A0A087YCY1_POEFO Loading...

TATA box-binding protein-associated factor RNA polymerase I subunit B

AlphaFold DB , UniProt , Accession A0A087YCY1, Species POEFO (Poecilia formosa, Amazon molly), Gene TAF1B, Length 598 aa.

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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	42.1	Very low	57.6	Low	222 Å²	222	111.1 Å²	111.1	100%	1.094	58%	0.577	S	S	*	*				0	-1.5	0	-131.4	172.4	-119.1	0	0	112.1
2	D	47.3	Very low	59.5	Low	80 Å²	80	108.6 Å²	108.6	43%	0.428	57%	0.572	S	S	.	*			trans	-110	-12.1	-172.6	-55.8	-20.2	0	0	0	115.1
3	E	49.5	Very low	61.1	Low	151 Å²	151	100.5 Å²	100.5	71%	0.706	53%	0.53	S	S	*	.	S	Bend	trans	-77.3	-33.8	-178.9	-84.5	179.1	160.8	0	0	113.1	D5 T6	E3-D5 PolarHBondContact O-N 3.25Å; E3-T6 PolarHBondContact O-N 3.3Å; E3-T6 PolarHBondContact O-OG1 2.66Å
4	E	52.9	Low	62.4	Low	180 Å²	180	101.6 Å²	101.6	84%	0.841	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.4	178.4	-119.1	175.6	174.3	0	0	112.4
5	D	53.8	Low	63.5	Low	57 Å²	57	104.3 Å²	104.3	31%	0.305	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-11.1	-175.2	-74.6	-31.3	0	0	0	114.2	E3 I23 R42	E3-D5 PolarHBondContact O-N 3.25Å; D5-I23 HydrophobicContact CB-CD1 3.9Å; D5-R42 IonicContact OD1-CZ 3.14Å; D5-R42 IonicContact OD1-NE 3.93Å; D5-R42 IonicContact OD1-NH1 3.95Å; D5-R42 PolarHBondContact OD1-NH1 2.62Å; D5-R42 IonicContact OD1-NH2 3.17Å; D5-R42 PolarHBondContact OD1-NH2 3.24Å; D5-R42 IonicContact OD2-CZ 2.73Å; D5-R42 IonicContact OD2-NH1 2.72Å; D5-R42 PolarHBondContact OD2-NH1 3.48Å; D5-R42 IonicContact OD2-NH2 3.99Å; D5-R42 PolarHBondContact OD2-NH2 3.47Å
6	T	58.1	Low	64.7	Low	21 Å²	21	101.1 Å²	101.1	13%	0.129	53%	0.534	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-4.9	179.6	55.9	0	0	0	0	113.7	E3 G8 Y9 W21 I23 F29	E3-T6 PolarHBondContact O-N 3.3Å; E3-T6 PolarHBondContact O-OG1 2.66Å; T6-G8 PolarHBondContact O-N 3.38Å; T6-Y9 PolarHBondContact O-N 2.93Å; T6-W21 WeakPolarHBondContact CG2-O 3.49Å; T6-I23 HydrophobicContact CG2-CD1 4.07Å; T6-I23 HydrophobicContact CG2-CG1 3.93Å; T6-F29 HydrophobicContact CG2-CD1 4.46Å; T6-F29 HydrophobicContact CG2-CE1 3.97Å
7	D	54.8	Low	65.7	Low	126 Å²	126	99.4 Å²	99.4	67%	0.674	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-13.5	-168.7	-157.4	26.3	0	0	0	114.6
8	G	59.1	Low	66.6	Low	80 Å²	80	95.2 Å²	95.2	83%	0.825	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.8	173.6	0	0	0	0	0	115.8	T6	T6-G8 PolarHBondContact O-N 3.38Å
9	Y	66.7	Low	67.2	Low	39 Å²	39	94.5 Å²	94.5	15%	0.153	52%	0.517	C	S	.	.			trans	-109.9	96.4	-171.2	-165.8	-118.3	0	0	0	112.4	T6 E11 W21 F29 I38	T6-Y9 PolarHBondContact O-N 2.93Å; Y9-E11 HydrophobicContact CD2-CB 4.49Å; Y9-E11 HydrophobicContact CD2-CG 4.48Å; Y9-E11 HydrophobicContact CE1-CB 4.26Å; Y9-E11 HydrophobicContact CE2-CB 3.77Å; Y9-E11 HydrophobicContact CE2-CG 3.81Å; Y9-E11 WeakPolarHBondContact CE2-OE2 3.46Å; Y9-E11 VanDerWaalsContact CZ-OE2 3.29Å; Y9-E11 PolarHBondContact OH-OE2 2.8Å; Y9-W21 HydrophobicContact CD1-CB 4.47Å; Y9-W21 AromaticContact CD1-CD1 3.51Å; Y9-W21 AromaticContact CD1-CD2 3.99Å; Y9-W21 HydrophobicContact CD1-CD2 3.99Å; Y9-W21 AromaticContact CD1-CE2 3.91Å; Y9-W21 AromaticContact CD1-CG 3.76Å; Y9-W21 HydrophobicContact CD1-CG 3.76Å; Y9-W21 AromaticContact CD1-NE1 3.58Å; Y9-W21 AromaticContact CE1-CD1 3.89Å; Y9-W21 AromaticContact CE1-CD2 3.83Å; Y9-W21 HydrophobicContact CE1-CD2 3.83Å; Y9-W21 AromaticContact CE1-CE2 3.45Å; Y9-W21 VanDerWaalsContact CE1-CE2 3.45Å; Y9-W21 HydrophobicContact CE1-CE3 4.46Å; Y9-W21 HydrophobicContact CE1-CG 4.1Å; Y9-W21 HydrophobicContact CE1-CH2 4.45Å; Y9-W21 AromaticContact CE1-CZ2 3.78Å; Y9-W21 HydrophobicContact CE1-CZ2 3.78Å; Y9-W21 AromaticContact CE1-NE1 3.47Å; Y9-F29 HydrophobicContact CD1-CD1 4.46Å; Y9-I38 HydrophobicContact CE1-CD1 3.77Å
10	K	71.8	Confident	67.8	Low	165 Å²	165	93.1 Å²	93.1	72%	0.717	51%	0.509	S	S	*	.			trans	-105.7	15.8	-178.2	-62.1	-173.9	-180	-178.4	0	114.3	V19	K10-V19 VanDerWaalsContact C-CG1 3.47Å; K10-V19 HydrophobicContact CB-CG1 4.26Å; K10-V19 WeakPolarHBondContact O-CG1 3.4Å
11	E	77.3	Confident	68.5	Low	101 Å²	101	89 Å²	89	47%	0.472	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-76.4	138.5	176.9	-69	178.5	-178.7	0	0	110.8	Y9 W21	Y9-E11 HydrophobicContact CD2-CB 4.49Å; Y9-E11 HydrophobicContact CD2-CG 4.48Å; Y9-E11 HydrophobicContact CE1-CB 4.26Å; Y9-E11 HydrophobicContact CE2-CB 3.77Å; Y9-E11 HydrophobicContact CE2-CG 3.81Å; Y9-E11 WeakPolarHBondContact CE2-OE2 3.46Å; Y9-E11 VanDerWaalsContact CZ-OE2 3.29Å; Y9-E11 PolarHBondContact OH-OE2 2.8Å; E11-W21 PolarHBondContact O-NE1 3.37Å
12	P	80.2	Confident	70.3	Confident	81 Å²	81	78.5 Å²	78.5	53%	0.526	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-71.4	141.9	177.6	28.6	-33.1	0	0	0	111.2	N14 A17 V19	P12-N14 PolarHBondContact O-N 2.81Å; P12-A17 WeakPolarHBondContact CB-O 3.5Å; P12-V19 HydrophobicContact CB-CG2 4.19Å
13	C	80.6	Confident	71.8	Confident	4 Å²	4	76 Å²	76	3%	0.027	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-57.3	130	173.4	-177.2	0	0	0	0	111.1	Q15 A17 A18 W21 C31	C13-Q15 PolarHBondContact O-N 2.93Å; C13-Q15 VanDerWaalsContact O-N 3.12Å; C13-Q15 PolarHBondContact SG-N 3.42Å; C13-A17 WeakPolarHBondContact O-CA 3.09Å; C13-A17 PolarHBondContact O-N 3.49Å; C13-A18 WeakPolarHBondContact CB-O 3.48Å; C13-A18 PolarHBondContact N-O 3.49Å; C13-W21 HydrophobicContact CB-CH2 4.13Å; C13-W21 HydrophobicContact CB-CZ2 3.88Å; C13-C31 HydrophobicContact CB-CB 4.26Å
14	N	78.9	Confident	72.9	Confident	116 Å²	116	70.5 Å²	70.5	62%	0.62	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.9	178	62.1	-13.9	0	0	0	114.6	P12 N36	P12-N14 PolarHBondContact O-N 2.81Å; N14-N36 PolarHBondContact OD1-ND2 3.25Å
15	Q	79.3	Confident	73.5	Confident	141 Å²	141	70.5 Å²	70.5	66%	0.659	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-37	-179.6	-65.8	-63.3	-27.4	0	0	113.4	C13 N36	C13-Q15 PolarHBondContact O-N 2.93Å; C13-Q15 VanDerWaalsContact O-N 3.12Å; C13-Q15 PolarHBondContact SG-N 3.42Å; Q15-N36 HydrophobicContact CB-CB 4.48Å; Q15-N36 HydrophobicContact CG-CB 4.11Å
16	C	83.3	Confident	73.9	Confident	54 Å²	54	74.5 Å²	74.5	37%	0.365	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	2	-174.5	69.9	0	0	0	0	114.7	A18 C34	C16-A18 PolarHBondContact O-N 2.96Å; C16-C34 HydrophobicContact CB-CB 4.04Å
17	A	81.5	Confident	74.3	Confident	71 Å²	71	74.5 Å²	74.5	59%	0.587	43%	0.426	S	S	*	.			trans	59.1	1	-177.2	0	0	0	0	0	116.5	P12 C13	P12-A17 WeakPolarHBondContact CB-O 3.5Å; C13-A17 WeakPolarHBondContact O-CA 3.09Å; C13-A17 PolarHBondContact O-N 3.49Å
18	A	81.1	Confident	75.2	Confident	25 Å²	25	74.2 Å²	74.2	21%	0.207	42%	0.415	C	S	.	.			trans	-67.8	142.4	174.3	0	0	0	0	0	111.4	C13 C16 S33	C13-A18 WeakPolarHBondContact CB-O 3.48Å; C13-A18 PolarHBondContact N-O 3.49Å; C16-A18 PolarHBondContact O-N 2.96Å; A18-S33 WeakPolarHBondContact CB-OG 3.31Å
19	V	78.9	Confident	76.2	Confident	81 Å²	81	71.2 Å²	71.2	49%	0.491	38%	0.38	S	S	.	.			trans	-104.3	56.4	175.1	-168.1	0	0	0	0	108.2	K10 P12	K10-V19 VanDerWaalsContact C-CG1 3.47Å; K10-V19 HydrophobicContact CB-CG1 4.26Å; K10-V19 WeakPolarHBondContact O-CG1 3.4Å; P12-V19 HydrophobicContact CB-CG2 4.19Å
20	D	79.8	Confident	77	Confident	67 Å²	67	72.2 Å²	72.2	36%	0.358	38%	0.384	S	S	.	.			trans	-134.4	104.5	-177.7	-175	18	0	0	0	109.1	C31 R32	D20-C31 WeakPolarHBondContact O-CA 3.34Å; D20-C31 PolarHBondContact O-SG 2.68Å; D20-R32 PolarHBondContact O-N 3.5Å; D20-R32 WeakPolarHBondContact OD1-CD 3.19Å; D20-R32 WeakPolarHBondContact OD2-CB 3.42Å
21	W	82.1	Confident	77.6	Confident	8 Å²	8	64.4 Å²	64.4	3%	0.03	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	142.4	-169.6	-64.7	98.8	0	0	0	110.2	T6 Y9 E11 C13 F29 Y30 C31 I38	T6-W21 WeakPolarHBondContact CG2-O 3.49Å; Y9-W21 HydrophobicContact CD1-CB 4.47Å; Y9-W21 AromaticContact CD1-CD1 3.51Å; Y9-W21 AromaticContact CD1-CD2 3.99Å; Y9-W21 HydrophobicContact CD1-CD2 3.99Å; Y9-W21 AromaticContact CD1-CE2 3.91Å; Y9-W21 AromaticContact CD1-CG 3.76Å; Y9-W21 HydrophobicContact CD1-CG 3.76Å; Y9-W21 AromaticContact CD1-NE1 3.58Å; Y9-W21 AromaticContact CE1-CD1 3.89Å; Y9-W21 AromaticContact CE1-CD2 3.83Å; Y9-W21 HydrophobicContact CE1-CD2 3.83Å; Y9-W21 AromaticContact CE1-CE2 3.45Å; Y9-W21 VanDerWaalsContact CE1-CE2 3.45Å; Y9-W21 HydrophobicContact CE1-CE3 4.46Å; Y9-W21 HydrophobicContact CE1-CG 4.1Å; Y9-W21 HydrophobicContact CE1-CH2 4.45Å; Y9-W21 AromaticContact CE1-CZ2 3.78Å; Y9-W21 HydrophobicContact CE1-CZ2 3.78Å; Y9-W21 AromaticContact CE1-NE1 3.47Å; E11-W21 PolarHBondContact O-NE1 3.37Å; C13-W21 HydrophobicContact CB-CH2 4.13Å; C13-W21 HydrophobicContact CB-CZ2 3.88Å; W21-F29 HydrophobicContact CB-CD1 4.3Å; W21-F29 HydrophobicContact CE3-CB 4.4Å; W21-Y30 WeakPolarHBondContact CA-O 3.41Å; W21-Y30 VanDerWaalsContact CE3-C 3.48Å; W21-C31 HydrophobicContact CE3-CB 4.04Å; W21-C31 HydrophobicContact CH2-CB 4.3Å; W21-C31 HydrophobicContact CZ3-CB 3.87Å; W21-I38 HydrophobicContact CE3-CD1 4.27Å; W21-I38 HydrophobicContact CH2-CD1 3.99Å; W21-I38 HydrophobicContact CH2-CG1 4.39Å; W21-I38 HydrophobicContact CH2-CG2 3.74Å; W21-I38 HydrophobicContact CZ3-CD1 3.83Å; W21-I38 HydrophobicContact CZ3-CG1 3.93Å; W21-I38 HydrophobicContact CZ3-CG2 3.86Å
22	G	79.6	Confident	77.8	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	165.8	169.3	0	0	0	0	0	110.6	F29 Y30	G22-F29 CarbonylContact O-C 3.43Å; G22-F29 WeakPolarHBondContact O-CA 3.45Å; G22-Y30 PolarHBondContact N-O 3.24Å; G22-Y30 WeakPolarHBondContact O-CD1 3.44Å; G22-Y30 PolarHBondContact O-N 3.29Å
23	I	78.1	Confident	77.8	Confident	27 Å²	27	63 Å²	63	14%	0.138	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.2	177.2	-59.7	174.5	0	0	0	108.2	D5 T6 R28 F29	D5-I23 HydrophobicContact CB-CD1 3.9Å; T6-I23 HydrophobicContact CG2-CD1 4.07Å; T6-I23 HydrophobicContact CG2-CG1 3.93Å; I23-R28 WeakPolarHBondContact CA-O 3.34Å; I23-F29 HydrophobicContact CD1-CE1 3.95Å; I23-F29 HydrophobicContact CD1-CE2 4.14Å; I23-F29 HydrophobicContact CD1-CZ 3.7Å; I23-F29 HydrophobicContact CG1-CD1 4.01Å; I23-F29 HydrophobicContact CG1-CD2 4.4Å; I23-F29 HydrophobicContact CG1-CE1 3.87Å; I23-F29 HydrophobicContact CG1-CE2 4.27Å; I23-F29 HydrophobicContact CG1-CG 4.28Å; I23-F29 HydrophobicContact CG1-CZ 4Å
24	S	72.6	Confident	77.8	Confident	37 Å²	37	65.1 Å²	65.1	26%	0.259	36%	0.355	S	S	.	.			trans	-79.8	161.7	175	54.2	0	0	0	0	111.2	E26 G27 R28	S24-E26 PolarHBondContact O-N 3.03Å; S24-G27 WeakPolarHBondContact O-CA 3.43Å; S24-G27 PolarHBondContact O-N 3.23Å; S24-R28 PolarHBondContact N-O 2.77Å; S24-R28 WeakPolarHBondContact OG-CB 3.48Å; S24-R28 PolarHBondContact OG-N 3.29Å; S24-R28 PolarHBondContact OG-O 3.1Å
25	D	65.8	Low	77.9	Confident	180 Å²	180	66.1 Å²	66.1	96%	0.963	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.9	178.7	-56.8	-22.5	0	0	0	113.3	G27	D25-G27 VanDerWaalsContact C-N 3.29Å
26	E	63.1	Low	77.9	Confident	141 Å²	141	61.5 Å²	61.5	66%	0.659	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	2.4	173.4	-57.6	-174.1	-168.6	0	0	113.9	S24 R28	S24-E26 PolarHBondContact O-N 3.03Å; E26-R28 IonicContact OE2-CZ 2.66Å; E26-R28 IonicContact OE2-NE 2.62Å; E26-R28 PolarHBondContact OE2-NE 2.86Å; E26-R28 IonicContact OE2-NH2 3.25Å; E26-R28 PolarHBondContact OE2-NH2 2.83Å
27	G	65.5	Low	77.7	Confident	21 Å²	21	62.8 Å²	62.8	22%	0.216	34%	0.341	C	S	.	.	S	Bend	trans	80.2	14.1	178.7	0	0	0	0	0	115.7	S24 D25 T41 R42	S24-G27 WeakPolarHBondContact O-CA 3.43Å; S24-G27 PolarHBondContact O-N 3.23Å; D25-G27 VanDerWaalsContact C-N 3.29Å; G27-T41 VanDerWaalsContact O-CA 3.31Å; G27-T41 WeakPolarHBondContact O-CA 3.42Å; G27-R42 PolarHBondContact O-N 2.94Å
28	R	74.8	Confident	77.4	Confident	120 Å²	120	60.8 Å²	60.8	45%	0.453	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	140.9	178.5	-50.2	-175.4	-156.7	-162.2	8.5	111.8	I23 S24 E26 V37 T41	I23-R28 WeakPolarHBondContact CA-O 3.34Å; S24-R28 PolarHBondContact N-O 2.77Å; S24-R28 WeakPolarHBondContact OG-CB 3.48Å; S24-R28 PolarHBondContact OG-N 3.29Å; S24-R28 PolarHBondContact OG-O 3.1Å; E26-R28 IonicContact OE2-CZ 2.66Å; E26-R28 IonicContact OE2-NE 2.62Å; E26-R28 PolarHBondContact OE2-NE 2.86Å; E26-R28 IonicContact OE2-NH2 3.25Å; E26-R28 PolarHBondContact OE2-NH2 2.83Å; R28-V37 HydrophobicContact CB-CG1 4.08Å; R28-T41 HydrophobicContact CG-CG2 4.39Å
29	F	78.7	Confident	76.4	Confident	17 Å²	17	69 Å²	69	8%	0.075	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	134.8	174.6	-76	-102.8	0	0	0	111.3	T6 Y9 W21 G22 I23 V37 I38 R40	T6-F29 HydrophobicContact CG2-CD1 4.46Å; T6-F29 HydrophobicContact CG2-CE1 3.97Å; Y9-F29 HydrophobicContact CD1-CD1 4.46Å; W21-F29 HydrophobicContact CB-CD1 4.3Å; W21-F29 HydrophobicContact CE3-CB 4.4Å; G22-F29 CarbonylContact O-C 3.43Å; G22-F29 WeakPolarHBondContact O-CA 3.45Å; I23-F29 HydrophobicContact CD1-CE1 3.95Å; I23-F29 HydrophobicContact CD1-CE2 4.14Å; I23-F29 HydrophobicContact CD1-CZ 3.7Å; I23-F29 HydrophobicContact CG1-CD1 4.01Å; I23-F29 HydrophobicContact CG1-CD2 4.4Å; I23-F29 HydrophobicContact CG1-CE1 3.87Å; I23-F29 HydrophobicContact CG1-CE2 4.27Å; I23-F29 HydrophobicContact CG1-CG 4.28Å; I23-F29 HydrophobicContact CG1-CZ 4Å; F29-V37 WeakPolarHBondContact O-CA 3.32Å; F29-I38 HydrophobicContact CB-CD1 3.79Å; F29-I38 HydrophobicContact CB-CG1 3.56Å; F29-I38 PolarHBondContact O-N 3.34Å; F29-R40 HydrophobicContact CD2-CB 4.4Å; F29-R40 WeakPolarHBondContact CD2-O 3.48Å; F29-R40 PolarHBondContact N-O 3.1Å
30	Y	84.2	Confident	75.5	Confident	60 Å²	60	71.8 Å²	71.8	24%	0.235	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.9	171.9	70	-88.8	0	0	0	110.6	W21 G22 R32 N36	W21-Y30 WeakPolarHBondContact CA-O 3.41Å; W21-Y30 VanDerWaalsContact CE3-C 3.48Å; G22-Y30 PolarHBondContact N-O 3.24Å; G22-Y30 WeakPolarHBondContact O-CD1 3.44Å; G22-Y30 PolarHBondContact O-N 3.29Å; Y30-R32 HydrophobicContact CE2-CG 4.11Å; Y30-N36 CarbonylContact C-O 3.55Å; Y30-N36 VanDerWaalsContact CA-O 3.32Å; Y30-N36 WeakPolarHBondContact CA-O 3.41Å
31	C	84.4	Confident	74.2	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	128.7	175.9	178.1	0	0	0	0	109.6	C13 D20 W21 S33 H35 N36	C13-C31 HydrophobicContact CB-CB 4.26Å; D20-C31 WeakPolarHBondContact O-CA 3.34Å; D20-C31 PolarHBondContact O-SG 2.68Å; W21-C31 HydrophobicContact CE3-CB 4.04Å; W21-C31 HydrophobicContact CH2-CB 4.3Å; W21-C31 HydrophobicContact CZ3-CB 3.87Å; C31-S33 VanDerWaalsContact C-N 3.28Å; C31-S33 PolarHBondContact O-N 2.89Å; C31-S33 PolarHBondContact SG-N 2.9Å; C31-H35 WeakPolarHBondContact O-CA 3.46Å; C31-H35 PolarHBondContact O-N 3.04Å; C31-N36 PolarHBondContact N-O 2.83Å
32	R	80.7	Confident	72.5	Confident	81 Å²	81	78.1 Å²	78.1	31%	0.306	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-24	179.3	-72.9	-178.5	175.9	167.2	0.5	113.1	D20 Y30	D20-R32 PolarHBondContact O-N 3.5Å; D20-R32 WeakPolarHBondContact OD1-CD 3.19Å; D20-R32 WeakPolarHBondContact OD2-CB 3.42Å; Y30-R32 HydrophobicContact CE2-CG 4.11Å
33	S	81.6	Confident	71	Confident	71 Å²	71	84.3 Å²	84.3	50%	0.497	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-32	-178.7	-43.1	0	0	0	0	113.8	A18 C31	A18-S33 WeakPolarHBondContact CB-OG 3.31Å; C31-S33 VanDerWaalsContact C-N 3.28Å; C31-S33 PolarHBondContact O-N 2.89Å; C31-S33 PolarHBondContact SG-N 2.9Å
34	C	80.4	Confident	69.2	Low	49 Å²	49	89 Å²	89	33%	0.331	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	3.8	-177.3	72.8	0	0	0	0	115.2	C16 N36	C16-C34 HydrophobicContact CB-CB 4.04Å; C34-N36 PolarHBondContact O-N 2.95Å; C34-N36 VanDerWaalsContact SG-CB 3.58Å
35	H	80.9	Confident	67.6	Low	137 Å²	137	93 Å²	93	63%	0.634	47%	0.467	S	S	*	.			trans	56.2	18.4	-178.5	-61.8	-74.4	0	0	0	115.4	C31 V37	C31-H35 WeakPolarHBondContact O-CA 3.46Å; C31-H35 PolarHBondContact O-N 3.04Å; H35-V37 PolarHBondContact O-N 2.87Å
36	N	79.1	Confident	66	Low	45 Å²	45	90.5 Å²	90.5	24%	0.241	45%	0.453	C	S	.	.			trans	-69.5	124.9	174.5	-171.9	42.4	0	0	0	110.4	N14 Q15 Y30 C31 C34	N14-N36 PolarHBondContact OD1-ND2 3.25Å; Q15-N36 HydrophobicContact CB-CB 4.48Å; Q15-N36 HydrophobicContact CG-CB 4.11Å; Y30-N36 CarbonylContact C-O 3.55Å; Y30-N36 VanDerWaalsContact CA-O 3.32Å; Y30-N36 WeakPolarHBondContact CA-O 3.41Å; C31-N36 PolarHBondContact N-O 2.83Å; C34-N36 PolarHBondContact O-N 2.95Å; C34-N36 VanDerWaalsContact SG-CB 3.58Å
37	V	79.6	Confident	64.6	Low	81 Å²	81	92 Å²	92	49%	0.491	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.4	-178.7	-175.3	0	0	0	0	109.2	R28 F29 H35	R28-V37 HydrophobicContact CB-CG1 4.08Å; F29-V37 WeakPolarHBondContact O-CA 3.32Å; H35-V37 PolarHBondContact O-N 2.87Å
38	I	74.5	Confident	63.3	Low	29 Å²	29	94.7 Å²	94.7	15%	0.149	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	150.8	175.8	60.8	171.2	0	0	0	110.5	Y9 W21 F29 R40	Y9-I38 HydrophobicContact CE1-CD1 3.77Å; W21-I38 HydrophobicContact CE3-CD1 4.27Å; W21-I38 HydrophobicContact CH2-CD1 3.99Å; W21-I38 HydrophobicContact CH2-CG1 4.39Å; W21-I38 HydrophobicContact CH2-CG2 3.74Å; W21-I38 HydrophobicContact CZ3-CD1 3.83Å; W21-I38 HydrophobicContact CZ3-CG1 3.93Å; W21-I38 HydrophobicContact CZ3-CG2 3.86Å; F29-I38 HydrophobicContact CB-CD1 3.79Å; F29-I38 HydrophobicContact CB-CG1 3.56Å; F29-I38 PolarHBondContact O-N 3.34Å; I38-R40 HydrophobicContact CD1-CB 4.14Å; I38-R40 HydrophobicContact CG1-CB 4.32Å; I38-R40 PolarHBondContact O-N 3.47Å
39	E	59.9	Low	61.2	Low	197 Å²	197	98.8 Å²	98.8	92%	0.921	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	6.4	-174.4	-150.4	176.9	-176.6	0	0	113.7
40	R	61	Low	59	Low	140 Å²	140	104.2 Å²	104.2	53%	0.528	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.7	178.8	-154.3	176.3	-171.5	135.9	-0.5	109.4	F29 I38	F29-R40 HydrophobicContact CD2-CB 4.4Å; F29-R40 WeakPolarHBondContact CD2-O 3.48Å; F29-R40 PolarHBondContact N-O 3.1Å; I38-R40 HydrophobicContact CD1-CB 4.14Å; I38-R40 HydrophobicContact CG1-CB 4.32Å; I38-R40 PolarHBondContact O-N 3.47Å
41	T	52.7	Low	56.5	Low	89 Å²	89	106.4 Å²	106.4	55%	0.546	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.2	141.7	175.1	52.4	0	0	0	0	110.7	G27 R28 E43	G27-T41 VanDerWaalsContact O-CA 3.31Å; G27-T41 WeakPolarHBondContact O-CA 3.42Å; R28-T41 HydrophobicContact CG-CG2 4.39Å; T41-E43 PolarHBondContact O-N 2.83Å
42	R	46.2	Very low	54.1	Low	119 Å²	119	114 Å²	114	45%	0.449	60%	0.599	S	S	.	*			trans	-53.7	128.8	178.4	-176.7	177.6	174.4	-179	1.9	111.3	D5 G27 V44	D5-R42 IonicContact OD1-CZ 3.14Å; D5-R42 IonicContact OD1-NE 3.93Å; D5-R42 IonicContact OD1-NH1 3.95Å; D5-R42 PolarHBondContact OD1-NH1 2.62Å; D5-R42 IonicContact OD1-NH2 3.17Å; D5-R42 PolarHBondContact OD1-NH2 3.24Å; D5-R42 IonicContact OD2-CZ 2.73Å; D5-R42 IonicContact OD2-NH1 2.72Å; D5-R42 PolarHBondContact OD2-NH1 3.48Å; D5-R42 IonicContact OD2-NH2 3.99Å; D5-R42 PolarHBondContact OD2-NH2 3.47Å; G27-R42 PolarHBondContact O-N 2.94Å; R42-V44 PolarHBondContact O-N 3.28Å
43	E	46.8	Very low	51.9	Low	130 Å²	130	115.4 Å²	115.4	61%	0.607	62%	0.621	S	S	*	*			trans	-75.6	109.3	165.4	-74.9	-159.6	126.5	0	0	108.3	T41 V45 R64	T41-E43 PolarHBondContact O-N 2.83Å; E43-V45 PolarHBondContact O-N 3.38Å; E43-R64 IonicContact OE1-CZ 3.1Å; E43-R64 IonicContact OE1-NH1 3.48Å; E43-R64 PolarHBondContact OE1-NH1 3.06Å; E43-R64 IonicContact OE1-NH2 2.79Å; E43-R64 PolarHBondContact OE1-NH2 3.3Å
44	V	40.2	Very low	49.8	Very low	126 Å²	126	120.3 Å²	120.3	76%	0.764	64%	0.641	S	S	*	*			trans	-73.6	111.3	177.1	-176.2	0	0	0	0	108.5	R42 D46	R42-V44 PolarHBondContact O-N 3.28Å; V44-D46 PolarHBondContact O-N 3.4Å
45	V	38.6	Very low	47.7	Very low	121 Å²	121	128.7 Å²	128.7	73%	0.733	67%	0.666	S	S	*	*			trans	-82.9	108.3	169.5	-179.5	0	0	0	0	107.5	E43 M47	E43-V45 PolarHBondContact O-N 3.38Å; V45-M47 PolarHBondContact O-N 3.01Å
46	D	33.1	Very low	45.6	Very low	126 Å²	126	130.9 Å²	130.9	67%	0.674	68%	0.68	S	S	*	*			trans	-71.7	110.5	171.1	-169.6	-10	0	0	0	108.7	V44 S48	V44-D46 PolarHBondContact O-N 3.4Å; D46-S48 VanDerWaalsContact CG-OG 3.25Å; D46-S48 PolarHBondContact O-N 2.95Å; D46-S48 WeakPolarHBondContact OD1-CB 3.19Å; D46-S48 PolarHBondContact OD1-N 2.8Å; D46-S48 PolarHBondContact OD1-OG 2.67Å; D46-S48 PolarHBondContact OD2-OG 3.12Å
47	M	34.7	Very low	43.3	Very low	172 Å²	172	133.7 Å²	133.7	85%	0.847	70%	0.704	S	S	*	*			trans	-81.1	13	-179	-72.1	-161.3	-70.3	0	0	113.7	V45 F49	V45-M47 PolarHBondContact O-N 3.01Å; M47-F49 VanDerWaalsContact C-N 3.28Å; M47-F49 PolarHBondContact O-N 3.34Å; M47-F49 VanDerWaalsContact O-N 3.1Å
48	S	37	Very low	41.2	Very low	79 Å²	79	141.5 Å²	141.5	55%	0.552	72%	0.724	S	S	*	*			trans	-85.9	50.3	179.3	63.8	0	0	0	0	114.3	D46	D46-S48 VanDerWaalsContact CG-OG 3.25Å; D46-S48 PolarHBondContact O-N 2.95Å; D46-S48 WeakPolarHBondContact OD1-CB 3.19Å; D46-S48 PolarHBondContact OD1-N 2.8Å; D46-S48 PolarHBondContact OD1-OG 2.67Å; D46-S48 PolarHBondContact OD2-OG 3.12Å
49	F	31	Very low	39.3	Very low	206 Å²	206	147.9 Å²	147.9	90%	0.904	76%	0.757	S	S	*	*			trans	-144.2	90.2	161.4	-103.3	-85.5	0	0	0	110.9	M47	M47-F49 VanDerWaalsContact C-N 3.28Å; M47-F49 PolarHBondContact O-N 3.34Å; M47-F49 VanDerWaalsContact O-N 3.1Å
50	T	33.1	Very low	38.1	Very low	130 Å²	130	141.2 Å²	141.2	80%	0.798	74%	0.741	S	S	*	*			trans	-82.8	141.2	165.7	49.8	0	0	0	0	111.4
51	S	31.3	Very low	36.9	Very low	107 Å²	107	142.4 Å²	142.4	75%	0.748	76%	0.758	S	S	*	*			trans	101.2	102.7	157.3	-65.5	0	0	0	0	119.2
52	N	34.5	Very low	35.9	Very low	160 Å²	160	147.7 Å²	147.7	86%	0.856	77%	0.773	S	S	*	*			trans	64.1	96.2	139.1	-70.9	-4.8	0	0	0	119.9
53	S	33.6	Very low	35.2	Very low	109 Å²	109	145.9 Å²	145.9	76%	0.762	78%	0.779	S	S	*	*			trans	-169.2	109.5	130.1	-169.8	0	0	0	0	111.2	R55	S53-R55 PolarHBondContact O-N 2.89Å; S53-R55 VanDerWaalsContact O-N 3.1Å
54	N	37.3	Very low	34.7	Very low	175 Å²	175	149 Å²	149	94%	0.936	79%	0.785	S	S	*	*			trans	-72.4	94	164.2	-87.5	-16.8	0	0	0	108.9
55	R	36.4	Very low	34.5	Very low	224 Å²	224	149.9 Å²	149.9	85%	0.845	78%	0.784	S	S	*	*			trans	-155.7	111.7	161.2	-110.4	170.9	175.9	177.1	-1.3	110.1	S53 S57	S53-R55 PolarHBondContact O-N 2.89Å; S53-R55 VanDerWaalsContact O-N 3.1Å; R55-S57 PolarHBondContact O-N 2.82Å
56	I	36.7	Very low	34.2	Very low	183 Å²	183	154.5 Å²	154.5	94%	0.938	79%	0.789	S	S	*	*			trans	-67	102.8	173.9	-62.3	167.6	0	0	0	108
57	S	31.8	Very low	34.3	Very low	104 Å²	104	158.4 Å²	158.4	73%	0.727	80%	0.8	S	S	*	*			trans	-99.2	126.4	165.8	56.1	0	0	0	0	109.2	R55 I59	R55-S57 PolarHBondContact O-N 2.82Å; S57-I59 PolarHBondContact O-N 3.06Å
58	R	35.2	Very low	34.5	Very low	245 Å²	245	153.6 Å²	153.6	93%	0.925	78%	0.783	S	S	*	*			trans	-39	133.6	176.2	-73.5	174.5	171.1	172.4	-3.9	112.1	G60	R58-G60 PolarHBondContact O-N 3.46Å
59	I	35	Very low	34.6	Very low	163 Å²	163	157.4 Å²	157.4	84%	0.836	79%	0.792	S	S	*	*			trans	-60.8	97.8	175.6	-61.3	166.9	0	0	0	108.4	S57	S57-I59 PolarHBondContact O-N 3.06Å
60	G	33.9	Very low	35.5	Very low	57 Å²	57	157 Å²	157	59%	0.588	78%	0.784	S	S	*	*			trans	-79.4	129.6	156.1	0	0	0	0	0	107.9	R58 K62	R58-G60 PolarHBondContact O-N 3.46Å; G60-K62 VanDerWaalsContact C-N 3.34Å; G60-K62 PolarHBondContact O-N 3.34Å
61	N	35.6	Very low	36.7	Very low	166 Å²	166	151.4 Å²	151.4	89%	0.888	75%	0.753	S	S	*	*			trans	-54.2	93.6	173.9	-92.5	-4	0	0	0	110.3	S63	N61-S63 PolarHBondContact O-N 2.68Å
62	K	32	Very low	38.1	Very low	199 Å²	199	154.6 Å²	154.6	87%	0.865	75%	0.75	S	S	*	*			trans	-90.8	98.7	162.3	-73.3	-172.4	178.7	-179.8	0	106.9	G60 R64	G60-K62 VanDerWaalsContact C-N 3.34Å; G60-K62 PolarHBondContact O-N 3.34Å; K62-R64 PolarHBondContact O-N 2.71Å; K62-R64 VanDerWaalsContact O-N 3.11Å
63	S	31.8	Very low	39.6	Very low	82 Å²	82	151.9 Å²	151.9	57%	0.573	73%	0.734	S	S	*	*			trans	-42	115.1	166.7	174.9	0	0	0	0	109.3	N61 I65	N61-S63 PolarHBondContact O-N 2.68Å; S63-I65 PolarHBondContact O-N 3.11Å
64	R	35.1	Very low	41.7	Very low	195 Å²	195	146.9 Å²	146.9	74%	0.736	70%	0.699	S	S	*	*			trans	-56.5	113.3	167	-75.8	177.8	176.7	160.4	-0.3	105.6	E43 K62 R66	E43-R64 IonicContact OE1-CZ 3.1Å; E43-R64 IonicContact OE1-NH1 3.48Å; E43-R64 PolarHBondContact OE1-NH1 3.06Å; E43-R64 IonicContact OE1-NH2 2.79Å; E43-R64 PolarHBondContact OE1-NH2 3.3Å; K62-R64 PolarHBondContact O-N 2.71Å; K62-R64 VanDerWaalsContact O-N 3.11Å; R64-R66 PolarHBondContact O-N 2.79Å
65	I	36	Very low	43.7	Very low	144 Å²	144	140.3 Å²	140.3	74%	0.738	66%	0.663	S	S	*	*			trans	-65.3	83.1	165.3	-61	170.7	0	0	0	106.1	S63 K67	S63-I65 PolarHBondContact O-N 3.11Å; I65-K67 PolarHBondContact O-N 3.47Å
66	R	33.4	Very low	45.8	Very low	218 Å²	218	129.8 Å²	129.8	82%	0.823	62%	0.623	S	S	*	*			trans	-52.1	128.7	150.7	-94.2	179.5	161.2	170.7	-5.5	104.4	R64 S68	R64-R66 PolarHBondContact O-N 2.79Å; R66-S68 PolarHBondContact O-N 2.91Å
67	K	35.9	Very low	48.1	Very low	209 Å²	209	121.8 Å²	121.8	91%	0.909	58%	0.584	S	S	*	*			trans	-60.3	84.3	161.2	-77.3	179.1	178.9	174.6	0	106.2	I65 E69	I65-K67 PolarHBondContact O-N 3.47Å; K67-E69 PolarHBondContact O-N 2.71Å
68	S	37.7	Very low	50.7	Low	71 Å²	71	120.8 Å²	120.8	50%	0.497	57%	0.567	S	S	.	*			trans	-59.4	132.7	164.6	40.3	0	0	0	0	105.9	R66 R70	R66-S68 PolarHBondContact O-N 2.91Å; S68-R70 PolarHBondContact O-N 3.48Å
69	E	40.3	Very low	53.2	Low	159 Å²	159	109.1 Å²	109.1	74%	0.743	52%	0.523	S	S	*	.			trans	-50.3	92.5	165	-70.5	169.7	179.2	0	0	108.4	K67 G71 K243	K67-E69 PolarHBondContact O-N 2.71Å; E69-G71 PolarHBondContact O-N 3.02Å; E69-K243 IonicContact OE2-NZ 2.59Å; E69-K243 PolarHBondContact OE2-NZ 2.93Å
70	R	49.6	Very low	55.9	Low	196 Å²	196	101.3 Å²	101.3	74%	0.74	48%	0.483	S	S	*	.			trans	-71.6	102.1	178.8	-76	-179.4	-175	-178.1	0.7	105.8	S68	S68-R70 PolarHBondContact O-N 3.48Å
71	G	56.7	Low	58.7	Low	14 Å²	14	102.7 Å²	102.7	14%	0.144	47%	0.474	C	S	.	.			trans	-52.9	144.9	162.8	0	0	0	0	0	109.3	E69 E241	E69-G71 PolarHBondContact O-N 3.02Å; G71-E241 CarbonylContact C-O 3.56Å; G71-E241 WeakPolarHBondContact CA-O 3.04Å
72	Y	61.2	Low	61.4	Low	173 Å²	173	97.2 Å²	97.2	68%	0.678	44%	0.443	S	S	*	.			trans	-61.3	151.9	178.2	-78.5	-70.4	0	0	0	110	W74 E241	Y72-W74 VanDerWaalsContact O-CD1 3.3Å; Y72-W74 PolarHBondContact O-N 2.9Å; Y72-E241 HydrophobicContact CD2-CB 3.5Å; Y72-E241 VanDerWaalsContact CD2-CB 3.5Å; Y72-E241 HydrophobicContact CD2-CG 3.87Å; Y72-E241 HydrophobicContact CE2-CB 4.11Å; Y72-E241 HydrophobicContact CE2-CG 3.94Å; Y72-E241 HydrophobicContact CG-CB 4.48Å; Y72-E241 PolarHBondContact N-O 3.19Å; Y72-E241 VanDerWaalsContact N-O 3.08Å
73	I	66.1	Low	64.3	Low	103 Å²	103	87.7 Å²	87.7	53%	0.528	40%	0.402	S	S	.	.			trans	-79.3	115.9	165.9	-61.8	173.8	0	0	0	106	R129 F130 R131	I73-R129 HydrophobicContact CG2-CB 4.3Å; I73-R129 HydrophobicContact CG2-CG 4.44Å; I73-F130 WeakPolarHBondContact CA-O 3.32Å; I73-R131 HydrophobicContact CD1-CG 4.46Å
74	W	78.5	Confident	67.3	Low	5 Å²	5	84.2 Å²	84.2	2%	0.019	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	159.3	-178.9	63.5	-83.6	0	0	0	110.7	Y72 E78 G79 F130 M242 L244 F252	Y72-W74 VanDerWaalsContact O-CD1 3.3Å; Y72-W74 PolarHBondContact O-N 2.9Å; W74-E78 VanDerWaalsContact CA-OE2 3.23Å; W74-E78 WeakPolarHBondContact CA-OE2 3.18Å; W74-E78 WeakPolarHBondContact CB-OE2 3.31Å; W74-E78 HydrophobicContact CE3-CB 4.45Å; W74-G79 VanDerWaalsContact CZ3-CA 3.49Å; W74-F130 HydrophobicContact CD2-CB 4.22Å; W74-F130 HydrophobicContact CD2-CD2 4.04Å; W74-F130 HydrophobicContact CD2-CG 4.37Å; W74-F130 AromaticContact CE2-CD2 3.87Å; W74-F130 AromaticContact CE2-CG 3.86Å; W74-F130 HydrophobicContact CE3-CD2 4.01Å; W74-F130 HydrophobicContact CG-CB 4.38Å; W74-F130 AromaticContact CH2-CD2 3.66Å; W74-F130 HydrophobicContact CH2-CD2 3.66Å; W74-F130 AromaticContact CH2-CE2 3.7Å; W74-F130 HydrophobicContact CH2-CE2 3.7Å; W74-F130 HydrophobicContact CH2-CG 4.2Å; W74-F130 HydrophobicContact CH2-CZ 4.26Å; W74-F130 HydrophobicContact CZ2-CB 4.23Å; W74-F130 HydrophobicContact CZ2-CD1 4.27Å; W74-F130 AromaticContact CZ2-CD2 3.73Å; W74-F130 HydrophobicContact CZ2-CD2 3.73Å; W74-F130 HydrophobicContact CZ2-CE2 4.15Å; W74-F130 AromaticContact CZ2-CG 3.8Å; W74-F130 HydrophobicContact CZ2-CG 3.8Å; W74-F130 AromaticContact CZ3-CD2 3.79Å; W74-F130 HydrophobicContact CZ3-CD2 3.79Å; W74-F130 AromaticContact CZ3-CE2 3.91Å; W74-F130 HydrophobicContact CZ3-CE2 3.91Å; W74-F130 PolarHBondContact O-N 3.23Å; W74-M242 HydrophobicContact CB-CE 4.1Å; W74-M242 HydrophobicContact CB-CG 4.44Å; W74-M242 HydrophobicContact CD2-CB 4.22Å; W74-M242 HydrophobicContact CD2-CG 3.96Å; W74-M242 HydrophobicContact CD2-SD 4.12Å; W74-M242 HydrophobicContact CE3-SD 4.17Å; W74-M242 HydrophobicContact CG-CB 4.41Å; W74-M242 HydrophobicContact CG-CE 4.36Å; W74-M242 HydrophobicContact CG-CG 3.87Å; W74-M242 HydrophobicContact CG-SD 4.38Å; W74-M242 HydrophobicContact CZ2-CB 4.19Å; W74-L244 HydrophobicContact CH2-CD2 3.6Å; W74-L244 HydrophobicContact CZ2-CD2 3.63Å; W74-L244 HydrophobicContact CZ2-CG 4.36Å; W74-F252 AromaticContact CH2-CE2 3.77Å; W74-F252 HydrophobicContact CH2-CE2 3.77Å; W74-F252 AromaticContact CH2-CZ 3.84Å; W74-F252 HydrophobicContact CH2-CZ 3.84Å; W74-F252 HydrophobicContact CZ3-CE2 4.3Å; W74-F252 AromaticContact CZ3-CZ 3.98Å; W74-F252 HydrophobicContact CZ3-CZ 3.98Å
75	M	78.7	Confident	70.1	Confident	36 Å²	36	79.1 Å²	79.1	18%	0.177	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	144.8	-177.3	-66.4	-69.9	-58.4	0	0	110.6	C77 E78 R129	M75-C77 PolarHBondContact O-N 3.08Å; M75-E78 HydrophobicContact CB-CG 4.09Å; M75-E78 PolarHBondContact N-OE2 3.05Å; M75-E78 WeakPolarHBondContact O-CA 3.24Å; M75-E78 VanDerWaalsContact O-CB 3.31Å; M75-E78 WeakPolarHBondContact O-CB 3.03Å; M75-E78 PolarHBondContact O-N 3.41Å; M75-R129 HydrophobicContact SD-CG 3.73Å
76	L	80.6	Confident	72.9	Confident	3 Å²	3	73.8 Å²	73.8	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-48.8	-40.4	178	-178.2	70	0	0	0	113.8	E78 G79 F80 L128 F130 L194 L251 F252	L76-E78 VanDerWaalsContact C-N 3.3Å; L76-E78 PolarHBondContact O-N 2.79Å; L76-G79 PolarHBondContact O-N 3.28Å; L76-F80 HydrophobicContact CD1-CD2 4.28Å; L76-F80 HydrophobicContact CD1-CE2 3.77Å; L76-F80 HydrophobicContact CD2-CE2 4.26Å; L76-F80 HydrophobicContact CG-CD2 4.04Å; L76-F80 HydrophobicContact CG-CE2 3.81Å; L76-F80 WeakPolarHBondContact O-CD2 3.1Å; L76-F80 PolarHBondContact O-N 3.04Å; L76-L128 HydrophobicContact CD2-CD1 4.28Å; L76-F130 HydrophobicContact CB-CE2 3.98Å; L76-F130 HydrophobicContact CD1-CE2 3.65Å; L76-F130 HydrophobicContact CD1-CZ 3.88Å; L76-F130 HydrophobicContact CG-CE2 4.45Å; L76-L194 HydrophobicContact CD2-CD2 4.34Å; L76-L251 HydrophobicContact CD1-CD1 4.02Å; L76-L251 HydrophobicContact CD2-CD1 3.59Å; L76-L251 HydrophobicContact CG-CD1 4.47Å; L76-F252 HydrophobicContact CD1-CD2 4.43Å; L76-F252 HydrophobicContact CD1-CE2 3.43Å; L76-F252 VanDerWaalsContact CD1-CE2 3.43Å; L76-F252 HydrophobicContact CD1-CZ 3.56Å
77	C	84.5	Confident	75.8	Confident	16 Å²	16	63.4 Å²	63.4	11%	0.108	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-30.9	176.7	54.5	0	0	0	0	113.9	M75 F80 Q81 W109 L113	M75-C77 PolarHBondContact O-N 3.08Å; C77-F80 PolarHBondContact O-N 3.26Å; C77-Q81 WeakPolarHBondContact O-CB 3.35Å; C77-Q81 PolarHBondContact O-N 2.64Å; C77-W109 HydrophobicContact CB-CH2 4.2Å; C77-W109 HydrophobicContact CB-CZ2 4.17Å; C77-W109 WeakPolarHBondContact O-CZ2 3.26Å; C77-L113 HydrophobicContact CB-CD2 3.74Å
78	E	87.2	Confident	78.7	Confident	82 Å²	82	53.4 Å²	53.4	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-67.7	-38.9	177.4	-65.4	168.6	168.4	0	0	111	W74 M75 L76 Q81 F82 M242	W74-E78 VanDerWaalsContact CA-OE2 3.23Å; W74-E78 WeakPolarHBondContact CA-OE2 3.18Å; W74-E78 WeakPolarHBondContact CB-OE2 3.31Å; W74-E78 HydrophobicContact CE3-CB 4.45Å; M75-E78 HydrophobicContact CB-CG 4.09Å; M75-E78 PolarHBondContact N-OE2 3.05Å; M75-E78 WeakPolarHBondContact O-CA 3.24Å; M75-E78 VanDerWaalsContact O-CB 3.31Å; M75-E78 WeakPolarHBondContact O-CB 3.03Å; M75-E78 PolarHBondContact O-N 3.41Å; L76-E78 VanDerWaalsContact C-N 3.3Å; L76-E78 PolarHBondContact O-N 2.79Å; E78-Q81 WeakPolarHBondContact O-CB 3.42Å; E78-Q81 PolarHBondContact O-N 3.09Å; E78-F82 PolarHBondContact O-N 3.29Å; E78-M242 HydrophobicContact CB-CE 4.19Å
79	G	88.1	Confident	81.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-43.2	174.2	0	0	0	0	0	112.4	W74 L76 Q81 F82 I83	W74-G79 VanDerWaalsContact CZ3-CA 3.49Å; L76-G79 PolarHBondContact O-N 3.28Å; G79-Q81 VanDerWaalsContact C-N 3.33Å; G79-Q81 PolarHBondContact O-N 3.48Å; G79-F82 PolarHBondContact O-N 3.37Å; G79-I83 WeakPolarHBondContact O-CG1 3.37Å; G79-I83 PolarHBondContact O-N 2.97Å
80	F	91.1	Very high	84	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-33	174.7	-77	-66.4	0	0	0	113	L76 C77 F82 I83 L84 W109 M195 M197 T200 L251 F252	L76-F80 HydrophobicContact CD1-CD2 4.28Å; L76-F80 HydrophobicContact CD1-CE2 3.77Å; L76-F80 HydrophobicContact CD2-CE2 4.26Å; L76-F80 HydrophobicContact CG-CD2 4.04Å; L76-F80 HydrophobicContact CG-CE2 3.81Å; L76-F80 WeakPolarHBondContact O-CD2 3.1Å; L76-F80 PolarHBondContact O-N 3.04Å; C77-F80 PolarHBondContact O-N 3.26Å; F80-F82 VanDerWaalsContact C-N 3.32Å; F80-I83 PolarHBondContact O-N 2.83Å; F80-L84 WeakPolarHBondContact O-CB 3.4Å; F80-L84 WeakPolarHBondContact O-CG 3.39Å; F80-L84 PolarHBondContact O-N 3.26Å; F80-W109 HydrophobicContact CB-CH2 4.29Å; F80-M195 HydrophobicContact CB-CB 4.44Å; F80-M195 HydrophobicContact CB-CG 3.74Å; F80-M195 HydrophobicContact CD1-CG 3.65Å; F80-M195 HydrophobicContact CD2-CB 3.61Å; F80-M195 HydrophobicContact CD2-CG 3.6Å; F80-M195 HydrophobicContact CE1-CG 4.11Å; F80-M195 HydrophobicContact CE2-CB 3.88Å; F80-M195 HydrophobicContact CE2-CG 4.05Å; F80-M195 VanDerWaalsContact CE2-O 3.3Å; F80-M195 WeakPolarHBondContact CE2-O 3.38Å; F80-M195 HydrophobicContact CG-CB 3.95Å; F80-M195 HydrophobicContact CG-CG 3.37Å; F80-M195 HydrophobicContact CZ-CB 4.46Å; F80-M195 HydrophobicContact CZ-CG 4.29Å; F80-M195 WeakPolarHBondContact CZ-O 3.41Å; F80-M197 HydrophobicContact CD1-SD 4.35Å; F80-M197 HydrophobicContact CE1-CG 4.3Å; F80-M197 HydrophobicContact CE1-SD 3.83Å; F80-T200 HydrophobicContact CD1-CG2 3.77Å; F80-T200 HydrophobicContact CE1-CG2 4.34Å; F80-L251 HydrophobicContact CZ-CB 4.22Å; F80-F252 HydrophobicContact CD1-CD1 4.29Å; F80-F252 AromaticContact CD1-CE1 3.89Å; F80-F252 HydrophobicContact CD1-CE1 3.89Å; F80-F252 AromaticContact CD2-CE1 3.9Å; F80-F252 HydrophobicContact CD2-CE1 3.9Å; F80-F252 HydrophobicContact CD2-CZ 4.12Å; F80-F252 AromaticContact CE1-CD1 3.93Å; F80-F252 HydrophobicContact CE1-CD1 3.93Å; F80-F252 AromaticContact CE1-CE1 3.87Å; F80-F252 HydrophobicContact CE1-CE1 3.87Å; F80-F252 HydrophobicContact CE2-CD1 4.49Å; F80-F252 AromaticContact CE2-CE1 3.89Å; F80-F252 HydrophobicContact CE2-CE1 3.89Å; F80-F252 HydrophobicContact CE2-CZ 4.05Å; F80-F252 AromaticContact CG-CE1 3.91Å; F80-F252 HydrophobicContact CG-CE1 3.91Å; F80-F252 HydrophobicContact CZ-CD1 4.04Å; F80-F252 AromaticContact CZ-CE1 3.87Å; F80-F252 HydrophobicContact CZ-CE1 3.87Å; F80-F252 HydrophobicContact CZ-CZ 4.38Å
81	Q	92.7	Very high	86.1	Confident	85 Å²	85	35 Å²	35	40%	0.397	17%	0.168	S	C	.	.	H	α-helix	trans	-61.7	-43.3	173.1	179.9	172.3	-44.6	0	0	111	C77 E78 G79 L84 Q85 W109	C77-Q81 WeakPolarHBondContact O-CB 3.35Å; C77-Q81 PolarHBondContact O-N 2.64Å; E78-Q81 WeakPolarHBondContact O-CB 3.42Å; E78-Q81 PolarHBondContact O-N 3.09Å; G79-Q81 VanDerWaalsContact C-N 3.33Å; G79-Q81 PolarHBondContact O-N 3.48Å; Q81-L84 PolarHBondContact O-N 3.44Å; Q81-Q85 WeakPolarHBondContact O-CB 3.5Å; Q81-Q85 PolarHBondContact O-N 2.95Å; Q81-W109 HydrophobicContact CB-CZ2 3.9Å; Q81-W109 VanDerWaalsContact OE1-NE1 3.08Å
82	F	92	Very high	87.9	Confident	51 Å²	51	36.6 Å²	36.6	22%	0.224	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-44.9	176.3	-171.7	-88.4	0	0	0	111.8	E78 G79 F80 Q85 N86 D237 L238 P239	E78-F82 PolarHBondContact O-N 3.29Å; G79-F82 PolarHBondContact O-N 3.37Å; F80-F82 VanDerWaalsContact C-N 3.32Å; F82-Q85 WeakPolarHBondContact O-CB 3.36Å; F82-Q85 PolarHBondContact O-N 3.42Å; F82-N86 WeakPolarHBondContact CE1-ND2 3.23Å; F82-N86 PolarHBondContact O-N 3.45Å; F82-D237 HydrophobicContact CE1-CB 4.14Å; F82-D237 WeakPolarHBondContact CE1-O 3.17Å; F82-D237 VanDerWaalsContact CZ-O 3.24Å; F82-D237 WeakPolarHBondContact CZ-O 3.38Å; F82-L238 HydrophobicContact CB-CD2 3.98Å; F82-L238 HydrophobicContact CD1-CD2 3.65Å; F82-L238 HydrophobicContact CD1-CG 4.46Å; F82-L238 HydrophobicContact CE1-CD2 4.43Å; F82-L238 HydrophobicContact CG-CD2 4.02Å; F82-P239 HydrophobicContact CD2-CG 4.41Å; F82-P239 HydrophobicContact CE2-CG 3.98Å; F82-P239 HydrophobicContact CZ-CG 4.29Å
83	I	93	Very high	89.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.3	-47	176.1	-69.3	171.4	0	0	0	111.3	G79 F80 Q85 N86 Q87 M197 A234 F252	G79-I83 WeakPolarHBondContact O-CG1 3.37Å; G79-I83 PolarHBondContact O-N 2.97Å; F80-I83 PolarHBondContact O-N 2.83Å; I83-Q85 VanDerWaalsContact C-N 3.28Å; I83-Q85 PolarHBondContact O-N 3.25Å; I83-N86 PolarHBondContact O-N 3.4Å; I83-Q87 HydrophobicContact CG2-CG 4.39Å; I83-Q87 WeakPolarHBondContact O-CB 3.22Å; I83-Q87 VanDerWaalsContact O-CG 3.28Å; I83-Q87 WeakPolarHBondContact O-CG 3.48Å; I83-Q87 PolarHBondContact O-N 3.32Å; I83-M197 HydrophobicContact CD1-CE 4.39Å; I83-M197 HydrophobicContact CD1-SD 3.81Å; I83-M197 HydrophobicContact CG2-CE 3.99Å; I83-M197 HydrophobicContact CG2-SD 4.26Å; I83-A234 HydrophobicContact CD1-CB 4.43Å; I83-A234 HydrophobicContact CG1-CB 4.21Å; I83-A234 HydrophobicContact CG2-CB 3.96Å; I83-F252 HydrophobicContact CD1-CD1 3.47Å; I83-F252 VanDerWaalsContact CD1-CD1 3.47Å; I83-F252 HydrophobicContact CD1-CE1 3.83Å
84	L	95.1	Very high	90.6	Very high	8 Å²	8	36 Å²	36	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-40.1	176.6	-83	168.8	0	0	0	111.7	F80 Q81 Q87 A88 W109 T200 L203 I204	F80-L84 WeakPolarHBondContact O-CB 3.4Å; F80-L84 WeakPolarHBondContact O-CG 3.39Å; F80-L84 PolarHBondContact O-N 3.26Å; Q81-L84 PolarHBondContact O-N 3.44Å; L84-Q87 PolarHBondContact O-N 2.89Å; L84-A88 WeakPolarHBondContact O-CB 3.09Å; L84-A88 PolarHBondContact O-N 3.4Å; L84-W109 HydrophobicContact CD1-CD2 4Å; L84-W109 HydrophobicContact CD1-CE3 3.7Å; L84-W109 HydrophobicContact CD1-CZ3 4.05Å; L84-T200 HydrophobicContact CD2-CG2 4.28Å; L84-T200 HydrophobicContact CG-CG2 4.18Å; L84-L203 HydrophobicContact CD1-CD2 4.04Å; L84-L203 HydrophobicContact CD2-CD2 4.41Å; L84-I204 HydrophobicContact CD2-CD1 4.16Å; L84-I204 HydrophobicContact CD2-CG1 4.06Å
85	Q	94	Very high	91.2	Very high	89 Å²	89	38.8 Å²	38.8	42%	0.416	20%	0.198	S	C	.	.	H	α-helix	trans	-63.9	-46.6	176.7	-177.8	172.3	-10.1	0	0	111.3	Q81 F82 I83 Q87 A88 D89	Q81-Q85 WeakPolarHBondContact O-CB 3.5Å; Q81-Q85 PolarHBondContact O-N 2.95Å; F82-Q85 WeakPolarHBondContact O-CB 3.36Å; F82-Q85 PolarHBondContact O-N 3.42Å; I83-Q85 VanDerWaalsContact C-N 3.28Å; I83-Q85 PolarHBondContact O-N 3.25Å; Q85-Q87 VanDerWaalsContact C-N 3.33Å; Q85-Q87 PolarHBondContact O-N 3.25Å; Q85-A88 PolarHBondContact O-N 2.84Å; Q85-D89 WeakPolarHBondContact O-CB 3.49Å; Q85-D89 VanDerWaalsContact O-CG 3.28Å; Q85-D89 PolarHBondContact O-N 3.01Å
86	N	94.1	Very high	91.8	Very high	31 Å²	31	37.5 Å²	37.5	17%	0.166	19%	0.192	C	C	.	.	H	α-helix	trans	-62.9	-40	177.1	-74.4	0.4	0	0	0	112.5	F82 I83 D89 A90 P230 D237	F82-N86 WeakPolarHBondContact CE1-ND2 3.23Å; F82-N86 PolarHBondContact O-N 3.45Å; I83-N86 PolarHBondContact O-N 3.4Å; N86-D89 PolarHBondContact O-N 3.33Å; N86-A90 WeakPolarHBondContact O-CB 3.31Å; N86-A90 PolarHBondContact O-N 2.75Å; N86-P230 HydrophobicContact CB-CG 4.15Å; N86-D237 WeakPolarHBondContact ND2-CB 3.01Å
87	Q	95.8	Very high	92.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-43.8	175.1	-72.7	175.3	-22.8	0	0	111.6	I83 L84 Q85 A90 L91 T200 I204 V229 P230	I83-Q87 HydrophobicContact CG2-CG 4.39Å; I83-Q87 WeakPolarHBondContact O-CB 3.22Å; I83-Q87 VanDerWaalsContact O-CG 3.28Å; I83-Q87 WeakPolarHBondContact O-CG 3.48Å; I83-Q87 PolarHBondContact O-N 3.32Å; L84-Q87 PolarHBondContact O-N 2.89Å; Q85-Q87 VanDerWaalsContact C-N 3.33Å; Q85-Q87 PolarHBondContact O-N 3.25Å; Q87-A90 WeakPolarHBondContact O-CB 3.38Å; Q87-A90 PolarHBondContact O-N 3.11Å; Q87-L91 WeakPolarHBondContact O-CG 3.4Å; Q87-L91 PolarHBondContact O-N 2.77Å; Q87-T200 PolarHBondContact NE2-OG1 3Å; Q87-T200 PolarHBondContact OE1-OG1 3.18Å; Q87-I204 HydrophobicContact CB-CD1 3.44Å; Q87-I204 VanDerWaalsContact CB-CD1 3.44Å; Q87-I204 HydrophobicContact CG-CD1 4.18Å; Q87-I204 VanDerWaalsContact OE1-CD1 3.22Å; Q87-V229 HydrophobicContact CB-CG1 4.13Å; Q87-V229 HydrophobicContact CG-CG1 3.99Å; Q87-P230 HydrophobicContact CG-CG 4.18Å; Q87-P230 WeakPolarHBondContact CG-O 3.38Å; Q87-P230 PolarHBondContact NE2-O 2.88Å
88	A	95.8	Very high	92.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-44.3	176.2	0	0	0	0	0	111.8	L84 Q85 A90 L91 L92 F100 K101 L105	L84-A88 WeakPolarHBondContact O-CB 3.09Å; L84-A88 PolarHBondContact O-N 3.4Å; Q85-A88 PolarHBondContact O-N 2.84Å; A88-A90 VanDerWaalsContact C-N 3.27Å; A88-A90 PolarHBondContact O-N 3.11Å; A88-L91 WeakPolarHBondContact O-CB 3.44Å; A88-L91 PolarHBondContact O-N 2.6Å; A88-L91 VanDerWaalsContact O-N 3.08Å; A88-L92 WeakPolarHBondContact O-CG 2.95Å; A88-L92 PolarHBondContact O-N 2.92Å; A88-F100 HydrophobicContact CB-CE1 4.42Å; A88-K101 HydrophobicContact CB-CB 4.45Å; A88-K101 HydrophobicContact CB-CD 4.11Å; A88-K101 HydrophobicContact CB-CG 3.94Å; A88-L105 HydrophobicContact CB-CD2 3.72Å
89	D	95.1	Very high	92.9	Very high	35 Å²	35	44.3 Å²	44.3	19%	0.187	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-35.2	177.6	-73.3	-25.5	0	0	0	112.1	Q85 N86 L92 R93 K101	Q85-D89 WeakPolarHBondContact O-CB 3.49Å; Q85-D89 VanDerWaalsContact O-CG 3.28Å; Q85-D89 PolarHBondContact O-N 3.01Å; N86-D89 PolarHBondContact O-N 3.33Å; D89-L92 PolarHBondContact O-N 3.07Å; D89-R93 WeakPolarHBondContact O-CG 3.42Å; D89-R93 PolarHBondContact O-N 2.67Å; D89-R93 VanDerWaalsContact O-N 3.09Å; D89-K101 WeakPolarHBondContact OD1-CE 3.47Å; D89-K101 IonicContact OD1-NZ 3.82Å; D89-K101 PolarHBondContact OD1-NZ 2.84Å; D89-K101 IonicContact OD2-NZ 3.42Å
