Q479 WeakPolarHBondContact O-CB 3.28Å; Y475-Q479 PolarHBondContact O-N 2.65Å; K476-Q479 PolarHBondContact O-N 2.73Å; E477-Q479 VanDerWaalsContact C-N 3.32Å; E477-Q479 PolarHBondContact O-N 3.45Å; Q479-K483 WeakPolarHBondContact O-CB 3.35Å; Q479-K483 WeakPolarHBondContact O-CG 3.4Å; Q479-K483 PolarHBondContact O-N 3.03Å
480	R	85.6	Confident	79.2	Confident	145 Å²	145	108.1 Å²	108.1	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-69.6	-42.2	175.8	-159.5	179.5	67.9	73.2	5.2	111.2	K476 E477 C478 K483 Q484	K476-R480 WeakPolarHBondContact O-CB 3.19Å; K476-R480 PolarHBondContact O-N 3Å; E477-R480 CarbonylContact O-C 3.58Å; E477-R480 WeakPolarHBondContact O-CA 3.34Å; E477-R480 WeakPolarHBondContact O-CB 3.44Å; E477-R480 PolarHBondContact O-N 3.26Å; C478-R480 VanDerWaalsContact C-N 3.32Å; C478-R480 PolarHBondContact O-N 3Å; R480-K483 PolarHBondContact O-N 3.24Å; R480-Q484 WeakPolarHBondContact O-CB 3.48Å; R480-Q484 PolarHBondContact O-N 3.41Å
481	L	82.9	Confident	77.8	Confident	80 Å²	80	110 Å²	110	42%	0.419	52%	0.516	S	S	.	.	H	α-helix	trans	-65.8	-40.3	172.3	-70.8	170.6	0	0	0	111.6	E477 C478 K483 Q484 V485	E477-L481 HydrophobicContact CG-CD1 4.05Å; E477-L481 HydrophobicContact CG-CG 4.43Å; E477-L481 WeakPolarHBondContact O-CB 3.43Å; E477-L481 WeakPolarHBondContact O-CG 3.23Å; E477-L481 PolarHBondContact O-N 2.61Å; C478-L481 PolarHBondContact O-N 3.27Å; L481-K483 PolarHBondContact O-N 3.37Å; L481-Q484 CarbonylContact O-C 3.57Å; L481-Q484 WeakPolarHBondContact O-CA 3.34Å; L481-Q484 WeakPolarHBondContact O-CB 3.38Å; L481-Q484 PolarHBondContact O-N 3.37Å; L481-V485 WeakPolarHBondContact O-CG2 3.32Å; L481-V485 PolarHBondContact O-N 2.97Å
482	Q	74.9	Confident	76	Confident	129 Å²	129	110.3 Å²	110.3	60%	0.603	52%	0.524	S	S	*	.	H	α-helix	trans	-62.8	-40.8	175.1	-170.3	179.3	23.9	0	0	111.6	C478 Q484 V485 L486	C478-Q482 VanDerWaalsContact O-CB 3.26Å; C478-Q482 WeakPolarHBondContact O-CB 3.45Å; C478-Q482 PolarHBondContact O-N 3.43Å; Q482-Q484 VanDerWaalsContact C-N 3.27Å; Q482-Q484 PolarHBondContact O-N 2.96Å; Q482-V485 PolarHBondContact O-N 2.89Å; Q482-L486 WeakPolarHBondContact O-CB 3.44Å; Q482-L486 PolarHBondContact O-N 2.81Å
483	K	81.6	Confident	74	Confident	116 Å²	116	108.1 Å²	108.1	50%	0.504	53%	0.532	S	S	.	.	H	α-helix	trans	-64.6	-29.1	170.3	-75.5	165.3	174.3	168.9	0	112.8	Q479 R480 L481 K487	Q479-K483 WeakPolarHBondContact O-CB 3.35Å; Q479-K483 WeakPolarHBondContact O-CG 3.4Å; Q479-K483 PolarHBondContact O-N 3.03Å; R480-K483 PolarHBondContact O-N 3.24Å; L481-K483 PolarHBondContact O-N 3.37Å; K483-K487 WeakPolarHBondContact O-CG 3.25Å; K483-K487 PolarHBondContact O-N 2.87Å
484	Q	79.2	Confident	71.7	Confident	96 Å²	96	110.6 Å²	110.6	45%	0.449	54%	0.544	S	S	.	.	H	α-helix	trans	-79.7	-36.8	177	-161	164.3	-3.8	0	0	111.9	R480 L481 Q482 K487 L488	R480-Q484 WeakPolarHBondContact O-CB 3.48Å; R480-Q484 PolarHBondContact O-N 3.41Å; L481-Q484 CarbonylContact O-C 3.57Å; L481-Q484 WeakPolarHBondContact O-CA 3.34Å; L481-Q484 WeakPolarHBondContact O-CB 3.38Å; L481-Q484 PolarHBondContact O-N 3.37Å; Q482-Q484 VanDerWaalsContact C-N 3.27Å; Q482-Q484 PolarHBondContact O-N 2.96Å; Q484-K487 PolarHBondContact O-N 2.76Å; Q484-L488 VanDerWaalsContact O-CG 3.3Å; Q484-L488 WeakPolarHBondContact O-CG 3.43Å; Q484-L488 PolarHBondContact O-N 3.34Å
485	V	73.8	Confident	69.4	Low	96 Å²	96	111.8 Å²	111.8	58%	0.582	56%	0.559	S	S	*	*	H	α-helix	trans	-66.6	-41.4	170.5	170.4	0	0	0	0	111	L481 Q482 L488 S489	L481-V485 WeakPolarHBondContact O-CG2 3.32Å; L481-V485 PolarHBondContact O-N 2.97Å; Q482-V485 PolarHBondContact O-N 2.89Å; V485-L488 PolarHBondContact O-N 3.1Å; V485-S489 PolarHBondContact O-N 2.83Å; V485-S489 PolarHBondContact O-OG 3.12Å
486	L	74.8	Confident	67	Low	92 Å²	92	113.2 Å²	113.2	48%	0.482	57%	0.568	S	S	.	*	H	α-helix	trans	-55	-53.1	170.5	-93.3	161.5	0	0	0	110.8	Q482 L488 S489 E490	Q482-L486 WeakPolarHBondContact O-CB 3.44Å; Q482-L486 PolarHBondContact O-N 2.81Å; L486-L488 VanDerWaalsContact C-N 3.28Å; L486-L488 PolarHBondContact O-N 3.41Å; L486-S489 WeakPolarHBondContact CA-OG 3.44Å; L486-S489 CarbonylContact O-C 3.56Å; L486-S489 PolarHBondContact O-N 2.99Å; L486-S489 PolarHBondContact O-OG 3.42Å; L486-E490 WeakPolarHBondContact O-CG 3.35Å; L486-E490 PolarHBondContact O-N 2.79Å
487	K	73.8	Confident	64.3	Low	132 Å²	132	115.8 Å²	115.8	57%	0.574	58%	0.579	S	S	*	*	H	α-helix	trans	-58.8	-34.4	176	-75.9	-178.8	175.6	-169.8	0	114.1	K483 Q484 E490 Q491	K483-K487 WeakPolarHBondContact O-CG 3.25Å; K483-K487 PolarHBondContact O-N 2.87Å; Q484-K487 PolarHBondContact O-N 2.76Å; K487-E490 WeakPolarHBondContact CA-OE2 3.47Å; K487-Q491 WeakPolarHBondContact O-CB 3.25Å; K487-Q491 WeakPolarHBondContact O-CG 3.4Å; K487-Q491 PolarHBondContact O-N 2.94Å
488	L	70.1	Confident	61.5	Low	100 Å²	100	116.7 Å²	116.7	52%	0.524	59%	0.593	S	S	.	*	H	α-helix	trans	-73.9	-32.9	175.2	-72.2	167.3	0	0	0	112.3	Q484 V485 L486 Q491 Q492	Q484-L488 VanDerWaalsContact O-CG 3.3Å; Q484-L488 WeakPolarHBondContact O-CG 3.43Å; Q484-L488 PolarHBondContact O-N 3.34Å; V485-L488 PolarHBondContact O-N 3.1Å; L486-L488 VanDerWaalsContact C-N 3.28Å; L486-L488 PolarHBondContact O-N 3.41Å; L488-Q491 PolarHBondContact O-N 3.27Å; L488-Q492 PolarHBondContact O-N 3.43Å; L488-Q492 VanDerWaalsContact O-N 3.09Å
489	S	61.8	Low	59.1	Low	65 Å²	65	118.6 Å²	118.6	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-71	-38	172.3	71	0	0	0	0	112.3	V485 L486 Q491 Q492 G493	V485-S489 PolarHBondContact O-N 2.83Å; V485-S489 PolarHBondContact O-OG 3.12Å; L486-S489 WeakPolarHBondContact CA-OG 3.44Å; L486-S489 CarbonylContact O-C 3.56Å; L486-S489 PolarHBondContact O-N 2.99Å; L486-S489 PolarHBondContact O-OG 3.42Å; S489-Q491 VanDerWaalsContact C-N 3.33Å; S489-Q492 PolarHBondContact O-N 2.77Å; S489-G493 PolarHBondContact O-N 3.24Å
490	E	59	Low	56.7	Low	125 Å²	125	121.8 Å²	121.8	58%	0.584	63%	0.626	S	S	*	*	H	α-helix	trans	-63.2	-38.5	170.2	-68.9	169.1	156.6	0	0	110.9	L486 K487 Q492 G493	L486-E490 WeakPolarHBondContact O-CG 3.35Å; L486-E490 PolarHBondContact O-N 2.79Å; K487-E490 WeakPolarHBondContact CA-OE2 3.47Å; E490-Q492 VanDerWaalsContact C-N 3.33Å; E490-Q492 PolarHBondContact O-N 3.18Å; E490-G493 WeakPolarHBondContact O-CA 3.5Å; E490-G493 PolarHBondContact O-N 3.46Å
491	Q	53.3	Low	55.2	Low	151 Å²	151	120.1 Å²	120.1	71%	0.706	63%	0.634	S	S	*	*	H	α-helix	trans	-72.4	-19.3	175.9	-76	172.1	11.7	0	0	114.6	K487 L488 S489 G493	K487-Q491 WeakPolarHBondContact O-CB 3.25Å; K487-Q491 WeakPolarHBondContact O-CG 3.4Å; K487-Q491 PolarHBondContact O-N 2.94Å; L488-Q491 PolarHBondContact O-N 3.27Å; S489-Q491 VanDerWaalsContact C-N 3.33Å; Q491-G493 VanDerWaalsContact C-N 3.31Å
492	Q	47.6	Very low	52.5	Low	180 Å²	180	124.9 Å²	124.9	84%	0.841	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-9.5	163.6	-70	-171.3	-1.5	0	0	112.6	L488 S489 E490	L488-Q492 PolarHBondContact O-N 3.43Å; L488-Q492 VanDerWaalsContact O-N 3.09Å; S489-Q492 PolarHBondContact O-N 2.77Å; E490-Q492 VanDerWaalsContact C-N 3.33Å; E490-Q492 PolarHBondContact O-N 3.18Å
493	G	46.8	Very low	50.3	Low	63 Å²	63	123.2 Å²	123.2	65%	0.649	66%	0.662	S	S	*	*	S	Bend	trans	-95	-2	-167.7	0	0	0	0	0	117.1	S489 E490 Q491	S489-G493 PolarHBondContact O-N 3.24Å; E490-G493 WeakPolarHBondContact O-CA 3.5Å; E490-G493 PolarHBondContact O-N 3.46Å; Q491-G493 VanDerWaalsContact C-N 3.31Å
494	E	36.7	Very low	47.7	Very low	172 Å²	172	122.4 Å²	122.4	80%	0.804	68%	0.677	S	S	*	*			trans	-134.5	97.3	-176.7	-150.3	177.1	-117.7	0	0	115.2
495	V	35.8	Very low	45.2	Very low	120 Å²	120	122.3 Å²	122.3	73%	0.727	69%	0.693	S	S	*	*			trans	-95.6	95.6	168.8	176.4	0	0	0	0	109.8
496	K	33.6	Very low	43.1	Very low	171 Å²	171	121.8 Å²	121.8	74%	0.743	70%	0.699	S	S	*	*			trans	73.3	144.9	167.3	-50	157.6	-171.5	164.6	0	114.7
497	K	31.2	Very low	41.1	Very low	182 Å²	182	125.1 Å²	125.1	79%	0.791	72%	0.715	S	S	*	*			cis	-170.4	149.2	-11.2	-117.1	-174.4	177.7	-171.8	0	108
498	S	27.7	Very low	39.5	Very low	92 Å²	92	125 Å²	125	64%	0.643	73%	0.728	S	S	*	*			trans	30.5	143.6	141.8	69.2	0	0	0	0	120.5
499	T	29.8	Very low	37.7	Very low	116 Å²	116	124.9 Å²	124.9	71%	0.712	74%	0.742	S	S	*	*			cis	-178.6	141.6	40	-10.8	0	0	0	0	111.1
500	V	31.2	Very low	35.9	Very low	134 Å²	134	127.9 Å²	127.9	81%	0.812	76%	0.763	S	S	*	*			trans	63.7	149.4	130.8	166.1	0	0	0	0	119.2
501	P	53.8	Low	34.4	Very low	110 Å²	110	125.6 Å²	125.6	71%	0.714	77%	0.773	S	S	*	*			trans	-130.4	-140.8	-133.6	45.5	-30.1	0	0	0	115.3
502	E	26.3	Very low	33.3	Very low	181 Å²	181	123.5 Å²	123.5	85%	0.846	78%	0.775	S	S	*	*			trans	100	131.7	164.5	-60.6	-160.4	105.2	0	0	121
503	A	28.3	Very low	33.1	Very low	93 Å²	93	120.1 Å²	120.1	77%	0.769	77%	0.768	S	S	*	*			trans	61.3	123	134.4	0	0	0	0	0	124.7
504	A	27.9	Very low	32.1	Very low	99 Å²	99	123.3 Å²	123.3	82%	0.818	77%	0.771	S	S	*	*				84.3	146.9	126.6	0	0	0	0	0	123.8
505	A	27	Very low	31.6	Very low	94 Å²	94	121.5 Å²	121.5	78%	0.777	77%	0.772	S	S	*	*			trans	70.9	110.6	146.6	0	0	0	0	0	123.1
506	A	28	Very low	31.3	Very low	85 Å²	85	121 Å²	121	70%	0.702	77%	0.773	S	S	*	*				44.2	127.4	123.4	0	0	0	0	0	123.9
507	I	33.1	Very low	31.5	Very low	162 Å²	162	119.2 Å²	119.2	83%	0.831	78%	0.776	S	S	*	*				47.1	117.3	123.8	-55.8	172.1	0	0	0	117.2
508	P	40.8	Very low	32	Very low	129 Å²	129	116.8 Å²	116.8	84%	0.838	78%	0.779	S	S	*	*				-150.9	-170	86.8	40.8	-21.7	0	0	0	116.4
509	A	32	Very low	32	Very low	99 Å²	99	116.1 Å²	116.1	82%	0.818	79%	0.787	S	S	*	*			trans	-120.4	161.1	-171.3	0	0	0	0	0	114.3
510	S	24.8	Very low	32.2	Very low	127 Å²	127	116.2 Å²	116.2	89%	0.888	79%	0.792	S	S	*	*			trans	-160	149.7	161.4	56.1	0	0	0	0	109.7
511	G	27.8	Very low	33.1	Very low	78 Å²	78	115.4 Å²	115.4	80%	0.804	79%	0.79	S	S	*	*			cis	-165.5	176.2	-3	0	0	0	0	0	113.2
512	S	29	Very low	32.1	Very low	106 Å²	106	114 Å²	114	74%	0.741	80%	0.795	S	S	*	*			trans	-88	179.5	170.5	-143.9	0	0	0	0	110.2
513	P	43.8	Very low	32.5	Very low	109 Å²	109	111.1 Å²	111.1	71%	0.708	80%	0.795	S	S	*	*				-144.7	156.4	57.6	37.1	-16.1	0	0	0	118.5
514	D	26.2	Very low	33.4	Very low	130 Å²	130	111.2 Å²	111.2	70%	0.695	80%	0.796	S	S	*	*			trans	27.4	131.5	131.4	-40.5	-39.7	0	0	0	119.8
515	T	26.6	Very low	34.3	Very low	135 Å²	135	111.1 Å²	111.1	83%	0.828	78%	0.782	S	S	*	*				-177	163.7	70.5	29.5	0	0	0	0	109.8
516	S	29.3	Very low	35.7	Very low	109 Å²	109	111.7 Å²	111.7	76%	0.762	78%	0.777	S	S	*	*			cis	-161.3	-162.2	-14.4	59.3	0	0	0	0	109.1
517	V	36.8	Very low	37.1	Very low	133 Å²	133	113.9 Å²	113.9	81%	0.806	78%	0.775	S	S	*	*			trans	-139.4	138.3	-175.4	-173.7	0	0	0	0	110.3
518	P	41.8	Very low	38.1	Very low	131 Å²	131	111.2 Å²	111.2	85%	0.851	76%	0.762	S	S	*	*				-150.8	150.6	113.1	37.7	-21	0	0	0	115.9
519	G	27.3	Very low	38.9	Very low	79 Å²	79	111 Å²	111	81%	0.814	75%	0.749	S	S	*	*			trans	133.4	127.7	157.3	0	0	0	0	0	116.8
520	S	35.5	Very low	40.3	Very low	117 Å²	117	108.9 Å²	108.9	82%	0.818	73%	0.732	S	S	*	*			trans	-127.7	171.8	167.5	-138.6	0	0	0	0	107.4
521	P	48.6	Very low	42.4	Very low	118 Å²	118	106.2 Å²	106.2	77%	0.766	71%	0.707	S	S	*	*			cis	-136.8	174.8	3.5	42.1	-25.3	0	0	0	116.2
522	G	33	Very low	44.3	Very low	79 Å²	79	106.2 Å²	106.2	81%	0.814	69%	0.688	S	S	*	*			trans	84.8	88.6	135.1	0	0	0	0	0	119.9
523	S	35.7	Very low	46.1	Very low	121 Å²	121	105.7 Å²	105.7	85%	0.846	67%	0.674	S	S	*	*			trans	-161.5	126.2	132.6	-171.2	0	0	0	0	109
524	A	45.8	Very low	47.2	Very low	96 Å²	96	107.2 Å²	107.2	79%	0.793	67%	0.671	S	S	*	*			trans	-90	109.8	175.6	0	0	0	0	0	109.2	P526	A524-P526 VanDerWaalsContact O-CD 3.31Å; A524-P526 WeakPolarHBondContact O-CD 3.17Å
525	D	47.7	Very low	49.2	Very low	97 Å²	97	108.1 Å²	108.1	52%	0.519	67%	0.669	S	S	.	*			trans	-83.8	109.7	167.4	-177.3	-3.4	0	0	0	109.2	M527 L528	D525-M527 PolarHBondContact O-N 3.36Å; D525-M527 VanDerWaalsContact O-N 3.17Å; D525-M527 VanDerWaalsContact OD1-CB 3.22Å; D525-M527 WeakPolarHBondContact OD1-CB 3.48Å; D525-M527 PolarHBondContact OD1-N 2.86Å; D525-L528 PolarHBondContact O-N 3.42Å
526	P	57.2	Low	51.2	Low	105 Å²	105	106.8 Å²	106.8	68%	0.682	66%	0.657	S	S	*	*	H	α-helix	trans	-65	-17.2	-179.9	28.8	-35.7	0	0	0	112.9	A524 A530	A524-P526 VanDerWaalsContact O-CD 3.31Å; A524-P526 WeakPolarHBondContact O-CD 3.17Å; P526-A530 VanDerWaalsContact O-CB 3.24Å; P526-A530 WeakPolarHBondContact O-CB 3.22Å; P526-A530 PolarHBondContact O-N 3.45Å
527	M	55.6	Low	53	Low	132 Å²	132	107.1 Å²	107.1	65%	0.65	64%	0.644	S	S	*	*	H	α-helix	trans	-70.8	-39.8	178.2	-168.6	170.5	-179.3	0	0	112	D525 I531	D525-M527 PolarHBondContact O-N 3.36Å; D525-M527 VanDerWaalsContact O-N 3.17Å; D525-M527 VanDerWaalsContact OD1-CB 3.22Å; D525-M527 WeakPolarHBondContact OD1-CB 3.48Å; D525-M527 PolarHBondContact OD1-N 2.86Å; M527-I531 HydrophobicContact CG-CD1 4.13Å; M527-I531 WeakPolarHBondContact O-CD1 3.41Å; M527-I531 VanDerWaalsContact O-CG1 3.27Å; M527-I531 WeakPolarHBondContact O-CG1 3.03Å; M527-I531 PolarHBondContact O-N 2.8Å; M527-I531 VanDerWaalsContact O-N 3.11Å
528	L	54.3	Low	54.6	Low	106 Å²	106	102.3 Å²	102.3	56%	0.555	62%	0.621	S	S	*	*	H	α-helix	trans	-73.2	-42.5	-177.5	-172.4	60.4	0	0	0	111.9	D525 A530 I531 I532	D525-L528 PolarHBondContact O-N 3.42Å; L528-A530 VanDerWaalsContact C-N 3.32Å; L528-A530 PolarHBondContact O-N 3.21Å; L528-I531 PolarHBondContact O-N 3.47Å; L528-I532 HydrophobicContact CG-CD1 4.2Å; L528-I532 WeakPolarHBondContact O-CG1 3.41Å; L528-I532 PolarHBondContact O-N 2.93Å
529	E	57.2	Low	56	Low	123 Å²	123	101.2 Å²	101.2	58%	0.575	61%	0.607	S	S	*	*	H	α-helix	trans	-63.4	-39	175.7	-166.4	63.4	-154.8	0	0	111.1	I532 Q533	E529-I532 PolarHBondContact O-N 3.39Å; E529-Q533 VanDerWaalsContact O-CB 3.32Å; E529-Q533 WeakPolarHBondContact O-CB 3.02Å; E529-Q533 PolarHBondContact O-N 3.23Å
530	A	62.9	Low	58	Low	55 Å²	55	101.3 Å²	101.3	46%	0.455	60%	0.595	S	S	.	*	H	α-helix	trans	-61.6	-45	174.2	0	0	0	0	0	112.3	P526 L528 I532 Q533 E534	P526-A530 VanDerWaalsContact O-CB 3.24Å; P526-A530 WeakPolarHBondContact O-CB 3.22Å; P526-A530 PolarHBondContact O-N 3.45Å; L528-A530 VanDerWaalsContact C-N 3.32Å; L528-A530 PolarHBondContact O-N 3.21Å; A530-I532 PolarHBondContact O-N 2.73Å; A530-Q533 PolarHBondContact O-N 2.84Å; A530-E534 VanDerWaalsContact O-CB 3.28Å; A530-E534 WeakPolarHBondContact O-CB 3.43Å; A530-E534 PolarHBondContact O-N 3Å
531	I	68.6	Low	59.8	Low	71 Å²	71	104.8 Å²	104.8	36%	0.364	59%	0.59	S	S	.	*	H	α-helix	trans	-63.8	-40.6	177.9	-70	163.5	0	0	0	111.5	M527 L528 K535	M527-I531 HydrophobicContact CG-CD1 4.13Å; M527-I531 WeakPolarHBondContact O-CD1 3.41Å; M527-I531 VanDerWaalsContact O-CG1 3.27Å; M527-I531 WeakPolarHBondContact O-CG1 3.03Å; M527-I531 PolarHBondContact O-N 2.8Å; M527-I531 VanDerWaalsContact O-N 3.11Å; L528-I531 PolarHBondContact O-N 3.47Å; I531-K535 WeakPolarHBondContact O-CG 3.48Å; I531-K535 PolarHBondContact O-N 2.9Å
532	I	67.5	Low	61.1	Low	78 Å²	78	104 Å²	104	40%	0.4	58%	0.576	S	S	.	*	H	α-helix	trans	-65.5	-46.5	176.4	-68.4	167.1	0	0	0	110.2	L528 E529 A530 E534 K535 L536	L528-I532 HydrophobicContact CG-CD1 4.2Å; L528-I532 WeakPolarHBondContact O-CG1 3.41Å; L528-I532 PolarHBondContact O-N 2.93Å; E529-I532 PolarHBondContact O-N 3.39Å; A530-I532 PolarHBondContact O-N 2.73Å; I532-E534 VanDerWaalsContact C-N 3.34Å; I532-E534 PolarHBondContact O-N 2.95Å; I532-K535 PolarHBondContact O-N 2.94Å; I532-L536 HydrophobicContact CG2-CD1 4.01Å; I532-L536 WeakPolarHBondContact O-CG 3.49Å; I532-L536 PolarHBondContact O-N 3.24Å
533	Q	66	Low	62.9	Low	96 Å²	96	103 Å²	103	45%	0.449	56%	0.56	S	S	.	*	H	α-helix	trans	-68.5	-31.5	179.7	-158.1	-173.8	92.2	0	0	112.6	E529 A530 K537	E529-Q533 VanDerWaalsContact O-CB 3.32Å; E529-Q533 WeakPolarHBondContact O-CB 3.02Å; E529-Q533 PolarHBondContact O-N 3.23Å; A530-Q533 PolarHBondContact O-N 2.84Å; Q533-K537 WeakPolarHBondContact O-CB 3.29Å; Q533-K537 WeakPolarHBondContact O-CD 3.47Å; Q533-K537 VanDerWaalsContact O-CG 3.23Å; Q533-K537 WeakPolarHBondContact O-CG 3.49Å; Q533-K537 PolarHBondContact O-N 3.39Å
534	E	68.5	Low	64.8	Low	140 Å²	140	100 Å²	100	65%	0.654	54%	0.54	S	S	*	.	H	α-helix	trans	-68.5	-45.4	172	-176.7	168.9	-148.4	0	0	111.6	A530 I532 L536 K537 G538	A530-E534 VanDerWaalsContact O-CB 3.28Å; A530-E534 WeakPolarHBondContact O-CB 3.43Å; A530-E534 PolarHBondContact O-N 3Å; I532-E534 VanDerWaalsContact C-N 3.34Å; I532-E534 PolarHBondContact O-N 2.95Å; E534-L536 VanDerWaalsContact C-N 3.34Å; E534-L536 PolarHBondContact O-N 3.34Å; E534-K537 PolarHBondContact O-N 2.69Å; E534-G538 PolarHBondContact O-N 3.11Å
