A0A3Q0KG86_SCHMA Loading...

Zinc finger protein

AlphaFold DB , UniProt , Accession A0A3Q0KG86, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 697 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.4	Very low	69.7	Low	240 Å²	240	102.3 Å²	102.3	100%	1.182	51%	0.514	S	S	*	.				0	160.4	0	-68.6	178.7	173.3	0	0	107.6
2	T	49.1	Very low	71.1	Confident	121 Å²	121	99.4 Å²	99.4	74%	0.742	50%	0.496	S	S	*	.			trans	-92.3	128.1	177.5	64.5	0	0	0	0	110.8
3	D	53.2	Low	71.9	Confident	120 Å²	120	95.6 Å²	95.6	64%	0.642	48%	0.479	S	S	*	.			trans	-57.3	138.4	-174.4	-57.2	-72.4	0	0	0	113.7	K7	D3-K7 PolarHBondContact O-NZ 3.02Å
4	S	60.1	Low	72.7	Confident	54 Å²	54	91.6 Å²	91.6	38%	0.378	46%	0.462	S	S	.	.	S	Bend	trans	-86.1	-24.6	175.8	51.8	0	0	0	0	112.8	N6 K7	S4-N6 VanDerWaalsContact C-N 3.3Å; S4-N6 PolarHBondContact O-N 3.36Å; S4-K7 PolarHBondContact O-N 3.4Å; S4-K7 VanDerWaalsContact O-N 3.14Å
5	T	62.4	Low	73.3	Confident	84 Å²	84	95.9 Å²	95.9	52%	0.515	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-42.5	-174	49	0	0	0	0	114.1	K7 L27	T5-K7 VanDerWaalsContact C-N 3.29Å; T5-K7 PolarHBondContact O-N 2.79Å; T5-L27 WeakPolarHBondContact O-CD1 3.46Å
6	N	70.8	Confident	73.9	Confident	110 Å²	110	96.2 Å²	96.2	59%	0.588	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	2.9	-171.8	-60.7	20.3	0	0	0	113.6	S4	S4-N6 VanDerWaalsContact C-N 3.3Å; S4-N6 PolarHBondContact O-N 3.36Å
7	K	83.6	Confident	74.6	Confident	96 Å²	96	91.8 Å²	91.8	42%	0.417	47%	0.468	S	S	.	.	S	Bend	trans	-99.1	126.3	-175.6	-71.3	155	-174.7	143.2	0	110.6	D3 S4 T5 F26 L27	D3-K7 PolarHBondContact O-NZ 3.02Å; S4-K7 PolarHBondContact O-N 3.4Å; S4-K7 VanDerWaalsContact O-N 3.14Å; T5-K7 VanDerWaalsContact C-N 3.29Å; T5-K7 PolarHBondContact O-N 2.79Å; K7-F26 HydrophobicContact CB-CD1 3.66Å; K7-F26 HydrophobicContact CB-CE1 3.95Å; K7-F26 HydrophobicContact CD-CE1 4.35Å; K7-F26 CarbonylContact O-C 3.57Å; K7-F26 WeakPolarHBondContact O-CA 3.3Å; K7-F26 VanDerWaalsContact O-CB 3.27Å; K7-F26 WeakPolarHBondContact O-CB 3.46Å; K7-L27 PolarHBondContact O-N 2.92Å
8	I	84.5	Confident	75.5	Confident	30 Å²	30	87.4 Å²	87.4	15%	0.154	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-69.7	138.2	177.5	-57.6	175.7	0	0	0	110.7	R10 I29 L60	I8-R10 PolarHBondContact O-N 2.96Å; I8-I29 HydrophobicContact CD1-CD1 3.79Å; I8-I29 HydrophobicContact CG1-CD1 3.88Å; I8-I29 HydrophobicContact CG1-CG1 4.5Å; I8-L60 HydrophobicContact CD1-CD1 3.68Å; I8-L60 HydrophobicContact CD1-CD2 3.83Å; I8-L60 HydrophobicContact CD1-CG 4.36Å
9	C	88.1	Confident	76.2	Confident	0 Å²	0	92.9 Å²	92.9	0%	0	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-66.3	124	176.2	-178.6	0	0	0	0	111.6	Y11 F12 C18 C24 F26 L27 H28	C9-Y11 VanDerWaalsContact C-N 3.3Å; C9-Y11 PolarHBondContact O-N 3.5Å; C9-Y11 PolarHBondContact SG-N 3.34Å; C9-F12 HydrophobicContact CB-CB 4.02Å; C9-F12 PolarHBondContact SG-N 3.2Å; C9-C18 PolarHBondContact SG-SG 3.14Å; C9-C24 VanDerWaalsContact SG-SG 3.68Å; C9-F26 HydrophobicContact CB-CB 3.77Å; C9-L27 PolarHBondContact N-O 3.09Å; C9-H28 VanDerWaalsContact CB-CD2 3.41Å; C9-H28 WeakPolarHBondContact CB-CD2 3.46Å
10	R	86.5	Confident	76.8	Confident	139 Å²	139	95.7 Å²	95.7	53%	0.525	47%	0.468	S	S	.	.	S	Bend	trans	-72	-22.4	178.2	-66.2	-172.5	-172.7	146.5	10.3	114.1	I8 T14 P34 F53	I8-R10 PolarHBondContact O-N 2.96Å; R10-T14 WeakPolarHBondContact O-CG2 3.44Å; R10-P34 HydrophobicContact CG-CG 4.46Å; R10-F53 HydrophobicContact CB-CE1 4.34Å; R10-F53 HydrophobicContact CG-CE1 4.29Å
11	Y	86.4	Confident	77.3	Confident	131 Å²	131	98.1 Å²	98.1	51%	0.514	48%	0.476	S	S	.	.	S	Bend	trans	-97	-24.9	-171.8	-57.3	-68.2	0	0	0	113	C9 N13 T14 G17	C9-Y11 VanDerWaalsContact C-N 3.3Å; C9-Y11 PolarHBondContact O-N 3.5Å; C9-Y11 PolarHBondContact SG-N 3.34Å; Y11-N13 VanDerWaalsContact C-N 3.34Å; Y11-N13 PolarHBondContact O-N 2.78Å; Y11-T14 WeakPolarHBondContact O-CB 3.4Å; Y11-T14 PolarHBondContact O-N 3.42Å; Y11-T14 PolarHBondContact O-OG1 2.87Å; Y11-G17 CarbonylContact C-O 3.07Å; Y11-G17 CarbonylContact O-C 3.57Å
12	F	87.1	Confident	79.4	Confident	68 Å²	68	93.9 Å²	93.9	30%	0.298	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-44.7	-174.5	-174.1	-115.3	0	0	0	114.1	C9 T14 C18 H28 P30	C9-F12 HydrophobicContact CB-CB 4.02Å; C9-F12 PolarHBondContact SG-N 3.2Å; F12-T14 VanDerWaalsContact C-N 3.34Å; F12-T14 PolarHBondContact O-N 2.96Å; F12-C18 HydrophobicContact CB-CB 4.2Å; F12-C18 HydrophobicContact CD2-CB 4.24Å; F12-H28 HydrophobicContact CD1-CB 3.98Å; F12-H28 HydrophobicContact CD2-CB 3.89Å; F12-H28 AromaticContact CD2-CD2 3.71Å; F12-H28 AromaticContact CD2-CE1 3.49Å; F12-H28 VanDerWaalsContact CD2-CE1 3.49Å; F12-H28 WeakPolarHBondContact CD2-CE1 3.47Å; F12-H28 AromaticContact CD2-CG 3.39Å; F12-H28 AromaticContact CD2-ND1 3.28Å; F12-H28 VanDerWaalsContact CD2-ND1 3.28Å; F12-H28 WeakPolarHBondContact CD2-ND1 3.31Å; F12-H28 AromaticContact CD2-NE2 3.74Å; F12-H28 HydrophobicContact CE1-CB 3.96Å; F12-H28 HydrophobicContact CE2-CB 3.88Å; F12-H28 AromaticContact CE2-CG 3.73Å; F12-H28 AromaticContact CE2-ND1 3.44Å; F12-H28 WeakPolarHBondContact CE2-ND1 3.39Å; F12-H28 HydrophobicContact CG-CB 3.94Å; F12-H28 AromaticContact CG-CD2 3.76Å; F12-H28 AromaticContact CG-CG 3.69Å; F12-H28 HydrophobicContact CZ-CB 3.92Å; F12-P30 HydrophobicContact CE1-CB 4.21Å
13	N	81.6	Confident	81.2	Confident	50 Å²	50	97.4 Å²	97.4	27%	0.267	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	21.7	178.2	-66	-54.8	0	0	0	113.5	Y11 I29 N31 K32	Y11-N13 VanDerWaalsContact C-N 3.34Å; Y11-N13 PolarHBondContact O-N 2.78Å; N13-I29 PolarHBondContact ND2-O 3.1Å; N13-N31 PolarHBondContact OD1-N 3.19Å; N13-K32 PolarHBondContact ND2-O 2.92Å
14	T	82.7	Confident	82.9	Confident	39 Å²	39	92.7 Å²	92.7	24%	0.239	44%	0.435	C	S	.	.	S	Bend	trans	-95.1	166.8	171.6	72.6	0	0	0	0	111.4	R10 Y11 F12 E16 G17	R10-T14 WeakPolarHBondContact O-CG2 3.44Å; Y11-T14 WeakPolarHBondContact O-CB 3.4Å; Y11-T14 PolarHBondContact O-N 3.42Å; Y11-T14 PolarHBondContact O-OG1 2.87Å; F12-T14 VanDerWaalsContact C-N 3.34Å; F12-T14 PolarHBondContact O-N 2.96Å; T14-E16 VanDerWaalsContact C-N 3.25Å; T14-E16 PolarHBondContact O-N 2.95Å; T14-G17 PolarHBondContact O-N 3.35Å
15	I	81.7	Confident	84.3	Confident	157 Å²	157	97.7 Å²	97.7	81%	0.805	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-29.9	-177.7	-59.4	173.5	0	0	0	112.1	G17	I15-G17 VanDerWaalsContact C-N 3.34Å
16	E	82.8	Confident	85.6	Confident	100 Å²	100	97.9 Å²	97.9	47%	0.467	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-4	175.6	-60.6	-169.8	166.3	0	0	113	T14 W19 R329	T14-E16 VanDerWaalsContact C-N 3.25Å; T14-E16 PolarHBondContact O-N 2.95Å; E16-W19 PolarHBondContact OE2-NE1 3.24Å; E16-R329 IonicContact OE1-CZ 3.08Å; E16-R329 VanDerWaalsContact OE1-CZ 3.26Å; E16-R329 IonicContact OE1-NH1 2.73Å; E16-R329 PolarHBondContact OE1-NH1 2.87Å; E16-R329 IonicContact OE1-NH2 2.71Å; E16-R329 PolarHBondContact OE1-NH2 3.38Å; E16-R329 IonicContact OE2-NH1 3.28Å
17	G	86.5	Confident	86.4	Confident	22 Å²	22	96.3 Å²	96.3	23%	0.227	44%	0.435	C	S	.	.			trans	65.6	-170.6	-174.5	0	0	0	0	0	113.7	Y11 T14 I15	Y11-G17 CarbonylContact C-O 3.07Å; Y11-G17 CarbonylContact O-C 3.57Å; T14-G17 PolarHBondContact O-N 3.35Å; I15-G17 VanDerWaalsContact C-N 3.34Å
18	C	90.9	Very high	86.7	Confident	13 Å²	13	94.2 Å²	94.2	9%	0.088	43%	0.427	C	S	.	.			trans	-85.9	118.3	171	-177.2	0	0	0	0	110.4	C9 F12 Y20 K21 C24 H28	C9-C18 PolarHBondContact SG-SG 3.14Å; F12-C18 HydrophobicContact CB-CB 4.2Å; F12-C18 HydrophobicContact CD2-CB 4.24Å; C18-Y20 PolarHBondContact O-N 3.42Å; C18-K21 PolarHBondContact O-N 3.27Å; C18-C24 PolarHBondContact SG-SG 3.35Å; C18-H28 VanDerWaalsContact CB-CE1 3.42Å; C18-H28 WeakPolarHBondContact CB-CE1 3.38Å; C18-H28 WeakPolarHBondContact CB-NE2 3.48Å; C18-H28 PolarHBondContact SG-NE2 2.86Å
19	W	88.8	Confident	86.8	Confident	191 Å²	191	94 Å²	94	72%	0.723	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-32	178.9	-58.8	-9.5	0	0	0	113.3	E16 K21	E16-W19 PolarHBondContact OE2-NE1 3.24Å; W19-K21 VanDerWaalsContact C-N 3.31Å; W19-K21 PolarHBondContact O-N 2.8Å
20	Y	88.4	Confident	86.5	Confident	149 Å²	149	97.9 Å²	97.9	58%	0.584	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.2	179.3	-61.8	-75.1	0	0	0	114.4	C18 D22 Y23	C18-Y20 PolarHBondContact O-N 3.42Å; Y20-D22 PolarHBondContact O-N 3.27Å; Y20-Y23 WeakPolarHBondContact O-CB 3.4Å; Y20-Y23 PolarHBondContact O-N 3.19Å
21	K	86.7	Confident	86	Confident	147 Å²	147	99 Å²	99	64%	0.639	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	45	-128.3	-173.6	-55.6	175.4	-174	168.4	0	110.8	C18 W19 Y23 C24 H28	C18-K21 PolarHBondContact O-N 3.27Å; W19-K21 VanDerWaalsContact C-N 3.31Å; W19-K21 PolarHBondContact O-N 2.8Å; K21-Y23 PolarHBondContact O-N 3.22Å; K21-C24 WeakPolarHBondContact O-CB 3.44Å; K21-C24 PolarHBondContact O-N 2.85Å; K21-H28 PolarHBondContact O-CE1 3.47Å
22	D	85.8	Confident	85.7	Confident	150 Å²	150	97.3 Å²	97.3	80%	0.802	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-72.1	-16	-174.6	-46	-68.2	0	0	0	113.2	Y20 C24	Y20-D22 PolarHBondContact O-N 3.27Å; D22-C24 PolarHBondContact O-N 3.36Å
23	Y	86.3	Confident	85.5	Confident	195 Å²	195	98.6 Å²	98.6	77%	0.765	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-81.4	7.7	172.5	-53.6	-86.6	0	0	0	113.4	Y20 K21 K25	Y20-Y23 WeakPolarHBondContact O-CB 3.4Å; Y20-Y23 PolarHBondContact O-N 3.19Å; K21-Y23 PolarHBondContact O-N 3.22Å; Y23-K25 PolarHBondContact O-N 3.07Å
24	C	88.7	Confident	85.5	Confident	21 Å²	21	96.7 Å²	96.7	14%	0.142	46%	0.459	C	S	.	.			trans	-70.3	119.5	-178.6	-160.7	0	0	0	0	111.8	C9 C18 K21 D22 F26 H28	C9-C24 VanDerWaalsContact SG-SG 3.68Å; C18-C24 PolarHBondContact SG-SG 3.35Å; K21-C24 WeakPolarHBondContact O-CB 3.44Å; K21-C24 PolarHBondContact O-N 2.85Å; D22-C24 PolarHBondContact O-N 3.36Å; C24-F26 PolarHBondContact O-N 3.26Å; C24-H28 VanDerWaalsContact CB-NE2 3.27Å; C24-H28 WeakPolarHBondContact CB-NE2 3.23Å
25	K	90.1	Very high	85.6	Confident	159 Å²	159	98.2 Å²	98.2	69%	0.691	47%	0.469	S	S	*	.	S	Bend	trans	-69.6	19.4	174.9	-55.2	-174.7	-177.9	-179	0	113.8	Y23	Y23-K25 PolarHBondContact O-N 3.07Å
26	F	89.6	Confident	85.9	Confident	89 Å²	89	91.1 Å²	91.1	39%	0.39	43%	0.433	S	S	.	.	S	Bend	trans	-141.7	138.5	-175.6	-62.4	-57.6	0	0	0	110.7	K7 C9 C24 H28	K7-F26 HydrophobicContact CB-CD1 3.66Å; K7-F26 HydrophobicContact CB-CE1 3.95Å; K7-F26 HydrophobicContact CD-CE1 4.35Å; K7-F26 CarbonylContact O-C 3.57Å; K7-F26 WeakPolarHBondContact O-CA 3.3Å; K7-F26 VanDerWaalsContact O-CB 3.27Å; K7-F26 WeakPolarHBondContact O-CB 3.46Å; C9-F26 HydrophobicContact CB-CB 3.77Å; C24-F26 PolarHBondContact O-N 3.26Å; F26-H28 PolarHBondContact O-CD2 2.92Å; F26-H28 PolarHBondContact O-N 3.24Å
27	L	87.3	Confident	86.1	Confident	77 Å²	77	93.9 Å²	93.9	40%	0.403	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-58.6	124.6	-174.5	-83.6	160.3	0	0	0	113.4	T5 K7 C9 I29	T5-L27 WeakPolarHBondContact O-CD1 3.46Å; K7-L27 PolarHBondContact O-N 2.92Å; C9-L27 PolarHBondContact N-O 3.09Å; L27-I29 HydrophobicContact CB-CG1 4.26Å; L27-I29 PolarHBondContact O-N 3.49Å
