F7BIR0_MACMU Loading...

Centrosomal protein 112

AlphaFold DB , UniProt , Accession F7BIR0, Species MACMU (Macaca mulatta, Rhesus macaque), Gene CEP112, Length 955 aa.

						>F7BIR0_MACMU|F7BIR0|CEP112
MEVGSEEEKWEKLDAEFDHFVVDMKPYVLKLPHRTERQRCALWIRKLCEPSGTGAGIMGRKNRNLYAKLLLHMLKRGVLEGPFTHRPEPGTLKILPSYMSIYFDEPNPAQAKGSSPEGLPAWVLGELETSERKLNESWKLSSGEDNTLVQSPTDVYSREQYTGKLRMRSHSMSPTHREDGQNITPKICEVYSKKSPVSLDDSDIEARLNSWNLGIENPRYLRQKPIPVSLMTPKFSLRKSSSFHDDHFLSRIREKELDMKTKMMEAKFHEEKLRLQQKHDADVQKILERKNNEIEELKTLYRSKQHETEETIRKLEKKVQTLIRDCQVIRETKEDQIAELKKICEQSTESLNNDWEKKLHNAVAEMEQEKFDLQKRHTENIQELLEDTNVRLNKMESEYMAQTQSTNHMIKELEARVQQLTGEAENSNLQRQKLIQEKAELERCYQITCSELQEVKARRNTLHKEKDHLVNDYEQNMKLLQTKYDADINLLKQEHALSASKASSMIEELEQNVCQLKQQLQESELQRKQQLRDQENKFQMEKSHLKHTYEKKAHDLQSELDKGKEDTQKKIHKFEEALKEKEEQLTRVTEVQRLQAQQADAALEEFKRQVELNSEKVYAEMKEQMEKVEADLTRSKSLREKQSKEFLWQLEDIRQRYEQQIVELKLEHEQEKTHLLQQHNAEKDSLVRDHEREIENLEKQLRAANMEHEDQIQEFKKRDAQVIADMEAQVQKLREELINVNSQRKQQLVELGLLREEEKQRATREHEIVVNKLKAESEKMKIELKKTHAAETEMTLEKANSRLKQIEKEYTQKLAKSSQIIAELQTTISSLKEENSQQQLAAERRLQDVRQKFEDEKKQLIRDNDQAIKILQDELENRSNQVRCAEKKLQHKELESQEQITYIRQEYETKLKGLMPASLRQELEDTISSLKSQVNFLQKRASILQEELTTYQGRR
					

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(Predicted Aligned Error values between residue pairs)

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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	42.8	Very low	62.4	Low	240 Å²	240	119.5 Å²	119.5	100%	1.182	61%	0.608	S	S	*	*				0	148.2	0	-63	174.8	-174.2	0	0	106.1
2	E	39.4	Very low	63.9	Low	185 Å²	185	120.5 Å²	120.5	86%	0.864	61%	0.605	S	S	*	*			cis	-120.7	162.3	12.6	-69.5	174.4	123.1	0	0	113.1
3	V	46.5	Very low	65.7	Low	143 Å²	143	112.9 Å²	112.9	87%	0.867	57%	0.568	S	S	*	*			trans	-97.4	86.5	173.4	-179.2	0	0	0	0	108	S5	V3-S5 PolarHBondContact O-N 3.34Å; V3-S5 VanDerWaalsContact O-N 3.16Å
4	G	47.6	Very low	67.1	Low	47 Å²	47	107.9 Å²	107.9	49%	0.485	54%	0.543	S	S	.	.			trans	-67.3	107.1	165.8	0	0	0	0	0	109.1
5	S	61.4	Low	68.4	Low	56 Å²	56	104.6 Å²	104.6	39%	0.392	54%	0.539	S	S	.	.			trans	-53.8	143.3	-172.8	-171.8	0	0	0	0	111.8	V3 E7 E8	V3-S5 PolarHBondContact O-N 3.34Å; V3-S5 VanDerWaalsContact O-N 3.16Å; S5-E7 PolarHBondContact O-N 3.48Å; S5-E7 VanDerWaalsContact O-N 3.15Å; S5-E7 WeakPolarHBondContact OG-CB 3.4Å; S5-E7 PolarHBondContact OG-N 3.2Å; S5-E8 PolarHBondContact O-N 3.23Å
6	E	64.8	Low	69.6	Low	115 Å²	115	103 Å²	103	54%	0.537	53%	0.529	S	S	.	.	H	α-helix	trans	-59.6	-24.8	171.9	-63.7	-153	135.1	0	0	112	E8 K9 W10	E6-E8 PolarHBondContact O-N 3.49Å; E6-K9 CarbonylContact O-C 3.46Å; E6-K9 WeakPolarHBondContact O-CA 3.47Å; E6-K9 WeakPolarHBondContact O-CB 3.32Å; E6-K9 PolarHBondContact O-N 3.33Å; E6-K9 VanDerWaalsContact O-N 3.12Å; E6-W10 HydrophobicContact CB-CZ2 4.18Å; E6-W10 PolarHBondContact O-N 3.21Å; E6-W10 PolarHBondContact O-NE1 3.18Å
7	E	69	Low	70.8	Confident	121 Å²	121	97.3 Å²	97.3	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-57.9	-42.4	177	-155.7	156.7	-139.5	0	0	112.5	S5 K9 W10 E11	S5-E7 PolarHBondContact O-N 3.48Å; S5-E7 VanDerWaalsContact O-N 3.15Å; S5-E7 WeakPolarHBondContact OG-CB 3.4Å; S5-E7 PolarHBondContact OG-N 3.2Å; E7-K9 VanDerWaalsContact C-N 3.28Å; E7-K9 PolarHBondContact O-N 2.79Å; E7-W10 CarbonylContact O-C 3.57Å; E7-W10 WeakPolarHBondContact O-CA 3.29Å; E7-W10 VanDerWaalsContact O-CB 3.29Å; E7-W10 WeakPolarHBondContact O-CB 3.38Å; E7-W10 PolarHBondContact O-N 3.17Å; E7-E11 PolarHBondContact O-N 2.87Å
8	E	74.7	Confident	71.8	Confident	89 Å²	89	97.3 Å²	97.3	42%	0.416	50%	0.5	S	S	.	.	H	α-helix	trans	-65.5	-33.1	176.1	-163.6	-154.2	156.9	0	0	111.7	S5 E6 W10 K12	S5-E8 PolarHBondContact O-N 3.23Å; E6-E8 PolarHBondContact O-N 3.49Å; E8-W10 VanDerWaalsContact C-N 3.27Å; E8-K12 WeakPolarHBondContact O-CG 3.21Å; E8-K12 PolarHBondContact O-N 3.26Å; E8-K12 VanDerWaalsContact O-N 3.15Å; E8-K12 VanDerWaalsContact OE1-CE 3.31Å; E8-K12 WeakPolarHBondContact OE1-CE 3.46Å; E8-K12 IonicContact OE1-NZ 2.78Å; E8-K12 PolarHBondContact OE1-NZ 3.33Å
9	K	76.5	Confident	72.6	Confident	112 Å²	112	98.9 Å²	98.9	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-75.8	-17.9	173.6	-65.2	166.6	-177.5	157	0	112	E6 E7 L13 I57	E6-K9 CarbonylContact O-C 3.46Å; E6-K9 WeakPolarHBondContact O-CA 3.47Å; E6-K9 WeakPolarHBondContact O-CB 3.32Å; E6-K9 PolarHBondContact O-N 3.33Å; E6-K9 VanDerWaalsContact O-N 3.12Å; E7-K9 VanDerWaalsContact C-N 3.28Å; E7-K9 PolarHBondContact O-N 2.79Å; K9-L13 WeakPolarHBondContact O-CD1 3.34Å; K9-L13 WeakPolarHBondContact O-CG 3.33Å; K9-I57 HydrophobicContact CB-CD1 4.39Å; K9-I57 HydrophobicContact CD-CD1 4.41Å
10	W	82.5	Confident	73.5	Confident	76 Å²	76	95.2 Å²	95.2	29%	0.288	49%	0.485	S	S	.	.	H	α-helix	trans	-81.8	-48.9	171.4	-62.8	-3.5	0	0	0	110.4	E6 E7 E8 K12 L13 D14 R60	E6-W10 HydrophobicContact CB-CZ2 4.18Å; E6-W10 PolarHBondContact O-N 3.21Å; E6-W10 PolarHBondContact O-NE1 3.18Å; E7-W10 CarbonylContact O-C 3.57Å; E7-W10 WeakPolarHBondContact O-CA 3.29Å; E7-W10 VanDerWaalsContact O-CB 3.29Å; E7-W10 WeakPolarHBondContact O-CB 3.38Å; E7-W10 PolarHBondContact O-N 3.17Å; E8-W10 VanDerWaalsContact C-N 3.27Å; W10-K12 VanDerWaalsContact C-N 3.32Å; W10-K12 PolarHBondContact O-N 2.77Å; W10-L13 CarbonylContact O-C 3.26Å; W10-L13 PolarHBondContact O-N 2.71Å; W10-D14 WeakPolarHBondContact O-CB 3.14Å; W10-D14 PolarHBondContact O-N 2.84Å; W10-R60 VanDerWaalsContact CB-CZ 3.47Å; W10-R60 VanDerWaalsContact CG-CZ 3.49Å
11	E	81.1	Confident	74.2	Confident	130 Å²	130	92.3 Å²	92.3	61%	0.607	47%	0.472	S	S	*	.	H	α-helix	trans	-54.6	-45.4	176.4	-70.7	-174.9	150.4	0	0	112	E7 L13 D14 A15	E7-E11 PolarHBondContact O-N 2.87Å; E11-L13 VanDerWaalsContact C-N 3.31Å; E11-L13 PolarHBondContact O-N 3.3Å; E11-D14 PolarHBondContact O-N 3.39Å; E11-A15 VanDerWaalsContact O-CB 3.31Å; E11-A15 WeakPolarHBondContact O-CB 3.42Å; E11-A15 PolarHBondContact O-N 2.9Å
12	K	81	Confident	76.4	Confident	132 Å²	132	85.6 Å²	85.6	57%	0.574	45%	0.445	S	S	*	.	H	α-helix	trans	-61.8	-35.5	177	-73.6	170.7	176.6	175.3	0	113.3	E8 W10 E16	E8-K12 WeakPolarHBondContact O-CG 3.21Å; E8-K12 PolarHBondContact O-N 3.26Å; E8-K12 VanDerWaalsContact O-N 3.15Å; E8-K12 VanDerWaalsContact OE1-CE 3.31Å; E8-K12 WeakPolarHBondContact OE1-CE 3.46Å; E8-K12 IonicContact OE1-NZ 2.78Å; E8-K12 PolarHBondContact OE1-NZ 3.33Å; W10-K12 VanDerWaalsContact C-N 3.32Å; W10-K12 PolarHBondContact O-N 2.77Å; K12-E16 WeakPolarHBondContact O-CB 3.26Å; K12-E16 PolarHBondContact O-N 3.22Å; K12-E16 VanDerWaalsContact O-N 3.16Å
13	L	86.1	Confident	78.7	Confident	22 Å²	22	79.2 Å²	79.2	12%	0.115	42%	0.416	C	S	.	.	H	α-helix	trans	-80.5	-30.4	176.1	-70.5	172	0	0	0	112.8	K9 W10 E11 F17 I57 R60 K61 R63 N64	K9-L13 WeakPolarHBondContact O-CD1 3.34Å; K9-L13 WeakPolarHBondContact O-CG 3.33Å; W10-L13 CarbonylContact O-C 3.26Å; W10-L13 PolarHBondContact O-N 2.71Å; E11-L13 VanDerWaalsContact C-N 3.31Å; E11-L13 PolarHBondContact O-N 3.3Å; L13-F17 WeakPolarHBondContact O-CB 3.38Å; L13-F17 PolarHBondContact O-N 2.79Å; L13-I57 HydrophobicContact CD1-CG2 3.89Å; L13-R60 HydrophobicContact CB-CB 4.01Å; L13-R60 HydrophobicContact CD1-CB 3.92Å; L13-K61 HydrophobicContact CD1-CG 3.72Å; L13-K61 HydrophobicContact CD2-CG 3.93Å; L13-R63 PolarHBondContact O-NH2 3.36Å; L13-N64 PolarHBondContact O-ND2 2.97Å; L13-N64 PolarHBondContact O-OD1 2.68Å
14	D	86.2	Confident	80.7	Confident	42 Å²	42	72.4 Å²	72.4	23%	0.225	38%	0.375	C	S	.	.	H	α-helix	trans	-73.4	-37.6	175.4	-68.2	-27.9	0	0	0	110.3	W10 E11 F17 D18 R60 R63	W10-D14 WeakPolarHBondContact O-CB 3.14Å; W10-D14 PolarHBondContact O-N 2.84Å; E11-D14 PolarHBondContact O-N 3.39Å; D14-F17 WeakPolarHBondContact O-CB 3.49Å; D14-F17 PolarHBondContact O-N 3.28Å; D14-D18 PolarHBondContact O-N 2.81Å; D14-R60 VanDerWaalsContact CG-NE 3.29Å; D14-R60 WeakPolarHBondContact OD1-CD 3.47Å; D14-R60 IonicContact OD1-NE 3.15Å; D14-R60 PolarHBondContact OD1-NE 3.36Å; D14-R60 IonicContact OD2-CZ 3.53Å; D14-R60 IonicContact OD2-NE 3.28Å; D14-R60 PolarHBondContact OD2-NE 3.34Å; D14-R60 IonicContact OD2-NH2 3.6Å; D14-R60 PolarHBondContact OD2-NH2 2.94Å; D14-R63 IonicContact OD1-CZ 2.63Å; D14-R63 IonicContact OD1-NH1 3.37Å; D14-R63 PolarHBondContact OD1-NH1 2.83Å; D14-R63 IonicContact OD1-NH2 2.97Å; D14-R63 PolarHBondContact OD1-NH2 3.36Å
15	A	86.9	Confident	82.6	Confident	59 Å²	59	76.9 Å²	76.9	49%	0.488	38%	0.381	S	S	.	.	H	α-helix	trans	-66.9	-41.1	171.7	0	0	0	0	0	113.9	E11 F17 D18 H19	E11-A15 VanDerWaalsContact O-CB 3.31Å; E11-A15 WeakPolarHBondContact O-CB 3.42Å; E11-A15 PolarHBondContact O-N 2.9Å; A15-F17 VanDerWaalsContact C-N 3.26Å; A15-F17 PolarHBondContact O-N 3.36Å; A15-D18 PolarHBondContact O-N 3.33Å; A15-H19 PolarHBondContact O-N 3.32Å
16	E	86.4	Confident	83.8	Confident	79 Å²	79	76.9 Å²	76.9	37%	0.369	38%	0.38	S	S	.	.	H	α-helix	trans	-59.5	-40	173.2	-171.1	-160.3	-169.8	0	0	111	K12 H19 F20 N64	K12-E16 WeakPolarHBondContact O-CB 3.26Å; K12-E16 PolarHBondContact O-N 3.22Å; K12-E16 VanDerWaalsContact O-N 3.16Å; E16-H19 PolarHBondContact O-N 3.46Å; E16-F20 HydrophobicContact CG-CD2 4.34Å; E16-F20 HydrophobicContact CG-CE2 3.61Å; E16-F20 HydrophobicContact CG-CZ 3.81Å; E16-F20 WeakPolarHBondContact O-CD2 3.39Å; E16-F20 PolarHBondContact O-N 2.93Å; E16-F20 VanDerWaalsContact O-N 3.14Å; E16-F20 WeakPolarHBondContact OE1-CE2 3.21Å; E16-F20 WeakPolarHBondContact OE1-CZ 3.24Å; E16-N64 PolarHBondContact OE2-ND2 3.35Å
17	F	90.5	Very high	84.8	Confident	6 Å²	6	75.2 Å²	75.2	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-65.3	-47.9	177.4	176.7	-109.6	0	0	0	112.6	L13 D14 A15 H19 F20 V21 L47 R63 N64 A67	L13-F17 WeakPolarHBondContact O-CB 3.38Å; L13-F17 PolarHBondContact O-N 2.79Å; D14-F17 WeakPolarHBondContact O-CB 3.49Å; D14-F17 PolarHBondContact O-N 3.28Å; A15-F17 VanDerWaalsContact C-N 3.26Å; A15-F17 PolarHBondContact O-N 3.36Å; F17-H19 PolarHBondContact O-N 3.4Å; F17-F20 PolarHBondContact O-N 3.11Å; F17-F20 VanDerWaalsContact O-N 3.11Å; F17-V21 HydrophobicContact CD1-CG2 4.28Å; F17-V21 HydrophobicContact CD2-CG2 4.28Å; F17-V21 HydrophobicContact CE1-CG2 3.79Å; F17-V21 HydrophobicContact CE2-CG2 3.75Å; F17-V21 HydrophobicContact CZ-CG2 3.49Å; F17-V21 VanDerWaalsContact CZ-CG2 3.49Å; F17-V21 WeakPolarHBondContact O-CG2 3.43Å; F17-V21 PolarHBondContact O-N 3.44Å; F17-L47 HydrophobicContact CE2-CB 3.57Å; F17-L47 HydrophobicContact CE2-CD1 4.31Å; F17-L47 HydrophobicContact CE2-CG 4.49Å; F17-L47 HydrophobicContact CZ-CB 3.53Å; F17-R63 HydrophobicContact CD2-CG 3.88Å; F17-R63 HydrophobicContact CE2-CG 3.79Å; F17-R63 HydrophobicContact CZ-CG 4.33Å; F17-N64 WeakPolarHBondContact CB-OD1 3.14Å; F17-A67 HydrophobicContact CD2-CB 3.76Å; F17-A67 HydrophobicContact CE2-CB 3.82Å
18	D	88.6	Confident	85.6	Confident	97 Å²	97	70.2 Å²	70.2	52%	0.519	35%	0.347	S	S	.	.	H	α-helix	trans	-60.4	-37.4	178	-78.5	-17.5	0	0	0	111.4	D14 A15 V21 V22	D14-D18 PolarHBondContact O-N 2.81Å; A15-D18 PolarHBondContact O-N 3.33Å; D18-V21 PolarHBondContact O-N 2.96Å; D18-V22 WeakPolarHBondContact O-CG2 3.38Å; D18-V22 PolarHBondContact O-N 3.06Å
19	H	87.6	Confident	86.1	Confident	128 Å²	128	71.8 Å²	71.8	59%	0.593	36%	0.358	S	S	*	.	H	α-helix	trans	-59.2	-50	172.3	-166.2	76.1	0	0	0	111.5	A15 E16 F17 V21 V22 D23	A15-H19 PolarHBondContact O-N 3.32Å; E16-H19 PolarHBondContact O-N 3.46Å; F17-H19 PolarHBondContact O-N 3.4Å; H19-V21 VanDerWaalsContact C-N 3.32Å; H19-V21 PolarHBondContact O-N 3.27Å; H19-V22 PolarHBondContact O-N 3.43Å; H19-D23 WeakPolarHBondContact O-CB 3.3Å; H19-D23 PolarHBondContact O-N 3.04Å
20	F	90.4	Very high	86.3	Confident	24 Å²	24	74.3 Å²	74.3	11%	0.105	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-36.5	175.8	-62.9	-39.7	0	0	0	113.1	E16 F17 D23 M24 N64 A67 K68 L71	E16-F20 HydrophobicContact CG-CD2 4.34Å; E16-F20 HydrophobicContact CG-CE2 3.61Å; E16-F20 HydrophobicContact CG-CZ 3.81Å; E16-F20 WeakPolarHBondContact O-CD2 3.39Å; E16-F20 PolarHBondContact O-N 2.93Å; E16-F20 VanDerWaalsContact O-N 3.14Å; E16-F20 WeakPolarHBondContact OE1-CE2 3.21Å; E16-F20 WeakPolarHBondContact OE1-CZ 3.24Å; F17-F20 PolarHBondContact O-N 3.11Å; F17-F20 VanDerWaalsContact O-N 3.11Å; F20-D23 PolarHBondContact O-N 3.11Å; F20-M24 HydrophobicContact CB-CE 4.02Å; F20-M24 WeakPolarHBondContact O-CB 2.98Å; F20-M24 WeakPolarHBondContact O-CE 3.23Å; F20-M24 VanDerWaalsContact O-CG 3.27Å; F20-M24 WeakPolarHBondContact O-CG 3Å; F20-M24 PolarHBondContact O-N 3.44Å; F20-N64 HydrophobicContact CE2-CB 4.47Å; F20-A67 HydrophobicContact CB-CB 4.03Å; F20-A67 HydrophobicContact CD2-CB 3.99Å; F20-A67 HydrophobicContact CG-CB 4.42Å; F20-K68 HydrophobicContact CD2-CB 4.35Å; F20-K68 HydrophobicContact CE1-CB 4.41Å; F20-K68 HydrophobicContact CE1-CG 4.18Å; F20-K68 HydrophobicContact CE2-CB 3.93Å; F20-K68 HydrophobicContact CE2-CG 4.41Å; F20-K68 HydrophobicContact CZ-CB 3.98Å; F20-K68 HydrophobicContact CZ-CD 3.96Å; F20-K68 HydrophobicContact CZ-CG 3.95Å; F20-L71 HydrophobicContact CB-CD2 4.37Å; F20-L71 HydrophobicContact CD1-CD2 3.69Å; F20-L71 HydrophobicContact CE1-CD2 4.5Å; F20-L71 HydrophobicContact CG-CD2 4.41Å
21	V	88.1	Confident	86.3	Confident	35 Å²	35	71.2 Å²	71.2	21%	0.212	36%	0.358	C	S	.	.	H	α-helix	trans	-68.7	-40	178	172.9	0	0	0	0	111.8	F17 D18 H19 M24 K25 I44	F17-V21 HydrophobicContact CD1-CG2 4.28Å; F17-V21 HydrophobicContact CD2-CG2 4.28Å; F17-V21 HydrophobicContact CE1-CG2 3.79Å; F17-V21 HydrophobicContact CE2-CG2 3.75Å; F17-V21 HydrophobicContact CZ-CG2 3.49Å; F17-V21 VanDerWaalsContact CZ-CG2 3.49Å; F17-V21 WeakPolarHBondContact O-CG2 3.43Å; F17-V21 PolarHBondContact O-N 3.44Å; D18-V21 PolarHBondContact O-N 2.96Å; H19-V21 VanDerWaalsContact C-N 3.32Å; H19-V21 PolarHBondContact O-N 3.27Å; V21-M24 HydrophobicContact CG2-CE 4.4Å; V21-K25 PolarHBondContact O-N 3.1Å; V21-I44 HydrophobicContact CG1-CG2 4.07Å; V21-I44 HydrophobicContact CG2-CG2 4.46Å
22	V	88.8	Confident	86.1	Confident	100 Å²	100	69.6 Å²	69.6	61%	0.606	36%	0.359	S	S	*	.	H	α-helix	trans	-62.4	-45.5	171.6	170.6	0	0	0	0	110.4	D18 H19 M24 K25 P26	D18-V22 WeakPolarHBondContact O-CG2 3.38Å; D18-V22 PolarHBondContact O-N 3.06Å; H19-V22 PolarHBondContact O-N 3.43Å; V22-M24 VanDerWaalsContact C-N 3.33Å; V22-M24 PolarHBondContact O-N 3.42Å; V22-K25 WeakPolarHBondContact O-CB 3.11Å; V22-K25 PolarHBondContact O-N 2.86Å; V22-P26 WeakPolarHBondContact O-CD 3.2Å
23	D	87	Confident	86.2	Confident	50 Å²	50	68.6 Å²	68.6	27%	0.267	36%	0.356	S	S	.	.	H	α-helix	trans	-69.4	-29.4	-176.7	-144.4	50.1	0	0	0	112.7	H19 F20 P26 Y27 L71 K75	H19-D23 WeakPolarHBondContact O-CB 3.3Å; H19-D23 PolarHBondContact O-N 3.04Å; F20-D23 PolarHBondContact O-N 3.11Å; D23-P26 WeakPolarHBondContact O-CD 3.41Å; D23-P26 WeakPolarHBondContact O-CG 3.41Å; D23-Y27 WeakPolarHBondContact O-CD2 3.39Å; D23-Y27 WeakPolarHBondContact O-CE2 3.29Å; D23-L71 HydrophobicContact CB-CD1 4Å; D23-L71 HydrophobicContact CB-CD2 3.93Å; D23-K75 WeakPolarHBondContact OD2-CE 3.44Å; D23-K75 IonicContact OD2-NZ 2.68Å; D23-K75 PolarHBondContact OD2-NZ 3.03Å
24	M	90.3	Very high	86.1	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-67.9	-33.4	172.6	-81.1	-174.8	-104.4	0	0	113.2	F20 V21 V22 Y27 V28 I44 A67 L70 L71 L74	F20-M24 HydrophobicContact CB-CE 4.02Å; F20-M24 WeakPolarHBondContact O-CB 2.98Å; F20-M24 WeakPolarHBondContact O-CE 3.23Å; F20-M24 VanDerWaalsContact O-CG 3.27Å; F20-M24 WeakPolarHBondContact O-CG 3Å; F20-M24 PolarHBondContact O-N 3.44Å; V21-M24 HydrophobicContact CG2-CE 4.4Å; V22-M24 VanDerWaalsContact C-N 3.33Å; V22-M24 PolarHBondContact O-N 3.42Å; M24-Y27 PolarHBondContact O-N 3.38Å; M24-V28 HydrophobicContact CB-CG2 4.34Å; M24-V28 WeakPolarHBondContact O-CG2 3.34Å; M24-V28 PolarHBondContact O-N 2.7Å; M24-I44 HydrophobicContact CB-CD1 4.44Å; M24-I44 HydrophobicContact SD-CD1 4.16Å; M24-I44 HydrophobicContact SD-CG1 4.17Å; M24-A67 HydrophobicContact CE-CB 3.79Å; M24-A67 WeakPolarHBondContact CE-O 3.36Å; M24-L70 HydrophobicContact SD-CB 3.96Å; M24-L70 HydrophobicContact SD-CD2 3.71Å; M24-L70 HydrophobicContact SD-CG 3.63Å; M24-L71 HydrophobicContact CB-CD1 4.38Å; M24-L71 HydrophobicContact CG-CB 3.73Å; M24-L71 HydrophobicContact CG-CD1 3.72Å; M24-L71 HydrophobicContact CG-CG 4.29Å; M24-L71 HydrophobicContact SD-CB 4.44Å; M24-L74 HydrophobicContact CB-CD1 4.05Å; M24-L74 HydrophobicContact CG-CD1 3.69Å; M24-L74 HydrophobicContact SD-CD1 3.95Å
25	K	86	Confident	86	Confident	140 Å²	140	79.6 Å²	79.6	61%	0.609	40%	0.402	S	S	*	.	H	α-helix	trans	-49.6	-51.1	-173.3	-170.3	178.6	179.5	179.8	0	114.2	V21 V22 Y27 L29	V21-K25 PolarHBondContact O-N 3.1Å; V22-K25 WeakPolarHBondContact O-CB 3.11Å; V22-K25 PolarHBondContact O-N 2.86Å; K25-Y27 VanDerWaalsContact C-N 3.32Å; K25-Y27 PolarHBondContact O-N 2.83Å; K25-L29 HydrophobicContact CG-CD1 4.16Å; K25-L29 WeakPolarHBondContact O-CB 3.1Å; K25-L29 VanDerWaalsContact O-CG 3.26Å; K25-L29 WeakPolarHBondContact O-CG 2.83Å; K25-L29 PolarHBondContact O-N 2.79Å; K25-L29 VanDerWaalsContact O-N 3.11Å
26	P	86.8	Confident	85.9	Confident	57 Å²	57	78.9 Å²	78.9	37%	0.37	39%	0.389	S	S	.	.	H	α-helix	trans	-64.1	-30.9	177.9	24.4	-35.3	0	0	0	114.1	V22 D23 K30	V22-P26 WeakPolarHBondContact O-CD 3.2Å; D23-P26 WeakPolarHBondContact O-CD 3.41Å; D23-P26 WeakPolarHBondContact O-CG 3.41Å; P26-K30 WeakPolarHBondContact O-CD 3.37Å; P26-K30 WeakPolarHBondContact O-CG 3.49Å; P26-K30 PolarHBondContact O-N 3.03Å
27	Y	86.5	Confident	86	Confident	79 Å²	79	79.9 Å²	79.9	31%	0.31	39%	0.39	S	S	.	.	H	α-helix	trans	-81.3	-43.6	180	-58.6	-85	0	0	0	111.8	D23 M24 K25 L29 K30 L31 L71 K75	D23-Y27 WeakPolarHBondContact O-CD2 3.39Å; D23-Y27 WeakPolarHBondContact O-CE2 3.29Å; M24-Y27 PolarHBondContact O-N 3.38Å; K25-Y27 VanDerWaalsContact C-N 3.32Å; K25-Y27 PolarHBondContact O-N 2.83Å; Y27-L29 VanDerWaalsContact C-N 3.26Å; Y27-L29 PolarHBondContact O-N 3.3Å; Y27-K30 PolarHBondContact O-N 3.06Å; Y27-L31 PolarHBondContact O-N 2.83Å; Y27-L31 VanDerWaalsContact O-N 3.16Å; Y27-L71 HydrophobicContact CD2-CD1 4.37Å; Y27-K75 HydrophobicContact CD1-CG 4.12Å; Y27-K75 HydrophobicContact CD2-CG 4.09Å; Y27-K75 HydrophobicContact CE1-CB 4.45Å; Y27-K75 HydrophobicContact CE1-CG 3.74Å; Y27-K75 HydrophobicContact CE2-CD 4.29Å; Y27-K75 HydrophobicContact CE2-CG 3.73Å; Y27-K75 HydrophobicContact CG-CG 4.3Å
28	V	85.8	Confident	85.7	Confident	17 Å²	17	84.9 Å²	84.9	10%	0.103	41%	0.413	C	S	.	.	H	α-helix	trans	-58.4	-39.5	173.6	178.4	0	0	0	0	110.8	M24 K30 L31 R37 C40 I44 L74	M24-V28 HydrophobicContact CB-CG2 4.34Å; M24-V28 WeakPolarHBondContact O-CG2 3.34Å; M24-V28 PolarHBondContact O-N 2.7Å; V28-K30 VanDerWaalsContact C-N 3.29Å; V28-K30 PolarHBondContact O-N 2.84Å; V28-L31 PolarHBondContact O-N 3.5Å; V28-R37 VanDerWaalsContact O-CD 3.23Å; V28-R37 WeakPolarHBondContact O-CD 3.15Å; V28-R37 VanDerWaalsContact O-CG 3.22Å; V28-R37 WeakPolarHBondContact O-CG 3.44Å; V28-C40 HydrophobicContact CG1-CB 4.02Å; V28-C40 HydrophobicContact CG2-CB 4.15Å; V28-I44 HydrophobicContact CG2-CD1 3.99Å; V28-L74 HydrophobicContact CG2-CD1 3.48Å; V28-L74 VanDerWaalsContact CG2-CD1 3.48Å; V28-L74 HydrophobicContact CG2-CD2 3.9Å; V28-L74 HydrophobicContact CG2-CG 4.36Å
29	L	84.5	Confident	85.7	Confident	122 Å²	122	83.7 Å²	83.7	64%	0.639	40%	0.401	S	S	*	.	H	α-helix	trans	-68.9	-25.4	176.9	-70.4	172.5	0	0	0	113.5	K25 Y27	K25-L29 HydrophobicContact CG-CD1 4.16Å; K25-L29 WeakPolarHBondContact O-CB 3.1Å; K25-L29 VanDerWaalsContact O-CG 3.26Å; K25-L29 WeakPolarHBondContact O-CG 2.83Å; K25-L29 PolarHBondContact O-N 2.79Å; K25-L29 VanDerWaalsContact O-N 3.11Å; Y27-L29 VanDerWaalsContact C-N 3.26Å; Y27-L29 PolarHBondContact O-N 3.3Å
30	K	81.2	Confident	85.8	Confident	164 Å²	164	77.6 Å²	77.6	71%	0.713	37%	0.373	S	S	*	.	H	α-helix	trans	-85	-15	177.9	-75.2	172.1	-177.2	-180	0	114.5	P26 Y27 V28	P26-K30 WeakPolarHBondContact O-CD 3.37Å; P26-K30 WeakPolarHBondContact O-CG 3.49Å; P26-K30 PolarHBondContact O-N 3.03Å; Y27-K30 PolarHBondContact O-N 3.06Å; V28-K30 VanDerWaalsContact C-N 3.29Å; V28-K30 PolarHBondContact O-N 2.84Å
31	L	82.4	Confident	85.7	Confident	12 Å²	12	79.1 Å²	79.1	6%	0.063	39%	0.39	C	S	.	.			trans	-58.3	129.1	178.5	-75	175.2	0	0	0	111.8	Y27 V28 E36 R37 L74 L79	Y27-L31 PolarHBondContact O-N 2.83Å; Y27-L31 VanDerWaalsContact O-N 3.16Å; V28-L31 PolarHBondContact O-N 3.5Å; L31-E36 HydrophobicContact CD1-CB 4.22Å; L31-R37 HydrophobicContact CB-CG 3.67Å; L31-R37 HydrophobicContact CD1-CG 4.23Å; L31-R37 WeakPolarHBondContact O-CD 3.47Å; L31-R37 PolarHBondContact O-NE 3.16Å; L31-L74 HydrophobicContact CD1-CD2 3.63Å; L31-L74 HydrophobicContact CD2-CD2 4.22Å; L31-L74 HydrophobicContact CG-CD2 4.04Å; L31-L79 HydrophobicContact CD1-CD1 3.99Å; L31-L79 HydrophobicContact CD2-CD1 4.42Å
32	P	76.8	Confident	85.7	Confident	96 Å²	96	80.2 Å²	80.2	62%	0.623	39%	0.394	S	S	*	.	S	Bend	trans	-65.5	-52.3	-176.4	24.1	-32	0	0	0	111.8	R34 R37	P32-R34 PolarHBondContact O-N 3.28Å; P32-R37 PolarHBondContact O-NH2 3.25Å
33	H	83	Confident	85.7	Confident	110 Å²	110	76.4 Å²	76.4	51%	0.509	37%	0.369	S	S	.	.			trans	-75.5	125.7	-171.7	-58.9	-68.4	0	0	0	112.8	T35 E36 R37	H33-T35 PolarHBondContact O-N 3.16Å; H33-E36 HydrophobicContact CB-CB 4.33Å; H33-E36 HydrophobicContact CB-CG 4.25Å; H33-E36 WeakPolarHBondContact CB-OE2 3.43Å; H33-E36 IonicContact CD2-OE1 3.15Å; H33-E36 IonicContact CD2-OE2 3.07Å; H33-E36 PolarHBondContact CD2-OE2 3.09Å; H33-E36 IonicContact CG-OE2 2.64Å; H33-E36 PolarHBondContact O-N 3.4Å; H33-E36 VanDerWaalsContact O-N 3.16Å; H33-R37 PolarHBondContact O-N 3Å; H33-R37 VanDerWaalsContact O-N 3.15Å
34	R	83.7	Confident	85.8	Confident	206 Å²	206	75.4 Å²	75.4	78%	0.777	36%	0.363	S	S	*	.	H	α-helix	trans	-61.1	-32.5	178.9	-174.3	177.5	179.3	179	0.7	112.8	P32 Q38	P32-R34 PolarHBondContact O-N 3.28Å; R34-Q38 WeakPolarHBondContact O-CB 3.32Å; R34-Q38 PolarHBondContact O-N 2.85Å
35	T	84.7	Confident	85.7	Confident	89 Å²	89	83 Å²	83	55%	0.546	39%	0.392	S	S	.	.	H	α-helix	trans	-68.4	-34.4	176.8	43.7	0	0	0	0	112.7	H33 R39	H33-T35 PolarHBondContact O-N 3.16Å; T35-R39 WeakPolarHBondContact O-CG 3.42Å; T35-R39 PolarHBondContact O-N 2.84Å
36	E	85.2	Confident	85.7	Confident	45 Å²	45	77.3 Å²	77.3	21%	0.21	37%	0.367	C	S	.	.	H	α-helix	trans	-71.6	-47.1	174.1	-75.2	157.4	-165.9	0	0	111	L31 H33 Q38 R39 C40 L79	L31-E36 HydrophobicContact CD1-CB 4.22Å; H33-E36 HydrophobicContact CB-CB 4.33Å; H33-E36 HydrophobicContact CB-CG 4.25Å; H33-E36 WeakPolarHBondContact CB-OE2 3.43Å; H33-E36 IonicContact CD2-OE1 3.15Å; H33-E36 IonicContact CD2-OE2 3.07Å; H33-E36 PolarHBondContact CD2-OE2 3.09Å; H33-E36 IonicContact CG-OE2 2.64Å; H33-E36 PolarHBondContact O-N 3.4Å; H33-E36 VanDerWaalsContact O-N 3.16Å; E36-Q38 PolarHBondContact O-N 2.73Å; E36-R39 CarbonylContact O-C 3.59Å; E36-R39 WeakPolarHBondContact O-CA 3.45Å; E36-R39 PolarHBondContact O-N 2.8Å; E36-R39 IonicContact OE1-NH2 3.02Å; E36-R39 PolarHBondContact OE1-NH2 3.14Å; E36-C40 PolarHBondContact O-N 2.91Å; E36-C40 PolarHBondContact O-SG 2.78Å; E36-L79 HydrophobicContact CB-CD1 4.1Å; E36-L79 HydrophobicContact CG-CD1 4.27Å
37	R	87.3	Confident	85.7	Confident	99 Å²	99	74.6 Å²	74.6	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-53.9	-40.3	171.8	-70.9	-171	-91.4	160.4	-9.9	112.4	V28 L31 P32 H33 A41	V28-R37 VanDerWaalsContact O-CD 3.23Å; V28-R37 WeakPolarHBondContact O-CD 3.15Å; V28-R37 VanDerWaalsContact O-CG 3.22Å; V28-R37 WeakPolarHBondContact O-CG 3.44Å; L31-R37 HydrophobicContact CB-CG 3.67Å; L31-R37 HydrophobicContact CD1-CG 4.23Å; L31-R37 WeakPolarHBondContact O-CD 3.47Å; L31-R37 PolarHBondContact O-NE 3.16Å; P32-R37 PolarHBondContact O-NH2 3.25Å; H33-R37 PolarHBondContact O-N 3Å; H33-R37 VanDerWaalsContact O-N 3.15Å; R37-A41 VanDerWaalsContact O-CB 3.3Å; R37-A41 WeakPolarHBondContact O-CB 3.37Å; R37-A41 PolarHBondContact O-N 3.01Å
38	Q	85.9	Confident	85.6	Confident	111 Å²	111	74 Å²	74	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-71.8	-35.5	175.9	-165.7	172.6	6.5	0	0	113.2	R34 E36 L42	R34-Q38 WeakPolarHBondContact O-CB 3.32Å; R34-Q38 PolarHBondContact O-N 2.85Å; E36-Q38 PolarHBondContact O-N 2.73Å; Q38-L42 VanDerWaalsContact O-CG 3.31Å; Q38-L42 WeakPolarHBondContact O-CG 3.4Å; Q38-L42 PolarHBondContact O-N 3.23Å; Q38-L42 VanDerWaalsContact O-N 3.1Å
39	R	88.1	Confident	85.4	Confident	72 Å²	72	76 Å²	76	27%	0.272	37%	0.365	S	S	.	.	H	α-helix	trans	-64.2	-48.2	171.3	-79	-175.7	-73.5	-171.8	3.2	111.5	T35 E36 A41 L42 W43 T84	T35-R39 WeakPolarHBondContact O-CG 3.42Å; T35-R39 PolarHBondContact O-N 2.84Å; E36-R39 CarbonylContact O-C 3.59Å; E36-R39 WeakPolarHBondContact O-CA 3.45Å; E36-R39 PolarHBondContact O-N 2.8Å; E36-R39 IonicContact OE1-NH2 3.02Å; E36-R39 PolarHBondContact OE1-NH2 3.14Å; R39-A41 PolarHBondContact O-N 3Å; R39-L42 PolarHBondContact O-N 3Å; R39-W43 PolarHBondContact O-N 3.35Å; R39-T84 VanDerWaalsContact CD-O 3.3Å; R39-T84 WeakPolarHBondContact CD-O 3.43Å; R39-T84 PolarHBondContact NH1-O 3.07Å
40	C	88.4	Confident	84.3	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.007	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-43.2	176.3	-63	0	0	0	0	111.8	V28 E36 L42 W43 I44 L79	V28-C40 HydrophobicContact CG1-CB 4.02Å; V28-C40 HydrophobicContact CG2-CB 4.15Å; E36-C40 PolarHBondContact O-N 2.91Å; E36-C40 PolarHBondContact O-SG 2.78Å; C40-L42 VanDerWaalsContact C-N 3.33Å; C40-L42 PolarHBondContact O-N 2.83Å; C40-W43 PolarHBondContact O-N 2.76Å; C40-I44 WeakPolarHBondContact O-CB 3.38Å; C40-I44 WeakPolarHBondContact O-CG1 3.48Å; C40-I44 PolarHBondContact O-N 3.14Å; C40-L79 VanDerWaalsContact SG-CD1 3.56Å
41	A	88.3	Confident	83.1	Confident	55 Å²	55	72.7 Å²	72.7	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-36.3	176.1	0	0	0	0	0	113	R37 R39 R45	R37-A41 VanDerWaalsContact O-CB 3.3Å; R37-A41 WeakPolarHBondContact O-CB 3.37Å; R37-A41 PolarHBondContact O-N 3.01Å; R39-A41 PolarHBondContact O-N 3Å; A41-R45 VanDerWaalsContact O-CB 3.22Å; A41-R45 WeakPolarHBondContact O-CB 3.3Å; A41-R45 PolarHBondContact O-N 3.18Å
42	L	88.7	Confident	81.9	Confident	58 Å²	58	72.1 Å²	72.1	30%	0.304	37%	0.367	S	S	.	.	H	α-helix	trans	-68.7	-39.8	173.4	-72.5	170	0	0	0	112.2	Q38 R39 C40 K46 R86 P87	Q38-L42 VanDerWaalsContact O-CG 3.31Å; Q38-L42 WeakPolarHBondContact O-CG 3.4Å; Q38-L42 PolarHBondContact O-N 3.23Å; Q38-L42 VanDerWaalsContact O-N 3.1Å; R39-L42 PolarHBondContact O-N 3Å; C40-L42 VanDerWaalsContact C-N 3.33Å; C40-L42 PolarHBondContact O-N 2.83Å; L42-K46 WeakPolarHBondContact O-CB 3.5Å; L42-K46 PolarHBondContact O-N 3.41Å; L42-R86 HydrophobicContact CD1-CG 4.15Å; L42-P87 HydrophobicContact CB-CG 4.44Å
43	W	89.6	Confident	81.1	Confident	20 Å²	20	68.2 Å²	68.2	8%	0.076	34%	0.341	C	S	.	.	H	α-helix	trans	-68.7	-46.1	175.8	-88.7	104.6	0	0	0	112.8	R39 C40 R45 K46 L47 Y66 L70 P82 F83 H85 P87 L92	R39-W43 PolarHBondContact O-N 3.35Å; C40-W43 PolarHBondContact O-N 2.76Å; W43-R45 VanDerWaalsContact C-N 3.35Å; W43-R45 PolarHBondContact O-N 2.84Å; W43-K46 WeakPolarHBondContact O-CA 3.47Å; W43-K46 WeakPolarHBondContact O-CB 3.5Å; W43-K46 PolarHBondContact O-N 3.47Å; W43-L47 WeakPolarHBondContact O-CG 3.47Å; W43-L47 PolarHBondContact O-N 2.81Å; W43-Y66 HydrophobicContact CH2-CE1 4.46Å; W43-Y66 HydrophobicContact CZ3-CD1 4.2Å; W43-Y66 HydrophobicContact CZ3-CE1 4.31Å; W43-L70 HydrophobicContact CB-CD2 4.31Å; W43-P82 HydrophobicContact CH2-CB 4.17Å; W43-P82 HydrophobicContact CZ2-CB 4.09Å; W43-P82 VanDerWaalsContact CZ2-O 3.28Å; W43-P82 WeakPolarHBondContact CZ2-O 3.36Å; W43-P82 PolarHBondContact NE1-O 2.9Å; W43-F83 HydrophobicContact CB-CD1 4.26Å; W43-F83 AromaticContact CD1-CD1 4Å; W43-F83 AromaticContact CD2-CD1 3.74Å; W43-F83 HydrophobicContact CD2-CD1 3.74Å; W43-F83 HydrophobicContact CD2-CE1 4.05Å; W43-F83 HydrophobicContact CE3-CD1 4.21Å; W43-F83 HydrophobicContact CE3-CE1 4.02Å; W43-F83 AromaticContact CG-CD1 3.76Å; W43-F83 HydrophobicContact CG-CD1 3.76Å; W43-F83 HydrophobicContact CG-CE1 4.33Å; W43-H85 PolarHBondContact NE1-O 3.43Å; W43-P87 HydrophobicContact CD2-CB 3.89Å; W43-P87 HydrophobicContact CD2-CG 4.25Å; W43-P87 HydrophobicContact CE3-CB 3.97Å; W43-P87 HydrophobicContact CG-CG 4.42Å; W43-P87 HydrophobicContact CH2-CB 4.01Å; W43-P87 HydrophobicContact CZ2-CB 3.93Å; W43-P87 HydrophobicContact CZ3-CB 4.03Å; W43-L92 HydrophobicContact CZ3-CD2 4.15Å
44	I	89.3	Confident	80	Confident	29 Å²	29	64.2 Å²	64.2	15%	0.149	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-47.9	175	-69.2	166.8	0	0	0	109.8	V21 M24 V28 C40 K46 L47 C48 L70	V21-I44 HydrophobicContact CG1-CG2 4.07Å; V21-I44 HydrophobicContact CG2-CG2 4.46Å; M24-I44 HydrophobicContact CB-CD1 4.44Å; M24-I44 HydrophobicContact SD-CD1 4.16Å; M24-I44 HydrophobicContact SD-CG1 4.17Å; V28-I44 HydrophobicContact CG2-CD1 3.99Å; C40-I44 WeakPolarHBondContact O-CB 3.38Å; C40-I44 WeakPolarHBondContact O-CG1 3.48Å; C40-I44 PolarHBondContact O-N 3.14Å; I44-K46 VanDerWaalsContact C-N 3.28Å; I44-K46 PolarHBondContact O-N 2.95Å; I44-L47 PolarHBondContact O-N 3.09Å; I44-L47 VanDerWaalsContact O-N 3.14Å; I44-C48 PolarHBondContact O-N 3.02Å; I44-C48 PolarHBondContact O-SG 3.04Å; I44-L70 HydrophobicContact CG1-CD2 4.03Å
45	R	88.5	Confident	78.8	Confident	161 Å²	161	59.5 Å²	59.5	61%	0.608	34%	0.335	S	S	*	.	H	α-helix	trans	-54.6	-44.1	172.7	174.4	-178.4	158.4	151.4	1.1	111.9	A41 W43 L47 C48 E49	A41-R45 VanDerWaalsContact O-CB 3.22Å; A41-R45 WeakPolarHBondContact O-CB 3.3Å; A41-R45 PolarHBondContact O-N 3.18Å; W43-R45 VanDerWaalsContact C-N 3.35Å; W43-R45 PolarHBondContact O-N 2.84Å; R45-L47 VanDerWaalsContact C-N 3.33Å; R45-L47 PolarHBondContact O-N 3.14Å; R45-C48 CarbonylContact O-C 3.53Å; R45-C48 PolarHBondContact O-N 3.2Å; R45-E49 IonicContact CZ-OE1 2.62Å; R45-E49 IonicContact NE-OE1 2.6Å; R45-E49 PolarHBondContact NE-OE1 2.98Å; R45-E49 IonicContact NH2-OE1 2.72Å; R45-E49 PolarHBondContact NH2-OE1 3.01Å; R45-E49 WeakPolarHBondContact O-CG 3.4Å; R45-E49 PolarHBondContact O-N 3.46Å; R45-E49 VanDerWaalsContact O-N 3.09Å
46	K	85.4	Confident	78.3	Confident	20 Å²	20	56.8 Å²	56.8	9%	0.087	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-37	179.7	-178.8	61.6	-180	166.8	0	112.6	L42 W43 I44 C48 E49 P87 G90 L92	L42-K46 WeakPolarHBondContact O-CB 3.5Å; L42-K46 PolarHBondContact O-N 3.41Å; W43-K46 WeakPolarHBondContact O-CA 3.47Å; W43-K46 WeakPolarHBondContact O-CB 3.5Å; W43-K46 PolarHBondContact O-N 3.47Å; I44-K46 VanDerWaalsContact C-N 3.28Å; I44-K46 PolarHBondContact O-N 2.95Å; K46-C48 VanDerWaalsContact C-N 3.34Å; K46-E49 WeakPolarHBondContact CD-OE2 3.46Å; K46-E49 IonicContact NZ-OE2 3.39Å; K46-E49 PolarHBondContact O-N 3.16Å; K46-P87 HydrophobicContact CB-CB 3.95Å; K46-P87 HydrophobicContact CB-CG 3.92Å; K46-P87 HydrophobicContact CG-CB 3.76Å; K46-P87 HydrophobicContact CG-CG 4.24Å; K46-G90 WeakPolarHBondContact CE-O 3.39Å; K46-G90 PolarHBondContact NZ-O 3.35Å; K46-L92 HydrophobicContact CG-CD2 4.46Å
47	L	85.4	Confident	77.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.4	-33.2	174.8	-63	170.2	0	0	0	111.3	F17 W43 I44 R45 E49 R63 A67 L92	F17-L47 HydrophobicContact CE2-CB 3.57Å; F17-L47 HydrophobicContact CE2-CD1 4.31Å; F17-L47 HydrophobicContact CE2-CG 4.49Å; F17-L47 HydrophobicContact CZ-CB 3.53Å; W43-L47 WeakPolarHBondContact O-CG 3.47Å; W43-L47 PolarHBondContact O-N 2.81Å; I44-L47 PolarHBondContact O-N 3.09Å; I44-L47 VanDerWaalsContact O-N 3.14Å; R45-L47 VanDerWaalsContact C-N 3.33Å; R45-L47 PolarHBondContact O-N 3.14Å; L47-E49 VanDerWaalsContact C-N 3.33Å; L47-R63 HydrophobicContact CB-CG 3.99Å; L47-R63 HydrophobicContact CD2-CG 3.93Å; L47-R63 WeakPolarHBondContact O-CD 3.5Å; L47-A67 HydrophobicContact CD1-CB 4.26Å; L47-L92 HydrophobicContact CD2-CD1 3.73Å; L47-L92 HydrophobicContact CD2-CD2 4.07Å
48	C	84.9	Confident	77.4	Confident	68 Å²	68	58.8 Å²	58.8	46%	0.459	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-8.1	172.3	-59.6	0	0	0	0	114.7	I44 R45 K46 P50	I44-C48 PolarHBondContact O-N 3.02Å; I44-C48 PolarHBondContact O-SG 3.04Å; R45-C48 CarbonylContact O-C 3.53Å; R45-C48 PolarHBondContact O-N 3.2Å; K46-C48 VanDerWaalsContact C-N 3.34Å; C48-P50 WeakPolarHBondContact O-CD 3.5Å
49	E	81.2	Confident	77.2	Confident	57 Å²	57	54 Å²	54	27%	0.266	32%	0.321	S	S	.	.			trans	-80.3	120.9	179.3	-82.7	171.1	-174.3	0	0	110.4	R45 K46 L47 S51 G52 T53	R45-E49 IonicContact CZ-OE1 2.62Å; R45-E49 IonicContact NE-OE1 2.6Å; R45-E49 PolarHBondContact NE-OE1 2.98Å; R45-E49 IonicContact NH2-OE1 2.72Å; R45-E49 PolarHBondContact NH2-OE1 3.01Å; R45-E49 WeakPolarHBondContact O-CG 3.4Å; R45-E49 PolarHBondContact O-N 3.46Å; R45-E49 VanDerWaalsContact O-N 3.09Å; K46-E49 WeakPolarHBondContact CD-OE2 3.46Å; K46-E49 IonicContact NZ-OE2 3.39Å; K46-E49 PolarHBondContact O-N 3.16Å; L47-E49 VanDerWaalsContact C-N 3.33Å; E49-S51 VanDerWaalsContact C-N 3.29Å; E49-S51 PolarHBondContact O-N 3.13Å; E49-G52 WeakPolarHBondContact O-CA 3.41Å; E49-G52 PolarHBondContact O-N 3.29Å; E49-T53 PolarHBondContact O-N 2.91Å; E49-T53 PolarHBondContact O-OG1 3.01Å
50	P	63.3	Low	77.1	Confident	113 Å²	113	53 Å²	53	73%	0.734	32%	0.317	S	S	*	.	H	α-helix	trans	-55.3	-43.7	-178.3	-27.8	35.4	0	0	0	112.8	C48 G52 T53	C48-P50 WeakPolarHBondContact O-CD 3.5Å; P50-G52 PolarHBondContact O-N 3.36Å; P50-T53 PolarHBondContact O-N 3.39Å
51	S	55.5	Low	76.8	Confident	104 Å²	104	58 Å²	58	73%	0.727	34%	0.339	S	S	*	.	H	α-helix	trans	-68.9	-16.9	177.1	-40.3	0	0	0	0	114.1	E49	E49-S51 VanDerWaalsContact C-N 3.29Å; E49-S51 PolarHBondContact O-N 3.13Å
52	G	56.1	Low	76.7	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-79	-34	173.6	0	0	0	0	0	112.7	E49 P50 G54 L92	E49-G52 WeakPolarHBondContact O-CA 3.41Å; E49-G52 PolarHBondContact O-N 3.29Å; P50-G52 PolarHBondContact O-N 3.36Å; G52-G54 VanDerWaalsContact C-N 3.32Å; G52-G54 PolarHBondContact O-N 2.72Å; G52-L92 WeakPolarHBondContact O-CG 3.34Å; G52-L92 PolarHBondContact O-N 3.46Å
53	T	60.8	Low	76.7	Confident	15 Å²	15	54 Å²	54	9%	0.092	31%	0.309	C	S	.	.	H	α-helix	trans	-64.2	-33.7	-174	-59.2	0	0	0	0	112.7	E49 P50 G59 R60 R63	E49-T53 PolarHBondContact O-N 2.91Å; E49-T53 PolarHBondContact O-OG1 3.01Å; P50-T53 PolarHBondContact O-N 3.39Å; T53-G59 CarbonylContact O-C 2.59Å; T53-G59 VanDerWaalsContact O-C 3.26Å; T53-G59 WeakPolarHBondContact O-CA 3.47Å; T53-R60 HydrophobicContact CG2-CB 4.42Å; T53-R60 HydrophobicContact CG2-CG 3.85Å; T53-R63 HydrophobicContact CG2-CB 4.29Å
54	G	60.2	Low	76.7	Confident	25 Å²	25	53.3 Å²	53.3	26%	0.258	31%	0.307	S	S	.	.			trans	80.3	151.3	-171.5	0	0	0	0	0	112.1	G52	G52-G54 VanDerWaalsContact C-N 3.32Å; G52-G54 PolarHBondContact O-N 2.72Å
55	A	58.3	Low	76.6	Confident	108 Å²	108	55.8 Å²	55.8	89%	0.893	32%	0.32	S	S	*	.	S	Bend	trans	-72.6	134.5	-171.4	0	0	0	0	0	112.8
56	G	73.6	Confident	76.6	Confident	31 Å²	31	48.9 Å²	48.9	32%	0.32	29%	0.294	S	S	.	.	S	Bend	trans	89.2	-175.9	172.3	0	0	0	0	0	116	M58 G59	G56-M58 VanDerWaalsContact C-N 3.32Å; G56-M58 PolarHBondContact O-N 3.07Å; G56-G59 PolarHBondContact O-N 3.22Å
57	I	77	Confident	76.8	Confident	43 Å²	43	47.9 Å²	47.9	22%	0.221	29%	0.29	C	S	.	.	H	α-helix	trans	-58.8	-41	-173	-61.5	174.3	0	0	0	112	K9 L13 G59 R60 K61	K9-I57 HydrophobicContact CB-CD1 4.39Å; K9-I57 HydrophobicContact CD-CD1 4.41Å; L13-I57 HydrophobicContact CD1-CG2 3.89Å; I57-G59 VanDerWaalsContact C-N 3.33Å; I57-G59 PolarHBondContact O-N 3.3Å; I57-R60 PolarHBondContact O-N 2.93Å; I57-K61 HydrophobicContact CG2-CD 4.35Å; I57-K61 HydrophobicContact CG2-CG 4.43Å; I57-K61 PolarHBondContact O-N 3.44Å
58	M	77.6	Confident	77	Confident	143 Å²	143	52.4 Å²	52.4	70%	0.704	31%	0.309	S	S	*	.	H	α-helix	trans	-66.3	-34.5	-176	-163.4	62.4	71.6	0	0	112.7	G56 K61 N62	G56-M58 VanDerWaalsContact C-N 3.32Å; G56-M58 PolarHBondContact O-N 3.07Å; M58-K61 PolarHBondContact O-N 3.44Å; M58-N62 PolarHBondContact O-N 3.16Å
59	G	80.9	Confident	77.1	Confident	11 Å²	11	49.2 Å²	49.2	11%	0.113	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-48.3	175.3	0	0	0	0	0	112.1	T53 G56 I57 K61 N62 R63	T53-G59 CarbonylContact O-C 2.59Å; T53-G59 VanDerWaalsContact O-C 3.26Å; T53-G59 WeakPolarHBondContact O-CA 3.47Å; G56-G59 PolarHBondContact O-N 3.22Å; I57-G59 VanDerWaalsContact C-N 3.33Å; I57-G59 PolarHBondContact O-N 3.3Å; G59-K61 PolarHBondContact O-N 2.9Å; G59-N62 PolarHBondContact O-N 2.99Å; G59-R63 PolarHBondContact O-N 3.13Å
60	R	85.7	Confident	77.5	Confident	50 Å²	50	46.5 Å²	46.5	19%	0.189	28%	0.275	C	S	.	.	H	α-helix	trans	-58.7	-46.6	173.8	-71.2	179.6	167.7	101.4	-13.1	112.1	W10 L13 D14 T53 I57 N62 R63 N64	W10-R60 VanDerWaalsContact CB-CZ 3.47Å; W10-R60 VanDerWaalsContact CG-CZ 3.49Å; L13-R60 HydrophobicContact CB-CB 4.01Å; L13-R60 HydrophobicContact CD1-CB 3.92Å; D14-R60 VanDerWaalsContact CG-NE 3.29Å; D14-R60 WeakPolarHBondContact OD1-CD 3.47Å; D14-R60 IonicContact OD1-NE 3.15Å; D14-R60 PolarHBondContact OD1-NE 3.36Å; D14-R60 IonicContact OD2-CZ 3.53Å; D14-R60 IonicContact OD2-NE 3.28Å; D14-R60 PolarHBondContact OD2-NE 3.34Å; D14-R60 IonicContact OD2-NH2 3.6Å; D14-R60 PolarHBondContact OD2-NH2 2.94Å; T53-R60 HydrophobicContact CG2-CB 4.42Å; T53-R60 HydrophobicContact CG2-CG 3.85Å; I57-R60 PolarHBondContact O-N 2.93Å; R60-N62 VanDerWaalsContact C-N 3.33Å; R60-N62 PolarHBondContact O-N 3.16Å; R60-R63 WeakPolarHBondContact O-CB 3.29Å; R60-R63 PolarHBondContact O-N 2.95Å; R60-N64 PolarHBondContact O-N 3.35Å; R60-N64 PolarHBondContact O-OD1 2.92Å
61	K	83.6	Confident	78.7	Confident	107 Å²	107	41.6 Å²	41.6	47%	0.465	24%	0.242	S	C	.	.	H	α-helix	trans	-57.9	-43.1	175.3	-72.9	-169.7	174.6	-168.7	0	112.6	L13 I57 M58 G59 N64 L65	L13-K61 HydrophobicContact CD1-CG 3.72Å; L13-K61 HydrophobicContact CD2-CG 3.93Å; I57-K61 HydrophobicContact CG2-CD 4.35Å; I57-K61 HydrophobicContact CG2-CG 4.43Å; I57-K61 PolarHBondContact O-N 3.44Å; M58-K61 PolarHBondContact O-N 3.44Å; G59-K61 PolarHBondContact O-N 2.9Å; K61-N64 PolarHBondContact O-N 2.96Å; K61-L65 WeakPolarHBondContact O-CG 3.46Å; K61-L65 PolarHBondContact O-N 3.44Å
62	N	86	Confident	80.1	Confident	14 Å²	14	39 Å²	39	8%	0.075	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-44	177.4	-169.7	43.7	0	0	0	112	M58 G59 R60 N64 L65 Y66 L92 K93 L95	M58-N62 PolarHBondContact O-N 3.16Å; G59-N62 PolarHBondContact O-N 2.99Å; R60-N62 VanDerWaalsContact C-N 3.33Å; R60-N62 PolarHBondContact O-N 3.16Å; N62-N64 VanDerWaalsContact C-N 3.29Å; N62-N64 PolarHBondContact O-N 2.75Å; N62-L65 PolarHBondContact O-N 2.75Å; N62-Y66 WeakPolarHBondContact O-CD2 3.24Å; N62-Y66 PolarHBondContact O-N 3.33Å; N62-L92 PolarHBondContact ND2-O 3.14Å; N62-K93 PolarHBondContact ND2-O 3.26Å; N62-L95 PolarHBondContact OD1-N 3.02Å
63	R	88.8	Confident	81.6	Confident	16 Å²	16	39.2 Å²	39.2	6%	0.06	22%	0.22	C	C	.	.	H	α-helix	trans	-54.2	-45.5	171.8	177.6	-157.6	62.2	-161.2	-3	111.5	L13 D14 F17 L47 T53 G59 R60 Y66 A67 L92	L13-R63 PolarHBondContact O-NH2 3.36Å; D14-R63 IonicContact OD1-CZ 2.63Å; D14-R63 IonicContact OD1-NH1 3.37Å; D14-R63 PolarHBondContact OD1-NH1 2.83Å; D14-R63 IonicContact OD1-NH2 2.97Å; D14-R63 PolarHBondContact OD1-NH2 3.36Å; F17-R63 HydrophobicContact CD2-CG 3.88Å; F17-R63 HydrophobicContact CE2-CG 3.79Å; F17-R63 HydrophobicContact CZ-CG 4.33Å; L47-R63 HydrophobicContact CB-CG 3.99Å; L47-R63 HydrophobicContact CD2-CG 3.93Å; L47-R63 WeakPolarHBondContact O-CD 3.5Å; T53-R63 HydrophobicContact CG2-CB 4.29Å; G59-R63 PolarHBondContact O-N 3.13Å; R60-R63 WeakPolarHBondContact O-CB 3.29Å; R60-R63 PolarHBondContact O-N 2.95Å; R63-Y66 PolarHBondContact O-N 2.87Å; R63-A67 PolarHBondContact O-N 3.49Å; R63-L92 HydrophobicContact CB-CD1 4Å; R63-L92 HydrophobicContact CG-CD1 4.41Å
64	N	89.8	Confident	82.8	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.027	22%	0.217	C	C	.	.	H	α-helix	trans	-66.2	-38.1	-178.9	-66.5	18.8	0	0	0	112	L13 E16 F17 F20 R60 K61 N62 A67 K68	L13-N64 PolarHBondContact O-ND2 2.97Å; L13-N64 PolarHBondContact O-OD1 2.68Å; E16-N64 PolarHBondContact OE2-ND2 3.35Å; F17-N64 WeakPolarHBondContact CB-OD1 3.14Å; F20-N64 HydrophobicContact CE2-CB 4.47Å; R60-N64 PolarHBondContact O-N 3.35Å; R60-N64 PolarHBondContact O-OD1 2.92Å; K61-N64 PolarHBondContact O-N 2.96Å; N62-N64 VanDerWaalsContact C-N 3.29Å; N62-N64 PolarHBondContact O-N 2.75Å; N64-A67 WeakPolarHBondContact O-CB 3.43Å; N64-A67 PolarHBondContact O-N 3.26Å; N64-K68 WeakPolarHBondContact O-CB 3.47Å; N64-K68 PolarHBondContact O-N 3.43Å
65	L	87	Confident	84	Confident	81 Å²	81	42.1 Å²	42.1	42%	0.424	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-43.7	173.2	-73.1	168.3	0	0	0	112.3	K61 N62 A67 K68 L69 L95	K61-L65 WeakPolarHBondContact O-CG 3.46Å; K61-L65 PolarHBondContact O-N 3.44Å; N62-L65 PolarHBondContact O-N 2.75Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 2.85Å; L65-K68 PolarHBondContact O-N 3.48Å; L65-L69 WeakPolarHBondContact O-CB 3.41Å; L65-L69 PolarHBondContact O-N 3.36Å; L65-L95 HydrophobicContact CB-CD2 4.47Å
66	Y	87.9	Confident	85	Confident	15 Å²	15	43 Å²	43	6%	0.059	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-38	173.1	-88.1	-96.9	0	0	0	112.1	W43 N62 R63 L70 P82 F83 K93 L95	W43-Y66 HydrophobicContact CH2-CE1 4.46Å; W43-Y66 HydrophobicContact CZ3-CD1 4.2Å; W43-Y66 HydrophobicContact CZ3-CE1 4.31Å; N62-Y66 WeakPolarHBondContact O-CD2 3.24Å; N62-Y66 PolarHBondContact O-N 3.33Å; R63-Y66 PolarHBondContact O-N 2.87Å; Y66-L70 WeakPolarHBondContact O-CB 3.39Å; Y66-L70 PolarHBondContact O-N 3.24Å; Y66-P82 HydrophobicContact CD1-CG 4.42Å; Y66-P82 HydrophobicContact CE1-CB 4.09Å; Y66-P82 HydrophobicContact CE1-CG 3.85Å; Y66-F83 HydrophobicContact CD1-CE1 4.05Å; Y66-F83 AromaticContact CD1-CZ 3.88Å; Y66-F83 HydrophobicContact CD1-CZ 3.88Å; Y66-F83 WeakPolarHBondContact O-CZ 3.26Å; Y66-K93 VanDerWaalsContact CE2-O 3.26Å; Y66-K93 WeakPolarHBondContact CE2-O 3.43Å; Y66-K93 PolarHBondContact OH-O 3.02Å; Y66-L95 HydrophobicContact CD1-CD1 4.39Å; Y66-L95 HydrophobicContact CD2-CB 4.23Å; Y66-L95 HydrophobicContact CD2-CD1 4.36Å; Y66-L95 HydrophobicContact CE1-CD1 3.93Å; Y66-L95 HydrophobicContact CE2-CB 3.67Å; Y66-L95 HydrophobicContact CE2-CD1 3.9Å; Y66-L95 HydrophobicContact CE2-CG 4.37Å
67	A	89.6	Confident	85.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-46.8	175.2	0	0	0	0	0	112.1	F17 F20 M24 L47 R63 N64 L65 L70 L71	F17-A67 HydrophobicContact CD2-CB 3.76Å; F17-A67 HydrophobicContact CE2-CB 3.82Å; F20-A67 HydrophobicContact CB-CB 4.03Å; F20-A67 HydrophobicContact CD2-CB 3.99Å; F20-A67 HydrophobicContact CG-CB 4.42Å; M24-A67 HydrophobicContact CE-CB 3.79Å; M24-A67 WeakPolarHBondContact CE-O 3.36Å; L47-A67 HydrophobicContact CD1-CB 4.26Å; R63-A67 PolarHBondContact O-N 3.49Å; N64-A67 WeakPolarHBondContact O-CB 3.43Å; N64-A67 PolarHBondContact O-N 3.26Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 2.85Å; A67-L70 PolarHBondContact O-N 3Å; A67-L71 WeakPolarHBondContact O-CB 3.43Å; A67-L71 PolarHBondContact O-N 3.28Å
68	K	88.7	Confident	85.4	Confident	95 Å²	95	45.3 Å²	45.3	41%	0.413	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-40.8	178.2	-167.8	176.9	-178.7	176.7	0	111.9	F20 N64 L65 H72 F103	F20-K68 HydrophobicContact CD2-CB 4.35Å; F20-K68 HydrophobicContact CE1-CB 4.41Å; F20-K68 HydrophobicContact CE1-CG 4.18Å; F20-K68 HydrophobicContact CE2-CB 3.93Å; F20-K68 HydrophobicContact CE2-CG 4.41Å; F20-K68 HydrophobicContact CZ-CB 3.98Å; F20-K68 HydrophobicContact CZ-CD 3.96Å; F20-K68 HydrophobicContact CZ-CG 3.95Å; N64-K68 WeakPolarHBondContact O-CB 3.47Å; N64-K68 PolarHBondContact O-N 3.43Å; L65-K68 PolarHBondContact O-N 3.48Å; K68-H72 WeakPolarHBondContact O-CB 3.47Å; K68-H72 PolarHBondContact O-N 2.86Å; K68-F103 HydrophobicContact CB-CE1 4.42Å; K68-F103 HydrophobicContact CD-CE1 4.38Å; K68-F103 HydrophobicContact CG-CE1 3.95Å; K68-F103 HydrophobicContact CG-CZ 4.44Å
69	L	88.1	Confident	85.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-47	174.8	-173.3	67	0	0	0	111.6	L65 L71 H72 M73 F83 L95 M99 Y102 F103	L65-L69 WeakPolarHBondContact O-CB 3.41Å; L65-L69 PolarHBondContact O-N 3.36Å; L69-L71 VanDerWaalsContact C-N 3.35Å; L69-L71 PolarHBondContact O-N 2.9Å; L69-H72 PolarHBondContact O-N 3.2Å; L69-M73 HydrophobicContact CD1-CE 4.09Å; L69-M73 HydrophobicContact CD2-CE 4.33Å; L69-M73 HydrophobicContact CG-CE 4.18Å; L69-M73 HydrophobicContact CG-SD 4.2Å; L69-M73 WeakPolarHBondContact O-CB 3.31Å; L69-M73 PolarHBondContact O-N 3Å; L69-F83 HydrophobicContact CB-CE2 4.29Å; L69-F83 HydrophobicContact CD2-CE2 3.89Å; L69-F83 HydrophobicContact CD2-CZ 4.49Å; L69-F83 HydrophobicContact CG-CE2 4.01Å; L69-L95 HydrophobicContact CD2-CD1 3.82Å; L69-L95 HydrophobicContact CD2-CD2 4.09Å; L69-M99 HydrophobicContact CD2-CB 4.15Å; L69-M99 HydrophobicContact CD2-CG 4.44Å; L69-M99 HydrophobicContact CD2-SD 3.85Å; L69-Y102 HydrophobicContact CD1-CD2 4.07Å; L69-Y102 HydrophobicContact CD1-CG 4.11Å; L69-F103 HydrophobicContact CB-CE1 4.39Å; L69-F103 HydrophobicContact CB-CZ 3.9Å; L69-F103 HydrophobicContact CD1-CE1 4.2Å; L69-F103 HydrophobicContact CD1-CE2 4.49Å; L69-F103 HydrophobicContact CD1-CZ 3.91Å
70	L	88.5	Confident	85.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-44.5	177.7	-178.5	54.3	0	0	0	111.1	M24 W43 I44 Y66 A67 H72 M73 L74 L79 F83	M24-L70 HydrophobicContact SD-CB 3.96Å; M24-L70 HydrophobicContact SD-CD2 3.71Å; M24-L70 HydrophobicContact SD-CG 3.63Å; W43-L70 HydrophobicContact CB-CD2 4.31Å; I44-L70 HydrophobicContact CG1-CD2 4.03Å; Y66-L70 WeakPolarHBondContact O-CB 3.39Å; Y66-L70 PolarHBondContact O-N 3.24Å; A67-L70 PolarHBondContact O-N 3Å; L70-H72 VanDerWaalsContact C-N 3.34Å; L70-H72 PolarHBondContact O-N 2.8Å; L70-M73 PolarHBondContact O-N 2.9Å; L70-L74 HydrophobicContact CD1-CD1 3.99Å; L70-L74 HydrophobicContact CD1-CG 4.11Å; L70-L74 HydrophobicContact CG-CD1 3.83Å; L70-L74 HydrophobicContact CG-CG 4.43Å; L70-L74 VanDerWaalsContact O-CB 3.26Å; L70-L74 WeakPolarHBondContact O-CB 3.37Å; L70-L74 WeakPolarHBondContact O-CD1 3.4Å; L70-L74 WeakPolarHBondContact O-CG 3.5Å; L70-L74 PolarHBondContact O-N 3.18Å; L70-L79 HydrophobicContact CD1-CD2 3.68Å; L70-F83 HydrophobicContact CB-CD1 4.46Å; L70-F83 HydrophobicContact CB-CD2 4.45Å; L70-F83 HydrophobicContact CB-CE1 3.97Å; L70-F83 HydrophobicContact CB-CE2 3.95Å; L70-F83 HydrophobicContact CB-CZ 3.7Å; L70-F83 HydrophobicContact CD1-CB 4.26Å; L70-F83 HydrophobicContact CD1-CD1 3.95Å; L70-F83 HydrophobicContact CD1-CD2 4.02Å; L70-F83 HydrophobicContact CD1-CE1 4.32Å; L70-F83 HydrophobicContact CD1-CE2 4.38Å; L70-F83 HydrophobicContact CD1-CG 3.79Å; L70-F83 HydrophobicContact CD2-CD1 4.28Å; L70-F83 HydrophobicContact CD2-CE1 4.19Å; L70-F83 HydrophobicContact CG-CD1 4.45Å; L70-F83 HydrophobicContact CG-CE1 4.38Å
71	L	88.7	Confident	85.3	Confident	10 Å²	10	42.6 Å²	42.6	5%	0.052	22%	0.218	C	C	.	.	H	α-helix	trans	-58.5	-43.2	174.6	177.3	58.9	0	0	0	112.5	F20 D23 M24 Y27 A67 L69 L74 K75	F20-L71 HydrophobicContact CB-CD2 4.37Å; F20-L71 HydrophobicContact CD1-CD2 3.69Å; F20-L71 HydrophobicContact CE1-CD2 4.5Å; F20-L71 HydrophobicContact CG-CD2 4.41Å; D23-L71 HydrophobicContact CB-CD1 4Å; D23-L71 HydrophobicContact CB-CD2 3.93Å; M24-L71 HydrophobicContact CB-CD1 4.38Å; M24-L71 HydrophobicContact CG-CB 3.73Å; M24-L71 HydrophobicContact CG-CD1 3.72Å; M24-L71 HydrophobicContact CG-CG 4.29Å; M24-L71 HydrophobicContact SD-CB 4.44Å; Y27-L71 HydrophobicContact CD2-CD1 4.37Å; A67-L71 WeakPolarHBondContact O-CB 3.43Å; A67-L71 PolarHBondContact O-N 3.28Å; L69-L71 VanDerWaalsContact C-N 3.35Å; L69-L71 PolarHBondContact O-N 2.9Å; L71-L74 PolarHBondContact O-N 3.46Å; L71-K75 HydrophobicContact CD1-CD 4.21Å; L71-K75 HydrophobicContact CD1-CG 4.41Å; L71-K75 HydrophobicContact CG-CD 4.28Å; L71-K75 WeakPolarHBondContact O-CB 3.45Å; L71-K75 WeakPolarHBondContact O-CG 3.49Å; L71-K75 PolarHBondContact O-N 3.31Å
72	H	86.1	Confident	85.1	Confident	51 Å²	51	39 Å²	39	24%	0.236	21%	0.206	C	C	.	.	H	α-helix	trans	-68.4	-45.4	179.4	-177.5	-110.1	0	0	0	112.5	K68 L69 L70 L74 K75 R76 Y102	K68-H72 WeakPolarHBondContact O-CB 3.47Å; K68-H72 PolarHBondContact O-N 2.86Å; L69-H72 PolarHBondContact O-N 3.2Å; L70-H72 VanDerWaalsContact C-N 3.34Å; L70-H72 PolarHBondContact O-N 2.8Å; H72-L74 VanDerWaalsContact C-N 3.3Å; H72-L74 PolarHBondContact O-N 2.98Å; H72-K75 WeakPolarHBondContact O-CB 3.31Å; H72-K75 PolarHBondContact O-N 3.33Å; H72-K75 VanDerWaalsContact O-N 3.11Å; H72-R76 WeakPolarHBondContact CE1-CD 3.34Å; H72-R76 PolarHBondContact O-N 2.87Å; H72-Y102 PolarHBondContact CE1-O 2.82Å; H72-Y102 PolarHBondContact ND1-O 2.9Å
73	M	86.9	Confident	85.1	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.02	20%	0.203	C	C	.	.	H	α-helix	trans	-58.3	-40.9	173.1	-79.5	-179	172.6	0	0	112.1	L69 L70 R76 G77 V78 L79 E80 F83 M99 Y102	L69-M73 HydrophobicContact CD1-CE 4.09Å; L69-M73 HydrophobicContact CD2-CE 4.33Å; L69-M73 HydrophobicContact CG-CE 4.18Å; L69-M73 HydrophobicContact CG-SD 4.2Å; L69-M73 WeakPolarHBondContact O-CB 3.31Å; L69-M73 PolarHBondContact O-N 3Å; L70-M73 PolarHBondContact O-N 2.9Å; M73-R76 PolarHBondContact O-N 2.99Å; M73-G77 PolarHBondContact O-N 2.83Å; M73-V78 CarbonylContact C-O 3.54Å; M73-V78 WeakPolarHBondContact CA-O 3.37Å; M73-V78 WeakPolarHBondContact CB-O 3.48Å; M73-V78 PolarHBondContact O-N 2.85Å; M73-L79 HydrophobicContact CB-CD2 4.25Å; M73-E80 HydrophobicContact CE-CB 4.11Å; M73-F83 HydrophobicContact SD-CD2 3.76Å; M73-F83 HydrophobicContact SD-CE2 4.08Å; M73-M99 HydrophobicContact CE-SD 4.25Å; M73-Y102 HydrophobicContact CE-CD1 4.01Å; M73-Y102 HydrophobicContact CE-CD2 4.01Å; M73-Y102 HydrophobicContact CE-CE1 3.79Å; M73-Y102 HydrophobicContact CE-CE2 3.81Å; M73-Y102 HydrophobicContact CE-CG 4.11Å
74	L	86.4	Confident	84.9	Confident	6 Å²	6	39.9 Å²	39.9	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-36.6	173.3	-75	166.5	0	0	0	113.4	M24 V28 L31 L70 L71 H72 G77 L79	M24-L74 HydrophobicContact CB-CD1 4.05Å; M24-L74 HydrophobicContact CG-CD1 3.69Å; M24-L74 HydrophobicContact SD-CD1 3.95Å; V28-L74 HydrophobicContact CG2-CD1 3.48Å; V28-L74 VanDerWaalsContact CG2-CD1 3.48Å; V28-L74 HydrophobicContact CG2-CD2 3.9Å; V28-L74 HydrophobicContact CG2-CG 4.36Å; L31-L74 HydrophobicContact CD1-CD2 3.63Å; L31-L74 HydrophobicContact CD2-CD2 4.22Å; L31-L74 HydrophobicContact CG-CD2 4.04Å; L70-L74 HydrophobicContact CD1-CD1 3.99Å; L70-L74 HydrophobicContact CD1-CG 4.11Å; L70-L74 HydrophobicContact CG-CD1 3.83Å; L70-L74 HydrophobicContact CG-CG 4.43Å; L70-L74 VanDerWaalsContact O-CB 3.26Å; L70-L74 WeakPolarHBondContact O-CB 3.37Å; L70-L74 WeakPolarHBondContact O-CD1 3.4Å; L70-L74 WeakPolarHBondContact O-CG 3.5Å; L70-L74 PolarHBondContact O-N 3.18Å; L71-L74 PolarHBondContact O-N 3.46Å; H72-L74 VanDerWaalsContact C-N 3.3Å; H72-L74 PolarHBondContact O-N 2.98Å; L74-G77 PolarHBondContact O-N 3.42Å; L74-L79 HydrophobicContact CD2-CD2 4.07Å; L74-L79 HydrophobicContact CG-CD2 4.17Å
75	K	84	Confident	84.5	Confident	95 Å²	95	46.3 Å²	46.3	41%	0.413	24%	0.243	S	C	.	.	H	α-helix	trans	-67.3	-34.2	174.8	-82.2	174.7	175.4	174.6	0	112.3	D23 Y27 L71 H72	D23-K75 WeakPolarHBondContact OD2-CE 3.44Å; D23-K75 IonicContact OD2-NZ 2.68Å; D23-K75 PolarHBondContact OD2-NZ 3.03Å; Y27-K75 HydrophobicContact CD1-CG 4.12Å; Y27-K75 HydrophobicContact CD2-CG 4.09Å; Y27-K75 HydrophobicContact CE1-CB 4.45Å; Y27-K75 HydrophobicContact CE1-CG 3.74Å; Y27-K75 HydrophobicContact CE2-CD 4.29Å; Y27-K75 HydrophobicContact CE2-CG 3.73Å; Y27-K75 HydrophobicContact CG-CG 4.3Å; L71-K75 HydrophobicContact CD1-CD 4.21Å; L71-K75 HydrophobicContact CD1-CG 4.41Å; L71-K75 HydrophobicContact CG-CD 4.28Å; L71-K75 WeakPolarHBondContact O-CB 3.45Å; L71-K75 WeakPolarHBondContact O-CG 3.49Å; L71-K75 PolarHBondContact O-N 3.31Å; H72-K75 WeakPolarHBondContact O-CB 3.31Å; H72-K75 PolarHBondContact O-N 3.33Å; H72-K75 VanDerWaalsContact O-N 3.11Å
76	R	80.5	Confident	84.3	Confident	125 Å²	125	51 Å²	51	47%	0.472	26%	0.255	S	S	.	.	H	α-helix	trans	-81.7	-14.3	171.8	-71.5	175.1	73.8	150	-1.3	114.2	H72 M73 V78 E105	H72-R76 WeakPolarHBondContact CE1-CD 3.34Å; H72-R76 PolarHBondContact O-N 2.87Å; M73-R76 PolarHBondContact O-N 2.99Å; R76-V78 VanDerWaalsContact C-N 3.34Å; R76-E105 IonicContact CZ-OE2 3.99Å; R76-E105 IonicContact NH1-OE2 3.53Å; R76-E105 PolarHBondContact NH1-OE2 3.43Å; R76-E105 IonicContact NH2-OE2 3.56Å; R76-E105 PolarHBondContact NH2-OE2 3.36Å
77	G	78.3	Confident	84.2	Confident	51 Å²	51	51.7 Å²	51.7	53%	0.526	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	15.7	-178.3	0	0	0	0	0	114.9	M73 L74	M73-G77 PolarHBondContact O-N 2.83Å; L74-G77 PolarHBondContact O-N 3.42Å
78	V	80.4	Confident	83.7	Confident	73 Å²	73	57.3 Å²	57.3	44%	0.442	29%	0.287	S	S	.	.			trans	-127.7	117	-175.3	178.8	0	0	0	0	109.2	M73 R76 E80	M73-V78 CarbonylContact C-O 3.54Å; M73-V78 WeakPolarHBondContact CA-O 3.37Å; M73-V78 WeakPolarHBondContact CB-O 3.48Å; M73-V78 PolarHBondContact O-N 2.85Å; R76-V78 VanDerWaalsContact C-N 3.34Å; V78-E80 HydrophobicContact CG1-CG 3.92Å; V78-E80 VanDerWaalsContact CG1-OE1 3.31Å; V78-E80 WeakPolarHBondContact CG1-OE1 3.38Å
79	L	83.3	Confident	82.9	Confident	28 Å²	28	59 Å²	59	15%	0.147	31%	0.308	C	S	.	.			trans	-105.9	102	-175.7	-71.3	170	0	0	0	111.1	L31 E36 C40 L70 M73 L74 T84	L31-L79 HydrophobicContact CD1-CD1 3.99Å; L31-L79 HydrophobicContact CD2-CD1 4.42Å; E36-L79 HydrophobicContact CB-CD1 4.1Å; E36-L79 HydrophobicContact CG-CD1 4.27Å; C40-L79 VanDerWaalsContact SG-CD1 3.56Å; L70-L79 HydrophobicContact CD1-CD2 3.68Å; M73-L79 HydrophobicContact CB-CD2 4.25Å; L74-L79 HydrophobicContact CD2-CD2 4.07Å; L74-L79 HydrophobicContact CG-CD2 4.17Å; L79-T84 WeakPolarHBondContact O-CG2 3.3Å
80	E	80	Confident	82.2	Confident	90 Å²	90	61.1 Å²	61.1	42%	0.421	33%	0.33	S	S	.	.			trans	-119.2	177.6	-175.7	-75.9	177.2	-171.5	0	0	112.7	M73 V78 Y102	M73-E80 HydrophobicContact CE-CB 4.11Å; V78-E80 HydrophobicContact CG1-CG 3.92Å; V78-E80 VanDerWaalsContact CG1-OE1 3.31Å; V78-E80 WeakPolarHBondContact CG1-OE1 3.38Å; E80-Y102 PolarHBondContact OE2-OH 3.06Å
81	G	79.3	Confident	81.5	Confident	29 Å²	29	65.8 Å²	65.8	30%	0.299	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	56.9	-131.3	179.8	0	0	0	0	0	113.1	F83 T84	G81-F83 VanDerWaalsContact C-N 3.25Å; G81-F83 PolarHBondContact O-N 3.44Å; G81-T84 WeakPolarHBondContact O-CB 3.28Å; G81-T84 WeakPolarHBondContact O-CG2 3.43Å; G81-T84 PolarHBondContact O-N 3.44Å; G81-T84 PolarHBondContact O-OG1 3.29Å
82	P	78.3	Confident	81	Confident	32 Å²	32	66.5 Å²	66.5	21%	0.208	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-62.7	-28.3	-169.8	26.1	-34.4	0	0	0	113.9	W43 Y66 T84 H85	W43-P82 HydrophobicContact CH2-CB 4.17Å; W43-P82 HydrophobicContact CZ2-CB 4.09Å; W43-P82 VanDerWaalsContact CZ2-O 3.28Å; W43-P82 WeakPolarHBondContact CZ2-O 3.36Å; W43-P82 PolarHBondContact NE1-O 2.9Å; Y66-P82 HydrophobicContact CD1-CG 4.42Å; Y66-P82 HydrophobicContact CE1-CB 4.09Å; Y66-P82 HydrophobicContact CE1-CG 3.85Å; P82-T84 PolarHBondContact O-N 3.16Å; P82-H85 PolarHBondContact O-N 2.91Å
83	F	87.1	Confident	80.7	Confident	3 Å²	3	70.3 Å²	70.3	1%	0.013	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-75.9	-10.1	-175.2	-50.6	-61.8	0	0	0	113.8	W43 Y66 L69 L70 M73 G81 H85	W43-F83 HydrophobicContact CB-CD1 4.26Å; W43-F83 AromaticContact CD1-CD1 4Å; W43-F83 AromaticContact CD2-CD1 3.74Å; W43-F83 HydrophobicContact CD2-CD1 3.74Å; W43-F83 HydrophobicContact CD2-CE1 4.05Å; W43-F83 HydrophobicContact CE3-CD1 4.21Å; W43-F83 HydrophobicContact CE3-CE1 4.02Å; W43-F83 AromaticContact CG-CD1 3.76Å; W43-F83 HydrophobicContact CG-CD1 3.76Å; W43-F83 HydrophobicContact CG-CE1 4.33Å; Y66-F83 HydrophobicContact CD1-CE1 4.05Å; Y66-F83 AromaticContact CD1-CZ 3.88Å; Y66-F83 HydrophobicContact CD1-CZ 3.88Å; Y66-F83 WeakPolarHBondContact O-CZ 3.26Å; L69-F83 HydrophobicContact CB-CE2 4.29Å; L69-F83 HydrophobicContact CD2-CE2 3.89Å; L69-F83 HydrophobicContact CD2-CZ 4.49Å; L69-F83 HydrophobicContact CG-CE2 4.01Å; L70-F83 HydrophobicContact CB-CD1 4.46Å; L70-F83 HydrophobicContact CB-CD2 4.45Å; L70-F83 HydrophobicContact CB-CE1 3.97Å; L70-F83 HydrophobicContact CB-CE2 3.95Å; L70-F83 HydrophobicContact CB-CZ 3.7Å; L70-F83 HydrophobicContact CD1-CB 4.26Å; L70-F83 HydrophobicContact CD1-CD1 3.95Å; L70-F83 HydrophobicContact CD1-CD2 4.02Å; L70-F83 HydrophobicContact CD1-CE1 4.32Å; L70-F83 HydrophobicContact CD1-CE2 4.38Å; L70-F83 HydrophobicContact CD1-CG 3.79Å; L70-F83 HydrophobicContact CD2-CD1 4.28Å; L70-F83 HydrophobicContact CD2-CE1 4.19Å; L70-F83 HydrophobicContact CG-CD1 4.45Å; L70-F83 HydrophobicContact CG-CE1 4.38Å; M73-F83 HydrophobicContact SD-CD2 3.76Å; M73-F83 HydrophobicContact SD-CE2 4.08Å; G81-F83 VanDerWaalsContact C-N 3.25Å; G81-F83 PolarHBondContact O-N 3.44Å; F83-H85 VanDerWaalsContact C-N 3.3Å
84	T	83.4	Confident	80.4	Confident	45 Å²	45	76.9 Å²	76.9	28%	0.276	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-68.2	-29.5	172.1	62.4	0	0	0	0	112.3	R39 L79 G81 P82	R39-T84 VanDerWaalsContact CD-O 3.3Å; R39-T84 WeakPolarHBondContact CD-O 3.43Å; R39-T84 PolarHBondContact NH1-O 3.07Å; L79-T84 WeakPolarHBondContact O-CG2 3.3Å; G81-T84 WeakPolarHBondContact O-CB 3.28Å; G81-T84 WeakPolarHBondContact O-CG2 3.43Å; G81-T84 PolarHBondContact O-N 3.44Å; G81-T84 PolarHBondContact O-OG1 3.29Å; P82-T84 PolarHBondContact O-N 3.16Å