535	K	67.6	Low	66.5	Low	149 Å²	149	99.3 Å²	99.3	65%	0.648	52%	0.523	S	S	*	.	H	α-helix	trans	-61.8	-40	174	-76.8	-169.4	175.5	-172.4	0	112.5	I531 I532 G538 I539	I531-K535 WeakPolarHBondContact O-CG 3.48Å; I531-K535 PolarHBondContact O-N 2.9Å; I532-K535 PolarHBondContact O-N 2.94Å; K535-G538 PolarHBondContact O-N 2.95Å; K535-I539 WeakPolarHBondContact O-CG1 3.11Å; K535-I539 PolarHBondContact O-N 3.27Å
536	L	67.5	Low	67.8	Low	108 Å²	108	102.6 Å²	102.6	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-64.8	-39	174.3	-72.6	169.5	0	0	0	112.2	I532 E534 G538 S540	I532-L536 HydrophobicContact CG2-CD1 4.01Å; I532-L536 WeakPolarHBondContact O-CG 3.49Å; I532-L536 PolarHBondContact O-N 3.24Å; E534-L536 VanDerWaalsContact C-N 3.34Å; E534-L536 PolarHBondContact O-N 3.34Å; L536-G538 VanDerWaalsContact C-N 3.35Å; L536-S540 VanDerWaalsContact O-CB 3.24Å; L536-S540 WeakPolarHBondContact O-CB 3.31Å; L536-S540 PolarHBondContact O-N 2.9Å
537	K	68.9	Low	68.8	Low	116 Å²	116	101.7 Å²	101.7	50%	0.504	52%	0.517	S	S	.	.	H	α-helix	trans	-65	-36.7	171.4	-74.1	164.7	-173.3	164.3	0	112.1	Q533 E534 R541	Q533-K537 WeakPolarHBondContact O-CB 3.29Å; Q533-K537 WeakPolarHBondContact O-CD 3.47Å; Q533-K537 VanDerWaalsContact O-CG 3.23Å; Q533-K537 WeakPolarHBondContact O-CG 3.49Å; Q533-K537 PolarHBondContact O-N 3.39Å; E534-K537 PolarHBondContact O-N 2.69Å; K537-R541 WeakPolarHBondContact O-CB 3.43Å; K537-R541 WeakPolarHBondContact O-CG 3.38Å; K537-R541 PolarHBondContact O-N 3.36Å
538	G	68.8	Low	70.2	Confident	31 Å²	31	98.5 Å²	98.5	32%	0.32	50%	0.503	S	S	.	.	H	α-helix	trans	-61.7	-53.5	173	0	0	0	0	0	112.2	E534 K535 L536 S540 R541 E542	E534-G538 PolarHBondContact O-N 3.11Å; K535-G538 PolarHBondContact O-N 2.95Å; L536-G538 VanDerWaalsContact C-N 3.35Å; G538-S540 VanDerWaalsContact C-N 3.3Å; G538-S540 PolarHBondContact O-N 2.8Å; G538-R541 WeakPolarHBondContact O-CB 3.47Å; G538-R541 PolarHBondContact O-N 2.96Å; G538-R541 VanDerWaalsContact O-N 3.16Å; G538-E542 PolarHBondContact O-N 3.22Å
539	I	71.1	Confident	71.7	Confident	109 Å²	109	99.5 Å²	99.5	56%	0.559	50%	0.503	S	S	*	.	H	α-helix	trans	-60.5	-39.2	177.4	-65.9	162.7	0	0	0	111.2	K535 E542 A543	K535-I539 WeakPolarHBondContact O-CG1 3.11Å; K535-I539 PolarHBondContact O-N 3.27Å; I539-E542 PolarHBondContact O-N 3.02Å; I539-A543 WeakPolarHBondContact O-CB 3.36Å; I539-A543 PolarHBondContact O-N 3.07Å
540	S	69.9	Low	72.9	Confident	80 Å²	80	101.1 Å²	101.1	56%	0.559	51%	0.505	S	S	*	.	H	α-helix	trans	-65.4	-40.8	175.5	178.7	0	0	0	0	112.6	L536 G538 A543 S544	L536-S540 VanDerWaalsContact O-CB 3.24Å; L536-S540 WeakPolarHBondContact O-CB 3.31Å; L536-S540 PolarHBondContact O-N 2.9Å; G538-S540 VanDerWaalsContact C-N 3.3Å; G538-S540 PolarHBondContact O-N 2.8Å; S540-A543 PolarHBondContact O-N 3.17Å; S540-S544 PolarHBondContact O-N 3.17Å
541	R	74.3	Confident	74	Confident	191 Å²	191	105 Å²	105	72%	0.721	51%	0.507	S	S	*	.	H	α-helix	trans	-63.4	-48	171.8	-78	175.6	173.6	172.8	-2.4	111.5	K537 G538 A543 S544 D545	K537-R541 WeakPolarHBondContact O-CB 3.43Å; K537-R541 WeakPolarHBondContact O-CG 3.38Å; K537-R541 PolarHBondContact O-N 3.36Å; G538-R541 WeakPolarHBondContact O-CB 3.47Å; G538-R541 PolarHBondContact O-N 2.96Å; G538-R541 VanDerWaalsContact O-N 3.16Å; R541-A543 VanDerWaalsContact C-N 3.27Å; R541-A543 PolarHBondContact O-N 2.75Å; R541-S544 WeakPolarHBondContact O-CB 3.45Å; R541-S544 PolarHBondContact O-N 2.72Å; R541-S544 VanDerWaalsContact O-N 3.11Å; R541-D545 WeakPolarHBondContact O-CB 3.4Å; R541-D545 PolarHBondContact O-N 2.93Å
542	E	75.3	Confident	75	Confident	100 Å²	100	108.3 Å²	108.3	47%	0.467	52%	0.519	S	S	.	.	H	α-helix	trans	-57.9	-37.9	175.6	-78.4	-169.9	-134.3	0	0	112.8	G538 I539 R546	G538-E542 PolarHBondContact O-N 3.22Å; I539-E542 PolarHBondContact O-N 3.02Å; E542-R546 WeakPolarHBondContact O-CB 3.49Å; E542-R546 WeakPolarHBondContact O-CG 3.27Å; E542-R546 PolarHBondContact O-N 3.38Å; E542-R546 IonicContact OE2-CZ 3.96Å; E542-R546 IonicContact OE2-NE 2.62Å; E542-R546 IonicContact OE2-NH2 3.38Å; E542-R546 PolarHBondContact OE2-NH2 3.43Å
543	A	70.6	Confident	75.5	Confident	58 Å²	58	108.3 Å²	108.3	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-66.6	-40	175.4	0	0	0	0	0	112.3	I539 S540 R541 N547	I539-A543 WeakPolarHBondContact O-CB 3.36Å; I539-A543 PolarHBondContact O-N 3.07Å; S540-A543 PolarHBondContact O-N 3.17Å; R541-A543 VanDerWaalsContact C-N 3.27Å; R541-A543 PolarHBondContact O-N 2.75Å; A543-N547 WeakPolarHBondContact O-CB 3.35Å; A543-N547 PolarHBondContact O-N 3.23Å
544	S	75.8	Confident	76.4	Confident	59 Å²	59	109.5 Å²	109.5	41%	0.413	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-50.7	172.3	-160.8	0	0	0	0	111	S540 R541 R546 N547 D548	S540-S544 PolarHBondContact O-N 3.17Å; R541-S544 WeakPolarHBondContact O-CB 3.45Å; R541-S544 PolarHBondContact O-N 2.72Å; R541-S544 VanDerWaalsContact O-N 3.11Å; S544-R546 VanDerWaalsContact C-N 3.27Å; S544-R546 PolarHBondContact O-N 2.8Å; S544-N547 CarbonylContact O-C 3.6Å; S544-N547 WeakPolarHBondContact O-CA 3.32Å; S544-N547 WeakPolarHBondContact O-CB 3.43Å; S544-N547 PolarHBondContact O-N 3.15Å; S544-D548 PolarHBondContact O-N 3.42Å; S544-D548 PolarHBondContact OG-OD2 2.66Å
545	D	80.8	Confident	77.4	Confident	82 Å²	82	108.1 Å²	108.1	44%	0.439	52%	0.523	S	S	.	.	H	α-helix	trans	-51.9	-44.3	176.3	-102.4	43.5	0	0	0	112.3	R541 K549	R541-D545 WeakPolarHBondContact O-CB 3.4Å; R541-D545 PolarHBondContact O-N 2.93Å; D545-K549 VanDerWaalsContact O-CB 3.22Å; D545-K549 WeakPolarHBondContact O-CB 3.26Å; D545-K549 VanDerWaalsContact O-CD 3.25Å; D545-K549 WeakPolarHBondContact O-CD 3.45Å; D545-K549 WeakPolarHBondContact O-CG 3.41Å; D545-K549 PolarHBondContact O-N 3.1Å; D545-K549 IonicContact OD2-NZ 2.71Å; D545-K549 PolarHBondContact OD2-NZ 2.77Å
546	R	76.1	Confident	78.2	Confident	165 Å²	165	105.8 Å²	105.8	62%	0.623	52%	0.515	S	S	*	.	H	α-helix	trans	-67.4	-38.6	176.6	-71.2	169.9	-158.6	-164.3	8.4	111.8	E542 S544 Y550	E542-R546 WeakPolarHBondContact O-CB 3.49Å; E542-R546 WeakPolarHBondContact O-CG 3.27Å; E542-R546 PolarHBondContact O-N 3.38Å; E542-R546 IonicContact OE2-CZ 3.96Å; E542-R546 IonicContact OE2-NE 2.62Å; E542-R546 IonicContact OE2-NH2 3.38Å; E542-R546 PolarHBondContact OE2-NH2 3.43Å; S544-R546 VanDerWaalsContact C-N 3.27Å; S544-R546 PolarHBondContact O-N 2.8Å; R546-Y550 VanDerWaalsContact O-CB 3.27Å; R546-Y550 WeakPolarHBondContact O-CB 3.32Å; R546-Y550 PolarHBondContact O-N 2.78Å
547	N	77.8	Confident	79.1	Confident	87 Å²	87	106.7 Å²	106.7	47%	0.465	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-43.2	176.1	-172.3	4.3	0	0	0	111.9	A543 S544 Y550 R551	A543-N547 WeakPolarHBondContact O-CB 3.35Å; A543-N547 PolarHBondContact O-N 3.23Å; S544-N547 CarbonylContact O-C 3.6Å; S544-N547 WeakPolarHBondContact O-CA 3.32Å; S544-N547 WeakPolarHBondContact O-CB 3.43Å; S544-N547 PolarHBondContact O-N 3.15Å; N547-Y550 PolarHBondContact O-N 2.79Å; N547-R551 WeakPolarHBondContact O-CB 3.28Å; N547-R551 PolarHBondContact O-N 2.81Å
548	D	85.4	Confident	79.9	Confident	65 Å²	65	105.7 Å²	105.7	35%	0.348	52%	0.518	S	S	.	.	H	α-helix	trans	-71.1	-37.3	177.6	-65.1	-46.9	0	0	0	111.8	S544 R551 K552	S544-D548 PolarHBondContact O-N 3.42Å; S544-D548 PolarHBondContact OG-OD2 2.66Å; D548-R551 PolarHBondContact O-N 3.35Å; D548-R551 IonicContact OD1-CZ 2.66Å; D548-R551 IonicContact OD1-NH1 2.97Å; D548-R551 PolarHBondContact OD1-NH1 3.04Å; D548-R551 IonicContact OD1-NH2 2.72Å; D548-R551 PolarHBondContact OD1-NH2 3.42Å; D548-K552 WeakPolarHBondContact O-CB 3.38Å; D548-K552 PolarHBondContact O-N 2.81Å
549	K	84.8	Confident	80.8	Confident	127 Å²	127	107.8 Å²	107.8	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-61.4	-42.5	168.5	-74.2	161.4	-171.7	152.9	0	111.7	D545 K552 C553	D545-K549 VanDerWaalsContact O-CB 3.22Å; D545-K549 WeakPolarHBondContact O-CB 3.26Å; D545-K549 VanDerWaalsContact O-CD 3.25Å; D545-K549 WeakPolarHBondContact O-CD 3.45Å; D545-K549 WeakPolarHBondContact O-CG 3.41Å; D545-K549 PolarHBondContact O-N 3.1Å; D545-K549 IonicContact OD2-NZ 2.71Å; D545-K549 PolarHBondContact OD2-NZ 2.77Å; K549-K552 PolarHBondContact O-N 3.34Å; K549-C553 VanDerWaalsContact O-CB 3.31Å; K549-C553 WeakPolarHBondContact O-CB 3.33Å; K549-C553 PolarHBondContact O-N 2.91Å
550	Y	82.5	Confident	81.5	Confident	156 Å²	156	107.4 Å²	107.4	61%	0.612	52%	0.516	S	S	*	.	H	α-helix	trans	-63.8	-44	174.7	176.3	-99.9	0	0	0	112	R546 N547 K552 C553 K554	R546-Y550 VanDerWaalsContact O-CB 3.27Å; R546-Y550 WeakPolarHBondContact O-CB 3.32Å; R546-Y550 PolarHBondContact O-N 2.78Å; N547-Y550 PolarHBondContact O-N 2.79Å; Y550-K552 PolarHBondContact O-N 3Å; Y550-C553 PolarHBondContact O-N 3.49Å; Y550-K554 WeakPolarHBondContact O-CB 3.44Å; Y550-K554 PolarHBondContact O-N 3.45Å
551	R	86.5	Confident	82.3	Confident	136 Å²	136	110.8 Å²	110.8	51%	0.513	52%	0.52	S	S	.	.	H	α-helix	trans	-60	-45.2	175.9	-164.2	-175.5	-51.9	119.5	21.9	111.4	N547 D548 K554 Q555	N547-R551 WeakPolarHBondContact O-CB 3.28Å; N547-R551 PolarHBondContact O-N 2.81Å; D548-R551 PolarHBondContact O-N 3.35Å; D548-R551 IonicContact OD1-CZ 2.66Å; D548-R551 IonicContact OD1-NH1 2.97Å; D548-R551 PolarHBondContact OD1-NH1 3.04Å; D548-R551 IonicContact OD1-NH2 2.72Å; D548-R551 PolarHBondContact OD1-NH2 3.42Å; R551-K554 PolarHBondContact O-N 2.62Å; R551-Q555 PolarHBondContact O-N 2.79Å
552	K	88.4	Confident	83	Confident	142 Å²	142	107.2 Å²	107.2	62%	0.617	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-40.8	177.4	-169.5	170.6	-176.4	176.1	0	112.5	D548 K549 Y550 Q555 M556	D548-K552 WeakPolarHBondContact O-CB 3.38Å; D548-K552 PolarHBondContact O-N 2.81Å; K549-K552 PolarHBondContact O-N 3.34Å; Y550-K552 PolarHBondContact O-N 3Å; K552-Q555 PolarHBondContact O-N 3.29Å; K552-M556 WeakPolarHBondContact O-CG 3.25Å; K552-M556 PolarHBondContact O-N 3.38Å
553	C	78.5	Confident	83.6	Confident	78 Å²	78	108.9 Å²	108.9	53%	0.527	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-43.8	175	-167.2	0	0	0	0	111.8	K549 Y550 Q555 M556 L557	K549-C553 VanDerWaalsContact O-CB 3.31Å; K549-C553 WeakPolarHBondContact O-CB 3.33Å; K549-C553 PolarHBondContact O-N 2.91Å; Y550-C553 PolarHBondContact O-N 3.49Å; C553-Q555 VanDerWaalsContact C-N 3.32Å; C553-Q555 PolarHBondContact O-N 2.63Å; C553-M556 PolarHBondContact O-N 3.42Å; C553-L557 WeakPolarHBondContact O-CB 3.15Å; C553-L557 PolarHBondContact O-N 3.3Å
554	K	86.4	Confident	84.1	Confident	121 Å²	121	109.9 Å²	109.9	53%	0.526	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-37.8	173.8	-177.4	177.7	177.2	-179.3	0	112.4	Y550 R551 M558	Y550-K554 WeakPolarHBondContact O-CB 3.44Å; Y550-K554 PolarHBondContact O-N 3.45Å; R551-K554 PolarHBondContact O-N 2.62Å; K554-M558 WeakPolarHBondContact O-CG 3.45Å; K554-M558 PolarHBondContact O-N 3.13Å
555	Q	89.2	Confident	84.7	Confident	111 Å²	111	110.2 Å²	110.2	52%	0.519	52%	0.519	S	S	.	.	H	α-helix	trans	-66.3	-50	176	177	170.6	-12.9	0	0	111.6	R551 K552 C553 L557 M558 E559	R551-Q555 PolarHBondContact O-N 2.79Å; K552-Q555 PolarHBondContact O-N 3.29Å; C553-Q555 VanDerWaalsContact C-N 3.32Å; C553-Q555 PolarHBondContact O-N 2.63Å; Q555-L557 PolarHBondContact O-N 2.64Å; Q555-M558 WeakPolarHBondContact O-CA 3.19Å; Q555-M558 WeakPolarHBondContact O-CB 3.26Å; Q555-M558 PolarHBondContact O-N 3.04Å; Q555-E559 HydrophobicContact CG-CG 4.38Å; Q555-E559 VanDerWaalsContact CG-OE1 3.22Å; Q555-E559 WeakPolarHBondContact CG-OE1 3.37Å; Q555-E559 PolarHBondContact NE2-OE1 3.4Å; Q555-E559 WeakPolarHBondContact O-CG 3.45Å; Q555-E559 PolarHBondContact O-N 2.89Å
556	M	83.7	Confident	85.2	Confident	99 Å²	99	111.5 Å²	111.5	49%	0.488	53%	0.526	S	S	.	.	H	α-helix	trans	-59.3	-35.3	177	-65.4	-176.3	-51.8	0	0	112	K552 C553 M558 E559 E560	K552-M556 WeakPolarHBondContact O-CG 3.25Å; K552-M556 PolarHBondContact O-N 3.38Å; C553-M556 PolarHBondContact O-N 3.42Å; M556-M558 VanDerWaalsContact C-N 3.33Å; M556-M558 PolarHBondContact O-N 2.95Å; M556-E559 PolarHBondContact O-N 2.83Å; M556-E560 VanDerWaalsContact O-CB 3.31Å; M556-E560 WeakPolarHBondContact O-CB 3.47Å; M556-E560 PolarHBondContact O-N 2.92Å
557	L	85.8	Confident	85.7	Confident	127 Å²	127	110.1 Å²	110.1	67%	0.665	52%	0.524	S	S	*	.	H	α-helix	trans	-66.8	-30.4	174.5	-177.1	62.8	0	0	0	113.4	C553 Q555 K561	C553-L557 WeakPolarHBondContact O-CB 3.15Å; C553-L557 PolarHBondContact O-N 3.3Å; Q555-L557 PolarHBondContact O-N 2.64Å; L557-K561 VanDerWaalsContact O-CB 3.29Å; L557-K561 WeakPolarHBondContact O-CB 3.33Å; L557-K561 PolarHBondContact O-N 3.25Å
558	M	86.3	Confident	86.2	Confident	95 Å²	95	108.7 Å²	108.7	47%	0.468	53%	0.525	S	S	.	.	H	α-helix	trans	-73.8	-47.7	172.6	-71.7	-66.1	-56	0	0	111	K554 Q555 M556 E560 K561 E562	K554-M558 WeakPolarHBondContact O-CG 3.45Å; K554-M558 PolarHBondContact O-N 3.13Å; Q555-M558 WeakPolarHBondContact O-CA 3.19Å; Q555-M558 WeakPolarHBondContact O-CB 3.26Å; Q555-M558 PolarHBondContact O-N 3.04Å; M556-M558 VanDerWaalsContact C-N 3.33Å; M556-M558 PolarHBondContact O-N 2.95Å; M558-E560 VanDerWaalsContact C-N 3.3Å; M558-E560 PolarHBondContact O-N 2.8Å; M558-K561 WeakPolarHBondContact O-CB 3.48Å; M558-K561 PolarHBondContact O-N 3.27Å; M558-K561 VanDerWaalsContact O-N 3.13Å; M558-E562 WeakPolarHBondContact O-CG 3.26Å; M558-E562 PolarHBondContact O-N 2.95Å
559	E	88	Confident	86.5	Confident	76 Å²	76	110.4 Å²	110.4	36%	0.355	53%	0.534	S	S	.	.	H	α-helix	trans	-58.5	-41.1	178	-68.1	167	177.9	0	0	111.6	Q555 M556 E562 R563	Q555-E559 HydrophobicContact CG-CG 4.38Å; Q555-E559 VanDerWaalsContact CG-OE1 3.22Å; Q555-E559 WeakPolarHBondContact CG-OE1 3.37Å; Q555-E559 PolarHBondContact NE2-OE1 3.4Å; Q555-E559 WeakPolarHBondContact O-CG 3.45Å; Q555-E559 PolarHBondContact O-N 2.89Å; M556-E559 PolarHBondContact O-N 2.83Å; E559-E562 PolarHBondContact O-N 3.4Å; E559-R563 WeakPolarHBondContact O-CG 3.34Å; E559-R563 PolarHBondContact O-N 3.22Å
560	E	84.9	Confident	86.9	Confident	101 Å²	101	110.1 Å²	110.1	47%	0.472	54%	0.535	S	S	.	.	H	α-helix	trans	-73.9	-31.4	177.3	-158.2	63.4	-164	0	0	112.6	M556 M558 R563 S564	M556-E560 VanDerWaalsContact O-CB 3.31Å; M556-E560 WeakPolarHBondContact O-CB 3.47Å; M556-E560 PolarHBondContact O-N 2.92Å; M558-E560 VanDerWaalsContact C-N 3.3Å; M558-E560 PolarHBondContact O-N 2.8Å; E560-R563 VanDerWaalsContact OE2-CD 3.29Å; E560-R563 WeakPolarHBondContact OE2-CD 3.45Å; E560-R563 IonicContact OE2-CZ 3.15Å; E560-R563 IonicContact OE2-NE 2.78Å; E560-R563 IonicContact OE2-NH1 2.73Å; E560-R563 PolarHBondContact OE2-NH1 2.77Å; E560-S564 WeakPolarHBondContact O-CB 3.27Å; E560-S564 PolarHBondContact O-N 3.02Å
561	K	87.3	Confident	87.2	Confident	151 Å²	151	107.3 Å²	107.3	66%	0.657	53%	0.53	S	S	*	.	H	α-helix	trans	-67.4	-38.2	171.3	-176.3	-178.9	176.8	-173.7	0	111.7	L557 M558 S564 S565	L557-K561 VanDerWaalsContact O-CB 3.29Å; L557-K561 WeakPolarHBondContact O-CB 3.33Å; L557-K561 PolarHBondContact O-N 3.25Å; M558-K561 WeakPolarHBondContact O-CB 3.48Å; M558-K561 PolarHBondContact O-N 3.27Å; M558-K561 VanDerWaalsContact O-N 3.13Å; K561-S564 PolarHBondContact O-N 3.21Å; K561-S565 PolarHBondContact O-N 3.37Å
562	E	89.6	Confident	87.5	Confident	116 Å²	116	103.5 Å²	103.5	54%	0.542	53%	0.527	S	S	.	.	H	α-helix	trans	-66	-44	175.5	-74	168.9	-168.1	0	0	110.9	M558 E559 S564 S565 L566	M558-E562 WeakPolarHBondContact O-CG 3.26Å; M558-E562 PolarHBondContact O-N 2.95Å; E559-E562 PolarHBondContact O-N 3.4Å; E562-S564 PolarHBondContact O-N 2.9Å; E562-S565 WeakPolarHBondContact O-CB 3.41Å; E562-S565 PolarHBondContact O-N 3.02Å; E562-S565 VanDerWaalsContact O-N 3.13Å; E562-L566 WeakPolarHBondContact O-CG 3.42Å; E562-L566 PolarHBondContact O-N 3.11Å
563	R	86.9	Confident	87.8	Confident	134 Å²	134	103.5 Å²	103.5	51%	0.506	53%	0.527	S	S	.	.	H	α-helix	trans	-56.6	-47	169.3	-74.2	171.2	176.5	158.6	0.5	112.8	E559 E560 S565 L566 F567	E559-R563 WeakPolarHBondContact O-CG 3.34Å; E559-R563 PolarHBondContact O-N 3.22Å; E560-R563 VanDerWaalsContact OE2-CD 3.29Å; E560-R563 WeakPolarHBondContact OE2-CD 3.45Å; E560-R563 IonicContact OE2-CZ 3.15Å; E560-R563 IonicContact OE2-NE 2.78Å; E560-R563 IonicContact OE2-NH1 2.73Å; E560-R563 PolarHBondContact OE2-NH1 2.77Å; R563-S565 PolarHBondContact O-N 3.24Å; R563-L566 PolarHBondContact O-N 2.73Å; R563-L566 VanDerWaalsContact O-N 3.14Å; R563-F567 HydrophobicContact CB-CE2 4.27Å; R563-F567 WeakPolarHBondContact O-CD2 3.46Å; R563-F567 PolarHBondContact O-N 3.14Å