28	H	91.1	Very high	86.3	Confident	51 Å²	51	98.3 Å²	98.3	24%	0.236	46%	0.457	C	S	.	.			trans	-88.4	88.9	173.9	-79.4	-169.1	0	0	0	110.7	C9 F12 C18 K21 C24 F26 P30	C9-H28 VanDerWaalsContact CB-CD2 3.41Å; C9-H28 WeakPolarHBondContact CB-CD2 3.46Å; F12-H28 HydrophobicContact CD1-CB 3.98Å; F12-H28 HydrophobicContact CD2-CB 3.89Å; F12-H28 AromaticContact CD2-CD2 3.71Å; F12-H28 AromaticContact CD2-CE1 3.49Å; F12-H28 VanDerWaalsContact CD2-CE1 3.49Å; F12-H28 WeakPolarHBondContact CD2-CE1 3.47Å; F12-H28 AromaticContact CD2-CG 3.39Å; F12-H28 AromaticContact CD2-ND1 3.28Å; F12-H28 VanDerWaalsContact CD2-ND1 3.28Å; F12-H28 WeakPolarHBondContact CD2-ND1 3.31Å; F12-H28 AromaticContact CD2-NE2 3.74Å; F12-H28 HydrophobicContact CE1-CB 3.96Å; F12-H28 HydrophobicContact CE2-CB 3.88Å; F12-H28 AromaticContact CE2-CG 3.73Å; F12-H28 AromaticContact CE2-ND1 3.44Å; F12-H28 WeakPolarHBondContact CE2-ND1 3.39Å; F12-H28 HydrophobicContact CG-CB 3.94Å; F12-H28 AromaticContact CG-CD2 3.76Å; F12-H28 AromaticContact CG-CG 3.69Å; F12-H28 HydrophobicContact CZ-CB 3.92Å; C18-H28 VanDerWaalsContact CB-CE1 3.42Å; C18-H28 WeakPolarHBondContact CB-CE1 3.38Å; C18-H28 WeakPolarHBondContact CB-NE2 3.48Å; C18-H28 PolarHBondContact SG-NE2 2.86Å; K21-H28 PolarHBondContact O-CE1 3.47Å; C24-H28 VanDerWaalsContact CB-NE2 3.27Å; C24-H28 WeakPolarHBondContact CB-NE2 3.23Å; F26-H28 PolarHBondContact O-CD2 2.92Å; F26-H28 PolarHBondContact O-N 3.24Å; H28-P30 WeakPolarHBondContact O-CD 3.26Å
29	I	85.7	Confident	86.1	Confident	27 Å²	27	102 Å²	102	14%	0.138	47%	0.47	C	S	.	.			trans	-98.6	108.5	178.3	-49.4	-172.6	0	0	0	109.6	I8 N13 L27 K32 I63	I8-I29 HydrophobicContact CD1-CD1 3.79Å; I8-I29 HydrophobicContact CG1-CD1 3.88Å; I8-I29 HydrophobicContact CG1-CG1 4.5Å; N13-I29 PolarHBondContact ND2-O 3.1Å; L27-I29 HydrophobicContact CB-CG1 4.26Å; L27-I29 PolarHBondContact O-N 3.49Å; I29-K32 HydrophobicContact CB-CB 4.46Å; I29-K32 HydrophobicContact CG2-CB 3.95Å; I29-K32 HydrophobicContact CG2-CD 3.9Å; I29-K32 HydrophobicContact CG2-CG 3.91Å; I29-I63 HydrophobicContact CD1-CG2 4.4Å
30	P	82.8	Confident	85.9	Confident	81 Å²	81	98.3 Å²	98.3	53%	0.526	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	149	178.1	25.9	-33.6	0	0	0	111.3	F12 H28 K32	F12-P30 HydrophobicContact CE1-CB 4.21Å; H28-P30 WeakPolarHBondContact O-CD 3.26Å; P30-K32 PolarHBondContact O-N 2.72Å
31	N	75.7	Confident	85.8	Confident	162 Å²	162	95.5 Å²	95.5	87%	0.866	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	-2.2	177.4	-54.6	-35.1	0	0	0	116.6	N13	N13-N31 PolarHBondContact OD1-N 3.19Å
32	K	80.1	Confident	85.7	Confident	96 Å²	96	94.9 Å²	94.9	42%	0.417	47%	0.473	S	S	.	.			trans	-105.8	99.1	175.8	-60.9	-162.9	-172	176.7	0	111.6	N13 I29 P30 I63	N13-K32 PolarHBondContact ND2-O 2.92Å; I29-K32 HydrophobicContact CB-CB 4.46Å; I29-K32 HydrophobicContact CG2-CB 3.95Å; I29-K32 HydrophobicContact CG2-CD 3.9Å; I29-K32 HydrophobicContact CG2-CG 3.91Å; P30-K32 PolarHBondContact O-N 2.72Å; K32-I63 HydrophobicContact CD-CD1 3.68Å
33	K	82.7	Confident	85.6	Confident	94 Å²	94	92.7 Å²	92.7	41%	0.409	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-59.8	132	169.2	-66.6	-179.7	179.4	-179	0	109.3	C51 H52 S54	K33-C51 PolarHBondContact NZ-O 3.14Å; K33-H52 WeakPolarHBondContact CG-O 3.27Å; K33-S54 WeakPolarHBondContact O-CB 2.92Å
34	P	80.9	Confident	85.6	Confident	11 Å²	11	84.6 Å²	84.6	7%	0.071	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-66.3	152.5	173.8	15.4	-13.6	0	0	0	110.8	R10 F53 S54	R10-P34 HydrophobicContact CG-CG 4.46Å; P34-F53 HydrophobicContact CB-CD1 4.32Å; P34-F53 HydrophobicContact CG-CD1 3.94Å; P34-F53 HydrophobicContact CG-CE1 4.16Å; P34-F53 CarbonylContact O-C 3.54Å; P34-F53 WeakPolarHBondContact O-CA 3.38Å; P34-F53 WeakPolarHBondContact O-CB 3.1Å; P34-F53 WeakPolarHBondContact O-CD1 3.33Å; P34-S54 PolarHBondContact O-N 3.38Å
35	P	84.7	Confident	85.8	Confident	71 Å²	71	84.4 Å²	84.4	46%	0.461	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-66.7	144.2	-171.5	25.2	-34.8	0	0	0	113.6	K37 L60	P35-K37 PolarHBondContact O-N 2.73Å; P35-L60 HydrophobicContact CG-CD1 4.05Å
36	C	88.4	Confident	85.8	Confident	7 Å²	7	87.8 Å²	87.8	5%	0.047	45%	0.448	C	S	.	.			trans	-81.7	110.9	-175.5	-175.8	0	0	0	0	112.4	F38 Y39 C45 C51 F53 S54 H55	C36-F38 PolarHBondContact O-N 2.78Å; C36-Y39 PolarHBondContact O-N 3.38Å; C36-C45 PolarHBondContact SG-SG 3.06Å; C36-C51 VanDerWaalsContact SG-SG 3.65Å; C36-F53 VanDerWaalsContact CA-CB 3.49Å; C36-F53 HydrophobicContact CB-CB 3.56Å; C36-S54 WeakPolarHBondContact CB-O 3.42Å; C36-S54 PolarHBondContact N-O 3.37Å; C36-H55 VanDerWaalsContact CB-CD2 3.44Å; C36-H55 WeakPolarHBondContact CB-CD2 3.48Å
37	K	87.7	Confident	85.7	Confident	158 Å²	158	91.1 Å²	91.1	69%	0.687	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-21.4	174.8	-74.8	-164.7	167.3	-155	0	115.2	P35 L41	P35-K37 PolarHBondContact O-N 2.73Å; K37-L41 WeakPolarHBondContact O-CD1 3.36Å
38	F	90.3	Very high	85.7	Confident	115 Å²	115	89.1 Å²	89.1	50%	0.504	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-7.1	-177.3	-57.6	-69.6	0	0	0	113.4	C36 L41 G44 C45	C36-F38 PolarHBondContact O-N 2.78Å; F38-L41 HydrophobicContact CD1-CD2 4.4Å; F38-L41 PolarHBondContact O-N 2.59Å; F38-G44 CarbonylContact O-C 3.45Å; F38-C45 HydrophobicContact CB-CB 4.18Å; F38-C45 PolarHBondContact O-N 3.35Å; F38-C45 VanDerWaalsContact O-N 3.15Å
39	Y	87.4	Confident	85.3	Confident	92 Å²	92	94.8 Å²	94.8	36%	0.361	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-38.5	-177.1	-176.4	-112.3	0	0	0	112.7	C36 L41 H55 R57	C36-Y39 PolarHBondContact O-N 3.38Å; Y39-L41 VanDerWaalsContact C-N 3.32Å; Y39-H55 HydrophobicContact CD1-CB 4.31Å; Y39-H55 HydrophobicContact CD2-CB 3.68Å; Y39-H55 AromaticContact CD2-CD2 3.61Å; Y39-H55 AromaticContact CD2-CE1 3.95Å; Y39-H55 AromaticContact CD2-CG 3.36Å; Y39-H55 AromaticContact CD2-ND1 3.6Å; Y39-H55 AromaticContact CD2-NE2 3.98Å; Y39-H55 HydrophobicContact CE1-CB 4.25Å; Y39-H55 WeakPolarHBondContact CE1-O 3.47Å; Y39-H55 HydrophobicContact CE2-CB 3.63Å; Y39-H55 AromaticContact CE2-CG 3.72Å; Y39-H55 AromaticContact CE2-ND1 3.83Å; Y39-H55 HydrophobicContact CG-CB 4.02Å; Y39-H55 AromaticContact CG-CD2 3.83Å; Y39-H55 AromaticContact CG-CG 3.89Å; Y39-R57 HydrophobicContact CE1-CG 4.17Å
40	D	84.1	Confident	85.2	Confident	112 Å²	112	98.8 Å²	98.8	60%	0.599	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	6.7	177.4	-60.2	-58.2	0	0	0	113.9	R57	D40-R57 IonicContact OD1-CZ 2.65Å; D40-R57 IonicContact OD1-NE 2.72Å; D40-R57 PolarHBondContact OD1-NE 3.22Å; D40-R57 IonicContact OD1-NH2 3.84Å; D40-R57 PolarHBondContact OD1-NH2 3.37Å
41	L	86	Confident	85.4	Confident	90 Å²	90	95.1 Å²	95.1	47%	0.471	48%	0.479	S	S	.	.	S	Bend	trans	-77.8	149.2	167.8	-97.9	72.1	0	0	0	110.3	K37 F38 Y39 T43 G44	K37-L41 WeakPolarHBondContact O-CD1 3.36Å; F38-L41 HydrophobicContact CD1-CD2 4.4Å; F38-L41 PolarHBondContact O-N 2.59Å; Y39-L41 VanDerWaalsContact C-N 3.32Å; L41-T43 PolarHBondContact O-N 2.89Å; L41-T43 VanDerWaalsContact O-N 3.11Å; L41-G44 WeakPolarHBondContact O-CA 3.47Å; L41-G44 PolarHBondContact O-N 3.3Å
42	S	84.3	Confident	85.8	Confident	135 Å²	135	92 Å²	92	94%	0.944	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.2	176.2	53.6	0	0	0	0	114.3	G44	S42-G44 VanDerWaalsContact C-N 3.3Å
43	T	84.7	Confident	86.1	Confident	103 Å²	103	90.6 Å²	90.6	63%	0.632	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-8.9	173	60.5	0	0	0	0	113.8	L41	L41-T43 PolarHBondContact O-N 2.89Å; L41-T43 VanDerWaalsContact O-N 3.11Å
44	G	86	Confident	86.2	Confident	26 Å²	26	86.9 Å²	86.9	27%	0.268	44%	0.439	S	S	.	.			trans	61.1	179.9	-166.7	0	0	0	0	0	113.9	F38 L41 S42	F38-G44 CarbonylContact O-C 3.45Å; L41-G44 WeakPolarHBondContact O-CA 3.47Å; L41-G44 PolarHBondContact O-N 3.3Å; S42-G44 VanDerWaalsContact C-N 3.3Å
45	C	92.2	Very high	86.7	Confident	16 Å²	16	88.2 Å²	88.2	11%	0.108	44%	0.444	C	S	.	.			trans	-83.3	115	172.2	177	0	0	0	0	110.2	C36 F38 Y47 G48 C51 H55	C36-C45 PolarHBondContact SG-SG 3.06Å; F38-C45 HydrophobicContact CB-CB 4.18Å; F38-C45 PolarHBondContact O-N 3.35Å; F38-C45 VanDerWaalsContact O-N 3.15Å; C45-Y47 PolarHBondContact O-N 3.19Å; C45-G48 PolarHBondContact O-N 3.29Å; C45-C51 PolarHBondContact SG-SG 2.85Å; C45-H55 VanDerWaalsContact CB-CE1 3.47Å; C45-H55 WeakPolarHBondContact CB-CE1 3.33Å; C45-H55 WeakPolarHBondContact CB-NE2 3.44Å; C45-H55 PolarHBondContact SG-NE2 3.45Å
46	R	91.2	Very high	86.5	Confident	230 Å²	230	90.3 Å²	90.3	87%	0.868	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-13.2	179.9	-65.1	-173.1	179	-166.8	-0.8	115.4
47	Y	87	Confident	85.5	Confident	160 Å²	160	98.9 Å²	98.9	63%	0.627	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-10.4	178.7	-59.6	-76	0	0	0	113.8	C45 E49 M50	C45-Y47 PolarHBondContact O-N 3.19Å; Y47-E49 PolarHBondContact O-N 3.35Å; Y47-M50 WeakPolarHBondContact O-CA 3.33Å; Y47-M50 VanDerWaalsContact O-CB 3.32Å; Y47-M50 WeakPolarHBondContact O-CB 3.33Å; Y47-M50 PolarHBondContact O-N 2.9Å
48	G	86.6	Confident	84.2	Confident	34 Å²	34	96.7 Å²	96.7	35%	0.351	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	51.6	-138.1	-177.8	0	0	0	0	0	112.6	C45 M50 C51 H55	C45-G48 PolarHBondContact O-N 3.29Å; G48-M50 PolarHBondContact O-N 3.23Å; G48-C51 WeakPolarHBondContact O-CB 3.26Å; G48-C51 PolarHBondContact O-N 2.9Å; G48-C51 VanDerWaalsContact O-N 3.09Å; G48-H55 PolarHBondContact O-CE1 2.81Å; G48-H55 PolarHBondContact O-ND1 3.16Å
49	E	83.9	Confident	82.5	Confident	170 Å²	170	95 Å²	95	79%	0.794	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-59.4	-25.2	175.9	-59.9	-179.5	169.6	0	0	113.6	Y47 C51	Y47-E49 PolarHBondContact O-N 3.35Å; E49-C51 PolarHBondContact O-N 2.83Å
50	M	83.9	Confident	81	Confident	112 Å²	112	93.5 Å²	93.5	55%	0.552	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-76.7	4.9	177.7	-54.2	-65.6	161.8	0	0	112.8	Y47 G48 H52 Y582	Y47-M50 WeakPolarHBondContact O-CA 3.33Å; Y47-M50 VanDerWaalsContact O-CB 3.32Å; Y47-M50 WeakPolarHBondContact O-CB 3.33Å; Y47-M50 PolarHBondContact O-N 2.9Å; G48-M50 PolarHBondContact O-N 3.23Å; M50-H52 PolarHBondContact O-N 3.32Å; M50-Y582 HydrophobicContact CE-CE1 4.43Å
51	C	86.7	Confident	79.5	Confident	3 Å²	3	96 Å²	96	2%	0.02	49%	0.489	C	S	.	.			trans	-64.7	134	175.7	-159.8	0	0	0	0	111.9	K33 C36 C45 G48 E49 F53 H55	K33-C51 PolarHBondContact NZ-O 3.14Å; C36-C51 VanDerWaalsContact SG-SG 3.65Å; C45-C51 PolarHBondContact SG-SG 2.85Å; G48-C51 WeakPolarHBondContact O-CB 3.26Å; G48-C51 PolarHBondContact O-N 2.9Å; G48-C51 VanDerWaalsContact O-N 3.09Å; E49-C51 PolarHBondContact O-N 2.83Å; C51-F53 PolarHBondContact O-N 3.29Å; C51-F53 PolarHBondContact SG-N 3.27Å; C51-H55 WeakPolarHBondContact CB-NE2 3.33Å
52	H	82.9	Confident	77.9	Confident	98 Å²	98	97.6 Å²	97.6	45%	0.454	50%	0.497	S	S	.	.	S	Bend	trans	-70.5	-14.5	170.6	-65.5	-66	0	0	0	113.1	K33 M50	K33-H52 WeakPolarHBondContact CG-O 3.27Å; M50-H52 PolarHBondContact O-N 3.32Å
53	F	86.9	Confident	76.3	Confident	66 Å²	66	92.7 Å²	92.7	29%	0.289	46%	0.46	S	S	.	.	S	Bend	trans	-99.5	155.8	175	-59.5	-79.3	0	0	0	110.5	R10 P34 C36 C51	R10-F53 HydrophobicContact CB-CE1 4.34Å; R10-F53 HydrophobicContact CG-CE1 4.29Å; P34-F53 HydrophobicContact CB-CD1 4.32Å; P34-F53 HydrophobicContact CG-CD1 3.94Å; P34-F53 HydrophobicContact CG-CE1 4.16Å; P34-F53 CarbonylContact O-C 3.54Å; P34-F53 WeakPolarHBondContact O-CA 3.38Å; P34-F53 WeakPolarHBondContact O-CB 3.1Å; P34-F53 WeakPolarHBondContact O-CD1 3.33Å; C36-F53 VanDerWaalsContact CA-CB 3.49Å; C36-F53 HydrophobicContact CB-CB 3.56Å; C51-F53 PolarHBondContact O-N 3.29Å; C51-F53 PolarHBondContact SG-N 3.27Å
54	S	85.9	Confident	74.7	Confident	16 Å²	16	93.7 Å²	93.7	11%	0.112	46%	0.458	C	S	.	.	B	Isolated β-bridge	trans	-75.3	143.4	177.6	177.7	0	0	0	0	111.4	K33 P34 C36 D56	K33-S54 WeakPolarHBondContact O-CB 2.92Å; P34-S54 PolarHBondContact O-N 3.38Å; C36-S54 WeakPolarHBondContact CB-O 3.42Å; C36-S54 PolarHBondContact N-O 3.37Å; S54-D56 VanDerWaalsContact OG-CB 3.32Å; S54-D56 WeakPolarHBondContact OG-CB 3.38Å; S54-D56 VanDerWaalsContact OG-CG 3.27Å; S54-D56 PolarHBondContact OG-N 2.79Å; S54-D56 PolarHBondContact OG-OD2 2.9Å