90	A	94	Very high	93.2	Very high	4 Å²	4	44.3 Å²	44.3	3%	0.033	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-44.3	171.6	0	0	0	0	0	112.1	N86 Q87 A88 R93 L94 H228 V229	N86-A90 WeakPolarHBondContact O-CB 3.31Å; N86-A90 PolarHBondContact O-N 2.75Å; Q87-A90 WeakPolarHBondContact O-CB 3.38Å; Q87-A90 PolarHBondContact O-N 3.11Å; A88-A90 VanDerWaalsContact C-N 3.27Å; A88-A90 PolarHBondContact O-N 3.11Å; A90-R93 PolarHBondContact O-N 3.46Å; A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 2.72Å; A90-H228 WeakPolarHBondContact CB-O 3.35Å; A90-V229 HydrophobicContact CB-CG2 4.43Å
91	L	94.8	Very high	93.3	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-36.6	176.6	-68.5	172.5	0	0	0	112.7	Q87 A88 R93 L94 G95 V96 F100 I204 L215 L220 L223 V229	Q87-L91 WeakPolarHBondContact O-CG 3.4Å; Q87-L91 PolarHBondContact O-N 2.77Å; A88-L91 WeakPolarHBondContact O-CB 3.44Å; A88-L91 PolarHBondContact O-N 2.6Å; A88-L91 VanDerWaalsContact O-N 3.08Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 3.22Å; L91-L94 HydrophobicContact CD2-CD1 4.47Å; L91-L94 CarbonylContact O-C 3.55Å; L91-L94 WeakPolarHBondContact O-CB 3.44Å; L91-L94 PolarHBondContact O-N 2.6Å; L91-L94 VanDerWaalsContact O-N 3.1Å; L91-G95 PolarHBondContact O-N 3.01Å; L91-V96 HydrophobicContact CB-CB 4.31Å; L91-V96 HydrophobicContact CB-CG2 4.01Å; L91-V96 WeakPolarHBondContact O-CB 3.25Å; L91-V96 WeakPolarHBondContact O-CG2 3.19Å; L91-V96 PolarHBondContact O-N 3.49Å; L91-F100 HydrophobicContact CD1-CE1 4.14Å; L91-F100 HydrophobicContact CD1-CZ 4.19Å; L91-I204 HydrophobicContact CD1-CG2 3.6Å; L91-L215 HydrophobicContact CD2-CD1 4.08Å; L91-L220 HydrophobicContact CD1-CD1 4.46Å; L91-L220 HydrophobicContact CD2-CD1 4.42Å; L91-L223 HydrophobicContact CD2-CD1 4.1Å; L91-V229 HydrophobicContact CD2-CG2 3.75Å; L91-V229 HydrophobicContact CG-CG2 4.16Å
92	L	94.5	Very high	93.2	Very high	48 Å²	48	46.2 Å²	46.2	25%	0.251	25%	0.246	S	C	.	.	H	α-helix	trans	-62.7	-40.2	173.9	-66.2	-176.9	0	0	0	112	A88 D89 L94 G95 V96 K101	A88-L92 WeakPolarHBondContact O-CG 2.95Å; A88-L92 PolarHBondContact O-N 2.92Å; D89-L92 PolarHBondContact O-N 3.07Å; L92-L94 PolarHBondContact O-N 3.12Å; L92-G95 PolarHBondContact O-N 3.08Å; L92-V96 VanDerWaalsContact CD2-O 3.28Å; L92-V96 WeakPolarHBondContact CD2-O 3.44Å; L92-K101 HydrophobicContact CD1-CB 4.25Å; L92-K101 HydrophobicContact CD1-CD 3.6Å; L92-K101 HydrophobicContact CD2-CB 4.49Å
93	R	93.3	Very high	93.2	Very high	190 Å²	190	48 Å²	48	72%	0.717	26%	0.258	S	S	*	.	H	α-helix	trans	-63.5	-23.8	174.4	-68.4	179.1	-146.7	113.2	4.2	112.9	D89 A90 L91 G95	D89-R93 WeakPolarHBondContact O-CG 3.42Å; D89-R93 PolarHBondContact O-N 2.67Å; D89-R93 VanDerWaalsContact O-N 3.09Å; A90-R93 PolarHBondContact O-N 3.46Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 3.22Å; R93-G95 VanDerWaalsContact C-N 3.34Å
94	L	90.6	Very high	93.3	Very high	72 Å²	72	48.7 Å²	48.7	38%	0.377	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.2	176	-63.5	172.8	0	0	0	113.3	A90 L91 L92 L223 H228 A453	A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 2.72Å; L91-L94 HydrophobicContact CD2-CD1 4.47Å; L91-L94 CarbonylContact O-C 3.55Å; L91-L94 WeakPolarHBondContact O-CB 3.44Å; L91-L94 PolarHBondContact O-N 2.6Å; L91-L94 VanDerWaalsContact O-N 3.1Å; L92-L94 PolarHBondContact O-N 3.12Å; L94-L223 HydrophobicContact CD1-CD1 3.86Å; L94-L223 HydrophobicContact CD1-CD2 3.9Å; L94-L223 HydrophobicContact CD1-CG 4.42Å; L94-H228 HydrophobicContact CD1-CB 4.2Å; L94-A453 HydrophobicContact CD2-CB 3.61Å
95	G	89.8	Confident	93.3	Very high	65 Å²	65	48.7 Å²	48.7	67%	0.67	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.3	8.1	173.3	0	0	0	0	0	116	L91 L92 R93	L91-G95 PolarHBondContact O-N 3.01Å; L92-G95 PolarHBondContact O-N 3.08Å; R93-G95 VanDerWaalsContact C-N 3.34Å
96	V	91.9	Very high	93.3	Very high	9 Å²	9	46.4 Å²	46.4	6%	0.055	26%	0.256	C	S	.	.			trans	-65	142.1	171.3	177	0	0	0	0	110.2	L91 L92 F100 L208 E213 L215	L91-V96 HydrophobicContact CB-CB 4.31Å; L91-V96 HydrophobicContact CB-CG2 4.01Å; L91-V96 WeakPolarHBondContact O-CB 3.25Å; L91-V96 WeakPolarHBondContact O-CG2 3.19Å; L91-V96 PolarHBondContact O-N 3.49Å; L92-V96 VanDerWaalsContact CD2-O 3.28Å; L92-V96 WeakPolarHBondContact CD2-O 3.44Å; V96-F100 HydrophobicContact CG1-CB 3.84Å; V96-F100 HydrophobicContact CG1-CD1 3.73Å; V96-F100 HydrophobicContact CG1-CG 3.82Å; V96-L208 HydrophobicContact CG1-CD2 4.14Å; V96-L208 HydrophobicContact CG2-CD2 4.49Å; V96-E213 HydrophobicContact CG1-CG 3.98Å; V96-L215 HydrophobicContact CG2-CD1 3.45Å; V96-L215 VanDerWaalsContact CG2-CD1 3.45Å
97	A	91.1	Very high	93.3	Very high	31 Å²	31	50.5 Å²	50.5	26%	0.256	27%	0.274	S	S	.	.			trans	-64.4	140.3	-175.8	0	0	0	0	0	111.8	Q99 F100 E213	A97-Q99 PolarHBondContact O-N 3.28Å; A97-Q99 VanDerWaalsContact O-N 3.09Å; A97-F100 WeakPolarHBondContact O-CB 3.38Å; A97-F100 PolarHBondContact O-N 3.44Å; A97-E213 WeakPolarHBondContact CB-OE1 3.35Å; A97-E213 PolarHBondContact N-OE1 3.49Å
98	P	92.6	Very high	93.2	Very high	81 Å²	81	51 Å²	51	53%	0.526	28%	0.276	S	S	.	.	H	α-helix	trans	-56.2	-30.6	179	-27.7	35.4	0	0	0	114.6	F100 K101 D102	P98-F100 PolarHBondContact O-N 3.15Å; P98-K101 PolarHBondContact O-N 2.87Å; P98-D102 PolarHBondContact O-N 3.48Å
99	Q	91.6	Very high	93.2	Very high	131 Å²	131	51.8 Å²	51.8	61%	0.612	28%	0.279	S	S	*	.	H	α-helix	trans	-56.3	-34.2	178	-64.7	156.4	8.2	0	0	112.2	A97 K101 D103 V104	A97-Q99 PolarHBondContact O-N 3.28Å; A97-Q99 VanDerWaalsContact O-N 3.09Å; Q99-K101 VanDerWaalsContact C-N 3.28Å; Q99-K101 PolarHBondContact O-N 3.5Å; Q99-D103 WeakPolarHBondContact O-CB 3.41Å; Q99-D103 PolarHBondContact O-N 3.3Å; Q99-V104 PolarHBondContact O-N 3.25Å
100	F	94	Very high	93.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-57.6	-42	175.4	154.5	-94.4	0	0	0	111.8	A88 L91 V96 A97 P98 V104 L105 I204 A207 L208	A88-F100 HydrophobicContact CB-CE1 4.42Å; L91-F100 HydrophobicContact CD1-CE1 4.14Å; L91-F100 HydrophobicContact CD1-CZ 4.19Å; V96-F100 HydrophobicContact CG1-CB 3.84Å; V96-F100 HydrophobicContact CG1-CD1 3.73Å; V96-F100 HydrophobicContact CG1-CG 3.82Å; A97-F100 WeakPolarHBondContact O-CB 3.38Å; A97-F100 PolarHBondContact O-N 3.44Å; P98-F100 PolarHBondContact O-N 3.15Å; F100-V104 WeakPolarHBondContact O-CB 3.49Å; F100-L105 HydrophobicContact CE1-CD2 4.29Å; F100-L105 HydrophobicContact CZ-CD2 4.17Å; F100-L105 WeakPolarHBondContact O-CB 3.43Å; F100-L105 PolarHBondContact O-N 3.35Å; F100-I204 HydrophobicContact CZ-CG2 4.13Å; F100-A207 HydrophobicContact CD2-CB 3.85Å; F100-A207 WeakPolarHBondContact CD2-O 3.39Å; F100-A207 VanDerWaalsContact CE2-C 3.43Å; F100-A207 HydrophobicContact CE2-CB 3.31Å; F100-A207 HydrophobicContact CZ-CB 4.15Å; F100-L208 HydrophobicContact CD2-CD2 3.82Å; F100-L208 HydrophobicContact CD2-CG 4.19Å; F100-L208 HydrophobicContact CE2-CB 4.26Å; F100-L208 HydrophobicContact CE2-CD2 3.61Å; F100-L208 HydrophobicContact CE2-CG 3.59Å; F100-L208 VanDerWaalsContact CE2-N 3.32Å; F100-L208 HydrophobicContact CG-CD2 4.35Å; F100-L208 HydrophobicContact CZ-CD2 4.01Å; F100-L208 HydrophobicContact CZ-CG 4.09Å
101	K	93.6	Very high	93	Very high	35 Å²	35	58.1 Å²	58.1	15%	0.152	30%	0.303	C	S	.	.	I	π-helix	trans	-75.6	-57	-178.3	-179.3	-174.8	171.3	-169.8	0	110.8	A88 D89 L92 P98 Q99 C106	A88-K101 HydrophobicContact CB-CB 4.45Å; A88-K101 HydrophobicContact CB-CD 4.11Å; A88-K101 HydrophobicContact CB-CG 3.94Å; D89-K101 WeakPolarHBondContact OD1-CE 3.47Å; D89-K101 IonicContact OD1-NZ 3.82Å; D89-K101 PolarHBondContact OD1-NZ 2.84Å; D89-K101 IonicContact OD2-NZ 3.42Å; L92-K101 HydrophobicContact CD1-CB 4.25Å; L92-K101 HydrophobicContact CD1-CD 3.6Å; L92-K101 HydrophobicContact CD2-CB 4.49Å; P98-K101 PolarHBondContact O-N 2.87Å; Q99-K101 VanDerWaalsContact C-N 3.28Å; Q99-K101 PolarHBondContact O-N 3.5Å; K101-C106 PolarHBondContact O-N 3.42Å; K101-C106 PolarHBondContact O-SG 3.38Å
102	D	91.4	Very high	92.8	Very high	91 Å²	91	58.1 Å²	58.1	49%	0.487	30%	0.303	S	S	.	.	I	π-helix	trans	-79.5	-39.4	-165.6	-64.1	-29.2	0	0	0	112.7	P98 C106	P98-D102 PolarHBondContact O-N 3.48Å; D102-C106 WeakPolarHBondContact O-CB 3.33Å
103	D	92.1	Very high	92.6	Very high	87 Å²	87	56.3 Å²	56.3	47%	0.465	29%	0.293	S	S	.	.	I	π-helix	trans	-92.3	-35.6	-176	-60.8	-35.5	0	0	0	112	Q99 Q107	Q99-D103 WeakPolarHBondContact O-CB 3.41Å; Q99-D103 PolarHBondContact O-N 3.3Å; D103-Q107 WeakPolarHBondContact O-CB 3.28Å; D103-Q107 WeakPolarHBondContact O-CG 3.34Å; D103-Q107 PolarHBondContact O-NE2 3.28Å
104	V	93.6	Very high	92.4	Very high	16 Å²	16	52 Å²	52	10%	0.097	28%	0.281	C	S	.	.	I	π-helix	trans	-102.4	-63.3	-171.3	-176.9	0	0	0	0	111.7	Q99 F100 C106 Q107 M108 A207 W210 S211	Q99-V104 PolarHBondContact O-N 3.25Å; F100-V104 WeakPolarHBondContact O-CB 3.49Å; V104-C106 PolarHBondContact O-N 3.3Å; V104-Q107 PolarHBondContact O-N 2.8Å; V104-M108 HydrophobicContact CG1-CE 3.86Å; V104-M108 HydrophobicContact CG1-SD 4.34Å; V104-M108 WeakPolarHBondContact O-CG 3.44Å; V104-M108 PolarHBondContact O-N 3.46Å; V104-A207 HydrophobicContact CG1-CB 3.83Å; V104-W210 HydrophobicContact CG1-CB 3.77Å; V104-W210 HydrophobicContact CG1-CG 3.62Å; V104-W210 VanDerWaalsContact CG2-CD1 3.49Å; V104-S211 WeakPolarHBondContact CG2-OG 3.4Å
105	L	95.8	Very high	92.2	Very high	8 Å²	8	52.2 Å²	52.2	4%	0.042	28%	0.279	C	S	.	.	I	π-helix	trans	-62.8	-44.4	-175.1	-178.7	62.8	0	0	0	111.8	A88 F100 Q107 M108 W109 L203 I204 A207	A88-L105 HydrophobicContact CB-CD2 3.72Å; F100-L105 HydrophobicContact CE1-CD2 4.29Å; F100-L105 HydrophobicContact CZ-CD2 4.17Å; F100-L105 WeakPolarHBondContact O-CB 3.43Å; F100-L105 PolarHBondContact O-N 3.35Å; L105-Q107 VanDerWaalsContact C-N 3.32Å; L105-Q107 PolarHBondContact O-N 3.45Å; L105-M108 PolarHBondContact O-N 3.02Å; L105-W109 WeakPolarHBondContact O-CB 3.37Å; L105-W109 PolarHBondContact O-N 2.95Å; L105-L203 HydrophobicContact CD1-CD2 4.1Å; L105-L203 HydrophobicContact CD1-CG 3.96Å; L105-I204 HydrophobicContact CD1-CG1 4.4Å; L105-I204 HydrophobicContact CD2-CG1 4.37Å; L105-A207 HydrophobicContact CB-CB 3.98Å; L105-A207 HydrophobicContact CD1-CB 4Å
106	C	94.1	Very high	91.9	Very high	41 Å²	41	49.3 Å²	49.3	28%	0.277	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-39.1	175.7	-78	0	0	0	0	112.6	K101 D102 V104 R110	K101-C106 PolarHBondContact O-N 3.42Å; K101-C106 PolarHBondContact O-SG 3.38Å; D102-C106 WeakPolarHBondContact O-CB 3.33Å; V104-C106 PolarHBondContact O-N 3.3Å; C106-R110 VanDerWaalsContact O-CG 3.26Å; C106-R110 WeakPolarHBondContact O-CG 3.28Å; C106-R110 PolarHBondContact O-N 3.28Å
107	Q	93.4	Very high	91.4	Very high	117 Å²	117	53.5 Å²	53.5	55%	0.547	27%	0.267	S	S	.	.	H	α-helix	trans	-68.7	-44	176.3	-70.1	-176.3	29.6	0	0	111.6	D103 V104 L105 W109 R110 L111	D103-Q107 WeakPolarHBondContact O-CB 3.28Å; D103-Q107 WeakPolarHBondContact O-CG 3.34Å; D103-Q107 PolarHBondContact O-NE2 3.28Å; V104-Q107 PolarHBondContact O-N 2.8Å; L105-Q107 VanDerWaalsContact C-N 3.32Å; L105-Q107 PolarHBondContact O-N 3.45Å; Q107-W109 VanDerWaalsContact C-N 3.31Å; Q107-W109 PolarHBondContact O-N 3.04Å; Q107-R110 PolarHBondContact O-N 3.41Å; Q107-L111 WeakPolarHBondContact O-CB 3.49Å; Q107-L111 PolarHBondContact O-N 3.26Å
108	M	94.6	Very high	90.8	Very high	9 Å²	9	53.4 Å²	53.4	4%	0.044	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-38.9	175.5	-70	-170.7	178.1	0	0	112	V104 L105 L111 Y112 L203 L206 A207 W210 L276 F279	V104-M108 HydrophobicContact CG1-CE 3.86Å; V104-M108 HydrophobicContact CG1-SD 4.34Å; V104-M108 WeakPolarHBondContact O-CG 3.44Å; V104-M108 PolarHBondContact O-N 3.46Å; L105-M108 PolarHBondContact O-N 3.02Å; M108-L111 PolarHBondContact O-N 2.89Å; M108-Y112 WeakPolarHBondContact O-CB 3.41Å; M108-Y112 PolarHBondContact O-N 3.11Å; M108-L203 HydrophobicContact CB-CD1 4Å; M108-L206 HydrophobicContact SD-CB 4.12Å; M108-A207 HydrophobicContact SD-CB 4.03Å; M108-W210 HydrophobicContact CE-CB 3.69Å; M108-W210 HydrophobicContact CE-CD2 3.94Å; M108-W210 HydrophobicContact CE-CE3 3.92Å; M108-W210 HydrophobicContact CE-CG 3.85Å; M108-L276 HydrophobicContact CE-CD1 4.1Å; M108-L276 HydrophobicContact SD-CD1 4.46Å; M108-F279 HydrophobicContact CE-CZ 4.36Å
109	W	95.1	Very high	90	Very high	17 Å²	17	50.4 Å²	50.4	6%	0.064	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-45.1	174.6	176.1	-121.6	0	0	0	112.5	C77 F80 Q81 L84 L105 Q107 L111 Y112 L113 M195 L203	C77-W109 HydrophobicContact CB-CH2 4.2Å; C77-W109 HydrophobicContact CB-CZ2 4.17Å; C77-W109 WeakPolarHBondContact O-CZ2 3.26Å; F80-W109 HydrophobicContact CB-CH2 4.29Å; Q81-W109 HydrophobicContact CB-CZ2 3.9Å; Q81-W109 VanDerWaalsContact OE1-NE1 3.08Å; L84-W109 HydrophobicContact CD1-CD2 4Å; L84-W109 HydrophobicContact CD1-CE3 3.7Å; L84-W109 HydrophobicContact CD1-CZ3 4.05Å; L105-W109 WeakPolarHBondContact O-CB 3.37Å; L105-W109 PolarHBondContact O-N 2.95Å; Q107-W109 VanDerWaalsContact C-N 3.31Å; Q107-W109 PolarHBondContact O-N 3.04Å; W109-L111 VanDerWaalsContact C-N 3.31Å; W109-L111 PolarHBondContact O-N 3.08Å; W109-Y112 AromaticContact CE3-CD1 3.88Å; W109-Y112 HydrophobicContact CE3-CD1 3.88Å; W109-Y112 HydrophobicContact CE3-CG 4.34Å; W109-Y112 HydrophobicContact CH2-CD1 4.33Å; W109-Y112 AromaticContact CZ3-CD1 3.46Å; W109-Y112 HydrophobicContact CZ3-CD1 3.46Å; W109-Y112 VanDerWaalsContact CZ3-CD1 3.46Å; W109-Y112 AromaticContact CZ3-CE1 3.88Å; W109-Y112 HydrophobicContact CZ3-CE1 3.88Å; W109-Y112 HydrophobicContact CZ3-CG 4.3Å; W109-Y112 WeakPolarHBondContact O-CB 3.19Å; W109-Y112 PolarHBondContact O-N 3.21Å; W109-L113 HydrophobicContact CD2-CD1 4.3Å; W109-L113 HydrophobicContact CD2-CG 4.19Å; W109-L113 HydrophobicContact CH2-CD2 3.79Å; W109-L113 HydrophobicContact CH2-CG 4.31Å; W109-L113 HydrophobicContact CZ2-CD1 3.98Å; W109-L113 HydrophobicContact CZ2-CD2 3.65Å; W109-L113 HydrophobicContact CZ2-CG 3.94Å; W109-L113 HydrophobicContact CZ3-CD2 4.34Å; W109-L113 WeakPolarHBondContact O-CG 3.34Å; W109-L113 PolarHBondContact O-N 3.01Å; W109-M195 HydrophobicContact CE3-CE 4.04Å; W109-M195 HydrophobicContact CH2-CE 4.45Å; W109-M195 HydrophobicContact CZ3-CE 3.43Å; W109-M195 VanDerWaalsContact CZ3-CE 3.43Å; W109-M195 HydrophobicContact CZ3-CG 4.47Å; W109-L203 HydrophobicContact CB-CD2 4.39Å; W109-L203 HydrophobicContact CE3-CD2 4.17Å
110	R	93	Very high	89.3	Confident	126 Å²	126	51.4 Å²	51.4	48%	0.475	25%	0.245	S	C	.	.	H	α-helix	trans	-59.4	-43.5	174.8	-72.1	170	-172.1	151.8	5.2	111.5	C106 Q107 Y112 L113 Q114 Y120	C106-R110 VanDerWaalsContact O-CG 3.26Å; C106-R110 WeakPolarHBondContact O-CG 3.28Å; C106-R110 PolarHBondContact O-N 3.28Å; Q107-R110 PolarHBondContact O-N 3.41Å; R110-Y112 VanDerWaalsContact C-N 3.34Å; R110-L113 PolarHBondContact O-N 2.95Å; R110-Q114 PolarHBondContact O-N 2.88Å; R110-Y120 HydrophobicContact CB-CE2 4.28Å; R110-Y120 HydrophobicContact CG-CE2 3.98Å
111	L	91.2	Very high	88.3	Confident	47 Å²	47	53.5 Å²	53.5	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-63.4	-40.5	176.2	-176.2	62.6	0	0	0	111.6	Q107 M108 W109 Q114 K115 L274 L276	Q107-L111 WeakPolarHBondContact O-CB 3.49Å; Q107-L111 PolarHBondContact O-N 3.26Å; M108-L111 PolarHBondContact O-N 2.89Å; W109-L111 VanDerWaalsContact C-N 3.31Å; W109-L111 PolarHBondContact O-N 3.08Å; L111-Q114 PolarHBondContact O-N 3.29Å; L111-K115 HydrophobicContact CD1-CG 4.18Å; L111-K115 HydrophobicContact CG-CG 4.39Å; L111-K115 WeakPolarHBondContact O-CB 3.35Å; L111-K115 WeakPolarHBondContact O-CG 3.39Å; L111-K115 PolarHBondContact O-N 3.06Å; L111-L274 HydrophobicContact CD2-CB 4.09Å; L111-L274 HydrophobicContact CG-CD2 4.22Å; L111-L276 HydrophobicContact CD2-CD2 3.75Å
112	Y	91.9	Very high	86.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-48.4	173.7	179.7	-88.7	0	0	0	111.8	M108 W109 R110 Q114 K115 S116 S193 L194 M195 L270 F273 L274	M108-Y112 WeakPolarHBondContact O-CB 3.41Å; M108-Y112 PolarHBondContact O-N 3.11Å; W109-Y112 AromaticContact CE3-CD1 3.88Å; W109-Y112 HydrophobicContact CE3-CD1 3.88Å; W109-Y112 HydrophobicContact CE3-CG 4.34Å; W109-Y112 HydrophobicContact CH2-CD1 4.33Å; W109-Y112 AromaticContact CZ3-CD1 3.46Å; W109-Y112 HydrophobicContact CZ3-CD1 3.46Å; W109-Y112 VanDerWaalsContact CZ3-CD1 3.46Å; W109-Y112 AromaticContact CZ3-CE1 3.88Å; W109-Y112 HydrophobicContact CZ3-CE1 3.88Å; W109-Y112 HydrophobicContact CZ3-CG 4.3Å; W109-Y112 WeakPolarHBondContact O-CB 3.19Å; W109-Y112 PolarHBondContact O-N 3.21Å; R110-Y112 VanDerWaalsContact C-N 3.34Å; Y112-Q114 VanDerWaalsContact C-N 3.29Å; Y112-Q114 PolarHBondContact O-N 2.86Å; Y112-K115 PolarHBondContact O-N 3.22Å; Y112-S116 VanDerWaalsContact O-CB 3.25Å; Y112-S116 WeakPolarHBondContact O-CB 3.46Å; Y112-S116 PolarHBondContact O-N 3.09Å; Y112-S116 PolarHBondContact O-OG 3.18Å; Y112-S193 PolarHBondContact OH-O 3.04Å; Y112-L194 PolarHBondContact OH-O 2.92Å; Y112-M195 HydrophobicContact CD1-CE 3.92Å; Y112-M195 HydrophobicContact CD2-CE 4.21Å; Y112-M195 HydrophobicContact CE1-CB 4.17Å; Y112-M195 HydrophobicContact CE1-CE 3.66Å; Y112-M195 HydrophobicContact CE2-CE 3.96Å; Y112-M195 HydrophobicContact CG-CE 4.19Å; Y112-M195 VanDerWaalsContact OH-CA 3.31Å; Y112-M195 WeakPolarHBondContact OH-CA 3.45Å; Y112-M195 PolarHBondContact OH-N 3.19Å; Y112-M195 VanDerWaalsContact OH-N 3.11Å; Y112-L270 HydrophobicContact CD2-CD2 4.1Å; Y112-L270 HydrophobicContact CE2-CD2 3.96Å; Y112-F273 HydrophobicContact CD2-CD1 4.2Å; Y112-F273 AromaticContact CD2-CE1 3.8Å; Y112-F273 HydrophobicContact CD2-CE1 3.8Å; Y112-F273 HydrophobicContact CE2-CD1 4.32Å; Y112-F273 AromaticContact CE2-CE1 3.86Å; Y112-F273 HydrophobicContact CE2-CE1 3.86Å; Y112-L274 VanDerWaalsContact CA-CD2 3.42Å; Y112-L274 HydrophobicContact CD2-CD2 4.09Å; Y112-L274 HydrophobicContact CG-CD2 4.42Å
113	L	89.9	Confident	85.3	Confident	9 Å²	9	65.7 Å²	65.7	5%	0.047	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-39.4	177.5	-70.7	176.3	0	0	0	112.2	C77 W109 R110 S116 Q117 Q118 G119 Y120	C77-L113 HydrophobicContact CB-CD2 3.74Å; W109-L113 HydrophobicContact CD2-CD1 4.3Å; W109-L113 HydrophobicContact CD2-CG 4.19Å; W109-L113 HydrophobicContact CH2-CD2 3.79Å; W109-L113 HydrophobicContact CH2-CG 4.31Å; W109-L113 HydrophobicContact CZ2-CD1 3.98Å; W109-L113 HydrophobicContact CZ2-CD2 3.65Å; W109-L113 HydrophobicContact CZ2-CG 3.94Å; W109-L113 HydrophobicContact CZ3-CD2 4.34Å; W109-L113 WeakPolarHBondContact O-CG 3.34Å; W109-L113 PolarHBondContact O-N 3.01Å; R110-L113 PolarHBondContact O-N 2.95Å; L113-S116 WeakPolarHBondContact CA-OG 3.44Å; L113-S116 PolarHBondContact O-OG 3.02Å; L113-Q117 PolarHBondContact O-N 3.36Å; L113-Q117 VanDerWaalsContact O-N 3.13Å; L113-Q118 HydrophobicContact CD2-CB 3.94Å; L113-Q118 PolarHBondContact O-N 2.84Å; L113-G119 CarbonylContact C-O 3.59Å; L113-G119 VanDerWaalsContact C-O 3.3Å; L113-G119 PolarHBondContact O-N 3.3Å; L113-G119 VanDerWaalsContact O-N 3.16Å; L113-G119 VanDerWaalsContact O-O 3.07Å; L113-Y120 HydrophobicContact CB-CD2 4.03Å; L113-Y120 HydrophobicContact CB-CE2 4.38Å; L113-Y120 HydrophobicContact CD1-CD2 4.35Å; L113-Y120 HydrophobicContact CD1-CE2 3.88Å
114	Q	88.8	Confident	84	Confident	99 Å²	99	64.6 Å²	64.6	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-65.5	-50.4	176.2	-170.1	-175.4	17	0	0	112	R110 L111 Y112 Q117 G119 T121	R110-Q114 PolarHBondContact O-N 2.88Å; L111-Q114 PolarHBondContact O-N 3.29Å; Y112-Q114 VanDerWaalsContact C-N 3.29Å; Y112-Q114 PolarHBondContact O-N 2.86Å; Q114-Q117 PolarHBondContact O-N 3.03Å; Q114-Q117 VanDerWaalsContact O-N 3.13Å; Q114-G119 VanDerWaalsContact CA-O 3.29Å; Q114-G119 WeakPolarHBondContact CA-O 3.5Å; Q114-G119 PolarHBondContact N-O 3.02Å; Q114-T121 HydrophobicContact CG-CG2 4.12Å; Q114-T121 WeakPolarHBondContact O-CG2 3.46Å
115	K	86.4	Confident	82.6	Confident	78 Å²	78	66.6 Å²	66.6	34%	0.339	31%	0.313	S	S	.	.	H	α-helix	trans	-69.2	-33.6	-177.8	-69	-75.8	-174.3	175.8	0	112.5	L111 Y112 Q117 F273	L111-K115 HydrophobicContact CD1-CG 4.18Å; L111-K115 HydrophobicContact CG-CG 4.39Å; L111-K115 WeakPolarHBondContact O-CB 3.35Å; L111-K115 WeakPolarHBondContact O-CG 3.39Å; L111-K115 PolarHBondContact O-N 3.06Å; Y112-K115 PolarHBondContact O-N 3.22Å; K115-Q117 PolarHBondContact O-N 2.98Å; K115-F273 HydrophobicContact CB-CE1 3.88Å; K115-F273 HydrophobicContact CB-CE2 4.48Å; K115-F273 HydrophobicContact CB-CZ 3.81Å
116	S	84.7	Confident	80.8	Confident	4 Å²	4	74.4 Å²	74.4	3%	0.028	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-5.6	173.3	62.7	0	0	0	0	113.5	Y112 L113 Q118	Y112-S116 VanDerWaalsContact O-CB 3.25Å; Y112-S116 WeakPolarHBondContact O-CB 3.46Å; Y112-S116 PolarHBondContact O-N 3.09Å; Y112-S116 PolarHBondContact O-OG 3.18Å; L113-S116 WeakPolarHBondContact CA-OG 3.44Å; L113-S116 PolarHBondContact O-OG 3.02Å; S116-Q118 PolarHBondContact O-N 3.35Å; S116-Q118 WeakPolarHBondContact OG-CG 3.47Å
117	Q	80.3	Confident	78.7	Confident	96 Å²	96	75.5 Å²	75.5	45%	0.449	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	23.6	-175.3	-52.9	-179.3	-2.8	0	0	114	L113 Q114 K115 T121 P124 I125	L113-Q117 PolarHBondContact O-N 3.36Å; L113-Q117 VanDerWaalsContact O-N 3.13Å; Q114-Q117 PolarHBondContact O-N 3.03Å; Q114-Q117 VanDerWaalsContact O-N 3.13Å; K115-Q117 PolarHBondContact O-N 2.98Å; Q117-T121 HydrophobicContact CB-CG2 4.42Å; Q117-T121 HydrophobicContact CG-CG2 4.44Å; Q117-P124 CarbonylContact O-C 3.58Å; Q117-P124 VanDerWaalsContact O-CA 3.27Å; Q117-P124 WeakPolarHBondContact O-CA 3.48Å; Q117-I125 HydrophobicContact CB-CD1 3.89Å; Q117-I125 HydrophobicContact CB-CG1 3.82Å; Q117-I125 PolarHBondContact O-N 3.3Å
118	Q	79.1	Confident	77	Confident	30 Å²	30	72.4 Å²	72.4	14%	0.14	33%	0.332	C	S	.	.	S	Bend	trans	-86.3	-21.6	177.6	-65	177.8	26.7	0	0	112.3	L113 S116 S193	L113-Q118 HydrophobicContact CD2-CB 3.94Å; L113-Q118 PolarHBondContact O-N 2.84Å; S116-Q118 PolarHBondContact O-N 3.35Å; S116-Q118 WeakPolarHBondContact OG-CG 3.47Å; Q118-S193 PolarHBondContact NE2-O 3.08Å
119	G	76.1	Confident	74.9	Confident	17 Å²	17	77.8 Å²	77.8	18%	0.175	35%	0.352	C	S	.	.	S	Bend	trans	-160.5	166.9	177	0	0	0	0	0	111.6	L113 Q114 T121	L113-G119 CarbonylContact C-O 3.59Å; L113-G119 VanDerWaalsContact C-O 3.3Å; L113-G119 PolarHBondContact O-N 3.3Å; L113-G119 VanDerWaalsContact O-N 3.16Å; L113-G119 VanDerWaalsContact O-O 3.07Å; Q114-G119 VanDerWaalsContact CA-O 3.29Å; Q114-G119 WeakPolarHBondContact CA-O 3.5Å; Q114-G119 PolarHBondContact N-O 3.02Å; G119-T121 PolarHBondContact O-N 3Å
120	Y	76.6	Confident	72.6	Confident	153 Å²	153	77.4 Å²	77.4	60%	0.6	35%	0.351	S	S	*	.	S	Bend	trans	56.6	29.4	179.5	-51.1	-80.7	0	0	0	115	R110 L113	R110-Y120 HydrophobicContact CB-CE2 4.28Å; R110-Y120 HydrophobicContact CG-CE2 3.98Å; L113-Y120 HydrophobicContact CB-CD2 4.03Å; L113-Y120 HydrophobicContact CB-CE2 4.38Å; L113-Y120 HydrophobicContact CD1-CD2 4.35Å; L113-Y120 HydrophobicContact CD1-CE2 3.88Å
121	T	72.9	Confident	70.2	Confident	43 Å²	43	79.8 Å²	79.8	26%	0.264	36%	0.36	S	S	.	.	S	Bend	trans	-128.5	156.6	176	63.4	0	0	0	0	111.4	Q114 Q117 G119 N123	Q114-T121 HydrophobicContact CG-CG2 4.12Å; Q114-T121 WeakPolarHBondContact O-CG2 3.46Å; Q117-T121 HydrophobicContact CB-CG2 4.42Å; Q117-T121 HydrophobicContact CG-CG2 4.44Å; G119-T121 PolarHBondContact O-N 3Å; T121-N123 VanDerWaalsContact C-N 3.28Å; T121-N123 PolarHBondContact O-N 3.32Å
122	R	59	Low	67.5	Low	246 Å²	246	79.8 Å²	79.8	93%	0.928	37%	0.371	S	S	*	.	S	Bend	trans	-64.6	-32.1	179.4	-70.5	-177.2	176.1	173.9	-1.5	112.8
123	N	62.1	Low	64.7	Low	136 Å²	136	82.6 Å²	82.6	73%	0.727	40%	0.395	S	S	*	.	S	Bend	trans	-127.1	79.9	180	-67	-19.3	0	0	0	109.6	T121 I125	T121-N123 VanDerWaalsContact C-N 3.28Å; T121-N123 PolarHBondContact O-N 3.32Å; N123-I125 PolarHBondContact O-N 3.21Å
124	P	66.4	Low	62	Low	65 Å²	65	85.9 Å²	85.9	42%	0.422	42%	0.423	S	S	.	.			trans	-68.7	129.5	-179	27.5	-33	0	0	0	110.2	Q117 R126	Q117-P124 CarbonylContact O-C 3.58Å; Q117-P124 VanDerWaalsContact O-CA 3.27Å; Q117-P124 WeakPolarHBondContact O-CA 3.48Å; P124-R126 PolarHBondContact O-N 3.33Å; P124-R126 VanDerWaalsContact O-N 3.11Å
125	I	63.6	Low	59.5	Low	58 Å²	58	86.7 Å²	86.7	30%	0.297	43%	0.43	S	S	.	.			trans	-70.9	108.3	173	-52.8	176.1	0	0	0	107.4	Q117 N123 N127	Q117-I125 HydrophobicContact CB-CD1 3.89Å; Q117-I125 HydrophobicContact CB-CG1 3.82Å; Q117-I125 PolarHBondContact O-N 3.3Å; N123-I125 PolarHBondContact O-N 3.21Å; I125-N127 HydrophobicContact CG2-CB 4Å; I125-N127 WeakPolarHBondContact CG2-ND2 3.41Å; I125-N127 WeakPolarHBondContact CG2-OD1 3.34Å; I125-N127 PolarHBondContact O-N 2.93Å
126	R	56.9	Low	56.9	Low	172 Å²	172	89.1 Å²	89.1	65%	0.649	45%	0.446	S	S	*	.			trans	-76.9	55.4	172.6	-70	-179.1	174.1	173	0.3	110.6	P124 L128	P124-R126 PolarHBondContact O-N 3.33Å; P124-R126 VanDerWaalsContact O-N 3.11Å; R126-L128 PolarHBondContact O-N 3.41Å
127	N	51.5	Low	54.3	Low	64 Å²	64	93.6 Å²	93.6	34%	0.342	48%	0.478	S	S	.	.			trans	-78.1	112.9	173.5	-78	-12.4	0	0	0	107.3	I125	I125-N127 HydrophobicContact CG2-CB 4Å; I125-N127 WeakPolarHBondContact CG2-ND2 3.41Å; I125-N127 WeakPolarHBondContact CG2-OD1 3.34Å; I125-N127 PolarHBondContact O-N 2.93Å
128	L	56.1	Low	52	Low	52 Å²	52	97.2 Å²	97.2	27%	0.272	50%	0.5	S	S	.	.			trans	79.4	83.1	162.1	-45.8	131.5	0	0	0	113.1	L76 R126 L194 D248	L76-L128 HydrophobicContact CD2-CD1 4.28Å; R126-L128 PolarHBondContact O-N 3.41Å; L128-L194 HydrophobicContact CD1-CD2 3.96Å; L128-D248 HydrophobicContact CD2-CB 4.48Å; L128-D248 WeakPolarHBondContact CD2-OD1 3.28Å; L128-D248 WeakPolarHBondContact CD2-OD2 3.46Å
129	R	51.8	Low	49.7	Very low	121 Å²	121	101 Å²	101	46%	0.457	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	122.4	164.7	-76.5	177	171.9	178.2	-9.4	108.5	I73 M75 R131	I73-R129 HydrophobicContact CG2-CB 4.3Å; I73-R129 HydrophobicContact CG2-CG 4.44Å; M75-R129 HydrophobicContact SD-CG 3.73Å; R129-R131 PolarHBondContact O-N 3.1Å; R129-R131 VanDerWaalsContact O-N 3.08Å
130	F	46.8	Very low	47.8	Very low	10 Å²	10	108 Å²	108	4%	0.044	56%	0.559	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.9	103.9	163.7	-70.7	-83.7	0	0	0	107.5	I73 W74 L76 D248 F252	I73-F130 WeakPolarHBondContact CA-O 3.32Å; W74-F130 HydrophobicContact CD2-CB 4.22Å; W74-F130 HydrophobicContact CD2-CD2 4.04Å; W74-F130 HydrophobicContact CD2-CG 4.37Å; W74-F130 AromaticContact CE2-CD2 3.87Å; W74-F130 AromaticContact CE2-CG 3.86Å; W74-F130 HydrophobicContact CE3-CD2 4.01Å; W74-F130 HydrophobicContact CG-CB 4.38Å; W74-F130 AromaticContact CH2-CD2 3.66Å; W74-F130 HydrophobicContact CH2-CD2 3.66Å; W74-F130 AromaticContact CH2-CE2 3.7Å; W74-F130 HydrophobicContact CH2-CE2 3.7Å; W74-F130 HydrophobicContact CH2-CG 4.2Å; W74-F130 HydrophobicContact CH2-CZ 4.26Å; W74-F130 HydrophobicContact CZ2-CB 4.23Å; W74-F130 HydrophobicContact CZ2-CD1 4.27Å; W74-F130 AromaticContact CZ2-CD2 3.73Å; W74-F130 HydrophobicContact CZ2-CD2 3.73Å; W74-F130 HydrophobicContact CZ2-CE2 4.15Å; W74-F130 AromaticContact CZ2-CG 3.8Å; W74-F130 HydrophobicContact CZ2-CG 3.8Å; W74-F130 AromaticContact CZ3-CD2 3.79Å; W74-F130 HydrophobicContact CZ3-CD2 3.79Å; W74-F130 AromaticContact CZ3-CE2 3.91Å; W74-F130 HydrophobicContact CZ3-CE2 3.91Å; W74-F130 PolarHBondContact O-N 3.23Å; L76-F130 HydrophobicContact CB-CE2 3.98Å; L76-F130 HydrophobicContact CD1-CE2 3.65Å; L76-F130 HydrophobicContact CD1-CZ 3.88Å; L76-F130 HydrophobicContact CG-CE2 4.45Å; F130-D248 HydrophobicContact CE1-CB 3.81Å; F130-D248 HydrophobicContact CZ-CB 3.58Å; F130-F252 HydrophobicContact CE2-CE2 4.2Å; F130-F252 AromaticContact CZ-CE2 3.99Å; F130-F252 HydrophobicContact CZ-CE2 3.99Å
131	R	41.9	Very low	45.7	Very low	175 Å²	175	109.5 Å²	109.5	66%	0.66	57%	0.573	S	S	*	*			trans	-90.8	120.6	172.1	-165.1	-175.3	-81.4	-123.8	6.6	107.1	I73 R129 A133	I73-R131 HydrophobicContact CD1-CG 4.46Å; R129-R131 PolarHBondContact O-N 3.1Å; R129-R131 VanDerWaalsContact O-N 3.08Å; R131-A133 HydrophobicContact CB-CB 4.27Å; R131-A133 HydrophobicContact CG-CB 3.84Å; R131-A133 PolarHBondContact O-N 3.29Å
132	G	35.3	Very low	43.7	Very low	47 Å²	47	114.8 Å²	114.8	49%	0.485	60%	0.6	S	S	.	*			trans	-67.4	56.1	160.9	0	0	0	0	0	111
133	A	32.7	Very low	42.8	Very low	60 Å²	60	108.9 Å²	108.9	50%	0.496	60%	0.596	S	S	.	*			trans	-77.9	127	-176.9	0	0	0	0	0	109.9	R131 L135	R131-A133 HydrophobicContact CB-CB 4.27Å; R131-A133 HydrophobicContact CG-CB 3.84Å; R131-A133 PolarHBondContact O-N 3.29Å; A133-L135 PolarHBondContact O-N 3.08Å
134	A	33.4	Very low	41.3	Very low	78 Å²	78	106.7 Å²	106.7	65%	0.645	60%	0.597	S	S	*	*			trans	-47.1	125.7	157.9	0	0	0	0	0	109.4	D136	A134-D136 PolarHBondContact O-N 3.19Å
135	L	36.7	Very low	39.8	Very low	116 Å²	116	106.6 Å²	106.6	61%	0.607	60%	0.602	S	S	*	*	S	Bend	trans	-67.8	84.4	166.1	-81.2	124.4	0	0	0	108.6	A133 K418	A133-L135 PolarHBondContact O-N 3.08Å; L135-K418 VanDerWaalsContact CD1-CE 3.45Å; L135-K418 HydrophobicContact CD2-CD 4.14Å; L135-K418 HydrophobicContact CD2-CG 4.43Å
136	D	30.8	Very low	38.1	Very low	128 Å²	128	111.7 Å²	111.7	68%	0.684	63%	0.625	S	S	*	*			trans	-147.2	73.1	162.1	-82.1	-26.7	0	0	0	107.4	A134	A134-D136 PolarHBondContact O-N 3.19Å
137	S	30.1	Very low	37	Very low	98 Å²	98	107.5 Å²	107.5	69%	0.685	62%	0.622	S	S	*	*			trans	-169.2	103.1	154.6	-172	0	0	0	0	108	T139	S137-T139 PolarHBondContact O-N 3.5Å; S137-T139 VanDerWaalsContact O-N 3.13Å; S137-T139 PolarHBondContact OG-OG1 2.9Å; S137-T139 VanDerWaalsContact OG-OG1 3.07Å
138	D	33.2	Very low	36.3	Very low	172 Å²	172	108.9 Å²	108.9	92%	0.92	63%	0.632	S	S	*	*			trans	-61.1	107.7	161.3	-70.5	-36.6	0	0	0	107.4
139	T	30.3	Very low	35.4	Very low	109 Å²	109	110.4 Å²	110.4	67%	0.669	64%	0.64	S	S	*	*			trans	-148.6	104.6	163.7	-27	0	0	0	0	107.2	S137 M141	S137-T139 PolarHBondContact O-N 3.5Å; S137-T139 VanDerWaalsContact O-N 3.13Å; S137-T139 PolarHBondContact OG-OG1 2.9Å; S137-T139 VanDerWaalsContact OG-OG1 3.07Å; T139-M141 PolarHBondContact O-N 3.45Å; T139-M141 VanDerWaalsContact O-N 3.07Å
140	D	35.5	Very low	34.5	Very low	164 Å²	164	108.9 Å²	108.9	88%	0.877	65%	0.648	S	S	*	*			trans	-54.6	109.7	173.8	-62.3	-48	0	0	0	109
141	M	32.3	Very low	33.8	Very low	185 Å²	185	114.7 Å²	114.7	91%	0.911	68%	0.68	S	S	*	*			trans	-116.2	64.9	170.1	-165.2	91.5	163.9	0	0	107.3	T139	T139-M141 PolarHBondContact O-N 3.45Å; T139-M141 VanDerWaalsContact O-N 3.07Å
142	D	31.4	Very low	33.4	Very low	155 Å²	155	112.8 Å²	112.8	83%	0.829	68%	0.683	S	S	*	*			trans	-69.9	144.3	164.3	-96.3	-24.5	0	0	0	109.5
143	S	40.6	Very low	33.2	Very low	121 Å²	121	116.8 Å²	116.8	85%	0.846	69%	0.687	S	S	*	*	S	Bend	trans	88.1	86	174.1	-165.6	0	0	0	0	117
144	A	30.5	Very low	33.2	Very low	90 Å²	90	120.5 Å²	120.5	74%	0.744	70%	0.703	S	S	*	*	S	Bend	trans	-175.2	-0	142.1	0	0	0	0	0	115.3
145	A	34	Very low	33	Very low	64 Å²	64	123.8 Å²	123.8	53%	0.529	71%	0.71	S	S	.	*	S	Bend	trans	-100.4	-16.8	-170.1	0	0	0	0	0	115.9	S147	A145-S147 PolarHBondContact O-N 2.91Å; A145-S147 VanDerWaalsContact O-N 3.16Å
146	E	28.8	Very low	32.7	Very low	165 Å²	165	123.7 Å²	123.7	77%	0.771	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-9.3	-175	-76.1	-63.4	149.5	0	0	114.9	S150	E146-S150 PolarHBondContact O-OG 3.39Å
147	S	33.2	Very low	32.8	Very low	84 Å²	84	121.7 Å²	121.7	59%	0.587	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-5.4	-177.5	67.1	0	0	0	0	115.4	A145	A145-S147 PolarHBondContact O-N 2.91Å; A145-S147 VanDerWaalsContact O-N 3.16Å
148	V	37.1	Very low	32.7	Very low	93 Å²	93	122 Å²	122	56%	0.564	73%	0.731	S	S	*	*	S	Bend	trans	-95.2	-22.3	-177.2	-171.6	0	0	0	0	112.2
149	L	37.8	Very low	32.5	Very low	84 Å²	84	120.2 Å²	120.2	44%	0.44	73%	0.726	S	S	.	*	S	Bend	trans	-92.3	-17.2	-173.2	-64.7	175.9	0	0	0	113.8	D151 F153	L149-D151 VanDerWaalsContact C-N 3.27Å; L149-D151 PolarHBondContact O-N 2.91Å; L149-F153 VanDerWaalsContact O-CD2 3.29Å; L149-F153 WeakPolarHBondContact O-CD2 3.38Å
150	S	31.7	Very low	32.2	Very low	89 Å²	89	123.1 Å²	123.1	62%	0.622	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-16.1	-173.4	-0.6	0	0	0	0	114.4	E146	E146-S150 PolarHBondContact O-OG 3.39Å
151	D	32.3	Very low	31.7	Very low	132 Å²	132	120.8 Å²	120.8	71%	0.706	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-5.1	-174.6	-119.5	10	0	0	0	114.2	L149	L149-D151 VanDerWaalsContact C-N 3.27Å; L149-D151 PolarHBondContact O-N 2.91Å
152	N	34.4	Very low	31.4	Very low	134 Å²	134	118 Å²	118	72%	0.717	73%	0.73	S	S	*	*	S	Bend	trans	-100.5	-4.5	-179.2	-82.2	-12.7	0	0	0	114.4
153	F	30.9	Very low	31.2	Very low	132 Å²	132	116.1 Å²	116.1	58%	0.579	73%	0.729	S	S	*	*			trans	-114.2	69.6	-177.5	-65.4	-75.6	0	0	0	111.9	L149	L149-F153 VanDerWaalsContact O-CD2 3.29Å; L149-F153 WeakPolarHBondContact O-CD2 3.38Å
154	T	31.4	Very low	30.4	Very low	137 Å²	137	115 Å²	115	84%	0.84	73%	0.728	S	S	*	*			trans	-152.6	81.2	151.4	37.4	0	0	0	0	109
155	D	30.2	Very low	30.1	Very low	147 Å²	147	114.4 Å²	114.4	79%	0.786	73%	0.731	S	S	*	*			trans	-151	80.3	148.8	-147	3.5	0	0	0	108.5
156	S	30.5	Very low	29.8	Very low	115 Å²	115	116.6 Å²	116.6	80%	0.804	74%	0.742	S	S	*	*			trans	-137.3	105.1	161.6	-74.9	0	0	0	0	105.7	S158	S156-S158 PolarHBondContact O-N 3.42Å
157	G	33.7	Very low	29.6	Very low	85 Å²	85	116.4 Å²	116.4	88%	0.876	75%	0.746	S	S	*	*			trans	-60.7	107.2	175	0	0	0	0	0	109.9
158	S	26.4	Very low	29.3	Very low	106 Å²	106	117.4 Å²	117.4	74%	0.741	76%	0.759	S	S	*	*			trans	-126.2	104.9	158.9	62.1	0	0	0	0	108.1	S156 L160	S156-S158 PolarHBondContact O-N 3.42Å; S158-L160 PolarHBondContact O-N 2.85Å
159	V	29.5	Very low	28.7	Very low	134 Å²	134	122.4 Å²	122.4	81%	0.812	78%	0.777	S	S	*	*			trans	-59.5	123.1	168.4	176.2	0	0	0	0	108.6
160	L	24.7	Very low	28.1	Very low	169 Å²	169	123.9 Å²	123.9	89%	0.885	79%	0.794	S	S	*	*			trans	-153.3	104.9	155.1	-99.1	160.3	0	0	0	108.4	S158	S158-L160 PolarHBondContact O-N 2.85Å
161	C	23.8	Very low	27.7	Very low	115 Å²	115	124.8 Å²	124.8	78%	0.777	80%	0.8	S	S	*	*			trans	-69.2	136.8	168.2	-73	0	0	0	0	110
162	S	25.9	Very low	27.5	Very low	126 Å²	126	123.7 Å²	123.7	88%	0.881	80%	0.803	S	S	*	*			trans	-157	137.9	137.2	-84.8	0	0	0	0	111.7
163	S	27.4	Very low	27.1	Very low	116 Å²	116	124.2 Å²	124.2	81%	0.811	81%	0.806	S	S	*	*			trans	-70.8	146.6	-173.3	49.8	0	0	0	0	115.1
164	A	25.4	Very low	27	Very low	99 Å²	99	129.6 Å²	129.6	82%	0.818	82%	0.823	S	S	*	*				165.5	132.5	118.2	0	0	0	0	0	111.1
165	G	23.8	Very low	26.8	Very low	77 Å²	77	131.5 Å²	131.5	79%	0.794	83%	0.827	S	S	*	*			trans	40.7	144.1	154.2	0	0	0	0	0	120.9
166	S	26.6	Very low	26.6	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	83%	0.828	S	S	*	*			cis	-177.2	137.4	4.6	40.7	0	0	0	0	106.1
167	N	24.3	Very low	26.3	Very low	160 Å²	160	127.5 Å²	127.5	86%	0.856	82%	0.822	S	S	*	*			trans	16.7	124.4	151.8	-56.6	-12.4	0	0	0	119.8
168	A	26.8	Very low	26.3	Very low	105 Å²	105	131.5 Å²	131.5	87%	0.868	82%	0.824	S	S	*	*				-169.6	133.1	117.5	0	0	0	0	0	111
169	E	25.2	Very low	26.3	Very low	198 Å²	198	135.6 Å²	135.6	93%	0.925	82%	0.824	S	S	*	*			trans	-66.5	137.7	176.5	-60.7	169.2	143.2	0	0	111.3
170	S	24.4	Very low	26.6	Very low	115 Å²	115	134.8 Å²	134.8	80%	0.804	82%	0.824	S	S	*	*			trans	-151	91.9	152	-156.6	0	0	0	0	110.2
171	S	24.9	Very low	26.7	Very low	108 Å²	108	131.5 Å²	131.5	76%	0.755	82%	0.815	S	S	*	*			trans	-65.6	121.8	159.7	169.7	0	0	0	0	108.8
172	S	27.4	Very low	27.1	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	82%	0.819	S	S	*	*			trans	-151.5	137.3	148.6	52.8	0	0	0	0	111.6
173	D	26.2	Very low	27.4	Very low	146 Å²	146	129.2 Å²	129.2	78%	0.781	80%	0.804	S	S	*	*			trans	-74.8	158.8	-169.1	-66.8	-62.5	0	0	0	113	L175	D173-L175 PolarHBondContact O-N 3.06Å
174	W	28.5	Very low	27.7	Very low	245 Å²	245	128.5 Å²	128.5	93%	0.928	80%	0.795	S	S	*	*			trans	-59.3	121.1	162.6	-64.8	75.8	0	0	0	109.7
175	L	27.4	Very low	28.4	Very low	177 Å²	177	127 Å²	127	93%	0.927	78%	0.779	S	S	*	*				168.9	122.3	126.4	-88.1	155.8	0	0	0	111	D173	D173-L175 PolarHBondContact O-N 3.06Å
176	G	25.1	Very low	29.1	Very low	78 Å²	78	125.3 Å²	125.3	80%	0.804	76%	0.757	S	S	*	*			trans	87.5	95.2	149.5	0	0	0	0	0	117.7
177	S	24.7	Very low	29.7	Very low	99 Å²	99	122.5 Å²	122.5	69%	0.692	74%	0.738	S	S	*	*			trans	-153.5	124.5	130	73.5	0	0	0	0	111.5	Y179	S177-Y179 PolarHBondContact O-N 3.39Å
178	D	33.3	Very low	30.2	Very low	169 Å²	169	123.2 Å²	123.2	90%	0.904	73%	0.728	S	S	*	*			trans	-71.9	111.4	165.9	-86	-41.1	0	0	0	108.9
179	Y	27.3	Very low	31.1	Very low	193 Å²	193	125.4 Å²	125.4	76%	0.757	72%	0.718	S	S	*	*			trans	-165.5	117.7	137.6	58.5	-83	0	0	0	111.2	S177	S177-Y179 PolarHBondContact O-N 3.39Å
180	S	35	Very low	32.4	Very low	116 Å²	116	123.3 Å²	123.3	81%	0.811	70%	0.702	S	S	*	*			trans	43.2	89.4	148.7	-140.9	0	0	0	0	119.4
181	S	28.4	Very low	33.7	Very low	100 Å²	100	120.9 Å²	120.9	70%	0.699	69%	0.685	S	S	*	*			trans	-155.8	78.7	146.7	44.8	0	0	0	0	110.7	G183	S181-G183 PolarHBondContact O-N 3.01Å
182	T	30.7	Very low	35.3	Very low	138 Å²	138	122.5 Å²	122.5	85%	0.847	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	14.4	-177.2	22.2	0	0	0	0	115.5
183	G	32.8	Very low	37.2	Very low	56 Å²	56	118.1 Å²	118.1	58%	0.577	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-32.9	-174.5	0	0	0	0	0	116.4	S181	S181-G183 PolarHBondContact O-N 3.01Å
184	T	34.5	Very low	39.7	Very low	100 Å²	100	112.9 Å²	112.9	61%	0.613	62%	0.615	S	S	*	*	H	α-helix	trans	-92.5	-36.9	-165.3	52.8	0	0	0	0	113.7	A186 S187 W188	T184-A186 VanDerWaalsContact C-N 3.34Å; T184-A186 PolarHBondContact O-N 3.3Å; T184-S187 PolarHBondContact O-N 3.32Å; T184-W188 PolarHBondContact O-N 3.5Å
185	S	38.6	Very low	42.5	Very low	68 Å²	68	101.2 Å²	101.2	48%	0.476	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-33.7	179.7	-177.3	0	0	0	0	113.4	K189	S185-K189 WeakPolarHBondContact O-CB 3.49Å; S185-K189 VanDerWaalsContact O-CG 3.27Å; S185-K189 WeakPolarHBondContact O-CG 3.43Å; S185-K189 PolarHBondContact O-N 3.27Å; S185-K189 VanDerWaalsContact O-N 3.17Å
186	A	39.3	Very low	45.4	Very low	41 Å²	41	94.9 Å²	94.9	34%	0.339	54%	0.54	S	S	.	.	H	α-helix	trans	-76.5	-38.3	-179.7	0	0	0	0	0	112.7	T184 R190	T184-A186 VanDerWaalsContact C-N 3.34Å; T184-A186 PolarHBondContact O-N 3.3Å; A186-R190 WeakPolarHBondContact O-CB 3.18Å; A186-R190 VanDerWaalsContact O-CG 3.25Å; A186-R190 WeakPolarHBondContact O-CG 3.37Å; A186-R190 PolarHBondContact O-N 3.31Å
187	S	38.7	Very low	48.6	Very low	52 Å²	52	91.5 Å²	91.5	36%	0.364	50%	0.503	S	S	.	.	H	α-helix	trans	-66.6	-45.1	177.2	-175.6	0	0	0	0	111.6	T184 K189 R190 S191	T184-S187 PolarHBondContact O-N 3.32Å; S187-K189 PolarHBondContact O-N 3.42Å; S187-R190 WeakPolarHBondContact O-CB 3.43Å; S187-R190 PolarHBondContact O-N 2.82Å; S187-R190 VanDerWaalsContact O-N 3.14Å; S187-S191 PolarHBondContact O-N 3.39Å
188	W	34.5	Very low	51.8	Low	175 Å²	175	90 Å²	90	66%	0.663	48%	0.484	S	S	*	.	H	α-helix	trans	-66.5	-36.2	177	-83.7	37	0	0	0	113.7	T184 R190 S191 R192	T184-W188 PolarHBondContact O-N 3.5Å; W188-R190 VanDerWaalsContact C-N 3.34Å; W188-S191 PolarHBondContact O-OG 2.84Å; W188-R192 WeakPolarHBondContact O-CG 3.39Å; W188-R192 PolarHBondContact O-N 3.06Å
189	K	47.6	Very low	54.7	Low	150 Å²	150	82.6 Å²	82.6	65%	0.652	44%	0.444	S	S	*	.	H	α-helix	trans	-67.1	-35.5	171.4	-77.6	174.8	-178.4	176.5	0	111.8	S185 S187 S193	S185-K189 WeakPolarHBondContact O-CB 3.49Å; S185-K189 VanDerWaalsContact O-CG 3.27Å; S185-K189 WeakPolarHBondContact O-CG 3.43Å; S185-K189 PolarHBondContact O-N 3.27Å; S185-K189 VanDerWaalsContact O-N 3.17Å; S187-K189 PolarHBondContact O-N 3.42Å; K189-S193 PolarHBondContact O-N 3.15Å
190	R	51.3	Low	58	Low	154 Å²	154	73.4 Å²	73.4	58%	0.581	41%	0.408	S	S	*	.	H	α-helix	trans	-67.9	-45.3	176	-77.2	174.3	-165.1	158.1	3.6	112.3	A186 S187 W188 R192 S193 L194	A186-R190 WeakPolarHBondContact O-CB 3.18Å; A186-R190 VanDerWaalsContact O-CG 3.25Å; A186-R190 WeakPolarHBondContact O-CG 3.37Å; A186-R190 PolarHBondContact O-N 3.31Å; S187-R190 WeakPolarHBondContact O-CB 3.43Å; S187-R190 PolarHBondContact O-N 2.82Å; S187-R190 VanDerWaalsContact O-N 3.14Å; W188-R190 VanDerWaalsContact C-N 3.34Å; R190-R192 PolarHBondContact O-N 3.32Å; R190-S193 PolarHBondContact O-N 2.85Å; R190-S193 VanDerWaalsContact O-N 3.08Å; R190-S193 PolarHBondContact O-OG 3.12Å; R190-L194 PolarHBondContact O-N 2.88Å
191	S	52.9	Low	60.9	Low	64 Å²	64	67.9 Å²	67.9	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-63.8	-37.9	-179.7	71.6	0	0	0	0	112.9	S187 W188 S193 L194	S187-S191 PolarHBondContact O-N 3.39Å; W188-S191 PolarHBondContact O-OG 2.84Å; S191-S193 VanDerWaalsContact C-N 3.26Å; S191-S193 PolarHBondContact O-N 3.08Å; S191-L194 PolarHBondContact O-N 3.4Å
192	R	58.4	Low	64.2	Low	143 Å²	143	63.1 Å²	63.1	54%	0.54	34%	0.336	S	S	.	.	H	α-helix	trans	-66.3	-27.9	174.6	-66.1	-176.2	88.9	178	5.4	112.8	W188 R190 K199	W188-R192 WeakPolarHBondContact O-CG 3.39Å; W188-R192 PolarHBondContact O-N 3.06Å; R190-R192 PolarHBondContact O-N 3.32Å; R192-K199 PolarHBondContact O-NZ 3.11Å
193	S	65.5	Low	67.3	Low	16 Å²	16	56.5 Å²	56.5	11%	0.112	30%	0.296	C	S	.	.	H	α-helix	trans	-81	-18.2	-179.3	76.8	0	0	0	0	114.9	Y112 Q118 K189 R190 S191	Y112-S193 PolarHBondContact OH-O 3.04Å; Q118-S193 PolarHBondContact NE2-O 3.08Å; K189-S193 PolarHBondContact O-N 3.15Å; R190-S193 PolarHBondContact O-N 2.85Å; R190-S193 VanDerWaalsContact O-N 3.08Å; R190-S193 PolarHBondContact O-OG 3.12Å; S191-S193 VanDerWaalsContact C-N 3.26Å; S191-S193 PolarHBondContact O-N 3.08Å
194	L	78.9	Confident	70.4	Confident	36 Å²	36	53.9 Å²	53.9	19%	0.188	27%	0.268	C	S	.	.	S	Bend	trans	-81.9	140.2	-177.8	-68.7	173.4	0	0	0	111.3	L76 Y112 L128 R190 S191 K199	L76-L194 HydrophobicContact CD2-CD2 4.34Å; Y112-L194 PolarHBondContact OH-O 2.92Å; L128-L194 HydrophobicContact CD1-CD2 3.96Å; R190-L194 PolarHBondContact O-N 2.88Å; S191-L194 PolarHBondContact O-N 3.4Å; L194-K199 WeakPolarHBondContact O-CD 3.46Å; L194-K199 PolarHBondContact O-NZ 3.22Å