564	S	80.9	Confident	88.2	Confident	79 Å²	79	103.9 Å²	103.9	55%	0.552	53%	0.528	S	S	*	.	H	α-helix	trans	-62.4	-27.3	177.7	-175.3	0	0	0	0	113	E560 K561 E562 A568	E560-S564 WeakPolarHBondContact O-CB 3.27Å; E560-S564 PolarHBondContact O-N 3.02Å; K561-S564 PolarHBondContact O-N 3.21Å; E562-S564 PolarHBondContact O-N 2.9Å; S564-A568 PolarHBondContact O-N 3.37Å
565	S	88.5	Confident	88.4	Confident	66 Å²	66	102.4 Å²	102.4	46%	0.462	52%	0.522	S	S	.	.	H	α-helix	trans	-72.2	-47.6	171.7	-161.4	0	0	0	0	110.9	K561 E562 R563 F567 A568 D569	K561-S565 PolarHBondContact O-N 3.37Å; E562-S565 WeakPolarHBondContact O-CB 3.41Å; E562-S565 PolarHBondContact O-N 3.02Å; E562-S565 VanDerWaalsContact O-N 3.13Å; R563-S565 PolarHBondContact O-N 3.24Å; S565-F567 VanDerWaalsContact C-N 3.33Å; S565-F567 PolarHBondContact O-N 2.78Å; S565-A568 WeakPolarHBondContact O-CA 3.18Å; S565-A568 WeakPolarHBondContact O-CB 3.49Å; S565-A568 PolarHBondContact O-N 3.37Å; S565-D569 PolarHBondContact O-N 2.85Å
566	L	92.6	Very high	88.6	Confident	110 Å²	110	102.5 Å²	102.5	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-58.6	-43.2	178.9	-67.7	171.2	0	0	0	112	E562 R563 A568 D569 E570	E562-L566 WeakPolarHBondContact O-CG 3.42Å; E562-L566 PolarHBondContact O-N 3.11Å; R563-L566 PolarHBondContact O-N 2.73Å; R563-L566 VanDerWaalsContact O-N 3.14Å; L566-A568 VanDerWaalsContact C-N 3.31Å; L566-A568 PolarHBondContact O-N 2.9Å; L566-D569 PolarHBondContact O-N 2.93Å; L566-E570 WeakPolarHBondContact O-CB 3.4Å; L566-E570 WeakPolarHBondContact O-CG 3.3Å; L566-E570 PolarHBondContact O-N 2.78Å
567	F	85.9	Confident	89.1	Confident	135 Å²	135	103.7 Å²	103.7	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-65.1	-32.7	175	-67.1	-50.2	0	0	0	113.1	R563 S565 L571	R563-F567 HydrophobicContact CB-CE2 4.27Å; R563-F567 WeakPolarHBondContact O-CD2 3.46Å; R563-F567 PolarHBondContact O-N 3.14Å; S565-F567 VanDerWaalsContact C-N 3.33Å; S565-F567 PolarHBondContact O-N 2.78Å; F567-L571 VanDerWaalsContact O-CB 3.26Å; F567-L571 WeakPolarHBondContact O-CB 3.44Å; F567-L571 PolarHBondContact O-N 3.33Å
568	A	88.7	Confident	89.3	Confident	57 Å²	57	102.8 Å²	102.8	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-70.4	-40.1	174.3	0	0	0	0	0	111.9	S564 S565 L566 L571 A572	S564-A568 PolarHBondContact O-N 3.37Å; S565-A568 WeakPolarHBondContact O-CA 3.18Å; S565-A568 WeakPolarHBondContact O-CB 3.49Å; S565-A568 PolarHBondContact O-N 3.37Å; L566-A568 VanDerWaalsContact C-N 3.31Å; L566-A568 PolarHBondContact O-N 2.9Å; A568-L571 PolarHBondContact O-N 3.1Å; A568-A572 WeakPolarHBondContact O-CB 3.48Å; A568-A572 PolarHBondContact O-N 2.81Å
569	D	92.3	Very high	89.6	Confident	101 Å²	101	103.7 Å²	103.7	54%	0.54	53%	0.525	S	S	.	.	H	α-helix	trans	-66.8	-39.1	175.6	-67.5	-40.6	0	0	0	111.7	S565 L566 K573	S565-D569 PolarHBondContact O-N 2.85Å; L566-D569 PolarHBondContact O-N 2.93Å; D569-K573 VanDerWaalsContact O-CB 3.31Å; D569-K573 WeakPolarHBondContact O-CB 3.25Å; D569-K573 PolarHBondContact O-N 3.36Å; D569-K573 VanDerWaalsContact O-N 3.08Å
570	E	92.6	Very high	89.9	Confident	121 Å²	121	105.6 Å²	105.6	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-66.2	-40.7	173	-74.2	-169.9	150.5	0	0	112.4	L566 K573 T574	L566-E570 WeakPolarHBondContact O-CB 3.4Å; L566-E570 WeakPolarHBondContact O-CG 3.3Å; L566-E570 PolarHBondContact O-N 2.78Å; E570-K573 WeakPolarHBondContact O-CB 3.28Å; E570-K573 PolarHBondContact O-N 2.83Å; E570-T574 PolarHBondContact O-N 2.87Å; E570-T574 PolarHBondContact O-OG1 3.21Å
571	L	87.9	Confident	90	Very high	98 Å²	98	106.9 Å²	106.9	51%	0.513	54%	0.54	S	S	.	.	H	α-helix	trans	-66.6	-42.6	176.4	-172.5	151.1	0	0	0	111.8	F567 A568 K573 T574 E575	F567-L571 VanDerWaalsContact O-CB 3.26Å; F567-L571 WeakPolarHBondContact O-CB 3.44Å; F567-L571 PolarHBondContact O-N 3.33Å; A568-L571 PolarHBondContact O-N 3.1Å; L571-K573 PolarHBondContact O-N 2.85Å; L571-T574 PolarHBondContact O-N 3.33Å; L571-T574 PolarHBondContact O-OG1 3.14Å; L571-E575 HydrophobicContact CD2-CG 4.26Å; L571-E575 PolarHBondContact O-N 2.85Å
572	A	93.3	Very high	90.2	Very high	56 Å²	56	104.4 Å²	104.4	46%	0.463	53%	0.533	S	S	.	.	H	α-helix	trans	-60.6	-34	172.8	0	0	0	0	0	112.1	A568 L576	A568-A572 WeakPolarHBondContact O-CB 3.48Å; A568-A572 PolarHBondContact O-N 2.81Å; A572-L576 WeakPolarHBondContact O-CB 3.48Å; A572-L576 PolarHBondContact O-N 3.33Å; A572-L576 VanDerWaalsContact O-N 3.07Å
573	K	94.2	Very high	90.4	Very high	141 Å²	141	105.6 Å²	105.6	61%	0.613	54%	0.537	S	S	*	.	H	α-helix	trans	-73.6	-33.4	176.3	-172.4	179.1	-177.3	-179.9	0	113.1	D569 E570 L571 K577	D569-K573 VanDerWaalsContact O-CB 3.31Å; D569-K573 WeakPolarHBondContact O-CB 3.25Å; D569-K573 PolarHBondContact O-N 3.36Å; D569-K573 VanDerWaalsContact O-N 3.08Å; E570-K573 WeakPolarHBondContact O-CB 3.28Å; E570-K573 PolarHBondContact O-N 2.83Å; L571-K573 PolarHBondContact O-N 2.85Å; K573-K577 WeakPolarHBondContact O-CG 3.37Å; K573-K577 PolarHBondContact O-N 3.43Å
574	T	88.3	Confident	90.6	Very high	87 Å²	87	102.2 Å²	102.2	53%	0.534	53%	0.531	S	S	.	.	H	α-helix	trans	-74.6	-38.4	172.1	55.9	0	0	0	0	111.8	E570 L571 L576 K577 L578	E570-T574 PolarHBondContact O-N 2.87Å; E570-T574 PolarHBondContact O-OG1 3.21Å; L571-T574 PolarHBondContact O-N 3.33Å; L571-T574 PolarHBondContact O-OG1 3.14Å; T574-L576 VanDerWaalsContact C-N 3.33Å; T574-L576 PolarHBondContact O-N 2.87Å; T574-K577 PolarHBondContact O-N 3.16Å; T574-L578 WeakPolarHBondContact O-CB 3.24Å; T574-L578 PolarHBondContact O-N 2.9Å
575	E	89.8	Confident	90.9	Very high	89 Å²	89	102.5 Å²	102.5	42%	0.416	53%	0.526	S	S	.	.	H	α-helix	trans	-56.9	-44.3	170.7	-83.1	-165.7	-153.6	0	0	112.6	L571 L578 K579	L571-E575 HydrophobicContact CD2-CG 4.26Å; L571-E575 PolarHBondContact O-N 2.85Å; E575-L578 PolarHBondContact O-N 3.47Å; E575-K579 WeakPolarHBondContact O-CD 3.42Å; E575-K579 VanDerWaalsContact O-CG 3.32Å; E575-K579 WeakPolarHBondContact O-CG 3.3Å; E575-K579 PolarHBondContact O-N 3.38Å; E575-K579 IonicContact OE2-NZ 2.72Å; E575-K579 PolarHBondContact OE2-NZ 3.21Å
576	L	94.3	Very high	91.2	Very high	114 Å²	114	105.1 Å²	105.1	60%	0.597	53%	0.531	S	S	*	.	H	α-helix	trans	-65.1	-43.2	179.9	-170.4	151.5	0	0	0	111	A572 T574 L578 K579 E580	A572-L576 WeakPolarHBondContact O-CB 3.48Å; A572-L576 PolarHBondContact O-N 3.33Å; A572-L576 VanDerWaalsContact O-N 3.07Å; T574-L576 VanDerWaalsContact C-N 3.33Å; T574-L576 PolarHBondContact O-N 2.87Å; L576-L578 VanDerWaalsContact C-N 3.33Å; L576-L578 PolarHBondContact O-N 2.91Å; L576-K579 PolarHBondContact O-N 2.82Å; L576-E580 PolarHBondContact O-N 3.13Å
577	K	92.8	Very high	91.2	Very high	123 Å²	123	102.6 Å²	102.6	54%	0.535	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-40.1	172.4	-76.1	179.9	170.9	-167.9	0	112.6	K573 T574 E580 Q581	K573-K577 WeakPolarHBondContact O-CG 3.37Å; K573-K577 PolarHBondContact O-N 3.43Å; T574-K577 PolarHBondContact O-N 3.16Å; K577-E580 PolarHBondContact O-N 2.95Å; K577-Q581 WeakPolarHBondContact O-CB 3.37Å; K577-Q581 WeakPolarHBondContact O-CG 3.28Å; K577-Q581 PolarHBondContact O-N 2.97Å
578	L	91.4	Very high	91.4	Very high	108 Å²	108	101.3 Å²	101.3	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-64.5	-43.5	177	-176.8	62.6	0	0	0	111.1	T574 E575 L576 E580 Q581 L582	T574-L578 WeakPolarHBondContact O-CB 3.24Å; T574-L578 PolarHBondContact O-N 2.9Å; E575-L578 PolarHBondContact O-N 3.47Å; L576-L578 VanDerWaalsContact C-N 3.33Å; L576-L578 PolarHBondContact O-N 2.91Å; L578-E580 VanDerWaalsContact C-N 3.27Å; L578-E580 PolarHBondContact O-N 2.94Å; L578-Q581 PolarHBondContact O-N 2.93Å; L578-L582 HydrophobicContact CG-CD1 4.36Å; L578-L582 WeakPolarHBondContact O-CG 3.44Å; L578-L582 PolarHBondContact O-N 2.81Å
579	K	92.8	Very high	91.5	Very high	114 Å²	114	103.6 Å²	103.6	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-29.2	175.1	-70.5	159.3	-174.9	160.5	0	112.8	E575 L576 K583	E575-K579 WeakPolarHBondContact O-CD 3.42Å; E575-K579 VanDerWaalsContact O-CG 3.32Å; E575-K579 WeakPolarHBondContact O-CG 3.3Å; E575-K579 PolarHBondContact O-N 3.38Å; E575-K579 IonicContact OE2-NZ 2.72Å; E575-K579 PolarHBondContact OE2-NZ 3.21Å; L576-K579 PolarHBondContact O-N 2.82Å; K579-K583 WeakPolarHBondContact O-CG 3.5Å; K579-K583 PolarHBondContact O-N 3.38Å
580	E	92.7	Very high	91.6	Very high	117 Å²	117	104.9 Å²	104.9	55%	0.547	53%	0.527	S	S	.	.	H	α-helix	trans	-74.7	-45.3	172.1	-173.7	169.7	-140.9	0	0	111.8	L576 K577 L578 L582 K583 T584	L576-E580 PolarHBondContact O-N 3.13Å; K577-E580 PolarHBondContact O-N 2.95Å; L578-E580 VanDerWaalsContact C-N 3.27Å; L578-E580 PolarHBondContact O-N 2.94Å; E580-L582 PolarHBondContact O-N 3.36Å; E580-K583 PolarHBondContact O-N 3.14Å; E580-T584 PolarHBondContact O-N 3.27Å; E580-T584 PolarHBondContact O-OG1 2.93Å
581	Q	86.7	Confident	91.7	Very high	127 Å²	127	104.7 Å²	104.7	59%	0.593	53%	0.526	S	S	*	.	H	α-helix	trans	-60	-42.4	175.5	-76.4	-68	-60.9	0	0	112.6	K577 L578 K583 T584 N585	K577-Q581 WeakPolarHBondContact O-CB 3.37Å; K577-Q581 WeakPolarHBondContact O-CG 3.28Å; K577-Q581 PolarHBondContact O-N 2.97Å; L578-Q581 PolarHBondContact O-N 2.93Å; Q581-K583 PolarHBondContact O-N 3.36Å; Q581-T584 WeakPolarHBondContact CA-OG1 3.48Å; Q581-T584 PolarHBondContact O-N 3.32Å; Q581-T584 PolarHBondContact O-OG1 3.32Å; Q581-N585 WeakPolarHBondContact O-CB 3.29Å; Q581-N585 PolarHBondContact O-N 2.85Å
582	L	91.4	Very high	91.8	Very high	100 Å²	100	105.1 Å²	105.1	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-58.3	-46.2	175.2	-74	168.4	0	0	0	111.6	L578 E580 T584 N585 E586	L578-L582 HydrophobicContact CG-CD1 4.36Å; L578-L582 WeakPolarHBondContact O-CG 3.44Å; L578-L582 PolarHBondContact O-N 2.81Å; E580-L582 PolarHBondContact O-N 3.36Å; L582-T584 VanDerWaalsContact C-N 3.34Å; L582-T584 PolarHBondContact O-N 3.38Å; L582-N585 WeakPolarHBondContact O-CA 3.29Å; L582-N585 WeakPolarHBondContact O-CB 3.33Å; L582-N585 PolarHBondContact O-N 3.3Å; L582-E586 WeakPolarHBondContact O-CG 3.44Å; L582-E586 PolarHBondContact O-N 2.84Å
583	K	95.1	Very high	91.7	Very high	140 Å²	140	104.6 Å²	104.6	61%	0.609	52%	0.524	S	S	*	.	H	α-helix	trans	-62.1	-38.2	175.6	-71.6	175.5	-179.8	-176.1	0	113.2	K579 E580 Q581 N585 S587	K579-K583 WeakPolarHBondContact O-CG 3.5Å; K579-K583 PolarHBondContact O-N 3.38Å; E580-K583 PolarHBondContact O-N 3.14Å; Q581-K583 PolarHBondContact O-N 3.36Å; K583-N585 VanDerWaalsContact C-N 3.31Å; K583-S587 WeakPolarHBondContact O-CB 3.33Å; K583-S587 PolarHBondContact O-N 2.86Å
584	T	91.4	Very high	91.7	Very high	63 Å²	63	100 Å²	100	39%	0.387	51%	0.513	S	S	.	.	H	α-helix	trans	-67.2	-34.6	173.5	53.5	0	0	0	0	111.8	E580 Q581 L582 S587 L588	E580-T584 PolarHBondContact O-N 3.27Å; E580-T584 PolarHBondContact O-OG1 2.93Å; Q581-T584 WeakPolarHBondContact CA-OG1 3.48Å; Q581-T584 PolarHBondContact O-N 3.32Å; Q581-T584 PolarHBondContact O-OG1 3.32Å; L582-T584 VanDerWaalsContact C-N 3.34Å; L582-T584 PolarHBondContact O-N 3.38Å; T584-S587 PolarHBondContact O-N 3.49Å; T584-L588 WeakPolarHBondContact O-CB 3.24Å; T584-L588 VanDerWaalsContact O-CG 3.25Å; T584-L588 WeakPolarHBondContact O-CG 3.34Å; T584-L588 PolarHBondContact O-N 3.47Å
585	N	86.8	Confident	91.9	Very high	85 Å²	85	97.7 Å²	97.7	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-67.5	-46.7	175.4	-164.1	-61	0	0	0	111.5	Q581 L582 K583 S587 L588 K589	Q581-N585 WeakPolarHBondContact O-CB 3.29Å; Q581-N585 PolarHBondContact O-N 2.85Å; L582-N585 WeakPolarHBondContact O-CA 3.29Å; L582-N585 WeakPolarHBondContact O-CB 3.33Å; L582-N585 PolarHBondContact O-N 3.3Å; K583-N585 VanDerWaalsContact C-N 3.31Å; N585-S587 VanDerWaalsContact C-N 3.32Å; N585-S587 PolarHBondContact O-N 2.85Å; N585-L588 PolarHBondContact O-N 2.92Å; N585-L588 VanDerWaalsContact O-N 3.15Å; N585-K589 WeakPolarHBondContact O-CG 3.4Å; N585-K589 PolarHBondContact O-N 3.35Å; N585-K589 VanDerWaalsContact OD1-CE 3.29Å; N585-K589 WeakPolarHBondContact OD1-CE 3.24Å
586	E	94	Very high	91.9	Very high	121 Å²	121	97.7 Å²	97.7	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-54.6	-46.4	171.5	-69.3	177	132.6	0	0	111.7	L582 L588 K589 L590	L582-E586 WeakPolarHBondContact O-CG 3.44Å; L582-E586 PolarHBondContact O-N 2.84Å; E586-L588 VanDerWaalsContact C-N 3.33Å; E586-L588 PolarHBondContact O-N 3.47Å; E586-K589 PolarHBondContact O-N 3.28Å; E586-L590 WeakPolarHBondContact O-CG 3.49Å; E586-L590 PolarHBondContact O-N 2.81Å
587	S	92.3	Very high	91.8	Very high	57 Å²	57	96.5 Å²	96.5	40%	0.399	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-34.6	178.4	-169.9	0	0	0	0	113	K583 T584 N585 Q591	K583-S587 WeakPolarHBondContact O-CB 3.33Å; K583-S587 PolarHBondContact O-N 2.86Å; T584-S587 PolarHBondContact O-N 3.49Å; N585-S587 VanDerWaalsContact C-N 3.32Å; N585-S587 PolarHBondContact O-N 2.85Å; S587-Q591 VanDerWaalsContact O-CG 3.3Å; S587-Q591 WeakPolarHBondContact O-CG 3.45Å; S587-Q591 PolarHBondContact O-N 3.33Å; S587-Q591 VanDerWaalsContact O-N 3.13Å
588	L	91.4	Very high	91.9	Very high	109 Å²	109	98 Å²	98	57%	0.571	50%	0.499	S	S	*	.	H	α-helix	trans	-73.9	-40.2	175.7	-72.9	168.7	0	0	0	111.7	T584 N585 E586 L590 Q591 L592	T584-L588 WeakPolarHBondContact O-CB 3.24Å; T584-L588 VanDerWaalsContact O-CG 3.25Å; T584-L588 WeakPolarHBondContact O-CG 3.34Å; T584-L588 PolarHBondContact O-N 3.47Å; N585-L588 PolarHBondContact O-N 2.92Å; N585-L588 VanDerWaalsContact O-N 3.15Å; E586-L588 VanDerWaalsContact C-N 3.33Å; E586-L588 PolarHBondContact O-N 3.47Å; L588-L590 VanDerWaalsContact C-N 3.3Å; L588-L590 PolarHBondContact O-N 2.85Å; L588-Q591 PolarHBondContact O-N 3.42Å; L588-L592 WeakPolarHBondContact O-CB 3.39Å; L588-L592 PolarHBondContact O-N 2.97Å
589	K	91	Very high	92	Very high	105 Å²	105	100.3 Å²	100.3	46%	0.457	50%	0.501	S	S	.	.	H	α-helix	trans	-55.3	-45.4	171.5	-75.5	-179.9	175.8	-176	0	111	N585 E586 L592 A593	N585-K589 WeakPolarHBondContact O-CG 3.4Å; N585-K589 PolarHBondContact O-N 3.35Å; N585-K589 VanDerWaalsContact OD1-CE 3.29Å; N585-K589 WeakPolarHBondContact OD1-CE 3.24Å; E586-K589 PolarHBondContact O-N 3.28Å; K589-L592 PolarHBondContact O-N 3.38Å; K589-A593 PolarHBondContact O-N 2.96Å
590	L	94.2	Very high	92.1	Very high	128 Å²	128	100 Å²	100	67%	0.67	50%	0.5	S	S	*	.	H	α-helix	trans	-65.2	-39.3	176.6	-72.5	168.4	0	0	0	113.1	E586 L588 A594	E586-L590 WeakPolarHBondContact O-CG 3.49Å; E586-L590 PolarHBondContact O-N 2.81Å; L588-L590 VanDerWaalsContact C-N 3.3Å; L588-L590 PolarHBondContact O-N 2.85Å; L590-A594 WeakPolarHBondContact O-CB 3.47Å; L590-A594 PolarHBondContact O-N 2.91Å; L590-A594 VanDerWaalsContact O-N 3.14Å
591	Q	93.7	Very high	92.1	Very high	116 Å²	116	98.1 Å²	98.1	54%	0.542	50%	0.499	S	S	.	.	H	α-helix	trans	-68.1	-36.5	175.5	-74.2	174.4	14	0	0	112.5	S587 L588 A595	S587-Q591 VanDerWaalsContact O-CG 3.3Å; S587-Q591 WeakPolarHBondContact O-CG 3.45Å; S587-Q591 PolarHBondContact O-N 3.33Å; S587-Q591 VanDerWaalsContact O-N 3.13Å; L588-Q591 PolarHBondContact O-N 3.42Å; Q591-A595 WeakPolarHBondContact O-CB 3.38Å; Q591-A595 PolarHBondContact O-N 2.86Å
592	L	91.1	Very high	92.4	Very high	107 Å²	107	97.8 Å²	97.8	56%	0.56	50%	0.498	S	S	*	.	H	α-helix	trans	-64.2	-53.4	176.4	-169.3	77.8	0	0	0	111	L588 K589 A594 A595 E596	L588-L592 WeakPolarHBondContact O-CB 3.39Å; L588-L592 PolarHBondContact O-N 2.97Å; K589-L592 PolarHBondContact O-N 3.38Å; L592-A594 VanDerWaalsContact C-N 3.31Å; L592-A594 PolarHBondContact O-N 3.12Å; L592-A595 CarbonylContact O-C 3.57Å; L592-A595 WeakPolarHBondContact O-CA 3.47Å; L592-A595 WeakPolarHBondContact O-CB 3.47Å; L592-A595 PolarHBondContact O-N 3.38Å; L592-E596 PolarHBondContact O-N 3.05Å
593	A	91	Very high	92.4	Very high	45 Å²	45	96.6 Å²	96.6	37%	0.372	50%	0.495	S	S	.	.	H	α-helix	trans	-56.4	-44.9	177.4	0	0	0	0	0	111.8	K589 A595 E596 D597	K589-A593 PolarHBondContact O-N 2.96Å; A593-A595 PolarHBondContact O-N 2.67Å; A593-E596 PolarHBondContact O-N 2.96Å; A593-D597 PolarHBondContact O-N 3.46Å
594	A	93.9	Very high	92.3	Very high	45 Å²	45	92.5 Å²	92.5	37%	0.372	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-25.7	175.7	0	0	0	0	0	113.5	L590 L592 R598	L590-A594 WeakPolarHBondContact O-CB 3.47Å; L590-A594 PolarHBondContact O-N 2.91Å; L590-A594 VanDerWaalsContact O-N 3.14Å; L592-A594 VanDerWaalsContact C-N 3.31Å; L592-A594 PolarHBondContact O-N 3.12Å; A594-R598 VanDerWaalsContact C-NH1 3.31Å; A594-R598 WeakPolarHBondContact O-CG 3.42Å; A594-R598 VanDerWaalsContact O-CZ 3.31Å; A594-R598 PolarHBondContact O-N 2.9Å; A594-R598 PolarHBondContact O-NH1 3.5Å