55	H	90	Very high	72.7	Confident	39 Å²	39	95.9 Å²	95.9	18%	0.181	47%	0.468	C	S	.	.			trans	-102.5	-0.1	168.6	-69.7	178.8	0	0	0	112.1	C36 Y39 C45 G48 C51 R57	C36-H55 VanDerWaalsContact CB-CD2 3.44Å; C36-H55 WeakPolarHBondContact CB-CD2 3.48Å; Y39-H55 HydrophobicContact CD1-CB 4.31Å; Y39-H55 HydrophobicContact CD2-CB 3.68Å; Y39-H55 AromaticContact CD2-CD2 3.61Å; Y39-H55 AromaticContact CD2-CE1 3.95Å; Y39-H55 AromaticContact CD2-CG 3.36Å; Y39-H55 AromaticContact CD2-ND1 3.6Å; Y39-H55 AromaticContact CD2-NE2 3.98Å; Y39-H55 HydrophobicContact CE1-CB 4.25Å; Y39-H55 WeakPolarHBondContact CE1-O 3.47Å; Y39-H55 HydrophobicContact CE2-CB 3.63Å; Y39-H55 AromaticContact CE2-CG 3.72Å; Y39-H55 AromaticContact CE2-ND1 3.83Å; Y39-H55 HydrophobicContact CG-CB 4.02Å; Y39-H55 AromaticContact CG-CD2 3.83Å; Y39-H55 AromaticContact CG-CG 3.89Å; C45-H55 VanDerWaalsContact CB-CE1 3.47Å; C45-H55 WeakPolarHBondContact CB-CE1 3.33Å; C45-H55 WeakPolarHBondContact CB-NE2 3.44Å; C45-H55 PolarHBondContact SG-NE2 3.45Å; G48-H55 PolarHBondContact O-CE1 2.81Å; G48-H55 PolarHBondContact O-ND1 3.16Å; C51-H55 WeakPolarHBondContact CB-NE2 3.33Å; H55-R57 PolarHBondContact O-N 3.48Å
56	D	80.5	Confident	70.6	Confident	114 Å²	114	102.9 Å²	102.9	61%	0.61	49%	0.494	S	S	*	.			trans	-71.2	126	176.9	-49.2	-54	0	0	0	108.9	S54 T58	S54-D56 VanDerWaalsContact OG-CB 3.32Å; S54-D56 WeakPolarHBondContact OG-CB 3.38Å; S54-D56 VanDerWaalsContact OG-CG 3.27Å; S54-D56 PolarHBondContact OG-N 2.79Å; S54-D56 PolarHBondContact OG-OD2 2.9Å; D56-T58 WeakPolarHBondContact CB-OG1 3.49Å; D56-T58 PolarHBondContact O-N 3.49Å
57	R	67.9	Low	68.6	Low	188 Å²	188	96.1 Å²	96.1	71%	0.709	48%	0.475	S	S	*	.			trans	-74.9	15.3	177.8	-73.3	-176.4	162.3	162.3	-2.7	113.7	Y39 D40 H55 S59	Y39-R57 HydrophobicContact CE1-CG 4.17Å; D40-R57 IonicContact OD1-CZ 2.65Å; D40-R57 IonicContact OD1-NE 2.72Å; D40-R57 PolarHBondContact OD1-NE 3.22Å; D40-R57 IonicContact OD1-NH2 3.84Å; D40-R57 PolarHBondContact OD1-NH2 3.37Å; H55-R57 PolarHBondContact O-N 3.48Å; R57-S59 VanDerWaalsContact C-N 3.29Å; R57-S59 PolarHBondContact O-N 3.15Å
58	T	61.1	Low	66.7	Low	111 Å²	111	93.3 Å²	93.3	68%	0.681	47%	0.474	S	S	*	.			trans	-71.1	82.5	172.9	39.9	0	0	0	0	110	D56 L60	D56-T58 WeakPolarHBondContact CB-OG1 3.49Å; D56-T58 PolarHBondContact O-N 3.49Å; T58-L60 PolarHBondContact O-N 3.24Å
59	S	53.8	Low	64.8	Low	80 Å²	80	97 Å²	97	56%	0.559	49%	0.486	S	S	*	.			trans	-52.7	131.8	-179.4	63.2	0	0	0	0	111.9	R57 K61 L62	R57-S59 VanDerWaalsContact C-N 3.29Å; R57-S59 PolarHBondContact O-N 3.15Å; S59-K61 PolarHBondContact O-N 2.88Å; S59-L62 PolarHBondContact O-N 3.39Å
60	L	55.9	Low	63	Low	61 Å²	61	96.5 Å²	96.5	32%	0.319	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-10.7	-174	-61.8	174	0	0	0	115.2	I8 P35 T58 L62 I63	I8-L60 HydrophobicContact CD1-CD1 3.68Å; I8-L60 HydrophobicContact CD1-CD2 3.83Å; I8-L60 HydrophobicContact CD1-CG 4.36Å; P35-L60 HydrophobicContact CG-CD1 4.05Å; T58-L60 PolarHBondContact O-N 3.24Å; L60-L62 PolarHBondContact O-N 2.75Å; L60-L62 VanDerWaalsContact O-N 3.08Å; L60-I63 HydrophobicContact CD2-CD1 3.81Å; L60-I63 WeakPolarHBondContact O-CB 3.38Å; L60-I63 PolarHBondContact O-N 3.36Å
61	K	52.8	Low	61.3	Low	164 Å²	164	94.2 Å²	94.2	71%	0.713	47%	0.473	S	S	*	.	H	α-helix	trans	-50.5	-28.5	170.9	-68.9	-168.8	171.3	-167.5	0	113.4	S59 I63	S59-K61 PolarHBondContact O-N 2.88Å; K61-I63 PolarHBondContact O-N 2.86Å
62	L	51.3	Low	59.7	Low	124 Å²	124	98.9 Å²	98.9	65%	0.649	50%	0.496	S	S	*	.	H	α-helix	trans	-83.5	12.6	177	-142.1	103.4	0	0	0	114.2	S59 L60 Y66	S59-L62 PolarHBondContact O-N 3.39Å; L60-L62 PolarHBondContact O-N 2.75Å; L60-L62 VanDerWaalsContact O-N 3.08Å; L62-Y66 HydrophobicContact CD2-CE2 4.28Å; L62-Y66 HydrophobicContact CG-CE2 4.5Å; L62-Y66 WeakPolarHBondContact O-CD2 3.44Å
63	I	52.3	Low	58.3	Low	32 Å²	32	100.6 Å²	100.6	16%	0.164	50%	0.504	C	S	.	.	H	α-helix	trans	-118.1	-30.1	177.5	-63.1	171.2	0	0	0	110.8	I29 K32 L60 K61 S65 Y66	I29-I63 HydrophobicContact CD1-CG2 4.4Å; K32-I63 HydrophobicContact CD-CD1 3.68Å; L60-I63 HydrophobicContact CD2-CD1 3.81Å; L60-I63 WeakPolarHBondContact O-CB 3.38Å; L60-I63 PolarHBondContact O-N 3.36Å; K61-I63 PolarHBondContact O-N 2.86Å; I63-S65 PolarHBondContact O-N 3.03Å; I63-Y66 PolarHBondContact O-N 2.88Å
64	E	49.6	Very low	56.7	Low	124 Å²	124	102.1 Å²	102.1	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-61.2	-27.4	171.6	-65.4	174.5	132	0	0	111.6
65	S	44.8	Very low	55.3	Low	71 Å²	71	105.5 Å²	105.5	50%	0.497	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-11.6	177.6	65.4	0	0	0	0	115.9	I63	I63-S65 PolarHBondContact O-N 3.03Å
66	Y	47.5	Very low	54	Low	163 Å²	163	109.6 Å²	109.6	64%	0.639	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-7	-171.9	-91.2	-84.6	0	0	0	114.7	L62 I63	L62-Y66 HydrophobicContact CD2-CE2 4.28Å; L62-Y66 HydrophobicContact CG-CE2 4.5Å; L62-Y66 WeakPolarHBondContact O-CD2 3.44Å; I63-Y66 PolarHBondContact O-N 2.88Å
67	N	48.9	Very low	52.6	Low	89 Å²	89	106.1 Å²	106.1	48%	0.476	54%	0.539	S	S	.	.	H	α-helix	trans	-95.4	-7.6	-176.4	-87.7	-7	0	0	0	114.7	S71	N67-S71 WeakPolarHBondContact O-CB 3.49Å
68	V	47.4	Very low	51.8	Low	101 Å²	101	102 Å²	102	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-73	-52	-179.9	-176.9	0	0	0	0	110.5	M72	V68-M72 PolarHBondContact O-N 2.9Å
69	D	46.1	Very low	51.4	Low	112 Å²	112	102.1 Å²	102.1	60%	0.599	53%	0.526	S	S	*	.	H	α-helix	trans	-67.4	-45.6	-177	-59.5	-46.1	0	0	0	112.5	S71 M72 E73	D69-S71 VanDerWaalsContact C-N 3.26Å; D69-S71 PolarHBondContact O-N 3.43Å; D69-M72 CarbonylContact O-C 3.59Å; D69-M72 WeakPolarHBondContact O-CA 3.37Å; D69-M72 WeakPolarHBondContact O-CB 3.26Å; D69-M72 PolarHBondContact O-N 3.3Å; D69-E73 PolarHBondContact O-N 2.83Å
70	Y	46.1	Very low	51.3	Low	159 Å²	159	106.4 Å²	106.4	62%	0.624	54%	0.535	S	S	*	.	H	α-helix	trans	-65.3	-29.7	-175.8	-150.6	-104.8	0	0	0	112.9	L74	Y70-L74 HydrophobicContact CD1-CD1 3.96Å; Y70-L74 HydrophobicContact CE1-CD1 3.84Å; Y70-L74 WeakPolarHBondContact O-CB 3.45Å; Y70-L74 PolarHBondContact O-N 3.49Å; Y70-L74 VanDerWaalsContact O-N 3.12Å
71	S	49.4	Very low	50.9	Low	64 Å²	64	111.3 Å²	111.3	45%	0.448	55%	0.554	S	S	.	*	H	α-helix	trans	-69.4	-44	172.2	-167.2	0	0	0	0	111.2	N67 D69 L74 I75	N67-S71 WeakPolarHBondContact O-CB 3.49Å; D69-S71 VanDerWaalsContact C-N 3.26Å; D69-S71 PolarHBondContact O-N 3.43Å; S71-L74 PolarHBondContact O-N 2.92Å; S71-I75 WeakPolarHBondContact O-CB 3.38Å; S71-I75 WeakPolarHBondContact O-CD1 3.34Å; S71-I75 WeakPolarHBondContact O-CG1 3.15Å; S71-I75 PolarHBondContact O-N 3.19Å
72	M	51.9	Low	50.7	Low	101 Å²	101	110 Å²	110	50%	0.498	55%	0.554	S	S	.	*	H	α-helix	trans	-63.9	-39.2	175.2	-89.7	-74.2	-108.6	0	0	112.9	V68 D69 K76	V68-M72 PolarHBondContact O-N 2.9Å; D69-M72 CarbonylContact O-C 3.59Å; D69-M72 WeakPolarHBondContact O-CA 3.37Å; D69-M72 WeakPolarHBondContact O-CB 3.26Å; D69-M72 PolarHBondContact O-N 3.3Å; M72-K76 WeakPolarHBondContact O-CB 3.38Å; M72-K76 WeakPolarHBondContact O-CG 3.25Å; M72-K76 PolarHBondContact O-N 3.16Å
73	E	53.3	Low	50.4	Low	134 Å²	134	111.9 Å²	111.9	63%	0.626	56%	0.562	S	S	*	*	H	α-helix	trans	-69.3	-39.5	176.3	-70.7	-161	123.5	0	0	112.9	D69 G77	D69-E73 PolarHBondContact O-N 2.83Å; E73-G77 PolarHBondContact O-N 3.19Å
74	L	55.2	Low	49.7	Very low	97 Å²	97	115.4 Å²	115.4	51%	0.508	59%	0.585	S	S	.	*	H	α-helix	trans	-65.9	-41.7	174.1	-99.3	158.4	0	0	0	112.3	Y70 S71 G77 L78	Y70-L74 HydrophobicContact CD1-CD1 3.96Å; Y70-L74 HydrophobicContact CE1-CD1 3.84Å; Y70-L74 WeakPolarHBondContact O-CB 3.45Å; Y70-L74 PolarHBondContact O-N 3.49Å; Y70-L74 VanDerWaalsContact O-N 3.12Å; S71-L74 PolarHBondContact O-N 2.92Å; L74-G77 PolarHBondContact O-N 3.06Å; L74-L78 WeakPolarHBondContact O-CB 3.28Å; L74-L78 WeakPolarHBondContact O-CG 3.27Å; L74-L78 PolarHBondContact O-N 3.35Å
75	I	54.8	Low	49.5	Very low	87 Å²	87	115.4 Å²	115.4	45%	0.446	60%	0.598	S	S	.	*	H	α-helix	trans	-67.7	-44.9	176.7	-71.5	162	0	0	0	110.9	S71 G77 L78 L79	S71-I75 WeakPolarHBondContact O-CB 3.38Å; S71-I75 WeakPolarHBondContact O-CD1 3.34Å; S71-I75 WeakPolarHBondContact O-CG1 3.15Å; S71-I75 PolarHBondContact O-N 3.19Å; I75-G77 VanDerWaalsContact C-N 3.3Å; I75-G77 PolarHBondContact O-N 3.43Å; I75-L78 PolarHBondContact O-N 2.94Å; I75-L79 HydrophobicContact CG2-CD1 3.8Å; I75-L79 HydrophobicContact CG2-CG 4.46Å; I75-L79 WeakPolarHBondContact O-CB 3.25Å; I75-L79 WeakPolarHBondContact O-CG 3.28Å; I75-L79 PolarHBondContact O-N 3.4Å
76	K	62.9	Low	48.9	Very low	125 Å²	125	121.6 Å²	121.6	54%	0.543	62%	0.616	S	S	.	*	H	α-helix	trans	-60.1	-39.4	172.4	-75.6	170	179	179.3	0	111.5	M72 K80	M72-K76 WeakPolarHBondContact O-CB 3.38Å; M72-K76 WeakPolarHBondContact O-CG 3.25Å; M72-K76 PolarHBondContact O-N 3.16Å; K76-K80 WeakPolarHBondContact O-CB 3.11Å; K76-K80 PolarHBondContact O-N 2.57Å
77	G	52.6	Low	48.6	Very low	41 Å²	41	122.3 Å²	122.3	42%	0.423	63%	0.626	S	S	.	*	H	α-helix	trans	-64.3	-44.6	176.8	0	0	0	0	0	113.2	E73 L74 I75 K81	E73-G77 PolarHBondContact O-N 3.19Å; L74-G77 PolarHBondContact O-N 3.06Å; I75-G77 VanDerWaalsContact C-N 3.3Å; I75-G77 PolarHBondContact O-N 3.43Å; G77-K81 VanDerWaalsContact O-CB 3.3Å; G77-K81 WeakPolarHBondContact O-CB 3.23Å; G77-K81 PolarHBondContact O-N 3.35Å
78	L	51.1	Low	48.3	Very low	101 Å²	101	125 Å²	125	53%	0.529	64%	0.639	S	S	.	*	H	α-helix	trans	-69.5	-44.2	177.6	-72.5	167.2	0	0	0	112.1	L74 I75 K80 K81 N82	L74-L78 WeakPolarHBondContact O-CB 3.28Å; L74-L78 WeakPolarHBondContact O-CG 3.27Å; L74-L78 PolarHBondContact O-N 3.35Å; I75-L78 PolarHBondContact O-N 2.94Å; L78-K80 PolarHBondContact O-N 3.32Å; L78-K81 PolarHBondContact O-N 3.17Å; L78-N82 WeakPolarHBondContact O-CB 3.32Å; L78-N82 VanDerWaalsContact O-CG 3.3Å; L78-N82 PolarHBondContact O-N 3.32Å
79	L	52.3	Low	47.7	Very low	115 Å²	115	127.8 Å²	127.8	60%	0.602	65%	0.651	S	S	*	*	H	α-helix	trans	-61.1	-42.7	174.8	-74.6	168.1	0	0	0	112	I75 K81 N82 M83	I75-L79 HydrophobicContact CG2-CD1 3.8Å; I75-L79 HydrophobicContact CG2-CG 4.46Å; I75-L79 WeakPolarHBondContact O-CB 3.25Å; I75-L79 WeakPolarHBondContact O-CG 3.28Å; I75-L79 PolarHBondContact O-N 3.4Å; L79-K81 VanDerWaalsContact C-N 3.32Å; L79-K81 PolarHBondContact O-N 3.21Å; L79-N82 PolarHBondContact O-N 2.96Å; L79-M83 PolarHBondContact O-N 3.21Å
80	K	51.1	Low	47.2	Very low	169 Å²	169	125.6 Å²	125.6	74%	0.735	66%	0.655	S	S	*	*	H	α-helix	trans	-70.5	-26.7	178.8	-165.9	166.2	-174.6	172.4	0	113	K76 L78	K76-K80 WeakPolarHBondContact O-CB 3.11Å; K76-K80 PolarHBondContact O-N 2.57Å; L78-K80 PolarHBondContact O-N 3.32Å
81	K	47.7	Very low	46.6	Very low	165 Å²	165	123.7 Å²	123.7	72%	0.717	66%	0.66	S	S	*	*	H	α-helix	trans	-81.7	-25.1	175.7	-160.8	170.4	-173.5	178.7	0	113.3	G77 L78 L79 M83	G77-K81 VanDerWaalsContact O-CB 3.3Å; G77-K81 WeakPolarHBondContact O-CB 3.23Å; G77-K81 PolarHBondContact O-N 3.35Å; L78-K81 PolarHBondContact O-N 3.17Å; L79-K81 VanDerWaalsContact C-N 3.32Å; L79-K81 PolarHBondContact O-N 3.21Å; K81-M83 VanDerWaalsContact C-N 3.35Å
82	N	47.5	Very low	46.2	Very low	136 Å²	136	127 Å²	127	73%	0.727	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-1.5	176.5	-68.6	-7.8	0	0	0	113.9	L78 L79	L78-N82 WeakPolarHBondContact O-CB 3.32Å; L78-N82 VanDerWaalsContact O-CG 3.3Å; L78-N82 PolarHBondContact O-N 3.32Å; L79-N82 PolarHBondContact O-N 2.96Å
83	M	46.7	Very low	45.6	Very low	163 Å²	163	128.4 Å²	128.4	80%	0.803	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-5.9	179.2	-92.8	-74.5	172	0	0	114.6	L79 K81	L79-M83 PolarHBondContact O-N 3.21Å; K81-M83 VanDerWaalsContact C-N 3.35Å
84	T	37.7	Very low	45.4	Very low	107 Å²	107	128.8 Å²	128.8	66%	0.656	69%	0.688	S	S	*	*	S	Bend	trans	-136.2	72.4	-175.3	59.3	0	0	0	0	113.2
85	S	43.7	Very low	44.8	Very low	123 Å²	123	130.7 Å²	130.7	86%	0.86	70%	0.699	S	S	*	*			trans	-168.3	113.6	143.8	-101.9	0	0	0	0	109.7
86	K	34.1	Very low	44.2	Very low	201 Å²	201	132.8 Å²	132.8	87%	0.874	71%	0.711	S	S	*	*			trans	-80.7	129.1	164.8	-67.2	176.6	177.8	179	0	107.9
87	E	40.6	Very low	43.2	Very low	179 Å²	179	133.9 Å²	133.9	84%	0.836	72%	0.723	S	S	*	*			trans	-170.4	125.1	143.3	-108.1	155.4	-151.1	0	0	111.8