85	H	82.8	Confident	79.9	Confident	139 Å²	139	77.8 Å²	77.8	64%	0.644	42%	0.417	S	S	*	.	S	Bend	trans	-103.4	173.7	178.8	-60	-59.1	0	0	0	111.5	W43 P82 F83	W43-H85 PolarHBondContact NE1-O 3.43Å; P82-H85 PolarHBondContact O-N 2.91Å; F83-H85 VanDerWaalsContact C-N 3.3Å
86	R	82.1	Confident	79.6	Confident	180 Å²	180	76.1 Å²	76.1	68%	0.679	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-76.3	147.7	167.8	-73.7	-173.5	178.5	-178.2	1.4	109.3	L42	L42-R86 HydrophobicContact CD1-CG 4.15Å
87	P	85.4	Confident	79.1	Confident	30 Å²	30	75.2 Å²	75.2	20%	0.195	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-60.6	139.5	174.3	23.5	-31.6	0	0	0	111.4	L42 W43 K46	L42-P87 HydrophobicContact CB-CG 4.44Å; W43-P87 HydrophobicContact CD2-CB 3.89Å; W43-P87 HydrophobicContact CD2-CG 4.25Å; W43-P87 HydrophobicContact CE3-CB 3.97Å; W43-P87 HydrophobicContact CG-CG 4.42Å; W43-P87 HydrophobicContact CH2-CB 4.01Å; W43-P87 HydrophobicContact CZ2-CB 3.93Å; W43-P87 HydrophobicContact CZ3-CB 4.03Å; K46-P87 HydrophobicContact CB-CB 3.95Å; K46-P87 HydrophobicContact CB-CG 3.92Å; K46-P87 HydrophobicContact CG-CB 3.76Å; K46-P87 HydrophobicContact CG-CG 4.24Å
88	E	79.6	Confident	79	Confident	117 Å²	117	80 Å²	80	55%	0.547	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-71.6	149.5	175.2	-66.7	174.8	154.8	0	0	111.5	K93	E88-K93 VanDerWaalsContact CD-NZ 3.3Å; E88-K93 IonicContact OE1-NZ 3.57Å; E88-K93 PolarHBondContact OE1-NZ 2.89Å; E88-K93 VanDerWaalsContact OE1-NZ 3.15Å; E88-K93 WeakPolarHBondContact OE2-CE 3.44Å; E88-K93 IonicContact OE2-NZ 3.7Å; E88-K93 PolarHBondContact OE2-NZ 3.36Å
89	P	72.4	Confident	78.6	Confident	131 Å²	131	76.8 Å²	76.8	85%	0.851	41%	0.412	S	S	*	.	S	Bend	trans	-65.1	146.3	167.4	-18.5	32.4	0	0	0	111.8
90	G	72.5	Confident	77.8	Confident	45 Å²	45	78 Å²	78	46%	0.464	42%	0.423	S	S	.	.	S	Bend	trans	110.6	-159.2	-176.7	0	0	0	0	0	113.5	K46	K46-G90 WeakPolarHBondContact CE-O 3.39Å; K46-G90 PolarHBondContact NZ-O 3.35Å
91	T	74.5	Confident	77.1	Confident	98 Å²	98	78.6 Å²	78.6	60%	0.601	43%	0.428	S	S	*	.	S	Bend	trans	-83.2	153.4	176	44.1	0	0	0	0	111.7	K93	T91-K93 PolarHBondContact O-N 3.3Å
92	L	78.5	Confident	76.5	Confident	24 Å²	24	79.4 Å²	79.4	13%	0.126	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-65.2	120.4	176.7	-68	161.1	0	0	0	111.1	W43 K46 L47 G52 N62 R63	W43-L92 HydrophobicContact CZ3-CD2 4.15Å; K46-L92 HydrophobicContact CG-CD2 4.46Å; L47-L92 HydrophobicContact CD2-CD1 3.73Å; L47-L92 HydrophobicContact CD2-CD2 4.07Å; G52-L92 WeakPolarHBondContact O-CG 3.34Å; G52-L92 PolarHBondContact O-N 3.46Å; N62-L92 PolarHBondContact ND2-O 3.14Å; R63-L92 HydrophobicContact CB-CD1 4Å; R63-L92 HydrophobicContact CG-CD1 4.41Å
93	K	79.9	Confident	76.1	Confident	131 Å²	131	81 Å²	81	57%	0.57	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-58.8	151	167.7	-70.4	170.8	174.9	167.5	0	110.1	N62 Y66 E88 T91	N62-K93 PolarHBondContact ND2-O 3.26Å; Y66-K93 VanDerWaalsContact CE2-O 3.26Å; Y66-K93 WeakPolarHBondContact CE2-O 3.43Å; Y66-K93 PolarHBondContact OH-O 3.02Å; E88-K93 VanDerWaalsContact CD-NZ 3.3Å; E88-K93 IonicContact OE1-NZ 3.57Å; E88-K93 PolarHBondContact OE1-NZ 2.89Å; E88-K93 VanDerWaalsContact OE1-NZ 3.15Å; E88-K93 WeakPolarHBondContact OE2-CE 3.44Å; E88-K93 IonicContact OE2-NZ 3.7Å; E88-K93 PolarHBondContact OE2-NZ 3.36Å; T91-K93 PolarHBondContact O-N 3.3Å
94	I	79.3	Confident	74.6	Confident	142 Å²	142	87 Å²	87	73%	0.728	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-68	134.8	176.8	-60.4	174.6	0	0	0	109.1	P96	I94-P96 WeakPolarHBondContact O-CD 3.29Å
95	L	77.1	Confident	72.8	Confident	25 Å²	25	91 Å²	91	13%	0.131	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-62.5	125.4	179.5	-171	69.8	0	0	0	110.7	N62 L65 Y66 L69 M99	N62-L95 PolarHBondContact OD1-N 3.02Å; L65-L95 HydrophobicContact CB-CD2 4.47Å; Y66-L95 HydrophobicContact CD1-CD1 4.39Å; Y66-L95 HydrophobicContact CD2-CB 4.23Å; Y66-L95 HydrophobicContact CD2-CD1 4.36Å; Y66-L95 HydrophobicContact CE1-CD1 3.93Å; Y66-L95 HydrophobicContact CE2-CB 3.67Å; Y66-L95 HydrophobicContact CE2-CD1 3.9Å; Y66-L95 HydrophobicContact CE2-CG 4.37Å; L69-L95 HydrophobicContact CD2-CD1 3.82Å; L69-L95 HydrophobicContact CD2-CD2 4.09Å; L95-M99 HydrophobicContact CD1-CB 4.04Å; L95-M99 HydrophobicContact CD1-CG 4.18Å; L95-M99 HydrophobicContact CD2-CB 4.08Å; L95-M99 HydrophobicContact CG-CB 3.93Å
96	P	77.6	Confident	71.1	Confident	60 Å²	60	90.1 Å²	90.1	39%	0.39	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-62.8	138.7	179.4	-25.1	35.5	0	0	0	112.6	I94 Y98 M99	I94-P96 WeakPolarHBondContact O-CD 3.29Å; P96-Y98 HydrophobicContact CB-CD1 3.68Å; P96-Y98 HydrophobicContact CB-CE1 3.57Å; P96-Y98 HydrophobicContact CG-CE1 4.23Å; P96-Y98 PolarHBondContact O-N 3.41Å; P96-Y98 VanDerWaalsContact O-N 3.07Å; P96-M99 WeakPolarHBondContact O-CB 3.4Å; P96-M99 PolarHBondContact O-N 2.97Å
97	S	69.3	Low	68.9	Low	107 Å²	107	88.3 Å²	88.3	75%	0.748	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-53.7	-35.8	-172.4	-163	0	0	0	0	114.2	M99 S100	S97-M99 PolarHBondContact O-N 3.2Å; S97-S100 WeakPolarHBondContact O-CB 3.45Å; S97-S100 PolarHBondContact O-N 3.41Å; S97-S100 PolarHBondContact O-OG 2.85Å; S97-S100 VanDerWaalsContact O-OG 3.07Å
98	Y	75.1	Confident	66.8	Low	151 Å²	151	93.2 Å²	93.2	59%	0.592	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-63.9	-11.8	178.7	81.5	-87.6	0	0	0	114.6	P96 S100 I101	P96-Y98 HydrophobicContact CB-CD1 3.68Å; P96-Y98 HydrophobicContact CB-CE1 3.57Å; P96-Y98 HydrophobicContact CG-CE1 4.23Å; P96-Y98 PolarHBondContact O-N 3.41Å; P96-Y98 VanDerWaalsContact O-N 3.07Å; Y98-S100 VanDerWaalsContact C-N 3.3Å; Y98-I101 WeakPolarHBondContact O-CD1 3.44Å; Y98-I101 VanDerWaalsContact O-CG1 3.31Å; Y98-I101 WeakPolarHBondContact O-CG1 3.42Å
99	M	72.6	Confident	65	Low	5 Å²	5	91 Å²	91	3%	0.025	52%	0.518	C	S	.	.	G	3₁₀ helix	trans	-81	-4.5	171.9	-70.8	-90.6	135.2	0	0	113.1	L69 M73 L95 P96 S97 I101 Y102	L69-M99 HydrophobicContact CD2-CB 4.15Å; L69-M99 HydrophobicContact CD2-CG 4.44Å; L69-M99 HydrophobicContact CD2-SD 3.85Å; M73-M99 HydrophobicContact CE-SD 4.25Å; L95-M99 HydrophobicContact CD1-CB 4.04Å; L95-M99 HydrophobicContact CD1-CG 4.18Å; L95-M99 HydrophobicContact CD2-CB 4.08Å; L95-M99 HydrophobicContact CG-CB 3.93Å; P96-M99 WeakPolarHBondContact O-CB 3.4Å; P96-M99 PolarHBondContact O-N 2.97Å; S97-M99 PolarHBondContact O-N 3.2Å; M99-I101 VanDerWaalsContact C-N 3.3Å; M99-Y102 HydrophobicContact CE-CE2 3.84Å; M99-Y102 WeakPolarHBondContact O-CD2 3.42Å; M99-Y102 HydrophobicContact SD-CD2 4.3Å; M99-Y102 HydrophobicContact SD-CE2 3.85Å
100	S	66.8	Low	63.4	Low	53 Å²	53	94.4 Å²	94.4	37%	0.371	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-71.1	-25.9	173.3	72.2	0	0	0	0	112.8	S97 Y98 Y102 F103	S97-S100 WeakPolarHBondContact O-CB 3.45Å; S97-S100 PolarHBondContact O-N 3.41Å; S97-S100 PolarHBondContact O-OG 2.85Å; S97-S100 VanDerWaalsContact O-OG 3.07Å; Y98-S100 VanDerWaalsContact C-N 3.3Å; S100-Y102 PolarHBondContact O-N 2.82Å; S100-F103 WeakPolarHBondContact O-CB 3.49Å; S100-F103 WeakPolarHBondContact O-CD2 3.32Å; S100-F103 PolarHBondContact O-N 3.27Å
101	I	65.4	Low	61.5	Low	104 Å²	104	97 Å²	97	53%	0.533	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-56.9	-24.9	-177.6	71.7	-174.1	0	0	0	113.3	Y98 M99 F103 D104	Y98-I101 WeakPolarHBondContact O-CD1 3.44Å; Y98-I101 VanDerWaalsContact O-CG1 3.31Å; Y98-I101 WeakPolarHBondContact O-CG1 3.42Å; M99-I101 VanDerWaalsContact C-N 3.3Å; I101-F103 PolarHBondContact O-N 2.88Å; I101-D104 PolarHBondContact O-N 3.04Å
102	Y	66.7	Low	59.9	Low	45 Å²	45	102.9 Å²	102.9	18%	0.176	56%	0.557	C	S	.	*	G	3₁₀ helix	trans	-68.5	-11.5	175.4	-66.3	-85.2	0	0	0	113	L69 H72 M73 E80 M99 S100	L69-Y102 HydrophobicContact CD1-CD2 4.07Å; L69-Y102 HydrophobicContact CD1-CG 4.11Å; H72-Y102 PolarHBondContact CE1-O 2.82Å; H72-Y102 PolarHBondContact ND1-O 2.9Å; M73-Y102 HydrophobicContact CE-CD1 4.01Å; M73-Y102 HydrophobicContact CE-CD2 4.01Å; M73-Y102 HydrophobicContact CE-CE1 3.79Å; M73-Y102 HydrophobicContact CE-CE2 3.81Å; M73-Y102 HydrophobicContact CE-CG 4.11Å; E80-Y102 PolarHBondContact OE2-OH 3.06Å; M99-Y102 HydrophobicContact CE-CE2 3.84Å; M99-Y102 WeakPolarHBondContact O-CD2 3.42Å; M99-Y102 HydrophobicContact SD-CD2 4.3Å; M99-Y102 HydrophobicContact SD-CE2 3.85Å; S100-Y102 PolarHBondContact O-N 2.82Å
103	F	69.3	Low	57.7	Low	67 Å²	67	105 Å²	105	29%	0.294	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-95.3	-12.8	-179.6	-57.4	-55	0	0	0	114.2	K68 L69 S100 I101	K68-F103 HydrophobicContact CB-CE1 4.42Å; K68-F103 HydrophobicContact CD-CE1 4.38Å; K68-F103 HydrophobicContact CG-CE1 3.95Å; K68-F103 HydrophobicContact CG-CZ 4.44Å; L69-F103 HydrophobicContact CB-CE1 4.39Å; L69-F103 HydrophobicContact CB-CZ 3.9Å; L69-F103 HydrophobicContact CD1-CE1 4.2Å; L69-F103 HydrophobicContact CD1-CE2 4.49Å; L69-F103 HydrophobicContact CD1-CZ 3.91Å; S100-F103 WeakPolarHBondContact O-CB 3.49Å; S100-F103 WeakPolarHBondContact O-CD2 3.32Å; S100-F103 PolarHBondContact O-N 3.27Å; I101-F103 PolarHBondContact O-N 2.88Å
104	D	55.6	Low	55.4	Low	128 Å²	128	105.1 Å²	105.1	68%	0.684	60%	0.602	S	S	*	*			trans	-115.7	10.8	-164.2	-60.4	-38.4	0	0	0	115.1	I101	I101-D104 PolarHBondContact O-N 3.04Å
105	E	45.8	Very low	53.7	Low	130 Å²	130	103.2 Å²	103.2	61%	0.607	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-81.9	125.5	172.9	-86.2	-169.2	126	0	0	112.1	R76	R76-E105 IonicContact CZ-OE2 3.99Å; R76-E105 IonicContact NH1-OE2 3.53Å; R76-E105 PolarHBondContact NH1-OE2 3.43Å; R76-E105 IonicContact NH2-OE2 3.56Å; R76-E105 PolarHBondContact NH2-OE2 3.36Å
106	P	46.8	Very low	52.2	Low	120 Å²	120	107.8 Å²	107.8	78%	0.779	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-78.1	143.2	-173.4	30.2	-35.3	0	0	0	114.3
107	N	35.9	Very low	50.5	Low	142 Å²	142	113.6 Å²	113.6	76%	0.759	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-71.1	126.6	177	-171	25.2	0	0	0	110.8	A109	N107-A109 PolarHBondContact O-N 3.21Å
108	P	42.4	Very low	48.9	Very low	133 Å²	133	111.9 Å²	111.9	86%	0.864	65%	0.654	S	S	*	*	S	Bend	trans	-81.9	49.7	-165.6	34	-39.1	0	0	0	114.6
109	A	41.9	Very low	47.3	Very low	70 Å²	70	112.9 Å²	112.9	58%	0.579	67%	0.668	S	S	*	*			trans	-131.3	123.7	178.2	0	0	0	0	0	111.8	N107	N107-A109 PolarHBondContact O-N 3.21Å
110	Q	37.3	Very low	45.9	Very low	202 Å²	202	116.3 Å²	116.3	94%	0.944	69%	0.691	S	S	*	*			trans	69.5	99.8	174.4	-56.2	-176.1	-6.9	0	0	117.2
111	A	33.5	Very low	45	Very low	101 Å²	101	117.8 Å²	117.8	84%	0.835	71%	0.706	S	S	*	*			trans	-144.4	113.4	157.1	0	0	0	0	0	110.2
112	K	40.2	Very low	44.5	Very low	220 Å²	220	122.8 Å²	122.8	96%	0.957	72%	0.719	S	S	*	*			trans	-162.5	123.3	170.3	-101.5	-169.2	177.4	-175.7	0	109.1
113	G	33.5	Very low	43.7	Very low	69 Å²	69	126 Å²	126	71%	0.711	74%	0.743	S	S	*	*			trans	149.8	98.7	166.3	0	0	0	0	0	116.5
114	S	32.1	Very low	42.9	Very low	134 Å²	134	130.1 Å²	130.1	94%	0.937	77%	0.767	S	S	*	*			trans	61.8	146.3	158.1	47.7	0	0	0	0	121.3
115	S	43.1	Very low	42.3	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	77%	0.766	S	S	*	*			trans	-126.6	163.6	165.3	-175	0	0	0	0	107.5
116	P	45.6	Very low	42	Very low	121 Å²	121	130.2 Å²	130.2	79%	0.786	78%	0.781	S	S	*	*				-146.6	166	107.5	37.7	-22.3	0	0	0	116.7
117	E	42.3	Very low	41.6	Very low	183 Å²	183	132.7 Å²	132.7	86%	0.855	79%	0.786	S	S	*	*			trans	-39	155.5	173.3	-106.4	73.8	176.6	0	0	118.9
118	G	35.8	Very low	41.4	Very low	71 Å²	71	135.2 Å²	135.2	73%	0.732	79%	0.794	S	S	*	*			trans	-174.5	29.3	172	0	0	0	0	0	119.1
119	L	40.9	Very low	40.9	Very low	171 Å²	171	135.4 Å²	135.4	90%	0.895	79%	0.793	S	S	*	*			trans	-129.2	147.2	175.2	-79.3	173.5	0	0	0	113.5
120	P	43.2	Very low	40.4	Very low	77 Å²	77	137.2 Å²	137.2	50%	0.5	80%	0.801	S	S	.	*			trans	-93.6	156	-159	-6.6	28	0	0	0	115.7	W122	P120-W122 PolarHBondContact O-N 3.01Å
121	A	47.5	Very low	40	Very low	84 Å²	84	134.8 Å²	134.8	69%	0.694	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-71.2	11.9	-166.7	0	0	0	0	0	117.8	V123	A121-V123 VanDerWaalsContact C-N 3.33Å
122	W	55.1	Low	39.7	Very low	210 Å²	210	138.8 Å²	138.8	80%	0.795	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-84.4	-9.5	172.1	69.2	-92.6	0	0	0	113.2	P120 L124	P120-W122 PolarHBondContact O-N 3.01Å; W122-L124 PolarHBondContact O-N 2.77Å
123	V	50.9	Low	39.3	Very low	113 Å²	113	136.8 Å²	136.8	69%	0.685	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-79.9	-5.6	172.7	-175.3	0	0	0	0	111.7	A121	A121-V123 VanDerWaalsContact C-N 3.33Å
124	L	50.8	Low	39.1	Very low	152 Å²	152	140.6 Å²	140.6	80%	0.796	78%	0.778	S	S	*	*	S	Bend	trans	-89	104.3	169	-81.3	170.7	0	0	0	111.1	W122	W122-L124 PolarHBondContact O-N 2.77Å
125	G	44	Very low	38.9	Very low	65 Å²	65	139.4 Å²	139.4	67%	0.67	76%	0.761	S	S	*	*	S	Bend	trans	126.9	141.7	156.3	0	0	0	0	0	117
126	E	40	Very low	38.3	Very low	196 Å²	196	141.8 Å²	141.8	92%	0.916	76%	0.761	S	S	*	*	S	Bend	trans	105.8	-9.3	162.7	-59	-154.9	161.3	0	0	119.8
127	L	38.1	Very low	37.5	Very low	172 Å²	172	140.4 Å²	140.4	90%	0.901	75%	0.754	S	S	*	*	S	Bend	trans	-131.3	76.3	167.9	-74.9	177.6	0	0	0	113.5
128	E	31.5	Very low	36.8	Very low	194 Å²	194	142.5 Å²	142.5	91%	0.907	75%	0.754	S	S	*	*				-175.6	111.3	125.3	-105.2	-178.6	-169	0	0	111.2
129	T	32.2	Very low	36.4	Very low	138 Å²	138	148 Å²	148	85%	0.847	76%	0.758	S	S	*	*			trans	-127.6	126.8	164.6	54.3	0	0	0	0	110.6
130	S	30	Very low	35.8	Very low	107 Å²	107	148 Å²	148	75%	0.748	76%	0.758	S	S	*	*			trans	98.4	99.6	163.8	-44.4	0	0	0	0	117.8
131	E	30.1	Very low	34.9	Very low	152 Å²	152	150.1 Å²	150.1	71%	0.71	78%	0.775	S	S	*	*			trans	70.2	141.9	134.8	-59.9	-162.7	153	0	0	118.7
132	R	27.6	Very low	33.9	Very low	184 Å²	184	151.6 Å²	151.6	69%	0.694	78%	0.78	S	S	*	*			cis	-163.4	146.8	18.7	-134.3	171.8	-129.4	-175.1	5.3	111.5
133	K	30.9	Very low	32.5	Very low	178 Å²	178	144.3 Å²	144.3	77%	0.774	77%	0.77	S	S	*	*			trans	37.5	121.6	135.8	-76.4	-178.3	-175.7	178.4	0	118.4
134	L	28.7	Very low	31.4	Very low	149 Å²	149	147.9 Å²	147.9	78%	0.78	78%	0.779	S	S	*	*				173.3	162.2	64.6	-104.7	149.6	0	0	0	107.3
135	N	28.3	Very low	30.3	Very low	110 Å²	110	147.3 Å²	147.3	59%	0.588	78%	0.777	S	S	*	*			cis	-158.8	168.9	3.5	-165	14.8	0	0	0	110.2
136	E	30.5	Very low	29.3	Very low	150 Å²	150	150.6 Å²	150.6	70%	0.701	78%	0.779	S	S	*	*			trans	50.8	120.8	153.9	-85.9	160.7	-138.7	0	0	119.7
137	S	28.5	Very low	28.5	Very low	93 Å²	93	146.9 Å²	146.9	65%	0.65	77%	0.77	S	S	*	*				-173.4	140.8	57.5	-91.5	0	0	0	0	118.2
138	W	27.9	Very low	27.9	Very low	226 Å²	226	146 Å²	146	86%	0.856	77%	0.765	S	S	*	*			trans	70.7	98.6	136.1	-63.7	46.5	0	0	0	123.9
139	K	28.8	Very low	27.7	Very low	188 Å²	188	142.2 Å²	142.2	82%	0.817	76%	0.755	S	S	*	*			trans	48.3	108.4	130.7	-65.7	-172.5	175.7	-176.5	0	124.2
140	L	26.5	Very low	27.5	Very low	171 Å²	171	144.5 Å²	144.5	90%	0.895	76%	0.756	S	S	*	*				39.2	146.9	111.1	-79.5	165.3	0	0	0	124.1
141	S	25.1	Very low	27.5	Very low	121 Å²	121	144.3 Å²	144.3	85%	0.846	76%	0.755	S	S	*	*			trans	90.2	140.7	157.2	-169	0	0	0	0	117.6
142	S	27.1	Very low	27.9	Very low	115 Å²	115	142.2 Å²	142.2	80%	0.804	76%	0.755	S	S	*	*			cis	-171.9	161.6	-20.8	-175.8	0	0	0	0	110.2
143	G	25.7	Very low	27.8	Very low	57 Å²	57	139.1 Å²	139.1	59%	0.588	76%	0.757	S	S	*	*			trans	107.9	126.4	170.7	0	0	0	0	0	113.6
144	E	26.5	Very low	27.6	Very low	188 Å²	188	137.4 Å²	137.4	88%	0.879	76%	0.756	S	S	*	*			cis	73.2	132.8	48.1	-65.1	-178.3	167.5	0	0	113.8
145	D	27.6	Very low	27.5	Very low	140 Å²	140	136.4 Å²	136.4	75%	0.749	76%	0.755	S	S	*	*			cis	-159	-165.7	-19.9	-153.3	-21.5	0	0	0	109.6
146	N	24	Very low	27.4	Very low	133 Å²	133	141.2 Å²	141.2	71%	0.711	77%	0.767	S	S	*	*			trans	-68.9	170.6	-168.5	-82.1	-87.7	0	0	0	118.2
147	T	23.7	Very low	27.2	Very low	119 Å²	119	139 Å²	139	73%	0.73	77%	0.768	S	S	*	*			trans	98.4	122.7	134.4	17.1	0	0	0	0	124.3
148	L	26	Very low	27.1	Very low	152 Å²	152	143.3 Å²	143.3	80%	0.796	77%	0.77	S	S	*	*				84.5	140.2	127.4	-128.3	77.4	0	0	0	123.5
149	V	26.7	Very low	27.2	Very low	115 Å²	115	138.6 Å²	138.6	70%	0.697	76%	0.758	S	S	*	*			trans	51.5	119.1	160.1	-135.5	0	0	0	0	120.7
150	Q	26.8	Very low	27.2	Very low	186 Å²	186	135.7 Å²	135.7	87%	0.869	75%	0.747	S	S	*	*				174.7	136	104.2	-91.9	-179.9	14.2	0	0	114.7
151	S	30	Very low	27.3	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	74%	0.74	S	S	*	*			trans	-82.3	173.2	159.4	54.6	0	0	0	0	109.3
152	P	39	Very low	27.5	Very low	108 Å²	108	137 Å²	137	70%	0.701	74%	0.738	S	S	*	*			cis	-156.7	-170	34.4	45.7	-23.1	0	0	0	119.3
153	T	25.1	Very low	27.5	Very low	120 Å²	120	134.8 Å²	134.8	74%	0.736	73%	0.732	S	S	*	*			trans	83.3	144.1	147.2	-58.6	0	0	0	0	120.4
154	D	26.8	Very low	27.8	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	74%	0.744	S	S	*	*			trans	-60.5	169.3	179.8	-42.1	-97.9	0	0	0	115.3
155	V	27.6	Very low	27.9	Very low	127 Å²	127	139.8 Å²	139.8	77%	0.77	74%	0.742	S	S	*	*				-176.2	130.9	106.9	148.3	0	0	0	0	111.4
156	Y	24.8	Very low	27.8	Very low	211 Å²	211	143.7 Å²	143.7	83%	0.827	75%	0.746	S	S	*	*			trans	7.7	155	154.6	-78.6	-95	0	0	0	122.9
157	S	27.2	Very low	27.8	Very low	105 Å²	105	145.4 Å²	145.4	73%	0.734	75%	0.752	S	S	*	*			trans	79.1	150.1	138.4	-83.2	0	0	0	0	118.2
158	R	26.8	Very low	27.9	Very low	182 Å²	182	150.1 Å²	150.1	69%	0.687	76%	0.756	S	S	*	*			cis	-160.9	165.3	-8.7	178.4	164.6	-169.4	171.2	9.8	110.4
159	E	29.2	Very low	28	Very low	128 Å²	128	146.1 Å²	146.1	60%	0.598	74%	0.741	S	S	*	*			trans	-28.6	160.8	149.9	-40.9	157.8	128.4	0	0	113.7
160	Q	30	Very low	28	Very low	127 Å²	127	148.8 Å²	148.8	59%	0.593	75%	0.746	S	S	*	*				-178.7	142.2	78.9	-84.9	-158.4	-13.7	0	0	112.9
161	Y	28.8	Very low	28	Very low	189 Å²	189	145.6 Å²	145.6	74%	0.741	74%	0.744	S	S	*	*			trans	41.2	160.3	138.9	-64.2	-87.6	0	0	0	121.4
162	T	27.7	Very low	27.9	Very low	131 Å²	131	149.1 Å²	149.1	80%	0.804	75%	0.751	S	S	*	*			cis	-160.6	159.9	18.8	-21.8	0	0	0	0	111.8
163	G	27.2	Very low	27.4	Very low	67 Å²	67	149.3 Å²	149.3	69%	0.691	76%	0.755	S	S	*	*			trans	130.3	112.8	159.1	0	0	0	0	0	113
164	K	32.3	Very low	28.3	Very low	193 Å²	193	148.8 Å²	148.8	84%	0.839	75%	0.754	S	S	*	*			cis	56.1	127.2	48.7	-63.1	-171.5	177	179.6	0	112
165	L	28.3	Very low	28.5	Very low	157 Å²	157	148 Å²	148	82%	0.822	75%	0.754	S	S	*	*			cis	-166.3	165.7	13.7	-124.8	169	0	0	0	112.4
166	R	25.4	Very low	28.4	Very low	222 Å²	222	149.7 Å²	149.7	84%	0.838	75%	0.753	S	S	*	*			trans	90.8	95.2	144	-159.3	173.4	-159.6	-176.4	6.7	122.3
167	M	24.9	Very low	28.7	Very low	170 Å²	170	147.9 Å²	147.9	84%	0.837	75%	0.745	S	S	*	*				54.9	120.3	122.8	-77.7	-78.1	-168.8	0	0	123.5
168	R	24.6	Very low	28.8	Very low	217 Å²	217	148.9 Å²	148.9	82%	0.819	74%	0.738	S	S	*	*				105.7	121.3	112.4	-173.5	170.8	-176.4	-179.1	4.5	122.4
169	S	28	Very low	29	Very low	69 Å²	69	147.8 Å²	147.8	48%	0.483	75%	0.746	S	S	.	*			trans	82.5	120	143	-78.5	0	0	0	0	124.2
170	H	28.3	Very low	29.1	Very low	171 Å²	171	145.3 Å²	145.3	79%	0.792	76%	0.755	S	S	*	*			trans	67	116	136.3	-52.3	-47.2	0	0	0	121.7
171	S	27	Very low	29.2	Very low	118 Å²	118	147.6 Å²	147.6	83%	0.825	77%	0.765	S	S	*	*			trans	-78.7	159	151.1	-177.1	0	0	0	0	110.9
172	M	27.8	Very low	29.1	Very low	177 Å²	177	144.7 Å²	144.7	87%	0.872	76%	0.763	S	S	*	*			trans	-111.3	147.5	170.3	-70.1	-160.4	73	0	0	111.7
173	S	28.3	Very low	29.3	Very low	113 Å²	113	145.7 Å²	145.7	79%	0.79	76%	0.761	S	S	*	*			trans	-67.1	178.1	171.4	-43	0	0	0	0	112.3
174	P	43.9	Very low	29.3	Very low	109 Å²	109	148.3 Å²	148.3	71%	0.708	76%	0.764	S	S	*	*				-148	158.6	106.9	39	-24.7	0	0	0	116.7
175	T	29.7	Very low	29.7	Very low	126 Å²	126	144.8 Å²	144.8	77%	0.773	76%	0.761	S	S	*	*			trans	68.5	142.6	144.7	45.3	0	0	0	0	120.6
176	H	25.4	Very low	29.7	Very low	161 Å²	161	145.9 Å²	145.9	75%	0.745	76%	0.759	S	S	*	*			cis	-176	132.1	-5.4	177.5	-115.9	0	0	0	113.3
177	R	31.4	Very low	29.8	Very low	173 Å²	173	142.6 Å²	142.6	65%	0.653	76%	0.757	S	S	*	*			trans	63.3	158.2	155.5	-74.7	-174.5	-161	-122.3	9.7	118.9
178	E	30.9	Very low	29.9	Very low	127 Å²	127	139 Å²	139	59%	0.593	75%	0.748	S	S	*	*			cis	-154.6	167.5	-12.9	-130.9	155	-158.9	0	0	112.2
179	D	29.8	Very low	30	Very low	158 Å²	158	136.8 Å²	136.8	85%	0.845	75%	0.746	S	S	*	*			trans	55	152.5	154.3	-74.5	-12.5	0	0	0	123
180	G	31.9	Very low	30.1	Very low	76 Å²	76	139 Å²	139	78%	0.784	76%	0.756	S	S	*	*			trans	140	80	160.5	0	0	0	0	0	116.7
181	Q	31.4	Very low	30.3	Very low	175 Å²	175	141.5 Å²	141.5	82%	0.818	76%	0.761	S	S	*	*			trans	-63	163.3	166.1	-53.1	170.5	-4.7	0	0	110.1
182	N	27.5	Very low	30.5	Very low	128 Å²	128	141.6 Å²	141.6	68%	0.684	76%	0.761	S	S	*	*			cis	-174.5	174.4	39.8	-141.5	-30.5	0	0	0	113.6
183	I	32.3	Very low	30.5	Very low	152 Å²	152	142.7 Å²	142.7	78%	0.779	76%	0.761	S	S	*	*			trans	76.2	117.9	156.7	-63.2	159.7	0	0	0	119.4
184	T	26.2	Very low	30.5	Very low	122 Å²	122	147.2 Å²	147.2	75%	0.748	77%	0.766	S	S	*	*			trans	-94.7	170.3	166.3	-18.8	0	0	0	0	110.2
185	P	39.9	Very low	29.8	Very low	119 Å²	119	147.1 Å²	147.1	77%	0.773	77%	0.769	S	S	*	*				-157.7	133.8	86.4	38.6	-16.9	0	0	0	119.5
186	K	29.2	Very low	30.2	Very low	181 Å²	181	146.4 Å²	146.4	79%	0.787	77%	0.766	S	S	*	*			trans	74.6	149.6	132.6	-95.1	-174.1	175.1	-176.1	0	123.7
187	I	27.9	Very low	30.4	Very low	152 Å²	152	145 Å²	145	78%	0.779	77%	0.769	S	S	*	*			trans	71.6	129.7	159.4	-63.7	153.1	0	0	0	114.5
188	C	26.5	Very low	30.3	Very low	96 Å²	96	142.1 Å²	142.1	65%	0.649	78%	0.775	S	S	*	*			cis	-171.3	159.6	-16.1	-102.5	0	0	0	0	105
189	E	27.8	Very low	30.3	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.794	79%	0.787	S	S	*	*			cis	-174.1	-149.9	-7.8	-178.6	152.9	-148.2	0	0	106.3
190	V	30.1	Very low	30.3	Very low	114 Å²	114	143.8 Å²	143.8	69%	0.691	79%	0.787	S	S	*	*			trans	84.1	72.2	160.3	-163.2	0	0	0	0	117
191	Y	31.7	Very low	30.2	Very low	225 Å²	225	147.1 Å²	147.1	88%	0.882	79%	0.787	S	S	*	*			trans	84.7	137.7	144.2	-63.3	-60.3	0	0	0	123.2
192	S	30.1	Very low	30.4	Very low	120 Å²	120	143.3 Å²	143.3	84%	0.839	78%	0.779	S	S	*	*			trans	-125.7	149.6	-166.1	-52.2	0	0	0	0	111.1
193	K	29	Very low	30.6	Very low	199 Å²	199	143.4 Å²	143.4	87%	0.865	78%	0.78	S	S	*	*			trans	-82.1	133.7	154.2	-71.7	-176.4	177.1	-179.2	0	109.6
194	K	28.1	Very low	30.6	Very low	208 Å²	208	144.4 Å²	144.4	90%	0.904	79%	0.785	S	S	*	*				174.7	153.8	122.9	-94.2	159.8	-174.9	179	0	113.1
195	S	28.1	Very low	30.9	Very low	108 Å²	108	147.6 Å²	147.6	76%	0.755	79%	0.792	S	S	*	*			trans	-91.5	-174.2	167.9	61	0	0	0	0	109.8
196	P	38.3	Very low	30.5	Very low	110 Å²	110	145.7 Å²	145.7	71%	0.714	79%	0.786	S	S	*	*			cis	-134.2	166.5	-0.9	40.6	-23.6	0	0	0	116.8
197	V	29.5	Very low	30.5	Very low	132 Å²	132	148 Å²	148	80%	0.8	79%	0.79	S	S	*	*			trans	31.3	110.8	146.2	-174.7	0	0	0	0	119.2
198	S	29.6	Very low	30.5	Very low	112 Å²	112	148 Å²	148	78%	0.783	79%	0.791	S	S	*	*			trans	-145.2	131.3	136.9	58.3	0	0	0	0	108.9
199	L	32.5	Very low	30.6	Very low	164 Å²	164	150.8 Å²	150.8	86%	0.859	80%	0.799	S	S	*	*			trans	-72.7	131.1	168.6	-78.4	69.2	0	0	0	108.7
200	D	29.7	Very low	30.7	Very low	156 Å²	156	147.4 Å²	147.4	83%	0.834	79%	0.794	S	S	*	*				-165	173	109.7	-149.9	-1.1	0	0	0	112
201	D	29.3	Very low	30.7	Very low	147 Å²	147	152.7 Å²	152.7	79%	0.786	80%	0.802	S	S	*	*			trans	103.9	154.6	152.1	-137.1	-1.9	0	0	0	118.9
202	S	35.3	Very low	30.8	Very low	94 Å²	94	147.9 Å²	147.9	66%	0.657	79%	0.791	S	S	*	*			trans	-127.2	178.5	-139	-55.9	0	0	0	0	114
203	D	32.7	Very low	30.9	Very low	131 Å²	131	149.5 Å²	149.5	70%	0.701	79%	0.79	S	S	*	*			trans	68	102.6	149.7	-156.5	16.3	0	0	0	117.9
204	I	31.9	Very low	30.9	Very low	172 Å²	172	143.1 Å²	143.1	88%	0.882	78%	0.78	S	S	*	*			trans	-167.5	93.5	132	-88.6	143.6	0	0	0	106.9
205	E	31.9	Very low	31.1	Very low	190 Å²	190	140.8 Å²	140.8	89%	0.888	78%	0.776	S	S	*	*			trans	-163.4	64.1	140.1	-166.7	155.5	-136.8	0	0	110.9
206	A	31.6	Very low	31.2	Very low	79 Å²	79	144.3 Å²	144.3	65%	0.653	78%	0.781	S	S	*	*			trans	-112.3	89	172	0	0	0	0	0	111
207	R	29.7	Very low	31.2	Very low	230 Å²	230	146 Å²	146	87%	0.868	78%	0.783	S	S	*	*			trans	175.8	149	147	-100.6	150.7	146.3	-152.7	-9.6	114.3
208	L	26.9	Very low	32.3	Very low	152 Å²	152	143.6 Å²	143.6	80%	0.796	77%	0.771	S	S	*	*			trans	68.2	124.8	-172.5	-75	70.2	0	0	0	112.7
209	N	29.6	Very low	32.5	Very low	153 Å²	153	148 Å²	148	82%	0.818	77%	0.77	S	S	*	*			cis	-123	144.7	7.4	-74.3	-59.5	0	0	0	113.3
210	S	28.4	Very low	32.4	Very low	100 Å²	100	151.3 Å²	151.3	70%	0.699	77%	0.773	S	S	*	*			trans	-102.7	-170.2	161.7	-176.7	0	0	0	0	108.4
211	W	30.7	Very low	32.4	Very low	224 Å²	224	151.6 Å²	151.6	85%	0.848	77%	0.774	S	S	*	*			trans	74	134.2	178	-55.6	80.2	0	0	0	115.1
212	N	34.7	Very low	32.6	Very low	124 Å²	124	155 Å²	155	66%	0.663	78%	0.776	S	S	*	*			cis	-162.7	156.3	-19.5	-152.4	4.5	0	0	0	110.1
213	L	32.7	Very low	32.3	Very low	154 Å²	154	157.5 Å²	157.5	81%	0.806	78%	0.777	S	S	*	*			trans	167.5	94.4	135.3	-94.5	165.8	0	0	0	110.7
214	G	27.4	Very low	32.2	Very low	65 Å²	65	159.5 Å²	159.5	67%	0.67	78%	0.779	S	S	*	*			trans	-95.2	144.7	155	0	0	0	0	0	109.8
215	I	32.2	Very low	32.3	Very low	160 Å²	160	157.2 Å²	157.2	82%	0.821	78%	0.776	S	S	*	*			trans	-124.1	129.6	159.8	-65.4	-176.2	0	0	0	109.3
216	E	31.3	Very low	32.4	Very low	182 Å²	182	154.3 Å²	154.3	85%	0.85	77%	0.765	S	S	*	*			trans	-62.2	137.6	-172.2	-59.3	172.5	98	0	0	114.9
217	N	38.3	Very low	32.7	Very low	144 Å²	144	155.9 Å²	155.9	77%	0.77	77%	0.768	S	S	*	*			trans	-50.5	151.2	143.6	-170.9	15.6	0	0	0	109.6
218	P	52.9	Low	32.5	Very low	82 Å²	82	150.8 Å²	150.8	53%	0.532	76%	0.762	S	S	.	*				-159	164.1	98.6	39.6	-20.6	0	0	0	118.6
219	R	32.1	Very low	32.4	Very low	204 Å²	204	148.1 Å²	148.1	77%	0.77	76%	0.757	S	S	*	*			trans	67.4	130.5	145.3	-70.9	155.5	-142.2	-174.3	9.4	118.4
220	Y	32.3	Very low	32.2	Very low	235 Å²	235	147.9 Å²	147.9	92%	0.922	76%	0.755	S	S	*	*				-147.5	154.7	92.9	-90	-64.1	0	0	0	112.1
221	L	28.9	Very low	32.1	Very low	162 Å²	162	150.8 Å²	150.8	85%	0.848	76%	0.759	S	S	*	*			trans	-130.9	79	-174	-161.4	172.6	0	0	0	109.7
222	R	33	Very low	32	Very low	218 Å²	218	145.1 Å²	145.1	82%	0.823	75%	0.749	S	S	*	*			trans	-161	146.4	166.7	-86.8	-164.4	178.6	-166.6	0.7	106.5
223	Q	29.5	Very low	31.7	Very low	146 Å²	146	145.3 Å²	145.3	68%	0.682	76%	0.757	S	S	*	*			cis	-153.2	139.9	4	-138.8	166.8	-20.8	0	0	109.3
224	K	30.4	Very low	31.2	Very low	173 Å²	173	146.3 Å²	146.3	75%	0.752	76%	0.755	S	S	*	*			trans	-92.2	142.7	148	-79.8	-168.8	178.2	-175.8	0	108	I226	K224-I226 HydrophobicContact CB-CG1 4.03Å; K224-I226 HydrophobicContact CD-CD1 3.79Å; K224-I226 HydrophobicContact CD-CG1 3.78Å
225	P	34.7	Very low	31.1	Very low	125 Å²	125	152.6 Å²	152.6	81%	0.812	76%	0.764	S	S	*	*			trans	-98.5	105.1	141.1	-15.8	32.8	0	0	0	110.5
226	I	34	Very low	30.8	Very low	128 Å²	128	150 Å²	150	66%	0.656	76%	0.76	S	S	*	*			trans	-104.1	151.9	148.7	-14.7	170.3	0	0	0	103.5	K224	K224-I226 HydrophobicContact CB-CG1 4.03Å; K224-I226 HydrophobicContact CD-CD1 3.79Å; K224-I226 HydrophobicContact CD-CG1 3.78Å
227	P	37.2	Very low	30.7	Very low	112 Å²	112	149.2 Å²	149.2	73%	0.727	76%	0.761	S	S	*	*			cis	-130	-167.4	26.1	36.5	-12.5	0	0	0	112.6
228	V	24.8	Very low	30.3	Very low	123 Å²	123	153 Å²	153	75%	0.745	77%	0.765	S	S	*	*				-158	133.6	62.2	163.7	0	0	0	0	112.4
229	S	25.3	Very low	29.3	Very low	96 Å²	96	157.8 Å²	157.8	67%	0.671	78%	0.777	S	S	*	*			trans	42.9	124.9	149.5	-60.6	0	0	0	0	123.7
230	L	26.4	Very low	28.9	Very low	149 Å²	149	152.5 Å²	152.5	78%	0.78	77%	0.771	S	S	*	*				37.3	131.8	117.2	-66.3	157.7	0	0	0	120.9
231	M	25.1	Very low	28.4	Very low	161 Å²	161	146.7 Å²	146.7	79%	0.793	77%	0.765	S	S	*	*			trans	72.8	141.7	136	-75.4	-70	174.4	0	0	120.7
232	T	29.9	Very low	28.3	Very low	105 Å²	105	143.4 Å²	143.4	64%	0.644	76%	0.756	S	S	*	*			trans	-52.9	150.4	152.5	52.5	0	0	0	0	111.3
233	P	27.2	Very low	28	Very low	128 Å²	128	141.3 Å²	141.3	83%	0.831	75%	0.753	S	S	*	*				-104.3	139.4	107.9	-21.4	35.4	0	0	0	113.9
234	K	23.3	Very low	28.1	Very low	175 Å²	175	141.4 Å²	141.4	76%	0.761	75%	0.753	S	S	*	*			trans	-78.7	142	160	-80.3	178.5	178.5	174.9	0	108.8
235	F	23.9	Very low	28.1	Very low	196 Å²	196	138.9 Å²	138.9	86%	0.86	75%	0.748	S	S	*	*			trans	68	162.8	158.4	-80	-127.7	0	0	0	115.2
236	S	25.9	Very low	28.1	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	74%	0.741	S	S	*	*			cis	-132.3	138.3	7.9	48.8	0	0	0	0	114.5	R238	S236-R238 PolarHBondContact O-N 3.07Å
237	L	30.5	Very low	28.3	Very low	166 Å²	166	140.7 Å²	140.7	87%	0.869	75%	0.746	S	S	*	*			trans	-68.5	114.1	150.4	166.6	78.3	0	0	0	109
238	R	28.3	Very low	28.9	Very low	223 Å²	223	142.6 Å²	142.6	84%	0.842	74%	0.744	S	S	*	*			trans	-174.3	120.1	134	-127.6	172.8	171.9	156.2	-2.2	114.7	S236	S236-R238 PolarHBondContact O-N 3.07Å
239	K	31.8	Very low	30.1	Very low	183 Å²	183	144.5 Å²	144.5	80%	0.796	75%	0.749	S	S	*	*				13.1	130.5	108.8	-93.7	177.3	-179.3	179.8	0	115.2
240	S	23.8	Very low	31.3	Very low	93 Å²	93	144.3 Å²	144.3	65%	0.65	75%	0.747	S	S	*	*			cis	-168.2	164.9	26.8	-58.8	0	0	0	0	112
241	S	23.3	Very low	32.6	Very low	114 Å²	114	147.4 Å²	147.4	80%	0.797	75%	0.749	S	S	*	*			trans	47.9	155.2	134.5	65.4	0	0	0	0	123.7
242	S	25.5	Very low	33.7	Very low	93 Å²	93	147.1 Å²	147.1	65%	0.65	75%	0.749	S	S	*	*			trans	105.9	89.4	139.2	-167.2	0	0	0	0	119.4
243	F	27.3	Very low	34.4	Very low	173 Å²	173	153.2 Å²	153.2	76%	0.759	76%	0.76	S	S	*	*				63.8	134.1	126.9	-71.1	-68.7	0	0	0	123.6
244	H	32.1	Very low	35.1	Very low	148 Å²	148	155.8 Å²	155.8	69%	0.685	76%	0.761	S	S	*	*			trans	63.4	146.2	150.4	-64.4	-59.9	0	0	0	118.5
245	D	30.5	Very low	36.3	Very low	121 Å²	121	157.2 Å²	157.2	65%	0.647	77%	0.767	S	S	*	*			cis	-152.5	168.4	-7.7	-116.2	-20	0	0	0	112.7
246	D	34.2	Very low	37.4	Very low	122 Å²	122	157.2 Å²	157.2	65%	0.652	77%	0.77	S	S	*	*			trans	66.7	142.7	159.5	-68.1	-21.6	0	0	0	121.2
247	H	38.8	Very low	38.9	Very low	168 Å²	168	160.2 Å²	160.2	78%	0.778	78%	0.777	S	S	*	*			cis	-144.9	165.1	-0.6	-130.5	21.1	0	0	0	112.8
248	F	49.2	Very low	40.7	Very low	153 Å²	153	157 Å²	157	67%	0.671	76%	0.76	S	S	*	*			trans	-64.4	161.5	-177	-103.6	-118.6	0	0	0	114.1
249	L	49.6	Very low	42.3	Very low	162 Å²	162	154.5 Å²	154.5	85%	0.848	76%	0.76	S	S	*	*				-143.9	116.7	58.4	-74.8	161.5	0	0	0	116.8
250	S	50.9	Low	43.4	Very low	92 Å²	92	155.2 Å²	155.2	64%	0.643	76%	0.763	S	S	*	*			trans	66.1	166.5	131.4	-57.6	0	0	0	0	123.1
251	R	54.5	Low	45.2	Very low	215 Å²	215	154.5 Å²	154.5	81%	0.811	76%	0.755	S	S	*	*				-173.6	159.9	-88.3	-174	-175.3	-172.9	-168.4	5.9	111.3
252	I	47.9	Very low	47.7	Very low	155 Å²	155	154.7 Å²	154.7	80%	0.795	74%	0.742	S	S	*	*			trans	133.6	126.8	142.8	-68.2	166	0	0	0	115.9
253	R	43	Very low	49.3	Very low	233 Å²	233	158.5 Å²	158.5	88%	0.879	75%	0.751	S	S	*	*			trans	-166.6	176.1	166.5	-95.2	-164.7	-179.3	-167.5	2.3	109.7
254	E	43.7	Very low	50.8	Low	182 Å²	182	157.8 Å²	157.8	85%	0.85	75%	0.752	S	S	*	*			trans	76.9	123.9	141.3	-171.1	170.4	-101.1	0	0	121.5
255	K	47.8	Very low	52.3	Low	204 Å²	204	155 Å²	155	89%	0.887	74%	0.74	S	S	*	*			trans	-174.7	-25.9	145	-114.2	174.8	-177.7	-177	0	121.4	L257	K255-L257 PolarHBondContact O-N 2.67Å
256	E	46	Very low	54.1	Low	196 Å²	196	152.4 Å²	152.4	92%	0.916	74%	0.735	S	S	*	*			trans	-84.2	-11.2	-152.7	-158.9	171.4	175.2	0	0	118.3	D258	E256-D258 PolarHBondContact O-N 3.16Å
257	L	57.4	Low	55.2	Low	169 Å²	169	154.9 Å²	154.9	89%	0.885	74%	0.74	S	S	*	*			trans	-81.8	-4.4	-157.9	-88.2	162	0	0	0	118.8	K255	K255-L257 PolarHBondContact O-N 2.67Å
258	D	69.7	Low	56.4	Low	97 Å²	97	153.8 Å²	153.8	52%	0.519	73%	0.733	S	S	.	*			trans	-77	-37.1	-155.8	-176.8	73.3	0	0	0	117.2	E256 K260 T261 K262	E256-D258 PolarHBondContact O-N 3.16Å; D258-K260 PolarHBondContact O-N 2.89Å; D258-T261 PolarHBondContact O-OG1 2.87Å; D258-K262 IonicContact OD1-NZ 3.36Å; D258-K262 IonicContact OD2-NZ 3.41Å; D258-K262 PolarHBondContact OD2-NZ 2.96Å
259	M	61.5	Low	57.4	Low	171 Å²	171	152 Å²	152	84%	0.842	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-19.8	-151.6	-156.5	163	84.2	0	0	116.8
260	K	53.9	Low	58.2	Low	199 Å²	199	151.6 Å²	151.6	87%	0.865	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-21.4	-177.8	-87.5	-175.6	176.5	176.3	0	114.5	D258 K262	D258-K260 PolarHBondContact O-N 2.89Å; K260-K262 PolarHBondContact O-N 3.38Å
261	T	61.4	Low	58.8	Low	77 Å²	77	153.6 Å²	153.6	47%	0.472	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	-42.4	-171.5	-45.6	0	0	0	0	112.6	D258 M263 M264	D258-T261 PolarHBondContact O-OG1 2.87Å; T261-M263 VanDerWaalsContact C-N 3.34Å; T261-M263 PolarHBondContact O-N 3.47Å; T261-M264 PolarHBondContact O-N 3.17Å
262	K	75.9	Confident	59.4	Low	119 Å²	119	149.5 Å²	149.5	52%	0.517	71%	0.707	S	S	.	*	H	α-helix	trans	-67.6	-22.8	-161.4	-69.5	161	-177.4	164.3	0	115.9	D258 K260 E265	D258-K262 IonicContact OD1-NZ 3.36Å; D258-K262 IonicContact OD2-NZ 3.41Å; D258-K262 PolarHBondContact OD2-NZ 2.96Å; K260-K262 PolarHBondContact O-N 3.38Å; K262-E265 WeakPolarHBondContact CA-OE2 3.2Å
263	M	59.8	Low	60.7	Low	172 Å²	172	147.1 Å²	147.1	85%	0.847	70%	0.696	S	S	*	*	H	α-helix	trans	-82.9	-21.5	-178.6	-158.8	179.7	76.7	0	0	113.2	T261	T261-M263 VanDerWaalsContact C-N 3.34Å; T261-M263 PolarHBondContact O-N 3.47Å
264	M	58.2	Low	61.8	Low	158 Å²	158	145.7 Å²	145.7	78%	0.778	69%	0.69	S	S	*	*	H	α-helix	trans	-83.9	-28.9	-178.1	-149.4	176.6	-60.6	0	0	112.1	T261 A266	T261-M264 PolarHBondContact O-N 3.17Å; M264-A266 PolarHBondContact O-N 2.97Å
265	E	64.8	Low	62.9	Low	91 Å²	91	142.6 Å²	142.6	43%	0.425	68%	0.679	S	S	.	*	H	α-helix	trans	-62.5	-39.4	-178.3	-63.1	172.2	146	0	0	112.6	K262 K267 F268 H269	K262-E265 WeakPolarHBondContact CA-OE2 3.2Å; E265-K267 PolarHBondContact O-N 2.71Å; E265-F268 WeakPolarHBondContact O-CB 3.17Å; E265-F268 PolarHBondContact O-N 3.17Å; E265-F268 VanDerWaalsContact O-N 3.15Å; E265-H269 PolarHBondContact O-CD2 3.43Å; E265-H269 PolarHBondContact O-N 3.46Å; E265-H269 VanDerWaalsContact O-N 3.12Å
266	A	67.3	Low	63.9	Low	66 Å²	66	137 Å²	137	55%	0.545	66%	0.656	S	S	.	*	H	α-helix	trans	-59.5	-45.6	-174.5	0	0	0	0	0	114	M264 F268 H269	M264-A266 PolarHBondContact O-N 2.97Å; A266-F268 VanDerWaalsContact C-N 3.34Å; A266-H269 PolarHBondContact O-N 3.06Å
267	K	57.5	Low	65.2	Low	174 Å²	174	133.8 Å²	133.8	76%	0.757	64%	0.641	S	S	*	*	H	α-helix	trans	-67.9	-34.9	177.3	-76.1	-165.6	172.2	-169.6	0	112.4	E265 H269 E270 E271	E265-K267 PolarHBondContact O-N 2.71Å; K267-H269 PolarHBondContact O-N 3.38Å; K267-E270 PolarHBondContact O-N 2.79Å; K267-E271 PolarHBondContact O-N 2.83Å
268	F	64.4	Low	65.8	Low	145 Å²	145	132.7 Å²	132.7	64%	0.636	63%	0.629	S	S	*	*	H	α-helix	trans	-65.2	-28.6	177.3	-164.9	-99.6	0	0	0	112.1	E265 A266 K272	E265-F268 WeakPolarHBondContact O-CB 3.17Å; E265-F268 PolarHBondContact O-N 3.17Å; E265-F268 VanDerWaalsContact O-N 3.15Å; A266-F268 VanDerWaalsContact C-N 3.34Å; F268-K272 WeakPolarHBondContact O-CB 3.35Å; F268-K272 PolarHBondContact O-N 2.9Å
269	H	70.6	Confident	66.1	Low	116 Å²	116	133.6 Å²	133.6	54%	0.537	63%	0.63	S	S	.	*	H	α-helix	trans	-72.2	-36.5	175.7	-64	-29.5	0	0	0	113.9	E265 A266 K267 L273	E265-H269 PolarHBondContact O-CD2 3.43Å; E265-H269 PolarHBondContact O-N 3.46Å; E265-H269 VanDerWaalsContact O-N 3.12Å; A266-H269 PolarHBondContact O-N 3.06Å; K267-H269 PolarHBondContact O-N 3.38Å; H269-L273 PolarHBondContact O-N 3.01Å; H269-L273 VanDerWaalsContact O-N 3.1Å
270	E	66.1	Low	66.8	Low	152 Å²	152	129.2 Å²	129.2	71%	0.71	61%	0.61	S	S	*	*	H	α-helix	trans	-66.7	-48.5	178.6	-173.1	-179.1	-178.1	0	0	111.7	K267 K272 L273 R274	K267-E270 PolarHBondContact O-N 2.79Å; E270-K272 VanDerWaalsContact C-N 3.34Å; E270-K272 PolarHBondContact O-N 3.38Å; E270-L273 PolarHBondContact O-N 3.21Å; E270-R274 PolarHBondContact O-N 3.46Å
271	E	63.8	Low	67.9	Low	135 Å²	135	122 Å²	122	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-64.7	-39	178.7	-172.8	165.3	-145.3	0	0	111.8	K267 L273 R274 L275	K267-E271 PolarHBondContact O-N 2.83Å; E271-L273 VanDerWaalsContact C-N 3.34Å; E271-L273 PolarHBondContact O-N 2.66Å; E271-R274 PolarHBondContact O-N 2.84Å; E271-L275 HydrophobicContact CG-CD1 4.43Å; E271-L275 PolarHBondContact O-N 3.47Å
272	K	67	Low	68.6	Low	128 Å²	128	121.6 Å²	121.6	56%	0.557	58%	0.583	S	S	*	*	H	α-helix	trans	-58.2	-42.5	172.9	-177.9	178.4	179.5	-178.5	0	112.4	F268 E270 L275 Q276	F268-K272 WeakPolarHBondContact O-CB 3.35Å; F268-K272 PolarHBondContact O-N 2.9Å; E270-K272 VanDerWaalsContact C-N 3.34Å; E270-K272 PolarHBondContact O-N 3.38Å; K272-L275 PolarHBondContact O-N 3.3Å; K272-Q276 WeakPolarHBondContact O-CB 3.47Å; K272-Q276 PolarHBondContact O-N 2.97Å
273	L	74.3	Confident	68.6	Low	105 Å²	105	118.7 Å²	118.7	55%	0.55	58%	0.575	S	S	.	*	H	α-helix	trans	-64.8	-39.6	178.4	-177.5	63	0	0	0	111.8	H269 E270 E271 Q276 Q277	H269-L273 PolarHBondContact O-N 3.01Å; H269-L273 VanDerWaalsContact O-N 3.1Å; E270-L273 PolarHBondContact O-N 3.21Å; E271-L273 VanDerWaalsContact C-N 3.34Å; E271-L273 PolarHBondContact O-N 2.66Å; L273-Q276 WeakPolarHBondContact O-CB 3.4Å; L273-Q276 PolarHBondContact O-N 3.46Å; L273-Q277 PolarHBondContact O-N 3.02Å; L273-Q277 VanDerWaalsContact O-N 3.07Å
274	R	66.2	Low	69.5	Low	203 Å²	203	115.2 Å²	115.2	77%	0.766	56%	0.556	S	S	*	*	H	α-helix	trans	-69.6	-35.5	178.7	-164.8	173.2	-173.3	160	2.5	112.7	E270 E271 K278	E270-R274 PolarHBondContact O-N 3.46Å; E271-R274 PolarHBondContact O-N 2.84Å; R274-K278 PolarHBondContact O-N 3.05Å
275	L	67.9	Low	70.6	Confident	118 Å²	118	112.6 Å²	112.6	62%	0.618	54%	0.541	S	S	*	.	H	α-helix	trans	-65.3	-42.9	170.7	-98.7	151.5	0	0	0	112	E271 K272 K278 H279	E271-L275 HydrophobicContact CG-CD1 4.43Å; E271-L275 PolarHBondContact O-N 3.47Å; K272-L275 PolarHBondContact O-N 3.3Å; L275-K278 PolarHBondContact O-N 2.82Å; L275-H279 PolarHBondContact O-N 3.16Å
276	Q	67.4	Low	71.1	Confident	87 Å²	87	113.2 Å²	113.2	41%	0.407	55%	0.546	S	S	.	.	H	α-helix	trans	-57.8	-51.9	176.7	-170.6	67.5	58.4	0	0	111.5	K272 L273 K278 H279 D280	K272-Q276 WeakPolarHBondContact O-CB 3.47Å; K272-Q276 PolarHBondContact O-N 2.97Å; L273-Q276 WeakPolarHBondContact O-CB 3.4Å; L273-Q276 PolarHBondContact O-N 3.46Å; Q276-K278 VanDerWaalsContact C-N 3.27Å; Q276-K278 PolarHBondContact O-N 3.06Å; Q276-H279 WeakPolarHBondContact O-CB 3.34Å; Q276-H279 PolarHBondContact O-N 3.33Å; Q276-H279 VanDerWaalsContact O-N 3.1Å; Q276-D280 PolarHBondContact NE2-OD1 2.91Å; Q276-D280 PolarHBondContact NE2-OD2 3.5Å; Q276-D280 PolarHBondContact O-N 3.23Å
277	Q	73.4	Confident	71.7	Confident	127 Å²	127	114.3 Å²	114.3	59%	0.593	54%	0.542	S	S	*	.	H	α-helix	trans	-57.6	-36.7	179.8	-73.5	179.8	-14.3	0	0	113.5	L273 A281	L273-Q277 PolarHBondContact O-N 3.02Å; L273-Q277 VanDerWaalsContact O-N 3.07Å; Q277-A281 PolarHBondContact O-N 2.92Å
278	K	71.8	Confident	72.7	Confident	146 Å²	146	110.8 Å²	110.8	64%	0.635	53%	0.528	S	S	*	.	H	α-helix	trans	-70.7	-44.4	176.3	-171.4	-176.6	176.3	-171.6	0	111.6	R274 L275 Q276 D280 A281 D282	R274-K278 PolarHBondContact O-N 3.05Å; L275-K278 PolarHBondContact O-N 2.82Å; Q276-K278 VanDerWaalsContact C-N 3.27Å; Q276-K278 PolarHBondContact O-N 3.06Å; K278-D280 VanDerWaalsContact C-N 3.34Å; K278-D280 PolarHBondContact O-N 2.87Å; K278-A281 PolarHBondContact O-N 3.3Å; K278-D282 PolarHBondContact O-N 3.39Å; K278-D282 VanDerWaalsContact O-N 3.17Å
279	H	75.1	Confident	73.5	Confident	117 Å²	117	111.7 Å²	111.7	54%	0.542	53%	0.527	S	S	.	.	H	α-helix	trans	-57.8	-47.6	177.3	176.1	-86.7	0	0	0	111.3	L275 Q276 A281 D282 V283	L275-H279 PolarHBondContact O-N 3.16Å; Q276-H279 WeakPolarHBondContact O-CB 3.34Å; Q276-H279 PolarHBondContact O-N 3.33Å; Q276-H279 VanDerWaalsContact O-N 3.1Å; H279-A281 VanDerWaalsContact C-N 3.33Å; H279-A281 PolarHBondContact O-N 3Å; H279-D282 PolarHBondContact O-N 2.8Å; H279-V283 WeakPolarHBondContact O-CG2 3.47Å; H279-V283 PolarHBondContact O-N 3.33Å
280	D	76	Confident	74	Confident	78 Å²	78	111 Å²	111	42%	0.417	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-37.4	-177.7	-59	-17.8	0	0	0	111.9	Q276 K278 V283 Q284	Q276-D280 PolarHBondContact NE2-OD1 2.91Å; Q276-D280 PolarHBondContact NE2-OD2 3.5Å; Q276-D280 PolarHBondContact O-N 3.23Å; K278-D280 VanDerWaalsContact C-N 3.34Å; K278-D280 PolarHBondContact O-N 2.87Å; D280-V283 PolarHBondContact O-N 3.34Å; D280-Q284 PolarHBondContact O-N 3.1Å
281	A	77.8	Confident	74.8	Confident	49 Å²	49	108.2 Å²	108.2	41%	0.405	51%	0.513	S	S	.	.	H	α-helix	trans	-68.4	-33.6	176.1	0	0	0	0	0	113.8	Q277 K278 H279 K285	Q277-A281 PolarHBondContact O-N 2.92Å; K278-A281 PolarHBondContact O-N 3.3Å; H279-A281 VanDerWaalsContact C-N 3.33Å; H279-A281 PolarHBondContact O-N 3Å; A281-K285 PolarHBondContact O-N 2.86Å
282	D	75.3	Confident	75.7	Confident	68 Å²	68	106.7 Å²	106.7	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-80.5	-30.9	176.1	-72.9	-29.6	0	0	0	111.9	K278 H279 K285 I286	K278-D282 PolarHBondContact O-N 3.39Å; K278-D282 VanDerWaalsContact O-N 3.17Å; H279-D282 PolarHBondContact O-N 2.8Å; D282-K285 PolarHBondContact O-N 3.08Å; D282-K285 IonicContact OD1-NZ 3.62Å; D282-K285 PolarHBondContact OD1-NZ 2.91Å; D282-I286 WeakPolarHBondContact O-CG1 3.31Å; D282-I286 PolarHBondContact O-N 3.14Å
283	V	76.8	Confident	76.5	Confident	58 Å²	58	104.5 Å²	104.5	35%	0.352	50%	0.501	S	S	.	.	H	α-helix	trans	-59.8	-44.1	167.2	168.4	0	0	0	0	111.3	H279 D280 K285 I286 L287	H279-V283 WeakPolarHBondContact O-CG2 3.47Å; H279-V283 PolarHBondContact O-N 3.33Å; D280-V283 PolarHBondContact O-N 3.34Å; V283-K285 VanDerWaalsContact C-N 3.34Å; V283-K285 PolarHBondContact O-N 2.79Å; V283-I286 WeakPolarHBondContact O-CB 3.26Å; V283-I286 PolarHBondContact O-N 3.48Å; V283-L287 HydrophobicContact CG1-CD1 4.14Å; V283-L287 HydrophobicContact CG1-CG 4.48Å; V283-L287 PolarHBondContact O-N 2.85Å
284	Q	78.3	Confident	76.9	Confident	99 Å²	99	103.2 Å²	103.2	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-58.8	-42.4	179.3	-172.1	64	18.7	0	0	112.3	D280 I286 L287 E288	D280-Q284 PolarHBondContact O-N 3.1Å; Q284-I286 VanDerWaalsContact C-N 3.27Å; Q284-I286 PolarHBondContact O-N 2.89Å; Q284-L287 PolarHBondContact O-N 2.8Å; Q284-E288 PolarHBondContact NE2-OE1 2.81Å; Q284-E288 WeakPolarHBondContact O-CG 3.26Å; Q284-E288 PolarHBondContact O-N 3.36Å
285	K	80.3	Confident	77.7	Confident	103 Å²	103	97.5 Å²	97.5	45%	0.448	48%	0.476	S	S	.	.	H	α-helix	trans	-67	-24.3	175.8	-65.4	171.3	-162.8	152.6	0	113.9	A281 D282 V283 R289	A281-K285 PolarHBondContact O-N 2.86Å; D282-K285 PolarHBondContact O-N 3.08Å; D282-K285 IonicContact OD1-NZ 3.62Å; D282-K285 PolarHBondContact OD1-NZ 2.91Å; V283-K285 VanDerWaalsContact C-N 3.34Å; V283-K285 PolarHBondContact O-N 2.79Å; K285-R289 PolarHBondContact O-N 2.82Å
286	I	77.1	Confident	78.5	Confident	104 Å²	104	98.2 Å²	98.2	53%	0.533	48%	0.476	S	S	.	.	H	α-helix	trans	-76.3	-43.8	173.8	-67.1	166.6	0	0	0	109.3	D282 V283 Q284 R289 K290	D282-I286 WeakPolarHBondContact O-CG1 3.31Å; D282-I286 PolarHBondContact O-N 3.14Å; V283-I286 WeakPolarHBondContact O-CB 3.26Å; V283-I286 PolarHBondContact O-N 3.48Å; Q284-I286 VanDerWaalsContact C-N 3.27Å; Q284-I286 PolarHBondContact O-N 2.89Å; I286-R289 PolarHBondContact O-N 2.93Å; I286-K290 WeakPolarHBondContact O-CG 3.46Å; I286-K290 PolarHBondContact O-N 3.31Å
287	L	78.3	Confident	79.4	Confident	88 Å²	88	98.8 Å²	98.8	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-60.7	-44.2	174.9	-69.6	171.6	0	0	0	112	V283 Q284 K290 N291	V283-L287 HydrophobicContact CG1-CD1 4.14Å; V283-L287 HydrophobicContact CG1-CG 4.48Å; V283-L287 PolarHBondContact O-N 2.85Å; Q284-L287 PolarHBondContact O-N 2.8Å; L287-K290 PolarHBondContact O-N 2.96Å; L287-N291 WeakPolarHBondContact O-CB 3.48Å; L287-N291 VanDerWaalsContact O-CG 3.28Å; L287-N291 PolarHBondContact O-N 3.26Å; L287-N291 PolarHBondContact O-ND2 3.17Å
288	E	78.8	Confident	79.9	Confident	100 Å²	100	97 Å²	97	47%	0.467	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-44.7	177	-75.2	167.9	-174.2	0	0	112.3	Q284 N291 N292	Q284-E288 PolarHBondContact NE2-OE1 2.81Å; Q284-E288 WeakPolarHBondContact O-CG 3.26Å; Q284-E288 PolarHBondContact O-N 3.36Å; E288-N291 PolarHBondContact O-N 2.92Å; E288-N292 PolarHBondContact O-N 3.41Å
289	R	80.9	Confident	80.5	Confident	165 Å²	165	93.6 Å²	93.6	62%	0.623	46%	0.463	S	S	*	.	H	α-helix	trans	-61	-45.7	173	-80.9	-167.6	-178.2	84.1	-5.7	112.5	K285 I286 N291 N292 E293	K285-R289 PolarHBondContact O-N 2.82Å; I286-R289 PolarHBondContact O-N 2.93Å; R289-N291 VanDerWaalsContact C-N 3.33Å; R289-N291 PolarHBondContact O-N 2.92Å; R289-N292 PolarHBondContact O-N 2.87Å; R289-E293 WeakPolarHBondContact O-CG 3.32Å; R289-E293 PolarHBondContact O-N 3.46Å
290	K	81.2	Confident	81.1	Confident	100 Å²	100	93.3 Å²	93.3	44%	0.435	47%	0.465	S	S	.	.	H	α-helix	trans	-67.7	-32.3	-179.7	-69.4	-44.6	-171	-167.6	0	112.9	I286 L287 E293 I294	I286-K290 WeakPolarHBondContact O-CG 3.46Å; I286-K290 PolarHBondContact O-N 3.31Å; L287-K290 PolarHBondContact O-N 2.96Å; K290-E293 WeakPolarHBondContact CD-OE1 3.48Å; K290-E293 VanDerWaalsContact CD-OE2 3.32Å; K290-E293 WeakPolarHBondContact CD-OE2 3.49Å; K290-E293 IonicContact NZ-OE1 2.75Å; K290-E293 PolarHBondContact NZ-OE1 2.68Å; K290-E293 IonicContact NZ-OE2 2.61Å; K290-E293 PolarHBondContact NZ-OE2 3.02Å; K290-I294 WeakPolarHBondContact O-CB 3.41Å; K290-I294 WeakPolarHBondContact O-CD1 3.4Å; K290-I294 WeakPolarHBondContact O-CG1 3.26Å; K290-I294 PolarHBondContact O-N 2.85Å
291	N	82.6	Confident	81.6	Confident	94 Å²	94	97.5 Å²	97.5	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-65.7	-40.8	171.2	-73.2	-23.7	0	0	0	112	L287 E288 R289 I294 E295	L287-N291 WeakPolarHBondContact O-CB 3.48Å; L287-N291 VanDerWaalsContact O-CG 3.28Å; L287-N291 PolarHBondContact O-N 3.26Å; L287-N291 PolarHBondContact O-ND2 3.17Å; E288-N291 PolarHBondContact O-N 2.92Å; R289-N291 VanDerWaalsContact C-N 3.33Å; R289-N291 PolarHBondContact O-N 2.92Å; N291-I294 PolarHBondContact O-N 3.33Å; N291-E295 PolarHBondContact O-N 3.13Å
292	N	84.4	Confident	82.1	Confident	104 Å²	104	101.9 Å²	101.9	56%	0.556	48%	0.482	S	S	*	.	H	α-helix	trans	-65.6	-47.8	175.7	-69.6	-1.4	0	0	0	111.9	E288 R289 I294 E295 E296	E288-N292 PolarHBondContact O-N 3.41Å; R289-N292 PolarHBondContact O-N 2.87Å; N292-I294 PolarHBondContact O-N 3.02Å; N292-E295 PolarHBondContact O-N 2.99Å; N292-E295 VanDerWaalsContact O-N 3.1Å; N292-E296 PolarHBondContact O-N 2.93Å
293	E	83	Confident	82.6	Confident	82 Å²	82	101.7 Å²	101.7	38%	0.383	49%	0.486	S	S	.	.	H	α-helix	trans	-54.8	-37.4	173.5	-71.9	175.3	-143.6	0	0	111.9	R289 K290 L297	R289-E293 WeakPolarHBondContact O-CG 3.32Å; R289-E293 PolarHBondContact O-N 3.46Å; K290-E293 WeakPolarHBondContact CD-OE1 3.48Å; K290-E293 VanDerWaalsContact CD-OE2 3.32Å; K290-E293 WeakPolarHBondContact CD-OE2 3.49Å; K290-E293 IonicContact NZ-OE1 2.75Å; K290-E293 PolarHBondContact NZ-OE1 2.68Å; K290-E293 IonicContact NZ-OE2 2.61Å; K290-E293 PolarHBondContact NZ-OE2 3.02Å; E293-L297 WeakPolarHBondContact O-CB 3.29Å; E293-L297 WeakPolarHBondContact O-CG 3.47Å; E293-L297 PolarHBondContact O-N 2.84Å
294	I	81.8	Confident	83.2	Confident	77 Å²	77	105.1 Å²	105.1	40%	0.395	50%	0.496	S	S	.	.	H	α-helix	trans	-69.3	-39.8	177.5	-75.8	166.4	0	0	0	112.2	K290 N291 N292 K298	K290-I294 WeakPolarHBondContact O-CB 3.41Å; K290-I294 WeakPolarHBondContact O-CD1 3.4Å; K290-I294 WeakPolarHBondContact O-CG1 3.26Å; K290-I294 PolarHBondContact O-N 2.85Å; N291-I294 PolarHBondContact O-N 3.33Å; N292-I294 PolarHBondContact O-N 3.02Å; I294-K298 HydrophobicContact CG2-CD 3.95Å; I294-K298 WeakPolarHBondContact O-CB 3.29Å; I294-K298 WeakPolarHBondContact O-CD 3.47Å; I294-K298 VanDerWaalsContact O-CG 3.22Å; I294-K298 WeakPolarHBondContact O-CG 3.37Å; I294-K298 PolarHBondContact O-N 3.42Å
295	E	84.6	Confident	83.6	Confident	84 Å²	84	105.7 Å²	105.7	39%	0.393	50%	0.499	S	S	.	.	H	α-helix	trans	-75.3	-32.1	176.1	-69.9	-55.7	144.7	0	0	113.1	N291 N292 K298 T299 R302	N291-E295 PolarHBondContact O-N 3.13Å; N292-E295 PolarHBondContact O-N 2.99Å; N292-E295 VanDerWaalsContact O-N 3.1Å; E295-K298 VanDerWaalsContact CD-CD 3.41Å; E295-K298 PolarHBondContact O-N 3.04Å; E295-K298 WeakPolarHBondContact OE1-CD 3.47Å; E295-K298 WeakPolarHBondContact OE1-CE 3.35Å; E295-K298 IonicContact OE1-NZ 2.65Å; E295-K298 PolarHBondContact OE1-NZ 3.34Å; E295-K298 VanDerWaalsContact OE2-CD 3.26Å; E295-K298 WeakPolarHBondContact OE2-CD 3.38Å; E295-T299 WeakPolarHBondContact O-CB 3.34Å; E295-T299 WeakPolarHBondContact O-CG2 3.33Å; E295-T299 PolarHBondContact O-N 2.78Å; E295-T299 PolarHBondContact O-OG1 2.9Å; E295-R302 IonicContact OE2-NH2 3.16Å; E295-R302 PolarHBondContact OE2-NH2 2.83Å
296	E	84.2	Confident	84	Confident	132 Å²	132	105.3 Å²	105.3	62%	0.617	50%	0.498	S	S	*	.	H	α-helix	trans	-61.8	-45.6	169.5	-73.6	176.7	-167.1	0	0	111.1	N292 T299 L300	N292-E296 PolarHBondContact O-N 2.93Å; E296-T299 WeakPolarHBondContact CA-OG1 3.38Å; E296-T299 PolarHBondContact O-N 3.49Å; E296-T299 PolarHBondContact O-OG1 3.06Å; E296-L300 WeakPolarHBondContact O-CB 3.28Å; E296-L300 PolarHBondContact O-N 2.79Å
297	L	85	Confident	84.5	Confident	100 Å²	100	105.3 Å²	105.3	52%	0.524	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-45.4	172.9	-75.4	169.2	0	0	0	112.1	E293 T299 L300 Y301	E293-L297 WeakPolarHBondContact O-CB 3.29Å; E293-L297 WeakPolarHBondContact O-CG 3.47Å; E293-L297 PolarHBondContact O-N 2.84Å; L297-T299 VanDerWaalsContact C-N 3.34Å; L297-T299 PolarHBondContact O-N 2.86Å; L297-L300 PolarHBondContact O-N 3.14Å; L297-Y301 VanDerWaalsContact O-CD2 3.28Å; L297-Y301 WeakPolarHBondContact O-CD2 3.27Å; L297-Y301 PolarHBondContact O-N 2.85Å
298	K	84.8	Confident	84.9	Confident	89 Å²	89	104.5 Å²	104.5	39%	0.387	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-40.4	177.6	-77.4	162	173	169.8	0	112.5	I294 E295 R302	I294-K298 HydrophobicContact CG2-CD 3.95Å; I294-K298 WeakPolarHBondContact O-CB 3.29Å; I294-K298 WeakPolarHBondContact O-CD 3.47Å; I294-K298 VanDerWaalsContact O-CG 3.22Å; I294-K298 WeakPolarHBondContact O-CG 3.37Å; I294-K298 PolarHBondContact O-N 3.42Å; E295-K298 VanDerWaalsContact CD-CD 3.41Å; E295-K298 PolarHBondContact O-N 3.04Å; E295-K298 WeakPolarHBondContact OE1-CD 3.47Å; E295-K298 WeakPolarHBondContact OE1-CE 3.35Å; E295-K298 IonicContact OE1-NZ 2.65Å; E295-K298 PolarHBondContact OE1-NZ 3.34Å; E295-K298 VanDerWaalsContact OE2-CD 3.26Å; E295-K298 WeakPolarHBondContact OE2-CD 3.38Å; K298-R302 VanDerWaalsContact O-CG 3.3Å; K298-R302 WeakPolarHBondContact O-CG 3.45Å; K298-R302 PolarHBondContact O-N 3.48Å
299	T	83.9	Confident	85.4	Confident	75 Å²	75	103.2 Å²	103.2	46%	0.46	49%	0.489	S	S	.	.	H	α-helix	trans	-70.8	-40.1	179.2	46.7	0	0	0	0	111.7	E295 E296 L297 R302 S303	E295-T299 WeakPolarHBondContact O-CB 3.34Å; E295-T299 WeakPolarHBondContact O-CG2 3.33Å; E295-T299 PolarHBondContact O-N 2.78Å; E295-T299 PolarHBondContact O-OG1 2.9Å; E296-T299 WeakPolarHBondContact CA-OG1 3.38Å; E296-T299 PolarHBondContact O-N 3.49Å; E296-T299 PolarHBondContact O-OG1 3.06Å; L297-T299 VanDerWaalsContact C-N 3.34Å; L297-T299 PolarHBondContact O-N 2.86Å; T299-R302 PolarHBondContact O-N 2.83Å; T299-S303 PolarHBondContact O-N 2.78Å
300	L	87.6	Confident	85.8	Confident	110 Å²	110	98.8 Å²	98.8	58%	0.576	48%	0.475	S	S	*	.	H	α-helix	trans	-62.3	-43.1	173.8	-168.2	152.8	0	0	0	112.1	E296 L297 S303 K304	E296-L300 WeakPolarHBondContact O-CB 3.28Å; E296-L300 PolarHBondContact O-N 2.79Å; L297-L300 PolarHBondContact O-N 3.14Å; L300-S303 PolarHBondContact O-N 3.43Å; L300-K304 PolarHBondContact O-N 3.41Å
301	Y	87	Confident	86.1	Confident	166 Å²	166	97.7 Å²	97.7	65%	0.651	48%	0.477	S	S	*	.	H	α-helix	trans	-63.2	-39.4	173.4	-87.3	-71.3	0	0	0	112.8	L297 K304 Q305	L297-Y301 VanDerWaalsContact O-CD2 3.28Å; L297-Y301 WeakPolarHBondContact O-CD2 3.27Å; L297-Y301 PolarHBondContact O-N 2.85Å; Y301-K304 PolarHBondContact O-N 2.85Å; Y301-Q305 WeakPolarHBondContact O-CB 3.31Å; Y301-Q305 PolarHBondContact O-N 3.12Å
302	R	87.9	Confident	86.4	Confident	142 Å²	142	97.4 Å²	97.4	54%	0.536	47%	0.474	S	S	.	.	H	α-helix	trans	-64.5	-41.1	175.2	-73.5	178.1	-135.3	165.5	9.6	112.5	E295 K298 T299 Q305 H306	E295-R302 IonicContact OE2-NH2 3.16Å; E295-R302 PolarHBondContact OE2-NH2 2.83Å; K298-R302 VanDerWaalsContact O-CG 3.3Å; K298-R302 WeakPolarHBondContact O-CG 3.45Å; K298-R302 PolarHBondContact O-N 3.48Å; T299-R302 PolarHBondContact O-N 2.83Å; R302-Q305 PolarHBondContact O-N 3.36Å; R302-H306 PolarHBondContact O-N 2.85Å
303	S	87.4	Confident	86.6	Confident	63 Å²	63	97.6 Å²	97.6	44%	0.441	47%	0.468	S	S	.	.	H	α-helix	trans	-59.9	-51.4	174.6	-168	0	0	0	0	110.7	T299 L300 Q305 H306 E307	T299-S303 PolarHBondContact O-N 2.78Å; L300-S303 PolarHBondContact O-N 3.43Å; S303-Q305 VanDerWaalsContact C-N 3.3Å; S303-Q305 PolarHBondContact O-N 2.76Å; S303-H306 WeakPolarHBondContact O-CB 3.35Å; S303-H306 PolarHBondContact O-N 2.82Å; S303-E307 VanDerWaalsContact C-OE1 3.29Å; S303-E307 WeakPolarHBondContact O-CG 3.35Å; S303-E307 PolarHBondContact O-N 3.43Å; S303-E307 PolarHBondContact OG-OE1 2.72Å
304	K	88.7	Confident	87	Confident	131 Å²	131	99.3 Å²	99.3	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-63.1	-35.2	-178.7	-167.1	164.6	-173.6	169	0	112.9	L300 Y301 T308	L300-K304 PolarHBondContact O-N 3.41Å; Y301-K304 PolarHBondContact O-N 2.85Å; K304-T308 WeakPolarHBondContact O-CG2 3.17Å; K304-T308 PolarHBondContact O-N 3.19Å; K304-T308 VanDerWaalsContact O-N 3.11Å; K304-T308 PolarHBondContact O-OG1 3.37Å
305	Q	85.4	Confident	87.4	Confident	110 Å²	110	100.6 Å²	100.6	51%	0.514	48%	0.481	S	S	.	.	H	α-helix	trans	-61.3	-52.5	170.2	-179.1	-178.4	-22.7	0	0	110.9	Y301 R302 S303 E307 T308 E309	Y301-Q305 WeakPolarHBondContact O-CB 3.31Å; Y301-Q305 PolarHBondContact O-N 3.12Å; R302-Q305 PolarHBondContact O-N 3.36Å; S303-Q305 VanDerWaalsContact C-N 3.3Å; S303-Q305 PolarHBondContact O-N 2.76Å; Q305-E307 VanDerWaalsContact C-N 3.31Å; Q305-E307 PolarHBondContact O-N 3.4Å; Q305-T308 PolarHBondContact O-N 3.48Å; Q305-T308 VanDerWaalsContact O-N 3.07Å; Q305-T308 PolarHBondContact O-OG1 2.83Å; Q305-E309 HydrophobicContact CG-CG 4.44Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.24Å; Q305-E309 PolarHBondContact NE2-OE1 3.12Å; Q305-E309 PolarHBondContact O-N 3.5Å
306	H	89.7	Confident	87.5	Confident	95 Å²	95	101.5 Å²	101.5	44%	0.44	49%	0.485	S	S	.	.	H	α-helix	trans	-58.3	-41.6	179.9	-175.4	-88.2	0	0	0	112.6	R302 S303 E309 E310	R302-H306 PolarHBondContact O-N 2.85Å; S303-H306 WeakPolarHBondContact O-CB 3.35Å; S303-H306 PolarHBondContact O-N 2.82Å; H306-E309 PolarHBondContact O-N 2.91Å; H306-E310 IonicContact CE1-OE1 2.81Å; H306-E310 PolarHBondContact CE1-OE1 3.44Å; H306-E310 PolarHBondContact O-N 2.92Å
307	E	88.3	Confident	87.9	Confident	105 Å²	105	102.2 Å²	102.2	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-57.8	-47.3	173.3	-70.3	157	-134.4	0	0	111.5	S303 Q305 E310 T311	S303-E307 VanDerWaalsContact C-OE1 3.29Å; S303-E307 WeakPolarHBondContact O-CG 3.35Å; S303-E307 PolarHBondContact O-N 3.43Å; S303-E307 PolarHBondContact OG-OE1 2.72Å; Q305-E307 VanDerWaalsContact C-N 3.31Å; Q305-E307 PolarHBondContact O-N 3.4Å; E307-E310 PolarHBondContact O-N 3.49Å; E307-T311 WeakPolarHBondContact O-CG2 3.48Å; E307-T311 PolarHBondContact O-N 2.97Å; E307-T311 VanDerWaalsContact O-N 3.08Å
308	T	86.2	Confident	88.3	Confident	70 Å²	70	104.2 Å²	104.2	43%	0.429	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-43.1	176.7	55.4	0	0	0	0	112.6	K304 Q305 E310 T311 I312	K304-T308 WeakPolarHBondContact O-CG2 3.17Å; K304-T308 PolarHBondContact O-N 3.19Å; K304-T308 VanDerWaalsContact O-N 3.11Å; K304-T308 PolarHBondContact O-OG1 3.37Å; Q305-T308 PolarHBondContact O-N 3.48Å; Q305-T308 VanDerWaalsContact O-N 3.07Å; Q305-T308 PolarHBondContact O-OG1 2.83Å; T308-E310 VanDerWaalsContact C-N 3.31Å; T308-E310 PolarHBondContact O-N 2.78Å; T308-T311 PolarHBondContact O-N 2.89Å; T308-T311 VanDerWaalsContact O-N 3.1Å; T308-T311 PolarHBondContact O-OG1 2.76Å; T308-I312 WeakPolarHBondContact O-CG1 3.49Å; T308-I312 PolarHBondContact O-N 2.82Å
309	E	89.4	Confident	88.6	Confident	73 Å²	73	103.9 Å²	103.9	34%	0.341	50%	0.496	S	S	.	.	H	α-helix	trans	-62.2	-35.9	176.3	-69.7	179.7	-160.6	0	0	112.7	Q305 H306 I312 R313	Q305-E309 HydrophobicContact CG-CG 4.44Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.24Å; Q305-E309 PolarHBondContact NE2-OE1 3.12Å; Q305-E309 PolarHBondContact O-N 3.5Å; H306-E309 PolarHBondContact O-N 2.91Å; E309-I312 PolarHBondContact O-N 3.22Å; E309-R313 WeakPolarHBondContact O-CB 3.38Å; E309-R313 PolarHBondContact O-N 2.81Å; E309-R313 IonicContact OE2-NH2 2.69Å; E309-R313 PolarHBondContact OE2-NH2 2.82Å; E309-R313 VanDerWaalsContact OE2-NH2 3.15Å
310	E	88.8	Confident	89	Confident	72 Å²	72	105.4 Å²	105.4	34%	0.336	50%	0.498	S	S	.	.	H	α-helix	trans	-65.7	-40	171.9	-88.7	-152.4	-170.4	0	0	112.7	H306 E307 T308 I312 R313 K314	H306-E310 IonicContact CE1-OE1 2.81Å; H306-E310 PolarHBondContact CE1-OE1 3.44Å; H306-E310 PolarHBondContact O-N 2.92Å; E307-E310 PolarHBondContact O-N 3.49Å; T308-E310 VanDerWaalsContact C-N 3.31Å; T308-E310 PolarHBondContact O-N 2.78Å; E310-I312 VanDerWaalsContact C-N 3.32Å; E310-R313 PolarHBondContact O-N 2.79Å; E310-K314 WeakPolarHBondContact O-CB 3.5Å; E310-K314 WeakPolarHBondContact O-CD 3.2Å; E310-K314 WeakPolarHBondContact O-CG 3.44Å; E310-K314 PolarHBondContact O-N 2.92Å; E310-K314 WeakPolarHBondContact OE2-CE 3.43Å; E310-K314 IonicContact OE2-NZ 2.62Å; E310-K314 PolarHBondContact OE2-NZ 2.79Å