595	A	91.4	Very high	92.5	Very high	38 Å²	38	93.8 Å²	93.8	31%	0.314	49%	0.488	S	S	.	.	H	α-helix	trans	-79.2	-41.4	173.8	0	0	0	0	0	112.1	Q591 L592 A593 D597 R598 Y599	Q591-A595 WeakPolarHBondContact O-CB 3.38Å; Q591-A595 PolarHBondContact O-N 2.86Å; L592-A595 CarbonylContact O-C 3.57Å; L592-A595 WeakPolarHBondContact O-CA 3.47Å; L592-A595 WeakPolarHBondContact O-CB 3.47Å; L592-A595 PolarHBondContact O-N 3.38Å; A593-A595 PolarHBondContact O-N 2.67Å; A595-D597 VanDerWaalsContact C-N 3.34Å; A595-D597 PolarHBondContact O-N 3.27Å; A595-R598 PolarHBondContact O-N 2.85Å; A595-Y599 PolarHBondContact O-N 2.86Å
596	E	90.1	Very high	92.8	Very high	90 Å²	90	94.9 Å²	94.9	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-58.7	-44.5	173.4	-71.5	179.2	-159.9	0	0	111.8	L592 A593 R598 Y599 K600	L592-E596 PolarHBondContact O-N 3.05Å; A593-E596 PolarHBondContact O-N 2.96Å; E596-R598 VanDerWaalsContact C-N 3.34Å; E596-R598 PolarHBondContact O-N 2.84Å; E596-Y599 CarbonylContact O-C 3.55Å; E596-Y599 PolarHBondContact O-N 3.21Å; E596-Y599 VanDerWaalsContact O-N 3.1Å; E596-K600 WeakPolarHBondContact O-CB 3.29Å; E596-K600 VanDerWaalsContact O-CG 3.27Å; E596-K600 WeakPolarHBondContact O-CG 3.43Å; E596-K600 PolarHBondContact O-N 3.04Å; E596-K600 IonicContact OE2-NZ 3.1Å; E596-K600 PolarHBondContact OE2-NZ 3.25Å
597	D	93.7	Very high	92.9	Very high	89 Å²	89	90.9 Å²	90.9	48%	0.476	48%	0.48	S	S	.	.	H	α-helix	trans	-68.7	-32.5	-179.5	-69	-13.9	0	0	0	112.6	A593 A595 K600 S601	A593-D597 PolarHBondContact O-N 3.46Å; A595-D597 VanDerWaalsContact C-N 3.34Å; A595-D597 PolarHBondContact O-N 3.27Å; D597-K600 IonicContact OD1-NZ 2.65Å; D597-K600 PolarHBondContact OD1-NZ 2.98Å; D597-S601 WeakPolarHBondContact O-CB 3.38Å; D597-S601 PolarHBondContact O-N 2.97Å; D597-S601 PolarHBondContact O-OG 3.43Å
598	R	94.3	Very high	93	Very high	154 Å²	154	94.1 Å²	94.1	58%	0.581	48%	0.484	S	S	*	.	H	α-helix	trans	-63.9	-43	167.8	-72.7	-172.8	-53.3	-92.1	8.9	111.4	A594 A595 E596 S601 Q602	A594-R598 VanDerWaalsContact C-NH1 3.31Å; A594-R598 WeakPolarHBondContact O-CG 3.42Å; A594-R598 VanDerWaalsContact O-CZ 3.31Å; A594-R598 PolarHBondContact O-N 2.9Å; A594-R598 PolarHBondContact O-NH1 3.5Å; A595-R598 PolarHBondContact O-N 2.85Å; E596-R598 VanDerWaalsContact C-N 3.34Å; E596-R598 PolarHBondContact O-N 2.84Å; R598-S601 WeakPolarHBondContact O-CB 3.47Å; R598-S601 PolarHBondContact O-N 2.97Å; R598-Q602 WeakPolarHBondContact O-CG 3.33Å; R598-Q602 PolarHBondContact O-N 3.5Å
599	Y	93.4	Very high	93.3	Very high	156 Å²	156	93 Å²	93	61%	0.612	48%	0.475	S	S	*	.	H	α-helix	trans	-67.1	-45.9	179.1	-174.7	-104.8	0	0	0	112.1	A595 E596 S601 Q602 V603	A595-Y599 PolarHBondContact O-N 2.86Å; E596-Y599 CarbonylContact O-C 3.55Å; E596-Y599 PolarHBondContact O-N 3.21Å; E596-Y599 VanDerWaalsContact O-N 3.1Å; Y599-S601 VanDerWaalsContact C-N 3.26Å; Y599-S601 PolarHBondContact O-N 3.29Å; Y599-Q602 PolarHBondContact O-N 2.9Å; Y599-Q602 VanDerWaalsContact O-N 3.17Å; Y599-V603 HydrophobicContact CD1-CG2 4.06Å; Y599-V603 HydrophobicContact CE1-CG2 3.66Å; Y599-V603 HydrophobicContact CE2-CG2 4.17Å; Y599-V603 HydrophobicContact CG-CG2 4.48Å; Y599-V603 WeakPolarHBondContact O-CG2 3.47Å; Y599-V603 PolarHBondContact O-N 3.28Å
600	K	93.4	Very high	93.3	Very high	109 Å²	109	92.5 Å²	92.5	47%	0.474	48%	0.477	S	S	.	.	H	α-helix	trans	-54.6	-42.5	172	-68.5	165.4	-161.8	155.5	0	111.1	E596 D597 V603 A604	E596-K600 WeakPolarHBondContact O-CB 3.29Å; E596-K600 VanDerWaalsContact O-CG 3.27Å; E596-K600 WeakPolarHBondContact O-CG 3.43Å; E596-K600 PolarHBondContact O-N 3.04Å; E596-K600 IonicContact OE2-NZ 3.1Å; E596-K600 PolarHBondContact OE2-NZ 3.25Å; D597-K600 IonicContact OD1-NZ 2.65Å; D597-K600 PolarHBondContact OD1-NZ 2.98Å; K600-V603 PolarHBondContact O-N 2.88Å; K600-A604 WeakPolarHBondContact O-CB 3.35Å; K600-A604 PolarHBondContact O-N 3.13Å
601	S	94	Very high	93.4	Very high	76 Å²	76	92 Å²	92	53%	0.531	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-45.5	176.8	-59.3	0	0	0	0	112.6	D597 R598 Y599 A604 E605	D597-S601 WeakPolarHBondContact O-CB 3.38Å; D597-S601 PolarHBondContact O-N 2.97Å; D597-S601 PolarHBondContact O-OG 3.43Å; R598-S601 WeakPolarHBondContact O-CB 3.47Å; R598-S601 PolarHBondContact O-N 2.97Å; Y599-S601 VanDerWaalsContact C-N 3.26Å; Y599-S601 PolarHBondContact O-N 3.29Å; S601-A604 PolarHBondContact O-N 3.47Å; S601-E605 WeakPolarHBondContact O-CB 3.42Å; S601-E605 PolarHBondContact O-N 2.87Å
602	Q	92.4	Very high	93.5	Very high	120 Å²	120	92.2 Å²	92.2	56%	0.561	47%	0.471	S	S	*	.	H	α-helix	trans	-65.1	-40.7	175.9	-74	179.8	-10.7	0	0	112.4	R598 Y599 E605 K606	R598-Q602 WeakPolarHBondContact O-CG 3.33Å; R598-Q602 PolarHBondContact O-N 3.5Å; Y599-Q602 PolarHBondContact O-N 2.9Å; Y599-Q602 VanDerWaalsContact O-N 3.17Å; Q602-E605 WeakPolarHBondContact O-CB 3.27Å; Q602-E605 PolarHBondContact O-N 3.28Å; Q602-K606 WeakPolarHBondContact O-CG 3.49Å; Q602-K606 PolarHBondContact O-N 2.98Å
603	V	92.4	Very high	93.6	Very high	76 Å²	76	92.8 Å²	92.8	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175.5	171.1	0	0	0	0	110.8	Y599 K600 E605 G607	Y599-V603 HydrophobicContact CD1-CG2 4.06Å; Y599-V603 HydrophobicContact CE1-CG2 3.66Å; Y599-V603 HydrophobicContact CE2-CG2 4.17Å; Y599-V603 HydrophobicContact CG-CG2 4.48Å; Y599-V603 WeakPolarHBondContact O-CG2 3.47Å; Y599-V603 PolarHBondContact O-N 3.28Å; K600-V603 PolarHBondContact O-N 2.88Å; V603-E605 VanDerWaalsContact C-N 3.29Å; V603-E605 PolarHBondContact O-N 3.03Å; V603-G607 PolarHBondContact O-N 3.42Å
604	A	93.3	Very high	93.8	Very high	53 Å²	53	97.6 Å²	97.6	44%	0.438	48%	0.482	S	S	.	.	H	α-helix	trans	-64.7	-32.6	174.1	0	0	0	0	0	112.5	K600 S601 R608	K600-A604 WeakPolarHBondContact O-CB 3.35Å; K600-A604 PolarHBondContact O-N 3.13Å; S601-A604 PolarHBondContact O-N 3.47Å; A604-R608 WeakPolarHBondContact O-CG 3.37Å; A604-R608 PolarHBondContact O-N 3.48Å; A604-R608 PolarHBondContact O-NH1 3.33Å
605	E	95.3	Very high	93.9	Very high	90 Å²	90	99.3 Å²	99.3	42%	0.421	49%	0.485	S	S	.	.	H	α-helix	trans	-70.6	-51	174.8	-177.6	153.2	-105	0	0	112.8	S601 Q602 V603 G607 R608 E609	S601-E605 WeakPolarHBondContact O-CB 3.42Å; S601-E605 PolarHBondContact O-N 2.87Å; Q602-E605 WeakPolarHBondContact O-CB 3.27Å; Q602-E605 PolarHBondContact O-N 3.28Å; V603-E605 VanDerWaalsContact C-N 3.29Å; V603-E605 PolarHBondContact O-N 3.03Å; E605-G607 PolarHBondContact O-N 2.83Å; E605-R608 WeakPolarHBondContact O-CA 3.5Å; E605-R608 WeakPolarHBondContact O-CB 3.41Å; E605-R608 PolarHBondContact O-N 2.84Å; E605-R608 IonicContact OE1-NH2 3.16Å; E605-R608 PolarHBondContact OE1-NH2 2.76Å; E605-R608 VanDerWaalsContact OE1-NH2 3.16Å; E605-E609 PolarHBondContact O-N 3.05Å
606	K	92.9	Very high	94.1	Very high	108 Å²	108	101.3 Å²	101.3	47%	0.47	49%	0.493	S	S	.	.	H	α-helix	trans	-63	-27.6	173	-61.3	-45.2	-174.3	-172.3	0	112.3	Q602 E609 L610	Q602-K606 WeakPolarHBondContact O-CG 3.49Å; Q602-K606 PolarHBondContact O-N 2.98Å; K606-E609 VanDerWaalsContact CD-CD 3.45Å; K606-E609 WeakPolarHBondContact CD-OE1 3.47Å; K606-E609 WeakPolarHBondContact CD-OE2 3.37Å; K606-E609 WeakPolarHBondContact CE-OE2 3.42Å; K606-E609 IonicContact NZ-OE1 4Å; K606-E609 PolarHBondContact NZ-OE1 3Å; K606-E609 IonicContact NZ-OE2 2.85Å; K606-E609 PolarHBondContact NZ-OE2 3.25Å; K606-L610 VanDerWaalsContact O-CB 3.24Å; K606-L610 WeakPolarHBondContact O-CB 3.4Å; K606-L610 WeakPolarHBondContact O-CG 3.43Å; K606-L610 PolarHBondContact O-N 3.31Å
607	G	94.6	Very high	94.1	Very high	37 Å²	37	103.8 Å²	103.8	38%	0.381	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-35.5	168.9	0	0	0	0	0	114.1	V603 E605 K611	V603-G607 PolarHBondContact O-N 3.42Å; E605-G607 PolarHBondContact O-N 2.83Å; G607-K611 PolarHBondContact O-N 2.87Å
608	R	95.9	Very high	94.1	Very high	125 Å²	125	101.6 Å²	101.6	47%	0.472	50%	0.497	S	S	.	.	H	α-helix	trans	-72.4	-51.5	172.8	-66.8	-175.8	-57.4	-88.7	8.7	111.2	A604 E605 L610 K611 E612	A604-R608 WeakPolarHBondContact O-CG 3.37Å; A604-R608 PolarHBondContact O-N 3.48Å; A604-R608 PolarHBondContact O-NH1 3.33Å; E605-R608 WeakPolarHBondContact O-CA 3.5Å; E605-R608 WeakPolarHBondContact O-CB 3.41Å; E605-R608 PolarHBondContact O-N 2.84Å; E605-R608 IonicContact OE1-NH2 3.16Å; E605-R608 PolarHBondContact OE1-NH2 2.76Å; E605-R608 VanDerWaalsContact OE1-NH2 3.16Å; R608-L610 VanDerWaalsContact C-N 3.31Å; R608-L610 PolarHBondContact O-N 3.06Å; R608-K611 WeakPolarHBondContact O-CA 3.33Å; R608-K611 WeakPolarHBondContact O-CB 3.39Å; R608-K611 PolarHBondContact O-N 3.39Å; R608-E612 PolarHBondContact O-N 2.88Å
609	E	96.1	Very high	94.2	Very high	85 Å²	85	99.1 Å²	99.1	40%	0.397	50%	0.495	S	S	.	.	H	α-helix	trans	-54	-46.4	177.4	-69.3	174.2	-152	0	0	112	E605 K606 K611 E612 L613	E605-E609 PolarHBondContact O-N 3.05Å; K606-E609 VanDerWaalsContact CD-CD 3.45Å; K606-E609 WeakPolarHBondContact CD-OE1 3.47Å; K606-E609 WeakPolarHBondContact CD-OE2 3.37Å; K606-E609 WeakPolarHBondContact CE-OE2 3.42Å; K606-E609 IonicContact NZ-OE1 4Å; K606-E609 PolarHBondContact NZ-OE1 3Å; K606-E609 IonicContact NZ-OE2 2.85Å; K606-E609 PolarHBondContact NZ-OE2 3.25Å; E609-K611 VanDerWaalsContact C-N 3.27Å; E609-K611 PolarHBondContact O-N 2.96Å; E609-E612 PolarHBondContact O-N 3.34Å; E609-L613 WeakPolarHBondContact O-CB 3.44Å; E609-L613 PolarHBondContact O-N 3.11Å
610	L	92.6	Very high	94.2	Very high	95 Å²	95	95.6 Å²	95.6	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-24.8	176.8	-73.6	171.8	0	0	0	113.2	K606 R608 R614	K606-L610 VanDerWaalsContact O-CB 3.24Å; K606-L610 WeakPolarHBondContact O-CB 3.4Å; K606-L610 WeakPolarHBondContact O-CG 3.43Å; K606-L610 PolarHBondContact O-N 3.31Å; R608-L610 VanDerWaalsContact C-N 3.31Å; R608-L610 PolarHBondContact O-N 3.06Å; L610-R614 WeakPolarHBondContact O-CB 3.46Å; L610-R614 VanDerWaalsContact O-CG 3.26Å; L610-R614 WeakPolarHBondContact O-CG 3.3Å; L610-R614 PolarHBondContact O-N 3.41Å; L610-R614 PolarHBondContact O-NE 3.24Å; L610-R614 PolarHBondContact O-NH1 2.89Å
611	K	94.9	Very high	94.2	Very high	119 Å²	119	92.7 Å²	92.7	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-74.8	-51.2	172.4	-172.6	-168.6	170	-169.8	0	110.4	G607 R608 E609 L613 R614 D615	G607-K611 PolarHBondContact O-N 2.87Å; R608-K611 WeakPolarHBondContact O-CA 3.33Å; R608-K611 WeakPolarHBondContact O-CB 3.39Å; R608-K611 PolarHBondContact O-N 3.39Å; E609-K611 VanDerWaalsContact C-N 3.27Å; E609-K611 PolarHBondContact O-N 2.96Å; K611-L613 VanDerWaalsContact C-N 3.3Å; K611-L613 PolarHBondContact O-N 3.44Å; K611-R614 WeakPolarHBondContact O-CB 3.33Å; K611-R614 PolarHBondContact O-N 3.33Å; K611-R614 VanDerWaalsContact O-N 3.08Å; K611-D615 WeakPolarHBondContact CE-OD2 3.48Å; K611-D615 PolarHBondContact O-N 3.39Å
612	E	96.3	Very high	94.2	Very high	120 Å²	120	96.1 Å²	96.1	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-56.6	-45.6	178.8	-70.8	164.7	-156.4	0	0	110.8	R608 E609 R614 D615 T616	R608-E612 PolarHBondContact O-N 2.88Å; E609-E612 PolarHBondContact O-N 3.34Å; E612-R614 PolarHBondContact O-N 2.93Å; E612-D615 PolarHBondContact O-N 2.9Å; E612-T616 WeakPolarHBondContact O-CB 3.48Å; E612-T616 PolarHBondContact O-N 3.45Å; E612-T616 PolarHBondContact O-OG1 3.48Å; E612-T616 VanDerWaalsContact O-OG1 3.07Å
613	L	94.6	Very high	94.2	Very high	118 Å²	118	96.1 Å²	96.1	62%	0.618	48%	0.482	S	S	*	.	H	α-helix	trans	-63.6	-36	176.5	-172.1	63.2	0	0	0	113.3	E609 K611 F617	E609-L613 WeakPolarHBondContact O-CB 3.44Å; E609-L613 PolarHBondContact O-N 3.11Å; K611-L613 VanDerWaalsContact C-N 3.3Å; K611-L613 PolarHBondContact O-N 3.44Å; L613-F617 WeakPolarHBondContact O-CB 3.5Å; L613-F617 PolarHBondContact O-N 3.13Å
614	R	94.1	Very high	94.1	Very high	147 Å²	147	97.7 Å²	97.7	56%	0.555	48%	0.483	S	S	*	.	H	α-helix	trans	-68	-42	172.5	-79.2	-174.8	-55.5	-99	-0.3	111.9	L610 K611 E612 F617 A618	L610-R614 WeakPolarHBondContact O-CB 3.46Å; L610-R614 VanDerWaalsContact O-CG 3.26Å; L610-R614 WeakPolarHBondContact O-CG 3.3Å; L610-R614 PolarHBondContact O-N 3.41Å; L610-R614 PolarHBondContact O-NE 3.24Å; L610-R614 PolarHBondContact O-NH1 2.89Å; K611-R614 WeakPolarHBondContact O-CB 3.33Å; K611-R614 PolarHBondContact O-N 3.33Å; K611-R614 VanDerWaalsContact O-N 3.08Å; E612-R614 PolarHBondContact O-N 2.93Å; R614-F617 PolarHBondContact O-N 3.23Å; R614-A618 WeakPolarHBondContact O-CB 3.45Å; R614-A618 PolarHBondContact O-N 2.99Å
615	D	95.9	Very high	94	Very high	81 Å²	81	100.7 Å²	100.7	43%	0.433	49%	0.488	S	S	.	.	H	α-helix	trans	-67.1	-38.8	179.9	-67.7	-17.8	0	0	0	110.5	K611 E612 A618 L619	K611-D615 WeakPolarHBondContact CE-OD2 3.48Å; K611-D615 PolarHBondContact O-N 3.39Å; E612-D615 PolarHBondContact O-N 2.9Å; D615-A618 PolarHBondContact O-N 3.23Å; D615-L619 WeakPolarHBondContact O-CG 3.38Å; D615-L619 PolarHBondContact O-N 3.32Å
616	T	95.6	Very high	93.8	Very high	79 Å²	79	102.3 Å²	102.3	49%	0.485	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-46.2	169.5	-58.9	0	0	0	0	112.1	E612 A618 L619 V620	E612-T616 WeakPolarHBondContact O-CB 3.48Å; E612-T616 PolarHBondContact O-N 3.45Å; E612-T616 PolarHBondContact O-OG1 3.48Å; E612-T616 VanDerWaalsContact O-OG1 3.07Å; T616-A618 VanDerWaalsContact C-N 3.31Å; T616-A618 PolarHBondContact O-N 2.83Å; T616-L619 WeakPolarHBondContact O-CB 3.36Å; T616-L619 PolarHBondContact O-N 3.36Å; T616-L619 VanDerWaalsContact O-N 3.08Å; T616-V620 PolarHBondContact O-N 2.91Å
617	F	90.8	Very high	93.6	Very high	143 Å²	143	101.8 Å²	101.8	63%	0.627	50%	0.495	S	S	*	.	H	α-helix	trans	-60.7	-40.9	176.3	-176.7	-100.6	0	0	0	111.7	L613 R614 L619 V620 V621	L613-F617 WeakPolarHBondContact O-CB 3.5Å; L613-F617 PolarHBondContact O-N 3.13Å; R614-F617 PolarHBondContact O-N 3.23Å; F617-L619 VanDerWaalsContact C-N 3.27Å; F617-L619 PolarHBondContact O-N 2.8Å; F617-V620 PolarHBondContact O-N 3.49Å; F617-V621 HydrophobicContact CD1-CG2 4.02Å; F617-V621 HydrophobicContact CE1-CG2 3.64Å; F617-V621 HydrophobicContact CE2-CG2 4.37Å; F617-V621 HydrophobicContact CZ-CG2 3.83Å; F617-V621 WeakPolarHBondContact O-CG2 3.46Å; F617-V621 PolarHBondContact O-N 3.02Å
618	A	94	Very high	93.1	Very high	42 Å²	42	104.6 Å²	104.6	35%	0.347	50%	0.498	S	S	.	.	H	α-helix	trans	-68.4	-20.5	175.4	0	0	0	0	0	113.7	R614 D615 T616 R622	R614-A618 WeakPolarHBondContact O-CB 3.45Å; R614-A618 PolarHBondContact O-N 2.99Å; D615-A618 PolarHBondContact O-N 3.23Å; T616-A618 VanDerWaalsContact C-N 3.31Å; T616-A618 PolarHBondContact O-N 2.83Å; A618-R622 WeakPolarHBondContact O-CG 3.33Å; A618-R622 PolarHBondContact O-NE 2.74Å; A618-R622 PolarHBondContact O-NH2 3.26Å
619	L	95.6	Very high	92.5	Very high	102 Å²	102	99.6 Å²	99.6	53%	0.534	49%	0.486	S	S	.	.	H	α-helix	trans	-74.5	-49.9	166.7	-75.8	161.1	0	0	0	110.8	D615 T616 F617 V621 R622 E623	D615-L619 WeakPolarHBondContact O-CG 3.38Å; D615-L619 PolarHBondContact O-N 3.32Å; T616-L619 WeakPolarHBondContact O-CB 3.36Å; T616-L619 PolarHBondContact O-N 3.36Å; T616-L619 VanDerWaalsContact O-N 3.08Å; F617-L619 VanDerWaalsContact C-N 3.27Å; F617-L619 PolarHBondContact O-N 2.8Å; L619-V621 VanDerWaalsContact C-N 3.32Å; L619-V621 PolarHBondContact O-N 3.4Å; L619-R622 VanDerWaalsContact CD2-NH2 3.34Å; L619-R622 PolarHBondContact O-N 2.93Å; L619-R622 VanDerWaalsContact O-N 3.15Å; L619-E623 PolarHBondContact O-N 3.33Å
620	V	93.7	Very high	92	Very high	83 Å²	83	100 Å²	100	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-60.2	-39.1	179.7	174.5	0	0	0	0	112.2	T616 F617 E623 K624	T616-V620 PolarHBondContact O-N 2.91Å; F617-V620 PolarHBondContact O-N 3.49Å; V620-E623 PolarHBondContact O-N 2.77Å; V620-K624 WeakPolarHBondContact O-CB 3.31Å; V620-K624 PolarHBondContact O-N 2.97Å
621	V	92.8	Very high	91.3	Very high	48 Å²	48	101.3 Å²	101.3	29%	0.291	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-44.9	175.1	170.6	0	0	0	0	111.5	F617 L619 E623 K624 E625	F617-V621 HydrophobicContact CD1-CG2 4.02Å; F617-V621 HydrophobicContact CE1-CG2 3.64Å; F617-V621 HydrophobicContact CE2-CG2 4.37Å; F617-V621 HydrophobicContact CZ-CG2 3.83Å; F617-V621 WeakPolarHBondContact O-CG2 3.46Å; F617-V621 PolarHBondContact O-N 3.02Å; L619-V621 VanDerWaalsContact C-N 3.32Å; L619-V621 PolarHBondContact O-N 3.4Å; V621-E623 VanDerWaalsContact C-N 3.33Å; V621-E623 PolarHBondContact O-N 3.19Å; V621-K624 WeakPolarHBondContact O-CB 3.42Å; V621-K624 PolarHBondContact O-N 3.47Å; V621-E625 HydrophobicContact CG1-CG 4.5Å; V621-E625 WeakPolarHBondContact O-CG 3.43Å; V621-E625 PolarHBondContact O-N 2.89Å