88	L	41.6	Very low	42.7	Very low	144 Å²	144	137.3 Å²	137.3	75%	0.754	73%	0.73	S	S	*	*			trans	54.9	97.7	151.1	-51.5	171	0	0	0	117.7
89	N	35.8	Very low	42.3	Very low	160 Å²	160	137.6 Å²	137.6	86%	0.856	73%	0.731	S	S	*	*				102.6	125.9	60.1	-83.3	0	0	0	0	112.5
90	G	34.6	Very low	41.7	Very low	66 Å²	66	138.8 Å²	138.8	68%	0.68	73%	0.734	S	S	*	*			trans	112	62	164.2	0	0	0	0	0	117.3
91	T	34.2	Very low	41.3	Very low	120 Å²	120	133.9 Å²	133.9	74%	0.736	72%	0.721	S	S	*	*				63.6	106.8	88	65.8	0	0	0	0	118.2
92	N	41.4	Very low	40.9	Very low	133 Å²	133	132.4 Å²	132.4	71%	0.711	72%	0.719	S	S	*	*			trans	169.2	88.4	144.6	-177.3	1.3	0	0	0	108	N94	N92-N94 PolarHBondContact OD1-ND2 3.48Å
93	N	39.7	Very low	40.7	Very low	131 Å²	131	132.1 Å²	132.1	70%	0.701	72%	0.717	S	S	*	*			cis	83.4	48.9	30.7	-54.6	38	0	0	0	116.2
94	N	48.3	Very low	40.4	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	71%	0.712	S	S	*	*			trans	-141.3	-5.3	174.7	-94.6	-55.4	0	0	0	119.6	N92	N92-N94 PolarHBondContact OD1-ND2 3.48Å
95	N	41.8	Very low	40.6	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	72%	0.715	S	S	*	*			trans	-126.5	10.7	-171.6	-100.4	-12.1	0	0	0	117.6	N97	N95-N97 VanDerWaalsContact C-N 3.29Å; N95-N97 PolarHBondContact O-N 3.14Å
96	N	42.3	Very low	40.4	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-10.9	-175.1	-79.9	3.3	0	0	0	115.6	I98 I99	N96-I98 VanDerWaalsContact C-N 3.3Å; N96-I98 PolarHBondContact O-N 3.4Å; N96-I99 PolarHBondContact O-N 2.85Å
97	N	43	Very low	40.2	Very low	148 Å²	148	134.4 Å²	134.4	79%	0.791	71%	0.713	S	S	*	*	H	α-helix	trans	-74	-14.3	-171.7	-68.9	4.1	0	0	0	114.6	N95	N95-N97 VanDerWaalsContact C-N 3.29Å; N95-N97 PolarHBondContact O-N 3.14Å
98	I	41.4	Very low	40	Very low	113 Å²	113	134 Å²	134	58%	0.579	71%	0.712	S	S	*	*	H	α-helix	trans	-82.6	-24.7	177.6	-63.4	173.4	0	0	0	111.7	N96 S101 I102	N96-I98 VanDerWaalsContact C-N 3.3Å; N96-I98 PolarHBondContact O-N 3.4Å; I98-S101 PolarHBondContact O-OG 2.88Å; I98-I102 HydrophobicContact CG2-CD1 4.36Å
99	I	42.1	Very low	39.6	Very low	108 Å²	108	135.8 Å²	135.8	55%	0.554	71%	0.713	S	S	*	*	H	α-helix	trans	-84	-33.8	-172.6	-62.2	177.7	0	0	0	111.8	N96 L103	N96-I99 PolarHBondContact O-N 2.85Å; I99-L103 HydrophobicContact CG2-CD1 4.22Å
100	Q	41.3	Very low	39.2	Very low	140 Å²	140	134.3 Å²	134.3	65%	0.654	71%	0.71	S	S	*	*	H	α-helix	trans	-75.9	-30	179.5	-72.3	-165.2	-17.7	0	0	114.1	I102 L103 N104	Q100-I102 VanDerWaalsContact C-N 3.28Å; Q100-I102 PolarHBondContact O-N 2.68Å; Q100-L103 PolarHBondContact O-N 3.45Å; Q100-N104 PolarHBondContact O-N 3.35Å
101	S	42.8	Very low	39	Very low	65 Å²	65	137.3 Å²	137.3	46%	0.455	72%	0.715	S	S	.	*	H	α-helix	trans	-70.7	-23	178.1	53.9	0	0	0	0	113.4	I98 N105	I98-S101 PolarHBondContact O-OG 2.88Å; S101-N105 PolarHBondContact O-ND2 3.06Å
102	I	39.7	Very low	39	Very low	134 Å²	134	139.5 Å²	139.5	69%	0.687	72%	0.717	S	S	*	*	H	α-helix	trans	-83.8	-28.2	176.5	-63.6	173.6	0	0	0	111.5	I98 Q100	I98-I102 HydrophobicContact CG2-CD1 4.36Å; Q100-I102 VanDerWaalsContact C-N 3.28Å; Q100-I102 PolarHBondContact O-N 2.68Å
103	L	42.9	Very low	38.6	Very low	131 Å²	131	137.4 Å²	137.4	69%	0.686	71%	0.712	S	S	*	*	H	α-helix	trans	-84.3	-28.5	-179.4	-78.9	163.8	0	0	0	114.2	I99 Q100	I99-L103 HydrophobicContact CG2-CD1 4.22Å; Q100-L103 PolarHBondContact O-N 3.45Å
104	N	39.8	Very low	38.1	Very low	129 Å²	129	137.1 Å²	137.1	69%	0.69	72%	0.716	S	S	*	*	S	Bend	trans	-89.2	1.2	-173.2	-71.5	-5.1	0	0	0	115.6	Q100	Q100-N104 PolarHBondContact O-N 3.35Å
105	N	41.2	Very low	37.4	Very low	134 Å²	134	135.5 Å²	135.5	72%	0.717	72%	0.715	S	S	*	*	S	Bend	trans	-102	23.7	-171.2	-85.9	-52.3	0	0	0	115.1	S101	S101-N105 PolarHBondContact O-ND2 3.06Å
106	K	39.2	Very low	37.1	Very low	193 Å²	193	135.2 Å²	135.2	84%	0.839	71%	0.714	S	S	*	*	S	Bend	trans	-145.8	67.3	175.4	-73.5	-172.3	175.7	177.9	0	113.1
107	E	31.8	Very low	36.7	Very low	185 Å²	185	135.4 Å²	135.4	86%	0.864	71%	0.714	S	S	*	*			trans	-179.6	88.8	151.6	-104.2	158	-144.9	0	0	111.9
108	Q	36.2	Very low	36.4	Very low	172 Å²	172	134 Å²	134	80%	0.804	71%	0.705	S	S	*	*			trans	171.7	142.8	160.7	-100.4	163.2	101.5	0	0	108.4
109	K	32.9	Very low	36.2	Very low	181 Å²	181	135.9 Å²	135.9	79%	0.787	71%	0.712	S	S	*	*			cis	-153.3	160	-6.9	-140.2	166.8	-165.8	163.7	0	108.9
110	T	26.6	Very low	36.1	Very low	129 Å²	129	135.3 Å²	135.3	79%	0.791	71%	0.71	S	S	*	*			trans	-112.2	174.4	-172.9	-39	0	0	0	0	111.5
111	V	30	Very low	36	Very low	128 Å²	128	135.7 Å²	135.7	78%	0.776	71%	0.709	S	S	*	*			trans	65.3	150.6	176	-98.7	0	0	0	0	114.8
112	E	35.3	Very low	35.6	Very low	167 Å²	167	139.2 Å²	139.2	78%	0.78	72%	0.723	S	S	*	*			cis	-157.4	168.7	33.6	-140.4	166.2	-124.1	0	0	114.2
113	S	33.3	Very low	35.5	Very low	88 Å²	88	140.9 Å²	140.9	62%	0.615	73%	0.728	S	S	*	*			trans	53.5	101.7	154.3	-57.4	0	0	0	0	120.5
114	T	29.3	Very low	35.1	Very low	126 Å²	126	140.1 Å²	140.1	77%	0.773	73%	0.728	S	S	*	*				78.2	132.3	70	61.8	0	0	0	0	117.2
115	S	32.4	Very low	34.8	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	73%	0.732	S	S	*	*			trans	67.6	137.2	167.6	-70.8	0	0	0	0	117.7
116	D	36.6	Very low	34.5	Very low	131 Å²	131	140.2 Å²	140.2	70%	0.701	73%	0.733	S	S	*	*			cis	-166.1	-159.9	-10.1	-119.7	-69.2	0	0	0	107.9
117	L	33.3	Very low	34.2	Very low	134 Å²	134	138.2 Å²	138.2	70%	0.702	73%	0.73	S	S	*	*			cis	-160.5	143.6	12.1	-156.1	75.4	0	0	0	110.7
118	I	36.5	Very low	34.4	Very low	118 Å²	118	133.7 Å²	133.7	61%	0.605	72%	0.719	S	S	*	*			trans	62.7	119.5	142.1	-84.6	176.1	0	0	0	124
119	Q	37.8	Very low	34.2	Very low	154 Å²	154	132.7 Å²	132.7	72%	0.72	72%	0.719	S	S	*	*			trans	67.4	152.5	133.1	-66.6	175.4	5	0	0	121.7
120	D	38.5	Very low	34.5	Very low	95 Å²	95	133.5 Å²	133.5	51%	0.508	73%	0.725	S	S	.	*			cis	-158.8	163.6	-3.8	-125	-31.3	0	0	0	115
121	K	39.6	Very low	34.9	Very low	149 Å²	149	134.1 Å²	134.1	65%	0.648	72%	0.724	S	S	*	*			trans	37.4	131.3	147.3	-71.5	147.8	-162.6	152.3	0	121.1
122	N	34.9	Very low	35.5	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	72%	0.717	S	S	*	*			cis	109.1	158.6	37.6	-81.2	-12.4	0	0	0	112.3
123	H	38	Very low	35.6	Very low	170 Å²	170	129.2 Å²	129.2	79%	0.787	71%	0.711	S	S	*	*			trans	81.2	102.9	-177.1	-56.6	-77.3	0	0	0	114.2
124	T	33.1	Very low	35.7	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	72%	0.715	S	S	*	*			cis	80.9	133.1	27.9	-34.4	0	0	0	0	114.5
125	N	34.8	Very low	36	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	72%	0.716	S	S	*	*			trans	92.4	150.1	172.8	-61.8	-29.3	0	0	0	119
126	V	34	Very low	35.9	Very low	122 Å²	122	137.9 Å²	137.9	74%	0.739	72%	0.722	S	S	*	*			cis	179.5	167.4	-43.8	133.4	0	0	0	0	110.1
127	I	34.1	Very low	35.7	Very low	151 Å²	151	137.6 Å²	137.6	77%	0.774	73%	0.725	S	S	*	*			trans	80.3	136.4	171.7	-20.7	179.2	0	0	0	120.3
128	S	35.9	Very low	35.6	Very low	91 Å²	91	136.7 Å²	136.7	64%	0.636	73%	0.729	S	S	*	*			trans	84.3	91.2	142.4	36.3	0	0	0	0	122.4
129	N	31.3	Very low	35.5	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	74%	0.736	S	S	*	*				46.3	118.4	109.8	-51.7	-4.3	0	0	0	120.1
130	H	39.3	Very low	35	Very low	198 Å²	198	138.2 Å²	138.2	92%	0.917	74%	0.742	S	S	*	*				-153	130.8	124.2	-121.3	-72.6	0	0	0	113
131	D	34.9	Very low	34.8	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	76%	0.76	S	S	*	*			trans	-113.3	180	169.8	-149.1	22.9	0	0	0	106.3
132	P	42.7	Very low	34.4	Very low	98 Å²	98	142.3 Å²	142.3	64%	0.636	77%	0.765	S	S	*	*			cis	-135	-170.3	-7.6	43.3	-26.7	0	0	0	114.2
133	S	37.3	Very low	34.4	Very low	95 Å²	95	143 Å²	143	66%	0.664	76%	0.764	S	S	*	*				168.6	144.2	117.4	55.4	0	0	0	0	116.6
134	N	35.1	Very low	34.2	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	76%	0.758	S	S	*	*			trans	57.7	143.2	148.8	-66.9	-41.9	0	0	0	120.1
135	R	34.9	Very low	34.1	Very low	207 Å²	207	140.6 Å²	140.6	78%	0.781	76%	0.756	S	S	*	*			cis	-158.6	133.4	1.1	-121.4	163.1	-163	178.8	0.7	109.4
136	N	31	Very low	34	Very low	165 Å²	165	139.4 Å²	139.4	88%	0.882	75%	0.754	S	S	*	*			trans	-94.2	141.2	162.6	-77.3	-24.4	0	0	0	109.7
137	V	32.5	Very low	34	Very low	124 Å²	124	141.3 Å²	141.3	75%	0.752	76%	0.756	S	S	*	*			trans	-133.3	114.9	169.9	178.2	0	0	0	0	108.9	I139	V137-I139 HydrophobicContact CG1-CG1 4.46Å
138	S	30.9	Very low	34.2	Very low	115 Å²	115	139.6 Å²	139.6	80%	0.804	75%	0.752	S	S	*	*			trans	-90.3	143	171.1	-52.5	0	0	0	0	109.8
139	I	34.6	Very low	34.2	Very low	144 Å²	144	144.2 Å²	144.2	74%	0.738	76%	0.763	S	S	*	*			trans	-125.8	101.4	167.1	-56.9	179.2	0	0	0	108.1	V137	V137-I139 HydrophobicContact CG1-CG1 4.46Å
140	N	27.1	Very low	34.2	Very low	160 Å²	160	143.8 Å²	143.8	86%	0.856	76%	0.761	S	S	*	*			trans	-95.7	139	154.7	-83.8	-18	0	0	0	107.5
141	L	35.2	Very low	34.2	Very low	168 Å²	168	140.2 Å²	140.2	88%	0.88	76%	0.755	S	S	*	*			trans	-131.8	143.8	158.6	-96.7	166.4	0	0	0	108
142	H	30.3	Very low	34.2	Very low	163 Å²	163	138.1 Å²	138.1	76%	0.755	75%	0.752	S	S	*	*			trans	-126.4	-171.9	-168.9	-166.5	58.4	0	0	0	108.5
143	E	35	Very low	34	Very low	152 Å²	152	139.3 Å²	139.3	71%	0.71	76%	0.76	S	S	*	*			trans	72.4	145	166.6	-57.6	-178.6	-146.9	0	0	116.3
144	N	34.8	Very low	33.8	Very low	123 Å²	123	140.1 Å²	140.1	66%	0.658	77%	0.765	S	S	*	*			cis	-154.2	178.6	-11.6	-112.1	-24.6	0	0	0	112.1
145	T	29.6	Very low	33.5	Very low	111 Å²	111	141.6 Å²	141.6	68%	0.681	77%	0.773	S	S	*	*			trans	-41.4	164.9	170.9	12.7	0	0	0	0	115.8
146	T	34.2	Very low	33.5	Very low	117 Å²	117	136.3 Å²	136.3	72%	0.718	77%	0.774	S	S	*	*				-162.9	135.8	53.6	-47.5	0	0	0	0	114.6
147	E	33.7	Very low	33.6	Very low	163 Å²	163	137.9 Å²	137.9	76%	0.762	77%	0.773	S	S	*	*			trans	9.9	166	146.3	-47.5	176.4	148.1	0	0	125.5
148	V	36.9	Very low	33.6	Very low	115 Å²	115	139.3 Å²	139.3	70%	0.697	78%	0.776	S	S	*	*			trans	114.7	118.2	146.9	-170.8	0	0	0	0	119.2
149	E	37.1	Very low	33.6	Very low	188 Å²	188	141.1 Å²	141.1	88%	0.879	78%	0.776	S	S	*	*			trans	74.7	124.7	154.3	-77.6	161.4	-150.8	0	0	125.5
150	D	31.7	Very low	33.5	Very low	140 Å²	140	141.5 Å²	141.5	75%	0.749	78%	0.778	S	S	*	*			trans	-69	169.5	157.7	-107	-55.5	0	0	0	111.5
151	P	38.1	Very low	33.5	Very low	123 Å²	123	139 Å²	139	80%	0.799	77%	0.768	S	S	*	*			cis	-146.9	179.6	40.8	41	-19	0	0	0	119.2
152	S	34.6	Very low	33.5	Very low	98 Å²	98	138 Å²	138	69%	0.685	76%	0.763	S	S	*	*			trans	-76.5	-174.8	177.2	-61.9	0	0	0	0	114.6
153	P	38.6	Very low	33.5	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	76%	0.761	S	S	*	*				-137.1	154.9	-56.6	37.9	-22.9	0	0	0	114
154	S	34.3	Very low	33.4	Very low	111 Å²	111	138 Å²	138	78%	0.776	77%	0.767	S	S	*	*			trans	-157.5	127.7	163.5	68.9	0	0	0	0	117.4
155	N	29.4	Very low	33.3	Very low	162 Å²	162	137.7 Å²	137.7	87%	0.866	77%	0.77	S	S	*	*			trans	39.3	103.5	143.4	-66	-32.9	0	0	0	120.9
156	A	34.8	Very low	33.4	Very low	96 Å²	96	139.1 Å²	139.1	79%	0.793	77%	0.773	S	S	*	*			trans	-146.6	108.9	143.1	0	0	0	0	0	110.9
157	K	31.5	Very low	33.4	Very low	199 Å²	199	143.6 Å²	143.6	87%	0.865	78%	0.779	S	S	*	*			trans	-78.8	130.6	171	-66.9	175.6	179.9	175.2	0	109.1
158	N	33	Very low	33.3	Very low	153 Å²	153	141 Å²	141	82%	0.818	78%	0.778	S	S	*	*			trans	-130.7	98.2	163.6	-91.3	-43.9	0	0	0	109.8	I160	N158-I160 PolarHBondContact O-N 3.29Å
159	L	30.5	Very low	33.2	Very low	154 Å²	154	142 Å²	142	81%	0.806	79%	0.785	S	S	*	*			trans	-71.3	122.6	166.2	-113	70.1	0	0	0	108.3	T161	L159-T161 PolarHBondContact O-N 3.34Å
160	I	32.4	Very low	33	Very low	151 Å²	151	138 Å²	138	77%	0.774	78%	0.777	S	S	*	*			trans	-89.8	90.5	166.9	-60.3	-179.5	0	0	0	107.4	N158 I162	N158-I160 PolarHBondContact O-N 3.29Å; I160-I162 PolarHBondContact O-N 3.31Å
161	T	28.3	Very low	33.1	Very low	107 Å²	107	136.2 Å²	136.2	66%	0.656	78%	0.776	S	S	*	*			trans	-65.7	112.7	172.8	-53.8	0	0	0	0	109.6	L159	L159-T161 PolarHBondContact O-N 3.34Å