195	M	87	Confident	73.3	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	24%	0.241	C	C	.	.			trans	-76.8	144.3	175.8	-176.3	52.8	84	0	0	109.5	F80 W109 Y112 K199 T200	F80-M195 HydrophobicContact CB-CB 4.44Å; F80-M195 HydrophobicContact CB-CG 3.74Å; F80-M195 HydrophobicContact CD1-CG 3.65Å; F80-M195 HydrophobicContact CD2-CB 3.61Å; F80-M195 HydrophobicContact CD2-CG 3.6Å; F80-M195 HydrophobicContact CE1-CG 4.11Å; F80-M195 HydrophobicContact CE2-CB 3.88Å; F80-M195 HydrophobicContact CE2-CG 4.05Å; F80-M195 VanDerWaalsContact CE2-O 3.3Å; F80-M195 WeakPolarHBondContact CE2-O 3.38Å; F80-M195 HydrophobicContact CG-CB 3.95Å; F80-M195 HydrophobicContact CG-CG 3.37Å; F80-M195 HydrophobicContact CZ-CB 4.46Å; F80-M195 HydrophobicContact CZ-CG 4.29Å; F80-M195 WeakPolarHBondContact CZ-O 3.41Å; W109-M195 HydrophobicContact CE3-CE 4.04Å; W109-M195 HydrophobicContact CH2-CE 4.45Å; W109-M195 HydrophobicContact CZ3-CE 3.43Å; W109-M195 VanDerWaalsContact CZ3-CE 3.43Å; W109-M195 HydrophobicContact CZ3-CG 4.47Å; Y112-M195 HydrophobicContact CD1-CE 3.92Å; Y112-M195 HydrophobicContact CD2-CE 4.21Å; Y112-M195 HydrophobicContact CE1-CB 4.17Å; Y112-M195 HydrophobicContact CE1-CE 3.66Å; Y112-M195 HydrophobicContact CE2-CE 3.96Å; Y112-M195 HydrophobicContact CG-CE 4.19Å; Y112-M195 VanDerWaalsContact OH-CA 3.31Å; Y112-M195 WeakPolarHBondContact OH-CA 3.45Å; Y112-M195 PolarHBondContact OH-N 3.19Å; Y112-M195 VanDerWaalsContact OH-N 3.11Å; M195-K199 HydrophobicContact CE-CB 4.32Å; M195-K199 HydrophobicContact SD-CB 3.3Å; M195-K199 WeakPolarHBondContact SD-CB 3.29Å; M195-K199 HydrophobicContact SD-CD 4.32Å; M195-K199 HydrophobicContact SD-CG 4.44Å; M195-T200 HydrophobicContact CG-CG2 4.4Å; M195-T200 HydrophobicContact SD-CG2 4.14Å
196	T	90.2	Very high	76	Confident	43 Å²	43	46.2 Å²	46.2	26%	0.264	22%	0.218	S	C	.	.			trans	-135.8	159.5	177.4	66.1	0	0	0	0	108.8	K198 K199 T200	T196-K198 VanDerWaalsContact C-N 3.26Å; T196-K198 PolarHBondContact O-N 3.42Å; T196-K199 WeakPolarHBondContact O-CA 3.34Å; T196-K199 WeakPolarHBondContact O-CB 3.48Å; T196-K199 PolarHBondContact O-N 3.08Å; T196-K199 WeakPolarHBondContact OG1-CG 3.46Å; T196-K199 PolarHBondContact OG1-N 3.3Å; T196-T200 PolarHBondContact O-N 3.13Å; T196-T200 VanDerWaalsContact O-N 3.14Å
197	M	91.3	Very high	78.6	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.039	20%	0.202	C	C	.	.	H	α-helix	trans	-54.5	-42.2	176.1	-68	-60.3	-65.6	0	0	112.2	F80 I83 K199 T200 L201 Y231 A234 V254	F80-M197 HydrophobicContact CD1-SD 4.35Å; F80-M197 HydrophobicContact CE1-CG 4.3Å; F80-M197 HydrophobicContact CE1-SD 3.83Å; I83-M197 HydrophobicContact CD1-CE 4.39Å; I83-M197 HydrophobicContact CD1-SD 3.81Å; I83-M197 HydrophobicContact CG2-CE 3.99Å; I83-M197 HydrophobicContact CG2-SD 4.26Å; M197-K199 VanDerWaalsContact C-N 3.31Å; M197-K199 PolarHBondContact O-N 3.38Å; M197-T200 PolarHBondContact O-N 3.42Å; M197-T200 PolarHBondContact O-OG1 3.32Å; M197-L201 PolarHBondContact O-N 2.91Å; M197-Y231 HydrophobicContact CB-CE2 3.81Å; M197-Y231 HydrophobicContact CE-CD2 3.96Å; M197-Y231 HydrophobicContact CE-CE2 4.14Å; M197-Y231 VanDerWaalsContact CE-O 3.28Å; M197-Y231 WeakPolarHBondContact CE-O 3.44Å; M197-Y231 WeakPolarHBondContact O-CE2 3.44Å; M197-A234 HydrophobicContact CE-CB 3.99Å; M197-V254 HydrophobicContact CB-CG2 3.77Å; M197-V254 HydrophobicContact CE-CG2 4.11Å; M197-V254 HydrophobicContact CG-CG2 3.62Å
198	K	92.8	Very high	81.3	Confident	68 Å²	68	41.9 Å²	41.9	30%	0.296	19%	0.185	S	C	.	.	H	α-helix	trans	-59.4	-39.9	175.4	-171.9	-176	-58.3	-179.5	0	112.8	T196 T200 L201 A202 Y231 P258 S262 V263 E266	T196-K198 VanDerWaalsContact C-N 3.26Å; T196-K198 PolarHBondContact O-N 3.42Å; K198-T200 VanDerWaalsContact C-N 3.27Å; K198-T200 PolarHBondContact O-N 3.46Å; K198-L201 PolarHBondContact O-N 3.42Å; K198-A202 PolarHBondContact O-N 2.82Å; K198-Y231 PolarHBondContact N-OH 3.35Å; K198-P258 HydrophobicContact CD-CB 4.45Å; K198-P258 HydrophobicContact CG-CB 4.2Å; K198-P258 HydrophobicContact CG-CG 4.37Å; K198-S262 WeakPolarHBondContact CE-OG 3.4Å; K198-S262 PolarHBondContact NZ-OG 2.99Å; K198-V263 HydrophobicContact CG-CG2 4.28Å; K198-E266 HydrophobicContact CD-CB 4.37Å; K198-E266 HydrophobicContact CG-CB 4.42Å
199	K	93.7	Very high	84	Confident	12 Å²	12	33.7 Å²	33.7	5%	0.052	15%	0.154	C	C	.	.	H	α-helix	trans	-66.8	-27.3	176.5	-77.6	175	-178.7	171.4	0	112.3	R192 L194 M195 T196 M197 A202 L203 E266	R192-K199 PolarHBondContact O-NZ 3.11Å; L194-K199 WeakPolarHBondContact O-CD 3.46Å; L194-K199 PolarHBondContact O-NZ 3.22Å; M195-K199 HydrophobicContact CE-CB 4.32Å; M195-K199 HydrophobicContact SD-CB 3.3Å; M195-K199 WeakPolarHBondContact SD-CB 3.29Å; M195-K199 HydrophobicContact SD-CD 4.32Å; M195-K199 HydrophobicContact SD-CG 4.44Å; T196-K199 WeakPolarHBondContact O-CA 3.34Å; T196-K199 WeakPolarHBondContact O-CB 3.48Å; T196-K199 PolarHBondContact O-N 3.08Å; T196-K199 WeakPolarHBondContact OG1-CG 3.46Å; T196-K199 PolarHBondContact OG1-N 3.3Å; M197-K199 VanDerWaalsContact C-N 3.31Å; M197-K199 PolarHBondContact O-N 3.38Å; K199-A202 PolarHBondContact O-N 3.11Å; K199-L203 WeakPolarHBondContact O-CB 3.27Å; K199-L203 PolarHBondContact O-N 3.44Å; K199-E266 HydrophobicContact CB-CG 4.39Å; K199-E266 WeakPolarHBondContact CE-OE1 3.43Å; K199-E266 HydrophobicContact CG-CG 3.51Å; K199-E266 VanDerWaalsContact CG-OE1 3.26Å; K199-E266 WeakPolarHBondContact CG-OE1 3.41Å
200	T	95.9	Very high	86.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.6	-46.5	174.8	79.8	0	0	0	0	111	F80 L84 Q87 M195 T196 M197 K198 A202 L203 I204	F80-T200 HydrophobicContact CD1-CG2 3.77Å; F80-T200 HydrophobicContact CE1-CG2 4.34Å; L84-T200 HydrophobicContact CD2-CG2 4.28Å; L84-T200 HydrophobicContact CG-CG2 4.18Å; Q87-T200 PolarHBondContact NE2-OG1 3Å; Q87-T200 PolarHBondContact OE1-OG1 3.18Å; M195-T200 HydrophobicContact CG-CG2 4.4Å; M195-T200 HydrophobicContact SD-CG2 4.14Å; T196-T200 PolarHBondContact O-N 3.13Å; T196-T200 VanDerWaalsContact O-N 3.14Å; M197-T200 PolarHBondContact O-N 3.42Å; M197-T200 PolarHBondContact O-OG1 3.32Å; K198-T200 VanDerWaalsContact C-N 3.27Å; K198-T200 PolarHBondContact O-N 3.46Å; T200-A202 VanDerWaalsContact C-N 3.34Å; T200-A202 PolarHBondContact O-N 3.11Å; T200-L203 PolarHBondContact O-N 2.97Å; T200-I204 WeakPolarHBondContact O-CG1 3.39Å; T200-I204 PolarHBondContact O-N 3.27Å
201	L	96.9	Very high	88	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.8	-40.3	174.5	-64.7	-178.2	0	0	0	112.1	M197 K198 L203 I204 H205 L221 V224 Y231 P258 V263	M197-L201 PolarHBondContact O-N 2.91Å; K198-L201 PolarHBondContact O-N 3.42Å; L201-L203 VanDerWaalsContact C-N 3.35Å; L201-L203 PolarHBondContact O-N 3.5Å; L201-I204 PolarHBondContact O-N 3.35Å; L201-H205 WeakPolarHBondContact O-CB 3.34Å; L201-H205 PolarHBondContact O-N 3.47Å; L201-L221 HydrophobicContact CD1-CD2 4.05Å; L201-V224 HydrophobicContact CD2-CG2 3.83Å; L201-Y231 HydrophobicContact CD1-CD2 3.62Å; L201-Y231 HydrophobicContact CD1-CE1 4.36Å; L201-Y231 HydrophobicContact CD1-CE2 3.35Å; L201-Y231 HydrophobicContact CD1-CG 4.26Å; L201-Y231 HydrophobicContact CD2-CD2 3.86Å; L201-Y231 HydrophobicContact CD2-CE2 4.22Å; L201-Y231 HydrophobicContact CG-CD2 3.67Å; L201-Y231 HydrophobicContact CG-CE2 3.5Å; L201-Y231 VanDerWaalsContact CG-CE2 3.5Å; L201-P258 HydrophobicContact CD1-CG 3.9Å; L201-V263 HydrophobicContact CB-CG1 4.1Å
202	A	96.8	Very high	89.7	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63	-40.9	176.7	0	0	0	0	0	112.1	K198 K199 T200 H205 L206 V263 E266 A267 L270	K198-A202 PolarHBondContact O-N 2.82Å; K199-A202 PolarHBondContact O-N 3.11Å; T200-A202 VanDerWaalsContact C-N 3.34Å; T200-A202 PolarHBondContact O-N 3.11Å; A202-H205 PolarHBondContact O-N 3.1Å; A202-L206 WeakPolarHBondContact O-CG 3.37Å; A202-L206 PolarHBondContact O-N 2.88Å; A202-V263 HydrophobicContact CB-CG1 4.15Å; A202-E266 HydrophobicContact CB-CB 3.96Å; A202-E266 HydrophobicContact CB-CG 4.02Å; A202-A267 HydrophobicContact CB-CB 4.06Å; A202-L270 HydrophobicContact CB-CD1 3.73Å
203	L	96.1	Very high	91.2	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.9	-41.8	177.2	-165	69.5	0	0	0	111.8	L84 L105 M108 W109 K199 T200 L201 L206 A207 L270 L274	L84-L203 HydrophobicContact CD1-CD2 4.04Å; L84-L203 HydrophobicContact CD2-CD2 4.41Å; L105-L203 HydrophobicContact CD1-CD2 4.1Å; L105-L203 HydrophobicContact CD1-CG 3.96Å; M108-L203 HydrophobicContact CB-CD1 4Å; W109-L203 HydrophobicContact CB-CD2 4.39Å; W109-L203 HydrophobicContact CE3-CD2 4.17Å; K199-L203 WeakPolarHBondContact O-CB 3.27Å; K199-L203 PolarHBondContact O-N 3.44Å; T200-L203 PolarHBondContact O-N 2.97Å; L201-L203 VanDerWaalsContact C-N 3.35Å; L201-L203 PolarHBondContact O-N 3.5Å; L203-L206 PolarHBondContact O-N 3.42Å; L203-A207 WeakPolarHBondContact O-CB 3.38Å; L203-A207 PolarHBondContact O-N 2.86Å; L203-L270 HydrophobicContact CB-CD1 4.41Å; L203-L270 HydrophobicContact CD1-CD1 4.47Å; L203-L274 HydrophobicContact CD1-CD1 4.07Å
204	I	97.1	Very high	92.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.1	-47.9	173.4	-72.9	169.1	0	0	0	110.5	L84 Q87 L91 F100 L105 T200 L201 L206 A207 L208 L220	L84-I204 HydrophobicContact CD2-CD1 4.16Å; L84-I204 HydrophobicContact CD2-CG1 4.06Å; Q87-I204 HydrophobicContact CB-CD1 3.44Å; Q87-I204 VanDerWaalsContact CB-CD1 3.44Å; Q87-I204 HydrophobicContact CG-CD1 4.18Å; Q87-I204 VanDerWaalsContact OE1-CD1 3.22Å; L91-I204 HydrophobicContact CD1-CG2 3.6Å; F100-I204 HydrophobicContact CZ-CG2 4.13Å; L105-I204 HydrophobicContact CD1-CG1 4.4Å; L105-I204 HydrophobicContact CD2-CG1 4.37Å; T200-I204 WeakPolarHBondContact O-CG1 3.39Å; T200-I204 PolarHBondContact O-N 3.27Å; L201-I204 PolarHBondContact O-N 3.35Å; I204-L206 VanDerWaalsContact C-N 3.35Å; I204-L206 PolarHBondContact O-N 2.91Å; I204-A207 PolarHBondContact O-N 2.9Å; I204-A207 VanDerWaalsContact O-N 3.16Å; I204-L208 HydrophobicContact CG2-CD1 4.03Å; I204-L208 HydrophobicContact CG2-CG 4.38Å; I204-L208 WeakPolarHBondContact O-CG 3.43Å; I204-L208 PolarHBondContact O-N 2.87Å; I204-L220 HydrophobicContact CB-CD2 4.44Å; I204-L220 HydrophobicContact CG2-CD1 4Å; I204-L220 HydrophobicContact CG2-CD2 3.86Å
205	H	95.9	Very high	92.7	Very high	8 Å²	8	21.6 Å²	21.6	4%	0.037	11%	0.105	C	C	.	.	H	α-helix	trans	-57.6	-46.4	177.2	173.4	53.8	0	0	0	111.8	L201 A202 A207 L208 V209 L217 L220	L201-H205 WeakPolarHBondContact O-CB 3.34Å; L201-H205 PolarHBondContact O-N 3.47Å; A202-H205 PolarHBondContact O-N 3.1Å; H205-A207 VanDerWaalsContact C-N 3.32Å; H205-A207 PolarHBondContact O-N 2.74Å; H205-L208 PolarHBondContact O-N 3.31Å; H205-V209 WeakPolarHBondContact O-CG2 3.48Å; H205-V209 PolarHBondContact O-N 2.91Å; H205-L217 HydrophobicContact CB-CD1 4.19Å; H205-L220 HydrophobicContact CB-CD2 4.17Å
206	L	95	Very high	93.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.3	-41.6	176.1	-69.9	177	0	0	0	112.4	M108 A202 L203 I204 L208 V209 W210 A267 L270 V271 L276 F279 L336	M108-L206 HydrophobicContact SD-CB 4.12Å; A202-L206 WeakPolarHBondContact O-CG 3.37Å; A202-L206 PolarHBondContact O-N 2.88Å; L203-L206 PolarHBondContact O-N 3.42Å; I204-L206 VanDerWaalsContact C-N 3.35Å; I204-L206 PolarHBondContact O-N 2.91Å; L206-L208 VanDerWaalsContact C-N 3.35Å; L206-V209 PolarHBondContact O-N 3.39Å; L206-W210 WeakPolarHBondContact O-CB 3.48Å; L206-W210 PolarHBondContact O-N 3.4Å; L206-A267 HydrophobicContact CD1-CB 4.46Å; L206-A267 HydrophobicContact CD2-CB 3.96Å; L206-A267 HydrophobicContact CG-CB 4.02Å; L206-L270 HydrophobicContact CD1-CB 3.79Å; L206-L270 HydrophobicContact CD1-CD1 4.46Å; L206-V271 HydrophobicContact CD1-CG2 4Å; L206-V271 HydrophobicContact CD2-CG2 3.51Å; L206-V271 HydrophobicContact CG-CG2 4.42Å; L206-L276 HydrophobicContact CD1-CD1 4.33Å; L206-F279 HydrophobicContact CB-CZ 4.46Å; L206-F279 HydrophobicContact CD2-CE2 4.45Å; L206-F279 HydrophobicContact CD2-CZ 4.07Å; L206-F279 WeakPolarHBondContact O-CE2 3.25Å; L206-L336 HydrophobicContact CD2-CD1 4.19Å; L206-L336 HydrophobicContact CD2-CD2 3.85Å
207	A	95.1	Very high	93.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-66.9	-35.3	177.8	0	0	0	0	0	112.2	F100 V104 L105 M108 L203 I204 H205 W210 S211	F100-A207 HydrophobicContact CD2-CB 3.85Å; F100-A207 WeakPolarHBondContact CD2-O 3.39Å; F100-A207 VanDerWaalsContact CE2-C 3.43Å; F100-A207 HydrophobicContact CE2-CB 3.31Å; F100-A207 HydrophobicContact CZ-CB 4.15Å; V104-A207 HydrophobicContact CG1-CB 3.83Å; L105-A207 HydrophobicContact CB-CB 3.98Å; L105-A207 HydrophobicContact CD1-CB 4Å; M108-A207 HydrophobicContact SD-CB 4.03Å; L203-A207 WeakPolarHBondContact O-CB 3.38Å; L203-A207 PolarHBondContact O-N 2.86Å; I204-A207 PolarHBondContact O-N 2.9Å; I204-A207 VanDerWaalsContact O-N 3.16Å; H205-A207 VanDerWaalsContact C-N 3.32Å; H205-A207 PolarHBondContact O-N 2.74Å; A207-W210 PolarHBondContact O-N 3.17Å; A207-S211 WeakPolarHBondContact O-CB 3.32Å; A207-S211 PolarHBondContact O-N 2.94Å; A207-S211 PolarHBondContact O-OG 3.29Å
208	L	93.9	Very high	93.5	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-65.8	-45.7	176.4	-73.2	170.7	0	0	0	110.4	V96 F100 I204 H205 L206 W210 S211 R212 E213 L215	V96-L208 HydrophobicContact CG1-CD2 4.14Å; V96-L208 HydrophobicContact CG2-CD2 4.49Å; F100-L208 HydrophobicContact CD2-CD2 3.82Å; F100-L208 HydrophobicContact CD2-CG 4.19Å; F100-L208 HydrophobicContact CE2-CB 4.26Å; F100-L208 HydrophobicContact CE2-CD2 3.61Å; F100-L208 HydrophobicContact CE2-CG 3.59Å; F100-L208 VanDerWaalsContact CE2-N 3.32Å; F100-L208 HydrophobicContact CG-CD2 4.35Å; F100-L208 HydrophobicContact CZ-CD2 4.01Å; F100-L208 HydrophobicContact CZ-CG 4.09Å; I204-L208 HydrophobicContact CG2-CD1 4.03Å; I204-L208 HydrophobicContact CG2-CG 4.38Å; I204-L208 WeakPolarHBondContact O-CG 3.43Å; I204-L208 PolarHBondContact O-N 2.87Å; H205-L208 PolarHBondContact O-N 3.31Å; L206-L208 VanDerWaalsContact C-N 3.35Å; L208-W210 PolarHBondContact O-N 3.44Å; L208-S211 CarbonylContact O-C 3.57Å; L208-S211 PolarHBondContact O-N 3.45Å; L208-R212 PolarHBondContact O-N 3.01Å; L208-E213 HydrophobicContact CD2-CB 3.97Å; L208-E213 HydrophobicContact CD2-CG 4.12Å; L208-E213 PolarHBondContact O-N 2.98Å; L208-E213 VanDerWaalsContact O-N 3.14Å; L208-L215 HydrophobicContact CD1-CB 4.31Å
209	V	91.9	Very high	93.6	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.018	8%	0.08	C	C	.	.	H	α-helix	trans	-63.2	-43.2	176.9	179.3	0	0	0	0	110.8	H205 L206 S211 R212 F279 L288 Y339	H205-V209 WeakPolarHBondContact O-CG2 3.48Å; H205-V209 PolarHBondContact O-N 2.91Å; L206-V209 PolarHBondContact O-N 3.39Å; V209-S211 VanDerWaalsContact C-N 3.29Å; V209-S211 PolarHBondContact O-N 3.42Å; V209-R212 PolarHBondContact O-N 3.42Å; V209-R212 VanDerWaalsContact O-N 3.12Å; V209-F279 HydrophobicContact CB-CD2 4.33Å; V209-F279 HydrophobicContact CB-CE2 4.12Å; V209-F279 HydrophobicContact CG1-CD2 3.81Å; V209-F279 HydrophobicContact CG1-CE2 4.01Å; V209-L288 HydrophobicContact CB-CD2 4.3Å; V209-L288 HydrophobicContact CG1-CD2 4.07Å; V209-L288 HydrophobicContact CG2-CD2 4.17Å; V209-Y339 HydrophobicContact CG1-CE2 3.85Å; V209-Y339 HydrophobicContact CG2-CE2 4.45Å
210	W	91.3	Very high	93.7	Very high	70 Å²	70	16 Å²	16	27%	0.265	8%	0.078	S	C	.	.	H	α-helix	trans	-61.9	-37.9	176.4	-178.2	-73.4	0	0	0	112.3	V104 M108 L206 A207 L208 R212 P277 F279 P280	V104-W210 HydrophobicContact CG1-CB 3.77Å; V104-W210 HydrophobicContact CG1-CG 3.62Å; V104-W210 VanDerWaalsContact CG2-CD1 3.49Å; M108-W210 HydrophobicContact CE-CB 3.69Å; M108-W210 HydrophobicContact CE-CD2 3.94Å; M108-W210 HydrophobicContact CE-CE3 3.92Å; M108-W210 HydrophobicContact CE-CG 3.85Å; L206-W210 WeakPolarHBondContact O-CB 3.48Å; L206-W210 PolarHBondContact O-N 3.4Å; A207-W210 PolarHBondContact O-N 3.17Å; L208-W210 PolarHBondContact O-N 3.44Å; W210-R212 PolarHBondContact O-N 2.86Å; W210-P277 HydrophobicContact CH2-CG 3.63Å; W210-P277 HydrophobicContact CZ3-CG 3.96Å; W210-F279 HydrophobicContact CB-CD2 4.13Å; W210-F279 HydrophobicContact CB-CE2 4.05Å; W210-F279 HydrophobicContact CE3-CB 4.31Å; W210-F279 AromaticContact CE3-CD1 3.47Å; W210-F279 HydrophobicContact CE3-CD1 3.47Å; W210-F279 VanDerWaalsContact CE3-CD1 3.47Å; W210-F279 HydrophobicContact CE3-CD2 4.05Å; W210-F279 AromaticContact CE3-CE1 3.67Å; W210-F279 HydrophobicContact CE3-CE1 3.67Å; W210-F279 HydrophobicContact CE3-CE2 4.23Å; W210-F279 AromaticContact CE3-CG 3.68Å; W210-F279 HydrophobicContact CE3-CG 3.68Å; W210-F279 HydrophobicContact CE3-CZ 4.05Å; W210-F279 AromaticContact CZ3-CD1 3.63Å; W210-F279 HydrophobicContact CZ3-CD1 3.63Å; W210-F279 HydrophobicContact CZ3-CE1 4.01Å; W210-F279 HydrophobicContact CZ3-CG 4.13Å; W210-P280 HydrophobicContact CD2-CG 4.35Å; W210-P280 HydrophobicContact CZ2-CG 4.35Å
211	S	90.7	Very high	93.6	Very high	29 Å²	29	16.2 Å²	16.2	20%	0.203	8%	0.079	C	C	.	.	H	α-helix	trans	-77.5	-8.9	178.3	-53	0	0	0	0	113	V104 A207 L208 V209 E213	V104-S211 WeakPolarHBondContact CG2-OG 3.4Å; A207-S211 WeakPolarHBondContact O-CB 3.32Å; A207-S211 PolarHBondContact O-N 2.94Å; A207-S211 PolarHBondContact O-OG 3.29Å; L208-S211 CarbonylContact O-C 3.57Å; L208-S211 PolarHBondContact O-N 3.45Å; V209-S211 VanDerWaalsContact C-N 3.29Å; V209-S211 PolarHBondContact O-N 3.42Å; S211-E213 PolarHBondContact O-N 3.32Å
212	R	88.6	Confident	93.4	Very high	108 Å²	108	17 Å²	17	41%	0.408	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	34.2	-175.3	-56.4	172.6	-69.1	177.1	2	112.7	L208 V209 W210	L208-R212 PolarHBondContact O-N 3.01Å; V209-R212 PolarHBondContact O-N 3.42Å; V209-R212 VanDerWaalsContact O-N 3.12Å; W210-R212 PolarHBondContact O-N 2.86Å
213	E	89.9	Confident	93.3	Very high	38 Å²	38	17.6 Å²	17.6	18%	0.178	9%	0.085	C	C	.	.			trans	-69.3	153.9	176.1	-70	-70.6	179.1	0	0	111.1	V96 A97 L208 S211 L215	V96-E213 HydrophobicContact CG1-CG 3.98Å; A97-E213 WeakPolarHBondContact CB-OE1 3.35Å; A97-E213 PolarHBondContact N-OE1 3.49Å; L208-E213 HydrophobicContact CD2-CB 3.97Å; L208-E213 HydrophobicContact CD2-CG 4.12Å; L208-E213 PolarHBondContact O-N 2.98Å; L208-E213 VanDerWaalsContact O-N 3.14Å; S211-E213 PolarHBondContact O-N 3.32Å; E213-L215 PolarHBondContact O-N 3.39Å
214	A	85.8	Confident	93.1	Very high	32 Å²	32	17.9 Å²	17.9	26%	0.264	9%	0.087	S	C	.	.	S	Bend	trans	-71.6	-13.1	-176.5	0	0	0	0	0	114.4	L287	A214-L287 HydrophobicContact CB-CB 3.65Å; A214-L287 HydrophobicContact CB-CD1 3.61Å; A214-L287 HydrophobicContact CB-CG 4.28Å
215	L	91.7	Very high	92.7	Very high	33 Å²	33	21.4 Å²	21.4	17%	0.173	10%	0.102	C	C	.	.			trans	-80.2	119.5	-175.5	-65.3	175.8	0	0	0	111.2	L91 V96 L208 E213 D219 L223	L91-L215 HydrophobicContact CD2-CD1 4.08Å; V96-L215 HydrophobicContact CG2-CD1 3.45Å; V96-L215 VanDerWaalsContact CG2-CD1 3.45Å; L208-L215 HydrophobicContact CD1-CB 4.31Å; E213-L215 PolarHBondContact O-N 3.39Å; L215-D219 HydrophobicContact CB-CB 4.45Å; L215-D219 HydrophobicContact CD2-CB 4.06Å; L215-L223 HydrophobicContact CD1-CD1 4.45Å; L215-L223 HydrophobicContact CD2-CD1 4.48Å
216	T	93.9	Very high	92.2	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.018	11%	0.113	C	C	.	.			trans	-81.9	176.2	175.1	68.7	0	0	0	0	111.9	D219 L220 L288 L293 D340	T216-D219 PolarHBondContact N-OD2 3.16Å; T216-D219 PolarHBondContact O-N 3.39Å; T216-D219 VanDerWaalsContact OG1-CG 3.31Å; T216-D219 PolarHBondContact OG1-N 3.18Å; T216-D219 PolarHBondContact OG1-OD2 2.93Å; T216-D219 VanDerWaalsContact OG1-OD2 3.06Å; T216-L220 PolarHBondContact O-N 3.31Å; T216-L288 HydrophobicContact CG2-CD1 4.09Å; T216-L293 HydrophobicContact CG2-CD1 4.07Å; T216-L293 HydrophobicContact CG2-CD2 3.79Å; T216-D340 HydrophobicContact CG2-CB 4.15Å
217	L	95.6	Very high	91.8	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-67.8	-38.9	175.1	178.5	55.6	0	0	0	111	H205 D219 L220 L221 V263 H264 D340	H205-L217 HydrophobicContact CB-CD1 4.19Å; L217-D219 VanDerWaalsContact C-N 3.3Å; L217-D219 PolarHBondContact O-N 2.93Å; L217-L220 HydrophobicContact CD1-CD2 4.41Å; L217-L220 PolarHBondContact O-N 3.27Å; L217-L221 HydrophobicContact CD1-CD1 4.31Å; L217-L221 HydrophobicContact CD1-CG 4.18Å; L217-L221 HydrophobicContact CG-CD1 4.31Å; L217-L221 WeakPolarHBondContact O-CG 3.42Å; L217-L221 PolarHBondContact O-N 2.8Å; L217-V263 HydrophobicContact CD1-CB 4.17Å; L217-V263 HydrophobicContact CD1-CG1 3.74Å; L217-V263 HydrophobicContact CD2-CB 4.38Å; L217-V263 HydrophobicContact CD2-CG1 4.48Å; L217-H264 HydrophobicContact CD2-CB 3.81Å; L217-D340 PolarHBondContact N-OD2 3.07Å
218	S	95.1	Very high	91.5	Very high	5 Å²	5	29.1 Å²	29.1	4%	0.035	15%	0.154	C	C	.	.	H	α-helix	trans	-55.9	-43.6	170.1	-70.8	0	0	0	0	112.4	L221 R222 D340 L533	S218-L221 PolarHBondContact O-N 3.41Å; S218-R222 WeakPolarHBondContact O-CB 3.29Å; S218-R222 PolarHBondContact O-N 3.41Å; S218-D340 PolarHBondContact N-OD2 3.41Å; S218-L533 VanDerWaalsContact CB-O 3.25Å; S218-L533 WeakPolarHBondContact CB-O 3.08Å; S218-L533 PolarHBondContact OG-O 3.31Å
219	D	94.8	Very high	91.5	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.027	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-46.8	177.7	-64.3	-36.7	0	0	0	111.7	L215 T216 L217 L221 R222 L223 R296	L215-D219 HydrophobicContact CB-CB 4.45Å; L215-D219 HydrophobicContact CD2-CB 4.06Å; T216-D219 PolarHBondContact N-OD2 3.16Å; T216-D219 PolarHBondContact O-N 3.39Å; T216-D219 VanDerWaalsContact OG1-CG 3.31Å; T216-D219 PolarHBondContact OG1-N 3.18Å; T216-D219 PolarHBondContact OG1-OD2 2.93Å; T216-D219 VanDerWaalsContact OG1-OD2 3.06Å; L217-D219 VanDerWaalsContact C-N 3.3Å; L217-D219 PolarHBondContact O-N 2.93Å; D219-L221 VanDerWaalsContact C-N 3.34Å; D219-L221 PolarHBondContact O-N 3.21Å; D219-R222 PolarHBondContact O-N 3.13Å; D219-R222 IonicContact OD1-CZ 2.72Å; D219-R222 IonicContact OD1-NH2 3.98Å; D219-R222 PolarHBondContact OD1-NH2 3.27Å; D219-L223 VanDerWaalsContact O-CG 3.3Å; D219-L223 WeakPolarHBondContact O-CG 3.45Å; D219-L223 PolarHBondContact O-N 3.45Å; D219-R296 IonicContact OD1-NH1 3.4Å; D219-R296 IonicContact OD1-NH2 2.64Å; D219-R296 IonicContact OD2-CZ 2.93Å; D219-R296 VanDerWaalsContact OD2-CZ 3.28Å; D219-R296 IonicContact OD2-NH1 3.22Å; D219-R296 PolarHBondContact OD2-NH1 2.97Å; D219-R296 IonicContact OD2-NH2 3.71Å; D219-R296 PolarHBondContact OD2-NH2 2.97Å
220	L	95.6	Very high	91.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-46	177.3	175.9	62.3	0	0	0	111.8	L91 I204 H205 T216 L217 L223 V224	L91-L220 HydrophobicContact CD1-CD1 4.46Å; L91-L220 HydrophobicContact CD2-CD1 4.42Å; I204-L220 HydrophobicContact CB-CD2 4.44Å; I204-L220 HydrophobicContact CG2-CD1 4Å; I204-L220 HydrophobicContact CG2-CD2 3.86Å; H205-L220 HydrophobicContact CB-CD2 4.17Å; T216-L220 PolarHBondContact O-N 3.31Å; L217-L220 HydrophobicContact CD1-CD2 4.41Å; L217-L220 PolarHBondContact O-N 3.27Å; L220-L223 PolarHBondContact O-N 3Å; L220-V224 WeakPolarHBondContact O-CG2 3.01Å; L220-V224 PolarHBondContact O-N 3.29Å
221	L	95.1	Very high	91.4	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-67.8	-36.2	-179.9	-69.9	179	0	0	0	112.4	L201 L217 S218 D219 V224 K225 I257 H260 V263	L201-L221 HydrophobicContact CD1-CD2 4.05Å; L217-L221 HydrophobicContact CD1-CD1 4.31Å; L217-L221 HydrophobicContact CD1-CG 4.18Å; L217-L221 HydrophobicContact CG-CD1 4.31Å; L217-L221 WeakPolarHBondContact O-CG 3.42Å; L217-L221 PolarHBondContact O-N 2.8Å; S218-L221 PolarHBondContact O-N 3.41Å; D219-L221 VanDerWaalsContact C-N 3.34Å; D219-L221 PolarHBondContact O-N 3.21Å; L221-V224 WeakPolarHBondContact O-CB 3.36Å; L221-V224 PolarHBondContact O-N 3.43Å; L221-K225 WeakPolarHBondContact O-CG 3.39Å; L221-K225 PolarHBondContact O-N 3.06Å; L221-I257 HydrophobicContact CD2-CG2 4.48Å; L221-H260 VanDerWaalsContact CD1-CA 3.46Å; L221-H260 HydrophobicContact CD1-CB 3.94Å; L221-V263 HydrophobicContact CD2-CG2 4.16Å
222	R	92.5	Very high	91.1	Very high	17 Å²	17	27.2 Å²	27.2	6%	0.064	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-48.3	171.9	172.9	170.7	50	169.7	-6.7	111.7	S218 D219 V224 K225 E226 S455 F456	S218-R222 WeakPolarHBondContact O-CB 3.29Å; S218-R222 PolarHBondContact O-N 3.41Å; D219-R222 PolarHBondContact O-N 3.13Å; D219-R222 IonicContact OD1-CZ 2.72Å; D219-R222 IonicContact OD1-NH2 3.98Å; D219-R222 PolarHBondContact OD1-NH2 3.27Å; R222-V224 PolarHBondContact O-N 3.4Å; R222-K225 CarbonylContact O-C 3.49Å; R222-K225 WeakPolarHBondContact O-CA 3.48Å; R222-K225 WeakPolarHBondContact O-CB 3.33Å; R222-K225 PolarHBondContact O-N 2.88Å; R222-E226 VanDerWaalsContact CD-OE1 3.26Å; R222-E226 WeakPolarHBondContact CD-OE1 3.48Å; R222-E226 VanDerWaalsContact CG-CD 3.46Å; R222-E226 HydrophobicContact CG-CG 4.28Å; R222-E226 WeakPolarHBondContact CG-OE1 3.38Å; R222-E226 WeakPolarHBondContact O-CB 3.29Å; R222-E226 WeakPolarHBondContact O-CG 3.45Å; R222-E226 PolarHBondContact O-N 3.11Å; R222-S455 PolarHBondContact NH1-O 3.41Å; R222-S455 PolarHBondContact NH2-O 2.75Å; R222-F456 PolarHBondContact NH1-O 3.02Å
223	L	92.9	Very high	90.6	Very high	12 Å²	12	24.3 Å²	24.3	6%	0.063	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-35.3	177	-69.2	172.3	0	0	0	112.1	L91 L94 L215 D219 L220 G227 H228 V229 A453	L91-L223 HydrophobicContact CD2-CD1 4.1Å; L94-L223 HydrophobicContact CD1-CD1 3.86Å; L94-L223 HydrophobicContact CD1-CD2 3.9Å; L94-L223 HydrophobicContact CD1-CG 4.42Å; L215-L223 HydrophobicContact CD1-CD1 4.45Å; L215-L223 HydrophobicContact CD2-CD1 4.48Å; D219-L223 VanDerWaalsContact O-CG 3.3Å; D219-L223 WeakPolarHBondContact O-CG 3.45Å; D219-L223 PolarHBondContact O-N 3.45Å; L220-L223 PolarHBondContact O-N 3Å; L223-G227 PolarHBondContact O-N 3.37Å; L223-H228 HydrophobicContact CB-CB 4.36Å; L223-H228 HydrophobicContact CD2-CB 4.06Å; L223-H228 PolarHBondContact O-N 3.25Å; L223-V229 HydrophobicContact CB-CG2 3.89Å; L223-V229 PolarHBondContact O-N 3.45Å; L223-V229 VanDerWaalsContact O-N 3.15Å; L223-A453 HydrophobicContact CD2-CB 3.97Å
224	V	92.3	Very high	90.2	Very high	7 Å²	7	22.6 Å²	22.6	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-66.7	-45.5	171.8	168.1	0	0	0	0	111.3	L201 L220 L221 R222 E226 G227 V229 Y231 I257	L201-V224 HydrophobicContact CD2-CG2 3.83Å; L220-V224 WeakPolarHBondContact O-CG2 3.01Å; L220-V224 PolarHBondContact O-N 3.29Å; L221-V224 WeakPolarHBondContact O-CB 3.36Å; L221-V224 PolarHBondContact O-N 3.43Å; R222-V224 PolarHBondContact O-N 3.4Å; V224-E226 VanDerWaalsContact C-N 3.33Å; V224-E226 PolarHBondContact O-N 2.91Å; V224-G227 PolarHBondContact O-N 3.01Å; V224-V229 HydrophobicContact CG2-CB 3.84Å; V224-V229 HydrophobicContact CG2-CG1 3.87Å; V224-Y231 VanDerWaalsContact CG1-CB 3.42Å; V224-Y231 HydrophobicContact CG1-CD1 3.95Å; V224-Y231 HydrophobicContact CG1-CG 3.8Å; V224-I257 HydrophobicContact CG1-CD1 4.11Å; V224-I257 HydrophobicContact CG1-CG1 4.19Å; V224-I257 HydrophobicContact CG1-CG2 4.09Å
225	K	88.8	Confident	89.9	Confident	73 Å²	73	22 Å²	22	32%	0.317	13%	0.126	S	C	.	.	H	α-helix	trans	-61.1	-42.1	177.2	-76.8	-179.8	176.5	-162.3	0	111.6	L221 R222 G227 I257 K406 D534	L221-K225 WeakPolarHBondContact O-CG 3.39Å; L221-K225 PolarHBondContact O-N 3.06Å; R222-K225 CarbonylContact O-C 3.49Å; R222-K225 WeakPolarHBondContact O-CA 3.48Å; R222-K225 WeakPolarHBondContact O-CB 3.33Å; R222-K225 PolarHBondContact O-N 2.88Å; K225-G227 PolarHBondContact O-N 3.36Å; K225-I257 HydrophobicContact CB-CD1 4.19Å; K225-I257 HydrophobicContact CG-CD1 3.55Å; K225-I257 HydrophobicContact CG-CG2 4.22Å; K225-K406 WeakPolarHBondContact O-CE 3.41Å; K225-K406 PolarHBondContact O-NZ 2.87Å; K225-D534 VanDerWaalsContact CD-OD2 3.32Å; K225-D534 WeakPolarHBondContact CD-OD2 3.42Å; K225-D534 WeakPolarHBondContact CE-OD2 3.45Å; K225-D534 IonicContact NZ-OD1 3.19Å; K225-D534 PolarHBondContact NZ-OD1 3.43Å; K225-D534 IonicContact NZ-OD2 3.39Å; K225-D534 PolarHBondContact NZ-OD2 3.33Å
226	E	86.7	Confident	89.4	Confident	59 Å²	59	22.2 Å²	22.2	28%	0.276	13%	0.126	S	C	.	.	H	α-helix	trans	-73.8	-14	180	-70.9	165.5	-177.3	0	0	113.1	R222 V224 H228	R222-E226 VanDerWaalsContact CD-OE1 3.26Å; R222-E226 WeakPolarHBondContact CD-OE1 3.48Å; R222-E226 VanDerWaalsContact CG-CD 3.46Å; R222-E226 HydrophobicContact CG-CG 4.28Å; R222-E226 WeakPolarHBondContact CG-OE1 3.38Å; R222-E226 WeakPolarHBondContact O-CB 3.29Å; R222-E226 WeakPolarHBondContact O-CG 3.45Å; R222-E226 PolarHBondContact O-N 3.11Å; V224-E226 VanDerWaalsContact C-N 3.33Å; V224-E226 PolarHBondContact O-N 2.91Å; E226-H228 IonicContact OE2-CD2 3.36Å; E226-H228 PolarHBondContact OE2-CD2 2.91Å; E226-H228 IonicContact OE2-NE2 3.28Å
227	G	86.3	Confident	88.8	Confident	59 Å²	59	26.1 Å²	26.1	61%	0.608	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	86	9.7	178.8	0	0	0	0	0	113.9	L223 V224 K225	L223-G227 PolarHBondContact O-N 3.37Å; V224-G227 PolarHBondContact O-N 3.01Å; K225-G227 PolarHBondContact O-N 3.36Å
228	H	89.3	Confident	88.2	Confident	53 Å²	53	26.3 Å²	26.3	25%	0.245	15%	0.148	C	C	.	.	S	Bend	trans	-71.4	-32.7	173.3	-64.4	-58.3	0	0	0	112	A90 L94 L223 E226	A90-H228 WeakPolarHBondContact CB-O 3.35Å; L94-H228 HydrophobicContact CD1-CB 4.2Å; L223-H228 HydrophobicContact CB-CB 4.36Å; L223-H228 HydrophobicContact CD2-CB 4.06Å; L223-H228 PolarHBondContact O-N 3.25Å; E226-H228 IonicContact OE2-CD2 3.36Å; E226-H228 PolarHBondContact OE2-CD2 2.91Å; E226-H228 IonicContact OE2-NE2 3.28Å
229	V	92.1	Very high	87.6	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	16%	0.16	C	C	.	.	S	Bend	trans	-110.6	120.8	173.8	176.9	0	0	0	0	109.6	Q87 A90 L91 L223 V224 Y231	Q87-V229 HydrophobicContact CB-CG1 4.13Å; Q87-V229 HydrophobicContact CG-CG1 3.99Å; A90-V229 HydrophobicContact CB-CG2 4.43Å; L91-V229 HydrophobicContact CD2-CG2 3.75Å; L91-V229 HydrophobicContact CG-CG2 4.16Å; L223-V229 HydrophobicContact CB-CG2 3.89Å; L223-V229 PolarHBondContact O-N 3.45Å; L223-V229 VanDerWaalsContact O-N 3.15Å; V224-V229 HydrophobicContact CG2-CB 3.84Å; V224-V229 HydrophobicContact CG2-CG1 3.87Å; V229-Y231 PolarHBondContact O-N 3.07Å
230	P	90.8	Very high	86.6	Confident	27 Å²	27	35.2 Å²	35.2	18%	0.175	19%	0.193	C	C	.	.			trans	-67.1	126.2	-176.2	25.7	-33.2	0	0	0	111.5	N86 Q87 A234	N86-P230 HydrophobicContact CB-CG 4.15Å; Q87-P230 HydrophobicContact CG-CG 4.18Å; Q87-P230 WeakPolarHBondContact CG-O 3.38Å; Q87-P230 PolarHBondContact NE2-O 2.88Å; P230-A234 HydrophobicContact CB-CB 4.26Å
231	Y	90.8	Very high	85.7	Confident	11 Å²	11	39.5 Å²	39.5	4%	0.043	21%	0.212	C	C	.	.			trans	-142.4	-64.8	178.7	-174	-104.5	0	0	0	112.4	M197 K198 L201 V224 V229 T233 A234 V254 I257 P258	M197-Y231 HydrophobicContact CB-CE2 3.81Å; M197-Y231 HydrophobicContact CE-CD2 3.96Å; M197-Y231 HydrophobicContact CE-CE2 4.14Å; M197-Y231 VanDerWaalsContact CE-O 3.28Å; M197-Y231 WeakPolarHBondContact CE-O 3.44Å; M197-Y231 WeakPolarHBondContact O-CE2 3.44Å; K198-Y231 PolarHBondContact N-OH 3.35Å; L201-Y231 HydrophobicContact CD1-CD2 3.62Å; L201-Y231 HydrophobicContact CD1-CE1 4.36Å; L201-Y231 HydrophobicContact CD1-CE2 3.35Å; L201-Y231 HydrophobicContact CD1-CG 4.26Å; L201-Y231 HydrophobicContact CD2-CD2 3.86Å; L201-Y231 HydrophobicContact CD2-CE2 4.22Å; L201-Y231 HydrophobicContact CG-CD2 3.67Å; L201-Y231 HydrophobicContact CG-CE2 3.5Å; L201-Y231 VanDerWaalsContact CG-CE2 3.5Å; V224-Y231 VanDerWaalsContact CG1-CB 3.42Å; V224-Y231 HydrophobicContact CG1-CD1 3.95Å; V224-Y231 HydrophobicContact CG1-CG 3.8Å; V229-Y231 PolarHBondContact O-N 3.07Å; Y231-T233 VanDerWaalsContact C-N 3.35Å; Y231-T233 PolarHBondContact O-N 2.86Å; Y231-A234 WeakPolarHBondContact O-CB 3.38Å; Y231-A234 PolarHBondContact O-N 2.76Å; Y231-V254 HydrophobicContact CD1-CG1 3.82Å; Y231-V254 HydrophobicContact CD1-CG2 4.37Å; Y231-V254 HydrophobicContact CE1-CB 4.33Å; Y231-V254 HydrophobicContact CE1-CG1 3.37Å; Y231-V254 HydrophobicContact CE1-CG2 4Å; Y231-I257 HydrophobicContact CD1-CG1 4.3Å; Y231-P258 VanDerWaalsContact CE1-CD 3.45Å; Y231-P258 HydrophobicContact CE1-CG 4.4Å; Y231-P258 WeakPolarHBondContact OH-CD 3.13Å
232	V	84.3	Confident	84.8	Confident	24 Å²	24	41.2 Å²	41.2	15%	0.145	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-43.1	-174.8	-179.7	0	0	0	0	111.8	Y235 V254 I257 W408	V232-Y235 WeakPolarHBondContact O-CE1 3.3Å; V232-V254 HydrophobicContact CG2-CG1 4.33Å; V232-I257 HydrophobicContact CG2-CD1 4.22Å; V232-I257 HydrophobicContact CG2-CG1 3.85Å; V232-W408 HydrophobicContact CG2-CZ3 4.45Å
233	T	77.6	Confident	83.9	Confident	47 Å²	47	44.7 Å²	44.7	29%	0.288	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	19.4	179.6	56.3	0	0	0	0	112.5	Y231 Y235 E236	Y231-T233 VanDerWaalsContact C-N 3.35Å; Y231-T233 PolarHBondContact O-N 2.86Å; T233-Y235 PolarHBondContact O-N 2.82Å; T233-Y235 VanDerWaalsContact O-N 3.08Å; T233-E236 VanDerWaalsContact O-CB 3.29Å; T233-E236 WeakPolarHBondContact O-CB 3.46Å; T233-E236 WeakPolarHBondContact O-CG 3.27Å; T233-E236 PolarHBondContact O-N 3.47Å
234	A	81.9	Confident	82.9	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.017	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-60.3	-25.6	-175.7	0	0	0	0	0	113.3	I83 M197 P230 Y231 E236 D237	I83-A234 HydrophobicContact CD1-CB 4.43Å; I83-A234 HydrophobicContact CG1-CB 4.21Å; I83-A234 HydrophobicContact CG2-CB 3.96Å; M197-A234 HydrophobicContact CE-CB 3.99Å; P230-A234 HydrophobicContact CB-CB 4.26Å; Y231-A234 WeakPolarHBondContact O-CB 3.38Å; Y231-A234 PolarHBondContact O-N 2.76Å; A234-E236 PolarHBondContact O-N 2.88Å; A234-D237 PolarHBondContact O-N 3.26Å
235	Y	79.6	Confident	81.4	Confident	18 Å²	18	48.1 Å²	48.1	7%	0.071	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-67.1	-18.8	174.9	70	-93.6	0	0	0	113.3	V232 T233 D237 L238 L244 G410 K412 F414	V232-Y235 WeakPolarHBondContact O-CE1 3.3Å; T233-Y235 PolarHBondContact O-N 2.82Å; T233-Y235 VanDerWaalsContact O-N 3.08Å; Y235-D237 VanDerWaalsContact C-N 3.29Å; Y235-L238 WeakPolarHBondContact O-CB 3.37Å; Y235-L238 WeakPolarHBondContact O-CG 3.21Å; Y235-L238 PolarHBondContact O-N 3.11Å; Y235-L244 HydrophobicContact CD2-CD1 4.29Å; Y235-L244 HydrophobicContact CG-CD1 4.46Å; Y235-G410 WeakPolarHBondContact OH-CA 3.4Å; Y235-K412 HydrophobicContact CE2-CB 4.05Å; Y235-K412 WeakPolarHBondContact CE2-O 3.33Å; Y235-K412 PolarHBondContact OH-O 2.97Å; Y235-K412 VanDerWaalsContact OH-O 3.11Å; Y235-F414 AromaticContact CD1-CE2 3.89Å; Y235-F414 HydrophobicContact CD1-CE2 3.89Å; Y235-F414 AromaticContact CD1-CZ 3.72Å; Y235-F414 HydrophobicContact CD1-CZ 3.72Å; Y235-F414 HydrophobicContact CD2-CE1 4.46Å; Y235-F414 AromaticContact CD2-CE2 3.91Å; Y235-F414 HydrophobicContact CD2-CE2 3.91Å; Y235-F414 AromaticContact CD2-CZ 3.61Å; Y235-F414 HydrophobicContact CD2-CZ 3.61Å; Y235-F414 AromaticContact CE1-CE2 3.57Å; Y235-F414 HydrophobicContact CE1-CE2 3.57Å; Y235-F414 AromaticContact CE1-CZ 3.92Å; Y235-F414 HydrophobicContact CE1-CZ 3.92Å; Y235-F414 HydrophobicContact CE2-CD2 4.41Å; Y235-F414 AromaticContact CE2-CE2 3.57Å; Y235-F414 HydrophobicContact CE2-CE2 3.57Å; Y235-F414 AromaticContact CE2-CZ 3.8Å; Y235-F414 HydrophobicContact CE2-CZ 3.8Å; Y235-F414 HydrophobicContact CG-CE2 4.06Å; Y235-F414 AromaticContact CG-CZ 3.57Å; Y235-F414 HydrophobicContact CG-CZ 3.57Å; Y235-F414 AromaticContact CZ-CE2 3.4Å; Y235-F414 AromaticContact CZ-CZ 3.96Å
236	E	81.3	Confident	80.3	Confident	39 Å²	39	45.5 Å²	45.5	18%	0.182	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-72.7	-28.9	-179.4	-59	-155.9	128.6	0	0	112.7	T233 A234 L238 G410 K411 K412	T233-E236 VanDerWaalsContact O-CB 3.29Å; T233-E236 WeakPolarHBondContact O-CB 3.46Å; T233-E236 WeakPolarHBondContact O-CG 3.27Å; T233-E236 PolarHBondContact O-N 3.47Å; A234-E236 PolarHBondContact O-N 2.88Å; E236-L238 PolarHBondContact O-N 3.07Å; E236-G410 WeakPolarHBondContact OE1-CA 3.33Å; E236-K411 WeakPolarHBondContact OE1-CA 3.3Å; E236-K411 PolarHBondContact OE1-N 3.31Å; E236-K412 HydrophobicContact CG-CB 4.45Å; E236-K412 PolarHBondContact O-NZ 2.89Å; E236-K412 PolarHBondContact OE1-N 3.17Å
237	D	81.3	Confident	79.2	Confident	84 Å²	84	46.1 Å²	46.1	45%	0.449	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-77	-9.6	179.4	-58.1	-34.4	0	0	0	112	F82 N86 A234 Y235	F82-D237 HydrophobicContact CE1-CB 4.14Å; F82-D237 WeakPolarHBondContact CE1-O 3.17Å; F82-D237 VanDerWaalsContact CZ-O 3.24Å; F82-D237 WeakPolarHBondContact CZ-O 3.38Å; N86-D237 WeakPolarHBondContact ND2-CB 3.01Å; A234-D237 PolarHBondContact O-N 3.26Å; Y235-D237 VanDerWaalsContact C-N 3.29Å
238	L	83.4	Confident	78.2	Confident	6 Å²	6	45.4 Å²	45.4	3%	0.031	24%	0.244	C	C	.	.	S	Bend	trans	-59.1	140.3	176.3	-70.4	169.3	0	0	0	110.5	F82 Y235 E236 M242 L244	F82-L238 HydrophobicContact CB-CD2 3.98Å; F82-L238 HydrophobicContact CD1-CD2 3.65Å; F82-L238 HydrophobicContact CD1-CG 4.46Å; F82-L238 HydrophobicContact CE1-CD2 4.43Å; F82-L238 HydrophobicContact CG-CD2 4.02Å; Y235-L238 WeakPolarHBondContact O-CB 3.37Å; Y235-L238 WeakPolarHBondContact O-CG 3.21Å; Y235-L238 PolarHBondContact O-N 3.11Å; E236-L238 PolarHBondContact O-N 3.07Å; L238-M242 HydrophobicContact CB-CB 4.45Å; L238-M242 HydrophobicContact CD2-SD 4.3Å; L238-L244 HydrophobicContact CD1-CD1 3.74Å; L238-L244 HydrophobicContact CD1-CD2 4.26Å; L238-L244 HydrophobicContact CD1-CG 4.1Å
239	P	81.9	Confident	77.3	Confident	44 Å²	44	43.1 Å²	43.1	29%	0.286	23%	0.234	S	C	.	.			trans	-53.1	148.9	178	-24.1	32.4	0	0	0	112.2	F82 E241 M242	F82-P239 HydrophobicContact CD2-CG 4.41Å; F82-P239 HydrophobicContact CE2-CG 3.98Å; F82-P239 HydrophobicContact CZ-CG 4.29Å; P239-E241 WeakPolarHBondContact CB-OE2 3.44Å; P239-E241 PolarHBondContact O-N 3.26Å; P239-M242 PolarHBondContact O-N 3.27Å
240	E	74.1	Confident	76.5	Confident	153 Å²	153	46.6 Å²	46.6	72%	0.715	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-24.1	-178	-64.2	-167.2	163.7	0	0	112.7	K243	E240-K243 WeakPolarHBondContact O-CE 3.26Å; E240-K243 VanDerWaalsContact O-CG 3.31Å; E240-K243 WeakPolarHBondContact O-CG 3.5Å
241	E	76.9	Confident	75.9	Confident	89 Å²	89	47.6 Å²	47.6	42%	0.416	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-21	178.2	-50.2	78.2	-171.7	0	0	112.9	G71 Y72 P239 K243	G71-E241 CarbonylContact C-O 3.56Å; G71-E241 WeakPolarHBondContact CA-O 3.04Å; Y72-E241 HydrophobicContact CD2-CB 3.5Å; Y72-E241 VanDerWaalsContact CD2-CB 3.5Å; Y72-E241 HydrophobicContact CD2-CG 3.87Å; Y72-E241 HydrophobicContact CE2-CB 4.11Å; Y72-E241 HydrophobicContact CE2-CG 3.94Å; Y72-E241 HydrophobicContact CG-CB 4.48Å; Y72-E241 PolarHBondContact N-O 3.19Å; Y72-E241 VanDerWaalsContact N-O 3.08Å; P239-E241 WeakPolarHBondContact CB-OE2 3.44Å; P239-E241 PolarHBondContact O-N 3.26Å; E241-K243 VanDerWaalsContact C-N 3.33Å; E241-K243 PolarHBondContact O-N 3.26Å
242	M	76.7	Confident	75.4	Confident	40 Å²	40	47.1 Å²	47.1	20%	0.197	25%	0.254	C	S	.	.	S	Bend	trans	-90.2	63.1	175.8	-71.8	-169	172.6	0	0	111.4	W74 E78 L238 P239 L244	W74-M242 HydrophobicContact CB-CE 4.1Å; W74-M242 HydrophobicContact CB-CG 4.44Å; W74-M242 HydrophobicContact CD2-CB 4.22Å; W74-M242 HydrophobicContact CD2-CG 3.96Å; W74-M242 HydrophobicContact CD2-SD 4.12Å; W74-M242 HydrophobicContact CE3-SD 4.17Å; W74-M242 HydrophobicContact CG-CB 4.41Å; W74-M242 HydrophobicContact CG-CE 4.36Å; W74-M242 HydrophobicContact CG-CG 3.87Å; W74-M242 HydrophobicContact CG-SD 4.38Å; W74-M242 HydrophobicContact CZ2-CB 4.19Å; E78-M242 HydrophobicContact CB-CE 4.19Å; L238-M242 HydrophobicContact CB-CB 4.45Å; L238-M242 HydrophobicContact CD2-SD 4.3Å; P239-M242 PolarHBondContact O-N 3.27Å; M242-L244 PolarHBondContact O-N 3.35Å
243	K	72.5	Confident	75.2	Confident	90 Å²	90	49.8 Å²	49.8	39%	0.391	27%	0.265	S	S	.	.			trans	-68.1	123.9	179.5	-62.7	-177.6	179.6	173.9	0	110.5	E69 E240 E241	E69-K243 IonicContact OE2-NZ 2.59Å; E69-K243 PolarHBondContact OE2-NZ 2.93Å; E240-K243 WeakPolarHBondContact O-CE 3.26Å; E240-K243 VanDerWaalsContact O-CG 3.31Å; E240-K243 WeakPolarHBondContact O-CG 3.5Å; E241-K243 VanDerWaalsContact C-N 3.33Å; E241-K243 PolarHBondContact O-N 3.26Å
244	L	71.6	Confident	75.3	Confident	28 Å²	28	48.1 Å²	48.1	15%	0.147	25%	0.254	C	S	.	.			trans	-83.9	111.3	177.2	-70.2	168.8	0	0	0	110.3	W74 Y235 L238 M242 A249 F252 F414	W74-L244 HydrophobicContact CH2-CD2 3.6Å; W74-L244 HydrophobicContact CZ2-CD2 3.63Å; W74-L244 HydrophobicContact CZ2-CG 4.36Å; Y235-L244 HydrophobicContact CD2-CD1 4.29Å; Y235-L244 HydrophobicContact CG-CD1 4.46Å; L238-L244 HydrophobicContact CD1-CD1 3.74Å; L238-L244 HydrophobicContact CD1-CD2 4.26Å; L238-L244 HydrophobicContact CD1-CG 4.1Å; M242-L244 PolarHBondContact O-N 3.35Å; L244-A249 HydrophobicContact CB-CB 4Å; L244-F252 HydrophobicContact CD2-CD2 3.39Å; L244-F252 HydrophobicContact CD2-CE2 3.59Å; L244-F252 HydrophobicContact CD2-CG 4.19Å; L244-F414 HydrophobicContact CB-CE1 4.47Å; L244-F414 HydrophobicContact CD1-CE1 3.83Å; L244-F414 HydrophobicContact CD1-CZ 4.32Å
245	C	62	Low	74.9	Confident	64 Å²	64	54.9 Å²	54.9	43%	0.432	29%	0.286	S	S	.	.			trans	-135.3	146.8	178.8	-66.3	0	0	0	0	110.8
246	G	65.1	Low	75.1	Confident	18 Å²	18	57.9 Å²	57.9	19%	0.186	31%	0.309	C	S	.	.	S	Bend	trans	87.5	-178.9	175.3	0	0	0	0	0	114.6	D248 A249	G246-D248 PolarHBondContact O-N 2.65Å; G246-A249 VanDerWaalsContact O-CB 3.27Å; G246-A249 WeakPolarHBondContact O-CB 3.4Å; G246-A249 PolarHBondContact O-N 3.07Å
247	P	63.7	Low	75.4	Confident	71 Å²	71	57.3 Å²	57.3	46%	0.461	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-62.5	-29.2	-175.1	24.2	-33.7	0	0	0	113.2	A249 L250 V416	P247-A249 PolarHBondContact O-N 3.38Å; P247-L250 WeakPolarHBondContact O-CB 3.49Å; P247-L250 VanDerWaalsContact O-CG 3.29Å; P247-L250 WeakPolarHBondContact O-CG 3.35Å; P247-L250 PolarHBondContact O-N 2.89Å; P247-L250 VanDerWaalsContact O-N 3.07Å; P247-V416 HydrophobicContact CB-CG1 4.46Å