622	R	94.3	Very high	90.3	Very high	147 Å²	147	102.4 Å²	102.4	56%	0.555	50%	0.502	S	S	*	.	H	α-helix	trans	-66.7	-33.7	177.3	-76.5	178.7	-71.4	162.7	-4.2	112.8	A618 L619 K626	A618-R622 WeakPolarHBondContact O-CG 3.33Å; A618-R622 PolarHBondContact O-NE 2.74Å; A618-R622 PolarHBondContact O-NH2 3.26Å; L619-R622 VanDerWaalsContact CD2-NH2 3.34Å; L619-R622 PolarHBondContact O-N 2.93Å; L619-R622 VanDerWaalsContact O-N 3.15Å; R622-K626 WeakPolarHBondContact O-CB 3.48Å; R622-K626 PolarHBondContact O-N 2.9Å
623	E	93	Very high	89.3	Confident	120 Å²	120	103.9 Å²	103.9	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-68.6	-42.4	173.3	-176	162.3	-140.5	0	0	111.6	L619 V620 V621 K626 L627	L619-E623 PolarHBondContact O-N 3.33Å; V620-E623 PolarHBondContact O-N 2.77Å; V621-E623 VanDerWaalsContact C-N 3.33Å; V621-E623 PolarHBondContact O-N 3.19Å; E623-K626 WeakPolarHBondContact O-CB 3.44Å; E623-K626 PolarHBondContact O-N 3.45Å; E623-L627 HydrophobicContact CG-CD1 4.12Å; E623-L627 WeakPolarHBondContact O-CG 3.47Å; E623-L627 PolarHBondContact O-N 3.09Å
624	K	90.6	Very high	87.9	Confident	110 Å²	110	101.7 Å²	101.7	48%	0.478	50%	0.501	S	S	.	.	H	α-helix	trans	-57	-51	171.4	177.4	-173.6	177.3	-77.3	0	111.6	V620 V621 K626 L627 E628	V620-K624 WeakPolarHBondContact O-CB 3.31Å; V620-K624 PolarHBondContact O-N 2.97Å; V621-K624 WeakPolarHBondContact O-CB 3.42Å; V621-K624 PolarHBondContact O-N 3.47Å; K624-K626 VanDerWaalsContact C-N 3.29Å; K624-K626 PolarHBondContact O-N 2.91Å; K624-L627 PolarHBondContact O-N 3.48Å; K624-E628 VanDerWaalsContact CE-OE1 3.31Å; K624-E628 WeakPolarHBondContact CE-OE1 3.14Å; K624-E628 HydrophobicContact CG-CG 4.41Å; K624-E628 IonicContact NZ-OE1 2.61Å; K624-E628 PolarHBondContact NZ-OE1 2.97Å; K624-E628 IonicContact NZ-OE2 3.9Å; K624-E628 PolarHBondContact NZ-OE2 3.21Å; K624-E628 WeakPolarHBondContact O-CB 3.47Å; K624-E628 WeakPolarHBondContact O-CG 3.46Å; K624-E628 PolarHBondContact O-N 2.71Å
625	E	90.8	Very high	86.1	Confident	115 Å²	115	98.9 Å²	98.9	54%	0.537	50%	0.504	S	S	.	.	H	α-helix	trans	-58.3	-40.3	178.2	-72.9	170.8	163.1	0	0	112.1	V621 G629	V621-E625 HydrophobicContact CG1-CG 4.5Å; V621-E625 WeakPolarHBondContact O-CG 3.43Å; V621-E625 PolarHBondContact O-N 2.89Å; E625-G629 PolarHBondContact O-N 3.48Å
626	K	91.7	Very high	84.1	Confident	125 Å²	125	99.6 Å²	99.6	54%	0.543	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-47.9	174.8	-176.2	-167	172.7	-137.5	0	111.5	R622 E623 K624 G629 E630	R622-K626 WeakPolarHBondContact O-CB 3.48Å; R622-K626 PolarHBondContact O-N 2.9Å; E623-K626 WeakPolarHBondContact O-CB 3.44Å; E623-K626 PolarHBondContact O-N 3.45Å; K624-K626 VanDerWaalsContact C-N 3.29Å; K624-K626 PolarHBondContact O-N 2.91Å; K626-G629 PolarHBondContact O-N 2.86Å; K626-E630 WeakPolarHBondContact CE-OE1 3.4Å; K626-E630 IonicContact NZ-OE1 3.82Å; K626-E630 WeakPolarHBondContact O-CG 3.17Å; K626-E630 PolarHBondContact O-N 3.48Å
627	L	88.3	Confident	82.1	Confident	96 Å²	96	105.1 Å²	105.1	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-40.5	179.7	-70.9	169.9	0	0	0	112.2	E623 K624 G629 E630 L631	E623-L627 HydrophobicContact CG-CD1 4.12Å; E623-L627 WeakPolarHBondContact O-CG 3.47Å; E623-L627 PolarHBondContact O-N 3.09Å; K624-L627 PolarHBondContact O-N 3.48Å; L627-G629 VanDerWaalsContact C-N 3.34Å; L627-E630 PolarHBondContact O-N 3.05Å; L627-L631 WeakPolarHBondContact O-CB 3.25Å; L627-L631 PolarHBondContact O-N 3.46Å
628	E	83.8	Confident	80.1	Confident	96 Å²	96	108 Å²	108	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-62.3	-42	172.5	-73.5	176.6	146.8	0	0	111	K624 E630 L631 Q632	K624-E628 VanDerWaalsContact CE-OE1 3.31Å; K624-E628 WeakPolarHBondContact CE-OE1 3.14Å; K624-E628 HydrophobicContact CG-CG 4.41Å; K624-E628 IonicContact NZ-OE1 2.61Å; K624-E628 PolarHBondContact NZ-OE1 2.97Å; K624-E628 IonicContact NZ-OE2 3.9Å; K624-E628 PolarHBondContact NZ-OE2 3.21Å; K624-E628 WeakPolarHBondContact O-CB 3.47Å; K624-E628 WeakPolarHBondContact O-CG 3.46Å; K624-E628 PolarHBondContact O-N 2.71Å; E628-E630 PolarHBondContact O-N 3.44Å; E628-L631 PolarHBondContact O-N 3.4Å; E628-Q632 WeakPolarHBondContact O-CB 3.25Å; E628-Q632 PolarHBondContact O-N 2.89Å
629	G	82.3	Confident	77.7	Confident	21 Å²	21	109.4 Å²	109.4	22%	0.216	56%	0.564	C	S	.	*	H	α-helix	trans	-66.3	-32.6	174.5	0	0	0	0	0	114.3	E625 K626 L627 K633	E625-G629 PolarHBondContact O-N 3.48Å; K626-G629 PolarHBondContact O-N 2.86Å; L627-G629 VanDerWaalsContact C-N 3.34Å; G629-K633 WeakPolarHBondContact O-CB 3.48Å; G629-K633 VanDerWaalsContact O-CD 3.25Å; G629-K633 WeakPolarHBondContact O-CD 3.46Å; G629-K633 WeakPolarHBondContact O-CG 3.24Å; G629-K633 PolarHBondContact O-N 2.96Å; G629-K633 VanDerWaalsContact O-N 3.17Å
630	E	85.6	Confident	75.1	Confident	93 Å²	93	111.4 Å²	111.4	44%	0.435	58%	0.575	S	S	.	*	H	α-helix	trans	-72.9	-42.4	172.6	-75.9	175.4	-169.6	0	0	111.5	K626 L627 E628 Q632 K633 S634	K626-E630 WeakPolarHBondContact CE-OE1 3.4Å; K626-E630 IonicContact NZ-OE1 3.82Å; K626-E630 WeakPolarHBondContact O-CG 3.17Å; K626-E630 PolarHBondContact O-N 3.48Å; L627-E630 PolarHBondContact O-N 3.05Å; E628-E630 PolarHBondContact O-N 3.44Å; E630-Q632 PolarHBondContact O-N 3.13Å; E630-K633 PolarHBondContact O-N 3.25Å; E630-S634 PolarHBondContact O-N 3.32Å
631	L	78.5	Confident	72.5	Confident	123 Å²	123	116.6 Å²	116.6	64%	0.644	59%	0.594	S	S	*	*	H	α-helix	trans	-60	-45.5	174.4	-172.5	67.8	0	0	0	111.2	L627 E628 K633 S634 S635	L627-L631 WeakPolarHBondContact O-CB 3.25Å; L627-L631 PolarHBondContact O-N 3.46Å; E628-L631 PolarHBondContact O-N 3.4Å; L631-K633 PolarHBondContact O-N 2.92Å; L631-S634 WeakPolarHBondContact O-CB 3.12Å; L631-S634 PolarHBondContact O-N 3.18Å; L631-S634 VanDerWaalsContact O-N 3.13Å; L631-S634 PolarHBondContact O-OG 2.81Å; L631-S635 PolarHBondContact O-N 2.98Å
632	Q	73.8	Confident	69.7	Low	141 Å²	141	118.2 Å²	118.2	66%	0.659	62%	0.62	S	S	*	*	H	α-helix	trans	-65.7	-38.8	178.2	-161.3	171.3	18.8	0	0	112.1	E628 E630 S634 S635 S636	E628-Q632 WeakPolarHBondContact O-CB 3.25Å; E628-Q632 PolarHBondContact O-N 2.89Å; E630-Q632 PolarHBondContact O-N 3.13Å; Q632-S634 VanDerWaalsContact C-N 3.31Å; Q632-S634 PolarHBondContact O-N 3.06Å; Q632-S635 WeakPolarHBondContact O-CB 3.3Å; Q632-S635 PolarHBondContact O-N 3.5Å; Q632-S636 PolarHBondContact O-N 3.24Å; Q632-S636 PolarHBondContact O-OG 3.24Å
633	K	76.1	Confident	66.8	Low	151 Å²	151	116 Å²	116	66%	0.657	63%	0.634	S	S	*	*	H	α-helix	trans	-64	-33.1	171.2	-73.3	163.9	-168.3	164.1	0	112.7	G629 E630 L631	G629-K633 WeakPolarHBondContact O-CB 3.48Å; G629-K633 VanDerWaalsContact O-CD 3.25Å; G629-K633 WeakPolarHBondContact O-CD 3.46Å; G629-K633 WeakPolarHBondContact O-CG 3.24Å; G629-K633 PolarHBondContact O-N 2.96Å; G629-K633 VanDerWaalsContact O-N 3.17Å; E630-K633 PolarHBondContact O-N 3.25Å; L631-K633 PolarHBondContact O-N 2.92Å
634	S	64.9	Low	64	Low	72 Å²	72	115.2 Å²	115.2	50%	0.503	64%	0.641	S	S	.	*	H	α-helix	trans	-69.4	-38.9	174.8	84.6	0	0	0	0	111.9	E630 L631 Q632 K637	E630-S634 PolarHBondContact O-N 3.32Å; L631-S634 WeakPolarHBondContact O-CB 3.12Å; L631-S634 PolarHBondContact O-N 3.18Å; L631-S634 VanDerWaalsContact O-N 3.13Å; L631-S634 PolarHBondContact O-OG 2.81Å; Q632-S634 VanDerWaalsContact C-N 3.31Å; Q632-S634 PolarHBondContact O-N 3.06Å; S634-K637 PolarHBondContact O-N 3.38Å
635	S	56.8	Low	61.3	Low	88 Å²	88	117 Å²	117	62%	0.615	65%	0.651	S	S	*	*	H	α-helix	trans	-61.3	-48.7	175	-172.8	0	0	0	0	111.4	L631 Q632 K637 K638	L631-S635 PolarHBondContact O-N 2.98Å; Q632-S635 WeakPolarHBondContact O-CB 3.3Å; Q632-S635 PolarHBondContact O-N 3.5Å; S635-K637 PolarHBondContact O-N 2.82Å; S635-K637 VanDerWaalsContact O-N 3.08Å; S635-K638 PolarHBondContact O-N 2.94Å; S635-K638 VanDerWaalsContact O-N 3.15Å
636	S	52.7	Low	58.7	Low	97 Å²	97	119.1 Å²	119.1	68%	0.678	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-10.7	-178.8	-60	0	0	0	0	114.9	Q632	Q632-S636 PolarHBondContact O-N 3.24Å; Q632-S636 PolarHBondContact O-OG 3.24Å
637	K	54.7	Low	55.8	Low	194 Å²	194	119.1 Å²	119.1	84%	0.843	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-0.9	175.1	-84.4	-172.2	171.8	-176.5	0	114.8	S634 S635	S634-K637 PolarHBondContact O-N 3.38Å; S635-K637 PolarHBondContact O-N 2.82Å; S635-K637 VanDerWaalsContact O-N 3.08Å
638	K	47.9	Very low	53.1	Low	203 Å²	203	119.7 Å²	119.7	88%	0.883	68%	0.681	S	S	*	*	S	Bend	trans	-101.1	19.9	179.6	-110.4	179.9	178.5	-179.8	0	114.4	S635	S635-K638 PolarHBondContact O-N 2.94Å; S635-K638 VanDerWaalsContact O-N 3.15Å
639	G	43.3	Very low	50.8	Low	73 Å²	73	122.4 Å²	122.4	75%	0.753	70%	0.698	S	S	*	*	S	Bend	trans	-104.8	11.7	-168.7	0	0	0	0	0	117.7
640	D	41.8	Very low	48.4	Very low	143 Å²	143	130 Å²	130	77%	0.765	73%	0.728	S	S	*	*	S	Bend	trans	-152	88.1	174.6	-166.8	11.9	0	0	0	113.8
641	Q	39.8	Very low	45.9	Very low	192 Å²	192	132.2 Å²	132.2	90%	0.897	74%	0.743	S	S	*	*			trans	-179.1	141.9	151.6	-107.8	151.2	102.2	0	0	112.3
642	G	32.9	Very low	43.8	Very low	83 Å²	83	134.5 Å²	134.5	86%	0.856	76%	0.755	S	S	*	*			trans	83.5	98.9	154.3	0	0	0	0	0	117.2
643	A	33.3	Very low	42	Very low	101 Å²	101	135.8 Å²	135.8	84%	0.835	76%	0.761	S	S	*	*			trans	-115.8	159.4	158.5	0	0	0	0	0	110.2
644	S	34.1	Very low	40	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	77%	0.765	S	S	*	*			trans	73.4	143.9	-165.9	-131.6	0	0	0	0	113.9
645	E	33.5	Very low	38.4	Very low	147 Å²	147	136.6 Å²	136.6	69%	0.687	78%	0.78	S	S	*	*			cis	-138.8	-169.4	5.7	-161.1	129.4	-162.2	0	0	113.1
646	K	37.2	Very low	37.4	Very low	161 Å²	161	137.8 Å²	137.8	70%	0.7	78%	0.784	S	S	*	*			trans	-77	173.9	-166.5	-59.5	145.5	-167.8	140.1	0	111.2
647	T	30.4	Very low	36.7	Very low	124 Å²	124	138.6 Å²	138.6	76%	0.761	79%	0.786	S	S	*	*			cis	-171.8	162.9	45.1	-32.6	0	0	0	0	113.3
648	S	30.8	Very low	35.7	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	79%	0.786	S	S	*	*			trans	87.2	129.1	151.3	-58.4	0	0	0	0	121.2
649	L	37.2	Very low	35	Very low	153 Å²	153	134.6 Å²	134.6	80%	0.801	78%	0.782	S	S	*	*			trans	-63.8	165.7	156.1	-77.9	88.6	0	0	0	109.9
650	E	31.5	Very low	34.6	Very low	181 Å²	181	139.3 Å²	139.3	85%	0.846	79%	0.789	S	S	*	*			cis	-160.6	-175.5	49.2	-151.2	159.4	-130	0	0	114.1
651	N	33.3	Very low	34.1	Very low	139 Å²	139	141.1 Å²	141.1	74%	0.743	79%	0.793	S	S	*	*			trans	-83.8	146.6	-164.2	-66.4	-80.9	0	0	0	115.7
652	L	33.2	Very low	33.8	Very low	170 Å²	170	142.4 Å²	142.4	89%	0.89	79%	0.791	S	S	*	*				-154.6	160.2	126.2	-136.4	69.7	0	0	0	114
653	Q	36.8	Very low	34.1	Very low	169 Å²	169	143.7 Å²	143.7	79%	0.79	78%	0.784	S	S	*	*			trans	-74.3	148.7	-158.8	-80.6	172.3	-69.9	0	0	119.1
654	T	34.3	Very low	34.3	Very low	121 Å²	121	145.3 Å²	145.3	74%	0.742	78%	0.783	S	S	*	*			trans	67.9	111	136	-54.7	0	0	0	0	121.3
655	S	31.8	Very low	34.6	Very low	118 Å²	118	145.2 Å²	145.2	83%	0.825	78%	0.78	S	S	*	*			trans	-147.4	154.1	130.9	60.7	0	0	0	0	110.3
656	V	35.6	Very low	34.8	Very low	114 Å²	114	149.4 Å²	149.4	69%	0.691	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-102	135.6	-166.1	176.4	0	0	0	0	111.5
657	P	37.1	Very low	34.7	Very low	113 Å²	113	146.4 Å²	146.4	73%	0.734	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-75.9	123.4	166.1	30.9	-31.9	0	0	0	110.4	I659	P657-I659 PolarHBondContact O-N 2.78Å
658	L	34.1	Very low	34.8	Very low	158 Å²	158	149.8 Å²	149.8	83%	0.827	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.1	129.4	174	-88.3	73.8	0	0	0	110.6
659	I	34.1	Very low	35.1	Very low	156 Å²	156	151.6 Å²	151.6	80%	0.8	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-92.9	120.5	163.8	-62.6	174.2	0	0	0	107.1	P657 Q661	P657-I659 PolarHBondContact O-N 2.78Å; I659-Q661 PolarHBondContact O-N 3.12Å
660	L	33.5	Very low	35	Very low	172 Å²	172	150.2 Å²	150.2	90%	0.901	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.8	117.3	168.6	-92.9	92.4	0	0	0	109.3
661	Q	31.1	Very low	35.6	Very low	181 Å²	181	147 Å²	147	85%	0.846	80%	0.798	S	S	*	*			trans	-107.8	119.6	179.7	-170.1	173.8	15.3	0	0	109.4	I659	I659-Q661 PolarHBondContact O-N 3.12Å
662	Y	33.1	Very low	35.3	Very low	219 Å²	219	147.2 Å²	147.2	86%	0.859	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-82.4	132.1	177.4	-135.3	-86.7	0	0	0	110.1	V664	Y662-V664 PolarHBondContact O-N 2.75Å
663	P	39.6	Very low	35.7	Very low	110 Å²	110	144.3 Å²	144.3	71%	0.714	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.6	122.3	-178.3	-15.3	30.4	0	0	0	112.1
664	V	37.3	Very low	35.5	Very low	134 Å²	134	144.6 Å²	144.6	81%	0.812	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-97.7	123.4	160	-179.3	0	0	0	0	107.3	Y662	Y662-V664 PolarHBondContact O-N 2.75Å
665	P	41.9	Very low	35.6	Very low	100 Å²	100	146.8 Å²	146.8	65%	0.649	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-77.3	156	178.9	31.2	-34.1	0	0	0	112.3
666	Y	37.1	Very low	35.5	Very low	235 Å²	235	147.9 Å²	147.9	92%	0.922	81%	0.81	S	S	*	*			trans	83.2	128.2	-174.9	-59.7	-75.4	0	0	0	115.9
667	A	33.8	Very low	35.5	Very low	99 Å²	99	147.3 Å²	147.3	82%	0.818	81%	0.811	S	S	*	*			trans	-108.7	156.8	-170.3	0	0	0	0	0	112.2
668	Q	34.4	Very low	35.3	Very low	194 Å²	194	151.1 Å²	151.1	91%	0.907	82%	0.819	S	S	*	*			trans	-123.5	139.1	164.9	-75.6	-175.1	-35.9	0	0	109
669	D	36.9	Very low	35.3	Very low	147 Å²	147	148 Å²	148	79%	0.786	81%	0.81	S	S	*	*			trans	-113.8	113.8	174.5	-103.1	-44.5	0	0	0	111.3
670	T	33.6	Very low	35.5	Very low	124 Å²	124	147.1 Å²	147.1	76%	0.761	81%	0.814	S	S	*	*			trans	71.4	166.4	154.2	77.8	0	0	0	0	117.2
671	P	44	Very low	35.4	Very low	115 Å²	115	144 Å²	144	75%	0.747	81%	0.807	S	S	*	*				-135.6	148.3	-82.1	36.2	-18.3	0	0	0	115.6
672	T	28.6	Very low	35.6	Very low	142 Å²	142	143 Å²	143	87%	0.871	80%	0.8	S	S	*	*			trans	-117.8	128.8	176.6	-49.9	0	0	0	0	112.3
673	P	40.4	Very low	35.6	Very low	109 Å²	109	140.8 Å²	140.8	71%	0.708	80%	0.802	S	S	*	*			trans	-96.5	132.3	178.7	34.7	-31.9	0	0	0	114.8
674	L	33.6	Very low	35.4	Very low	175 Å²	175	143.6 Å²	143.6	92%	0.916	81%	0.805	S	S	*	*			trans	58.9	137.8	145.6	-57.6	178.5	0	0	0	122.2
675	L	36.6	Very low	35.3	Very low	167 Å²	167	147.9 Å²	147.9	87%	0.874	81%	0.813	S	S	*	*			trans	-74.7	150.1	179.8	-62.5	145	0	0	0	114.4
676	V	29.8	Very low	35.1	Very low	142 Å²	142	146.4 Å²	146.4	86%	0.861	82%	0.816	S	S	*	*				-149.6	151.5	128.7	169.2	0	0	0	0	108.6
677	S	35.6	Very low	35.1	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	81%	0.805	S	S	*	*			trans	-93.7	152.5	-177.2	55.4	0	0	0	0	115.1
678	Q	32.9	Very low	35.6	Very low	193 Å²	193	142 Å²	142	90%	0.902	80%	0.801	S	S	*	*			trans	-161.3	173.5	145.2	-120	155.3	97.9	0	0	113.8
679	S	32.8	Very low	35.9	Very low	93 Å²	93	142.6 Å²	142.6	65%	0.65	80%	0.797	S	S	*	*			trans	-76.9	158.7	-163.8	34.5	0	0	0	0	115.8	S681	S679-S681 PolarHBondContact O-N 3.47Å
680	P	38.9	Very low	35.8	Very low	136 Å²	136	140.7 Å²	140.7	88%	0.883	80%	0.795	S	S	*	*			trans	-67.8	125.9	-171.6	27.4	-35.9	0	0	0	112.8
681	S	31.1	Very low	35.8	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	80%	0.799	S	S	*	*			trans	-118.5	99.4	179	-66.3	0	0	0	0	111.5	S679 L683	S679-S681 PolarHBondContact O-N 3.47Å; S681-L683 PolarHBondContact O-N 2.76Å
682	K	35.7	Very low	35.1	Very low	160 Å²	160	142.3 Å²	142.3	70%	0.696	80%	0.799	S	S	*	*			trans	13.6	93.4	149.1	-166.8	-178.8	-170.5	-179	0	116.4	H684	K682-H684 WeakPolarHBondContact CD-NE2 3.34Å; K682-H684 VanDerWaalsContact CE-NE2 3.28Å; K682-H684 WeakPolarHBondContact CE-NE2 3.41Å
683	L	32.6	Very low	35.3	Very low	172 Å²	172	143.2 Å²	143.2	90%	0.901	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-83.2	126.2	163.3	-78.6	172.6	0	0	0	110.2	S681	S681-L683 PolarHBondContact O-N 2.76Å
684	H	35.4	Very low	34.9	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.787	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-92.3	140.6	167	-70.7	-107.7	0	0	0	109.1	K682	K682-H684 WeakPolarHBondContact CD-NE2 3.34Å; K682-H684 VanDerWaalsContact CE-NE2 3.28Å; K682-H684 WeakPolarHBondContact CE-NE2 3.41Å
685	F	35.5	Very low	35	Very low	223 Å²	223	144 Å²	144	98%	0.978	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.9	135.5	166.4	-84.2	-92.9	0	0	0	110.1
686	G	36.6	Very low	34.7	Very low	69 Å²	69	143.3 Å²	143.3	71%	0.711	79%	0.794	S	S	*	*			trans	-113.4	140.1	176	0	0	0	0	0	111.6