162	I	33.8	Very low	33	Very low	149 Å²	149	138 Å²	138	76%	0.764	78%	0.778	S	S	*	*			trans	-89.3	116.9	169.1	-62	176	0	0	0	107.4	I160 Q164	I160-I162 PolarHBondContact O-N 3.31Å; I162-Q164 PolarHBondContact O-N 3.41Å
163	N	30.5	Very low	33	Very low	135 Å²	135	138.1 Å²	138.1	72%	0.722	78%	0.777	S	S	*	*			trans	-67.3	117.4	179.5	-70	-17	0	0	0	110.6	T165	N163-T165 PolarHBondContact O-N 2.75Å
164	Q	33.9	Very low	32.9	Very low	180 Å²	180	138.5 Å²	138.5	84%	0.841	78%	0.78	S	S	*	*			trans	-71.1	115	167.8	-70.8	175	-32.9	0	0	109.7	I162 N166	I162-Q164 PolarHBondContact O-N 3.41Å; Q164-N166 PolarHBondContact O-N 3.38Å
165	T	32.4	Very low	33	Very low	116 Å²	116	139 Å²	139	71%	0.712	78%	0.778	S	S	*	*			trans	-85.5	101	169.7	47.2	0	0	0	0	109.7	N163 Y167	N163-T165 PolarHBondContact O-N 2.75Å; T165-Y167 PolarHBondContact O-N 2.87Å
166	N	30.7	Very low	33.5	Very low	141 Å²	141	136.9 Å²	136.9	75%	0.754	78%	0.776	S	S	*	*			trans	-59.6	119.1	176.8	-66.5	-30	0	0	0	111.4	Q164	Q164-N166 PolarHBondContact O-N 3.38Å
167	Y	35.2	Very low	33.4	Very low	211 Å²	211	138.5 Å²	138.5	83%	0.827	77%	0.771	S	S	*	*			trans	-96.3	91.7	169	-96.7	-86.8	0	0	0	110.7	T165 V169	T165-Y167 PolarHBondContact O-N 2.87Å; Y167-V169 PolarHBondContact O-N 3.13Å; Y167-V169 VanDerWaalsContact O-N 3.16Å
168	S	31.8	Very low	33.7	Very low	108 Å²	108	136.7 Å²	136.7	76%	0.755	77%	0.771	S	S	*	*			trans	-72.7	99.6	172	-55.9	0	0	0	0	110.5
169	V	34.9	Very low	33.9	Very low	137 Å²	137	133.3 Å²	133.3	83%	0.83	75%	0.753	S	S	*	*			trans	-88.1	107.1	171.2	-177.9	0	0	0	0	109.2	Y167 S171	Y167-V169 PolarHBondContact O-N 3.13Å; Y167-V169 VanDerWaalsContact O-N 3.16Å; V169-S171 PolarHBondContact O-N 2.9Å
170	S	33.3	Very low	34.3	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	74%	0.743	S	S	*	*			trans	-66.1	121.3	-176.8	-58.2	0	0	0	0	112.7
171	S	33.4	Very low	34.4	Very low	103 Å²	103	127.1 Å²	127.1	72%	0.72	72%	0.721	S	S	*	*			trans	-71.9	130.2	162.3	-177.4	0	0	0	0	110.1	V169	V169-S171 PolarHBondContact O-N 2.9Å
172	L	35	Very low	34.8	Very low	161 Å²	161	128.9 Å²	128.9	84%	0.843	73%	0.725	S	S	*	*			trans	-129.6	91.9	172	-83.1	171	0	0	0	109.4
173	C	34.3	Very low	34.9	Very low	99 Å²	99	128.5 Å²	128.5	67%	0.669	73%	0.725	S	S	*	*			trans	-102.2	118.4	169.4	-62.4	0	0	0	0	109.5	V175	C173-V175 PolarHBondContact O-N 3.42Å
174	P	36.7	Very low	35.1	Very low	132 Å²	132	126 Å²	126	86%	0.857	72%	0.723	S	S	*	*			trans	-75	120.2	165.9	30.4	-30.4	0	0	0	109
175	V	37	Very low	35.1	Very low	122 Å²	122	124.4 Å²	124.4	74%	0.739	72%	0.72	S	S	*	*			trans	-104.5	127.3	172.7	178.5	0	0	0	0	108.8	C173 N177	C173-V175 PolarHBondContact O-N 3.42Å; V175-N177 WeakPolarHBondContact CG1-OD1 3.43Å
176	S	40.7	Very low	35.1	Very low	117 Å²	117	123.3 Å²	123.3	82%	0.818	72%	0.717	S	S	*	*			trans	-123.1	116.9	168.5	54.6	0	0	0	0	108.5
177	N	32.8	Very low	35.3	Very low	130 Å²	130	122.4 Å²	122.4	70%	0.695	72%	0.717	S	S	*	*			trans	-84.8	164.2	175.4	-56.8	-23.4	0	0	0	110.6	V175	V175-N177 WeakPolarHBondContact CG1-OD1 3.43Å
178	D	38.1	Very low	35.2	Very low	162 Å²	162	119 Å²	119	87%	0.866	71%	0.712	S	S	*	*			trans	-165.1	159.1	140.9	-93.4	-31.5	0	0	0	110
179	D	36.5	Very low	35.1	Very low	81 Å²	81	119.6 Å²	119.6	43%	0.433	71%	0.707	S	S	.	*			trans	-120.2	-176.3	-158.3	-69	-39.3	0	0	0	116.2	T610 M611	D179-T610 HydrophobicContact CB-CG2 4.06Å; D179-M611 HydrophobicContact CB-CE 4.17Å; D179-M611 WeakPolarHBondContact OD1-CE 3.35Å; D179-M611 WeakPolarHBondContact OD2-CE 3.42Å
180	H	38.9	Very low	35	Very low	129 Å²	129	119.3 Å²	119.3	60%	0.597	70%	0.701	S	S	*	*			trans	98.4	135.1	159.5	-59.3	-49.2	0	0	0	120	T609 T610	H180-T609 WeakPolarHBondContact O-CB 3.45Å; H180-T609 PolarHBondContact O-N 3.2Å; H180-T609 VanDerWaalsContact O-N 3.1Å; H180-T609 PolarHBondContact O-OG1 3.34Å; H180-T610 WeakPolarHBondContact CA-OG1 3.49Å; H180-T610 PolarHBondContact N-OG1 2.92Å
181	S	34.2	Very low	35	Very low	46 Å²	46	122 Å²	122	32%	0.322	71%	0.706	S	S	.	*			cis	-168.6	151.2	-24	-119.6	0	0	0	0	113.5	T609 T610	S181-T609 CarbonylContact C-O 3.58Å; S181-T609 WeakPolarHBondContact CA-O 3.33Å; S181-T609 PolarHBondContact N-O 3.31Å; S181-T609 VanDerWaalsContact N-O 3.16Å; S181-T610 CarbonylContact C-O 3.56Å; S181-T610 WeakPolarHBondContact CA-O 3.46Å
182	I	37.6	Very low	34.8	Very low	145 Å²	145	122.4 Å²	122.4	74%	0.744	71%	0.708	S	S	*	*			trans	76.5	162.5	154.9	-60.1	157.5	0	0	0	116.5	T609 T610	I182-T609 PolarHBondContact N-O 3.08Å; I182-T610 PolarHBondContact N-O 3.29Å
183	N	34.2	Very low	34.8	Very low	141 Å²	141	121 Å²	121	75%	0.754	71%	0.706	S	S	*	*			cis	-178.5	170.7	-46.1	-167.8	8.8	0	0	0	108.7
184	A	35.4	Very low	34.6	Very low	82 Å²	82	123.4 Å²	123.4	68%	0.678	71%	0.712	S	S	*	*			trans	124.5	101.9	151	0	0	0	0	0	118.7
185	N	33.3	Very low	34.6	Very low	146 Å²	146	127.4 Å²	127.4	78%	0.781	72%	0.716	S	S	*	*			trans	3.6	150.4	136.9	-49.6	-18.7	0	0	0	118.4
186	S	34.4	Very low	34.2	Very low	94 Å²	94	126.2 Å²	126.2	66%	0.657	72%	0.719	S	S	*	*				-179.5	158.3	60.2	56.8	0	0	0	0	115.7
187	T	34.1	Very low	34	Very low	121 Å²	121	126.1 Å²	126.1	74%	0.742	72%	0.718	S	S	*	*			trans	61.7	149.5	152.7	54.7	0	0	0	0	119.8
188	L	32.7	Very low	34	Very low	140 Å²	140	125.8 Å²	125.8	73%	0.733	72%	0.721	S	S	*	*			cis	-160.8	140.6	-10.4	-113.5	165.4	0	0	0	110.5
189	N	30.5	Very low	34	Very low	121 Å²	121	125.8 Å²	125.8	65%	0.647	72%	0.721	S	S	*	*			trans	50.8	150.5	138.4	-92.5	42.8	0	0	0	126
190	D	32	Very low	33.9	Very low	131 Å²	131	130.6 Å²	130.6	70%	0.701	74%	0.741	S	S	*	*			trans	65.9	132.9	144.2	-60	-25.7	0	0	0	119.1
191	L	34	Very low	33.8	Very low	159 Å²	159	129.4 Å²	129.4	83%	0.832	75%	0.745	S	S	*	*			cis	-152.3	158.6	24.4	-111.3	134	0	0	0	112.8
192	C	28.6	Very low	33.9	Very low	112 Å²	112	134.3 Å²	134.3	76%	0.757	77%	0.772	S	S	*	*			trans	-96	149.5	163.3	-71.1	0	0	0	0	111.5
193	T	34.3	Very low	33.6	Very low	131 Å²	131	133 Å²	133	80%	0.804	77%	0.771	S	S	*	*			trans	-164	112.7	140.5	4.6	0	0	0	0	114.7
194	N	30.8	Very low	33.7	Very low	150 Å²	150	132.3 Å²	132.3	80%	0.802	78%	0.777	S	S	*	*			trans	13.4	133.6	141.3	-54.5	-17.8	0	0	0	120.8
195	K	36	Very low	33.5	Very low	216 Å²	216	134.6 Å²	134.6	94%	0.939	78%	0.783	S	S	*	*				-158.4	133.4	119.4	-111.1	162.6	-172.8	174.1	0	112.1
196	A	29.2	Very low	33.7	Very low	96 Å²	96	134.1 Å²	134.1	79%	0.793	79%	0.785	S	S	*	*			trans	-142.3	127.1	174.1	0	0	0	0	0	110
197	S	36.4	Very low	33.7	Very low	115 Å²	115	137.6 Å²	137.6	80%	0.804	80%	0.795	S	S	*	*			trans	-151.7	100	170.5	-55.5	0	0	0	0	106.5
198	T	33	Very low	33.7	Very low	123 Å²	123	135.3 Å²	135.3	76%	0.755	80%	0.795	S	S	*	*				67.2	104.2	82.5	-55.2	0	0	0	0	113.6
199	N	37.6	Very low	33.6	Very low	162 Å²	162	137.9 Å²	137.9	87%	0.866	80%	0.803	S	S	*	*				-163	146.3	129.4	-92.8	-25.9	0	0	0	110.2
200	Q	34	Very low	33.9	Very low	182 Å²	182	137.1 Å²	137.1	85%	0.85	81%	0.807	S	S	*	*			trans	-120.4	-152.8	-173.3	-71.1	-170.6	-28.2	0	0	110.5
201	P	36.7	Very low	34.3	Very low	105 Å²	105	139.9 Å²	139.9	68%	0.682	81%	0.813	S	S	*	*				-129	170.6	-83.3	38.3	-23.5	0	0	0	114.2
202	V	37.1	Very low	34.4	Very low	148 Å²	148	140.2 Å²	140.2	90%	0.897	82%	0.815	S	S	*	*			trans	-140.4	145.8	149.3	-173	0	0	0	0	110.2
203	T	32.5	Very low	35.1	Very low	118 Å²	118	141.3 Å²	141.3	72%	0.724	81%	0.813	S	S	*	*			trans	-96.1	150	-171.4	49.1	0	0	0	0	115.1
204	S	35.7	Very low	35.7	Very low	126 Å²	126	140 Å²	140	88%	0.881	81%	0.809	S	S	*	*			trans	-161.5	151.1	141	-82.2	0	0	0	0	110.2
205	T	30.8	Very low	37	Very low	131 Å²	131	137.2 Å²	137.2	80%	0.804	79%	0.794	S	S	*	*			trans	-137.8	116.8	-161.7	-55.2	0	0	0	0	113.3
206	V	36.5	Very low	38.5	Very low	135 Å²	135	134.9 Å²	134.9	82%	0.818	79%	0.787	S	S	*	*			trans	-144	107	161.5	-175.7	0	0	0	0	111.5
207	I	34.8	Very low	41	Very low	168 Å²	168	134.3 Å²	134.3	86%	0.862	77%	0.77	S	S	*	*			trans	27.2	121.7	136.9	-47.7	172	0	0	0	118.9
208	G	33.7	Very low	43.3	Very low	72 Å²	72	132.4 Å²	132.4	74%	0.742	75%	0.749	S	S	*	*			trans	163.2	103.2	157.8	0	0	0	0	0	115.7
209	H	31.3	Very low	45.9	Very low	194 Å²	194	126.7 Å²	126.7	90%	0.898	71%	0.713	S	S	*	*			trans	-83.8	158.1	163.3	-57.5	-85.5	0	0	0	109.2
210	S	37.8	Very low	48.4	Very low	106 Å²	106	121.7 Å²	121.7	74%	0.741	69%	0.689	S	S	*	*			cis	-156.3	136.7	19.9	55	0	0	0	0	114.7
211	K	38.9	Very low	51.1	Low	189 Å²	189	113 Å²	113	82%	0.822	65%	0.648	S	S	*	*			trans	39.6	108.2	149.1	-68.6	-174.5	174.5	-177.1	0	119.6	L213	K211-L213 PolarHBondContact O-N 3.37Å
212	D	36.2	Very low	53.4	Low	165 Å²	165	108.9 Å²	108.9	88%	0.882	63%	0.625	S	S	*	*			trans	-62.3	119.8	149.8	-52.5	-84.1	0	0	0	111.4
213	L	44	Very low	55.8	Low	136 Å²	136	102.8 Å²	102.8	71%	0.712	59%	0.589	S	S	*	*			trans	-146.5	112.6	158.7	-89.1	174.7	0	0	0	107.3	K211 N215	K211-L213 PolarHBondContact O-N 3.37Å; L213-N215 PolarHBondContact O-N 3.24Å
214	S	47.8	Very low	58.5	Low	102 Å²	102	99.1 Å²	99.1	71%	0.713	57%	0.567	S	S	*	*			trans	-72.8	92	179.8	54	0	0	0	0	110.7	E216	S214-E216 PolarHBondContact O-N 2.95Å
215	N	56.6	Low	61	Low	93 Å²	93	98 Å²	98	50%	0.497	55%	0.551	S	S	.	*			trans	-69.1	98.6	179.2	-76	-19.2	0	0	0	111.5	L213 N217 E218	L213-N215 PolarHBondContact O-N 3.24Å; N215-N217 PolarHBondContact O-N 3.31Å; N215-E218 HydrophobicContact CB-CG 4.02Å; N215-E218 VanDerWaalsContact CB-OE1 3.29Å; N215-E218 WeakPolarHBondContact CB-OE1 3.4Å; N215-E218 PolarHBondContact ND2-OE1 3.04Å; N215-E218 PolarHBondContact O-N 2.91Å; N215-E218 VanDerWaalsContact O-N 3.14Å
216	E	68.1	Low	63.6	Low	166 Å²	166	96.1 Å²	96.1	78%	0.776	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-12	174.8	-58.9	-175.4	149.1	0	0	114.1	S214 Y236	S214-E216 PolarHBondContact O-N 2.95Å; E216-Y236 PolarHBondContact O-OH 2.8Å
217	N	81	Confident	66.1	Low	84 Å²	84	94.5 Å²	94.5	45%	0.449	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	1.8	179.9	-64.7	-46.9	0	0	0	114.1	N215 R230	N215-N217 PolarHBondContact O-N 3.31Å; N217-R230 HydrophobicContact CB-CB 4.27Å; N217-R230 WeakPolarHBondContact O-CB 3.49Å; N217-R230 PolarHBondContact O-N 3.35Å
218	E	85.5	Confident	68.6	Low	75 Å²	75	87.6 Å²	87.6	35%	0.35	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.4	-174.8	-71.7	176.4	-151.4	0	0	113.4	N215 I227 V229	N215-E218 HydrophobicContact CB-CG 4.02Å; N215-E218 VanDerWaalsContact CB-OE1 3.29Å; N215-E218 WeakPolarHBondContact CB-OE1 3.4Å; N215-E218 PolarHBondContact ND2-OE1 3.04Å; N215-E218 PolarHBondContact O-N 2.91Å; N215-E218 VanDerWaalsContact O-N 3.14Å; E218-I227 HydrophobicContact CB-CG2 3.88Å; E218-I227 HydrophobicContact CG-CG2 3.83Å; E218-V229 HydrophobicContact CG-CG2 4.32Å
219	I	88.1	Confident	71.1	Confident	3 Å²	3	87.2 Å²	87.2	2%	0.015	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.5	171.2	-175.1	166.8	0	0	0	110.5	L228 Y236 L239 L240 L323	I219-L228 HydrophobicContact CG2-CB 3.96Å; I219-L228 PolarHBondContact N-O 3.19Å; I219-L228 PolarHBondContact O-N 2.97Å; I219-Y236 HydrophobicContact CB-CD1 4.11Å; I219-Y236 HydrophobicContact CG2-CD1 4.13Å; I219-L239 HydrophobicContact CG2-CD2 4.04Å; I219-L240 HydrophobicContact CD1-CD2 3.94Å; I219-L240 HydrophobicContact CG1-CD2 4.49Å; I219-L323 HydrophobicContact CD1-CD2 3.38Å; I219-L323 HydrophobicContact CD1-CG 3.93Å
220	V	88.6	Confident	73.6	Confident	57 Å²	57	81.1 Å²	81.1	35%	0.345	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.7	-178.2	-174.2	0	0	0	0	110.3	N225 Q226 I227	V220-N225 HydrophobicContact CG1-CB 4.4Å; V220-Q226 WeakPolarHBondContact CA-O 3.19Å; V220-I227 HydrophobicContact CG2-CG1 4.26Å