311	T	87.8	Confident	89.1	Confident	78 Å²	78	102.9 Å²	102.9	48%	0.479	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-38.4	175.9	61.5	0	0	0	0	111.6	E307 T308 K314 L315	E307-T311 WeakPolarHBondContact O-CG2 3.48Å; E307-T311 PolarHBondContact O-N 2.97Å; E307-T311 VanDerWaalsContact O-N 3.08Å; T308-T311 PolarHBondContact O-N 2.89Å; T308-T311 VanDerWaalsContact O-N 3.1Å; T308-T311 PolarHBondContact O-OG1 2.76Å; T311-K314 PolarHBondContact O-N 3.35Å; T311-L315 WeakPolarHBondContact O-CG 3.12Å; T311-L315 PolarHBondContact O-N 3.38Å
312	I	87.8	Confident	89.3	Confident	87 Å²	87	100.1 Å²	100.1	45%	0.446	48%	0.483	S	S	.	.	H	α-helix	trans	-61.4	-53.1	173	-66.9	164.8	0	0	0	110	T308 E309 E310 K314 L315 E316	T308-I312 WeakPolarHBondContact O-CG1 3.49Å; T308-I312 PolarHBondContact O-N 2.82Å; E309-I312 PolarHBondContact O-N 3.22Å; E310-I312 VanDerWaalsContact C-N 3.32Å; I312-K314 PolarHBondContact O-N 2.88Å; I312-K314 VanDerWaalsContact O-N 3.11Å; I312-L315 WeakPolarHBondContact O-CA 3.28Å; I312-L315 PolarHBondContact O-N 3.45Å; I312-E316 HydrophobicContact CG2-CG 4.15Å; I312-E316 WeakPolarHBondContact O-CG 3.42Å; I312-E316 PolarHBondContact O-N 3.4Å
313	R	90.1	Very high	89.5	Confident	109 Å²	109	98.2 Å²	98.2	41%	0.411	48%	0.482	S	S	.	.	H	α-helix	trans	-56.2	-29.8	176.2	-96.1	175.7	-92.7	141.1	-8	114.1	E309 E310 E316 K317	E309-R313 WeakPolarHBondContact O-CB 3.38Å; E309-R313 PolarHBondContact O-N 2.81Å; E309-R313 IonicContact OE2-NH2 2.69Å; E309-R313 PolarHBondContact OE2-NH2 2.82Å; E309-R313 VanDerWaalsContact OE2-NH2 3.15Å; E310-R313 PolarHBondContact O-N 2.79Å; R313-E316 WeakPolarHBondContact CA-OE2 3.36Å; R313-K317 WeakPolarHBondContact O-CG 3.24Å; R313-K317 PolarHBondContact O-N 3.27Å
314	K	91.2	Very high	89.7	Confident	117 Å²	117	101.4 Å²	101.4	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-77.6	-33.4	175.2	-71.2	161.1	-167.1	166.1	0	112.2	E310 T311 I312	E310-K314 WeakPolarHBondContact O-CB 3.5Å; E310-K314 WeakPolarHBondContact O-CD 3.2Å; E310-K314 WeakPolarHBondContact O-CG 3.44Å; E310-K314 PolarHBondContact O-N 2.92Å; E310-K314 WeakPolarHBondContact OE2-CE 3.43Å; E310-K314 IonicContact OE2-NZ 2.62Å; E310-K314 PolarHBondContact OE2-NZ 2.79Å; T311-K314 PolarHBondContact O-N 3.35Å; I312-K314 PolarHBondContact O-N 2.88Å; I312-K314 VanDerWaalsContact O-N 3.11Å
315	L	89.3	Confident	89.7	Confident	105 Å²	105	98.9 Å²	98.9	55%	0.55	48%	0.478	S	S	.	.	H	α-helix	trans	-74.8	-43.4	174.3	-70.1	170.4	0	0	0	112.1	T311 I312 K317 K318 V319	T311-L315 WeakPolarHBondContact O-CG 3.12Å; T311-L315 PolarHBondContact O-N 3.38Å; I312-L315 WeakPolarHBondContact O-CA 3.28Å; I312-L315 PolarHBondContact O-N 3.45Å; L315-K317 VanDerWaalsContact C-N 3.3Å; L315-K317 PolarHBondContact O-N 2.94Å; L315-K318 WeakPolarHBondContact O-CA 3.32Å; L315-K318 WeakPolarHBondContact O-CB 3.43Å; L315-K318 PolarHBondContact O-N 3.07Å; L315-V319 PolarHBondContact O-N 2.77Å
316	E	88.3	Confident	89.9	Confident	102 Å²	102	96.7 Å²	96.7	48%	0.477	47%	0.473	S	S	.	.	H	α-helix	trans	-53.9	-45.7	175.4	-71.4	171.5	155.5	0	0	111.7	I312 R313 K318 V319 Q320	I312-E316 HydrophobicContact CG2-CG 4.15Å; I312-E316 WeakPolarHBondContact O-CG 3.42Å; I312-E316 PolarHBondContact O-N 3.4Å; R313-E316 WeakPolarHBondContact CA-OE2 3.36Å; E316-K318 VanDerWaalsContact C-N 3.32Å; E316-K318 PolarHBondContact O-N 3.35Å; E316-V319 PolarHBondContact O-N 2.87Å; E316-Q320 WeakPolarHBondContact O-CG 3.22Å; E316-Q320 PolarHBondContact O-N 3.4Å
317	K	92.5	Very high	90	Very high	147 Å²	147	95.6 Å²	95.6	64%	0.639	47%	0.469	S	S	*	.	H	α-helix	trans	-62.5	-35	176	-75.4	-178.5	177.8	-174	0	113.2	R313 L315 T321	R313-K317 WeakPolarHBondContact O-CG 3.24Å; R313-K317 PolarHBondContact O-N 3.27Å; L315-K317 VanDerWaalsContact C-N 3.3Å; L315-K317 PolarHBondContact O-N 2.94Å; K317-T321 PolarHBondContact O-N 2.69Å; K317-T321 PolarHBondContact O-OG1 3.36Å
318	K	92.4	Very high	90.2	Very high	142 Å²	142	94.4 Å²	94.4	62%	0.617	47%	0.468	S	S	*	.	H	α-helix	trans	-68.5	-45.5	173.9	-71.8	-178.5	176.1	-172.6	0	111.2	L315 E316 T321 L322	L315-K318 WeakPolarHBondContact O-CA 3.32Å; L315-K318 WeakPolarHBondContact O-CB 3.43Å; L315-K318 PolarHBondContact O-N 3.07Å; E316-K318 VanDerWaalsContact C-N 3.32Å; E316-K318 PolarHBondContact O-N 3.35Å; K318-T321 PolarHBondContact O-N 2.75Å; K318-L322 WeakPolarHBondContact O-CG 3.46Å; K318-L322 PolarHBondContact O-N 3.19Å
319	V	91.8	Very high	90.4	Very high	82 Å²	82	96.2 Å²	96.2	50%	0.497	47%	0.474	S	S	.	.	H	α-helix	trans	-60	-46.4	176.7	172.8	0	0	0	0	111	L315 E316 T321 L322 I323	L315-V319 PolarHBondContact O-N 2.77Å; E316-V319 PolarHBondContact O-N 2.87Å; V319-T321 VanDerWaalsContact C-N 3.27Å; V319-T321 PolarHBondContact O-N 2.89Å; V319-L322 PolarHBondContact O-N 3.41Å; V319-I323 HydrophobicContact CG1-CD1 3.75Å; V319-I323 HydrophobicContact CG1-CG1 4.42Å; V319-I323 WeakPolarHBondContact O-CB 3.47Å; V319-I323 VanDerWaalsContact O-CG1 3.26Å; V319-I323 WeakPolarHBondContact O-CG1 3.39Å; V319-I323 PolarHBondContact O-N 3.47Å
320	Q	91.1	Very high	90.5	Very high	107 Å²	107	98.2 Å²	98.2	50%	0.5	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-32.2	176.6	-72.2	179.7	2.1	0	0	113.5	E316 R324	E316-Q320 WeakPolarHBondContact O-CG 3.22Å; E316-Q320 PolarHBondContact O-N 3.4Å; Q320-R324 PolarHBondContact O-N 3.29Å
321	T	90	Very high	90.6	Very high	58 Å²	58	98.7 Å²	98.7	36%	0.356	48%	0.481	S	S	.	.	H	α-helix	trans	-74.4	-47.5	175	-64.4	0	0	0	0	111.6	K317 K318 V319 I323 R324 D325	K317-T321 PolarHBondContact O-N 2.69Å; K317-T321 PolarHBondContact O-OG1 3.36Å; K318-T321 PolarHBondContact O-N 2.75Å; V319-T321 VanDerWaalsContact C-N 3.27Å; V319-T321 PolarHBondContact O-N 2.89Å; T321-I323 PolarHBondContact O-N 2.74Å; T321-R324 VanDerWaalsContact CA-NH1 3.32Å; T321-R324 WeakPolarHBondContact O-CA 3.34Å; T321-R324 PolarHBondContact O-N 3.14Å; T321-R324 PolarHBondContact OG1-NH1 2.84Å; T321-D325 PolarHBondContact O-N 2.85Å
322	L	91.7	Very high	90.7	Very high	108 Å²	108	98 Å²	98	57%	0.565	48%	0.477	S	S	*	.	H	α-helix	trans	-57.5	-33.5	173.6	-68.6	171.7	0	0	0	112.7	K318 V319 C326	K318-L322 WeakPolarHBondContact O-CG 3.46Å; K318-L322 PolarHBondContact O-N 3.19Å; V319-L322 PolarHBondContact O-N 3.41Å; L322-C326 VanDerWaalsContact O-CB 3.24Å; L322-C326 WeakPolarHBondContact O-CB 3.3Å; L322-C326 PolarHBondContact O-N 3.38Å; L322-C326 PolarHBondContact O-SG 2.89Å
323	I	92.1	Very high	90.9	Very high	102 Å²	102	99.3 Å²	99.3	52%	0.523	48%	0.479	S	S	.	.	H	α-helix	trans	-66.2	-41.4	174.3	-72.8	167.2	0	0	0	111.6	V319 T321 Q327	V319-I323 HydrophobicContact CG1-CD1 3.75Å; V319-I323 HydrophobicContact CG1-CG1 4.42Å; V319-I323 WeakPolarHBondContact O-CB 3.47Å; V319-I323 VanDerWaalsContact O-CG1 3.26Å; V319-I323 WeakPolarHBondContact O-CG1 3.39Å; V319-I323 PolarHBondContact O-N 3.47Å; T321-I323 PolarHBondContact O-N 2.74Å; I323-Q327 WeakPolarHBondContact O-CB 3.35Å; I323-Q327 PolarHBondContact O-N 3.07Å
324	R	90.8	Very high	91	Very high	129 Å²	129	99.5 Å²	99.5	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-67.3	-45.5	175.5	-74.7	-176.8	-118	95.9	6.1	111.4	Q320 T321 C326 Q327 V328	Q320-R324 PolarHBondContact O-N 3.29Å; T321-R324 VanDerWaalsContact CA-NH1 3.32Å; T321-R324 WeakPolarHBondContact O-CA 3.34Å; T321-R324 PolarHBondContact O-N 3.14Å; T321-R324 PolarHBondContact OG1-NH1 2.84Å; R324-C326 VanDerWaalsContact C-N 3.35Å; R324-C326 PolarHBondContact O-N 3.26Å; R324-Q327 WeakPolarHBondContact O-CB 3.24Å; R324-Q327 PolarHBondContact O-N 2.69Å; R324-V328 PolarHBondContact O-N 3.36Å
325	D	89.6	Confident	91	Very high	79 Å²	79	99.1 Å²	99.1	42%	0.422	49%	0.488	S	S	.	.	H	α-helix	trans	-61.4	-44.5	178	-53.2	-24.3	0	0	0	110.6	T321 Q327 V328 I329	T321-D325 PolarHBondContact O-N 2.85Å; D325-Q327 VanDerWaalsContact C-N 3.29Å; D325-Q327 PolarHBondContact O-N 3.3Å; D325-V328 PolarHBondContact O-N 3.18Å; D325-I329 WeakPolarHBondContact O-CB 3.22Å; D325-I329 WeakPolarHBondContact O-CD1 3.49Å; D325-I329 VanDerWaalsContact O-CG1 3.26Å; D325-I329 WeakPolarHBondContact O-CG1 3.32Å; D325-I329 PolarHBondContact O-N 2.94Å
326	C	89.1	Confident	91.1	Very high	63 Å²	63	98.7 Å²	98.7	43%	0.426	48%	0.483	S	S	.	.	H	α-helix	trans	-65.5	-25.2	173	-67.6	0	0	0	0	114.2	L322 R324 R330	L322-C326 VanDerWaalsContact O-CB 3.24Å; L322-C326 WeakPolarHBondContact O-CB 3.3Å; L322-C326 PolarHBondContact O-N 3.38Å; L322-C326 PolarHBondContact O-SG 2.89Å; R324-C326 VanDerWaalsContact C-N 3.35Å; R324-C326 PolarHBondContact O-N 3.26Å; C326-R330 PolarHBondContact O-N 3.42Å
327	Q	91.4	Very high	91.2	Very high	73 Å²	73	98.3 Å²	98.3	34%	0.341	48%	0.484	S	S	.	.	H	α-helix	trans	-73.8	-47.4	174.3	178.5	62.6	22.4	0	0	110.5	I323 R324 D325 I329 R330 E331	I323-Q327 WeakPolarHBondContact O-CB 3.35Å; I323-Q327 PolarHBondContact O-N 3.07Å; R324-Q327 WeakPolarHBondContact O-CB 3.24Å; R324-Q327 PolarHBondContact O-N 2.69Å; D325-Q327 VanDerWaalsContact C-N 3.29Å; D325-Q327 PolarHBondContact O-N 3.3Å; Q327-I329 VanDerWaalsContact C-N 3.28Å; Q327-I329 PolarHBondContact O-N 3.48Å; Q327-R330 WeakPolarHBondContact O-CA 3.27Å; Q327-R330 WeakPolarHBondContact O-CB 3.23Å; Q327-R330 PolarHBondContact O-N 2.65Å; Q327-E331 VanDerWaalsContact CG-OE1 3.32Å; Q327-E331 WeakPolarHBondContact CG-OE1 3.38Å; Q327-E331 PolarHBondContact NE2-OE1 2.92Å; Q327-E331 WeakPolarHBondContact O-CG 3.37Å; Q327-E331 PolarHBondContact O-N 3.29Å
328	V	93.2	Very high	91.1	Very high	80 Å²	80	93.9 Å²	93.9	49%	0.485	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-35.5	176.1	176.8	0	0	0	0	111.5	R324 D325 R330 E331 T332	R324-V328 PolarHBondContact O-N 3.36Å; D325-V328 PolarHBondContact O-N 3.18Å; V328-R330 VanDerWaalsContact C-N 3.32Å; V328-R330 PolarHBondContact O-N 3.47Å; V328-E331 PolarHBondContact O-N 3.25Å; V328-T332 HydrophobicContact CG1-CG2 4.32Å; V328-T332 WeakPolarHBondContact O-CB 3.16Å; V328-T332 WeakPolarHBondContact O-CG2 3.45Å; V328-T332 PolarHBondContact O-N 2.64Å; V328-T332 PolarHBondContact O-OG1 3.38Å
329	I	91.3	Very high	91	Very high	107 Å²	107	93.5 Å²	93.5	55%	0.549	48%	0.475	S	S	.	.	H	α-helix	trans	-67.7	-29.7	173.5	-69.7	164.8	0	0	0	112.2	D325 Q327 K333	D325-I329 WeakPolarHBondContact O-CB 3.22Å; D325-I329 WeakPolarHBondContact O-CD1 3.49Å; D325-I329 VanDerWaalsContact O-CG1 3.26Å; D325-I329 WeakPolarHBondContact O-CG1 3.32Å; D325-I329 PolarHBondContact O-N 2.94Å; Q327-I329 VanDerWaalsContact C-N 3.28Å; Q327-I329 PolarHBondContact O-N 3.48Å; I329-K333 WeakPolarHBondContact O-CB 3.29Å; I329-K333 WeakPolarHBondContact O-CG 3.45Å; I329-K333 PolarHBondContact O-N 2.66Å
330	R	90.6	Very high	90.9	Very high	115 Å²	115	95 Å²	95	43%	0.434	48%	0.48	S	S	.	.	H	α-helix	trans	-72.1	-52.9	170.4	-82.9	-171.1	-65.5	-85.3	0.3	111.2	C326 Q327 V328 T332 K333 E334	C326-R330 PolarHBondContact O-N 3.42Å; Q327-R330 WeakPolarHBondContact O-CA 3.27Å; Q327-R330 WeakPolarHBondContact O-CB 3.23Å; Q327-R330 PolarHBondContact O-N 2.65Å; V328-R330 VanDerWaalsContact C-N 3.32Å; V328-R330 PolarHBondContact O-N 3.47Å; R330-T332 PolarHBondContact O-N 3.32Å; R330-K333 CarbonylContact O-C 3.53Å; R330-K333 WeakPolarHBondContact O-CA 3.2Å; R330-K333 WeakPolarHBondContact O-CB 3.38Å; R330-K333 PolarHBondContact O-N 3.09Å; R330-E334 WeakPolarHBondContact O-CG 3.48Å; R330-E334 PolarHBondContact O-N 3.47Å
331	E	91.3	Very high	90.8	Very high	82 Å²	82	95.8 Å²	95.8	38%	0.383	48%	0.482	S	S	.	.	H	α-helix	trans	-53.7	-51.7	-178.7	-70.2	162.8	172.8	0	0	110.9	Q327 V328 K333 E334 D335	Q327-E331 VanDerWaalsContact CG-OE1 3.32Å; Q327-E331 WeakPolarHBondContact CG-OE1 3.38Å; Q327-E331 PolarHBondContact NE2-OE1 2.92Å; Q327-E331 WeakPolarHBondContact O-CG 3.37Å; Q327-E331 PolarHBondContact O-N 3.29Å; V328-E331 PolarHBondContact O-N 3.25Å; E331-K333 PolarHBondContact O-N 2.81Å; E331-K333 VanDerWaalsContact O-N 3.12Å; E331-E334 PolarHBondContact O-N 3.2Å; E331-E334 VanDerWaalsContact O-N 3.12Å; E331-D335 PolarHBondContact O-N 2.78Å
332	T	89.7	Confident	91	Very high	64 Å²	64	98.7 Å²	98.7	39%	0.393	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-15.4	177.1	54.6	0	0	0	0	115	V328 R330 Q336	V328-T332 HydrophobicContact CG1-CG2 4.32Å; V328-T332 WeakPolarHBondContact O-CB 3.16Å; V328-T332 WeakPolarHBondContact O-CG2 3.45Å; V328-T332 PolarHBondContact O-N 2.64Å; V328-T332 PolarHBondContact O-OG1 3.38Å; R330-T332 PolarHBondContact O-N 3.32Å; T332-Q336 VanDerWaalsContact O-CG 3.23Å; T332-Q336 WeakPolarHBondContact O-CG 3.4Å
333	K	92	Very high	90.8	Very high	115 Å²	115	98.1 Å²	98.1	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-92.1	-34.4	171.5	-73.7	-73	159.8	-160.8	0	112.4	I329 R330 E331 Q336 I337	I329-K333 WeakPolarHBondContact O-CB 3.29Å; I329-K333 WeakPolarHBondContact O-CG 3.45Å; I329-K333 PolarHBondContact O-N 2.66Å; R330-K333 CarbonylContact O-C 3.53Å; R330-K333 WeakPolarHBondContact O-CA 3.2Å; R330-K333 WeakPolarHBondContact O-CB 3.38Å; R330-K333 PolarHBondContact O-N 3.09Å; E331-K333 PolarHBondContact O-N 2.81Å; E331-K333 VanDerWaalsContact O-N 3.12Å; K333-Q336 PolarHBondContact O-N 3.47Å; K333-I337 WeakPolarHBondContact O-CB 3.2Å; K333-I337 WeakPolarHBondContact O-CD1 3.3Å; K333-I337 VanDerWaalsContact O-CG1 3.23Å; K333-I337 WeakPolarHBondContact O-CG1 3.38Å; K333-I337 PolarHBondContact O-N 3.12Å
334	E	90.9	Very high	90.5	Very high	113 Å²	113	97.2 Å²	97.2	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-66.6	-40.9	173.2	-72.2	166	-157.4	0	0	110.5	R330 E331 I337 A338	R330-E334 WeakPolarHBondContact O-CG 3.48Å; R330-E334 PolarHBondContact O-N 3.47Å; E331-E334 PolarHBondContact O-N 3.2Å; E331-E334 VanDerWaalsContact O-N 3.12Å; E334-I337 PolarHBondContact O-N 2.79Å; E334-A338 WeakPolarHBondContact O-CB 3.21Å; E334-A338 PolarHBondContact O-N 3.21Å
335	D	92.9	Very high	90.5	Very high	109 Å²	109	96.6 Å²	96.6	58%	0.583	49%	0.49	S	S	*	.	H	α-helix	trans	-59.3	-47.7	170.9	-72.3	-29.9	0	0	0	112	E331 I337 A338 E339	E331-D335 PolarHBondContact O-N 2.78Å; D335-I337 VanDerWaalsContact C-N 3.3Å; D335-I337 PolarHBondContact O-N 2.75Å; D335-A338 PolarHBondContact O-N 3.43Å; D335-A338 VanDerWaalsContact O-N 3.13Å; D335-E339 PolarHBondContact O-N 2.88Å
336	Q	90.4	Very high	90.4	Very high	96 Å²	96	97.7 Å²	97.7	45%	0.449	49%	0.493	S	S	.	.	H	α-helix	trans	-63	-35.3	177.2	-76.2	174.7	0.9	0	0	112.4	T332 K333 L340	T332-Q336 VanDerWaalsContact O-CG 3.23Å; T332-Q336 WeakPolarHBondContact O-CG 3.4Å; K333-Q336 PolarHBondContact O-N 3.47Å; Q336-L340 WeakPolarHBondContact O-CB 3.29Å; Q336-L340 VanDerWaalsContact O-CG 3.28Å; Q336-L340 WeakPolarHBondContact O-CG 3.4Å; Q336-L340 PolarHBondContact O-N 2.88Å; Q336-L340 VanDerWaalsContact O-N 3.11Å
337	I	91.1	Very high	90.4	Very high	93 Å²	93	98.1 Å²	98.1	48%	0.477	50%	0.496	S	S	.	.	H	α-helix	trans	-70.1	-37.8	173.9	-71	163.6	0	0	0	110.9	K333 E334 D335 K341	K333-I337 WeakPolarHBondContact O-CB 3.2Å; K333-I337 WeakPolarHBondContact O-CD1 3.3Å; K333-I337 VanDerWaalsContact O-CG1 3.23Å; K333-I337 WeakPolarHBondContact O-CG1 3.38Å; K333-I337 PolarHBondContact O-N 3.12Å; E334-I337 PolarHBondContact O-N 2.79Å; D335-I337 VanDerWaalsContact C-N 3.3Å; D335-I337 PolarHBondContact O-N 2.75Å; I337-K341 HydrophobicContact CG2-CD 4.25Å; I337-K341 WeakPolarHBondContact O-CB 3.18Å; I337-K341 VanDerWaalsContact O-CG 3.27Å; I337-K341 WeakPolarHBondContact O-CG 3.32Å; I337-K341 PolarHBondContact O-N 3.39Å
338	A	90	Very high	90.1	Very high	55 Å²	55	99 Å²	99	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-67.6	-41.1	177.3	0	0	0	0	0	112.3	E334 D335 K341 K342	E334-A338 WeakPolarHBondContact O-CB 3.21Å; E334-A338 PolarHBondContact O-N 3.21Å; D335-A338 PolarHBondContact O-N 3.43Å; D335-A338 VanDerWaalsContact O-N 3.13Å; A338-K341 PolarHBondContact O-N 3.12Å; A338-K342 WeakPolarHBondContact O-CB 3.27Å; A338-K342 PolarHBondContact O-N 2.9Å
339	E	89.2	Confident	90	Very high	134 Å²	134	101.1 Å²	101.1	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-66.9	-44.2	176.1	-174	163.9	-129	0	0	112	D335 K341 K342 I343	D335-E339 PolarHBondContact O-N 2.88Å; E339-K341 PolarHBondContact O-N 3.47Å; E339-K342 PolarHBondContact O-N 3.35Å; E339-I343 HydrophobicContact CG-CD1 4.14Å; E339-I343 WeakPolarHBondContact O-CG1 3.35Å; E339-I343 PolarHBondContact O-N 3.38Å
340	L	89.9	Confident	89.8	Confident	114 Å²	114	99 Å²	99	60%	0.597	51%	0.506	S	S	*	.	H	α-helix	trans	-61.7	-42.9	174.1	-73.8	171.5	0	0	0	112.3	Q336 I343 C344	Q336-L340 WeakPolarHBondContact O-CB 3.29Å; Q336-L340 VanDerWaalsContact O-CG 3.28Å; Q336-L340 WeakPolarHBondContact O-CG 3.4Å; Q336-L340 PolarHBondContact O-N 2.88Å; Q336-L340 VanDerWaalsContact O-N 3.11Å; L340-I343 PolarHBondContact O-N 3.08Å; L340-C344 PolarHBondContact O-N 2.87Å; L340-C344 PolarHBondContact O-SG 2.71Å; L340-C344 VanDerWaalsContact O-SG 3.38Å
341	K	90.8	Very high	89.8	Confident	123 Å²	123	97.9 Å²	97.9	54%	0.535	51%	0.508	S	S	.	.	H	α-helix	trans	-57.8	-49.3	173.6	-81.4	177.2	177.8	-175.9	0	111.6	I337 A338 E339 I343 C344 E345	I337-K341 HydrophobicContact CG2-CD 4.25Å; I337-K341 WeakPolarHBondContact O-CB 3.18Å; I337-K341 VanDerWaalsContact O-CG 3.27Å; I337-K341 WeakPolarHBondContact O-CG 3.32Å; I337-K341 PolarHBondContact O-N 3.39Å; A338-K341 PolarHBondContact O-N 3.12Å; E339-K341 PolarHBondContact O-N 3.47Å; K341-I343 VanDerWaalsContact C-N 3.31Å; K341-I343 PolarHBondContact O-N 2.75Å; K341-C344 PolarHBondContact O-N 3.31Å; K341-C344 VanDerWaalsContact O-N 3.15Å; K341-E345 WeakPolarHBondContact O-CB 3.48Å; K341-E345 VanDerWaalsContact O-CG 3.25Å; K341-E345 WeakPolarHBondContact O-CG 3.4Å; K341-E345 PolarHBondContact O-N 3.18Å
342	K	92.8	Very high	89.7	Confident	119 Å²	119	97.8 Å²	97.8	52%	0.517	51%	0.51	S	S	.	.	H	α-helix	trans	-58.2	-41.3	178.6	-178.2	-173.4	172.1	-166.2	0	112.2	A338 E339 E345 Q346	A338-K342 WeakPolarHBondContact O-CB 3.27Å; A338-K342 PolarHBondContact O-N 2.9Å; E339-K342 PolarHBondContact O-N 3.35Å; K342-E345 PolarHBondContact O-N 2.66Å; K342-Q346 WeakPolarHBondContact O-CB 3.5Å; K342-Q346 VanDerWaalsContact O-CG 3.23Å; K342-Q346 WeakPolarHBondContact O-CG 3.25Å; K342-Q346 PolarHBondContact O-N 3.25Å
343	I	88.6	Confident	89.8	Confident	96 Å²	96	98.7 Å²	98.7	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-43.6	176.8	-67.6	165.4	0	0	0	110.8	E339 L340 K341 Q346 S347	E339-I343 HydrophobicContact CG-CD1 4.14Å; E339-I343 WeakPolarHBondContact O-CG1 3.35Å; E339-I343 PolarHBondContact O-N 3.38Å; L340-I343 PolarHBondContact O-N 3.08Å; K341-I343 VanDerWaalsContact C-N 3.31Å; K341-I343 PolarHBondContact O-N 2.75Å; I343-Q346 PolarHBondContact O-N 2.78Å; I343-S347 WeakPolarHBondContact O-CB 3.47Å; I343-S347 PolarHBondContact O-N 3.45Å
344	C	86.1	Confident	89.8	Confident	82 Å²	82	96.6 Å²	96.6	55%	0.554	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-44.8	174	-69.2	0	0	0	0	112.3	L340 K341 S347 T348	L340-C344 PolarHBondContact O-N 2.87Å; L340-C344 PolarHBondContact O-SG 2.71Å; L340-C344 VanDerWaalsContact O-SG 3.38Å; K341-C344 PolarHBondContact O-N 3.31Å; K341-C344 VanDerWaalsContact O-N 3.15Å; C344-S347 PolarHBondContact O-N 2.92Å; C344-T348 WeakPolarHBondContact O-CG2 3.25Å; C344-T348 PolarHBondContact O-N 2.81Å; C344-T348 PolarHBondContact O-OG1 2.75Å
345	E	90.3	Very high	89.8	Confident	116 Å²	116	97 Å²	97	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-59	-49.5	177	-74.5	161.1	-165.7	0	0	110.6	K341 K342 S347 T348 E349	K341-E345 WeakPolarHBondContact O-CB 3.48Å; K341-E345 VanDerWaalsContact O-CG 3.25Å; K341-E345 WeakPolarHBondContact O-CG 3.4Å; K341-E345 PolarHBondContact O-N 3.18Å; K342-E345 PolarHBondContact O-N 2.66Å; E345-S347 VanDerWaalsContact C-N 3.32Å; E345-S347 PolarHBondContact O-N 2.69Å; E345-T348 WeakPolarHBondContact CA-OG1 3.46Å; E345-T348 PolarHBondContact O-N 3.3Å; E345-T348 VanDerWaalsContact O-N 3.14Å; E345-T348 PolarHBondContact O-OG1 2.81Å; E345-E349 WeakPolarHBondContact O-CB 3.41Å; E345-E349 PolarHBondContact O-N 3.45Å
346	Q	86.9	Confident	89.7	Confident	103 Å²	103	96.2 Å²	96.2	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-37.7	175.7	-73.2	179.3	-43.3	0	0	112.8	K342 I343 E349 S350	K342-Q346 WeakPolarHBondContact O-CB 3.5Å; K342-Q346 VanDerWaalsContact O-CG 3.23Å; K342-Q346 WeakPolarHBondContact O-CG 3.25Å; K342-Q346 PolarHBondContact O-N 3.25Å; I343-Q346 PolarHBondContact O-N 2.78Å; Q346-E349 PolarHBondContact O-N 3.47Å; Q346-S350 PolarHBondContact O-N 3.06Å; Q346-S350 PolarHBondContact O-OG 2.88Å
347	S	89	Confident	89.8	Confident	72 Å²	72	97.3 Å²	97.3	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-69.5	-34.2	174.7	-176.5	0	0	0	0	112.9	I343 C344 E345 S350 L351	I343-S347 WeakPolarHBondContact O-CB 3.47Å; I343-S347 PolarHBondContact O-N 3.45Å; C344-S347 PolarHBondContact O-N 2.92Å; E345-S347 VanDerWaalsContact C-N 3.32Å; E345-S347 PolarHBondContact O-N 2.69Å; S347-S350 PolarHBondContact O-OG 3.46Å; S347-S350 VanDerWaalsContact O-OG 3.12Å; S347-L351 WeakPolarHBondContact O-CB 3.43Å; S347-L351 PolarHBondContact O-N 2.86Å
348	T	86.3	Confident	89.9	Confident	90 Å²	90	98.2 Å²	98.2	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-74.5	-32.7	173	53.5	0	0	0	0	112.1	C344 E345 N352	C344-T348 WeakPolarHBondContact O-CG2 3.25Å; C344-T348 PolarHBondContact O-N 2.81Å; C344-T348 PolarHBondContact O-OG1 2.75Å; E345-T348 WeakPolarHBondContact CA-OG1 3.46Å; E345-T348 PolarHBondContact O-N 3.3Å; E345-T348 VanDerWaalsContact O-N 3.14Å; E345-T348 PolarHBondContact O-OG1 2.81Å; T348-N352 VanDerWaalsContact O-CB 3.22Å; T348-N352 WeakPolarHBondContact O-CB 3.22Å; T348-N352 PolarHBondContact O-N 2.8Å
349	E	90	Very high	90	Very high	125 Å²	125	100.9 Å²	100.9	58%	0.584	51%	0.506	S	S	*	.	H	α-helix	trans	-70.6	-43.3	177.2	-173.5	173.9	-150	0	0	111.3	E345 Q346 N352 N353	E345-E349 WeakPolarHBondContact O-CB 3.41Å; E345-E349 PolarHBondContact O-N 3.45Å; Q346-E349 PolarHBondContact O-N 3.47Å; E349-N352 PolarHBondContact O-N 3.37Å; E349-N353 WeakPolarHBondContact O-CB 3.43Å; E349-N353 VanDerWaalsContact O-CG 3.32Å; E349-N353 PolarHBondContact O-N 2.71Å; E349-N353 PolarHBondContact O-ND2 2.89Å
350	S	87.2	Confident	90.2	Very high	62 Å²	62	100.5 Å²	100.5	43%	0.434	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-47.8	173.4	61.3	0	0	0	0	111.8	Q346 S347 N352 N353 D354	Q346-S350 PolarHBondContact O-N 3.06Å; Q346-S350 PolarHBondContact O-OG 2.88Å; S347-S350 PolarHBondContact O-OG 3.46Å; S347-S350 VanDerWaalsContact O-OG 3.12Å; S350-N352 VanDerWaalsContact C-N 3.31Å; S350-N352 PolarHBondContact O-N 2.95Å; S350-N353 WeakPolarHBondContact O-CB 3.16Å; S350-N353 PolarHBondContact O-N 2.85Å; S350-D354 PolarHBondContact O-N 3.04Å
351	L	90.5	Very high	90.3	Very high	92 Å²	92	99 Å²	99	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-60.3	-39.9	177	-176	61.8	0	0	0	112.1	S347 D354 W355	S347-L351 WeakPolarHBondContact O-CB 3.43Å; S347-L351 PolarHBondContact O-N 2.86Å; L351-D354 PolarHBondContact O-N 2.62Å; L351-W355 PolarHBondContact O-N 3.36Å
352	N	90.1	Very high	90.4	Very high	80 Å²	80	95.2 Å²	95.2	43%	0.428	49%	0.489	S	S	.	.	H	α-helix	trans	-65.5	-44.9	175	-175	77.7	0	0	0	111.9	T348 E349 S350 D354 W355 E356	T348-N352 VanDerWaalsContact O-CB 3.22Å; T348-N352 WeakPolarHBondContact O-CB 3.22Å; T348-N352 PolarHBondContact O-N 2.8Å; E349-N352 PolarHBondContact O-N 3.37Å; S350-N352 VanDerWaalsContact C-N 3.31Å; S350-N352 PolarHBondContact O-N 2.95Å; N352-D354 VanDerWaalsContact C-N 3.27Å; N352-D354 PolarHBondContact O-N 3.09Å; N352-W355 PolarHBondContact O-N 2.92Å; N352-W355 VanDerWaalsContact O-N 3.13Å; N352-E356 PolarHBondContact ND2-OE1 3.08Å; N352-E356 PolarHBondContact O-N 2.73Å
353	N	91.6	Very high	90.3	Very high	83 Å²	83	92.7 Å²	92.7	44%	0.444	48%	0.483	S	S	.	.	H	α-helix	trans	-58.6	-38.4	175.4	-77	-56.7	0	0	0	112	E349 S350 K357	E349-N353 WeakPolarHBondContact O-CB 3.43Å; E349-N353 VanDerWaalsContact O-CG 3.32Å; E349-N353 PolarHBondContact O-N 2.71Å; E349-N353 PolarHBondContact O-ND2 2.89Å; S350-N353 WeakPolarHBondContact O-CB 3.16Å; S350-N353 PolarHBondContact O-N 2.85Å; N353-K357 WeakPolarHBondContact O-CB 3.35Å; N353-K357 PolarHBondContact O-N 3.11Å
354	D	90.9	Very high	90.4	Very high	72 Å²	72	90.8 Å²	90.8	39%	0.385	48%	0.482	S	S	.	.	H	α-helix	trans	-69.7	-34.7	175.3	-78.3	-35.1	0	0	0	113.1	S350 L351 N352 K358	S350-D354 PolarHBondContact O-N 3.04Å; L351-D354 PolarHBondContact O-N 2.62Å; N352-D354 VanDerWaalsContact C-N 3.27Å; N352-D354 PolarHBondContact O-N 3.09Å; D354-K358 WeakPolarHBondContact O-CB 3.41Å; D354-K358 WeakPolarHBondContact O-CD 3.5Å; D354-K358 VanDerWaalsContact O-CG 3.22Å; D354-K358 WeakPolarHBondContact O-CG 3.27Å; D354-K358 PolarHBondContact O-N 3.46Å
355	W	91.1	Very high	90.7	Very high	122 Å²	122	92.3 Å²	92.3	46%	0.462	48%	0.48	S	S	.	.	H	α-helix	trans	-71.2	-40	172.5	-73.9	120.1	0	0	0	112.6	L351 N352 K357 K358 L359	L351-W355 PolarHBondContact O-N 3.36Å; N352-W355 PolarHBondContact O-N 2.92Å; N352-W355 VanDerWaalsContact O-N 3.13Å; W355-K357 VanDerWaalsContact C-N 3.35Å; W355-K358 HydrophobicContact CE3-CD 3.87Å; W355-K358 HydrophobicContact CZ3-CD 3.99Å; W355-K358 PolarHBondContact O-N 3.5Å; W355-L359 VanDerWaalsContact O-CB 3.31Å; W355-L359 WeakPolarHBondContact O-CB 3.28Å; W355-L359 PolarHBondContact O-N 3.14Å
356	E	90.4	Very high	90.7	Very high	91 Å²	91	92.4 Å²	92.4	43%	0.425	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-40.6	173.1	-73.9	-176.4	-166.9	0	0	111.4	N352 L359 H360	N352-E356 PolarHBondContact ND2-OE1 3.08Å; N352-E356 PolarHBondContact O-N 2.73Å; E356-L359 PolarHBondContact O-N 2.71Å; E356-H360 WeakPolarHBondContact O-CB 3.38Å; E356-H360 PolarHBondContact O-CD2 2.78Å; E356-H360 PolarHBondContact O-N 2.83Å
357	K	93.1	Very high	90.9	Very high	119 Å²	119	94 Å²	94	52%	0.517	49%	0.49	S	S	.	.	H	α-helix	trans	-63.6	-45.1	173.6	-177.8	-178.1	171.6	-165	0	112.1	N353 W355 L359 H360 N361	N353-K357 WeakPolarHBondContact O-CB 3.35Å; N353-K357 PolarHBondContact O-N 3.11Å; W355-K357 VanDerWaalsContact C-N 3.35Å; K357-L359 VanDerWaalsContact C-N 3.34Å; K357-L359 PolarHBondContact O-N 3.43Å; K357-H360 PolarHBondContact O-N 2.73Å; K357-N361 WeakPolarHBondContact O-CB 3.32Å; K357-N361 PolarHBondContact O-N 3.26Å; K357-N361 PolarHBondContact O-OD1 2.84Å
358	K	94.3	Very high	91.1	Very high	113 Å²	113	95.3 Å²	95.3	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-41.1	174	-76	163.5	-176.1	162.8	0	111.9	D354 W355 N361 A362	D354-K358 WeakPolarHBondContact O-CB 3.41Å; D354-K358 WeakPolarHBondContact O-CD 3.5Å; D354-K358 VanDerWaalsContact O-CG 3.22Å; D354-K358 WeakPolarHBondContact O-CG 3.27Å; D354-K358 PolarHBondContact O-N 3.46Å; W355-K358 HydrophobicContact CE3-CD 3.87Å; W355-K358 HydrophobicContact CZ3-CD 3.99Å; W355-K358 PolarHBondContact O-N 3.5Å; K358-N361 PolarHBondContact O-N 2.8Å; K358-A362 WeakPolarHBondContact O-CB 3.44Å; K358-A362 PolarHBondContact O-N 2.85Å
359	L	91.4	Very high	91.4	Very high	110 Å²	110	96.8 Å²	96.8	58%	0.576	49%	0.488	S	S	*	.	H	α-helix	trans	-64.9	-43.4	175.5	179.5	62.6	0	0	0	111.8	W355 E356 K357 A362 V363	W355-L359 VanDerWaalsContact O-CB 3.31Å; W355-L359 WeakPolarHBondContact O-CB 3.28Å; W355-L359 PolarHBondContact O-N 3.14Å; E356-L359 PolarHBondContact O-N 2.71Å; K357-L359 VanDerWaalsContact C-N 3.34Å; K357-L359 PolarHBondContact O-N 3.43Å; L359-A362 PolarHBondContact O-N 3.31Å; L359-V363 HydrophobicContact CD1-CG2 4.24Å; L359-V363 WeakPolarHBondContact O-CB 3.17Å; L359-V363 VanDerWaalsContact O-CG2 3.24Å; L359-V363 WeakPolarHBondContact O-CG2 3.24Å; L359-V363 PolarHBondContact O-N 2.88Å
360	H	92.8	Very high	91.4	Very high	126 Å²	126	97.6 Å²	97.6	58%	0.583	49%	0.49	S	S	*	.	H	α-helix	trans	-66.9	-38.3	177.1	-79.8	-51.3	0	0	0	112.9	E356 K357 A364	E356-H360 WeakPolarHBondContact O-CB 3.38Å; E356-H360 PolarHBondContact O-CD2 2.78Å; E356-H360 PolarHBondContact O-N 2.83Å; K357-H360 PolarHBondContact O-N 2.73Å; H360-A364 WeakPolarHBondContact O-CB 3.08Å; H360-A364 PolarHBondContact O-N 3.43Å
361	N	92.9	Very high	91.8	Very high	84 Å²	84	100.4 Å²	100.4	45%	0.449	50%	0.495	S	S	.	.	H	α-helix	trans	-61.7	-54.3	172	-76.5	16.9	0	0	0	110.8	K357 K358 V363 A364 E365	K357-N361 WeakPolarHBondContact O-CB 3.32Å; K357-N361 PolarHBondContact O-N 3.26Å; K357-N361 PolarHBondContact O-OD1 2.84Å; K358-N361 PolarHBondContact O-N 2.8Å; N361-V363 VanDerWaalsContact C-N 3.28Å; N361-V363 PolarHBondContact O-N 3.13Å; N361-A364 CarbonylContact O-C 3.5Å; N361-A364 WeakPolarHBondContact O-CA 3.22Å; N361-A364 WeakPolarHBondContact O-CB 3.4Å; N361-A364 PolarHBondContact O-N 2.79Å; N361-E365 WeakPolarHBondContact O-CB 3.38Å; N361-E365 WeakPolarHBondContact O-CG 3.4Å; N361-E365 PolarHBondContact O-N 3.37Å
362	A	91.2	Very high	91.8	Very high	43 Å²	43	98.6 Å²	98.6	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-60.1	-35.2	179.5	0	0	0	0	0	113	K358 L359 M366	K358-A362 WeakPolarHBondContact O-CB 3.44Å; K358-A362 PolarHBondContact O-N 2.85Å; L359-A362 PolarHBondContact O-N 3.31Å; A362-M366 WeakPolarHBondContact O-CB 3.28Å; A362-M366 WeakPolarHBondContact O-CG 3.18Å; A362-M366 PolarHBondContact O-N 3.35Å
363	V	91.9	Very high	92	Very high	66 Å²	66	99.9 Å²	99.9	40%	0.4	49%	0.492	S	S	.	.	H	α-helix	trans	-68.4	-41.8	173	168.2	0	0	0	0	111.4	L359 N361 M366 E367	L359-V363 HydrophobicContact CD1-CG2 4.24Å; L359-V363 WeakPolarHBondContact O-CB 3.17Å; L359-V363 VanDerWaalsContact O-CG2 3.24Å; L359-V363 WeakPolarHBondContact O-CG2 3.24Å; L359-V363 PolarHBondContact O-N 2.88Å; N361-V363 VanDerWaalsContact C-N 3.28Å; N361-V363 PolarHBondContact O-N 3.13Å; V363-M366 PolarHBondContact O-N 3.46Å; V363-E367 HydrophobicContact CG1-CG 4.49Å; V363-E367 WeakPolarHBondContact O-CB 3.24Å; V363-E367 WeakPolarHBondContact O-CG 3.15Å; V363-E367 PolarHBondContact O-N 3.4Å
364	A	90.8	Very high	92	Very high	56 Å²	56	101.8 Å²	101.8	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-38.5	176.8	0	0	0	0	0	112.3	H360 N361 E367 Q368	H360-A364 WeakPolarHBondContact O-CB 3.08Å; H360-A364 PolarHBondContact O-N 3.43Å; N361-A364 CarbonylContact O-C 3.5Å; N361-A364 WeakPolarHBondContact O-CA 3.22Å; N361-A364 WeakPolarHBondContact O-CB 3.4Å; N361-A364 PolarHBondContact O-N 2.79Å; A364-E367 PolarHBondContact O-N 2.84Å; A364-Q368 VanDerWaalsContact O-CB 3.28Å; A364-Q368 WeakPolarHBondContact O-CB 3.38Å; A364-Q368 PolarHBondContact O-N 3.47Å
365	E	92	Very high	92.2	Very high	114 Å²	114	102.9 Å²	102.9	53%	0.533	50%	0.499	S	S	.	.	H	α-helix	trans	-61.2	-50.5	172.6	-72.2	152.8	-157.5	0	0	110.5	N361 E367 Q368 E369	N361-E365 WeakPolarHBondContact O-CB 3.38Å; N361-E365 WeakPolarHBondContact O-CG 3.4Å; N361-E365 PolarHBondContact O-N 3.37Å; E365-E367 VanDerWaalsContact C-N 3.34Å; E365-E367 PolarHBondContact O-N 2.81Å; E365-Q368 PolarHBondContact O-N 2.89Å; E365-E369 WeakPolarHBondContact O-CG 3.33Å; E365-E369 PolarHBondContact O-N 2.82Å
366	M	90.6	Very high	92.3	Very high	118 Å²	118	103.4 Å²	103.4	58%	0.581	50%	0.501	S	S	*	.	H	α-helix	trans	-62.9	-34.3	175.4	-71.9	-64.4	-40.8	0	0	113.6	A362 V363 K370	A362-M366 WeakPolarHBondContact O-CB 3.28Å; A362-M366 WeakPolarHBondContact O-CG 3.18Å; A362-M366 PolarHBondContact O-N 3.35Å; V363-M366 PolarHBondContact O-N 3.46Å; M366-K370 VanDerWaalsContact O-CB 3.23Å; M366-K370 WeakPolarHBondContact O-CB 3.35Å; M366-K370 PolarHBondContact O-N 3.3Å; M366-K370 VanDerWaalsContact O-N 3.12Å
367	E	91.4	Very high	92.5	Very high	136 Å²	136	104.9 Å²	104.9	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-71.6	-36.3	174.3	-76.6	-172.5	161.5	0	0	111.9	V363 A364 E365 F371	V363-E367 HydrophobicContact CG1-CG 4.49Å; V363-E367 WeakPolarHBondContact O-CB 3.24Å; V363-E367 WeakPolarHBondContact O-CG 3.15Å; V363-E367 PolarHBondContact O-N 3.4Å; A364-E367 PolarHBondContact O-N 2.84Å; E365-E367 VanDerWaalsContact C-N 3.34Å; E365-E367 PolarHBondContact O-N 2.81Å; E367-F371 WeakPolarHBondContact O-CB 3.36Å; E367-F371 PolarHBondContact O-N 3.5Å
368	Q	91.7	Very high	92.4	Very high	100 Å²	100	102.8 Å²	102.8	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-69	-48.3	174.3	-177.1	61.7	42.9	0	0	111.5	A364 E365 K370 F371 D372	A364-Q368 VanDerWaalsContact O-CB 3.28Å; A364-Q368 WeakPolarHBondContact O-CB 3.38Å; A364-Q368 PolarHBondContact O-N 3.47Å; E365-Q368 PolarHBondContact O-N 2.89Å; Q368-K370 VanDerWaalsContact C-N 3.28Å; Q368-K370 PolarHBondContact O-N 3.39Å; Q368-F371 CarbonylContact O-C 3.59Å; Q368-F371 WeakPolarHBondContact O-CA 3.4Å; Q368-F371 WeakPolarHBondContact O-CB 3.47Å; Q368-F371 PolarHBondContact O-N 3.1Å; Q368-D372 VanDerWaalsContact NE2-CG 3.28Å; Q368-D372 PolarHBondContact NE2-OD1 2.84Å; Q368-D372 PolarHBondContact NE2-OD2 2.71Å; Q368-D372 PolarHBondContact O-N 3.33Å
369	E	93.3	Very high	92.4	Very high	120 Å²	120	101 Å²	101	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-56.1	-43.3	174.4	-77	-170.6	172.3	0	0	111.8	E365 D372 L373	E365-E369 WeakPolarHBondContact O-CG 3.33Å; E365-E369 PolarHBondContact O-N 2.82Å; E369-D372 PolarHBondContact O-N 3.26Å; E369-L373 VanDerWaalsContact O-CB 3.25Å; E369-L373 WeakPolarHBondContact O-CB 3.15Å; E369-L373 PolarHBondContact O-N 3.16Å
370	K	90.8	Very high	92.6	Very high	143 Å²	143	100 Å²	100	62%	0.622	49%	0.494	S	S	*	.	H	α-helix	trans	-62.5	-42.3	175.5	178.8	-173.2	171.9	-169	0	111.6	M366 Q368 Q374	M366-K370 VanDerWaalsContact O-CB 3.23Å; M366-K370 WeakPolarHBondContact O-CB 3.35Å; M366-K370 PolarHBondContact O-N 3.3Å; M366-K370 VanDerWaalsContact O-N 3.12Å; Q368-K370 VanDerWaalsContact C-N 3.28Å; Q368-K370 PolarHBondContact O-N 3.39Å; K370-Q374 WeakPolarHBondContact O-CB 3.37Å; K370-Q374 PolarHBondContact O-N 2.83Å
371	F	94.2	Very high	92.7	Very high	121 Å²	121	98 Å²	98	53%	0.531	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-47.7	175.1	177	-95.3	0	0	0	111.2	E367 Q368 L373 Q374 K375	E367-F371 WeakPolarHBondContact O-CB 3.36Å; E367-F371 PolarHBondContact O-N 3.5Å; Q368-F371 CarbonylContact O-C 3.59Å; Q368-F371 WeakPolarHBondContact O-CA 3.4Å; Q368-F371 WeakPolarHBondContact O-CB 3.47Å; Q368-F371 PolarHBondContact O-N 3.1Å; F371-L373 VanDerWaalsContact C-N 3.32Å; F371-L373 PolarHBondContact O-N 2.91Å; F371-Q374 PolarHBondContact O-N 2.78Å; F371-K375 HydrophobicContact CE1-CD 4.38Å; F371-K375 VanDerWaalsContact O-CB 3.24Å; F371-K375 WeakPolarHBondContact O-CB 3.05Å; F371-K375 PolarHBondContact O-N 2.77Å
372	D	92.3	Very high	92.6	Very high	53 Å²	53	98.9 Å²	98.9	28%	0.283	49%	0.488	S	S	.	.	H	α-helix	trans	-70.2	-26.4	-179.2	-70.7	-35.1	0	0	0	113.1	Q368 E369 R376	Q368-D372 VanDerWaalsContact NE2-CG 3.28Å; Q368-D372 PolarHBondContact NE2-OD1 2.84Å; Q368-D372 PolarHBondContact NE2-OD2 2.71Å; Q368-D372 PolarHBondContact O-N 3.33Å; E369-D372 PolarHBondContact O-N 3.26Å; D372-R376 WeakPolarHBondContact O-CB 3.33Å; D372-R376 WeakPolarHBondContact O-CG 3.13Å; D372-R376 PolarHBondContact O-N 2.86Å; D372-R376 PolarHBondContact O-NE 2.86Å
373	L	94.1	Very high	92.8	Very high	107 Å²	107	102.8 Å²	102.8	56%	0.56	50%	0.499	S	S	*	.	H	α-helix	trans	-73.7	-42.5	169.5	-174.8	64.6	0	0	0	111.6	E369 F371 K375 H377	E369-L373 VanDerWaalsContact O-CB 3.25Å; E369-L373 WeakPolarHBondContact O-CB 3.15Å; E369-L373 PolarHBondContact O-N 3.16Å; F371-L373 VanDerWaalsContact C-N 3.32Å; F371-L373 PolarHBondContact O-N 2.91Å; L373-K375 VanDerWaalsContact C-N 3.31Å; L373-K375 PolarHBondContact O-N 3.27Å; L373-H377 WeakPolarHBondContact O-CB 3.45Å; L373-H377 PolarHBondContact O-N 3.32Å
374	Q	91.5	Very high	92.9	Very high	123 Å²	123	105 Å²	105	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-64.8	-37	174.2	-179.2	176.4	-16.6	0	0	111.6	K370 F371 T378	K370-Q374 WeakPolarHBondContact O-CB 3.37Å; K370-Q374 PolarHBondContact O-N 2.83Å; F371-Q374 PolarHBondContact O-N 2.78Å; Q374-T378 PolarHBondContact O-N 2.9Å; Q374-T378 PolarHBondContact O-OG1 3.49Å
375	K	94.6	Very high	93	Very high	95 Å²	95	107.7 Å²	107.7	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-56.2	174.6	-172.6	-166.3	150.7	-169.5	0	110.3	F371 L373 H377 T378 E379	F371-K375 HydrophobicContact CE1-CD 4.38Å; F371-K375 VanDerWaalsContact O-CB 3.24Å; F371-K375 WeakPolarHBondContact O-CB 3.05Å; F371-K375 PolarHBondContact O-N 2.77Å; L373-K375 VanDerWaalsContact C-N 3.31Å; L373-K375 PolarHBondContact O-N 3.27Å; K375-H377 VanDerWaalsContact C-N 3.29Å; K375-H377 PolarHBondContact O-N 2.86Å; K375-T378 CarbonylContact O-C 3.5Å; K375-T378 WeakPolarHBondContact O-CA 3.15Å; K375-T378 VanDerWaalsContact O-CB 3.32Å; K375-T378 WeakPolarHBondContact O-CB 3.46Å; K375-T378 PolarHBondContact O-N 3.48Å; K375-E379 VanDerWaalsContact CE-CD 3.4Å; K375-E379 WeakPolarHBondContact CE-OE1 3.3Å; K375-E379 WeakPolarHBondContact CE-OE2 3.17Å; K375-E379 IonicContact NZ-OE1 2.87Å; K375-E379 WeakPolarHBondContact O-CG 3.45Å; K375-E379 PolarHBondContact O-N 2.86Å
376	R	93.8	Very high	93.2	Very high	133 Å²	133	107 Å²	107	50%	0.502	51%	0.511	S	S	.	.	H	α-helix	trans	-55.8	-39.7	174.5	-78.2	174.8	-71.7	167	-5.3	113	D372 T378 E379 N380	D372-R376 WeakPolarHBondContact O-CB 3.33Å; D372-R376 WeakPolarHBondContact O-CG 3.13Å; D372-R376 PolarHBondContact O-N 2.86Å; D372-R376 PolarHBondContact O-NE 2.86Å; R376-T378 VanDerWaalsContact C-N 3.28Å; R376-T378 PolarHBondContact O-N 3.44Å; R376-E379 WeakPolarHBondContact CA-OE2 2.96Å; R376-E379 PolarHBondContact N-OE2 3.07Å; R376-E379 PolarHBondContact O-N 2.83Å; R376-N380 WeakPolarHBondContact O-CB 3.31Å; R376-N380 PolarHBondContact O-N 3.43Å; R376-N380 PolarHBondContact O-OD1 2.83Å
377	H	93.3	Very high	93.4	Very high	122 Å²	122	105 Å²	105	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-64.5	-32.8	174.7	-178	-87.1	0	0	0	112.8	L373 K375 I381	L373-H377 WeakPolarHBondContact O-CB 3.45Å; L373-H377 PolarHBondContact O-N 3.32Å; K375-H377 VanDerWaalsContact C-N 3.29Å; K375-H377 PolarHBondContact O-N 2.86Å; H377-I381 WeakPolarHBondContact CE1-CD1 3.25Å; H377-I381 WeakPolarHBondContact O-CG1 3.45Å; H377-I381 PolarHBondContact O-N 2.78Å
378	T	91.4	Very high	93.6	Very high	76 Å²	76	101.8 Å²	101.8	47%	0.466	49%	0.492	S	S	.	.	H	α-helix	trans	-73.4	-42.4	174.3	-52.2	0	0	0	0	111	Q374 K375 R376 I381 Q382	Q374-T378 PolarHBondContact O-N 2.9Å; Q374-T378 PolarHBondContact O-OG1 3.49Å; K375-T378 CarbonylContact O-C 3.5Å; K375-T378 WeakPolarHBondContact O-CA 3.15Å; K375-T378 VanDerWaalsContact O-CB 3.32Å; K375-T378 WeakPolarHBondContact O-CB 3.46Å; K375-T378 PolarHBondContact O-N 3.48Å; R376-T378 VanDerWaalsContact C-N 3.28Å; R376-T378 PolarHBondContact O-N 3.44Å; T378-I381 PolarHBondContact O-N 3.4Å; T378-Q382 WeakPolarHBondContact O-CB 3.39Å; T378-Q382 PolarHBondContact O-N 3.34Å
379	E	93.9	Very high	93.7	Very high	75 Å²	75	101.3 Å²	101.3	35%	0.35	49%	0.493	S	S	.	.	H	α-helix	trans	-62	-49.9	176.4	-69	166.3	143.3	0	0	110.8	K375 R376 I381 Q382 E383	K375-E379 VanDerWaalsContact CE-CD 3.4Å; K375-E379 WeakPolarHBondContact CE-OE1 3.3Å; K375-E379 WeakPolarHBondContact CE-OE2 3.17Å; K375-E379 IonicContact NZ-OE1 2.87Å; K375-E379 WeakPolarHBondContact O-CG 3.45Å; K375-E379 PolarHBondContact O-N 2.86Å; R376-E379 WeakPolarHBondContact CA-OE2 2.96Å; R376-E379 PolarHBondContact N-OE2 3.07Å; R376-E379 PolarHBondContact O-N 2.83Å; E379-I381 VanDerWaalsContact C-N 3.3Å; E379-I381 PolarHBondContact O-N 3.5Å; E379-Q382 CarbonylContact O-C 3.57Å; E379-Q382 WeakPolarHBondContact O-CA 3.34Å; E379-Q382 WeakPolarHBondContact O-CB 3.46Å; E379-Q382 PolarHBondContact O-N 2.91Å; E379-E383 WeakPolarHBondContact O-CG 3.38Å; E379-E383 PolarHBondContact O-N 2.84Å
380	N	95.8	Very high	93.8	Very high	90 Å²	90	100.3 Å²	100.3	48%	0.481	50%	0.495	S	S	.	.	H	α-helix	trans	-58.7	-37.3	175.3	-68.3	19.8	0	0	0	113	R376 L384	R376-N380 WeakPolarHBondContact O-CB 3.31Å; R376-N380 PolarHBondContact O-N 3.43Å; R376-N380 PolarHBondContact O-OD1 2.83Å; N380-L384 WeakPolarHBondContact O-CB 3.28Å; N380-L384 WeakPolarHBondContact O-CD1 3.24Å; N380-L384 VanDerWaalsContact O-CG 3.25Å; N380-L384 WeakPolarHBondContact O-CG 3.23Å; N380-L384 PolarHBondContact O-N 2.82Å; N380-L384 VanDerWaalsContact O-N 3.07Å
381	I	94.9	Very high	94.1	Very high	82 Å²	82	99.2 Å²	99.2	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-68.1	-40.4	174.6	-77.4	173.9	0	0	0	110.6	H377 T378 E379 L384 L385	H377-I381 WeakPolarHBondContact CE1-CD1 3.25Å; H377-I381 WeakPolarHBondContact O-CG1 3.45Å; H377-I381 PolarHBondContact O-N 2.78Å; T378-I381 PolarHBondContact O-N 3.4Å; E379-I381 VanDerWaalsContact C-N 3.3Å; E379-I381 PolarHBondContact O-N 3.5Å; I381-L384 PolarHBondContact O-N 2.81Å; I381-L385 HydrophobicContact CG2-CD1 3.97Å; I381-L385 WeakPolarHBondContact O-CB 3.48Å; I381-L385 VanDerWaalsContact O-CG 3.28Å; I381-L385 WeakPolarHBondContact O-CG 3.42Å; I381-L385 PolarHBondContact O-N 2.8Å
382	Q	91.9	Very high	94.1	Very high	104 Å²	104	97.3 Å²	97.3	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-65	-45.7	177.5	-179.1	167.2	-12.8	0	0	111.1	T378 E379 L384 L385 E386	T378-Q382 WeakPolarHBondContact O-CB 3.39Å; T378-Q382 PolarHBondContact O-N 3.34Å; E379-Q382 CarbonylContact O-C 3.57Å; E379-Q382 WeakPolarHBondContact O-CA 3.34Å; E379-Q382 WeakPolarHBondContact O-CB 3.46Å; E379-Q382 PolarHBondContact O-N 2.91Å; Q382-L384 PolarHBondContact O-N 2.84Å; Q382-L385 PolarHBondContact O-N 3.33Å; Q382-E386 HydrophobicContact CG-CG 4.34Å; Q382-E386 VanDerWaalsContact CG-OE1 3.22Å; Q382-E386 WeakPolarHBondContact CG-OE1 3.29Å; Q382-E386 PolarHBondContact NE2-OE1 3.32Å; Q382-E386 WeakPolarHBondContact O-CB 3.47Å; Q382-E386 VanDerWaalsContact O-CG 3.3Å; Q382-E386 WeakPolarHBondContact O-CG 3.17Å; Q382-E386 PolarHBondContact O-N 3.23Å
383	E	94.3	Very high	94.1	Very high	124 Å²	124	98.7 Å²	98.7	58%	0.579	49%	0.489	S	S	*	.	H	α-helix	trans	-58.2	-43.6	174	-71.5	177.6	177.2	0	0	112.3	E379 L385 E386 D387	E379-E383 WeakPolarHBondContact O-CG 3.38Å; E379-E383 PolarHBondContact O-N 2.84Å; E383-L385 PolarHBondContact O-N 3.27Å; E383-E386 PolarHBondContact O-N 2.85Å; E383-D387 WeakPolarHBondContact O-CB 3.49Å; E383-D387 PolarHBondContact O-N 3.06Å
384	L	94.9	Very high	94.2	Very high	113 Å²	113	99.7 Å²	99.7	59%	0.592	49%	0.489	S	S	*	.	H	α-helix	trans	-66.1	-35	176.7	-75.4	169.1	0	0	0	113.1	N380 I381 Q382 T388	N380-L384 WeakPolarHBondContact O-CB 3.28Å; N380-L384 WeakPolarHBondContact O-CD1 3.24Å; N380-L384 VanDerWaalsContact O-CG 3.25Å; N380-L384 WeakPolarHBondContact O-CG 3.23Å; N380-L384 PolarHBondContact O-N 2.82Å; N380-L384 VanDerWaalsContact O-N 3.07Å; I381-L384 PolarHBondContact O-N 2.81Å; Q382-L384 PolarHBondContact O-N 2.84Å; L384-T388 WeakPolarHBondContact O-CB 3.45Å; L384-T388 PolarHBondContact O-N 2.91Å; L384-T388 VanDerWaalsContact O-N 3.09Å; L384-T388 PolarHBondContact O-OG1 2.83Å
385	L	93.3	Very high	94.2	Very high	113 Å²	113	98.4 Å²	98.4	59%	0.592	48%	0.484	S	S	*	.	H	α-helix	trans	-70.1	-38.6	172.7	-72.7	169.7	0	0	0	111.2	I381 Q382 E383 T388 N389	I381-L385 HydrophobicContact CG2-CD1 3.97Å; I381-L385 WeakPolarHBondContact O-CB 3.48Å; I381-L385 VanDerWaalsContact O-CG 3.28Å; I381-L385 WeakPolarHBondContact O-CG 3.42Å; I381-L385 PolarHBondContact O-N 2.8Å; Q382-L385 PolarHBondContact O-N 3.33Å; E383-L385 PolarHBondContact O-N 3.27Å; L385-T388 PolarHBondContact O-N 3.5Å; L385-N389 VanDerWaalsContact O-CB 3.23Å; L385-N389 WeakPolarHBondContact O-CB 3.33Å; L385-N389 PolarHBondContact O-N 2.8Å
386	E	94.7	Very high	94.1	Very high	98 Å²	98	99.2 Å²	99.2	46%	0.458	49%	0.489	S	S	.	.	H	α-helix	trans	-73.2	-43	-178.9	-73.8	170	177.5	0	0	111.9	Q382 E383 N389 V390	Q382-E386 HydrophobicContact CG-CG 4.34Å; Q382-E386 VanDerWaalsContact CG-OE1 3.22Å; Q382-E386 WeakPolarHBondContact CG-OE1 3.29Å; Q382-E386 PolarHBondContact NE2-OE1 3.32Å; Q382-E386 WeakPolarHBondContact O-CB 3.47Å; Q382-E386 VanDerWaalsContact O-CG 3.3Å; Q382-E386 WeakPolarHBondContact O-CG 3.17Å; Q382-E386 PolarHBondContact O-N 3.23Å; E383-E386 PolarHBondContact O-N 2.85Å; E386-N389 PolarHBondContact O-N 3.47Å; E386-V390 WeakPolarHBondContact O-CB 3.31Å; E386-V390 VanDerWaalsContact O-CG2 3.31Å; E386-V390 WeakPolarHBondContact O-CG2 3.47Å; E386-V390 PolarHBondContact O-N 3.45Å
387	D	96.3	Very high	94.1	Very high	78 Å²	78	96.6 Å²	96.6	42%	0.417	49%	0.492	S	S	.	.	H	α-helix	trans	-56.7	-48	166.7	158.6	70.8	0	0	0	111.4	E383 N389 V390 R391	E383-D387 WeakPolarHBondContact O-CB 3.49Å; E383-D387 PolarHBondContact O-N 3.06Å; D387-N389 VanDerWaalsContact C-N 3.28Å; D387-N389 PolarHBondContact O-N 2.87Å; D387-V390 PolarHBondContact O-N 3.26Å; D387-R391 WeakPolarHBondContact O-CB 3.41Å; D387-R391 PolarHBondContact O-N 2.84Å; D387-R391 IonicContact OD1-NH1 3.22Å; D387-R391 PolarHBondContact OD1-NH1 2.92Å; D387-R391 IonicContact OD2-CZ 2.72Å; D387-R391 VanDerWaalsContact OD2-CZ 3.31Å; D387-R391 IonicContact OD2-NH1 3.98Å; D387-R391 PolarHBondContact OD2-NH1 3.4Å; D387-R391 IonicContact OD2-NH2 3.76Å; D387-R391 PolarHBondContact OD2-NH2 2.76Å
388	T	93.9	Very high	94.2	Very high	67 Å²	67	96 Å²	96	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-38.9	179.2	-63.4	0	0	0	0	111.6	L384 L385 R391 L392	L384-T388 WeakPolarHBondContact O-CB 3.45Å; L384-T388 PolarHBondContact O-N 2.91Å; L384-T388 VanDerWaalsContact O-N 3.09Å; L384-T388 PolarHBondContact O-OG1 2.83Å; L385-T388 PolarHBondContact O-N 3.5Å; T388-R391 PolarHBondContact OG1-NH2 3.2Å; T388-L392 VanDerWaalsContact O-CB 3.26Å; T388-L392 WeakPolarHBondContact O-CB 3.34Å; T388-L392 PolarHBondContact O-N 3.31Å
389	N	95.2	Very high	94.4	Very high	91 Å²	91	99.1 Å²	99.1	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-69.7	-40.2	175.6	-168.3	42.1	0	0	0	111.7	L385 E386 D387 L392 N393	L385-N389 VanDerWaalsContact O-CB 3.23Å; L385-N389 WeakPolarHBondContact O-CB 3.33Å; L385-N389 PolarHBondContact O-N 2.8Å; E386-N389 PolarHBondContact O-N 3.47Å; D387-N389 VanDerWaalsContact C-N 3.28Å; D387-N389 PolarHBondContact O-N 2.87Å; N389-L392 PolarHBondContact O-N 3.14Å; N389-N393 WeakPolarHBondContact O-CB 3.26Å; N389-N393 PolarHBondContact O-N 3.35Å; N389-N393 PolarHBondContact O-ND2 2.84Å; N389-N393 PolarHBondContact OD1-ND2 2.88Å
390	V	95.8	Very high	94.4	Very high	99 Å²	99	100.7 Å²	100.7	60%	0.6	50%	0.502	S	S	*	.	H	α-helix	trans	-64	-44.7	174.9	167.1	0	0	0	0	111	E386 D387 L392 N393 K394	E386-V390 WeakPolarHBondContact O-CB 3.31Å; E386-V390 VanDerWaalsContact O-CG2 3.31Å; E386-V390 WeakPolarHBondContact O-CG2 3.47Å; E386-V390 PolarHBondContact O-N 3.45Å; D387-V390 PolarHBondContact O-N 3.26Å; V390-L392 VanDerWaalsContact C-N 3.33Å; V390-L392 PolarHBondContact O-N 3.3Å; V390-N393 PolarHBondContact O-N 3.34Å; V390-K394 WeakPolarHBondContact O-CB 3.22Å; V390-K394 PolarHBondContact O-N 3.47Å
391	R	96	Very high	94.3	Very high	119 Å²	119	99 Å²	99	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-39.4	174	175.2	172.5	51.8	-98.9	-1.4	112	D387 T388 M395	D387-R391 WeakPolarHBondContact O-CB 3.41Å; D387-R391 PolarHBondContact O-N 2.84Å; D387-R391 IonicContact OD1-NH1 3.22Å; D387-R391 PolarHBondContact OD1-NH1 2.92Å; D387-R391 IonicContact OD2-CZ 2.72Å; D387-R391 VanDerWaalsContact OD2-CZ 3.31Å; D387-R391 IonicContact OD2-NH1 3.98Å; D387-R391 PolarHBondContact OD2-NH1 3.4Å; D387-R391 IonicContact OD2-NH2 3.76Å; D387-R391 PolarHBondContact OD2-NH2 2.76Å; T388-R391 PolarHBondContact OG1-NH2 3.2Å; R391-M395 WeakPolarHBondContact O-CB 3.29Å; R391-M395 PolarHBondContact O-N 2.82Å
392	L	94.9	Very high	94.3	Very high	82 Å²	82	100.6 Å²	100.6	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-67.7	-48.2	176.1	-175.2	147.7	0	0	0	111.6	T388 N389 V390 K394 M395 E396	T388-L392 VanDerWaalsContact O-CB 3.26Å; T388-L392 WeakPolarHBondContact O-CB 3.34Å; T388-L392 PolarHBondContact O-N 3.31Å; N389-L392 PolarHBondContact O-N 3.14Å; V390-L392 VanDerWaalsContact C-N 3.33Å; V390-L392 PolarHBondContact O-N 3.3Å; L392-K394 VanDerWaalsContact C-N 3.28Å; L392-K394 PolarHBondContact O-N 3.49Å; L392-M395 WeakPolarHBondContact O-CB 3.5Å; L392-M395 PolarHBondContact O-N 3.41Å; L392-M395 VanDerWaalsContact O-N 3.11Å; L392-E396 HydrophobicContact CD2-CG 4.13Å; L392-E396 WeakPolarHBondContact O-CG 3.46Å; L392-E396 PolarHBondContact O-N 3.43Å
393	N	91.7	Very high	94.3	Very high	81 Å²	81	98.6 Å²	98.6	43%	0.433	50%	0.501	S	S	.	.	H	α-helix	trans	-59.3	-38.4	175.1	-77.2	-69.2	0	0	0	112	N389 V390 S397	N389-N393 WeakPolarHBondContact O-CB 3.26Å; N389-N393 PolarHBondContact O-N 3.35Å; N389-N393 PolarHBondContact O-ND2 2.84Å; N389-N393 PolarHBondContact OD1-ND2 2.88Å; V390-N393 PolarHBondContact O-N 3.34Å; N393-S397 WeakPolarHBondContact O-CB 3.37Å; N393-S397 PolarHBondContact O-N 2.96Å
394	K	95.8	Very high	94.3	Very high	128 Å²	128	98.9 Å²	98.9	56%	0.557	50%	0.502	S	S	*	.	H	α-helix	trans	-63.1	-47.1	173.1	178	173	172.5	175.9	0	111.4	V390 L392 E396 S397 E398	V390-K394 WeakPolarHBondContact O-CB 3.22Å; V390-K394 PolarHBondContact O-N 3.47Å; L392-K394 VanDerWaalsContact C-N 3.28Å; L392-K394 PolarHBondContact O-N 3.49Å; K394-E396 PolarHBondContact O-N 3.16Å; K394-S397 WeakPolarHBondContact O-CB 3.29Å; K394-S397 PolarHBondContact O-N 3.41Å; K394-E398 WeakPolarHBondContact CE-OE1 3.33Å; K394-E398 IonicContact NZ-OE1 2.85Å; K394-E398 WeakPolarHBondContact O-CG 3.18Å; K394-E398 PolarHBondContact O-N 2.72Å
395	M	92.6	Very high	94.2	Very high	96 Å²	96	97.2 Å²	97.2	47%	0.473	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-41.5	177.2	-171.5	-173.1	-61.8	0	0	112.1	R391 L392 E398 Y399	R391-M395 WeakPolarHBondContact O-CB 3.29Å; R391-M395 PolarHBondContact O-N 2.82Å; L392-M395 WeakPolarHBondContact O-CB 3.5Å; L392-M395 PolarHBondContact O-N 3.41Å; L392-M395 VanDerWaalsContact O-N 3.11Å; M395-E398 PolarHBondContact O-N 2.82Å; M395-Y399 HydrophobicContact CG-CD2 3.85Å; M395-Y399 HydrophobicContact CG-CE2 3.72Å; M395-Y399 WeakPolarHBondContact O-CB 3.26Å; M395-Y399 VanDerWaalsContact O-CD2 3.27Å; M395-Y399 WeakPolarHBondContact O-CD2 3.31Å; M395-Y399 PolarHBondContact O-N 2.82Å; M395-Y399 HydrophobicContact SD-CE2 4.09Å
396	E	92.6	Very high	94.2	Very high	112 Å²	112	94.6 Å²	94.6	52%	0.523	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-41.2	173.4	-72.1	-170.9	166.4	0	0	111.7	L392 K394 Y399 M400	L392-E396 HydrophobicContact CD2-CG 4.13Å; L392-E396 WeakPolarHBondContact O-CG 3.46Å; L392-E396 PolarHBondContact O-N 3.43Å; K394-E396 PolarHBondContact O-N 3.16Å; E396-Y399 PolarHBondContact O-N 3.46Å; E396-M400 WeakPolarHBondContact O-CB 3.31Å; E396-M400 VanDerWaalsContact O-CG 3.25Å; E396-M400 WeakPolarHBondContact O-CG 3.4Å; E396-M400 PolarHBondContact O-N 3.39Å
397	S	92.9	Very high	94.2	Very high	79 Å²	79	93.7 Å²	93.7	55%	0.552	49%	0.487	S	S	*	.	H	α-helix	trans	-62.6	-43.5	174.7	-170.2	0	0	0	0	112.1	N393 K394 M400 A401	N393-S397 WeakPolarHBondContact O-CB 3.37Å; N393-S397 PolarHBondContact O-N 2.96Å; K394-S397 WeakPolarHBondContact O-CB 3.29Å; K394-S397 PolarHBondContact O-N 3.41Å; S397-M400 PolarHBondContact O-N 2.88Å; S397-A401 WeakPolarHBondContact O-CB 3.31Å; S397-A401 PolarHBondContact O-N 2.69Å
398	E	94.6	Very high	94.2	Very high	108 Å²	108	95.3 Å²	95.3	51%	0.505	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-44.5	175.9	-73.8	170.4	178.7	0	0	111.6	K394 M395 M400 A401 Q402	K394-E398 WeakPolarHBondContact CE-OE1 3.33Å; K394-E398 IonicContact NZ-OE1 2.85Å; K394-E398 WeakPolarHBondContact O-CG 3.18Å; K394-E398 PolarHBondContact O-N 2.72Å; M395-E398 PolarHBondContact O-N 2.82Å; E398-M400 PolarHBondContact O-N 2.78Å; E398-A401 PolarHBondContact O-N 2.8Å; E398-Q402 WeakPolarHBondContact O-CB 3.27Å; E398-Q402 PolarHBondContact O-N 3.42Å
399	Y	96.1	Very high	94.2	Very high	142 Å²	142	97 Å²	97	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-63.8	-38.2	173.3	-85.9	-59.2	0	0	0	112.8	M395 E396 T403	M395-Y399 HydrophobicContact CG-CD2 3.85Å; M395-Y399 HydrophobicContact CG-CE2 3.72Å; M395-Y399 WeakPolarHBondContact O-CB 3.26Å; M395-Y399 VanDerWaalsContact O-CD2 3.27Å; M395-Y399 WeakPolarHBondContact O-CD2 3.31Å; M395-Y399 PolarHBondContact O-N 2.82Å; M395-Y399 HydrophobicContact SD-CE2 4.09Å; E396-Y399 PolarHBondContact O-N 3.46Å; Y399-T403 VanDerWaalsContact O-CB 3.24Å; Y399-T403 WeakPolarHBondContact O-CB 3.34Å; Y399-T403 PolarHBondContact O-N 3.22Å; Y399-T403 PolarHBondContact O-OG1 2.97Å
400	M	93.8	Very high	94.1	Very high	109 Å²	109	96.2 Å²	96.2	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-68.7	-40.1	176.2	-75.8	-62.3	-65.5	0	0	111.7	E396 S397 E398 T403 Q404	E396-M400 WeakPolarHBondContact O-CB 3.31Å; E396-M400 VanDerWaalsContact O-CG 3.25Å; E396-M400 WeakPolarHBondContact O-CG 3.4Å; E396-M400 PolarHBondContact O-N 3.39Å; S397-M400 PolarHBondContact O-N 2.88Å; E398-M400 PolarHBondContact O-N 2.78Å; M400-T403 PolarHBondContact O-N 2.65Å; M400-Q404 WeakPolarHBondContact O-CB 3.43Å; M400-Q404 VanDerWaalsContact O-CG 3.29Å; M400-Q404 WeakPolarHBondContact O-CG 3.46Å; M400-Q404 PolarHBondContact O-N 3.32Å
401	A	94.1	Very high	94	Very high	55 Å²	55	98 Å²	98	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-64.4	-43.5	173.5	0	0	0	0	0	111.8	S397 E398 T403 Q404 S405	S397-A401 WeakPolarHBondContact O-CB 3.31Å; S397-A401 PolarHBondContact O-N 2.69Å; E398-A401 PolarHBondContact O-N 2.8Å; A401-T403 VanDerWaalsContact C-N 3.33Å; A401-T403 PolarHBondContact O-N 2.96Å; A401-Q404 PolarHBondContact O-N 3Å; A401-S405 WeakPolarHBondContact O-CB 3.38Å; A401-S405 PolarHBondContact O-N 3.49Å
402	Q	94.3	Very high	94	Very high	114 Å²	114	97.9 Å²	97.9	53%	0.533	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-41.5	173.3	-171.3	-177.6	31.1	0	0	111.6	E398 S405 T406	E398-Q402 WeakPolarHBondContact O-CB 3.27Å; E398-Q402 PolarHBondContact O-N 3.42Å; Q402-S405 PolarHBondContact O-N 3.49Å; Q402-T406 WeakPolarHBondContact O-CG2 3.37Å; Q402-T406 PolarHBondContact O-N 2.84Å; Q402-T406 PolarHBondContact O-OG1 2.95Å
403	T	93.4	Very high	94	Very high	63 Å²	63	98.9 Å²	98.9	39%	0.387	50%	0.501	S	S	.	.	H	α-helix	trans	-66.2	-37.4	176.5	-60.7	0	0	0	0	111.5	Y399 M400 A401 T406 N407	Y399-T403 VanDerWaalsContact O-CB 3.24Å; Y399-T403 WeakPolarHBondContact O-CB 3.34Å; Y399-T403 PolarHBondContact O-N 3.22Å; Y399-T403 PolarHBondContact O-OG1 2.97Å; M400-T403 PolarHBondContact O-N 2.65Å; A401-T403 VanDerWaalsContact C-N 3.33Å; A401-T403 PolarHBondContact O-N 2.96Å; T403-T406 WeakPolarHBondContact CA-OG1 3.48Å; T403-T406 PolarHBondContact O-OG1 3.14Å; T403-T406 VanDerWaalsContact O-OG1 3.12Å; T403-N407 WeakPolarHBondContact CG2-ND2 2.84Å; T403-N407 VanDerWaalsContact O-CB 3.27Å; T403-N407 WeakPolarHBondContact O-CB 3.23Å; T403-N407 VanDerWaalsContact O-CG 3.27Å; T403-N407 PolarHBondContact O-N 3.46Å; T403-N407 PolarHBondContact O-ND2 3.49Å
404	Q	94.3	Very high	94.1	Very high	129 Å²	129	100 Å²	100	60%	0.603	50%	0.504	S	S	*	.	H	α-helix	trans	-68.5	-43.2	173.8	-73	172.8	16.4	0	0	111.8	M400 A401 N407 H408	M400-Q404 WeakPolarHBondContact O-CB 3.43Å; M400-Q404 VanDerWaalsContact O-CG 3.29Å; M400-Q404 WeakPolarHBondContact O-CG 3.46Å; M400-Q404 PolarHBondContact O-N 3.32Å; A401-Q404 PolarHBondContact O-N 3Å; Q404-N407 PolarHBondContact O-N 2.84Å; Q404-H408 WeakPolarHBondContact O-CB 3.21Å; Q404-H408 PolarHBondContact O-N 3.4Å
405	S	93.1	Very high	94.1	Very high	79 Å²	79	96.5 Å²	96.5	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-61.6	-47.1	176.5	177.6	0	0	0	0	112.2	A401 Q402 H408 M409	A401-S405 WeakPolarHBondContact O-CB 3.38Å; A401-S405 PolarHBondContact O-N 3.49Å; Q402-S405 PolarHBondContact O-N 3.49Å; S405-H408 WeakPolarHBondContact O-CB 3.37Å; S405-H408 PolarHBondContact O-N 2.93Å; S405-M409 PolarHBondContact O-N 2.81Å
406	T	92.3	Very high	94.3	Very high	57 Å²	57	97.2 Å²	97.2	35%	0.35	50%	0.496	S	S	.	.	H	α-helix	trans	-64.6	-41.1	176.1	48.8	0	0	0	0	112.2	Q402 T403 H408 M409 I410	Q402-T406 WeakPolarHBondContact O-CG2 3.37Å; Q402-T406 PolarHBondContact O-N 2.84Å; Q402-T406 PolarHBondContact O-OG1 2.95Å; T403-T406 WeakPolarHBondContact CA-OG1 3.48Å; T403-T406 PolarHBondContact O-OG1 3.14Å; T403-T406 VanDerWaalsContact O-OG1 3.12Å; T406-H408 VanDerWaalsContact C-N 3.31Å; T406-H408 PolarHBondContact O-N 3.45Å; T406-M409 PolarHBondContact O-N 3.41Å; T406-I410 WeakPolarHBondContact O-CB 3.42Å; T406-I410 WeakPolarHBondContact O-CD1 3.22Å; T406-I410 VanDerWaalsContact O-CG1 3.22Å; T406-I410 WeakPolarHBondContact O-CG1 3.18Å; T406-I410 PolarHBondContact O-N 2.86Å
407	N	95.4	Very high	94.5	Very high	80 Å²	80	96.1 Å²	96.1	43%	0.428	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-31.7	173.1	-79.5	-51.1	0	0	0	113.3	T403 Q404 K411	T403-N407 WeakPolarHBondContact CG2-ND2 2.84Å; T403-N407 VanDerWaalsContact O-CB 3.27Å; T403-N407 WeakPolarHBondContact O-CB 3.23Å; T403-N407 VanDerWaalsContact O-CG 3.27Å; T403-N407 PolarHBondContact O-N 3.46Å; T403-N407 PolarHBondContact O-ND2 3.49Å; Q404-N407 PolarHBondContact O-N 2.84Å; N407-K411 WeakPolarHBondContact O-CG 3.46Å; N407-K411 PolarHBondContact O-N 3.46Å; N407-K411 VanDerWaalsContact O-N 3.16Å