687	N	37.9	Very low	34.8	Very low	128 Å²	128	144.5 Å²	144.5	68%	0.684	79%	0.791	S	S	*	*			trans	-71	129.3	179.3	-178.6	-25.4	0	0	0	110.7	Y689	N687-Y689 PolarHBondContact O-N 2.82Å; N687-Y689 VanDerWaalsContact O-N 3.16Å; N687-Y689 WeakPolarHBondContact OD1-CD2 3.45Å; N687-Y689 PolarHBondContact OD1-N 2.77Å
688	P	45.1	Very low	34.6	Very low	115 Å²	115	145 Å²	145	75%	0.747	79%	0.789	S	S	*	*	S	Bend	trans	-74	1.2	-171.9	29.9	-37.1	0	0	0	116.1	S690	P688-S690 PolarHBondContact O-N 2.82Å
689	Y	40.6	Very low	34.5	Very low	206 Å²	206	143.8 Å²	143.8	81%	0.808	78%	0.784	S	S	*	*			trans	-97.4	75.9	-179.7	-66	-74.8	0	0	0	113	N687	N687-Y689 PolarHBondContact O-N 2.82Å; N687-Y689 VanDerWaalsContact O-N 3.16Å; N687-Y689 WeakPolarHBondContact OD1-CD2 3.45Å; N687-Y689 PolarHBondContact OD1-N 2.77Å
690	S	34	Very low	34.4	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	79%	0.789	S	S	*	*			trans	-147.2	112.6	165.9	-77	0	0	0	0	110.7	P688 S692	P688-S690 PolarHBondContact O-N 2.82Å; S690-S692 PolarHBondContact O-N 2.88Å
691	I	33.5	Very low	34	Very low	166 Å²	166	147.4 Å²	147.4	85%	0.851	78%	0.778	S	S	*	*			trans	-83.4	111.8	-173.9	-59.8	170	0	0	0	109.5
692	S	30.9	Very low	33.9	Very low	106 Å²	106	150.8 Å²	150.8	74%	0.741	78%	0.78	S	S	*	*			trans	-103.7	105.4	170.6	53.1	0	0	0	0	111.2	S690	S690-S692 PolarHBondContact O-N 2.88Å
693	N	31.9	Very low	33.6	Very low	161 Å²	161	146.5 Å²	146.5	86%	0.861	78%	0.775	S	S	*	*			trans	-100.5	116	167.2	-98.1	-0.3	0	0	0	110.4
694	S	32.1	Very low	33.4	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	77%	0.772	S	S	*	*			trans	-163.3	138.3	169.1	64.7	0	0	0	0	107.8
695	K	34.8	Very low	33.3	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	78%	0.775	S	S	*	*			cis	-160.7	154.8	1.2	-152.5	179.8	-177.9	-174	0	107.1
696	D	30.3	Very low	33.2	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	77%	0.766	S	S	*	*			trans	-138.4	173.2	162.3	-113.2	-26.8	0	0	0	110.9
697	E	33.5	Very low	33.8	Very low	167 Å²	167	144 Å²	144	78%	0.78	76%	0.762	S	S	*	*			trans	-85.2	-176.4	-143.7	-52.2	-172.6	117	0	0	118.1
698	T	30.7	Very low	33.5	Very low	112 Å²	112	144.7 Å²	144.7	69%	0.687	77%	0.765	S	S	*	*			trans	74.6	129.6	158.7	44.9	0	0	0	0	121.3
699	E	31.5	Very low	32.8	Very low	168 Å²	168	148.1 Å²	148.1	79%	0.785	77%	0.768	S	S	*	*			trans	63.3	152.2	142.6	-68	167.2	-163.9	0	0	118.7
700	E	29.8	Very low	32.3	Very low	162 Å²	162	146 Å²	146	76%	0.757	77%	0.769	S	S	*	*			cis	-154.2	167.1	-23	-129.3	-177.9	171.7	0	0	109.1
701	E	31.2	Very low	32.8	Very low	142 Å²	142	146.2 Å²	146.2	66%	0.664	77%	0.768	S	S	*	*			trans	47.2	144.6	155.6	-69.7	-156.5	141.1	0	0	125.1
702	F	28.6	Very low	34	Very low	178 Å²	178	143.6 Å²	143.6	78%	0.781	76%	0.762	S	S	*	*			trans	47.5	160.1	154.6	-62.4	-60.9	0	0	0	122.4
703	A	29.2	Very low	34.1	Very low	71 Å²	71	145.2 Å²	145.2	59%	0.587	77%	0.768	S	S	*	*			cis	176.8	147.4	-45.9	0	0	0	0	0	108.2
704	D	29	Very low	34.1	Very low	159 Å²	159	140.8 Å²	140.8	85%	0.85	76%	0.76	S	S	*	*			trans	59	165.8	172.6	-70	-35.6	0	0	0	115.9
705	D	31.8	Very low	34.8	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	76%	0.762	S	S	*	*			cis	-134.6	178.4	13.3	-153.8	-18.5	0	0	0	112.5
706	Q	34.7	Very low	35.7	Very low	169 Å²	169	138.1 Å²	138.1	79%	0.79	76%	0.76	S	S	*	*			trans	-105.7	-162	-156.8	-135	-161.1	40.8	0	0	113.5
707	P	49.7	Very low	35.8	Very low	98 Å²	98	136.3 Å²	136.3	64%	0.636	76%	0.759	S	S	*	*				-122.8	-121.8	-126.6	43.3	-23.5	0	0	0	113.9
708	L	31	Very low	35.7	Very low	142 Å²	142	140.2 Å²	140.2	74%	0.743	77%	0.767	S	S	*	*			trans	100.7	131.6	179.9	-54	172.7	0	0	0	113.5
709	K	30.9	Very low	35.8	Very low	187 Å²	187	141.4 Å²	141.4	81%	0.813	77%	0.769	S	S	*	*			cis	-152.9	168.6	5.2	-134.1	159.1	-176.7	167.3	0	113.4
710	L	30	Very low	35.8	Very low	160 Å²	160	138.4 Å²	138.4	84%	0.838	77%	0.766	S	S	*	*			trans	-131.1	177.7	-169	-90.5	173.4	0	0	0	109
711	P	44	Very low	36.1	Very low	112 Å²	112	135.9 Å²	135.9	73%	0.727	76%	0.758	S	S	*	*			cis	-136.3	-125.7	-21	36.1	-10.1	0	0	0	113.3
712	P	57.5	Low	36.1	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	76%	0.763	S	S	*	*			trans	-140.6	-153.3	-135.7	38.8	-10.5	0	0	0	117.7
713	V	34.5	Very low	36.4	Very low	141 Å²	141	133 Å²	133	86%	0.855	76%	0.764	S	S	*	*			trans	92.8	125.5	158.5	-168.3	0	0	0	0	120.1
714	G	31.1	Very low	36.4	Very low	67 Å²	67	134.8 Å²	134.8	69%	0.691	77%	0.771	S	S	*	*			trans	116.6	118.9	135.4	0	0	0	0	0	120.4
715	P	47.3	Very low	36.4	Very low	125 Å²	125	135.3 Å²	135.3	81%	0.812	77%	0.772	S	S	*	*			trans	-112.7	-163.6	165	44.7	-35	0	0	0	111.2
716	P	53.7	Low	36.3	Very low	122 Å²	122	136.2 Å²	136.2	79%	0.792	77%	0.771	S	S	*	*			cis	-129.5	178.1	-18	40.9	-26.2	0	0	0	114.4
717	S	31.7	Very low	36.8	Very low	114 Å²	114	133 Å²	133	80%	0.797	77%	0.765	S	S	*	*			trans	-159.5	160.3	155	61.3	0	0	0	0	113.5
718	W	31	Very low	35.7	Very low	249 Å²	249	133.6 Å²	133.6	94%	0.943	77%	0.772	S	S	*	*			trans	-120.9	-165.3	179.2	-90.3	22.3	0	0	0	111.3
719	D	32.5	Very low	35.6	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	78%	0.779	S	S	*	*			trans	87.1	148.5	173.6	-80.4	-11.5	0	0	0	117.6	N721	D719-N721 PolarHBondContact OD1-ND2 2.72Å
720	S	32.3	Very low	35.5	Very low	105 Å²	105	136.4 Å²	136.4	73%	0.734	78%	0.779	S	S	*	*			cis	-165.6	159.5	0.5	145.3	0	0	0	0	112.1
721	N	35.9	Very low	35.5	Very low	110 Å²	110	137.3 Å²	137.3	59%	0.588	78%	0.783	S	S	*	*			cis	-175.5	136.7	-29.6	-93.4	-33.7	0	0	0	111.2	D719	D719-N721 PolarHBondContact OD1-ND2 2.72Å
722	V	31.6	Very low	34.8	Very low	127 Å²	127	137 Å²	137	77%	0.77	78%	0.784	S	S	*	*			trans	69.6	168.9	155.3	-172.4	0	0	0	0	112.8
723	V	33.9	Very low	33.7	Very low	131 Å²	131	140.8 Å²	140.8	79%	0.794	78%	0.784	S	S	*	*			cis	-148.6	171.6	36.8	-155.9	0	0	0	0	113.6
724	C	29.4	Very low	34.3	Very low	109 Å²	109	139 Å²	139	74%	0.736	78%	0.775	S	S	*	*			trans	-108.9	177.5	-168.9	-38.8	0	0	0	0	114.8
725	I	30.1	Very low	34.3	Very low	170 Å²	170	143 Å²	143	87%	0.872	78%	0.776	S	S	*	*			trans	158.5	152.6	133.3	-81.4	159.2	0	0	0	113.9
726	Q	29.5	Very low	33.4	Very low	175 Å²	175	140 Å²	140	82%	0.818	77%	0.768	S	S	*	*			trans	-100.1	-178.8	176.9	-92.4	-171.8	-10.9	0	0	112.3
727	P	44.2	Very low	32.6	Very low	102 Å²	102	141 Å²	141	66%	0.662	76%	0.761	S	S	*	*			cis	-137.4	-174.4	-31.1	37.4	-18.3	0	0	0	114.9
728	S	27.8	Very low	32.7	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	75%	0.752	S	S	*	*			trans	82.4	143.8	144.7	-67.5	0	0	0	0	124.5
729	R	28.8	Very low	32.8	Very low	236 Å²	236	137.7 Å²	137.7	89%	0.891	74%	0.744	S	S	*	*			trans	87	101.7	153.9	-76.6	-179.8	173.4	-176.1	-2.3	123
730	N	28.1	Very low	32.8	Very low	152 Å²	152	134.2 Å²	134.2	81%	0.813	73%	0.734	S	S	*	*			trans	21.1	132.4	133.3	-57.1	-0.3	0	0	0	122.8
731	L	30.1	Very low	32.9	Very low	178 Å²	178	137.4 Å²	137.4	93%	0.932	74%	0.738	S	S	*	*				-144.2	169.1	129.8	-92.1	-179	0	0	0	110.2
732	S	30.6	Very low	32.8	Very low	106 Å²	106	139.1 Å²	139.1	74%	0.741	74%	0.742	S	S	*	*			trans	-114.2	154.1	-148.2	-44.4	0	0	0	0	117.7
733	R	33.7	Very low	32.8	Very low	191 Å²	191	138.5 Å²	138.5	72%	0.721	73%	0.734	S	S	*	*			trans	49.2	148.1	134.4	-160.6	170	174.6	145.5	4.3	118.7
734	P	46	Very low	32.6	Very low	102 Å²	102	138 Å²	138	66%	0.662	73%	0.727	S	S	*	*			cis	-128.3	-179	27.4	17.5	10.9	0	0	0	116.1
735	E	31.5	Very low	32.7	Very low	152 Å²	152	139.7 Å²	139.7	71%	0.71	73%	0.729	S	S	*	*			cis	-154.1	139.8	-7	-117.9	144.7	-172.3	0	0	108.2
736	G	29.6	Very low	32.6	Very low	62 Å²	62	137.7 Å²	137.7	64%	0.639	72%	0.724	S	S	*	*				105.2	144.7	92.4	0	0	0	0	0	110.1
737	H	36.8	Very low	32.7	Very low	143 Å²	143	136.1 Å²	136.1	66%	0.662	72%	0.722	S	S	*	*			cis	-142.3	140.1	0.9	-103	-102.2	0	0	0	106.8
738	E	33.4	Very low	32	Very low	128 Å²	128	137.5 Å²	137.5	60%	0.598	73%	0.728	S	S	*	*				64.2	143.1	89	-65.2	173.5	-156.3	0	0	114
739	E	32.7	Very low	32.1	Very low	165 Å²	165	138.6 Å²	138.6	77%	0.771	73%	0.725	S	S	*	*			cis	-167.6	179.5	0.7	-120.2	174.8	-159.7	0	0	109.1
740	A	33	Very low	32.1	Very low	64 Å²	64	135.6 Å²	135.6	53%	0.529	72%	0.722	S	S	.	*			cis	-162.3	157.4	-1.7	0	0	0	0	0	110.9
741	E	34.4	Very low	32.1	Very low	172 Å²	172	137 Å²	137	80%	0.804	72%	0.723	S	S	*	*			trans	52.8	159.2	131	-64.7	-178.2	168.1	0	0	123.5
742	E	33.6	Very low	33.5	Very low	146 Å²	146	133.1 Å²	133.1	68%	0.682	71%	0.709	S	S	*	*			cis	-154.6	146.2	-6.4	-128.2	-154.7	157.4	0	0	114.6
743	N	31.2	Very low	33.2	Very low	114 Å²	114	136.2 Å²	136.2	61%	0.61	72%	0.716	S	S	*	*			trans	55.4	144.6	131.1	-102.1	-25	0	0	0	129
744	N	30.3	Very low	32.8	Very low	120 Å²	120	130.1 Å²	130.1	64%	0.642	71%	0.712	S	S	*	*			trans	94.8	87.5	135.8	-79.7	-42.7	0	0	0	125.8
745	N	31.2	Very low	32	Very low	145 Å²	145	131.6 Å²	131.6	78%	0.775	72%	0.72	S	S	*	*				70.3	163.1	96.1	-159.4	16.3	0	0	0	122.9
746	V	28.7	Very low	31.8	Very low	128 Å²	128	132.6 Å²	132.6	78%	0.776	72%	0.724	S	S	*	*			trans	100.8	143.9	165.6	-171.5	0	0	0	0	117.7
747	N	31.7	Very low	31.7	Very low	142 Å²	142	135.6 Å²	135.6	76%	0.759	73%	0.731	S	S	*	*			trans	-149.9	133.9	-163.1	158.1	47.7	0	0	0	111
748	T	27.9	Very low	31.3	Very low	130 Å²	130	139.3 Å²	139.3	80%	0.798	74%	0.739	S	S	*	*			trans	-167.5	115.1	157.9	16.5	0	0	0	0	114.6
749	N	29.7	Very low	30.9	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	74%	0.743	S	S	*	*				26.9	133.2	122.2	-147.8	43.9	0	0	0	121.9
750	E	29	Very low	30.7	Very low	174 Å²	174	134.2 Å²	134.2	81%	0.813	74%	0.735	S	S	*	*				158.8	164.9	119.5	-82	-167.6	174.9	0	0	116.1
751	Q	29	Very low	30.4	Very low	180 Å²	180	140.8 Å²	140.8	84%	0.841	75%	0.753	S	S	*	*			trans	-151.7	179.8	-170.2	-118.9	-167.1	8.9	0	0	108.1
752	P	58.9	Low	30.3	Very low	97 Å²	97	138.3 Å²	138.3	63%	0.63	75%	0.749	S	S	*	*			cis	-135	-143.1	-21	33.7	-9.6	0	0	0	112.3
753	L	24.7	Very low	30.1	Very low	172 Å²	172	138.3 Å²	138.3	90%	0.901	75%	0.754	S	S	*	*			trans	86.7	144.8	179.8	-76.7	69.4	0	0	0	116.7
754	G	26.3	Very low	30	Very low	62 Å²	62	140.6 Å²	140.6	64%	0.639	77%	0.766	S	S	*	*			cis	168	151.5	-9.9	0	0	0	0	0	115.6
755	T	27.7	Very low	30	Very low	134 Å²	134	138.2 Å²	138.2	82%	0.822	77%	0.769	S	S	*	*			trans	61.7	121.3	165	41	0	0	0	0	121.9
756	E	27.6	Very low	30.1	Very low	172 Å²	172	140.3 Å²	140.3	80%	0.804	77%	0.774	S	S	*	*				41.3	143.9	128.9	-61.4	-173.8	-173.3	0	0	121.4
757	T	28.5	Very low	30.2	Very low	126 Å²	126	139.8 Å²	139.8	77%	0.773	77%	0.771	S	S	*	*			cis	-157.9	-168.8	15.8	-3.6	0	0	0	0	109.1
758	R	27.4	Very low	30.3	Very low	221 Å²	221	138.8 Å²	138.8	83%	0.834	77%	0.773	S	S	*	*			cis	-168	148.3	3.9	145.2	-178	-178.8	174.1	1.2	110.8
759	S	25.9	Very low	30.5	Very low	97 Å²	97	141.3 Å²	141.3	68%	0.678	77%	0.773	S	S	*	*			trans	22.4	135.8	146.6	-160.5	0	0	0	0	120.3
760	S	28.5	Very low	30.8	Very low	88 Å²	88	140.9 Å²	140.9	62%	0.615	78%	0.779	S	S	*	*				-172.2	164.8	61.6	-51.9	0	0	0	0	115.9
761	F	26.8	Very low	31	Very low	203 Å²	203	140.6 Å²	140.6	89%	0.89	78%	0.775	S	S	*	*			trans	86.6	150.3	169.7	-75.4	-80.2	0	0	0	118.7
762	V	32.2	Very low	31	Very low	119 Å²	119	139.1 Å²	139.1	72%	0.721	77%	0.773	S	S	*	*			trans	-135.7	149.1	-141.1	-72.4	0	0	0	0	114.9
763	N	28.8	Very low	30.1	Very low	147 Å²	147	140.6 Å²	140.6	79%	0.786	79%	0.786	S	S	*	*			trans	144.2	87.7	143.8	-79.4	8.2	0	0	0	107.6
764	D	29.3	Very low	30.8	Very low	162 Å²	162	136 Å²	136	87%	0.866	77%	0.769	S	S	*	*				74.6	126.5	62.8	-159.8	11.3	0	0	0	112.1
765	G	29.8	Very low	31.7	Very low	69 Å²	69	141.9 Å²	141.9	71%	0.711	78%	0.781	S	S	*	*			trans	139.7	-2.9	-171.1	0	0	0	0	0	117.9
766	Q	33.8	Very low	32.8	Very low	190 Å²	190	141 Å²	141	89%	0.888	77%	0.772	S	S	*	*			trans	-139	109	168.4	-82	-171.9	-11.6	0	0	111.1
767	T	30.6	Very low	34.2	Very low	116 Å²	116	137.6 Å²	137.6	71%	0.712	76%	0.757	S	S	*	*			trans	-109.8	114.4	171.1	50.6	0	0	0	0	109.9	F769	T767-F769 PolarHBondContact O-N 3.01Å
768	P	33.9	Very low	36	Very low	122 Å²	122	134 Å²	134	79%	0.792	73%	0.731	S	S	*	*			trans	-62.2	131.1	162.9	-16.6	30.6	0	0	0	108.9	C770	P768-C770 PolarHBondContact O-N 3.42Å
769	F	32.8	Very low	38.2	Very low	183 Å²	183	130.7 Å²	130.7	80%	0.803	72%	0.718	S	S	*	*			trans	-66.5	114.9	174.2	-103.1	-91.8	0	0	0	109.7	T767 F771	T767-F769 PolarHBondContact O-N 3.01Å; F769-F771 HydrophobicContact CD1-CD2 4.2Å; F769-F771 AromaticContact CD1-CE2 3.65Å; F769-F771 HydrophobicContact CD1-CE2 3.65Å; F769-F771 HydrophobicContact CD1-CZ 4.39Å; F769-F771 HydrophobicContact CE1-CE2 4.07Å; F769-F771 HydrophobicContact CE1-CZ 4.42Å
770	C	34.4	Very low	40.6	Very low	124 Å²	124	126.1 Å²	126.1	84%	0.838	69%	0.686	S	S	*	*			trans	-111.3	117.2	170.4	-171.5	0	0	0	0	108	P768	P768-C770 PolarHBondContact O-N 3.42Å
771	F	33.8	Very low	42.3	Very low	168 Å²	168	127 Å²	127	74%	0.737	69%	0.69	S	S	*	*			trans	-94.4	135.1	177	-97.4	-79.8	0	0	0	111.4	F769	F769-F771 HydrophobicContact CD1-CD2 4.2Å; F769-F771 AromaticContact CD1-CE2 3.65Å; F769-F771 HydrophobicContact CD1-CE2 3.65Å; F769-F771 HydrophobicContact CD1-CZ 4.39Å; F769-F771 HydrophobicContact CE1-CE2 4.07Å; F769-F771 HydrophobicContact CE1-CZ 4.42Å
772	D	30.3	Very low	44.3	Very low	150 Å²	150	121.3 Å²	121.3	80%	0.802	67%	0.668	S	S	*	*			trans	-72.2	149.2	-178.1	-165.9	8	0	0	0	112	S774	D772-S774 VanDerWaalsContact C-N 3.27Å; D772-S774 PolarHBondContact O-N 3.12Å
773	S	39.6	Very low	46.3	Very low	127 Å²	127	118 Å²	118	89%	0.888	65%	0.649	S	S	*	*			trans	-88.6	59.8	-172	-156.9	0	0	0	0	111.8
774	S	38.3	Very low	48.1	Very low	77 Å²	77	118.7 Å²	118.7	54%	0.538	65%	0.648	S	S	.	*			trans	-92.5	155.7	172.1	-176.8	0	0	0	0	111.6	D772 D776	D772-S774 VanDerWaalsContact C-N 3.27Å; D772-S774 PolarHBondContact O-N 3.12Å; S774-D776 PolarHBondContact O-N 3.45Å; S774-D776 PolarHBondContact OG-OD2 2.93Å
775	M	46.5	Very low	50.3	Low	184 Å²	184	114.2 Å²	114.2	91%	0.906	63%	0.626	S	S	*	*	S	Bend	trans	-79	50.8	179.7	-73.3	-170.7	62.1	0	0	113.5
776	D	49.6	Very low	52.5	Low	117 Å²	117	114.7 Å²	114.7	63%	0.626	61%	0.612	S	S	*	*			trans	-107	145.6	179.2	-72	-75.8	0	0	0	111.9	S774 K778	S774-D776 PolarHBondContact O-N 3.45Å; S774-D776 PolarHBondContact OG-OD2 2.93Å; D776-K778 PolarHBondContact O-N 3.12Å
777	M	58	Low	54.6	Low	99 Å²	99	106.8 Å²	106.8	49%	0.488	58%	0.575	S	S	.	*			trans	-68	116.5	-178	-66.7	143.9	57.5	0	0	110.2	R779 I786 P789	M777-R779 WeakPolarHBondContact O-CG 3.35Å; M777-R779 PolarHBondContact O-N 3.2Å; M777-I786 HydrophobicContact CB-CG2 3.93Å; M777-I786 HydrophobicContact CE-CG2 3.59Å; M777-P789 HydrophobicContact CG-CG 4.38Å
778	K	65.1	Low	56.6	Low	52 Å²	52	105 Å²	105	23%	0.226	57%	0.565	C	S	.	*			trans	-58.6	120	179.8	-57.7	-177.5	-173.3	-176.1	0	109.9	D776 F787 Y791 F796	D776-K778 PolarHBondContact O-N 3.12Å; K778-F787 HydrophobicContact CB-CB 4.31Å; K778-F787 PolarHBondContact O-N 3.5Å; K778-Y791 PolarHBondContact NZ-O 2.84Å; K778-F796 HydrophobicContact CB-CD2 4.05Å; K778-F796 HydrophobicContact CB-CE2 3.89Å; K778-F796 HydrophobicContact CB-CZ 4.21Å; K778-F796 HydrophobicContact CD-CG 4.28Å
779	R	73.2	Confident	58	Low	150 Å²	150	102.3 Å²	102.3	57%	0.566	55%	0.548	S	S	*	.	B	Isolated β-bridge	trans	-117.3	133.6	177	-50.9	-165.4	-174.8	-157.4	2.2	110	M777 P781 V785 I786 F796	M777-R779 WeakPolarHBondContact O-CG 3.35Å; M777-R779 PolarHBondContact O-N 3.2Å; R779-P781 WeakPolarHBondContact O-CD 3.45Å; R779-V785 WeakPolarHBondContact CA-O 2.95Å; R779-I786 HydrophobicContact CG-CG1 4.09Å; R779-I786 HydrophobicContact CG-CG2 4.37Å; R779-F796 WeakPolarHBondContact O-CZ 3.32Å
780	C	76.9	Confident	59.7	Low	1 Å²	1	101.1 Å²	101.1	1%	0.007	55%	0.55	C	S	.	.			trans	-71.1	124.2	170	-177.7	0	0	0	0	109.4	L782 C783 E784 V785 F787	C780-L782 PolarHBondContact O-N 3.37Å; C780-C783 VanDerWaalsContact CB-SG 3.56Å; C780-E784 VanDerWaalsContact O-CA 3.25Å; C780-E784 WeakPolarHBondContact O-CA 3.39Å; C780-E784 PolarHBondContact O-N 2.92Å; C780-V785 PolarHBondContact N-O 2.92Å; C780-F787 HydrophobicContact CB-CE2 4.34Å
781	P	64.8	Low	61.7	Low	106 Å²	106	99.2 Å²	99.2	69%	0.688	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-5.6	-176.8	29.7	-34.6	0	0	0	114.2	R779	R779-P781 WeakPolarHBondContact O-CD 3.45Å
782	L	68.7	Low	63.8	Low	84 Å²	84	95.1 Å²	95.1	44%	0.44	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-23.2	-173.6	-61.1	168.8	0	0	0	113.3	C780 H803 W804	C780-L782 PolarHBondContact O-N 3.37Å; L782-H803 HydrophobicContact CB-CB 4.16Å; L782-H803 HydrophobicContact CD1-CB 3.49Å; L782-H803 VanDerWaalsContact CD1-CB 3.49Å; L782-H803 HydrophobicContact CG-CB 4.45Å; L782-W804 HydrophobicContact CD1-CZ2 3.77Å; L782-W804 HydrophobicContact CD2-CZ2 4.34Å