221	C	91.4	Very high	75.4	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	43%	0.431	C	S	.	.			trans	-75.9	125.8	170.8	176	0	0	0	0	111.2	S223 C224 N225 Q226 L240 H243	C221-S223 PolarHBondContact O-N 3.07Å; C221-S223 PolarHBondContact SG-N 2.89Å; C221-C224 PolarHBondContact O-N 3.39Å; C221-N225 VanDerWaalsContact O-CA 3.23Å; C221-N225 WeakPolarHBondContact O-CA 3.29Å; C221-N225 PolarHBondContact O-N 3.44Å; C221-Q226 PolarHBondContact N-O 3Å; C221-L240 HydrophobicContact CB-CD1 3.67Å; C221-H243 WeakPolarHBondContact CB-NE2 3.3Å; C221-H243 VanDerWaalsContact SG-CD2 3.58Å; C221-H243 PolarHBondContact SG-NE2 3.33Å; C221-H243 VanDerWaalsContact SG-NE2 3.38Å
222	G	85.8	Confident	76.9	Confident	18 Å²	18	82 Å²	82	19%	0.186	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.1	-179.1	0	0	0	0	0	115.2	Y258 D322	G222-Y258 WeakPolarHBondContact O-CE2 3.42Å; G222-Y258 VanDerWaalsContact O-CZ 3.32Å; G222-Y258 PolarHBondContact O-OH 3.31Å; G222-D322 WeakPolarHBondContact CA-OD2 3.39Å; G222-D322 PolarHBondContact N-OD2 2.77Å
223	S	87.5	Confident	78.6	Confident	21 Å²	21	82 Å²	82	15%	0.147	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-46.3	175.2	-66.3	0	0	0	0	113.3	C221 Y244 Y258	C221-S223 PolarHBondContact O-N 3.07Å; C221-S223 PolarHBondContact SG-N 2.89Å; S223-Y244 WeakPolarHBondContact OG-CE1 3.4Å; S223-Y244 PolarHBondContact OG-OH 2.75Å; S223-Y258 WeakPolarHBondContact OG-CD1 3.37Å
224	C	89.4	Confident	80.4	Confident	40 Å²	40	79.6 Å²	79.6	27%	0.27	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-3.7	-167.7	64.5	0	0	0	0	114.1	C221 Q226 H243	C221-C224 PolarHBondContact O-N 3.39Å; C224-Q226 HydrophobicContact CB-CG 4.36Å; C224-Q226 PolarHBondContact O-N 2.79Å; C224-Q226 VanDerWaalsContact O-N 3.15Å; C224-Q226 VanDerWaalsContact SG-CG 3.57Å; C224-H243 PolarHBondContact SG-NE2 2.75Å
225	N	86.7	Confident	82.3	Confident	102 Å²	102	77.1 Å²	77.1	55%	0.545	40%	0.399	S	S	.	.			trans	56.9	18.3	-175.2	-56.9	-69.9	0	0	0	115.1	V220 C221	V220-N225 HydrophobicContact CG1-CB 4.4Å; C221-N225 VanDerWaalsContact O-CA 3.23Å; C221-N225 WeakPolarHBondContact O-CA 3.29Å; C221-N225 PolarHBondContact O-N 3.44Å
226	Q	87	Confident	83.7	Confident	93 Å²	93	75.8 Å²	75.8	44%	0.435	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-69.9	136.9	171.8	-68.9	-177.8	9	0	0	110.7	V220 C221 C224 H243	V220-Q226 WeakPolarHBondContact CA-O 3.19Å; C221-Q226 PolarHBondContact N-O 3Å; C224-Q226 HydrophobicContact CB-CG 4.36Å; C224-Q226 PolarHBondContact O-N 2.79Å; C224-Q226 VanDerWaalsContact O-N 3.15Å; C224-Q226 VanDerWaalsContact SG-CG 3.57Å; Q226-H243 PolarHBondContact OE1-CE1 3.46Å
227	I	87.7	Confident	84.6	Confident	101 Å²	101	70 Å²	70	52%	0.518	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120.4	172.2	-56.2	170.6	0	0	0	107.7	E218 V220	E218-I227 HydrophobicContact CB-CG2 3.88Å; E218-I227 HydrophobicContact CG-CG2 3.83Å; V220-I227 HydrophobicContact CG2-CG1 4.26Å
228	L	87.9	Confident	85	Confident	22 Å²	22	69 Å²	69	12%	0.115	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.6	173.6	-49.2	178.7	0	0	0	108	I219 L239 L240 H243	I219-L228 HydrophobicContact CG2-CB 3.96Å; I219-L228 PolarHBondContact N-O 3.19Å; I219-L228 PolarHBondContact O-N 2.97Å; L228-L239 HydrophobicContact CB-CD2 3.85Å; L228-L239 HydrophobicContact CB-CG 4.06Å; L228-L239 HydrophobicContact CD1-CG 4.3Å; L228-L240 HydrophobicContact CD1-CB 4.38Å; L228-L240 HydrophobicContact CD1-CD1 3.71Å; L228-H243 HydrophobicContact CD1-CB 3.64Å; L228-H243 HydrophobicContact CD2-CB 4.32Å
229	V	85.2	Confident	85.2	Confident	65 Å²	65	66.7 Å²	66.7	39%	0.394	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	121.8	175.2	-176.6	0	0	0	0	108.6	E218 H231	E218-V229 HydrophobicContact CG-CG2 4.32Å; V229-H231 PolarHBondContact O-N 3.32Å
230	R	83.8	Confident	85.4	Confident	66 Å²	66	66.5 Å²	66.5	25%	0.249	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-71.4	121.2	176.2	-177.2	-178.9	179.2	-148.8	-4	110.4	N217 E234 Y236 L239	N217-R230 HydrophobicContact CB-CB 4.27Å; N217-R230 WeakPolarHBondContact O-CB 3.49Å; N217-R230 PolarHBondContact O-N 3.35Å; R230-E234 VanDerWaalsContact CZ-O 3.25Å; R230-E234 PolarHBondContact NE-O 3.48Å; R230-E234 PolarHBondContact NH2-O 3.02Å; R230-Y236 HydrophobicContact CB-CE1 4.26Å; R230-Y236 VanDerWaalsContact CD-CZ 3.43Å; R230-Y236 VanDerWaalsContact NH1-CE2 3.34Å; R230-Y236 PolarHBondContact NH1-OH 3.1Å; R230-Y236 VanDerWaalsContact NH1-OH 3.14Å; R230-L239 HydrophobicContact CB-CD2 4.1Å
231	H	76.9	Confident	85.5	Confident	135 Å²	135	66.1 Å²	66.1	63%	0.625	35%	0.345	S	S	*	.			trans	-105	111.8	174.9	-65.1	-48.7	0	0	0	110.5	V229	V229-H231 PolarHBondContact O-N 3.32Å
232	Q	70.5	Confident	85.5	Confident	177 Å²	177	69.3 Å²	69.3	83%	0.827	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	-149.4	174.9	-52.3	-177.5	3.9	0	0	113.1	E234	Q232-E234 PolarHBondContact O-N 3.1Å
233	N	72.1	Confident	85.8	Confident	167 Å²	167	69.3 Å²	69.3	89%	0.893	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	9.9	-162.6	-72.4	-10.3	0	0	0	116
234	E	81.8	Confident	86	Confident	84 Å²	84	68.3 Å²	68.3	39%	0.393	35%	0.35	S	S	.	.			trans	-60.1	154.5	172.3	-60.8	-171	154.6	0	0	111.4	R230 Q232	R230-E234 VanDerWaalsContact CZ-O 3.25Å; R230-E234 PolarHBondContact NE-O 3.48Å; R230-E234 PolarHBondContact NH2-O 3.02Å; Q232-E234 PolarHBondContact O-N 3.1Å
235	S	86.2	Confident	86.1	Confident	51 Å²	51	67 Å²	67	36%	0.357	34%	0.34	S	S	.	.			trans	-90.5	146.2	170.4	87.7	0	0	0	0	110.3	C237 T238 L239	S235-C237 PolarHBondContact O-N 3.33Å; S235-C237 VanDerWaalsContact O-N 3.16Å; S235-C237 PolarHBondContact OG-N 3.41Å; S235-T238 WeakPolarHBondContact O-CB 3.12Å; S235-T238 PolarHBondContact O-N 3.4Å; S235-T238 PolarHBondContact OG-N 3.1Å; S235-T238 PolarHBondContact OG-OG1 3.34Å; S235-L239 PolarHBondContact O-N 2.84Å
236	Y	86.8	Confident	86.2	Confident	65 Å²	65	66.8 Å²	66.8	26%	0.255	34%	0.339	S	S	.	.	H	α-helix	trans	-56.5	-31.2	174.6	-57.3	-90.2	0	0	0	112.1	E216 I219 R230 L240	E216-Y236 PolarHBondContact O-OH 2.8Å; I219-Y236 HydrophobicContact CB-CD1 4.11Å; I219-Y236 HydrophobicContact CG2-CD1 4.13Å; R230-Y236 HydrophobicContact CB-CE1 4.26Å; R230-Y236 VanDerWaalsContact CD-CZ 3.43Å; R230-Y236 VanDerWaalsContact NH1-CE2 3.34Å; R230-Y236 PolarHBondContact NH1-OH 3.1Å; R230-Y236 VanDerWaalsContact NH1-OH 3.14Å; Y236-L240 VanDerWaalsContact O-CB 3.26Å; Y236-L240 WeakPolarHBondContact O-CB 3.35Å; Y236-L240 PolarHBondContact O-N 3.49Å
237	C	87.6	Confident	86.3	Confident	45 Å²	45	64.7 Å²	64.7	30%	0.304	33%	0.329	S	S	.	.	H	α-helix	trans	-66	-46.4	174.1	-173.4	0	0	0	0	111.3	S235 K241 L323	S235-C237 PolarHBondContact O-N 3.33Å; S235-C237 VanDerWaalsContact O-N 3.16Å; S235-C237 PolarHBondContact OG-N 3.41Å; C237-K241 WeakPolarHBondContact O-CB 3.49Å; C237-K241 PolarHBondContact O-N 2.8Å; C237-L323 HydrophobicContact CB-CD1 3.66Å
238	T	88.6	Confident	86.3	Confident	61 Å²	61	60.1 Å²	60.1	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-49.4	175.3	-49.4	0	0	0	0	111.3	S235 L240 K241 N242	S235-T238 WeakPolarHBondContact O-CB 3.12Å; S235-T238 PolarHBondContact O-N 3.4Å; S235-T238 PolarHBondContact OG-N 3.1Å; S235-T238 PolarHBondContact OG-OG1 3.34Å; T238-L240 PolarHBondContact O-N 2.65Å; T238-K241 PolarHBondContact O-N 3.49Å; T238-N242 WeakPolarHBondContact O-CB 3.41Å; T238-N242 PolarHBondContact O-N 2.98Å; T238-N242 PolarHBondContact O-OD1 3.13Å
239	L	90.3	Very high	86.1	Confident	27 Å²	27	60.3 Å²	60.3	14%	0.141	31%	0.307	C	S	.	.	H	α-helix	trans	-57.7	-50	-180	180	64.5	0	0	0	111.7	I219 L228 R230 S235 H243	I219-L239 HydrophobicContact CG2-CD2 4.04Å; L228-L239 HydrophobicContact CB-CD2 3.85Å; L228-L239 HydrophobicContact CB-CG 4.06Å; L228-L239 HydrophobicContact CD1-CG 4.3Å; R230-L239 HydrophobicContact CB-CD2 4.1Å; S235-L239 PolarHBondContact O-N 2.84Å; L239-H243 PolarHBondContact O-N 3.05Å; L239-H243 VanDerWaalsContact O-N 3.08Å
240	L	90.8	Very high	85.7	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-72.4	-35	-178.6	-174.9	54.9	0	0	0	112.3	I219 C221 L228 Y236 T238 H243 Y244 A319 D322	I219-L240 HydrophobicContact CD1-CD2 3.94Å; I219-L240 HydrophobicContact CG1-CD2 4.49Å; C221-L240 HydrophobicContact CB-CD1 3.67Å; L228-L240 HydrophobicContact CD1-CB 4.38Å; L228-L240 HydrophobicContact CD1-CD1 3.71Å; Y236-L240 VanDerWaalsContact O-CB 3.26Å; Y236-L240 WeakPolarHBondContact O-CB 3.35Å; Y236-L240 PolarHBondContact O-N 3.49Å; T238-L240 PolarHBondContact O-N 2.65Å; L240-H243 PolarHBondContact O-N 2.97Å; L240-Y244 HydrophobicContact CD1-CD2 4.01Å; L240-Y244 HydrophobicContact CD1-CE2 3.86Å; L240-Y244 HydrophobicContact CG-CD2 4.03Å; L240-Y244 HydrophobicContact CG-CE2 4.02Å; L240-Y244 VanDerWaalsContact O-CD2 3.3Å; L240-Y244 WeakPolarHBondContact O-CD2 3.14Å; L240-Y244 PolarHBondContact O-N 3.49Å; L240-A319 HydrophobicContact CB-CB 4.04Å; L240-A319 HydrophobicContact CD2-CB 4.29Å; L240-A319 HydrophobicContact CG-CB 3.92Å; L240-D322 HydrophobicContact CD2-CB 3.66Å
241	K	91.8	Very high	84.7	Confident	48 Å²	48	67.8 Å²	67.8	21%	0.209	34%	0.342	C	S	.	.	H	α-helix	trans	-63.9	-44.3	173.9	-174.1	-172	-165.9	-154.2	0	111.7	C237 T238 Y244 L245 D312 A315 A319	C237-K241 WeakPolarHBondContact O-CB 3.49Å; C237-K241 PolarHBondContact O-N 2.8Å; T238-K241 PolarHBondContact O-N 3.49Å; K241-Y244 PolarHBondContact O-N 3.07Å; K241-L245 PolarHBondContact O-N 2.99Å; K241-D312 VanDerWaalsContact CE-CG 3.46Å; K241-D312 WeakPolarHBondContact CE-O 3.27Å; K241-D312 WeakPolarHBondContact CE-OD1 3.3Å; K241-D312 WeakPolarHBondContact CE-OD2 3.22Å; K241-D312 IonicContact NZ-OD1 3.73Å; K241-D312 PolarHBondContact NZ-OD1 3.22Å; K241-D312 IonicContact NZ-OD2 2.57Å; K241-D312 PolarHBondContact NZ-OD2 3.35Å; K241-A315 HydrophobicContact CG-CB 3.84Å; K241-A319 HydrophobicContact CB-CB 4.04Å
242	N	90.5	Very high	84.1	Confident	68 Å²	68	62.1 Å²	62.1	36%	0.364	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-46.4	175.7	-69	-4.4	0	0	0	110.5	T238 Y244 L245 D246	T238-N242 WeakPolarHBondContact O-CB 3.41Å; T238-N242 PolarHBondContact O-N 2.98Å; T238-N242 PolarHBondContact O-OD1 3.13Å; N242-Y244 VanDerWaalsContact C-N 3.34Å; N242-Y244 PolarHBondContact O-N 3.48Å; N242-L245 WeakPolarHBondContact O-CB 3.49Å; N242-L245 PolarHBondContact O-N 3.44Å; N242-L245 VanDerWaalsContact O-N 3.13Å; N242-D246 PolarHBondContact O-N 2.87Å
243	H	92	Very high	84.1	Confident	18 Å²	18	54.2 Å²	54.2	8%	0.083	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-43.2	173.5	170.9	85.8	0	0	0	112.9	C221 C224 Q226 L228 L239 L240 H247 H255	C221-H243 WeakPolarHBondContact CB-NE2 3.3Å; C221-H243 VanDerWaalsContact SG-CD2 3.58Å; C221-H243 PolarHBondContact SG-NE2 3.33Å; C221-H243 VanDerWaalsContact SG-NE2 3.38Å; C224-H243 PolarHBondContact SG-NE2 2.75Å; Q226-H243 PolarHBondContact OE1-CE1 3.46Å; L228-H243 HydrophobicContact CD1-CB 3.64Å; L228-H243 HydrophobicContact CD2-CB 4.32Å; L239-H243 PolarHBondContact O-N 3.05Å; L239-H243 VanDerWaalsContact O-N 3.08Å; L240-H243 PolarHBondContact O-N 2.97Å; H243-H247 AromaticContact CE1-CD2 3.21Å; H243-H247 PolarHBondContact CE1-CD2 3.42Å; H243-H247 AromaticContact CE1-NE2 3.17Å; H243-H247 PolarHBondContact CE1-NE2 3.19Å; H243-H247 AromaticContact ND1-CD2 3.55Å; H243-H247 AromaticContact ND1-NE2 3.72Å; H243-H247 AromaticContact NE2-CD2 3.55Å; H243-H247 AromaticContact NE2-NE2 3.85Å; H243-H247 PolarHBondContact O-CD2 3.3Å; H243-H247 PolarHBondContact O-N 3.28Å; H243-H247 VanDerWaalsContact O-N 3.14Å; H243-H255 AromaticContact CD2-NE2 3.67Å; H243-H255 AromaticContact CE1-NE2 3.84Å; H243-H255 AromaticContact NE2-CE1 3.88Å; H243-H255 AromaticContact NE2-NE2 2.99Å; H243-H255 PolarHBondContact NE2-NE2 3.29Å