408	H	94.9	Very high	94.6	Very high	111 Å²	111	99.1 Å²	99.1	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-68.9	-48.6	173.9	-174.6	8.4	0	0	0	111	Q404 S405 T406 I410 K411 E412	Q404-H408 WeakPolarHBondContact O-CB 3.21Å; Q404-H408 PolarHBondContact O-N 3.4Å; S405-H408 WeakPolarHBondContact O-CB 3.37Å; S405-H408 PolarHBondContact O-N 2.93Å; T406-H408 VanDerWaalsContact C-N 3.31Å; T406-H408 PolarHBondContact O-N 3.45Å; H408-I410 VanDerWaalsContact C-N 3.31Å; H408-I410 PolarHBondContact O-N 2.81Å; H408-K411 PolarHBondContact O-N 2.82Å; H408-K411 VanDerWaalsContact O-N 3.13Å; H408-E412 IonicContact CE1-OE1 3.71Å; H408-E412 PolarHBondContact O-N 3.29Å
409	M	94.5	Very high	94.7	Very high	102 Å²	102	98.6 Å²	98.6	50%	0.502	50%	0.5	S	S	.	.	H	α-helix	trans	-60.1	-39.3	175.6	-177.8	-178.7	65.5	0	0	112	S405 T406 E412 L413	S405-M409 PolarHBondContact O-N 2.81Å; T406-M409 PolarHBondContact O-N 3.41Å; M409-E412 PolarHBondContact O-N 3.01Å; M409-L413 HydrophobicContact CG-CD1 4.11Å; M409-L413 WeakPolarHBondContact O-CB 3.3Å; M409-L413 VanDerWaalsContact O-CG 3.27Å; M409-L413 WeakPolarHBondContact O-CG 3.45Å; M409-L413 PolarHBondContact O-N 2.92Å
410	I	92.7	Very high	94.6	Very high	75 Å²	75	95.7 Å²	95.7	39%	0.385	49%	0.493	S	S	.	.	H	α-helix	trans	-59.2	-47.6	173.5	-73.6	163.7	0	0	0	110.3	T406 H408 E412 L413 E414	T406-I410 WeakPolarHBondContact O-CB 3.42Å; T406-I410 WeakPolarHBondContact O-CD1 3.22Å; T406-I410 VanDerWaalsContact O-CG1 3.22Å; T406-I410 WeakPolarHBondContact O-CG1 3.18Å; T406-I410 PolarHBondContact O-N 2.86Å; H408-I410 VanDerWaalsContact C-N 3.31Å; H408-I410 PolarHBondContact O-N 2.81Å; I410-E412 VanDerWaalsContact C-N 3.35Å; I410-E412 PolarHBondContact O-N 3.4Å; I410-L413 PolarHBondContact O-N 2.98Å; I410-E414 HydrophobicContact CG2-CG 4.26Å; I410-E414 WeakPolarHBondContact O-CB 3.31Å; I410-E414 VanDerWaalsContact O-CG 3.3Å; I410-E414 WeakPolarHBondContact O-CG 3.25Å; I410-E414 PolarHBondContact O-N 3.08Å
411	K	95.3	Very high	94.6	Very high	137 Å²	137	93.7 Å²	93.7	60%	0.596	49%	0.487	S	S	*	.	H	α-helix	trans	-63.8	-36.1	177.7	-73.3	173.2	-179.9	-179.8	0	113.5	N407 H408 A415	N407-K411 WeakPolarHBondContact O-CG 3.46Å; N407-K411 PolarHBondContact O-N 3.46Å; N407-K411 VanDerWaalsContact O-N 3.16Å; H408-K411 PolarHBondContact O-N 2.82Å; H408-K411 VanDerWaalsContact O-N 3.13Å; K411-A415 VanDerWaalsContact O-CB 3.28Å; K411-A415 WeakPolarHBondContact O-CB 3.47Å; K411-A415 PolarHBondContact O-N 3.13Å
412	E	95.8	Very high	94.7	Very high	116 Å²	116	92.1 Å²	92.1	54%	0.542	48%	0.476	S	S	.	.	H	α-helix	trans	-66.3	-41.4	173.7	-69.4	-172.2	138.9	0	0	111.7	H408 M409 I410 A415 R416	H408-E412 IonicContact CE1-OE1 3.71Å; H408-E412 PolarHBondContact O-N 3.29Å; M409-E412 PolarHBondContact O-N 3.01Å; I410-E412 VanDerWaalsContact C-N 3.35Å; I410-E412 PolarHBondContact O-N 3.4Å; E412-A415 PolarHBondContact O-N 3.46Å; E412-R416 VanDerWaalsContact O-CB 3.28Å; E412-R416 WeakPolarHBondContact O-CB 3.45Å; E412-R416 PolarHBondContact O-N 3.12Å
413	L	94.2	Very high	94.7	Very high	103 Å²	103	90.9 Å²	90.9	54%	0.539	47%	0.471	S	S	.	.	H	α-helix	trans	-66.8	-41.6	174.9	-69.5	170	0	0	0	111.8	M409 I410 R416 V417	M409-L413 HydrophobicContact CG-CD1 4.11Å; M409-L413 WeakPolarHBondContact O-CB 3.3Å; M409-L413 VanDerWaalsContact O-CG 3.27Å; M409-L413 WeakPolarHBondContact O-CG 3.45Å; M409-L413 PolarHBondContact O-N 2.92Å; I410-L413 PolarHBondContact O-N 2.98Å; L413-R416 PolarHBondContact O-N 2.78Å; L413-V417 WeakPolarHBondContact O-CB 3.28Å; L413-V417 VanDerWaalsContact O-CG2 3.28Å; L413-V417 WeakPolarHBondContact O-CG2 3.23Å; L413-V417 PolarHBondContact O-N 2.9Å
414	E	94.3	Very high	94.7	Very high	104 Å²	104	90.6 Å²	90.6	49%	0.486	48%	0.475	S	S	.	.	H	α-helix	trans	-59.5	-49.2	173.1	-74.6	172.7	161.5	0	0	111.3	I410 R416 V417 Q418	I410-E414 HydrophobicContact CG2-CG 4.26Å; I410-E414 WeakPolarHBondContact O-CB 3.31Å; I410-E414 VanDerWaalsContact O-CG 3.3Å; I410-E414 WeakPolarHBondContact O-CG 3.25Å; I410-E414 PolarHBondContact O-N 3.08Å; E414-R416 VanDerWaalsContact C-N 3.33Å; E414-R416 PolarHBondContact O-N 3.4Å; E414-V417 PolarHBondContact O-N 3.26Å; E414-Q418 WeakPolarHBondContact O-CG 3.22Å; E414-Q418 PolarHBondContact O-N 2.85Å
415	A	95.3	Very high	94.7	Very high	55 Å²	55	90.6 Å²	90.6	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-62	-40.1	176.5	0	0	0	0	0	111.8	K411 E412 Q418 Q419	K411-A415 VanDerWaalsContact O-CB 3.28Å; K411-A415 WeakPolarHBondContact O-CB 3.47Å; K411-A415 PolarHBondContact O-N 3.13Å; E412-A415 PolarHBondContact O-N 3.46Å; A415-Q418 PolarHBondContact O-N 3.38Å; A415-Q419 WeakPolarHBondContact O-CB 3.36Å; A415-Q419 PolarHBondContact O-N 2.83Å
416	R	97	Very high	94.9	Very high	112 Å²	112	91.5 Å²	91.5	42%	0.423	47%	0.473	S	S	.	.	H	α-helix	trans	-68.6	-35.9	176.8	-172.7	59.7	-179.6	142.5	8.6	112.2	E412 L413 E414 Q419 L420 E423	E412-R416 VanDerWaalsContact O-CB 3.28Å; E412-R416 WeakPolarHBondContact O-CB 3.45Å; E412-R416 PolarHBondContact O-N 3.12Å; L413-R416 PolarHBondContact O-N 2.78Å; E414-R416 VanDerWaalsContact C-N 3.33Å; E414-R416 PolarHBondContact O-N 3.4Å; R416-Q419 VanDerWaalsContact NH1-NE2 3.13Å; R416-Q419 PolarHBondContact O-N 3.08Å; R416-L420 HydrophobicContact CG-CD1 4.15Å; R416-L420 WeakPolarHBondContact O-CB 3.39Å; R416-L420 VanDerWaalsContact O-CG 3.25Å; R416-L420 WeakPolarHBondContact O-CG 3.35Å; R416-L420 PolarHBondContact O-N 2.8Å; R416-E423 IonicContact NH1-OE1 3.98Å
417	V	96.1	Very high	94.9	Very high	89 Å²	89	90.8 Å²	90.8	54%	0.539	47%	0.471	S	S	.	.	H	α-helix	trans	-66.9	-42.8	172.6	166.7	0	0	0	0	111	L413 E414 L420 T421	L413-V417 WeakPolarHBondContact O-CB 3.28Å; L413-V417 VanDerWaalsContact O-CG2 3.28Å; L413-V417 WeakPolarHBondContact O-CG2 3.23Å; L413-V417 PolarHBondContact O-N 2.9Å; E414-V417 PolarHBondContact O-N 3.26Å; V417-L420 PolarHBondContact O-N 3.12Å; V417-T421 WeakPolarHBondContact O-CB 3.35Å; V417-T421 PolarHBondContact O-N 2.88Å; V417-T421 PolarHBondContact O-OG1 3.31Å
418	Q	95.6	Very high	94.9	Very high	141 Å²	141	90.6 Å²	90.6	66%	0.659	47%	0.47	S	S	*	.	H	α-helix	trans	-61.1	-45.2	173.9	-71.6	173.9	17.4	0	0	111.4	E414 A415 T421 G422	E414-Q418 WeakPolarHBondContact O-CG 3.22Å; E414-Q418 PolarHBondContact O-N 2.85Å; A415-Q418 PolarHBondContact O-N 3.38Å; Q418-T421 PolarHBondContact O-N 3.24Å; Q418-G422 PolarHBondContact O-N 2.98Å
419	Q	96.2	Very high	95	Very high	98 Å²	98	89.2 Å²	89.2	46%	0.458	47%	0.466	S	S	.	.	H	α-helix	trans	-59.9	-50.3	175.1	-174.1	-169.8	-1.3	0	0	111.7	A415 R416 T421 G422 E423	A415-Q419 WeakPolarHBondContact O-CB 3.36Å; A415-Q419 PolarHBondContact O-N 2.83Å; R416-Q419 VanDerWaalsContact NH1-NE2 3.13Å; R416-Q419 PolarHBondContact O-N 3.08Å; Q419-T421 VanDerWaalsContact C-N 3.26Å; Q419-T421 PolarHBondContact O-N 2.87Å; Q419-G422 PolarHBondContact O-N 3.33Å; Q419-E423 HydrophobicContact CG-CG 4.48Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.33Å; Q419-E423 PolarHBondContact NE2-OE1 2.98Å; Q419-E423 WeakPolarHBondContact O-CG 3.49Å; Q419-E423 PolarHBondContact O-N 2.89Å
420	L	93.8	Very high	95	Very high	80 Å²	80	90.2 Å²	90.2	42%	0.419	47%	0.469	S	S	.	.	H	α-helix	trans	-62.8	-33	179	-75.4	169.2	0	0	0	112.4	R416 V417 A424	R416-L420 HydrophobicContact CG-CD1 4.15Å; R416-L420 WeakPolarHBondContact O-CB 3.39Å; R416-L420 VanDerWaalsContact O-CG 3.25Å; R416-L420 WeakPolarHBondContact O-CG 3.35Å; R416-L420 PolarHBondContact O-N 2.8Å; V417-L420 PolarHBondContact O-N 3.12Å; L420-A424 VanDerWaalsContact O-CB 3.3Å; L420-A424 WeakPolarHBondContact O-CB 3.46Å; L420-A424 PolarHBondContact O-N 2.88Å
421	T	93.8	Very high	95	Very high	67 Å²	67	92.3 Å²	92.3	41%	0.411	47%	0.472	S	S	.	.	H	α-helix	trans	-65.5	-49.5	173.1	-56.1	0	0	0	0	110.3	V417 Q418 Q419 E423 A424 E425	V417-T421 WeakPolarHBondContact O-CB 3.35Å; V417-T421 PolarHBondContact O-N 2.88Å; V417-T421 PolarHBondContact O-OG1 3.31Å; Q418-T421 PolarHBondContact O-N 3.24Å; Q419-T421 VanDerWaalsContact C-N 3.26Å; Q419-T421 PolarHBondContact O-N 2.87Å; T421-E423 VanDerWaalsContact C-N 3.34Å; T421-E423 PolarHBondContact O-N 2.85Å; T421-A424 PolarHBondContact O-N 3.5Å; T421-A424 VanDerWaalsContact O-N 3.17Å; T421-E425 WeakPolarHBondContact O-CB 3.14Å; T421-E425 WeakPolarHBondContact O-CG 3.42Å; T421-E425 PolarHBondContact O-N 2.81Å
422	G	96.3	Very high	95	Very high	22 Å²	22	91 Å²	91	23%	0.227	47%	0.468	C	S	.	.	H	α-helix	trans	-62.6	-36.2	175.4	0	0	0	0	0	113.6	Q418 Q419 N426	Q418-G422 PolarHBondContact O-N 2.98Å; Q419-G422 PolarHBondContact O-N 3.33Å; G422-N426 WeakPolarHBondContact O-CB 3.3Å; G422-N426 PolarHBondContact O-N 3.01Å; G422-N426 PolarHBondContact O-ND2 3.29Å
423	E	94.9	Very high	95	Very high	88 Å²	88	90.9 Å²	90.9	41%	0.411	47%	0.466	S	S	.	.	H	α-helix	trans	-65	-42.6	172.6	-74.9	172.7	-168.9	0	0	111.2	R416 Q419 T421 S427	R416-E423 IonicContact NH1-OE1 3.98Å; Q419-E423 HydrophobicContact CG-CG 4.48Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.33Å; Q419-E423 PolarHBondContact NE2-OE1 2.98Å; Q419-E423 WeakPolarHBondContact O-CG 3.49Å; Q419-E423 PolarHBondContact O-N 2.89Å; T421-E423 VanDerWaalsContact C-N 3.34Å; T421-E423 PolarHBondContact O-N 2.85Å; E423-S427 VanDerWaalsContact O-CB 3.24Å; E423-S427 WeakPolarHBondContact O-CB 3.41Å; E423-S427 PolarHBondContact O-N 3.21Å
424	A	92.6	Very high	95.1	Very high	57 Å²	57	91.2 Å²	91.2	47%	0.471	47%	0.468	S	S	.	.	H	α-helix	trans	-66.7	-41.3	176.4	0	0	0	0	0	112.7	L420 T421 S427 N428	L420-A424 VanDerWaalsContact O-CB 3.3Å; L420-A424 WeakPolarHBondContact O-CB 3.46Å; L420-A424 PolarHBondContact O-N 2.88Å; T421-A424 PolarHBondContact O-N 3.5Å; T421-A424 VanDerWaalsContact O-N 3.17Å; A424-S427 PolarHBondContact O-N 3Å; A424-N428 WeakPolarHBondContact O-CB 3.45Å; A424-N428 PolarHBondContact O-N 2.63Å
425	E	95	Very high	95.1	Very high	130 Å²	130	91.8 Å²	91.8	61%	0.607	47%	0.473	S	S	*	.	H	α-helix	trans	-63.9	-47.1	174.7	-75.1	178.3	173.6	0	0	111.7	T421 S427 N428 L429	T421-E425 WeakPolarHBondContact O-CB 3.14Å; T421-E425 WeakPolarHBondContact O-CG 3.42Å; T421-E425 PolarHBondContact O-N 2.81Å; E425-S427 VanDerWaalsContact C-N 3.32Å; E425-S427 PolarHBondContact O-N 3.27Å; E425-N428 CarbonylContact O-C 3.56Å; E425-N428 WeakPolarHBondContact O-CA 3.31Å; E425-N428 WeakPolarHBondContact O-CB 3.39Å; E425-N428 PolarHBondContact O-N 3.37Å; E425-L429 PolarHBondContact O-N 2.98Å
426	N	96.3	Very high	95.1	Very high	97 Å²	97	94.7 Å²	94.7	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-60.4	-42.1	174.3	-83.3	-66.4	0	0	0	111.7	G422 N428 L429 Q430	G422-N426 WeakPolarHBondContact O-CB 3.3Å; G422-N426 PolarHBondContact O-N 3.01Å; G422-N426 PolarHBondContact O-ND2 3.29Å; N426-N428 VanDerWaalsContact C-N 3.27Å; N426-N428 PolarHBondContact O-N 2.88Å; N426-L429 PolarHBondContact O-N 2.91Å; N426-Q430 WeakPolarHBondContact O-CG 3.38Å; N426-Q430 PolarHBondContact O-N 2.85Å
427	S	93.4	Very high	95	Very high	42 Å²	42	94.3 Å²	94.3	29%	0.294	48%	0.48	S	S	.	.	H	α-helix	trans	-63	-33.9	174.2	-167.5	0	0	0	0	112.1	E423 A424 E425 R431	E423-S427 VanDerWaalsContact O-CB 3.24Å; E423-S427 WeakPolarHBondContact O-CB 3.41Å; E423-S427 PolarHBondContact O-N 3.21Å; A424-S427 PolarHBondContact O-N 3Å; E425-S427 VanDerWaalsContact C-N 3.32Å; E425-S427 PolarHBondContact O-N 3.27Å; S427-R431 VanDerWaalsContact O-CZ 3.29Å; S427-R431 PolarHBondContact O-N 3.13Å; S427-R431 VanDerWaalsContact O-N 3.08Å; S427-R431 PolarHBondContact O-NH1 2.93Å; S427-R431 PolarHBondContact OG-NH1 2.92Å; S427-R431 PolarHBondContact OG-NH2 3.45Å
428	N	94.7	Very high	95	Very high	77 Å²	77	95.5 Å²	95.5	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-72.6	-41.8	175.3	-159.5	26.5	0	0	0	112	A424 E425 N426 Q430 R431 Q432	A424-N428 WeakPolarHBondContact O-CB 3.45Å; A424-N428 PolarHBondContact O-N 2.63Å; E425-N428 CarbonylContact O-C 3.56Å; E425-N428 WeakPolarHBondContact O-CA 3.31Å; E425-N428 WeakPolarHBondContact O-CB 3.39Å; E425-N428 PolarHBondContact O-N 3.37Å; N426-N428 VanDerWaalsContact C-N 3.27Å; N426-N428 PolarHBondContact O-N 2.88Å; N428-Q430 VanDerWaalsContact C-N 3.32Å; N428-Q430 PolarHBondContact O-N 3.45Å; N428-R431 WeakPolarHBondContact O-CB 3.26Å; N428-R431 PolarHBondContact O-N 3.5Å; N428-R431 VanDerWaalsContact O-N 3.15Å; N428-Q432 WeakPolarHBondContact O-CG 3.32Å; N428-Q432 PolarHBondContact O-N 3.43Å
429	L	96.3	Very high	94.9	Very high	82 Å²	82	90.9 Å²	90.9	43%	0.429	46%	0.464	S	S	.	.	H	α-helix	trans	-62.8	-37.8	174.5	-175.9	64.1	0	0	0	111.7	E425 N426 Q432 K433	E425-L429 PolarHBondContact O-N 2.98Å; N426-L429 PolarHBondContact O-N 2.91Å; L429-Q432 PolarHBondContact O-N 3.31Å; L429-K433 WeakPolarHBondContact O-CG 3.48Å; L429-K433 PolarHBondContact O-N 2.9Å
430	Q	94.7	Very high	94.9	Very high	122 Å²	122	89.7 Å²	89.7	57%	0.57	46%	0.459	S	S	*	.	H	α-helix	trans	-63.2	-44.4	170.7	-73.3	172.7	1.6	0	0	111.8	N426 N428 Q432 K433 L434	N426-Q430 WeakPolarHBondContact O-CG 3.38Å; N426-Q430 PolarHBondContact O-N 2.85Å; N428-Q430 VanDerWaalsContact C-N 3.32Å; N428-Q430 PolarHBondContact O-N 3.45Å; Q430-Q432 VanDerWaalsContact C-N 3.34Å; Q430-Q432 PolarHBondContact O-N 2.7Å; Q430-K433 PolarHBondContact O-N 3.23Å; Q430-L434 WeakPolarHBondContact O-CG 3.3Å; Q430-L434 PolarHBondContact O-N 3.45Å
431	R	93.8	Very high	94.8	Very high	120 Å²	120	91.8 Å²	91.8	45%	0.453	47%	0.47	S	S	.	.	H	α-helix	trans	-59.5	-42.2	173.2	-79.1	-176.9	-74	-81.3	-0.8	112.3	S427 N428 L434 I435	S427-R431 VanDerWaalsContact O-CZ 3.29Å; S427-R431 PolarHBondContact O-N 3.13Å; S427-R431 VanDerWaalsContact O-N 3.08Å; S427-R431 PolarHBondContact O-NH1 2.93Å; S427-R431 PolarHBondContact OG-NH1 2.92Å; S427-R431 PolarHBondContact OG-NH2 3.45Å; N428-R431 WeakPolarHBondContact O-CB 3.26Å; N428-R431 PolarHBondContact O-N 3.5Å; N428-R431 VanDerWaalsContact O-N 3.15Å; R431-L434 PolarHBondContact O-N 2.86Å; R431-I435 WeakPolarHBondContact O-CD1 3.43Å; R431-I435 VanDerWaalsContact O-CG1 3.24Å; R431-I435 WeakPolarHBondContact O-CG1 3.26Å; R431-I435 PolarHBondContact O-N 3.35Å
432	Q	94.5	Very high	94.9	Very high	109 Å²	109	93.3 Å²	93.3	51%	0.509	47%	0.472	S	S	.	.	H	α-helix	trans	-62.2	-43.6	176.5	-72.1	176.1	1.8	0	0	112.2	N428 L429 Q430 I435 Q436	N428-Q432 WeakPolarHBondContact O-CG 3.32Å; N428-Q432 PolarHBondContact O-N 3.43Å; L429-Q432 PolarHBondContact O-N 3.31Å; Q430-Q432 VanDerWaalsContact C-N 3.34Å; Q430-Q432 PolarHBondContact O-N 2.7Å; Q432-I435 PolarHBondContact O-N 2.96Å; Q432-Q436 PolarHBondContact O-N 2.87Å
433	K	97	Very high	94.9	Very high	113 Å²	113	98.6 Å²	98.6	49%	0.491	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-47.1	174.3	-72.7	176.2	179.8	-177.8	0	112.1	L429 Q430 I435 Q436 E437	L429-K433 WeakPolarHBondContact O-CG 3.48Å; L429-K433 PolarHBondContact O-N 2.9Å; Q430-K433 PolarHBondContact O-N 3.23Å; K433-I435 VanDerWaalsContact C-N 3.29Å; K433-I435 PolarHBondContact O-N 3.46Å; K433-Q436 WeakPolarHBondContact O-CB 3.33Å; K433-Q436 PolarHBondContact O-N 3.46Å; K433-Q436 VanDerWaalsContact O-N 3.09Å; K433-E437 WeakPolarHBondContact O-CG 3.24Å; K433-E437 PolarHBondContact O-N 3.44Å
434	L	94.6	Very high	94.9	Very high	110 Å²	110	97.7 Å²	97.7	58%	0.576	49%	0.488	S	S	*	.	H	α-helix	trans	-62.5	-34.4	176.8	-70.3	169.5	0	0	0	112.8	Q430 R431 K438	Q430-L434 WeakPolarHBondContact O-CG 3.3Å; Q430-L434 PolarHBondContact O-N 3.45Å; R431-L434 PolarHBondContact O-N 2.86Å; L434-K438 WeakPolarHBondContact O-CB 3.23Å; L434-K438 PolarHBondContact O-N 2.88Å
435	I	95.6	Very high	95	Very high	116 Å²	116	102.7 Å²	102.7	60%	0.595	50%	0.496	S	S	*	.	H	α-helix	trans	-67.3	-40.6	173.2	-70.9	163.2	0	0	0	110.9	R431 Q432 K433 A439	R431-I435 WeakPolarHBondContact O-CD1 3.43Å; R431-I435 VanDerWaalsContact O-CG1 3.24Å; R431-I435 WeakPolarHBondContact O-CG1 3.26Å; R431-I435 PolarHBondContact O-N 3.35Å; Q432-I435 PolarHBondContact O-N 2.96Å; K433-I435 VanDerWaalsContact C-N 3.29Å; K433-I435 PolarHBondContact O-N 3.46Å; I435-A439 WeakPolarHBondContact O-CB 3.4Å; I435-A439 PolarHBondContact O-N 2.78Å
436	Q	95.6	Very high	95.1	Very high	116 Å²	116	102 Å²	102	54%	0.542	49%	0.492	S	S	.	.	H	α-helix	trans	-65	-51.1	174.7	-178.6	-178.9	-20.9	0	0	111.4	Q432 K433 K438 A439 E440	Q432-Q436 PolarHBondContact O-N 2.87Å; K433-Q436 WeakPolarHBondContact O-CB 3.33Å; K433-Q436 PolarHBondContact O-N 3.46Å; K433-Q436 VanDerWaalsContact O-N 3.09Å; Q436-K438 VanDerWaalsContact C-N 3.29Å; Q436-K438 PolarHBondContact O-N 2.83Å; Q436-A439 CarbonylContact O-C 3.6Å; Q436-A439 PolarHBondContact O-N 3.39Å; Q436-E440 HydrophobicContact CG-CG 4.43Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.44Å; Q436-E440 PolarHBondContact NE2-OE1 2.86Å; Q436-E440 WeakPolarHBondContact O-CG 3.43Å; Q436-E440 PolarHBondContact O-N 3.38Å
437	E	94.9	Very high	95.1	Very high	105 Å²	105	101.4 Å²	101.4	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-57.1	-42	177.5	-72.4	168.8	-164.3	0	0	111.4	K433 E440 L441	K433-E437 WeakPolarHBondContact O-CG 3.24Å; K433-E437 PolarHBondContact O-N 3.44Å; E437-E440 PolarHBondContact O-N 2.9Å; E437-L441 WeakPolarHBondContact O-CG 3.49Å; E437-L441 PolarHBondContact O-N 3.3Å
438	K	95	Very high	95.1	Very high	113 Å²	113	103.4 Å²	103.4	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-58.7	-50	172	177.2	179.2	179.7	-79.1	0	111.9	L434 Q436 E440 L441 E442	L434-K438 WeakPolarHBondContact O-CB 3.23Å; L434-K438 PolarHBondContact O-N 2.88Å; Q436-K438 VanDerWaalsContact C-N 3.29Å; Q436-K438 PolarHBondContact O-N 2.83Å; K438-E440 PolarHBondContact O-N 3.36Å; K438-L441 PolarHBondContact O-N 2.81Å; K438-E442 WeakPolarHBondContact CE-OE1 3.23Å; K438-E442 HydrophobicContact CG-CG 4.4Å; K438-E442 IonicContact NZ-OE1 2.63Å; K438-E442 PolarHBondContact NZ-OE1 2.92Å; K438-E442 IonicContact NZ-OE2 3.73Å; K438-E442 PolarHBondContact NZ-OE2 3.33Å; K438-E442 WeakPolarHBondContact O-CB 3.39Å; K438-E442 WeakPolarHBondContact O-CG 3.38Å; K438-E442 PolarHBondContact O-N 2.86Å
439	A	93.9	Very high	95.1	Very high	45 Å²	45	101.7 Å²	101.7	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-65.7	-28.1	179.8	0	0	0	0	0	112.7	I435 Q436 R443	I435-A439 WeakPolarHBondContact O-CB 3.4Å; I435-A439 PolarHBondContact O-N 2.78Å; Q436-A439 CarbonylContact O-C 3.6Å; Q436-A439 PolarHBondContact O-N 3.39Å; A439-R443 WeakPolarHBondContact O-CB 3.34Å; A439-R443 PolarHBondContact O-N 3.25Å; A439-R443 VanDerWaalsContact O-N 3.17Å
440	E	95.1	Very high	95	Very high	73 Å²	73	100.3 Å²	100.3	34%	0.341	49%	0.49	S	S	.	.	H	α-helix	trans	-71.6	-44.2	172.2	-70.4	177.9	-171.2	0	0	111.8	Q436 E437 K438 R443 C444	Q436-E440 HydrophobicContact CG-CG 4.43Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.44Å; Q436-E440 PolarHBondContact NE2-OE1 2.86Å; Q436-E440 WeakPolarHBondContact O-CG 3.43Å; Q436-E440 PolarHBondContact O-N 3.38Å; E437-E440 PolarHBondContact O-N 2.9Å; K438-E440 PolarHBondContact O-N 3.36Å; E440-R443 WeakPolarHBondContact O-CB 3.4Å; E440-R443 PolarHBondContact O-N 3.39Å; E440-C444 PolarHBondContact O-N 2.8Å; E440-C444 PolarHBondContact O-SG 2.93Å
441	L	93.4	Very high	95.1	Very high	124 Å²	124	99.6 Å²	99.6	65%	0.649	49%	0.486	S	S	*	.	H	α-helix	trans	-64.2	-42.3	174	-71.2	169.9	0	0	0	112.6	E437 K438 R443 C444 Y445	E437-L441 WeakPolarHBondContact O-CG 3.49Å; E437-L441 PolarHBondContact O-N 3.3Å; K438-L441 PolarHBondContact O-N 2.81Å; L441-R443 VanDerWaalsContact C-N 3.29Å; L441-R443 PolarHBondContact O-N 2.84Å; L441-C444 PolarHBondContact O-N 3.3Å; L441-Y445 WeakPolarHBondContact O-CB 3.3Å; L441-Y445 PolarHBondContact O-N 3.49Å
442	E	94.1	Very high	95	Very high	99 Å²	99	98.2 Å²	98.2	46%	0.463	49%	0.487	S	S	.	.	H	α-helix	trans	-61.1	-38.1	175.1	-73.8	176	143.3	0	0	111.2	K438 Q446	K438-E442 WeakPolarHBondContact CE-OE1 3.23Å; K438-E442 HydrophobicContact CG-CG 4.4Å; K438-E442 IonicContact NZ-OE1 2.63Å; K438-E442 PolarHBondContact NZ-OE1 2.92Å; K438-E442 IonicContact NZ-OE2 3.73Å; K438-E442 PolarHBondContact NZ-OE2 3.33Å; K438-E442 WeakPolarHBondContact O-CB 3.39Å; K438-E442 WeakPolarHBondContact O-CG 3.38Å; K438-E442 PolarHBondContact O-N 2.86Å; E442-Q446 WeakPolarHBondContact O-CB 3.31Å; E442-Q446 PolarHBondContact O-N 3.36Å
443	R	96.7	Very high	95	Very high	132 Å²	132	99 Å²	99	50%	0.498	49%	0.491	S	S	.	.	H	α-helix	trans	-66.2	-45.8	173.9	-164.9	-165.7	-45.1	111.1	4.5	112.3	A439 E440 L441 Q446 I447	A439-R443 WeakPolarHBondContact O-CB 3.34Å; A439-R443 PolarHBondContact O-N 3.25Å; A439-R443 VanDerWaalsContact O-N 3.17Å; E440-R443 WeakPolarHBondContact O-CB 3.4Å; E440-R443 PolarHBondContact O-N 3.39Å; L441-R443 VanDerWaalsContact C-N 3.29Å; L441-R443 PolarHBondContact O-N 2.84Å; R443-Q446 PolarHBondContact O-N 3.48Å; R443-I447 HydrophobicContact CG-CD1 4.39Å; R443-I447 WeakPolarHBondContact O-CG1 3.43Å; R443-I447 PolarHBondContact O-N 2.97Å
444	C	96.4	Very high	94.9	Very high	70 Å²	70	98.5 Å²	98.5	47%	0.473	49%	0.49	S	S	.	.	H	α-helix	trans	-61.9	-44.1	176.8	-73	0	0	0	0	111.7	E440 L441 Q446 I447 T448	E440-C444 PolarHBondContact O-N 2.8Å; E440-C444 PolarHBondContact O-SG 2.93Å; L441-C444 PolarHBondContact O-N 3.3Å; C444-Q446 VanDerWaalsContact C-N 3.34Å; C444-Q446 PolarHBondContact O-N 3.14Å; C444-I447 PolarHBondContact O-N 2.92Å; C444-T448 PolarHBondContact O-N 3.33Å; C444-T448 PolarHBondContact O-OG1 3.06Å
445	Y	94.4	Very high	94.9	Very high	162 Å²	162	97.5 Å²	97.5	64%	0.635	49%	0.489	S	S	*	.	H	α-helix	trans	-56.9	-46.3	173.6	174.5	-97.9	0	0	0	111.8	L441 I447 T448 C449	L441-Y445 WeakPolarHBondContact O-CB 3.3Å; L441-Y445 PolarHBondContact O-N 3.49Å; Y445-I447 VanDerWaalsContact C-N 3.33Å; Y445-I447 PolarHBondContact O-N 3.46Å; Y445-T448 PolarHBondContact O-N 2.8Å; Y445-C449 VanDerWaalsContact CE1-SG 3.59Å; Y445-C449 WeakPolarHBondContact O-CB 3.42Å; Y445-C449 PolarHBondContact O-N 3.37Å; Y445-C449 PolarHBondContact O-SG 2.88Å
446	Q	96.2	Very high	94.8	Very high	115 Å²	115	97.5 Å²	97.5	54%	0.537	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-35.4	178.7	-170.5	61	33.6	0	0	113	E442 R443 C444 S450	E442-Q446 WeakPolarHBondContact O-CB 3.31Å; E442-Q446 PolarHBondContact O-N 3.36Å; R443-Q446 PolarHBondContact O-N 3.48Å; C444-Q446 VanDerWaalsContact C-N 3.34Å; C444-Q446 PolarHBondContact O-N 3.14Å; Q446-S450 PolarHBondContact O-N 3.04Å; Q446-S450 VanDerWaalsContact O-N 3.1Å; Q446-S450 PolarHBondContact O-OG 3.46Å
447	I	95.8	Very high	94.8	Very high	85 Å²	85	94.4 Å²	94.4	44%	0.436	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-53.1	172.7	-68.6	163.7	0	0	0	109.7	R443 C444 Y445 C449 S450 E451	R443-I447 HydrophobicContact CG-CD1 4.39Å; R443-I447 WeakPolarHBondContact O-CG1 3.43Å; R443-I447 PolarHBondContact O-N 2.97Å; C444-I447 PolarHBondContact O-N 2.92Å; Y445-I447 VanDerWaalsContact C-N 3.33Å; Y445-I447 PolarHBondContact O-N 3.46Å; I447-C449 VanDerWaalsContact C-N 3.29Å; I447-C449 PolarHBondContact O-N 3.21Å; I447-S450 CarbonylContact O-C 3.52Å; I447-S450 WeakPolarHBondContact O-CA 3.33Å; I447-S450 VanDerWaalsContact O-CB 3.31Å; I447-S450 WeakPolarHBondContact O-CB 3.33Å; I447-S450 PolarHBondContact O-N 2.84Å; I447-E451 HydrophobicContact CG2-CG 4.34Å; I447-E451 WeakPolarHBondContact O-CG 3.44Å; I447-E451 PolarHBondContact O-N 3.08Å
448	T	93.8	Very high	94.8	Very high	84 Å²	84	96.9 Å²	96.9	52%	0.515	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-31.9	179.9	-58.8	0	0	0	0	113.2	C444 Y445 S450 E451 L452	C444-T448 PolarHBondContact O-N 3.33Å; C444-T448 PolarHBondContact O-OG1 3.06Å; Y445-T448 PolarHBondContact O-N 2.8Å; T448-S450 VanDerWaalsContact C-N 3.35Å; T448-E451 WeakPolarHBondContact CA-OE2 3.46Å; T448-L452 VanDerWaalsContact O-CB 3.25Å; T448-L452 WeakPolarHBondContact O-CB 3.38Å; T448-L452 PolarHBondContact O-N 2.88Å
449	C	95.1	Very high	94.8	Very high	40 Å²	40	99.3 Å²	99.3	27%	0.27	49%	0.49	S	S	.	.	H	α-helix	trans	-64	-39.3	169.7	-73	0	0	0	0	112.5	Y445 I447 L452 Q453	Y445-C449 VanDerWaalsContact CE1-SG 3.59Å; Y445-C449 WeakPolarHBondContact O-CB 3.42Å; Y445-C449 PolarHBondContact O-N 3.37Å; Y445-C449 PolarHBondContact O-SG 2.88Å; I447-C449 VanDerWaalsContact C-N 3.29Å; I447-C449 PolarHBondContact O-N 3.21Å; C449-L452 PolarHBondContact O-N 3.4Å; C449-Q453 WeakPolarHBondContact O-CB 3.23Å; C449-Q453 PolarHBondContact O-N 3.23Å
450	S	95.4	Very high	94.9	Very high	54 Å²	54	100.7 Å²	100.7	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-68.5	-44.9	177.2	-52.3	0	0	0	0	111.2	Q446 I447 T448 L452 Q453 E454	Q446-S450 PolarHBondContact O-N 3.04Å; Q446-S450 VanDerWaalsContact O-N 3.1Å; Q446-S450 PolarHBondContact O-OG 3.46Å; I447-S450 CarbonylContact O-C 3.52Å; I447-S450 WeakPolarHBondContact O-CA 3.33Å; I447-S450 VanDerWaalsContact O-CB 3.31Å; I447-S450 WeakPolarHBondContact O-CB 3.33Å; I447-S450 PolarHBondContact O-N 2.84Å; T448-S450 VanDerWaalsContact C-N 3.35Å; S450-L452 VanDerWaalsContact C-N 3.34Å; S450-L452 PolarHBondContact O-N 2.96Å; S450-Q453 WeakPolarHBondContact O-CB 3.38Å; S450-Q453 PolarHBondContact O-N 3.02Å; S450-Q453 VanDerWaalsContact O-N 3.14Å; S450-E454 PolarHBondContact O-N 2.95Å
451	E	94.9	Very high	94.8	Very high	107 Å²	107	100.7 Å²	100.7	50%	0.5	50%	0.496	S	S	.	.	H	α-helix	trans	-59.1	-43.4	173.4	-66.9	172.4	148.5	0	0	111.6	I447 T448 Q453 E454 V455	I447-E451 HydrophobicContact CG2-CG 4.34Å; I447-E451 WeakPolarHBondContact O-CG 3.44Å; I447-E451 PolarHBondContact O-N 3.08Å; T448-E451 WeakPolarHBondContact CA-OE2 3.46Å; E451-Q453 VanDerWaalsContact C-N 3.32Å; E451-Q453 PolarHBondContact O-N 3.46Å; E451-E454 PolarHBondContact O-N 2.95Å; E451-V455 WeakPolarHBondContact O-CG2 3.16Å; E451-V455 PolarHBondContact O-N 3.46Å
452	L	93.3	Very high	94.9	Very high	90 Å²	90	100 Å²	100	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-64.3	-35.5	175.6	179	61.6	0	0	0	112.2	T448 C449 S450 K456	T448-L452 VanDerWaalsContact O-CB 3.25Å; T448-L452 WeakPolarHBondContact O-CB 3.38Å; T448-L452 PolarHBondContact O-N 2.88Å; C449-L452 PolarHBondContact O-N 3.4Å; S450-L452 VanDerWaalsContact C-N 3.34Å; S450-L452 PolarHBondContact O-N 2.96Å; L452-K456 HydrophobicContact CG-CD 4.36Å; L452-K456 WeakPolarHBondContact O-CB 3.41Å; L452-K456 VanDerWaalsContact O-CG 3.23Å; L452-K456 WeakPolarHBondContact O-CG 3.39Å; L452-K456 PolarHBondContact O-N 2.62Å
453	Q	93.6	Very high	94.9	Very high	125 Å²	125	100.5 Å²	100.5	58%	0.584	49%	0.494	S	S	*	.	H	α-helix	trans	-68.8	-41.6	174.5	-174.6	170.2	-8.5	0	0	111.4	C449 S450 E451 K456 A457	C449-Q453 WeakPolarHBondContact O-CB 3.23Å; C449-Q453 PolarHBondContact O-N 3.23Å; S450-Q453 WeakPolarHBondContact O-CB 3.38Å; S450-Q453 PolarHBondContact O-N 3.02Å; S450-Q453 VanDerWaalsContact O-N 3.14Å; E451-Q453 VanDerWaalsContact C-N 3.32Å; E451-Q453 PolarHBondContact O-N 3.46Å; Q453-K456 PolarHBondContact O-N 2.99Å; Q453-A457 WeakPolarHBondContact O-CB 3.42Å; Q453-A457 PolarHBondContact O-N 2.89Å
454	E	94.5	Very high	94.8	Very high	103 Å²	103	100.8 Å²	100.8	48%	0.481	50%	0.499	S	S	.	.	H	α-helix	trans	-60.6	-47	171.1	-81.7	-160.3	-139	0	0	112.4	S450 E451 K456 A457 R458	S450-E454 PolarHBondContact O-N 2.95Å; E451-E454 PolarHBondContact O-N 2.95Å; E454-K456 VanDerWaalsContact C-N 3.31Å; E454-K456 PolarHBondContact O-N 3.22Å; E454-A457 WeakPolarHBondContact O-CB 3.47Å; E454-A457 PolarHBondContact O-N 3.05Å; E454-A457 VanDerWaalsContact O-N 3.11Å; E454-R458 WeakPolarHBondContact O-CB 3.2Å; E454-R458 VanDerWaalsContact O-CG 3.27Å; E454-R458 WeakPolarHBondContact O-CG 3.24Å; E454-R458 PolarHBondContact O-N 3.07Å; E454-R458 IonicContact OE2-CZ 3.8Å; E454-R458 IonicContact OE2-NE 2.69Å; E454-R458 IonicContact OE2-NH2 2.65Å; E454-R458 PolarHBondContact OE2-NH2 3.39Å
455	V	94.4	Very high	94.6	Very high	89 Å²	89	102.5 Å²	102.5	54%	0.539	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-39.6	178.2	170.4	0	0	0	0	111	E451 R459	E451-V455 WeakPolarHBondContact O-CG2 3.16Å; E451-V455 PolarHBondContact O-N 3.46Å; V455-R459 VanDerWaalsContact O-CB 3.25Å; V455-R459 WeakPolarHBondContact O-CB 3.31Å; V455-R459 PolarHBondContact O-N 3.15Å
456	K	94.4	Very high	94.7	Very high	117 Å²	117	99.5 Å²	99.5	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-43.3	171.5	-76.4	167.8	-179.4	173.2	0	111.9	L452 Q453 E454 N460	L452-K456 HydrophobicContact CG-CD 4.36Å; L452-K456 WeakPolarHBondContact O-CB 3.41Å; L452-K456 VanDerWaalsContact O-CG 3.23Å; L452-K456 WeakPolarHBondContact O-CG 3.39Å; L452-K456 PolarHBondContact O-N 2.62Å; Q453-K456 PolarHBondContact O-N 2.99Å; E454-K456 VanDerWaalsContact C-N 3.31Å; E454-K456 PolarHBondContact O-N 3.22Å; K456-N460 WeakPolarHBondContact O-CB 3.32Å; K456-N460 PolarHBondContact O-N 2.81Å; K456-N460 PolarHBondContact O-ND2 3.46Å; K456-N460 PolarHBondContact O-OD1 3.5Å
457	A	94.8	Very high	94.6	Very high	51 Å²	51	96.7 Å²	96.7	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-50.9	177	0	0	0	0	0	111.7	Q453 E454 R459 N460 T461	Q453-A457 WeakPolarHBondContact O-CB 3.42Å; Q453-A457 PolarHBondContact O-N 2.89Å; E454-A457 WeakPolarHBondContact O-CB 3.47Å; E454-A457 PolarHBondContact O-N 3.05Å; E454-A457 VanDerWaalsContact O-N 3.11Å; A457-R459 VanDerWaalsContact C-N 3.32Å; A457-R459 PolarHBondContact O-N 2.86Å; A457-N460 WeakPolarHBondContact O-CB 3.49Å; A457-N460 PolarHBondContact O-N 3.23Å; A457-T461 PolarHBondContact O-N 3.33Å; A457-T461 PolarHBondContact O-OG1 3.4Å
458	R	96.2	Very high	94.5	Very high	156 Å²	156	98.4 Å²	98.4	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-56	-44.4	176.1	-66	171.4	-167	-155	8.3	111.6	E454 N460 T461 L462	E454-R458 WeakPolarHBondContact O-CB 3.2Å; E454-R458 VanDerWaalsContact O-CG 3.27Å; E454-R458 WeakPolarHBondContact O-CG 3.24Å; E454-R458 PolarHBondContact O-N 3.07Å; E454-R458 IonicContact OE2-CZ 3.8Å; E454-R458 IonicContact OE2-NE 2.69Å; E454-R458 IonicContact OE2-NH2 2.65Å; E454-R458 PolarHBondContact OE2-NH2 3.39Å; R458-N460 VanDerWaalsContact C-N 3.35Å; R458-N460 PolarHBondContact O-N 2.88Å; R458-T461 PolarHBondContact O-N 3.09Å; R458-L462 WeakPolarHBondContact O-CG 3.45Å; R458-L462 PolarHBondContact O-N 2.9Å
459	R	94.6	Very high	94.5	Very high	165 Å²	165	98.8 Å²	98.8	62%	0.623	48%	0.483	S	S	*	.	H	α-helix	trans	-59.7	-42	173.9	-172.4	-151.2	73.2	141	4	112.1	V455 A457 H463	V455-R459 VanDerWaalsContact O-CB 3.25Å; V455-R459 WeakPolarHBondContact O-CB 3.31Å; V455-R459 PolarHBondContact O-N 3.15Å; A457-R459 VanDerWaalsContact C-N 3.32Å; A457-R459 PolarHBondContact O-N 2.86Å; R459-H463 WeakPolarHBondContact O-CB 3.48Å; R459-H463 PolarHBondContact O-N 3.4Å
460	N	94.7	Very high	94.4	Very high	74 Å²	74	100 Å²	100	40%	0.396	49%	0.49	S	S	.	.	H	α-helix	trans	-68.3	-36.4	179.2	-67.5	-9.3	0	0	0	111.8	K456 A457 R458 H463 K464	K456-N460 WeakPolarHBondContact O-CB 3.32Å; K456-N460 PolarHBondContact O-N 2.81Å; K456-N460 PolarHBondContact O-ND2 3.46Å; K456-N460 PolarHBondContact O-OD1 3.5Å; A457-N460 WeakPolarHBondContact O-CB 3.49Å; A457-N460 PolarHBondContact O-N 3.23Å; R458-N460 VanDerWaalsContact C-N 3.35Å; R458-N460 PolarHBondContact O-N 2.88Å; N460-H463 PolarHBondContact O-N 2.88Å; N460-K464 WeakPolarHBondContact O-CG 3.49Å; N460-K464 PolarHBondContact O-N 2.91Å; N460-K464 VanDerWaalsContact O-N 3.15Å
461	T	94.9	Very high	94.3	Very high	73 Å²	73	101.3 Å²	101.3	45%	0.448	49%	0.492	S	S	.	.	H	α-helix	trans	-64.7	-51	172.7	-52.1	0	0	0	0	111.1	A457 R458 H463 K464 E465	A457-T461 PolarHBondContact O-N 3.33Å; A457-T461 PolarHBondContact O-OG1 3.4Å; R458-T461 PolarHBondContact O-N 3.09Å; T461-H463 PolarHBondContact O-N 2.91Å; T461-K464 WeakPolarHBondContact O-CB 3.46Å; T461-K464 PolarHBondContact O-N 2.91Å; T461-E465 WeakPolarHBondContact CG2-OE1 3.31Å; T461-E465 WeakPolarHBondContact O-CG 3.45Å; T461-E465 PolarHBondContact O-N 3Å
462	L	94.1	Very high	94.2	Very high	110 Å²	110	100 Å²	100	58%	0.576	49%	0.489	S	S	*	.	H	α-helix	trans	-57.6	-33.8	175.8	-72.9	166	0	0	0	112.9	R458 K466	R458-L462 WeakPolarHBondContact O-CG 3.45Å; R458-L462 PolarHBondContact O-N 2.9Å; L462-K466 VanDerWaalsContact O-CB 3.3Å; L462-K466 WeakPolarHBondContact O-CB 3.4Å; L462-K466 PolarHBondContact O-N 3.42Å
463	H	93.6	Very high	94.1	Very high	108 Å²	108	102.9 Å²	102.9	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-47.9	174.7	-165.4	72.8	0	0	0	111.4	R459 N460 T461 E465 K466 D467	R459-H463 WeakPolarHBondContact O-CB 3.48Å; R459-H463 PolarHBondContact O-N 3.4Å; N460-H463 PolarHBondContact O-N 2.88Å; T461-H463 PolarHBondContact O-N 2.91Å; H463-E465 PolarHBondContact O-N 2.97Å; H463-K466 PolarHBondContact O-N 2.85Å; H463-D467 IonicContact CD2-OD2 2.63Å; H463-D467 PolarHBondContact CD2-OD2 3.2Å; H463-D467 IonicContact CG-OD2 3.03Å; H463-D467 IonicContact NE2-OD2 2.83Å; H463-D467 PolarHBondContact O-N 3.06Å
464	K	94.9	Very high	94	Very high	138 Å²	138	101.4 Å²	101.4	60%	0.6	49%	0.488	S	S	*	.	H	α-helix	trans	-60.1	-44.4	174.7	-69.6	176.9	177.8	-173.3	0	112	N460 T461 K466 D467 H468	N460-K464 WeakPolarHBondContact O-CG 3.49Å; N460-K464 PolarHBondContact O-N 2.91Å; N460-K464 VanDerWaalsContact O-N 3.15Å; T461-K464 WeakPolarHBondContact O-CB 3.46Å; T461-K464 PolarHBondContact O-N 2.91Å; K464-K466 VanDerWaalsContact C-N 3.34Å; K464-K466 PolarHBondContact O-N 3.38Å; K464-D467 PolarHBondContact O-N 3.31Å; K464-D467 VanDerWaalsContact O-N 3.14Å; K464-H468 PolarHBondContact O-CD2 3.43Å; K464-H468 PolarHBondContact O-N 2.86Å
465	E	93.9	Very high	93.9	Very high	107 Å²	107	101.9 Å²	101.9	50%	0.5	49%	0.49	S	S	.	.	H	α-helix	trans	-59.7	-43.9	176	-71.3	168.9	-176.9	0	0	111.6	T461 H463 D467 H468 L469	T461-E465 WeakPolarHBondContact CG2-OE1 3.31Å; T461-E465 WeakPolarHBondContact O-CG 3.45Å; T461-E465 PolarHBondContact O-N 3Å; H463-E465 PolarHBondContact O-N 2.97Å; E465-D467 VanDerWaalsContact C-N 3.34Å; E465-D467 PolarHBondContact O-N 3.36Å; E465-H468 PolarHBondContact O-N 3.32Å; E465-L469 WeakPolarHBondContact O-CB 3.23Å; E465-L469 PolarHBondContact O-N 3.11Å
466	K	95.4	Very high	93.8	Very high	98 Å²	98	102.3 Å²	102.3	43%	0.426	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-37.4	173.7	-177	-112.4	59.9	178.9	0	111.9	L462 H463 K464 V470	L462-K466 VanDerWaalsContact O-CB 3.3Å; L462-K466 WeakPolarHBondContact O-CB 3.4Å; L462-K466 PolarHBondContact O-N 3.42Å; H463-K466 PolarHBondContact O-N 2.85Å; K464-K466 VanDerWaalsContact C-N 3.34Å; K464-K466 PolarHBondContact O-N 3.38Å; K466-V470 WeakPolarHBondContact O-CB 3.43Å; K466-V470 VanDerWaalsContact O-CG2 3.27Å; K466-V470 WeakPolarHBondContact O-CG2 3.34Å; K466-V470 PolarHBondContact O-N 2.96Å
467	D	93.5	Very high	93.6	Very high	56 Å²	56	102.6 Å²	102.6	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-69.8	-42	176	-71.6	-39.6	0	0	0	111.7	H463 K464 E465 V470 N471	H463-D467 IonicContact CD2-OD2 2.63Å; H463-D467 PolarHBondContact CD2-OD2 3.2Å; H463-D467 IonicContact CG-OD2 3.03Å; H463-D467 IonicContact NE2-OD2 2.83Å; H463-D467 PolarHBondContact O-N 3.06Å; K464-D467 PolarHBondContact O-N 3.31Å; K464-D467 VanDerWaalsContact O-N 3.14Å; E465-D467 VanDerWaalsContact C-N 3.34Å; E465-D467 PolarHBondContact O-N 3.36Å; D467-V470 PolarHBondContact O-N 3.22Å; D467-N471 PolarHBondContact O-N 3.43Å; D467-N471 PolarHBondContact O-ND2 3.42Å
468	H	94.1	Very high	93.4	Very high	121 Å²	121	105.3 Å²	105.3	56%	0.56	50%	0.496	S	S	*	.	H	α-helix	trans	-58.5	-49.6	172.4	-75.6	-63.1	0	0	0	110.9	K464 E465 V470 N471 D472	K464-H468 PolarHBondContact O-CD2 3.43Å; K464-H468 PolarHBondContact O-N 2.86Å; E465-H468 PolarHBondContact O-N 3.32Å; H468-V470 VanDerWaalsContact C-N 3.32Å; H468-V470 PolarHBondContact O-N 2.99Å; H468-N471 WeakPolarHBondContact O-CB 3.42Å; H468-N471 PolarHBondContact O-N 3.23Å; H468-N471 VanDerWaalsContact O-N 3.08Å; H468-D472 VanDerWaalsContact O-CG 3.3Å; H468-D472 PolarHBondContact O-N 2.92Å
469	L	93.9	Very high	93.2	Very high	92 Å²	92	103.4 Å²	103.4	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-61.3	-37.6	178.8	-175.5	62.3	0	0	0	112.8	E465 D472 Y473	E465-L469 WeakPolarHBondContact O-CB 3.23Å; E465-L469 PolarHBondContact O-N 3.11Å; L469-D472 PolarHBondContact O-N 3.45Å; L469-Y473 HydrophobicContact CD1-CD2 4.08Å; L469-Y473 HydrophobicContact CD1-CE2 3.6Å; L469-Y473 HydrophobicContact CD2-CE2 4.1Å; L469-Y473 HydrophobicContact CG-CD2 3.91Å; L469-Y473 HydrophobicContact CG-CE2 3.6Å; L469-Y473 WeakPolarHBondContact O-CD2 3.21Å; L469-Y473 PolarHBondContact O-N 3.14Å
470	V	93.4	Very high	93	Very high	67 Å²	67	99.3 Å²	99.3	41%	0.406	49%	0.487	S	S	.	.	H	α-helix	trans	-65.5	-43.6	172.8	166.9	0	0	0	0	111.4	K466 D467 H468 D472 Y473 E474	K466-V470 WeakPolarHBondContact O-CB 3.43Å; K466-V470 VanDerWaalsContact O-CG2 3.27Å; K466-V470 WeakPolarHBondContact O-CG2 3.34Å; K466-V470 PolarHBondContact O-N 2.96Å; D467-V470 PolarHBondContact O-N 3.22Å; H468-V470 VanDerWaalsContact C-N 3.32Å; H468-V470 PolarHBondContact O-N 2.99Å; V470-D472 VanDerWaalsContact C-N 3.33Å; V470-D472 PolarHBondContact O-N 2.9Å; V470-Y473 PolarHBondContact O-N 2.99Å; V470-E474 PolarHBondContact O-N 2.97Å
471	N	92.9	Very high	92.7	Very high	80 Å²	80	101.7 Å²	101.7	43%	0.428	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-38.9	175.6	-77.8	-66.2	0	0	0	112.2	D467 H468 E474 Q475	D467-N471 PolarHBondContact O-N 3.43Å; D467-N471 PolarHBondContact O-ND2 3.42Å; H468-N471 WeakPolarHBondContact O-CB 3.42Å; H468-N471 PolarHBondContact O-N 3.23Å; H468-N471 VanDerWaalsContact O-N 3.08Å; N471-E474 PolarHBondContact O-N 3.4Å; N471-Q475 WeakPolarHBondContact O-CB 3.28Å; N471-Q475 WeakPolarHBondContact O-CG 3.48Å; N471-Q475 PolarHBondContact O-N 2.86Å
472	D	92.7	Very high	92.5	Very high	79 Å²	79	102.5 Å²	102.5	42%	0.422	50%	0.501	S	S	.	.	H	α-helix	trans	-68.4	-41.1	177.1	-67.4	-17.2	0	0	0	111.1	H468 L469 V470 Q475 N476	H468-D472 VanDerWaalsContact O-CG 3.3Å; H468-D472 PolarHBondContact O-N 2.92Å; L469-D472 PolarHBondContact O-N 3.45Å; V470-D472 VanDerWaalsContact C-N 3.33Å; V470-D472 PolarHBondContact O-N 2.9Å; D472-Q475 PolarHBondContact O-N 3.3Å; D472-N476 WeakPolarHBondContact O-CB 3.48Å; D472-N476 PolarHBondContact O-N 2.82Å; D472-N476 PolarHBondContact O-ND2 2.95Å
473	Y	90.7	Very high	92.4	Very high	151 Å²	151	103.1 Å²	103.1	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-64.1	-41	171.6	-79	-54.1	0	0	0	112.3	L469 V470 N476 M477	L469-Y473 HydrophobicContact CD1-CD2 4.08Å; L469-Y473 HydrophobicContact CD1-CE2 3.6Å; L469-Y473 HydrophobicContact CD2-CE2 4.1Å; L469-Y473 HydrophobicContact CG-CD2 3.91Å; L469-Y473 HydrophobicContact CG-CE2 3.6Å; L469-Y473 WeakPolarHBondContact O-CD2 3.21Å; L469-Y473 PolarHBondContact O-N 3.14Å; V470-Y473 PolarHBondContact O-N 2.99Å; Y473-N476 PolarHBondContact O-N 2.9Å; Y473-M477 WeakPolarHBondContact O-CB 3.36Å; Y473-M477 WeakPolarHBondContact O-CG 3.31Å; Y473-M477 PolarHBondContact O-N 2.8Å
474	E	92.8	Very high	92.2	Very high	95 Å²	95	104.6 Å²	104.6	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-42.1	173.4	-87.3	-161.6	-149.4	0	0	112.4	V470 N471 M477 K478	V470-E474 PolarHBondContact O-N 2.97Å; N471-E474 PolarHBondContact O-N 3.4Å; E474-M477 PolarHBondContact O-N 3.45Å; E474-K478 WeakPolarHBondContact O-CB 3.36Å; E474-K478 VanDerWaalsContact O-CD 3.31Å; E474-K478 WeakPolarHBondContact O-CD 3.35Å; E474-K478 WeakPolarHBondContact O-CG 3.42Å; E474-K478 PolarHBondContact O-N 3.48Å; E474-K478 WeakPolarHBondContact OE2-CE 3.33Å; E474-K478 IonicContact OE2-NZ 3.71Å; E474-K478 PolarHBondContact OE2-NZ 2.84Å
475	Q	92.2	Very high	92	Very high	113 Å²	113	101.7 Å²	101.7	53%	0.528	49%	0.492	S	S	.	.	H	α-helix	trans	-64.9	-44.6	176.1	-76.5	178.8	61.7	0	0	111.5	N471 D472 M477 K478 L479	N471-Q475 WeakPolarHBondContact O-CB 3.28Å; N471-Q475 WeakPolarHBondContact O-CG 3.48Å; N471-Q475 PolarHBondContact O-N 2.86Å; D472-Q475 PolarHBondContact O-N 3.3Å; Q475-M477 VanDerWaalsContact C-N 3.34Å; Q475-M477 PolarHBondContact O-N 3.41Å; Q475-K478 PolarHBondContact O-N 2.67Å; Q475-L479 WeakPolarHBondContact O-CB 3.43Å; Q475-L479 WeakPolarHBondContact O-CG 3.45Å; Q475-L479 PolarHBondContact O-N 3.05Å
476	N	92.4	Very high	91.8	Very high	98 Å²	98	99.1 Å²	99.1	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-61.7	-40.2	175.2	-78.3	-63	0	0	0	112.1	D472 Y473 L479 L480	D472-N476 WeakPolarHBondContact O-CB 3.48Å; D472-N476 PolarHBondContact O-N 2.82Å; D472-N476 PolarHBondContact O-ND2 2.95Å; Y473-N476 PolarHBondContact O-N 2.9Å; N476-L479 PolarHBondContact O-N 2.93Å; N476-L480 VanDerWaalsContact O-CB 3.28Å; N476-L480 WeakPolarHBondContact O-CB 3.44Å; N476-L480 PolarHBondContact O-N 3.27Å
477	M	90	Very high	91.5	Very high	122 Å²	122	98 Å²	98	60%	0.601	49%	0.487	S	S	*	.	H	α-helix	trans	-64.8	-41.8	173.6	-75.5	-61.7	-61.9	0	0	112.3	Y473 E474 Q475 L480 Q481	Y473-M477 WeakPolarHBondContact O-CB 3.36Å; Y473-M477 WeakPolarHBondContact O-CG 3.31Å; Y473-M477 PolarHBondContact O-N 2.8Å; E474-M477 PolarHBondContact O-N 3.45Å; Q475-M477 VanDerWaalsContact C-N 3.34Å; Q475-M477 PolarHBondContact O-N 3.41Å; M477-L480 PolarHBondContact O-N 3.35Å; M477-Q481 VanDerWaalsContact O-CB 3.32Å; M477-Q481 WeakPolarHBondContact O-CB 3.36Å; M477-Q481 PolarHBondContact O-N 2.85Å
478	K	90.8	Very high	91.2	Very high	109 Å²	109	99.2 Å²	99.2	47%	0.474	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-39.5	176	-71.1	159.9	-166.5	167.1	0	111.8	E474 Q475 T482	E474-K478 WeakPolarHBondContact O-CB 3.36Å; E474-K478 VanDerWaalsContact O-CD 3.31Å; E474-K478 WeakPolarHBondContact O-CD 3.35Å; E474-K478 WeakPolarHBondContact O-CG 3.42Å; E474-K478 PolarHBondContact O-N 3.48Å; E474-K478 WeakPolarHBondContact OE2-CE 3.33Å; E474-K478 IonicContact OE2-NZ 3.71Å; E474-K478 PolarHBondContact OE2-NZ 2.84Å; Q475-K478 PolarHBondContact O-N 2.67Å; K478-T482 WeakPolarHBondContact O-CB 3.18Å; K478-T482 PolarHBondContact O-N 3.41Å; K478-T482 PolarHBondContact O-OG1 3.32Å
479	L	92.2	Very high	90.9	Very high	115 Å²	115	97.4 Å²	97.4	60%	0.602	49%	0.488	S	S	*	.	H	α-helix	trans	-65.1	-45.1	173.4	-73.9	169.4	0	0	0	111.7	Q475 N476 T482 K483	Q475-L479 WeakPolarHBondContact O-CB 3.43Å; Q475-L479 WeakPolarHBondContact O-CG 3.45Å; Q475-L479 PolarHBondContact O-N 3.05Å; N476-L479 PolarHBondContact O-N 2.93Å; L479-T482 PolarHBondContact O-N 3.26Å; L479-K483 PolarHBondContact O-N 3.02Å
480	L	89.7	Confident	90.7	Very high	79 Å²	79	97.5 Å²	97.5	41%	0.414	49%	0.488	S	S	.	.	H	α-helix	trans	-64.8	-41	177.9	-173.9	66.1	0	0	0	111.6	N476 M477 K483 Y484	N476-L480 VanDerWaalsContact O-CB 3.28Å; N476-L480 WeakPolarHBondContact O-CB 3.44Å; N476-L480 PolarHBondContact O-N 3.27Å; M477-L480 PolarHBondContact O-N 3.35Å; L480-K483 WeakPolarHBondContact O-CB 3.41Å; L480-K483 PolarHBondContact O-N 3.29Å; L480-Y484 HydrophobicContact CD1-CD2 4.46Å; L480-Y484 HydrophobicContact CD1-CE2 3.95Å; L480-Y484 HydrophobicContact CD2-CE2 4.04Å; L480-Y484 HydrophobicContact CG-CD2 4.02Å; L480-Y484 HydrophobicContact CG-CE2 3.64Å; L480-Y484 VanDerWaalsContact O-CD2 3.24Å; L480-Y484 WeakPolarHBondContact O-CD2 3.27Å; L480-Y484 PolarHBondContact O-N 3.3Å
481	Q	88.7	Confident	90.4	Very high	124 Å²	124	98.6 Å²	98.6	58%	0.579	49%	0.491	S	S	*	.	H	α-helix	trans	-63.3	-47.2	172.8	-177.7	172.7	-5.3	0	0	111.5	M477 K483 Y484 D485	M477-Q481 VanDerWaalsContact O-CB 3.32Å; M477-Q481 WeakPolarHBondContact O-CB 3.36Å; M477-Q481 PolarHBondContact O-N 2.85Å; Q481-K483 PolarHBondContact O-N 3.43Å; Q481-Y484 PolarHBondContact O-N 2.86Å; Q481-Y484 VanDerWaalsContact O-N 3.08Å; Q481-D485 PolarHBondContact O-N 2.94Å
482	T	90.8	Very high	90	Very high	91 Å²	91	100.4 Å²	100.4	56%	0.558	50%	0.495	S	S	*	.	H	α-helix	trans	-57.4	-37.4	175.3	-56.1	0	0	0	0	111.3	K478 L479 A486	K478-T482 WeakPolarHBondContact O-CB 3.18Å; K478-T482 PolarHBondContact O-N 3.41Å; K478-T482 PolarHBondContact O-OG1 3.32Å; L479-T482 PolarHBondContact O-N 3.26Å; T482-A486 WeakPolarHBondContact O-CB 3.28Å; T482-A486 PolarHBondContact O-N 2.88Å
483	K	92.1	Very high	89.6	Confident	123 Å²	123	102.7 Å²	102.7	54%	0.535	50%	0.503	S	S	.	.	H	α-helix	trans	-67	-47.6	173.8	-164.4	-158.2	171.1	-159.4	0	111.8	L479 L480 Q481 D485 A486 D487	L479-K483 PolarHBondContact O-N 3.02Å; L480-K483 WeakPolarHBondContact O-CB 3.41Å; L480-K483 PolarHBondContact O-N 3.29Å; Q481-K483 PolarHBondContact O-N 3.43Å; K483-D485 VanDerWaalsContact C-N 3.31Å; K483-D485 PolarHBondContact O-N 3.4Å; K483-A486 CarbonylContact O-C 3.54Å; K483-A486 WeakPolarHBondContact O-CB 3.5Å; K483-A486 PolarHBondContact O-N 3.02Å; K483-A486 VanDerWaalsContact O-N 3.12Å; K483-D487 WeakPolarHBondContact CE-OD2 3.48Å; K483-D487 IonicContact NZ-OD2 3.2Å; K483-D487 WeakPolarHBondContact O-CB 3.27Å; K483-D487 VanDerWaalsContact O-CG 3.3Å; K483-D487 PolarHBondContact O-N 3.23Å
484	Y	88.9	Confident	89.3	Confident	139 Å²	139	100.3 Å²	100.3	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-60.2	-40.3	175.9	-77.4	-55.6	0	0	0	112.3	L480 Q481 A486 D487 I488	L480-Y484 HydrophobicContact CD1-CD2 4.46Å; L480-Y484 HydrophobicContact CD1-CE2 3.95Å; L480-Y484 HydrophobicContact CD2-CE2 4.04Å; L480-Y484 HydrophobicContact CG-CD2 4.02Å; L480-Y484 HydrophobicContact CG-CE2 3.64Å; L480-Y484 VanDerWaalsContact O-CD2 3.24Å; L480-Y484 WeakPolarHBondContact O-CD2 3.27Å; L480-Y484 PolarHBondContact O-N 3.3Å; Q481-Y484 PolarHBondContact O-N 2.86Å; Q481-Y484 VanDerWaalsContact O-N 3.08Å; Y484-A486 VanDerWaalsContact C-N 3.33Å; Y484-A486 PolarHBondContact O-N 3.27Å; Y484-D487 PolarHBondContact O-N 2.99Å; Y484-I488 VanDerWaalsContact O-CB 3.23Å; Y484-I488 WeakPolarHBondContact O-CB 3.47Å; Y484-I488 WeakPolarHBondContact O-CD1 3.43Å; Y484-I488 WeakPolarHBondContact O-CG1 3.27Å; Y484-I488 PolarHBondContact O-N 2.89Å
485	D	90.5	Very high	88.9	Confident	77 Å²	77	101.5 Å²	101.5	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-64	-38	174.4	-74.2	-41.1	0	0	0	111.7	Q481 K483 N489	Q481-D485 PolarHBondContact O-N 2.94Å; K483-D485 VanDerWaalsContact C-N 3.31Å; K483-D485 PolarHBondContact O-N 3.4Å; D485-N489 VanDerWaalsContact O-CB 3.3Å; D485-N489 WeakPolarHBondContact O-CB 3.37Å; D485-N489 PolarHBondContact O-N 2.97Å; D485-N489 PolarHBondContact O-ND2 2.91Å
486	A	89.4	Confident	88.5	Confident	53 Å²	53	99 Å²	99	44%	0.438	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-46.8	173.3	0	0	0	0	0	112.5	T482 K483 Y484 I488 N489 L490	T482-A486 WeakPolarHBondContact O-CB 3.28Å; T482-A486 PolarHBondContact O-N 2.88Å; K483-A486 CarbonylContact O-C 3.54Å; K483-A486 WeakPolarHBondContact O-CB 3.5Å; K483-A486 PolarHBondContact O-N 3.02Å; K483-A486 VanDerWaalsContact O-N 3.12Å; Y484-A486 VanDerWaalsContact C-N 3.33Å; Y484-A486 PolarHBondContact O-N 3.27Å; A486-I488 VanDerWaalsContact C-N 3.33Å; A486-I488 PolarHBondContact O-N 2.89Å; A486-N489 PolarHBondContact O-N 2.84Å; A486-N489 VanDerWaalsContact O-N 3.14Å; A486-L490 WeakPolarHBondContact O-CB 3.42Å; A486-L490 PolarHBondContact O-N 3.44Å
487	D	89	Confident	88.2	Confident	73 Å²	73	98.8 Å²	98.8	39%	0.39	50%	0.5	S	S	.	.	H	α-helix	trans	-61.6	-41	177.2	-68.1	-21.3	0	0	0	110.5	K483 Y484 L490 L491	K483-D487 WeakPolarHBondContact CE-OD2 3.48Å; K483-D487 IonicContact NZ-OD2 3.2Å; K483-D487 WeakPolarHBondContact O-CB 3.27Å; K483-D487 VanDerWaalsContact O-CG 3.3Å; K483-D487 PolarHBondContact O-N 3.23Å; Y484-D487 PolarHBondContact O-N 2.99Å; D487-L490 PolarHBondContact O-N 2.75Å; D487-L491 WeakPolarHBondContact O-CB 3.34Å; D487-L491 PolarHBondContact O-N 3.1Å
488	I	89	Confident	87.9	Confident	82 Å²	82	96.3 Å²	96.3	42%	0.421	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-40.4	173.2	-75.3	166.5	0	0	0	111.5	Y484 A486 L491 K492	Y484-I488 VanDerWaalsContact O-CB 3.23Å; Y484-I488 WeakPolarHBondContact O-CB 3.47Å; Y484-I488 WeakPolarHBondContact O-CD1 3.43Å; Y484-I488 WeakPolarHBondContact O-CG1 3.27Å; Y484-I488 PolarHBondContact O-N 2.89Å; A486-I488 VanDerWaalsContact C-N 3.33Å; A486-I488 PolarHBondContact O-N 2.89Å; I488-L491 PolarHBondContact O-N 3.16Å; I488-K492 HydrophobicContact CG2-CD 4.43Å; I488-K492 VanDerWaalsContact CG2-CE 3.45Å; I488-K492 VanDerWaalsContact O-CG 3.3Å; I488-K492 WeakPolarHBondContact O-CG 3.36Å; I488-K492 PolarHBondContact O-N 2.86Å
489	N	87.9	Confident	87.5	Confident	84 Å²	84	94 Å²	94	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-73.5	-33.5	178.9	-71.3	-29.6	0	0	0	112.4	D485 A486 K492 Q493	D485-N489 VanDerWaalsContact O-CB 3.3Å; D485-N489 WeakPolarHBondContact O-CB 3.37Å; D485-N489 PolarHBondContact O-N 2.97Å; D485-N489 PolarHBondContact O-ND2 2.91Å; A486-N489 PolarHBondContact O-N 2.84Å; A486-N489 VanDerWaalsContact O-N 3.14Å; N489-K492 PolarHBondContact O-N 2.79Å; N489-K492 PolarHBondContact OD1-NZ 3.07Å; N489-Q493 WeakPolarHBondContact O-CB 3.26Å; N489-Q493 PolarHBondContact O-N 3.01Å
490	L	89.2	Confident	87.1	Confident	93 Å²	93	92.1 Å²	92.1	49%	0.487	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-46.1	169.2	-176.8	143.6	0	0	0	110.6	A486 D487 K492 Q493 E494	A486-L490 WeakPolarHBondContact O-CB 3.42Å; A486-L490 PolarHBondContact O-N 3.44Å; D487-L490 PolarHBondContact O-N 2.75Å; L490-K492 VanDerWaalsContact C-N 3.33Å; L490-K492 PolarHBondContact O-N 2.64Å; L490-Q493 CarbonylContact O-C 3.59Å; L490-Q493 WeakPolarHBondContact O-CA 3.44Å; L490-Q493 WeakPolarHBondContact O-CB 3.35Å; L490-Q493 PolarHBondContact O-N 3.36Å; L490-E494 HydrophobicContact CD2-CG 4.13Å; L490-E494 PolarHBondContact O-N 2.97Å
491	L	86.2	Confident	86.8	Confident	90 Å²	90	95.7 Å²	95.7	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-61.9	-38.4	176	-170.5	68.8	0	0	0	112.3	D487 I488 Q493 E494 H495	D487-L491 WeakPolarHBondContact O-CB 3.34Å; D487-L491 PolarHBondContact O-N 3.1Å; I488-L491 PolarHBondContact O-N 3.16Å; L491-Q493 VanDerWaalsContact C-N 3.33Å; L491-Q493 PolarHBondContact O-N 3.23Å; L491-E494 PolarHBondContact O-N 3.1Å; L491-H495 WeakPolarHBondContact O-CB 3.48Å; L491-H495 PolarHBondContact O-CD2 3.37Å; L491-H495 PolarHBondContact O-N 2.94Å
492	K	85.4	Confident	86.3	Confident	119 Å²	119	92.2 Å²	92.2	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-40.1	170.2	-71.4	168.6	-162.7	158.2	0	111.9	I488 N489 L490 H495 A496	I488-K492 HydrophobicContact CG2-CD 4.43Å; I488-K492 VanDerWaalsContact CG2-CE 3.45Å; I488-K492 VanDerWaalsContact O-CG 3.3Å; I488-K492 WeakPolarHBondContact O-CG 3.36Å; I488-K492 PolarHBondContact O-N 2.86Å; N489-K492 PolarHBondContact O-N 2.79Å; N489-K492 PolarHBondContact OD1-NZ 3.07Å; L490-K492 VanDerWaalsContact C-N 3.33Å; L490-K492 PolarHBondContact O-N 2.64Å; K492-H495 PolarHBondContact O-N 2.72Å; K492-A496 WeakPolarHBondContact O-CB 3.45Å; K492-A496 PolarHBondContact O-N 3.28Å
493	Q	84.6	Confident	85.8	Confident	126 Å²	126	91.1 Å²	91.1	59%	0.589	49%	0.493	S	S	*	.	H	α-helix	trans	-68.8	-39.6	177.8	-171.9	176.6	1.4	0	0	111.7	N489 L490 L491 A496 L497	N489-Q493 WeakPolarHBondContact O-CB 3.26Å; N489-Q493 PolarHBondContact O-N 3.01Å; L490-Q493 CarbonylContact O-C 3.59Å; L490-Q493 WeakPolarHBondContact O-CA 3.44Å; L490-Q493 WeakPolarHBondContact O-CB 3.35Å; L490-Q493 PolarHBondContact O-N 3.36Å; L491-Q493 VanDerWaalsContact C-N 3.33Å; L491-Q493 PolarHBondContact O-N 3.23Å; Q493-A496 PolarHBondContact O-N 3.24Å; Q493-L497 HydrophobicContact CG-CD1 4.24Å; Q493-L497 WeakPolarHBondContact O-CB 3.48Å; Q493-L497 VanDerWaalsContact O-CG 3.31Å; Q493-L497 WeakPolarHBondContact O-CG 3.3Å; Q493-L497 PolarHBondContact O-N 3.14Å
494	E	83.8	Confident	85.1	Confident	101 Å²	101	87.8 Å²	87.8	47%	0.472	49%	0.485	S	S	.	.	H	α-helix	trans	-65.7	-40.2	172.8	-70.7	-172.4	149.8	0	0	112.1	L490 L491 L497 S498	L490-E494 HydrophobicContact CD2-CG 4.13Å; L490-E494 PolarHBondContact O-N 2.97Å; L491-E494 PolarHBondContact O-N 3.1Å; E494-L497 PolarHBondContact O-N 2.82Å; E494-S498 VanDerWaalsContact O-CB 3.23Å; E494-S498 WeakPolarHBondContact O-CB 3.39Å; E494-S498 PolarHBondContact O-N 3.3Å; E494-S498 PolarHBondContact O-OG 3.17Å
495	H	83.5	Confident	84.7	Confident	120 Å²	120	86 Å²	86	56%	0.556	48%	0.483	S	S	*	.	H	α-helix	trans	-63	-41.6	170.7	-80.2	-56.4	0	0	0	112	L491 K492 S498 A499	L491-H495 WeakPolarHBondContact O-CB 3.48Å; L491-H495 PolarHBondContact O-CD2 3.37Å; L491-H495 PolarHBondContact O-N 2.94Å; K492-H495 PolarHBondContact O-N 2.72Å; H495-S498 PolarHBondContact O-N 2.81Å; H495-A499 VanDerWaalsContact O-CB 3.23Å; H495-A499 WeakPolarHBondContact O-CB 3.47Å; H495-A499 PolarHBondContact O-N 3.19Å
496	A	85.2	Confident	84	Confident	61 Å²	61	86.6 Å²	86.6	50%	0.504	49%	0.485	S	S	.	.	H	α-helix	trans	-65.6	-41.5	176.1	0	0	0	0	0	112.3	K492 Q493 A499 S500	K492-A496 WeakPolarHBondContact O-CB 3.45Å; K492-A496 PolarHBondContact O-N 3.28Å; Q493-A496 PolarHBondContact O-N 3.24Å; A496-A499 PolarHBondContact O-N 2.77Å; A496-S500 VanDerWaalsContact O-CB 3.26Å; A496-S500 WeakPolarHBondContact O-CB 3.49Å; A496-S500 PolarHBondContact O-N 3.32Å
497	L	85.9	Confident	83.6	Confident	94 Å²	94	89.4 Å²	89.4	49%	0.492	49%	0.49	S	S	.	.	H	α-helix	trans	-65.4	-37.6	173.5	-75.6	165.7	0	0	0	112.1	Q493 E494 S500 K501	Q493-L497 HydrophobicContact CG-CD1 4.24Å; Q493-L497 WeakPolarHBondContact O-CB 3.48Å; Q493-L497 VanDerWaalsContact O-CG 3.31Å; Q493-L497 WeakPolarHBondContact O-CG 3.3Å; Q493-L497 PolarHBondContact O-N 3.14Å; E494-L497 PolarHBondContact O-N 2.82Å; L497-S500 PolarHBondContact O-N 2.85Å; L497-K501 WeakPolarHBondContact O-CG 3.14Å; L497-K501 PolarHBondContact O-N 3.4Å
498	S	83.3	Confident	83.2	Confident	69 Å²	69	90.6 Å²	90.6	48%	0.483	49%	0.493	S	S	.	.	H	α-helix	trans	-72.7	-39	177.6	-58.7	0	0	0	0	111.8	E494 H495 K501 A502	E494-S498 VanDerWaalsContact O-CB 3.23Å; E494-S498 WeakPolarHBondContact O-CB 3.39Å; E494-S498 PolarHBondContact O-N 3.3Å; E494-S498 PolarHBondContact O-OG 3.17Å; H495-S498 PolarHBondContact O-N 2.81Å; S498-K501 PolarHBondContact O-N 3.45Å; S498-A502 WeakPolarHBondContact O-CB 3.4Å; S498-A502 PolarHBondContact O-N 2.9Å
499	A	82.1	Confident	82.6	Confident	61 Å²	61	91.1 Å²	91.1	50%	0.504	50%	0.496	S	S	.	.	H	α-helix	trans	-65.9	-37.7	171.5	0	0	0	0	0	111.6	H495 A496 A502 S503	H495-A499 VanDerWaalsContact O-CB 3.23Å; H495-A499 WeakPolarHBondContact O-CB 3.47Å; H495-A499 PolarHBondContact O-N 3.19Å; A496-A499 PolarHBondContact O-N 2.77Å; A499-A502 PolarHBondContact O-N 3.48Å; A499-S503 VanDerWaalsContact O-CB 3.3Å; A499-S503 WeakPolarHBondContact O-CB 3.17Å; A499-S503 PolarHBondContact O-N 2.87Å
500	S	83.6	Confident	82.2	Confident	75 Å²	75	92.8 Å²	92.8	52%	0.524	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-43.7	172.7	172.5	0	0	0	0	112	A496 L497 S503 S504	A496-S500 VanDerWaalsContact O-CB 3.26Å; A496-S500 WeakPolarHBondContact O-CB 3.49Å; A496-S500 PolarHBondContact O-N 3.32Å; L497-S500 PolarHBondContact O-N 2.85Å; S500-S503 WeakPolarHBondContact O-CB 3.27Å; S500-S503 PolarHBondContact O-N 2.88Å; S500-S504 PolarHBondContact O-N 3.4Å
501	K	83.1	Confident	81.6	Confident	155 Å²	155	93.8 Å²	93.8	67%	0.674	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-42.1	172.6	-74.3	172.2	-179.6	178.4	0	112.4	L497 S498 S503 S504 M505	L497-K501 WeakPolarHBondContact O-CG 3.14Å; L497-K501 PolarHBondContact O-N 3.4Å; S498-K501 PolarHBondContact O-N 3.45Å; K501-S503 VanDerWaalsContact C-N 3.33Å; K501-S504 PolarHBondContact O-N 3.15Å; K501-M505 WeakPolarHBondContact O-CB 3.49Å; K501-M505 PolarHBondContact O-N 3.08Å
502	A	79.2	Confident	81.2	Confident	50 Å²	50	93.4 Å²	93.4	41%	0.413	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-39	174.5	0	0	0	0	0	111.5	S498 A499 M505 I506	S498-A502 WeakPolarHBondContact O-CB 3.4Å; S498-A502 PolarHBondContact O-N 2.9Å; A499-A502 PolarHBondContact O-N 3.48Å; A502-M505 PolarHBondContact O-N 3.3Å; A502-I506 WeakPolarHBondContact O-CB 3.45Å; A502-I506 WeakPolarHBondContact O-CD1 3.35Å; A502-I506 VanDerWaalsContact O-CG1 3.23Å; A502-I506 WeakPolarHBondContact O-CG1 3.21Å; A502-I506 PolarHBondContact O-N 3.45Å
503	S	79.6	Confident	80.8	Confident	69 Å²	69	91 Å²	91	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-41.7	173.8	-163.9	0	0	0	0	111.7	A499 S500 K501 I506 E507	A499-S503 VanDerWaalsContact O-CB 3.3Å; A499-S503 WeakPolarHBondContact O-CB 3.17Å; A499-S503 PolarHBondContact O-N 2.87Å; S500-S503 WeakPolarHBondContact O-CB 3.27Å; S500-S503 PolarHBondContact O-N 2.88Å; K501-S503 VanDerWaalsContact C-N 3.33Å; S503-I506 CarbonylContact O-C 3.59Å; S503-I506 PolarHBondContact O-N 2.98Å; S503-E507 VanDerWaalsContact O-CB 3.28Å; S503-E507 WeakPolarHBondContact O-CB 3.42Å; S503-E507 PolarHBondContact O-N 3.35Å
504	S	77	Confident	80.4	Confident	53 Å²	53	88.3 Å²	88.3	37%	0.371	49%	0.491	S	S	.	.	H	α-helix	trans	-62.4	-41.7	173.7	-169	0	0	0	0	111.5	S500 K501 E507 E508	S500-S504 PolarHBondContact O-N 3.4Å; K501-S504 PolarHBondContact O-N 3.15Å; S504-E507 PolarHBondContact O-N 3.29Å; S504-E508 WeakPolarHBondContact O-CB 3.45Å; S504-E508 WeakPolarHBondContact O-CG 3.31Å; S504-E508 PolarHBondContact O-N 2.83Å
505	M	81.6	Confident	80	Confident	100 Å²	100	88.4 Å²	88.4	49%	0.493	49%	0.492	S	S	.	.	H	α-helix	trans	-66.7	-36.5	175.1	-170.7	73.2	-156.6	0	0	111.9	K501 A502 L509	K501-M505 WeakPolarHBondContact O-CB 3.49Å; K501-M505 PolarHBondContact O-N 3.08Å; A502-M505 PolarHBondContact O-N 3.3Å; M505-L509 HydrophobicContact CE-CD1 4.35Å; M505-L509 HydrophobicContact CE-CD2 4.48Å; M505-L509 HydrophobicContact CE-CG 4.26Å; M505-L509 HydrophobicContact CG-CD1 4.37Å; M505-L509 WeakPolarHBondContact O-CB 3.27Å; M505-L509 WeakPolarHBondContact O-CG 3.39Å; M505-L509 PolarHBondContact O-N 3.09Å