783	C	73.8	Confident	66	Low	49 Å²	49	91.7 Å²	91.7	33%	0.331	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.2	6.9	178.9	66.9	0	0	0	0	113.9	C780 V785 H799	C780-C783 VanDerWaalsContact CB-SG 3.56Å; C783-V785 HydrophobicContact CB-CG2 4.37Å; C783-V785 PolarHBondContact O-N 3.19Å; C783-V785 VanDerWaalsContact SG-CG2 3.51Å; C783-H799 PolarHBondContact SG-NE2 2.71Å; C783-H799 VanDerWaalsContact SG-NE2 3.36Å
784	E	66.9	Low	67.8	Low	162 Å²	162	89.3 Å²	89.3	76%	0.757	47%	0.474	S	S	*	.			trans	55.2	6	-176.9	-58.4	-161.5	162.7	0	0	116.9	C780 I786	C780-E784 VanDerWaalsContact O-CA 3.25Å; C780-E784 WeakPolarHBondContact O-CA 3.39Å; C780-E784 PolarHBondContact O-N 2.92Å; E784-I786 WeakPolarHBondContact O-CG1 3.48Å; E784-I786 PolarHBondContact O-N 3.25Å
785	V	75.6	Confident	69.5	Low	68 Å²	68	90.5 Å²	90.5	41%	0.412	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-59.4	127.1	179.5	176.9	0	0	0	0	110.6	R779 C780 C783 F787	R779-V785 WeakPolarHBondContact CA-O 2.95Å; C780-V785 PolarHBondContact N-O 2.92Å; C783-V785 HydrophobicContact CB-CG2 4.37Å; C783-V785 PolarHBondContact O-N 3.19Å; C783-V785 VanDerWaalsContact SG-CG2 3.51Å; V785-F787 HydrophobicContact CB-CE2 3.94Å; V785-F787 HydrophobicContact CB-CZ 4.35Å; V785-F787 HydrophobicContact CG1-CD2 4.17Å; V785-F787 HydrophobicContact CG1-CE1 4.35Å; V785-F787 HydrophobicContact CG1-CE2 3.55Å; V785-F787 HydrophobicContact CG1-CZ 3.66Å; V785-F787 WeakPolarHBondContact O-CD2 3.43Å
786	I	76.2	Confident	71	Confident	80 Å²	80	83 Å²	83	41%	0.41	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-99.6	118.1	-176.3	-51.9	-177.2	0	0	0	109.4	M777 R779 E784	M777-I786 HydrophobicContact CB-CG2 3.93Å; M777-I786 HydrophobicContact CE-CG2 3.59Å; R779-I786 HydrophobicContact CG-CG1 4.09Å; R779-I786 HydrophobicContact CG-CG2 4.37Å; E784-I786 WeakPolarHBondContact O-CG1 3.48Å; E784-I786 PolarHBondContact O-N 3.25Å
787	F	78.1	Confident	72.3	Confident	23 Å²	23	81.8 Å²	81.8	10%	0.101	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-98.6	150.3	178.2	-63.4	-95.4	0	0	0	111	K778 C780 V785 Y791 F796 H799	K778-F787 HydrophobicContact CB-CB 4.31Å; K778-F787 PolarHBondContact O-N 3.5Å; C780-F787 HydrophobicContact CB-CE2 4.34Å; V785-F787 HydrophobicContact CB-CE2 3.94Å; V785-F787 HydrophobicContact CB-CZ 4.35Å; V785-F787 HydrophobicContact CG1-CD2 4.17Å; V785-F787 HydrophobicContact CG1-CE1 4.35Å; V785-F787 HydrophobicContact CG1-CE2 3.55Å; V785-F787 HydrophobicContact CG1-CZ 3.66Å; V785-F787 WeakPolarHBondContact O-CD2 3.43Å; F787-Y791 HydrophobicContact CB-CD1 4.24Å; F787-Y791 HydrophobicContact CB-CG 4.01Å; F787-Y791 AromaticContact CD1-CD1 3.69Å; F787-Y791 HydrophobicContact CD1-CD1 3.69Å; F787-Y791 AromaticContact CD1-CD2 3.96Å; F787-Y791 HydrophobicContact CD1-CD2 3.96Å; F787-Y791 AromaticContact CD1-CE1 3.58Å; F787-Y791 HydrophobicContact CD1-CE1 3.58Å; F787-Y791 AromaticContact CD1-CE2 3.88Å; F787-Y791 HydrophobicContact CD1-CE2 3.88Å; F787-Y791 AromaticContact CD1-CG 3.87Å; F787-Y791 HydrophobicContact CD1-CG 3.87Å; F787-Y791 AromaticContact CD1-CZ 3.69Å; F787-Y791 HydrophobicContact CE1-CD1 4.41Å; F787-Y791 AromaticContact CE1-CE1 3.87Å; F787-Y791 HydrophobicContact CE1-CE1 3.87Å; F787-Y791 HydrophobicContact CE1-CE2 4.37Å; F787-Y791 AromaticContact CE1-CZ 3.85Å; F787-Y791 HydrophobicContact CG-CD1 4.2Å; F787-Y791 HydrophobicContact CG-CE1 4.46Å; F787-Y791 HydrophobicContact CG-CG 4.34Å; F787-F796 AromaticContact CD2-CD2 3.71Å; F787-F796 HydrophobicContact CD2-CD2 3.71Å; F787-F796 AromaticContact CD2-CE2 3.81Å; F787-F796 HydrophobicContact CD2-CE2 3.81Å; F787-F796 HydrophobicContact CE2-CD2 4.09Å; F787-F796 HydrophobicContact CE2-CE2 4.18Å; F787-F796 HydrophobicContact CG-CD2 4.16Å; F787-H799 AromaticContact CE2-CD2 3.57Å; F787-H799 AromaticContact CE2-NE2 3.89Å; F787-H799 HydrophobicContact CZ-CB 4.36Å; F787-H799 AromaticContact CZ-CD2 3.44Å; F787-H799 VanDerWaalsContact CZ-CD2 3.44Å; F787-H799 WeakPolarHBondContact CZ-CD2 3.34Å; F787-H799 AromaticContact CZ-CG 3.71Å; F787-H799 AromaticContact CZ-NE2 3.76Å
788	P	72.1	Confident	73.2	Confident	78 Å²	78	83 Å²	83	51%	0.506	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-56.7	150.8	173.1	-25.5	34.5	0	0	0	112.4	N790 Y791	P788-N790 PolarHBondContact O-N 3Å; P788-N790 VanDerWaalsContact O-N 3.14Å; P788-Y791 WeakPolarHBondContact O-CB 3.36Å; P788-Y791 PolarHBondContact O-N 2.71Å
789	P	62.8	Low	73.9	Confident	66 Å²	66	82.8 Å²	82.8	43%	0.429	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-34.8	177.9	-25.7	34.7	0	0	0	113.1	M777 Y791	M777-P789 HydrophobicContact CG-CG 4.38Å; P789-Y791 VanDerWaalsContact C-N 3.26Å; P789-Y791 PolarHBondContact O-N 3.05Å
790	N	68.3	Low	74	Confident	159 Å²	159	77.3 Å²	77.3	85%	0.85	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	8	-179.8	-52.2	14.3	0	0	0	113.3	P788	P788-N790 PolarHBondContact O-N 3Å; P788-N790 VanDerWaalsContact O-N 3.14Å
791	Y	78.2	Confident	73.8	Confident	83 Å²	83	83.7 Å²	83.7	33%	0.325	44%	0.439	S	S	.	.	S	Bend	trans	-70	137.5	-178.5	-164.7	-96	0	0	0	110.9	K778 F787 P788 P789 Q793 K795 F796	K778-Y791 PolarHBondContact NZ-O 2.84Å; F787-Y791 HydrophobicContact CB-CD1 4.24Å; F787-Y791 HydrophobicContact CB-CG 4.01Å; F787-Y791 AromaticContact CD1-CD1 3.69Å; F787-Y791 HydrophobicContact CD1-CD1 3.69Å; F787-Y791 AromaticContact CD1-CD2 3.96Å; F787-Y791 HydrophobicContact CD1-CD2 3.96Å; F787-Y791 AromaticContact CD1-CE1 3.58Å; F787-Y791 HydrophobicContact CD1-CE1 3.58Å; F787-Y791 AromaticContact CD1-CE2 3.88Å; F787-Y791 HydrophobicContact CD1-CE2 3.88Å; F787-Y791 AromaticContact CD1-CG 3.87Å; F787-Y791 HydrophobicContact CD1-CG 3.87Å; F787-Y791 AromaticContact CD1-CZ 3.69Å; F787-Y791 HydrophobicContact CE1-CD1 4.41Å; F787-Y791 AromaticContact CE1-CE1 3.87Å; F787-Y791 HydrophobicContact CE1-CE1 3.87Å; F787-Y791 HydrophobicContact CE1-CE2 4.37Å; F787-Y791 AromaticContact CE1-CZ 3.85Å; F787-Y791 HydrophobicContact CG-CD1 4.2Å; F787-Y791 HydrophobicContact CG-CE1 4.46Å; F787-Y791 HydrophobicContact CG-CG 4.34Å; P788-Y791 WeakPolarHBondContact O-CB 3.36Å; P788-Y791 PolarHBondContact O-N 2.71Å; P789-Y791 VanDerWaalsContact C-N 3.26Å; P789-Y791 PolarHBondContact O-N 3.05Å; Y791-Q793 PolarHBondContact O-N 2.87Å; Y791-K795 HydrophobicContact CE1-CB 3.71Å; Y791-F796 HydrophobicContact CD1-CB 4.21Å
792	D	77.6	Confident	74.1	Confident	83 Å²	83	81.9 Å²	81.9	44%	0.444	43%	0.429	S	S	.	.			trans	-55.6	127.3	-174.9	-171.1	-3.2	0	0	0	111.1	K795 F796	D792-K795 HydrophobicContact CB-CB 4.17Å; D792-K795 HydrophobicContact CB-CD 4.09Å; D792-K795 HydrophobicContact CB-CG 4Å; D792-K795 PolarHBondContact O-N 2.77Å; D792-K795 VanDerWaalsContact OD2-CE 3.27Å; D792-K795 WeakPolarHBondContact OD2-CE 3.11Å; D792-F796 PolarHBondContact O-N 2.64Å
793	Q	76.6	Confident	74.2	Confident	77 Å²	77	79.4 Å²	79.4	36%	0.36	42%	0.416	S	S	.	.	H	α-helix	trans	-66.3	-43.7	-171.6	-176.3	61.3	20.6	0	0	111.2	Y791 K795 F796 E797	Y791-Q793 PolarHBondContact O-N 2.87Å; Q793-K795 PolarHBondContact O-N 3.44Å; Q793-F796 WeakPolarHBondContact O-CB 3.24Å; Q793-F796 PolarHBondContact O-N 3.44Å; Q793-F796 VanDerWaalsContact O-N 3.11Å; Q793-E797 WeakPolarHBondContact CG-OE1 3.47Å; Q793-E797 PolarHBondContact NE2-OE1 3.24Å; Q793-E797 WeakPolarHBondContact O-CG 3.45Å; Q793-E797 PolarHBondContact O-N 3.13Å
794	S	76.2	Confident	74.3	Confident	77 Å²	77	81.1 Å²	81.1	54%	0.538	42%	0.415	S	S	.	.	H	α-helix	trans	-60.4	-31.1	177.9	174.5	0	0	0	0	112.3	E798	S794-E798 VanDerWaalsContact O-CB 3.26Å; S794-E798 WeakPolarHBondContact O-CB 3.28Å; S794-E798 PolarHBondContact O-N 3.35Å
795	K	74.7	Confident	74.7	Confident	103 Å²	103	75.3 Å²	75.3	45%	0.448	39%	0.387	S	S	.	.	H	α-helix	trans	-84.6	-25.5	179	-57.2	-170.5	-177.6	-168.8	0	113	Y791 D792 Q793 H799	Y791-K795 HydrophobicContact CE1-CB 3.71Å; D792-K795 HydrophobicContact CB-CB 4.17Å; D792-K795 HydrophobicContact CB-CD 4.09Å; D792-K795 HydrophobicContact CB-CG 4Å; D792-K795 PolarHBondContact O-N 2.77Å; D792-K795 VanDerWaalsContact OD2-CE 3.27Å; D792-K795 WeakPolarHBondContact OD2-CE 3.11Å; Q793-K795 PolarHBondContact O-N 3.44Å; K795-H799 VanDerWaalsContact O-CB 3.25Å; K795-H799 WeakPolarHBondContact O-CB 3.38Å; K795-H799 PolarHBondContact O-N 2.78Å
796	F	78.8	Confident	74.9	Confident	26 Å²	26	76.2 Å²	76.2	11%	0.114	39%	0.389	C	S	.	.	H	α-helix	trans	-70.7	-39.9	168.1	-179.9	-102.4	0	0	0	110.6	K778 R779 F787 Y791 D792 Q793 H799 V800	K778-F796 HydrophobicContact CB-CD2 4.05Å; K778-F796 HydrophobicContact CB-CE2 3.89Å; K778-F796 HydrophobicContact CB-CZ 4.21Å; K778-F796 HydrophobicContact CD-CG 4.28Å; R779-F796 WeakPolarHBondContact O-CZ 3.32Å; F787-F796 AromaticContact CD2-CD2 3.71Å; F787-F796 HydrophobicContact CD2-CD2 3.71Å; F787-F796 AromaticContact CD2-CE2 3.81Å; F787-F796 HydrophobicContact CD2-CE2 3.81Å; F787-F796 HydrophobicContact CE2-CD2 4.09Å; F787-F796 HydrophobicContact CE2-CE2 4.18Å; F787-F796 HydrophobicContact CG-CD2 4.16Å; Y791-F796 HydrophobicContact CD1-CB 4.21Å; D792-F796 PolarHBondContact O-N 2.64Å; Q793-F796 WeakPolarHBondContact O-CB 3.24Å; Q793-F796 PolarHBondContact O-N 3.44Å; Q793-F796 VanDerWaalsContact O-N 3.11Å; F796-H799 PolarHBondContact O-N 2.91Å; F796-V800 HydrophobicContact CD1-CG2 4.46Å; F796-V800 HydrophobicContact CE1-CG2 4.04Å; F796-V800 HydrophobicContact CE2-CG2 4.39Å; F796-V800 HydrophobicContact CZ-CG2 4Å; F796-V800 WeakPolarHBondContact O-CG2 3.27Å; F796-V800 PolarHBondContact O-N 2.81Å
797	E	75.8	Confident	75.2	Confident	91 Å²	91	72.4 Å²	72.4	43%	0.425	37%	0.37	S	S	.	.	H	α-helix	trans	-66.1	-51.5	174.6	-74.1	158.6	178.5	0	0	111.1	Q793 H799 V800 E801	Q793-E797 WeakPolarHBondContact CG-OE1 3.47Å; Q793-E797 PolarHBondContact NE2-OE1 3.24Å; Q793-E797 WeakPolarHBondContact O-CG 3.45Å; Q793-E797 PolarHBondContact O-N 3.13Å; E797-H799 PolarHBondContact O-N 3.32Å; E797-V800 CarbonylContact O-C 3.6Å; E797-V800 PolarHBondContact O-N 2.83Å; E797-E801 WeakPolarHBondContact O-CB 3.43Å; E797-E801 WeakPolarHBondContact O-CG 3.45Å; E797-E801 PolarHBondContact O-N 3.47Å
798	E	77.6	Confident	74.9	Confident	126 Å²	126	76.2 Å²	76.2	59%	0.589	40%	0.396	S	S	*	.	H	α-helix	trans	-51	-42.4	171.3	-179.7	-176.5	-158.6	0	0	112	S794 S802	S794-E798 VanDerWaalsContact O-CB 3.26Å; S794-E798 WeakPolarHBondContact O-CB 3.28Å; S794-E798 PolarHBondContact O-N 3.35Å; E798-S802 WeakPolarHBondContact O-CB 3.43Å; E798-S802 PolarHBondContact O-N 3.29Å
799	H	79.4	Confident	75.1	Confident	46 Å²	46	77 Å²	77	21%	0.213	39%	0.394	C	S	.	.	H	α-helix	trans	-66.6	-41.5	174.9	176.6	69.4	0	0	0	113.1	C783 F787 K795 F796 E797 S802 H803	C783-H799 PolarHBondContact SG-NE2 2.71Å; C783-H799 VanDerWaalsContact SG-NE2 3.36Å; F787-H799 AromaticContact CE2-CD2 3.57Å; F787-H799 AromaticContact CE2-NE2 3.89Å; F787-H799 HydrophobicContact CZ-CB 4.36Å; F787-H799 AromaticContact CZ-CD2 3.44Å; F787-H799 VanDerWaalsContact CZ-CD2 3.44Å; F787-H799 WeakPolarHBondContact CZ-CD2 3.34Å; F787-H799 AromaticContact CZ-CG 3.71Å; F787-H799 AromaticContact CZ-NE2 3.76Å; K795-H799 VanDerWaalsContact O-CB 3.25Å; K795-H799 WeakPolarHBondContact O-CB 3.38Å; K795-H799 PolarHBondContact O-N 2.78Å; F796-H799 PolarHBondContact O-N 2.91Å; E797-H799 PolarHBondContact O-N 3.32Å; H799-S802 PolarHBondContact O-N 3.49Å; H799-S802 PolarHBondContact O-OG 3.33Å; H799-H803 AromaticContact CD2-NE2 3.93Å; H799-H803 AromaticContact CE1-NE2 3.34Å; H799-H803 PolarHBondContact CE1-NE2 3.17Å; H799-H803 VanDerWaalsContact CE1-NE2 3.34Å; H799-H803 AromaticContact NE2-NE2 3.24Å; H799-H803 PolarHBondContact NE2-NE2 3.04Å; H799-H803 PolarHBondContact O-CD2 3.43Å; H799-H803 PolarHBondContact O-NE2 3.24Å
800	V	74.6	Confident	76.1	Confident	35 Å²	35	76.2 Å²	76.2	21%	0.212	39%	0.39	C	S	.	.	H	α-helix	trans	-67.9	-41.1	177.1	170.2	0	0	0	0	111.1	F796 E797 S802 H803 W804	F796-V800 HydrophobicContact CD1-CG2 4.46Å; F796-V800 HydrophobicContact CE1-CG2 4.04Å; F796-V800 HydrophobicContact CE2-CG2 4.39Å; F796-V800 HydrophobicContact CZ-CG2 4Å; F796-V800 WeakPolarHBondContact O-CG2 3.27Å; F796-V800 PolarHBondContact O-N 2.81Å; E797-V800 CarbonylContact O-C 3.6Å; E797-V800 PolarHBondContact O-N 2.83Å; V800-S802 VanDerWaalsContact C-N 3.31Å; V800-S802 PolarHBondContact O-N 3.47Å; V800-H803 PolarHBondContact O-N 3.5Å; V800-W804 VanDerWaalsContact O-CD1 3.24Å; V800-W804 PolarHBondContact O-NE1 3.25Å
801	E	73.8	Confident	76.5	Confident	135 Å²	135	72.9 Å²	72.9	63%	0.631	38%	0.379	S	S	*	.	H	α-helix	trans	-63.9	-34.6	176.4	-71.3	179.2	169.8	0	0	111.8	E797 H803 W804	E797-E801 WeakPolarHBondContact O-CB 3.43Å; E797-E801 WeakPolarHBondContact O-CG 3.45Å; E797-E801 PolarHBondContact O-N 3.47Å; E801-H803 PolarHBondContact O-N 3.39Å; E801-W804 PolarHBondContact O-N 2.88Å
802	S	71.3	Confident	76.4	Confident	69 Å²	69	74.2 Å²	74.2	48%	0.483	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-14.3	176.3	78.1	0	0	0	0	115	E798 H799 V800 W804 L816	E798-S802 WeakPolarHBondContact O-CB 3.43Å; E798-S802 PolarHBondContact O-N 3.29Å; H799-S802 PolarHBondContact O-N 3.49Å; H799-S802 PolarHBondContact O-OG 3.33Å; V800-S802 VanDerWaalsContact C-N 3.31Å; V800-S802 PolarHBondContact O-N 3.47Å; S802-W804 VanDerWaalsContact C-N 3.34Å; S802-L816 WeakPolarHBondContact O-CD1 3.39Å
803	H	68.9	Low	76.5	Confident	32 Å²	32	76.1 Å²	76.1	15%	0.148	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	5.6	175.4	-63	-77.9	0	0	0	114.5	L782 H799 V800 E801 L816	L782-H803 HydrophobicContact CB-CB 4.16Å; L782-H803 HydrophobicContact CD1-CB 3.49Å; L782-H803 VanDerWaalsContact CD1-CB 3.49Å; L782-H803 HydrophobicContact CG-CB 4.45Å; H799-H803 AromaticContact CD2-NE2 3.93Å; H799-H803 AromaticContact CE1-NE2 3.34Å; H799-H803 PolarHBondContact CE1-NE2 3.17Å; H799-H803 VanDerWaalsContact CE1-NE2 3.34Å; H799-H803 AromaticContact NE2-NE2 3.24Å; H799-H803 PolarHBondContact NE2-NE2 3.04Å; H799-H803 PolarHBondContact O-CD2 3.43Å; H799-H803 PolarHBondContact O-NE2 3.24Å; V800-H803 PolarHBondContact O-N 3.5Å; E801-H803 PolarHBondContact O-N 3.39Å; H803-L816 WeakPolarHBondContact O-CB 3.28Å; H803-L816 PolarHBondContact O-N 3.43Å
804	W	76.7	Confident	76.5	Confident	84 Å²	84	74 Å²	74	32%	0.318	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.8	-178.9	-54	85	0	0	0	112.7	L782 V800 E801 S802 Q813 F814 P815	L782-W804 HydrophobicContact CD1-CZ2 3.77Å; L782-W804 HydrophobicContact CD2-CZ2 4.34Å; V800-W804 VanDerWaalsContact O-CD1 3.24Å; V800-W804 PolarHBondContact O-NE1 3.25Å; E801-W804 PolarHBondContact O-N 2.88Å; S802-W804 VanDerWaalsContact C-N 3.34Å; W804-Q813 HydrophobicContact CE3-CB 4Å; W804-F814 CarbonylContact C-O 3.6Å; W804-F814 VanDerWaalsContact CA-O 3.31Å; W804-F814 WeakPolarHBondContact CA-O 3.31Å; W804-P815 HydrophobicContact CE3-CG 4.39Å; W804-P815 HydrophobicContact CZ3-CG 3.94Å
805	K	75.6	Confident	76.4	Confident	40 Å²	40	73 Å²	73	17%	0.174	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	123.6	163.1	-57	175.8	-172.9	171.2	0	107.9	F814 L816 C818 F823	K805-F814 HydrophobicContact CB-CB 4.38Å; K805-F814 PolarHBondContact N-O 3.26Å; K805-F814 PolarHBondContact O-N 3.39Å; K805-L816 WeakPolarHBondContact CE-O 3.18Å; K805-L816 HydrophobicContact CG-CD2 4.1Å; K805-L816 PolarHBondContact NZ-O 2.77Å; K805-C818 PolarHBondContact NZ-O 2.88Å; K805-F823 HydrophobicContact CB-CD2 3.95Å; K805-F823 HydrophobicContact CB-CE1 4.48Å; K805-F823 HydrophobicContact CB-CE2 3.69Å; K805-F823 HydrophobicContact CB-CG 4.45Å; K805-F823 HydrophobicContact CB-CZ 3.97Å; K805-F823 HydrophobicContact CD-CD1 4.37Å; K805-F823 HydrophobicContact CD-CD2 4.47Å; K805-F823 HydrophobicContact CD-CG 4.22Å
806	I	79.8	Confident	76	Confident	88 Å²	88	72.4 Å²	72.4	45%	0.451	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.9	-179.8	-51.8	-175.2	0	0	0	108.9	P808 Q813	I806-P808 WeakPolarHBondContact O-CD 3.28Å; I806-Q813 HydrophobicContact CG1-CG 4.29Å
807	C	81.8	Confident	75.5	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	41%	0.409	C	S	.	.			trans	-69.9	121.6	174.9	176.8	0	0	0	0	110.3	M809 C810 S811 E812 F814 F823 H826 V827	C807-M809 PolarHBondContact O-N 3.21Å; C807-M809 VanDerWaalsContact O-N 3.16Å; C807-C810 VanDerWaalsContact CB-SG 3.59Å; C807-C810 PolarHBondContact SG-SG 2.76Å; C807-S811 VanDerWaalsContact O-CA 3.29Å; C807-S811 WeakPolarHBondContact O-CA 3.45Å; C807-S811 PolarHBondContact O-N 2.99Å; C807-E812 PolarHBondContact N-O 2.97Å; C807-F814 HydrophobicContact CB-CE2 4.19Å; C807-F823 HydrophobicContact CB-CE2 4.39Å; C807-H826 VanDerWaalsContact CB-NE2 3.3Å; C807-H826 WeakPolarHBondContact CB-NE2 3.21Å; C807-H826 PolarHBondContact SG-CD2 2.68Å; C807-H826 PolarHBondContact SG-NE2 3.45Å; C807-V827 HydrophobicContact CB-CG2 4.46Å