244	Y	92.3	Very high	84.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-44.4	173.8	-93.4	-73.2	0	0	0	112.3	S223 L240 K241 N242 F248 H255 M318 A319 D322	S223-Y244 WeakPolarHBondContact OG-CE1 3.4Å; S223-Y244 PolarHBondContact OG-OH 2.75Å; L240-Y244 HydrophobicContact CD1-CD2 4.01Å; L240-Y244 HydrophobicContact CD1-CE2 3.86Å; L240-Y244 HydrophobicContact CG-CD2 4.03Å; L240-Y244 HydrophobicContact CG-CE2 4.02Å; L240-Y244 VanDerWaalsContact O-CD2 3.3Å; L240-Y244 WeakPolarHBondContact O-CD2 3.14Å; L240-Y244 PolarHBondContact O-N 3.49Å; K241-Y244 PolarHBondContact O-N 3.07Å; N242-Y244 VanDerWaalsContact C-N 3.34Å; N242-Y244 PolarHBondContact O-N 3.48Å; Y244-F248 AromaticContact CD1-CE1 3.99Å; Y244-F248 HydrophobicContact CD1-CE1 3.99Å; Y244-F248 HydrophobicContact CD1-CE2 4.42Å; Y244-F248 AromaticContact CD1-CZ 3.69Å; Y244-F248 HydrophobicContact CD1-CZ 3.69Å; Y244-F248 HydrophobicContact CG-CZ 4.45Å; Y244-F248 VanDerWaalsContact O-CD2 3.28Å; Y244-F248 WeakPolarHBondContact O-CD2 3.47Å; Y244-F248 WeakPolarHBondContact O-CG 3.21Å; Y244-F248 PolarHBondContact O-N 3.24Å; Y244-H255 HydrophobicContact CD1-CB 4.35Å; Y244-H255 AromaticContact CD1-CD2 3.69Å; Y244-H255 HydrophobicContact CE1-CB 4.35Å; Y244-H255 AromaticContact CE1-CD2 3.7Å; Y244-M318 HydrophobicContact CD1-CB 3.78Å; Y244-M318 HydrophobicContact CD1-CG 4.24Å; Y244-M318 HydrophobicContact CD2-CB 3.9Å; Y244-M318 HydrophobicContact CE1-CB 3.61Å; Y244-M318 HydrophobicContact CE1-CE 4.18Å; Y244-M318 HydrophobicContact CE1-CG 4.04Å; Y244-M318 HydrophobicContact CE2-CB 3.75Å; Y244-M318 HydrophobicContact CG-CB 3.94Å; Y244-A319 HydrophobicContact CD2-CB 4.45Å; Y244-D322 VanDerWaalsContact CE2-OD2 3.3Å; Y244-D322 WeakPolarHBondContact CE2-OD2 3.48Å; Y244-D322 PolarHBondContact OH-OD2 3Å
245	L	90.9	Very high	84.7	Confident	11 Å²	11	47 Å²	47	6%	0.058	25%	0.25	C	C	.	.	H	α-helix	trans	-59.4	-50.4	175.9	-83.2	171.5	0	0	0	112.3	K241 N242 H247 F248 L249 F308 L311 D312 A315	K241-L245 PolarHBondContact O-N 2.99Å; N242-L245 WeakPolarHBondContact O-CB 3.49Å; N242-L245 PolarHBondContact O-N 3.44Å; N242-L245 VanDerWaalsContact O-N 3.13Å; L245-H247 VanDerWaalsContact C-N 3.32Å; L245-H247 PolarHBondContact O-N 3.41Å; L245-F248 PolarHBondContact O-N 3.15Å; L245-L249 WeakPolarHBondContact O-CB 3.39Å; L245-L249 VanDerWaalsContact O-CG 3.23Å; L245-L249 WeakPolarHBondContact O-CG 3.43Å; L245-L249 PolarHBondContact O-N 2.85Å; L245-F308 HydrophobicContact CD1-CZ 4.17Å; L245-F308 HydrophobicContact CD2-CZ 4.45Å; L245-L311 HydrophobicContact CD2-CB 4.09Å; L245-D312 HydrophobicContact CD2-CB 4.41Å; L245-A315 HydrophobicContact CD2-CB 4.11Å; L245-A315 HydrophobicContact CG-CB 3.73Å
246	D	88.9	Confident	84.6	Confident	99 Å²	99	44.9 Å²	44.9	53%	0.529	24%	0.235	S	C	.	.	H	α-helix	trans	-59.7	-43.6	-178.7	-69.9	-28.9	0	0	0	111.1	N242 L249 D250	N242-D246 PolarHBondContact O-N 2.87Å; D246-L249 PolarHBondContact O-N 2.88Å; D246-D250 PolarHBondContact O-N 3.48Å
247	H	89.3	Confident	84.5	Confident	49 Å²	49	47.3 Å²	47.3	23%	0.227	25%	0.246	C	C	.	.	H	α-helix	trans	-68.3	-38.1	175.8	-84.3	-75.6	0	0	0	113.8	H243 L245 L249 G252 H255	H243-H247 AromaticContact CE1-CD2 3.21Å; H243-H247 PolarHBondContact CE1-CD2 3.42Å; H243-H247 AromaticContact CE1-NE2 3.17Å; H243-H247 PolarHBondContact CE1-NE2 3.19Å; H243-H247 AromaticContact ND1-CD2 3.55Å; H243-H247 AromaticContact ND1-NE2 3.72Å; H243-H247 AromaticContact NE2-CD2 3.55Å; H243-H247 AromaticContact NE2-NE2 3.85Å; H243-H247 PolarHBondContact O-CD2 3.3Å; H243-H247 PolarHBondContact O-N 3.28Å; H243-H247 VanDerWaalsContact O-N 3.14Å; L245-H247 VanDerWaalsContact C-N 3.32Å; L245-H247 PolarHBondContact O-N 3.41Å; H247-L249 VanDerWaalsContact C-N 3.29Å; H247-L249 PolarHBondContact O-N 2.93Å; H247-G252 WeakPolarHBondContact O-CA 3.49Å; H247-G252 PolarHBondContact O-N 3.46Å; H247-H255 HydrophobicContact CB-CB 4.24Å; H247-H255 AromaticContact CD2-CE1 3.35Å; H247-H255 PolarHBondContact CD2-CE1 2.87Å; H247-H255 AromaticContact CD2-NE2 3.32Å; H247-H255 PolarHBondContact CD2-NE2 2.82Å; H247-H255 VanDerWaalsContact CD2-NE2 3.32Å; H247-H255 AromaticContact CE1-CE1 3.72Å; H247-H255 AromaticContact CG-CE1 3.18Å; H247-H255 AromaticContact CG-ND1 3.6Å; H247-H255 AromaticContact CG-NE2 3.46Å; H247-H255 AromaticContact ND1-CE1 3.43Å; H247-H255 PolarHBondContact ND1-CE1 2.87Å; H247-H255 AromaticContact ND1-ND1 3.79Å; H247-H255 AromaticContact NE2-CE1 3.68Å; H247-H255 AromaticContact NE2-NE2 3.96Å
248	F	88.6	Confident	84.4	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-40.5	172	-63.4	-25.2	0	0	0	111.4	Y244 L245 H255 V256 V259 V291 I314 A315 M318	Y244-F248 AromaticContact CD1-CE1 3.99Å; Y244-F248 HydrophobicContact CD1-CE1 3.99Å; Y244-F248 HydrophobicContact CD1-CE2 4.42Å; Y244-F248 AromaticContact CD1-CZ 3.69Å; Y244-F248 HydrophobicContact CD1-CZ 3.69Å; Y244-F248 HydrophobicContact CG-CZ 4.45Å; Y244-F248 VanDerWaalsContact O-CD2 3.28Å; Y244-F248 WeakPolarHBondContact O-CD2 3.47Å; Y244-F248 WeakPolarHBondContact O-CG 3.21Å; Y244-F248 PolarHBondContact O-N 3.24Å; L245-F248 PolarHBondContact O-N 3.15Å; F248-H255 HydrophobicContact CD1-CB 4.04Å; F248-H255 HydrophobicContact CE1-CB 3.78Å; F248-V256 HydrophobicContact CD1-CG2 3.66Å; F248-V256 HydrophobicContact CE1-CG2 4.21Å; F248-V259 HydrophobicContact CE1-CG2 3.82Å; F248-V259 HydrophobicContact CZ-CG2 3.69Å; F248-V291 WeakPolarHBondContact O-CG2 3.18Å; F248-I314 HydrophobicContact CE2-CB 4.34Å; F248-I314 HydrophobicContact CE2-CG2 3.82Å; F248-I314 HydrophobicContact CZ-CG2 3.87Å; F248-A315 HydrophobicContact CD2-CB 4.42Å; F248-A315 HydrophobicContact CE2-CB 3.94Å; F248-M318 HydrophobicContact CZ-CG 4.39Å
249	L	83.8	Confident	84.2	Confident	27 Å²	27	43.9 Å²	43.9	14%	0.141	22%	0.221	C	C	.	.	H	α-helix	trans	-68.3	-48.5	-179.5	-75.8	172.4	0	0	0	112.1	L245 D246 H247 K251 K295 L311	L245-L249 WeakPolarHBondContact O-CB 3.39Å; L245-L249 VanDerWaalsContact O-CG 3.23Å; L245-L249 WeakPolarHBondContact O-CG 3.43Å; L245-L249 PolarHBondContact O-N 2.85Å; D246-L249 PolarHBondContact O-N 2.88Å; H247-L249 VanDerWaalsContact C-N 3.29Å; H247-L249 PolarHBondContact O-N 2.93Å; L249-K251 PolarHBondContact O-N 2.86Å; L249-K251 VanDerWaalsContact O-N 3.1Å; L249-K295 HydrophobicContact CD2-CD 4.39Å; L249-K295 HydrophobicContact CD2-CG 3.94Å; L249-K295 VanDerWaalsContact O-CE 3.26Å; L249-K295 WeakPolarHBondContact O-CE 3.45Å; L249-K295 PolarHBondContact O-NZ 3.31Å; L249-L311 HydrophobicContact CD2-CD1 4.48Å
250	D	75.5	Confident	84	Confident	124 Å²	124	45.5 Å²	45.5	66%	0.663	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	36	-171.3	-80.9	4.6	0	0	0	114.3	D246 G252 K295	D246-D250 PolarHBondContact O-N 3.48Å; D250-G252 PolarHBondContact O-N 3.24Å; D250-K295 IonicContact OD1-NZ 3.53Å; D250-K295 PolarHBondContact OD1-NZ 2.99Å
251	K	63.9	Low	83.6	Confident	164 Å²	164	50.8 Å²	50.8	71%	0.713	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	25	178.3	-52.2	179.3	-179.6	178.4	0	113.4	L249 G253	L249-K251 PolarHBondContact O-N 2.86Å; L249-K251 VanDerWaalsContact O-N 3.1Å; K251-G253 PolarHBondContact O-N 3.24Å
252	G	63.1	Low	83.3	Confident	15 Å²	15	50.9 Å²	50.9	16%	0.155	26%	0.255	C	S	.	.			trans	-67	74.7	172.6	0	0	0	0	0	110.9	H247 D250 D254 H255	H247-G252 WeakPolarHBondContact O-CA 3.49Å; H247-G252 PolarHBondContact O-N 3.46Å; D250-G252 PolarHBondContact O-N 3.24Å; G252-D254 PolarHBondContact O-N 3.03Å; G252-H255 PolarHBondContact O-N 3.23Å
253	G	70.7	Confident	82.8	Confident	12 Å²	12	47.7 Å²	47.7	12%	0.124	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-17.4	-174.9	0	0	0	0	0	113.5	K251 K257	K251-G253 PolarHBondContact O-N 3.24Å; G253-K257 WeakPolarHBondContact O-CB 3.31Å; G253-K257 WeakPolarHBondContact O-CG 3.43Å; G253-K257 PolarHBondContact O-N 2.73Å
254	D	79.7	Confident	82.2	Confident	95 Å²	95	51.9 Å²	51.9	51%	0.508	26%	0.258	S	S	.	.	H	α-helix	trans	-74	-42.5	-179.2	-60.1	-53.5	0	0	0	113.2	G252 V256 K257 Y258	G252-D254 PolarHBondContact O-N 3.03Å; D254-V256 VanDerWaalsContact C-N 3.29Å; D254-V256 PolarHBondContact O-N 3.45Å; D254-K257 WeakPolarHBondContact O-CB 3.41Å; D254-K257 PolarHBondContact O-N 3.02Å; D254-K257 WeakPolarHBondContact OD1-CE 3.34Å; D254-K257 IonicContact OD1-NZ 2.59Å; D254-K257 PolarHBondContact OD1-NZ 3.41Å; D254-Y258 WeakPolarHBondContact O-CB 3.25Å; D254-Y258 PolarHBondContact O-N 3.24Å
255	H	87.1	Confident	81.3	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-39.2	170.4	-65.1	60.6	0	0	0	111.1	H243 Y244 H247 F248 G252 Y258 V259	H243-H255 AromaticContact CD2-NE2 3.67Å; H243-H255 AromaticContact CE1-NE2 3.84Å; H243-H255 AromaticContact NE2-CE1 3.88Å; H243-H255 AromaticContact NE2-NE2 2.99Å; H243-H255 PolarHBondContact NE2-NE2 3.29Å; Y244-H255 HydrophobicContact CD1-CB 4.35Å; Y244-H255 AromaticContact CD1-CD2 3.69Å; Y244-H255 HydrophobicContact CE1-CB 4.35Å; Y244-H255 AromaticContact CE1-CD2 3.7Å; H247-H255 HydrophobicContact CB-CB 4.24Å; H247-H255 AromaticContact CD2-CE1 3.35Å; H247-H255 PolarHBondContact CD2-CE1 2.87Å; H247-H255 AromaticContact CD2-NE2 3.32Å; H247-H255 PolarHBondContact CD2-NE2 2.82Å; H247-H255 VanDerWaalsContact CD2-NE2 3.32Å; H247-H255 AromaticContact CE1-CE1 3.72Å; H247-H255 AromaticContact CG-CE1 3.18Å; H247-H255 AromaticContact CG-ND1 3.6Å; H247-H255 AromaticContact CG-NE2 3.46Å; H247-H255 AromaticContact ND1-CE1 3.43Å; H247-H255 PolarHBondContact ND1-CE1 2.87Å; H247-H255 AromaticContact ND1-ND1 3.79Å; H247-H255 AromaticContact NE2-CE1 3.68Å; H247-H255 AromaticContact NE2-NE2 3.96Å; F248-H255 HydrophobicContact CD1-CB 4.04Å; F248-H255 HydrophobicContact CE1-CB 3.78Å; G252-H255 PolarHBondContact O-N 3.23Å; H255-Y258 PolarHBondContact O-N 2.93Å; H255-V259 WeakPolarHBondContact O-CG2 3.4Å; H255-V259 PolarHBondContact O-N 3.46Å
256	V	84.6	Confident	80.1	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-70.8	-37	176.8	-174.7	0	0	0	0	112.1	F248 D254 Y258 V259 N260 W284 F287	F248-V256 HydrophobicContact CD1-CG2 3.66Å; F248-V256 HydrophobicContact CE1-CG2 4.21Å; D254-V256 VanDerWaalsContact C-N 3.29Å; D254-V256 PolarHBondContact O-N 3.45Å; V256-Y258 VanDerWaalsContact C-N 3.32Å; V256-V259 PolarHBondContact O-N 3Å; V256-N260 WeakPolarHBondContact O-CB 3.36Å; V256-N260 PolarHBondContact O-N 3.47Å; V256-W284 HydrophobicContact CB-CE3 4.25Å; V256-W284 HydrophobicContact CB-CZ3 3.83Å; V256-W284 HydrophobicContact CG1-CE3 3.74Å; V256-W284 HydrophobicContact CG1-CZ3 3.8Å; V256-W284 HydrophobicContact CG2-CZ3 4.15Å; V256-F287 HydrophobicContact CG1-CB 4Å; V256-F287 HydrophobicContact CG1-CD1 3.91Å; V256-F287 HydrophobicContact CG1-CD2 3.7Å; V256-F287 HydrophobicContact CG1-CE1 4.31Å; V256-F287 HydrophobicContact CG1-CE2 4.11Å; V256-F287 HydrophobicContact CG1-CG 3.6Å; V256-F287 HydrophobicContact CG1-CZ 4.4Å
257	K	83.8	Confident	78.8	Confident	115 Å²	115	58 Å²	58	50%	0.5	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-44.2	169.6	-75.7	165.2	-151	166.9	0	110.2	G253 D254 N260 I261	G253-K257 WeakPolarHBondContact O-CB 3.31Å; G253-K257 WeakPolarHBondContact O-CG 3.43Å; G253-K257 PolarHBondContact O-N 2.73Å; D254-K257 WeakPolarHBondContact O-CB 3.41Å; D254-K257 PolarHBondContact O-N 3.02Å; D254-K257 WeakPolarHBondContact OD1-CE 3.34Å; D254-K257 IonicContact OD1-NZ 2.59Å; D254-K257 PolarHBondContact OD1-NZ 3.41Å; K257-N260 WeakPolarHBondContact O-CB 3.23Å; K257-N260 PolarHBondContact O-N 3.37Å; K257-I261 WeakPolarHBondContact O-CD1 3.44Å; K257-I261 VanDerWaalsContact O-CG1 3.24Å; K257-I261 WeakPolarHBondContact O-CG1 3.13Å; K257-I261 PolarHBondContact O-N 2.91Å
258	Y	85.4	Confident	77.5	Confident	35 Å²	35	67.6 Å²	67.6	14%	0.137	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-43.5	178.4	-176.5	-107	0	0	0	111.6	G222 S223 D254 H255 V256 N260 I261 R262 M318 D322	G222-Y258 WeakPolarHBondContact O-CE2 3.42Å; G222-Y258 VanDerWaalsContact O-CZ 3.32Å; G222-Y258 PolarHBondContact O-OH 3.31Å; S223-Y258 WeakPolarHBondContact OG-CD1 3.37Å; D254-Y258 WeakPolarHBondContact O-CB 3.25Å; D254-Y258 PolarHBondContact O-N 3.24Å; H255-Y258 PolarHBondContact O-N 2.93Å; V256-Y258 VanDerWaalsContact C-N 3.32Å; Y258-N260 PolarHBondContact O-N 2.86Å; Y258-I261 PolarHBondContact O-N 2.83Å; Y258-R262 HydrophobicContact CD1-CG 4.3Å; Y258-R262 HydrophobicContact CE1-CG 4.24Å; Y258-R262 HydrophobicContact CE2-CG 4.41Å; Y258-R262 HydrophobicContact CG-CG 4.48Å; Y258-R262 WeakPolarHBondContact O-CB 3.31Å; Y258-R262 VanDerWaalsContact O-CG 3.25Å; Y258-R262 WeakPolarHBondContact O-CG 3.41Å; Y258-R262 PolarHBondContact O-N 3.27Å; Y258-R262 PolarHBondContact OH-NE 3.13Å; Y258-R262 PolarHBondContact OH-NH2 2.79Å; Y258-M318 HydrophobicContact CD1-CE 3.35Å; Y258-M318 HydrophobicContact CE1-CE 3.31Å; Y258-D322 PolarHBondContact OH-OD1 2.86Å