506	I	75.5	Confident	79.6	Confident	90 Å²	90	88 Å²	88	46%	0.462	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-43.2	172	-71.6	162.3	0	0	0	110	A502 S503 L509 E510	A502-I506 WeakPolarHBondContact O-CB 3.45Å; A502-I506 WeakPolarHBondContact O-CD1 3.35Å; A502-I506 VanDerWaalsContact O-CG1 3.23Å; A502-I506 WeakPolarHBondContact O-CG1 3.21Å; A502-I506 PolarHBondContact O-N 3.45Å; S503-I506 CarbonylContact O-C 3.59Å; S503-I506 PolarHBondContact O-N 2.98Å; I506-L509 CarbonylContact O-C 3.58Å; I506-L509 PolarHBondContact O-N 3.35Å; I506-L509 VanDerWaalsContact O-N 3.16Å; I506-E510 HydrophobicContact CG2-CG 4.26Å; I506-E510 WeakPolarHBondContact O-CB 3.45Å; I506-E510 WeakPolarHBondContact O-CG 3.19Å; I506-E510 PolarHBondContact O-N 2.86Å
507	E	80.8	Confident	78.9	Confident	113 Å²	113	90.8 Å²	90.8	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-66.3	-36.6	178.6	-167.5	166.7	-146	0	0	111.7	S503 S504 E510 Q511	S503-E507 VanDerWaalsContact O-CB 3.28Å; S503-E507 WeakPolarHBondContact O-CB 3.42Å; S503-E507 PolarHBondContact O-N 3.35Å; S504-E507 PolarHBondContact O-N 3.29Å; E507-E510 PolarHBondContact O-N 2.95Å; E507-Q511 WeakPolarHBondContact O-CB 3.45Å; E507-Q511 VanDerWaalsContact O-CG 3.31Å; E507-Q511 WeakPolarHBondContact O-CG 3.45Å; E507-Q511 PolarHBondContact O-N 3.38Å
508	E	80.2	Confident	78.3	Confident	97 Å²	97	91.4 Å²	91.4	45%	0.453	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-43.8	168	-76.4	173.7	-140.6	0	0	112	S504 E510 Q511 N512	S504-E508 WeakPolarHBondContact O-CB 3.45Å; S504-E508 WeakPolarHBondContact O-CG 3.31Å; S504-E508 PolarHBondContact O-N 2.83Å; E508-E510 VanDerWaalsContact C-N 3.33Å; E508-Q511 PolarHBondContact O-N 3.22Å; E508-N512 PolarHBondContact O-N 2.74Å; E508-N512 PolarHBondContact O-ND2 2.79Å
509	L	77.6	Confident	77.6	Confident	94 Å²	94	94 Å²	94	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-34.8	175.6	-73.7	168.1	0	0	0	111.9	M505 I506 N512 V513	M505-L509 HydrophobicContact CE-CD1 4.35Å; M505-L509 HydrophobicContact CE-CD2 4.48Å; M505-L509 HydrophobicContact CE-CG 4.26Å; M505-L509 HydrophobicContact CG-CD1 4.37Å; M505-L509 WeakPolarHBondContact O-CB 3.27Å; M505-L509 WeakPolarHBondContact O-CG 3.39Å; M505-L509 PolarHBondContact O-N 3.09Å; I506-L509 CarbonylContact O-C 3.58Å; I506-L509 PolarHBondContact O-N 3.35Å; I506-L509 VanDerWaalsContact O-N 3.16Å; L509-N512 PolarHBondContact O-N 2.94Å; L509-V513 WeakPolarHBondContact O-CB 3.41Å; L509-V513 VanDerWaalsContact O-CG2 3.31Å; L509-V513 WeakPolarHBondContact O-CG2 3.29Å; L509-V513 PolarHBondContact O-N 3.3Å
510	E	77.9	Confident	77.2	Confident	119 Å²	119	96.2 Å²	96.2	56%	0.556	50%	0.501	S	S	*	.	H	α-helix	trans	-70	-36.6	172.9	-76.9	-174.7	162.9	0	0	111.3	I506 E507 E508 V513 C514	I506-E510 HydrophobicContact CG2-CG 4.26Å; I506-E510 WeakPolarHBondContact O-CB 3.45Å; I506-E510 WeakPolarHBondContact O-CG 3.19Å; I506-E510 PolarHBondContact O-N 2.86Å; E507-E510 PolarHBondContact O-N 2.95Å; E508-E510 VanDerWaalsContact C-N 3.33Å; E510-V513 CarbonylContact O-C 3.57Å; E510-V513 PolarHBondContact O-N 2.97Å; E510-C514 VanDerWaalsContact O-CB 3.31Å; E510-C514 WeakPolarHBondContact O-CB 3.28Å; E510-C514 PolarHBondContact O-N 3.48Å; E510-C514 PolarHBondContact O-SG 3.09Å
511	Q	76.6	Confident	76.4	Confident	113 Å²	113	98.8 Å²	98.8	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-42.4	168.9	-77.9	-178.1	34.2	0	0	111.7	E507 E508 C514 Q515	E507-Q511 WeakPolarHBondContact O-CB 3.45Å; E507-Q511 VanDerWaalsContact O-CG 3.31Å; E507-Q511 WeakPolarHBondContact O-CG 3.45Å; E507-Q511 PolarHBondContact O-N 3.38Å; E508-Q511 PolarHBondContact O-N 3.22Å; Q511-C514 CarbonylContact O-C 3.58Å; Q511-C514 WeakPolarHBondContact O-CA 3.45Å; Q511-C514 WeakPolarHBondContact O-CB 3.23Å; Q511-C514 PolarHBondContact O-N 2.81Å; Q511-C514 VanDerWaalsContact O-N 3.11Å; Q511-Q515 WeakPolarHBondContact O-CG 3.45Å; Q511-Q515 PolarHBondContact O-N 3.4Å
512	N	78.7	Confident	76.1	Confident	82 Å²	82	96 Å²	96	44%	0.439	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-41.6	173.6	-78.4	-74	0	0	0	111.7	E508 L509 C514 Q515 L516	E508-N512 PolarHBondContact O-N 2.74Å; E508-N512 PolarHBondContact O-ND2 2.79Å; L509-N512 PolarHBondContact O-N 2.94Å; N512-C514 VanDerWaalsContact C-N 3.29Å; N512-C514 PolarHBondContact O-N 3.44Å; N512-Q515 PolarHBondContact O-N 2.85Å; N512-L516 WeakPolarHBondContact O-CG 3.25Å; N512-L516 PolarHBondContact O-N 3.39Å
513	V	78.1	Confident	75.4	Confident	68 Å²	68	97 Å²	97	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-64.8	-32.8	171.4	165.8	0	0	0	0	111.2	L509 E510 K517	L509-V513 WeakPolarHBondContact O-CB 3.41Å; L509-V513 VanDerWaalsContact O-CG2 3.31Å; L509-V513 WeakPolarHBondContact O-CG2 3.29Å; L509-V513 PolarHBondContact O-N 3.3Å; E510-V513 CarbonylContact O-C 3.57Å; E510-V513 PolarHBondContact O-N 2.97Å; V513-K517 HydrophobicContact CG1-CD 4.04Å; V513-K517 HydrophobicContact CG1-CG 4.4Å; V513-K517 VanDerWaalsContact O-CB 3.22Å; V513-K517 WeakPolarHBondContact O-CB 3.4Å; V513-K517 WeakPolarHBondContact O-CG 3.45Å; V513-K517 PolarHBondContact O-N 3.49Å
514	C	75.3	Confident	74.9	Confident	70 Å²	70	97.6 Å²	97.6	47%	0.473	49%	0.494	S	S	.	.	H	α-helix	trans	-71.7	-36.1	173.2	-71.4	0	0	0	0	112	E510 Q511 N512 K517 Q518	E510-C514 VanDerWaalsContact O-CB 3.31Å; E510-C514 WeakPolarHBondContact O-CB 3.28Å; E510-C514 PolarHBondContact O-N 3.48Å; E510-C514 PolarHBondContact O-SG 3.09Å; Q511-C514 CarbonylContact O-C 3.58Å; Q511-C514 WeakPolarHBondContact O-CA 3.45Å; Q511-C514 WeakPolarHBondContact O-CB 3.23Å; Q511-C514 PolarHBondContact O-N 2.81Å; Q511-C514 VanDerWaalsContact O-N 3.11Å; N512-C514 VanDerWaalsContact C-N 3.29Å; N512-C514 PolarHBondContact O-N 3.44Å; C514-K517 CarbonylContact O-C 3.6Å; C514-K517 PolarHBondContact O-N 2.92Å; C514-Q518 WeakPolarHBondContact O-CA 3.47Å; C514-Q518 WeakPolarHBondContact O-CB 3.4Å; C514-Q518 PolarHBondContact O-N 3.17Å
515	Q	75.4	Confident	74.3	Confident	104 Å²	104	98.3 Å²	98.3	49%	0.486	49%	0.493	S	S	.	.	H	α-helix	trans	-67.4	-41	172.2	-70.6	174.8	28.6	0	0	111.5	Q511 N512 Q518 Q519	Q511-Q515 WeakPolarHBondContact O-CG 3.45Å; Q511-Q515 PolarHBondContact O-N 3.4Å; N512-Q515 PolarHBondContact O-N 2.85Å; Q515-Q518 CarbonylContact O-C 3.6Å; Q515-Q518 WeakPolarHBondContact O-CB 3.49Å; Q515-Q518 PolarHBondContact O-N 2.92Å; Q515-Q518 VanDerWaalsContact O-N 3.14Å; Q515-Q519 WeakPolarHBondContact O-CG 3.48Å; Q515-Q519 PolarHBondContact O-N 2.9Å
516	L	74.9	Confident	73.4	Confident	112 Å²	112	100.6 Å²	100.6	59%	0.586	50%	0.502	S	S	*	.	H	α-helix	trans	-67.1	-40	172.7	-71	169.9	0	0	0	111.9	N512 Q518 Q519 L520	N512-L516 WeakPolarHBondContact O-CG 3.25Å; N512-L516 PolarHBondContact O-N 3.39Å; L516-Q518 VanDerWaalsContact C-N 3.26Å; L516-Q518 PolarHBondContact O-N 3.47Å; L516-Q519 PolarHBondContact O-N 3.4Å; L516-L520 VanDerWaalsContact O-CB 3.31Å; L516-L520 WeakPolarHBondContact O-CB 3.44Å; L516-L520 PolarHBondContact O-N 2.9Å
517	K	70.1	Confident	72.7	Confident	119 Å²	119	104.7 Å²	104.7	52%	0.517	51%	0.512	S	S	.	.	H	α-helix	trans	-64.1	-30.5	169	-78.2	169.7	-179.1	170.8	0	111.8	V513 C514 Q521	V513-K517 HydrophobicContact CG1-CD 4.04Å; V513-K517 HydrophobicContact CG1-CG 4.4Å; V513-K517 VanDerWaalsContact O-CB 3.22Å; V513-K517 WeakPolarHBondContact O-CB 3.4Å; V513-K517 WeakPolarHBondContact O-CG 3.45Å; V513-K517 PolarHBondContact O-N 3.49Å; C514-K517 CarbonylContact O-C 3.6Å; C514-K517 PolarHBondContact O-N 2.92Å; K517-Q521 WeakPolarHBondContact O-CA 3.48Å; K517-Q521 WeakPolarHBondContact O-CB 3.49Å; K517-Q521 VanDerWaalsContact O-CG 3.25Å; K517-Q521 WeakPolarHBondContact O-CG 3.27Å; K517-Q521 PolarHBondContact O-N 2.88Å
518	Q	73.1	Confident	71.7	Confident	106 Å²	106	103.5 Å²	103.5	50%	0.495	51%	0.505	S	S	.	.	H	α-helix	trans	-75.5	-41.9	177.7	-176.6	175.2	-18.4	0	0	110.6	C514 Q515 L516 L520 Q521 E522	C514-Q518 WeakPolarHBondContact O-CA 3.47Å; C514-Q518 WeakPolarHBondContact O-CB 3.4Å; C514-Q518 PolarHBondContact O-N 3.17Å; Q515-Q518 CarbonylContact O-C 3.6Å; Q515-Q518 WeakPolarHBondContact O-CB 3.49Å; Q515-Q518 PolarHBondContact O-N 2.92Å; Q515-Q518 VanDerWaalsContact O-N 3.14Å; L516-Q518 VanDerWaalsContact C-N 3.26Å; L516-Q518 PolarHBondContact O-N 3.47Å; Q518-L520 VanDerWaalsContact C-N 3.35Å; Q518-L520 PolarHBondContact O-N 3.07Å; Q518-Q521 CarbonylContact O-C 3.56Å; Q518-Q521 PolarHBondContact O-N 3.41Å; Q518-E522 HydrophobicContact CG-CG 4.43Å; Q518-E522 WeakPolarHBondContact CG-OE1 3.5Å; Q518-E522 PolarHBondContact NE2-OE1 2.83Å; Q518-E522 VanDerWaalsContact O-CB 3.31Å; Q518-E522 WeakPolarHBondContact O-CB 3.39Å; Q518-E522 VanDerWaalsContact O-CG 3.26Å; Q518-E522 WeakPolarHBondContact O-CG 3.34Å; Q518-E522 PolarHBondContact O-N 3.43Å
519	Q	70.1	Confident	70.7	Confident	125 Å²	125	103 Å²	103	58%	0.584	50%	0.503	S	S	*	.	H	α-helix	trans	-62.1	-42	169.9	-71	176.8	-0.5	0	0	111.7	Q515 L516 E522 S523	Q515-Q519 WeakPolarHBondContact O-CG 3.48Å; Q515-Q519 PolarHBondContact O-N 2.9Å; L516-Q519 PolarHBondContact O-N 3.4Å; Q519-E522 PolarHBondContact O-N 3.4Å; Q519-S523 PolarHBondContact O-N 3.45Å
520	L	72.1	Confident	69.7	Low	106 Å²	106	105.3 Å²	105.3	56%	0.555	51%	0.511	S	S	*	.	H	α-helix	trans	-64.9	-39.5	172.4	-178.4	63.2	0	0	0	111.5	L516 Q518 E522 S523 E524	L516-L520 VanDerWaalsContact O-CB 3.31Å; L516-L520 WeakPolarHBondContact O-CB 3.44Å; L516-L520 PolarHBondContact O-N 2.9Å; Q518-L520 VanDerWaalsContact C-N 3.35Å; Q518-L520 PolarHBondContact O-N 3.07Å; L520-E522 VanDerWaalsContact C-N 3.34Å; L520-S523 PolarHBondContact O-N 2.92Å; L520-E524 WeakPolarHBondContact O-CB 3.25Å; L520-E524 PolarHBondContact O-N 3.39Å
521	Q	68.3	Low	68.6	Low	130 Å²	130	103.8 Å²	103.8	61%	0.607	51%	0.506	S	S	*	.	H	α-helix	trans	-70.8	-27.7	174.6	-84.3	-171.5	-3.8	0	0	112.4	K517 Q518 E524 L525	K517-Q521 WeakPolarHBondContact O-CA 3.48Å; K517-Q521 WeakPolarHBondContact O-CB 3.49Å; K517-Q521 VanDerWaalsContact O-CG 3.25Å; K517-Q521 WeakPolarHBondContact O-CG 3.27Å; K517-Q521 PolarHBondContact O-N 2.88Å; Q518-Q521 CarbonylContact O-C 3.56Å; Q518-Q521 PolarHBondContact O-N 3.41Å; Q521-E524 CarbonylContact O-C 3.6Å; Q521-L525 WeakPolarHBondContact O-CA 3.42Å; Q521-L525 WeakPolarHBondContact O-CB 3.35Å; Q521-L525 PolarHBondContact O-N 2.93Å
522	E	75.7	Confident	67.6	Low	96 Å²	96	103.7 Å²	103.7	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-76.6	-35.4	174.8	-78.2	167	-169.4	0	0	110.4	Q518 Q519 L520 L525 Q526	Q518-E522 HydrophobicContact CG-CG 4.43Å; Q518-E522 WeakPolarHBondContact CG-OE1 3.5Å; Q518-E522 PolarHBondContact NE2-OE1 2.83Å; Q518-E522 VanDerWaalsContact O-CB 3.31Å; Q518-E522 WeakPolarHBondContact O-CB 3.39Å; Q518-E522 VanDerWaalsContact O-CG 3.26Å; Q518-E522 WeakPolarHBondContact O-CG 3.34Å; Q518-E522 PolarHBondContact O-N 3.43Å; Q519-E522 PolarHBondContact O-N 3.4Å; L520-E522 VanDerWaalsContact C-N 3.34Å; E522-L525 CarbonylContact O-C 3.54Å; E522-L525 PolarHBondContact O-N 3.25Å; E522-Q526 WeakPolarHBondContact O-CG 3.49Å; E522-Q526 PolarHBondContact O-N 2.88Å
523	S	64.2	Low	66.9	Low	72 Å²	72	104.9 Å²	104.9	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-46.7	166.6	-171	0	0	0	0	111.8	Q519 L520 L525 Q526 R527	Q519-S523 PolarHBondContact O-N 3.45Å; L520-S523 PolarHBondContact O-N 2.92Å; S523-L525 PolarHBondContact O-N 3.32Å; S523-Q526 PolarHBondContact O-N 2.87Å; S523-R527 PolarHBondContact O-N 3.01Å; S523-R527 VanDerWaalsContact O-N 3.09Å
524	E	69.4	Low	65.6	Low	80 Å²	80	108.2 Å²	108.2	37%	0.374	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-25.9	170	-80.2	-157.5	172.3	0	0	112.4	L520 Q521 R527 K528	L520-E524 WeakPolarHBondContact O-CB 3.25Å; L520-E524 PolarHBondContact O-N 3.39Å; Q521-E524 CarbonylContact O-C 3.6Å; E524-R527 CarbonylContact O-C 3.35Å; E524-R527 PolarHBondContact O-N 2.87Å; E524-K528 WeakPolarHBondContact O-CA 3.44Å; E524-K528 WeakPolarHBondContact O-CB 3.17Å; E524-K528 VanDerWaalsContact O-CG 3.22Å; E524-K528 WeakPolarHBondContact O-CG 3.45Å; E524-K528 PolarHBondContact O-N 2.97Å; E524-K528 IonicContact OE2-NZ 2.66Å; E524-K528 PolarHBondContact OE2-NZ 3.19Å
525	L	64.3	Low	64.7	Low	68 Å²	68	110.7 Å²	110.7	36%	0.356	52%	0.523	S	S	.	.	H	α-helix	trans	-84.7	-30.2	179.7	-174.3	64.4	0	0	0	111.1	Q521 E522 S523 R527 K528 Q529	Q521-L525 WeakPolarHBondContact O-CA 3.42Å; Q521-L525 WeakPolarHBondContact O-CB 3.35Å; Q521-L525 PolarHBondContact O-N 2.93Å; E522-L525 CarbonylContact O-C 3.54Å; E522-L525 PolarHBondContact O-N 3.25Å; S523-L525 PolarHBondContact O-N 3.32Å; L525-R527 VanDerWaalsContact C-N 3.29Å; L525-K528 CarbonylContact O-C 3.59Å; L525-K528 PolarHBondContact O-N 2.96Å; L525-Q529 WeakPolarHBondContact O-CA 3.48Å; L525-Q529 WeakPolarHBondContact O-CB 3.47Å; L525-Q529 PolarHBondContact O-N 2.82Å
526	Q	63.7	Low	63.7	Low	148 Å²	148	109.8 Å²	109.8	69%	0.692	52%	0.522	S	S	*	.	H	α-helix	trans	-59.7	-45.8	162.4	-72.9	177.9	-5.8	0	0	109.7	E522 S523 K528 Q530	E522-Q526 WeakPolarHBondContact O-CG 3.49Å; E522-Q526 PolarHBondContact O-N 2.88Å; S523-Q526 PolarHBondContact O-N 2.87Å; Q526-K528 PolarHBondContact O-N 3.22Å; Q526-Q530 WeakPolarHBondContact O-CG 3.27Å; Q526-Q530 PolarHBondContact O-N 2.94Å
527	R	60.9	Low	63.1	Low	177 Å²	177	112.4 Å²	112.4	67%	0.668	53%	0.528	S	S	*	.	H	α-helix	trans	-67.8	-27.3	174	178.5	179.9	163.6	88.7	2.3	114.2	S523 E524 L525	S523-R527 PolarHBondContact O-N 3.01Å; S523-R527 VanDerWaalsContact O-N 3.09Å; E524-R527 CarbonylContact O-C 3.35Å; E524-R527 PolarHBondContact O-N 2.87Å; L525-R527 VanDerWaalsContact C-N 3.29Å
528	K	58.9	Low	62	Low	87 Å²	87	114.6 Å²	114.6	38%	0.378	54%	0.538	S	S	.	.	H	α-helix	trans	-99.1	-12.3	179.8	-79.2	168.8	175.7	159.9	0	113.4	E524 L525 Q526 L531 R532	E524-K528 WeakPolarHBondContact O-CA 3.44Å; E524-K528 WeakPolarHBondContact O-CB 3.17Å; E524-K528 VanDerWaalsContact O-CG 3.22Å; E524-K528 WeakPolarHBondContact O-CG 3.45Å; E524-K528 PolarHBondContact O-N 2.97Å; E524-K528 IonicContact OE2-NZ 2.66Å; E524-K528 PolarHBondContact OE2-NZ 3.19Å; L525-K528 CarbonylContact O-C 3.59Å; L525-K528 PolarHBondContact O-N 2.96Å; Q526-K528 PolarHBondContact O-N 3.22Å; K528-L531 HydrophobicContact CG-CD1 4.35Å; K528-L531 CarbonylContact O-C 3.51Å; K528-L531 PolarHBondContact O-N 2.73Å; K528-R532 VanDerWaalsContact O-CB 3.28Å; K528-R532 WeakPolarHBondContact O-CB 3.39Å; K528-R532 PolarHBondContact O-N 2.84Å
529	Q	59.2	Low	60.7	Low	88 Å²	88	119.7 Å²	119.7	41%	0.411	56%	0.562	S	S	.	*	H	α-helix	trans	-74.8	-42.4	168	-162.2	68.3	31.1	0	0	108.1	L525 L531 R532 D533	L525-Q529 WeakPolarHBondContact O-CA 3.48Å; L525-Q529 WeakPolarHBondContact O-CB 3.47Å; L525-Q529 PolarHBondContact O-N 2.82Å; Q529-L531 PolarHBondContact O-N 2.85Å; Q529-R532 PolarHBondContact O-N 3.27Å; Q529-R532 VanDerWaalsContact O-N 3.07Å; Q529-D533 PolarHBondContact NE2-OD1 2.8Å; Q529-D533 WeakPolarHBondContact O-CB 3.49Å; Q529-D533 VanDerWaalsContact O-CG 3.27Å; Q529-D533 PolarHBondContact O-N 3.33Å
530	Q	55.8	Low	60	Low	141 Å²	141	123.8 Å²	123.8	66%	0.659	58%	0.584	S	S	*	*	H	α-helix	trans	-49.8	-20.6	163	-70.9	175.4	-12.2	0	0	114.2	Q526 Q534	Q526-Q530 WeakPolarHBondContact O-CG 3.27Å; Q526-Q530 PolarHBondContact O-N 2.94Å; Q530-Q534 PolarHBondContact O-NE2 3.41Å
531	L	55.2	Low	58.4	Low	87 Å²	87	127 Å²	127	46%	0.455	60%	0.596	S	S	.	*	H	α-helix	trans	-106.7	-31.3	174.8	-63.1	169.3	0	0	0	114	K528 Q529 Q534 E535	K528-L531 HydrophobicContact CG-CD1 4.35Å; K528-L531 CarbonylContact O-C 3.51Å; K528-L531 PolarHBondContact O-N 2.73Å; Q529-L531 PolarHBondContact O-N 2.85Å; L531-Q534 WeakPolarHBondContact O-CB 3.28Å; L531-Q534 WeakPolarHBondContact O-CG 3.39Å; L531-Q534 PolarHBondContact O-N 2.71Å; L531-E535 PolarHBondContact O-N 2.84Å
532	R	57	Low	55.7	Low	111 Å²	111	129.4 Å²	129.4	42%	0.419	60%	0.604	S	S	.	*	H	α-helix	trans	-89.7	-16.2	-177.6	-88.4	-166.2	-73.3	-138.2	1.2	114.4	K528 Q529 Q534 E535 N536	K528-R532 VanDerWaalsContact O-CB 3.28Å; K528-R532 WeakPolarHBondContact O-CB 3.39Å; K528-R532 PolarHBondContact O-N 2.84Å; Q529-R532 PolarHBondContact O-N 3.27Å; Q529-R532 VanDerWaalsContact O-N 3.07Å; R532-Q534 PolarHBondContact O-N 2.88Å; R532-E535 HydrophobicContact CG-CB 4.23Å; R532-E535 PolarHBondContact O-N 3.31Å; R532-N536 HydrophobicContact CB-CB 4.04Å; R532-N536 HydrophobicContact CG-CB 4.19Å; R532-N536 VanDerWaalsContact O-CB 3.3Å; R532-N536 WeakPolarHBondContact O-CB 3.37Å; R532-N536 PolarHBondContact O-N 3.35Å
533	D	62.7	Low	52.9	Low	108 Å²	108	131.6 Å²	131.6	58%	0.578	63%	0.63	S	S	*	*	H	α-helix	trans	-65.5	-22.5	160.7	-62.7	-23.5	0	0	0	110.5	Q529	Q529-D533 PolarHBondContact NE2-OD1 2.8Å; Q529-D533 WeakPolarHBondContact O-CB 3.49Å; Q529-D533 VanDerWaalsContact O-CG 3.27Å; Q529-D533 PolarHBondContact O-N 3.33Å
534	Q	50.6	Low	50.5	Low	138 Å²	138	137.4 Å²	137.4	65%	0.645	65%	0.649	S	S	*	*	H	α-helix	trans	-76.4	-51.8	168.1	-37.6	-177.9	5.6	0	0	110.6	Q530 L531 R532 K537	Q530-Q534 PolarHBondContact O-NE2 3.41Å; L531-Q534 WeakPolarHBondContact O-CB 3.28Å; L531-Q534 WeakPolarHBondContact O-CG 3.39Å; L531-Q534 PolarHBondContact O-N 2.71Å; R532-Q534 PolarHBondContact O-N 2.88Å; Q534-K537 PolarHBondContact O-NZ 3.5Å
535	E	56.2	Low	48.3	Very low	122 Å²	122	142 Å²	142	57%	0.57	68%	0.675	S	S	*	*	H	α-helix	trans	-80.9	-49.5	-169.4	-171.2	75.6	-131.6	0	0	116.4	L531 R532 K537 F538	L531-E535 PolarHBondContact O-N 2.84Å; R532-E535 HydrophobicContact CG-CB 4.23Å; R532-E535 PolarHBondContact O-N 3.31Å; E535-K537 WeakPolarHBondContact O-CD 3.41Å; E535-K537 PolarHBondContact O-N 2.73Å; E535-F538 HydrophobicContact CG-CE2 3.87Å; E535-F538 HydrophobicContact CG-CZ 4.04Å
536	N	56.2	Low	45.8	Very low	84 Å²	84	147.4 Å²	147.4	45%	0.449	70%	0.696	S	S	.	*			trans	-84.2	114.3	-134.2	-170.9	37.5	0	0	0	117.3	R532 F538	R532-N536 HydrophobicContact CB-CB 4.04Å; R532-N536 HydrophobicContact CG-CB 4.19Å; R532-N536 VanDerWaalsContact O-CB 3.3Å; R532-N536 WeakPolarHBondContact O-CB 3.37Å; R532-N536 PolarHBondContact O-N 3.35Å; N536-F538 WeakPolarHBondContact OD1-CD2 3.45Å; N536-F538 WeakPolarHBondContact OD1-CE2 3.31Å
537	K	61.1	Low	43.6	Very low	167 Å²	167	149 Å²	149	73%	0.726	70%	0.703	S	S	*	*			trans	-143.9	0	174.9	-61.3	90.2	175	169.7	0	111.2	Q534 E535	Q534-K537 PolarHBondContact O-NZ 3.5Å; E535-K537 WeakPolarHBondContact O-CD 3.41Å; E535-K537 PolarHBondContact O-N 2.73Å
538	F	46.8	Very low	41.5	Very low	165 Å²	165	146.6 Å²	146.6	72%	0.724	71%	0.708	S	S	*	*				0	0	0	-36.2	-52.7	0	0	0	141.2	E535 N536	E535-F538 HydrophobicContact CG-CE2 3.87Å; E535-F538 HydrophobicContact CG-CZ 4.04Å; N536-F538 WeakPolarHBondContact OD1-CD2 3.45Å; N536-F538 WeakPolarHBondContact OD1-CE2 3.31Å
539	Q	46.4	Very low	39.3	Very low	213 Å²	213	153.9 Å²	153.9	100%	0.995	74%	0.735	S	S	*	*				0	0	0	-54.6	-171.4	0.9	0	0	141.4
540	M	56.3	Low	37.1	Very low	212 Å²	212	158 Å²	158	100%	1.044	75%	0.754	S	S	*	*				0	0	0	-48.5	-176.2	-173.8	0	0	140.9
541	E	38.5	Very low	35.3	Very low	172 Å²	172	159.8 Å²	159.8	80%	0.804	76%	0.759	S	S	*	*				0	0	0	-98.4	-61	139.4	0	0	141.7
542	K	10.7	Very low	33.3	Very low	181 Å²	181	166.7 Å²	166.7	79%	0.787	79%	0.786	S	S	*	*				0	0	0	-63.5	176.5	-103.1	67.3	0	142.2
543	S	16.4	Very low	31.7	Very low	142 Å²	142	167.1 Å²	167.1	99%	0.993	81%	0.813	S	S	*	*				0	0	0	-35.7	0	0	0	0	141.3
544	H	14.6	Very low	29.8	Very low	194 Å²	194	172.2 Å²	172.2	90%	0.898	83%	0.833	S	S	*	*				0	0	0	65	35	0	0	0	141.6
545	L	22.1	Very low	28.5	Very low	177 Å²	177	173.6 Å²	173.6	93%	0.927	85%	0.845	S	S	*	*				0	0	0	-159.3	68.9	0	0	0	141.1
546	K	12.9	Very low	27.2	Very low	182 Å²	182	175.5 Å²	175.5	79%	0.791	86%	0.858	S	S	*	*				0	0	0	-61.8	-177	-174.1	178.5	0	144
547	H	16.6	Very low	26.1	Very low	182 Å²	182	180.5 Å²	180.5	84%	0.843	88%	0.879	S	S	*	*				0	0	0	38.3	42.2	0	0	0	140.7
548	T	17.8	Very low	24.8	Very low	125 Å²	125	177.9 Å²	177.9	77%	0.767	88%	0.881	S	S	*	*				0	0	0	64	0	0	0	0	140.7
549	Y	11.4	Very low	24.3	Very low	240 Å²	240	178.1 Å²	178.1	94%	0.941	89%	0.885	S	S	*	*				0	0	0	-58.7	-60.4	0	0	0	144.1
550	E	14.5	Very low	24.3	Very low	174 Å²	174	177.7 Å²	177.7	81%	0.813	89%	0.888	S	S	*	*				0	0	0	-78.2	-88.1	-127.8	0	0	148.3
551	K	16.7	Very low	23.8	Very low	179 Å²	179	175.7 Å²	175.7	78%	0.778	88%	0.882	S	S	*	*				0	0	0	-86.8	54.7	-176.5	178.7	0	141.7
552	K	13.4	Very low	24.2	Very low	232 Å²	232	177.4 Å²	177.4	100%	1.009	89%	0.886	S	S	*	*				0	0	0	-154	176.3	175.4	-175.4	0	139.2
553	A	23.5	Very low	26.1	Very low	120 Å²	120	172.4 Å²	172.4	99%	0.992	89%	0.887	S	S	*	*				0	0	0	0	0	0	0	0	139.6
554	H	23.6	Very low	27.6	Very low	215 Å²	215	174.4 Å²	174.4	100%	0.995	88%	0.878	S	S	*	*				0	0	0	-163.5	54.7	0	0	0	139.3
555	D	23.7	Very low	28.9	Very low	167 Å²	167	170.5 Å²	170.5	89%	0.893	86%	0.86	S	S	*	*				0	0	0	-166.2	36.3	0	0	0	139.2
556	L	27.9	Very low	29.6	Very low	163 Å²	163	169.4 Å²	169.4	85%	0.853	86%	0.855	S	S	*	*				0	0	0	-158.8	-94	0	0	0	140.4
557	Q	33.8	Very low	31.8	Very low	189 Å²	189	164.6 Å²	164.6	88%	0.883	84%	0.841	S	S	*	*				0	0	0	-161.4	53.8	-92.5	0	0	140.5
558	S	33.2	Very low	33	Very low	111 Å²	111	164.8 Å²	164.8	78%	0.776	84%	0.842	S	S	*	*				0	0	0	-137.3	0	0	0	0	142
559	E	35.6	Very low	34.4	Very low	171 Å²	171	168.8 Å²	168.8	80%	0.799	85%	0.849	S	S	*	*				0	0	0	-76.1	126.1	-66.3	0	0	141.5
560	L	47.7	Very low	35.9	Very low	203 Å²	203	166.5 Å²	166.5	100%	1.063	84%	0.844	S	S	*	*				0	0	0	-145	55	0	0	0	140.2
561	D	44.5	Very low	37.7	Very low	171 Å²	171	164.9 Å²	164.9	91%	0.914	84%	0.839	S	S	*	*				0	0	0	179.9	35.3	0	0	0	131.3
562	K	48	Very low	38.9	Very low	207 Å²	207	164.9 Å²	164.9	90%	0.9	84%	0.842	S	S	*	*				0	88.5	0	-165	-174.6	-175.8	175.8	0	126
563	G	49.8	Very low	40.4	Very low	77 Å²	77	162.7 Å²	162.7	79%	0.794	83%	0.832	S	S	*	*			trans	-126.8	6.9	-162.9	0	0	0	0	0	128.8
564	K	48.3	Very low	41.3	Very low	184 Å²	184	165.6 Å²	165.6	80%	0.8	82%	0.823	S	S	*	*			trans	-142.5	153.9	-172.6	-68.6	171.2	160.6	-87.6	0	112.8
565	E	41.4	Very low	42.4	Very low	112 Å²	112	163.2 Å²	163.2	52%	0.523	81%	0.812	S	S	.	*			cis	-160.2	150.5	-17.4	-98.6	168.1	70.1	0	0	104.3	T567	E565-T567 HydrophobicContact CG-CG2 4.05Å; E565-T567 WeakPolarHBondContact OE1-CB 3.41Å; E565-T567 WeakPolarHBondContact OE1-CG2 3.28Å; E565-T567 PolarHBondContact OE1-OG1 3.45Å
566	D	36.7	Very low	43.5	Very low	154 Å²	154	164.9 Å²	164.9	82%	0.824	81%	0.814	S	S	*	*			cis	91.9	-81.5	26.9	-167	84.6	0	0	0	116.3	Q568	D566-Q568 VanDerWaalsContact C-N 3.27Å; D566-Q568 PolarHBondContact O-N 3.15Å
567	T	59.1	Low	44.1	Very low	80 Å²	80	161.5 Å²	161.5	49%	0.491	81%	0.81	S	S	.	*			trans	-73.3	5	-142.6	48.3	0	0	0	0	118.1	E565 K569	E565-T567 HydrophobicContact CG-CG2 4.05Å; E565-T567 WeakPolarHBondContact OE1-CB 3.41Å; E565-T567 WeakPolarHBondContact OE1-CG2 3.28Å; E565-T567 PolarHBondContact OE1-OG1 3.45Å; T567-K569 PolarHBondContact O-N 2.89Å; T567-K569 VanDerWaalsContact O-N 3.16Å
568	Q	43	Very low	44.2	Very low	186 Å²	186	160.3 Å²	160.3	87%	0.869	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	24.2	-160.2	-160.3	157.1	-4.8	0	0	116.8	D566	D566-Q568 VanDerWaalsContact C-N 3.27Å; D566-Q568 PolarHBondContact O-N 3.15Å
569	K	46.3	Very low	44.8	Very low	210 Å²	210	163.1 Å²	163.1	91%	0.913	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.4	25.3	-178.8	-74.4	-165.7	175.8	-179.6	0	117.5	T567	T567-K569 PolarHBondContact O-N 2.89Å; T567-K569 VanDerWaalsContact O-N 3.16Å
570	K	44.3	Very low	45.1	Very low	192 Å²	192	163.7 Å²	163.7	84%	0.835	81%	0.809	S	S	*	*	S	Bend	trans	-134.5	-9.9	-176.6	-99.8	-178.6	179.1	175.4	0	120.3
571	I	51.5	Low	45.1	Very low	140 Å²	140	163 Å²	163	72%	0.718	80%	0.798	S	S	*	*			trans	-92.5	-17	-169.7	-67.9	177	0	0	0	114.5	K573	I571-K573 PolarHBondContact O-N 3.25Å
572	H	42.3	Very low	44.9	Very low	179 Å²	179	162.2 Å²	162.2	83%	0.829	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	55.1	-176.7	-160.1	52.4	0	0	0	113.3
573	K	45.3	Very low	44.5	Very low	186 Å²	186	160.6 Å²	160.6	81%	0.809	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.9	14.7	-175.3	-120.4	-179.4	-175.3	-172.6	0	116.8	I571	I571-K573 PolarHBondContact O-N 3.25Å
574	F	40.7	Very low	43.5	Very low	181 Å²	181	164 Å²	164	79%	0.794	78%	0.78	S	S	*	*	S	Bend	trans	-135	0.9	-175.4	-77.7	-61.6	0	0	0	116.7
575	E	47.1	Very low	42.6	Very low	164 Å²	164	161.7 Å²	161.7	77%	0.766	78%	0.775	S	S	*	*			trans	-87	-5	-171.8	-66.6	174.8	122.4	0	0	114.4	A577	E575-A577 VanDerWaalsContact C-N 3.28Å; E575-A577 PolarHBondContact O-N 3.36Å; E575-A577 VanDerWaalsContact O-N 3.17Å
576	E	48.2	Very low	42.3	Very low	203 Å²	203	160 Å²	160	95%	0.949	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	25.9	-172.1	-155.4	170.3	-142.5	0	0	114.3
577	A	38.9	Very low	42.1	Very low	91 Å²	91	162.1 Å²	162.1	75%	0.752	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.5	2.3	-162.6	0	0	0	0	0	117.7	E575	E575-A577 VanDerWaalsContact C-N 3.28Å; E575-A577 PolarHBondContact O-N 3.36Å; E575-A577 VanDerWaalsContact O-N 3.17Å
578	L	37.3	Very low	40.9	Very low	164 Å²	164	164.6 Å²	164.6	86%	0.859	78%	0.784	S	S	*	*	S	Bend	trans	-126.2	11.1	-163.3	-151	108.4	0	0	0	118
579	K	45.2	Very low	40.6	Very low	170 Å²	170	161 Å²	161	74%	0.739	78%	0.775	S	S	*	*			trans	-140.4	31.8	179	-133.4	169.1	-174.4	172.8	0	119.4	E582	K579-E582 WeakPolarHBondContact CE-OE2 3.11Å; K579-E582 IonicContact NZ-OE2 2.84Å; K579-E582 PolarHBondContact NZ-OE2 2.85Å
580	E	41	Very low	40.7	Very low	183 Å²	183	158.5 Å²	158.5	86%	0.855	77%	0.766	S	S	*	*	S	Bend	trans	-98.2	29.8	167.4	-155	-177.5	-158.3	0	0	112.3
581	K	48.3	Very low	40.5	Very low	190 Å²	190	153.3 Å²	153.3	83%	0.826	75%	0.751	S	S	*	*	S	Bend	trans	-138	-0.4	-169.3	-82.5	-67.1	159.8	-150.3	0	118.7
582	E	41.4	Very low	39.7	Very low	153 Å²	153	156.1 Å²	156.1	72%	0.715	76%	0.761	S	S	*	*	S	Bend	trans	-109.4	8.9	171.7	-65.4	-175.4	130.1	0	0	112.8	K579	K579-E582 WeakPolarHBondContact CE-OE2 3.11Å; K579-E582 IonicContact NZ-OE2 2.84Å; K579-E582 PolarHBondContact NZ-OE2 2.85Å
583	E	39.5	Very low	39.9	Very low	173 Å²	173	155.3 Å²	155.3	81%	0.808	75%	0.75	S	S	*	*			trans	-80.7	135.3	161.1	-169.8	174.9	-120.9	0	0	109.6
584	Q	27.3	Very low	39.6	Very low	149 Å²	149	152.4 Å²	152.4	70%	0.696	74%	0.743	S	S	*	*			trans	68.7	131.5	-164.3	-46.2	-173.8	40.9	0	0	113
585	L	29.1	Very low	39.1	Very low	135 Å²	135	153 Å²	153	71%	0.707	75%	0.748	S	S	*	*			cis	-138.8	100.9	11	-156	72.4	0	0	0	107.3
586	T	35.1	Very low	39.1	Very low	77 Å²	77	148.9 Å²	148.9	47%	0.472	74%	0.743	S	S	.	*				41.4	141.9	87.9	74.6	0	0	0	0	116.2
587	R	32.7	Very low	38.7	Very low	199 Å²	199	146.8 Å²	146.8	75%	0.751	73%	0.733	S	S	*	*			trans	73.1	148.4	159	-72.2	163.3	-84.4	-138.5	-9.5	116.8
588	V	35.5	Very low	38.4	Very low	131 Å²	131	151.5 Å²	151.5	79%	0.794	74%	0.739	S	S	*	*			trans	65.5	108.9	164.7	172.3	0	0	0	0	112.4
589	T	34.9	Very low	38.5	Very low	111 Å²	111	147.5 Å²	147.5	68%	0.681	73%	0.729	S	S	*	*			cis	-158.7	140.4	17.5	-5.6	0	0	0	0	106.8
590	E	49.4	Very low	38.6	Very low	158 Å²	158	146 Å²	146	74%	0.738	73%	0.73	S	S	*	*			cis	57.2	142.5	45	-166.2	51.8	-106.6	0	0	112.2
591	V	40	Very low	39.2	Very low	83 Å²	83	142.1 Å²	142.1	50%	0.503	73%	0.729	S	S	.	*			trans	65.1	68.6	-175.6	-160.4	0	0	0	0	116.2
592	Q	35.1	Very low	39.4	Very low	199 Å²	199	136.4 Å²	136.4	93%	0.93	72%	0.717	S	S	*	*			trans	-165.9	75	134.8	-112.1	179.7	-3.4	0	0	109.2
593	R	45.3	Very low	39.6	Very low	161 Å²	161	136.9 Å²	136.9	61%	0.608	72%	0.723	S	S	*	*			cis	57.7	91.5	21.8	-157.3	-135	66.5	141.6	-4.1	115.3
594	L	40.5	Very low	40.3	Very low	126 Å²	126	133.4 Å²	133.4	66%	0.66	71%	0.707	S	S	*	*			trans	70.1	69.2	159.9	-66.2	167.1	0	0	0	117.1
595	Q	29.7	Very low	41.8	Very low	192 Å²	192	133.7 Å²	133.7	90%	0.897	71%	0.708	S	S	*	*			trans	-165.8	144.2	130.3	-106.3	175.9	-23.6	0	0	107.7
596	A	46.2	Very low	42.7	Very low	79 Å²	79	135.4 Å²	135.4	65%	0.653	71%	0.71	S	S	*	*			cis	-146.8	145.1	-12.7	0	0	0	0	0	106.1
597	Q	41.3	Very low	43.2	Very low	158 Å²	158	139.7 Å²	139.7	74%	0.738	72%	0.723	S	S	*	*			cis	62.1	137.2	36.9	-149.4	174.9	21.4	0	0	111.7
598	Q	31.4	Very low	44.4	Very low	191 Å²	191	138.5 Å²	138.5	89%	0.893	72%	0.718	S	S	*	*			trans	62.3	45.7	-175.2	-51.6	-177.4	-75.1	0	0	115.2
599	A	39.8	Very low	45.4	Very low	79 Å²	79	140.1 Å²	140.1	65%	0.653	72%	0.717	S	S	*	*	S	Bend	trans	-116.1	116.8	140.3	0	0	0	0	0	107.8
600	D	47.5	Very low	46.4	Very low	140 Å²	140	140.6 Å²	140.6	75%	0.749	72%	0.72	S	S	*	*			trans	42.4	83.8	145.7	-46.1	-32.1	0	0	0	116.6	A602	D600-A602 HydrophobicContact CB-CB 3.93Å
601	A	52.5	Low	46.5	Very low	101 Å²	101	140.8 Å²	140.8	84%	0.835	72%	0.721	S	S	*	*			cis	57.7	14.6	19.4	0	0	0	0	0	115.3
602	A	53.4	Low	47.4	Very low	69 Å²	69	144.1 Å²	144.1	57%	0.57	74%	0.735	S	S	*	*			trans	-116	8	-175.6	0	0	0	0	0	115	D600	D600-A602 HydrophobicContact CB-CB 3.93Å
603	L	46.2	Very low	48.4	Very low	163 Å²	163	143.8 Å²	143.8	85%	0.853	74%	0.739	S	S	*	*	S	Bend	trans	-139.6	39.5	-176	-77.3	178.4	0	0	0	114.5
604	E	54	Low	48.5	Very low	101 Å²	101	144 Å²	144	47%	0.472	77%	0.765	S	S	.	*	S	Bend	trans	-88.2	-56.1	158.2	-142.8	-77.5	177.2	0	0	109.1	F606 K607 R608	E604-F606 VanDerWaalsContact C-N 3.32Å; E604-F606 PolarHBondContact O-N 2.96Å; E604-K607 PolarHBondContact O-N 3.48Å; E604-K607 VanDerWaalsContact O-N 3.14Å; E604-R608 IonicContact OE1-NH1 3.78Å; E604-R608 VanDerWaalsContact OE2-CB 3.28Å; E604-R608 WeakPolarHBondContact OE2-CB 3.35Å; E604-R608 WeakPolarHBondContact OE2-CD 3.43Å
605	E	57.8	Low	49.2	Very low	154 Å²	154	145.6 Å²	145.6	72%	0.72	77%	0.769	S	S	*	*	H	α-helix	trans	-39.3	-44.3	-169.5	-114.4	63.1	-150.2	0	0	117.3
606	F	48.2	Very low	50.4	Low	171 Å²	171	146.1 Å²	146.1	75%	0.75	77%	0.769	S	S	*	*	H	α-helix	trans	-81.4	-29.8	-171.6	-148.9	-85	0	0	0	114.1	E604	E604-F606 VanDerWaalsContact C-N 3.32Å; E604-F606 PolarHBondContact O-N 2.96Å
607	K	46.3	Very low	50.8	Low	168 Å²	168	149.3 Å²	149.3	73%	0.73	78%	0.78	S	S	*	*	H	α-helix	trans	-76.4	-31.4	178.1	-158.9	-175.9	179.2	-166.1	0	111	E604 Q609	E604-K607 PolarHBondContact O-N 3.48Å; E604-K607 VanDerWaalsContact O-N 3.14Å; K607-Q609 VanDerWaalsContact C-N 3.31Å; K607-Q609 PolarHBondContact O-N 2.83Å
608	R	57.8	Low	50.8	Low	173 Å²	173	153.5 Å²	153.5	65%	0.653	79%	0.79	S	S	*	*	H	α-helix	trans	-74.2	-14.7	-176	-165.5	178	176.3	83.2	15	114.5	E604 V610	E604-R608 IonicContact OE1-NH1 3.78Å; E604-R608 VanDerWaalsContact OE2-CB 3.28Å; E604-R608 WeakPolarHBondContact OE2-CB 3.35Å; E604-R608 WeakPolarHBondContact OE2-CD 3.43Å; R608-V610 PolarHBondContact O-N 3.29Å; R608-V610 VanDerWaalsContact O-N 3.17Å
609	Q	56.9	Low	50.7	Low	166 Å²	166	151 Å²	151	78%	0.776	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	6.6	-175.6	-162.8	152.9	28.3	0	0	115.2	K607	K607-Q609 VanDerWaalsContact C-N 3.31Å; K607-Q609 PolarHBondContact O-N 2.83Å
610	V	54.5	Low	49.4	Very low	121 Å²	121	156.8 Å²	156.8	73%	0.733	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-24.3	-171.7	-178.9	0	0	0	0	116.2	R608	R608-V610 PolarHBondContact O-N 3.29Å; R608-V610 VanDerWaalsContact O-N 3.17Å
611	E	53.2	Low	47.6	Very low	162 Å²	162	158 Å²	158	76%	0.757	82%	0.819	S	S	*	*			trans	-115.4	63.8	-158.7	-59.6	178.8	167.2	0	0	119.4
612	L	57.2	Low	45.2	Very low	152 Å²	152	162.8 Å²	162.8	80%	0.796	82%	0.821	S	S	*	*			trans	-139.4	0	-163.3	-153	68.9	0	0	0	124.1
613	N	56.5	Low	42.8	Very low	193 Å²	193	168.9 Å²	168.9	100%	1.032	84%	0.838	S	S	*	*				0	0	0	-55.3	-70.5	0	0	0	134.7
614	S	47.2	Very low	41.3	Very low	164 Å²	164	170.8 Å²	170.8	100%	1.147	84%	0.842	S	S	*	*				0	0	0	-36.3	0	0	0	0	152.2
615	E	55.3	Low	41.4	Very low	161 Å²	161	175.9 Å²	175.9	75%	0.752	87%	0.869	S	S	*	*				0	0	0	62.4	45.1	-98.2	0	0	151.5
616	K	56.3	Low	41.4	Very low	202 Å²	202	174.6 Å²	174.6	88%	0.878	86%	0.863	S	S	*	*				0	0	0	-66.5	151.6	-165.7	64	0	150.8
617	V	52.6	Low	41.9	Very low	147 Å²	147	172.3 Å²	172.3	89%	0.891	85%	0.853	S	S	*	*				0	0	0	79.5	0	0	0	0	150.5
618	Y	42.7	Very low	42.5	Very low	245 Å²	245	169.8 Å²	169.8	96%	0.961	85%	0.851	S	S	*	*				0	0	0	-52.6	-69.8	0	0	0	154.6
619	A	29	Very low	42.4	Very low	138 Å²	138	166.1 Å²	166.1	100%	1.141	84%	0.841	S	S	*	*				0	0	0	0	0	0	0	0	150.4
620	E	13.2	Very low	42.6	Very low	202 Å²	202	160.1 Å²	160.1	94%	0.944	82%	0.82	S	S	*	*				0	0	0	-119.2	-60.8	-92.4	0	0	149.7
621	M	9.3	Very low	43	Very low	166 Å²	166	156.7 Å²	156.7	82%	0.818	80%	0.797	S	S	*	*				0	0	0	-61	-164.2	-75.6	0	0	150.4
622	K	2.7	Very low	43.5	Very low	200 Å²	200	154.4 Å²	154.4	87%	0.87	79%	0.79	S	S	*	*				0	0	0	91.2	-84.8	-83.4	112.7	0	156.1
623	E	3.1	Very low	44	Very low	197 Å²	197	153.6 Å²	153.6	92%	0.921	79%	0.791	S	S	*	*				0	0	0	141.7	171.1	74.6	0	0	150.2
624	Q	14.2	Very low	44.4	Very low	203 Å²	203	151.7 Å²	151.7	95%	0.949	77%	0.77	S	S	*	*				0	0	0	-46.4	-172.2	65.6	0	0	151.1
625	M	54.6	Low	45.3	Very low	208 Å²	208	144.4 Å²	144.4	100%	1.025	72%	0.719	S	S	*	*				0	0	0	-73.8	-74.2	-165	0	0	150.6
626	E	59.7	Low	46.2	Very low	127 Å²	127	143.9 Å²	143.9	59%	0.593	71%	0.714	S	S	*	*				0	0	0	137.6	83.6	-1.4	0	0	150.1	R656	E626-R656 IonicContact OE2-NH1 3.11Å; E626-R656 PolarHBondContact OE2-NH1 3.42Å
627	K	56.9	Low	46.6	Very low	124 Å²	124	135 Å²	135	54%	0.539	68%	0.677	S	S	.	*				0	0	0	61.1	51.1	-96	82	0	151.2
628	V	59.7	Low	47.5	Very low	115 Å²	115	130.7 Å²	130.7	70%	0.697	65%	0.649	S	S	*	*				0	0	0	146.9	0	0	0	0	151.4	Q649	V628-Q649 VanDerWaalsContact C-OE1 3.27Å; V628-Q649 HydrophobicContact CG1-CG 4.2Å
629	E	55.6	Low	48.9	Very low	96 Å²	96	127.1 Å²	127.1	45%	0.449	63%	0.634	S	S	.	*				0	0	0	-132.9	-84.6	-6.7	0	0	149.5	Q642 E645 F646 Q649	E629-Q642 PolarHBondContact OE2-NE2 3.47Å; E629-E645 WeakPolarHBondContact O-CB 3.32Å; E629-F646 HydrophobicContact CG-CD1 4.32Å; E629-F646 HydrophobicContact CG-CE1 3.49Å; E629-F646 VanDerWaalsContact CG-CE1 3.49Å; E629-F646 HydrophobicContact CG-CZ 3.69Å; E629-Q649 VanDerWaalsContact N-OE1 3.14Å; E629-Q649 PolarHBondContact O-NE2 3.46Å; E629-Q649 VanDerWaalsContact O-NE2 3.1Å
630	A	60.5	Low	51.2	Low	39 Å²	39	124.1 Å²	124.1	32%	0.322	60%	0.596	S	S	.	*				0	0	0	0	0	0	0	0	155.1	L638 K641 Q642 E645	A630-L638 VanDerWaalsContact C-CD1 3.41Å; A630-L638 WeakPolarHBondContact O-CD1 3.24Å; A630-K641 VanDerWaalsContact CB-C 3.44Å; A630-K641 HydrophobicContact CB-CB 3.56Å; A630-Q642 HydrophobicContact CB-CG 4.24Å; A630-E645 HydrophobicContact CB-CB 4.31Å; A630-E645 HydrophobicContact CB-CG 4.13Å; A630-E645 WeakPolarHBondContact CB-OE1 3.24Å
631	D	64	Low	54	Low	50 Å²	50	119.1 Å²	119.1	27%	0.267	57%	0.571	S	S	.	*				0	0	0	127.5	79.8	0	0	0	155.5	R634 S635 S637 L638 K641	D631-R634 CarbonylContact C-O 3.57Å; D631-R634 WeakPolarHBondContact CA-O 3.4Å; D631-R634 WeakPolarHBondContact OD1-CB 3.32Å; D631-R634 IonicContact OD1-CZ 3.88Å; D631-R634 VanDerWaalsContact OD1-CZ 3.24Å; D631-R634 IonicContact OD1-NE 3Å; D631-R634 PolarHBondContact OD1-NE 2.96Å; D631-R634 IonicContact OD1-NH2 3.31Å; D631-R634 PolarHBondContact OD1-NH2 3.41Å; D631-R634 WeakPolarHBondContact OD2-CB 3.33Å; D631-R634 IonicContact OD2-CZ 2.73Å; D631-R634 IonicContact OD2-NE 2.72Å; D631-R634 PolarHBondContact OD2-NE 3.41Å; D631-R634 IonicContact OD2-NH2 3.17Å; D631-S635 VanDerWaalsContact C-CB 3.47Å; D631-S635 WeakPolarHBondContact O-CB 3.36Å; D631-S637 PolarHBondContact N-O 3.49Å; D631-S637 PolarHBondContact OD2-OG 2.8Å; D631-L638 VanDerWaalsContact CA-CG 3.46Å; D631-L638 WeakPolarHBondContact O-CB 3.35Å; D631-L638 WeakPolarHBondContact O-CD2 3.36Å; D631-L638 VanDerWaalsContact O-CG 3.26Å; D631-L638 WeakPolarHBondContact O-CG 3.4Å; D631-K641 IonicContact OD2-NZ 2.71Å
632	L	63.8	Low	57.3	Low	114 Å²	114	113.6 Å²	113.6	60%	0.597	54%	0.544	S	S	*	.	H	α-helix		0	-93.2	0	-162.1	74.5	0	0	0	130.6	R634 S635 K636	L632-R634 PolarHBondContact N-O 3.48Å; L632-R634 CarbonylContact O-C 3.38Å; L632-R634 PolarHBondContact O-N 3.37Å; L632-R634 VanDerWaalsContact O-N 3.12Å; L632-S635 VanDerWaalsContact CA-OG 3.25Å; L632-S635 WeakPolarHBondContact CA-OG 3.34Å; L632-S635 VanDerWaalsContact CB-OG 3.24Å; L632-S635 WeakPolarHBondContact CB-OG 3.38Å; L632-S635 VanDerWaalsContact CD1-OG 3.23Å; L632-S635 WeakPolarHBondContact CD1-OG 3.03Å; L632-S635 VanDerWaalsContact N-CA 3.29Å; L632-S635 CarbonylContact O-C 3.33Å; L632-S635 VanDerWaalsContact O-CA 3.29Å; L632-S635 WeakPolarHBondContact O-CA 3.47Å; L632-S635 PolarHBondContact O-N 3.13Å; L632-K636 PolarHBondContact O-N 3.04Å
633	T	67.9	Low	60.8	Low	135 Å²	135	106.4 Å²	106.4	83%	0.828	52%	0.518	S	S	*	.	H	α-helix	trans	-50.9	-32.8	160.9	-85.7	0	0	0	0	104.1	K636 S637	T633-K636 WeakPolarHBondContact O-CB 3.48Å; T633-S637 PolarHBondContact O-N 2.94Å
634	R	64.9	Low	64.5	Low	153 Å²	153	102.7 Å²	102.7	58%	0.577	50%	0.499	S	S	*	.	H	α-helix	trans	-75	30.2	146.8	-56.7	-159.3	-31.3	-127	-7.3	123.3	D631 L632 K636 S637 L638	D631-R634 CarbonylContact C-O 3.57Å; D631-R634 WeakPolarHBondContact CA-O 3.4Å; D631-R634 WeakPolarHBondContact OD1-CB 3.32Å; D631-R634 IonicContact OD1-CZ 3.88Å; D631-R634 VanDerWaalsContact OD1-CZ 3.24Å; D631-R634 IonicContact OD1-NE 3Å; D631-R634 PolarHBondContact OD1-NE 2.96Å; D631-R634 IonicContact OD1-NH2 3.31Å; D631-R634 PolarHBondContact OD1-NH2 3.41Å; D631-R634 WeakPolarHBondContact OD2-CB 3.33Å; D631-R634 IonicContact OD2-CZ 2.73Å; D631-R634 IonicContact OD2-NE 2.72Å; D631-R634 PolarHBondContact OD2-NE 3.41Å; D631-R634 IonicContact OD2-NH2 3.17Å; L632-R634 PolarHBondContact N-O 3.48Å; L632-R634 CarbonylContact O-C 3.38Å; L632-R634 PolarHBondContact O-N 3.37Å; L632-R634 VanDerWaalsContact O-N 3.12Å; R634-K636 VanDerWaalsContact C-C 3.49Å; R634-S637 VanDerWaalsContact C-CB 3.5Å; R634-S637 VanDerWaalsContact CA-CA 3.49Å; R634-S637 VanDerWaalsContact CA-N 3.29Å; R634-S637 WeakPolarHBondContact CA-OG 3.42Å; R634-S637 WeakPolarHBondContact CB-OG 3.21Å; R634-S637 WeakPolarHBondContact CG-OG 3.36Å; R634-S637 CarbonylContact O-C 3.26Å; R634-S637 WeakPolarHBondContact O-CA 3.4Å; R634-S637 WeakPolarHBondContact O-CB 3.46Å; R634-S637 PolarHBondContact O-N 3.2Å; R634-S637 PolarHBondContact O-OG 3.49Å; R634-L638 PolarHBondContact O-N 3.33Å
635	S	65.8	Low	67.6	Low	11 Å²	11	97.2 Å²	97.2	8%	0.077	47%	0.473	C	S	.	.	H	α-helix	trans	-153.1	-4.8	-178.8	91.5	0	0	0	0	111.9	D631 L632 R639	D631-S635 VanDerWaalsContact C-CB 3.47Å; D631-S635 WeakPolarHBondContact O-CB 3.36Å; L632-S635 VanDerWaalsContact CA-OG 3.25Å; L632-S635 WeakPolarHBondContact CA-OG 3.34Å; L632-S635 VanDerWaalsContact CB-OG 3.24Å; L632-S635 WeakPolarHBondContact CB-OG 3.38Å; L632-S635 VanDerWaalsContact CD1-OG 3.23Å; L632-S635 WeakPolarHBondContact CD1-OG 3.03Å; L632-S635 VanDerWaalsContact N-CA 3.29Å; L632-S635 CarbonylContact O-C 3.33Å; L632-S635 VanDerWaalsContact O-CA 3.29Å; L632-S635 WeakPolarHBondContact O-CA 3.47Å; L632-S635 PolarHBondContact O-N 3.13Å; S635-R639 WeakPolarHBondContact O-CB 3.46Å; S635-R639 PolarHBondContact O-NE 2.95Å; S635-R639 PolarHBondContact O-NH2 2.87Å; S635-R639 PolarHBondContact OG-NH2 2.8Å
636	K	74.1	Confident	68.7	Low	149 Å²	149	91.6 Å²	91.6	65%	0.648	44%	0.443	S	S	*	.	H	α-helix		-49.7	-91.3	95.3	-51.5	-176.8	-179.4	-177	0	110.4	L632 T633 R634 L638 R639 E640	L632-K636 PolarHBondContact O-N 3.04Å; T633-K636 WeakPolarHBondContact O-CB 3.48Å; R634-K636 VanDerWaalsContact C-C 3.49Å; K636-L638 VanDerWaalsContact C-N 3.28Å; K636-L638 CarbonylContact O-C 2.55Å; K636-L638 PolarHBondContact O-N 3.42Å; K636-R639 CarbonylContact O-C 3.58Å; K636-R639 VanDerWaalsContact O-C 3.26Å; K636-R639 PolarHBondContact O-N 2.88Å; K636-E640 WeakPolarHBondContact O-CA 3.21Å; K636-E640 WeakPolarHBondContact O-CB 3.45Å; K636-E640 PolarHBondContact O-N 2.98Å
637	S	63.9	Low	69.8	Low	16 Å²	16	90.3 Å²	90.3	11%	0.112	44%	0.44	C	S	.	.	H	α-helix	trans	-48.3	13	171.4	114.8	0	0	0	0	124.1	D631 T633 R634 E640 K641	D631-S637 PolarHBondContact N-O 3.49Å; D631-S637 PolarHBondContact OD2-OG 2.8Å; T633-S637 PolarHBondContact O-N 2.94Å; R634-S637 VanDerWaalsContact C-CB 3.5Å; R634-S637 VanDerWaalsContact CA-CA 3.49Å; R634-S637 VanDerWaalsContact CA-N 3.29Å; R634-S637 WeakPolarHBondContact CA-OG 3.42Å; R634-S637 WeakPolarHBondContact CB-OG 3.21Å; R634-S637 WeakPolarHBondContact CG-OG 3.36Å; R634-S637 CarbonylContact O-C 3.26Å; R634-S637 WeakPolarHBondContact O-CA 3.4Å; R634-S637 WeakPolarHBondContact O-CB 3.46Å; R634-S637 PolarHBondContact O-N 3.2Å; R634-S637 PolarHBondContact O-OG 3.49Å; S637-E640 PolarHBondContact N-OE2 2.87Å; S637-K641 WeakPolarHBondContact O-CA 3.31Å; S637-K641 WeakPolarHBondContact O-CB 3.49Å; S637-K641 WeakPolarHBondContact O-CG 3.3Å; S637-K641 PolarHBondContact O-N 2.63Å
638	L	71.4	Confident	71.2	Confident	56 Å²	56	92.8 Å²	92.8	29%	0.293	45%	0.446	S	S	.	.	H	α-helix	trans	-99.9	-68.1	165.2	-164.1	34.6	0	0	0	102.4	A630 D631 R634 K636 E640 K641 Q642 S643	A630-L638 VanDerWaalsContact C-CD1 3.41Å; A630-L638 WeakPolarHBondContact O-CD1 3.24Å; D631-L638 VanDerWaalsContact CA-CG 3.46Å; D631-L638 WeakPolarHBondContact O-CB 3.35Å; D631-L638 WeakPolarHBondContact O-CD2 3.36Å; D631-L638 VanDerWaalsContact O-CG 3.26Å; D631-L638 WeakPolarHBondContact O-CG 3.4Å; R634-L638 PolarHBondContact O-N 3.33Å; K636-L638 VanDerWaalsContact C-N 3.28Å; K636-L638 CarbonylContact O-C 2.55Å; K636-L638 PolarHBondContact O-N 3.42Å; L638-E640 PolarHBondContact O-N 2.91Å; L638-K641 CarbonylContact O-C 3.54Å; L638-K641 PolarHBondContact O-N 3.45Å; L638-Q642 HydrophobicContact CD1-CG 3.78Å; L638-Q642 HydrophobicContact CG-CG 4.38Å; L638-Q642 VanDerWaalsContact CG-OE1 3.23Å; L638-Q642 WeakPolarHBondContact O-CA 3.43Å; L638-Q642 WeakPolarHBondContact O-CB 3.43Å; L638-Q642 WeakPolarHBondContact O-CG 3.32Å; L638-Q642 PolarHBondContact O-N 2.88Å; L638-S643 PolarHBondContact O-N 3.38Å
639	R	73.5	Confident	72.1	Confident	171 Å²	171	88.6 Å²	88.6	65%	0.645	42%	0.419	S	S	*	.	H	α-helix	trans	-69.2	5.2	171.7	-65.6	170.4	-80.4	-154.8	-9.6	111.7	S635 K636 S643	S635-R639 WeakPolarHBondContact O-CB 3.46Å; S635-R639 PolarHBondContact O-NE 2.95Å; S635-R639 PolarHBondContact O-NH2 2.87Å; S635-R639 PolarHBondContact OG-NH2 2.8Å; K636-R639 CarbonylContact O-C 3.58Å; K636-R639 VanDerWaalsContact O-C 3.26Å; K636-R639 PolarHBondContact O-N 2.88Å; R639-S643 WeakPolarHBondContact O-CB 3.42Å
640	E	76.9	Confident	73.3	Confident	75 Å²	75	89.5 Å²	89.5	35%	0.35	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-17.9	174.9	-177.5	-138.9	153.4	0	0	111.6	K636 S637 L638 K644	K636-E640 WeakPolarHBondContact O-CA 3.21Å; K636-E640 WeakPolarHBondContact O-CB 3.45Å; K636-E640 PolarHBondContact O-N 2.98Å; S637-E640 PolarHBondContact N-OE2 2.87Å; L638-E640 PolarHBondContact O-N 2.91Å; E640-K644 HydrophobicContact CG-CD 4.31Å; E640-K644 WeakPolarHBondContact O-CA 3.44Å; E640-K644 WeakPolarHBondContact O-CB 3.45Å; E640-K644 WeakPolarHBondContact O-CD 3.35Å; E640-K644 WeakPolarHBondContact O-CG 3.24Å; E640-K644 PolarHBondContact O-N 2.87Å; E640-K644 WeakPolarHBondContact OE1-CE 3.45Å; E640-K644 IonicContact OE1-NZ 2.68Å; E640-K644 PolarHBondContact OE1-NZ 2.68Å
641	K	72.6	Confident	74.4	Confident	96 Å²	96	90.9 Å²	90.9	42%	0.417	43%	0.426	S	S	.	.	H	α-helix	trans	-90.8	-46.6	157.5	-70.8	177.2	169.9	-174.5	0	111.6	A630 D631 S637 L638 S643 K644 E645	A630-K641 VanDerWaalsContact CB-C 3.44Å; A630-K641 HydrophobicContact CB-CB 3.56Å; D631-K641 IonicContact OD2-NZ 2.71Å; S637-K641 WeakPolarHBondContact O-CA 3.31Å; S637-K641 WeakPolarHBondContact O-CB 3.49Å; S637-K641 WeakPolarHBondContact O-CG 3.3Å; S637-K641 PolarHBondContact O-N 2.63Å; L638-K641 CarbonylContact O-C 3.54Å; L638-K641 PolarHBondContact O-N 3.45Å; K641-S643 VanDerWaalsContact C-N 3.26Å; K641-S643 PolarHBondContact O-N 3.12Å; K641-K644 CarbonylContact O-C 3.54Å; K641-K644 PolarHBondContact O-N 2.88Å; K641-K644 VanDerWaalsContact O-N 3.11Å; K641-E645 WeakPolarHBondContact O-CA 3.13Å; K641-E645 WeakPolarHBondContact O-CB 3.25Å; K641-E645 WeakPolarHBondContact O-CG 3.35Å; K641-E645 PolarHBondContact O-N 3.16Å
642	Q	77.8	Confident	75.6	Confident	51 Å²	51	89.6 Å²	89.6	24%	0.238	42%	0.419	C	S	.	.	H	α-helix	trans	-54.7	-43.2	161.2	-59.8	-179.9	-58.5	0	0	110	E629 A630 L638 E645 F646	E629-Q642 PolarHBondContact OE2-NE2 3.47Å; A630-Q642 HydrophobicContact CB-CG 4.24Å; L638-Q642 HydrophobicContact CD1-CG 3.78Å; L638-Q642 HydrophobicContact CG-CG 4.38Å; L638-Q642 VanDerWaalsContact CG-OE1 3.23Å; L638-Q642 WeakPolarHBondContact O-CA 3.43Å; L638-Q642 WeakPolarHBondContact O-CB 3.43Å; L638-Q642 WeakPolarHBondContact O-CG 3.32Å; L638-Q642 PolarHBondContact O-N 2.88Å; Q642-E645 PolarHBondContact O-N 2.71Å; Q642-F646 HydrophobicContact CB-CD2 3.87Å; Q642-F646 HydrophobicContact CB-CE2 3.74Å; Q642-F646 WeakPolarHBondContact O-CA 3.3Å; Q642-F646 WeakPolarHBondContact O-CB 3.39Å; Q642-F646 WeakPolarHBondContact O-CD2 2.94Å; Q642-F646 WeakPolarHBondContact O-CG 3.43Å; Q642-F646 PolarHBondContact O-N 3.03Å
643	S	76	Confident	76.6	Confident	49 Å²	49	86.5 Å²	86.5	34%	0.343	40%	0.403	S	S	.	.	H	α-helix	trans	-71	-34.2	173.7	-177.2	0	0	0	0	112.6	L638 R639 K641 E645 L647	L638-S643 PolarHBondContact O-N 3.38Å; R639-S643 WeakPolarHBondContact O-CB 3.42Å; K641-S643 VanDerWaalsContact C-N 3.26Å; K641-S643 PolarHBondContact O-N 3.12Å; S643-E645 VanDerWaalsContact C-N 3.33Å; S643-L647 WeakPolarHBondContact O-CA 3.11Å; S643-L647 WeakPolarHBondContact O-CB 3.2Å; S643-L647 VanDerWaalsContact O-CD1 3.3Å; S643-L647 WeakPolarHBondContact O-CD1 3.32Å; S643-L647 WeakPolarHBondContact O-CG 3.26Å; S643-L647 PolarHBondContact O-N 3.36Å
644	K	81.6	Confident	77.5	Confident	119 Å²	119	85.8 Å²	85.8	52%	0.517	39%	0.385	S	S	.	.	H	α-helix	trans	-69.9	-30	174.5	-81.9	165.9	-179.8	168	0	112.8	E640 K641 L647 W648	E640-K644 HydrophobicContact CG-CD 4.31Å; E640-K644 WeakPolarHBondContact O-CA 3.44Å; E640-K644 WeakPolarHBondContact O-CB 3.45Å; E640-K644 WeakPolarHBondContact O-CD 3.35Å; E640-K644 WeakPolarHBondContact O-CG 3.24Å; E640-K644 PolarHBondContact O-N 2.87Å; E640-K644 WeakPolarHBondContact OE1-CE 3.45Å; E640-K644 IonicContact OE1-NZ 2.68Å; E640-K644 PolarHBondContact OE1-NZ 2.68Å; K641-K644 CarbonylContact O-C 3.54Å; K641-K644 PolarHBondContact O-N 2.88Å; K641-K644 VanDerWaalsContact O-N 3.11Å; K644-L647 CarbonylContact O-C 3.59Å; K644-W648 VanDerWaalsContact O-CB 3.23Å; K644-W648 WeakPolarHBondContact O-CB 3.44Å; K644-W648 PolarHBondContact O-N 2.84Å
645	E	78.3	Confident	78.5	Confident	87 Å²	87	83 Å²	83	41%	0.407	38%	0.379	S	S	.	.	H	α-helix	trans	-90.3	-29.7	179.3	-73.2	179.8	-137.4	0	0	111.2	E629 A630 K641 Q642 S643 L647 W648 Q649	E629-E645 WeakPolarHBondContact O-CB 3.32Å; A630-E645 HydrophobicContact CB-CB 4.31Å; A630-E645 HydrophobicContact CB-CG 4.13Å; A630-E645 WeakPolarHBondContact CB-OE1 3.24Å; K641-E645 WeakPolarHBondContact O-CA 3.13Å; K641-E645 WeakPolarHBondContact O-CB 3.25Å; K641-E645 WeakPolarHBondContact O-CG 3.35Å; K641-E645 PolarHBondContact O-N 3.16Å; Q642-E645 PolarHBondContact O-N 2.71Å; S643-E645 VanDerWaalsContact C-N 3.33Å; E645-L647 VanDerWaalsContact C-N 3.34Å; E645-W648 CarbonylContact O-C 3.48Å; E645-W648 PolarHBondContact O-N 2.96Å; E645-Q649 VanDerWaalsContact O-CB 3.26Å; E645-Q649 WeakPolarHBondContact O-CB 3.41Å; E645-Q649 WeakPolarHBondContact O-CG 3.16Å; E645-Q649 PolarHBondContact O-N 2.87Å; E645-Q649 PolarHBondContact O-NE2 3.25Å
646	F	76.9	Confident	79.6	Confident	90 Å²	90	86 Å²	86	40%	0.395	39%	0.388	S	S	.	.	H	α-helix	trans	-66.4	-37.8	161.3	-73.2	-50.6	0	0	0	110	E629 Q642 Q649 L650	E629-F646 HydrophobicContact CG-CD1 4.32Å; E629-F646 HydrophobicContact CG-CE1 3.49Å; E629-F646 VanDerWaalsContact CG-CE1 3.49Å; E629-F646 HydrophobicContact CG-CZ 3.69Å; Q642-F646 HydrophobicContact CB-CD2 3.87Å; Q642-F646 HydrophobicContact CB-CE2 3.74Å; Q642-F646 WeakPolarHBondContact O-CA 3.3Å; Q642-F646 WeakPolarHBondContact O-CB 3.39Å; Q642-F646 WeakPolarHBondContact O-CD2 2.94Å; Q642-F646 WeakPolarHBondContact O-CG 3.43Å; Q642-F646 PolarHBondContact O-N 3.03Å; F646-Q649 VanDerWaalsContact CA-NE2 3.31Å; F646-L650 WeakPolarHBondContact O-CB 3.4Å; F646-L650 WeakPolarHBondContact O-CD1 3.39Å; F646-L650 WeakPolarHBondContact O-CG 3.48Å; F646-L650 PolarHBondContact O-N 2.88Å
647	L	82.8	Confident	80.2	Confident	100 Å²	100	85.4 Å²	85.4	52%	0.524	38%	0.383	S	S	.	.	H	α-helix	trans	-67.7	-36.8	167.7	-74	165.4	0	0	0	111.1	S643 K644 E645 E651	S643-L647 WeakPolarHBondContact O-CA 3.11Å; S643-L647 WeakPolarHBondContact O-CB 3.2Å; S643-L647 VanDerWaalsContact O-CD1 3.3Å; S643-L647 WeakPolarHBondContact O-CD1 3.32Å; S643-L647 WeakPolarHBondContact O-CG 3.26Å; S643-L647 PolarHBondContact O-N 3.36Å; K644-L647 CarbonylContact O-C 3.59Å; E645-L647 VanDerWaalsContact C-N 3.34Å; L647-E651 WeakPolarHBondContact O-CA 3.33Å; L647-E651 WeakPolarHBondContact O-CB 3.35Å; L647-E651 PolarHBondContact O-N 3.26Å
648	W	86.6	Confident	81.2	Confident	177 Å²	177	89.1 Å²	89.1	67%	0.67	40%	0.398	S	S	*	.	H	α-helix	trans	-72.3	-30.9	177.3	-149.9	92.4	0	0	0	111.9	K644 E645 D652	K644-W648 VanDerWaalsContact O-CB 3.23Å; K644-W648 WeakPolarHBondContact O-CB 3.44Å; K644-W648 PolarHBondContact O-N 2.84Å; E645-W648 CarbonylContact O-C 3.48Å; E645-W648 PolarHBondContact O-N 2.96Å; W648-D652 HydrophobicContact CE3-CB 3.99Å; W648-D652 HydrophobicContact CZ3-CB 3.96Å; W648-D652 WeakPolarHBondContact O-CA 3.46Å; W648-D652 WeakPolarHBondContact O-CB 3.28Å; W648-D652 PolarHBondContact O-N 3.33Å
649	Q	78.7	Confident	82.1	Confident	26 Å²	26	91.7 Å²	91.7	12%	0.121	41%	0.409	C	S	.	.	H	α-helix	trans	-71	-49.5	170.3	-76.2	162.1	73.6	0	0	111.1	V628 E629 E645 F646 E651 D652 I653	V628-Q649 VanDerWaalsContact C-OE1 3.27Å; V628-Q649 HydrophobicContact CG1-CG 4.2Å; E629-Q649 VanDerWaalsContact N-OE1 3.14Å; E629-Q649 PolarHBondContact O-NE2 3.46Å; E629-Q649 VanDerWaalsContact O-NE2 3.1Å; E645-Q649 VanDerWaalsContact O-CB 3.26Å; E645-Q649 WeakPolarHBondContact O-CB 3.41Å; E645-Q649 WeakPolarHBondContact O-CG 3.16Å; E645-Q649 PolarHBondContact O-N 2.87Å; E645-Q649 PolarHBondContact O-NE2 3.25Å; F646-Q649 VanDerWaalsContact CA-NE2 3.31Å; Q649-E651 PolarHBondContact O-N 3.37Å; Q649-D652 PolarHBondContact O-N 3.38Å; Q649-I653 WeakPolarHBondContact O-CA 3.28Å; Q649-I653 WeakPolarHBondContact O-CB 3.42Å; Q649-I653 WeakPolarHBondContact O-CD1 3.38Å; Q649-I653 WeakPolarHBondContact O-CG1 3.36Å; Q649-I653 PolarHBondContact O-N 3.2Å
650	L	80.7	Confident	82.8	Confident	115 Å²	115	86.4 Å²	86.4	60%	0.602	39%	0.392	S	S	*	.	H	α-helix	trans	-63.5	-33	176.9	-73.7	167.5	0	0	0	110	F646 R654	F646-L650 WeakPolarHBondContact O-CB 3.4Å; F646-L650 WeakPolarHBondContact O-CD1 3.39Å; F646-L650 WeakPolarHBondContact O-CG 3.48Å; F646-L650 PolarHBondContact O-N 2.88Å; L650-R654 WeakPolarHBondContact O-CA 3.4Å; L650-R654 WeakPolarHBondContact O-CB 3.43Å; L650-R654 PolarHBondContact O-N 3.16Å
651	E	85.1	Confident	83.3	Confident	69 Å²	69	86.9 Å²	86.9	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-80.7	-32.2	175.9	-169.4	64.5	-167.5	0	0	112.8	L647 Q649 R654 Q655	L647-E651 WeakPolarHBondContact O-CA 3.33Å; L647-E651 WeakPolarHBondContact O-CB 3.35Å; L647-E651 PolarHBondContact O-N 3.26Å; Q649-E651 PolarHBondContact O-N 3.37Å; E651-R654 IonicContact OE1-CZ 3.33Å; E651-R654 IonicContact OE1-NH1 2.99Å; E651-R654 PolarHBondContact OE1-NH1 3.49Å; E651-R654 IonicContact OE2-CZ 3.83Å; E651-R654 IonicContact OE2-NH1 3.73Å; E651-R654 PolarHBondContact OE2-NH1 2.9Å; E651-Q655 WeakPolarHBondContact O-CA 3.27Å; E651-Q655 WeakPolarHBondContact O-CB 3.49Å; E651-Q655 WeakPolarHBondContact O-CG 3.26Å; E651-Q655 PolarHBondContact O-N 2.85Å; E651-Q655 PolarHBondContact OE1-NE2 3.03Å
652	D	87.9	Confident	84.2	Confident	23 Å²	23	86.4 Å²	86.4	12%	0.123	40%	0.401	C	S	.	.	H	α-helix	trans	-71.6	-47.7	171.2	170.4	44.1	0	0	0	110.8	W648 Q649 R654 Q655 R656	W648-D652 HydrophobicContact CE3-CB 3.99Å; W648-D652 HydrophobicContact CZ3-CB 3.96Å; W648-D652 WeakPolarHBondContact O-CA 3.46Å; W648-D652 WeakPolarHBondContact O-CB 3.28Å; W648-D652 PolarHBondContact O-N 3.33Å; Q649-D652 PolarHBondContact O-N 3.38Å; D652-R654 VanDerWaalsContact C-N 3.33Å; D652-R654 PolarHBondContact O-N 2.88Å; D652-Q655 CarbonylContact O-C 3.4Å; D652-Q655 PolarHBondContact O-N 3.39Å; D652-R656 VanDerWaalsContact CG-NE 3.3Å; D652-R656 WeakPolarHBondContact O-CB 3.43Å; D652-R656 WeakPolarHBondContact O-CG 3.39Å; D652-R656 PolarHBondContact O-N 2.85Å; D652-R656 IonicContact OD1-CZ 3.61Å; D652-R656 IonicContact OD1-NE 2.76Å; D652-R656 PolarHBondContact OD1-NE 2.86Å; D652-R656 IonicContact OD1-NH2 2.73Å; D652-R656 PolarHBondContact OD1-NH2 2.74Å; D652-R656 IonicContact OD2-CZ 2.73Å; D652-R656 IonicContact OD2-NE 3.24Å; D652-R656 PolarHBondContact OD2-NE 3.42Å; D652-R656 IonicContact OD2-NH2 3.67Å; D652-R656 PolarHBondContact OD2-NH2 3.25Å
653	I	84.6	Confident	84.7	Confident	49 Å²	49	89.1 Å²	89.1	25%	0.251	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-42	172.5	-67.6	166.6	0	0	0	110	Q649 R656 Y657	Q649-I653 WeakPolarHBondContact O-CA 3.28Å; Q649-I653 WeakPolarHBondContact O-CB 3.42Å; Q649-I653 WeakPolarHBondContact O-CD1 3.38Å; Q649-I653 WeakPolarHBondContact O-CG1 3.36Å; Q649-I653 PolarHBondContact O-N 3.2Å; I653-R656 PolarHBondContact O-N 2.8Å; I653-Y657 HydrophobicContact CG2-CD2 3.67Å; I653-Y657 HydrophobicContact CG2-CE2 3.31Å; I653-Y657 WeakPolarHBondContact O-CD2 3.39Å; I653-Y657 PolarHBondContact O-N 3.1Å
654	R	87.8	Confident	85.3	Confident	119 Å²	119	92 Å²	92	45%	0.449	42%	0.424	S	S	.	.	H	α-helix	trans	-64.4	-43.4	171.9	174.8	-178.8	160.1	-118	-19.7	111.3	L650 E651 D652 R656 Y657 E658	L650-R654 WeakPolarHBondContact O-CA 3.4Å; L650-R654 WeakPolarHBondContact O-CB 3.43Å; L650-R654 PolarHBondContact O-N 3.16Å; E651-R654 IonicContact OE1-CZ 3.33Å; E651-R654 IonicContact OE1-NH1 2.99Å; E651-R654 PolarHBondContact OE1-NH1 3.49Å; E651-R654 IonicContact OE2-CZ 3.83Å; E651-R654 IonicContact OE2-NH1 3.73Å; E651-R654 PolarHBondContact OE2-NH1 2.9Å; D652-R654 VanDerWaalsContact C-N 3.33Å; D652-R654 PolarHBondContact O-N 2.88Å; R654-R656 VanDerWaalsContact C-N 3.32Å; R654-R656 PolarHBondContact O-N 3.4Å; R654-Y657 CarbonylContact O-C 3.57Å; R654-Y657 PolarHBondContact O-N 2.96Å; R654-E658 IonicContact CZ-OE2 2.65Å; R654-E658 VanDerWaalsContact CZ-OE2 3.22Å; R654-E658 IonicContact NE-OE2 2.85Å; R654-E658 PolarHBondContact NE-OE2 2.98Å; R654-E658 IonicContact NH2-OE1 3.39Å; R654-E658 IonicContact NH2-OE2 3.47Å; R654-E658 PolarHBondContact NH2-OE2 3.45Å; R654-E658 WeakPolarHBondContact O-CB 3.45Å; R654-E658 PolarHBondContact O-N 3Å
655	Q	85.5	Confident	85.6	Confident	96 Å²	96	92.5 Å²	92.5	45%	0.449	43%	0.427	S	S	.	.	H	α-helix	trans	-66.3	-34.4	178.2	-80.6	172.4	23.4	0	0	111.6	E651 D652 E658 Q659	E651-Q655 WeakPolarHBondContact O-CA 3.27Å; E651-Q655 WeakPolarHBondContact O-CB 3.49Å; E651-Q655 WeakPolarHBondContact O-CG 3.26Å; E651-Q655 PolarHBondContact O-N 2.85Å; E651-Q655 PolarHBondContact OE1-NE2 3.03Å; D652-Q655 CarbonylContact O-C 3.4Å; D652-Q655 PolarHBondContact O-N 3.39Å; Q655-E658 PolarHBondContact O-N 3.2Å; Q655-Q659 WeakPolarHBondContact O-CB 3.48Å; Q655-Q659 WeakPolarHBondContact O-CG 3.34Å; Q655-Q659 PolarHBondContact O-N 3.35Å
656	R	89.6	Confident	86.3	Confident	72 Å²	72	93 Å²	93	27%	0.272	43%	0.432	S	S	.	.	H	α-helix	trans	-67.1	-43.3	170.7	-69.7	168.4	-164	-138.1	18.4	112	E626 D652 I653 R654 Q659 Q660	E626-R656 IonicContact OE2-NH1 3.11Å; E626-R656 PolarHBondContact OE2-NH1 3.42Å; D652-R656 VanDerWaalsContact CG-NE 3.3Å; D652-R656 WeakPolarHBondContact O-CB 3.43Å; D652-R656 WeakPolarHBondContact O-CG 3.39Å; D652-R656 PolarHBondContact O-N 2.85Å; D652-R656 IonicContact OD1-CZ 3.61Å; D652-R656 IonicContact OD1-NE 2.76Å; D652-R656 PolarHBondContact OD1-NE 2.86Å; D652-R656 IonicContact OD1-NH2 2.73Å; D652-R656 PolarHBondContact OD1-NH2 2.74Å; D652-R656 IonicContact OD2-CZ 2.73Å; D652-R656 IonicContact OD2-NE 3.24Å; D652-R656 PolarHBondContact OD2-NE 3.42Å; D652-R656 IonicContact OD2-NH2 3.67Å; D652-R656 PolarHBondContact OD2-NH2 3.25Å; I653-R656 PolarHBondContact O-N 2.8Å; R654-R656 VanDerWaalsContact C-N 3.32Å; R654-R656 PolarHBondContact O-N 3.4Å; R656-Q659 PolarHBondContact O-N 2.77Å; R656-Q660 WeakPolarHBondContact O-CB 3.36Å; R656-Q660 VanDerWaalsContact O-CG 3.29Å; R656-Q660 WeakPolarHBondContact O-CG 3.44Å; R656-Q660 PolarHBondContact O-N 3.16Å
657	Y	85.2	Confident	86.7	Confident	137 Å²	137	94 Å²	94	54%	0.537	44%	0.437	S	S	.	.	H	α-helix	trans	-68.3	-34.9	173.4	-72.2	-45.6	0	0	0	112.5	I653 R654 Q660 I661	I653-Y657 HydrophobicContact CG2-CD2 3.67Å; I653-Y657 HydrophobicContact CG2-CE2 3.31Å; I653-Y657 WeakPolarHBondContact O-CD2 3.39Å; I653-Y657 PolarHBondContact O-N 3.1Å; R654-Y657 CarbonylContact O-C 3.57Å; R654-Y657 PolarHBondContact O-N 2.96Å; Y657-Q660 PolarHBondContact O-N 2.82Å; Y657-I661 WeakPolarHBondContact O-CB 3.1Å; Y657-I661 WeakPolarHBondContact O-CD1 3.29Å; Y657-I661 WeakPolarHBondContact O-CG1 3.21Å; Y657-I661 PolarHBondContact O-N 3.46Å