248	D	65.7	Low	76	Confident	45 Å²	45	54 Å²	54	24%	0.241	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-70	-19	-179.4	-55.2	-32.5	0	0	0	113.2	L128 F130 G246 L250 L251	L128-D248 HydrophobicContact CD2-CB 4.48Å; L128-D248 WeakPolarHBondContact CD2-OD1 3.28Å; L128-D248 WeakPolarHBondContact CD2-OD2 3.46Å; F130-D248 HydrophobicContact CE1-CB 3.81Å; F130-D248 HydrophobicContact CZ-CB 3.58Å; G246-D248 PolarHBondContact O-N 2.65Å; D248-L250 PolarHBondContact O-N 3.07Å; D248-L251 WeakPolarHBondContact O-CB 3.43Å; D248-L251 PolarHBondContact O-N 3.23Å; D248-L251 VanDerWaalsContact O-N 3.11Å
249	A	70.8	Confident	76.5	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.033	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-62.7	-24.2	172.2	0	0	0	0	0	111.9	L244 G246 P247 L251 F252 F414	L244-A249 HydrophobicContact CB-CB 4Å; G246-A249 VanDerWaalsContact O-CB 3.27Å; G246-A249 WeakPolarHBondContact O-CB 3.4Å; G246-A249 PolarHBondContact O-N 3.07Å; P247-A249 PolarHBondContact O-N 3.38Å; A249-L251 PolarHBondContact O-N 3.49Å; A249-F252 PolarHBondContact O-N 3.34Å; A249-F414 HydrophobicContact CB-CD1 3.84Å; A249-F414 HydrophobicContact CB-CE1 4.12Å; A249-F414 VanDerWaalsContact O-CE1 3.24Å; A249-F414 WeakPolarHBondContact O-CE1 3.43Å
250	L	73.6	Confident	77.2	Confident	74 Å²	74	54.6 Å²	54.6	39%	0.387	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-64.8	-21.2	175.6	-60.5	173.6	0	0	0	112.6	P247 D248 F252 H253 V416	P247-L250 WeakPolarHBondContact O-CB 3.49Å; P247-L250 VanDerWaalsContact O-CG 3.29Å; P247-L250 WeakPolarHBondContact O-CG 3.35Å; P247-L250 PolarHBondContact O-N 2.89Å; P247-L250 VanDerWaalsContact O-N 3.07Å; D248-L250 PolarHBondContact O-N 3.07Å; L250-F252 PolarHBondContact O-N 2.88Å; L250-H253 WeakPolarHBondContact O-CB 3.28Å; L250-H253 PolarHBondContact O-N 3.4Å; L250-H253 VanDerWaalsContact O-N 3.07Å; L250-V416 HydrophobicContact CD1-CG2 4.28Å; L250-V416 HydrophobicContact CD2-CG2 4.38Å; L250-V416 HydrophobicContact CG-CG2 4.42Å
251	L	79.4	Confident	78.1	Confident	49 Å²	49	53 Å²	53	26%	0.257	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-67.7	-22.3	176.2	-63.9	174	0	0	0	113	L76 F80 D248 A249	L76-L251 HydrophobicContact CD1-CD1 4.02Å; L76-L251 HydrophobicContact CD2-CD1 3.59Å; L76-L251 HydrophobicContact CG-CD1 4.47Å; F80-L251 HydrophobicContact CZ-CB 4.22Å; D248-L251 WeakPolarHBondContact O-CB 3.43Å; D248-L251 PolarHBondContact O-N 3.23Å; D248-L251 VanDerWaalsContact O-N 3.11Å; A249-L251 PolarHBondContact O-N 3.49Å
252	F	80.9	Confident	78.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-93.2	-11	173.5	-61	-75.9	0	0	0	112.7	W74 L76 F80 I83 F130 L244 A249 L250 F414	W74-F252 AromaticContact CH2-CE2 3.77Å; W74-F252 HydrophobicContact CH2-CE2 3.77Å; W74-F252 AromaticContact CH2-CZ 3.84Å; W74-F252 HydrophobicContact CH2-CZ 3.84Å; W74-F252 HydrophobicContact CZ3-CE2 4.3Å; W74-F252 AromaticContact CZ3-CZ 3.98Å; W74-F252 HydrophobicContact CZ3-CZ 3.98Å; L76-F252 HydrophobicContact CD1-CD2 4.43Å; L76-F252 HydrophobicContact CD1-CE2 3.43Å; L76-F252 VanDerWaalsContact CD1-CE2 3.43Å; L76-F252 HydrophobicContact CD1-CZ 3.56Å; F80-F252 HydrophobicContact CD1-CD1 4.29Å; F80-F252 AromaticContact CD1-CE1 3.89Å; F80-F252 HydrophobicContact CD1-CE1 3.89Å; F80-F252 AromaticContact CD2-CE1 3.9Å; F80-F252 HydrophobicContact CD2-CE1 3.9Å; F80-F252 HydrophobicContact CD2-CZ 4.12Å; F80-F252 AromaticContact CE1-CD1 3.93Å; F80-F252 HydrophobicContact CE1-CD1 3.93Å; F80-F252 AromaticContact CE1-CE1 3.87Å; F80-F252 HydrophobicContact CE1-CE1 3.87Å; F80-F252 HydrophobicContact CE2-CD1 4.49Å; F80-F252 AromaticContact CE2-CE1 3.89Å; F80-F252 HydrophobicContact CE2-CE1 3.89Å; F80-F252 HydrophobicContact CE2-CZ 4.05Å; F80-F252 AromaticContact CG-CE1 3.91Å; F80-F252 HydrophobicContact CG-CE1 3.91Å; F80-F252 HydrophobicContact CZ-CD1 4.04Å; F80-F252 AromaticContact CZ-CE1 3.87Å; F80-F252 HydrophobicContact CZ-CE1 3.87Å; F80-F252 HydrophobicContact CZ-CZ 4.38Å; I83-F252 HydrophobicContact CD1-CD1 3.47Å; I83-F252 VanDerWaalsContact CD1-CD1 3.47Å; I83-F252 HydrophobicContact CD1-CE1 3.83Å; F130-F252 HydrophobicContact CE2-CE2 4.2Å; F130-F252 AromaticContact CZ-CE2 3.99Å; F130-F252 HydrophobicContact CZ-CE2 3.99Å; L244-F252 HydrophobicContact CD2-CD2 3.39Å; L244-F252 HydrophobicContact CD2-CE2 3.59Å; L244-F252 HydrophobicContact CD2-CG 4.19Å; A249-F252 PolarHBondContact O-N 3.34Å; L250-F252 PolarHBondContact O-N 2.88Å; F252-F414 HydrophobicContact CB-CZ 4.49Å
253	H	78.3	Confident	79.9	Confident	81 Å²	81	48.4 Å²	48.4	38%	0.375	27%	0.265	S	S	.	.			trans	-77.8	132.8	178.5	-169.4	57.6	0	0	0	110.2	L250 F414	L250-H253 WeakPolarHBondContact O-CB 3.28Å; L250-H253 PolarHBondContact O-N 3.4Å; L250-H253 VanDerWaalsContact O-N 3.07Å; H253-F414 HydrophobicContact CB-CE2 4.14Å; H253-F414 HydrophobicContact CB-CZ 4.22Å; H253-F414 AromaticContact ND1-CD2 3.61Å; H253-F414 AromaticContact ND1-CE2 3.41Å; H253-F414 WeakPolarHBondContact ND1-CE2 3.45Å
254	V	80.8	Confident	80.9	Confident	11 Å²	11	45 Å²	45	7%	0.067	25%	0.25	C	S	.	.			trans	-121.1	115.1	178.7	177.5	0	0	0	0	108	M197 Y231 V232 S256	M197-V254 HydrophobicContact CB-CG2 3.77Å; M197-V254 HydrophobicContact CE-CG2 4.11Å; M197-V254 HydrophobicContact CG-CG2 3.62Å; Y231-V254 HydrophobicContact CD1-CG1 3.82Å; Y231-V254 HydrophobicContact CD1-CG2 4.37Å; Y231-V254 HydrophobicContact CE1-CB 4.33Å; Y231-V254 HydrophobicContact CE1-CG1 3.37Å; Y231-V254 HydrophobicContact CE1-CG2 4Å; V232-V254 HydrophobicContact CG2-CG1 4.33Å; V254-S256 WeakPolarHBondContact CG1-O 3.24Å
255	E	72.9	Confident	81.9	Confident	144 Å²	144	50.5 Å²	50.5	67%	0.673	27%	0.273	S	S	*	.	S	Bend	trans	-81.4	-36.1	174.7	-64.3	-175.5	168.3	0	0	111.8
256	S	83.2	Confident	83.4	Confident	82 Å²	82	49.3 Å²	49.3	57%	0.573	26%	0.261	S	S	*	.	S	Bend	trans	-149.2	154.9	-178.4	63.8	0	0	0	0	111.9	V254	V254-S256 WeakPolarHBondContact CG1-O 3.24Å
257	I	89.1	Confident	84.8	Confident	27 Å²	27	48.5 Å²	48.5	14%	0.138	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-72.4	128.1	172.4	-63.3	168.7	0	0	0	107.7	L221 V224 K225 Y231 V232 W408	L221-I257 HydrophobicContact CD2-CG2 4.48Å; V224-I257 HydrophobicContact CG1-CD1 4.11Å; V224-I257 HydrophobicContact CG1-CG1 4.19Å; V224-I257 HydrophobicContact CG1-CG2 4.09Å; K225-I257 HydrophobicContact CB-CD1 4.19Å; K225-I257 HydrophobicContact CG-CD1 3.55Å; K225-I257 HydrophobicContact CG-CG2 4.22Å; Y231-I257 HydrophobicContact CD1-CG1 4.3Å; V232-I257 HydrophobicContact CG2-CD1 4.22Å; V232-I257 HydrophobicContact CG2-CG1 3.85Å; I257-W408 HydrophobicContact CD1-CH2 4.22Å; I257-W408 HydrophobicContact CD1-CZ3 4.03Å; I257-W408 HydrophobicContact CG1-CZ3 4.38Å
258	P	93.2	Very high	86.1	Confident	15 Å²	15	46.6 Å²	46.6	10%	0.097	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-67.7	148.4	-176.2	29	-36.5	0	0	0	111.5	K198 L201 Y231 V263	K198-P258 HydrophobicContact CD-CB 4.45Å; K198-P258 HydrophobicContact CG-CB 4.2Å; K198-P258 HydrophobicContact CG-CG 4.37Å; L201-P258 HydrophobicContact CD1-CG 3.9Å; Y231-P258 VanDerWaalsContact CE1-CD 3.45Å; Y231-P258 HydrophobicContact CE1-CG 4.4Å; Y231-P258 WeakPolarHBondContact OH-CD 3.13Å; P258-V263 HydrophobicContact CB-CG2 3.75Å; P258-V263 HydrophobicContact CG-CG2 3.48Å; P258-V263 VanDerWaalsContact CG-CG2 3.48Å
259	S	94.6	Very high	87.3	Confident	57 Å²	57	46.1 Å²	46.1	40%	0.399	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-68.7	155	174.8	68.8	0	0	0	0	112.1	R261 S262 V263	S259-R261 VanDerWaalsContact C-N 3.31Å; S259-R261 PolarHBondContact O-N 2.89Å; S259-S262 WeakPolarHBondContact O-CA 3.27Å; S259-S262 VanDerWaalsContact O-CB 3.31Å; S259-S262 WeakPolarHBondContact O-CB 3.21Å; S259-S262 PolarHBondContact O-N 3.26Å; S259-S262 WeakPolarHBondContact OG-CB 3.22Å; S259-S262 PolarHBondContact OG-N 2.94Å; S259-V263 PolarHBondContact O-N 2.9Å
260	H	95.8	Very high	88.3	Confident	5 Å²	5	46 Å²	46	2%	0.023	24%	0.235	C	C	.	.	H	α-helix	trans	-48.1	-51.1	175.1	-178.6	-72.1	0	0	0	112.5	L221 S262 V263 H264 D340 V535 Y539	L221-H260 VanDerWaalsContact CD1-CA 3.46Å; L221-H260 HydrophobicContact CD1-CB 3.94Å; H260-S262 VanDerWaalsContact C-N 3.27Å; H260-S262 PolarHBondContact O-N 3.47Å; H260-V263 PolarHBondContact O-N 3.41Å; H260-H264 WeakPolarHBondContact O-CB 3.19Å; H260-H264 PolarHBondContact O-N 3.05Å; H260-D340 IonicContact CD2-OD2 3.7Å; H260-D340 IonicContact CE1-OD1 3.12Å; H260-D340 IonicContact NE2-OD1 2.88Å; H260-D340 IonicContact NE2-OD2 2.6Å; H260-D340 PolarHBondContact NE2-OD2 2.97Å; H260-D340 VanDerWaalsContact NE2-OD2 3.14Å; H260-V535 HydrophobicContact CB-CG1 3.73Å; H260-Y539 AromaticContact ND1-CE1 3.59Å
261	R	93.6	Very high	89.1	Confident	118 Å²	118	42.6 Å²	42.6	45%	0.445	22%	0.217	S	C	.	.	H	α-helix	trans	-57.5	-40	177.8	-179.7	178.3	176.9	-120.3	5.9	112.2	S259 K265 Y539	S259-R261 VanDerWaalsContact C-N 3.31Å; S259-R261 PolarHBondContact O-N 2.89Å; R261-K265 VanDerWaalsContact O-CB 3.3Å; R261-K265 WeakPolarHBondContact O-CB 3.29Å; R261-K265 PolarHBondContact O-N 2.94Å; R261-Y539 HydrophobicContact CB-CE1 4.05Å; R261-Y539 HydrophobicContact CB-CE2 4.27Å; R261-Y539 HydrophobicContact CG-CE2 4.09Å
262	S	93.9	Very high	89.4	Confident	34 Å²	34	44.6 Å²	44.6	24%	0.238	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-47	-179.1	-151.4	0	0	0	0	111.6	K198 S259 H260 K265 E266	K198-S262 WeakPolarHBondContact CE-OG 3.4Å; K198-S262 PolarHBondContact NZ-OG 2.99Å; S259-S262 WeakPolarHBondContact O-CA 3.27Å; S259-S262 VanDerWaalsContact O-CB 3.31Å; S259-S262 WeakPolarHBondContact O-CB 3.21Å; S259-S262 PolarHBondContact O-N 3.26Å; S259-S262 WeakPolarHBondContact OG-CB 3.22Å; S259-S262 PolarHBondContact OG-N 2.94Å; H260-S262 VanDerWaalsContact C-N 3.27Å; H260-S262 PolarHBondContact O-N 3.47Å; S262-K265 PolarHBondContact O-N 3.5Å; S262-E266 PolarHBondContact O-N 3.44Å; S262-E266 VanDerWaalsContact O-N 3.08Å
263	V	96.2	Very high	89.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.8	-42.6	178.3	-178.5	0	0	0	0	111.1	K198 L201 A202 L217 L221 P258 S259 H260 K265 E266 A267	K198-V263 HydrophobicContact CG-CG2 4.28Å; L201-V263 HydrophobicContact CB-CG1 4.1Å; A202-V263 HydrophobicContact CB-CG1 4.15Å; L217-V263 HydrophobicContact CD1-CB 4.17Å; L217-V263 HydrophobicContact CD1-CG1 3.74Å; L217-V263 HydrophobicContact CD2-CB 4.38Å; L217-V263 HydrophobicContact CD2-CG1 4.48Å; L221-V263 HydrophobicContact CD2-CG2 4.16Å; P258-V263 HydrophobicContact CB-CG2 3.75Å; P258-V263 HydrophobicContact CG-CG2 3.48Å; P258-V263 VanDerWaalsContact CG-CG2 3.48Å; S259-V263 PolarHBondContact O-N 2.9Å; H260-V263 PolarHBondContact O-N 3.41Å; V263-K265 VanDerWaalsContact C-N 3.34Å; V263-K265 PolarHBondContact O-N 3.41Å; V263-E266 PolarHBondContact O-N 3.14Å; V263-E266 VanDerWaalsContact O-N 3.16Å; V263-A267 WeakPolarHBondContact O-CB 3.33Å; V263-A267 PolarHBondContact O-N 3.12Å
264	H	94.8	Very high	90.3	Very high	19 Å²	19	43.4 Å²	43.4	9%	0.088	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-42.5	176.1	-175.2	-85.4	0	0	0	112	L217 H260 E266 A267 Q268 L336 R338	L217-H264 HydrophobicContact CD2-CB 3.81Å; H260-H264 WeakPolarHBondContact O-CB 3.19Å; H260-H264 PolarHBondContact O-N 3.05Å; H264-E266 VanDerWaalsContact C-N 3.31Å; H264-E266 PolarHBondContact O-N 3.41Å; H264-A267 PolarHBondContact O-N 2.89Å; H264-Q268 WeakPolarHBondContact O-CB 3.31Å; H264-Q268 PolarHBondContact O-N 3.23Å; H264-L336 PolarHBondContact CE1-O 3.2Å; H264-L336 PolarHBondContact NE2-O 3.33Å; H264-R338 VanDerWaalsContact NE2-CG 3.27Å; H264-R338 WeakPolarHBondContact NE2-CG 3.46Å
265	K	92.6	Very high	90.5	Very high	143 Å²	143	49.6 Å²	49.6	62%	0.622	25%	0.247	S	C	*	.	H	α-helix	trans	-61.8	-40.5	175.4	-175.1	-179.4	178.6	-174.9	0	111.5	R261 S262 V263 Q268 V269	R261-K265 VanDerWaalsContact O-CB 3.3Å; R261-K265 WeakPolarHBondContact O-CB 3.29Å; R261-K265 PolarHBondContact O-N 2.94Å; S262-K265 PolarHBondContact O-N 3.5Å; V263-K265 VanDerWaalsContact C-N 3.34Å; V263-K265 PolarHBondContact O-N 3.41Å; K265-Q268 WeakPolarHBondContact O-CB 3.44Å; K265-Q268 PolarHBondContact O-N 3.36Å; K265-V269 WeakPolarHBondContact O-CG2 3.35Å; K265-V269 PolarHBondContact O-N 3.13Å
266	E	93.6	Very high	91.1	Very high	39 Å²	39	43.7 Å²	43.7	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-41.9	176.6	-164.9	62.2	-137.4	0	0	111.6	K198 K199 A202 S262 V263 H264 Q268 V269 L270	K198-E266 HydrophobicContact CD-CB 4.37Å; K198-E266 HydrophobicContact CG-CB 4.42Å; K199-E266 HydrophobicContact CB-CG 4.39Å; K199-E266 WeakPolarHBondContact CE-OE1 3.43Å; K199-E266 HydrophobicContact CG-CG 3.51Å; K199-E266 VanDerWaalsContact CG-OE1 3.26Å; K199-E266 WeakPolarHBondContact CG-OE1 3.41Å; A202-E266 HydrophobicContact CB-CB 3.96Å; A202-E266 HydrophobicContact CB-CG 4.02Å; S262-E266 PolarHBondContact O-N 3.44Å; S262-E266 VanDerWaalsContact O-N 3.08Å; V263-E266 PolarHBondContact O-N 3.14Å; V263-E266 VanDerWaalsContact O-N 3.16Å; H264-E266 VanDerWaalsContact C-N 3.31Å; H264-E266 PolarHBondContact O-N 3.41Å; E266-Q268 VanDerWaalsContact C-N 3.32Å; E266-Q268 PolarHBondContact O-N 2.92Å; E266-V269 WeakPolarHBondContact O-CB 3.5Å; E266-V269 PolarHBondContact O-N 3.45Å; E266-V269 VanDerWaalsContact O-N 3.11Å; E266-L270 WeakPolarHBondContact O-CG 3.49Å; E266-L270 PolarHBondContact O-N 3.27Å
267	A	94.3	Very high	91.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-44	174.4	0	0	0	0	0	111.3	A202 L206 V263 H264 V269 L270 V271 L336	A202-A267 HydrophobicContact CB-CB 4.06Å; L206-A267 HydrophobicContact CD1-CB 4.46Å; L206-A267 HydrophobicContact CD2-CB 3.96Å; L206-A267 HydrophobicContact CG-CB 4.02Å; V263-A267 WeakPolarHBondContact O-CB 3.33Å; V263-A267 PolarHBondContact O-N 3.12Å; H264-A267 PolarHBondContact O-N 2.89Å; A267-V269 VanDerWaalsContact C-N 3.3Å; A267-V269 PolarHBondContact O-N 3.18Å; A267-L270 PolarHBondContact O-N 2.89Å; A267-L270 VanDerWaalsContact O-N 3.16Å; A267-V271 WeakPolarHBondContact O-CG2 3.21Å; A267-V271 PolarHBondContact O-N 2.89Å; A267-L336 HydrophobicContact CB-CD2 3.86Å
268	Q	91.2	Very high	90.6	Very high	32 Å²	32	44.7 Å²	44.7	15%	0.15	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-38.1	174.5	179.8	60.5	73.5	0	0	112.9	H264 K265 E266 P334	H264-Q268 WeakPolarHBondContact O-CB 3.31Å; H264-Q268 PolarHBondContact O-N 3.23Å; K265-Q268 WeakPolarHBondContact O-CB 3.44Å; K265-Q268 PolarHBondContact O-N 3.36Å; E266-Q268 VanDerWaalsContact C-N 3.32Å; E266-Q268 PolarHBondContact O-N 2.92Å; Q268-P334 PolarHBondContact NE2-O 3.37Å
269	V	90.5	Very high	90.2	Very high	35 Å²	35	44.4 Å²	44.4	21%	0.212	23%	0.228	C	C	.	.	H	α-helix	trans	-69.5	-41.3	174.6	168.9	0	0	0	0	110.9	K265 E266 A267 Q272 F273	K265-V269 WeakPolarHBondContact O-CG2 3.35Å; K265-V269 PolarHBondContact O-N 3.13Å; E266-V269 WeakPolarHBondContact O-CB 3.5Å; E266-V269 PolarHBondContact O-N 3.45Å; E266-V269 VanDerWaalsContact O-N 3.11Å; A267-V269 VanDerWaalsContact C-N 3.3Å; A267-V269 PolarHBondContact O-N 3.18Å; V269-Q272 PolarHBondContact O-N 3.4Å; V269-F273 WeakPolarHBondContact O-CB 3.33Å; V269-F273 PolarHBondContact O-N 3.16Å
270	L	91.4	Very high	89.7	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-41.2	177.8	-76	176.8	0	0	0	112.1	Y112 A202 L203 L206 E266 A267 Q272 F273 L274	Y112-L270 HydrophobicContact CD2-CD2 4.1Å; Y112-L270 HydrophobicContact CE2-CD2 3.96Å; A202-L270 HydrophobicContact CB-CD1 3.73Å; L203-L270 HydrophobicContact CB-CD1 4.41Å; L203-L270 HydrophobicContact CD1-CD1 4.47Å; L206-L270 HydrophobicContact CD1-CB 3.79Å; L206-L270 HydrophobicContact CD1-CD1 4.46Å; E266-L270 WeakPolarHBondContact O-CG 3.49Å; E266-L270 PolarHBondContact O-N 3.27Å; A267-L270 PolarHBondContact O-N 2.89Å; A267-L270 VanDerWaalsContact O-N 3.16Å; L270-Q272 VanDerWaalsContact C-N 3.29Å; L270-Q272 PolarHBondContact O-N 3.02Å; L270-F273 HydrophobicContact CD2-CD1 4.49Å; L270-F273 PolarHBondContact O-N 3.21Å; L270-L274 VanDerWaalsContact O-CB 3.25Å; L270-L274 WeakPolarHBondContact O-CB 3.37Å; L270-L274 VanDerWaalsContact O-CG 3.24Å; L270-L274 WeakPolarHBondContact O-CG 3.25Å; L270-L274 PolarHBondContact O-N 2.99Å
271	V	90	Very high	88.8	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-53.1	-48.3	174	165.7	0	0	0	0	111.2	L206 A267 Q275 L276 L328 P334	L206-V271 HydrophobicContact CD1-CG2 4Å; L206-V271 HydrophobicContact CD2-CG2 3.51Å; L206-V271 HydrophobicContact CG-CG2 4.42Å; A267-V271 WeakPolarHBondContact O-CG2 3.21Å; A267-V271 PolarHBondContact O-N 2.89Å; V271-Q275 WeakPolarHBondContact O-CA 3.43Å; V271-Q275 PolarHBondContact O-N 3.41Å; V271-L276 HydrophobicContact CG2-CD1 4.38Å; V271-L276 PolarHBondContact O-N 2.69Å; V271-L328 HydrophobicContact CB-CD2 4.45Å; V271-L328 HydrophobicContact CG1-CD1 4.18Å; V271-L328 HydrophobicContact CG1-CD2 3.42Å; V271-L328 VanDerWaalsContact CG1-CD2 3.42Å; V271-L328 HydrophobicContact CG1-CG 4.32Å; V271-L328 HydrophobicContact CG2-CD2 4.14Å; V271-P334 HydrophobicContact CG1-CB 4.02Å; V271-P334 HydrophobicContact CG1-CG 3.57Å
272	Q	87.1	Confident	88.1	Confident	91 Å²	91	40.7 Å²	40.7	43%	0.425	22%	0.218	S	C	.	.	H	α-helix	trans	-69.2	-39.8	179.9	-66.2	174.1	11.1	0	0	112	V269 L270 Q275 P334	V269-Q272 PolarHBondContact O-N 3.4Å; L270-Q272 VanDerWaalsContact C-N 3.29Å; L270-Q272 PolarHBondContact O-N 3.02Å; Q272-Q275 PolarHBondContact O-N 3.37Å; Q272-P334 HydrophobicContact CG-CG 4.49Å
273	F	88.4	Confident	87.4	Confident	56 Å²	56	42 Å²	42	25%	0.246	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-46.5	-179.8	173.1	-106.6	0	0	0	112.3	Y112 K115 V269 L270 Q275	Y112-F273 HydrophobicContact CD2-CD1 4.2Å; Y112-F273 AromaticContact CD2-CE1 3.8Å; Y112-F273 HydrophobicContact CD2-CE1 3.8Å; Y112-F273 HydrophobicContact CE2-CD1 4.32Å; Y112-F273 AromaticContact CE2-CE1 3.86Å; Y112-F273 HydrophobicContact CE2-CE1 3.86Å; K115-F273 HydrophobicContact CB-CE1 3.88Å; K115-F273 HydrophobicContact CB-CE2 4.48Å; K115-F273 HydrophobicContact CB-CZ 3.81Å; V269-F273 WeakPolarHBondContact O-CB 3.33Å; V269-F273 PolarHBondContact O-N 3.16Å; L270-F273 HydrophobicContact CD2-CD1 4.49Å; L270-F273 PolarHBondContact O-N 3.21Å; F273-Q275 PolarHBondContact O-N 3Å
274	L	88.4	Confident	86.6	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-73.1	-21.2	178.8	-64.9	178.7	0	0	0	112	L111 Y112 L203 L270 L276	L111-L274 HydrophobicContact CD2-CB 4.09Å; L111-L274 HydrophobicContact CG-CD2 4.22Å; Y112-L274 VanDerWaalsContact CA-CD2 3.42Å; Y112-L274 HydrophobicContact CD2-CD2 4.09Å; Y112-L274 HydrophobicContact CG-CD2 4.42Å; L203-L274 HydrophobicContact CD1-CD1 4.07Å; L270-L274 VanDerWaalsContact O-CB 3.25Å; L270-L274 WeakPolarHBondContact O-CB 3.37Å; L270-L274 VanDerWaalsContact O-CG 3.24Å; L270-L274 WeakPolarHBondContact O-CG 3.25Å; L270-L274 PolarHBondContact O-N 2.99Å; L274-L276 VanDerWaalsContact C-N 3.29Å; L274-L276 HydrophobicContact CB-CD2 3.98Å; L274-L276 HydrophobicContact CB-CG 3.8Å; L274-L276 HydrophobicContact CD1-CD1 4.23Å; L274-L276 HydrophobicContact CD1-CD2 4.27Å; L274-L276 HydrophobicContact CD1-CG 4.28Å
275	Q	86.1	Confident	85.9	Confident	140 Å²	140	50.5 Å²	50.5	65%	0.654	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	47.8	-172.3	-58.1	170.3	-8.1	0	0	110.2	V271 Q272 F273	V271-Q275 WeakPolarHBondContact O-CA 3.43Å; V271-Q275 PolarHBondContact O-N 3.41Å; Q272-Q275 PolarHBondContact O-N 3.37Å; F273-Q275 PolarHBondContact O-N 3Å
276	L	84.6	Confident	85.5	Confident	21 Å²	21	44.2 Å²	44.2	11%	0.11	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-61.1	139.9	179.5	-66.1	175.9	0	0	0	109.6	M108 L111 L206 V271 L274 F279	M108-L276 HydrophobicContact CE-CD1 4.1Å; M108-L276 HydrophobicContact SD-CD1 4.46Å; L111-L276 HydrophobicContact CD2-CD2 3.75Å; L206-L276 HydrophobicContact CD1-CD1 4.33Å; V271-L276 HydrophobicContact CG2-CD1 4.38Å; V271-L276 PolarHBondContact O-N 2.69Å; L274-L276 VanDerWaalsContact C-N 3.29Å; L274-L276 HydrophobicContact CB-CD2 3.98Å; L274-L276 HydrophobicContact CB-CG 3.8Å; L274-L276 HydrophobicContact CD1-CD1 4.23Å; L274-L276 HydrophobicContact CD1-CD2 4.27Å; L274-L276 HydrophobicContact CD1-CG 4.28Å; L276-F279 HydrophobicContact CB-CE1 4.05Å; L276-F279 HydrophobicContact CD1-CE1 3.81Å; L276-F279 HydrophobicContact CD1-CZ 3.93Å
277	P	82.8	Confident	85.2	Confident	80 Å²	80	47.4 Å²	47.4	52%	0.519	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-64.6	173.3	171.8	32.2	-38.5	0	0	0	110.3	W210 F279	W210-P277 HydrophobicContact CH2-CG 3.63Å; W210-P277 HydrophobicContact CZ3-CG 3.96Å; P277-F279 PolarHBondContact O-N 2.86Å
278	A	80.4	Confident	84.8	Confident	49 Å²	49	47.6 Å²	47.6	41%	0.405	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-54.3	134.9	171.9	0	0	0	0	0	110.1	L328	A278-L328 WeakPolarHBondContact CA-O 3.38Å; A278-L328 WeakPolarHBondContact CB-O 3.43Å
279	F	84.3	Confident	84.6	Confident	10 Å²	10	46.2 Å²	46.2	4%	0.044	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-68	159.3	-178.9	-81	34.3	0	0	0	109.5	M108 L206 V209 W210 L276 P277 T327 L328	M108-F279 HydrophobicContact CE-CZ 4.36Å; L206-F279 HydrophobicContact CB-CZ 4.46Å; L206-F279 HydrophobicContact CD2-CE2 4.45Å; L206-F279 HydrophobicContact CD2-CZ 4.07Å; L206-F279 WeakPolarHBondContact O-CE2 3.25Å; V209-F279 HydrophobicContact CB-CD2 4.33Å; V209-F279 HydrophobicContact CB-CE2 4.12Å; V209-F279 HydrophobicContact CG1-CD2 3.81Å; V209-F279 HydrophobicContact CG1-CE2 4.01Å; W210-F279 HydrophobicContact CB-CD2 4.13Å; W210-F279 HydrophobicContact CB-CE2 4.05Å; W210-F279 HydrophobicContact CE3-CB 4.31Å; W210-F279 AromaticContact CE3-CD1 3.47Å; W210-F279 HydrophobicContact CE3-CD1 3.47Å; W210-F279 VanDerWaalsContact CE3-CD1 3.47Å; W210-F279 HydrophobicContact CE3-CD2 4.05Å; W210-F279 AromaticContact CE3-CE1 3.67Å; W210-F279 HydrophobicContact CE3-CE1 3.67Å; W210-F279 HydrophobicContact CE3-CE2 4.23Å; W210-F279 AromaticContact CE3-CG 3.68Å; W210-F279 HydrophobicContact CE3-CG 3.68Å; W210-F279 HydrophobicContact CE3-CZ 4.05Å; W210-F279 AromaticContact CZ3-CD1 3.63Å; W210-F279 HydrophobicContact CZ3-CD1 3.63Å; W210-F279 HydrophobicContact CZ3-CE1 4.01Å; W210-F279 HydrophobicContact CZ3-CG 4.13Å; L276-F279 HydrophobicContact CB-CE1 4.05Å; L276-F279 HydrophobicContact CD1-CE1 3.81Å; L276-F279 HydrophobicContact CD1-CZ 3.93Å; P277-F279 PolarHBondContact O-N 2.86Å; F279-T327 HydrophobicContact CB-CG2 4.31Å; F279-T327 WeakPolarHBondContact O-CG2 3.38Å; F279-L328 HydrophobicContact CB-CB 4.07Å; F279-L328 HydrophobicContact CD1-CB 3.82Å; F279-L328 HydrophobicContact CD1-CD2 3.46Å; F279-L328 VanDerWaalsContact CD1-CD2 3.46Å; F279-L328 HydrophobicContact CD1-CG 4.28Å; F279-L328 HydrophobicContact CE1-CB 4.47Å; F279-L328 HydrophobicContact CE1-CD2 3.43Å; F279-L328 VanDerWaalsContact CE1-CD2 3.43Å; F279-L328 HydrophobicContact CG-CB 3.92Å; F279-L328 HydrophobicContact CG-CD2 4.36Å; F279-L328 HydrophobicContact CZ-CD2 4.29Å; F279-L328 PolarHBondContact N-O 3.48Å
280	P	82.9	Confident	84.5	Confident	36 Å²	36	44.6 Å²	44.6	23%	0.234	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-55	136.2	170	-24.9	35.5	0	0	0	110.2	W210 I282	W210-P280 HydrophobicContact CD2-CG 4.35Å; W210-P280 HydrophobicContact CZ2-CG 4.35Å; P280-I282 PolarHBondContact O-N 2.85Å
281	P	77.8	Confident	84.4	Confident	63 Å²	63	45 Å²	45	41%	0.409	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-63.3	134.3	-178.2	25.3	-32.9	0	0	0	110.8	I283 T327	P281-I283 PolarHBondContact O-N 2.85Å; P281-T327 VanDerWaalsContact CA-OG1 3.32Å; P281-T327 WeakPolarHBondContact CA-OG1 3.49Å
282	I	79.1	Confident	84.5	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.257	C	S	.	.			trans	-79.4	103.5	174.1	-59.3	-176	0	0	0	107.2	P280 A286 L288 H289 H326 Y339	P280-I282 PolarHBondContact O-N 2.85Å; I282-A286 HydrophobicContact CG2-CB 3.86Å; I282-L288 HydrophobicContact CD1-CD2 3.92Å; I282-L288 HydrophobicContact CD1-CG 4.34Å; I282-H289 HydrophobicContact CG2-CB 3.77Å; I282-H326 HydrophobicContact CB-CB 4.19Å; I282-H326 WeakPolarHBondContact CD1-O 3.43Å; I282-Y339 HydrophobicContact CD1-CD1 4.26Å; I282-Y339 HydrophobicContact CD1-CE1 3.43Å; I282-Y339 VanDerWaalsContact CD1-CE1 3.43Å; I282-Y339 HydrophobicContact CD1-CE2 3.88Å; I282-Y339 WeakPolarHBondContact CD1-OH 3.26Å
283	I	80	Confident	84.7	Confident	62 Å²	62	42.3 Å²	42.3	32%	0.318	24%	0.237	S	C	.	.			trans	-70.1	152.1	174.6	58.9	175.1	0	0	0	110	P281 E285 A286	P281-I283 PolarHBondContact O-N 2.85Å; I283-E285 WeakPolarHBondContact CB-OE2 3.3Å; I283-E285 HydrophobicContact CD1-CB 4.37Å; I283-E285 PolarHBondContact O-N 2.77Å; I283-A286 HydrophobicContact CG1-CB 4.01Å; I283-A286 VanDerWaalsContact O-CB 3.29Å; I283-A286 WeakPolarHBondContact O-CB 3.47Å; I283-A286 PolarHBondContact O-N 3.04Å
284	P	78.3	Confident	85	Confident	56 Å²	56	39.7 Å²	39.7	36%	0.364	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-27.3	-179.3	-28.5	37	0	0	0	114.9
285	E	80.1	Confident	85.3	Confident	141 Å²	141	42.9 Å²	42.9	66%	0.659	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-13.8	179.5	-55.9	73.5	-159	0	0	113.3	I283	I283-E285 WeakPolarHBondContact CB-OE2 3.3Å; I283-E285 HydrophobicContact CD1-CB 4.37Å; I283-E285 PolarHBondContact O-N 2.77Å
286	A	84.9	Confident	85.7	Confident	12 Å²	12	37.9 Å²	37.9	10%	0.099	22%	0.218	C	C	.	.	S	Bend	trans	-69.5	134.2	178.3	0	0	0	0	0	110	I282 I283 L288 H289 P292	I282-A286 HydrophobicContact CG2-CB 3.86Å; I283-A286 HydrophobicContact CG1-CB 4.01Å; I283-A286 VanDerWaalsContact O-CB 3.29Å; I283-A286 WeakPolarHBondContact O-CB 3.47Å; I283-A286 PolarHBondContact O-N 3.04Å; A286-L288 PolarHBondContact O-N 3.06Å; A286-H289 WeakPolarHBondContact O-CB 3.41Å; A286-H289 PolarHBondContact O-N 3.04Å; A286-P292 WeakPolarHBondContact O-CG 3.17Å
287	L	85.9	Confident	86.2	Confident	106 Å²	106	37.1 Å²	37.1	56%	0.555	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.4	-176	-66.3	174.9	0	0	0	114	A214 H289 L293	A214-L287 HydrophobicContact CB-CB 3.65Å; A214-L287 HydrophobicContact CB-CD1 3.61Å; A214-L287 HydrophobicContact CB-CG 4.28Å; L287-H289 VanDerWaalsContact C-N 3.33Å; L287-L293 VanDerWaalsContact O-CD2 3.24Å; L287-L293 WeakPolarHBondContact O-CD2 3.28Å; L287-L293 VanDerWaalsContact O-CG 3.25Å; L287-L293 WeakPolarHBondContact O-CG 3.4Å
288	L	85.8	Confident	86.9	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.016	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.7	175.1	-164.8	65.9	0	0	0	113.3	V209 T216 I282 A286 L293 Y339	V209-L288 HydrophobicContact CB-CD2 4.3Å; V209-L288 HydrophobicContact CG1-CD2 4.07Å; V209-L288 HydrophobicContact CG2-CD2 4.17Å; T216-L288 HydrophobicContact CG2-CD1 4.09Å; I282-L288 HydrophobicContact CD1-CD2 3.92Å; I282-L288 HydrophobicContact CD1-CG 4.34Å; A286-L288 PolarHBondContact O-N 3.06Å; L288-L293 HydrophobicContact CD1-CD1 4.38Å; L288-L293 WeakPolarHBondContact O-CD1 3.37Å; L288-Y339 HydrophobicContact CD1-CD2 4.1Å; L288-Y339 HydrophobicContact CD1-CG 4.4Å; L288-Y339 HydrophobicContact CD2-CD2 3.85Å; L288-Y339 HydrophobicContact CD2-CE2 3.88Å; L288-Y339 HydrophobicContact CG-CD2 3.78Å; L288-Y339 HydrophobicContact CG-CE2 4.25Å; L288-Y339 HydrophobicContact CG-CG 4.01Å
289	H	87.8	Confident	87.5	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.019	18%	0.181	C	C	.	.	S	Bend	trans	-64	142.2	176.7	-173.4	-94.8	0	0	0	110	I282 A286 L287 A291 P292 L293 H326	I282-H289 HydrophobicContact CG2-CB 3.77Å; A286-H289 WeakPolarHBondContact O-CB 3.41Å; A286-H289 PolarHBondContact O-N 3.04Å; L287-H289 VanDerWaalsContact C-N 3.33Å; H289-A291 WeakPolarHBondContact ND1-CB 3.31Å; H289-A291 PolarHBondContact ND1-N 3.4Å; H289-A291 PolarHBondContact O-N 2.87Å; H289-A291 VanDerWaalsContact O-N 3.08Å; H289-P292 HydrophobicContact CB-CG 3.92Å; H289-P292 WeakPolarHBondContact O-CD 3.39Å; H289-P292 WeakPolarHBondContact O-CG 3.18Å; H289-L293 WeakPolarHBondContact O-CG 3.41Å; H289-L293 PolarHBondContact O-N 3.06Å; H289-L293 VanDerWaalsContact O-N 3.1Å; H289-H326 AromaticContact CD2-CD2 3.71Å; H289-H326 AromaticContact NE2-CD2 3.48Å; H289-H326 PolarHBondContact NE2-CD2 3.31Å; H289-H326 AromaticContact NE2-NE2 3.47Å; H289-H326 PolarHBondContact NE2-NE2 3.42Å
290	P	88	Confident	88.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-55.2	-31.5	-177.5	-30	37.2	0	0	0	114.5	S294 M315 M320 L346	P290-S294 VanDerWaalsContact O-CB 3.25Å; P290-S294 WeakPolarHBondContact O-CB 2.97Å; P290-S294 PolarHBondContact O-N 3.39Å; P290-S294 PolarHBondContact O-OG 3.04Å; P290-M315 HydrophobicContact CB-SD 4.25Å; P290-M320 HydrophobicContact CG-CE 4.35Å; P290-L346 HydrophobicContact CB-CD1 4.02Å
291	A	89.1	Confident	88.7	Confident	11 Å²	11	30.9 Å²	30.9	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-63	177	0	0	0	0	0	113.5	H289 L293 S294 L295 H308 M315	H289-A291 WeakPolarHBondContact ND1-CB 3.31Å; H289-A291 PolarHBondContact ND1-N 3.4Å; H289-A291 PolarHBondContact O-N 2.87Å; H289-A291 VanDerWaalsContact O-N 3.08Å; A291-L293 VanDerWaalsContact C-N 3.3Å; A291-L293 PolarHBondContact O-N 3.49Å; A291-S294 PolarHBondContact O-N 3.43Å; A291-S294 VanDerWaalsContact O-N 3.14Å; A291-L295 PolarHBondContact O-N 3.11Å; A291-L295 VanDerWaalsContact O-N 3.13Å; A291-H308 PolarHBondContact O-CE1 2.9Å; A291-M315 HydrophobicContact CB-CE 3.97Å; A291-M315 HydrophobicContact CB-SD 4.13Å
292	P	91.8	Very high	89.6	Confident	33 Å²	33	27.9 Å²	27.9	21%	0.214	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-33.3	176.7	21.7	-31.9	0	0	0	113.3	A286 H289 S294 L295 R296	A286-P292 WeakPolarHBondContact O-CG 3.17Å; H289-P292 HydrophobicContact CB-CG 3.92Å; H289-P292 WeakPolarHBondContact O-CD 3.39Å; H289-P292 WeakPolarHBondContact O-CG 3.18Å; P292-S294 PolarHBondContact O-N 3.44Å; P292-L295 PolarHBondContact O-N 3.29Å; P292-R296 PolarHBondContact O-N 3.42Å; P292-R296 VanDerWaalsContact O-N 3.09Å
293	L	92.6	Very high	90.3	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-41.8	172.3	-75	-178.1	0	0	0	112.3	T216 L287 L288 H289 A291 L295 R296 Y297 A343	T216-L293 HydrophobicContact CG2-CD1 4.07Å; T216-L293 HydrophobicContact CG2-CD2 3.79Å; L287-L293 VanDerWaalsContact O-CD2 3.24Å; L287-L293 WeakPolarHBondContact O-CD2 3.28Å; L287-L293 VanDerWaalsContact O-CG 3.25Å; L287-L293 WeakPolarHBondContact O-CG 3.4Å; L288-L293 HydrophobicContact CD1-CD1 4.38Å; L288-L293 WeakPolarHBondContact O-CD1 3.37Å; H289-L293 WeakPolarHBondContact O-CG 3.41Å; H289-L293 PolarHBondContact O-N 3.06Å; H289-L293 VanDerWaalsContact O-N 3.1Å; A291-L293 VanDerWaalsContact C-N 3.3Å; A291-L293 PolarHBondContact O-N 3.49Å; L293-L295 VanDerWaalsContact C-N 3.29Å; L293-L295 PolarHBondContact O-N 2.72Å; L293-R296 WeakPolarHBondContact O-CB 3.39Å; L293-R296 PolarHBondContact O-N 3.43Å; L293-Y297 PolarHBondContact O-N 2.68Å; L293-A343 HydrophobicContact CB-CB 3.75Å
294	S	94.4	Very high	91	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.2	-36.3	176.7	-73.2	0	0	0	0	111.6	P290 A291 P292 Y297 L298 A343 I347	P290-S294 VanDerWaalsContact O-CB 3.25Å; P290-S294 WeakPolarHBondContact O-CB 2.97Å; P290-S294 PolarHBondContact O-N 3.39Å; P290-S294 PolarHBondContact O-OG 3.04Å; A291-S294 PolarHBondContact O-N 3.43Å; A291-S294 VanDerWaalsContact O-N 3.14Å; P292-S294 PolarHBondContact O-N 3.44Å; S294-Y297 PolarHBondContact O-N 3.1Å; S294-L298 WeakPolarHBondContact O-CB 3.32Å; S294-L298 VanDerWaalsContact O-CG 3.23Å; S294-L298 WeakPolarHBondContact O-CG 3.36Å; S294-L298 PolarHBondContact O-N 3.45Å; S294-A343 WeakPolarHBondContact OG-CA 3.29Å; S294-A343 PolarHBondContact OG-O 3.14Å; S294-I347 WeakPolarHBondContact O-CD1 3.4Å
295	L	94.1	Very high	91.6	Very high	69 Å²	69	25.8 Å²	25.8	36%	0.361	14%	0.136	S	C	.	.	H	α-helix	trans	-61	-48	173.4	-175.3	63.2	0	0	0	111	A291 P292 L293 Y297 L298 T299 H308	A291-L295 PolarHBondContact O-N 3.11Å; A291-L295 VanDerWaalsContact O-N 3.13Å; P292-L295 PolarHBondContact O-N 3.29Å; L293-L295 VanDerWaalsContact C-N 3.29Å; L293-L295 PolarHBondContact O-N 2.72Å; L295-Y297 VanDerWaalsContact C-N 3.28Å; L295-Y297 PolarHBondContact O-N 3.39Å; L295-L298 PolarHBondContact O-N 3.38Å; L295-T299 PolarHBondContact O-N 2.83Å; L295-T299 PolarHBondContact O-OG1 3.32Å; L295-T299 VanDerWaalsContact O-OG1 3.07Å; L295-H308 HydrophobicContact CD1-CB 4.12Å
296	R	94.4	Very high	92.1	Very high	34 Å²	34	22.8 Å²	22.8	13%	0.128	12%	0.122	C	C	.	.	H	α-helix	trans	-53.7	-45.6	174.9	-177.7	178.6	75.4	163.1	8.6	112	D219 P292 L293 T299 D300 F456	D219-R296 IonicContact OD1-NH1 3.4Å; D219-R296 IonicContact OD1-NH2 2.64Å; D219-R296 IonicContact OD2-CZ 2.93Å; D219-R296 VanDerWaalsContact OD2-CZ 3.28Å; D219-R296 IonicContact OD2-NH1 3.22Å; D219-R296 PolarHBondContact OD2-NH1 2.97Å; D219-R296 IonicContact OD2-NH2 3.71Å; D219-R296 PolarHBondContact OD2-NH2 2.97Å; P292-R296 PolarHBondContact O-N 3.42Å; P292-R296 VanDerWaalsContact O-N 3.09Å; L293-R296 WeakPolarHBondContact O-CB 3.39Å; L293-R296 PolarHBondContact O-N 3.43Å; R296-T299 PolarHBondContact O-N 2.92Å; R296-D300 WeakPolarHBondContact O-CB 3.32Å; R296-D300 PolarHBondContact O-N 3.34Å; R296-F456 HydrophobicContact CG-CE1 4.06Å; R296-F456 HydrophobicContact CG-CZ 4.02Å
297	Y	96.1	Very high	92.5	Very high	6 Å²	6	22.3 Å²	22.3	2%	0.024	12%	0.117	C	C	.	.	H	α-helix	trans	-74	-30.1	-179	-66.4	-21.4	0	0	0	113.9	L293 S294 L295 A301 D340 A343 L533	L293-Y297 PolarHBondContact O-N 2.68Å; S294-Y297 PolarHBondContact O-N 3.1Å; L295-Y297 VanDerWaalsContact C-N 3.28Å; L295-Y297 PolarHBondContact O-N 3.39Å; Y297-A301 WeakPolarHBondContact O-CB 2.91Å; Y297-A301 PolarHBondContact O-N 3.4Å; Y297-D340 WeakPolarHBondContact CE2-O 3.26Å; Y297-D340 WeakPolarHBondContact OH-CB 3.49Å; Y297-A343 HydrophobicContact CD2-CB 3.9Å; Y297-A343 HydrophobicContact CE2-CB 3.86Å; Y297-L533 HydrophobicContact CE1-CD2 3.89Å; Y297-L533 HydrophobicContact CE2-CD2 3.95Å; Y297-L533 VanDerWaalsContact CZ-CD2 3.49Å; Y297-L533 WeakPolarHBondContact OH-CD2 3.25Å
298	L	96.4	Very high	92.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.3	-45	169.7	-73	169.6	0	0	0	110.4	S294 L295 A301 N302 L303 L307 H308 V311 I347	S294-L298 WeakPolarHBondContact O-CB 3.32Å; S294-L298 VanDerWaalsContact O-CG 3.23Å; S294-L298 WeakPolarHBondContact O-CG 3.36Å; S294-L298 PolarHBondContact O-N 3.45Å; L295-L298 PolarHBondContact O-N 3.38Å; L298-A301 PolarHBondContact O-N 3.13Å; L298-N302 PolarHBondContact O-N 2.96Å; L298-L303 HydrophobicContact CB-CB 4.36Å; L298-L303 HydrophobicContact CD2-CB 3.77Å; L298-L303 HydrophobicContact CD2-CD1 3.66Å; L298-L303 HydrophobicContact CD2-CG 4.38Å; L298-L303 PolarHBondContact O-N 3.32Å; L298-L307 HydrophobicContact CD1-CB 4.21Å; L298-L307 HydrophobicContact CD2-CB 4.05Å; L298-L307 HydrophobicContact CD2-CD1 4.13Å; L298-H308 HydrophobicContact CD1-CB 3.87Å; L298-V311 HydrophobicContact CD1-CG2 4.45Å; L298-I347 HydrophobicContact CD2-CD1 4.26Å; L298-I347 HydrophobicContact CD2-CG1 4.1Å; L298-I347 HydrophobicContact CD2-CG2 3.78Å; L298-I347 HydrophobicContact CG-CD1 4.04Å; L298-I347 HydrophobicContact CG-CG1 4.17Å
299	T	94.8	Very high	93.1	Very high	40 Å²	40	28 Å²	28	25%	0.245	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-47.9	175.9	-53.5	0	0	0	0	111.2	L295 R296 A301 N302 F456 H472	L295-T299 PolarHBondContact O-N 2.83Å; L295-T299 PolarHBondContact O-OG1 3.32Å; L295-T299 VanDerWaalsContact O-OG1 3.07Å; R296-T299 PolarHBondContact O-N 2.92Å; T299-A301 VanDerWaalsContact C-N 3.3Å; T299-A301 PolarHBondContact O-N 2.71Å; T299-N302 PolarHBondContact O-N 3.42Å; T299-N302 VanDerWaalsContact O-N 3.15Å; T299-F456 HydrophobicContact CG2-CE1 3.91Å; T299-H472 VanDerWaalsContact CA-CE1 3.43Å; T299-H472 WeakPolarHBondContact CA-CE1 3.47Å; T299-H472 PolarHBondContact O-CE1 3.03Å
300	D	95.1	Very high	93.3	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-65	-33.7	179.7	-160.7	19.7	0	0	0	112.1	R296 N302 F456 Q457 F458 W460 M532	R296-D300 WeakPolarHBondContact O-CB 3.32Å; R296-D300 PolarHBondContact O-N 3.34Å; D300-N302 VanDerWaalsContact C-N 3.28Å; D300-N302 PolarHBondContact O-N 3.01Å; D300-F456 HydrophobicContact CB-CD1 3.7Å; D300-F456 HydrophobicContact CB-CE1 4.2Å; D300-Q457 PolarHBondContact OD1-N 2.96Å; D300-Q457 PolarHBondContact OD2-N 3.4Å; D300-Q457 VanDerWaalsContact OD2-N 3.13Å; D300-F458 WeakPolarHBondContact O-CD2 3.29Å; D300-F458 PolarHBondContact OD1-N 3.25Å; D300-W460 PolarHBondContact O-NE1 2.73Å; D300-M532 HydrophobicContact CB-CE 3.5Å; D300-M532 WeakPolarHBondContact OD2-CE 3.32Å
301	A	96.5	Very high	93.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	8.4	176.4	0	0	0	0	0	114.8	Y297 L298 T299 L303 W384 L528 F529 M532	Y297-A301 WeakPolarHBondContact O-CB 2.91Å; Y297-A301 PolarHBondContact O-N 3.4Å; L298-A301 PolarHBondContact O-N 3.13Å; T299-A301 VanDerWaalsContact C-N 3.3Å; T299-A301 PolarHBondContact O-N 2.71Å; A301-L303 HydrophobicContact CB-CD1 3.91Å; A301-L303 HydrophobicContact CB-CG 4.21Å; A301-L303 PolarHBondContact O-N 3.28Å; A301-W384 PolarHBondContact O-NE1 3.44Å; A301-L528 HydrophobicContact CB-CD2 4.37Å; A301-F529 HydrophobicContact CB-CE1 4.36Å; A301-F529 HydrophobicContact CB-CZ 4.07Å; A301-M532 HydrophobicContact CB-CE 4.17Å; A301-M532 HydrophobicContact CB-SD 4.17Å
302	N	95.7	Very high	93.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	34.9	-175.7	-148.6	6.2	0	0	0	115	L298 T299 D300 W384 L387 V388 W460 P469 L471	L298-N302 PolarHBondContact O-N 2.96Å; T299-N302 PolarHBondContact O-N 3.42Å; T299-N302 VanDerWaalsContact O-N 3.15Å; D300-N302 VanDerWaalsContact C-N 3.28Å; D300-N302 PolarHBondContact O-N 3.01Å; N302-W384 PolarHBondContact O-NE1 3.34Å; N302-L387 WeakPolarHBondContact ND2-CD2 3.38Å; N302-V388 HydrophobicContact CB-CG2 4.01Å; N302-W460 HydrophobicContact CB-CD2 3.71Å; N302-W460 VanDerWaalsContact CB-CE2 3.46Å; N302-W460 HydrophobicContact CB-CE3 4.31Å; N302-W460 HydrophobicContact CB-CG 3.99Å; N302-W460 HydrophobicContact CB-CH2 4.37Å; N302-W460 HydrophobicContact CB-CZ2 3.81Å; N302-P469 PolarHBondContact ND2-O 3.06Å; N302-L471 PolarHBondContact OD1-N 2.87Å
303	L	95.6	Very high	93.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.15	C	C	.	.			trans	-91.4	159	-179.8	-77	165.8	0	0	0	111.5	L298 A301 L307 I347 I351 F379 W384 H472	L298-L303 HydrophobicContact CB-CB 4.36Å; L298-L303 HydrophobicContact CD2-CB 3.77Å; L298-L303 HydrophobicContact CD2-CD1 3.66Å; L298-L303 HydrophobicContact CD2-CG 4.38Å; L298-L303 PolarHBondContact O-N 3.32Å; A301-L303 HydrophobicContact CB-CD1 3.91Å; A301-L303 HydrophobicContact CB-CG 4.21Å; A301-L303 PolarHBondContact O-N 3.28Å; L303-L307 HydrophobicContact CB-CD1 4.12Å; L303-L307 HydrophobicContact CD2-CD1 4.02Å; L303-L307 HydrophobicContact CG-CD1 4.47Å; L303-I347 HydrophobicContact CD1-CG2 4.06Å; L303-I351 HydrophobicContact CD1-CD1 3.6Å; L303-I351 HydrophobicContact CD2-CD1 4.21Å; L303-F379 HydrophobicContact CD2-CZ 4Å; L303-W384 HydrophobicContact CD1-CZ2 4.22Å; L303-W384 HydrophobicContact CD2-CD2 4.13Å; L303-W384 VanDerWaalsContact CD2-CE2 3.48Å; L303-W384 HydrophobicContact CD2-CH2 4.04Å; L303-W384 HydrophobicContact CD2-CZ2 3.46Å; L303-W384 VanDerWaalsContact CD2-CZ2 3.46Å; L303-W384 HydrophobicContact CG-CZ2 3.81Å; L303-H472 PolarHBondContact O-ND1 3Å
304	P	93.1	Very high	93.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.			trans	-62.6	138	176.4	-23.9	34	0	0	0	113.1	E306 L307 F379 T474 L476	P304-E306 PolarHBondContact O-N 3.27Å; P304-L307 WeakPolarHBondContact O-CB 3.15Å; P304-L307 PolarHBondContact O-N 3.13Å; P304-L307 VanDerWaalsContact O-N 3.14Å; P304-F379 HydrophobicContact CG-CB 3.84Å; P304-F379 HydrophobicContact CG-CD1 4.18Å; P304-F379 HydrophobicContact CG-CD2 3.22Å; P304-F379 HydrophobicContact CG-CE2 3.68Å; P304-F379 HydrophobicContact CG-CG 3.47Å; P304-F379 VanDerWaalsContact CG-CG 3.47Å; P304-F379 HydrophobicContact CG-CZ 4.32Å; P304-T474 WeakPolarHBondContact CB-O 3.37Å; P304-T474 WeakPolarHBondContact CG-OG1 3.29Å; P304-L476 HydrophobicContact CB-CD2 4.32Å; P304-L476 HydrophobicContact CB-CG 4.5Å; P304-L476 HydrophobicContact CG-CD2 4.14Å
305	D	90.8	Very high	93.3	Very high	74 Å²	74	32.4 Å²	32.4	40%	0.396	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.3	178.7	-70.3	-18.8	0	0	0	112.2	L307 H308 H472	D305-L307 PolarHBondContact O-N 2.99Å; D305-L307 VanDerWaalsContact O-N 3.12Å; D305-H308 VanDerWaalsContact O-CB 3.24Å; D305-H308 WeakPolarHBondContact O-CB 3.09Å; D305-H308 PolarHBondContact O-N 3.4Å; D305-H472 PolarHBondContact N-O 2.97Å; D305-H472 IonicContact OD1-CG 3.76Å
306	E	90.8	Very high	92.9	Very high	79 Å²	79	33.6 Å²	33.6	37%	0.369	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.1	176.6	-68.2	-171.6	171.3	0	0	113.2	P304 H308 R309 K475 L476	P304-E306 PolarHBondContact O-N 3.27Å; E306-H308 PolarHBondContact O-N 2.9Å; E306-R309 PolarHBondContact O-N 2.77Å; E306-K475 WeakPolarHBondContact OE2-CA 3.33Å; E306-L476 HydrophobicContact CB-CD1 3.67Å; E306-L476 HydrophobicContact CB-CG 4Å; E306-L476 PolarHBondContact OE2-N 2.89Å
307	L	93.1	Very high	92.5	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-64.2	-26.5	174.6	-74.7	175.6	0	0	0	112.2	L298 L303 P304 D305 R309 W310 V311 T350 I351 M354 F355 L476	L298-L307 HydrophobicContact CD1-CB 4.21Å; L298-L307 HydrophobicContact CD2-CB 4.05Å; L298-L307 HydrophobicContact CD2-CD1 4.13Å; L303-L307 HydrophobicContact CB-CD1 4.12Å; L303-L307 HydrophobicContact CD2-CD1 4.02Å; L303-L307 HydrophobicContact CG-CD1 4.47Å; P304-L307 WeakPolarHBondContact O-CB 3.15Å; P304-L307 PolarHBondContact O-N 3.13Å; P304-L307 VanDerWaalsContact O-N 3.14Å; D305-L307 PolarHBondContact O-N 2.99Å; D305-L307 VanDerWaalsContact O-N 3.12Å; L307-R309 VanDerWaalsContact C-N 3.26Å; L307-R309 PolarHBondContact O-N 3.34Å; L307-W310 WeakPolarHBondContact O-CB 3.16Å; L307-W310 PolarHBondContact O-N 3.43Å; L307-V311 PolarHBondContact O-N 3.37Å; L307-T350 HydrophobicContact CD2-CG2 4.33Å; L307-I351 HydrophobicContact CD1-CG1 4.36Å; L307-M354 HydrophobicContact CD2-CG 4.24Å; L307-F355 HydrophobicContact CD2-CE2 4.35Å; L307-L476 HydrophobicContact CD2-CD1 3.58Å; L307-L476 HydrophobicContact CD2-CD2 4.17Å; L307-L476 HydrophobicContact CG-CD1 3.82Å; L307-L476 HydrophobicContact CG-CD2 4.33Å