808	P	72.9	Confident	75.3	Confident	102 Å²	102	75.1 Å²	75.1	66%	0.662	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-12	-175.7	28.8	-35.9	0	0	0	114	I806	I806-P808 WeakPolarHBondContact O-CD 3.28Å
809	M	76.8	Confident	75.1	Confident	95 Å²	95	73.6 Å²	73.6	47%	0.468	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-22.4	-175.4	-58.6	-58.6	-70.3	0	0	113.8	C807 H830 F831	C807-M809 PolarHBondContact O-N 3.21Å; C807-M809 VanDerWaalsContact O-N 3.16Å; M809-H830 HydrophobicContact CB-CB 3.87Å; M809-H830 HydrophobicContact CE-CB 4.14Å; M809-H830 HydrophobicContact CG-CB 3.87Å; M809-F831 HydrophobicContact CE-CZ 4.14Å; M809-F831 HydrophobicContact CG-CE2 4.18Å; M809-F831 HydrophobicContact CG-CZ 4.43Å; M809-F831 HydrophobicContact SD-CE2 4.27Å; M809-F831 HydrophobicContact SD-CZ 3.92Å
810	C	81.8	Confident	75	Confident	49 Å²	49	75.5 Å²	75.5	33%	0.331	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.6	-5.8	-174.7	66.1	0	0	0	0	114.6	C807 E812 H826	C807-C810 VanDerWaalsContact CB-SG 3.59Å; C807-C810 PolarHBondContact SG-SG 2.76Å; C810-E812 PolarHBondContact O-N 2.7Å; C810-H826 PolarHBondContact SG-NE2 2.65Å
811	S	77	Confident	75.1	Confident	90 Å²	90	80.6 Å²	80.6	63%	0.629	42%	0.422	S	S	*	.			trans	62.3	16.9	-175.9	-53.5	0	0	0	0	115.9	C807	C807-S811 VanDerWaalsContact O-CA 3.29Å; C807-S811 WeakPolarHBondContact O-CA 3.45Å; C807-S811 PolarHBondContact O-N 2.99Å
812	E	76.4	Confident	75.3	Confident	111 Å²	111	77.9 Å²	77.9	52%	0.519	41%	0.414	S	S	.	.			trans	-64.3	136.6	169.5	-73.5	-173.1	178.8	0	0	110.9	C807 C810 F814 H826	C807-E812 PolarHBondContact N-O 2.97Å; C810-E812 PolarHBondContact O-N 2.7Å; E812-F814 HydrophobicContact CB-CE2 3.77Å; E812-F814 HydrophobicContact CB-CZ 4.29Å; E812-H826 IonicContact OE2-CE1 2.86Å; E812-H826 PolarHBondContact OE2-CE1 3.45Å; E812-H826 IonicContact OE2-ND1 3.75Å; E812-H826 IonicContact OE2-NE2 2.66Å
813	Q	79.2	Confident	75.7	Confident	123 Å²	123	76 Å²	76	58%	0.575	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	124.7	-176	-60.2	-176.2	-8	0	0	110.5	W804 I806	W804-Q813 HydrophobicContact CE3-CB 4Å; I806-Q813 HydrophobicContact CG1-CG 4.29Å
814	F	77.4	Confident	76.2	Confident	32 Å²	32	78.6 Å²	78.6	14%	0.14	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.1	178.7	-64.1	-97.4	0	0	0	109.3	W804 K805 C807 E812 C818 F823 H826	W804-F814 CarbonylContact C-O 3.6Å; W804-F814 VanDerWaalsContact CA-O 3.31Å; W804-F814 WeakPolarHBondContact CA-O 3.31Å; K805-F814 HydrophobicContact CB-CB 4.38Å; K805-F814 PolarHBondContact N-O 3.26Å; K805-F814 PolarHBondContact O-N 3.39Å; C807-F814 HydrophobicContact CB-CE2 4.19Å; E812-F814 HydrophobicContact CB-CE2 3.77Å; E812-F814 HydrophobicContact CB-CZ 4.29Å; F814-C818 HydrophobicContact CB-CB 4.22Å; F814-F823 HydrophobicContact CB-CD2 4.07Å; F814-F823 AromaticContact CD2-CD2 3.61Å; F814-F823 HydrophobicContact CD2-CD2 3.61Å; F814-F823 AromaticContact CD2-CE2 3.82Å; F814-F823 HydrophobicContact CD2-CE2 3.82Å; F814-F823 HydrophobicContact CE2-CD2 4.23Å; F814-F823 HydrophobicContact CE2-CE2 4.42Å; F814-F823 AromaticContact CG-CD2 3.82Å; F814-F823 HydrophobicContact CG-CD2 3.82Å; F814-F823 HydrophobicContact CG-CE2 4.41Å; F814-H826 AromaticContact CE2-CD2 3.58Å; F814-H826 AromaticContact CE2-NE2 3.65Å; F814-H826 HydrophobicContact CZ-CB 4.11Å; F814-H826 AromaticContact CZ-CD2 3.56Å; F814-H826 AromaticContact CZ-CE1 3.78Å; F814-H826 AromaticContact CZ-CG 3.5Å; F814-H826 AromaticContact CZ-ND1 3.66Å; F814-H826 AromaticContact CZ-NE2 3.74Å
815	P	74.1	Confident	76.4	Confident	55 Å²	55	79.5 Å²	79.5	36%	0.357	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	147.8	172.3	-27.8	36.7	0	0	0	112.6	W804 D817 C818	W804-P815 HydrophobicContact CE3-CG 4.39Å; W804-P815 HydrophobicContact CZ3-CG 3.94Å; P815-D817 WeakPolarHBondContact CB-OD1 3.31Å; P815-D817 PolarHBondContact O-N 2.68Å; P815-C818 WeakPolarHBondContact O-CB 3.26Å; P815-C818 PolarHBondContact O-N 3.19Å
816	L	67.3	Low	76.7	Confident	91 Å²	91	79.2 Å²	79.2	48%	0.476	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-35	178.3	-102.2	-172.7	0	0	0	113.4	S802 H803 K805 C818	S802-L816 WeakPolarHBondContact O-CD1 3.39Å; H803-L816 WeakPolarHBondContact O-CB 3.28Å; H803-L816 PolarHBondContact O-N 3.43Å; K805-L816 WeakPolarHBondContact CE-O 3.18Å; K805-L816 HydrophobicContact CG-CD2 4.1Å; K805-L816 PolarHBondContact NZ-O 2.77Å; L816-C818 VanDerWaalsContact C-N 3.28Å; L816-C818 PolarHBondContact O-N 2.75Å
817	D	66.6	Low	76.7	Confident	146 Å²	146	76.3 Å²	76.3	78%	0.781	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-3.9	179	67	-49.2	0	0	0	113.8	P815 D819	P815-D817 WeakPolarHBondContact CB-OD1 3.31Å; P815-D817 PolarHBondContact O-N 2.68Å; D817-D819 PolarHBondContact O-N 2.73Å
818	C	73	Confident	76.5	Confident	29 Å²	29	80.9 Å²	80.9	20%	0.196	43%	0.43	C	S	.	.	S	Bend	trans	-56.5	127.3	169.5	-174	0	0	0	0	110.1	K805 F814 P815 L816 Q820	K805-C818 PolarHBondContact NZ-O 2.88Å; F814-C818 HydrophobicContact CB-CB 4.22Å; P815-C818 WeakPolarHBondContact O-CB 3.26Å; P815-C818 PolarHBondContact O-N 3.19Å; L816-C818 VanDerWaalsContact C-N 3.28Å; L816-C818 PolarHBondContact O-N 2.75Å; C818-Q820 PolarHBondContact O-N 3.19Å; C818-Q820 VanDerWaalsContact O-N 3.16Å
819	D	73.8	Confident	76.6	Confident	94 Å²	94	80.6 Å²	80.6	50%	0.503	43%	0.427	S	S	.	.			trans	-48.3	124	177.5	177.9	-2.9	0	0	0	109	D817 K821 V822 F823	D817-D819 PolarHBondContact O-N 2.73Å; D819-K821 PolarHBondContact O-N 3.11Å; D819-K821 PolarHBondContact OD1-N 3.39Å; D819-V822 HydrophobicContact CB-CB 4.44Å; D819-V822 HydrophobicContact CB-CG2 3.99Å; D819-V822 WeakPolarHBondContact O-CA 3.45Å; D819-V822 WeakPolarHBondContact O-CB 3.31Å; D819-V822 PolarHBondContact O-N 3.27Å; D819-F823 PolarHBondContact O-N 2.7Å
820	Q	76.8	Confident	76.5	Confident	85 Å²	85	79.7 Å²	79.7	40%	0.397	42%	0.421	S	S	.	.	H	α-helix	trans	-52.1	-34.7	-177.9	-172.8	60.3	20.9	0	0	111.6	C818 V822 F823 E824	C818-Q820 PolarHBondContact O-N 3.19Å; C818-Q820 VanDerWaalsContact O-N 3.16Å; Q820-V822 VanDerWaalsContact C-N 3.35Å; Q820-V822 PolarHBondContact O-N 3.45Å; Q820-F823 PolarHBondContact O-N 3.48Å; Q820-E824 HydrophobicContact CG-CG 4.45Å; Q820-E824 VanDerWaalsContact CG-OE1 3.24Å; Q820-E824 WeakPolarHBondContact CG-OE1 3.5Å; Q820-E824 PolarHBondContact NE2-OE1 3.45Å; Q820-E824 VanDerWaalsContact O-CB 3.29Å; Q820-E824 WeakPolarHBondContact O-CB 3.38Å; Q820-E824 VanDerWaalsContact O-CG 3.25Å; Q820-E824 WeakPolarHBondContact O-CG 3.19Å; Q820-E824 PolarHBondContact O-N 3.39Å
821	K	76.3	Confident	75.8	Confident	143 Å²	143	83.2 Å²	83.2	62%	0.622	43%	0.431	S	S	*	.	H	α-helix	trans	-71.3	-24.6	177.2	-65.2	178.6	179.1	177	0	114.3	D819 N825	D819-K821 PolarHBondContact O-N 3.11Å; D819-K821 PolarHBondContact OD1-N 3.39Å; K821-N825 VanDerWaalsContact O-CB 3.23Å; K821-N825 WeakPolarHBondContact O-CB 3.23Å; K821-N825 VanDerWaalsContact O-CG 3.3Å; K821-N825 PolarHBondContact O-N 3.4Å; K821-N825 PolarHBondContact O-ND2 3.2Å
822	V	77.1	Confident	74.7	Confident	77 Å²	77	86 Å²	86	47%	0.467	44%	0.439	S	S	.	.	H	α-helix	trans	-78.2	-43.9	175.8	176.7	0	0	0	0	109.6	D819 Q820 H826	D819-V822 HydrophobicContact CB-CB 4.44Å; D819-V822 HydrophobicContact CB-CG2 3.99Å; D819-V822 WeakPolarHBondContact O-CA 3.45Å; D819-V822 WeakPolarHBondContact O-CB 3.31Å; D819-V822 PolarHBondContact O-N 3.27Å; Q820-V822 VanDerWaalsContact C-N 3.35Å; Q820-V822 PolarHBondContact O-N 3.45Å; V822-H826 WeakPolarHBondContact O-CB 3.39Å; V822-H826 PolarHBondContact O-N 3.02Å
823	F	81.4	Confident	73.5	Confident	29 Å²	29	83.5 Å²	83.5	13%	0.127	44%	0.443	C	S	.	.	H	α-helix	trans	-61.2	-48.1	172.1	-178	-103.7	0	0	0	111.7	K805 C807 F814 D819 Q820 H826 V827	K805-F823 HydrophobicContact CB-CD2 3.95Å; K805-F823 HydrophobicContact CB-CE1 4.48Å; K805-F823 HydrophobicContact CB-CE2 3.69Å; K805-F823 HydrophobicContact CB-CG 4.45Å; K805-F823 HydrophobicContact CB-CZ 3.97Å; K805-F823 HydrophobicContact CD-CD1 4.37Å; K805-F823 HydrophobicContact CD-CD2 4.47Å; K805-F823 HydrophobicContact CD-CG 4.22Å; C807-F823 HydrophobicContact CB-CE2 4.39Å; F814-F823 HydrophobicContact CB-CD2 4.07Å; F814-F823 AromaticContact CD2-CD2 3.61Å; F814-F823 HydrophobicContact CD2-CD2 3.61Å; F814-F823 AromaticContact CD2-CE2 3.82Å; F814-F823 HydrophobicContact CD2-CE2 3.82Å; F814-F823 HydrophobicContact CE2-CD2 4.23Å; F814-F823 HydrophobicContact CE2-CE2 4.42Å; F814-F823 AromaticContact CG-CD2 3.82Å; F814-F823 HydrophobicContact CG-CD2 3.82Å; F814-F823 HydrophobicContact CG-CE2 4.41Å; D819-F823 PolarHBondContact O-N 2.7Å; Q820-F823 PolarHBondContact O-N 3.48Å; F823-H826 PolarHBondContact O-N 3.24Å; F823-V827 HydrophobicContact CD1-CG2 4.39Å; F823-V827 HydrophobicContact CE1-CG2 4.06Å; F823-V827 HydrophobicContact CE2-CG2 4.43Å; F823-V827 HydrophobicContact CZ-CG2 4.08Å; F823-V827 WeakPolarHBondContact O-CG2 3.08Å; F823-V827 PolarHBondContact O-N 2.73Å
824	E	79.4	Confident	71.6	Confident	88 Å²	88	85.4 Å²	85.4	41%	0.411	45%	0.451	S	S	.	.	H	α-helix	trans	-63.3	-44	177.8	-75.4	167.4	-177.6	0	0	112.4	Q820 H826 V827 L828	Q820-E824 HydrophobicContact CG-CG 4.45Å; Q820-E824 VanDerWaalsContact CG-OE1 3.24Å; Q820-E824 WeakPolarHBondContact CG-OE1 3.5Å; Q820-E824 PolarHBondContact NE2-OE1 3.45Å; Q820-E824 VanDerWaalsContact O-CB 3.29Å; Q820-E824 WeakPolarHBondContact O-CB 3.38Å; Q820-E824 VanDerWaalsContact O-CG 3.25Å; Q820-E824 WeakPolarHBondContact O-CG 3.19Å; Q820-E824 PolarHBondContact O-N 3.39Å; E824-H826 VanDerWaalsContact C-N 3.35Å; E824-H826 PolarHBondContact O-N 2.99Å; E824-V827 PolarHBondContact O-N 2.75Å; E824-L828 WeakPolarHBondContact O-CB 3.17Å; E824-L828 WeakPolarHBondContact O-CG 3.34Å; E824-L828 PolarHBondContact O-N 3.04Å
825	N	80.9	Confident	69.9	Low	102 Å²	102	89.8 Å²	89.8	55%	0.545	48%	0.483	S	S	.	.	H	α-helix	trans	-59.2	-44.8	173.3	-87.2	-40.6	0	0	0	111.8	K821 L828 T829	K821-N825 VanDerWaalsContact O-CB 3.23Å; K821-N825 WeakPolarHBondContact O-CB 3.23Å; K821-N825 VanDerWaalsContact O-CG 3.3Å; K821-N825 PolarHBondContact O-N 3.4Å; K821-N825 PolarHBondContact O-ND2 3.2Å; N825-L828 PolarHBondContact O-N 3.41Å; N825-T829 WeakPolarHBondContact O-CG2 3.17Å; N825-T829 PolarHBondContact O-N 3.28Å
826	H	82	Confident	68.3	Low	34 Å²	34	93.5 Å²	93.5	16%	0.157	50%	0.499	C	S	.	.	H	α-helix	trans	-58	-51	177	166	88.4	0	0	0	110.9	C807 C810 E812 F814 V822 F823 E824 L828 T829 H830	C807-H826 VanDerWaalsContact CB-NE2 3.3Å; C807-H826 WeakPolarHBondContact CB-NE2 3.21Å; C807-H826 PolarHBondContact SG-CD2 2.68Å; C807-H826 PolarHBondContact SG-NE2 3.45Å; C810-H826 PolarHBondContact SG-NE2 2.65Å; E812-H826 IonicContact OE2-CE1 2.86Å; E812-H826 PolarHBondContact OE2-CE1 3.45Å; E812-H826 IonicContact OE2-ND1 3.75Å; E812-H826 IonicContact OE2-NE2 2.66Å; F814-H826 AromaticContact CE2-CD2 3.58Å; F814-H826 AromaticContact CE2-NE2 3.65Å; F814-H826 HydrophobicContact CZ-CB 4.11Å; F814-H826 AromaticContact CZ-CD2 3.56Å; F814-H826 AromaticContact CZ-CE1 3.78Å; F814-H826 AromaticContact CZ-CG 3.5Å; F814-H826 AromaticContact CZ-ND1 3.66Å; F814-H826 AromaticContact CZ-NE2 3.74Å; V822-H826 WeakPolarHBondContact O-CB 3.39Å; V822-H826 PolarHBondContact O-N 3.02Å; F823-H826 PolarHBondContact O-N 3.24Å; E824-H826 VanDerWaalsContact C-N 3.35Å; E824-H826 PolarHBondContact O-N 2.99Å; H826-L828 VanDerWaalsContact C-N 3.3Å; H826-L828 PolarHBondContact O-N 3.15Å; H826-T829 PolarHBondContact O-N 3.29Å; H826-T829 PolarHBondContact O-OG1 3.31Å; H826-H830 AromaticContact CE1-NE2 3.96Å; H826-H830 AromaticContact NE2-NE2 3.82Å; H826-H830 PolarHBondContact O-CD2 2.71Å
827	V	79.1	Confident	66.7	Low	28 Å²	28	96 Å²	96	17%	0.17	51%	0.513	C	S	.	.	H	α-helix	trans	-56.4	-43.8	175.6	173.8	0	0	0	0	111.1	C807 F823 E824 T829 H830 F831	C807-V827 HydrophobicContact CB-CG2 4.46Å; F823-V827 HydrophobicContact CD1-CG2 4.39Å; F823-V827 HydrophobicContact CE1-CG2 4.06Å; F823-V827 HydrophobicContact CE2-CG2 4.43Å; F823-V827 HydrophobicContact CZ-CG2 4.08Å; F823-V827 WeakPolarHBondContact O-CG2 3.08Å; F823-V827 PolarHBondContact O-N 2.73Å; E824-V827 PolarHBondContact O-N 2.75Å; V827-T829 PolarHBondContact O-N 3.06Å; V827-H830 WeakPolarHBondContact O-CB 3.21Å; V827-H830 PolarHBondContact O-N 3.15Å; V827-F831 HydrophobicContact CG1-CE2 4.02Å; V827-F831 VanDerWaalsContact O-CD2 3.3Å; V827-F831 WeakPolarHBondContact O-CD2 3.41Å
828	L	77.1	Confident	65.2	Low	96 Å²	96	97.3 Å²	97.3	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-65.7	-30.5	179.8	-73	167.7	0	0	0	113.8	E824 N825 H826 H830 F831	E824-L828 WeakPolarHBondContact O-CB 3.17Å; E824-L828 WeakPolarHBondContact O-CG 3.34Å; E824-L828 PolarHBondContact O-N 3.04Å; N825-L828 PolarHBondContact O-N 3.41Å; H826-L828 VanDerWaalsContact C-N 3.3Å; H826-L828 PolarHBondContact O-N 3.15Å; L828-H830 PolarHBondContact O-N 3.25Å; L828-H830 VanDerWaalsContact O-N 3.07Å; L828-F831 PolarHBondContact O-N 3.2Å
829	T	75.9	Confident	63.3	Low	95 Å²	95	106.7 Å²	106.7	58%	0.583	56%	0.56	S	S	*	*	H	α-helix	trans	-62.3	-17.9	175.8	64.5	0	0	0	0	113.6	N825 H826 V827 F831	N825-T829 WeakPolarHBondContact O-CG2 3.17Å; N825-T829 PolarHBondContact O-N 3.28Å; H826-T829 PolarHBondContact O-N 3.29Å; H826-T829 PolarHBondContact O-OG1 3.31Å; V827-T829 PolarHBondContact O-N 3.06Å; T829-F831 VanDerWaalsContact C-N 3.34Å
830	H	74.6	Confident	62.7	Low	76 Å²	76	107.4 Å²	107.4	35%	0.352	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-12.5	171.8	-65	-76.6	0	0	0	114.2	M809 H826 V827 L828	M809-H830 HydrophobicContact CB-CB 3.87Å; M809-H830 HydrophobicContact CE-CB 4.14Å; M809-H830 HydrophobicContact CG-CB 3.87Å; H826-H830 AromaticContact CE1-NE2 3.96Å; H826-H830 AromaticContact NE2-NE2 3.82Å; H826-H830 PolarHBondContact O-CD2 2.71Å; V827-H830 WeakPolarHBondContact O-CB 3.21Å; V827-H830 PolarHBondContact O-N 3.15Å; L828-H830 PolarHBondContact O-N 3.25Å; L828-H830 VanDerWaalsContact O-N 3.07Å
831	F	67.1	Low	62	Low	124 Å²	124	108.5 Å²	108.5	54%	0.544	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104	-20.4	-176.4	-68.7	-85	0	0	0	114.5	M809 V827 L828 T829 G833	M809-F831 HydrophobicContact CE-CZ 4.14Å; M809-F831 HydrophobicContact CG-CE2 4.18Å; M809-F831 HydrophobicContact CG-CZ 4.43Å; M809-F831 HydrophobicContact SD-CE2 4.27Å; M809-F831 HydrophobicContact SD-CZ 3.92Å; V827-F831 HydrophobicContact CG1-CE2 4.02Å; V827-F831 VanDerWaalsContact O-CD2 3.3Å; V827-F831 WeakPolarHBondContact O-CD2 3.41Å; L828-F831 PolarHBondContact O-N 3.2Å; T829-F831 VanDerWaalsContact C-N 3.34Å; F831-G833 PolarHBondContact O-N 3.49Å
832	D	53.6	Low	61.2	Low	149 Å²	149	106.6 Å²	106.6	80%	0.797	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	6	-179.9	-83	-28	0	0	0	115.3
833	G	50.1	Low	60.3	Low	58 Å²	58	108.4 Å²	108.4	60%	0.598	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-15.3	-171.4	0	0	0	0	0	117.7	F831	F831-G833 PolarHBondContact O-N 3.49Å
834	H	40.4	Very low	59	Low	162 Å²	162	113.3 Å²	113.3	75%	0.75	60%	0.603	S	S	*	*			trans	-137.6	101.1	-169	-90.8	-68.8	0	0	0	115.4	L836	H834-L836 PolarHBondContact O-N 2.95Å
835	P	42.5	Very low	57.6	Low	125 Å²	125	115 Å²	115	81%	0.812	62%	0.616	S	S	*	*			trans	-78.6	105.2	166.4	31.1	-31.7	0	0	0	110.6	N837	P835-N837 PolarHBondContact O-N 3.31Å
836	L	39.2	Very low	55.9	Low	133 Å²	133	115.9 Å²	115.9	70%	0.696	62%	0.621	S	S	*	*			trans	-84.6	101.5	174.3	-70.2	175.7	0	0	0	111	H834 F838	H834-L836 PolarHBondContact O-N 2.95Å; L836-F838 HydrophobicContact CB-CE2 4.17Å
837	N	33.5	Very low	53.9	Low	142 Å²	142	122.2 Å²	122.2	76%	0.759	66%	0.657	S	S	*	*			trans	-64.9	133.9	159.4	-85.6	-45.2	0	0	0	109.5	P835	P835-N837 PolarHBondContact O-N 3.31Å
838	F	35.4	Very low	51.8	Low	174 Å²	174	130.1 Å²	130.1	76%	0.763	70%	0.698	S	S	*	*			trans	-109.2	127.6	160.8	-76.2	-92.8	0	0	0	108.9	L836	L836-F838 HydrophobicContact CB-CE2 4.17Å
839	D	32.4	Very low	49.5	Very low	227 Å²	227	133.2 Å²	133.2	100%	1.214	72%	0.715	S	S	*	*			trans	-109.6	0	162.5	-87.5	-23.6	0	0	0	108.2

Retrieved 839 of 839 residues in 1059.7 ms (Link to these results)

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