658	E	86.6	Confident	86.9	Confident	94 Å²	94	94.3 Å²	94.3	44%	0.439	44%	0.436	S	S	.	.	H	α-helix	trans	-75.7	-30.8	179	-162.3	149.9	-160.1	0	0	110.4	R654 Q655 V662	R654-E658 IonicContact CZ-OE2 2.65Å; R654-E658 VanDerWaalsContact CZ-OE2 3.22Å; R654-E658 IonicContact NE-OE2 2.85Å; R654-E658 PolarHBondContact NE-OE2 2.98Å; R654-E658 IonicContact NH2-OE1 3.39Å; R654-E658 IonicContact NH2-OE2 3.47Å; R654-E658 PolarHBondContact NH2-OE2 3.45Å; R654-E658 WeakPolarHBondContact O-CB 3.45Å; R654-E658 PolarHBondContact O-N 3Å; Q655-E658 PolarHBondContact O-N 3.2Å; E658-V662 WeakPolarHBondContact O-CB 3.36Å; E658-V662 VanDerWaalsContact O-CG2 3.23Å; E658-V662 WeakPolarHBondContact O-CG2 3.41Å; E658-V662 PolarHBondContact O-N 2.89Å
659	Q	88.6	Confident	86.9	Confident	110 Å²	110	90 Å²	90	51%	0.514	42%	0.423	S	S	.	.	H	α-helix	trans	-64.9	-54.6	163.5	-79	165.9	-5.1	0	0	111.5	Q655 R656 I661 V662 E663	Q655-Q659 WeakPolarHBondContact O-CB 3.48Å; Q655-Q659 WeakPolarHBondContact O-CG 3.34Å; Q655-Q659 PolarHBondContact O-N 3.35Å; R656-Q659 PolarHBondContact O-N 2.77Å; Q659-I661 PolarHBondContact O-N 2.81Å; Q659-V662 CarbonylContact O-C 3.58Å; Q659-V662 WeakPolarHBondContact O-CA 3.45Å; Q659-V662 WeakPolarHBondContact O-CB 3.28Å; Q659-V662 PolarHBondContact O-N 3.18Å; Q659-E663 WeakPolarHBondContact O-CG 3.44Å; Q659-E663 PolarHBondContact O-N 3.11Å
660	Q	89.4	Confident	87.4	Confident	60 Å²	60	94.1 Å²	94.1	28%	0.28	44%	0.442	S	S	.	.	H	α-helix	trans	-57.3	-37.1	176.5	-76.1	172.9	-4.5	0	0	112.1	R656 Y657 V662 E663 L664	R656-Q660 WeakPolarHBondContact O-CB 3.36Å; R656-Q660 VanDerWaalsContact O-CG 3.29Å; R656-Q660 WeakPolarHBondContact O-CG 3.44Å; R656-Q660 PolarHBondContact O-N 3.16Å; Y657-Q660 PolarHBondContact O-N 2.82Å; Q660-V662 VanDerWaalsContact C-N 3.35Å; Q660-E663 PolarHBondContact O-N 3.34Å; Q660-L664 VanDerWaalsContact O-CB 3.24Å; Q660-L664 WeakPolarHBondContact O-CB 3.38Å; Q660-L664 WeakPolarHBondContact O-CD1 3.41Å; Q660-L664 VanDerWaalsContact O-CG 3.23Å; Q660-L664 WeakPolarHBondContact O-CG 3.38Å; Q660-L664 PolarHBondContact O-N 3.41Å
661	I	86.6	Confident	87.8	Confident	85 Å²	85	94.3 Å²	94.3	44%	0.436	44%	0.44	S	S	.	.	H	α-helix	trans	-68.5	-32.4	173.5	-75.3	165.1	0	0	0	111.6	Y657 Q659 K665	Y657-I661 WeakPolarHBondContact O-CB 3.1Å; Y657-I661 WeakPolarHBondContact O-CD1 3.29Å; Y657-I661 WeakPolarHBondContact O-CG1 3.21Å; Y657-I661 PolarHBondContact O-N 3.46Å; Q659-I661 PolarHBondContact O-N 2.81Å; I661-K665 HydrophobicContact CG2-CD 4.12Å; I661-K665 VanDerWaalsContact CG2-NZ 3.27Å; I661-K665 VanDerWaalsContact O-CB 3.26Å; I661-K665 WeakPolarHBondContact O-CB 3.43Å; I661-K665 WeakPolarHBondContact O-CD 2.82Å; I661-K665 WeakPolarHBondContact O-CG 3.42Å; I661-K665 PolarHBondContact O-N 2.9Å; I661-K665 VanDerWaalsContact O-N 3.14Å
662	V	91.4	Very high	88	Confident	86 Å²	86	96 Å²	96	52%	0.521	45%	0.446	S	S	.	.	H	α-helix	trans	-76.1	-38.5	173.6	164.2	0	0	0	0	111.5	E658 Q659 Q660 K665 L666	E658-V662 WeakPolarHBondContact O-CB 3.36Å; E658-V662 VanDerWaalsContact O-CG2 3.23Å; E658-V662 WeakPolarHBondContact O-CG2 3.41Å; E658-V662 PolarHBondContact O-N 2.89Å; Q659-V662 CarbonylContact O-C 3.58Å; Q659-V662 WeakPolarHBondContact O-CA 3.45Å; Q659-V662 WeakPolarHBondContact O-CB 3.28Å; Q659-V662 PolarHBondContact O-N 3.18Å; Q660-V662 VanDerWaalsContact C-N 3.35Å; V662-K665 PolarHBondContact O-N 2.97Å; V662-L666 VanDerWaalsContact O-CB 3.23Å; V662-L666 WeakPolarHBondContact O-CB 3.43Å; V662-L666 PolarHBondContact O-N 2.87Å
663	E	89.4	Confident	88	Confident	108 Å²	108	98 Å²	98	51%	0.505	46%	0.46	S	S	.	.	H	α-helix	trans	-65.2	-52.4	175.4	-71.5	168.8	163.9	0	0	110	Q659 Q660 K665 L666 E667	Q659-E663 WeakPolarHBondContact O-CG 3.44Å; Q659-E663 PolarHBondContact O-N 3.11Å; Q660-E663 PolarHBondContact O-N 3.34Å; E663-K665 VanDerWaalsContact C-N 3.27Å; E663-K665 PolarHBondContact O-N 3.43Å; E663-L666 CarbonylContact O-C 3.56Å; E663-L666 WeakPolarHBondContact O-CA 3.36Å; E663-L666 WeakPolarHBondContact O-CB 3.38Å; E663-L666 PolarHBondContact O-N 3.32Å; E663-E667 WeakPolarHBondContact O-CB 3.37Å; E663-E667 WeakPolarHBondContact O-CG 3.27Å; E663-E667 PolarHBondContact O-N 2.91Å
664	L	88.5	Confident	88.4	Confident	110 Å²	110	101 Å²	101	58%	0.576	47%	0.473	S	S	*	.	H	α-helix	trans	-61	-32	174.1	-71.1	167.2	0	0	0	113	Q660 H668	Q660-L664 VanDerWaalsContact O-CB 3.24Å; Q660-L664 WeakPolarHBondContact O-CB 3.38Å; Q660-L664 WeakPolarHBondContact O-CD1 3.41Å; Q660-L664 VanDerWaalsContact O-CG 3.23Å; Q660-L664 WeakPolarHBondContact O-CG 3.38Å; Q660-L664 PolarHBondContact O-N 3.41Å; L664-H668 WeakPolarHBondContact O-CB 3.22Å; L664-H668 PolarHBondContact O-N 2.83Å
665	K	87.4	Confident	88.6	Confident	130 Å²	130	100.5 Å²	100.5	57%	0.565	48%	0.478	S	S	*	.	H	α-helix	trans	-71.2	-36.8	171.4	-80.4	168.1	-171.9	166	0	112.3	I661 V662 E663 E669	I661-K665 HydrophobicContact CG2-CD 4.12Å; I661-K665 VanDerWaalsContact CG2-NZ 3.27Å; I661-K665 VanDerWaalsContact O-CB 3.26Å; I661-K665 WeakPolarHBondContact O-CB 3.43Å; I661-K665 WeakPolarHBondContact O-CD 2.82Å; I661-K665 WeakPolarHBondContact O-CG 3.42Å; I661-K665 PolarHBondContact O-N 2.9Å; I661-K665 VanDerWaalsContact O-N 3.14Å; V662-K665 PolarHBondContact O-N 2.97Å; E663-K665 VanDerWaalsContact C-N 3.27Å; E663-K665 PolarHBondContact O-N 3.43Å; K665-E669 WeakPolarHBondContact O-CB 3.47Å; K665-E669 WeakPolarHBondContact O-CG 3.29Å; K665-E669 PolarHBondContact O-N 3.38Å
666	L	92	Very high	88.7	Confident	98 Å²	98	100.7 Å²	100.7	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-70.6	-45.1	178.2	177.6	61.6	0	0	0	110.4	V662 E663 E669 Q670	V662-L666 VanDerWaalsContact O-CB 3.23Å; V662-L666 WeakPolarHBondContact O-CB 3.43Å; V662-L666 PolarHBondContact O-N 2.87Å; E663-L666 CarbonylContact O-C 3.56Å; E663-L666 WeakPolarHBondContact O-CA 3.36Å; E663-L666 WeakPolarHBondContact O-CB 3.38Å; E663-L666 PolarHBondContact O-N 3.32Å; L666-E669 PolarHBondContact O-N 3.21Å; L666-Q670 WeakPolarHBondContact O-CB 3.22Å; L666-Q670 WeakPolarHBondContact O-CG 3.45Å; L666-Q670 PolarHBondContact O-N 2.71Å
667	E	87.1	Confident	88.8	Confident	110 Å²	110	103.2 Å²	103.2	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-58.9	-48.2	170.6	-70.8	176.7	158.6	0	0	110.5	E663 E669 Q670 E671	E663-E667 WeakPolarHBondContact O-CB 3.37Å; E663-E667 WeakPolarHBondContact O-CG 3.27Å; E663-E667 PolarHBondContact O-N 2.91Å; E667-E669 VanDerWaalsContact C-N 3.34Å; E667-E669 PolarHBondContact O-N 2.85Å; E667-Q670 CarbonylContact O-C 3.59Å; E667-Q670 WeakPolarHBondContact O-CA 3.46Å; E667-Q670 WeakPolarHBondContact O-CB 3.46Å; E667-Q670 PolarHBondContact O-N 3.5Å; E667-Q670 VanDerWaalsContact O-N 3.08Å; E667-E671 WeakPolarHBondContact O-CG 3.41Å; E667-E671 PolarHBondContact O-N 3.28Å
668	H	86.5	Confident	89	Confident	106 Å²	106	100.7 Å²	100.7	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-36.6	177.5	-174	58.2	0	0	0	113.3	L664 K672	L664-H668 WeakPolarHBondContact O-CB 3.22Å; L664-H668 PolarHBondContact O-N 2.83Å; H668-K672 WeakPolarHBondContact O-CB 3.44Å; H668-K672 PolarHBondContact O-N 3.09Å
669	E	86.7	Confident	89.3	Confident	87 Å²	87	101.6 Å²	101.6	41%	0.407	49%	0.494	S	S	.	.	H	α-helix	trans	-74.2	-27.9	172.7	-76.5	-65.9	166.1	0	0	112.8	K665 L666 E667 K672 T673	K665-E669 WeakPolarHBondContact O-CB 3.47Å; K665-E669 WeakPolarHBondContact O-CG 3.29Å; K665-E669 PolarHBondContact O-N 3.38Å; L666-E669 PolarHBondContact O-N 3.21Å; E667-E669 VanDerWaalsContact C-N 3.34Å; E667-E669 PolarHBondContact O-N 2.85Å; E669-K672 IonicContact OE1-NZ 3.63Å; E669-K672 PolarHBondContact OE1-NZ 3.41Å; E669-K672 IonicContact OE2-NZ 2.58Å; E669-K672 PolarHBondContact OE2-NZ 3.33Å; E669-T673 WeakPolarHBondContact O-CB 3.38Å; E669-T673 WeakPolarHBondContact O-CG2 3.3Å; E669-T673 PolarHBondContact O-N 3.06Å; E669-T673 PolarHBondContact O-OG1 3.27Å
670	Q	88.8	Confident	89.3	Confident	112 Å²	112	99.3 Å²	99.3	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-69.3	-45.1	169.9	-75.7	173.6	17.9	0	0	111.4	L666 E667 T673 H674	L666-Q670 WeakPolarHBondContact O-CB 3.22Å; L666-Q670 WeakPolarHBondContact O-CG 3.45Å; L666-Q670 PolarHBondContact O-N 2.71Å; E667-Q670 CarbonylContact O-C 3.59Å; E667-Q670 WeakPolarHBondContact O-CA 3.46Å; E667-Q670 WeakPolarHBondContact O-CB 3.46Å; E667-Q670 PolarHBondContact O-N 3.5Å; E667-Q670 VanDerWaalsContact O-N 3.08Å; Q670-T673 WeakPolarHBondContact CA-OG1 3.24Å; Q670-T673 PolarHBondContact O-N 2.85Å; Q670-T673 PolarHBondContact O-OG1 3.25Å; Q670-T673 VanDerWaalsContact O-OG1 3.13Å; Q670-H674 VanDerWaalsContact O-CB 3.27Å; Q670-H674 WeakPolarHBondContact O-CB 3.42Å; Q670-H674 PolarHBondContact O-N 2.79Å
671	E	89	Confident	89.5	Confident	120 Å²	120	99 Å²	99	56%	0.561	49%	0.493	S	S	*	.	H	α-helix	trans	-61.1	-45.6	171.6	-72.1	-169.9	147.3	0	0	111.4	E667 T673 H674 L675	E667-E671 WeakPolarHBondContact O-CG 3.41Å; E667-E671 PolarHBondContact O-N 3.28Å; E671-T673 VanDerWaalsContact C-N 3.35Å; E671-T673 PolarHBondContact O-N 2.91Å; E671-H674 PolarHBondContact O-N 2.82Å; E671-L675 WeakPolarHBondContact O-CB 3.37Å; E671-L675 VanDerWaalsContact O-CG 3.29Å; E671-L675 WeakPolarHBondContact O-CG 3.37Å; E671-L675 PolarHBondContact O-N 2.77Å
672	K	89.6	Confident	89.6	Confident	103 Å²	103	100 Å²	100	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-36.2	178.8	172	164.3	155.6	-88.5	0	112.2	H668 E669 L676	H668-K672 WeakPolarHBondContact O-CB 3.44Å; H668-K672 PolarHBondContact O-N 3.09Å; E669-K672 IonicContact OE1-NZ 3.63Å; E669-K672 PolarHBondContact OE1-NZ 3.41Å; E669-K672 IonicContact OE2-NZ 2.58Å; E669-K672 PolarHBondContact OE2-NZ 3.33Å; K672-L676 WeakPolarHBondContact O-CB 3.48Å; K672-L676 PolarHBondContact O-N 2.89Å; K672-L676 VanDerWaalsContact O-N 3.09Å
673	T	88.3	Confident	89.7	Confident	66 Å²	66	101.3 Å²	101.3	41%	0.405	49%	0.494	S	S	.	.	H	α-helix	trans	-75.6	-35.4	172.7	49.2	0	0	0	0	112.4	E669 Q670 E671 L676 Q677	E669-T673 WeakPolarHBondContact O-CB 3.38Å; E669-T673 WeakPolarHBondContact O-CG2 3.3Å; E669-T673 PolarHBondContact O-N 3.06Å; E669-T673 PolarHBondContact O-OG1 3.27Å; Q670-T673 WeakPolarHBondContact CA-OG1 3.24Å; Q670-T673 PolarHBondContact O-N 2.85Å; Q670-T673 PolarHBondContact O-OG1 3.25Å; Q670-T673 VanDerWaalsContact O-OG1 3.13Å; E671-T673 VanDerWaalsContact C-N 3.35Å; E671-T673 PolarHBondContact O-N 2.91Å; T673-L676 PolarHBondContact O-N 3.27Å; T673-Q677 WeakPolarHBondContact O-CB 3.41Å; T673-Q677 WeakPolarHBondContact O-CG 3.47Å; T673-Q677 PolarHBondContact O-N 2.85Å
674	H	93.2	Very high	89.8	Confident	113 Å²	113	99.6 Å²	99.6	52%	0.523	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-49.2	172.3	-178.7	-75	0	0	0	111.7	Q670 E671 L676 Q677 Q678	Q670-H674 VanDerWaalsContact O-CB 3.27Å; Q670-H674 WeakPolarHBondContact O-CB 3.42Å; Q670-H674 PolarHBondContact O-N 2.79Å; E671-H674 PolarHBondContact O-N 2.82Å; H674-L676 VanDerWaalsContact C-N 3.32Å; H674-L676 PolarHBondContact O-N 3.01Å; H674-Q677 CarbonylContact O-C 3.48Å; H674-Q677 WeakPolarHBondContact O-CB 3.26Å; H674-Q677 PolarHBondContact O-N 3.39Å; H674-Q678 WeakPolarHBondContact O-CB 3.48Å; H674-Q678 PolarHBondContact O-N 3.44Å
675	L	91.2	Very high	90	Very high	107 Å²	107	96.4 Å²	96.4	56%	0.56	48%	0.475	S	S	*	.	H	α-helix	trans	-62.7	-38	177	-72.1	169.7	0	0	0	111.7	E671 Q678 H679	E671-L675 WeakPolarHBondContact O-CB 3.37Å; E671-L675 VanDerWaalsContact O-CG 3.29Å; E671-L675 WeakPolarHBondContact O-CG 3.37Å; E671-L675 PolarHBondContact O-N 2.77Å; L675-Q678 PolarHBondContact O-N 2.81Å; L675-H679 VanDerWaalsContact O-CB 3.24Å; L675-H679 WeakPolarHBondContact O-CB 3.34Å; L675-H679 PolarHBondContact O-N 3.26Å
676	L	88.3	Confident	90.3	Very high	100 Å²	100	94.8 Å²	94.8	52%	0.524	47%	0.472	S	S	.	.	H	α-helix	trans	-69.2	-35.7	174.1	-175.6	146.1	0	0	0	112.1	K672 T673 H674 N680	K672-L676 WeakPolarHBondContact O-CB 3.48Å; K672-L676 PolarHBondContact O-N 2.89Å; K672-L676 VanDerWaalsContact O-N 3.09Å; T673-L676 PolarHBondContact O-N 3.27Å; H674-L676 VanDerWaalsContact C-N 3.32Å; H674-L676 PolarHBondContact O-N 3.01Å; L676-N680 WeakPolarHBondContact CD2-ND2 3.43Å; L676-N680 VanDerWaalsContact O-CB 3.24Å; L676-N680 WeakPolarHBondContact O-CB 3.5Å; L676-N680 PolarHBondContact O-N 2.85Å; L676-N680 PolarHBondContact O-ND2 3Å; L676-N680 PolarHBondContact O-OD1 2.84Å
677	Q	90.8	Very high	90.3	Very high	126 Å²	126	92.9 Å²	92.9	59%	0.589	47%	0.465	S	S	*	.	H	α-helix	trans	-67.6	-42.6	172.3	-76.7	169.7	13.6	0	0	111.9	T673 H674 N680 A681	T673-Q677 WeakPolarHBondContact O-CB 3.41Å; T673-Q677 WeakPolarHBondContact O-CG 3.47Å; T673-Q677 PolarHBondContact O-N 2.85Å; H674-Q677 CarbonylContact O-C 3.48Å; H674-Q677 WeakPolarHBondContact O-CB 3.26Å; H674-Q677 PolarHBondContact O-N 3.39Å; Q677-N680 PolarHBondContact O-N 3.48Å; Q677-A681 WeakPolarHBondContact O-CB 3.29Å; Q677-A681 PolarHBondContact O-N 3Å
678	Q	90.5	Very high	90.6	Very high	84 Å²	84	93 Å²	93	39%	0.393	46%	0.461	S	S	.	.	H	α-helix	trans	-62.8	-53.9	176	177.5	178.7	-13.2	0	0	110.8	H674 L675 N680 A681 E682	H674-Q678 WeakPolarHBondContact O-CB 3.48Å; H674-Q678 PolarHBondContact O-N 3.44Å; L675-Q678 PolarHBondContact O-N 2.81Å; Q678-N680 PolarHBondContact O-N 3.17Å; Q678-A681 PolarHBondContact O-N 2.68Å; Q678-E682 HydrophobicContact CG-CG 4.39Å; Q678-E682 WeakPolarHBondContact CG-OE1 3.24Å; Q678-E682 PolarHBondContact NE2-OE1 3.09Å; Q678-E682 WeakPolarHBondContact O-CB 3.25Å; Q678-E682 WeakPolarHBondContact O-CG 3.49Å; Q678-E682 PolarHBondContact O-N 3.02Å
679	H	91.4	Very high	90.8	Very high	112 Å²	112	91.1 Å²	91.1	52%	0.519	45%	0.454	S	S	.	.	H	α-helix	trans	-54.8	-41	175.4	168.2	-84.6	0	0	0	111.9	L675 K683	L675-H679 VanDerWaalsContact O-CB 3.24Å; L675-H679 WeakPolarHBondContact O-CB 3.34Å; L675-H679 PolarHBondContact O-N 3.26Å; H679-K683 WeakPolarHBondContact O-CB 3.49Å; H679-K683 PolarHBondContact O-N 3.45Å
680	N	89.5	Confident	90.9	Very high	63 Å²	63	92.2 Å²	92.2	34%	0.337	46%	0.459	S	S	.	.	H	α-helix	trans	-69.1	-39.4	175.5	-71	-11.3	0	0	0	112.1	L676 Q677 Q678 K683 D684	L676-N680 WeakPolarHBondContact CD2-ND2 3.43Å; L676-N680 VanDerWaalsContact O-CB 3.24Å; L676-N680 WeakPolarHBondContact O-CB 3.5Å; L676-N680 PolarHBondContact O-N 2.85Å; L676-N680 PolarHBondContact O-ND2 3Å; L676-N680 PolarHBondContact O-OD1 2.84Å; Q677-N680 PolarHBondContact O-N 3.48Å; Q678-N680 PolarHBondContact O-N 3.17Å; N680-K683 PolarHBondContact O-N 3.14Å; N680-D684 WeakPolarHBondContact O-CB 3.38Å; N680-D684 PolarHBondContact O-N 2.82Å
681	A	92.4	Very high	90.9	Very high	54 Å²	54	92.2 Å²	92.2	45%	0.446	46%	0.459	S	S	.	.	H	α-helix	trans	-66.9	-36.8	177.1	0	0	0	0	0	112.8	Q677 Q678 S685	Q677-A681 WeakPolarHBondContact O-CB 3.29Å; Q677-A681 PolarHBondContact O-N 3Å; Q678-A681 PolarHBondContact O-N 2.68Å; A681-S685 WeakPolarHBondContact O-CB 3.48Å; A681-S685 PolarHBondContact O-N 3.25Å
682	E	90.8	Very high	91.2	Very high	105 Å²	105	92 Å²	92	49%	0.491	45%	0.453	S	S	.	.	H	α-helix	trans	-67.9	-49.7	173.2	-72.8	166.2	179.5	0	0	111	Q678 D684 S685 L686	Q678-E682 HydrophobicContact CG-CG 4.39Å; Q678-E682 WeakPolarHBondContact CG-OE1 3.24Å; Q678-E682 PolarHBondContact NE2-OE1 3.09Å; Q678-E682 WeakPolarHBondContact O-CB 3.25Å; Q678-E682 WeakPolarHBondContact O-CG 3.49Å; Q678-E682 PolarHBondContact O-N 3.02Å; E682-D684 VanDerWaalsContact C-N 3.35Å; E682-D684 PolarHBondContact O-N 3.48Å; E682-S685 WeakPolarHBondContact O-CA 3.43Å; E682-S685 WeakPolarHBondContact O-CB 3.45Å; E682-S685 PolarHBondContact O-N 3.36Å; E682-S685 VanDerWaalsContact O-N 3.09Å; E682-L686 PolarHBondContact O-N 3.2Å
683	K	92	Very high	91.2	Very high	113 Å²	113	91.5 Å²	91.5	49%	0.491	45%	0.452	S	S	.	.	H	α-helix	trans	-56.2	-47.8	172.8	179.8	-160.3	170.6	-156.1	0	111.4	H679 N680 S685 L686 V687	H679-K683 WeakPolarHBondContact O-CB 3.49Å; H679-K683 PolarHBondContact O-N 3.45Å; N680-K683 PolarHBondContact O-N 3.14Å; K683-S685 PolarHBondContact O-N 2.85Å; K683-L686 PolarHBondContact O-N 2.84Å; K683-V687 WeakPolarHBondContact O-CB 3.46Å; K683-V687 VanDerWaalsContact O-CG2 3.32Å; K683-V687 WeakPolarHBondContact O-CG2 3.31Å; K683-V687 PolarHBondContact O-N 2.78Å
684	D	91.8	Very high	91.3	Very high	73 Å²	73	93 Å²	93	39%	0.39	46%	0.457	S	S	.	.	H	α-helix	trans	-69.6	-25.6	179.5	-65.9	-12.1	0	0	0	111	N680 E682 R688	N680-D684 WeakPolarHBondContact O-CB 3.38Å; N680-D684 PolarHBondContact O-N 2.82Å; E682-D684 VanDerWaalsContact C-N 3.35Å; E682-D684 PolarHBondContact O-N 3.48Å; D684-R688 VanDerWaalsContact C-CZ 3.46Å; D684-R688 WeakPolarHBondContact O-CB 3.33Å; D684-R688 VanDerWaalsContact O-CG 3.22Å; D684-R688 WeakPolarHBondContact O-CG 3.32Å; D684-R688 PolarHBondContact O-N 2.8Å; D684-R688 PolarHBondContact O-NE 3.17Å; D684-R688 PolarHBondContact O-NH1 3.43Å
685	S	93.1	Very high	91.2	Very high	42 Å²	42	91.9 Å²	91.9	29%	0.294	45%	0.452	S	S	.	.	H	α-helix	trans	-68.4	-51.8	168.6	-159.4	0	0	0	0	110.9	A681 E682 K683 V687 R688 D689	A681-S685 WeakPolarHBondContact O-CB 3.48Å; A681-S685 PolarHBondContact O-N 3.25Å; E682-S685 WeakPolarHBondContact O-CA 3.43Å; E682-S685 WeakPolarHBondContact O-CB 3.45Å; E682-S685 PolarHBondContact O-N 3.36Å; E682-S685 VanDerWaalsContact O-N 3.09Å; K683-S685 PolarHBondContact O-N 2.85Å; S685-V687 PolarHBondContact O-N 3.28Å; S685-R688 CarbonylContact O-C 3.54Å; S685-R688 WeakPolarHBondContact O-CA 3.46Å; S685-R688 WeakPolarHBondContact O-CB 3.19Å; S685-R688 PolarHBondContact O-N 2.75Å; S685-D689 VanDerWaalsContact C-OD2 3.27Å; S685-D689 WeakPolarHBondContact O-CB 3.49Å; S685-D689 PolarHBondContact O-N 2.78Å; S685-D689 PolarHBondContact OG-OD2 2.93Å
686	L	92.6	Very high	91.4	Very high	96 Å²	96	89.8 Å²	89.8	50%	0.503	44%	0.441	S	S	.	.	H	α-helix	trans	-58.4	-36.8	177.7	-176.5	62.1	0	0	0	111.9	E682 K683 D689 H690	E682-L686 PolarHBondContact O-N 3.2Å; K683-L686 PolarHBondContact O-N 2.84Å; L686-D689 PolarHBondContact O-N 3.26Å; L686-H690 VanDerWaalsContact CD1-CE1 3.46Å; L686-H690 WeakPolarHBondContact CD1-CE1 3.44Å; L686-H690 WeakPolarHBondContact O-CB 3.46Å; L686-H690 VanDerWaalsContact O-CG 3.24Å; L686-H690 PolarHBondContact O-N 3.32Å; L686-H690 PolarHBondContact O-ND1 2.77Å
687	V	92.9	Very high	91.6	Very high	58 Å²	58	88.9 Å²	88.9	35%	0.352	44%	0.436	S	S	.	.	H	α-helix	trans	-62.8	-51.6	169.8	168.9	0	0	0	0	110.6	K683 S685 D689 H690 E691	K683-V687 WeakPolarHBondContact O-CB 3.46Å; K683-V687 VanDerWaalsContact O-CG2 3.32Å; K683-V687 WeakPolarHBondContact O-CG2 3.31Å; K683-V687 PolarHBondContact O-N 2.78Å; S685-V687 PolarHBondContact O-N 3.28Å; V687-D689 PolarHBondContact O-N 3Å; V687-H690 PolarHBondContact O-N 2.88Å; V687-E691 HydrophobicContact CG1-CG 4.2Å; V687-E691 WeakPolarHBondContact O-CB 3.24Å; V687-E691 VanDerWaalsContact O-CG 3.26Å; V687-E691 WeakPolarHBondContact O-CG 3.27Å; V687-E691 PolarHBondContact O-N 2.87Å
688	R	93.1	Very high	91.4	Very high	114 Å²	114	87.4 Å²	87.4	43%	0.43	43%	0.43	S	S	.	.	H	α-helix	trans	-60.9	-29.8	175.9	-71.6	179.7	-56.7	-94.5	1.2	113.4	D684 S685 E691 R692	D684-R688 VanDerWaalsContact C-CZ 3.46Å; D684-R688 WeakPolarHBondContact O-CB 3.33Å; D684-R688 VanDerWaalsContact O-CG 3.22Å; D684-R688 WeakPolarHBondContact O-CG 3.32Å; D684-R688 PolarHBondContact O-N 2.8Å; D684-R688 PolarHBondContact O-NE 3.17Å; D684-R688 PolarHBondContact O-NH1 3.43Å; S685-R688 CarbonylContact O-C 3.54Å; S685-R688 WeakPolarHBondContact O-CA 3.46Å; S685-R688 WeakPolarHBondContact O-CB 3.19Å; S685-R688 PolarHBondContact O-N 2.75Å; R688-E691 WeakPolarHBondContact CA-OE2 3.33Å; R688-R692 WeakPolarHBondContact O-CB 3.43Å; R688-R692 PolarHBondContact O-N 3.3Å; R688-R692 VanDerWaalsContact O-N 3.1Å; R688-R692 PolarHBondContact O-NE 3.4Å; R688-R692 PolarHBondContact O-NH2 3.28Å; R688-R692 VanDerWaalsContact O-NH2 3.16Å
689	D	90.8	Very high	91.6	Very high	66 Å²	66	87.5 Å²	87.5	35%	0.353	43%	0.428	S	S	.	.	H	α-helix	trans	-73.5	-46.4	177.9	-68.6	-45.7	0	0	0	109.9	S685 L686 V687 R692 E693	S685-D689 VanDerWaalsContact C-OD2 3.27Å; S685-D689 WeakPolarHBondContact O-CB 3.49Å; S685-D689 PolarHBondContact O-N 2.78Å; S685-D689 PolarHBondContact OG-OD2 2.93Å; L686-D689 PolarHBondContact O-N 3.26Å; V687-D689 PolarHBondContact O-N 3Å; D689-R692 PolarHBondContact O-N 3.13Å; D689-R692 IonicContact OD1-CZ 2.86Å; D689-R692 IonicContact OD1-NH1 3.62Å; D689-R692 PolarHBondContact OD1-NH1 2.78Å; D689-R692 IonicContact OD1-NH2 2.64Å; D689-R692 PolarHBondContact OD1-NH2 2.84Å; D689-E693 PolarHBondContact O-N 3.46Å
690	H	89.2	Confident	91.6	Very high	109 Å²	109	87.8 Å²	87.8	51%	0.505	43%	0.43	S	S	.	.	H	α-helix	trans	-63.8	-40.8	170.9	-66.7	141.2	0	0	0	112.8	L686 V687 R692 E693 I694	L686-H690 VanDerWaalsContact CD1-CE1 3.46Å; L686-H690 WeakPolarHBondContact CD1-CE1 3.44Å; L686-H690 WeakPolarHBondContact O-CB 3.46Å; L686-H690 VanDerWaalsContact O-CG 3.24Å; L686-H690 PolarHBondContact O-N 3.32Å; L686-H690 PolarHBondContact O-ND1 2.77Å; V687-H690 PolarHBondContact O-N 2.88Å; H690-R692 VanDerWaalsContact C-N 3.32Å; H690-R692 PolarHBondContact O-N 2.71Å; H690-E693 PolarHBondContact O-N 3.46Å; H690-I694 WeakPolarHBondContact O-CB 3.19Å; H690-I694 VanDerWaalsContact O-CG1 3.24Å; H690-I694 WeakPolarHBondContact O-CG1 3.33Å; H690-I694 PolarHBondContact O-N 3.47Å
691	E	88.8	Confident	91.5	Very high	112 Å²	112	90.1 Å²	90.1	52%	0.523	44%	0.442	S	S	.	.	H	α-helix	trans	-59.7	-42.4	175	-76.5	171	163.3	0	0	111.1	V687 R688 E695	V687-E691 HydrophobicContact CG1-CG 4.2Å; V687-E691 WeakPolarHBondContact O-CB 3.24Å; V687-E691 VanDerWaalsContact O-CG 3.26Å; V687-E691 WeakPolarHBondContact O-CG 3.27Å; V687-E691 PolarHBondContact O-N 2.87Å; R688-E691 WeakPolarHBondContact CA-OE2 3.33Å; E691-E695 WeakPolarHBondContact O-CB 3.3Å; E691-E695 PolarHBondContact O-N 3.09Å
692	R	94.1	Very high	91.6	Very high	116 Å²	116	93.2 Å²	93.2	44%	0.438	44%	0.442	S	S	.	.	H	α-helix	trans	-66.7	-37.8	174.5	-87.5	174.3	-81	118.1	-2	112.6	R688 D689 H690 E695 N696	R688-R692 WeakPolarHBondContact O-CB 3.43Å; R688-R692 PolarHBondContact O-N 3.3Å; R688-R692 VanDerWaalsContact O-N 3.1Å; R688-R692 PolarHBondContact O-NE 3.4Å; R688-R692 PolarHBondContact O-NH2 3.28Å; R688-R692 VanDerWaalsContact O-NH2 3.16Å; D689-R692 PolarHBondContact O-N 3.13Å; D689-R692 IonicContact OD1-CZ 2.86Å; D689-R692 IonicContact OD1-NH1 3.62Å; D689-R692 PolarHBondContact OD1-NH1 2.78Å; D689-R692 IonicContact OD1-NH2 2.64Å; D689-R692 PolarHBondContact OD1-NH2 2.84Å; H690-R692 VanDerWaalsContact C-N 3.32Å; H690-R692 PolarHBondContact O-N 2.71Å; R692-E695 PolarHBondContact O-N 2.8Å; R692-N696 WeakPolarHBondContact O-CB 3.26Å; R692-N696 PolarHBondContact O-N 3.39Å; R692-N696 PolarHBondContact O-ND2 3.4Å; R692-N696 PolarHBondContact O-OD1 3.32Å
693	E	91.4	Very high	91.7	Very high	92 Å²	92	90.4 Å²	90.4	43%	0.43	44%	0.437	S	S	.	.	H	α-helix	trans	-72.8	-36.9	177.5	-165.9	55.9	-161.7	0	0	112.5	D689 H690 N696 L697	D689-E693 PolarHBondContact O-N 3.46Å; H690-E693 PolarHBondContact O-N 3.46Å; E693-N696 WeakPolarHBondContact O-CB 3.43Å; E693-N696 PolarHBondContact O-N 2.95Å; E693-N696 PolarHBondContact OE2-ND2 2.83Å; E693-L697 HydrophobicContact CG-CD1 4.31Å; E693-L697 WeakPolarHBondContact O-CB 3.49Å; E693-L697 VanDerWaalsContact O-CG 3.29Å; E693-L697 WeakPolarHBondContact O-CG 3.19Å; E693-L697 PolarHBondContact O-N 3.43Å
694	I	88.6	Confident	91.7	Very high	98 Å²	98	86.9 Å²	86.9	50%	0.503	43%	0.429	S	S	.	.	H	α-helix	trans	-59.8	-46.4	168	-68.7	163.2	0	0	0	109.9	H690 N696 L697 E698	H690-I694 WeakPolarHBondContact O-CB 3.19Å; H690-I694 VanDerWaalsContact O-CG1 3.24Å; H690-I694 WeakPolarHBondContact O-CG1 3.33Å; H690-I694 PolarHBondContact O-N 3.47Å; I694-N696 VanDerWaalsContact C-N 3.29Å; I694-N696 PolarHBondContact O-N 2.97Å; I694-L697 PolarHBondContact O-N 3.07Å; I694-E698 HydrophobicContact CG2-CG 4.42Å; I694-E698 WeakPolarHBondContact O-CB 3.38Å; I694-E698 WeakPolarHBondContact O-CG 3.48Å; I694-E698 PolarHBondContact O-N 2.87Å
695	E	92.4	Very high	91.5	Very high	90 Å²	90	88.4 Å²	88.4	42%	0.421	44%	0.437	S	S	.	.	H	α-helix	trans	-64	-33.7	177.6	-152.7	-148.7	161.7	0	0	112.2	E691 R692 K699	E691-E695 WeakPolarHBondContact O-CB 3.3Å; E691-E695 PolarHBondContact O-N 3.09Å; R692-E695 PolarHBondContact O-N 2.8Å; E695-K699 WeakPolarHBondContact O-CB 3.46Å; E695-K699 VanDerWaalsContact O-CD 3.26Å; E695-K699 WeakPolarHBondContact O-CD 3.45Å; E695-K699 WeakPolarHBondContact O-CG 3.22Å; E695-K699 PolarHBondContact O-N 3.47Å; E695-K699 WeakPolarHBondContact OE1-CE 3.37Å; E695-K699 IonicContact OE1-NZ 2.69Å; E695-K699 PolarHBondContact OE1-NZ 2.81Å; E695-K699 IonicContact OE2-NZ 3.51Å; E695-K699 PolarHBondContact OE2-NZ 3.25Å
696	N	95.1	Very high	91.5	Very high	62 Å²	62	92.5 Å²	92.5	33%	0.332	45%	0.453	S	S	.	.	H	α-helix	trans	-68.3	-48.8	174	-71.1	-23.9	0	0	0	111.8	R692 E693 I694 K699 Q700	R692-N696 WeakPolarHBondContact O-CB 3.26Å; R692-N696 PolarHBondContact O-N 3.39Å; R692-N696 PolarHBondContact O-ND2 3.4Å; R692-N696 PolarHBondContact O-OD1 3.32Å; E693-N696 WeakPolarHBondContact O-CB 3.43Å; E693-N696 PolarHBondContact O-N 2.95Å; E693-N696 PolarHBondContact OE2-ND2 2.83Å; I694-N696 VanDerWaalsContact C-N 3.29Å; I694-N696 PolarHBondContact O-N 2.97Å; N696-K699 WeakPolarHBondContact O-CB 3.13Å; N696-K699 PolarHBondContact O-N 3.27Å; N696-K699 VanDerWaalsContact O-N 3.15Å; N696-Q700 WeakPolarHBondContact O-CG 3.44Å; N696-Q700 PolarHBondContact O-N 2.9Å
697	L	92	Very high	91.4	Very high	82 Å²	82	93.8 Å²	93.8	43%	0.429	46%	0.456	S	S	.	.	H	α-helix	trans	-64	-40.9	177.5	-70.2	169.6	0	0	0	110.9	E693 I694 K699 Q700 L701	E693-L697 HydrophobicContact CG-CD1 4.31Å; E693-L697 WeakPolarHBondContact O-CB 3.49Å; E693-L697 VanDerWaalsContact O-CG 3.29Å; E693-L697 WeakPolarHBondContact O-CG 3.19Å; E693-L697 PolarHBondContact O-N 3.43Å; I694-L697 PolarHBondContact O-N 3.07Å; L697-K699 PolarHBondContact O-N 3.28Å; L697-Q700 PolarHBondContact O-N 2.73Å; L697-L701 WeakPolarHBondContact O-CB 3.49Å; L697-L701 VanDerWaalsContact O-CG 3.29Å; L697-L701 WeakPolarHBondContact O-CG 3.41Å; L697-L701 PolarHBondContact O-N 3.18Å
698	E	87.4	Confident	91.4	Very high	95 Å²	95	95.9 Å²	95.9	44%	0.444	46%	0.462	S	S	.	.	H	α-helix	trans	-61.9	-40.8	170.6	-76.8	-170.1	-167.6	0	0	112.4	I694 Q700 L701 R702	I694-E698 HydrophobicContact CG2-CG 4.42Å; I694-E698 WeakPolarHBondContact O-CB 3.38Å; I694-E698 WeakPolarHBondContact O-CG 3.48Å; I694-E698 PolarHBondContact O-N 2.87Å; E698-Q700 VanDerWaalsContact C-N 3.34Å; E698-L701 PolarHBondContact O-N 3.17Å; E698-R702 VanDerWaalsContact CB-NH2 3.27Å; E698-R702 WeakPolarHBondContact O-CB 3.37Å; E698-R702 WeakPolarHBondContact O-CG 3.27Å; E698-R702 PolarHBondContact O-N 3.42Å; E698-R702 PolarHBondContact O-NE 2.99Å; E698-R702 IonicContact OE2-CZ 3.49Å; E698-R702 IonicContact OE2-NE 2.67Å; E698-R702 IonicContact OE2-NH2 2.62Å; E698-R702 PolarHBondContact OE2-NH2 3.46Å
699	K	94.3	Very high	91	Very high	85 Å²	85	94.1 Å²	94.1	37%	0.37	46%	0.459	S	S	.	.	H	α-helix	trans	-62.4	-42.1	175	-76.6	159.6	-170	160.2	0	111.1	E695 N696 L697 R702 A703	E695-K699 WeakPolarHBondContact O-CB 3.46Å; E695-K699 VanDerWaalsContact O-CD 3.26Å; E695-K699 WeakPolarHBondContact O-CD 3.45Å; E695-K699 WeakPolarHBondContact O-CG 3.22Å; E695-K699 PolarHBondContact O-N 3.47Å; E695-K699 WeakPolarHBondContact OE1-CE 3.37Å; E695-K699 IonicContact OE1-NZ 2.69Å; E695-K699 PolarHBondContact OE1-NZ 2.81Å; E695-K699 IonicContact OE2-NZ 3.51Å; E695-K699 PolarHBondContact OE2-NZ 3.25Å; N696-K699 WeakPolarHBondContact O-CB 3.13Å; N696-K699 PolarHBondContact O-N 3.27Å; N696-K699 VanDerWaalsContact O-N 3.15Å; L697-K699 PolarHBondContact O-N 3.28Å; K699-R702 PolarHBondContact O-N 3.33Å; K699-A703 WeakPolarHBondContact O-CB 3.48Å; K699-A703 PolarHBondContact O-N 2.86Å
700	Q	91.3	Very high	91.2	Very high	119 Å²	119	95.4 Å²	95.4	56%	0.556	47%	0.466	S	S	*	.	H	α-helix	trans	-65	-46.9	176.3	-69.6	172.6	33.4	0	0	111.6	N696 L697 E698 R702 A703 A704	N696-Q700 WeakPolarHBondContact O-CG 3.44Å; N696-Q700 PolarHBondContact O-N 2.9Å; L697-Q700 PolarHBondContact O-N 2.73Å; E698-Q700 VanDerWaalsContact C-N 3.34Å; Q700-R702 PolarHBondContact O-N 3.03Å; Q700-A703 PolarHBondContact O-N 2.83Å; Q700-A704 WeakPolarHBondContact O-CB 3.18Å; Q700-A704 PolarHBondContact O-N 2.76Å
701	L	88.5	Confident	91.4	Very high	111 Å²	111	94.4 Å²	94.4	58%	0.581	46%	0.461	S	S	*	.	H	α-helix	trans	-63.8	-38.9	175.9	-71.5	169.9	0	0	0	112	L697 E698 N705	L697-L701 WeakPolarHBondContact O-CB 3.49Å; L697-L701 VanDerWaalsContact O-CG 3.29Å; L697-L701 WeakPolarHBondContact O-CG 3.41Å; L697-L701 PolarHBondContact O-N 3.18Å; E698-L701 PolarHBondContact O-N 3.17Å; L701-N705 VanDerWaalsContact O-CB 3.26Å; L701-N705 WeakPolarHBondContact O-CB 3.24Å; L701-N705 PolarHBondContact O-N 2.78Å; L701-N705 PolarHBondContact O-ND2 2.91Å
702	R	93.6	Very high	91.4	Very high	119 Å²	119	92.8 Å²	92.8	45%	0.449	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-40.4	173.8	-76.2	-177.6	-99.7	114.3	-11.6	111.5	E698 K699 Q700 M706	E698-R702 VanDerWaalsContact CB-NH2 3.27Å; E698-R702 WeakPolarHBondContact O-CB 3.37Å; E698-R702 WeakPolarHBondContact O-CG 3.27Å; E698-R702 PolarHBondContact O-N 3.42Å; E698-R702 PolarHBondContact O-NE 2.99Å; E698-R702 IonicContact OE2-CZ 3.49Å; E698-R702 IonicContact OE2-NE 2.67Å; E698-R702 IonicContact OE2-NH2 2.62Å; E698-R702 PolarHBondContact OE2-NH2 3.46Å; K699-R702 PolarHBondContact O-N 3.33Å; Q700-R702 PolarHBondContact O-N 3.03Å; R702-M706 WeakPolarHBondContact O-CB 3.33Å; R702-M706 VanDerWaalsContact O-CG 3.31Å; R702-M706 WeakPolarHBondContact O-CG 3.15Å; R702-M706 PolarHBondContact O-N 2.77Å
703	A	92.6	Very high	91.3	Very high	47 Å²	47	90.7 Å²	90.7	39%	0.388	45%	0.451	S	S	.	.	H	α-helix	trans	-64.6	-49.3	174.4	0	0	0	0	0	112	K699 Q700 N705 M706 E707	K699-A703 WeakPolarHBondContact O-CB 3.48Å; K699-A703 PolarHBondContact O-N 2.86Å; Q700-A703 PolarHBondContact O-N 2.83Å; A703-N705 VanDerWaalsContact C-N 3.34Å; A703-N705 PolarHBondContact O-N 3.01Å; A703-M706 WeakPolarHBondContact O-CB 3.35Å; A703-M706 PolarHBondContact O-N 2.93Å; A703-M706 VanDerWaalsContact O-N 3.09Å; A703-E707 PolarHBondContact O-N 2.83Å
704	A	91.5	Very high	91.3	Very high	38 Å²	38	91.3 Å²	91.3	31%	0.314	45%	0.453	S	S	.	.	H	α-helix	trans	-61.2	-39.9	177.3	0	0	0	0	0	112.4	Q700 E707 H708	Q700-A704 WeakPolarHBondContact O-CB 3.18Å; Q700-A704 PolarHBondContact O-N 2.76Å; A704-E707 PolarHBondContact O-N 2.87Å; A704-H708 WeakPolarHBondContact O-CB 3.37Å; A704-H708 PolarHBondContact O-CD2 3.27Å; A704-H708 VanDerWaalsContact O-CD2 3.22Å; A704-H708 VanDerWaalsContact O-CG 3.3Å; A704-H708 PolarHBondContact O-N 3.47Å
705	N	89	Confident	91.5	Very high	106 Å²	106	91.9 Å²	91.9	57%	0.567	45%	0.453	S	S	*	.	H	α-helix	trans	-66.6	-35	173.8	-76.1	-35.1	0	0	0	112.7	L701 A703 E709	L701-N705 VanDerWaalsContact O-CB 3.26Å; L701-N705 WeakPolarHBondContact O-CB 3.24Å; L701-N705 PolarHBondContact O-N 2.78Å; L701-N705 PolarHBondContact O-ND2 2.91Å; A703-N705 VanDerWaalsContact C-N 3.34Å; A703-N705 PolarHBondContact O-N 3.01Å; N705-E709 PolarHBondContact O-N 2.73Å
706	M	93.1	Very high	91.4	Very high	128 Å²	128	93 Å²	93	63%	0.631	46%	0.456	S	S	*	.	H	α-helix	trans	-66.9	-46.2	171.9	-76.1	178.1	62.2	0	0	111.4	R702 A703 H708 E709 D710	R702-M706 WeakPolarHBondContact O-CB 3.33Å; R702-M706 VanDerWaalsContact O-CG 3.31Å; R702-M706 WeakPolarHBondContact O-CG 3.15Å; R702-M706 PolarHBondContact O-N 2.77Å; A703-M706 WeakPolarHBondContact O-CB 3.35Å; A703-M706 PolarHBondContact O-N 2.93Å; A703-M706 VanDerWaalsContact O-N 3.09Å; M706-H708 VanDerWaalsContact C-N 3.29Å; M706-H708 PolarHBondContact O-N 3.37Å; M706-E709 PolarHBondContact O-N 3.08Å; M706-D710 WeakPolarHBondContact O-CB 3.25Å; M706-D710 PolarHBondContact O-N 2.76Å
707	E	90.3	Very high	91.4	Very high	122 Å²	122	96 Å²	96	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-59.7	-39	175.3	-72.3	-179.1	-166.9	0	0	112.1	A703 A704 Q711	A703-E707 PolarHBondContact O-N 2.83Å; A704-E707 PolarHBondContact O-N 2.87Å; E707-Q711 WeakPolarHBondContact O-CB 3.28Å; E707-Q711 WeakPolarHBondContact O-CG 3.49Å; E707-Q711 PolarHBondContact O-N 3.35Å
708	H	91.4	Very high	91.4	Very high	103 Å²	103	97.2 Å²	97.2	48%	0.477	47%	0.465	S	S	.	.	H	α-helix	trans	-68.8	-42.4	174.6	-72.1	-36.8	0	0	0	113.1	A704 M706 Q711 I712	A704-H708 WeakPolarHBondContact O-CB 3.37Å; A704-H708 PolarHBondContact O-CD2 3.27Å; A704-H708 VanDerWaalsContact O-CD2 3.22Å; A704-H708 VanDerWaalsContact O-CG 3.3Å; A704-H708 PolarHBondContact O-N 3.47Å; M706-H708 VanDerWaalsContact C-N 3.29Å; M706-H708 PolarHBondContact O-N 3.37Å; H708-Q711 PolarHBondContact ND1-OE1 2.92Å; H708-Q711 PolarHBondContact O-N 2.98Å; H708-I712 VanDerWaalsContact O-CB 3.3Å; H708-I712 WeakPolarHBondContact O-CB 3.28Å; H708-I712 WeakPolarHBondContact O-CD1 3.4Å; H708-I712 WeakPolarHBondContact O-CG1 3.34Å; H708-I712 PolarHBondContact O-N 3.26Å
709	E	86.6	Confident	91.7	Very high	77 Å²	77	97 Å²	97	36%	0.36	47%	0.467	S	S	.	.	H	α-helix	trans	-68.4	-36.4	175.1	-179.2	56.6	-147.3	0	0	111.7	N705 M706 I712 Q713 K716	N705-E709 PolarHBondContact O-N 2.73Å; M706-E709 PolarHBondContact O-N 3.08Å; E709-I712 CarbonylContact O-C 3.45Å; E709-I712 PolarHBondContact O-N 3.39Å; E709-Q713 WeakPolarHBondContact O-CB 3.47Å; E709-Q713 WeakPolarHBondContact O-CG 3.47Å; E709-Q713 PolarHBondContact O-N 2.92Å; E709-Q713 WeakPolarHBondContact OE1-CG 3.22Å; E709-Q713 PolarHBondContact OE1-NE2 3.25Å; E709-Q713 VanDerWaalsContact OE1-NE2 3.1Å; E709-K716 IonicContact OE1-NZ 3.33Å; E709-K716 PolarHBondContact OE1-NZ 3.5Å; E709-K716 IonicContact OE2-NZ 3.63Å
710	D	93.5	Very high	91.6	Very high	92 Å²	92	95.5 Å²	95.5	49%	0.492	47%	0.471	S	S	.	.	H	α-helix	trans	-64.1	-44.9	173.2	-82.7	-28.1	0	0	0	111.3	M706 I712 Q713 E714	M706-D710 WeakPolarHBondContact O-CB 3.25Å; M706-D710 PolarHBondContact O-N 2.76Å; D710-I712 PolarHBondContact O-N 2.62Å; D710-Q713 CarbonylContact O-C 3.58Å; D710-Q713 PolarHBondContact O-N 2.69Å; D710-E714 PolarHBondContact O-N 2.86Å
711	Q	93.1	Very high	91.8	Very high	89 Å²	89	95 Å²	95	42%	0.416	47%	0.468	S	S	.	.	H	α-helix	trans	-57.6	-48.2	171.7	-75.8	164.6	23.2	0	0	111.1	E707 H708 Q713 E714 F715	E707-Q711 WeakPolarHBondContact O-CB 3.28Å; E707-Q711 WeakPolarHBondContact O-CG 3.49Å; E707-Q711 PolarHBondContact O-N 3.35Å; H708-Q711 PolarHBondContact ND1-OE1 2.92Å; H708-Q711 PolarHBondContact O-N 2.98Å; Q711-Q713 VanDerWaalsContact C-N 3.3Å; Q711-Q713 PolarHBondContact O-N 3.07Å; Q711-E714 PolarHBondContact O-N 2.89Å; Q711-E714 VanDerWaalsContact O-N 3.14Å; Q711-F715 HydrophobicContact CB-CE2 4.43Å; Q711-F715 WeakPolarHBondContact O-CD2 3.43Å; Q711-F715 PolarHBondContact O-N 2.82Å
712	I	90.6	Very high	92.1	Very high	77 Å²	77	93.6 Å²	93.6	40%	0.395	46%	0.464	S	S	.	.	H	α-helix	trans	-60.6	-38.5	176.9	-74.7	166.1	0	0	0	110.9	H708 E709 D710 F715 K716	H708-I712 VanDerWaalsContact O-CB 3.3Å; H708-I712 WeakPolarHBondContact O-CB 3.28Å; H708-I712 WeakPolarHBondContact O-CD1 3.4Å; H708-I712 WeakPolarHBondContact O-CG1 3.34Å; H708-I712 PolarHBondContact O-N 3.26Å; E709-I712 CarbonylContact O-C 3.45Å; E709-I712 PolarHBondContact O-N 3.39Å; D710-I712 PolarHBondContact O-N 2.62Å; I712-F715 PolarHBondContact O-N 2.75Å; I712-K716 HydrophobicContact CG2-CD 3.98Å; I712-K716 VanDerWaalsContact CG2-NZ 3.26Å; I712-K716 WeakPolarHBondContact O-CB 3.49Å; I712-K716 WeakPolarHBondContact O-CD 3.23Å; I712-K716 WeakPolarHBondContact O-CG 3.22Å; I712-K716 PolarHBondContact O-N 2.65Å
713	Q	90.9	Very high	92.1	Very high	73 Å²	73	92.6 Å²	92.6	34%	0.341	47%	0.466	S	S	.	.	H	α-helix	trans	-70.5	-34.1	174.3	-75.1	-174.6	35.4	0	0	112.8	E709 D710 Q711 K717	E709-Q713 WeakPolarHBondContact O-CB 3.47Å; E709-Q713 WeakPolarHBondContact O-CG 3.47Å; E709-Q713 PolarHBondContact O-N 2.92Å; E709-Q713 WeakPolarHBondContact OE1-CG 3.22Å; E709-Q713 PolarHBondContact OE1-NE2 3.25Å; E709-Q713 VanDerWaalsContact OE1-NE2 3.1Å; D710-Q713 CarbonylContact O-C 3.58Å; D710-Q713 PolarHBondContact O-N 2.69Å; Q711-Q713 VanDerWaalsContact C-N 3.3Å; Q711-Q713 PolarHBondContact O-N 3.07Å; Q713-K717 WeakPolarHBondContact O-CB 3.36Å; Q713-K717 VanDerWaalsContact O-CD 3.28Å; Q713-K717 WeakPolarHBondContact O-CD 3.46Å; Q713-K717 WeakPolarHBondContact O-CG 3.44Å; Q713-K717 PolarHBondContact O-N 3.48Å
714	E	92.4	Very high	92.2	Very high	104 Å²	104	92.5 Å²	92.5	49%	0.486	47%	0.466	S	S	.	.	H	α-helix	trans	-66.6	-40.6	169.4	-70.7	-155.8	164.2	0	0	112.4	D710 Q711 K717 R718	D710-E714 PolarHBondContact O-N 2.86Å; Q711-E714 PolarHBondContact O-N 2.89Å; Q711-E714 VanDerWaalsContact O-N 3.14Å; E714-K717 PolarHBondContact O-N 2.76Å; E714-R718 WeakPolarHBondContact O-CB 3.46Å; E714-R718 VanDerWaalsContact O-CG 3.28Å; E714-R718 WeakPolarHBondContact O-CG 3.29Å; E714-R718 PolarHBondContact O-N 3.19Å; E714-R718 IonicContact OE2-CZ 2.73Å; E714-R718 IonicContact OE2-NE 3.68Å; E714-R718 IonicContact OE2-NH2 3.73Å; E714-R718 PolarHBondContact OE2-NH2 3.02Å
715	F	91.8	Very high	92.3	Very high	111 Å²	111	94.4 Å²	94.4	49%	0.487	47%	0.471	S	S	.	.	H	α-helix	trans	-58.3	-54.5	171.6	-74.6	-69.3	0	0	0	110	Q711 I712 K717 R718 D719	Q711-F715 HydrophobicContact CB-CE2 4.43Å; Q711-F715 WeakPolarHBondContact O-CD2 3.43Å; Q711-F715 PolarHBondContact O-N 2.82Å; I712-F715 PolarHBondContact O-N 2.75Å; F715-K717 VanDerWaalsContact C-N 3.26Å; F715-K717 PolarHBondContact O-N 2.81Å; F715-K717 VanDerWaalsContact O-N 3.16Å; F715-R718 PolarHBondContact O-N 3.38Å; F715-D719 WeakPolarHBondContact O-CB 2.83Å; F715-D719 PolarHBondContact O-N 2.82Å
716	K	91.1	Very high	92.6	Very high	113 Å²	113	94.9 Å²	94.9	49%	0.491	47%	0.471	S	S	.	.	H	α-helix	trans	-51.6	-40.2	174.5	-69.3	162.3	-176.6	163.9	0	112.8	E709 I712 A720	E709-K716 IonicContact OE1-NZ 3.33Å; E709-K716 PolarHBondContact OE1-NZ 3.5Å; E709-K716 IonicContact OE2-NZ 3.63Å; I712-K716 HydrophobicContact CG2-CD 3.98Å; I712-K716 VanDerWaalsContact CG2-NZ 3.26Å; I712-K716 WeakPolarHBondContact O-CB 3.49Å; I712-K716 WeakPolarHBondContact O-CD 3.23Å; I712-K716 WeakPolarHBondContact O-CG 3.22Å; I712-K716 PolarHBondContact O-N 2.65Å; K716-A720 WeakPolarHBondContact O-CB 3.48Å; K716-A720 PolarHBondContact O-N 3.41Å
717	K	94	Very high	92.5	Very high	125 Å²	125	94.2 Å²	94.2	54%	0.543	47%	0.466	S	S	.	.	H	α-helix	trans	-69.7	-44.1	176.8	-73.4	159.7	-167.1	160.1	0	112.3	Q713 E714 F715 Q721	Q713-K717 WeakPolarHBondContact O-CB 3.36Å; Q713-K717 VanDerWaalsContact O-CD 3.28Å; Q713-K717 WeakPolarHBondContact O-CD 3.46Å; Q713-K717 WeakPolarHBondContact O-CG 3.44Å; Q713-K717 PolarHBondContact O-N 3.48Å; E714-K717 PolarHBondContact O-N 2.76Å; F715-K717 VanDerWaalsContact C-N 3.26Å; F715-K717 PolarHBondContact O-N 2.81Å; F715-K717 VanDerWaalsContact O-N 3.16Å; K717-Q721 WeakPolarHBondContact O-CB 3.48Å; K717-Q721 PolarHBondContact O-N 2.82Å
718	R	93.1	Very high	92.7	Very high	107 Å²	107	90.8 Å²	90.8	40%	0.404	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-42.8	177.7	-71.4	-176.7	-117.8	110.3	-10	110.9	E714 F715 Q721 V722	E714-R718 WeakPolarHBondContact O-CB 3.46Å; E714-R718 VanDerWaalsContact O-CG 3.28Å; E714-R718 WeakPolarHBondContact O-CG 3.29Å; E714-R718 PolarHBondContact O-N 3.19Å; E714-R718 IonicContact OE2-CZ 2.73Å; E714-R718 IonicContact OE2-NE 3.68Å; E714-R718 IonicContact OE2-NH2 3.73Å; E714-R718 PolarHBondContact OE2-NH2 3.02Å; F715-R718 PolarHBondContact O-N 3.38Å; R718-Q721 PolarHBondContact O-N 3.06Å; R718-V722 WeakPolarHBondContact O-CG2 3.23Å; R718-V722 PolarHBondContact O-N 2.76Å
719	D	92.6	Very high	92.9	Very high	90 Å²	90	91.5 Å²	91.5	48%	0.481	46%	0.463	S	S	.	.	H	α-helix	trans	-65.3	-44.1	176.4	-60.4	-23.9	0	0	0	111.1	F715 Q721 V722 I723	F715-D719 WeakPolarHBondContact O-CB 2.83Å; F715-D719 PolarHBondContact O-N 2.82Å; D719-Q721 VanDerWaalsContact C-N 3.33Å; D719-Q721 PolarHBondContact O-N 2.99Å; D719-V722 PolarHBondContact O-N 3.21Å; D719-I723 WeakPolarHBondContact O-CB 3.45Å; D719-I723 VanDerWaalsContact O-CG1 3.24Å; D719-I723 WeakPolarHBondContact O-CG1 3.4Å; D719-I723 PolarHBondContact O-N 3.41Å
720	A	92.9	Very high	93.3	Very high	55 Å²	55	91 Å²	91	46%	0.455	47%	0.465	S	S	.	.	H	α-helix	trans	-62.2	-37.5	174.7	0	0	0	0	0	112.8	K716 A724	K716-A720 WeakPolarHBondContact O-CB 3.48Å; K716-A720 PolarHBondContact O-N 3.41Å; A720-A724 WeakPolarHBondContact O-CB 3.46Å; A720-A724 PolarHBondContact O-N 3.38Å
721	Q	94.5	Very high	93.3	Very high	109 Å²	109	91.7 Å²	91.7	51%	0.509	47%	0.465	S	S	.	.	H	α-helix	trans	-65.8	-46.3	173.5	-178.7	59.8	50.7	0	0	111.4	K717 R718 D719 I723 A724 D725	K717-Q721 WeakPolarHBondContact O-CB 3.48Å; K717-Q721 PolarHBondContact O-N 2.82Å; R718-Q721 PolarHBondContact O-N 3.06Å; D719-Q721 VanDerWaalsContact C-N 3.33Å; D719-Q721 PolarHBondContact O-N 2.99Å; Q721-I723 VanDerWaalsContact C-N 3.33Å; Q721-I723 PolarHBondContact O-N 2.95Å; Q721-A724 PolarHBondContact O-N 3.33Å; Q721-D725 PolarHBondContact NE2-OD1 2.74Å; Q721-D725 PolarHBondContact NE2-OD2 3.35Å; Q721-D725 WeakPolarHBondContact O-CB 3.34Å; Q721-D725 PolarHBondContact O-N 3.12Å
722	V	95.7	Very high	93.4	Very high	81 Å²	81	93.1 Å²	93.1	49%	0.491	47%	0.47	S	S	.	.	H	α-helix	trans	-61.1	-41.3	176.1	169.8	0	0	0	0	111.4	R718 D719 D725 M726	R718-V722 WeakPolarHBondContact O-CG2 3.23Å; R718-V722 PolarHBondContact O-N 2.76Å; D719-V722 PolarHBondContact O-N 3.21Å; V722-D725 PolarHBondContact O-N 2.9Å; V722-M726 HydrophobicContact CG1-CG 4.45Å; V722-M726 HydrophobicContact CG1-SD 4.08Å; V722-M726 WeakPolarHBondContact O-CB 3.4Å; V722-M726 VanDerWaalsContact O-CG 3.27Å; V722-M726 WeakPolarHBondContact O-CG 3.41Å; V722-M726 PolarHBondContact O-N 2.9Å
723	I	93.6	Very high	93.5	Very high	97 Å²	97	94.5 Å²	94.5	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-48.6	174	-70.3	163.4	0	0	0	110.2	D719 Q721 D725 M726 E727	D719-I723 WeakPolarHBondContact O-CB 3.45Å; D719-I723 VanDerWaalsContact O-CG1 3.24Å; D719-I723 WeakPolarHBondContact O-CG1 3.4Å; D719-I723 PolarHBondContact O-N 3.41Å; Q721-I723 VanDerWaalsContact C-N 3.33Å; Q721-I723 PolarHBondContact O-N 2.95Å; I723-D725 PolarHBondContact O-N 3.02Å; I723-M726 PolarHBondContact O-N 2.82Å; I723-E727 HydrophobicContact CG2-CG 4.38Å; I723-E727 WeakPolarHBondContact O-CB 3.43Å; I723-E727 WeakPolarHBondContact O-CG 3.23Å; I723-E727 PolarHBondContact O-N 3.46Å
724	A	94.1	Very high	93.7	Very high	46 Å²	46	98.7 Å²	98.7	38%	0.38	49%	0.49	S	S	.	.	H	α-helix	trans	-61.3	-40.4	178	0	0	0	0	0	112.7	A720 Q721 E727 A728	A720-A724 WeakPolarHBondContact O-CB 3.46Å; A720-A724 PolarHBondContact O-N 3.38Å; Q721-A724 PolarHBondContact O-N 3.33Å; A724-E727 PolarHBondContact O-N 2.78Å; A724-A728 VanDerWaalsContact O-CB 3.31Å; A724-A728 WeakPolarHBondContact O-CB 3.42Å; A724-A728 PolarHBondContact O-N 2.8Å
725	D	94.7	Very high	93.8	Very high	77 Å²	77	99.4 Å²	99.4	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-69.4	-34	176.9	-71.1	-35.7	0	0	0	112.3	Q721 V722 I723 Q729	Q721-D725 PolarHBondContact NE2-OD1 2.74Å; Q721-D725 PolarHBondContact NE2-OD2 3.35Å; Q721-D725 WeakPolarHBondContact O-CB 3.34Å; Q721-D725 PolarHBondContact O-N 3.12Å; V722-D725 PolarHBondContact O-N 2.9Å; I723-D725 PolarHBondContact O-N 3.02Å; D725-Q729 WeakPolarHBondContact O-CB 3.41Å; D725-Q729 VanDerWaalsContact O-CG 3.28Å; D725-Q729 WeakPolarHBondContact O-CG 3.26Å; D725-Q729 PolarHBondContact O-N 2.87Å; D725-Q729 VanDerWaalsContact O-N 3.09Å; D725-Q729 PolarHBondContact O-NE2 3.02Å
726	M	93.7	Very high	93.9	Very high	116 Å²	116	98.1 Å²	98.1	57%	0.571	49%	0.489	S	S	*	.	H	α-helix	trans	-71.7	-40.6	172.1	-73	-177.4	73.7	0	0	111.7	V722 I723 Q729 V730	V722-M726 HydrophobicContact CG1-CG 4.45Å; V722-M726 HydrophobicContact CG1-SD 4.08Å; V722-M726 WeakPolarHBondContact O-CB 3.4Å; V722-M726 VanDerWaalsContact O-CG 3.27Å; V722-M726 WeakPolarHBondContact O-CG 3.41Å; V722-M726 PolarHBondContact O-N 2.9Å; I723-M726 PolarHBondContact O-N 2.82Å; M726-Q729 PolarHBondContact O-N 3.24Å; M726-V730 WeakPolarHBondContact O-CB 3.08Å; M726-V730 WeakPolarHBondContact O-CG2 3.44Å; M726-V730 PolarHBondContact O-N 2.94Å
727	E	92.7	Very high	94.1	Very high	114 Å²	114	98.4 Å²	98.4	53%	0.533	50%	0.495	S	S	.	.	H	α-helix	trans	-63.3	-42.6	174.1	-75.8	-172.6	167.8	0	0	111.6	I723 A724 Q729 V730 Q731	I723-E727 HydrophobicContact CG2-CG 4.38Å; I723-E727 WeakPolarHBondContact O-CB 3.43Å; I723-E727 WeakPolarHBondContact O-CG 3.23Å; I723-E727 PolarHBondContact O-N 3.46Å; A724-E727 PolarHBondContact O-N 2.78Å; E727-Q729 PolarHBondContact O-N 3.14Å; E727-V730 PolarHBondContact O-N 2.93Å; E727-Q731 WeakPolarHBondContact O-CB 3.32Å; E727-Q731 VanDerWaalsContact O-CG 3.27Å; E727-Q731 WeakPolarHBondContact O-CG 3.12Å; E727-Q731 PolarHBondContact O-N 3.07Å
728	A	94.7	Very high	94.1	Very high	51 Å²	51	97.6 Å²	97.6	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-41	174.7	0	0	0	0	0	112	A724 Q731 K732	A724-A728 VanDerWaalsContact O-CB 3.31Å; A724-A728 WeakPolarHBondContact O-CB 3.42Å; A724-A728 PolarHBondContact O-N 2.8Å; A728-Q731 PolarHBondContact O-N 3.2Å; A728-K732 WeakPolarHBondContact O-CB 3.32Å; A728-K732 PolarHBondContact O-N 3.19Å
729	Q	95.3	Very high	94.1	Very high	118 Å²	118	96.6 Å²	96.6	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-63.6	-42.4	172.4	-76.9	169.8	85.4	0	0	112.2	D725 M726 E727 K732 L733	D725-Q729 WeakPolarHBondContact O-CB 3.41Å; D725-Q729 VanDerWaalsContact O-CG 3.28Å; D725-Q729 WeakPolarHBondContact O-CG 3.26Å; D725-Q729 PolarHBondContact O-N 2.87Å; D725-Q729 VanDerWaalsContact O-N 3.09Å; D725-Q729 PolarHBondContact O-NE2 3.02Å; M726-Q729 PolarHBondContact O-N 3.24Å; E727-Q729 PolarHBondContact O-N 3.14Å; Q729-K732 PolarHBondContact O-N 2.77Å; Q729-L733 WeakPolarHBondContact O-CB 3.48Å; Q729-L733 VanDerWaalsContact O-CG 3.29Å; Q729-L733 WeakPolarHBondContact O-CG 3.49Å; Q729-L733 PolarHBondContact O-N 2.75Å
730	V	94.5	Very high	94.1	Very high	67 Å²	67	96.6 Å²	96.6	41%	0.406	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-37.7	176.2	167.5	0	0	0	0	111.6	M726 E727 R734	M726-V730 WeakPolarHBondContact O-CB 3.08Å; M726-V730 WeakPolarHBondContact O-CG2 3.44Å; M726-V730 PolarHBondContact O-N 2.94Å; E727-V730 PolarHBondContact O-N 2.93Å; V730-R734 WeakPolarHBondContact O-CB 3.31Å; V730-R734 WeakPolarHBondContact O-CD 3.25Å; V730-R734 WeakPolarHBondContact O-CG 3.03Å; V730-R734 PolarHBondContact O-N 3.46Å
731	Q	93.3	Very high	94.1	Very high	106 Å²	106	97.5 Å²	97.5	50%	0.495	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-50.5	172.9	-72.2	172.2	34.2	0	0	110.8	E727 A728 L733 R734 E735	E727-Q731 WeakPolarHBondContact O-CB 3.32Å; E727-Q731 VanDerWaalsContact O-CG 3.27Å; E727-Q731 WeakPolarHBondContact O-CG 3.12Å; E727-Q731 PolarHBondContact O-N 3.07Å; A728-Q731 PolarHBondContact O-N 3.2Å; Q731-L733 PolarHBondContact O-N 2.83Å; Q731-R734 WeakPolarHBondContact O-CA 3.49Å; Q731-R734 WeakPolarHBondContact O-CB 3.36Å; Q731-R734 PolarHBondContact O-N 3.48Å; Q731-E735 WeakPolarHBondContact O-CG 3.24Å; Q731-E735 PolarHBondContact O-N 2.7Å
732	K	94.9	Very high	94	Very high	118 Å²	118	95 Å²	95	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-58	-42.7	176.7	-175.9	172.3	-179.8	-69	0	112.9	A728 Q729 E735 E736	A728-K732 WeakPolarHBondContact O-CB 3.32Å; A728-K732 PolarHBondContact O-N 3.19Å; Q729-K732 PolarHBondContact O-N 2.77Å; K732-E735 PolarHBondContact O-N 3.49Å; K732-E736 IonicContact NZ-OE1 3.22Å; K732-E736 PolarHBondContact NZ-OE1 3.02Å; K732-E736 WeakPolarHBondContact O-CB 3.34Å; K732-E736 WeakPolarHBondContact O-CG 3.28Å; K732-E736 PolarHBondContact O-N 3.44Å
733	L	93.8	Very high	93.9	Very high	107 Å²	107	96.5 Å²	96.5	56%	0.56	50%	0.495	S	S	*	.	H	α-helix	trans	-67.3	-33.1	175.4	-72.6	169.8	0	0	0	112.7	Q729 Q731 L737	Q729-L733 WeakPolarHBondContact O-CB 3.48Å; Q729-L733 VanDerWaalsContact O-CG 3.29Å; Q729-L733 WeakPolarHBondContact O-CG 3.49Å; Q729-L733 PolarHBondContact O-N 2.75Å; Q731-L733 PolarHBondContact O-N 2.83Å; L733-L737 VanDerWaalsContact O-CB 3.27Å; L733-L737 WeakPolarHBondContact O-CB 3.29Å; L733-L737 PolarHBondContact O-N 2.8Å
734	R	93.8	Very high	93.8	Very high	160 Å²	160	99.9 Å²	99.9	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-68.1	-41.6	171.7	-73.6	166.1	-179.2	179.1	3.5	111.4	V730 Q731 L737 I738	V730-R734 WeakPolarHBondContact O-CB 3.31Å; V730-R734 WeakPolarHBondContact O-CD 3.25Å; V730-R734 WeakPolarHBondContact O-CG 3.03Å; V730-R734 PolarHBondContact O-N 3.46Å; Q731-R734 WeakPolarHBondContact O-CA 3.49Å; Q731-R734 WeakPolarHBondContact O-CB 3.36Å; Q731-R734 PolarHBondContact O-N 3.48Å; R734-L737 PolarHBondContact O-N 2.63Å; R734-I738 WeakPolarHBondContact O-CB 3.23Å; R734-I738 WeakPolarHBondContact O-CD1 3.44Å; R734-I738 WeakPolarHBondContact O-CG1 3.33Å; R734-I738 PolarHBondContact O-N 3.03Å
735	E	94.2	Very high	93.8	Very high	119 Å²	119	103.7 Å²	103.7	56%	0.556	51%	0.51	S	S	*	.	H	α-helix	trans	-64.1	-45.4	174.8	-71.1	178.3	176.8	0	0	111.8	Q731 K732 L737 I738 N739	Q731-E735 WeakPolarHBondContact O-CG 3.24Å; Q731-E735 PolarHBondContact O-N 2.7Å; K732-E735 PolarHBondContact O-N 3.49Å; E735-L737 VanDerWaalsContact C-N 3.35Å; E735-L737 PolarHBondContact O-N 3.24Å; E735-I738 PolarHBondContact O-N 2.73Å; E735-N739 WeakPolarHBondContact O-CB 3.38Å; E735-N739 VanDerWaalsContact O-CG 3.23Å; E735-N739 PolarHBondContact O-N 3.11Å; E735-N739 PolarHBondContact O-ND2 2.69Å; E735-N739 VanDerWaalsContact O-ND2 3.13Å
736	E	95.3	Very high	93.6	Very high	84 Å²	84	105.4 Å²	105.4	39%	0.393	52%	0.515	S	S	.	.	H	α-helix	trans	-59.2	-43.8	173.6	-75.6	172.7	-170.5	0	0	111.5	K732 N739 V740	K732-E736 IonicContact NZ-OE1 3.22Å; K732-E736 PolarHBondContact NZ-OE1 3.02Å; K732-E736 WeakPolarHBondContact O-CB 3.34Å; K732-E736 WeakPolarHBondContact O-CG 3.28Å; K732-E736 PolarHBondContact O-N 3.44Å; E736-N739 PolarHBondContact O-N 3.47Å; E736-V740 WeakPolarHBondContact O-CB 3.32Å; E736-V740 WeakPolarHBondContact O-CG2 3.38Å; E736-V740 PolarHBondContact O-N 2.85Å
737	L	93.9	Very high	93.6	Very high	119 Å²	119	105.2 Å²	105.2	62%	0.623	51%	0.513	S	S	*	.	H	α-helix	trans	-63.5	-40.3	174.6	-180	62.2	0	0	0	112.5	L733 R734 E735 N741	L733-L737 VanDerWaalsContact O-CB 3.27Å; L733-L737 WeakPolarHBondContact O-CB 3.29Å; L733-L737 PolarHBondContact O-N 2.8Å; R734-L737 PolarHBondContact O-N 2.63Å; E735-L737 VanDerWaalsContact C-N 3.35Å; E735-L737 PolarHBondContact O-N 3.24Å; L737-N741 WeakPolarHBondContact O-CB 3.5Å; L737-N741 PolarHBondContact O-N 2.72Å
738	I	94.1	Very high	93.5	Very high	109 Å²	109	104.8 Å²	104.8	56%	0.559	51%	0.514	S	S	*	.	H	α-helix	trans	-64.5	-41.9	175.2	-73.3	163.8	0	0	0	110.5	R734 E735 N741 S742	R734-I738 WeakPolarHBondContact O-CB 3.23Å; R734-I738 WeakPolarHBondContact O-CD1 3.44Å; R734-I738 WeakPolarHBondContact O-CG1 3.33Å; R734-I738 PolarHBondContact O-N 3.03Å; E735-I738 PolarHBondContact O-N 2.73Å; I738-N741 PolarHBondContact O-N 3.01Å; I738-S742 WeakPolarHBondContact O-CB 3.24Å; I738-S742 PolarHBondContact O-N 3.36Å; I738-S742 PolarHBondContact O-OG 2.9Å
739	N	93.2	Very high	93.4	Very high	86 Å²	86	106.8 Å²	106.8	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-68.8	-42.8	178.7	-72.8	-32.8	0	0	0	112.4	E735 E736 N741 S742 Q743	E735-N739 WeakPolarHBondContact O-CB 3.38Å; E735-N739 VanDerWaalsContact O-CG 3.23Å; E735-N739 PolarHBondContact O-N 3.11Å; E735-N739 PolarHBondContact O-ND2 2.69Å; E735-N739 VanDerWaalsContact O-ND2 3.13Å; E736-N739 PolarHBondContact O-N 3.47Å; N739-N741 VanDerWaalsContact C-N 3.3Å; N739-N741 PolarHBondContact O-N 3.39Å; N739-S742 PolarHBondContact O-N 3.16Å; N739-S742 PolarHBondContact O-OG 3.36Å; N739-Q743 WeakPolarHBondContact O-CB 3.38Å; N739-Q743 VanDerWaalsContact O-CG 3.28Å; N739-Q743 WeakPolarHBondContact O-CG 3.37Å; N739-Q743 PolarHBondContact O-N 3.5Å
740	V	94.2	Very high	93.3	Very high	89 Å²	89	105.1 Å²	105.1	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-36.6	173.1	170.7	0	0	0	0	110.9	E736 R744	E736-V740 WeakPolarHBondContact O-CB 3.32Å; E736-V740 WeakPolarHBondContact O-CG2 3.38Å; E736-V740 PolarHBondContact O-N 2.85Å; V740-R744 VanDerWaalsContact O-CB 3.27Å; V740-R744 WeakPolarHBondContact O-CB 3.02Å; V740-R744 PolarHBondContact O-N 3.49Å
741	N	92.9	Very high	93.1	Very high	75 Å²	75	106 Å²	106	40%	0.401	52%	0.515	S	S	.	.	H	α-helix	trans	-70.1	-37.6	175.2	-169.2	4.3	0	0	0	112.2	L737 I738 N739 R744 K745	L737-N741 WeakPolarHBondContact O-CB 3.5Å; L737-N741 PolarHBondContact O-N 2.72Å; I738-N741 PolarHBondContact O-N 3.01Å; N739-N741 VanDerWaalsContact C-N 3.3Å; N739-N741 PolarHBondContact O-N 3.39Å; N741-R744 PolarHBondContact O-N 2.81Å; N741-K745 WeakPolarHBondContact O-CB 3.17Å; N741-K745 VanDerWaalsContact O-CG 3.26Å; N741-K745 WeakPolarHBondContact O-CG 3.43Å; N741-K745 PolarHBondContact O-N 2.58Å; N741-K745 WeakPolarHBondContact OD1-CE 3.35Å
742	S	91.9	Very high	93	Very high	57 Å²	57	102.7 Å²	102.7	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-68.5	-43	175.5	71.6	0	0	0	0	111.5	I738 N739 K745 Q746	I738-S742 WeakPolarHBondContact O-CB 3.24Å; I738-S742 PolarHBondContact O-N 3.36Å; I738-S742 PolarHBondContact O-OG 2.9Å; N739-S742 PolarHBondContact O-N 3.16Å; N739-S742 PolarHBondContact O-OG 3.36Å; S742-K745 WeakPolarHBondContact O-CB 3.14Å; S742-K745 PolarHBondContact O-N 3.49Å; S742-Q746 PolarHBondContact O-N 2.96Å
743	Q	92.9	Very high	92.8	Very high	112 Å²	112	102 Å²	102	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-59.6	-45.1	171.3	-72.3	174	0.6	0	0	111.9	N739 K745 Q746 Q747	N739-Q743 WeakPolarHBondContact O-CB 3.38Å; N739-Q743 VanDerWaalsContact O-CG 3.28Å; N739-Q743 WeakPolarHBondContact O-CG 3.37Å; N739-Q743 PolarHBondContact O-N 3.5Å; Q743-K745 VanDerWaalsContact C-N 3.34Å; Q743-K745 PolarHBondContact O-N 2.85Å; Q743-Q746 WeakPolarHBondContact O-CB 3.2Å; Q743-Q746 PolarHBondContact O-N 3.26Å; Q743-Q747 WeakPolarHBondContact O-CG 3.21Å; Q743-Q747 PolarHBondContact O-N 3.44Å
744	R	91.9	Very high	92.6	Very high	167 Å²	167	101.4 Å²	101.4	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-62.8	-38.6	175.8	-175.3	178.5	178.5	-174.9	0.1	112.3	V740 N741 L748	V740-R744 VanDerWaalsContact O-CB 3.27Å; V740-R744 WeakPolarHBondContact O-CB 3.02Å; V740-R744 PolarHBondContact O-N 3.49Å; N741-R744 PolarHBondContact O-N 2.81Å; R744-L748 HydrophobicContact CG-CD1 4.34Å; R744-L748 WeakPolarHBondContact O-CB 3.21Å; R744-L748 VanDerWaalsContact O-CG 3.27Å; R744-L748 WeakPolarHBondContact O-CG 3.41Å; R744-L748 PolarHBondContact O-N 2.94Å
745	K	93.1	Very high	92.4	Very high	127 Å²	127	102.1 Å²	102.1	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-64.3	-43.4	173.1	-75.5	168.8	-178.8	177.3	0	111.4	N741 S742 Q743 L748 V749	N741-K745 WeakPolarHBondContact O-CB 3.17Å; N741-K745 VanDerWaalsContact O-CG 3.26Å; N741-K745 WeakPolarHBondContact O-CG 3.43Å; N741-K745 PolarHBondContact O-N 2.58Å; N741-K745 WeakPolarHBondContact OD1-CE 3.35Å; S742-K745 WeakPolarHBondContact O-CB 3.14Å; S742-K745 PolarHBondContact O-N 3.49Å; Q743-K745 VanDerWaalsContact C-N 3.34Å; Q743-K745 PolarHBondContact O-N 2.85Å; K745-L748 PolarHBondContact O-N 3.28Å; K745-V749 WeakPolarHBondContact O-CG2 3.49Å; K745-V749 PolarHBondContact O-N 2.91Å
746	Q	91.9	Very high	92	Very high	113 Å²	113	100 Å²	100	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-49.2	175.3	-179.6	179.1	-22.3	0	0	111.2	S742 Q743 L748 V749 E750	S742-Q746 PolarHBondContact O-N 2.96Å; Q743-Q746 WeakPolarHBondContact O-CB 3.2Å; Q743-Q746 PolarHBondContact O-N 3.26Å; Q746-L748 VanDerWaalsContact C-N 3.27Å; Q746-L748 PolarHBondContact O-N 2.97Å; Q746-V749 CarbonylContact O-C 3.55Å; Q746-V749 WeakPolarHBondContact O-CA 3.35Å; Q746-V749 WeakPolarHBondContact O-CB 3.11Å; Q746-V749 PolarHBondContact O-N 2.87Å; Q746-E750 HydrophobicContact CG-CG 4.37Å; Q746-E750 VanDerWaalsContact CG-OE1 3.31Å; Q746-E750 WeakPolarHBondContact CG-OE1 3.43Å; Q746-E750 PolarHBondContact NE2-OE1 3.4Å; Q746-E750 WeakPolarHBondContact O-CG 3.49Å; Q746-E750 PolarHBondContact O-N 2.88Å
747	Q	92.3	Very high	91.7	Very high	111 Å²	111	100.8 Å²	100.8	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-58.2	-37	175.4	-72.2	171.6	-7.9	0	0	112.7	Q743 E750 L751	Q743-Q747 WeakPolarHBondContact O-CG 3.21Å; Q743-Q747 PolarHBondContact O-N 3.44Å; Q747-E750 PolarHBondContact O-N 3.01Å; Q747-L751 VanDerWaalsContact O-CB 3.31Å; Q747-L751 WeakPolarHBondContact O-CB 3.11Å; Q747-L751 VanDerWaalsContact O-CG 3.23Å; Q747-L751 WeakPolarHBondContact O-CG 3.13Å; Q747-L751 PolarHBondContact O-N 3.01Å
748	L	91.6	Very high	91.3	Very high	106 Å²	106	100.5 Å²	100.5	56%	0.555	50%	0.499	S	S	*	.	H	α-helix	trans	-69.2	-33.8	174.4	-74.5	168.4	0	0	0	112.7	R744 K745 Q746 G752	R744-L748 HydrophobicContact CG-CD1 4.34Å; R744-L748 WeakPolarHBondContact O-CB 3.21Å; R744-L748 VanDerWaalsContact O-CG 3.27Å; R744-L748 WeakPolarHBondContact O-CG 3.41Å; R744-L748 PolarHBondContact O-N 2.94Å; K745-L748 PolarHBondContact O-N 3.28Å; Q746-L748 VanDerWaalsContact C-N 3.27Å; Q746-L748 PolarHBondContact O-N 2.97Å; L748-G752 PolarHBondContact O-N 3.24Å