308	H	93.8	Very high	92	Very high	45 Å²	45	40.9 Å²	40.9	21%	0.208	19%	0.191	C	C	.	.	H	α-helix	trans	-59.9	-37.7	-178.1	-176.7	54.9	0	0	0	112.1	A291 L295 L298 D305 E306 W310 V311 C312	A291-H308 PolarHBondContact O-CE1 2.9Å; L295-H308 HydrophobicContact CD1-CB 4.12Å; L298-H308 HydrophobicContact CD1-CB 3.87Å; D305-H308 VanDerWaalsContact O-CB 3.24Å; D305-H308 WeakPolarHBondContact O-CB 3.09Å; D305-H308 PolarHBondContact O-N 3.4Å; E306-H308 PolarHBondContact O-N 2.9Å; H308-W310 VanDerWaalsContact C-N 3.27Å; H308-W310 PolarHBondContact O-N 2.72Å; H308-V311 WeakPolarHBondContact O-CB 3.12Å; H308-V311 PolarHBondContact O-N 2.83Å; H308-C312 PolarHBondContact O-N 3.37Å; H308-C312 PolarHBondContact O-SG 3.02Å
309	R	92.1	Very high	91.1	Very high	185 Å²	185	42 Å²	42	70%	0.698	20%	0.204	S	C	*	.	H	α-helix	trans	-59.1	-40.7	175.4	-176.4	177.9	-178.5	172.4	1	111.7	E306 L307 C312 V313	E306-R309 PolarHBondContact O-N 2.77Å; L307-R309 VanDerWaalsContact C-N 3.26Å; L307-R309 PolarHBondContact O-N 3.34Å; R309-C312 PolarHBondContact O-N 2.94Å; R309-V313 WeakPolarHBondContact O-CG2 3.48Å; R309-V313 PolarHBondContact O-N 3.4Å; R309-V313 VanDerWaalsContact O-N 3.12Å
310	W	91.5	Very high	90.1	Very high	36 Å²	36	40.4 Å²	40.4	14%	0.136	19%	0.193	C	C	.	.	H	α-helix	trans	-71.7	-37.8	179.2	-66.6	101.1	0	0	0	112.3	L307 H308 C312 V313 L314 T350 M354 I480 M487	L307-W310 WeakPolarHBondContact O-CB 3.16Å; L307-W310 PolarHBondContact O-N 3.43Å; H308-W310 VanDerWaalsContact C-N 3.27Å; H308-W310 PolarHBondContact O-N 2.72Å; W310-C312 VanDerWaalsContact C-N 3.31Å; W310-C312 PolarHBondContact O-N 2.92Å; W310-V313 PolarHBondContact O-N 3.22Å; W310-L314 PolarHBondContact O-N 3.41Å; W310-T350 HydrophobicContact CB-CG2 3.6Å; W310-M354 HydrophobicContact CD2-CE 4.15Å; W310-M354 HydrophobicContact CD2-SD 3.82Å; W310-M354 HydrophobicContact CE3-SD 4.19Å; W310-M354 HydrophobicContact CG-CE 4.19Å; W310-M354 HydrophobicContact CG-SD 4.04Å; W310-M354 HydrophobicContact CZ2-CE 4.25Å; W310-M354 HydrophobicContact CZ2-SD 4.41Å; W310-I480 HydrophobicContact CZ2-CD1 3.77Å; W310-I480 HydrophobicContact CZ2-CG1 3.93Å; W310-I480 HydrophobicContact CZ2-CG2 4.13Å; W310-M487 HydrophobicContact CH2-CB 3.95Å; W310-M487 VanDerWaalsContact CH2-O 3.3Å; W310-M487 WeakPolarHBondContact CH2-O 3.39Å; W310-M487 HydrophobicContact CZ2-CB 3.92Å
311	V	93.7	Very high	88.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.1	-47.9	171.3	171	0	0	0	0	110.5	L298 L307 H308 V313 L314 M315 L346 I347 T350	L298-V311 HydrophobicContact CD1-CG2 4.45Å; L307-V311 PolarHBondContact O-N 3.37Å; H308-V311 WeakPolarHBondContact O-CB 3.12Å; H308-V311 PolarHBondContact O-N 2.83Å; V311-V313 PolarHBondContact O-N 3.43Å; V311-L314 PolarHBondContact O-N 2.93Å; V311-M315 WeakPolarHBondContact O-CB 3.25Å; V311-M315 PolarHBondContact O-N 2.93Å; V311-L346 HydrophobicContact CG1-CB 4.11Å; V311-I347 HydrophobicContact CG2-CG1 4.21Å; V311-T350 HydrophobicContact CG2-CG2 4.1Å; V311-T350 WeakPolarHBondContact CG2-OG1 3.46Å
312	C	91.6	Very high	86.6	Confident	31 Å²	31	46.8 Å²	46.8	21%	0.209	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-42.8	177.8	-68.1	0	0	0	0	112.4	H308 R309 W310 L314 M315 D316	H308-C312 PolarHBondContact O-N 3.37Å; H308-C312 PolarHBondContact O-SG 3.02Å; R309-C312 PolarHBondContact O-N 2.94Å; W310-C312 VanDerWaalsContact C-N 3.31Å; W310-C312 PolarHBondContact O-N 2.92Å; C312-L314 VanDerWaalsContact C-N 3.34Å; C312-L314 PolarHBondContact O-N 3.11Å; C312-M315 WeakPolarHBondContact O-CB 3.24Å; C312-M315 PolarHBondContact O-N 3.06Å; C312-D316 PolarHBondContact O-N 3.2Å
313	V	90.2	Very high	84.9	Confident	53 Å²	53	51.4 Å²	51.4	32%	0.321	26%	0.256	S	S	.	.	H	α-helix	trans	-60.4	-41.8	175.9	170.6	0	0	0	0	111.9	R309 W310 V311 R317	R309-V313 WeakPolarHBondContact O-CG2 3.48Å; R309-V313 PolarHBondContact O-N 3.4Å; R309-V313 VanDerWaalsContact O-N 3.12Å; W310-V313 PolarHBondContact O-N 3.22Å; V311-V313 PolarHBondContact O-N 3.43Å; V313-R317 WeakPolarHBondContact O-CG 3.48Å; V313-R317 PolarHBondContact O-N 3.37Å; V313-R317 VanDerWaalsContact O-N 3.14Å
314	L	89.9	Confident	83.2	Confident	13 Å²	13	60 Å²	60	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-72.1	-35.7	177.9	-68.8	-173.3	0	0	0	112.5	W310 V311 C312 R317 A318 V349 V353 V551	W310-L314 PolarHBondContact O-N 3.41Å; V311-L314 PolarHBondContact O-N 2.93Å; C312-L314 VanDerWaalsContact C-N 3.34Å; C312-L314 PolarHBondContact O-N 3.11Å; L314-R317 PolarHBondContact O-N 3.47Å; L314-A318 WeakPolarHBondContact O-CB 3.24Å; L314-A318 PolarHBondContact O-N 2.71Å; L314-V349 HydrophobicContact CD1-CG1 4.13Å; L314-V353 HydrophobicContact CD1-CG2 4.26Å; L314-V551 HydrophobicContact CD2-CG1 3.94Å
315	M	89.5	Confident	81.3	Confident	10 Å²	10	67.6 Å²	67.6	5%	0.049	32%	0.321	C	S	.	.	H	α-helix	trans	-60.9	-44.4	173.8	-176.2	-174.9	66.2	0	0	111.4	P290 A291 V311 C312 A318 G319 M320 L346	P290-M315 HydrophobicContact CB-SD 4.25Å; A291-M315 HydrophobicContact CB-CE 3.97Å; A291-M315 HydrophobicContact CB-SD 4.13Å; V311-M315 WeakPolarHBondContact O-CB 3.25Å; V311-M315 PolarHBondContact O-N 2.93Å; C312-M315 WeakPolarHBondContact O-CB 3.24Å; C312-M315 PolarHBondContact O-N 3.06Å; M315-A318 PolarHBondContact O-N 3.33Å; M315-G319 PolarHBondContact O-N 3.05Å; M315-M320 HydrophobicContact CG-CB 3.71Å; M315-M320 WeakPolarHBondContact O-CB 3.25Å; M315-M320 PolarHBondContact O-N 3.45Å; M315-L346 HydrophobicContact CB-CD1 4.18Å; M315-L346 HydrophobicContact CB-CD2 4.18Å; M315-L346 HydrophobicContact CG-CD1 4.17Å
316	D	87.4	Confident	79.6	Confident	94 Å²	94	64.1 Å²	64.1	50%	0.503	30%	0.303	S	S	.	.	H	α-helix	trans	-61.6	-44.9	175.2	-70.4	-11.6	0	0	0	111.2	C312 A318 G319 A321	C312-D316 PolarHBondContact O-N 3.2Å; D316-A318 VanDerWaalsContact C-N 3.32Å; D316-A318 PolarHBondContact O-N 2.85Å; D316-G319 PolarHBondContact O-N 3.29Å; D316-A321 WeakPolarHBondContact OD1-CB 3.18Å
317	R	84.9	Confident	78	Confident	179 Å²	179	61.2 Å²	61.2	68%	0.675	29%	0.29	S	S	*	.	H	α-helix	trans	-63.6	-34.9	176.4	-74.6	-176.7	-177.7	-165.1	2.8	113.3	V313 L314 G319	V313-R317 WeakPolarHBondContact O-CG 3.48Å; V313-R317 PolarHBondContact O-N 3.37Å; V313-R317 VanDerWaalsContact O-N 3.14Å; L314-R317 PolarHBondContact O-N 3.47Å; R317-G319 PolarHBondContact O-N 3.02Å; R317-G319 VanDerWaalsContact O-N 3.16Å
318	A	84.9	Confident	76.2	Confident	13 Å²	13	61.2 Å²	61.2	11%	0.107	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-4.2	174.7	0	0	0	0	0	113	L314 M315 D316 M320 M547 R550 V551	L314-A318 WeakPolarHBondContact O-CB 3.24Å; L314-A318 PolarHBondContact O-N 2.71Å; M315-A318 PolarHBondContact O-N 3.33Å; D316-A318 VanDerWaalsContact C-N 3.32Å; D316-A318 PolarHBondContact O-N 2.85Å; A318-M320 HydrophobicContact CB-CB 4.43Å; A318-M320 HydrophobicContact CB-CG 3.97Å; A318-M320 HydrophobicContact CB-SD 4.22Å; A318-M320 PolarHBondContact O-N 3.46Å; A318-M547 HydrophobicContact CB-SD 4.19Å; A318-R550 HydrophobicContact CB-CB 3.9Å; A318-V551 HydrophobicContact CB-CG2 3.9Å
319	G	78.2	Confident	74.5	Confident	25 Å²	25	64.4 Å²	64.4	26%	0.258	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	20.1	-173.1	0	0	0	0	0	112.4	M315 D316 R317 A321 R325	M315-G319 PolarHBondContact O-N 3.05Å; D316-G319 PolarHBondContact O-N 3.29Å; R317-G319 PolarHBondContact O-N 3.02Å; R317-G319 VanDerWaalsContact O-N 3.16Å; G319-A321 VanDerWaalsContact C-N 3.31Å; G319-R325 WeakPolarHBondContact O-CD 3.4Å
320	M	73.5	Confident	72.6	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.03	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	13.1	178.8	-67.3	-175.6	64.4	0	0	112	P290 M315 A318 H326 Q342 M547	P290-M320 HydrophobicContact CG-CE 4.35Å; M315-M320 HydrophobicContact CG-CB 3.71Å; M315-M320 WeakPolarHBondContact O-CB 3.25Å; M315-M320 PolarHBondContact O-N 3.45Å; A318-M320 HydrophobicContact CB-CB 4.43Å; A318-M320 HydrophobicContact CB-CG 3.97Å; A318-M320 HydrophobicContact CB-SD 4.22Å; A318-M320 PolarHBondContact O-N 3.46Å; M320-H326 PolarHBondContact O-CE1 2.8Å; M320-H326 PolarHBondContact O-NE2 3.17Å; M320-Q342 HydrophobicContact CE-CB 4.12Å; M320-Q342 HydrophobicContact CE-CG 4.13Å; M320-M547 HydrophobicContact CE-CE 4.03Å; M320-M547 HydrophobicContact SD-CE 3.5Å; M320-M547 WeakPolarHBondContact SD-CE 3.31Å; M320-M547 HydrophobicContact SD-SD 3.57Å
321	A	59.1	Low	70.9	Confident	47 Å²	47	58.5 Å²	58.5	39%	0.388	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-19.8	168.3	0	0	0	0	0	112.7	D316 G319 Q323	D316-A321 WeakPolarHBondContact OD1-CB 3.18Å; G319-A321 VanDerWaalsContact C-N 3.31Å; A321-Q323 PolarHBondContact O-N 3.27Å
322	D	60.4	Low	68.8	Low	91 Å²	91	67.4 Å²	67.4	49%	0.487	36%	0.364	S	S	.	.			trans	-74.1	116.2	-177.5	-82.6	-27.6	0	0	0	111.6	K324 R325	D322-K324 PolarHBondContact O-N 2.84Å; D322-R325 HydrophobicContact CB-CG 4.19Å; D322-R325 WeakPolarHBondContact O-CB 3.33Å; D322-R325 PolarHBondContact O-N 3.13Å; D322-R325 IonicContact OD2-NH1 3.68Å; D322-R325 PolarHBondContact OD2-NH1 3.09Å
323	Q	59.5	Low	67.2	Low	97 Å²	97	75.9 Å²	75.9	45%	0.453	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-50.3	-33.1	178.4	-65.7	173.2	-3.1	0	0	113.9	A321 R325 H326 T327	A321-Q323 PolarHBondContact O-N 3.27Å; Q323-R325 PolarHBondContact O-N 3.45Å; Q323-H326 PolarHBondContact O-N 3.5Å; Q323-T327 PolarHBondContact O-OG1 3.14Å
324	K	58.4	Low	66.1	Low	182 Å²	182	74.3 Å²	74.3	79%	0.791	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18.9	179.4	-67.6	-176.1	178.9	180	0	113.8	D322	D322-K324 PolarHBondContact O-N 2.84Å
325	R	55.2	Low	65.5	Low	158 Å²	158	78.9 Å²	78.9	60%	0.596	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-91.9	-19.5	-177	-66.1	-178.2	137.1	103.8	0.9	113.7	G319 D322 Q323 T327	G319-R325 WeakPolarHBondContact O-CD 3.4Å; D322-R325 HydrophobicContact CB-CG 4.19Å; D322-R325 WeakPolarHBondContact O-CB 3.33Å; D322-R325 PolarHBondContact O-N 3.13Å; D322-R325 IonicContact OD2-NH1 3.68Å; D322-R325 PolarHBondContact OD2-NH1 3.09Å; Q323-R325 PolarHBondContact O-N 3.45Å; R325-T327 VanDerWaalsContact C-N 3.33Å
326	H	54.2	Low	65.3	Low	2 Å²	2	78.5 Å²	78.5	1%	0.009	41%	0.409	C	S	.	.	S	Bend	trans	-96.1	7.5	172.5	-59.3	-50.1	0	0	0	112.7	I282 H289 M320 Q323 Y339	I282-H326 HydrophobicContact CB-CB 4.19Å; I282-H326 WeakPolarHBondContact CD1-O 3.43Å; H289-H326 AromaticContact CD2-CD2 3.71Å; H289-H326 AromaticContact NE2-CD2 3.48Å; H289-H326 PolarHBondContact NE2-CD2 3.31Å; H289-H326 AromaticContact NE2-NE2 3.47Å; H289-H326 PolarHBondContact NE2-NE2 3.42Å; M320-H326 PolarHBondContact O-CE1 2.8Å; M320-H326 PolarHBondContact O-NE2 3.17Å; Q323-H326 PolarHBondContact O-N 3.5Å; H326-Y339 HydrophobicContact CB-CE1 4.15Å; H326-Y339 PolarHBondContact O-OH 3.22Å
327	T	57.5	Low	65.2	Low	17 Å²	17	74.6 Å²	74.6	10%	0.104	39%	0.388	C	S	.	.	S	Bend	trans	-113.1	138.4	179.4	-49.2	0	0	0	0	106.9	F279 P281 Q323 R325 D329	F279-T327 HydrophobicContact CB-CG2 4.31Å; F279-T327 WeakPolarHBondContact O-CG2 3.38Å; P281-T327 VanDerWaalsContact CA-OG1 3.32Å; P281-T327 WeakPolarHBondContact CA-OG1 3.49Å; Q323-T327 PolarHBondContact O-OG1 3.14Å; R325-T327 VanDerWaalsContact C-N 3.33Å; T327-D329 PolarHBondContact O-N 3.37Å
328	L	55.8	Low	65.5	Low	1 Å²	1	69 Å²	69	1%	0.005	37%	0.367	C	S	.	.			trans	-59.8	102.9	168.4	-171.3	86.5	0	0	0	108.1	V271 A278 F279 P334 L336	V271-L328 HydrophobicContact CB-CD2 4.45Å; V271-L328 HydrophobicContact CG1-CD1 4.18Å; V271-L328 HydrophobicContact CG1-CD2 3.42Å; V271-L328 VanDerWaalsContact CG1-CD2 3.42Å; V271-L328 HydrophobicContact CG1-CG 4.32Å; V271-L328 HydrophobicContact CG2-CD2 4.14Å; A278-L328 WeakPolarHBondContact CA-O 3.38Å; A278-L328 WeakPolarHBondContact CB-O 3.43Å; F279-L328 HydrophobicContact CB-CB 4.07Å; F279-L328 HydrophobicContact CD1-CB 3.82Å; F279-L328 HydrophobicContact CD1-CD2 3.46Å; F279-L328 VanDerWaalsContact CD1-CD2 3.46Å; F279-L328 HydrophobicContact CD1-CG 4.28Å; F279-L328 HydrophobicContact CE1-CB 4.47Å; F279-L328 HydrophobicContact CE1-CD2 3.43Å; F279-L328 VanDerWaalsContact CE1-CD2 3.43Å; F279-L328 HydrophobicContact CG-CB 3.92Å; F279-L328 HydrophobicContact CG-CD2 4.36Å; F279-L328 HydrophobicContact CZ-CD2 4.29Å; F279-L328 PolarHBondContact N-O 3.48Å; L328-P334 HydrophobicContact CD1-CB 3.8Å; L328-P334 HydrophobicContact CD2-CB 4.04Å; L328-P334 HydrophobicContact CG-CB 3.71Å; L328-L336 HydrophobicContact CD1-CB 4.14Å; L328-L336 HydrophobicContact CD1-CD1 4.18Å
329	D	56.9	Low	65.8	Low	112 Å²	112	68.7 Å²	68.7	60%	0.599	36%	0.364	S	S	*	.			trans	-74.8	140.3	-177.4	-170	14.9	0	0	0	110.9	T327 G331 P334	T327-D329 PolarHBondContact O-N 3.37Å; D329-G331 PolarHBondContact O-N 3.1Å; D329-P334 VanDerWaalsContact O-CB 3.31Å; D329-P334 WeakPolarHBondContact O-CB 3.41Å
330	G	51.9	Low	66.5	Low	59 Å²	59	67.8 Å²	67.8	61%	0.608	35%	0.353	S	S	*	.			trans	-73.6	18.7	-177.3	0	0	0	0	0	114.8
331	G	55.4	Low	67.5	Low	39 Å²	39	67.5 Å²	67.5	40%	0.402	35%	0.351	S	S	.	.	S	Bend	trans	-66.3	175.1	179.2	0	0	0	0	0	113.3	D329 R333 P334	D329-G331 PolarHBondContact O-N 3.1Å; G331-R333 PolarHBondContact O-N 2.92Å; G331-P334 WeakPolarHBondContact O-CD 3.47Å
332	L	50.6	Low	69.2	Low	187 Å²	187	65.9 Å²	65.9	98%	0.979	34%	0.336	S	S	*	.	S	Bend	trans	-56.1	-20.9	-177.8	-72.8	162.4	0	0	0	114.1
333	R	58.1	Low	70.8	Confident	208 Å²	208	61.6 Å²	61.6	79%	0.785	31%	0.313	S	S	*	.	S	Bend	trans	-142.8	88	174.2	-66.2	-174.8	-176.5	174.1	2.5	109.8	G331 V335	G331-R333 PolarHBondContact O-N 2.92Å; R333-V335 PolarHBondContact O-N 3.16Å
334	P	66.5	Low	72.6	Confident	21 Å²	21	57 Å²	57	14%	0.136	29%	0.291	C	S	.	.			trans	-62.1	130.8	176.8	26	-33.5	0	0	0	108.9	Q268 V271 Q272 L328 D329 G331	Q268-P334 PolarHBondContact NE2-O 3.37Å; V271-P334 HydrophobicContact CG1-CB 4.02Å; V271-P334 HydrophobicContact CG1-CG 3.57Å; Q272-P334 HydrophobicContact CG-CG 4.49Å; L328-P334 HydrophobicContact CD1-CB 3.8Å; L328-P334 HydrophobicContact CD2-CB 4.04Å; L328-P334 HydrophobicContact CG-CB 3.71Å; D329-P334 VanDerWaalsContact O-CB 3.31Å; D329-P334 WeakPolarHBondContact O-CB 3.41Å; G331-P334 WeakPolarHBondContact O-CD 3.47Å
335	V	78.3	Confident	74.4	Confident	108 Å²	108	48.3 Å²	48.3	66%	0.655	25%	0.253	S	S	*	.			trans	-109.4	119.8	175.9	179.4	0	0	0	0	108.4	R333 P337	R333-V335 PolarHBondContact O-N 3.16Å; V335-P337 WeakPolarHBondContact O-CD 3.23Å
336	L	84.5	Confident	76.3	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	23%	0.225	C	C	.	.			trans	-71	122.4	177.1	-172.9	65.8	0	0	0	109.3	L206 H264 A267 L328	L206-L336 HydrophobicContact CD2-CD1 4.19Å; L206-L336 HydrophobicContact CD2-CD2 3.85Å; H264-L336 PolarHBondContact CE1-O 3.2Å; H264-L336 PolarHBondContact NE2-O 3.33Å; A267-L336 HydrophobicContact CB-CD2 3.86Å; L328-L336 HydrophobicContact CD1-CB 4.14Å; L328-L336 HydrophobicContact CD1-CD1 4.18Å
337	P	86.4	Confident	78.4	Confident	11 Å²	11	40.7 Å²	40.7	7%	0.071	23%	0.225	C	C	.	.			trans	-69.7	149.8	176.1	-19.4	33.4	0	0	0	112.2	V335 Y339	V335-P337 WeakPolarHBondContact O-CD 3.23Å; P337-Y339 HydrophobicContact CB-CD1 4.22Å; P337-Y339 HydrophobicContact CB-CE1 3.65Å; P337-Y339 HydrophobicContact CB-CE2 4.19Å; P337-Y339 HydrophobicContact CG-CE1 4.12Å; P337-Y339 WeakPolarHBondContact CG-OH 3.48Å
338	R	90.3	Very high	80.2	Confident	61 Å²	61	39.9 Å²	39.9	23%	0.23	22%	0.22	C	C	.	.			trans	-105.4	75.7	178.7	-64.6	175.1	-67.1	167.4	-9.6	109.1	H264 D340 L341 Q342 Y539 E543	H264-R338 VanDerWaalsContact NE2-CG 3.27Å; H264-R338 WeakPolarHBondContact NE2-CG 3.46Å; R338-D340 VanDerWaalsContact C-N 3.31Å; R338-D340 PolarHBondContact O-N 3.01Å; R338-L341 HydrophobicContact CB-CB 4.17Å; R338-L341 HydrophobicContact CB-CD1 4.1Å; R338-L341 HydrophobicContact CB-CG 4.34Å; R338-L341 HydrophobicContact CG-CD1 4.46Å; R338-L341 PolarHBondContact O-N 3.19Å; R338-Q342 WeakPolarHBondContact O-CB 3.49Å; R338-Q342 VanDerWaalsContact O-CG 3.27Å; R338-Q342 WeakPolarHBondContact O-CG 3.47Å; R338-Q342 PolarHBondContact O-N 2.86Å; R338-Y539 WeakPolarHBondContact CD-OH 3.42Å; R338-Y539 VanDerWaalsContact NH1-CZ 3.29Å; R338-Y539 PolarHBondContact NH1-OH 2.85Å; R338-E543 IonicContact CZ-OE2 3.3Å; R338-E543 IonicContact NE-OE2 2.68Å; R338-E543 PolarHBondContact NE-OE2 3.07Å; R338-E543 IonicContact NH1-OE2 2.74Å; R338-E543 IonicContact NH2-OE2 2.98Å; R338-E543 PolarHBondContact NH2-OE2 2.76Å
339	Y	90.8	Very high	82	Confident	8 Å²	8	39.9 Å²	39.9	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-39.5	-168	-56	-74.8	0	0	0	113.5	V209 I282 L288 H326 P337 Q342 A343	V209-Y339 HydrophobicContact CG1-CE2 3.85Å; V209-Y339 HydrophobicContact CG2-CE2 4.45Å; I282-Y339 HydrophobicContact CD1-CD1 4.26Å; I282-Y339 HydrophobicContact CD1-CE1 3.43Å; I282-Y339 VanDerWaalsContact CD1-CE1 3.43Å; I282-Y339 HydrophobicContact CD1-CE2 3.88Å; I282-Y339 WeakPolarHBondContact CD1-OH 3.26Å; L288-Y339 HydrophobicContact CD1-CD2 4.1Å; L288-Y339 HydrophobicContact CD1-CG 4.4Å; L288-Y339 HydrophobicContact CD2-CD2 3.85Å; L288-Y339 HydrophobicContact CD2-CE2 3.88Å; L288-Y339 HydrophobicContact CG-CD2 3.78Å; L288-Y339 HydrophobicContact CG-CE2 4.25Å; L288-Y339 HydrophobicContact CG-CG 4.01Å; H326-Y339 HydrophobicContact CB-CE1 4.15Å; H326-Y339 PolarHBondContact O-OH 3.22Å; P337-Y339 HydrophobicContact CB-CD1 4.22Å; P337-Y339 HydrophobicContact CB-CE1 3.65Å; P337-Y339 HydrophobicContact CB-CE2 4.19Å; P337-Y339 HydrophobicContact CG-CE1 4.12Å; P337-Y339 WeakPolarHBondContact CG-OH 3.48Å; Y339-Q342 PolarHBondContact O-N 3.11Å; Y339-A343 WeakPolarHBondContact O-CB 3.33Å; Y339-A343 PolarHBondContact O-N 3.37Å
340	D	93.4	Very high	83.8	Confident	5 Å²	5	34.6 Å²	34.6	3%	0.027	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-51.2	175.9	38.6	21.5	0	0	0	112.5	T216 L217 S218 H260 Y297 R338 Q342 A343 A344 L533	T216-D340 HydrophobicContact CG2-CB 4.15Å; L217-D340 PolarHBondContact N-OD2 3.07Å; S218-D340 PolarHBondContact N-OD2 3.41Å; H260-D340 IonicContact CD2-OD2 3.7Å; H260-D340 IonicContact CE1-OD1 3.12Å; H260-D340 IonicContact NE2-OD1 2.88Å; H260-D340 IonicContact NE2-OD2 2.6Å; H260-D340 PolarHBondContact NE2-OD2 2.97Å; H260-D340 VanDerWaalsContact NE2-OD2 3.14Å; Y297-D340 WeakPolarHBondContact CE2-O 3.26Å; Y297-D340 WeakPolarHBondContact OH-CB 3.49Å; R338-D340 VanDerWaalsContact C-N 3.31Å; R338-D340 PolarHBondContact O-N 3.01Å; D340-Q342 PolarHBondContact O-N 3.19Å; D340-A343 PolarHBondContact O-N 3.3Å; D340-A344 PolarHBondContact O-N 2.91Å; D340-L533 HydrophobicContact CB-CD1 4.5Å; D340-L533 HydrophobicContact CB-CD2 4.28Å
341	L	95	Very high	85.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66	-38.2	177.7	-60.2	179.3	0	0	0	112.2	R338 A344 A345 L533 V535 Y539 L540 E543	R338-L341 HydrophobicContact CB-CB 4.17Å; R338-L341 HydrophobicContact CB-CD1 4.1Å; R338-L341 HydrophobicContact CB-CG 4.34Å; R338-L341 HydrophobicContact CG-CD1 4.46Å; R338-L341 PolarHBondContact O-N 3.19Å; L341-A344 PolarHBondContact O-N 3.26Å; L341-A345 WeakPolarHBondContact O-CB 3.43Å; L341-A345 PolarHBondContact O-N 3.29Å; L341-L533 HydrophobicContact CD2-CD1 3.98Å; L341-V535 HydrophobicContact CD2-CB 4.47Å; L341-V535 HydrophobicContact CD2-CG1 4.16Å; L341-V535 HydrophobicContact CD2-CG2 3.94Å; L341-Y539 HydrophobicContact CD1-CD1 3.83Å; L341-Y539 HydrophobicContact CD1-CE1 3.35Å; L341-L540 HydrophobicContact CD2-CD1 4.03Å; L341-E543 HydrophobicContact CB-CB 4.22Å; L341-E543 HydrophobicContact CB-CG 3.9Å
342	Q	94	Very high	87.5	Confident	14 Å²	14	30 Å²	30	7%	0.065	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-45	177.5	-77.1	174.7	-1.6	0	0	111.7	M320 R338 Y339 D340 A345 L346 E543 M547	M320-Q342 HydrophobicContact CE-CB 4.12Å; M320-Q342 HydrophobicContact CE-CG 4.13Å; R338-Q342 WeakPolarHBondContact O-CB 3.49Å; R338-Q342 VanDerWaalsContact O-CG 3.27Å; R338-Q342 WeakPolarHBondContact O-CG 3.47Å; R338-Q342 PolarHBondContact O-N 2.86Å; Y339-Q342 PolarHBondContact O-N 3.11Å; D340-Q342 PolarHBondContact O-N 3.19Å; Q342-A345 PolarHBondContact O-N 3.41Å; Q342-L346 WeakPolarHBondContact O-CB 3.5Å; Q342-L346 WeakPolarHBondContact O-CG 3.46Å; Q342-L346 PolarHBondContact O-N 3.16Å; Q342-E543 HydrophobicContact CG-CG 4.45Å; Q342-E543 WeakPolarHBondContact CG-OE1 3.46Å; Q342-M547 HydrophobicContact CB-CE 4.28Å; Q342-M547 HydrophobicContact CG-CE 4.4Å
343	A	95.1	Very high	89.4	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.8	-42.3	177.6	0	0	0	0	0	112	L293 S294 Y297 Y339 D340 L346 I347	L293-A343 HydrophobicContact CB-CB 3.75Å; S294-A343 WeakPolarHBondContact OG-CA 3.29Å; S294-A343 PolarHBondContact OG-O 3.14Å; Y297-A343 HydrophobicContact CD2-CB 3.9Å; Y297-A343 HydrophobicContact CE2-CB 3.86Å; Y339-A343 WeakPolarHBondContact O-CB 3.33Å; Y339-A343 PolarHBondContact O-N 3.37Å; D340-A343 PolarHBondContact O-N 3.3Å; A343-L346 PolarHBondContact O-N 3.32Å; A343-I347 WeakPolarHBondContact O-CG1 3.25Å; A343-I347 PolarHBondContact O-N 2.99Å
344	A	97.1	Very high	90.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-66.6	-42	174.8	0	0	0	0	0	112.3	D340 L341 L346 I347 I348 F529 L533 L540	D340-A344 PolarHBondContact O-N 2.91Å; L341-A344 PolarHBondContact O-N 3.26Å; A344-L346 VanDerWaalsContact C-N 3.34Å; A344-L346 PolarHBondContact O-N 2.85Å; A344-I347 PolarHBondContact O-N 3.11Å; A344-I348 WeakPolarHBondContact O-CG1 2.84Å; A344-I348 PolarHBondContact O-N 3.14Å; A344-F529 HydrophobicContact CB-CB 4.38Å; A344-F529 HydrophobicContact CB-CD1 3.96Å; A344-F529 HydrophobicContact CB-CG 4.25Å; A344-L533 HydrophobicContact CB-CD1 3.68Å; A344-L540 HydrophobicContact CB-CD1 3.97Å
345	A	96	Very high	92	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.3	-41.2	175.9	0	0	0	0	0	112	L341 Q342 I347 I348 V349 E543 V544 M547	L341-A345 WeakPolarHBondContact O-CB 3.43Å; L341-A345 PolarHBondContact O-N 3.29Å; Q342-A345 PolarHBondContact O-N 3.41Å; A345-I347 PolarHBondContact O-N 3.42Å; A345-I348 PolarHBondContact O-N 3.25Å; A345-V349 WeakPolarHBondContact O-CB 3.45Å; A345-V349 VanDerWaalsContact O-CG2 3.29Å; A345-V349 WeakPolarHBondContact O-CG2 3.25Å; A345-V349 PolarHBondContact O-N 3.42Å; A345-E543 HydrophobicContact CB-CB 4.28Å; A345-E543 HydrophobicContact CB-CG 3.88Å; A345-V544 HydrophobicContact CB-CG2 4Å; A345-M547 HydrophobicContact CB-CB 4.13Å; A345-M547 HydrophobicContact CB-CE 4.42Å
346	L	95.3	Very high	92.5	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-59.3	-43.9	173.8	-80.8	167	0	0	0	112	P290 V311 M315 Q342 A343 A344 T350 M547	P290-L346 HydrophobicContact CB-CD1 4.02Å; V311-L346 HydrophobicContact CG1-CB 4.11Å; M315-L346 HydrophobicContact CB-CD1 4.18Å; M315-L346 HydrophobicContact CB-CD2 4.18Å; M315-L346 HydrophobicContact CG-CD1 4.17Å; Q342-L346 WeakPolarHBondContact O-CB 3.5Å; Q342-L346 WeakPolarHBondContact O-CG 3.46Å; Q342-L346 PolarHBondContact O-N 3.16Å; A343-L346 PolarHBondContact O-N 3.32Å; A344-L346 VanDerWaalsContact C-N 3.34Å; A344-L346 PolarHBondContact O-N 2.85Å; L346-T350 WeakPolarHBondContact O-CB 3.47Å; L346-T350 PolarHBondContact O-N 3.31Å; L346-T350 PolarHBondContact O-OG1 3.41Å; L346-M547 HydrophobicContact CD1-CE 4.41Å; L346-M547 HydrophobicContact CD2-CE 4.13Å; L346-M547 HydrophobicContact CD2-CG 3.96Å; L346-M547 HydrophobicContact CD2-SD 3.48Å; L346-M547 WeakPolarHBondContact CD2-SD 3.34Å; L346-M547 HydrophobicContact CG-CE 3.75Å; L346-M547 HydrophobicContact CG-CG 4.26Å; L346-M547 HydrophobicContact CG-SD 3.82Å
347	I	97.1	Very high	92.8	Very high	1 Å²	1	6.4 Å²	6.4	1%	0.005	3%	0.03	C	C	.	.	H	α-helix	trans	-63.3	-48	176.8	-65.9	164.2	0	0	0	110.6	S294 L298 L303 V311 A343 A344 A345 V349 T350 I351 F529	S294-I347 WeakPolarHBondContact O-CD1 3.4Å; L298-I347 HydrophobicContact CD2-CD1 4.26Å; L298-I347 HydrophobicContact CD2-CG1 4.1Å; L298-I347 HydrophobicContact CD2-CG2 3.78Å; L298-I347 HydrophobicContact CG-CD1 4.04Å; L298-I347 HydrophobicContact CG-CG1 4.17Å; L303-I347 HydrophobicContact CD1-CG2 4.06Å; V311-I347 HydrophobicContact CG2-CG1 4.21Å; A343-I347 WeakPolarHBondContact O-CG1 3.25Å; A343-I347 PolarHBondContact O-N 2.99Å; A344-I347 PolarHBondContact O-N 3.11Å; A345-I347 PolarHBondContact O-N 3.42Å; I347-V349 PolarHBondContact O-N 2.81Å; I347-T350 WeakPolarHBondContact O-CA 3.19Å; I347-T350 WeakPolarHBondContact O-CB 3.31Å; I347-T350 PolarHBondContact O-N 3.36Å; I347-T350 VanDerWaalsContact O-N 3.09Å; I347-I351 HydrophobicContact CG2-CD1 3.67Å; I347-I351 HydrophobicContact CG2-CG1 4.27Å; I347-I351 WeakPolarHBondContact O-CG1 3.38Å; I347-I351 PolarHBondContact O-N 3.14Å; I347-F529 HydrophobicContact CB-CZ 4.17Å; I347-F529 HydrophobicContact CD1-CE1 4.19Å; I347-F529 HydrophobicContact CD1-CZ 4.21Å; I347-F529 HydrophobicContact CG2-CE2 3.97Å; I347-F529 HydrophobicContact CG2-CZ 3.59Å
348	I	96.1	Very high	93	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-59	-47	179.5	-68.3	167.7	0	0	0	110.9	A344 A345 T350 I351 K352 F522 L525 L526 F529 L540 V544	A344-I348 WeakPolarHBondContact O-CG1 2.84Å; A344-I348 PolarHBondContact O-N 3.14Å; A345-I348 PolarHBondContact O-N 3.25Å; I348-T350 VanDerWaalsContact C-N 3.3Å; I348-T350 PolarHBondContact O-N 3.37Å; I348-I351 PolarHBondContact O-N 3.03Å; I348-K352 WeakPolarHBondContact O-CB 3.16Å; I348-K352 PolarHBondContact O-N 2.7Å; I348-F522 HydrophobicContact CG2-CD2 4.3Å; I348-F522 HydrophobicContact CG2-CE2 3.63Å; I348-F522 HydrophobicContact CG2-CZ 4.49Å; I348-L525 HydrophobicContact CG1-CD2 4.21Å; I348-L525 HydrophobicContact CG1-CG 4.23Å; I348-L525 HydrophobicContact CG2-CD2 4.38Å; I348-L526 HydrophobicContact CD1-CD1 4.19Å; I348-F529 HydrophobicContact CD1-CB 4.32Å; I348-F529 HydrophobicContact CD1-CD2 3.92Å; I348-F529 HydrophobicContact CD1-CG 4.35Å; I348-F529 HydrophobicContact CG1-CD2 3.71Å; I348-F529 HydrophobicContact CG1-CE2 4.05Å; I348-L540 HydrophobicContact CD1-CD2 3.88Å; I348-L540 HydrophobicContact CD1-CG 4.16Å; I348-V544 HydrophobicContact CB-CG2 4.13Å; I348-V544 HydrophobicContact CD1-CG2 3.87Å; I348-V544 HydrophobicContact CG2-CG1 4.15Å; I348-V544 HydrophobicContact CG2-CG2 3.95Å
349	V	94	Very high	93.1	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-62.9	-39	176.6	174.9	0	0	0	0	110.8	L314 A345 I347 K352 V353 V544 M547 E548	L314-V349 HydrophobicContact CD1-CG1 4.13Å; A345-V349 WeakPolarHBondContact O-CB 3.45Å; A345-V349 VanDerWaalsContact O-CG2 3.29Å; A345-V349 WeakPolarHBondContact O-CG2 3.25Å; A345-V349 PolarHBondContact O-N 3.42Å; I347-V349 PolarHBondContact O-N 2.81Å; V349-K352 PolarHBondContact O-N 3.08Å; V349-V353 HydrophobicContact CG1-CG2 4.42Å; V349-V353 VanDerWaalsContact O-CG2 3.31Å; V349-V353 WeakPolarHBondContact O-CG2 3.36Å; V349-V353 PolarHBondContact O-N 3.36Å; V349-V544 HydrophobicContact CG2-CG1 4.03Å; V349-M547 HydrophobicContact CG2-CB 4.2Å; V349-M547 HydrophobicContact CG2-CG 4.18Å; V349-E548 HydrophobicContact CG2-CG 3.82Å
350	T	93.9	Very high	93	Very high	2 Å²	2	13 Å²	13	1%	0.012	7%	0.065	C	C	.	.	H	α-helix	trans	-61.4	-50.2	176.3	-56.8	0	0	0	0	111.3	L307 W310 V311 L346 I347 I348 K352 V353 M354	L307-T350 HydrophobicContact CD2-CG2 4.33Å; W310-T350 HydrophobicContact CB-CG2 3.6Å; V311-T350 HydrophobicContact CG2-CG2 4.1Å; V311-T350 WeakPolarHBondContact CG2-OG1 3.46Å; L346-T350 WeakPolarHBondContact O-CB 3.47Å; L346-T350 PolarHBondContact O-N 3.31Å; L346-T350 PolarHBondContact O-OG1 3.41Å; I347-T350 WeakPolarHBondContact O-CA 3.19Å; I347-T350 WeakPolarHBondContact O-CB 3.31Å; I347-T350 PolarHBondContact O-N 3.36Å; I347-T350 VanDerWaalsContact O-N 3.09Å; I348-T350 VanDerWaalsContact C-N 3.3Å; I348-T350 PolarHBondContact O-N 3.37Å; T350-K352 VanDerWaalsContact C-N 3.27Å; T350-K352 PolarHBondContact O-N 3.36Å; T350-V353 PolarHBondContact O-N 3.11Å; T350-V353 VanDerWaalsContact O-N 3.16Å; T350-M354 HydrophobicContact CG2-CG 4.27Å; T350-M354 WeakPolarHBondContact O-CB 3.32Å; T350-M354 WeakPolarHBondContact O-CG 3.33Å; T350-M354 PolarHBondContact O-N 2.91Å
351	I	93.9	Very high	92.8	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-62.4	-39.1	179	-63.7	167.7	0	0	0	110.2	L303 L307 I347 I348 V353 M354 F355 L357 F381 L525	L303-I351 HydrophobicContact CD1-CD1 3.6Å; L303-I351 HydrophobicContact CD2-CD1 4.21Å; L307-I351 HydrophobicContact CD1-CG1 4.36Å; I347-I351 HydrophobicContact CG2-CD1 3.67Å; I347-I351 HydrophobicContact CG2-CG1 4.27Å; I347-I351 WeakPolarHBondContact O-CG1 3.38Å; I347-I351 PolarHBondContact O-N 3.14Å; I348-I351 PolarHBondContact O-N 3.03Å; I351-V353 PolarHBondContact O-N 3.27Å; I351-M354 PolarHBondContact O-N 3.36Å; I351-F355 HydrophobicContact CG2-CD2 3.84Å; I351-F355 WeakPolarHBondContact O-CB 3.45Å; I351-F355 PolarHBondContact O-N 3.15Å; I351-L357 HydrophobicContact CB-CD1 4.29Å; I351-L357 HydrophobicContact CG2-CD1 3.84Å; I351-L357 HydrophobicContact CG2-CD2 3.82Å; I351-L357 HydrophobicContact CG2-CG 3.97Å; I351-F381 HydrophobicContact CG2-CE2 4.26Å; I351-L525 HydrophobicContact CB-CD2 4.11Å; I351-L525 HydrophobicContact CD1-CD1 4.24Å; I351-L525 HydrophobicContact CD1-CD2 3.83Å; I351-L525 HydrophobicContact CG2-CD2 4.01Å
352	K	92.3	Very high	92.6	Very high	1 Å²	1	14.4 Å²	14.4	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-63.1	-41	175.4	-167.2	167.2	163.1	-176.5	0	112.8	I348 V349 T350 G356 L357 Y494 W495 F522 E548	I348-K352 WeakPolarHBondContact O-CB 3.16Å; I348-K352 PolarHBondContact O-N 2.7Å; V349-K352 PolarHBondContact O-N 3.08Å; T350-K352 VanDerWaalsContact C-N 3.27Å; T350-K352 PolarHBondContact O-N 3.36Å; K352-G356 VanDerWaalsContact O-CA 3.26Å; K352-G356 WeakPolarHBondContact O-CA 3.21Å; K352-G356 PolarHBondContact O-N 2.87Å; K352-L357 HydrophobicContact CB-CD1 3.98Å; K352-L357 HydrophobicContact CB-CG 4.49Å; K352-Y494 HydrophobicContact CB-CE2 4.06Å; K352-Y494 HydrophobicContact CD-CE1 4.42Å; K352-Y494 HydrophobicContact CD-CE2 3.9Å; K352-Y494 WeakPolarHBondContact CD-OH 3.31Å; K352-Y494 VanDerWaalsContact CE-CZ 3.43Å; K352-Y494 WeakPolarHBondContact CE-OH 3.44Å; K352-Y494 HydrophobicContact CG-CD2 4.36Å; K352-Y494 HydrophobicContact CG-CE2 3.62Å; K352-W495 HydrophobicContact CD-CZ2 4.1Å; K352-F522 HydrophobicContact CD-CD2 4.27Å; K352-F522 HydrophobicContact CD-CE2 4.22Å; K352-E548 IonicContact NZ-OE1 3.85Å; K352-E548 PolarHBondContact NZ-OE1 2.81Å
353	V	90	Very high	92.4	Very high	27 Å²	27	16.2 Å²	16.2	16%	0.164	8%	0.081	C	C	.	.	H	α-helix	trans	-65.4	-41.1	174.5	168.5	0	0	0	0	111.3	L314 V349 T350 I351 P489 N491 Y494 F552	L314-V353 HydrophobicContact CD1-CG2 4.26Å; V349-V353 HydrophobicContact CG1-CG2 4.42Å; V349-V353 VanDerWaalsContact O-CG2 3.31Å; V349-V353 WeakPolarHBondContact O-CG2 3.36Å; V349-V353 PolarHBondContact O-N 3.36Å; T350-V353 PolarHBondContact O-N 3.11Å; T350-V353 VanDerWaalsContact O-N 3.16Å; I351-V353 PolarHBondContact O-N 3.27Å; V353-P489 HydrophobicContact CG1-CB 4.44Å; V353-P489 HydrophobicContact CG1-CG 3.93Å; V353-N491 WeakPolarHBondContact O-CB 3.48Å; V353-Y494 HydrophobicContact CG2-CD2 4.11Å; V353-Y494 HydrophobicContact CG2-CE2 3.8Å; V353-F552 HydrophobicContact CG2-CZ 4.16Å
354	M	88.9	Confident	92	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-78.8	-47.6	-174.7	-63.9	-68.1	-74.2	0	0	112.5	L307 W310 T350 I351 L476 V479 I480 P489	L307-M354 HydrophobicContact CD2-CG 4.24Å; W310-M354 HydrophobicContact CD2-CE 4.15Å; W310-M354 HydrophobicContact CD2-SD 3.82Å; W310-M354 HydrophobicContact CE3-SD 4.19Å; W310-M354 HydrophobicContact CG-CE 4.19Å; W310-M354 HydrophobicContact CG-SD 4.04Å; W310-M354 HydrophobicContact CZ2-CE 4.25Å; W310-M354 HydrophobicContact CZ2-SD 4.41Å; T350-M354 HydrophobicContact CG2-CG 4.27Å; T350-M354 WeakPolarHBondContact O-CB 3.32Å; T350-M354 WeakPolarHBondContact O-CG 3.33Å; T350-M354 PolarHBondContact O-N 2.91Å; I351-M354 PolarHBondContact O-N 3.36Å; M354-L476 HydrophobicContact CE-CD1 4.14Å; M354-V479 HydrophobicContact CB-CG1 4.18Å; M354-V479 HydrophobicContact CE-CG1 4.39Å; M354-V479 WeakPolarHBondContact O-CG1 3.39Å; M354-I480 HydrophobicContact CE-CD1 3.96Å; M354-I480 HydrophobicContact CE-CG1 3.69Å; M354-P489 HydrophobicContact SD-CB 3.9Å
355	F	89.6	Confident	91.4	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.009	11%	0.108	C	C	.	.	H	α-helix	trans	-107.8	-6.1	-169.9	-64	-86.3	0	0	0	114.4	L307 I351 L357 T361 E362 L365 F379 F381 L476 V479	L307-F355 HydrophobicContact CD2-CE2 4.35Å; I351-F355 HydrophobicContact CG2-CD2 3.84Å; I351-F355 WeakPolarHBondContact O-CB 3.45Å; I351-F355 PolarHBondContact O-N 3.15Å; F355-L357 PolarHBondContact O-N 3.25Å; F355-L357 VanDerWaalsContact O-N 3.12Å; F355-T361 WeakPolarHBondContact O-CB 3.49Å; F355-T361 WeakPolarHBondContact O-CG2 3.44Å; F355-E362 HydrophobicContact CB-CB 4.12Å; F355-E362 PolarHBondContact O-N 2.89Å; F355-L365 HydrophobicContact CD1-CD1 4.3Å; F355-F379 AromaticContact CE1-CD1 3.74Å; F355-F379 HydrophobicContact CE1-CD1 3.74Å; F355-F379 AromaticContact CE1-CE1 3.87Å; F355-F379 HydrophobicContact CE1-CE1 3.87Å; F355-F379 HydrophobicContact CE2-CD1 4.47Å; F355-F379 HydrophobicContact CE2-CE1 4.22Å; F355-F379 AromaticContact CZ-CD1 3.44Å; F355-F379 HydrophobicContact CZ-CD1 3.44Å; F355-F379 VanDerWaalsContact CZ-CD1 3.44Å; F355-F379 AromaticContact CZ-CE1 3.53Å; F355-F379 HydrophobicContact CZ-CE1 3.53Å; F355-F381 HydrophobicContact CD1-CB 4.39Å; F355-F381 HydrophobicContact CD1-CD2 4.34Å; F355-F381 HydrophobicContact CG-CD2 4.31Å; F355-L476 HydrophobicContact CE2-CD2 4.5Å; F355-L476 HydrophobicContact CZ-CD2 3.97Å; F355-V479 HydrophobicContact CD1-CG1 4.35Å; F355-V479 HydrophobicContact CD1-CG2 4.21Å; F355-V479 HydrophobicContact CE1-CG1 4.27Å; F355-V479 HydrophobicContact CE1-CG2 3.57Å; F355-V479 HydrophobicContact CZ-CG2 4.06Å
356	G	88.3	Confident	90.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.109	C	C	.	.			trans	85.4	-55.7	-175.4	0	0	0	0	0	112.4	K352 D358 N491 W495	K352-G356 VanDerWaalsContact O-CA 3.26Å; K352-G356 WeakPolarHBondContact O-CA 3.21Å; K352-G356 PolarHBondContact O-N 2.87Å; G356-D358 VanDerWaalsContact C-N 3.29Å; G356-N491 WeakPolarHBondContact CA-ND2 3.05Å; G356-W495 VanDerWaalsContact O-CD1 3.27Å; G356-W495 PolarHBondContact O-NE1 3.35Å
357	L	91.8	Very high	90.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.128	C	C	.	.			trans	54.2	46.4	-170.4	-59.4	178.8	0	0	0	111.6	I351 K352 F355 E362 F381 W495 P519 S521 F522 L525	I351-L357 HydrophobicContact CB-CD1 4.29Å; I351-L357 HydrophobicContact CG2-CD1 3.84Å; I351-L357 HydrophobicContact CG2-CD2 3.82Å; I351-L357 HydrophobicContact CG2-CG 3.97Å; K352-L357 HydrophobicContact CB-CD1 3.98Å; K352-L357 HydrophobicContact CB-CG 4.49Å; F355-L357 PolarHBondContact O-N 3.25Å; F355-L357 VanDerWaalsContact O-N 3.12Å; L357-E362 WeakPolarHBondContact CA-OE2 3.49Å; L357-E362 PolarHBondContact N-OE2 2.94Å; L357-F381 HydrophobicContact CD2-CE2 3.59Å; L357-F381 HydrophobicContact CD2-CZ 3.57Å; L357-W495 VanDerWaalsContact O-CZ2 3.31Å; L357-W495 WeakPolarHBondContact O-CZ2 3.27Å; L357-W495 PolarHBondContact O-NE1 3.36Å; L357-P519 VanDerWaalsContact O-CB 3.28Å; L357-P519 WeakPolarHBondContact O-CB 3.46Å; L357-P519 WeakPolarHBondContact O-CG 3.39Å; L357-S521 WeakPolarHBondContact CA-OG 3.33Å; L357-F522 HydrophobicContact CB-CB 4.17Å; L357-F522 HydrophobicContact CD1-CD2 4.12Å; L357-L525 HydrophobicContact CD1-CD2 3.53Å
358	D	90.1	Very high	89.5	Confident	39 Å²	39	31.4 Å²	31.4	21%	0.209	16%	0.156	C	C	.	.	S	Bend	trans	-115.8	15.4	-175	65.3	0.6	0	0	0	113.2	G356 H360 T361 E362 W495	G356-D358 VanDerWaalsContact C-N 3.29Å; D358-H360 PolarHBondContact O-CD2 2.95Å; D358-H360 VanDerWaalsContact O-CD2 3.22Å; D358-H360 PolarHBondContact O-N 2.91Å; D358-H360 PolarHBondContact OD1-N 2.72Å; D358-T361 VanDerWaalsContact OD1-CB 3.29Å; D358-T361 WeakPolarHBondContact OD1-CB 3.34Å; D358-T361 PolarHBondContact OD1-N 3.32Å; D358-T361 PolarHBondContact OD1-OG1 3.06Å; D358-T361 PolarHBondContact OD2-OG1 3.3Å; D358-E362 PolarHBondContact N-OE2 2.94Å; D358-W495 HydrophobicContact CB-CG 4.24Å
359	D	92.2	Very high	88.6	Confident	51 Å²	51	32 Å²	32	27%	0.273	16%	0.16	S	C	.	.	S	Bend	trans	64.3	11.9	-173.2	-64.4	-30.4	0	0	0	114.5	E362 W363 P519 R520 S521	D359-E362 WeakPolarHBondContact CA-OE1 3.37Å; D359-E362 PolarHBondContact N-OE1 3.3Å; D359-E362 PolarHBondContact N-OE2 3.36Å; D359-W363 VanDerWaalsContact C-CD1 3.41Å; D359-P519 VanDerWaalsContact OD2-CA 3.24Å; D359-P519 WeakPolarHBondContact OD2-CA 3.29Å; D359-R520 VanDerWaalsContact CG-N 3.25Å; D359-R520 PolarHBondContact OD1-N 3.47Å; D359-R520 PolarHBondContact OD2-N 3.31Å; D359-S521 PolarHBondContact OD1-N 3.32Å; D359-S521 PolarHBondContact OD1-OG 3.23Å
360	H	90.1	Very high	87.5	Confident	128 Å²	128	35 Å²	35	59%	0.593	18%	0.177	S	C	*	.	S	Bend	trans	-135.4	-63.7	-178.7	-61.8	-61.6	0	0	0	112.3	D358 E362 W363 D364	D358-H360 PolarHBondContact O-CD2 2.95Å; D358-H360 VanDerWaalsContact O-CD2 3.22Å; D358-H360 PolarHBondContact O-N 2.91Å; D358-H360 PolarHBondContact OD1-N 2.72Å; H360-E362 VanDerWaalsContact C-N 3.33Å; H360-E362 PolarHBondContact O-N 2.96Å; H360-W363 PolarHBondContact O-N 2.96Å; H360-W363 VanDerWaalsContact O-N 3.07Å; H360-D364 PolarHBondContact O-N 3.37Å
361	T	88	Confident	86	Confident	36 Å²	36	39 Å²	39	22%	0.221	21%	0.205	C	C	.	.	H	α-helix	trans	-56.4	-44.3	-173.4	-59.7	0	0	0	0	111.4	F355 D358 W363 D364 L365	F355-T361 WeakPolarHBondContact O-CB 3.49Å; F355-T361 WeakPolarHBondContact O-CG2 3.44Å; D358-T361 VanDerWaalsContact OD1-CB 3.29Å; D358-T361 WeakPolarHBondContact OD1-CB 3.34Å; D358-T361 PolarHBondContact OD1-N 3.32Å; D358-T361 PolarHBondContact OD1-OG1 3.06Å; D358-T361 PolarHBondContact OD2-OG1 3.3Å; T361-W363 VanDerWaalsContact C-N 3.3Å; T361-W363 PolarHBondContact O-N 3.05Å; T361-D364 PolarHBondContact O-N 2.79Å; T361-L365 HydrophobicContact CG2-CD1 3.94Å; T361-L365 HydrophobicContact CG2-CG 4.37Å; T361-L365 WeakPolarHBondContact O-CB 3.45Å; T361-L365 VanDerWaalsContact O-CG 3.23Å; T361-L365 WeakPolarHBondContact O-CG 3.46Å; T361-L365 PolarHBondContact O-N 2.94Å
362	E	90	Very high	84.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-33.2	-179.7	64	-86.4	-161.5	0	0	113.1	F355 L357 D358 D359 H360 S366 F381 S521	F355-E362 HydrophobicContact CB-CB 4.12Å; F355-E362 PolarHBondContact O-N 2.89Å; L357-E362 WeakPolarHBondContact CA-OE2 3.49Å; L357-E362 PolarHBondContact N-OE2 2.94Å; D358-E362 PolarHBondContact N-OE2 2.94Å; D359-E362 WeakPolarHBondContact CA-OE1 3.37Å; D359-E362 PolarHBondContact N-OE1 3.3Å; D359-E362 PolarHBondContact N-OE2 3.36Å; H360-E362 VanDerWaalsContact C-N 3.33Å; H360-E362 PolarHBondContact O-N 2.96Å; E362-S366 WeakPolarHBondContact O-CB 3.24Å; E362-S366 PolarHBondContact O-N 2.59Å; E362-S366 VanDerWaalsContact O-N 3.12Å; E362-S366 PolarHBondContact O-OG 3.19Å; E362-F381 HydrophobicContact CB-CB 4.44Å; E362-F381 HydrophobicContact CB-CD1 3.87Å; E362-F381 HydrophobicContact CB-CD2 4.28Å; E362-F381 HydrophobicContact CB-CE1 4.15Å; E362-F381 HydrophobicContact CB-CG 3.95Å; E362-F381 HydrophobicContact CB-CZ 4.46Å; E362-F381 HydrophobicContact CG-CD1 3.82Å; E362-F381 HydrophobicContact CG-CE1 3.76Å; E362-F381 HydrophobicContact CG-CG 4.42Å; E362-F381 HydrophobicContact CG-CZ 4.27Å; E362-S521 WeakPolarHBondContact OE1-CB 3.21Å; E362-S521 PolarHBondContact OE1-OG 2.95Å
363	W	90.3	Very high	82.4	Confident	51 Å²	51	52.1 Å²	52.1	19%	0.193	27%	0.27	C	S	.	.	H	α-helix	trans	-80.2	-37.8	180	-52.5	109.3	0	0	0	111.1	D359 H360 T361 S366 N367 F381 R382 Y385	D359-W363 VanDerWaalsContact C-CD1 3.41Å; H360-W363 PolarHBondContact O-N 2.96Å; H360-W363 VanDerWaalsContact O-N 3.07Å; T361-W363 VanDerWaalsContact C-N 3.3Å; T361-W363 PolarHBondContact O-N 3.05Å; W363-S366 WeakPolarHBondContact O-CB 3.44Å; W363-S366 PolarHBondContact O-N 2.85Å; W363-N367 PolarHBondContact O-N 3.21Å; W363-N367 PolarHBondContact O-ND2 2.81Å; W363-N367 PolarHBondContact O-OD1 3.45Å; W363-F381 HydrophobicContact CE3-CD1 4.49Å; W363-F381 HydrophobicContact CH2-CD1 4.23Å; W363-F381 HydrophobicContact CH2-CE1 4.07Å; W363-F381 HydrophobicContact CZ2-CE1 4.23Å; W363-F381 HydrophobicContact CZ3-CD1 4.17Å; W363-F381 HydrophobicContact CZ3-CE1 4.48Å; W363-R382 HydrophobicContact CE3-CB 4.11Å; W363-R382 HydrophobicContact CE3-CG 4.36Å; W363-R382 HydrophobicContact CZ3-CB 4.07Å; W363-R382 HydrophobicContact CZ3-CG 4.19Å; W363-Y385 HydrophobicContact CH2-CD1 4.01Å; W363-Y385 HydrophobicContact CH2-CD2 4.39Å; W363-Y385 HydrophobicContact CH2-CE1 4.48Å; W363-Y385 AromaticContact CH2-CG 3.97Å; W363-Y385 HydrophobicContact CH2-CG 3.97Å
364	D	86.5	Confident	80.6	Confident	90 Å²	90	58.7 Å²	58.7	48%	0.481	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-41.2	174.9	-74.6	-17.2	0	0	0	111.8	H360 T361 S366 N367 K368	H360-D364 PolarHBondContact O-N 3.37Å; T361-D364 PolarHBondContact O-N 2.79Å; D364-S366 VanDerWaalsContact C-N 3.31Å; D364-N367 PolarHBondContact O-N 3.49Å; D364-K368 WeakPolarHBondContact O-CG 3.25Å; D364-K368 PolarHBondContact O-N 3.31Å
365	L	84.5	Confident	78.8	Confident	18 Å²	18	68.4 Å²	68.4	9%	0.094	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-39.5	172	-71.4	172.1	0	0	0	111.4	F355 T361 K368 A369 V479 L490	F355-L365 HydrophobicContact CD1-CD1 4.3Å; T361-L365 HydrophobicContact CG2-CD1 3.94Å; T361-L365 HydrophobicContact CG2-CG 4.37Å; T361-L365 WeakPolarHBondContact O-CB 3.45Å; T361-L365 VanDerWaalsContact O-CG 3.23Å; T361-L365 WeakPolarHBondContact O-CG 3.46Å; T361-L365 PolarHBondContact O-N 2.94Å; L365-K368 PolarHBondContact O-N 2.9Å; L365-A369 PolarHBondContact O-N 3.39Å; L365-V479 HydrophobicContact CD1-CG1 4.11Å; L365-V479 HydrophobicContact CD1-CG2 4.45Å; L365-L490 HydrophobicContact CD2-CD1 4.21Å