749	V	92.9	Very high	91.2	Very high	92 Å²	92	100.9 Å²	100.9	56%	0.558	50%	0.496	S	S	*	.	H	α-helix	trans	-70	-44.4	172.1	171.1	0	0	0	0	110.8	K745 Q746 G752 L753	K745-V749 WeakPolarHBondContact O-CG2 3.49Å; K745-V749 PolarHBondContact O-N 2.91Å; Q746-V749 CarbonylContact O-C 3.55Å; Q746-V749 WeakPolarHBondContact O-CA 3.35Å; Q746-V749 WeakPolarHBondContact O-CB 3.11Å; Q746-V749 PolarHBondContact O-N 2.87Å; V749-G752 CarbonylContact O-C 3.6Å; V749-G752 WeakPolarHBondContact O-CA 3.07Å; V749-G752 PolarHBondContact O-N 3.33Å; V749-G752 VanDerWaalsContact O-N 3.08Å; V749-L753 HydrophobicContact CG1-CD1 4.12Å; V749-L753 HydrophobicContact CG1-CG 4.44Å; V749-L753 WeakPolarHBondContact O-CG 3.46Å; V749-L753 PolarHBondContact O-N 3.3Å
750	E	92.5	Very high	90.9	Very high	83 Å²	83	100.2 Å²	100.2	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-61.3	-45.4	176.3	-71.2	167.4	177.3	0	0	111.5	Q746 Q747 G752 L753 L754	Q746-E750 HydrophobicContact CG-CG 4.37Å; Q746-E750 VanDerWaalsContact CG-OE1 3.31Å; Q746-E750 WeakPolarHBondContact CG-OE1 3.43Å; Q746-E750 PolarHBondContact NE2-OE1 3.4Å; Q746-E750 WeakPolarHBondContact O-CG 3.49Å; Q746-E750 PolarHBondContact O-N 2.88Å; Q747-E750 PolarHBondContact O-N 3.01Å; E750-G752 VanDerWaalsContact C-N 3.29Å; E750-G752 PolarHBondContact O-N 2.96Å; E750-L753 PolarHBondContact O-N 3.41Å; E750-L754 WeakPolarHBondContact O-CB 3.47Å; E750-L754 WeakPolarHBondContact O-CG 3.25Å; E750-L754 PolarHBondContact O-N 2.73Å
751	L	90.9	Very high	90.8	Very high	86 Å²	86	101.8 Å²	101.8	45%	0.45	49%	0.487	S	S	.	.	H	α-helix	trans	-64.4	-31.6	171.9	-72.9	169.6	0	0	0	112.7	Q747 R755	Q747-L751 VanDerWaalsContact O-CB 3.31Å; Q747-L751 WeakPolarHBondContact O-CB 3.11Å; Q747-L751 VanDerWaalsContact O-CG 3.23Å; Q747-L751 WeakPolarHBondContact O-CG 3.13Å; Q747-L751 PolarHBondContact O-N 3.01Å; L751-R755 WeakPolarHBondContact O-CB 3.5Å; L751-R755 WeakPolarHBondContact O-CD 3.19Å; L751-R755 WeakPolarHBondContact O-CG 3.31Å; L751-R755 PolarHBondContact O-N 2.93Å; L751-R755 VanDerWaalsContact O-N 3.12Å
752	G	91.9	Very high	90.5	Very high	36 Å²	36	100.8 Å²	100.8	37%	0.371	49%	0.489	S	S	.	.	H	α-helix	trans	-67	-45.1	172.8	0	0	0	0	0	112.3	L748 V749 E750 R755 E756	L748-G752 PolarHBondContact O-N 3.24Å; V749-G752 CarbonylContact O-C 3.6Å; V749-G752 WeakPolarHBondContact O-CA 3.07Å; V749-G752 PolarHBondContact O-N 3.33Å; V749-G752 VanDerWaalsContact O-N 3.08Å; E750-G752 VanDerWaalsContact C-N 3.29Å; E750-G752 PolarHBondContact O-N 2.96Å; G752-R755 PolarHBondContact O-N 3.25Å; G752-E756 PolarHBondContact O-N 2.88Å
753	L	88.8	Confident	90.3	Very high	105 Å²	105	102 Å²	102	55%	0.55	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-46.7	175.7	-70.7	170.7	0	0	0	111.3	V749 E750 R755 E756 E757	V749-L753 HydrophobicContact CG1-CD1 4.12Å; V749-L753 HydrophobicContact CG1-CG 4.44Å; V749-L753 WeakPolarHBondContact O-CG 3.46Å; V749-L753 PolarHBondContact O-N 3.3Å; E750-L753 PolarHBondContact O-N 3.41Å; L753-R755 VanDerWaalsContact C-N 3.34Å; L753-R755 PolarHBondContact O-N 2.74Å; L753-E756 CarbonylContact O-C 3.45Å; L753-E756 PolarHBondContact O-N 3.26Å; L753-E756 VanDerWaalsContact O-N 3.13Å; L753-E757 PolarHBondContact O-N 3.45Å
754	L	90.4	Very high	90.1	Very high	93 Å²	93	102.7 Å²	102.7	49%	0.487	49%	0.492	S	S	.	.	H	α-helix	trans	-58.5	-43.4	176.5	-73.8	169.7	0	0	0	112.1	E750 E756 E757 E758	E750-L754 WeakPolarHBondContact O-CB 3.47Å; E750-L754 WeakPolarHBondContact O-CG 3.25Å; E750-L754 PolarHBondContact O-N 2.73Å; L754-E756 PolarHBondContact O-N 2.84Å; L754-E757 PolarHBondContact O-N 3.32Å; L754-E758 WeakPolarHBondContact O-CB 2.98Å; L754-E758 WeakPolarHBondContact O-CG 3.1Å; L754-E758 PolarHBondContact O-N 3.48Å
755	R	89.3	Confident	90	Very high	175 Å²	175	100 Å²	100	66%	0.66	49%	0.487	S	S	*	.	H	α-helix	trans	-65.1	-36.8	175.3	-74.4	169.1	-179.5	176.9	0.9	112.8	L751 G752 L753 K759	L751-R755 WeakPolarHBondContact O-CB 3.5Å; L751-R755 WeakPolarHBondContact O-CD 3.19Å; L751-R755 WeakPolarHBondContact O-CG 3.31Å; L751-R755 PolarHBondContact O-N 2.93Å; L751-R755 VanDerWaalsContact O-N 3.12Å; G752-R755 PolarHBondContact O-N 3.25Å; L753-R755 VanDerWaalsContact C-N 3.34Å; L753-R755 PolarHBondContact O-N 2.74Å; R755-K759 WeakPolarHBondContact O-CB 3.4Å; R755-K759 PolarHBondContact O-N 2.91Å
756	E	87.1	Confident	89.9	Confident	74 Å²	74	100 Å²	100	35%	0.346	49%	0.488	S	S	.	.	H	α-helix	trans	-72.4	-35.5	175.6	-172.8	56	-141.2	0	0	111.6	G752 L753 L754 K759 Q760	G752-E756 PolarHBondContact O-N 2.88Å; L753-E756 CarbonylContact O-C 3.45Å; L753-E756 PolarHBondContact O-N 3.26Å; L753-E756 VanDerWaalsContact O-N 3.13Å; L754-E756 PolarHBondContact O-N 2.84Å; E756-K759 PolarHBondContact O-N 3Å; E756-K759 IonicContact OE1-NZ 2.73Å; E756-K759 PolarHBondContact OE1-NZ 3.45Å; E756-K759 IonicContact OE2-NZ 2.62Å; E756-K759 PolarHBondContact OE2-NZ 2.9Å; E756-Q760 WeakPolarHBondContact O-CB 3.39Å; E756-Q760 VanDerWaalsContact O-CG 3.23Å; E756-Q760 WeakPolarHBondContact O-CG 3.37Å; E756-Q760 PolarHBondContact O-N 3.47Å
757	E	87.9	Confident	89.9	Confident	102 Å²	102	100.3 Å²	100.3	48%	0.477	49%	0.49	S	S	.	.	H	α-helix	trans	-65	-43.5	170.9	-78	-170.7	-169.5	0	0	112.3	L753 L754 Q760 R761	L753-E757 PolarHBondContact O-N 3.45Å; L754-E757 PolarHBondContact O-N 3.32Å; E757-Q760 CarbonylContact O-C 3.59Å; E757-Q760 PolarHBondContact O-N 3.22Å; E757-R761 VanDerWaalsContact O-CB 3.24Å; E757-R761 WeakPolarHBondContact O-CB 3.24Å; E757-R761 PolarHBondContact O-N 3.01Å
758	E	85.9	Confident	89.8	Confident	112 Å²	112	100.6 Å²	100.6	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-44.4	173.8	-76.1	177.9	157.8	0	0	111.1	L754 R761 A762	L754-E758 WeakPolarHBondContact O-CB 2.98Å; L754-E758 WeakPolarHBondContact O-CG 3.1Å; L754-E758 PolarHBondContact O-N 3.48Å; E758-R761 WeakPolarHBondContact O-CB 3.37Å; E758-R761 PolarHBondContact O-N 2.93Å; E758-A762 WeakPolarHBondContact O-CB 3.31Å; E758-A762 PolarHBondContact O-N 2.74Å
759	K	91.9	Very high	89.8	Confident	117 Å²	117	99.2 Å²	99.2	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-60.7	-44.1	173.5	168.2	166.5	157.4	-84.6	0	112	R755 E756 R761 A762 T763	R755-K759 WeakPolarHBondContact O-CB 3.4Å; R755-K759 PolarHBondContact O-N 2.91Å; E756-K759 PolarHBondContact O-N 3Å; E756-K759 IonicContact OE1-NZ 2.73Å; E756-K759 PolarHBondContact OE1-NZ 3.45Å; E756-K759 IonicContact OE2-NZ 2.62Å; E756-K759 PolarHBondContact OE2-NZ 2.9Å; K759-R761 VanDerWaalsContact C-N 3.34Å; K759-A762 PolarHBondContact O-N 3.24Å; K759-T763 WeakPolarHBondContact O-CG2 3.41Å; K759-T763 PolarHBondContact O-N 2.82Å; K759-T763 PolarHBondContact O-OG1 3.33Å
760	Q	87.1	Confident	89.7	Confident	72 Å²	72	98 Å²	98	34%	0.336	48%	0.482	S	S	.	.	H	α-helix	trans	-68.6	-30.8	174.6	-74	177.6	27	0	0	113	E756 E757 T763 R764	E756-Q760 WeakPolarHBondContact O-CB 3.39Å; E756-Q760 VanDerWaalsContact O-CG 3.23Å; E756-Q760 WeakPolarHBondContact O-CG 3.37Å; E756-Q760 PolarHBondContact O-N 3.47Å; E757-Q760 CarbonylContact O-C 3.59Å; E757-Q760 PolarHBondContact O-N 3.22Å; Q760-T763 WeakPolarHBondContact CA-OG1 3.22Å; Q760-T763 PolarHBondContact O-OG1 3.35Å; Q760-T763 VanDerWaalsContact O-OG1 3.14Å; Q760-R764 WeakPolarHBondContact O-CB 3.23Å; Q760-R764 WeakPolarHBondContact O-CD 3.37Å; Q760-R764 WeakPolarHBondContact O-CG 3.49Å; Q760-R764 PolarHBondContact O-N 3.38Å
761	R	91.3	Very high	89.6	Confident	122 Å²	122	97.7 Å²	97.7	46%	0.46	48%	0.483	S	S	.	.	H	α-helix	trans	-69.3	-48	174.4	-166.5	-175.9	-55.9	151.9	8.2	109.9	E757 E758 K759 T763 R764 E765	E757-R761 VanDerWaalsContact O-CB 3.24Å; E757-R761 WeakPolarHBondContact O-CB 3.24Å; E757-R761 PolarHBondContact O-N 3.01Å; E758-R761 WeakPolarHBondContact O-CB 3.37Å; E758-R761 PolarHBondContact O-N 2.93Å; K759-R761 VanDerWaalsContact C-N 3.34Å; R761-T763 PolarHBondContact O-N 2.68Å; R761-R764 PolarHBondContact O-N 2.75Å; R761-E765 WeakPolarHBondContact CG-OE1 3.49Å; R761-E765 WeakPolarHBondContact O-CB 3.2Å; R761-E765 VanDerWaalsContact O-CG 3.32Å; R761-E765 WeakPolarHBondContact O-CG 3.47Å; R761-E765 PolarHBondContact O-N 2.87Å
762	A	88.1	Confident	89.7	Confident	54 Å²	54	99.7 Å²	99.7	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-37.9	175.7	0	0	0	0	0	112.8	E758 K759 H766	E758-A762 WeakPolarHBondContact O-CB 3.31Å; E758-A762 PolarHBondContact O-N 2.74Å; K759-A762 PolarHBondContact O-N 3.24Å; A762-H766 VanDerWaalsContact O-CB 3.26Å; A762-H766 WeakPolarHBondContact O-CB 3.37Å; A762-H766 PolarHBondContact O-N 2.91Å
763	T	86	Confident	89.6	Confident	83 Å²	83	102.8 Å²	102.8	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-70.9	-39.1	174.2	54.6	0	0	0	0	112.7	K759 Q760 R761 H766 E767	K759-T763 WeakPolarHBondContact O-CG2 3.41Å; K759-T763 PolarHBondContact O-N 2.82Å; K759-T763 PolarHBondContact O-OG1 3.33Å; Q760-T763 WeakPolarHBondContact CA-OG1 3.22Å; Q760-T763 PolarHBondContact O-OG1 3.35Å; Q760-T763 VanDerWaalsContact O-OG1 3.14Å; R761-T763 PolarHBondContact O-N 2.68Å; T763-H766 PolarHBondContact O-N 2.92Å; T763-E767 VanDerWaalsContact O-CB 3.31Å; T763-E767 WeakPolarHBondContact O-CB 3.37Å; T763-E767 PolarHBondContact O-N 3.44Å
764	R	89.4	Confident	89.7	Confident	127 Å²	127	104.1 Å²	104.1	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-43.4	171.7	-71.5	165.8	-166.9	130.3	6.4	111.8	Q760 R761 E767 I768	Q760-R764 WeakPolarHBondContact O-CB 3.23Å; Q760-R764 WeakPolarHBondContact O-CD 3.37Å; Q760-R764 WeakPolarHBondContact O-CG 3.49Å; Q760-R764 PolarHBondContact O-N 3.38Å; R761-R764 PolarHBondContact O-N 2.75Å; R764-E767 PolarHBondContact O-N 2.8Å; R764-I768 WeakPolarHBondContact O-CB 3.45Å; R764-I768 WeakPolarHBondContact O-CD1 3.45Å; R764-I768 WeakPolarHBondContact O-CG1 3.37Å; R764-I768 PolarHBondContact O-N 3.28Å
765	E	90	Very high	89.6	Confident	110 Å²	110	102.7 Å²	102.7	51%	0.514	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-43.2	176.6	-75.1	170.7	-171	0	0	111.3	R761 I768 V769	R761-E765 WeakPolarHBondContact CG-OE1 3.49Å; R761-E765 WeakPolarHBondContact O-CB 3.2Å; R761-E765 VanDerWaalsContact O-CG 3.32Å; R761-E765 WeakPolarHBondContact O-CG 3.47Å; R761-E765 PolarHBondContact O-N 2.87Å; E765-I768 PolarHBondContact O-N 2.64Å; E765-V769 WeakPolarHBondContact O-CG2 3.47Å; E765-V769 PolarHBondContact O-N 3.11Å
766	H	90.3	Very high	89.5	Confident	128 Å²	128	98.8 Å²	98.8	59%	0.593	49%	0.488	S	S	*	.	H	α-helix	trans	-62.6	-42.8	173.2	-174.7	70.5	0	0	0	111.9	A762 T763 I768 V769 V770	A762-H766 VanDerWaalsContact O-CB 3.26Å; A762-H766 WeakPolarHBondContact O-CB 3.37Å; A762-H766 PolarHBondContact O-N 2.91Å; T763-H766 PolarHBondContact O-N 2.92Å; H766-I768 PolarHBondContact O-N 3.47Å; H766-V769 PolarHBondContact O-N 2.92Å; H766-V770 WeakPolarHBondContact O-CB 3.35Å; H766-V770 VanDerWaalsContact O-CG2 3.3Å; H766-V770 WeakPolarHBondContact O-CG2 3.5Å; H766-V770 PolarHBondContact O-N 3.05Å
767	E	91.5	Very high	89.5	Confident	119 Å²	119	98.6 Å²	98.6	56%	0.556	50%	0.495	S	S	*	.	H	α-helix	trans	-62	-41.1	174.5	177.2	172	-156	0	0	112	T763 R764 V770 N771	T763-E767 VanDerWaalsContact O-CB 3.31Å; T763-E767 WeakPolarHBondContact O-CB 3.37Å; T763-E767 PolarHBondContact O-N 3.44Å; R764-E767 PolarHBondContact O-N 2.8Å; E767-V770 PolarHBondContact O-N 2.84Å; E767-N771 VanDerWaalsContact CG-ND2 3.31Å; E767-N771 WeakPolarHBondContact CG-ND2 3.16Å; E767-N771 VanDerWaalsContact O-CB 3.25Å; E767-N771 WeakPolarHBondContact O-CB 3.49Å; E767-N771 PolarHBondContact O-N 3.44Å; E767-N771 PolarHBondContact O-ND2 2.85Å; E767-N771 VanDerWaalsContact O-ND2 3.07Å
768	I	91.7	Very high	89.5	Confident	116 Å²	116	97.7 Å²	97.7	60%	0.595	49%	0.49	S	S	*	.	H	α-helix	trans	-62.5	-44.2	174.1	-71.8	162.2	0	0	0	110.6	R764 E765 H766 N771 K772	R764-I768 WeakPolarHBondContact O-CB 3.45Å; R764-I768 WeakPolarHBondContact O-CD1 3.45Å; R764-I768 WeakPolarHBondContact O-CG1 3.37Å; R764-I768 PolarHBondContact O-N 3.28Å; E765-I768 PolarHBondContact O-N 2.64Å; H766-I768 PolarHBondContact O-N 3.47Å; I768-N771 PolarHBondContact O-N 2.72Å; I768-K772 VanDerWaalsContact O-CB 3.27Å; I768-K772 WeakPolarHBondContact O-CB 3.12Å; I768-K772 PolarHBondContact O-N 3.01Å
769	V	91.8	Very high	89.7	Confident	78 Å²	78	98.2 Å²	98.2	47%	0.473	49%	0.491	S	S	.	.	H	α-helix	trans	-65.2	-44.3	176.7	169.8	0	0	0	0	111.4	E765 H766 K772 L773	E765-V769 WeakPolarHBondContact O-CG2 3.47Å; E765-V769 PolarHBondContact O-N 3.11Å; H766-V769 PolarHBondContact O-N 2.92Å; V769-K772 PolarHBondContact O-N 2.65Å; V769-L773 HydrophobicContact CG1-CD1 3.92Å; V769-L773 HydrophobicContact CG1-CG 4.42Å; V769-L773 WeakPolarHBondContact O-CB 3.38Å; V769-L773 WeakPolarHBondContact O-CG 3.4Å; V769-L773 PolarHBondContact O-N 3.25Å
770	V	89.7	Confident	89.5	Confident	65 Å²	65	99.1 Å²	99.1	39%	0.394	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-44.2	176.8	167.7	0	0	0	0	111	H766 E767 L773 K774	H766-V770 WeakPolarHBondContact O-CB 3.35Å; H766-V770 VanDerWaalsContact O-CG2 3.3Å; H766-V770 WeakPolarHBondContact O-CG2 3.5Å; H766-V770 PolarHBondContact O-N 3.05Å; E767-V770 PolarHBondContact O-N 2.84Å; V770-L773 PolarHBondContact O-N 3.49Å; V770-K774 WeakPolarHBondContact O-CB 3.19Å; V770-K774 PolarHBondContact O-N 3.43Å
771	N	90.9	Very high	89.7	Confident	78 Å²	78	100.2 Å²	100.2	42%	0.417	50%	0.502	S	S	.	.	H	α-helix	trans	-66.8	-35.8	176.6	-78.1	-44.4	0	0	0	112.1	E767 I768 K774 A775	E767-N771 VanDerWaalsContact CG-ND2 3.31Å; E767-N771 WeakPolarHBondContact CG-ND2 3.16Å; E767-N771 VanDerWaalsContact O-CB 3.25Å; E767-N771 WeakPolarHBondContact O-CB 3.49Å; E767-N771 PolarHBondContact O-N 3.44Å; E767-N771 PolarHBondContact O-ND2 2.85Å; E767-N771 VanDerWaalsContact O-ND2 3.07Å; I768-N771 PolarHBondContact O-N 2.72Å; N771-K774 PolarHBondContact O-N 2.79Å; N771-A775 WeakPolarHBondContact O-CB 3.36Å; N771-A775 PolarHBondContact O-N 2.76Å
772	K	92.8	Very high	89.6	Confident	127 Å²	127	98.6 Å²	98.6	55%	0.552	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-51.4	172	179.7	179.2	169.3	-177.3	0	111.5	I768 V769 K774 A775 E776	I768-K772 VanDerWaalsContact O-CB 3.27Å; I768-K772 WeakPolarHBondContact O-CB 3.12Å; I768-K772 PolarHBondContact O-N 3.01Å; V769-K772 PolarHBondContact O-N 2.65Å; K772-K774 VanDerWaalsContact C-N 3.26Å; K772-K774 PolarHBondContact O-N 2.94Å; K772-A775 PolarHBondContact O-N 3.16Å; K772-A775 VanDerWaalsContact O-N 3.1Å; K772-E776 WeakPolarHBondContact CE-OE1 3.38Å; K772-E776 IonicContact NZ-OE1 2.71Å; K772-E776 WeakPolarHBondContact O-CG 3.4Å; K772-E776 PolarHBondContact O-N 3.02Å
773	L	89.1	Confident	89.7	Confident	102 Å²	102	100.7 Å²	100.7	53%	0.534	50%	0.502	S	S	.	.	H	α-helix	trans	-60.6	-35.8	177.2	-72	170.8	0	0	0	111.9	V769 V770 E776 S777	V769-L773 HydrophobicContact CG1-CD1 3.92Å; V769-L773 HydrophobicContact CG1-CG 4.42Å; V769-L773 WeakPolarHBondContact O-CB 3.38Å; V769-L773 WeakPolarHBondContact O-CG 3.4Å; V769-L773 PolarHBondContact O-N 3.25Å; V770-L773 PolarHBondContact O-N 3.49Å; L773-E776 PolarHBondContact O-N 3.12Å; L773-S777 WeakPolarHBondContact O-CB 3.49Å; L773-S777 PolarHBondContact O-N 3.37Å
774	K	90.6	Very high	89.8	Confident	133 Å²	133	102.4 Å²	102.4	58%	0.578	51%	0.508	S	S	*	.	H	α-helix	trans	-67.5	-40.2	174	-173.9	177.8	180	-177.8	0	112.1	V770 N771 K772 S777 E778	V770-K774 WeakPolarHBondContact O-CB 3.19Å; V770-K774 PolarHBondContact O-N 3.43Å; N771-K774 PolarHBondContact O-N 2.79Å; K772-K774 VanDerWaalsContact C-N 3.26Å; K772-K774 PolarHBondContact O-N 2.94Å; K774-S777 PolarHBondContact O-N 3.15Å; K774-E778 PolarHBondContact O-N 3.15Å
775	A	88.7	Confident	89.6	Confident	62 Å²	62	103 Å²	103	51%	0.512	51%	0.514	S	S	.	.	H	α-helix	trans	-68.3	-38.8	174.1	0	0	0	0	0	112.3	N771 K772 K779	N771-A775 WeakPolarHBondContact O-CB 3.36Å; N771-A775 PolarHBondContact O-N 2.76Å; K772-A775 PolarHBondContact O-N 3.16Å; K772-A775 VanDerWaalsContact O-N 3.1Å; A775-K779 VanDerWaalsContact O-CB 3.29Å; A775-K779 WeakPolarHBondContact O-CB 3.45Å; A775-K779 PolarHBondContact O-N 3.4Å
776	E	88.4	Confident	89.5	Confident	93 Å²	93	104.6 Å²	104.6	44%	0.435	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-39.3	173.4	-72.7	171.8	170.1	0	0	111.5	K772 L773 K779 M780	K772-E776 WeakPolarHBondContact CE-OE1 3.38Å; K772-E776 IonicContact NZ-OE1 2.71Å; K772-E776 WeakPolarHBondContact O-CG 3.4Å; K772-E776 PolarHBondContact O-N 3.02Å; L773-E776 PolarHBondContact O-N 3.12Å; E776-K779 PolarHBondContact O-N 2.88Å; E776-M780 WeakPolarHBondContact O-CB 3.08Å; E776-M780 PolarHBondContact O-N 3.23Å
777	S	85.8	Confident	89.4	Confident	71 Å²	71	101.6 Å²	101.6	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-46.8	173.9	-174.8	0	0	0	0	112.4	L773 K774 M780 K781	L773-S777 WeakPolarHBondContact O-CB 3.49Å; L773-S777 PolarHBondContact O-N 3.37Å; K774-S777 PolarHBondContact O-N 3.15Å; S777-M780 PolarHBondContact O-N 2.94Å; S777-K781 WeakPolarHBondContact O-CB 2.87Å; S777-K781 PolarHBondContact O-N 3.39Å
778	E	88.3	Confident	89.2	Confident	82 Å²	82	101.5 Å²	101.5	38%	0.383	51%	0.509	S	S	.	.	H	α-helix	trans	-65.3	-36.8	174.1	-74.4	-62.9	149.9	0	0	111.9	K774 K781 I782	K774-E778 PolarHBondContact O-N 3.15Å; E778-K781 PolarHBondContact O-N 3.25Å; E778-K781 IonicContact OE1-NZ 3.69Å; E778-K781 PolarHBondContact OE1-NZ 3.12Å; E778-K781 WeakPolarHBondContact OE2-CD 3.33Å; E778-K781 IonicContact OE2-NZ 3.35Å; E778-K781 PolarHBondContact OE2-NZ 3.34Å; E778-I782 WeakPolarHBondContact O-CB 3.19Å; E778-I782 WeakPolarHBondContact O-CD1 3.06Å; E778-I782 VanDerWaalsContact O-CG1 3.23Å; E778-I782 WeakPolarHBondContact O-CG1 3.45Å; E778-I782 PolarHBondContact O-N 3.3Å
779	K	89.8	Confident	88.9	Confident	124 Å²	124	98.3 Å²	98.3	54%	0.539	50%	0.5	S	S	.	.	H	α-helix	trans	-58.8	-53.1	170.5	179.2	-178.8	-178.4	-76.7	0	110.5	A775 E776 K781 I782 E783	A775-K779 VanDerWaalsContact O-CB 3.29Å; A775-K779 WeakPolarHBondContact O-CB 3.45Å; A775-K779 PolarHBondContact O-N 3.4Å; E776-K779 PolarHBondContact O-N 2.88Å; K779-K781 VanDerWaalsContact C-N 3.28Å; K779-K781 PolarHBondContact O-N 2.96Å; K779-I782 CarbonylContact O-C 3.59Å; K779-I782 PolarHBondContact O-N 3.34Å; K779-I782 VanDerWaalsContact O-N 3.13Å; K779-E783 IonicContact NZ-OE1 2.64Å; K779-E783 IonicContact NZ-OE2 2.9Å; K779-E783 PolarHBondContact NZ-OE2 2.92Å; K779-E783 VanDerWaalsContact O-CB 3.29Å; K779-E783 WeakPolarHBondContact O-CB 3.45Å; K779-E783 PolarHBondContact O-N 3.42Å
780	M	88.3	Confident	88.5	Confident	136 Å²	136	97 Å²	97	67%	0.67	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-35.4	-179.4	-170.6	176.6	-175.6	0	0	112	E776 S777 E783 L784	E776-M780 WeakPolarHBondContact O-CB 3.08Å; E776-M780 PolarHBondContact O-N 3.23Å; S777-M780 PolarHBondContact O-N 2.94Å; M780-E783 PolarHBondContact O-N 2.96Å; M780-L784 VanDerWaalsContact O-CB 3.26Å; M780-L784 WeakPolarHBondContact O-CB 3.43Å; M780-L784 PolarHBondContact O-N 3.37Å
781	K	90.9	Very high	88.3	Confident	94 Å²	94	99 Å²	99	41%	0.409	50%	0.503	S	S	.	.	H	α-helix	trans	-68.8	-36.5	173.8	173.6	179.8	163.5	-139.7	0	112.7	S777 E778 K779 K785	S777-K781 WeakPolarHBondContact O-CB 2.87Å; S777-K781 PolarHBondContact O-N 3.39Å; E778-K781 PolarHBondContact O-N 3.25Å; E778-K781 IonicContact OE1-NZ 3.69Å; E778-K781 PolarHBondContact OE1-NZ 3.12Å; E778-K781 WeakPolarHBondContact OE2-CD 3.33Å; E778-K781 IonicContact OE2-NZ 3.35Å; E778-K781 PolarHBondContact OE2-NZ 3.34Å; K779-K781 VanDerWaalsContact C-N 3.28Å; K779-K781 PolarHBondContact O-N 2.96Å; K781-K785 WeakPolarHBondContact O-CB 3.45Å; K781-K785 VanDerWaalsContact O-CG 3.24Å; K781-K785 WeakPolarHBondContact O-CG 2.89Å; K781-K785 PolarHBondContact O-N 2.89Å
782	I	89.5	Confident	87.9	Confident	89 Å²	89	98 Å²	98	46%	0.456	50%	0.5	S	S	.	.	H	α-helix	trans	-69.4	-39.5	170.9	-71.4	163.7	0	0	0	110.3	E778 K779 K785 K786	E778-I782 WeakPolarHBondContact O-CB 3.19Å; E778-I782 WeakPolarHBondContact O-CD1 3.06Å; E778-I782 VanDerWaalsContact O-CG1 3.23Å; E778-I782 WeakPolarHBondContact O-CG1 3.45Å; E778-I782 PolarHBondContact O-N 3.3Å; K779-I782 CarbonylContact O-C 3.59Å; K779-I782 PolarHBondContact O-N 3.34Å; K779-I782 VanDerWaalsContact O-N 3.13Å; I782-K785 PolarHBondContact O-N 2.94Å; I782-K786 HydrophobicContact CG2-CD 4.36Å; I782-K786 WeakPolarHBondContact O-CG 3.36Å; I782-K786 PolarHBondContact O-N 3.07Å
783	E	89.4	Confident	87.4	Confident	97 Å²	97	98.5 Å²	98.5	45%	0.453	50%	0.504	S	S	.	.	H	α-helix	trans	-67.1	-45.5	179.4	-159.5	142.3	-141	0	0	110.9	K779 M780 K785 K786 T787	K779-E783 IonicContact NZ-OE1 2.64Å; K779-E783 IonicContact NZ-OE2 2.9Å; K779-E783 PolarHBondContact NZ-OE2 2.92Å; K779-E783 VanDerWaalsContact O-CB 3.29Å; K779-E783 WeakPolarHBondContact O-CB 3.45Å; K779-E783 PolarHBondContact O-N 3.42Å; M780-E783 PolarHBondContact O-N 2.96Å; E783-K785 VanDerWaalsContact C-N 3.35Å; E783-K785 PolarHBondContact O-N 3.35Å; E783-K786 CarbonylContact O-C 3.59Å; E783-K786 WeakPolarHBondContact O-CA 3.41Å; E783-K786 WeakPolarHBondContact O-CB 3.26Å; E783-K786 PolarHBondContact O-N 2.8Å; E783-T787 PolarHBondContact O-N 3.18Å
784	L	87.9	Confident	87.4	Confident	120 Å²	120	97.4 Å²	97.4	63%	0.628	50%	0.497	S	S	*	.	H	α-helix	trans	-64.4	-35.9	172.7	-162.7	79.5	0	0	0	112.5	M780 K786 T787 H788	M780-L784 VanDerWaalsContact O-CB 3.26Å; M780-L784 WeakPolarHBondContact O-CB 3.43Å; M780-L784 PolarHBondContact O-N 3.37Å; L784-K786 VanDerWaalsContact C-N 3.33Å; L784-T787 WeakPolarHBondContact CA-OG1 3.26Å; L784-T787 PolarHBondContact O-OG1 3.4Å; L784-T787 VanDerWaalsContact O-OG1 3.08Å; L784-H788 VanDerWaalsContact O-CB 3.28Å; L784-H788 WeakPolarHBondContact O-CB 3.23Å; L784-H788 PolarHBondContact O-N 2.89Å
785	K	86.4	Confident	87.1	Confident	138 Å²	138	94.8 Å²	94.8	60%	0.6	49%	0.492	S	S	*	.	H	α-helix	trans	-66.1	-34.8	170.4	-81.3	179.2	175.9	-166.9	0	112.1	K781 I782 E783 A789	K781-K785 WeakPolarHBondContact O-CB 3.45Å; K781-K785 VanDerWaalsContact O-CG 3.24Å; K781-K785 WeakPolarHBondContact O-CG 2.89Å; K781-K785 PolarHBondContact O-N 2.89Å; I782-K785 PolarHBondContact O-N 2.94Å; E783-K785 VanDerWaalsContact C-N 3.35Å; E783-K785 PolarHBondContact O-N 3.35Å; K785-A789 WeakPolarHBondContact O-CB 3.12Å; K785-A789 PolarHBondContact O-N 2.83Å
786	K	88.6	Confident	86.9	Confident	144 Å²	144	96.8 Å²	96.8	63%	0.626	49%	0.494	S	S	*	.	H	α-helix	trans	-71.7	-41.1	175.2	-77	175.6	177.1	-175	0	112.1	I782 E783 L784 A789 A790	I782-K786 HydrophobicContact CG2-CD 4.36Å; I782-K786 WeakPolarHBondContact O-CG 3.36Å; I782-K786 PolarHBondContact O-N 3.07Å; E783-K786 CarbonylContact O-C 3.59Å; E783-K786 WeakPolarHBondContact O-CA 3.41Å; E783-K786 WeakPolarHBondContact O-CB 3.26Å; E783-K786 PolarHBondContact O-N 2.8Å; L784-K786 VanDerWaalsContact C-N 3.33Å; K786-A789 PolarHBondContact O-N 2.83Å; K786-A790 WeakPolarHBondContact O-CB 2.94Å; K786-A790 PolarHBondContact O-N 3.22Å
787	T	87.1	Confident	86.8	Confident	65 Å²	65	99 Å²	99	40%	0.399	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-47.2	174.7	59.7	0	0	0	0	110.6	E783 L784 A789 A790 E791	E783-T787 PolarHBondContact O-N 3.18Å; L784-T787 WeakPolarHBondContact CA-OG1 3.26Å; L784-T787 PolarHBondContact O-OG1 3.4Å; L784-T787 VanDerWaalsContact O-OG1 3.08Å; T787-A789 VanDerWaalsContact C-N 3.31Å; T787-A789 PolarHBondContact O-N 3.24Å; T787-A790 CarbonylContact O-C 3.57Å; T787-A790 PolarHBondContact O-N 3.41Å; T787-E791 WeakPolarHBondContact O-CB 3.13Å; T787-E791 VanDerWaalsContact O-CG 3.29Å; T787-E791 WeakPolarHBondContact O-CG 3.21Å; T787-E791 PolarHBondContact O-N 3.16Å
788	H	87	Confident	86.9	Confident	118 Å²	118	101.5 Å²	101.5	55%	0.546	51%	0.506	S	S	.	.	H	α-helix	trans	-59	-41.1	173.6	-176	-64.2	0	0	0	112	L784 E791 T792	L784-H788 VanDerWaalsContact O-CB 3.28Å; L784-H788 WeakPolarHBondContact O-CB 3.23Å; L784-H788 PolarHBondContact O-N 2.89Å; H788-E791 PolarHBondContact O-N 2.83Å; H788-T792 WeakPolarHBondContact O-CG2 3.5Å; H788-T792 PolarHBondContact O-N 3.13Å; H788-T792 PolarHBondContact O-OG1 3.17Å; H788-T792 VanDerWaalsContact O-OG1 3.08Å
789	A	85.9	Confident	86.7	Confident	48 Å²	48	100 Å²	100	40%	0.397	51%	0.508	S	S	.	.	H	α-helix	trans	-61.7	-48.1	175.5	0	0	0	0	0	111.5	K785 K786 T787 E791 T792 E793	K785-A789 WeakPolarHBondContact O-CB 3.12Å; K785-A789 PolarHBondContact O-N 2.83Å; K786-A789 PolarHBondContact O-N 2.83Å; T787-A789 VanDerWaalsContact C-N 3.31Å; T787-A789 PolarHBondContact O-N 3.24Å; A789-E791 VanDerWaalsContact C-N 3.32Å; A789-E791 PolarHBondContact O-N 3.35Å; A789-T792 WeakPolarHBondContact CA-OG1 3.45Å; A789-T792 CarbonylContact O-C 3.59Å; A789-T792 PolarHBondContact O-N 2.81Å; A789-T792 PolarHBondContact O-OG1 2.77Å; A789-E793 WeakPolarHBondContact O-CB 3.03Å; A789-E793 PolarHBondContact O-N 2.97Å
790	A	84.1	Confident	86.5	Confident	52 Å²	52	98.2 Å²	98.2	43%	0.43	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-32.3	177	0	0	0	0	0	112.9	K786 T787 E793 M794	K786-A790 WeakPolarHBondContact O-CB 2.94Å; K786-A790 PolarHBondContact O-N 3.22Å; T787-A790 CarbonylContact O-C 3.57Å; T787-A790 PolarHBondContact O-N 3.41Å; A790-E793 PolarHBondContact O-N 3.05Å; A790-M794 WeakPolarHBondContact O-CB 3.08Å; A790-M794 PolarHBondContact O-N 3.33Å
791	E	84	Confident	86.4	Confident	107 Å²	107	94.9 Å²	94.9	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-70	-40.7	172.4	-74.6	165.2	-146.6	0	0	111.5	T787 H788 A789 T795	T787-E791 WeakPolarHBondContact O-CB 3.13Å; T787-E791 VanDerWaalsContact O-CG 3.29Å; T787-E791 WeakPolarHBondContact O-CG 3.21Å; T787-E791 PolarHBondContact O-N 3.16Å; H788-E791 PolarHBondContact O-N 2.83Å; A789-E791 VanDerWaalsContact C-N 3.32Å; A789-E791 PolarHBondContact O-N 3.35Å; E791-T795 WeakPolarHBondContact O-CB 3Å; E791-T795 WeakPolarHBondContact O-CG2 3.49Å; E791-T795 PolarHBondContact O-N 3.49Å; E791-T795 PolarHBondContact O-OG1 3.44Å
792	T	83.5	Confident	86.2	Confident	57 Å²	57	99.3 Å²	99.3	35%	0.35	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-36.8	171.2	52	0	0	0	0	112.2	H788 A789 T795 L796	H788-T792 WeakPolarHBondContact O-CG2 3.5Å; H788-T792 PolarHBondContact O-N 3.13Å; H788-T792 PolarHBondContact O-OG1 3.17Å; H788-T792 VanDerWaalsContact O-OG1 3.08Å; A789-T792 WeakPolarHBondContact CA-OG1 3.45Å; A789-T792 CarbonylContact O-C 3.59Å; A789-T792 PolarHBondContact O-N 2.81Å; A789-T792 PolarHBondContact O-OG1 2.77Å; T792-T795 WeakPolarHBondContact CA-OG1 3.4Å; T792-T795 PolarHBondContact O-N 3Å; T792-T795 PolarHBondContact O-OG1 3.35Å; T792-T795 VanDerWaalsContact O-OG1 3.12Å; T792-L796 VanDerWaalsContact O-CB 3.24Å; T792-L796 WeakPolarHBondContact O-CB 3.48Å; T792-L796 WeakPolarHBondContact O-CD1 2.96Å; T792-L796 WeakPolarHBondContact O-CG 3.09Å; T792-L796 PolarHBondContact O-N 3.45Å
793	E	82.9	Confident	86.1	Confident	136 Å²	136	99.1 Å²	99.1	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-69	-46	176.3	-173.2	166.8	-149.2	0	0	111.1	A789 A790 T795 L796 E797	A789-E793 WeakPolarHBondContact O-CB 3.03Å; A789-E793 PolarHBondContact O-N 2.97Å; A790-E793 PolarHBondContact O-N 3.05Å; E793-T795 VanDerWaalsContact C-N 3.34Å; E793-T795 PolarHBondContact O-N 3.41Å; E793-L796 CarbonylContact O-C 3.08Å; E793-L796 PolarHBondContact O-N 3.31Å; E793-E797 WeakPolarHBondContact O-CB 2.98Å; E793-E797 PolarHBondContact O-N 2.98Å
794	M	88.8	Confident	85.9	Confident	80 Å²	80	101.2 Å²	101.2	39%	0.394	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-39.4	173.3	179.2	-159.3	57.6	0	0	112.1	A790 E797 K798	A790-M794 WeakPolarHBondContact O-CB 3.08Å; A790-M794 PolarHBondContact O-N 3.33Å; M794-E797 PolarHBondContact O-N 3.05Å; M794-K798 HydrophobicContact CG-CD 4.12Å; M794-K798 WeakPolarHBondContact O-CB 3.5Å; M794-K798 VanDerWaalsContact O-CG 3.24Å; M794-K798 WeakPolarHBondContact O-CG 3.16Å; M794-K798 PolarHBondContact O-N 3.33Å; M794-K798 PolarHBondContact SD-NZ 2.91Å
795	T	84.8	Confident	85.8	Confident	77 Å²	77	99.8 Å²	99.8	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-74.4	-35.4	177.4	48.4	0	0	0	0	112.1	E791 T792 E793 K798 A799	E791-T795 WeakPolarHBondContact O-CB 3Å; E791-T795 WeakPolarHBondContact O-CG2 3.49Å; E791-T795 PolarHBondContact O-N 3.49Å; E791-T795 PolarHBondContact O-OG1 3.44Å; T792-T795 WeakPolarHBondContact CA-OG1 3.4Å; T792-T795 PolarHBondContact O-N 3Å; T792-T795 PolarHBondContact O-OG1 3.35Å; T792-T795 VanDerWaalsContact O-OG1 3.12Å; E793-T795 VanDerWaalsContact C-N 3.34Å; E793-T795 PolarHBondContact O-N 3.41Å; T795-K798 PolarHBondContact O-N 3.14Å; T795-A799 WeakPolarHBondContact O-CB 3.39Å; T795-A799 PolarHBondContact O-N 3.35Å
796	L	83.9	Confident	85.8	Confident	104 Å²	104	96.6 Å²	96.6	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-65.3	-36.3	168.5	-75.4	169.2	0	0	0	112.1	T792 E793 A799 N800	T792-L796 VanDerWaalsContact O-CB 3.24Å; T792-L796 WeakPolarHBondContact O-CB 3.48Å; T792-L796 WeakPolarHBondContact O-CD1 2.96Å; T792-L796 WeakPolarHBondContact O-CG 3.09Å; T792-L796 PolarHBondContact O-N 3.45Å; E793-L796 CarbonylContact O-C 3.08Å; E793-L796 PolarHBondContact O-N 3.31Å; L796-A799 PolarHBondContact O-N 3.4Å; L796-N800 WeakPolarHBondContact O-CB 2.96Å; L796-N800 PolarHBondContact O-N 2.94Å; L796-N800 PolarHBondContact O-ND2 3.26Å
797	E	85.4	Confident	85.5	Confident	140 Å²	140	94.7 Å²	94.7	65%	0.654	49%	0.488	S	S	*	.	H	α-helix	trans	-73	-37.3	176.1	-172.6	169.3	-135.5	0	0	111.6	E793 M794 A799 N800 S801	E793-E797 WeakPolarHBondContact O-CB 2.98Å; E793-E797 PolarHBondContact O-N 2.98Å; M794-E797 PolarHBondContact O-N 3.05Å; E797-A799 VanDerWaalsContact C-N 3.33Å; E797-N800 PolarHBondContact O-N 3.03Å; E797-S801 VanDerWaalsContact O-CB 3.28Å; E797-S801 WeakPolarHBondContact O-CB 3.48Å; E797-S801 PolarHBondContact O-N 3.38Å; E797-S801 PolarHBondContact O-OG 3.41Å
798	K	88	Confident	85.5	Confident	124 Å²	124	98.3 Å²	98.3	54%	0.539	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-37.3	168.6	-75.4	167.7	178.8	172.9	0	111.9	M794 T795 S801 R802	M794-K798 HydrophobicContact CG-CD 4.12Å; M794-K798 WeakPolarHBondContact O-CB 3.5Å; M794-K798 VanDerWaalsContact O-CG 3.24Å; M794-K798 WeakPolarHBondContact O-CG 3.16Å; M794-K798 PolarHBondContact O-N 3.33Å; M794-K798 PolarHBondContact SD-NZ 2.91Å; T795-K798 PolarHBondContact O-N 3.14Å; K798-S801 WeakPolarHBondContact CA-OG 3.48Å; K798-S801 PolarHBondContact O-OG 3.36Å; K798-R802 VanDerWaalsContact O-CB 3.27Å; K798-R802 WeakPolarHBondContact O-CB 3.48Å; K798-R802 PolarHBondContact O-N 2.83Å; K798-R802 VanDerWaalsContact O-N 3.14Å
799	A	85.4	Confident	85.5	Confident	51 Å²	51	96.1 Å²	96.1	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-68.8	-45.9	173.1	0	0	0	0	0	111.7	T795 L796 E797 R802 L803	T795-A799 WeakPolarHBondContact O-CB 3.39Å; T795-A799 PolarHBondContact O-N 3.35Å; L796-A799 PolarHBondContact O-N 3.4Å; E797-A799 VanDerWaalsContact C-N 3.33Å; A799-R802 CarbonylContact O-C 3.5Å; A799-R802 PolarHBondContact O-N 3.23Å; A799-L803 VanDerWaalsContact O-CB 3.25Å; A799-L803 WeakPolarHBondContact O-CB 3.39Å; A799-L803 PolarHBondContact O-N 3.06Å
800	N	85.6	Confident	85.5	Confident	86 Å²	86	101.2 Å²	101.2	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-69.4	-35	-179.7	-78.4	-27.9	0	0	0	113	L796 E797 L803 K804	L796-N800 WeakPolarHBondContact O-CB 2.96Å; L796-N800 PolarHBondContact O-N 2.94Å; L796-N800 PolarHBondContact O-ND2 3.26Å; E797-N800 PolarHBondContact O-N 3.03Å; N800-L803 PolarHBondContact O-N 3.36Å; N800-K804 WeakPolarHBondContact O-CB 3.38Å; N800-K804 VanDerWaalsContact O-CG 3.27Å; N800-K804 WeakPolarHBondContact O-CG 3.33Å; N800-K804 PolarHBondContact O-N 3.23Å
801	S	85.3	Confident	85.5	Confident	66 Å²	66	102.9 Å²	102.9	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-70.4	-39.8	172.9	52.1	0	0	0	0	111.4	E797 K798 Q805	E797-S801 VanDerWaalsContact O-CB 3.28Å; E797-S801 WeakPolarHBondContact O-CB 3.48Å; E797-S801 PolarHBondContact O-N 3.38Å; E797-S801 PolarHBondContact O-OG 3.41Å; K798-S801 WeakPolarHBondContact CA-OG 3.48Å; K798-S801 PolarHBondContact O-OG 3.36Å; S801-Q805 WeakPolarHBondContact O-CB 3.39Å; S801-Q805 PolarHBondContact O-N 2.94Å
802	R	86.8	Confident	85.6	Confident	187 Å²	187	103.1 Å²	103.1	71%	0.706	50%	0.504	S	S	*	.	H	α-helix	trans	-63	-40	169.6	-174.5	174.3	-176.4	158.3	1.7	112	K798 A799 Q805 I806	K798-R802 VanDerWaalsContact O-CB 3.27Å; K798-R802 WeakPolarHBondContact O-CB 3.48Å; K798-R802 PolarHBondContact O-N 2.83Å; K798-R802 VanDerWaalsContact O-N 3.14Å; A799-R802 CarbonylContact O-C 3.5Å; A799-R802 PolarHBondContact O-N 3.23Å; R802-Q805 PolarHBondContact O-N 3.29Å; R802-I806 HydrophobicContact CG-CD1 4.05Å; R802-I806 WeakPolarHBondContact O-CB 3.31Å; R802-I806 WeakPolarHBondContact O-CD1 3.4Å; R802-I806 VanDerWaalsContact O-CG1 3.25Å; R802-I806 WeakPolarHBondContact O-CG1 3.4Å; R802-I806 PolarHBondContact O-N 3.27Å
803	L	86.6	Confident	85.8	Confident	85 Å²	85	105.6 Å²	105.6	45%	0.445	51%	0.51	S	S	.	.	H	α-helix	trans	-67.4	-47	177.5	-169.9	150.2	0	0	0	110.8	A799 N800 Q805 I806 E807	A799-L803 VanDerWaalsContact O-CB 3.25Å; A799-L803 WeakPolarHBondContact O-CB 3.39Å; A799-L803 PolarHBondContact O-N 3.06Å; N800-L803 PolarHBondContact O-N 3.36Å; L803-Q805 VanDerWaalsContact C-N 3.3Å; L803-Q805 PolarHBondContact O-N 2.94Å; L803-I806 CarbonylContact O-C 3.57Å; L803-I806 WeakPolarHBondContact O-CA 3.44Å; L803-I806 WeakPolarHBondContact O-CB 3.4Å; L803-I806 PolarHBondContact O-N 2.94Å; L803-E807 VanDerWaalsContact CD2-CD 3.44Å; L803-E807 HydrophobicContact CD2-CG 3.89Å; L803-E807 WeakPolarHBondContact CD2-OE1 3.49Å; L803-E807 WeakPolarHBondContact O-CG 3.5Å; L803-E807 PolarHBondContact O-N 3.11Å
804	K	86	Confident	86	Confident	140 Å²	140	104.5 Å²	104.5	61%	0.609	51%	0.507	S	S	*	.	H	α-helix	trans	-59.5	-36.6	172.4	-76.7	173.7	178.7	177.5	0	113	N800 K808	N800-K804 WeakPolarHBondContact O-CB 3.38Å; N800-K804 VanDerWaalsContact O-CG 3.27Å; N800-K804 WeakPolarHBondContact O-CG 3.33Å; N800-K804 PolarHBondContact O-N 3.23Å; K804-K808 WeakPolarHBondContact O-CB 3.47Å; K804-K808 PolarHBondContact O-N 2.93Å
805	Q	86.3	Confident	85.7	Confident	91 Å²	91	103.4 Å²	103.4	43%	0.425	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-42.5	173.2	175.3	58.4	26.5	0	0	111.1	S801 R802 L803 K808 E809	S801-Q805 WeakPolarHBondContact O-CB 3.39Å; S801-Q805 PolarHBondContact O-N 2.94Å; R802-Q805 PolarHBondContact O-N 3.29Å; L803-Q805 VanDerWaalsContact C-N 3.3Å; L803-Q805 PolarHBondContact O-N 2.94Å; Q805-K808 PolarHBondContact O-N 3.36Å; Q805-E809 PolarHBondContact NE2-OE1 3.35Å; Q805-E809 WeakPolarHBondContact O-CG 3.5Å; Q805-E809 PolarHBondContact O-N 3.2Å
806	I	85.4	Confident	85.8	Confident	71 Å²	71	105.2 Å²	105.2	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-64.4	-44.9	174.6	-72.2	166.1	0	0	0	111.1	R802 L803 K808 E809 Y810	R802-I806 HydrophobicContact CG-CD1 4.05Å; R802-I806 WeakPolarHBondContact O-CB 3.31Å; R802-I806 WeakPolarHBondContact O-CD1 3.4Å; R802-I806 VanDerWaalsContact O-CG1 3.25Å; R802-I806 WeakPolarHBondContact O-CG1 3.4Å; R802-I806 PolarHBondContact O-N 3.27Å; L803-I806 CarbonylContact O-C 3.57Å; L803-I806 WeakPolarHBondContact O-CA 3.44Å; L803-I806 WeakPolarHBondContact O-CB 3.4Å; L803-I806 PolarHBondContact O-N 2.94Å; I806-K808 VanDerWaalsContact C-N 3.33Å; I806-K808 PolarHBondContact O-N 3.29Å; I806-E809 PolarHBondContact O-N 2.9Å; I806-Y810 HydrophobicContact CG2-CD2 3.58Å; I806-Y810 HydrophobicContact CG2-CE2 3.67Å; I806-Y810 VanDerWaalsContact O-CD2 3.29Å; I806-Y810 WeakPolarHBondContact O-CD2 3.31Å; I806-Y810 PolarHBondContact O-N 3.39Å
807	E	83.3	Confident	85.8	Confident	104 Å²	104	103 Å²	103	49%	0.486	51%	0.506	S	S	.	.	H	α-helix	trans	-58.8	-42.5	173.4	-73	176.9	144.7	0	0	111.7	L803 Y810 T811	L803-E807 VanDerWaalsContact CD2-CD 3.44Å; L803-E807 HydrophobicContact CD2-CG 3.89Å; L803-E807 WeakPolarHBondContact CD2-OE1 3.49Å; L803-E807 WeakPolarHBondContact O-CG 3.5Å; L803-E807 PolarHBondContact O-N 3.11Å; E807-Y810 PolarHBondContact O-N 2.92Å; E807-T811 WeakPolarHBondContact O-CB 3.45Å; E807-T811 WeakPolarHBondContact O-CG2 3.35Å; E807-T811 PolarHBondContact O-N 3.42Å; E807-T811 PolarHBondContact O-OG1 3.41Å
808	K	86.6	Confident	85.8	Confident	140 Å²	140	99.3 Å²	99.3	61%	0.609	50%	0.496	S	S	*	.	H	α-helix	trans	-64.8	-40.5	175.7	-174.4	178.7	179.9	-177.6	0	111.8	K804 Q805 I806 T811 Q812	K804-K808 WeakPolarHBondContact O-CB 3.47Å; K804-K808 PolarHBondContact O-N 2.93Å; Q805-K808 PolarHBondContact O-N 3.36Å; I806-K808 VanDerWaalsContact C-N 3.33Å; I806-K808 PolarHBondContact O-N 3.29Å; K808-T811 WeakPolarHBondContact CA-OG1 3.46Å; K808-T811 PolarHBondContact O-OG1 3.1Å; K808-Q812 WeakPolarHBondContact O-CB 3.41Å; K808-Q812 PolarHBondContact O-N 3Å
809	E	86.7	Confident	85.7	Confident	73 Å²	73	98.8 Å²	98.8	34%	0.341	50%	0.495	S	S	.	.	H	α-helix	trans	-67.4	-40.4	173.9	-76.8	176.8	-145.5	0	0	112.5	Q805 I806 Q812 K813	Q805-E809 PolarHBondContact NE2-OE1 3.35Å; Q805-E809 WeakPolarHBondContact O-CG 3.5Å; Q805-E809 PolarHBondContact O-N 3.2Å; I806-E809 PolarHBondContact O-N 2.9Å; E809-Q812 PolarHBondContact O-N 2.66Å; E809-K813 VanDerWaalsContact O-CB 3.3Å; E809-K813 WeakPolarHBondContact O-CB 3.38Å; E809-K813 WeakPolarHBondContact O-CD 3.44Å; E809-K813 WeakPolarHBondContact O-CG 2.99Å; E809-K813 PolarHBondContact O-N 3.11Å; E809-K813 IonicContact OE2-NZ 2.71Å
810	Y	85.2	Confident	85.7	Confident	154 Å²	154	100.6 Å²	100.6	60%	0.604	50%	0.497	S	S	*	.	H	α-helix	trans	-72.3	-39.2	177.5	-85.6	-70.2	0	0	0	112.5	I806 E807 K813 L814	I806-Y810 HydrophobicContact CG2-CD2 3.58Å; I806-Y810 HydrophobicContact CG2-CE2 3.67Å; I806-Y810 VanDerWaalsContact O-CD2 3.29Å; I806-Y810 WeakPolarHBondContact O-CD2 3.31Å; I806-Y810 PolarHBondContact O-N 3.39Å; E807-Y810 PolarHBondContact O-N 2.92Å; Y810-K813 HydrophobicContact CD1-CD 4.5Å; Y810-K813 PolarHBondContact O-N 3.31Å; Y810-L814 WeakPolarHBondContact O-CB 3.35Å; Y810-L814 PolarHBondContact O-N 2.9Å
811	T	85.6	Confident	85.7	Confident	87 Å²	87	100.2 Å²	100.2	53%	0.534	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-35.6	171.6	47.8	0	0	0	0	111.7	E807 K808 L814 A815	E807-T811 WeakPolarHBondContact O-CB 3.45Å; E807-T811 WeakPolarHBondContact O-CG2 3.35Å; E807-T811 PolarHBondContact O-N 3.42Å; E807-T811 PolarHBondContact O-OG1 3.41Å; K808-T811 WeakPolarHBondContact CA-OG1 3.46Å; K808-T811 PolarHBondContact O-OG1 3.1Å; T811-L814 PolarHBondContact O-N 3.39Å; T811-A815 VanDerWaalsContact O-CB 3.24Å; T811-A815 WeakPolarHBondContact O-CB 3.27Å; T811-A815 PolarHBondContact O-N 3.03Å
812	Q	86.3	Confident	85.6	Confident	112 Å²	112	99.3 Å²	99.3	52%	0.523	49%	0.491	S	S	.	.	H	α-helix	trans	-69.3	-39.2	172.4	-166.3	-176.1	37.5	0	0	112.4	K808 E809 K816	K808-Q812 WeakPolarHBondContact O-CB 3.41Å; K808-Q812 PolarHBondContact O-N 3Å; E809-Q812 PolarHBondContact O-N 2.66Å; Q812-K816 HydrophobicContact CG-CD 4.46Å; Q812-K816 WeakPolarHBondContact O-CB 3.43Å; Q812-K816 VanDerWaalsContact O-CG 3.29Å; Q812-K816 WeakPolarHBondContact O-CG 3.47Å; Q812-K816 PolarHBondContact O-N 3.39Å
813	K	87.7	Confident	85.5	Confident	110 Å²	110	94.8 Å²	94.8	48%	0.478	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-42.7	172.6	-76.6	162.3	-176.2	159	0	111.1	E809 Y810 K816 S817	E809-K813 VanDerWaalsContact O-CB 3.3Å; E809-K813 WeakPolarHBondContact O-CB 3.38Å; E809-K813 WeakPolarHBondContact O-CD 3.44Å; E809-K813 WeakPolarHBondContact O-CG 2.99Å; E809-K813 PolarHBondContact O-N 3.11Å; E809-K813 IonicContact OE2-NZ 2.71Å; Y810-K813 HydrophobicContact CD1-CD 4.5Å; Y810-K813 PolarHBondContact O-N 3.31Å; K813-K816 PolarHBondContact O-N 3.3Å; K813-S817 WeakPolarHBondContact O-CB 3.4Å; K813-S817 PolarHBondContact O-N 3.27Å
814	L	86.1	Confident	85.5	Confident	112 Å²	112	95.3 Å²	95.3	59%	0.586	48%	0.48	S	S	*	.	H	α-helix	trans	-64.3	-48.2	176.3	-177.4	62	0	0	0	110.9	Y810 T811 K816 S817 S818	Y810-L814 WeakPolarHBondContact O-CB 3.35Å; Y810-L814 PolarHBondContact O-N 2.9Å; T811-L814 PolarHBondContact O-N 3.39Å; L814-K816 PolarHBondContact O-N 3.32Å; L814-S817 CarbonylContact O-C 3.5Å; L814-S817 WeakPolarHBondContact O-CB 3.34Å; L814-S817 PolarHBondContact O-N 3.19Å; L814-S817 VanDerWaalsContact O-N 3.12Å; L814-S818 WeakPolarHBondContact O-CB 3.21Å; L814-S818 PolarHBondContact O-N 2.71Å; L814-S818 PolarHBondContact O-OG 2.58Å; L814-S818 VanDerWaalsContact O-OG 3.12Å
815	A	82.6	Confident	85.4	Confident	58 Å²	58	94.3 Å²	94.3	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-59.8	-43.9	176.6	0	0	0	0	0	112.2	T811 S818 Q819	T811-A815 VanDerWaalsContact O-CB 3.24Å; T811-A815 WeakPolarHBondContact O-CB 3.27Å; T811-A815 PolarHBondContact O-N 3.03Å; A815-S818 PolarHBondContact O-N 2.84Å; A815-Q819 WeakPolarHBondContact O-CB 3.43Å; A815-Q819 PolarHBondContact O-N 3.46Å
816	K	86.1	Confident	85.2	Confident	114 Å²	114	94.3 Å²	94.3	50%	0.496	48%	0.484	S	S	.	.	H	α-helix	trans	-62.5	-41.3	172.8	-75.2	174.9	176.4	-179.3	0	112.1	Q812 K813 L814 Q819 I820	Q812-K816 HydrophobicContact CG-CD 4.46Å; Q812-K816 WeakPolarHBondContact O-CB 3.43Å; Q812-K816 VanDerWaalsContact O-CG 3.29Å; Q812-K816 WeakPolarHBondContact O-CG 3.47Å; Q812-K816 PolarHBondContact O-N 3.39Å; K813-K816 PolarHBondContact O-N 3.3Å; L814-K816 PolarHBondContact O-N 3.32Å; K816-Q819 PolarHBondContact O-N 3.16Å; K816-I820 WeakPolarHBondContact O-CB 3.36Å; K816-I820 WeakPolarHBondContact O-CD1 3.26Å; K816-I820 VanDerWaalsContact O-CG1 3.27Å; K816-I820 WeakPolarHBondContact O-CG1 3.45Å; K816-I820 PolarHBondContact O-N 3.29Å
817	S	84.4	Confident	85.1	Confident	58 Å²	58	94.1 Å²	94.1	41%	0.406	49%	0.486	S	S	.	.	H	α-helix	trans	-65	-42.4	175.8	-167.9	0	0	0	0	111.7	K813 L814 I820 I821	K813-S817 WeakPolarHBondContact O-CB 3.4Å; K813-S817 PolarHBondContact O-N 3.27Å; L814-S817 CarbonylContact O-C 3.5Å; L814-S817 WeakPolarHBondContact O-CB 3.34Å; L814-S817 PolarHBondContact O-N 3.19Å; L814-S817 VanDerWaalsContact O-N 3.12Å; S817-I820 PolarHBondContact O-N 3.43Å; S817-I821 WeakPolarHBondContact O-CB 3.43Å; S817-I821 WeakPolarHBondContact O-CD1 3.47Å; S817-I821 WeakPolarHBondContact O-CG1 3.18Å; S817-I821 PolarHBondContact O-N 3.47Å
818	S	85.4	Confident	85.3	Confident	63 Å²	63	93.4 Å²	93.4	44%	0.441	49%	0.485	S	S	.	.	H	α-helix	trans	-66	-37.8	175.9	-63.6	0	0	0	0	112	L814 A815 I821 A822	L814-S818 WeakPolarHBondContact O-CB 3.21Å; L814-S818 PolarHBondContact O-N 2.71Å; L814-S818 PolarHBondContact O-OG 2.58Å; L814-S818 VanDerWaalsContact O-OG 3.12Å; A815-S818 PolarHBondContact O-N 2.84Å; S818-I821 PolarHBondContact O-N 3.19Å; S818-A822 WeakPolarHBondContact O-CB 3.13Å; S818-A822 PolarHBondContact O-N 3.42Å
819	Q	86.3	Confident	85.2	Confident	112 Å²	112	90.1 Å²	90.1	52%	0.523	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-51.6	171.7	177.5	-179.7	-10.9	0	0	110.9	A815 K816 I821 A822 E823	A815-Q819 WeakPolarHBondContact O-CB 3.43Å; A815-Q819 PolarHBondContact O-N 3.46Å; K816-Q819 PolarHBondContact O-N 3.16Å; Q819-I821 VanDerWaalsContact C-N 3.27Å; Q819-I821 PolarHBondContact O-N 3.46Å; Q819-A822 CarbonylContact O-C 3.11Å; Q819-A822 WeakPolarHBondContact O-CB 3.18Å; Q819-A822 PolarHBondContact O-N 3.01Å; Q819-E823 HydrophobicContact CG-CG 4.47Å; Q819-E823 VanDerWaalsContact CG-OE1 3.23Å; Q819-E823 WeakPolarHBondContact CG-OE1 3.4Å; Q819-E823 PolarHBondContact NE2-OE1 3.46Å; Q819-E823 WeakPolarHBondContact O-CG 3.4Å; Q819-E823 PolarHBondContact O-N 2.68Å
820	I	86.4	Confident	85	Confident	90 Å²	90	89.8 Å²	89.8	46%	0.462	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-38.1	177.2	-68.7	163.8	0	0	0	110.9	K816 S817 E823 L824	K816-I820 WeakPolarHBondContact O-CB 3.36Å; K816-I820 WeakPolarHBondContact O-CD1 3.26Å; K816-I820 VanDerWaalsContact O-CG1 3.27Å; K816-I820 WeakPolarHBondContact O-CG1 3.45Å; K816-I820 PolarHBondContact O-N 3.29Å; S817-I820 PolarHBondContact O-N 3.43Å; I820-E823 PolarHBondContact O-N 2.66Å; I820-L824 HydrophobicContact CG2-CD1 3.89Å; I820-L824 HydrophobicContact CG2-CG 4.35Å; I820-L824 VanDerWaalsContact O-CB 3.3Å; I820-L824 WeakPolarHBondContact O-CB 3.34Å; I820-L824 WeakPolarHBondContact O-CG 3.18Å; I820-L824 PolarHBondContact O-N 3.42Å
821	I	85.6	Confident	84.9	Confident	78 Å²	78	87.5 Å²	87.5	40%	0.4	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-38.6	174.4	-72.4	162.9	0	0	0	111.2	S817 S818 Q819 L824 Q825	S817-I821 WeakPolarHBondContact O-CB 3.43Å; S817-I821 WeakPolarHBondContact O-CD1 3.47Å; S817-I821 WeakPolarHBondContact O-CG1 3.18Å; S817-I821 PolarHBondContact O-N 3.47Å; S818-I821 PolarHBondContact O-N 3.19Å; Q819-I821 VanDerWaalsContact C-N 3.27Å; Q819-I821 PolarHBondContact O-N 3.46Å; I821-L824 PolarHBondContact O-N 2.73Å; I821-Q825 HydrophobicContact CG2-CG 4.39Å; I821-Q825 VanDerWaalsContact O-CB 3.28Å; I821-Q825 WeakPolarHBondContact O-CB 3.37Å; I821-Q825 WeakPolarHBondContact O-CG 3.26Å; I821-Q825 PolarHBondContact O-N 2.66Å
822	A	82.3	Confident	84.9	Confident	47 Å²	47	90.2 Å²	90.2	39%	0.388	49%	0.487	S	S	.	.	H	α-helix	trans	-69.9	-38.2	175.3	0	0	0	0	0	112.6	S818 Q819 Q825 T826	S818-A822 WeakPolarHBondContact O-CB 3.13Å; S818-A822 PolarHBondContact O-N 3.42Å; Q819-A822 CarbonylContact O-C 3.11Å; Q819-A822 WeakPolarHBondContact O-CB 3.18Å; Q819-A822 PolarHBondContact O-N 3.01Å; A822-Q825 PolarHBondContact O-N 2.6Å; A822-T826 WeakPolarHBondContact O-CB 3.44Å; A822-T826 WeakPolarHBondContact O-CG2 3.46Å; A822-T826 PolarHBondContact O-N 3.04Å; A822-T826 PolarHBondContact O-OG1 3.12Å
823	E	85.7	Confident	84.8	Confident	92 Å²	92	90.7 Å²	90.7	43%	0.43	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-39.9	173	-71	167.1	-176.7	0	0	111.2	Q819 I820 T826 T827	Q819-E823 HydrophobicContact CG-CG 4.47Å; Q819-E823 VanDerWaalsContact CG-OE1 3.23Å; Q819-E823 WeakPolarHBondContact CG-OE1 3.4Å; Q819-E823 PolarHBondContact NE2-OE1 3.46Å; Q819-E823 WeakPolarHBondContact O-CG 3.4Å; Q819-E823 PolarHBondContact O-N 2.68Å; I820-E823 PolarHBondContact O-N 2.66Å; E823-T826 WeakPolarHBondContact CA-OG1 3.5Å; E823-T826 PolarHBondContact O-OG1 2.71Å; E823-T827 WeakPolarHBondContact O-CB 3.35Å; E823-T827 WeakPolarHBondContact O-CG2 2.97Å; E823-T827 PolarHBondContact O-N 3.35Å; E823-T827 PolarHBondContact O-OG1 3.45Å
824	L	85.8	Confident	84.5	Confident	96 Å²	96	90.1 Å²	90.1	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-69.4	-37.1	171.8	-71.3	171.7	0	0	0	112.3	I820 I821 T827 I828	I820-L824 HydrophobicContact CG2-CD1 3.89Å; I820-L824 HydrophobicContact CG2-CG 4.35Å; I820-L824 VanDerWaalsContact O-CB 3.3Å; I820-L824 WeakPolarHBondContact O-CB 3.34Å; I820-L824 WeakPolarHBondContact O-CG 3.18Å; I820-L824 PolarHBondContact O-N 3.42Å; I821-L824 PolarHBondContact O-N 2.73Å; L824-T827 WeakPolarHBondContact CA-OG1 3.14Å; L824-T827 PolarHBondContact O-OG1 3.23Å; L824-I828 WeakPolarHBondContact O-CB 3.06Å; L824-I828 WeakPolarHBondContact O-CD1 3.21Å; L824-I828 WeakPolarHBondContact O-CG1 3.09Å; L824-I828 PolarHBondContact O-N 3.38Å
825	Q	84.7	Confident	84.5	Confident	119 Å²	119	89.4 Å²	89.4	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-69.5	-37.9	176.2	-79.6	172.9	-10.4	0	0	112.4	I821 A822 S829	I821-Q825 HydrophobicContact CG2-CG 4.39Å; I821-Q825 VanDerWaalsContact O-CB 3.28Å; I821-Q825 WeakPolarHBondContact O-CB 3.37Å; I821-Q825 WeakPolarHBondContact O-CG 3.26Å; I821-Q825 PolarHBondContact O-N 2.66Å; A822-Q825 PolarHBondContact O-N 2.6Å; Q825-S829 VanDerWaalsContact O-CB 3.31Å; Q825-S829 WeakPolarHBondContact O-CB 3.3Å; Q825-S829 PolarHBondContact O-N 2.98Å; Q825-S829 PolarHBondContact O-OG 3.24Å
826	T	81.6	Confident	84.5	Confident	90 Å²	90	89.5 Å²	89.5	55%	0.552	48%	0.482	S	S	*	.	H	α-helix	trans	-69.2	-43.4	175.3	45.2	0	0	0	0	111.5	A822 E823 S829 S830	A822-T826 WeakPolarHBondContact O-CB 3.44Å; A822-T826 WeakPolarHBondContact O-CG2 3.46Å; A822-T826 PolarHBondContact O-N 3.04Å; A822-T826 PolarHBondContact O-OG1 3.12Å; E823-T826 WeakPolarHBondContact CA-OG1 3.5Å; E823-T826 PolarHBondContact O-OG1 2.71Å; T826-S829 WeakPolarHBondContact O-CB 3.46Å; T826-S829 PolarHBondContact O-N 2.6Å; T826-S829 VanDerWaalsContact O-N 3.13Å; T826-S830 PolarHBondContact O-N 2.86Å; T826-S830 PolarHBondContact O-OG 3.39Å
827	T	83.7	Confident	84.4	Confident	67 Å²	67	89.3 Å²	89.3	41%	0.411	48%	0.483	S	S	.	.	H	α-helix	trans	-67.3	-37.5	174	49.7	0	0	0	0	113.3	E823 L824 S829 S830 L831	E823-T827 WeakPolarHBondContact O-CB 3.35Å; E823-T827 WeakPolarHBondContact O-CG2 2.97Å; E823-T827 PolarHBondContact O-N 3.35Å; E823-T827 PolarHBondContact O-OG1 3.45Å; L824-T827 WeakPolarHBondContact CA-OG1 3.14Å; L824-T827 PolarHBondContact O-OG1 3.23Å; T827-S829 VanDerWaalsContact C-N 3.26Å; T827-S829 PolarHBondContact O-N 2.78Å; T827-S830 WeakPolarHBondContact CA-OG 3.21Å; T827-S830 PolarHBondContact O-N 3.15Å; T827-S830 PolarHBondContact O-OG 3.36Å; T827-S830 VanDerWaalsContact O-OG 3.06Å; T827-L831 WeakPolarHBondContact O-CB 3.34Å; T827-L831 VanDerWaalsContact O-CG 3.24Å; T827-L831 WeakPolarHBondContact O-CG 3.09Å; T827-L831 PolarHBondContact O-N 2.82Å
828	I	86.1	Confident	84.2	Confident	89 Å²	89	91.9 Å²	91.9	46%	0.456	49%	0.489	S	S	.	.	H	α-helix	trans	-62.6	-34.8	169.5	-73.5	165.6	0	0	0	111	L824 K832	L824-I828 WeakPolarHBondContact O-CB 3.06Å; L824-I828 WeakPolarHBondContact O-CD1 3.21Å; L824-I828 WeakPolarHBondContact O-CG1 3.09Å; L824-I828 PolarHBondContact O-N 3.38Å; I828-K832 HydrophobicContact CG2-CD 4.17Å; I828-K832 WeakPolarHBondContact O-CB 3.08Å; I828-K832 VanDerWaalsContact O-CG 3.24Å; I828-K832 WeakPolarHBondContact O-CG 2.98Å; I828-K832 PolarHBondContact O-N 3.33Å
829	S	84.9	Confident	83.9	Confident	72 Å²	72	93.9 Å²	93.9	50%	0.503	49%	0.491	S	S	.	.	H	α-helix	trans	-72	-44.3	177.9	-59.6	0	0	0	0	111.8	Q825 T826 T827 K832 E833	Q825-S829 VanDerWaalsContact O-CB 3.31Å; Q825-S829 WeakPolarHBondContact O-CB 3.3Å; Q825-S829 PolarHBondContact O-N 2.98Å; Q825-S829 PolarHBondContact O-OG 3.24Å; T826-S829 WeakPolarHBondContact O-CB 3.46Å; T826-S829 PolarHBondContact O-N 2.6Å; T826-S829 VanDerWaalsContact O-N 3.13Å; T827-S829 VanDerWaalsContact C-N 3.26Å; T827-S829 PolarHBondContact O-N 2.78Å; S829-K832 PolarHBondContact O-N 3.46Å; S829-E833 PolarHBondContact O-N 2.77Å
830	S	83.7	Confident	83.8	Confident	65 Å²	65	92.4 Å²	92.4	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-65.6	-38.8	175.6	64.5	0	0	0	0	112.1	T826 T827 E833 E834	T826-S830 PolarHBondContact O-N 2.86Å; T826-S830 PolarHBondContact O-OG 3.39Å; T827-S830 WeakPolarHBondContact CA-OG 3.21Å; T827-S830 PolarHBondContact O-N 3.15Å; T827-S830 PolarHBondContact O-OG 3.36Å; T827-S830 VanDerWaalsContact O-OG 3.06Å; S830-E833 PolarHBondContact O-N 3.5Å; S830-E834 WeakPolarHBondContact O-CB 3.25Å; S830-E834 PolarHBondContact O-N 2.78Å
831	L	83.1	Confident	83.6	Confident	106 Å²	106	90 Å²	90	56%	0.555	48%	0.48	S	S	*	.	H	α-helix	trans	-67.3	-34.4	174.3	-72.6	169.8	0	0	0	112.4	T827 N835	T827-L831 WeakPolarHBondContact O-CB 3.34Å; T827-L831 VanDerWaalsContact O-CG 3.24Å; T827-L831 WeakPolarHBondContact O-CG 3.09Å; T827-L831 PolarHBondContact O-N 2.82Å; L831-N835 WeakPolarHBondContact O-CB 3.05Å; L831-N835 PolarHBondContact O-N 2.72Å
832	K	84.4	Confident	83.3	Confident	145 Å²	145	88.6 Å²	88.6	63%	0.63	48%	0.48	S	S	*	.	H	α-helix	trans	-67.7	-40.8	171.5	-81.5	175.1	177.9	-178	0	112.1	I828 S829 S836	I828-K832 HydrophobicContact CG2-CD 4.17Å; I828-K832 WeakPolarHBondContact O-CB 3.08Å; I828-K832 VanDerWaalsContact O-CG 3.24Å; I828-K832 WeakPolarHBondContact O-CG 2.98Å; I828-K832 PolarHBondContact O-N 3.33Å; S829-K832 PolarHBondContact O-N 3.46Å; K832-S836 VanDerWaalsContact O-CB 3.28Å; K832-S836 WeakPolarHBondContact O-CB 2.82Å; K832-S836 PolarHBondContact O-N 3.41Å
833	E	83.4	Confident	83.2	Confident	121 Å²	121	90.6 Å²	90.6	57%	0.565	48%	0.481	S	S	*	.	H	α-helix	trans	-66.3	-47.4	176.5	-165.6	-176	159.5	0	0	110.9	S829 S830 N835 S836 Q837	S829-E833 PolarHBondContact O-N 2.77Å; S830-E833 PolarHBondContact O-N 3.5Å; E833-N835 PolarHBondContact O-N 3.14Å; E833-S836 CarbonylContact O-C 3.59Å; E833-S836 WeakPolarHBondContact O-CB 3.49Å; E833-S836 PolarHBondContact O-N 2.77Å; E833-S836 VanDerWaalsContact O-N 3.14Å; E833-Q837 WeakPolarHBondContact O-CG 3.22Å; E833-Q837 PolarHBondContact O-N 2.99Å; E833-Q837 PolarHBondContact OE1-NE2 3.47Å; E833-Q837 VanDerWaalsContact OE1-NE2 3.1Å
834	E	83.2	Confident	83.1	Confident	98 Å²	98	94.4 Å²	94.4	46%	0.458	49%	0.492	S	S	.	.	H	α-helix	trans	-59.7	-47.2	175.8	-169	-173.2	168.8	0	0	111.3	S830 S836 Q837 Q838	S830-E834 WeakPolarHBondContact O-CB 3.25Å; S830-E834 PolarHBondContact O-N 2.78Å; E834-S836 VanDerWaalsContact C-N 3.29Å; E834-S836 PolarHBondContact O-N 3.07Å; E834-Q837 PolarHBondContact O-N 3.29Å; E834-Q837 VanDerWaalsContact O-N 3.17Å; E834-Q838 HydrophobicContact CG-CG 4.45Å; E834-Q838 WeakPolarHBondContact O-CB 3.39Å; E834-Q838 WeakPolarHBondContact O-CG 3.49Å; E834-Q838 PolarHBondContact O-N 3.35Å; E834-Q838 PolarHBondContact OE1-NE2 2.73Å
835	N	84.9	Confident	83	Confident	98 Å²	98	98.2 Å²	98.2	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-36.6	175.6	-177.2	80.6	0	0	0	112.1	L831 E833 Q839	L831-N835 WeakPolarHBondContact O-CB 3.05Å; L831-N835 PolarHBondContact O-N 2.72Å; E833-N835 PolarHBondContact O-N 3.14Å; N835-Q839 VanDerWaalsContact O-CB 3.27Å; N835-Q839 WeakPolarHBondContact O-CB 3.29Å; N835-Q839 PolarHBondContact O-N 3.24Å
836	S	82.8	Confident	82.9	Confident	59 Å²	59	97.4 Å²	97.4	41%	0.413	50%	0.498	S	S	.	.	H	α-helix	trans	-66.5	-42.5	173.5	-173.9	0	0	0	0	112	K832 E833 E834 Q839 L840	K832-S836 VanDerWaalsContact O-CB 3.28Å; K832-S836 WeakPolarHBondContact O-CB 2.82Å; K832-S836 PolarHBondContact O-N 3.41Å; E833-S836 CarbonylContact O-C 3.59Å; E833-S836 WeakPolarHBondContact O-CB 3.49Å; E833-S836 PolarHBondContact O-N 2.77Å; E833-S836 VanDerWaalsContact O-N 3.14Å; E834-S836 VanDerWaalsContact C-N 3.29Å; E834-S836 PolarHBondContact O-N 3.07Å; S836-Q839 PolarHBondContact O-N 3.11Å; S836-L840 WeakPolarHBondContact O-CB 3.28Å; S836-L840 VanDerWaalsContact O-CG 3.29Å; S836-L840 WeakPolarHBondContact O-CG 3.42Å; S836-L840 PolarHBondContact O-N 3.32Å
837	Q	83.1	Confident	82.9	Confident	111 Å²	111	99.8 Å²	99.8	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-42.4	174.7	-68.7	179	21	0	0	111.7	E833 E834 L840 A841	E833-Q837 WeakPolarHBondContact O-CG 3.22Å; E833-Q837 PolarHBondContact O-N 2.99Å; E833-Q837 PolarHBondContact OE1-NE2 3.47Å; E833-Q837 VanDerWaalsContact OE1-NE2 3.1Å; E834-Q837 PolarHBondContact O-N 3.29Å; E834-Q837 VanDerWaalsContact O-N 3.17Å; Q837-L840 PolarHBondContact O-N 2.99Å; Q837-A841 WeakPolarHBondContact O-CB 3.38Å; Q837-A841 PolarHBondContact O-N 2.91Å
838	Q	80.5	Confident	82.9	Confident	112 Å²	112	101.1 Å²	101.1	52%	0.523	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-42.8	174.7	-70.8	-175.2	23.1	0	0	111.5	E834 A841 A842	E834-Q838 HydrophobicContact CG-CG 4.45Å; E834-Q838 WeakPolarHBondContact O-CB 3.39Å; E834-Q838 WeakPolarHBondContact O-CG 3.49Å; E834-Q838 PolarHBondContact O-N 3.35Å; E834-Q838 PolarHBondContact OE1-NE2 2.73Å; Q838-A841 PolarHBondContact O-N 2.96Å; Q838-A842 WeakPolarHBondContact O-CB 3.43Å; Q838-A842 PolarHBondContact O-N 2.96Å
839	Q	80	Confident	82.9	Confident	105 Å²	105	100.2 Å²	100.2	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-47.2	175.7	-179.2	171.4	-20.3	0	0	111.5	N835 S836 A841 A842 E843	N835-Q839 VanDerWaalsContact O-CB 3.27Å; N835-Q839 WeakPolarHBondContact O-CB 3.29Å; N835-Q839 PolarHBondContact O-N 3.24Å; S836-Q839 PolarHBondContact O-N 3.11Å; Q839-A841 VanDerWaalsContact C-N 3.27Å; Q839-A841 PolarHBondContact O-N 3.24Å; Q839-A842 CarbonylContact O-C 3.54Å; Q839-A842 WeakPolarHBondContact O-CB 3.25Å; Q839-A842 PolarHBondContact O-N 3.19Å; Q839-A842 VanDerWaalsContact O-N 3.08Å; Q839-E843 HydrophobicContact CG-CG 4.32Å; Q839-E843 WeakPolarHBondContact CG-OE1 3.42Å; Q839-E843 PolarHBondContact NE2-OE1 3.31Å; Q839-E843 WeakPolarHBondContact O-CB 3.22Å; Q839-E843 WeakPolarHBondContact O-CG 3.29Å; Q839-E843 PolarHBondContact O-N 3.47Å
840	L	83.3	Confident	82.8	Confident	81 Å²	81	105.1 Å²	105.1	42%	0.424	51%	0.514	S	S	.	.	H	α-helix	trans	-61	-35.2	175.2	-74.4	168	0	0	0	112.3	S836 Q837 R844	S836-L840 WeakPolarHBondContact O-CB 3.28Å; S836-L840 VanDerWaalsContact O-CG 3.29Å; S836-L840 WeakPolarHBondContact O-CG 3.42Å; S836-L840 PolarHBondContact O-N 3.32Å; Q837-L840 PolarHBondContact O-N 2.99Å; L840-R844 WeakPolarHBondContact O-CB 3.36Å; L840-R844 VanDerWaalsContact O-CG 3.26Å; L840-R844 WeakPolarHBondContact O-CG 3.23Å; L840-R844 PolarHBondContact O-N 2.81Å
841	A	82.3	Confident	82.8	Confident	39 Å²	39	106.7 Å²	106.7	32%	0.322	51%	0.514	S	S	.	.	H	α-helix	trans	-69.5	-36.6	173.6	0	0	0	0	0	112.5	Q837 Q838 Q839 R845	Q837-A841 WeakPolarHBondContact O-CB 3.38Å; Q837-A841 PolarHBondContact O-N 2.91Å; Q838-A841 PolarHBondContact O-N 2.96Å; Q839-A841 VanDerWaalsContact C-N 3.27Å; Q839-A841 PolarHBondContact O-N 3.24Å; A841-R845 WeakPolarHBondContact O-CD 3.34Å; A841-R845 VanDerWaalsContact O-CG 3.26Å; A841-R845 WeakPolarHBondContact O-CG 3.33Å; A841-R845 PolarHBondContact O-N 3.46Å; A841-R845 VanDerWaalsContact O-N 3.16Å
842	A	79.8	Confident	82.9	Confident	48 Å²	48	108.1 Å²	108.1	40%	0.397	52%	0.516	S	S	.	.	H	α-helix	trans	-69.1	-43.6	174	0	0	0	0	0	112	Q838 Q839 R845 L846	Q838-A842 WeakPolarHBondContact O-CB 3.43Å; Q838-A842 PolarHBondContact O-N 2.96Å; Q839-A842 CarbonylContact O-C 3.54Å; Q839-A842 WeakPolarHBondContact O-CB 3.25Å; Q839-A842 PolarHBondContact O-N 3.19Å; Q839-A842 VanDerWaalsContact O-N 3.08Å; A842-R845 PolarHBondContact O-N 3.23Å; A842-L846 WeakPolarHBondContact O-CB 3.38Å; A842-L846 PolarHBondContact O-N 3.14Å