366	S	85.8	Confident	77.3	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.014	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-42.3	175.7	-60.2	0	0	0	0	112.4	E362 W363 D364 K368 A369 D370 F381 R382	E362-S366 WeakPolarHBondContact O-CB 3.24Å; E362-S366 PolarHBondContact O-N 2.59Å; E362-S366 VanDerWaalsContact O-N 3.12Å; E362-S366 PolarHBondContact O-OG 3.19Å; W363-S366 WeakPolarHBondContact O-CB 3.44Å; W363-S366 PolarHBondContact O-N 2.85Å; D364-S366 VanDerWaalsContact C-N 3.31Å; S366-K368 VanDerWaalsContact C-N 3.26Å; S366-K368 PolarHBondContact O-N 3.12Å; S366-A369 PolarHBondContact O-N 3.45Å; S366-D370 WeakPolarHBondContact O-CB 3.32Å; S366-D370 PolarHBondContact O-N 3.45Å; S366-F381 WeakPolarHBondContact OG-CB 3.48Å; S366-F381 PolarHBondContact OG-N 3.45Å; S366-R382 PolarHBondContact OG-N 3.41Å
367	N	84.1	Confident	76.6	Confident	77 Å²	77	75.6 Å²	75.6	41%	0.412	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-36.2	178.6	-62.8	-24.6	0	0	0	111.4	W363 D364 S371 R382	W363-N367 PolarHBondContact O-N 3.21Å; W363-N367 PolarHBondContact O-ND2 2.81Å; W363-N367 PolarHBondContact O-OD1 3.45Å; D364-N367 PolarHBondContact O-N 3.49Å; N367-S371 WeakPolarHBondContact O-CB 3.14Å; N367-S371 PolarHBondContact O-N 3.16Å; N367-R382 PolarHBondContact OD1-NH2 3.26Å
368	K	78.8	Confident	76.3	Confident	134 Å²	134	77.4 Å²	77.4	58%	0.583	40%	0.403	S	S	*	.	H	α-helix	trans	-67.5	-43.7	174	-68.8	171.8	-175.4	172.2	0	111.6	D364 L365 S366 D370 S371 H372	D364-K368 WeakPolarHBondContact O-CG 3.25Å; D364-K368 PolarHBondContact O-N 3.31Å; L365-K368 PolarHBondContact O-N 2.9Å; S366-K368 VanDerWaalsContact C-N 3.26Å; S366-K368 PolarHBondContact O-N 3.12Å; K368-D370 VanDerWaalsContact C-N 3.33Å; K368-D370 PolarHBondContact O-N 3.27Å; K368-S371 PolarHBondContact O-N 3.29Å; K368-S371 PolarHBondContact O-OG 3.41Å; K368-H372 PolarHBondContact O-CD2 3.23Å
369	A	77.2	Confident	76.2	Confident	12 Å²	12	75.9 Å²	75.9	10%	0.099	39%	0.394	C	S	.	.	H	α-helix	trans	-62.8	-38.8	177.3	0	0	0	0	0	112.4	L365 S366 S371 M378	L365-A369 PolarHBondContact O-N 3.39Å; S366-A369 PolarHBondContact O-N 3.45Å; A369-S371 VanDerWaalsContact C-N 3.32Å; A369-S371 PolarHBondContact O-N 3.09Å; A369-M378 HydrophobicContact CB-CG 4.2Å; A369-M378 HydrophobicContact CB-SD 3.67Å
370	D	71.2	Confident	76.2	Confident	63 Å²	63	73.8 Å²	73.8	34%	0.337	38%	0.383	S	S	.	.	H	α-helix	trans	-76.6	-15.6	179.3	-69.6	-28	0	0	0	113.5	S366 K368 S380 K383	S366-D370 WeakPolarHBondContact O-CB 3.32Å; S366-D370 PolarHBondContact O-N 3.45Å; K368-D370 VanDerWaalsContact C-N 3.33Å; K368-D370 PolarHBondContact O-N 3.27Å; D370-S380 PolarHBondContact OD1-OG 3.4Å; D370-S380 PolarHBondContact OD2-OG 2.75Å; D370-K383 WeakPolarHBondContact OD1-CE 3.39Å; D370-K383 IonicContact OD1-NZ 3.4Å; D370-K383 PolarHBondContact OD1-NZ 3.12Å
371	S	63.4	Low	76.2	Confident	87 Å²	87	67.7 Å²	67.7	61%	0.608	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-11.8	-179.8	71.8	0	0	0	0	114.7	N367 K368 A369	N367-S371 WeakPolarHBondContact O-CB 3.14Å; N367-S371 PolarHBondContact O-N 3.16Å; K368-S371 PolarHBondContact O-N 3.29Å; K368-S371 PolarHBondContact O-OG 3.41Å; A369-S371 VanDerWaalsContact C-N 3.32Å; A369-S371 PolarHBondContact O-N 3.09Å
372	H	59.6	Low	76.4	Confident	129 Å²	129	70 Å²	70	60%	0.597	36%	0.36	S	S	*	.	S	Bend	trans	-93.1	104.1	174.7	-78.3	-76.4	0	0	0	109.5	K368 D374 M378	K368-H372 PolarHBondContact O-CD2 3.23Å; H372-D374 PolarHBondContact O-N 2.76Å; H372-M378 HydrophobicContact CB-CE 4.29Å
373	D	50.2	Low	76.5	Confident	147 Å²	147	76 Å²	76	79%	0.786	39%	0.386	S	S	*	.			trans	-40.1	124.7	178.3	-100.8	-17.6	0	0	0	114.3	K375	D373-K375 PolarHBondContact O-N 2.89Å
374	D	53.1	Low	76.7	Confident	165 Å²	165	73.6 Å²	73.6	88%	0.882	38%	0.377	S	S	*	.	S	Bend	trans	35.1	7.6	148.9	-71.8	-13.4	0	0	0	122.4	H372	H372-D374 PolarHBondContact O-N 2.76Å
375	K	51.1	Low	77.2	Confident	206 Å²	206	72.6 Å²	72.6	90%	0.896	37%	0.367	S	S	*	.	S	Bend	trans	-127.2	0	-177.2	-77.6	-170.3	179.3	179	0	116.1	D373	D373-K375 PolarHBondContact O-N 2.89Å
376	A	56.3	Low	77.6	Confident	59 Å²	59	78.1 Å²	78.1	49%	0.488	39%	0.39	S	S	.	.			trans	-115	119.6	173.1	0	0	0	0	0	108.7	M378	A376-M378 HydrophobicContact CB-CB 4.18Å; A376-M378 HydrophobicContact CB-CE 4.09Å; A376-M378 PolarHBondContact O-N 3.25Å
377	D	74.5	Confident	78.1	Confident	93 Å²	93	79.7 Å²	79.7	50%	0.497	40%	0.398	S	S	.	.			trans	-61.7	53	163.7	-61.5	-38.2	0	0	0	109.7	T474 K475	D377-T474 CarbonylContact O-C 3.54Å; D377-T474 WeakPolarHBondContact O-CA 3.5Å; D377-T474 WeakPolarHBondContact O-CB 3.39Å; D377-K475 PolarHBondContact O-N 3.43Å
378	M	84.7	Confident	78.7	Confident	39 Å²	39	76 Å²	76	19%	0.192	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-89.2	133.3	-172.7	-160.3	-176.1	-32.3	0	0	109.4	A369 H372 A376 S380	A369-M378 HydrophobicContact CB-CG 4.2Å; A369-M378 HydrophobicContact CB-SD 3.67Å; H372-M378 HydrophobicContact CB-CE 4.29Å; A376-M378 HydrophobicContact CB-CB 4.18Å; A376-M378 HydrophobicContact CB-CE 4.09Å; A376-M378 PolarHBondContact O-N 3.25Å; M378-S380 PolarHBondContact O-N 3.08Å
379	F	89.4	Confident	79.5	Confident	7 Å²	7	72.4 Å²	72.4	3%	0.031	36%	0.364	C	S	.	.			trans	-68.2	122.8	179.6	-178.7	-102.4	0	0	0	111.4	L303 P304 F355 F381 W384 T474 K475 L476	L303-F379 HydrophobicContact CD2-CZ 4Å; P304-F379 HydrophobicContact CG-CB 3.84Å; P304-F379 HydrophobicContact CG-CD1 4.18Å; P304-F379 HydrophobicContact CG-CD2 3.22Å; P304-F379 HydrophobicContact CG-CE2 3.68Å; P304-F379 HydrophobicContact CG-CG 3.47Å; P304-F379 VanDerWaalsContact CG-CG 3.47Å; P304-F379 HydrophobicContact CG-CZ 4.32Å; F355-F379 AromaticContact CE1-CD1 3.74Å; F355-F379 HydrophobicContact CE1-CD1 3.74Å; F355-F379 AromaticContact CE1-CE1 3.87Å; F355-F379 HydrophobicContact CE1-CE1 3.87Å; F355-F379 HydrophobicContact CE2-CD1 4.47Å; F355-F379 HydrophobicContact CE2-CE1 4.22Å; F355-F379 AromaticContact CZ-CD1 3.44Å; F355-F379 HydrophobicContact CZ-CD1 3.44Å; F355-F379 VanDerWaalsContact CZ-CD1 3.44Å; F355-F379 AromaticContact CZ-CE1 3.53Å; F355-F379 HydrophobicContact CZ-CE1 3.53Å; F379-F381 HydrophobicContact CE1-CB 4.29Å; F379-F381 HydrophobicContact CE1-CD2 4.48Å; F379-W384 HydrophobicContact CE2-CB 3.53Å; F379-W384 AromaticContact CE2-CD1 3.94Å; F379-W384 HydrophobicContact CE2-CD2 4.42Å; F379-W384 AromaticContact CE2-CG 3.68Å; F379-W384 HydrophobicContact CE2-CG 3.68Å; F379-W384 HydrophobicContact CZ-CB 3.55Å; F379-W384 AromaticContact CZ-CD2 3.86Å; F379-W384 HydrophobicContact CZ-CD2 3.86Å; F379-W384 HydrophobicContact CZ-CE3 4.21Å; F379-W384 AromaticContact CZ-CG 3.56Å; F379-W384 HydrophobicContact CZ-CG 3.56Å; F379-T474 WeakPolarHBondContact CD2-OG1 3.01Å; F379-K475 PolarHBondContact N-O 2.93Å; F379-L476 HydrophobicContact CB-CD2 4.34Å
380	S	90.9	Very high	80.4	Confident	6 Å²	6	74.4 Å²	74.4	4%	0.042	38%	0.38	C	S	.	.			trans	-108.8	113.1	172.5	172.1	0	0	0	0	109.3	D370 M378 R382 K383 W384	D370-S380 PolarHBondContact OD1-OG 3.4Å; D370-S380 PolarHBondContact OD2-OG 2.75Å; M378-S380 PolarHBondContact O-N 3.08Å; S380-R382 PolarHBondContact O-N 3.47Å; S380-K383 PolarHBondContact O-N 3.48Å; S380-K383 VanDerWaalsContact O-N 3.11Å; S380-K383 PolarHBondContact OG-N 2.82Å; S380-W384 PolarHBondContact O-N 2.62Å
381	F	91.5	Very high	81.5	Confident	1 Å²	1	71.4 Å²	71.4	0%	0.004	36%	0.364	C	S	.	.	H	α-helix	trans	-57.2	-36.1	178.2	-174.1	-83.9	0	0	0	111.1	I351 F355 L357 E362 W363 S366 F379 W384 Y385	I351-F381 HydrophobicContact CG2-CE2 4.26Å; F355-F381 HydrophobicContact CD1-CB 4.39Å; F355-F381 HydrophobicContact CD1-CD2 4.34Å; F355-F381 HydrophobicContact CG-CD2 4.31Å; L357-F381 HydrophobicContact CD2-CE2 3.59Å; L357-F381 HydrophobicContact CD2-CZ 3.57Å; E362-F381 HydrophobicContact CB-CB 4.44Å; E362-F381 HydrophobicContact CB-CD1 3.87Å; E362-F381 HydrophobicContact CB-CD2 4.28Å; E362-F381 HydrophobicContact CB-CE1 4.15Å; E362-F381 HydrophobicContact CB-CG 3.95Å; E362-F381 HydrophobicContact CB-CZ 4.46Å; E362-F381 HydrophobicContact CG-CD1 3.82Å; E362-F381 HydrophobicContact CG-CE1 3.76Å; E362-F381 HydrophobicContact CG-CG 4.42Å; E362-F381 HydrophobicContact CG-CZ 4.27Å; W363-F381 HydrophobicContact CE3-CD1 4.49Å; W363-F381 HydrophobicContact CH2-CD1 4.23Å; W363-F381 HydrophobicContact CH2-CE1 4.07Å; W363-F381 HydrophobicContact CZ2-CE1 4.23Å; W363-F381 HydrophobicContact CZ3-CD1 4.17Å; W363-F381 HydrophobicContact CZ3-CE1 4.48Å; S366-F381 WeakPolarHBondContact OG-CB 3.48Å; S366-F381 PolarHBondContact OG-N 3.45Å; F379-F381 HydrophobicContact CE1-CB 4.29Å; F379-F381 HydrophobicContact CE1-CD2 4.48Å; F381-W384 AromaticContact CD2-CE3 3.89Å; F381-W384 HydrophobicContact CD2-CE3 3.89Å; F381-W384 AromaticContact CD2-CZ3 3.83Å; F381-W384 HydrophobicContact CD2-CZ3 3.83Å; F381-W384 HydrophobicContact CE1-CZ3 4.38Å; F381-W384 AromaticContact CE2-CE3 3.9Å; F381-W384 HydrophobicContact CE2-CE3 3.9Å; F381-W384 HydrophobicContact CE2-CH2 4.36Å; F381-W384 AromaticContact CE2-CZ3 3.36Å; F381-W384 HydrophobicContact CE2-CZ3 3.36Å; F381-W384 HydrophobicContact CG-CE3 4.27Å; F381-W384 HydrophobicContact CZ-CE3 4.27Å; F381-W384 AromaticContact CZ-CZ3 3.68Å; F381-W384 HydrophobicContact CZ-CZ3 3.68Å; F381-Y385 VanDerWaalsContact O-CB 3.22Å; F381-Y385 WeakPolarHBondContact O-CB 3.39Å; F381-Y385 PolarHBondContact O-N 3.31Å
382	R	92.3	Very high	83.1	Confident	84 Å²	84	67.5 Å²	67.5	32%	0.317	34%	0.336	S	S	.	.	H	α-helix	trans	-62.7	-45.2	175.9	-176.3	-172.6	-69.4	-83.9	6.5	113.1	W363 S366 N367 S380 K386	W363-R382 HydrophobicContact CE3-CB 4.11Å; W363-R382 HydrophobicContact CE3-CG 4.36Å; W363-R382 HydrophobicContact CZ3-CB 4.07Å; W363-R382 HydrophobicContact CZ3-CG 4.19Å; S366-R382 PolarHBondContact OG-N 3.41Å; N367-R382 PolarHBondContact OD1-NH2 3.26Å; S380-R382 PolarHBondContact O-N 3.47Å; R382-K386 WeakPolarHBondContact O-CG 3.22Å; R382-K386 PolarHBondContact O-N 3.33Å
383	K	91.8	Very high	84.8	Confident	127 Å²	127	63.7 Å²	63.7	55%	0.552	32%	0.322	S	S	*	.	H	α-helix	trans	-66.1	-47.1	178.3	-71.9	176.5	176.7	148.8	0	110.3	D370 S380 K386 L387	D370-K383 WeakPolarHBondContact OD1-CE 3.39Å; D370-K383 IonicContact OD1-NZ 3.4Å; D370-K383 PolarHBondContact OD1-NZ 3.12Å; S380-K383 PolarHBondContact O-N 3.48Å; S380-K383 VanDerWaalsContact O-N 3.11Å; S380-K383 PolarHBondContact OG-N 2.82Å; K383-K386 PolarHBondContact O-N 3.02Å; K383-L387 WeakPolarHBondContact O-CB 3.27Å; K383-L387 PolarHBondContact O-N 2.97Å; K383-L387 VanDerWaalsContact O-N 3.12Å
384	W	94.7	Very high	86.8	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.3	-49.7	176.6	169.8	77.8	0	0	0	112.5	A301 N302 L303 F379 S380 F381 K386 L387 V388 L471 W524 L525 L528	A301-W384 PolarHBondContact O-NE1 3.44Å; N302-W384 PolarHBondContact O-NE1 3.34Å; L303-W384 HydrophobicContact CD1-CZ2 4.22Å; L303-W384 HydrophobicContact CD2-CD2 4.13Å; L303-W384 VanDerWaalsContact CD2-CE2 3.48Å; L303-W384 HydrophobicContact CD2-CH2 4.04Å; L303-W384 HydrophobicContact CD2-CZ2 3.46Å; L303-W384 VanDerWaalsContact CD2-CZ2 3.46Å; L303-W384 HydrophobicContact CG-CZ2 3.81Å; F379-W384 HydrophobicContact CE2-CB 3.53Å; F379-W384 AromaticContact CE2-CD1 3.94Å; F379-W384 HydrophobicContact CE2-CD2 4.42Å; F379-W384 AromaticContact CE2-CG 3.68Å; F379-W384 HydrophobicContact CE2-CG 3.68Å; F379-W384 HydrophobicContact CZ-CB 3.55Å; F379-W384 AromaticContact CZ-CD2 3.86Å; F379-W384 HydrophobicContact CZ-CD2 3.86Å; F379-W384 HydrophobicContact CZ-CE3 4.21Å; F379-W384 AromaticContact CZ-CG 3.56Å; F379-W384 HydrophobicContact CZ-CG 3.56Å; S380-W384 PolarHBondContact O-N 2.62Å; F381-W384 AromaticContact CD2-CE3 3.89Å; F381-W384 HydrophobicContact CD2-CE3 3.89Å; F381-W384 AromaticContact CD2-CZ3 3.83Å; F381-W384 HydrophobicContact CD2-CZ3 3.83Å; F381-W384 HydrophobicContact CE1-CZ3 4.38Å; F381-W384 AromaticContact CE2-CE3 3.9Å; F381-W384 HydrophobicContact CE2-CE3 3.9Å; F381-W384 HydrophobicContact CE2-CH2 4.36Å; F381-W384 AromaticContact CE2-CZ3 3.36Å; F381-W384 HydrophobicContact CE2-CZ3 3.36Å; F381-W384 HydrophobicContact CG-CE3 4.27Å; F381-W384 HydrophobicContact CZ-CE3 4.27Å; F381-W384 AromaticContact CZ-CZ3 3.68Å; F381-W384 HydrophobicContact CZ-CZ3 3.68Å; W384-K386 PolarHBondContact O-N 2.97Å; W384-L387 PolarHBondContact O-N 3.28Å; W384-V388 HydrophobicContact CG-CG2 4.36Å; W384-V388 WeakPolarHBondContact O-CG2 3.46Å; W384-V388 PolarHBondContact O-N 3.24Å; W384-L471 HydrophobicContact CB-CD1 3.89Å; W384-L471 HydrophobicContact CG-CD1 4.36Å; W384-W524 HydrophobicContact CE3-CH2 4.4Å; W384-W524 HydrophobicContact CE3-CZ3 4.29Å; W384-W524 AromaticContact CH2-CH2 3.81Å; W384-W524 HydrophobicContact CH2-CH2 3.81Å; W384-W524 AromaticContact CH2-CZ3 3.4Å; W384-W524 HydrophobicContact CH2-CZ3 3.4Å; W384-W524 HydrophobicContact CZ2-CH2 4.14Å; W384-W524 HydrophobicContact CZ2-CZ3 4.16Å; W384-W524 AromaticContact CZ3-CH2 3.91Å; W384-W524 HydrophobicContact CZ3-CH2 3.91Å; W384-W524 AromaticContact CZ3-CZ3 3.44Å; W384-W524 HydrophobicContact CZ3-CZ3 3.44Å; W384-W524 VanDerWaalsContact CZ3-CZ3 3.44Å; W384-L525 HydrophobicContact CH2-CD1 3.79Å; W384-L525 HydrophobicContact CZ2-CD1 4.46Å; W384-L528 HydrophobicContact CZ2-CD2 4.24Å
385	Y	95.3	Very high	88.7	Confident	68 Å²	68	54.3 Å²	54.3	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-55.2	-48.6	178.2	171.1	-93.4	0	0	0	111.9	W363 F381 L387 Q389 W524	W363-Y385 HydrophobicContact CH2-CD1 4.01Å; W363-Y385 HydrophobicContact CH2-CD2 4.39Å; W363-Y385 HydrophobicContact CH2-CE1 4.48Å; W363-Y385 AromaticContact CH2-CG 3.97Å; W363-Y385 HydrophobicContact CH2-CG 3.97Å; F381-Y385 VanDerWaalsContact O-CB 3.22Å; F381-Y385 WeakPolarHBondContact O-CB 3.39Å; F381-Y385 PolarHBondContact O-N 3.31Å; Y385-L387 VanDerWaalsContact C-N 3.35Å; Y385-L387 PolarHBondContact O-N 3.48Å; Y385-Q389 WeakPolarHBondContact O-CB 3.37Å; Y385-Q389 PolarHBondContact O-N 3.28Å; Y385-W524 AromaticContact CD2-CD2 3.6Å; Y385-W524 HydrophobicContact CD2-CD2 3.6Å; Y385-W524 AromaticContact CD2-CE2 3.63Å; Y385-W524 AromaticContact CD2-CE3 3.71Å; Y385-W524 HydrophobicContact CD2-CE3 3.71Å; Y385-W524 HydrophobicContact CD2-CG 4.24Å; Y385-W524 AromaticContact CD2-CH2 3.91Å; Y385-W524 HydrophobicContact CD2-CH2 3.91Å; Y385-W524 AromaticContact CD2-CZ2 3.79Å; Y385-W524 HydrophobicContact CD2-CZ2 3.79Å; Y385-W524 AromaticContact CD2-CZ3 3.87Å; Y385-W524 HydrophobicContact CD2-CZ3 3.87Å; Y385-W524 HydrophobicContact CE2-CB 4.33Å; Y385-W524 AromaticContact CE2-CD1 3.69Å; Y385-W524 AromaticContact CE2-CD2 3.4Å; Y385-W524 HydrophobicContact CE2-CD2 3.4Å; Y385-W524 VanDerWaalsContact CE2-CD2 3.4Å; Y385-W524 AromaticContact CE2-CE2 3.48Å; Y385-W524 VanDerWaalsContact CE2-CE2 3.48Å; Y385-W524 AromaticContact CE2-CE3 3.96Å; Y385-W524 HydrophobicContact CE2-CE3 3.96Å; Y385-W524 AromaticContact CE2-CG 3.55Å; Y385-W524 HydrophobicContact CE2-CG 3.55Å; Y385-W524 HydrophobicContact CE2-CZ2 4.1Å; Y385-W524 AromaticContact CE2-NE1 3.63Å
386	K	94.7	Very high	90.7	Very high	135 Å²	135	48 Å²	48	59%	0.587	24%	0.243	S	C	*	.	H	α-helix	trans	-61.9	-43.7	-179.4	-75	179.8	177	-176.4	0	112	R382 K383 W384 A390	R382-K386 WeakPolarHBondContact O-CG 3.22Å; R382-K386 PolarHBondContact O-N 3.33Å; K383-K386 PolarHBondContact O-N 3.02Å; W384-K386 PolarHBondContact O-N 2.97Å; K386-A390 PolarHBondContact O-N 3.14Å
387	L	95.1	Very high	92.3	Very high	35 Å²	35	50.3 Å²	50.3	18%	0.183	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-51.6	-178.6	179.6	148.5	0	0	0	111.2	N302 K383 W384 Y385 Q389 A390 A391 W460 P469	N302-L387 WeakPolarHBondContact ND2-CD2 3.38Å; K383-L387 WeakPolarHBondContact O-CB 3.27Å; K383-L387 PolarHBondContact O-N 2.97Å; K383-L387 VanDerWaalsContact O-N 3.12Å; W384-L387 PolarHBondContact O-N 3.28Å; Y385-L387 VanDerWaalsContact C-N 3.35Å; Y385-L387 PolarHBondContact O-N 3.48Å; L387-Q389 VanDerWaalsContact C-N 3.34Å; L387-Q389 PolarHBondContact O-N 2.96Å; L387-A390 PolarHBondContact O-N 3.26Å; L387-A391 PolarHBondContact O-N 3.06Å; L387-W460 HydrophobicContact CD2-CE3 3.88Å; L387-W460 HydrophobicContact CD2-CH2 3.83Å; L387-W460 HydrophobicContact CD2-CZ3 3.3Å; L387-W460 HydrophobicContact CG-CZ3 4.38Å; L387-P469 HydrophobicContact CD1-CG 3.6Å
388	V	96.3	Very high	93	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68.4	-34.1	-179.7	176.2	0	0	0	0	111.6	N302 W384 A390 A391 L392 W460 W524 L528	N302-V388 HydrophobicContact CB-CG2 4.01Å; W384-V388 HydrophobicContact CG-CG2 4.36Å; W384-V388 WeakPolarHBondContact O-CG2 3.46Å; W384-V388 PolarHBondContact O-N 3.24Å; V388-A390 PolarHBondContact O-N 3.42Å; V388-A391 PolarHBondContact O-N 3.46Å; V388-L392 WeakPolarHBondContact O-CB 3.35Å; V388-L392 PolarHBondContact O-N 2.92Å; V388-W460 HydrophobicContact CG2-CH2 4.06Å; V388-W460 HydrophobicContact CG2-CZ2 4.23Å; V388-W524 HydrophobicContact CB-CH2 4.18Å; V388-W524 HydrophobicContact CB-CZ2 4.27Å; V388-W524 HydrophobicContact CG1-CH2 4.03Å; V388-W524 HydrophobicContact CG1-CZ2 4.06Å; V388-L528 HydrophobicContact CG1-CD1 3.76Å; V388-L528 HydrophobicContact CG1-CD2 3.74Å; V388-L528 HydrophobicContact CG1-CG 4.41Å
389	Q	96.6	Very high	93.1	Very high	58 Å²	58	52.4 Å²	52.4	27%	0.271	24%	0.243	S	C	.	.	H	α-helix	trans	-63.5	-40.8	175.5	176.1	58.2	12.1	0	0	112.2	Y385 L387 L392 V393 W524	Y385-Q389 WeakPolarHBondContact O-CB 3.37Å; Y385-Q389 PolarHBondContact O-N 3.28Å; L387-Q389 VanDerWaalsContact C-N 3.34Å; L387-Q389 PolarHBondContact O-N 2.96Å; Q389-L392 PolarHBondContact O-N 3.18Å; Q389-V393 WeakPolarHBondContact O-CG2 3.45Å; Q389-V393 PolarHBondContact O-N 2.69Å; Q389-V393 VanDerWaalsContact O-N 3.09Å; Q389-W524 HydrophobicContact CB-CZ2 4.31Å
390	A	95.4	Very high	92.9	Very high	53 Å²	53	57.2 Å²	57.2	44%	0.438	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-50.3	176	0	0	0	0	0	110.8	K386 L387 V388 L392 V393 E394	K386-A390 PolarHBondContact O-N 3.14Å; L387-A390 PolarHBondContact O-N 3.26Å; V388-A390 PolarHBondContact O-N 3.42Å; A390-L392 VanDerWaalsContact C-N 3.33Å; A390-L392 PolarHBondContact O-N 3.44Å; A390-V393 PolarHBondContact O-N 3.14Å; A390-E394 PolarHBondContact O-N 3.32Å; A390-E394 VanDerWaalsContact O-N 3.11Å
391	A	95.5	Very high	92.6	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.008	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-41.4	176.8	0	0	0	0	0	112.8	L387 V388 E394 A395 F458 W460 D467	L387-A391 PolarHBondContact O-N 3.06Å; V388-A391 PolarHBondContact O-N 3.46Å; A391-E394 PolarHBondContact O-N 3.48Å; A391-A395 VanDerWaalsContact O-CB 3.29Å; A391-A395 WeakPolarHBondContact O-CB 3.47Å; A391-A395 PolarHBondContact O-N 2.91Å; A391-F458 HydrophobicContact CB-CD1 4.04Å; A391-F458 HydrophobicContact CB-CE1 4.07Å; A391-W460 HydrophobicContact CB-CH2 3.46Å; A391-W460 VanDerWaalsContact CB-CH2 3.46Å; A391-W460 HydrophobicContact CB-CZ2 4.45Å; A391-W460 HydrophobicContact CB-CZ3 3.94Å; A391-D467 HydrophobicContact CB-CB 3.89Å
392	L	96.1	Very high	92.1	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-44.5	178.8	177.9	61.8	0	0	0	111.6	V388 Q389 A390 A395 Q396 F458 L528 F531	V388-L392 WeakPolarHBondContact O-CB 3.35Å; V388-L392 PolarHBondContact O-N 2.92Å; Q389-L392 PolarHBondContact O-N 3.18Å; A390-L392 VanDerWaalsContact C-N 3.33Å; A390-L392 PolarHBondContact O-N 3.44Å; L392-A395 PolarHBondContact O-N 3.45Å; L392-Q396 HydrophobicContact CD1-CG 4.38Å; L392-Q396 WeakPolarHBondContact O-CB 3.27Å; L392-Q396 VanDerWaalsContact O-CG 3.27Å; L392-Q396 WeakPolarHBondContact O-CG 3.38Å; L392-Q396 PolarHBondContact O-N 3.5Å; L392-F458 HydrophobicContact CB-CZ 4.48Å; L392-F458 HydrophobicContact CD1-CZ 4.16Å; L392-L528 HydrophobicContact CD1-CD1 4.19Å; L392-L528 HydrophobicContact CD2-CD1 4.28Å; L392-F531 HydrophobicContact CD1-CB 3.88Å; L392-F531 HydrophobicContact CD1-CD1 3.41Å; L392-F531 VanDerWaalsContact CD1-CD1 3.41Å; L392-F531 HydrophobicContact CD1-CD2 4.2Å; L392-F531 HydrophobicContact CD1-CE1 3.96Å; L392-F531 HydrophobicContact CD1-CG 3.55Å
393	V	95.4	Very high	91.5	Very high	50 Å²	50	63.1 Å²	63.1	30%	0.303	31%	0.306	S	S	.	.	H	α-helix	trans	-63.1	-43.6	177.3	170.7	0	0	0	0	110.7	Q389 A390 Q396 Q397	Q389-V393 WeakPolarHBondContact O-CG2 3.45Å; Q389-V393 PolarHBondContact O-N 2.69Å; Q389-V393 VanDerWaalsContact O-N 3.09Å; A390-V393 PolarHBondContact O-N 3.14Å; V393-Q396 PolarHBondContact O-N 2.9Å; V393-Q397 VanDerWaalsContact O-CG 3.32Å; V393-Q397 WeakPolarHBondContact O-CG 3.46Å; V393-Q397 PolarHBondContact O-N 3.27Å
394	E	92.9	Very high	90.8	Very high	107 Å²	107	61.2 Å²	61.2	50%	0.5	31%	0.313	S	S	.	.	H	α-helix	trans	-64.8	-41.2	176.7	-70.2	-176.9	-178.1	0	0	112.2	A390 A391 Q397 R398	A390-E394 PolarHBondContact O-N 3.32Å; A390-E394 VanDerWaalsContact O-N 3.11Å; A391-E394 PolarHBondContact O-N 3.48Å; E394-Q397 PolarHBondContact O-N 2.96Å; E394-R398 WeakPolarHBondContact O-CG 3.48Å; E394-R398 PolarHBondContact O-N 3.44Å
395	A	92	Very high	89.7	Confident	8 Å²	8	67 Å²	67	7%	0.066	34%	0.335	C	S	.	.	H	α-helix	trans	-65.3	-39.1	176.4	0	0	0	0	0	112.3	A391 L392 R398 R399 F458 F531	A391-A395 VanDerWaalsContact O-CB 3.29Å; A391-A395 WeakPolarHBondContact O-CB 3.47Å; A391-A395 PolarHBondContact O-N 2.91Å; L392-A395 PolarHBondContact O-N 3.45Å; A395-R398 PolarHBondContact O-N 3.06Å; A395-R399 WeakPolarHBondContact O-CB 3.06Å; A395-R399 PolarHBondContact O-N 3.43Å; A395-F458 HydrophobicContact CB-CE1 3.73Å; A395-F458 HydrophobicContact CB-CZ 4.37Å; A395-F531 HydrophobicContact CB-CE1 3.8Å; A395-F531 HydrophobicContact CB-CZ 3.67Å
396	Q	93.1	Very high	88.5	Confident	73 Å²	73	66.5 Å²	66.5	34%	0.341	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-47.4	173.1	-75.5	170.9	-0.8	0	0	111.2	L392 V393 R398 R399 D400 F531	L392-Q396 HydrophobicContact CD1-CG 4.38Å; L392-Q396 WeakPolarHBondContact O-CB 3.27Å; L392-Q396 VanDerWaalsContact O-CG 3.27Å; L392-Q396 WeakPolarHBondContact O-CG 3.38Å; L392-Q396 PolarHBondContact O-N 3.5Å; V393-Q396 PolarHBondContact O-N 2.9Å; Q396-R398 PolarHBondContact O-N 3.17Å; Q396-R399 PolarHBondContact O-N 2.68Å; Q396-D400 PolarHBondContact O-N 3.08Å; Q396-F531 HydrophobicContact CB-CE2 4.27Å; Q396-F531 HydrophobicContact CG-CD2 3.68Å; Q396-F531 HydrophobicContact CG-CE2 3.44Å; Q396-F531 VanDerWaalsContact CG-CE2 3.44Å; Q396-F531 HydrophobicContact CG-CZ 4.18Å
397	Q	90.8	Very high	87.1	Confident	107 Å²	107	65.8 Å²	65.8	50%	0.5	33%	0.333	S	S	.	.	H	α-helix	trans	-61.2	-42.5	177.2	-71.2	175.3	12	0	0	112.2	V393 E394 D400 Q401	V393-Q397 VanDerWaalsContact O-CG 3.32Å; V393-Q397 WeakPolarHBondContact O-CG 3.46Å; V393-Q397 PolarHBondContact O-N 3.27Å; E394-Q397 PolarHBondContact O-N 2.96Å; Q397-D400 PolarHBondContact O-N 3.49Å; Q397-Q401 WeakPolarHBondContact O-CB 3.44Å; Q397-Q401 VanDerWaalsContact O-CG 3.26Å; Q397-Q401 WeakPolarHBondContact O-CG 3.3Å; Q397-Q401 PolarHBondContact O-N 3.43Å
398	R	88.4	Confident	85.5	Confident	112 Å²	112	69.1 Å²	69.1	42%	0.423	34%	0.343	S	S	.	.	H	α-helix	trans	-58.9	-48.9	173.9	-77.7	-175	-74.3	171.7	-9	111.3	E394 A395 Q396 D400 Q401 D402 D467	E394-R398 WeakPolarHBondContact O-CG 3.48Å; E394-R398 PolarHBondContact O-N 3.44Å; A395-R398 PolarHBondContact O-N 3.06Å; Q396-R398 PolarHBondContact O-N 3.17Å; R398-D400 VanDerWaalsContact C-N 3.32Å; R398-D400 PolarHBondContact O-N 3.21Å; R398-Q401 PolarHBondContact O-N 3.37Å; R398-D402 PolarHBondContact O-N 2.69Å; R398-D467 IonicContact CZ-OD1 2.89Å; R398-D467 IonicContact NH1-OD1 2.82Å; R398-D467 IonicContact NH2-OD1 3.03Å; R398-D467 PolarHBondContact NH2-OD1 2.98Å
399	R	86.1	Confident	83.9	Confident	64 Å²	64	76.7 Å²	76.7	24%	0.242	38%	0.376	C	S	.	.	H	α-helix	trans	-59.6	-41.5	179.1	-173.7	179.2	-69.7	179	2.1	112.1	A395 Q396 D402 T403 F531 D534	A395-R399 WeakPolarHBondContact O-CB 3.06Å; A395-R399 PolarHBondContact O-N 3.43Å; Q396-R399 PolarHBondContact O-N 2.68Å; R399-D402 PolarHBondContact O-N 3.45Å; R399-T403 VanDerWaalsContact O-CB 3.25Å; R399-T403 WeakPolarHBondContact O-CB 3.24Å; R399-T403 PolarHBondContact O-N 2.75Å; R399-T403 PolarHBondContact O-OG1 3.23Å; R399-F531 VanDerWaalsContact CZ-CZ 3.4Å; R399-F531 VanDerWaalsContact NH1-CD2 3.26Å; R399-F531 VanDerWaalsContact NH1-CE2 3.27Å; R399-F531 PolarHBondContact NH1-O 3.03Å; R399-F531 VanDerWaalsContact NH2-CZ 3.32Å; R399-F531 PolarHBondContact NH2-O 3.28Å; R399-F531 VanDerWaalsContact NH2-O 3.13Å; R399-D534 IonicContact NH1-OD1 3.46Å
400	D	86.4	Confident	82.2	Confident	109 Å²	109	74.4 Å²	74.4	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-67	-42.9	177.9	-71.9	-16.3	0	0	0	111.6	Q396 Q397 R398 T403 A404	Q396-D400 PolarHBondContact O-N 3.08Å; Q397-D400 PolarHBondContact O-N 3.49Å; R398-D400 VanDerWaalsContact C-N 3.32Å; R398-D400 PolarHBondContact O-N 3.21Å; D400-T403 PolarHBondContact O-N 3.11Å; D400-A404 VanDerWaalsContact O-CB 3.31Å; D400-A404 WeakPolarHBondContact O-CB 3.43Å; D400-A404 PolarHBondContact O-N 3Å
401	Q	83.8	Confident	80.6	Confident	93 Å²	93	78.7 Å²	78.7	44%	0.435	38%	0.377	S	S	.	.	H	α-helix	trans	-61.9	-44.3	174.9	-71.9	177.7	25	0	0	111.8	Q397 R398 A404 R405	Q397-Q401 WeakPolarHBondContact O-CB 3.44Å; Q397-Q401 VanDerWaalsContact O-CG 3.26Å; Q397-Q401 WeakPolarHBondContact O-CG 3.3Å; Q397-Q401 PolarHBondContact O-N 3.43Å; R398-Q401 PolarHBondContact O-N 3.37Å; Q401-A404 PolarHBondContact O-N 3.36Å; Q401-R405 WeakPolarHBondContact O-CB 3.42Å; Q401-R405 WeakPolarHBondContact O-CG 3.46Å; Q401-R405 PolarHBondContact O-N 3.21Å
402	D	81.3	Confident	79	Confident	64 Å²	64	83.4 Å²	83.4	34%	0.342	40%	0.397	S	S	.	.	H	α-helix	trans	-66.8	-40.6	178.4	-71.4	-19.9	0	0	0	111.7	R398 R399 A404 R405 K406	R398-D402 PolarHBondContact O-N 2.69Å; R399-D402 PolarHBondContact O-N 3.45Å; D402-A404 VanDerWaalsContact C-N 3.34Å; D402-A404 PolarHBondContact O-N 3.23Å; D402-R405 PolarHBondContact O-N 3.41Å; D402-K406 VanDerWaalsContact O-CG 3.27Å; D402-K406 WeakPolarHBondContact O-CG 3.03Å; D402-K406 PolarHBondContact O-N 2.88Å
403	T	80.4	Confident	77.1	Confident	58 Å²	58	86 Å²	86	36%	0.356	41%	0.411	S	S	.	.	H	α-helix	trans	-61.9	-42.1	174.8	-60.4	0	0	0	0	111.1	R399 D400 R405 W408	R399-T403 VanDerWaalsContact O-CB 3.25Å; R399-T403 WeakPolarHBondContact O-CB 3.24Å; R399-T403 PolarHBondContact O-N 2.75Å; R399-T403 PolarHBondContact O-OG1 3.23Å; D400-T403 PolarHBondContact O-N 3.11Å; T403-R405 VanDerWaalsContact C-N 3.35Å; T403-W408 HydrophobicContact CG2-CZ2 3.83Å; T403-W408 PolarHBondContact O-NE1 3.43Å
404	A	76.8	Confident	75.4	Confident	86 Å²	86	85 Å²	85	71%	0.711	40%	0.402	S	S	*	.	H	α-helix	trans	-68.2	-32.3	176.4	0	0	0	0	0	113	D400 Q401 D402	D400-A404 VanDerWaalsContact O-CB 3.31Å; D400-A404 WeakPolarHBondContact O-CB 3.43Å; D400-A404 PolarHBondContact O-N 3Å; Q401-A404 PolarHBondContact O-N 3.36Å; D402-A404 VanDerWaalsContact C-N 3.34Å; D402-A404 PolarHBondContact O-N 3.23Å
405	R	72.1	Confident	73.9	Confident	123 Å²	123	82.9 Å²	82.9	46%	0.464	39%	0.392	S	S	.	.	H	α-helix	trans	-80.6	-24	179.1	-72.7	170	-174.9	170.6	5.5	113.5	Q401 D402 T403 Q407 V448	Q401-R405 WeakPolarHBondContact O-CB 3.42Å; Q401-R405 WeakPolarHBondContact O-CG 3.46Å; Q401-R405 PolarHBondContact O-N 3.21Å; D402-R405 PolarHBondContact O-N 3.41Å; T403-R405 VanDerWaalsContact C-N 3.35Å; R405-Q407 PolarHBondContact O-N 3.44Å; R405-V448 VanDerWaalsContact NH1-CG2 3.25Å
406	K	68.8	Low	72.2	Confident	56 Å²	56	85.8 Å²	85.8	24%	0.243	41%	0.408	C	S	.	.	S	Bend	trans	-59.5	132.4	-178.3	-85.2	166.2	-165.7	167.9	0	111.5	K225 D402 W408	K225-K406 WeakPolarHBondContact O-CE 3.41Å; K225-K406 PolarHBondContact O-NZ 2.87Å; D402-K406 VanDerWaalsContact O-CG 3.27Å; D402-K406 WeakPolarHBondContact O-CG 3.03Å; D402-K406 PolarHBondContact O-N 2.88Å; K406-W408 HydrophobicContact CB-CZ2 4.12Å; K406-W408 HydrophobicContact CD-CZ2 4.07Å; K406-W408 PolarHBondContact O-N 3.49Å; K406-W408 VanDerWaalsContact O-N 3.11Å; K406-W408 PolarHBondContact O-NE1 3.18Å
407	Q	65.6	Low	70.6	Confident	120 Å²	120	85.9 Å²	85.9	56%	0.561	41%	0.411	S	S	*	.			trans	-79.6	92.8	170.9	-176.7	170.7	-4.4	0	0	109	R405 K409	R405-Q407 PolarHBondContact O-N 3.44Å; Q407-K409 WeakPolarHBondContact CG-O 3.35Å; Q407-K409 PolarHBondContact NE2-O 2.87Å; Q407-K409 VanDerWaalsContact NE2-O 3.08Å; Q407-K409 PolarHBondContact O-N 3.16Å
408	W	62.7	Low	69	Low	106 Å²	106	86.4 Å²	86.4	40%	0.402	41%	0.412	S	S	.	.			trans	-71.8	-9.9	-179.2	-64.4	94.3	0	0	0	114.4	V232 I257 T403 K406	V232-W408 HydrophobicContact CG2-CZ3 4.45Å; I257-W408 HydrophobicContact CD1-CH2 4.22Å; I257-W408 HydrophobicContact CD1-CZ3 4.03Å; I257-W408 HydrophobicContact CG1-CZ3 4.38Å; T403-W408 HydrophobicContact CG2-CZ2 3.83Å; T403-W408 PolarHBondContact O-NE1 3.43Å; K406-W408 HydrophobicContact CB-CZ2 4.12Å; K406-W408 HydrophobicContact CD-CZ2 4.07Å; K406-W408 PolarHBondContact O-N 3.49Å; K406-W408 VanDerWaalsContact O-N 3.11Å; K406-W408 PolarHBondContact O-NE1 3.18Å
409	K	62.8	Low	67.7	Low	158 Å²	158	90.4 Å²	90.4	69%	0.687	43%	0.427	S	S	*	.	S	Bend	trans	-117.5	121.2	-178.6	-67.2	-175.3	-179.6	177.4	0	111	Q407	Q407-K409 WeakPolarHBondContact CG-O 3.35Å; Q407-K409 PolarHBondContact NE2-O 2.87Å; Q407-K409 VanDerWaalsContact NE2-O 3.08Å; Q407-K409 PolarHBondContact O-N 3.16Å
410	G	59.3	Low	66.6	Low	10 Å²	10	90.6 Å²	90.6	10%	0.103	43%	0.432	C	S	.	.			trans	-59.2	154.8	175.1	0	0	0	0	0	113.6	Y235 E236 K412	Y235-G410 WeakPolarHBondContact OH-CA 3.4Å; E236-G410 WeakPolarHBondContact OE1-CA 3.33Å; G410-K412 VanDerWaalsContact C-N 3.31Å
411	K	61.7	Low	65.7	Low	144 Å²	144	92.1 Å²	92.1	63%	0.626	43%	0.43	S	S	*	.	S	Bend	trans	-67.2	-25.4	169.5	-63.9	176	-177.2	172.3	0	112.7	E236 R428	E236-K411 WeakPolarHBondContact OE1-CA 3.3Å; E236-K411 PolarHBondContact OE1-N 3.31Å; K411-R428 PolarHBondContact O-NH1 3.45Å; K411-R428 PolarHBondContact O-NH2 3.32Å
412	K	61.9	Low	64.8	Low	99 Å²	99	94 Å²	94	43%	0.43	44%	0.443	S	S	.	.	S	Bend	trans	-92.6	128.2	174.9	-70.8	-178.9	-176.9	169.7	0	109.9	Y235 E236 G410	Y235-K412 HydrophobicContact CE2-CB 4.05Å; Y235-K412 WeakPolarHBondContact CE2-O 3.33Å; Y235-K412 PolarHBondContact OH-O 2.97Å; Y235-K412 VanDerWaalsContact OH-O 3.11Å; E236-K412 HydrophobicContact CG-CB 4.45Å; E236-K412 PolarHBondContact O-NZ 2.89Å; E236-K412 PolarHBondContact OE1-N 3.17Å; G410-K412 VanDerWaalsContact C-N 3.31Å
413	L	57.6	Low	64.3	Low	58 Å²	58	95.1 Å²	95.1	30%	0.304	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-95.5	137	-176	-71	175.6	0	0	0	111.8	V424	L413-V424 HydrophobicContact CB-CG1 4.27Å; L413-V424 HydrophobicContact CD1-CG1 4.07Å; L413-V424 HydrophobicContact CD2-CG1 3.55Å; L413-V424 HydrophobicContact CG-CG1 4.16Å
414	F	58.6	Low	63.8	Low	30 Å²	30	94.5 Å²	94.5	13%	0.132	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-81.3	144	165.7	-65.8	-84.7	0	0	0	110.7	Y235 L244 A249 F252 H253	Y235-F414 AromaticContact CD1-CE2 3.89Å; Y235-F414 HydrophobicContact CD1-CE2 3.89Å; Y235-F414 AromaticContact CD1-CZ 3.72Å; Y235-F414 HydrophobicContact CD1-CZ 3.72Å; Y235-F414 HydrophobicContact CD2-CE1 4.46Å; Y235-F414 AromaticContact CD2-CE2 3.91Å; Y235-F414 HydrophobicContact CD2-CE2 3.91Å; Y235-F414 AromaticContact CD2-CZ 3.61Å; Y235-F414 HydrophobicContact CD2-CZ 3.61Å; Y235-F414 AromaticContact CE1-CE2 3.57Å; Y235-F414 HydrophobicContact CE1-CE2 3.57Å; Y235-F414 AromaticContact CE1-CZ 3.92Å; Y235-F414 HydrophobicContact CE1-CZ 3.92Å; Y235-F414 HydrophobicContact CE2-CD2 4.41Å; Y235-F414 AromaticContact CE2-CE2 3.57Å; Y235-F414 HydrophobicContact CE2-CE2 3.57Å; Y235-F414 AromaticContact CE2-CZ 3.8Å; Y235-F414 HydrophobicContact CE2-CZ 3.8Å; Y235-F414 HydrophobicContact CG-CE2 4.06Å; Y235-F414 AromaticContact CG-CZ 3.57Å; Y235-F414 HydrophobicContact CG-CZ 3.57Å; Y235-F414 AromaticContact CZ-CE2 3.4Å; Y235-F414 AromaticContact CZ-CZ 3.96Å; L244-F414 HydrophobicContact CB-CE1 4.47Å; L244-F414 HydrophobicContact CD1-CE1 3.83Å; L244-F414 HydrophobicContact CD1-CZ 4.32Å; A249-F414 HydrophobicContact CB-CD1 3.84Å; A249-F414 HydrophobicContact CB-CE1 4.12Å; A249-F414 VanDerWaalsContact O-CE1 3.24Å; A249-F414 WeakPolarHBondContact O-CE1 3.43Å; F252-F414 HydrophobicContact CB-CZ 4.49Å; H253-F414 HydrophobicContact CB-CE2 4.14Å; H253-F414 HydrophobicContact CB-CZ 4.22Å; H253-F414 AromaticContact ND1-CD2 3.61Å; H253-F414 AromaticContact ND1-CE2 3.41Å; H253-F414 WeakPolarHBondContact ND1-CE2 3.45Å
415	F	61.7	Low	63.5	Low	63 Å²	63	92.4 Å²	92.4	28%	0.276	42%	0.422	S	S	.	.			trans	-146.6	127	165.9	44.2	-88.3	0	0	0	109.7	R421	F415-R421 HydrophobicContact CB-CB 3.74Å; F415-R421 HydrophobicContact CB-CG 4.31Å; F415-R421 HydrophobicContact CD1-CB 4.18Å; F415-R421 HydrophobicContact CD1-CG 3.8Å; F415-R421 HydrophobicContact CD2-CB 4.16Å; F415-R421 HydrophobicContact CD2-CG 4.34Å; F415-R421 HydrophobicContact CE1-CG 4.19Å; F415-R421 HydrophobicContact CG-CB 3.77Å; F415-R421 HydrophobicContact CG-CG 3.89Å
416	V	56.5	Low	63.8	Low	68 Å²	68	93.3 Å²	93.3	41%	0.412	43%	0.43	S	S	.	.	S	Bend	trans	-76.8	-39.9	176.8	-177.2	0	0	0	0	109.4	P247 L250	P247-V416 HydrophobicContact CB-CG1 4.46Å; L250-V416 HydrophobicContact CD1-CG2 4.28Å; L250-V416 HydrophobicContact CD2-CG2 4.38Å; L250-V416 HydrophobicContact CG-CG2 4.42Å
417	D	58.9	Low	64.1	Low	75 Å²	75	99.3 Å²	99.3	40%	0.401	45%	0.45	S	S	.	.	S	Bend	trans	-135.8	165.2	175.4	-177.9	33.5	0	0	0	113	R419 D420 R421	D417-R419 VanDerWaalsContact C-N 3.25Å; D417-R419 PolarHBondContact O-N 2.54Å; D417-R419 PolarHBondContact OD2-N 3.38Å; D417-D420 WeakPolarHBondContact O-CB 3.31Å; D417-D420 PolarHBondContact O-N 3Å; D417-R421 PolarHBondContact O-N 3.42Å
418	K	58.6	Low	64.5	Low	118 Å²	118	97.3 Å²	97.3	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-55.4	-35.8	174.3	-76	179.8	175	166.6	0	112.6	L135 R421 L422	L135-K418 VanDerWaalsContact CD1-CE 3.45Å; L135-K418 HydrophobicContact CD2-CD 4.14Å; L135-K418 HydrophobicContact CD2-CG 4.43Å; K418-R421 WeakPolarHBondContact O-CB 3.48Å; K418-R421 PolarHBondContact O-N 3.23Å; K418-L422 PolarHBondContact O-N 3.02Å
419	R	59.7	Low	65.1	Low	197 Å²	197	100.2 Å²	100.2	74%	0.743	45%	0.449	S	S	*	.	H	α-helix	trans	-68.5	-41.7	177.2	-67.4	-177	-174.2	178.9	5.1	111.4	D417 R421 L422 I423	D417-R419 VanDerWaalsContact C-N 3.25Å; D417-R419 PolarHBondContact O-N 2.54Å; D417-R419 PolarHBondContact OD2-N 3.38Å; R419-R421 VanDerWaalsContact C-N 3.31Å; R419-R421 PolarHBondContact O-N 3.33Å; R419-L422 PolarHBondContact O-N 2.92Å; R419-I423 PolarHBondContact O-N 3.24Å
420	D	63.3	Low	65.9	Low	67 Å²	67	97.1 Å²	97.1	36%	0.358	44%	0.439	S	S	.	.	H	α-helix	trans	-63.2	-38	174.2	-75.2	-20.4	0	0	0	112	D417 L422 I423 V424	D417-D420 WeakPolarHBondContact O-CB 3.31Å; D417-D420 PolarHBondContact O-N 3Å; D420-L422 VanDerWaalsContact C-N 3.26Å; D420-L422 PolarHBondContact O-N 2.95Å; D420-I423 PolarHBondContact O-N 2.85Å; D420-I423 VanDerWaalsContact O-N 3.11Å; D420-V424 WeakPolarHBondContact O-CB 3.48Å; D420-V424 VanDerWaalsContact O-CG2 3.25Å; D420-V424 WeakPolarHBondContact O-CG2 3.35Å; D420-V424 PolarHBondContact O-N 2.94Å
421	R	67.3	Low	66.7	Low	141 Å²	141	98.8 Å²	98.8	53%	0.532	45%	0.449	S	S	.	.	H	α-helix	trans	-54.5	-43.3	176.7	-171.5	177.9	175.4	-172.5	-0.4	111.9	F415 D417 K418 R419 T425	F415-R421 HydrophobicContact CB-CB 3.74Å; F415-R421 HydrophobicContact CB-CG 4.31Å; F415-R421 HydrophobicContact CD1-CB 4.18Å; F415-R421 HydrophobicContact CD1-CG 3.8Å; F415-R421 HydrophobicContact CD2-CB 4.16Å; F415-R421 HydrophobicContact CD2-CG 4.34Å; F415-R421 HydrophobicContact CE1-CG 4.19Å; F415-R421 HydrophobicContact CG-CB 3.77Å; F415-R421 HydrophobicContact CG-CG 3.89Å; D417-R421 PolarHBondContact O-N 3.42Å; K418-R421 WeakPolarHBondContact O-CB 3.48Å; K418-R421 PolarHBondContact O-N 3.23Å; R419-R421 VanDerWaalsContact C-N 3.31Å; R419-R421 PolarHBondContact O-N 3.33Å; R421-T425 VanDerWaalsContact O-CB 3.25Å; R421-T425 WeakPolarHBondContact O-CB 3.48Å; R421-T425 PolarHBondContact O-N 3.44Å; R421-T425 PolarHBondContact O-OG1 2.87Å
422	L	64.6	Low	67.5	Low	134 Å²	134	95.3 Å²	95.3	70%	0.702	44%	0.435	S	S	*	.	H	α-helix	trans	-65.8	-44.5	178	-72.4	165.8	0	0	0	111.7	K418 R419 D420 K426	K418-L422 PolarHBondContact O-N 3.02Å; R419-L422 PolarHBondContact O-N 2.92Å; D420-L422 VanDerWaalsContact C-N 3.26Å; D420-L422 PolarHBondContact O-N 2.95Å; L422-K426 WeakPolarHBondContact O-CB 3.39Å; L422-K426 PolarHBondContact O-N 3.41Å
423	I	71.5	Confident	68.2	Low	86 Å²	86	95 Å²	95	44%	0.441	44%	0.438	S	S	.	.	H	α-helix	trans	-65.1	-48.4	-179.4	-63.5	170.6	0	0	0	110.8	R419 D420 T425 K426 R427	R419-I423 PolarHBondContact O-N 3.24Å; D420-I423 PolarHBondContact O-N 2.85Å; D420-I423 VanDerWaalsContact O-N 3.11Å; I423-T425 PolarHBondContact O-N 2.95Å; I423-K426 PolarHBondContact O-N 3.41Å; I423-R427 HydrophobicContact CG2-CG 4.49Å; I423-R427 WeakPolarHBondContact O-CB 3.44Å; I423-R427 WeakPolarHBondContact O-CG 3.42Å; I423-R427 PolarHBondContact O-N 3.38Å
424	V	70.3	Confident	69.3	Low	46 Å²	46	96.4 Å²	96.4	28%	0.279	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-42	-179.8	175.5	0	0	0	0	110.6	L413 D420 K426 R427 R428	L413-V424 HydrophobicContact CB-CG1 4.27Å; L413-V424 HydrophobicContact CD1-CG1 4.07Å; L413-V424 HydrophobicContact CD2-CG1 3.55Å; L413-V424 HydrophobicContact CG-CG1 4.16Å; D420-V424 WeakPolarHBondContact O-CB 3.48Å; D420-V424 VanDerWaalsContact O-CG2 3.25Å; D420-V424 WeakPolarHBondContact O-CG2 3.35Å; D420-V424 PolarHBondContact O-N 2.94Å; V424-K426 PolarHBondContact O-N 3.12Å; V424-R427 PolarHBondContact O-N 3.25Å; V424-R428 WeakPolarHBondContact O-CB 3.5Å; V424-R428 PolarHBondContact O-N 3.47Å
425	T	70.9	Confident	70.1	Confident	42 Å²	42	99.5 Å²	99.5	26%	0.258	46%	0.463	S	S	.	.	H	α-helix	trans	-65.1	-40.3	176.2	-51.6	0	0	0	0	111.5	R421 I423 R428 R429	R421-T425 VanDerWaalsContact O-CB 3.25Å; R421-T425 WeakPolarHBondContact O-CB 3.48Å; R421-T425 PolarHBondContact O-N 3.44Å; R421-T425 PolarHBondContact O-OG1 2.87Å; I423-T425 PolarHBondContact O-N 2.95Å; T425-R428 PolarHBondContact O-N 3.27Å; T425-R429 WeakPolarHBondContact O-CG 3.19Å; T425-R429 PolarHBondContact O-N 3.03Å
426	K	76.6	Confident	70.6	Confident	142 Å²	142	101 Å²	101	62%	0.617	47%	0.472	S	S	*	.	H	α-helix	trans	-65.4	-46.3	175.8	-171.3	177.7	-179.9	-179	0	111.6	L422 I423 V424 R428 R429 I430	L422-K426 WeakPolarHBondContact O-CB 3.39Å; L422-K426 PolarHBondContact O-N 3.41Å; I423-K426 PolarHBondContact O-N 3.41Å; V424-K426 PolarHBondContact O-N 3.12Å; K426-R428 VanDerWaalsContact C-N 3.28Å; K426-R428 PolarHBondContact O-N 2.69Å; K426-R429 PolarHBondContact O-N 3.07Å; K426-I430 HydrophobicContact CG-CD1 4.13Å; K426-I430 VanDerWaalsContact O-CG1 3.32Å; K426-I430 WeakPolarHBondContact O-CG1 3.33Å; K426-I430 PolarHBondContact O-N 3.43Å
427	R	75.7	Confident	71.5	Confident	181 Å²	181	101.2 Å²	101.2	68%	0.683	48%	0.476	S	S	*	.	H	α-helix	trans	-58.3	-40.7	175.3	-77.3	-178	175.4	-178.7	-0.6	111.5	I423 V424 I430 S431	I423-R427 HydrophobicContact CG2-CG 4.49Å; I423-R427 WeakPolarHBondContact O-CB 3.44Å; I423-R427 WeakPolarHBondContact O-CG 3.42Å; I423-R427 PolarHBondContact O-N 3.38Å; V424-R427 PolarHBondContact O-N 3.25Å; R427-I430 PolarHBondContact O-N 2.92Å; R427-S431 WeakPolarHBondContact O-CB 3.27Å; R427-S431 PolarHBondContact O-N 3.37Å
428	R	75.1	Confident	72.2	Confident	78 Å²	78	103.2 Å²	103.2	29%	0.294	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-51.5	174.9	-179.8	-179.6	174.2	174.8	3.7	112.1	K411 V424 T425 K426 I430 S431 E432	K411-R428 PolarHBondContact O-NH1 3.45Å; K411-R428 PolarHBondContact O-NH2 3.32Å; V424-R428 WeakPolarHBondContact O-CB 3.5Å; V424-R428 PolarHBondContact O-N 3.47Å; T425-R428 PolarHBondContact O-N 3.27Å; K426-R428 VanDerWaalsContact C-N 3.28Å; K426-R428 PolarHBondContact O-N 2.69Å; R428-I430 PolarHBondContact O-N 2.98Å; R428-S431 CarbonylContact O-C 3.5Å; R428-S431 WeakPolarHBondContact O-CA 3.48Å; R428-S431 WeakPolarHBondContact O-CB 3.36Å; R428-S431 PolarHBondContact O-N 2.99Å; R428-E432 HydrophobicContact CG-CG 4.2Å; R428-E432 IonicContact CZ-OE1 3.93Å; R428-E432 IonicContact NE-OE1 2.75Å; R428-E432 PolarHBondContact NE-OE1 3.48Å; R428-E432 IonicContact NE-OE2 2.83Å; R428-E432 IonicContact NH2-OE1 3.54Å; R428-E432 PolarHBondContact NH2-OE1 3.2Å; R428-E432 WeakPolarHBondContact O-CG 3.36Å; R428-E432 PolarHBondContact O-N 2.67Å
429	R	75.6	Confident	72.8	Confident	167 Å²	167	104.8 Å²	104.8	63%	0.63	49%	0.493	S	S	*	.	H	α-helix	trans	-56.5	-40.8	178	-72.6	178.4	-175.3	177.8	1.1	112	T425 K426 N433	T425-R429 WeakPolarHBondContact O-CG 3.19Å; T425-R429 PolarHBondContact O-N 3.03Å; K426-R429 PolarHBondContact O-N 3.07Å; R429-N433 WeakPolarHBondContact O-CB 3.46Å; R429-N433 VanDerWaalsContact O-CG 3.27Å; R429-N433 PolarHBondContact O-N 2.9Å
430	I	78.6	Confident	73.5	Confident	93 Å²	93	105.4 Å²	105.4	48%	0.477	50%	0.495	S	S	.	.	H	α-helix	trans	-63.8	-48.2	175.2	-65.8	166.3	0	0	0	110.3	K426 R427 R428 E432 N433 V434	K426-I430 HydrophobicContact CG-CD1 4.13Å; K426-I430 VanDerWaalsContact O-CG1 3.32Å; K426-I430 WeakPolarHBondContact O-CG1 3.33Å; K426-I430 PolarHBondContact O-N 3.43Å; R427-I430 PolarHBondContact O-N 2.92Å; R428-I430 PolarHBondContact O-N 2.98Å; I430-E432 PolarHBondContact O-N 3.09Å; I430-N433 PolarHBondContact O-N 3.44Å; I430-V434 HydrophobicContact CG2-CG2 4.39Å; I430-V434 VanDerWaalsContact O-CG2 3.29Å; I430-V434 WeakPolarHBondContact O-CG2 3.35Å; I430-V434 PolarHBondContact O-N 2.93Å
431	S	76.7	Confident	74.1	Confident	45 Å²	45	109.4 Å²	109.4	32%	0.315	52%	0.516	S	S	.	.	H	α-helix	trans	-59.8	-43.1	177.9	-172	0	0	0	0	112.6	R427 R428 V434 Q435	R427-S431 WeakPolarHBondContact O-CB 3.27Å; R427-S431 PolarHBondContact O-N 3.37Å; R428-S431 CarbonylContact O-C 3.5Å; R428-S431 WeakPolarHBondContact O-CA 3.48Å; R428-S431 WeakPolarHBondContact O-CB 3.36Å; R428-S431 PolarHBondContact O-N 2.99Å; S431-V434 PolarHBondContact O-N 2.86Å; S431-Q435 WeakPolarHBondContact O-CB 3.49Å; S431-Q435 WeakPolarHBondContact O-CG 3.38Å; S431-Q435 PolarHBondContact O-N 2.91Å