843	E	80.2	Confident	82.8	Confident	89 Å²	89	107.5 Å²	107.5	42%	0.416	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-43.7	176.4	-74.5	173.1	-176.1	0	0	111.6	Q839 L846 Q847	Q839-E843 HydrophobicContact CG-CG 4.32Å; Q839-E843 WeakPolarHBondContact CG-OE1 3.42Å; Q839-E843 PolarHBondContact NE2-OE1 3.31Å; Q839-E843 WeakPolarHBondContact O-CB 3.22Å; Q839-E843 WeakPolarHBondContact O-CG 3.29Å; Q839-E843 PolarHBondContact O-N 3.47Å; E843-L846 WeakPolarHBondContact O-CB 3.38Å; E843-L846 PolarHBondContact O-N 2.92Å; E843-Q847 WeakPolarHBondContact O-CB 3.14Å; E843-Q847 PolarHBondContact O-N 2.95Å
844	R	83.9	Confident	82.9	Confident	172 Å²	172	105.6 Å²	105.6	65%	0.649	50%	0.504	S	S	*	.	H	α-helix	trans	-58.5	-49.1	172.3	-76.2	174	-175.1	176.4	3.5	112.1	L840 L846 Q847 D848	L840-R844 WeakPolarHBondContact O-CB 3.36Å; L840-R844 VanDerWaalsContact O-CG 3.26Å; L840-R844 WeakPolarHBondContact O-CG 3.23Å; L840-R844 PolarHBondContact O-N 2.81Å; R844-L846 VanDerWaalsContact C-N 3.28Å; R844-L846 PolarHBondContact O-N 3.06Å; R844-Q847 CarbonylContact O-C 3.57Å; R844-Q847 PolarHBondContact O-N 2.64Å; R844-D848 VanDerWaalsContact O-CG 3.26Å; R844-D848 PolarHBondContact O-N 3.15Å
845	R	83.9	Confident	83	Confident	177 Å²	177	104.2 Å²	104.2	67%	0.668	50%	0.5	S	S	*	.	H	α-helix	trans	-58.5	-39.5	175.9	-71.8	167.3	-178.5	170.6	1.9	112.2	A841 A842 V849	A841-R845 WeakPolarHBondContact O-CD 3.34Å; A841-R845 VanDerWaalsContact O-CG 3.26Å; A841-R845 WeakPolarHBondContact O-CG 3.33Å; A841-R845 PolarHBondContact O-N 3.46Å; A841-R845 VanDerWaalsContact O-N 3.16Å; A842-R845 PolarHBondContact O-N 3.23Å; R845-V849 WeakPolarHBondContact O-CB 3.35Å; R845-V849 VanDerWaalsContact O-CG2 3.29Å; R845-V849 WeakPolarHBondContact O-CG2 3.13Å; R845-V849 PolarHBondContact O-N 2.95Å
846	L	81.4	Confident	82.9	Confident	101 Å²	101	104.9 Å²	104.9	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-40.1	174.7	-109.6	164.9	0	0	0	112.1	A842 E843 R844 R850	A842-L846 WeakPolarHBondContact O-CB 3.38Å; A842-L846 PolarHBondContact O-N 3.14Å; E843-L846 WeakPolarHBondContact O-CB 3.38Å; E843-L846 PolarHBondContact O-N 2.92Å; R844-L846 VanDerWaalsContact C-N 3.28Å; R844-L846 PolarHBondContact O-N 3.06Å; L846-R850 WeakPolarHBondContact O-CB 3.44Å; L846-R850 VanDerWaalsContact O-CG 3.31Å; L846-R850 WeakPolarHBondContact O-CG 3.43Å; L846-R850 PolarHBondContact O-N 3.42Å
847	Q	82.1	Confident	82.9	Confident	140 Å²	140	106.9 Å²	106.9	65%	0.654	50%	0.501	S	S	*	.	H	α-helix	trans	-71.3	-40.1	177.5	-171.1	163.4	-8.4	0	0	112.1	E843 R844 V849 R850 Q851	E843-Q847 WeakPolarHBondContact O-CB 3.14Å; E843-Q847 PolarHBondContact O-N 2.95Å; R844-Q847 CarbonylContact O-C 3.57Å; R844-Q847 PolarHBondContact O-N 2.64Å; Q847-V849 VanDerWaalsContact C-N 3.34Å; Q847-V849 PolarHBondContact O-N 3.46Å; Q847-R850 PolarHBondContact O-N 2.81Å; Q847-Q851 WeakPolarHBondContact O-CB 3.28Å; Q847-Q851 PolarHBondContact O-N 3.19Å
848	D	84.8	Confident	82.8	Confident	96 Å²	96	105.8 Å²	105.8	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-42.2	173.2	-66.1	-29.3	0	0	0	111.5	R844 Q851 K852	R844-D848 VanDerWaalsContact O-CG 3.26Å; R844-D848 PolarHBondContact O-N 3.15Å; D848-Q851 PolarHBondContact O-N 2.86Å; D848-K852 WeakPolarHBondContact O-CG 2.86Å; D848-K852 PolarHBondContact O-N 3.15Å
849	V	85.7	Confident	83	Confident	70 Å²	70	104 Å²	104	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-67.5	-42.9	176.1	168.1	0	0	0	0	111.4	R845 Q847 Q851 K852 F853	R845-V849 WeakPolarHBondContact O-CB 3.35Å; R845-V849 VanDerWaalsContact O-CG2 3.29Å; R845-V849 WeakPolarHBondContact O-CG2 3.13Å; R845-V849 PolarHBondContact O-N 2.95Å; Q847-V849 VanDerWaalsContact C-N 3.34Å; Q847-V849 PolarHBondContact O-N 3.46Å; V849-Q851 VanDerWaalsContact C-N 3.34Å; V849-Q851 PolarHBondContact O-N 2.77Å; V849-K852 PolarHBondContact O-N 3.01Å; V849-F853 HydrophobicContact CG1-CD2 3.82Å; V849-F853 HydrophobicContact CG1-CE2 3.53Å; V849-F853 VanDerWaalsContact O-CD2 3.26Å; V849-F853 WeakPolarHBondContact O-CD2 3.33Å; V849-F853 PolarHBondContact O-N 2.94Å
850	R	82.6	Confident	83.1	Confident	175 Å²	175	104.1 Å²	104.1	66%	0.66	49%	0.49	S	S	*	.	H	α-helix	trans	-61.2	-41.2	173.6	-77	176.3	177.7	-161.6	0.7	112.3	L846 Q847 F853 E854	L846-R850 WeakPolarHBondContact O-CB 3.44Å; L846-R850 VanDerWaalsContact O-CG 3.31Å; L846-R850 WeakPolarHBondContact O-CG 3.43Å; L846-R850 PolarHBondContact O-N 3.42Å; Q847-R850 PolarHBondContact O-N 2.81Å; R850-F853 PolarHBondContact O-N 3.49Å; R850-E854 PolarHBondContact O-N 2.97Å
851	Q	84.1	Confident	83	Confident	98 Å²	98	104.3 Å²	104.3	46%	0.458	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-44.6	178.2	-176.3	60.6	41.7	0	0	111	Q847 D848 V849 F853 E854 D855	Q847-Q851 WeakPolarHBondContact O-CB 3.28Å; Q847-Q851 PolarHBondContact O-N 3.19Å; D848-Q851 PolarHBondContact O-N 2.86Å; V849-Q851 VanDerWaalsContact C-N 3.34Å; V849-Q851 PolarHBondContact O-N 2.77Å; Q851-F853 PolarHBondContact O-N 2.82Å; Q851-E854 PolarHBondContact O-N 3Å; Q851-D855 VanDerWaalsContact NE2-CG 3.28Å; Q851-D855 PolarHBondContact NE2-OD1 2.97Å; Q851-D855 VanDerWaalsContact NE2-OD1 3.16Å; Q851-D855 PolarHBondContact NE2-OD2 3.22Å; Q851-D855 PolarHBondContact O-N 2.95Å
852	K	84.5	Confident	83	Confident	136 Å²	136	109.6 Å²	109.6	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-56.9	-47.4	173.5	-74.7	172.9	-179.1	-178.7	0	112.2	D848 V849 E854 D855 E856	D848-K852 WeakPolarHBondContact O-CG 2.86Å; D848-K852 PolarHBondContact O-N 3.15Å; V849-K852 PolarHBondContact O-N 3.01Å; K852-E854 VanDerWaalsContact C-N 3.35Å; K852-E854 PolarHBondContact O-N 2.93Å; K852-D855 PolarHBondContact O-N 3.47Å; K852-D855 VanDerWaalsContact O-N 3.17Å; K852-E856 WeakPolarHBondContact O-CB 3.3Å; K852-E856 WeakPolarHBondContact O-CG 3.49Å; K852-E856 PolarHBondContact O-N 3.16Å
853	F	82.6	Confident	83.2	Confident	132 Å²	132	110.8 Å²	110.8	58%	0.579	50%	0.502	S	S	*	.	H	α-helix	trans	-62.5	-38	176.7	-77.3	-54.9	0	0	0	113.2	V849 R850 Q851 K857	V849-F853 HydrophobicContact CG1-CD2 3.82Å; V849-F853 HydrophobicContact CG1-CE2 3.53Å; V849-F853 VanDerWaalsContact O-CD2 3.26Å; V849-F853 WeakPolarHBondContact O-CD2 3.33Å; V849-F853 PolarHBondContact O-N 2.94Å; R850-F853 PolarHBondContact O-N 3.49Å; Q851-F853 PolarHBondContact O-N 2.82Å; F853-K857 WeakPolarHBondContact O-CB 3.23Å; F853-K857 PolarHBondContact O-N 3.43Å
854	E	84.9	Confident	83.3	Confident	81 Å²	81	111.2 Å²	111.2	38%	0.379	51%	0.507	S	S	.	.	H	α-helix	trans	-69.3	-32.2	173.9	-83.5	-64.3	148.5	0	0	112.9	R850 Q851 K852 K857 K858	R850-E854 PolarHBondContact O-N 2.97Å; Q851-E854 PolarHBondContact O-N 3Å; K852-E854 VanDerWaalsContact C-N 3.35Å; K852-E854 PolarHBondContact O-N 2.93Å; E854-K857 IonicContact OE1-NZ 2.74Å; E854-K857 PolarHBondContact OE1-NZ 3.43Å; E854-K857 IonicContact OE2-NZ 3.52Å; E854-K857 PolarHBondContact OE2-NZ 3.29Å; E854-K858 WeakPolarHBondContact O-CD 3.22Å; E854-K858 VanDerWaalsContact O-CE 3.32Å; E854-K858 WeakPolarHBondContact O-CE 3.41Å; E854-K858 WeakPolarHBondContact O-CG 3.33Å; E854-K858 PolarHBondContact O-N 3.13Å
855	D	84.8	Confident	83.3	Confident	69 Å²	69	107.6 Å²	107.6	37%	0.369	50%	0.501	S	S	.	.	H	α-helix	trans	-79.1	-34.7	177.4	-67.5	-28.9	0	0	0	112.6	Q851 K852 K858 Q859	Q851-D855 VanDerWaalsContact NE2-CG 3.28Å; Q851-D855 PolarHBondContact NE2-OD1 2.97Å; Q851-D855 VanDerWaalsContact NE2-OD1 3.16Å; Q851-D855 PolarHBondContact NE2-OD2 3.22Å; Q851-D855 PolarHBondContact O-N 2.95Å; K852-D855 PolarHBondContact O-N 3.47Å; K852-D855 VanDerWaalsContact O-N 3.17Å; D855-K858 PolarHBondContact O-N 3.48Å; D855-K858 IonicContact OD1-NZ 2.67Å; D855-K858 PolarHBondContact OD1-NZ 3.27Å; D855-Q859 WeakPolarHBondContact O-CB 3.3Å; D855-Q859 PolarHBondContact O-N 2.9Å
856	E	83.3	Confident	83.3	Confident	111 Å²	111	105.3 Å²	105.3	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-61.1	-44.2	166.3	-75.2	173.3	-174.5	0	0	111.3	K852 Q859 L860	K852-E856 WeakPolarHBondContact O-CB 3.3Å; K852-E856 WeakPolarHBondContact O-CG 3.49Å; K852-E856 PolarHBondContact O-N 3.16Å; E856-Q859 WeakPolarHBondContact O-CB 3.23Å; E856-Q859 PolarHBondContact O-N 2.97Å; E856-Q859 VanDerWaalsContact O-N 3.17Å; E856-L860 WeakPolarHBondContact O-CG 3.26Å; E856-L860 PolarHBondContact O-N 2.78Å
857	K	82.3	Confident	83.3	Confident	102 Å²	102	102.7 Å²	102.7	44%	0.443	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-43.3	174.1	170.4	176.8	159.7	-124.9	0	112.2	F853 E854 Q859 L860 I861	F853-K857 WeakPolarHBondContact O-CB 3.23Å; F853-K857 PolarHBondContact O-N 3.43Å; E854-K857 IonicContact OE1-NZ 2.74Å; E854-K857 PolarHBondContact OE1-NZ 3.43Å; E854-K857 IonicContact OE2-NZ 3.52Å; E854-K857 PolarHBondContact OE2-NZ 3.29Å; K857-Q859 VanDerWaalsContact C-N 3.33Å; K857-L860 PolarHBondContact O-N 2.94Å; K857-I861 HydrophobicContact CG-CD1 4.26Å; K857-I861 VanDerWaalsContact O-CG1 3.29Å; K857-I861 WeakPolarHBondContact O-CG1 3.24Å; K857-I861 PolarHBondContact O-N 3.01Å
858	K	82.6	Confident	83.2	Confident	88 Å²	88	100 Å²	100	38%	0.383	48%	0.479	S	S	.	.	H	α-helix	trans	-64.9	-35.7	172.8	-71.2	162.9	-147.3	158	0	112.2	E854 D855 I861 R862	E854-K858 WeakPolarHBondContact O-CD 3.22Å; E854-K858 VanDerWaalsContact O-CE 3.32Å; E854-K858 WeakPolarHBondContact O-CE 3.41Å; E854-K858 WeakPolarHBondContact O-CG 3.33Å; E854-K858 PolarHBondContact O-N 3.13Å; D855-K858 PolarHBondContact O-N 3.48Å; D855-K858 IonicContact OD1-NZ 2.67Å; D855-K858 PolarHBondContact OD1-NZ 3.27Å; K858-I861 PolarHBondContact O-N 2.87Å; K858-R862 WeakPolarHBondContact O-CG 3.38Å; K858-R862 PolarHBondContact O-N 3.39Å
859	Q	84.3	Confident	83.3	Confident	74 Å²	74	101.2 Å²	101.2	35%	0.346	48%	0.48	S	S	.	.	H	α-helix	trans	-64.1	-50.7	175.5	-175.5	54.8	38.4	0	0	110.7	D855 E856 K857 I861 R862 D863	D855-Q859 WeakPolarHBondContact O-CB 3.3Å; D855-Q859 PolarHBondContact O-N 2.9Å; E856-Q859 WeakPolarHBondContact O-CB 3.23Å; E856-Q859 PolarHBondContact O-N 2.97Å; E856-Q859 VanDerWaalsContact O-N 3.17Å; K857-Q859 VanDerWaalsContact C-N 3.33Å; Q859-I861 VanDerWaalsContact C-N 3.27Å; Q859-I861 PolarHBondContact O-N 2.88Å; Q859-R862 PolarHBondContact O-N 3.24Å; Q859-D863 WeakPolarHBondContact CG-OD2 3.23Å; Q859-D863 PolarHBondContact NE2-OD1 3.31Å; Q859-D863 PolarHBondContact NE2-OD2 3.09Å; Q859-D863 VanDerWaalsContact O-CG 3.31Å; Q859-D863 PolarHBondContact O-N 3.29Å
860	L	82	Confident	83.2	Confident	107 Å²	107	102.1 Å²	102.1	56%	0.56	48%	0.482	S	S	*	.	H	α-helix	trans	-58.5	-35.1	175.2	-73.5	168.1	0	0	0	113	E856 K857 N864	E856-L860 WeakPolarHBondContact O-CG 3.26Å; E856-L860 PolarHBondContact O-N 2.78Å; K857-L860 PolarHBondContact O-N 2.94Å; L860-N864 WeakPolarHBondContact O-CB 3.49Å; L860-N864 PolarHBondContact O-N 2.98Å; L860-N864 PolarHBondContact O-ND2 3.49Å
861	I	81.4	Confident	83	Confident	86 Å²	86	99.1 Å²	99.1	44%	0.441	48%	0.478	S	S	.	.	H	α-helix	trans	-63.7	-50.8	172.4	-70.4	163.1	0	0	0	110.3	K857 K858 Q859 D863 N864 D865	K857-I861 HydrophobicContact CG-CD1 4.26Å; K857-I861 VanDerWaalsContact O-CG1 3.29Å; K857-I861 WeakPolarHBondContact O-CG1 3.24Å; K857-I861 PolarHBondContact O-N 3.01Å; K858-I861 PolarHBondContact O-N 2.87Å; Q859-I861 VanDerWaalsContact C-N 3.27Å; Q859-I861 PolarHBondContact O-N 2.88Å; I861-D863 VanDerWaalsContact C-N 3.32Å; I861-D863 PolarHBondContact O-N 3.39Å; I861-N864 PolarHBondContact O-N 3.1Å; I861-D865 PolarHBondContact O-N 3Å
862	R	82.9	Confident	82.6	Confident	149 Å²	149	100.2 Å²	100.2	56%	0.562	48%	0.483	S	S	*	.	H	α-helix	trans	-59.9	-40	178.4	-70.7	-173.5	-63.5	-152.8	0.4	113	K858 Q859 D865 Q866	K858-R862 WeakPolarHBondContact O-CG 3.38Å; K858-R862 PolarHBondContact O-N 3.39Å; Q859-R862 PolarHBondContact O-N 3.24Å; R862-D865 PolarHBondContact O-N 3.37Å; R862-Q866 VanDerWaalsContact O-CB 3.28Å; R862-Q866 WeakPolarHBondContact O-CB 3.37Å; R862-Q866 PolarHBondContact O-N 3.22Å
863	D	82.9	Confident	82.3	Confident	74 Å²	74	97.6 Å²	97.6	40%	0.396	48%	0.476	S	S	.	.	H	α-helix	trans	-68.6	-37.4	179.4	-65	-32.5	0	0	0	111.5	Q859 I861 A867	Q859-D863 WeakPolarHBondContact CG-OD2 3.23Å; Q859-D863 PolarHBondContact NE2-OD1 3.31Å; Q859-D863 PolarHBondContact NE2-OD2 3.09Å; Q859-D863 VanDerWaalsContact O-CG 3.31Å; Q859-D863 PolarHBondContact O-N 3.29Å; I861-D863 VanDerWaalsContact C-N 3.32Å; I861-D863 PolarHBondContact O-N 3.39Å; D863-A867 WeakPolarHBondContact O-CB 3.18Å; D863-A867 PolarHBondContact O-N 2.97Å
864	N	82.1	Confident	82.2	Confident	98 Å²	98	96.9 Å²	96.9	52%	0.524	47%	0.474	S	S	.	.	H	α-helix	trans	-67.8	-45.2	171.3	-81.4	-71.7	0	0	0	112.1	L860 I861 Q866 A867 I868	L860-N864 WeakPolarHBondContact O-CB 3.49Å; L860-N864 PolarHBondContact O-N 2.98Å; L860-N864 PolarHBondContact O-ND2 3.49Å; I861-N864 PolarHBondContact O-N 3.1Å; N864-Q866 VanDerWaalsContact C-N 3.26Å; N864-Q866 PolarHBondContact O-N 3.49Å; N864-A867 PolarHBondContact O-N 3.49Å; N864-I868 WeakPolarHBondContact O-CB 3.23Å; N864-I868 VanDerWaalsContact O-CG1 3.26Å; N864-I868 WeakPolarHBondContact O-CG1 3.27Å; N864-I868 PolarHBondContact O-N 2.74Å
865	D	84.6	Confident	81.9	Confident	96 Å²	96	99.2 Å²	99.2	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-59.3	-39.5	176.3	-72.3	-29	0	0	0	111.3	I861 R862 K869	I861-D865 PolarHBondContact O-N 3Å; R862-D865 PolarHBondContact O-N 3.37Å; D865-K869 WeakPolarHBondContact O-CB 3.42Å; D865-K869 PolarHBondContact O-N 3.12Å
866	Q	83.3	Confident	81.7	Confident	129 Å²	129	100.6 Å²	100.6	60%	0.603	49%	0.493	S	S	*	.	H	α-helix	trans	-70.5	-37.8	177	-172.3	162.6	-17	0	0	112.2	R862 N864 K869 I870	R862-Q866 VanDerWaalsContact O-CB 3.28Å; R862-Q866 WeakPolarHBondContact O-CB 3.37Å; R862-Q866 PolarHBondContact O-N 3.22Å; N864-Q866 VanDerWaalsContact C-N 3.26Å; N864-Q866 PolarHBondContact O-N 3.49Å; Q866-K869 PolarHBondContact O-N 3.35Å; Q866-I870 HydrophobicContact CG-CD1 4.43Å; Q866-I870 VanDerWaalsContact O-CG1 3.31Å; Q866-I870 WeakPolarHBondContact O-CG1 3.4Å; Q866-I870 PolarHBondContact O-N 3.12Å
867	A	80.9	Confident	81.5	Confident	45 Å²	45	99.9 Å²	99.9	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-65.8	-43.2	172	0	0	0	0	0	112.3	D863 N864 K869 I870 L871	D863-A867 WeakPolarHBondContact O-CB 3.18Å; D863-A867 PolarHBondContact O-N 2.97Å; N864-A867 PolarHBondContact O-N 3.49Å; A867-K869 VanDerWaalsContact C-N 3.3Å; A867-K869 PolarHBondContact O-N 2.8Å; A867-I870 PolarHBondContact O-N 2.91Å; A867-L871 WeakPolarHBondContact O-CG 3.44Å; A867-L871 PolarHBondContact O-N 3.36Å
868	I	81.6	Confident	81.2	Confident	84 Å²	84	103.1 Å²	103.1	43%	0.431	50%	0.502	S	S	.	.	H	α-helix	trans	-58.7	-43.9	173.6	-71.5	164.3	0	0	0	110.2	N864 L871 Q872	N864-I868 WeakPolarHBondContact O-CB 3.23Å; N864-I868 VanDerWaalsContact O-CG1 3.26Å; N864-I868 WeakPolarHBondContact O-CG1 3.27Å; N864-I868 PolarHBondContact O-N 2.74Å; I868-L871 PolarHBondContact O-N 2.86Å; I868-Q872 HydrophobicContact CG2-CG 4.5Å; I868-Q872 WeakPolarHBondContact O-CG 3.47Å; I868-Q872 PolarHBondContact O-N 3.28Å
869	K	85.3	Confident	80.8	Confident	122 Å²	122	101.4 Å²	101.4	53%	0.53	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-42.4	177.6	-173.6	174	178.9	-179.3	0	112.6	D865 Q866 A867 L871 Q872 D873	D865-K869 WeakPolarHBondContact O-CB 3.42Å; D865-K869 PolarHBondContact O-N 3.12Å; Q866-K869 PolarHBondContact O-N 3.35Å; A867-K869 VanDerWaalsContact C-N 3.3Å; A867-K869 PolarHBondContact O-N 2.8Å; K869-L871 VanDerWaalsContact C-N 3.31Å; K869-L871 PolarHBondContact O-N 2.91Å; K869-Q872 WeakPolarHBondContact O-CB 3.44Å; K869-Q872 PolarHBondContact O-N 2.97Å; K869-Q872 VanDerWaalsContact O-N 3.16Å; K869-D873 WeakPolarHBondContact O-CB 3.5Å; K869-D873 PolarHBondContact O-N 3.45Å
870	I	84.9	Confident	80.5	Confident	89 Å²	89	100.9 Å²	100.9	46%	0.456	50%	0.5	S	S	.	.	H	α-helix	trans	-59.4	-44.1	174.8	-70.1	162.8	0	0	0	110.5	Q866 A867 Q872 D873 E874	Q866-I870 HydrophobicContact CG-CD1 4.43Å; Q866-I870 VanDerWaalsContact O-CG1 3.31Å; Q866-I870 WeakPolarHBondContact O-CG1 3.4Å; Q866-I870 PolarHBondContact O-N 3.12Å; A867-I870 PolarHBondContact O-N 2.91Å; I870-Q872 VanDerWaalsContact C-N 3.33Å; I870-Q872 PolarHBondContact O-N 3.07Å; I870-D873 PolarHBondContact O-N 2.99Å; I870-E874 WeakPolarHBondContact O-CB 3.4Å; I870-E874 WeakPolarHBondContact O-CG 3.22Å; I870-E874 PolarHBondContact O-N 2.75Å
871	L	78.2	Confident	80.1	Confident	111 Å²	111	101 Å²	101	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-64.7	-34.3	176.4	-68.5	168.7	0	0	0	112.8	A867 I868 K869 L875	A867-L871 WeakPolarHBondContact O-CG 3.44Å; A867-L871 PolarHBondContact O-N 3.36Å; I868-L871 PolarHBondContact O-N 2.86Å; K869-L871 VanDerWaalsContact C-N 3.31Å; K869-L871 PolarHBondContact O-N 2.91Å; L871-L875 VanDerWaalsContact O-CB 3.3Å; L871-L875 WeakPolarHBondContact O-CB 3.45Å; L871-L875 PolarHBondContact O-N 2.89Å
872	Q	74.6	Confident	79.9	Confident	121 Å²	121	100.9 Å²	100.9	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-67.9	-47.5	172.6	-73.4	171.5	-7	0	0	111.7	I868 K869 I870 E874 L875 E876	I868-Q872 HydrophobicContact CG2-CG 4.5Å; I868-Q872 WeakPolarHBondContact O-CG 3.47Å; I868-Q872 PolarHBondContact O-N 3.28Å; K869-Q872 WeakPolarHBondContact O-CB 3.44Å; K869-Q872 PolarHBondContact O-N 2.97Å; K869-Q872 VanDerWaalsContact O-N 3.16Å; I870-Q872 VanDerWaalsContact C-N 3.33Å; I870-Q872 PolarHBondContact O-N 3.07Å; Q872-E874 VanDerWaalsContact C-N 3.31Å; Q872-E874 PolarHBondContact O-N 3.32Å; Q872-L875 PolarHBondContact O-N 2.95Å; Q872-E876 WeakPolarHBondContact O-CB 3.31Å; Q872-E876 PolarHBondContact O-N 2.91Å
873	D	79.9	Confident	79.5	Confident	82 Å²	82	98.5 Å²	98.5	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-34.7	178	-72.3	-29.4	0	0	0	111.3	K869 I870 N877	K869-D873 WeakPolarHBondContact O-CB 3.5Å; K869-D873 PolarHBondContact O-N 3.45Å; I870-D873 PolarHBondContact O-N 2.99Å; D873-N877 WeakPolarHBondContact O-CB 3.49Å; D873-N877 PolarHBondContact O-N 3.04Å; D873-N877 PolarHBondContact O-ND2 2.97Å
874	E	80.4	Confident	79.2	Confident	117 Å²	117	98 Å²	98	55%	0.547	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-44.8	170.6	-77.4	-166.6	165.4	0	0	112.4	I870 Q872 N877 R878	I870-E874 WeakPolarHBondContact O-CB 3.4Å; I870-E874 WeakPolarHBondContact O-CG 3.22Å; I870-E874 PolarHBondContact O-N 2.75Å; Q872-E874 VanDerWaalsContact C-N 3.31Å; Q872-E874 PolarHBondContact O-N 3.32Å; E874-N877 WeakPolarHBondContact O-CB 3.43Å; E874-N877 PolarHBondContact O-N 2.99Å; E874-R878 WeakPolarHBondContact O-CG 3.34Å; E874-R878 PolarHBondContact O-N 2.87Å
875	L	77.8	Confident	78.9	Confident	129 Å²	129	96.1 Å²	96.1	68%	0.675	49%	0.492	S	S	*	.	H	α-helix	trans	-66.7	-39.6	-179.9	-167.7	152.4	0	0	0	111.6	L871 Q872 R878 S879	L871-L875 VanDerWaalsContact O-CB 3.3Å; L871-L875 WeakPolarHBondContact O-CB 3.45Å; L871-L875 PolarHBondContact O-N 2.89Å; Q872-L875 PolarHBondContact O-N 2.95Å; L875-R878 PolarHBondContact O-N 3.31Å; L875-S879 WeakPolarHBondContact O-CB 3.39Å; L875-S879 PolarHBondContact O-N 3.26Å
876	E	79.8	Confident	78.3	Confident	99 Å²	99	96.6 Å²	96.6	46%	0.463	49%	0.491	S	S	.	.	H	α-helix	trans	-62.1	-43.4	170.4	-173.1	60	-120.1	0	0	110.5	Q872 R878 S879 N880 R883	Q872-E876 WeakPolarHBondContact O-CB 3.31Å; Q872-E876 PolarHBondContact O-N 2.91Å; E876-R878 PolarHBondContact O-N 2.91Å; E876-S879 WeakPolarHBondContact O-CB 3.42Å; E876-S879 PolarHBondContact O-N 2.93Å; E876-N880 WeakPolarHBondContact O-CB 3.26Å; E876-N880 PolarHBondContact O-N 3.22Å; E876-N880 PolarHBondContact O-ND2 3.3Å; E876-N880 PolarHBondContact OE1-ND2 3.02Å; E876-R883 IonicContact OE1-NH2 3.44Å; E876-R883 PolarHBondContact OE1-NH2 3.11Å
877	N	80.3	Confident	77.9	Confident	95 Å²	95	97.2 Å²	97.2	51%	0.508	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-40.6	173.8	-87.9	-67	0	0	0	113	D873 E874 N880 Q881	D873-N877 WeakPolarHBondContact O-CB 3.49Å; D873-N877 PolarHBondContact O-N 3.04Å; D873-N877 PolarHBondContact O-ND2 2.97Å; E874-N877 WeakPolarHBondContact O-CB 3.43Å; E874-N877 PolarHBondContact O-N 2.99Å; N877-N880 PolarHBondContact O-N 3.2Å; N877-Q881 WeakPolarHBondContact O-CB 3.42Å; N877-Q881 VanDerWaalsContact O-CG 3.31Å; N877-Q881 WeakPolarHBondContact O-CG 3.48Å; N877-Q881 PolarHBondContact O-N 2.85Å
878	R	76.3	Confident	77.7	Confident	170 Å²	170	101.9 Å²	101.9	64%	0.642	50%	0.504	S	S	*	.	H	α-helix	trans	-63.2	-43.7	173.8	-66.9	-63.4	-174.4	175.9	4.1	111.5	E874 L875 E876 N880 Q881 V882	E874-R878 WeakPolarHBondContact O-CG 3.34Å; E874-R878 PolarHBondContact O-N 2.87Å; L875-R878 PolarHBondContact O-N 3.31Å; E876-R878 PolarHBondContact O-N 2.91Å; R878-N880 PolarHBondContact O-N 3.29Å; R878-Q881 PolarHBondContact O-N 3.33Å; R878-V882 WeakPolarHBondContact O-CG2 3.47Å; R878-V882 PolarHBondContact O-N 3Å
879	S	73.3	Confident	77.5	Confident	52 Å²	52	103.6 Å²	103.6	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-57	-47.3	173.3	174.9	0	0	0	0	111.7	L875 E876 Q881 V882 R883	L875-S879 WeakPolarHBondContact O-CB 3.39Å; L875-S879 PolarHBondContact O-N 3.26Å; E876-S879 WeakPolarHBondContact O-CB 3.42Å; E876-S879 PolarHBondContact O-N 2.93Å; S879-Q881 PolarHBondContact O-N 3.2Å; S879-V882 PolarHBondContact O-N 3.18Å; S879-R883 VanDerWaalsContact O-CB 3.29Å; S879-R883 WeakPolarHBondContact O-CB 3.47Å; S879-R883 PolarHBondContact O-N 3Å; S879-R883 PolarHBondContact OG-NH2 3.4Å
880	N	77.7	Confident	76.6	Confident	63 Å²	63	103.9 Å²	103.9	34%	0.337	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-35.5	177.1	-74.6	-68.4	0	0	0	112.8	E876 N877 R878 R883 C884	E876-N880 WeakPolarHBondContact O-CB 3.26Å; E876-N880 PolarHBondContact O-N 3.22Å; E876-N880 PolarHBondContact O-ND2 3.3Å; E876-N880 PolarHBondContact OE1-ND2 3.02Å; N877-N880 PolarHBondContact O-N 3.2Å; R878-N880 PolarHBondContact O-N 3.29Å; N880-R883 VanDerWaalsContact OD1-CZ 3.23Å; N880-R883 PolarHBondContact OD1-NH1 2.93Å; N880-R883 PolarHBondContact OD1-NH2 2.63Å; N880-C884 VanDerWaalsContact O-CB 3.24Å; N880-C884 WeakPolarHBondContact O-CB 3.47Å; N880-C884 PolarHBondContact O-N 2.99Å
881	Q	74.9	Confident	76.2	Confident	111 Å²	111	105.4 Å²	105.4	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-64.1	-47.7	174.2	-76.3	173	9.4	0	0	112.1	N877 R878 S879 C884 A885	N877-Q881 WeakPolarHBondContact O-CB 3.42Å; N877-Q881 VanDerWaalsContact O-CG 3.31Å; N877-Q881 WeakPolarHBondContact O-CG 3.48Å; N877-Q881 PolarHBondContact O-N 2.85Å; R878-Q881 PolarHBondContact O-N 3.33Å; S879-Q881 PolarHBondContact O-N 3.2Å; Q881-C884 PolarHBondContact O-N 3.43Å; Q881-A885 PolarHBondContact O-N 3.07Å
882	V	75.2	Confident	76	Confident	82 Å²	82	107.1 Å²	107.1	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-59.4	-51.3	176.1	172.4	0	0	0	0	110.4	R878 S879 C884 A885 E886	R878-V882 WeakPolarHBondContact O-CG2 3.47Å; R878-V882 PolarHBondContact O-N 3Å; S879-V882 PolarHBondContact O-N 3.18Å; V882-C884 PolarHBondContact O-N 3.46Å; V882-C884 VanDerWaalsContact O-N 3.14Å; V882-A885 WeakPolarHBondContact O-CA 3.24Å; V882-A885 WeakPolarHBondContact O-CB 3.38Å; V882-A885 PolarHBondContact O-N 3.11Å; V882-E886 HydrophobicContact CG1-CG 4.31Å; V882-E886 WeakPolarHBondContact O-CG 3.42Å; V882-E886 PolarHBondContact O-N 3.35Å
883	R	76	Confident	75.8	Confident	100 Å²	100	106.5 Å²	106.5	38%	0.377	52%	0.521	S	S	.	.	H	α-helix	trans	-58.3	-28.9	178.5	-155.8	-171.2	-46.9	145.2	10.8	113.7	E876 S879 N880 E886 K887	E876-R883 IonicContact OE1-NH2 3.44Å; E876-R883 PolarHBondContact OE1-NH2 3.11Å; S879-R883 VanDerWaalsContact O-CB 3.29Å; S879-R883 WeakPolarHBondContact O-CB 3.47Å; S879-R883 PolarHBondContact O-N 3Å; S879-R883 PolarHBondContact OG-NH2 3.4Å; N880-R883 VanDerWaalsContact OD1-CZ 3.23Å; N880-R883 PolarHBondContact OD1-NH1 2.93Å; N880-R883 PolarHBondContact OD1-NH2 2.63Å; R883-E886 WeakPolarHBondContact CA-OE2 3.43Å; R883-K887 WeakPolarHBondContact O-CG 3.4Å; R883-K887 PolarHBondContact O-N 3.08Å
884	C	77.2	Confident	75.4	Confident	63 Å²	63	107 Å²	107	43%	0.426	52%	0.523	S	S	.	.	H	α-helix	trans	-81.5	-32.7	175.6	-170	0	0	0	0	112.5	N880 Q881 V882 K888	N880-C884 VanDerWaalsContact O-CB 3.24Å; N880-C884 WeakPolarHBondContact O-CB 3.47Å; N880-C884 PolarHBondContact O-N 2.99Å; Q881-C884 PolarHBondContact O-N 3.43Å; V882-C884 PolarHBondContact O-N 3.46Å; V882-C884 VanDerWaalsContact O-N 3.14Å; C884-K888 WeakPolarHBondContact O-CG 3.42Å; C884-K888 PolarHBondContact O-N 2.72Å
885	A	74.4	Confident	75	Confident	59 Å²	59	105.4 Å²	105.4	49%	0.488	52%	0.516	S	S	.	.	H	α-helix	trans	-69.5	-44	172.2	0	0	0	0	0	111.8	Q881 V882 K887 K888 L889	Q881-A885 PolarHBondContact O-N 3.07Å; V882-A885 WeakPolarHBondContact O-CA 3.24Å; V882-A885 WeakPolarHBondContact O-CB 3.38Å; V882-A885 PolarHBondContact O-N 3.11Å; A885-K887 PolarHBondContact O-N 2.97Å; A885-K888 PolarHBondContact O-N 3.1Å; A885-K888 VanDerWaalsContact O-N 3.13Å; A885-L889 PolarHBondContact O-N 3.35Å
886	E	72.1	Confident	74.6	Confident	106 Å²	106	101.8 Å²	101.8	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-55.9	-48.7	175.9	-70.8	170.1	157.5	0	0	111.8	V882 R883 K888 L889 Q890	V882-E886 HydrophobicContact CG1-CG 4.31Å; V882-E886 WeakPolarHBondContact O-CG 3.42Å; V882-E886 PolarHBondContact O-N 3.35Å; R883-E886 WeakPolarHBondContact CA-OE2 3.43Å; E886-K888 VanDerWaalsContact C-N 3.3Å; E886-K888 PolarHBondContact O-N 2.91Å; E886-L889 WeakPolarHBondContact O-CB 3.42Å; E886-L889 PolarHBondContact O-N 3.37Å; E886-L889 VanDerWaalsContact O-N 3.16Å; E886-Q890 WeakPolarHBondContact O-CG 3.32Å; E886-Q890 PolarHBondContact O-N 2.7Å
887	K	75.4	Confident	74	Confident	142 Å²	142	102.1 Å²	102.1	62%	0.617	50%	0.503	S	S	*	.	H	α-helix	trans	-61.5	-35.4	176.6	-74.8	-177.8	176.6	-170.3	0	113.3	R883 A885 H891	R883-K887 WeakPolarHBondContact O-CG 3.4Å; R883-K887 PolarHBondContact O-N 3.08Å; A885-K887 PolarHBondContact O-N 2.97Å; K887-H891 WeakPolarHBondContact O-CB 3.42Å; K887-H891 PolarHBondContact O-N 3.45Å; K887-H891 VanDerWaalsContact O-N 3.07Å
888	K	77.3	Confident	73.5	Confident	142 Å²	142	103.4 Å²	103.4	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-71.7	-34.7	175.6	-73.2	172.3	-178.4	178.3	0	112.2	C884 A885 E886 K892	C884-K888 WeakPolarHBondContact O-CG 3.42Å; C884-K888 PolarHBondContact O-N 2.72Å; A885-K888 PolarHBondContact O-N 3.1Å; A885-K888 VanDerWaalsContact O-N 3.13Å; E886-K888 VanDerWaalsContact C-N 3.3Å; E886-K888 PolarHBondContact O-N 2.91Å; K888-K892 PolarHBondContact O-N 3.37Å
889	L	75.6	Confident	73.1	Confident	121 Å²	121	101.4 Å²	101.4	63%	0.634	50%	0.504	S	S	*	.	H	α-helix	trans	-65.4	-52.2	174.3	-174.1	66.8	0	0	0	110.5	A885 E886 H891 K892 E893	A885-L889 PolarHBondContact O-N 3.35Å; E886-L889 WeakPolarHBondContact O-CB 3.42Å; E886-L889 PolarHBondContact O-N 3.37Å; E886-L889 VanDerWaalsContact O-N 3.16Å; L889-H891 VanDerWaalsContact C-N 3.28Å; L889-H891 PolarHBondContact O-N 2.89Å; L889-K892 PolarHBondContact O-N 3.06Å; L889-K892 VanDerWaalsContact O-N 3.16Å; L889-E893 WeakPolarHBondContact O-CB 3.5Å; L889-E893 PolarHBondContact O-N 3.45Å
890	Q	67.6	Low	72.8	Confident	128 Å²	128	104 Å²	104	60%	0.598	51%	0.512	S	S	*	.	H	α-helix	trans	-57.1	-39.5	177.1	-72.7	179.9	-23.4	0	0	112.6	E886 E893 L894	E886-Q890 WeakPolarHBondContact O-CG 3.32Å; E886-Q890 PolarHBondContact O-N 2.7Å; Q890-E893 PolarHBondContact O-N 3.39Å; Q890-L894 PolarHBondContact O-N 2.73Å
891	H	75.4	Confident	72.2	Confident	120 Å²	120	104.7 Å²	104.7	56%	0.556	52%	0.519	S	S	*	.	H	α-helix	trans	-64.5	-44.3	177.7	-170.2	23.7	0	0	0	112.2	K887 L889 E893 L894 E895	K887-H891 WeakPolarHBondContact O-CB 3.42Å; K887-H891 PolarHBondContact O-N 3.45Å; K887-H891 VanDerWaalsContact O-N 3.07Å; L889-H891 VanDerWaalsContact C-N 3.28Å; L889-H891 PolarHBondContact O-N 2.89Å; H891-E893 VanDerWaalsContact C-N 3.34Å; H891-L894 WeakPolarHBondContact O-CB 3.49Å; H891-L894 PolarHBondContact O-N 2.92Å; H891-E895 WeakPolarHBondContact O-CG 3.49Å; H891-E895 PolarHBondContact O-N 2.92Å
892	K	75.9	Confident	71.9	Confident	148 Å²	148	107 Å²	107	64%	0.643	52%	0.524	S	S	*	.	H	α-helix	trans	-66.7	-34.4	175.3	-76.1	-151.8	165.1	-154.1	0	113.6	K888 L889 L894 E895 S896	K888-K892 PolarHBondContact O-N 3.37Å; L889-K892 PolarHBondContact O-N 3.06Å; L889-K892 VanDerWaalsContact O-N 3.16Å; K892-L894 VanDerWaalsContact C-N 3.32Å; K892-E895 PolarHBondContact O-N 3.45Å; K892-S896 WeakPolarHBondContact O-CB 3.42Å; K892-S896 PolarHBondContact O-N 2.93Å
893	E	69.6	Low	71.7	Confident	108 Å²	108	108.1 Å²	108.1	51%	0.505	53%	0.526	S	S	.	.	H	α-helix	trans	-63.7	-42.1	175.1	-163.4	160.4	-139.6	0	0	110.1	L889 Q890 H891 S896 Q897	L889-E893 WeakPolarHBondContact O-CB 3.5Å; L889-E893 PolarHBondContact O-N 3.45Å; Q890-E893 PolarHBondContact O-N 3.39Å; H891-E893 VanDerWaalsContact C-N 3.34Å; E893-S896 PolarHBondContact O-N 3.31Å; E893-S896 PolarHBondContact O-OG 3.06Å; E893-Q897 WeakPolarHBondContact O-CG 3.5Å; E893-Q897 PolarHBondContact O-N 2.96Å; E893-Q897 VanDerWaalsContact O-N 3.16Å
894	L	71.3	Confident	71.1	Confident	93 Å²	93	112.6 Å²	112.6	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-61.7	-51	172.1	-148.9	81.3	0	0	0	112.6	Q890 H891 K892 S896 Q897 E898	Q890-L894 PolarHBondContact O-N 2.73Å; H891-L894 WeakPolarHBondContact O-CB 3.49Å; H891-L894 PolarHBondContact O-N 2.92Å; K892-L894 VanDerWaalsContact C-N 3.32Å; L894-S896 PolarHBondContact O-N 3.3Å; L894-Q897 PolarHBondContact O-N 3.34Å; L894-E898 PolarHBondContact O-N 3.15Å
895	E	72.8	Confident	70.3	Confident	82 Å²	82	115.7 Å²	115.7	38%	0.383	55%	0.551	S	S	.	*	H	α-helix	trans	-53.4	-39.9	176.4	-71.7	-179.6	129.3	0	0	111.7	H891 K892 Q899	H891-E895 WeakPolarHBondContact O-CG 3.49Å; H891-E895 PolarHBondContact O-N 2.92Å; K892-E895 PolarHBondContact O-N 3.45Å; E895-Q899 WeakPolarHBondContact O-CG 3.26Å; E895-Q899 PolarHBondContact O-N 3.03Å; E895-Q899 VanDerWaalsContact O-N 3.14Å
896	S	69	Low	69.8	Low	53 Å²	53	116.9 Å²	116.9	37%	0.371	55%	0.547	S	S	.	.	H	α-helix	trans	-69.2	-35.5	179.2	78.6	0	0	0	0	113.1	K892 E893 L894 I900	K892-S896 WeakPolarHBondContact O-CB 3.42Å; K892-S896 PolarHBondContact O-N 2.93Å; E893-S896 PolarHBondContact O-N 3.31Å; E893-S896 PolarHBondContact O-OG 3.06Å; L894-S896 PolarHBondContact O-N 3.3Å; S896-I900 WeakPolarHBondContact O-CD1 3.37Å; S896-I900 VanDerWaalsContact O-CG1 3.3Å; S896-I900 WeakPolarHBondContact O-CG1 3.39Å; S896-I900 PolarHBondContact O-N 3.42Å; S896-I900 VanDerWaalsContact O-N 3.13Å
897	Q	67	Low	68.9	Low	107 Å²	107	119 Å²	119	50%	0.5	55%	0.552	S	S	.	*	H	α-helix	trans	-72.7	-35.7	177.7	-69.9	174.4	11.2	0	0	111.7	E893 L894 I900 T901	E893-Q897 WeakPolarHBondContact O-CG 3.5Å; E893-Q897 PolarHBondContact O-N 2.96Å; E893-Q897 VanDerWaalsContact O-N 3.16Å; L894-Q897 PolarHBondContact O-N 3.34Å; Q897-I900 PolarHBondContact O-N 3.01Å; Q897-T901 PolarHBondContact O-N 3.23Å; Q897-T901 VanDerWaalsContact O-N 3.09Å; Q897-T901 PolarHBondContact O-OG1 3.04Å
898	E	70.6	Confident	68.2	Low	121 Å²	121	118.8 Å²	118.8	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-64.4	-43.6	173.1	-69.5	-179.6	165.5	0	0	111.5	L894 I900 T901 Y902	L894-E898 PolarHBondContact O-N 3.15Å; E898-I900 PolarHBondContact O-N 3.37Å; E898-T901 WeakPolarHBondContact O-CB 3.39Å; E898-T901 PolarHBondContact O-N 3.42Å; E898-T901 VanDerWaalsContact O-N 3.14Å; E898-Y902 PolarHBondContact O-N 2.95Å
899	Q	67.9	Low	67.2	Low	128 Å²	128	117 Å²	117	60%	0.598	55%	0.554	S	S	*	*	H	α-helix	trans	-61	-43.4	175	-72	175.8	19.9	0	0	112.8	E895 T901 Y902 I903	E895-Q899 WeakPolarHBondContact O-CG 3.26Å; E895-Q899 PolarHBondContact O-N 3.03Å; E895-Q899 VanDerWaalsContact O-N 3.14Å; Q899-T901 PolarHBondContact O-N 2.99Å; Q899-Y902 PolarHBondContact O-N 2.8Å; Q899-I903 WeakPolarHBondContact O-CG1 3.48Å; Q899-I903 PolarHBondContact O-N 3.04Å
900	I	65.7	Low	66.1	Low	106 Å²	106	117.3 Å²	117.3	54%	0.544	55%	0.55	S	S	.	*	H	α-helix	trans	-60.9	-34.9	175.4	-71.5	165.7	0	0	0	111.4	S896 Q897 E898 R904	S896-I900 WeakPolarHBondContact O-CD1 3.37Å; S896-I900 VanDerWaalsContact O-CG1 3.3Å; S896-I900 WeakPolarHBondContact O-CG1 3.39Å; S896-I900 PolarHBondContact O-N 3.42Å; S896-I900 VanDerWaalsContact O-N 3.13Å; Q897-I900 PolarHBondContact O-N 3.01Å; E898-I900 PolarHBondContact O-N 3.37Å; I900-R904 WeakPolarHBondContact O-CG 3.41Å
901	T	65.1	Low	64.7	Low	79 Å²	79	118.6 Å²	118.6	49%	0.485	56%	0.56	S	S	.	*	H	α-helix	trans	-74.7	-43.6	-179.8	-55.7	0	0	0	0	111.8	Q897 E898 Q899 R904	Q897-T901 PolarHBondContact O-N 3.23Å; Q897-T901 VanDerWaalsContact O-N 3.09Å; Q897-T901 PolarHBondContact O-OG1 3.04Å; E898-T901 WeakPolarHBondContact O-CB 3.39Å; E898-T901 PolarHBondContact O-N 3.42Å; E898-T901 VanDerWaalsContact O-N 3.14Å; Q899-T901 PolarHBondContact O-N 2.99Å; T901-R904 PolarHBondContact O-N 2.94Å
902	Y	69.5	Low	63.7	Low	160 Å²	160	120.5 Å²	120.5	63%	0.627	57%	0.567	S	S	*	*	H	α-helix	trans	-61.7	-47.5	179.1	-172.6	-92.1	0	0	0	112.3	E898 Q899 R904 Q905 E906	E898-Y902 PolarHBondContact O-N 2.95Å; Q899-Y902 PolarHBondContact O-N 2.8Å; Y902-R904 VanDerWaalsContact C-N 3.27Å; Y902-R904 PolarHBondContact O-N 2.84Å; Y902-Q905 PolarHBondContact O-N 2.87Å; Y902-Q905 VanDerWaalsContact O-N 3.16Å; Y902-E906 PolarHBondContact O-N 3.04Å
903	I	70.6	Confident	62.6	Low	105 Å²	105	116.5 Å²	116.5	54%	0.538	57%	0.568	S	S	.	*	H	α-helix	trans	-64.6	-30.2	-177.8	-66.1	170.2	0	0	0	112	Q899	Q899-I903 WeakPolarHBondContact O-CG1 3.48Å; Q899-I903 PolarHBondContact O-N 3.04Å
904	R	62.8	Low	61.3	Low	193 Å²	193	119.7 Å²	119.7	73%	0.728	59%	0.587	S	S	*	*	H	α-helix	trans	-64.5	-40.9	174.6	-82	-179.9	167.9	-124.7	0.4	112.7	I900 T901 Y902 E908	I900-R904 WeakPolarHBondContact O-CG 3.41Å; T901-R904 PolarHBondContact O-N 2.94Å; Y902-R904 VanDerWaalsContact C-N 3.27Å; Y902-R904 PolarHBondContact O-N 2.84Å; R904-E908 PolarHBondContact O-N 3.39Å
905	Q	60.1	Low	59.5	Low	128 Å²	128	119.5 Å²	119.5	60%	0.598	59%	0.585	S	S	*	*	H	α-helix	trans	-70.9	-35.4	-175.1	-68	-176	-12.1	0	0	113.2	Y902 Y907 T909	Y902-Q905 PolarHBondContact O-N 2.87Å; Y902-Q905 VanDerWaalsContact O-N 3.16Å; Q905-Y907 PolarHBondContact O-N 3.36Å; Q905-T909 PolarHBondContact O-N 2.92Å; Q905-T909 PolarHBondContact O-OG1 3.1Å
906	E	63.9	Low	58.3	Low	85 Å²	85	119.8 Å²	119.8	40%	0.397	59%	0.594	S	S	.	*	H	α-helix	trans	-66.2	-32.2	-178.4	-103.2	-126.5	96.2	0	0	114.7	Y902 T909 K910	Y902-E906 PolarHBondContact O-N 3.04Å; E906-T909 PolarHBondContact O-OG1 2.96Å; E906-T909 VanDerWaalsContact O-OG1 3.06Å; E906-K910 IonicContact OE1-NZ 3.11Å; E906-K910 PolarHBondContact OE1-NZ 3.22Å; E906-K910 VanDerWaalsContact OE1-NZ 3.11Å
907	Y	53.6	Low	57.5	Low	151 Å²	151	121.4 Å²	121.4	59%	0.592	61%	0.611	S	S	*	*	H	α-helix	trans	-94.5	-28.4	-177.2	-76.3	-80.3	0	0	0	113.3	Q905 T909 K910	Q905-Y907 PolarHBondContact O-N 3.36Å; Y907-T909 VanDerWaalsContact C-N 3.28Å; Y907-T909 PolarHBondContact O-N 2.62Å; Y907-K910 PolarHBondContact O-N 3.28Å
908	E	60.5	Low	56.8	Low	136 Å²	136	120.5 Å²	120.5	64%	0.636	62%	0.616	S	S	*	*	H	α-helix	trans	-65.8	-32.4	173	-170.2	166.7	-151.1	0	0	112	R904	R904-E908 PolarHBondContact O-N 3.39Å
909	T	56.7	Low	56.2	Low	105 Å²	105	118.6 Å²	118.6	64%	0.644	61%	0.609	S	S	*	*	H	α-helix	trans	-69.2	-33.9	173.4	40.3	0	0	0	0	113.5	Q905 E906 Y907 L911	Q905-T909 PolarHBondContact O-N 2.92Å; Q905-T909 PolarHBondContact O-OG1 3.1Å; E906-T909 PolarHBondContact O-OG1 2.96Å; E906-T909 VanDerWaalsContact O-OG1 3.06Å; Y907-T909 VanDerWaalsContact C-N 3.28Å; Y907-T909 PolarHBondContact O-N 2.62Å; T909-L911 VanDerWaalsContact C-N 3.28Å; T909-L911 PolarHBondContact O-N 2.72Å
910	K	52.5	Low	55.6	Low	128 Å²	128	117.7 Å²	117.7	56%	0.557	60%	0.6	S	S	*	*	H	α-helix	trans	-71	-17.8	178	-73.7	-175.8	179.1	94.8	0	113.8	E906 Y907 K912	E906-K910 IonicContact OE1-NZ 3.11Å; E906-K910 PolarHBondContact OE1-NZ 3.22Å; E906-K910 VanDerWaalsContact OE1-NZ 3.11Å; Y907-K910 PolarHBondContact O-N 3.28Å; K910-K912 VanDerWaalsContact C-N 3.34Å; K910-K912 PolarHBondContact O-N 2.93Å
911	L	38.8	Very low	55	Low	155 Å²	155	117.5 Å²	117.5	81%	0.812	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-9.5	-173.1	-143.4	80.4	0	0	0	115.6	T909	T909-L911 VanDerWaalsContact C-N 3.28Å; T909-L911 PolarHBondContact O-N 2.72Å
912	K	53.5	Low	54.5	Low	160 Å²	160	119.8 Å²	119.8	70%	0.696	60%	0.602	S	S	*	*	S	Bend	trans	-102.6	-20.2	-167.7	-75.4	177.6	177.3	168.5	0	116.6	K910 R920	K910-K912 VanDerWaalsContact C-N 3.34Å; K910-K912 PolarHBondContact O-N 2.93Å; K912-R920 PolarHBondContact O-NH2 3.39Å
913	G	52.3	Low	54.1	Low	64 Å²	64	115.8 Å²	115.8	66%	0.66	59%	0.592	S	S	*	*	S	Bend	trans	-91.2	-27.7	-155.9	0	0	0	0	0	119.9
914	L	43.9	Very low	53.6	Low	174 Å²	174	115.9 Å²	115.9	91%	0.911	59%	0.59	S	S	*	*	S	Bend	trans	-132.5	47.2	-156.1	-67.9	174.1	0	0	0	116.2
915	M	32.7	Very low	53.3	Low	90 Å²	90	110.8 Å²	110.8	44%	0.443	58%	0.577	S	S	.	*			trans	-135.4	126.8	162.6	-83.3	-154.2	-66.4	0	0	112.5	L919 R920 L923	M915-L919 HydrophobicContact SD-CD2 4.16Å; M915-R920 HydrophobicContact CB-CG 4.46Å; M915-R920 PolarHBondContact O-NE 3.46Å; M915-L923 HydrophobicContact CE-CD1 3.74Å; M915-L923 HydrophobicContact SD-CD1 3.81Å
916	P	48.7	Very low	53.4	Low	87 Å²	87	108.3 Å²	108.3	57%	0.565	57%	0.571	S	S	*	*			trans	-60.3	154.3	176.3	-24.6	34.9	0	0	0	114.4	S918 L919 R920	P916-S918 PolarHBondContact O-N 3.41Å; P916-L919 PolarHBondContact O-N 3.02Å; P916-R920 PolarHBondContact O-N 3.31Å
917	A	51.9	Low	53	Low	88 Å²	88	108.3 Å²	108.3	73%	0.727	57%	0.572	S	S	*	*	H	α-helix	trans	-62.5	-35.6	-172.4	0	0	0	0	0	114.5	R920 Q921	A917-R920 PolarHBondContact O-N 3.22Å; A917-Q921 PolarHBondContact O-N 2.86Å
918	S	52.2	Low	53.2	Low	88 Å²	88	104.6 Å²	104.6	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-66.4	-38.1	175.8	47.1	0	0	0	0	112.9	P916 R920 Q921 E922	P916-S918 PolarHBondContact O-N 3.41Å; S918-R920 VanDerWaalsContact C-N 3.33Å; S918-Q921 WeakPolarHBondContact O-CB 3.33Å; S918-Q921 PolarHBondContact O-N 2.6Å; S918-E922 PolarHBondContact O-N 3.07Å
919	L	57.2	Low	52.9	Low	80 Å²	80	101.6 Å²	101.6	42%	0.419	56%	0.563	S	S	.	*	H	α-helix	trans	-75.8	-23.8	-178.9	-154.8	73.4	0	0	0	112.4	M915 P916 L923	M915-L919 HydrophobicContact SD-CD2 4.16Å; P916-L919 PolarHBondContact O-N 3.02Å; L919-L923 WeakPolarHBondContact O-CB 3.2Å; L919-L923 WeakPolarHBondContact O-CG 3.36Å; L919-L923 PolarHBondContact O-N 3.01Å
920	R	55.7	Low	53.1	Low	109 Å²	109	102.1 Å²	102.1	41%	0.411	56%	0.561	S	S	.	*	H	α-helix	trans	-65.8	-44.6	166.7	-67.1	-172.2	-172.6	-131.5	3.5	110.9	K912 M915 P916 A917 S918 E922 L923 E924	K912-R920 PolarHBondContact O-NH2 3.39Å; M915-R920 HydrophobicContact CB-CG 4.46Å; M915-R920 PolarHBondContact O-NE 3.46Å; P916-R920 PolarHBondContact O-N 3.31Å; A917-R920 PolarHBondContact O-N 3.22Å; S918-R920 VanDerWaalsContact C-N 3.33Å; R920-E922 PolarHBondContact O-N 3.37Å; R920-L923 CarbonylContact O-C 3.59Å; R920-L923 PolarHBondContact O-N 3.23Å; R920-E924 WeakPolarHBondContact O-CB 3.47Å; R920-E924 WeakPolarHBondContact O-CG 3.42Å; R920-E924 PolarHBondContact O-N 2.94Å
921	Q	52.9	Low	53	Low	102 Å²	102	103.4 Å²	103.4	48%	0.477	57%	0.566	S	S	.	*	H	α-helix	trans	-60	-48.6	179	-166.2	64.9	59.5	0	0	112.1	A917 S918 L923 E924 D925	A917-Q921 PolarHBondContact O-N 2.86Å; S918-Q921 WeakPolarHBondContact O-CB 3.33Å; S918-Q921 PolarHBondContact O-N 2.6Å; Q921-L923 VanDerWaalsContact C-N 3.29Å; Q921-L923 PolarHBondContact O-N 3.05Å; Q921-E924 PolarHBondContact O-N 3.34Å; Q921-D925 PolarHBondContact NE2-OD1 3.33Å; Q921-D925 WeakPolarHBondContact O-CB 3.46Å; Q921-D925 PolarHBondContact O-N 3.3Å
922	E	53.8	Low	53.6	Low	128 Å²	128	100 Å²	100	60%	0.598	56%	0.556	S	S	*	*	H	α-helix	trans	-63.5	-33.3	178.2	-69.3	-179.2	174.4	0	0	113	S918 R920 T926	S918-E922 PolarHBondContact O-N 3.07Å; R920-E922 PolarHBondContact O-N 3.37Å; E922-T926 VanDerWaalsContact O-CB 3.29Å; E922-T926 WeakPolarHBondContact O-CB 3.28Å; E922-T926 PolarHBondContact O-N 2.93Å; E922-T926 PolarHBondContact O-OG1 3.49Å
923	L	62.8	Low	53.4	Low	76 Å²	76	99.3 Å²	99.3	40%	0.398	56%	0.555	S	S	.	*	H	α-helix	trans	-73	-38.9	172.7	-77	171.6	0	0	0	112.5	M915 L919 R920 Q921 T926 I927	M915-L923 HydrophobicContact CE-CD1 3.74Å; M915-L923 HydrophobicContact SD-CD1 3.81Å; L919-L923 WeakPolarHBondContact O-CB 3.2Å; L919-L923 WeakPolarHBondContact O-CG 3.36Å; L919-L923 PolarHBondContact O-N 3.01Å; R920-L923 CarbonylContact O-C 3.59Å; R920-L923 PolarHBondContact O-N 3.23Å; Q921-L923 VanDerWaalsContact C-N 3.29Å; Q921-L923 PolarHBondContact O-N 3.05Å; L923-T926 PolarHBondContact O-N 2.81Å; L923-I927 VanDerWaalsContact O-CB 3.26Å; L923-I927 WeakPolarHBondContact O-CB 3.42Å; L923-I927 WeakPolarHBondContact O-CD1 3.4Å; L923-I927 WeakPolarHBondContact O-CG1 3.46Å; L923-I927 PolarHBondContact O-N 3.47Å
924	E	59.5	Low	53.2	Low	107 Å²	107	100.3 Å²	100.3	50%	0.5	55%	0.548	S	S	.	.	H	α-helix	trans	-70.9	-33.2	177.7	-73.7	172.3	138.7	0	0	111.2	R920 Q921 S928	R920-E924 WeakPolarHBondContact O-CB 3.47Å; R920-E924 WeakPolarHBondContact O-CG 3.42Å; R920-E924 PolarHBondContact O-N 2.94Å; Q921-E924 PolarHBondContact O-N 3.34Å; E924-S928 WeakPolarHBondContact O-CB 3.41Å; E924-S928 PolarHBondContact O-N 3.43Å; E924-S928 PolarHBondContact O-OG 3.37Å
925	D	55.4	Low	53.3	Low	85 Å²	85	94.9 Å²	94.9	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-71	-39	171.2	-65.4	-13.1	0	0	0	111.2	Q921 S928 S929	Q921-D925 PolarHBondContact NE2-OD1 3.33Å; Q921-D925 WeakPolarHBondContact O-CB 3.46Å; Q921-D925 PolarHBondContact O-N 3.3Å; D925-S928 PolarHBondContact O-N 3.21Å; D925-S929 WeakPolarHBondContact O-CB 3.47Å; D925-S929 PolarHBondContact O-N 3.17Å
926	T	62.4	Low	53.7	Low	77 Å²	77	98.3 Å²	98.3	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-68.7	-40	174	-58.7	0	0	0	0	112	E922 L923 S928 S929 L930	E922-T926 VanDerWaalsContact O-CB 3.29Å; E922-T926 WeakPolarHBondContact O-CB 3.28Å; E922-T926 PolarHBondContact O-N 2.93Å; E922-T926 PolarHBondContact O-OG1 3.49Å; L923-T926 PolarHBondContact O-N 2.81Å; T926-S928 VanDerWaalsContact C-N 3.33Å; T926-S929 PolarHBondContact O-N 3.03Å; T926-L930 HydrophobicContact CG2-CD1 4.46Å; T926-L930 WeakPolarHBondContact O-CB 3.47Å; T926-L930 PolarHBondContact O-N 3.37Å
927	I	56.8	Low	53.4	Low	84 Å²	84	99.7 Å²	99.7	43%	0.431	54%	0.535	S	S	.	.	H	α-helix	trans	-66.6	-36.3	173.7	-72.2	163.8	0	0	0	110.5	L923 K931	L923-I927 VanDerWaalsContact O-CB 3.26Å; L923-I927 WeakPolarHBondContact O-CB 3.42Å; L923-I927 WeakPolarHBondContact O-CD1 3.4Å; L923-I927 WeakPolarHBondContact O-CG1 3.46Å; L923-I927 PolarHBondContact O-N 3.47Å; I927-K931 HydrophobicContact CG2-CD 4.19Å; I927-K931 WeakPolarHBondContact O-CB 3.42Å; I927-K931 WeakPolarHBondContact O-CG 3.41Å; I927-K931 PolarHBondContact O-N 3.38Å
928	S	56.5	Low	52.9	Low	74 Å²	74	102.6 Å²	102.6	52%	0.517	53%	0.533	S	S	.	.	H	α-helix	trans	-67.5	-41.5	173.6	-63.9	0	0	0	0	111.8	E924 D925 T926 K931 S932	E924-S928 WeakPolarHBondContact O-CB 3.41Å; E924-S928 PolarHBondContact O-N 3.43Å; E924-S928 PolarHBondContact O-OG 3.37Å; D925-S928 PolarHBondContact O-N 3.21Å; T926-S928 VanDerWaalsContact C-N 3.33Å; S928-K931 PolarHBondContact O-N 3.48Å; S928-S932 VanDerWaalsContact O-CB 3.24Å; S928-S932 WeakPolarHBondContact O-CB 3.41Å; S928-S932 PolarHBondContact O-N 2.8Å
929	S	54.8	Low	51.7	Low	73 Å²	73	103 Å²	103	51%	0.51	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-46.6	174.8	-170	0	0	0	0	111.8	D925 T926 K931 S932 Q933	D925-S929 WeakPolarHBondContact O-CB 3.47Å; D925-S929 PolarHBondContact O-N 3.17Å; T926-S929 PolarHBondContact O-N 3.03Å; S929-K931 PolarHBondContact O-N 3.33Å; S929-S932 PolarHBondContact O-N 2.94Å; S929-Q933 PolarHBondContact O-N 3.1Å
930	L	60.8	Low	51.2	Low	116 Å²	116	104.8 Å²	104.8	61%	0.607	53%	0.525	S	S	*	.	H	α-helix	trans	-62.3	-40.5	175	-83.8	168.2	0	0	0	112.7	T926 Q933 V934	T926-L930 HydrophobicContact CG2-CD1 4.46Å; T926-L930 WeakPolarHBondContact O-CB 3.47Å; T926-L930 PolarHBondContact O-N 3.37Å; L930-Q933 CarbonylContact O-C 3.51Å; L930-Q933 PolarHBondContact O-N 3.04Å; L930-V934 WeakPolarHBondContact O-CG2 3.45Å; L930-V934 PolarHBondContact O-N 3.33Å
931	K	50.1	Low	51	Low	154 Å²	154	101.2 Å²	101.2	67%	0.67	52%	0.519	S	S	*	.	H	α-helix	trans	-74	-30.8	176.7	-74	178.8	178.1	176.1	0	112.8	I927 S928 S929 Q933 V934 N935	I927-K931 HydrophobicContact CG2-CD 4.19Å; I927-K931 WeakPolarHBondContact O-CB 3.42Å; I927-K931 WeakPolarHBondContact O-CG 3.41Å; I927-K931 PolarHBondContact O-N 3.38Å; S928-K931 PolarHBondContact O-N 3.48Å; S929-K931 PolarHBondContact O-N 3.33Å; K931-Q933 VanDerWaalsContact C-N 3.32Å; K931-V934 PolarHBondContact O-N 3.41Å; K931-N935 PolarHBondContact O-N 3.22Å
932	S	51.8	Low	50.5	Low	85 Å²	85	100.6 Å²	100.6	59%	0.594	53%	0.526	S	S	*	.	H	α-helix	trans	-66.4	-32.7	170.2	-166.3	0	0	0	0	112	S928 S929 N935	S928-S932 VanDerWaalsContact O-CB 3.24Å; S928-S932 WeakPolarHBondContact O-CB 3.41Å; S928-S932 PolarHBondContact O-N 2.8Å; S929-S932 PolarHBondContact O-N 2.94Å; S932-N935 WeakPolarHBondContact O-CA 3.46Å; S932-N935 PolarHBondContact O-N 3.38Å; S932-N935 VanDerWaalsContact O-N 3.11Å; S932-N935 PolarHBondContact O-OD1 3.07Å
933	Q	49.9	Very low	50.6	Low	144 Å²	144	102 Å²	102	67%	0.673	54%	0.536	S	S	*	.	H	α-helix	trans	-92	-2.8	172.1	-73.1	-162.7	-3.4	0	0	116	S929 L930 K931 N935	S929-Q933 PolarHBondContact O-N 3.1Å; L930-Q933 CarbonylContact O-C 3.51Å; L930-Q933 PolarHBondContact O-N 3.04Å; K931-Q933 VanDerWaalsContact C-N 3.32Å; Q933-N935 VanDerWaalsContact C-CG 3.5Å; Q933-N935 VanDerWaalsContact CA-CG 3.47Å; Q933-N935 WeakPolarHBondContact CA-ND2 3.3Å; Q933-N935 VanDerWaalsContact O-CB 3.3Å; Q933-N935 WeakPolarHBondContact O-CB 3.36Å; Q933-N935 VanDerWaalsContact O-CG 3.23Å; Q933-N935 PolarHBondContact O-ND2 3.3Å
934	V	47.8	Very low	49.2	Very low	86 Å²	86	103.6 Å²	103.6	52%	0.521	54%	0.544	S	S	.	.	H	α-helix	trans	-74.9	-9.6	151.5	172.2	0	0	0	0	111.2	L930 K931 Q938	L930-V934 WeakPolarHBondContact O-CG2 3.45Å; L930-V934 PolarHBondContact O-N 3.33Å; K931-V934 PolarHBondContact O-N 3.41Å; V934-Q938 PolarHBondContact O-N 2.97Å
935	N	46.5	Very low	48.5	Very low	59 Å²	59	101.2 Å²	101.2	32%	0.316	53%	0.533	S	S	.	.	H	α-helix	trans	73.4	164.7	136.1	-100.7	-33.2	0	0	0	114.7	K931 S932 Q933 L937 Q938	K931-N935 PolarHBondContact O-N 3.22Å; S932-N935 WeakPolarHBondContact O-CA 3.46Å; S932-N935 PolarHBondContact O-N 3.38Å; S932-N935 VanDerWaalsContact O-N 3.11Å; S932-N935 PolarHBondContact O-OD1 3.07Å; Q933-N935 VanDerWaalsContact C-CG 3.5Å; Q933-N935 VanDerWaalsContact CA-CG 3.47Å; Q933-N935 WeakPolarHBondContact CA-ND2 3.3Å; Q933-N935 VanDerWaalsContact O-CB 3.3Å; Q933-N935 WeakPolarHBondContact O-CB 3.36Å; Q933-N935 VanDerWaalsContact O-CG 3.23Å; Q933-N935 PolarHBondContact O-ND2 3.3Å; N935-L937 HydrophobicContact CB-CB 3.61Å; N935-L937 HydrophobicContact CB-CD1 3.86Å; N935-L937 HydrophobicContact CB-CG 3.61Å; N935-L937 PolarHBondContact O-N 3.43Å; N935-Q938 PolarHBondContact O-N 3.01Å; N935-Q938 VanDerWaalsContact O-N 3.1Å
936	F	41.2	Very low	48.3	Very low	162 Å²	162	99.4 Å²	99.4	71%	0.711	52%	0.522	S	S	*	.	H	α-helix		47.1	1.4	56.6	-124.6	-108.7	0	0	0	114.4	K939 R940	F936-K939 CarbonylContact C-O 3.16Å; F936-K939 WeakPolarHBondContact CA-O 3.47Å; F936-K939 PolarHBondContact N-O 3.44Å; F936-R940 VanDerWaalsContact O-CZ 3.24Å; F936-R940 PolarHBondContact O-NH1 3.42Å; F936-R940 PolarHBondContact O-NH2 3.42Å
937	L	41.4	Very low	47.8	Very low	117 Å²	117	99.9 Å²	99.9	61%	0.613	52%	0.519	S	S	*	.	H	α-helix	trans	-147.8	-38.1	-174.9	-76.5	175	0	0	0	109.7	N935 K939 A941	N935-L937 HydrophobicContact CB-CB 3.61Å; N935-L937 HydrophobicContact CB-CD1 3.86Å; N935-L937 HydrophobicContact CB-CG 3.61Å; N935-L937 PolarHBondContact O-N 3.43Å; L937-K939 PolarHBondContact N-O 3.25Å; L937-A941 WeakPolarHBondContact O-CB 3.4Å
938	Q	40.8	Very low	47	Very low	148 Å²	148	100 Å²	100	69%	0.692	52%	0.52	S	S	*	.	H	α-helix	trans	-82.2	-25	165.2	-165	176.6	14.6	0	0	112.2	V934 N935 A941	V934-Q938 PolarHBondContact O-N 2.97Å; N935-Q938 PolarHBondContact O-N 3.01Å; N935-Q938 VanDerWaalsContact O-N 3.1Å; Q938-A941 WeakPolarHBondContact O-CB 3.5Å
939	K	28.7	Very low	46.6	Very low	96 Å²	96	99.7 Å²	99.7	42%	0.417	52%	0.515	S	S	.	.	S	Bend	trans	-135.5	141.5	157.1	-72.6	-159.9	169.7	-149	0	111.6	F936 L937 Q945	F936-K939 CarbonylContact C-O 3.16Å; F936-K939 WeakPolarHBondContact CA-O 3.47Å; F936-K939 PolarHBondContact N-O 3.44Å; L937-K939 PolarHBondContact N-O 3.25Å; K939-Q945 HydrophobicContact CD-CG 4.25Å; K939-Q945 WeakPolarHBondContact CE-O 3.42Å; K939-Q945 PolarHBondContact NZ-O 3.2Å
940	R	45.8	Very low	46.4	Very low	119 Å²	119	101 Å²	101	45%	0.449	52%	0.52	S	S	.	.	S	Bend	cis	-71.8	115.2	-9.3	75	-57.7	83.5	-150.1	-15.7	111.4	F936 L944 Q945	F936-R940 VanDerWaalsContact O-CZ 3.24Å; F936-R940 PolarHBondContact O-NH1 3.42Å; F936-R940 PolarHBondContact O-NH2 3.42Å; R940-L944 CarbonylContact C-O 3.54Å; R940-L944 WeakPolarHBondContact CA-O 3.22Å; R940-L944 WeakPolarHBondContact CB-O 3.43Å; R940-L944 HydrophobicContact CG-CB 4.45Å; R940-Q945 HydrophobicContact CB-CG 4.19Å
941	A	51.4	Low	45.3	Very low	34 Å²	34	102.7 Å²	102.7	28%	0.281	52%	0.519	S	S	.	.			trans	-148.2	163.6	169.3	0	0	0	0	0	109.5	L937 Q938 L944 Q945	L937-A941 WeakPolarHBondContact O-CB 3.4Å; Q938-A941 WeakPolarHBondContact O-CB 3.5Å; A941-L944 CarbonylContact C-O 2.93Å; A941-L944 WeakPolarHBondContact CA-O 3.32Å; A941-L944 PolarHBondContact N-O 3.21Å; A941-L944 CarbonylContact O-C 3.43Å; A941-L944 VanDerWaalsContact O-O 3.04Å; A941-Q945 CarbonylContact O-C 3.56Å; A941-Q945 WeakPolarHBondContact O-CA 3.33Å; A941-Q945 PolarHBondContact O-N 3.1Å
942	S	41.6	Very low	45.5	Very low	88 Å²	88	99.8 Å²	99.8	62%	0.615	51%	0.508	S	S	*	.	S	Bend	trans	87.3	-142.8	-148.1	-43.4	0	0	0	0	111.1	L944	S942-L944 VanDerWaalsContact C-CA 3.4Å; S942-L944 WeakPolarHBondContact O-CA 3.32Å
943	I	56.5	Low	45.2	Very low	158 Å²	158	98.4 Å²	98.4	81%	0.81	51%	0.507	S	S	*	.	S	Bend	trans	-121.5	44.1	-173.1	58.3	176	0	0	0	113.5	E946	I943-E946 CarbonylContact C-O 2.91Å; I943-E946 WeakPolarHBondContact CA-O 3.18Å; I943-E946 WeakPolarHBondContact CG1-O 3.42Å; I943-E946 PolarHBondContact N-O 3.12Å
944	L	34.2	Very low	45.2	Very low	110 Å²	110	101.4 Å²	101.4	58%	0.576	51%	0.513	S	S	*	.	S	Bend	cis	-118.4	8.1	23.1	-67.5	174.7	0	0	0	114.7	R940 A941 S942 E946 E947	R940-L944 CarbonylContact C-O 3.54Å; R940-L944 WeakPolarHBondContact CA-O 3.22Å; R940-L944 WeakPolarHBondContact CB-O 3.43Å; R940-L944 HydrophobicContact CG-CB 4.45Å; A941-L944 CarbonylContact C-O 2.93Å; A941-L944 WeakPolarHBondContact CA-O 3.32Å; A941-L944 PolarHBondContact N-O 3.21Å; A941-L944 CarbonylContact O-C 3.43Å; A941-L944 VanDerWaalsContact O-O 3.04Å; S942-L944 VanDerWaalsContact C-CA 3.4Å; S942-L944 WeakPolarHBondContact O-CA 3.32Å; L944-E946 PolarHBondContact N-O 3.36Å; L944-E947 WeakPolarHBondContact CA-OE1 3.15Å; L944-E947 PolarHBondContact N-OE1 3.22Å
945	Q	43.8	Very low	44.6	Very low	56 Å²	56	112.6 Å²	112.6	26%	0.262	55%	0.546	S	S	.	.	S	Bend	trans	-156.8	-21.5	-156.4	-146.8	-121.3	120.2	0	0	122.5	K939 R940 A941 E947	K939-Q945 HydrophobicContact CD-CG 4.25Å; K939-Q945 WeakPolarHBondContact CE-O 3.42Å; K939-Q945 PolarHBondContact NZ-O 3.2Å; R940-Q945 HydrophobicContact CB-CG 4.19Å; A941-Q945 CarbonylContact O-C 3.56Å; A941-Q945 WeakPolarHBondContact O-CA 3.33Å; A941-Q945 PolarHBondContact O-N 3.1Å; Q945-E947 CarbonylContact C-O 3.27Å; Q945-E947 VanDerWaalsContact C-O 3.27Å; Q945-E947 HydrophobicContact CB-CB 4.39Å; Q945-E947 HydrophobicContact CB-CG 4.47Å; Q945-E947 WeakPolarHBondContact CB-OE1 3.47Å; Q945-E947 WeakPolarHBondContact CB-OE2 3.26Å; Q945-E947 PolarHBondContact N-OE1 3.45Å; Q945-E947 PolarHBondContact NE2-OE2 3.15Å
946	E	51.3	Low	44.5	Very low	48 Å²	48	115.3 Å²	115.3	22%	0.224	56%	0.557	C	S	.	*			cis	-45.3	-44.4	12.7	162.4	-156.6	-72.4	0	0	115	I943 L944 L948 T949 T950	I943-E946 CarbonylContact C-O 2.91Å; I943-E946 WeakPolarHBondContact CA-O 3.18Å; I943-E946 WeakPolarHBondContact CG1-O 3.42Å; I943-E946 PolarHBondContact N-O 3.12Å; L944-E946 PolarHBondContact N-O 3.36Å; E946-L948 WeakPolarHBondContact OE2-CA 3.46Å; E946-L948 PolarHBondContact OE2-N 3.33Å; E946-T949 VanDerWaalsContact CD-N 3.29Å; E946-T949 PolarHBondContact OE1-N 3.45Å; E946-T949 VanDerWaalsContact OE1-N 3.14Å; E946-T949 PolarHBondContact OE1-OG1 3.4Å; E946-T949 PolarHBondContact OE2-N 3.37Å; E946-T949 PolarHBondContact OE2-OG1 3.48Å; E946-T949 VanDerWaalsContact OE2-OG1 3.07Å; E946-T950 WeakPolarHBondContact OE1-CB 3.44Å; E946-T950 VanDerWaalsContact OE1-CG2 3.32Å; E946-T950 WeakPolarHBondContact OE1-CG2 3.43Å; E946-T950 PolarHBondContact OE1-N 3.42Å; E946-T950 PolarHBondContact OE1-OG1 3.31Å
947	E	52.4	Low	44.7	Very low	86 Å²	86	112.8 Å²	112.8	40%	0.402	55%	0.549	S	S	.	.				60.6	-135.2	-54.7	28	-78.5	108.8	0	0	118.7	L944 Q945	L944-E947 WeakPolarHBondContact CA-OE1 3.15Å; L944-E947 PolarHBondContact N-OE1 3.22Å; Q945-E947 CarbonylContact C-O 3.27Å; Q945-E947 VanDerWaalsContact C-O 3.27Å; Q945-E947 HydrophobicContact CB-CB 4.39Å; Q945-E947 HydrophobicContact CB-CG 4.47Å; Q945-E947 WeakPolarHBondContact CB-OE1 3.47Å; Q945-E947 WeakPolarHBondContact CB-OE2 3.26Å; Q945-E947 PolarHBondContact N-OE1 3.45Å; Q945-E947 PolarHBondContact NE2-OE2 3.15Å
948	L	39	Very low	44.9	Very low	87 Å²	87	112.6 Å²	112.6	46%	0.455	55%	0.545	S	S	.	.	S	Bend	trans	-112.6	-93.7	-172.9	-85.8	62.6	0	0	0	110.5	E946 T950 Y951	E946-L948 WeakPolarHBondContact OE2-CA 3.46Å; E946-L948 PolarHBondContact OE2-N 3.33Å; L948-T950 VanDerWaalsContact C-N 3.33Å; L948-T950 PolarHBondContact O-N 3.37Å; L948-Y951 HydrophobicContact CB-CD2 4.35Å; L948-Y951 HydrophobicContact CB-CE2 4.13Å; L948-Y951 HydrophobicContact CG-CE2 3.85Å; L948-Y951 WeakPolarHBondContact O-CB 3.4Å; L948-Y951 VanDerWaalsContact O-CD2 3.23Å; L948-Y951 WeakPolarHBondContact O-CD2 3.45Å
949	T	49.4	Very low	45.1	Very low	67 Å²	67	110.5 Å²	110.5	41%	0.411	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.7	-21.8	-147.9	34.3	0	0	0	0	122.7	E946 Q952 G953	E946-T949 VanDerWaalsContact CD-N 3.29Å; E946-T949 PolarHBondContact OE1-N 3.45Å; E946-T949 VanDerWaalsContact OE1-N 3.14Å; E946-T949 PolarHBondContact OE1-OG1 3.4Å; E946-T949 PolarHBondContact OE2-N 3.37Å; E946-T949 PolarHBondContact OE2-OG1 3.48Å; E946-T949 VanDerWaalsContact OE2-OG1 3.07Å; T949-Q952 CarbonylContact O-C 3.59Å; T949-Q952 WeakPolarHBondContact O-CA 3.46Å; T949-Q952 WeakPolarHBondContact O-CB 3.46Å; T949-Q952 PolarHBondContact O-N 3.18Å; T949-G953 PolarHBondContact O-N 3.26Å
950	T	50.6	Low	46.1	Very low	102 Å²	102	111.4 Å²	111.4	63%	0.626	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-31.4	-171.8	38.8	0	0	0	0	113.7	E946 L948 G953	E946-T950 WeakPolarHBondContact OE1-CB 3.44Å; E946-T950 VanDerWaalsContact OE1-CG2 3.32Å; E946-T950 WeakPolarHBondContact OE1-CG2 3.43Å; E946-T950 PolarHBondContact OE1-N 3.42Å; E946-T950 PolarHBondContact OE1-OG1 3.31Å; L948-T950 VanDerWaalsContact C-N 3.33Å; L948-T950 PolarHBondContact O-N 3.37Å; T950-G953 WeakPolarHBondContact O-CA 3.41Å; T950-G953 PolarHBondContact O-N 3.34Å
951	Y	36.4	Very low	46.1	Very low	150 Å²	150	110.9 Å²	110.9	59%	0.588	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn		-3.3	-80.5	121	-165.6	-57	0	0	0	115.2	L948 G953	L948-Y951 HydrophobicContact CB-CD2 4.35Å; L948-Y951 HydrophobicContact CB-CE2 4.13Å; L948-Y951 HydrophobicContact CG-CE2 3.85Å; L948-Y951 WeakPolarHBondContact O-CB 3.4Å; L948-Y951 VanDerWaalsContact O-CD2 3.23Å; L948-Y951 WeakPolarHBondContact O-CD2 3.45Å; Y951-G953 PolarHBondContact O-N 3.46Å; Y951-G953 VanDerWaalsContact O-N 3.16Å
952	Q	54.7	Low	45.7	Very low	93 Å²	93	116.4 Å²	116.4	44%	0.435	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.1	43.5	168.8	-60.9	128.9	-3.1	0	0	112.2	T949 R954	T949-Q952 CarbonylContact O-C 3.59Å; T949-Q952 WeakPolarHBondContact O-CA 3.46Å; T949-Q952 WeakPolarHBondContact O-CB 3.46Å; T949-Q952 PolarHBondContact O-N 3.18Å; Q952-R954 VanDerWaalsContact O-CD 3.29Å; Q952-R954 WeakPolarHBondContact O-CD 3.41Å; Q952-R954 WeakPolarHBondContact O-CG 3.21Å; Q952-R954 PolarHBondContact O-N 3.4Å
953	G	45.5	Very low	46.1	Very low	56 Å²	56	118.6 Å²	118.6	58%	0.577	57%	0.566	S	S	*	*			trans	-51.9	111.7	158.4	0	0	0	0	0	106.9	T949 T950 Y951 R955	T949-G953 PolarHBondContact O-N 3.26Å; T950-G953 WeakPolarHBondContact O-CA 3.41Å; T950-G953 PolarHBondContact O-N 3.34Å; Y951-G953 PolarHBondContact O-N 3.46Å; Y951-G953 VanDerWaalsContact O-N 3.16Å; G953-R955 PolarHBondContact O-N 2.61Å; G953-R955 VanDerWaalsContact O-N 3.09Å
954	R	49.4	Very low	45.2	Very low	208 Å²	208	115.3 Å²	115.3	79%	0.785	55%	0.546	S	S	*	.			trans	-78.5	108.1	-151.3	-83.3	106.6	-175.9	-95.6	3.6	112.7	Q952	Q952-R954 VanDerWaalsContact O-CD 3.29Å; Q952-R954 WeakPolarHBondContact O-CD 3.41Å; Q952-R954 WeakPolarHBondContact O-CG 3.21Å; Q952-R954 PolarHBondContact O-N 3.4Å
955	R	35.8	Very low	46.2	Very low	321 Å²	321	115.8 Å²	115.8	100%	1.211	54%	0.543	S	S	*	.			trans	63.5	0	154.4	-65.7	-176.1	172.5	-175.9	-2.9	115.7	G953	G953-R955 PolarHBondContact O-N 2.61Å; G953-R955 VanDerWaalsContact O-N 3.09Å

Retrieved 955 of 955 residues in 1353.4 ms (Link to these results)

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