432	E	77.1	Confident	74.1	Confident	72 Å²	72	105.7 Å²	105.7	34%	0.336	51%	0.512	S	S	.	.	H	α-helix	trans	-66.2	-41.9	177.7	-73.5	172.2	163.7	0	0	111.1	R428 I430 Q435 M436	R428-E432 HydrophobicContact CG-CG 4.2Å; R428-E432 IonicContact CZ-OE1 3.93Å; R428-E432 IonicContact NE-OE1 2.75Å; R428-E432 PolarHBondContact NE-OE1 3.48Å; R428-E432 IonicContact NE-OE2 2.83Å; R428-E432 IonicContact NH2-OE1 3.54Å; R428-E432 PolarHBondContact NH2-OE1 3.2Å; R428-E432 WeakPolarHBondContact O-CG 3.36Å; R428-E432 PolarHBondContact O-N 2.67Å; I430-E432 PolarHBondContact O-N 3.09Å; E432-Q435 PolarHBondContact O-N 3.42Å; E432-M436 WeakPolarHBondContact O-CB 3.39Å; E432-M436 WeakPolarHBondContact O-CG 3.29Å; E432-M436 PolarHBondContact O-N 3.43Å
433	N	77.9	Confident	73.5	Confident	91 Å²	91	104.9 Å²	104.9	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-43.2	174.1	-77.6	-9.5	0	0	0	111.9	R429 I430 M436 C437	R429-N433 WeakPolarHBondContact O-CB 3.46Å; R429-N433 VanDerWaalsContact O-CG 3.27Å; R429-N433 PolarHBondContact O-N 2.9Å; I430-N433 PolarHBondContact O-N 3.44Å; N433-M436 PolarHBondContact O-N 2.82Å; N433-M436 WeakPolarHBondContact OD1-CE 3.49Å; N433-C437 WeakPolarHBondContact O-CB 3.17Å; N433-C437 PolarHBondContact O-N 2.6Å; N433-C437 PolarHBondContact O-SG 3.24Å
434	V	80	Confident	72.4	Confident	88 Å²	88	106.2 Å²	106.2	53%	0.533	53%	0.533	S	S	.	.	H	α-helix	trans	-62.2	-44.5	175.3	170.9	0	0	0	0	110.6	I430 S431 M436 C437 L438	I430-V434 HydrophobicContact CG2-CG2 4.39Å; I430-V434 VanDerWaalsContact O-CG2 3.29Å; I430-V434 WeakPolarHBondContact O-CG2 3.35Å; I430-V434 PolarHBondContact O-N 2.93Å; S431-V434 PolarHBondContact O-N 2.86Å; V434-M436 PolarHBondContact O-N 2.94Å; V434-C437 PolarHBondContact O-N 3.46Å; V434-L438 WeakPolarHBondContact O-CB 3.5Å; V434-L438 PolarHBondContact O-N 3.41Å
435	Q	74.8	Confident	71.3	Confident	95 Å²	95	107.9 Å²	107.9	44%	0.444	55%	0.545	S	S	.	.	H	α-helix	trans	-61.6	-41.6	175.3	-79.8	-178.5	-10.6	0	0	112.3	S431 E432 L438 K439	S431-Q435 WeakPolarHBondContact O-CB 3.49Å; S431-Q435 WeakPolarHBondContact O-CG 3.38Å; S431-Q435 PolarHBondContact O-N 2.91Å; E432-Q435 PolarHBondContact O-N 3.42Å; Q435-L438 PolarHBondContact O-N 3.35Å; Q435-K439 WeakPolarHBondContact O-CB 3.46Å; Q435-K439 WeakPolarHBondContact O-CG 3.13Å; Q435-K439 PolarHBondContact O-N 2.89Å
436	M	72.5	Confident	70	Confident	94 Å²	94	112 Å²	112	46%	0.463	57%	0.57	S	S	.	*	H	α-helix	trans	-64.4	-42.8	175.4	-78.2	-160.9	-66.7	0	0	111.9	E432 N433 V434 K439 R440	E432-M436 WeakPolarHBondContact O-CB 3.39Å; E432-M436 WeakPolarHBondContact O-CG 3.29Å; E432-M436 PolarHBondContact O-N 3.43Å; N433-M436 PolarHBondContact O-N 2.82Å; N433-M436 WeakPolarHBondContact OD1-CE 3.49Å; V434-M436 PolarHBondContact O-N 2.94Å; M436-K439 PolarHBondContact O-N 2.95Å; M436-R440 WeakPolarHBondContact O-CG 3.5Å; M436-R440 PolarHBondContact O-N 3.39Å
437	C	75.3	Confident	68.2	Low	73 Å²	73	109.5 Å²	109.5	49%	0.493	58%	0.575	S	S	.	*	H	α-helix	trans	-61.7	-44.4	174.3	-70.5	0	0	0	0	111.2	N433 V434 K439 R440 L441	N433-C437 WeakPolarHBondContact O-CB 3.17Å; N433-C437 PolarHBondContact O-N 2.6Å; N433-C437 PolarHBondContact O-SG 3.24Å; V434-C437 PolarHBondContact O-N 3.46Å; C437-K439 PolarHBondContact O-N 3.09Å; C437-R440 PolarHBondContact O-N 3.31Å; C437-L441 VanDerWaalsContact O-CG 3.28Å; C437-L441 WeakPolarHBondContact O-CG 3.33Å; C437-L441 PolarHBondContact O-N 3.03Å; C437-L441 VanDerWaalsContact O-N 3.11Å
438	L	74.4	Confident	66.6	Low	117 Å²	117	104.5 Å²	104.5	61%	0.613	57%	0.565	S	S	*	*	H	α-helix	trans	-62.3	-44.4	177.6	-157.5	92.8	0	0	0	111.5	V434 Q435 R440 L441 S442	V434-L438 WeakPolarHBondContact O-CB 3.5Å; V434-L438 PolarHBondContact O-N 3.41Å; Q435-L438 PolarHBondContact O-N 3.35Å; L438-R440 VanDerWaalsContact C-N 3.27Å; L438-R440 PolarHBondContact O-N 3.28Å; L438-L441 PolarHBondContact O-N 3.28Å; L438-L441 VanDerWaalsContact O-N 3.08Å; L438-S442 PolarHBondContact O-N 3.23Å; L438-S442 PolarHBondContact O-OG 3.48Å; L438-S442 VanDerWaalsContact O-OG 3.1Å
439	K	71.1	Confident	64.9	Low	151 Å²	151	109.2 Å²	109.2	66%	0.657	59%	0.59	S	S	*	*	H	α-helix	trans	-62.6	-30.2	175.6	-79.4	-177.3	177.9	-175.5	0	113.5	Q435 M436 C437 L441	Q435-K439 WeakPolarHBondContact O-CB 3.46Å; Q435-K439 WeakPolarHBondContact O-CG 3.13Å; Q435-K439 PolarHBondContact O-N 2.89Å; M436-K439 PolarHBondContact O-N 2.95Å; C437-K439 PolarHBondContact O-N 3.09Å; K439-L441 VanDerWaalsContact C-N 3.35Å
440	R	75.3	Confident	63.5	Low	210 Å²	210	110.2 Å²	110.2	79%	0.792	60%	0.595	S	S	*	*	H	α-helix	trans	-75.9	-26.2	174.4	-74.1	177.6	-176.1	-177.1	1.7	112.4	M436 C437 L438	M436-R440 WeakPolarHBondContact O-CG 3.5Å; M436-R440 PolarHBondContact O-N 3.39Å; C437-R440 PolarHBondContact O-N 3.31Å; L438-R440 VanDerWaalsContact C-N 3.27Å; L438-R440 PolarHBondContact O-N 3.28Å
441	L	74.7	Confident	62.4	Low	151 Å²	151	108.5 Å²	108.5	79%	0.791	60%	0.6	S	S	*	*	H	α-helix	trans	-90.8	-25.5	-178.7	-67.9	169.7	0	0	0	112.8	C437 L438 K439	C437-L441 VanDerWaalsContact O-CG 3.28Å; C437-L441 WeakPolarHBondContact O-CG 3.33Å; C437-L441 PolarHBondContact O-N 3.03Å; C437-L441 VanDerWaalsContact O-N 3.11Å; L438-L441 PolarHBondContact O-N 3.28Å; L438-L441 VanDerWaalsContact O-N 3.08Å; K439-L441 VanDerWaalsContact C-N 3.35Å
442	S	68.3	Low	61.7	Low	63 Å²	63	110 Å²	110	44%	0.441	62%	0.622	S	S	.	*	S	Bend	trans	-92.3	133.3	175.1	60.1	0	0	0	0	111.7	L438 C444	L438-S442 PolarHBondContact O-N 3.23Å; L438-S442 PolarHBondContact O-OG 3.48Å; L438-S442 VanDerWaalsContact O-OG 3.1Å; S442-C444 PolarHBondContact O-N 3.34Å; S442-C444 VanDerWaalsContact O-N 3.15Å
443	S	52	Low	61.7	Low	117 Å²	117	108.4 Å²	108.4	82%	0.818	62%	0.622	S	S	*	*			trans	-62.4	113.8	163.2	35.1	0	0	0	0	108	P445	S443-P445 WeakPolarHBondContact O-CD 3.35Å
444	C	46.8	Very low	61.9	Low	115 Å²	115	106.5 Å²	106.5	78%	0.777	62%	0.616	S	S	*	*			trans	-67	115.3	-174.2	-158.1	0	0	0	0	109.8	S442	S442-C444 PolarHBondContact O-N 3.34Å; S442-C444 VanDerWaalsContact O-N 3.15Å
445	P	48.5	Very low	62	Low	81 Å²	81	104.5 Å²	104.5	53%	0.526	61%	0.605	S	S	.	*			trans	-69.8	144.3	163.5	-1.9	19.6	0	0	0	108	S443	S443-P445 WeakPolarHBondContact O-CD 3.35Å
446	V	42.2	Very low	62.6	Low	129 Å²	129	103.5 Å²	103.5	78%	0.782	60%	0.6	S	S	*	*			trans	-45.7	139.6	178.8	179.8	0	0	0	0	111	V448	V446-V448 PolarHBondContact O-N 2.9Å; V446-V448 VanDerWaalsContact O-N 3.12Å
447	A	39.4	Very low	63.4	Low	88 Å²	88	100.7 Å²	100.7	73%	0.727	59%	0.585	S	S	*	*			trans	-48.1	120.7	172.2	0	0	0	0	0	109.5	H449	A447-H449 PolarHBondContact O-N 3.47Å; A447-H449 VanDerWaalsContact O-N 3.11Å
448	V	42.2	Very low	64.3	Low	77 Å²	77	97.4 Å²	97.4	47%	0.467	56%	0.563	S	S	.	*			trans	-61.3	118.6	178.1	178.2	0	0	0	0	107.3	R405 V446 Y450	R405-V448 VanDerWaalsContact NH1-CG2 3.25Å; V446-V448 PolarHBondContact O-N 2.9Å; V446-V448 VanDerWaalsContact O-N 3.12Å; V448-Y450 PolarHBondContact O-N 3.18Å; V448-Y450 VanDerWaalsContact O-N 3.11Å
449	H	39.7	Very low	65.1	Low	177 Å²	177	95.3 Å²	95.3	82%	0.819	56%	0.557	S	S	*	*			trans	-58.3	114.2	160.9	-83	-80.5	0	0	0	106.4	A447 G451	A447-H449 PolarHBondContact O-N 3.47Å; A447-H449 VanDerWaalsContact O-N 3.11Å; H449-G451 VanDerWaalsContact C-N 3.34Å; H449-G451 PolarHBondContact O-N 3.36Å
450	Y	46.9	Very low	66.1	Low	188 Å²	188	89.9 Å²	89.9	74%	0.737	53%	0.532	S	S	*	.			trans	-58.1	105.4	166.4	-72.6	-89.2	0	0	0	106.3	V448	V448-Y450 PolarHBondContact O-N 3.18Å; V448-Y450 VanDerWaalsContact O-N 3.11Å
451	G	54.3	Low	66.8	Low	57 Å²	57	80.8 Å²	80.8	59%	0.588	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-54.4	155.3	166.4	0	0	0	0	0	109.1	H449	H449-G451 VanDerWaalsContact C-N 3.34Å; H449-G451 PolarHBondContact O-N 3.36Å
452	G	62.6	Low	67.2	Low	75 Å²	75	80.9 Å²	80.9	77%	0.773	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-54.9	145.8	171.9	0	0	0	0	0	110.5	S454	G452-S454 PolarHBondContact O-N 3.19Å
453	A	76.8	Confident	68	Low	40 Å²	40	85.6 Å²	85.6	33%	0.331	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-57.9	129.6	174.8	0	0	0	0	0	109.6	L94 L223	L94-A453 HydrophobicContact CD2-CB 3.61Å; L223-A453 HydrophobicContact CD2-CB 3.97Å
454	S	82.6	Confident	69.1	Low	51 Å²	51	88.5 Å²	88.5	36%	0.357	53%	0.527	S	S	.	.			trans	-125.5	142.5	179.5	-177.5	0	0	0	0	110.8	G452 F456	G452-S454 PolarHBondContact O-N 3.19Å; S454-F456 VanDerWaalsContact C-N 3.28Å; S454-F456 PolarHBondContact OG-N 3.45Å; S454-F456 PolarHBondContact OG-O 2.83Å
455	S	81.1	Confident	70.7	Confident	45 Å²	45	86.6 Å²	86.6	32%	0.315	53%	0.527	S	S	.	.	S	Bend	trans	-79.6	-11.6	169.1	61	0	0	0	0	112.9	R222	R222-S455 PolarHBondContact NH1-O 3.41Å; R222-S455 PolarHBondContact NH2-O 2.75Å
456	F	88.6	Confident	72.5	Confident	75 Å²	75	84.7 Å²	84.7	33%	0.329	52%	0.515	S	S	.	.			trans	-95	141.5	176.8	-69.4	-89.4	0	0	0	110.4	R222 R296 T299 D300 S454	R222-F456 PolarHBondContact NH1-O 3.02Å; R296-F456 HydrophobicContact CG-CE1 4.06Å; R296-F456 HydrophobicContact CG-CZ 4.02Å; T299-F456 HydrophobicContact CG2-CE1 3.91Å; D300-F456 HydrophobicContact CB-CD1 3.7Å; D300-F456 HydrophobicContact CB-CE1 4.2Å; S454-F456 VanDerWaalsContact C-N 3.28Å; S454-F456 PolarHBondContact OG-N 3.45Å; S454-F456 PolarHBondContact OG-O 2.83Å
457	Q	89.4	Confident	74.8	Confident	34 Å²	34	79.8 Å²	79.8	16%	0.159	49%	0.485	C	S	.	.	S	Bend	trans	-87.6	-30	175.3	-65	-74.8	9	0	0	111.6	D300 M532	D300-Q457 PolarHBondContact OD1-N 2.96Å; D300-Q457 PolarHBondContact OD2-N 3.4Å; D300-Q457 VanDerWaalsContact OD2-N 3.13Å; Q457-M532 HydrophobicContact CG-CB 4.33Å; Q457-M532 HydrophobicContact CG-CG 4.46Å; Q457-M532 PolarHBondContact NE2-O 3.32Å
458	F	92.5	Very high	77.3	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.018	46%	0.457	C	S	.	.			trans	-123.2	148.6	-179.2	-56.3	-77.6	0	0	0	110.7	D300 A391 L392 A395 W460 D467 L528 F531 M532	D300-F458 WeakPolarHBondContact O-CD2 3.29Å; D300-F458 PolarHBondContact OD1-N 3.25Å; A391-F458 HydrophobicContact CB-CD1 4.04Å; A391-F458 HydrophobicContact CB-CE1 4.07Å; L392-F458 HydrophobicContact CB-CZ 4.48Å; L392-F458 HydrophobicContact CD1-CZ 4.16Å; A395-F458 HydrophobicContact CB-CE1 3.73Å; A395-F458 HydrophobicContact CB-CZ 4.37Å; F458-W460 HydrophobicContact CB-CD2 4.33Å; F458-W460 VanDerWaalsContact CB-CE2 3.43Å; F458-W460 HydrophobicContact CB-CH2 4.31Å; F458-W460 HydrophobicContact CB-CZ2 3.44Å; F458-W460 VanDerWaalsContact CB-CZ2 3.44Å; F458-W460 HydrophobicContact CD1-CH2 4.37Å; F458-W460 HydrophobicContact CD1-CZ2 4.06Å; F458-W460 HydrophobicContact CD2-CZ2 4.15Å; F458-W460 HydrophobicContact CG-CH2 4.37Å; F458-W460 AromaticContact CG-CZ2 3.63Å; F458-W460 HydrophobicContact CG-CZ2 3.63Å; F458-D467 VanDerWaalsContact CA-OD2 3.28Å; F458-D467 WeakPolarHBondContact CA-OD2 3.49Å; F458-L528 HydrophobicContact CE2-CD1 4.07Å; F458-L528 HydrophobicContact CZ-CD1 4.25Å; F458-F531 HydrophobicContact CZ-CD1 4.23Å; F458-F531 HydrophobicContact CZ-CE1 4.06Å; F458-M532 HydrophobicContact CE2-CG 3.92Å; F458-M532 HydrophobicContact CE2-SD 4.44Å
459	C	91.6	Very high	79.7	Confident	74 Å²	74	75.7 Å²	75.7	50%	0.5	46%	0.455	S	S	.	.			trans	-116.4	104.1	177	-69	0	0	0	0	108.9	S466 D467	C459-S466 CarbonylContact O-C 3.3Å; C459-S466 WeakPolarHBondContact O-CA 3.49Å; C459-S466 WeakPolarHBondContact O-CB 3.22Å; C459-D467 PolarHBondContact N-OD2 2.88Å; C459-D467 PolarHBondContact O-N 3.28Å
460	W	92.9	Very high	82.2	Confident	36 Å²	36	68.7 Å²	68.7	14%	0.136	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-98.6	135.6	-179.3	-50.4	110.2	0	0	0	111.5	D300 N302 L387 V388 A391 F458 D467 G468	D300-W460 PolarHBondContact O-NE1 2.73Å; N302-W460 HydrophobicContact CB-CD2 3.71Å; N302-W460 VanDerWaalsContact CB-CE2 3.46Å; N302-W460 HydrophobicContact CB-CE3 4.31Å; N302-W460 HydrophobicContact CB-CG 3.99Å; N302-W460 HydrophobicContact CB-CH2 4.37Å; N302-W460 HydrophobicContact CB-CZ2 3.81Å; L387-W460 HydrophobicContact CD2-CE3 3.88Å; L387-W460 HydrophobicContact CD2-CH2 3.83Å; L387-W460 HydrophobicContact CD2-CZ3 3.3Å; L387-W460 HydrophobicContact CG-CZ3 4.38Å; V388-W460 HydrophobicContact CG2-CH2 4.06Å; V388-W460 HydrophobicContact CG2-CZ2 4.23Å; A391-W460 HydrophobicContact CB-CH2 3.46Å; A391-W460 VanDerWaalsContact CB-CH2 3.46Å; A391-W460 HydrophobicContact CB-CZ2 4.45Å; A391-W460 HydrophobicContact CB-CZ3 3.94Å; F458-W460 HydrophobicContact CB-CD2 4.33Å; F458-W460 VanDerWaalsContact CB-CE2 3.43Å; F458-W460 HydrophobicContact CB-CH2 4.31Å; F458-W460 HydrophobicContact CB-CZ2 3.44Å; F458-W460 VanDerWaalsContact CB-CZ2 3.44Å; F458-W460 HydrophobicContact CD1-CH2 4.37Å; F458-W460 HydrophobicContact CD1-CZ2 4.06Å; F458-W460 HydrophobicContact CD2-CZ2 4.15Å; F458-W460 HydrophobicContact CG-CH2 4.37Å; F458-W460 AromaticContact CG-CZ2 3.63Å; F458-W460 HydrophobicContact CG-CZ2 3.63Å; W460-D467 HydrophobicContact CE3-CB 4.17Å; W460-D467 HydrophobicContact CH2-CB 4.27Å; W460-D467 HydrophobicContact CZ3-CB 3.85Å; W460-G468 CarbonylContact C-O 3.38Å; W460-G468 WeakPolarHBondContact CA-O 3.44Å
461	G	90	Very high	84.3	Confident	19 Å²	19	61.2 Å²	61.2	20%	0.196	40%	0.399	C	S	.	.	S	Bend	trans	159.1	-171.5	179.6	0	0	0	0	0	112.7	S466 G468	G461-S466 WeakPolarHBondContact O-CB 3.46Å; G461-S466 PolarHBondContact O-OG 3.26Å; G461-S466 VanDerWaalsContact O-OG 3.07Å; G461-G468 PolarHBondContact N-O 3.22Å; G461-G468 CarbonylContact O-C 3.59Å; G461-G468 VanDerWaalsContact O-O 3.1Å
462	D	83.3	Confident	86	Confident	153 Å²	153	60.1 Å²	60.1	82%	0.818	38%	0.378	S	S	*	.	S	Bend	trans	-100.3	6.9	179.4	-58	-37	0	0	0	112.3
463	E	85.5	Confident	87.2	Confident	162 Å²	162	62 Å²	62	76%	0.757	37%	0.367	S	S	*	.	S	Bend	trans	-82.9	152.7	-176.3	-62.7	-172.7	174	0	0	112.5	G465 S466	E463-G465 PolarHBondContact O-N 3.04Å; E463-G465 VanDerWaalsContact O-N 3.12Å; E463-S466 WeakPolarHBondContact O-CB 3.42Å; E463-S466 PolarHBondContact O-N 3.41Å; E463-S466 VanDerWaalsContact O-N 3.08Å; E463-S466 PolarHBondContact O-OG 2.93Å
464	N	75	Confident	87.7	Confident	178 Å²	178	60.6 Å²	60.6	95%	0.952	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	116.9	176.1	-69.5	-29	0	0	0	110.6
465	G	79.4	Confident	87.9	Confident	75 Å²	75	62.7 Å²	62.7	77%	0.773	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.6	3.2	-177.4	0	0	0	0	0	114.7	E463	E463-G465 PolarHBondContact O-N 3.04Å; E463-G465 VanDerWaalsContact O-N 3.12Å
466	S	86.9	Confident	88	Confident	41 Å²	41	60.6 Å²	60.6	29%	0.287	34%	0.342	S	S	.	.			trans	-67.6	147.2	167.6	64.3	0	0	0	0	111.8	C459 G461 E463 G468	C459-S466 CarbonylContact O-C 3.3Å; C459-S466 WeakPolarHBondContact O-CA 3.49Å; C459-S466 WeakPolarHBondContact O-CB 3.22Å; G461-S466 WeakPolarHBondContact O-CB 3.46Å; G461-S466 PolarHBondContact O-OG 3.26Å; G461-S466 VanDerWaalsContact O-OG 3.07Å; E463-S466 WeakPolarHBondContact O-CB 3.42Å; E463-S466 PolarHBondContact O-N 3.41Å; E463-S466 VanDerWaalsContact O-N 3.08Å; E463-S466 PolarHBondContact O-OG 2.93Å; S466-G468 PolarHBondContact O-N 3.12Å
467	D	90.8	Very high	87.4	Confident	27 Å²	27	61.5 Å²	61.5	14%	0.144	35%	0.35	C	S	.	.	S	Bend	trans	-75.7	-5.8	172.8	-58.8	-66.7	0	0	0	112.7	A391 R398 F458 C459 W460	A391-D467 HydrophobicContact CB-CB 3.89Å; R398-D467 IonicContact CZ-OD1 2.89Å; R398-D467 IonicContact NH1-OD1 2.82Å; R398-D467 IonicContact NH2-OD1 3.03Å; R398-D467 PolarHBondContact NH2-OD1 2.98Å; F458-D467 VanDerWaalsContact CA-OD2 3.28Å; F458-D467 WeakPolarHBondContact CA-OD2 3.49Å; C459-D467 PolarHBondContact N-OD2 2.88Å; C459-D467 PolarHBondContact O-N 3.28Å; W460-D467 HydrophobicContact CE3-CB 4.17Å; W460-D467 HydrophobicContact CH2-CB 4.27Å; W460-D467 HydrophobicContact CZ3-CB 3.85Å
468	G	91.4	Very high	86.6	Confident	14 Å²	14	61.3 Å²	61.3	14%	0.144	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	152.7	175.5	175.2	0	0	0	0	0	112.9	W460 G461 S466	W460-G468 CarbonylContact C-O 3.38Å; W460-G468 WeakPolarHBondContact CA-O 3.44Å; G461-G468 PolarHBondContact N-O 3.22Å; G461-G468 CarbonylContact O-C 3.59Å; G461-G468 VanDerWaalsContact O-O 3.1Å; S466-G468 PolarHBondContact O-N 3.12Å
469	P	92.3	Very high	85.8	Confident	65 Å²	65	61.4 Å²	61.4	42%	0.422	36%	0.358	S	S	.	.			trans	-64.8	149.8	178.8	26.5	-35.3	0	0	0	112.1	N302 L387	N302-P469 PolarHBondContact ND2-O 3.06Å; L387-P469 HydrophobicContact CD1-CG 3.6Å
470	S	92.4	Very high	85.2	Confident	30 Å²	30	58.8 Å²	58.8	21%	0.21	34%	0.339	C	S	.	.			trans	-77.4	136.1	177	178.5	0	0	0	0	111.9	H472 H473	S470-H472 PolarHBondContact OG-CD2 3.39Å; S470-H472 PolarHBondContact OG-N 3.14Å; S470-H472 PolarHBondContact OG-NE2 3.46Å; S470-H473 PolarHBondContact O-CE1 3.31Å; S470-H473 PolarHBondContact O-ND1 3.19Å
471	L	91.3	Very high	84.3	Confident	31 Å²	31	58.9 Å²	58.9	16%	0.162	35%	0.345	C	S	.	.			trans	-108.4	8.2	176.1	-60.6	176.9	0	0	0	112.9	N302 W384 H473 T474	N302-L471 PolarHBondContact OD1-N 2.87Å; W384-L471 HydrophobicContact CB-CD1 3.89Å; W384-L471 HydrophobicContact CG-CD1 4.36Å; L471-H473 PolarHBondContact O-N 3.16Å; L471-T474 HydrophobicContact CB-CG2 4.38Å; L471-T474 HydrophobicContact CD2-CG2 4.32Å; L471-T474 WeakPolarHBondContact O-CB 3.41Å; L471-T474 WeakPolarHBondContact O-CG2 3.21Å; L471-T474 PolarHBondContact O-N 3.42Å; L471-T474 VanDerWaalsContact O-N 3.11Å; L471-T474 PolarHBondContact O-OG1 3.26Å
472	H	90.3	Very high	83.4	Confident	34 Å²	34	64.5 Å²	64.5	16%	0.157	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-32.8	-176	-59.4	-37.1	0	0	0	113.5	T299 L303 D305 S470 T474	T299-H472 VanDerWaalsContact CA-CE1 3.43Å; T299-H472 WeakPolarHBondContact CA-CE1 3.47Å; T299-H472 PolarHBondContact O-CE1 3.03Å; L303-H472 PolarHBondContact O-ND1 3Å; D305-H472 PolarHBondContact N-O 2.97Å; D305-H472 IonicContact OD1-CG 3.76Å; S470-H472 PolarHBondContact OG-CD2 3.39Å; S470-H472 PolarHBondContact OG-N 3.14Å; S470-H472 PolarHBondContact OG-NE2 3.46Å; H472-T474 VanDerWaalsContact C-N 3.25Å; H472-T474 PolarHBondContact O-N 3.28Å
473	H	87.3	Confident	81.9	Confident	115 Å²	115	59.5 Å²	59.5	53%	0.532	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-5.5	-178.8	64.1	-86.5	0	0	0	114.1	S470 L471	S470-H473 PolarHBondContact O-CE1 3.31Å; S470-H473 PolarHBondContact O-ND1 3.19Å; L471-H473 PolarHBondContact O-N 3.16Å
474	T	87.8	Confident	80.2	Confident	10 Å²	10	59.5 Å²	59.5	6%	0.061	35%	0.352	C	S	.	.			trans	-75.4	149.1	-178.2	61.8	0	0	0	0	112.2	P304 D377 F379 L471 H472	P304-T474 WeakPolarHBondContact CB-O 3.37Å; P304-T474 WeakPolarHBondContact CG-OG1 3.29Å; D377-T474 CarbonylContact O-C 3.54Å; D377-T474 WeakPolarHBondContact O-CA 3.5Å; D377-T474 WeakPolarHBondContact O-CB 3.39Å; F379-T474 WeakPolarHBondContact CD2-OG1 3.01Å; L471-T474 HydrophobicContact CB-CG2 4.38Å; L471-T474 HydrophobicContact CD2-CG2 4.32Å; L471-T474 WeakPolarHBondContact O-CB 3.41Å; L471-T474 WeakPolarHBondContact O-CG2 3.21Å; L471-T474 PolarHBondContact O-N 3.42Å; L471-T474 VanDerWaalsContact O-N 3.11Å; L471-T474 PolarHBondContact O-OG1 3.26Å; H472-T474 VanDerWaalsContact C-N 3.25Å; H472-T474 PolarHBondContact O-N 3.28Å
475	K	86	Confident	79.5	Confident	94 Å²	94	54 Å²	54	41%	0.409	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-102.1	151.3	-174	-59.7	-174.7	-179.5	177.3	0	112.3	E306 D377 F379	E306-K475 WeakPolarHBondContact OE2-CA 3.33Å; D377-K475 PolarHBondContact O-N 3.43Å; F379-K475 PolarHBondContact N-O 2.93Å
476	L	84.3	Confident	78.4	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	33%	0.333	C	S	.	.			trans	-97.3	10.9	-179.3	-63	174.3	0	0	0	114	P304 E306 L307 M354 F355 F379 G478 V479 I480	P304-L476 HydrophobicContact CB-CD2 4.32Å; P304-L476 HydrophobicContact CB-CG 4.5Å; P304-L476 HydrophobicContact CG-CD2 4.14Å; E306-L476 HydrophobicContact CB-CD1 3.67Å; E306-L476 HydrophobicContact CB-CG 4Å; E306-L476 PolarHBondContact OE2-N 2.89Å; L307-L476 HydrophobicContact CD2-CD1 3.58Å; L307-L476 HydrophobicContact CD2-CD2 4.17Å; L307-L476 HydrophobicContact CG-CD1 3.82Å; L307-L476 HydrophobicContact CG-CD2 4.33Å; M354-L476 HydrophobicContact CE-CD1 4.14Å; F355-L476 HydrophobicContact CE2-CD2 4.5Å; F355-L476 HydrophobicContact CZ-CD2 3.97Å; F379-L476 HydrophobicContact CB-CD2 4.34Å; L476-G478 PolarHBondContact O-N 3.18Å; L476-G478 VanDerWaalsContact O-N 3.07Å; L476-V479 PolarHBondContact O-N 3.39Å; L476-I480 HydrophobicContact CB-CD1 3.64Å; L476-I480 HydrophobicContact CB-CG1 4.39Å; L476-I480 PolarHBondContact O-N 3.11Å
477	D	75.9	Confident	77.5	Confident	94 Å²	94	59.7 Å²	59.7	50%	0.503	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-31.5	-175.4	-67.7	-31.7	0	0	0	113.5	V479	D477-V479 VanDerWaalsContact C-N 3.26Å; D477-V479 PolarHBondContact O-N 3.12Å
478	G	72.4	Confident	76.7	Confident	30 Å²	30	60.6 Å²	60.6	31%	0.309	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.6	177.9	0	0	0	0	0	115.5	L476 L490	L476-G478 PolarHBondContact O-N 3.18Å; L476-G478 VanDerWaalsContact O-N 3.07Å; G478-L490 VanDerWaalsContact O-CD1 3.23Å; G478-L490 WeakPolarHBondContact O-CD1 3.44Å
479	V	75.1	Confident	76	Confident	6 Å²	6	61.1 Å²	61.1	4%	0.036	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-7.1	-173.4	-171.6	0	0	0	0	111.6	M354 F355 L365 L476 D477 L490	M354-V479 HydrophobicContact CB-CG1 4.18Å; M354-V479 HydrophobicContact CE-CG1 4.39Å; M354-V479 WeakPolarHBondContact O-CG1 3.39Å; F355-V479 HydrophobicContact CD1-CG1 4.35Å; F355-V479 HydrophobicContact CD1-CG2 4.21Å; F355-V479 HydrophobicContact CE1-CG1 4.27Å; F355-V479 HydrophobicContact CE1-CG2 3.57Å; F355-V479 HydrophobicContact CZ-CG2 4.06Å; L365-V479 HydrophobicContact CD1-CG1 4.11Å; L365-V479 HydrophobicContact CD1-CG2 4.45Å; L476-V479 PolarHBondContact O-N 3.39Å; D477-V479 VanDerWaalsContact C-N 3.26Å; D477-V479 PolarHBondContact O-N 3.12Å; V479-L490 WeakPolarHBondContact O-CG 3.3Å; V479-L490 PolarHBondContact O-N 3.41Å
480	I	78.6	Confident	75.1	Confident	20 Å²	20	62 Å²	62	10%	0.103	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.4	-174.4	-58.7	164.9	0	0	0	109.3	W310 M354 L476 M487	W310-I480 HydrophobicContact CZ2-CD1 3.77Å; W310-I480 HydrophobicContact CZ2-CG1 3.93Å; W310-I480 HydrophobicContact CZ2-CG2 4.13Å; M354-I480 HydrophobicContact CE-CD1 3.96Å; M354-I480 HydrophobicContact CE-CG1 3.69Å; L476-I480 HydrophobicContact CB-CD1 3.64Å; L476-I480 HydrophobicContact CB-CG1 4.39Å; L476-I480 PolarHBondContact O-N 3.11Å; I480-M487 HydrophobicContact CB-CE 4.37Å; I480-M487 HydrophobicContact CD1-CE 4.38Å; I480-M487 HydrophobicContact CD1-SD 4.47Å; I480-M487 HydrophobicContact CG2-CB 3.55Å; I480-M487 HydrophobicContact CG2-CE 3.76Å; I480-M487 HydrophobicContact CG2-CG 3.71Å; I480-M487 HydrophobicContact CG2-SD 4Å
481	S	75.2	Confident	74.3	Confident	38 Å²	38	61.6 Å²	61.6	27%	0.266	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	144.6	168.7	53.8	0	0	0	0	110.3	S483 T488	S481-S483 PolarHBondContact O-N 2.88Å; S481-T488 PolarHBondContact N-O 2.9Å; S481-T488 PolarHBondContact O-N 3.5Å; S481-T488 PolarHBondContact O-OG1 3.43Å; S481-T488 PolarHBondContact OG-O 3.36Å; S481-T488 PolarHBondContact OG-OG1 3.35Å
482	L	70.3	Confident	73.3	Confident	136 Å²	136	67.7 Å²	67.7	71%	0.712	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	102.6	169.7	-154.8	99.8	0	0	0	108.2	M487	L482-M487 HydrophobicContact CD1-CG 4.26Å
483	S	52	Low	72.5	Confident	49 Å²	49	72.1 Å²	72.1	34%	0.343	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.6	175.6	67.6	0	0	0	0	110	S481 G485 F486 T488	S481-S483 PolarHBondContact O-N 2.88Å; S483-G485 PolarHBondContact O-N 2.91Å; S483-G485 VanDerWaalsContact O-N 3.11Å; S483-F486 PolarHBondContact N-O 3.16Å; S483-F486 PolarHBondContact O-N 3.28Å; S483-T488 VanDerWaalsContact OG-CG2 3.31Å; S483-T488 WeakPolarHBondContact OG-CG2 3.39Å; S483-T488 PolarHBondContact OG-OG1 3.34Å
484	N	50	Low	72.3	Confident	162 Å²	162	69 Å²	69	87%	0.866	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	35.4	179.5	-63	-15.5	0	0	0	115.1	F486	N484-F486 WeakPolarHBondContact O-CD2 3.38Å; N484-F486 PolarHBondContact O-N 2.87Å
485	G	59.3	Low	72	Confident	63 Å²	63	72 Å²	72	65%	0.649	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	0.8	-178.7	0	0	0	0	0	114.9	S483	S483-G485 PolarHBondContact O-N 2.91Å; S483-G485 VanDerWaalsContact O-N 3.11Å
486	F	57.8	Low	71.2	Confident	154 Å²	154	68.2 Å²	68.2	68%	0.675	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.6	172.6	-63.1	-82.8	0	0	0	110.2	S483 N484	S483-F486 PolarHBondContact N-O 3.16Å; S483-F486 PolarHBondContact O-N 3.28Å; N484-F486 WeakPolarHBondContact O-CD2 3.38Å; N484-F486 PolarHBondContact O-N 2.87Å
487	M	67.5	Low	70.3	Confident	81 Å²	81	72.3 Å²	72.3	40%	0.399	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	130	168.9	-78.9	-168.8	130.6	0	0	109.1	W310 I480 L482	W310-M487 HydrophobicContact CH2-CB 3.95Å; W310-M487 VanDerWaalsContact CH2-O 3.3Å; W310-M487 WeakPolarHBondContact CH2-O 3.39Å; W310-M487 HydrophobicContact CZ2-CB 3.92Å; I480-M487 HydrophobicContact CB-CE 4.37Å; I480-M487 HydrophobicContact CD1-CE 4.38Å; I480-M487 HydrophobicContact CD1-SD 4.47Å; I480-M487 HydrophobicContact CG2-CB 3.55Å; I480-M487 HydrophobicContact CG2-CE 3.76Å; I480-M487 HydrophobicContact CG2-CG 3.71Å; I480-M487 HydrophobicContact CG2-SD 4Å; L482-M487 HydrophobicContact CD1-CG 4.26Å
488	T	72.9	Confident	69.8	Low	45 Å²	45	68.7 Å²	68.7	28%	0.276	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136	178.2	44.3	0	0	0	0	110.7	S481 S483	S481-T488 PolarHBondContact N-O 2.9Å; S481-T488 PolarHBondContact O-N 3.5Å; S481-T488 PolarHBondContact O-OG1 3.43Å; S481-T488 PolarHBondContact OG-O 3.36Å; S481-T488 PolarHBondContact OG-OG1 3.35Å; S483-T488 VanDerWaalsContact OG-CG2 3.31Å; S483-T488 WeakPolarHBondContact OG-CG2 3.39Å; S483-T488 PolarHBondContact OG-OG1 3.34Å
489	P	77.5	Confident	69.9	Low	26 Å²	26	70.1 Å²	70.1	17%	0.169	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	143.7	175.1	25.4	-33.4	0	0	0	110.5	V353 M354 N491	V353-P489 HydrophobicContact CG1-CB 4.44Å; V353-P489 HydrophobicContact CG1-CG 3.93Å; M354-P489 HydrophobicContact SD-CB 3.9Å; P489-N491 PolarHBondContact O-N 3.15Å
490	L	73.7	Confident	69.9	Low	82 Å²	82	80.4 Å²	80.4	43%	0.429	42%	0.423	S	S	.	.	S	Bend	trans	-67.8	-24.6	175.8	-74.1	173.5	0	0	0	112.3	L365 G478 V479 L492	L365-L490 HydrophobicContact CD2-CD1 4.21Å; G478-L490 VanDerWaalsContact O-CD1 3.23Å; G478-L490 WeakPolarHBondContact O-CD1 3.44Å; V479-L490 WeakPolarHBondContact O-CG 3.3Å; V479-L490 PolarHBondContact O-N 3.41Å; L490-L492 PolarHBondContact O-N 2.85Å
491	N	75.6	Confident	69.5	Low	23 Å²	23	81.7 Å²	81.7	12%	0.123	43%	0.433	C	S	.	.			trans	-73.7	116.9	174.8	-178.2	22.8	0	0	0	110.9	V353 G356 P489 N493	V353-N491 WeakPolarHBondContact O-CB 3.48Å; G356-N491 WeakPolarHBondContact CA-ND2 3.05Å; P489-N491 PolarHBondContact O-N 3.15Å; N491-N493 PolarHBondContact ND2-O 3.36Å; N491-N493 PolarHBondContact OD1-N 3.23Å; N491-N493 PolarHBondContact OD1-O 2.86Å; N491-N493 VanDerWaalsContact OD1-O 3.04Å
492	L	69.6	Low	69.5	Low	159 Å²	159	82.8 Å²	82.8	83%	0.832	44%	0.44	S	S	*	.			trans	-95.2	-13.3	178.2	-61.9	174.6	0	0	0	113	L490	L490-L492 PolarHBondContact O-N 2.85Å
493	N	74	Confident	69.6	Low	126 Å²	126	80.3 Å²	80.3	67%	0.674	43%	0.428	S	S	*	.			trans	-118.1	120.3	-171	-70.1	-20.9	0	0	0	111.6	N491	N491-N493 PolarHBondContact ND2-O 3.36Å; N491-N493 PolarHBondContact OD1-N 3.23Å; N491-N493 PolarHBondContact OD1-O 2.86Å; N491-N493 VanDerWaalsContact OD1-O 3.04Å
494	Y	83.3	Confident	70.3	Confident	50 Å²	50	83.4 Å²	83.4	20%	0.196	45%	0.447	C	S	.	.			trans	-98.9	100.9	172.9	-159.6	-97.3	0	0	0	109.3	K352 V353 H496 E548 F552	K352-Y494 HydrophobicContact CB-CE2 4.06Å; K352-Y494 HydrophobicContact CD-CE1 4.42Å; K352-Y494 HydrophobicContact CD-CE2 3.9Å; K352-Y494 WeakPolarHBondContact CD-OH 3.31Å; K352-Y494 VanDerWaalsContact CE-CZ 3.43Å; K352-Y494 WeakPolarHBondContact CE-OH 3.44Å; K352-Y494 HydrophobicContact CG-CD2 4.36Å; K352-Y494 HydrophobicContact CG-CE2 3.62Å; V353-Y494 HydrophobicContact CG2-CD2 4.11Å; V353-Y494 HydrophobicContact CG2-CE2 3.8Å; Y494-H496 WeakPolarHBondContact CD1-O 3.21Å; Y494-H496 WeakPolarHBondContact CE1-O 3.5Å; Y494-H496 PolarHBondContact O-N 3.5Å; Y494-E548 HydrophobicContact CE1-CG 4.23Å; Y494-E548 VanDerWaalsContact OH-CD 3.28Å; Y494-E548 VanDerWaalsContact OH-CG 3.25Å; Y494-E548 WeakPolarHBondContact OH-CG 3.45Å; Y494-E548 PolarHBondContact OH-OE1 3.11Å; Y494-F552 AromaticContact CD1-CE2 3.97Å; Y494-F552 HydrophobicContact CD1-CE2 3.97Å; Y494-F552 HydrophobicContact CD1-CZ 4.17Å; Y494-F552 HydrophobicContact CD2-CE2 4.28Å; Y494-F552 AromaticContact CD2-CZ 3.83Å; Y494-F552 HydrophobicContact CD2-CZ 3.83Å; Y494-F552 HydrophobicContact CE1-CD2 4.36Å; Y494-F552 AromaticContact CE1-CE2 3.59Å; Y494-F552 HydrophobicContact CE1-CE2 3.59Å; Y494-F552 HydrophobicContact CE1-CZ 4.13Å; Y494-F552 AromaticContact CE2-CE2 3.93Å; Y494-F552 HydrophobicContact CE2-CE2 3.93Å; Y494-F552 AromaticContact CE2-CZ 3.79Å; Y494-F552 HydrophobicContact CE2-CZ 3.79Å; Y494-F552 HydrophobicContact CG-CE2 4.28Å; Y494-F552 HydrophobicContact CG-CZ 4.01Å; Y494-F552 AromaticContact CZ-CE2 3.56Å; Y494-F552 AromaticContact CZ-CZ 3.93Å
495	W	81.9	Confident	71.1	Confident	73 Å²	73	86.7 Å²	86.7	28%	0.277	45%	0.447	S	S	.	.	S	Bend	trans	-68.5	-14.9	-167.8	57.4	-96.1	0	0	0	115	K352 G356 L357 D358 L518 P519 F522	K352-W495 HydrophobicContact CD-CZ2 4.1Å; G356-W495 VanDerWaalsContact O-CD1 3.27Å; G356-W495 PolarHBondContact O-NE1 3.35Å; L357-W495 VanDerWaalsContact O-CZ2 3.31Å; L357-W495 WeakPolarHBondContact O-CZ2 3.27Å; L357-W495 PolarHBondContact O-NE1 3.36Å; D358-W495 HydrophobicContact CB-CG 4.24Å; W495-L518 HydrophobicContact CH2-CD2 3.97Å; W495-L518 HydrophobicContact CZ3-CD2 3.81Å; W495-P519 HydrophobicContact CD2-CG 4.16Å; W495-P519 HydrophobicContact CE3-CG 4.16Å; W495-P519 HydrophobicContact CH2-CG 3.76Å; W495-P519 HydrophobicContact CZ2-CG 3.69Å; W495-P519 VanDerWaalsContact CZ3-CD 3.45Å; W495-P519 HydrophobicContact CZ3-CG 3.97Å; W495-F522 HydrophobicContact CH2-CB 4.27Å; W495-F522 HydrophobicContact CH2-CD1 4.04Å; W495-F522 HydrophobicContact CH2-CD2 4.46Å; W495-F522 AromaticContact CH2-CG 3.98Å; W495-F522 HydrophobicContact CH2-CG 3.98Å; W495-F522 HydrophobicContact CZ2-CB 3.96Å; W495-F522 HydrophobicContact CZ2-CD1 4.44Å; W495-F522 HydrophobicContact CZ2-CD2 4.17Å; W495-F522 AromaticContact CZ2-CG 3.92Å; W495-F522 HydrophobicContact CZ2-CG 3.92Å
496	H	68.6	Low	71.3	Confident	15 Å²	15	89.2 Å²	89.2	7%	0.069	45%	0.45	C	S	.	.	S	Bend	trans	-117.2	92.6	177.2	-159.9	-99.2	0	0	0	110.3	Y494 M514 L545 E548	Y494-H496 WeakPolarHBondContact CD1-O 3.21Å; Y494-H496 WeakPolarHBondContact CE1-O 3.5Å; Y494-H496 PolarHBondContact O-N 3.5Å; H496-M514 WeakPolarHBondContact NE2-CE 3.23Å; H496-L545 VanDerWaalsContact CE1-CD2 3.45Å; H496-L545 WeakPolarHBondContact CE1-CD2 3.32Å; H496-E548 IonicContact ND1-OE2 3.44Å; H496-E548 PolarHBondContact ND1-OE2 2.96Å
497	P	64.4	Low	72	Confident	87 Å²	87	83.1 Å²	83.1	57%	0.565	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-59.5	147.2	175.2	25.8	-32.6	0	0	0	109.4	L499	P497-L499 PolarHBondContact O-N 3.47Å
498	P	66.8	Low	72	Confident	18 Å²	18	84 Å²	84	12%	0.117	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-61.6	118.3	-174.9	-3.3	11.9	0	0	0	109	R500 E548 R549 F552 I554	P498-R500 PolarHBondContact O-N 3.18Å; P498-E548 HydrophobicContact CB-CB 4.2Å; P498-R549 HydrophobicContact CB-CB 4.46Å; P498-R549 HydrophobicContact CB-CG 3.86Å; P498-F552 HydrophobicContact CG-CB 3.64Å; P498-F552 HydrophobicContact CG-CD2 4.03Å; P498-F552 HydrophobicContact CG-CG 4.23Å; P498-I554 HydrophobicContact CB-CB 4.44Å; P498-I554 HydrophobicContact CB-CD1 3.7Å; P498-I554 HydrophobicContact CB-CG1 4.2Å; P498-I554 HydrophobicContact CG-CD1 3.52Å; P498-I554 HydrophobicContact CG-CG1 3.95Å; P498-I554 WeakPolarHBondContact O-CD1 3.19Å
499	L	73.9	Confident	72.1	Confident	60 Å²	60	83.4 Å²	83.4	31%	0.314	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-64.5	139.3	-178.8	-65.6	176.3	0	0	0	109.4	P497 M514 L545 R549	P497-L499 PolarHBondContact O-N 3.47Å; L499-M514 HydrophobicContact CD1-CE 3.97Å; L499-M514 HydrophobicContact CD1-SD 3.88Å; L499-L545 HydrophobicContact CD1-CD1 4.2Å; L499-L545 HydrophobicContact CD1-CD2 4.29Å; L499-R549 WeakPolarHBondContact O-CD 3.49Å; L499-R549 PolarHBondContact O-NH1 3.11Å
500	R	74.1	Confident	72.3	Confident	221 Å²	221	85.9 Å²	85.9	83%	0.834	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-58.4	142.6	173.1	-70.3	-173.3	-178.1	-176.6	2.2	109.2	P498 C502	P498-R500 PolarHBondContact O-N 3.18Å; R500-C502 PolarHBondContact O-N 3.12Å
501	P	70.9	Confident	72.9	Confident	47 Å²	47	82.3 Å²	82.3	31%	0.305	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-60.9	131.5	177.9	25.2	-33.3	0	0	0	110.2	T556 P557	P501-T556 HydrophobicContact CB-CG2 4.36Å; P501-T556 HydrophobicContact CG-CG2 4.19Å; P501-P557 HydrophobicContact CG-CG 4.49Å
502	C	75.2	Confident	73.4	Confident	62 Å²	62	85.2 Å²	85.2	42%	0.419	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-83.1	159	169.5	61.1	0	0	0	0	110.2	R500 P504 C507	R500-C502 PolarHBondContact O-N 3.12Å; C502-P504 VanDerWaalsContact O-CD 3.28Å; C502-P504 WeakPolarHBondContact O-CD 3.48Å; C502-C507 HydrophobicContact CB-CB 3.85Å
503	N	73.3	Confident	74.2	Confident	84 Å²	84	81.7 Å²	81.7	45%	0.449	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-74.8	116.6	174.2	179.7	-3.8	0	0	0	109.3	R505 T506 C507	N503-R505 PolarHBondContact O-N 2.79Å; N503-R505 VanDerWaalsContact O-N 3.07Å; N503-R505 WeakPolarHBondContact OD1-CB 3.43Å; N503-R505 PolarHBondContact OD1-N 3.13Å; N503-T506 PolarHBondContact O-N 3.02Å; N503-T506 PolarHBondContact O-OG1 2.94Å; N503-C507 WeakPolarHBondContact O-CB 3.39Å; N503-C507 PolarHBondContact O-N 2.94Å
504	P	67.1	Low	74.8	Confident	114 Å²	114	77.3 Å²	77.3	74%	0.74	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-10.5	-176.7	27.1	-34.8	0	0	0	113.7	C502	C502-P504 VanDerWaalsContact O-CD 3.28Å; C502-P504 WeakPolarHBondContact O-CD 3.48Å
505	R	65.3	Low	75.1	Confident	230 Å²	230	77.8 Å²	77.8	87%	0.868	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-22.2	173.5	-64.2	-175.5	-179.3	176.5	0.5	113.4	N503	N503-R505 PolarHBondContact O-N 2.79Å; N503-R505 VanDerWaalsContact O-N 3.07Å; N503-R505 WeakPolarHBondContact OD1-CB 3.43Å; N503-R505 PolarHBondContact OD1-N 3.13Å
506	T	64.5	Low	75.5	Confident	117 Å²	117	78.3 Å²	78.3	72%	0.718	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-6	-173.1	58.5	0	0	0	0	112.7	N503	N503-T506 PolarHBondContact O-N 3.02Å; N503-T506 PolarHBondContact O-OG1 2.94Å
507	C	71.1	Confident	76.5	Confident	26 Å²	26	83 Å²	83	18%	0.176	47%	0.465	C	S	.	.			trans	-129.9	127.2	-180	-179.8	0	0	0	0	109.6	C502 N503 H510	C502-C507 HydrophobicContact CB-CB 3.85Å; N503-C507 WeakPolarHBondContact O-CB 3.39Å; N503-C507 PolarHBondContact O-N 2.94Å; C507-H510 VanDerWaalsContact SG-CD2 3.55Å; C507-H510 PolarHBondContact SG-CE1 3.34Å; C507-H510 PolarHBondContact SG-NE2 3.06Å
508	A	68.1	Low	77.8	Confident	99 Å²	99	79.2 Å²	79.2	82%	0.818	44%	0.44	S	S	*	.			trans	-90.7	-69.6	-179.5	0	0	0	0	0	111.9
509	S	75.6	Confident	79.2	Confident	33 Å²	33	79.2 Å²	79.2	23%	0.231	44%	0.44	C	S	.	.			trans	-151.6	139.9	172.9	179.7	0	0	0	0	109.7	Y511	S509-Y511 PolarHBondContact OG-N 2.76Å
510	H	81.3	Confident	80.1	Confident	77 Å²	77	83 Å²	83	36%	0.356	45%	0.45	S	S	.	.	S	Bend	trans	-92.3	-11.8	175.3	-67.9	-65.4	0	0	0	113	C507 S513 M514	C507-H510 VanDerWaalsContact SG-CD2 3.55Å; C507-H510 PolarHBondContact SG-CE1 3.34Å; C507-H510 PolarHBondContact SG-NE2 3.06Å; H510-S513 PolarHBondContact O-N 3.02Å; H510-S513 PolarHBondContact O-OG 3.34Å; H510-M514 HydrophobicContact CB-CG 4.42Å; H510-M514 HydrophobicContact CB-SD 4Å; H510-M514 WeakPolarHBondContact O-CB 3.33Å; H510-M514 WeakPolarHBondContact O-CG 3.41Å; H510-M514 PolarHBondContact O-N 3.36Å; H510-M514 VanDerWaalsContact O-N 3.09Å
511	Y	86.4	Confident	81.1	Confident	8 Å²	8	72.6 Å²	72.6	3%	0.031	41%	0.411	C	S	.	.	H	α-helix	trans	-56.2	-48.4	-173.9	178.7	-96.3	0	0	0	113.1	S509 S513 M514 E515 L518 L526 A537 W538 F541	S509-Y511 PolarHBondContact OG-N 2.76Å; Y511-S513 PolarHBondContact O-N 3.19Å; Y511-S513 VanDerWaalsContact O-N 3.17Å; Y511-M514 CarbonylContact O-C 3.59Å; Y511-M514 PolarHBondContact O-N 2.93Å; Y511-E515 HydrophobicContact CD1-CB 4.46Å; Y511-E515 HydrophobicContact CE1-CB 4.03Å; Y511-E515 HydrophobicContact CE1-CG 4.16Å; Y511-E515 WeakPolarHBondContact CE1-OE2 3.45Å; Y511-E515 HydrophobicContact CE2-CB 4.33Å; Y511-E515 WeakPolarHBondContact O-CB 3.44Å; Y511-E515 PolarHBondContact O-N 3.12Å; Y511-E515 VanDerWaalsContact OH-CD 3.28Å; Y511-E515 PolarHBondContact OH-OE1 2.93Å; Y511-L518 HydrophobicContact CD2-CD1 4.42Å; Y511-L518 HydrophobicContact CE2-CD1 4.19Å; Y511-L526 HydrophobicContact CD2-CD2 4.11Å; Y511-L526 HydrophobicContact CE2-CD2 3.31Å; Y511-A537 HydrophobicContact CE1-CB 4.1Å; Y511-W538 HydrophobicContact CD1-CB 3.71Å; Y511-W538 HydrophobicContact CG-CB 3.78Å; Y511-F541 HydrophobicContact CD2-CB 3.75Å; Y511-F541 AromaticContact CD2-CD1 3.73Å; Y511-F541 HydrophobicContact CD2-CD1 3.73Å; Y511-F541 HydrophobicContact CD2-CD2 4.11Å; Y511-F541 HydrophobicContact CD2-CE1 4.32Å; Y511-F541 AromaticContact CD2-CG 3.59Å; Y511-F541 HydrophobicContact CD2-CG 3.59Å; Y511-F541 HydrophobicContact CE2-CB 4.36Å; Y511-F541 HydrophobicContact CE2-CG 4.34Å; Y511-F541 HydrophobicContact CG-CB 4.42Å; Y511-F541 HydrophobicContact CG-CD1 4.3Å; Y511-F541 HydrophobicContact CG-CG 4.45Å
512	P	86.9	Confident	82.3	Confident	84 Å²	84	70.4 Å²	70.4	55%	0.545	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-32.6	-177.8	-24	35.2	0	0	0	113.8
513	S	86.1	Confident	83.2	Confident	84 Å²	84	67.7 Å²	67.7	59%	0.587	38%	0.379	S	S	*	.	H	α-helix	trans	-77.9	-25.9	176	55.2	0	0	0	0	113.5	H510 Y511	H510-S513 PolarHBondContact O-N 3.02Å; H510-S513 PolarHBondContact O-OG 3.34Å; Y511-S513 PolarHBondContact O-N 3.19Å; Y511-S513 VanDerWaalsContact O-N 3.17Å
514	M	86	Confident	84.4	Confident	34 Å²	34	64.3 Å²	64.3	17%	0.167	36%	0.36	C	S	.	.	H	α-helix	trans	-94.4	-30	-176.4	-71.1	-172.8	58.6	0	0	113.1	H496 L499 H510 Y511 P516 T517 L518 F541	H496-M514 WeakPolarHBondContact NE2-CE 3.23Å; L499-M514 HydrophobicContact CD1-CE 3.97Å; L499-M514 HydrophobicContact CD1-SD 3.88Å; H510-M514 HydrophobicContact CB-CG 4.42Å; H510-M514 HydrophobicContact CB-SD 4Å; H510-M514 WeakPolarHBondContact O-CB 3.33Å; H510-M514 WeakPolarHBondContact O-CG 3.41Å; H510-M514 PolarHBondContact O-N 3.36Å; H510-M514 VanDerWaalsContact O-N 3.09Å; Y511-M514 CarbonylContact O-C 3.59Å; Y511-M514 PolarHBondContact O-N 2.93Å; M514-P516 VanDerWaalsContact C-N 3.26Å; M514-P516 VanDerWaalsContact O-N 3.13Å; M514-T517 WeakPolarHBondContact O-CA 3.46Å; M514-T517 PolarHBondContact O-N 3.4Å; M514-T517 PolarHBondContact O-OG1 3.25Å; M514-L518 HydrophobicContact CB-CD1 4.46Å; M514-L518 HydrophobicContact CB-CG 4.49Å; M514-L518 HydrophobicContact CE-CD2 4.27Å; M514-L518 WeakPolarHBondContact O-CG 3.44Å; M514-L518 PolarHBondContact O-N 3.36Å; M514-L518 VanDerWaalsContact O-N 3.16Å; M514-F541 HydrophobicContact CE-CZ 4.07Å; M514-F541 HydrophobicContact SD-CE1 4.31Å; M514-F541 HydrophobicContact SD-CZ 4.43Å
515	E	90.2	Very high	85.8	Confident	60 Å²	60	58.9 Å²	58.9	28%	0.28	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-48.1	-39.3	-179	176.4	172.7	-143.3	0	0	114.1	Y511 T517 L518	Y511-E515 HydrophobicContact CD1-CB 4.46Å; Y511-E515 HydrophobicContact CE1-CB 4.03Å; Y511-E515 HydrophobicContact CE1-CG 4.16Å; Y511-E515 WeakPolarHBondContact CE1-OE2 3.45Å; Y511-E515 HydrophobicContact CE2-CB 4.33Å; Y511-E515 WeakPolarHBondContact O-CB 3.44Å; Y511-E515 PolarHBondContact O-N 3.12Å; Y511-E515 VanDerWaalsContact OH-CD 3.28Å; Y511-E515 PolarHBondContact OH-OE1 2.93Å; E515-T517 VanDerWaalsContact C-N 3.26Å; E515-T517 PolarHBondContact O-N 2.97Å; E515-L518 PolarHBondContact O-N 3.07Å
516	P	90.5	Very high	87.3	Confident	84 Å²	84	48 Å²	48	55%	0.545	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-64.1	-28.1	176.1	-23.8	35.6	0	0	0	114.3	M514 R520	M514-P516 VanDerWaalsContact C-N 3.26Å; M514-P516 VanDerWaalsContact O-N 3.13Å; P516-R520 PolarHBondContact O-NH2 2.55Å; P516-R520 VanDerWaalsContact O-NH2 3.11Å
517	T	90	Very high	88.8	Confident	115 Å²	115	46.4 Å²	46.4	71%	0.706	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-97.1	-8.9	-176.4	66	0	0	0	0	113.5	M514 E515	M514-T517 WeakPolarHBondContact O-CA 3.46Å; M514-T517 PolarHBondContact O-N 3.4Å; M514-T517 PolarHBondContact O-OG1 3.25Å; E515-T517 VanDerWaalsContact C-N 3.26Å; E515-T517 PolarHBondContact O-N 2.97Å
518	L	91.8	Very high	90.1	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	26%	0.259	C	S	.	.	S	Bend	trans	-80.4	147.1	179.5	-68.2	174.2	0	0	0	110.8	W495 Y511 M514 E515 F522 V523 F541	W495-L518 HydrophobicContact CH2-CD2 3.97Å; W495-L518 HydrophobicContact CZ3-CD2 3.81Å; Y511-L518 HydrophobicContact CD2-CD1 4.42Å; Y511-L518 HydrophobicContact CE2-CD1 4.19Å; M514-L518 HydrophobicContact CB-CD1 4.46Å; M514-L518 HydrophobicContact CB-CG 4.49Å; M514-L518 HydrophobicContact CE-CD2 4.27Å; M514-L518 WeakPolarHBondContact O-CG 3.44Å; M514-L518 PolarHBondContact O-N 3.36Å; M514-L518 VanDerWaalsContact O-N 3.16Å; E515-L518 PolarHBondContact O-N 3.07Å; L518-F522 HydrophobicContact CB-CD1 4.41Å; L518-F522 HydrophobicContact CD1-CD1 4.25Å; L518-F522 HydrophobicContact CD1-CE1 4.06Å; L518-V523 HydrophobicContact CB-CG2 3.71Å; L518-V523 HydrophobicContact CD1-CG2 4.39Å; L518-F541 HydrophobicContact CD1-CE2 3.95Å; L518-F541 HydrophobicContact CD1-CZ 4.17Å
519	P	94.3	Very high	91.5	Very high	17 Å²	17	40.4 Å²	40.4	11%	0.11	22%	0.22	C	C	.	.			trans	-55.8	142	171.8	-25.4	35.7	0	0	0	112.3	L357 D359 W495 F522 V523	L357-P519 VanDerWaalsContact O-CB 3.28Å; L357-P519 WeakPolarHBondContact O-CB 3.46Å; L357-P519 WeakPolarHBondContact O-CG 3.39Å; D359-P519 VanDerWaalsContact OD2-CA 3.24Å; D359-P519 WeakPolarHBondContact OD2-CA 3.29Å; W495-P519 HydrophobicContact CD2-CG 4.16Å; W495-P519 HydrophobicContact CE3-CG 4.16Å; W495-P519 HydrophobicContact CH2-CG 3.76Å; W495-P519 HydrophobicContact CZ2-CG 3.69Å; W495-P519 VanDerWaalsContact CZ3-CD 3.45Å; W495-P519 HydrophobicContact CZ3-CG 3.97Å; P519-F522 HydrophobicContact CB-CB 4.25Å; P519-F522 PolarHBondContact O-N 3.46Å; P519-V523 WeakPolarHBondContact O-CG2 3.49Å; P519-V523 PolarHBondContact O-N 3.31Å
520	R	94.6	Very high	92.6	Very high	140 Å²	140	39.8 Å²	39.8	53%	0.528	22%	0.216	S	C	.	.	H	α-helix	trans	-70.8	-35.6	-175.8	-61.4	-63.4	166.6	-155.4	-11.3	112.2	D359 P516 F522 V523 W524	D359-R520 VanDerWaalsContact CG-N 3.25Å; D359-R520 PolarHBondContact OD1-N 3.47Å; D359-R520 PolarHBondContact OD2-N 3.31Å; P516-R520 PolarHBondContact O-NH2 2.55Å; P516-R520 VanDerWaalsContact O-NH2 3.11Å; R520-F522 VanDerWaalsContact C-N 3.31Å; R520-F522 PolarHBondContact O-N 2.83Å; R520-V523 PolarHBondContact O-N 3.28Å; R520-W524 WeakPolarHBondContact O-CB 3.05Å; R520-W524 PolarHBondContact O-N 3.34Å
521	S	94.1	Very high	93.3	Very high	3 Å²	3	37 Å²	37	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-39.6	172.7	63.1	0	0	0	0	112.1	L357 D359 E362 L525	L357-S521 WeakPolarHBondContact CA-OG 3.33Å; D359-S521 PolarHBondContact OD1-N 3.32Å; D359-S521 PolarHBondContact OD1-OG 3.23Å; E362-S521 WeakPolarHBondContact OE1-CB 3.21Å; E362-S521 PolarHBondContact OE1-OG 2.95Å; S521-L525 WeakPolarHBondContact O-CB 3.39Å; S521-L525 PolarHBondContact O-N 3.33Å
522	F	95.3	Very high	93.7	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.6	-48.4	174.8	175.8	-100.3	0	0	0	112.4	I348 K352 L357 W495 L518 P519 R520 W524 L525 L526 F541 V544	I348-F522 HydrophobicContact CG2-CD2 4.3Å; I348-F522 HydrophobicContact CG2-CE2 3.63Å; I348-F522 HydrophobicContact CG2-CZ 4.49Å; K352-F522 HydrophobicContact CD-CD2 4.27Å; K352-F522 HydrophobicContact CD-CE2 4.22Å; L357-F522 HydrophobicContact CB-CB 4.17Å; L357-F522 HydrophobicContact CD1-CD2 4.12Å; W495-F522 HydrophobicContact CH2-CB 4.27Å; W495-F522 HydrophobicContact CH2-CD1 4.04Å; W495-F522 HydrophobicContact CH2-CD2 4.46Å; W495-F522 AromaticContact CH2-CG 3.98Å; W495-F522 HydrophobicContact CH2-CG 3.98Å; W495-F522 HydrophobicContact CZ2-CB 3.96Å; W495-F522 HydrophobicContact CZ2-CD1 4.44Å; W495-F522 HydrophobicContact CZ2-CD2 4.17Å; W495-F522 AromaticContact CZ2-CG 3.92Å; W495-F522 HydrophobicContact CZ2-CG 3.92Å; L518-F522 HydrophobicContact CB-CD1 4.41Å; L518-F522 HydrophobicContact CD1-CD1 4.25Å; L518-F522 HydrophobicContact CD1-CE1 4.06Å; P519-F522 HydrophobicContact CB-CB 4.25Å; P519-F522 PolarHBondContact O-N 3.46Å; R520-F522 VanDerWaalsContact C-N 3.31Å; R520-F522 PolarHBondContact O-N 2.83Å; F522-W524 VanDerWaalsContact C-N 3.28Å; F522-W524 PolarHBondContact O-N 3.48Å; F522-L525 PolarHBondContact O-N 3.28Å; F522-L526 WeakPolarHBondContact O-CB 3.06Å; F522-L526 PolarHBondContact O-N 2.83Å; F522-F541 AromaticContact CE1-CD2 3.83Å; F522-F541 HydrophobicContact CE1-CD2 3.83Å; F522-F541 AromaticContact CE1-CE2 3.7Å; F522-F541 HydrophobicContact CE1-CE2 3.7Å; F522-F541 AromaticContact CZ-CD2 3.9Å; F522-F541 HydrophobicContact CZ-CD2 3.9Å; F522-F541 AromaticContact CZ-CE2 3.91Å; F522-F541 HydrophobicContact CZ-CE2 3.91Å; F522-V544 HydrophobicContact CE2-CG1 4.47Å; F522-V544 HydrophobicContact CZ-CG1 4.35Å
523	V	95.9	Very high	94.1	Very high	6 Å²	6	33.2 Å²	33.2	4%	0.036	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-41.8	177.8	171.4	0	0	0	0	110.7	L518 P519 R520 L526 Q527	L518-V523 HydrophobicContact CB-CG2 3.71Å; L518-V523 HydrophobicContact CD1-CG2 4.39Å; P519-V523 WeakPolarHBondContact O-CG2 3.49Å; P519-V523 PolarHBondContact O-N 3.31Å; R520-V523 PolarHBondContact O-N 3.28Å; V523-L526 WeakPolarHBondContact O-CB 3.37Å; V523-L526 PolarHBondContact O-N 3.01Å; V523-Q527 HydrophobicContact CG1-CG 4.49Å; V523-Q527 VanDerWaalsContact O-CG 3.29Å; V523-Q527 WeakPolarHBondContact O-CG 3.37Å; V523-Q527 PolarHBondContact O-N 2.99Å
524	W	97.1	Very high	94.5	Very high	13 Å²	13	31.1 Å²	31.1	5%	0.049	16%	0.16	C	C	.	.	H	α-helix	trans	-61.8	-45	176	174.1	84.3	0	0	0	112.3	W384 Y385 V388 Q389 R520 F522 L526 Q527 L528	W384-W524 HydrophobicContact CE3-CH2 4.4Å; W384-W524 HydrophobicContact CE3-CZ3 4.29Å; W384-W524 AromaticContact CH2-CH2 3.81Å; W384-W524 HydrophobicContact CH2-CH2 3.81Å; W384-W524 AromaticContact CH2-CZ3 3.4Å; W384-W524 HydrophobicContact CH2-CZ3 3.4Å; W384-W524 HydrophobicContact CZ2-CH2 4.14Å; W384-W524 HydrophobicContact CZ2-CZ3 4.16Å; W384-W524 AromaticContact CZ3-CH2 3.91Å; W384-W524 HydrophobicContact CZ3-CH2 3.91Å; W384-W524 AromaticContact CZ3-CZ3 3.44Å; W384-W524 HydrophobicContact CZ3-CZ3 3.44Å; W384-W524 VanDerWaalsContact CZ3-CZ3 3.44Å; Y385-W524 AromaticContact CD2-CD2 3.6Å; Y385-W524 HydrophobicContact CD2-CD2 3.6Å; Y385-W524 AromaticContact CD2-CE2 3.63Å; Y385-W524 AromaticContact CD2-CE3 3.71Å; Y385-W524 HydrophobicContact CD2-CE3 3.71Å; Y385-W524 HydrophobicContact CD2-CG 4.24Å; Y385-W524 AromaticContact CD2-CH2 3.91Å; Y385-W524 HydrophobicContact CD2-CH2 3.91Å; Y385-W524 AromaticContact CD2-CZ2 3.79Å; Y385-W524 HydrophobicContact CD2-CZ2 3.79Å; Y385-W524 AromaticContact CD2-CZ3 3.87Å; Y385-W524 HydrophobicContact CD2-CZ3 3.87Å; Y385-W524 HydrophobicContact CE2-CB 4.33Å; Y385-W524 AromaticContact CE2-CD1 3.69Å; Y385-W524 AromaticContact CE2-CD2 3.4Å; Y385-W524 HydrophobicContact CE2-CD2 3.4Å; Y385-W524 VanDerWaalsContact CE2-CD2 3.4Å; Y385-W524 AromaticContact CE2-CE2 3.48Å; Y385-W524 VanDerWaalsContact CE2-CE2 3.48Å; Y385-W524 AromaticContact CE2-CE3 3.96Å; Y385-W524 HydrophobicContact CE2-CE3 3.96Å; Y385-W524 AromaticContact CE2-CG 3.55Å; Y385-W524 HydrophobicContact CE2-CG 3.55Å; Y385-W524 HydrophobicContact CE2-CZ2 4.1Å; Y385-W524 AromaticContact CE2-NE1 3.63Å; V388-W524 HydrophobicContact CB-CH2 4.18Å; V388-W524 HydrophobicContact CB-CZ2 4.27Å; V388-W524 HydrophobicContact CG1-CH2 4.03Å; V388-W524 HydrophobicContact CG1-CZ2 4.06Å; Q389-W524 HydrophobicContact CB-CZ2 4.31Å; R520-W524 WeakPolarHBondContact O-CB 3.05Å; R520-W524 PolarHBondContact O-N 3.34Å; F522-W524 VanDerWaalsContact C-N 3.28Å; F522-W524 PolarHBondContact O-N 3.48Å; W524-L526 VanDerWaalsContact C-N 3.29Å; W524-L526 PolarHBondContact O-N 3.44Å; W524-Q527 WeakPolarHBondContact O-CB 3.46Å; W524-Q527 PolarHBondContact O-N 2.75Å; W524-Q527 VanDerWaalsContact O-N 3.12Å; W524-L528 HydrophobicContact CH2-CD2 4.03Å; W524-L528 HydrophobicContact CZ3-CD2 4.38Å; W524-L528 PolarHBondContact O-N 2.83Å
525	L	97.2	Very high	95	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-40.2	177.4	-177.6	59.8	0	0	0	111.8	I348 I351 L357 W384 S521 F522 Q527 L528 F529	I348-L525 HydrophobicContact CG1-CD2 4.21Å; I348-L525 HydrophobicContact CG1-CG 4.23Å; I348-L525 HydrophobicContact CG2-CD2 4.38Å; I351-L525 HydrophobicContact CB-CD2 4.11Å; I351-L525 HydrophobicContact CD1-CD1 4.24Å; I351-L525 HydrophobicContact CD1-CD2 3.83Å; I351-L525 HydrophobicContact CG2-CD2 4.01Å; L357-L525 HydrophobicContact CD1-CD2 3.53Å; W384-L525 HydrophobicContact CH2-CD1 3.79Å; W384-L525 HydrophobicContact CZ2-CD1 4.46Å; S521-L525 WeakPolarHBondContact O-CB 3.39Å; S521-L525 PolarHBondContact O-N 3.33Å; F522-L525 PolarHBondContact O-N 3.28Å; L525-Q527 VanDerWaalsContact C-N 3.32Å; L525-L528 HydrophobicContact CD1-CD2 4.26Å; L525-L528 WeakPolarHBondContact O-CB 3.31Å; L525-L528 PolarHBondContact O-N 3.44Å; L525-F529 HydrophobicContact CD1-CD2 3.89Å; L525-F529 HydrophobicContact CD1-CE2 3.59Å; L525-F529 HydrophobicContact CG-CD2 4.18Å; L525-F529 HydrophobicContact CG-CE2 4.17Å; L525-F529 WeakPolarHBondContact O-CD2 3.18Å; L525-F529 PolarHBondContact O-N 3.11Å; L525-F529 VanDerWaalsContact O-N 3.16Å
526	L	96.6	Very high	95.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.8	-41.6	174.4	-174.5	73.8	0	0	0	111.3	I348 Y511 F522 V523 W524 S530 A537 L540 F541	I348-L526 HydrophobicContact CD1-CD1 4.19Å; Y511-L526 HydrophobicContact CD2-CD2 4.11Å; Y511-L526 HydrophobicContact CE2-CD2 3.31Å; F522-L526 WeakPolarHBondContact O-CB 3.06Å; F522-L526 PolarHBondContact O-N 2.83Å; V523-L526 WeakPolarHBondContact O-CB 3.37Å; V523-L526 PolarHBondContact O-N 3.01Å; W524-L526 VanDerWaalsContact C-N 3.29Å; W524-L526 PolarHBondContact O-N 3.44Å; L526-S530 WeakPolarHBondContact O-CB 3.23Å; L526-S530 PolarHBondContact O-N 3.38Å; L526-A537 HydrophobicContact CD2-CB 3.99Å; L526-A537 HydrophobicContact CG-CB 4.24Å; L526-L540 HydrophobicContact CD1-CB 3.92Å; L526-L540 HydrophobicContact CD1-CD2 3.79Å; L526-L540 HydrophobicContact CD1-CG 3.66Å; L526-F541 HydrophobicContact CD1-CB 4.25Å; L526-F541 HydrophobicContact CD2-CB 3.95Å; L526-F541 HydrophobicContact CD2-CD2 4.38Å
527	Q	96.9	Very high	95.3	Very high	84 Å²	84	28.2 Å²	28.2	39%	0.393	14%	0.143	S	C	.	.	H	α-helix	trans	-65.2	-38.2	175.9	-72.9	171.7	-6.5	0	0	112.5	V523 W524 L525 S530 F531	V523-Q527 HydrophobicContact CG1-CG 4.49Å; V523-Q527 VanDerWaalsContact O-CG 3.29Å; V523-Q527 WeakPolarHBondContact O-CG 3.37Å; V523-Q527 PolarHBondContact O-N 2.99Å; W524-Q527 WeakPolarHBondContact O-CB 3.46Å; W524-Q527 PolarHBondContact O-N 2.75Å; W524-Q527 VanDerWaalsContact O-N 3.12Å; L525-Q527 VanDerWaalsContact C-N 3.32Å; Q527-S530 PolarHBondContact O-N 2.93Å; Q527-F531 WeakPolarHBondContact O-CB 3.47Å; Q527-F531 PolarHBondContact O-N 3.49Å
528	L	97.6	Very high	95.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.6	-55.1	174.4	173.8	63.3	0	0	0	111.1	A301 W384 V388 L392 F458 W524 L525 S530 F531 M532	A301-L528 HydrophobicContact CB-CD2 4.37Å; W384-L528 HydrophobicContact CZ2-CD2 4.24Å; V388-L528 HydrophobicContact CG1-CD1 3.76Å; V388-L528 HydrophobicContact CG1-CD2 3.74Å; V388-L528 HydrophobicContact CG1-CG 4.41Å; L392-L528 HydrophobicContact CD1-CD1 4.19Å; L392-L528 HydrophobicContact CD2-CD1 4.28Å; F458-L528 HydrophobicContact CE2-CD1 4.07Å; F458-L528 HydrophobicContact CZ-CD1 4.25Å; W524-L528 HydrophobicContact CH2-CD2 4.03Å; W524-L528 HydrophobicContact CZ3-CD2 4.38Å; W524-L528 PolarHBondContact O-N 2.83Å; L525-L528 HydrophobicContact CD1-CD2 4.26Å; L525-L528 WeakPolarHBondContact O-CB 3.31Å; L525-L528 PolarHBondContact O-N 3.44Å; L528-S530 VanDerWaalsContact C-N 3.33Å; L528-S530 PolarHBondContact O-N 2.93Å; L528-F531 WeakPolarHBondContact O-CB 3.49Å; L528-F531 PolarHBondContact O-N 2.96Å; L528-M532 HydrophobicContact CD1-CG 4.4Å; L528-M532 HydrophobicContact CD1-SD 4.12Å; L528-M532 HydrophobicContact CG-SD 3.99Å; L528-M532 VanDerWaalsContact O-CG 3.32Å; L528-M532 WeakPolarHBondContact O-CG 3.34Å; L528-M532 PolarHBondContact O-N 2.85Å
529	F	97.8	Very high	95.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-68.1	-32.9	179.2	-78.6	-70.9	0	0	0	112.8	A301 A344 I347 I348 L525 F531 M532 L533 L540	A301-F529 HydrophobicContact CB-CE1 4.36Å; A301-F529 HydrophobicContact CB-CZ 4.07Å; A344-F529 HydrophobicContact CB-CB 4.38Å; A344-F529 HydrophobicContact CB-CD1 3.96Å; A344-F529 HydrophobicContact CB-CG 4.25Å; I347-F529 HydrophobicContact CB-CZ 4.17Å; I347-F529 HydrophobicContact CD1-CE1 4.19Å; I347-F529 HydrophobicContact CD1-CZ 4.21Å; I347-F529 HydrophobicContact CG2-CE2 3.97Å; I347-F529 HydrophobicContact CG2-CZ 3.59Å; I348-F529 HydrophobicContact CD1-CB 4.32Å; I348-F529 HydrophobicContact CD1-CD2 3.92Å; I348-F529 HydrophobicContact CD1-CG 4.35Å; I348-F529 HydrophobicContact CG1-CD2 3.71Å; I348-F529 HydrophobicContact CG1-CE2 4.05Å; L525-F529 HydrophobicContact CD1-CD2 3.89Å; L525-F529 HydrophobicContact CD1-CE2 3.59Å; L525-F529 HydrophobicContact CG-CD2 4.18Å; L525-F529 HydrophobicContact CG-CE2 4.17Å; L525-F529 WeakPolarHBondContact O-CD2 3.18Å; L525-F529 PolarHBondContact O-N 3.11Å; L525-F529 VanDerWaalsContact O-N 3.16Å; F529-F531 VanDerWaalsContact C-N 3.32Å; F529-F531 PolarHBondContact O-N 3.27Å; F529-M532 HydrophobicContact CD1-CE 4.46Å; F529-M532 HydrophobicContact CD1-SD 3.94Å; F529-M532 HydrophobicContact CE1-CE 4.29Å; F529-M532 HydrophobicContact CE1-SD 4.09Å; F529-M532 PolarHBondContact O-N 2.93Å; F529-L533 WeakPolarHBondContact O-CB 3.25Å; F529-L533 WeakPolarHBondContact O-CG 3.11Å; F529-L533 PolarHBondContact O-N 3.32Å; F529-L540 HydrophobicContact CB-CD2 3.5Å; F529-L540 VanDerWaalsContact CB-CD2 3.5Å
530	S	97.1	Very high	95.4	Very high	20 Å²	20	25 Å²	25	14%	0.14	12%	0.115	C	C	.	.	H	α-helix	trans	-59.3	-42.5	171	164.9	0	0	0	0	111.5	L526 Q527 L528 D534 V535 A537	L526-S530 WeakPolarHBondContact O-CB 3.23Å; L526-S530 PolarHBondContact O-N 3.38Å; Q527-S530 PolarHBondContact O-N 2.93Å; L528-S530 VanDerWaalsContact C-N 3.33Å; L528-S530 PolarHBondContact O-N 2.93Å; S530-D534 WeakPolarHBondContact O-CA 3.39Å; S530-D534 PolarHBondContact O-N 3.01Å; S530-V535 WeakPolarHBondContact CB-O 3.48Å; S530-V535 PolarHBondContact O-N 2.85Å; S530-V535 PolarHBondContact OG-O 3.04Å; S530-A537 PolarHBondContact OG-N 2.82Å
531	F	96.4	Very high	95.4	Very high	19 Å²	19	18.3 Å²	18.3	8%	0.083	9%	0.09	C	C	.	.	H	α-helix	trans	-68	-43.1	175.1	174.4	-93.7	0	0	0	112.8	L392 A395 Q396 R399 F458 Q527 L528 F529 D534	L392-F531 HydrophobicContact CD1-CB 3.88Å; L392-F531 HydrophobicContact CD1-CD1 3.41Å; L392-F531 VanDerWaalsContact CD1-CD1 3.41Å; L392-F531 HydrophobicContact CD1-CD2 4.2Å; L392-F531 HydrophobicContact CD1-CE1 3.96Å; L392-F531 HydrophobicContact CD1-CG 3.55Å; A395-F531 HydrophobicContact CB-CE1 3.8Å; A395-F531 HydrophobicContact CB-CZ 3.67Å; Q396-F531 HydrophobicContact CB-CE2 4.27Å; Q396-F531 HydrophobicContact CG-CD2 3.68Å; Q396-F531 HydrophobicContact CG-CE2 3.44Å; Q396-F531 VanDerWaalsContact CG-CE2 3.44Å; Q396-F531 HydrophobicContact CG-CZ 4.18Å; R399-F531 VanDerWaalsContact CZ-CZ 3.4Å; R399-F531 VanDerWaalsContact NH1-CD2 3.26Å; R399-F531 VanDerWaalsContact NH1-CE2 3.27Å; R399-F531 PolarHBondContact NH1-O 3.03Å; R399-F531 VanDerWaalsContact NH2-CZ 3.32Å; R399-F531 PolarHBondContact NH2-O 3.28Å; R399-F531 VanDerWaalsContact NH2-O 3.13Å; F458-F531 HydrophobicContact CZ-CD1 4.23Å; F458-F531 HydrophobicContact CZ-CE1 4.06Å; Q527-F531 WeakPolarHBondContact O-CB 3.47Å; Q527-F531 PolarHBondContact O-N 3.49Å; L528-F531 WeakPolarHBondContact O-CB 3.49Å; L528-F531 PolarHBondContact O-N 2.96Å; F529-F531 VanDerWaalsContact C-N 3.32Å; F529-F531 PolarHBondContact O-N 3.27Å; F531-D534 PolarHBondContact O-N 2.78Å
532	M	95.5	Very high	95.2	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.03	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-43.9	-178.9	-70.1	168.1	70.4	0	0	112.1	D300 A301 Q457 F458 L528 F529	D300-M532 HydrophobicContact CB-CE 3.5Å; D300-M532 WeakPolarHBondContact OD2-CE 3.32Å; A301-M532 HydrophobicContact CB-CE 4.17Å; A301-M532 HydrophobicContact CB-SD 4.17Å; Q457-M532 HydrophobicContact CG-CB 4.33Å; Q457-M532 HydrophobicContact CG-CG 4.46Å; Q457-M532 PolarHBondContact NE2-O 3.32Å; F458-M532 HydrophobicContact CE2-CG 3.92Å; F458-M532 HydrophobicContact CE2-SD 4.44Å; L528-M532 HydrophobicContact CD1-CG 4.4Å; L528-M532 HydrophobicContact CD1-SD 4.12Å; L528-M532 HydrophobicContact CG-SD 3.99Å; L528-M532 VanDerWaalsContact O-CG 3.32Å; L528-M532 WeakPolarHBondContact O-CG 3.34Å; L528-M532 PolarHBondContact O-N 2.85Å; F529-M532 HydrophobicContact CD1-CE 4.46Å; F529-M532 HydrophobicContact CD1-SD 3.94Å; F529-M532 HydrophobicContact CE1-CE 4.29Å; F529-M532 HydrophobicContact CE1-SD 4.09Å; F529-M532 PolarHBondContact O-N 2.93Å
533	L	95.4	Very high	95.1	Very high	5 Å²	5	20.5 Å²	20.5	3%	0.026	10%	0.101	C	C	.	.	H	α-helix	trans	-86.6	-8.2	179.6	-61.3	-174.1	0	0	0	113.4	S218 Y297 D340 L341 A344 F529 V535	S218-L533 VanDerWaalsContact CB-O 3.25Å; S218-L533 WeakPolarHBondContact CB-O 3.08Å; S218-L533 PolarHBondContact OG-O 3.31Å; Y297-L533 HydrophobicContact CE1-CD2 3.89Å; Y297-L533 HydrophobicContact CE2-CD2 3.95Å; Y297-L533 VanDerWaalsContact CZ-CD2 3.49Å; Y297-L533 WeakPolarHBondContact OH-CD2 3.25Å; D340-L533 HydrophobicContact CB-CD1 4.5Å; D340-L533 HydrophobicContact CB-CD2 4.28Å; L341-L533 HydrophobicContact CD2-CD1 3.98Å; A344-L533 HydrophobicContact CB-CD1 3.68Å; F529-L533 WeakPolarHBondContact O-CB 3.25Å; F529-L533 WeakPolarHBondContact O-CG 3.11Å; F529-L533 PolarHBondContact O-N 3.32Å; L533-V535 VanDerWaalsContact C-N 3.33Å; L533-V535 HydrophobicContact CB-CG1 4.18Å; L533-V535 HydrophobicContact CB-CG2 4Å; L533-V535 PolarHBondContact O-N 3.03Å
534	D	94.4	Very high	94.9	Very high	40 Å²	40	20.2 Å²	20.2	21%	0.214	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	46.7	-178.4	-175.7	52.4	0	0	0	112.4	K225 R399 S530 F531	K225-D534 VanDerWaalsContact CD-OD2 3.32Å; K225-D534 WeakPolarHBondContact CD-OD2 3.42Å; K225-D534 WeakPolarHBondContact CE-OD2 3.45Å; K225-D534 IonicContact NZ-OD1 3.19Å; K225-D534 PolarHBondContact NZ-OD1 3.43Å; K225-D534 IonicContact NZ-OD2 3.39Å; K225-D534 PolarHBondContact NZ-OD2 3.33Å; R399-D534 IonicContact NH1-OD1 3.46Å; S530-D534 WeakPolarHBondContact O-CA 3.39Å; S530-D534 PolarHBondContact O-N 3.01Å; F531-D534 PolarHBondContact O-N 2.78Å
535	V	95.4	Very high	94.6	Very high	14 Å²	14	20 Å²	20	9%	0.085	10%	0.1	C	C	.	.			trans	-124.8	159.9	179.7	-59.7	0	0	0	0	110.6	H260 L341 S530 L533 Y539 L540	H260-V535 HydrophobicContact CB-CG1 3.73Å; L341-V535 HydrophobicContact CD2-CB 4.47Å; L341-V535 HydrophobicContact CD2-CG1 4.16Å; L341-V535 HydrophobicContact CD2-CG2 3.94Å; S530-V535 WeakPolarHBondContact CB-O 3.48Å; S530-V535 PolarHBondContact O-N 2.85Å; S530-V535 PolarHBondContact OG-O 3.04Å; L533-V535 VanDerWaalsContact C-N 3.33Å; L533-V535 HydrophobicContact CB-CG1 4.18Å; L533-V535 HydrophobicContact CB-CG2 4Å; L533-V535 PolarHBondContact O-N 3.03Å; V535-Y539 HydrophobicContact CB-CD1 4.33Å; V535-L540 HydrophobicContact CG2-CB 4.32Å
536	E	93.3	Very high	94.2	Very high	87 Å²	87	22 Å²	22	41%	0.407	11%	0.109	S	C	.	.			trans	-72.9	141.4	177.6	-59.5	151.6	139.6	0	0	110.9	W538 Y539 L540	E536-W538 VanDerWaalsContact C-N 3.3Å; E536-W538 HydrophobicContact CB-CG 4.36Å; E536-W538 VanDerWaalsContact CB-NE1 3.32Å; E536-W538 PolarHBondContact O-N 2.74Å; E536-W538 VanDerWaalsContact OE2-CZ2 3.24Å; E536-W538 WeakPolarHBondContact OE2-CZ2 3.28Å; E536-W538 PolarHBondContact OE2-NE1 3.23Å; E536-Y539 WeakPolarHBondContact O-CB 3.37Å; E536-Y539 PolarHBondContact O-N 3.43Å; E536-L540 PolarHBondContact O-N 3.03Å
537	A	94	Very high	93.8	Very high	17 Å²	17	22 Å²	22	14%	0.14	11%	0.109	C	C	.	.	H	α-helix	trans	-56.8	-41.2	-176.8	0	0	0	0	0	112.9	Y511 L526 S530 Y539 L540 F541	Y511-A537 HydrophobicContact CE1-CB 4.1Å; L526-A537 HydrophobicContact CD2-CB 3.99Å; L526-A537 HydrophobicContact CG-CB 4.24Å; S530-A537 PolarHBondContact OG-N 2.82Å; A537-Y539 PolarHBondContact O-N 2.98Å; A537-L540 PolarHBondContact O-N 3.45Å; A537-F541 WeakPolarHBondContact O-CB 3.45Å; A537-F541 PolarHBondContact O-N 2.68Å
538	W	92.1	Very high	93.6	Very high	56 Å²	56	18 Å²	18	21%	0.212	9%	0.09	C	C	.	.	H	α-helix	trans	-60.2	-34.1	177.1	70.9	-98	0	0	0	112.7	Y511 E536 F541 D542	Y511-W538 HydrophobicContact CD1-CB 3.71Å; Y511-W538 HydrophobicContact CG-CB 3.78Å; E536-W538 VanDerWaalsContact C-N 3.3Å; E536-W538 HydrophobicContact CB-CG 4.36Å; E536-W538 VanDerWaalsContact CB-NE1 3.32Å; E536-W538 PolarHBondContact O-N 2.74Å; E536-W538 VanDerWaalsContact OE2-CZ2 3.24Å; E536-W538 WeakPolarHBondContact OE2-CZ2 3.28Å; E536-W538 PolarHBondContact OE2-NE1 3.23Å; W538-F541 PolarHBondContact O-N 3.44Å; W538-D542 PolarHBondContact O-N 3Å
539	Y	92.4	Very high	93.1	Very high	14 Å²	14	19.4 Å²	19.4	6%	0.055	10%	0.096	C	C	.	.	H	α-helix	trans	-74.4	-36.2	-176.8	-174.4	-128.6	0	0	0	111.6	H260 R261 R338 L341 V535 E536 A537	H260-Y539 AromaticContact ND1-CE1 3.59Å; R261-Y539 HydrophobicContact CB-CE1 4.05Å; R261-Y539 HydrophobicContact CB-CE2 4.27Å; R261-Y539 HydrophobicContact CG-CE2 4.09Å; R338-Y539 WeakPolarHBondContact CD-OH 3.42Å; R338-Y539 VanDerWaalsContact NH1-CZ 3.29Å; R338-Y539 PolarHBondContact NH1-OH 2.85Å; L341-Y539 HydrophobicContact CD1-CD1 3.83Å; L341-Y539 HydrophobicContact CD1-CE1 3.35Å; V535-Y539 HydrophobicContact CB-CD1 4.33Å; E536-Y539 WeakPolarHBondContact O-CB 3.37Å; E536-Y539 PolarHBondContact O-N 3.43Å; A537-Y539 PolarHBondContact O-N 2.98Å
540	L	95.1	Very high	92.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-71.5	-39	170.9	-179	59.3	0	0	0	111.4	L341 A344 I348 L526 F529 V535 E536 A537 D542 E543 V544	L341-L540 HydrophobicContact CD2-CD1 4.03Å; A344-L540 HydrophobicContact CB-CD1 3.97Å; I348-L540 HydrophobicContact CD1-CD2 3.88Å; I348-L540 HydrophobicContact CD1-CG 4.16Å; L526-L540 HydrophobicContact CD1-CB 3.92Å; L526-L540 HydrophobicContact CD1-CD2 3.79Å; L526-L540 HydrophobicContact CD1-CG 3.66Å; F529-L540 HydrophobicContact CB-CD2 3.5Å; F529-L540 VanDerWaalsContact CB-CD2 3.5Å; V535-L540 HydrophobicContact CG2-CB 4.32Å; E536-L540 PolarHBondContact O-N 3.03Å; A537-L540 PolarHBondContact O-N 3.45Å; L540-D542 VanDerWaalsContact C-N 3.32Å; L540-D542 PolarHBondContact O-N 3.04Å; L540-E543 WeakPolarHBondContact O-CB 3.45Å; L540-E543 PolarHBondContact O-N 3Å; L540-E543 VanDerWaalsContact O-N 3.09Å; L540-V544 WeakPolarHBondContact O-CG2 3.37Å; L540-V544 PolarHBondContact O-N 2.7Å
541	F	93.6	Very high	92	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-58.8	-42.3	176.9	-178.7	-109.4	0	0	0	112.1	Y511 M514 L518 F522 L526 A537 W538 E543 V544 L545	Y511-F541 HydrophobicContact CD2-CB 3.75Å; Y511-F541 AromaticContact CD2-CD1 3.73Å; Y511-F541 HydrophobicContact CD2-CD1 3.73Å; Y511-F541 HydrophobicContact CD2-CD2 4.11Å; Y511-F541 HydrophobicContact CD2-CE1 4.32Å; Y511-F541 AromaticContact CD2-CG 3.59Å; Y511-F541 HydrophobicContact CD2-CG 3.59Å; Y511-F541 HydrophobicContact CE2-CB 4.36Å; Y511-F541 HydrophobicContact CE2-CG 4.34Å; Y511-F541 HydrophobicContact CG-CB 4.42Å; Y511-F541 HydrophobicContact CG-CD1 4.3Å; Y511-F541 HydrophobicContact CG-CG 4.45Å; M514-F541 HydrophobicContact CE-CZ 4.07Å; M514-F541 HydrophobicContact SD-CE1 4.31Å; M514-F541 HydrophobicContact SD-CZ 4.43Å; L518-F541 HydrophobicContact CD1-CE2 3.95Å; L518-F541 HydrophobicContact CD1-CZ 4.17Å; F522-F541 AromaticContact CE1-CD2 3.83Å; F522-F541 HydrophobicContact CE1-CD2 3.83Å; F522-F541 AromaticContact CE1-CE2 3.7Å; F522-F541 HydrophobicContact CE1-CE2 3.7Å; F522-F541 AromaticContact CZ-CD2 3.9Å; F522-F541 HydrophobicContact CZ-CD2 3.9Å; F522-F541 AromaticContact CZ-CE2 3.91Å; F522-F541 HydrophobicContact CZ-CE2 3.91Å; L526-F541 HydrophobicContact CD1-CB 4.25Å; L526-F541 HydrophobicContact CD2-CB 3.95Å; L526-F541 HydrophobicContact CD2-CD2 4.38Å; A537-F541 WeakPolarHBondContact O-CB 3.45Å; A537-F541 PolarHBondContact O-N 2.68Å; W538-F541 PolarHBondContact O-N 3.44Å; F541-E543 VanDerWaalsContact C-N 3.27Å; F541-E543 PolarHBondContact O-N 3.32Å; F541-V544 WeakPolarHBondContact O-CB 3.43Å; F541-V544 PolarHBondContact O-N 3.21Å; F541-V544 VanDerWaalsContact O-N 3.13Å; F541-L545 HydrophobicContact CD1-CD1 4Å; F541-L545 HydrophobicContact CD1-CG 4.31Å; F541-L545 HydrophobicContact CE1-CD1 3.56Å; F541-L545 HydrophobicContact CE1-CD2 4.31Å; F541-L545 HydrophobicContact CE1-CG 4Å; F541-L545 HydrophobicContact CE2-CD2 4.27Å; F541-L545 HydrophobicContact CE2-CG 4.45Å; F541-L545 HydrophobicContact CZ-CD1 4.02Å; F541-L545 HydrophobicContact CZ-CD2 3.9Å; F541-L545 HydrophobicContact CZ-CG 4.06Å; F541-L545 WeakPolarHBondContact O-CG 3.26Å; F541-L545 PolarHBondContact O-N 3.07Å
542	D	90.8	Very high	91.5	Very high	46 Å²	46	26.7 Å²	26.7	25%	0.246	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-36.2	175.9	-72.9	-18.5	0	0	0	112.4	W538 L540 E546	W538-D542 PolarHBondContact O-N 3Å; L540-D542 VanDerWaalsContact C-N 3.32Å; L540-D542 PolarHBondContact O-N 3.04Å; D542-E546 PolarHBondContact O-N 3.03Å; D542-E546 VanDerWaalsContact O-N 3.11Å
543	E	92.6	Very high	90.2	Very high	2 Å²	2	29 Å²	29	1%	0.009	15%	0.15	C	C	.	.	H	α-helix	trans	-71.5	-37.2	174.3	-166.6	67.6	-153.4	0	0	111.8	R338 L341 Q342 A345 L540 F541 L545 E546 M547	R338-E543 IonicContact CZ-OE2 3.3Å; R338-E543 IonicContact NE-OE2 2.68Å; R338-E543 PolarHBondContact NE-OE2 3.07Å; R338-E543 IonicContact NH1-OE2 2.74Å; R338-E543 IonicContact NH2-OE2 2.98Å; R338-E543 PolarHBondContact NH2-OE2 2.76Å; L341-E543 HydrophobicContact CB-CB 4.22Å; L341-E543 HydrophobicContact CB-CG 3.9Å; Q342-E543 HydrophobicContact CG-CG 4.45Å; Q342-E543 WeakPolarHBondContact CG-OE1 3.46Å; A345-E543 HydrophobicContact CB-CB 4.28Å; A345-E543 HydrophobicContact CB-CG 3.88Å; L540-E543 WeakPolarHBondContact O-CB 3.45Å; L540-E543 PolarHBondContact O-N 3Å; L540-E543 VanDerWaalsContact O-N 3.09Å; F541-E543 VanDerWaalsContact C-N 3.27Å; F541-E543 PolarHBondContact O-N 3.32Å; E543-L545 PolarHBondContact O-N 3.05Å; E543-E546 PolarHBondContact O-N 3.36Å; E543-M547 WeakPolarHBondContact O-CB 3.28Å; E543-M547 PolarHBondContact O-N 3.44Å
544	V	92.8	Very high	88.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.5	-47.8	172.4	173.2	0	0	0	0	110.4	A345 I348 V349 F522 L540 F541 E546 M547 E548	A345-V544 HydrophobicContact CB-CG2 4Å; I348-V544 HydrophobicContact CB-CG2 4.13Å; I348-V544 HydrophobicContact CD1-CG2 3.87Å; I348-V544 HydrophobicContact CG2-CG1 4.15Å; I348-V544 HydrophobicContact CG2-CG2 3.95Å; V349-V544 HydrophobicContact CG2-CG1 4.03Å; F522-V544 HydrophobicContact CE2-CG1 4.47Å; F522-V544 HydrophobicContact CZ-CG1 4.35Å; L540-V544 WeakPolarHBondContact O-CG2 3.37Å; L540-V544 PolarHBondContact O-N 2.7Å; F541-V544 WeakPolarHBondContact O-CB 3.43Å; F541-V544 PolarHBondContact O-N 3.21Å; F541-V544 VanDerWaalsContact O-N 3.13Å; V544-E546 VanDerWaalsContact C-N 3.29Å; V544-E546 PolarHBondContact O-N 2.7Å; V544-M547 WeakPolarHBondContact O-CB 3.43Å; V544-M547 PolarHBondContact O-N 3Å; V544-M547 VanDerWaalsContact O-N 3.15Å; V544-E548 HydrophobicContact CG1-CG 4.38Å; V544-E548 VanDerWaalsContact O-CG 3.32Å; V544-E548 WeakPolarHBondContact O-CG 3.29Å; V544-E548 PolarHBondContact O-N 2.85Å
545	L	90.3	Very high	86.4	Confident	10 Å²	10	39 Å²	39	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-37.6	177.3	-65.5	-179.1	0	0	0	112.5	H496 L499 F541 E543 R549	H496-L545 VanDerWaalsContact CE1-CD2 3.45Å; H496-L545 WeakPolarHBondContact CE1-CD2 3.32Å; L499-L545 HydrophobicContact CD1-CD1 4.2Å; L499-L545 HydrophobicContact CD1-CD2 4.29Å; F541-L545 HydrophobicContact CD1-CD1 4Å; F541-L545 HydrophobicContact CD1-CG 4.31Å; F541-L545 HydrophobicContact CE1-CD1 3.56Å; F541-L545 HydrophobicContact CE1-CD2 4.31Å; F541-L545 HydrophobicContact CE1-CG 4Å; F541-L545 HydrophobicContact CE2-CD2 4.27Å; F541-L545 HydrophobicContact CE2-CG 4.45Å; F541-L545 HydrophobicContact CZ-CD1 4.02Å; F541-L545 HydrophobicContact CZ-CD2 3.9Å; F541-L545 HydrophobicContact CZ-CG 4.06Å; F541-L545 WeakPolarHBondContact O-CG 3.26Å; F541-L545 PolarHBondContact O-N 3.07Å; E543-L545 PolarHBondContact O-N 3.05Å; L545-R549 WeakPolarHBondContact O-CG 3.4Å; L545-R549 PolarHBondContact O-N 3.09Å; L545-R549 PolarHBondContact O-NH1 3.48Å
546	E	87.8	Confident	84	Confident	41 Å²	41	41.2 Å²	41.2	19%	0.192	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-40.4	175.3	-178.3	59.3	-163.7	0	0	111.8	D542 E543 V544 R549 R550	D542-E546 PolarHBondContact O-N 3.03Å; D542-E546 VanDerWaalsContact O-N 3.11Å; E543-E546 PolarHBondContact O-N 3.36Å; V544-E546 VanDerWaalsContact C-N 3.29Å; V544-E546 PolarHBondContact O-N 2.7Å; E546-R549 PolarHBondContact O-N 3.29Å; E546-R549 IonicContact OE2-CZ 2.85Å; E546-R549 VanDerWaalsContact OE2-CZ 3.3Å; E546-R549 IonicContact OE2-NE 3.92Å; E546-R549 PolarHBondContact OE2-NE 3.21Å; E546-R549 IonicContact OE2-NH2 2.77Å; E546-R549 PolarHBondContact OE2-NH2 3.38Å; E546-R550 VanDerWaalsContact CG-NH2 3.29Å; E546-R550 WeakPolarHBondContact O-CG 3.33Å; E546-R550 PolarHBondContact O-N 3.22Å; E546-R550 IonicContact OE1-CZ 3.93Å; E546-R550 IonicContact OE1-NE 3.28Å; E546-R550 PolarHBondContact OE1-NE 3Å; E546-R550 VanDerWaalsContact OE1-NE 3.12Å; E546-R550 IonicContact OE1-NH2 3.7Å; E546-R550 PolarHBondContact OE1-NH2 2.8Å
547	M	89.8	Confident	81	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.4	-45.7	175	-165.7	60.9	63.5	0	0	111.7	A318 M320 Q342 A345 L346 V349 E543 V544 R549 R550 V551	A318-M547 HydrophobicContact CB-SD 4.19Å; M320-M547 HydrophobicContact CE-CE 4.03Å; M320-M547 HydrophobicContact SD-CE 3.5Å; M320-M547 WeakPolarHBondContact SD-CE 3.31Å; M320-M547 HydrophobicContact SD-SD 3.57Å; Q342-M547 HydrophobicContact CB-CE 4.28Å; Q342-M547 HydrophobicContact CG-CE 4.4Å; A345-M547 HydrophobicContact CB-CB 4.13Å; A345-M547 HydrophobicContact CB-CE 4.42Å; L346-M547 HydrophobicContact CD1-CE 4.41Å; L346-M547 HydrophobicContact CD2-CE 4.13Å; L346-M547 HydrophobicContact CD2-CG 3.96Å; L346-M547 HydrophobicContact CD2-SD 3.48Å; L346-M547 WeakPolarHBondContact CD2-SD 3.34Å; L346-M547 HydrophobicContact CG-CE 3.75Å; L346-M547 HydrophobicContact CG-CG 4.26Å; L346-M547 HydrophobicContact CG-SD 3.82Å; V349-M547 HydrophobicContact CG2-CB 4.2Å; V349-M547 HydrophobicContact CG2-CG 4.18Å; E543-M547 WeakPolarHBondContact O-CB 3.28Å; E543-M547 PolarHBondContact O-N 3.44Å; V544-M547 WeakPolarHBondContact O-CB 3.43Å; V544-M547 PolarHBondContact O-N 3Å; V544-M547 VanDerWaalsContact O-N 3.15Å; M547-R549 VanDerWaalsContact C-N 3.33Å; M547-R549 PolarHBondContact O-N 3.16Å; M547-R550 PolarHBondContact O-N 3.31Å; M547-R550 VanDerWaalsContact O-N 3.11Å; M547-V551 HydrophobicContact CG-CG2 4.45Å; M547-V551 WeakPolarHBondContact O-CG2 3.49Å; M547-V551 PolarHBondContact O-N 2.85Å
548	E	90.8	Very high	78.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-55.7	-46.7	174.9	-72.8	177.9	176.3	0	0	111.3	V349 K352 Y494 H496 P498 V544 R550 V551 F552	V349-E548 HydrophobicContact CG2-CG 3.82Å; K352-E548 IonicContact NZ-OE1 3.85Å; K352-E548 PolarHBondContact NZ-OE1 2.81Å; Y494-E548 HydrophobicContact CE1-CG 4.23Å; Y494-E548 VanDerWaalsContact OH-CD 3.28Å; Y494-E548 VanDerWaalsContact OH-CG 3.25Å; Y494-E548 WeakPolarHBondContact OH-CG 3.45Å; Y494-E548 PolarHBondContact OH-OE1 3.11Å; H496-E548 IonicContact ND1-OE2 3.44Å; H496-E548 PolarHBondContact ND1-OE2 2.96Å; P498-E548 HydrophobicContact CB-CB 4.2Å; V544-E548 HydrophobicContact CG1-CG 4.38Å; V544-E548 VanDerWaalsContact O-CG 3.32Å; V544-E548 WeakPolarHBondContact O-CG 3.29Å; V544-E548 PolarHBondContact O-N 2.85Å; E548-R550 VanDerWaalsContact C-N 3.27Å; E548-R550 PolarHBondContact O-N 2.77Å; E548-V551 PolarHBondContact O-N 3.12Å; E548-F552 HydrophobicContact CB-CD2 4.28Å; E548-F552 WeakPolarHBondContact O-CB 3.24Å; E548-F552 WeakPolarHBondContact O-CD2 3.24Å; E548-F552 PolarHBondContact O-N 3.37Å
549	R	87.3	Confident	75.6	Confident	30 Å²	30	54.3 Å²	54.3	11%	0.113	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-40.1	177.2	-78.7	-173.7	-71	-84	0.7	112.3	P498 L499 L545 E546 M547 G553 I554	P498-R549 HydrophobicContact CB-CB 4.46Å; P498-R549 HydrophobicContact CB-CG 3.86Å; L499-R549 WeakPolarHBondContact O-CD 3.49Å; L499-R549 PolarHBondContact O-NH1 3.11Å; L545-R549 WeakPolarHBondContact O-CG 3.4Å; L545-R549 PolarHBondContact O-N 3.09Å; L545-R549 PolarHBondContact O-NH1 3.48Å; E546-R549 PolarHBondContact O-N 3.29Å; E546-R549 IonicContact OE2-CZ 2.85Å; E546-R549 VanDerWaalsContact OE2-CZ 3.3Å; E546-R549 IonicContact OE2-NE 3.92Å; E546-R549 PolarHBondContact OE2-NE 3.21Å; E546-R549 IonicContact OE2-NH2 2.77Å; E546-R549 PolarHBondContact OE2-NH2 3.38Å; M547-R549 VanDerWaalsContact C-N 3.33Å; M547-R549 PolarHBondContact O-N 3.16Å; R549-G553 PolarHBondContact O-N 3.17Å; R549-I554 HydrophobicContact CG-CB 4.39Å; R549-I554 PolarHBondContact O-N 2.74Å
550	R	86.1	Confident	73.1	Confident	87 Å²	87	56.7 Å²	56.7	33%	0.328	31%	0.309	S	S	.	.	H	α-helix	trans	-69.8	-46.6	178.9	-69.3	176.1	-170.3	161.9	6.2	111.9	A318 E546 M547 E548	A318-R550 HydrophobicContact CB-CB 3.9Å; E546-R550 VanDerWaalsContact CG-NH2 3.29Å; E546-R550 WeakPolarHBondContact O-CG 3.33Å; E546-R550 PolarHBondContact O-N 3.22Å; E546-R550 IonicContact OE1-CZ 3.93Å; E546-R550 IonicContact OE1-NE 3.28Å; E546-R550 PolarHBondContact OE1-NE 3Å; E546-R550 VanDerWaalsContact OE1-NE 3.12Å; E546-R550 IonicContact OE1-NH2 3.7Å; E546-R550 PolarHBondContact OE1-NH2 2.8Å; M547-R550 PolarHBondContact O-N 3.31Å; M547-R550 VanDerWaalsContact O-N 3.11Å; E548-R550 VanDerWaalsContact C-N 3.27Å; E548-R550 PolarHBondContact O-N 2.77Å
551	V	86.5	Confident	69.9	Low	18 Å²	18	64.6 Å²	64.6	11%	0.109	35%	0.346	C	S	.	.	H	α-helix	trans	-64.8	-42	-179.1	172.3	0	0	0	0	111.8	L314 A318 M547 E548	L314-V551 HydrophobicContact CD2-CG1 3.94Å; A318-V551 HydrophobicContact CB-CG2 3.9Å; M547-V551 HydrophobicContact CG-CG2 4.45Å; M547-V551 WeakPolarHBondContact O-CG2 3.49Å; M547-V551 PolarHBondContact O-N 2.85Å; E548-V551 PolarHBondContact O-N 3.12Å
552	F	85.1	Confident	66.9	Low	87 Å²	87	74 Å²	74	38%	0.382	39%	0.391	S	S	.	.	H	α-helix	trans	-99.6	4.2	-174.4	-58.6	-67.7	0	0	0	114.1	V353 Y494 P498 E548	V353-F552 HydrophobicContact CG2-CZ 4.16Å; Y494-F552 AromaticContact CD1-CE2 3.97Å; Y494-F552 HydrophobicContact CD1-CE2 3.97Å; Y494-F552 HydrophobicContact CD1-CZ 4.17Å; Y494-F552 HydrophobicContact CD2-CE2 4.28Å; Y494-F552 AromaticContact CD2-CZ 3.83Å; Y494-F552 HydrophobicContact CD2-CZ 3.83Å; Y494-F552 HydrophobicContact CE1-CD2 4.36Å; Y494-F552 AromaticContact CE1-CE2 3.59Å; Y494-F552 HydrophobicContact CE1-CE2 3.59Å; Y494-F552 HydrophobicContact CE1-CZ 4.13Å; Y494-F552 AromaticContact CE2-CE2 3.93Å; Y494-F552 HydrophobicContact CE2-CE2 3.93Å; Y494-F552 AromaticContact CE2-CZ 3.79Å; Y494-F552 HydrophobicContact CE2-CZ 3.79Å; Y494-F552 HydrophobicContact CG-CE2 4.28Å; Y494-F552 HydrophobicContact CG-CZ 4.01Å; Y494-F552 AromaticContact CZ-CE2 3.56Å; Y494-F552 AromaticContact CZ-CZ 3.93Å; P498-F552 HydrophobicContact CG-CB 3.64Å; P498-F552 HydrophobicContact CG-CD2 4.03Å; P498-F552 HydrophobicContact CG-CG 4.23Å; E548-F552 HydrophobicContact CB-CD2 4.28Å; E548-F552 WeakPolarHBondContact O-CB 3.24Å; E548-F552 WeakPolarHBondContact O-CD2 3.24Å; E548-F552 PolarHBondContact O-N 3.37Å
553	G	69.3	Low	63.9	Low	55 Å²	55	78.3 Å²	78.3	57%	0.567	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	21.8	166.1	0	0	0	0	0	116.9	R549 K555	R549-G553 PolarHBondContact O-N 3.17Å; G553-K555 PolarHBondContact O-N 2.98Å; G553-K555 VanDerWaalsContact O-N 3.12Å
554	I	62.2	Low	60.8	Low	61 Å²	61	86.9 Å²	86.9	31%	0.313	46%	0.458	S	S	.	.			trans	-82.5	93	173.1	-59.9	-171.3	0	0	0	108.6	P498 R549 T556	P498-I554 HydrophobicContact CB-CB 4.44Å; P498-I554 HydrophobicContact CB-CD1 3.7Å; P498-I554 HydrophobicContact CB-CG1 4.2Å; P498-I554 HydrophobicContact CG-CD1 3.52Å; P498-I554 HydrophobicContact CG-CG1 3.95Å; P498-I554 WeakPolarHBondContact O-CD1 3.19Å; R549-I554 HydrophobicContact CG-CB 4.39Å; R549-I554 PolarHBondContact O-N 2.74Å; I554-T556 PolarHBondContact O-N 3.37Å
555	K	47.9	Very low	57.6	Low	194 Å²	194	93.3 Å²	93.3	84%	0.843	50%	0.497	S	S	*	.			trans	-60.1	129.9	178.9	-65	-175	180	-176.8	0	110.4	G553	G553-K555 PolarHBondContact O-N 2.98Å; G553-K555 VanDerWaalsContact O-N 3.12Å
556	T	43.6	Very low	54.6	Low	60 Å²	60	104.4 Å²	104.4	37%	0.368	54%	0.539	S	S	.	.			trans	-56.5	137.1	162.1	49.2	0	0	0	0	109.4	P501 I554 Q558	P501-T556 HydrophobicContact CB-CG2 4.36Å; P501-T556 HydrophobicContact CG-CG2 4.19Å; I554-T556 PolarHBondContact O-N 3.37Å; T556-Q558 VanDerWaalsContact C-N 3.3Å; T556-Q558 PolarHBondContact O-N 3.45Å
557	P	31.3	Very low	51.7	Low	111 Å²	111	111.6 Å²	111.6	72%	0.721	57%	0.569	S	S	*	*			trans	-64.4	97	171	25.4	-28.4	0	0	0	107.9	P501 I559	P501-P557 HydrophobicContact CG-CG 4.49Å; P557-I559 PolarHBondContact O-N 3Å
558	Q	36	Very low	48.6	Very low	144 Å²	144	123.6 Å²	123.6	67%	0.673	62%	0.615	S	S	*	*			trans	-69.7	123	169	-71.2	-168.3	-10.2	0	0	107.3	T556 G560	T556-Q558 VanDerWaalsContact C-N 3.3Å; T556-Q558 PolarHBondContact O-N 3.45Å; Q558-G560 PolarHBondContact O-N 3.18Å
559	I	37.4	Very low	45.6	Very low	179 Å²	179	130.7 Å²	130.7	92%	0.918	65%	0.652	S	S	*	*	S	Bend	trans	-63.8	105.1	167.2	-69.1	167	0	0	0	106.6	P557	P557-I559 PolarHBondContact O-N 3Å
560	G	39.1	Very low	42.8	Very low	64 Å²	64	139.5 Å²	139.5	66%	0.66	69%	0.685	S	S	*	*	S	Bend	trans	76.1	81.4	163.5	0	0	0	0	0	116.1	Q558	Q558-G560 PolarHBondContact O-N 3.18Å
561	Q	28.6	Very low	40	Very low	166 Å²	166	141.5 Å²	141.5	78%	0.776	71%	0.707	S	S	*	*			trans	-161.6	111.4	142.6	-107.3	168.3	23.7	0	0	109	V563	Q561-V563 PolarHBondContact O-N 3.33Å
562	Q	29.4	Very low	37.2	Very low	200 Å²	200	148.4 Å²	148.4	94%	0.935	74%	0.738	S	S	*	*			trans	-72.9	118.9	170.3	-87.5	-178.6	-26.6	0	0	109
563	V	28.2	Very low	34.5	Very low	135 Å²	135	152.8 Å²	152.8	82%	0.818	76%	0.757	S	S	*	*			trans	-141.2	135.2	158.3	-177.8	0	0	0	0	109.2	Q561	Q561-V563 PolarHBondContact O-N 3.33Å
564	E	28.3	Very low	32.7	Very low	182 Å²	182	156.6 Å²	156.6	85%	0.85	77%	0.77	S	S	*	*			trans	-55.8	138.9	-165	-66.7	171	134.2	0	0	116.2	R566	E564-R566 PolarHBondContact O-N 3.41Å
565	T	25.6	Very low	31.1	Very low	135 Å²	135	161.3 Å²	161.3	83%	0.828	80%	0.795	S	S	*	*			trans	-75.3	106.8	171.4	24.5	0	0	0	0	111.2	K567	T565-K567 PolarHBondContact O-N 3.46Å
566	R	26.1	Very low	30.3	Very low	243 Å²	243	156.8 Å²	156.8	92%	0.917	79%	0.794	S	S	*	*			trans	-81.1	104.9	160.5	-79.2	-174.9	178.4	173.4	0.7	109.6	E564	E564-R566 PolarHBondContact O-N 3.41Å
567	K	27.1	Very low	29.7	Very low	192 Å²	192	160.7 Å²	160.7	84%	0.835	82%	0.818	S	S	*	*			trans	-63.7	137.6	168.3	-78.3	178.1	175.7	176.4	0	110.4	T565	T565-K567 PolarHBondContact O-N 3.46Å
568	W	25	Very low	29.6	Very low	252 Å²	252	163.6 Å²	163.6	96%	0.955	82%	0.822	S	S	*	*			trans	-64.6	129.4	166.6	-81.6	71.9	0	0	0	110.7
569	L	26.9	Very low	29.4	Very low	149 Å²	149	163.8 Å²	163.8	78%	0.78	83%	0.834	S	S	*	*			trans	-135.7	107.9	162.8	-107.5	135.5	0	0	0	109.4	T571	L569-T571 PolarHBondContact O-N 3.45Å; L569-T571 PolarHBondContact O-OG1 3.34Å
570	R	29.2	Very low	29	Very low	215 Å²	215	159.1 Å²	159.1	81%	0.811	83%	0.829	S	S	*	*			trans	1.7	112	144.3	-151.9	177.8	-165.2	170.3	4.9	113.7
571	T	26.8	Very low	28.6	Very low	130 Å²	130	163.8 Å²	163.8	80%	0.798	84%	0.839	S	S	*	*			trans	-124.1	80.3	165.4	-11.2	0	0	0	0	108.7	L569	L569-T571 PolarHBondContact O-N 3.45Å; L569-T571 PolarHBondContact O-OG1 3.34Å
572	E	29.4	Very low	28.9	Very low	162 Å²	162	161.2 Å²	161.2	76%	0.757	84%	0.837	S	S	*	*			trans	-77.8	111.7	149.3	-80.4	175	146.6	0	0	106.7
573	K	28.1	Very low	29.1	Very low	179 Å²	179	158 Å²	158	78%	0.778	83%	0.83	S	S	*	*			trans	-137	101.6	153.7	-84.7	-167.3	177.2	179.3	0	109
574	T	30.9	Very low	29.3	Very low	136 Å²	136	160.9 Å²	160.9	83%	0.834	83%	0.832	S	S	*	*			trans	-31.6	125.7	144.9	23.8	0	0	0	0	112.2
575	N	28.5	Very low	29.4	Very low	159 Å²	159	161.9 Å²	161.9	85%	0.85	83%	0.833	S	S	*	*			trans	-118	102.6	158.5	-86	-17.2	0	0	0	107.9
576	A	30.8	Very low	29.9	Very low	99 Å²	99	161 Å²	161	82%	0.818	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-79.2	144	162.7	0	0	0	0	0	109.5
577	T	30.6	Very low	30	Very low	142 Å²	142	160 Å²	160	87%	0.871	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-65.1	143.6	-177.9	-40.5	0	0	0	0	112.4
578	Q	30.8	Very low	30.2	Very low	172 Å²	172	156.7 Å²	156.7	80%	0.804	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-55.8	148.2	175.2	-64.9	166.1	-6.7	0	0	113.5
579	T	29.9	Very low	30.8	Very low	149 Å²	149	149.5 Å²	149.5	91%	0.914	81%	0.808	S	S	*	*				174.2	134.4	116.3	40.7	0	0	0	0	110
580	G	28.9	Very low	30.8	Very low	80 Å²	80	152.3 Å²	152.3	83%	0.825	81%	0.808	S	S	*	*			trans	143.5	116.4	161.6	0	0	0	0	0	115.9
581	D	32.2	Very low	30.9	Very low	163 Å²	163	151.2 Å²	151.2	87%	0.872	81%	0.809	S	S	*	*			trans	-56.7	168.9	-172.5	-83.9	-50.3	0	0	0	119.5
582	P	35.2	Very low	31	Very low	111 Å²	111	148.3 Å²	148.3	72%	0.721	81%	0.805	S	S	*	*			trans	-101.1	134.4	-164.8	36.4	-27.5	0	0	0	113.5
583	V	32.8	Very low	31.1	Very low	132 Å²	132	151.5 Å²	151.5	80%	0.8	81%	0.81	S	S	*	*			trans	-142.4	111.9	163.2	-178.1	0	0	0	0	112.2
584	K	32.1	Very low	31.1	Very low	197 Å²	197	150.6 Å²	150.6	86%	0.857	81%	0.814	S	S	*	*			trans	48.3	117.1	144.5	-62.1	176.4	179	175.7	0	120.7
585	K	30.7	Very low	31	Very low	202 Å²	202	147.3 Å²	147.3	88%	0.878	81%	0.807	S	S	*	*			trans	-57.1	157.9	152.5	-69.5	178.9	173.5	173.2	0	111.1
586	P	35.3	Very low	31	Very low	116 Å²	116	147.1 Å²	147.1	75%	0.753	81%	0.805	S	S	*	*				-144.6	135.2	92	32.7	-14.2	0	0	0	116.6
587	R	29	Very low	30.8	Very low	223 Å²	223	149.5 Å²	149.5	84%	0.842	80%	0.804	S	S	*	*				55.4	110.5	126	-74.4	-177.2	164	173.3	-4.1	121.3
588	T	31	Very low	31.1	Very low	123 Å²	123	154 Å²	154	76%	0.755	82%	0.82	S	S	*	*				63.1	165.7	124.1	63.4	0	0	0	0	120.2
589	P	38.7	Very low	31.1	Very low	101 Å²	101	153.1 Å²	153.1	66%	0.656	82%	0.821	S	S	*	*				-137.9	-170.8	-51.4	39.5	-22.6	0	0	0	111.9
590	R	26.7	Very low	31.2	Very low	208 Å²	208	153.3 Å²	153.3	79%	0.785	82%	0.816	S	S	*	*			trans	90.9	131.7	143.3	-91.1	178.5	171.6	-177	-1.7	120.3
591	K	31.1	Very low	31.3	Very low	191 Å²	191	157.4 Å²	157.4	83%	0.83	82%	0.815	S	S	*	*			trans	71.2	132.8	150.3	-65.6	173	176.3	-175.1	0	114
592	G	28.5	Very low	31.2	Very low	69 Å²	69	157.1 Å²	157.1	71%	0.711	81%	0.812	S	S	*	*			cis	150.3	158.2	11.6	0	0	0	0	0	107.5
593	R	31.9	Very low	31	Very low	229 Å²	229	159.9 Å²	159.9	86%	0.864	82%	0.818	S	S	*	*			trans	73.3	114.5	162.6	-75.9	-179.5	172.9	175.7	-3.3	119.3
594	N	28.1	Very low	30.9	Very low	160 Å²	160	161.8 Å²	161.8	86%	0.856	82%	0.819	S	S	*	*				59.6	134.3	114	-60.6	4	0	0	0	121.1
595	G	29.2	Very low	30.8	Very low	67 Å²	67	159.3 Å²	159.3	69%	0.691	82%	0.816	S	S	*	*			trans	120.6	95.2	157.1	0	0	0	0	0	110.5
596	I	28	Very low	30.8	Very low	155 Å²	155	156 Å²	156	80%	0.795	81%	0.811	S	S	*	*				61.2	131.2	68.6	-61.3	179.6	0	0	0	113.2
597	N	26.5	Very low	30.4	Very low	149 Å²	149	159.3 Å²	159.3	80%	0.797	82%	0.816	S	S	*	*			trans	84.1	124	172.4	-64.5	-17.4	0	0	0	114.2
598	I	36.2	Very low	30.5	Very low	237 Å²	237	153.5 Å²	153.5	100%	1.215	81%	0.814	S	S	*	*			cis	-141.7	0	22.3	-66	178.4	0	0	0	108.9

Retrieved 598 of 598 residues in 162.3 ms (Link to these results)

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