259	V	86.5	Confident	76.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-55.7	-48.5	169.7	176.7	0	0	0	0	111.3	F248 H255 V256 I261 R262 A263 F287 I314 M318 L335 L339	F248-V259 HydrophobicContact CE1-CG2 3.82Å; F248-V259 HydrophobicContact CZ-CG2 3.69Å; H255-V259 WeakPolarHBondContact O-CG2 3.4Å; H255-V259 PolarHBondContact O-N 3.46Å; V256-V259 PolarHBondContact O-N 3Å; V259-I261 VanDerWaalsContact C-N 3.32Å; V259-I261 PolarHBondContact O-N 2.63Å; V259-R262 PolarHBondContact O-N 3.01Å; V259-A263 WeakPolarHBondContact O-CB 3.45Å; V259-A263 PolarHBondContact O-N 3.14Å; V259-F287 HydrophobicContact CB-CZ 4.4Å; V259-F287 HydrophobicContact CG1-CE2 4.41Å; V259-F287 HydrophobicContact CG1-CZ 3.73Å; V259-I314 HydrophobicContact CG1-CG2 4.03Å; V259-I314 HydrophobicContact CG2-CG2 4.07Å; V259-M318 HydrophobicContact CB-SD 4.46Å; V259-M318 HydrophobicContact CG2-CE 4.4Å; V259-M318 HydrophobicContact CG2-CG 3.66Å; V259-M318 HydrophobicContact CG2-SD 3.74Å; V259-L335 HydrophobicContact CG1-CD1 4.09Å; V259-L335 HydrophobicContact CG1-CD2 4Å; V259-L339 HydrophobicContact CG1-CD1 4.31Å
260	N	84.2	Confident	76.3	Confident	60 Å²	60	73.4 Å²	73.4	32%	0.321	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-35.6	-179.8	-179.5	83.9	0	0	0	113	V256 K257 Y258 E264 P283	V256-N260 WeakPolarHBondContact O-CB 3.36Å; V256-N260 PolarHBondContact O-N 3.47Å; K257-N260 WeakPolarHBondContact O-CB 3.23Å; K257-N260 PolarHBondContact O-N 3.37Å; Y258-N260 PolarHBondContact O-N 2.86Å; N260-E264 PolarHBondContact O-N 2.68Å; N260-P283 WeakPolarHBondContact OD1-CG 3.37Å
261	I	83.8	Confident	76.7	Confident	112 Å²	112	67.7 Å²	67.7	57%	0.574	32%	0.324	S	S	*	.	H	α-helix	trans	-68.5	-46.6	173.1	-69.9	161.8	0	0	0	110.4	K257 Y258 V259 A263 E264	K257-I261 WeakPolarHBondContact O-CD1 3.44Å; K257-I261 VanDerWaalsContact O-CG1 3.24Å; K257-I261 WeakPolarHBondContact O-CG1 3.13Å; K257-I261 PolarHBondContact O-N 2.91Å; Y258-I261 PolarHBondContact O-N 2.83Å; V259-I261 VanDerWaalsContact C-N 3.32Å; V259-I261 PolarHBondContact O-N 2.63Å; I261-A263 PolarHBondContact O-N 2.92Å; I261-E264 WeakPolarHBondContact O-CG 2.95Å; I261-E264 PolarHBondContact O-N 2.67Å; I261-E264 VanDerWaalsContact O-N 3.14Å
262	R	84	Confident	77.7	Confident	50 Å²	50	64.4 Å²	64.4	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-68.2	-30.4	-178.6	-69.6	-65.7	-173.1	-178.9	5.5	113.8	Y258 V259 E264 M318 Y321 L331 L335	Y258-R262 HydrophobicContact CD1-CG 4.3Å; Y258-R262 HydrophobicContact CE1-CG 4.24Å; Y258-R262 HydrophobicContact CE2-CG 4.41Å; Y258-R262 HydrophobicContact CG-CG 4.48Å; Y258-R262 WeakPolarHBondContact O-CB 3.31Å; Y258-R262 VanDerWaalsContact O-CG 3.25Å; Y258-R262 WeakPolarHBondContact O-CG 3.41Å; Y258-R262 PolarHBondContact O-N 3.27Å; Y258-R262 PolarHBondContact OH-NE 3.13Å; Y258-R262 PolarHBondContact OH-NH2 2.79Å; V259-R262 PolarHBondContact O-N 3.01Å; R262-E264 VanDerWaalsContact C-N 3.33Å; R262-M318 HydrophobicContact CG-CE 4.42Å; R262-Y321 PolarHBondContact NH1-OH 3.28Å; R262-Y321 VanDerWaalsContact NH1-OH 3.1Å; R262-Y321 PolarHBondContact NH2-OH 2.94Å; R262-L331 HydrophobicContact CB-CD2 3.74Å; R262-L331 HydrophobicContact CG-CD2 4.04Å; R262-L335 HydrophobicContact CB-CD1 4.19Å
263	A	81.3	Confident	78.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-76.4	-18.4	172.8	0	0	0	0	0	113.4	V259 I261 L265 L335 R336 L339	V259-A263 WeakPolarHBondContact O-CB 3.45Å; V259-A263 PolarHBondContact O-N 3.14Å; I261-A263 PolarHBondContact O-N 2.92Å; A263-L265 HydrophobicContact CB-CD1 4.45Å; A263-L265 HydrophobicContact CB-CD2 3.89Å; A263-L265 HydrophobicContact CB-CG 3.8Å; A263-L265 PolarHBondContact O-N 2.93Å; A263-L335 HydrophobicContact CB-CB 3.87Å; A263-L335 HydrophobicContact CB-CD1 4.06Å; A263-R336 WeakPolarHBondContact O-CG 3.36Å; A263-R336 PolarHBondContact O-NE 3.41Å; A263-L339 HydrophobicContact CB-CD1 4.16Å
264	E	79.5	Confident	79.5	Confident	106 Å²	106	69.9 Å²	69.9	50%	0.495	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.1	55.5	-172.5	-63.9	175.6	-123.5	0	0	112.1	N260 I261 R262 K332 R336	N260-E264 PolarHBondContact O-N 2.68Å; I261-E264 WeakPolarHBondContact O-CG 2.95Å; I261-E264 PolarHBondContact O-N 2.67Å; I261-E264 VanDerWaalsContact O-N 3.14Å; R262-E264 VanDerWaalsContact C-N 3.33Å; E264-K332 VanDerWaalsContact CD-CE 3.48Å; E264-K332 WeakPolarHBondContact OE1-CD 3.32Å; E264-K332 VanDerWaalsContact OE1-CE 3.31Å; E264-K332 WeakPolarHBondContact OE1-CE 3.34Å; E264-K332 IonicContact OE1-NZ 3.56Å; E264-K332 PolarHBondContact OE1-NZ 3.16Å; E264-K332 IonicContact OE2-NZ 2.75Å; E264-K332 PolarHBondContact OE2-NZ 3.47Å; E264-R336 PolarHBondContact O-NH2 3.47Å
265	L	74.1	Confident	79.8	Confident	22 Å²	22	68 Å²	68	12%	0.115	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-69.5	133.7	-175.1	-62.9	177.1	0	0	0	111.9	A263 F271 P283 R336 L339 T340	A263-L265 HydrophobicContact CB-CD1 4.45Å; A263-L265 HydrophobicContact CB-CD2 3.89Å; A263-L265 HydrophobicContact CB-CG 3.8Å; A263-L265 PolarHBondContact O-N 2.93Å; L265-F271 HydrophobicContact CB-CE1 4.45Å; L265-F271 HydrophobicContact CB-CZ 4.17Å; L265-F271 HydrophobicContact CD1-CE1 3.72Å; L265-F271 HydrophobicContact CD1-CZ 4.05Å; L265-F271 HydrophobicContact CD2-CE1 4.12Å; L265-F271 HydrophobicContact CG-CE1 4.32Å; L265-P283 HydrophobicContact CB-CG 4.32Å; L265-P283 HydrophobicContact CD1-CB 3.62Å; L265-P283 HydrophobicContact CD1-CG 3.46Å; L265-P283 VanDerWaalsContact CD1-CG 3.46Å; L265-R336 HydrophobicContact CD2-CG 4.08Å; L265-L339 HydrophobicContact CD1-CB 4.49Å; L265-L339 HydrophobicContact CD1-CD1 4.18Å; L265-L339 HydrophobicContact CD2-CB 4.43Å; L265-T340 HydrophobicContact CD2-CG2 4.5Å
266	E	65.7	Low	79.7	Confident	109 Å²	109	69.2 Å²	69.2	51%	0.509	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-75.8	126.9	-174.7	-68.2	-66.8	164.7	0	0	110.9	R268 Q269 R336	E266-R268 PolarHBondContact O-N 3Å; E266-Q269 HydrophobicContact CB-CG 4.03Å; E266-Q269 PolarHBondContact O-N 2.75Å; E266-Q269 VanDerWaalsContact O-N 3.08Å; E266-R336 IonicContact OE1-NH2 2.68Å
267	P	59.7	Low	79.7	Confident	109 Å²	109	75.3 Å²	75.3	71%	0.708	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	126.7	172.5	-22.8	33.5	0	0	0	110.5
268	R	63.4	Low	79.8	Confident	249 Å²	249	73 Å²	73	94%	0.94	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-3.9	-173.5	-53.4	159.8	178	-164.1	-1.6	116.3	E266	E266-R268 PolarHBondContact O-N 3Å
269	Q	72.3	Confident	79.8	Confident	44 Å²	44	77.9 Å²	77.9	21%	0.206	38%	0.378	C	S	.	.			trans	-60.9	145	163.6	-77	175.8	-40.3	0	0	110.6	E266 F271	E266-Q269 HydrophobicContact CB-CG 4.03Å; E266-Q269 PolarHBondContact O-N 2.75Å; E266-Q269 VanDerWaalsContact O-N 3.08Å; Q269-F271 HydrophobicContact CB-CE1 4.22Å; Q269-F271 HydrophobicContact CB-CE2 3.94Å; Q269-F271 HydrophobicContact CB-CZ 3.54Å; Q269-F271 WeakPolarHBondContact O-CE2 3.47Å
270	M	74.8	Confident	79.8	Confident	109 Å²	109	79.4 Å²	79.4	54%	0.537	39%	0.385	S	S	.	.			trans	-96.5	139.3	169.1	-66.5	-68.2	-179.2	0	0	108.4	L279 K281	M270-L279 HydrophobicContact CB-CD2 4.44Å; M270-K281 HydrophobicContact CE-CG 4.25Å; M270-K281 HydrophobicContact SD-CG 3.95Å
271	F	82.8	Confident	79.6	Confident	4 Å²	4	84.9 Å²	84.9	2%	0.018	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.7	-179.2	-55.7	-84.2	0	0	0	108.2	L265 Q269 L279 F280 P283 L286 L339 T340	L265-F271 HydrophobicContact CB-CE1 4.45Å; L265-F271 HydrophobicContact CB-CZ 4.17Å; L265-F271 HydrophobicContact CD1-CE1 3.72Å; L265-F271 HydrophobicContact CD1-CZ 4.05Å; L265-F271 HydrophobicContact CD2-CE1 4.12Å; L265-F271 HydrophobicContact CG-CE1 4.32Å; Q269-F271 HydrophobicContact CB-CE1 4.22Å; Q269-F271 HydrophobicContact CB-CE2 3.94Å; Q269-F271 HydrophobicContact CB-CZ 3.54Å; Q269-F271 WeakPolarHBondContact O-CE2 3.47Å; F271-L279 CarbonylContact O-C 3.39Å; F271-F280 HydrophobicContact CB-CB 4.4Å; F271-F280 PolarHBondContact N-O 3.03Å; F271-F280 PolarHBondContact O-N 2.85Å; F271-P283 HydrophobicContact CD2-CG 4.12Å; F271-P283 HydrophobicContact CE1-CG 4.11Å; F271-P283 HydrophobicContact CE2-CG 3.61Å; F271-P283 HydrophobicContact CZ-CG 3.62Å; F271-L286 HydrophobicContact CB-CB 4.15Å; F271-L286 HydrophobicContact CB-CD2 3.9Å; F271-L339 WeakPolarHBondContact CD1-O 3.49Å; F271-T340 HydrophobicContact CD1-CG2 4.15Å; F271-T340 HydrophobicContact CE1-CG2 3.69Å
272	W	85.5	Confident	79.5	Confident	96 Å²	96	86.1 Å²	86.1	36%	0.364	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	152.7	-177.2	75.3	-45.8	0	0	0	113.8	L278 L279	W272-L278 WeakPolarHBondContact CA-O 3.49Å; W272-L278 WeakPolarHBondContact CB-O 3.3Å; W272-L279 HydrophobicContact CB-CD2 4.03Å
273	C	88.3	Confident	79.4	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	111.4	171.1	175.1	0	0	0	0	109.8	S275 C276 I277 L278 F280 L286 H289 M290 H307	C273-S275 PolarHBondContact O-N 2.98Å; C273-C276 HydrophobicContact CB-CB 4.17Å; C273-C276 PolarHBondContact O-N 3.14Å; C273-C276 PolarHBondContact SG-N 3.02Å; C273-C276 VanDerWaalsContact SG-N 3.42Å; C273-I277 WeakPolarHBondContact O-CA 3.42Å; C273-I277 PolarHBondContact O-N 2.87Å; C273-L278 PolarHBondContact N-O 2.92Å; C273-F280 HydrophobicContact CB-CE2 4.21Å; C273-L286 HydrophobicContact CB-CD1 3.88Å; C273-H289 WeakPolarHBondContact CB-NE2 3.41Å; C273-M290 HydrophobicContact CB-CE 3.95Å; C273-H307 PolarHBondContact SG-NE2 3.34Å
274	K	84	Confident	79.5	Confident	141 Å²	141	90.3 Å²	90.3	61%	0.613	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-37.3	178.8	-158.7	168	-161.9	151	0	113	D341	K274-D341 IonicContact NZ-OD2 3.26Å; K274-D341 PolarHBondContact NZ-OD2 3.48Å
275	S	84.3	Confident	79.8	Confident	57 Å²	57	87.5 Å²	87.5	40%	0.399	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-17.9	-178.5	-54.9	0	0	0	0	115.3	C273 S306	C273-S275 PolarHBondContact O-N 2.98Å; S275-S306 VanDerWaalsContact CB-OG 3.3Å; S275-S306 WeakPolarHBondContact CB-OG 3.41Å; S275-S306 WeakPolarHBondContact OG-CB 3.39Å; S275-S306 PolarHBondContact OG-OG 3.48Å
276	C	85.4	Confident	80.5	Confident	29 Å²	29	86.5 Å²	86.5	20%	0.196	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-10.6	177.7	-75.4	0	0	0	0	114.3	C273 L278 K293 H307	C273-C276 HydrophobicContact CB-CB 4.17Å; C273-C276 PolarHBondContact O-N 3.14Å; C273-C276 PolarHBondContact SG-N 3.02Å; C273-C276 VanDerWaalsContact SG-N 3.42Å; C276-L278 HydrophobicContact CB-CB 4.38Å; C276-L278 HydrophobicContact CB-CD1 3.98Å; C276-L278 HydrophobicContact CB-CG 3.95Å; C276-L278 PolarHBondContact O-N 2.78Å; C276-K293 WeakPolarHBondContact SG-CE 3.37Å; C276-K293 PolarHBondContact SG-NZ 3.44Å; C276-H307 VanDerWaalsContact SG-CE1 3.52Å; C276-H307 PolarHBondContact SG-NE2 3.13Å
277	I	85.3	Confident	81.6	Confident	135 Å²	135	81.4 Å²	81.4	69%	0.692	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	46.6	-174.3	-41.6	179.2	0	0	0	110.5	C273	C273-I277 WeakPolarHBondContact O-CA 3.42Å; C273-I277 PolarHBondContact O-N 2.87Å
278	L	85.7	Confident	82.9	Confident	67 Å²	67	78.6 Å²	78.6	35%	0.351	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.9	178.8	-69.9	178.7	0	0	0	111.1	W272 C273 C276 F280	W272-L278 WeakPolarHBondContact CA-O 3.49Å; W272-L278 WeakPolarHBondContact CB-O 3.3Å; C273-L278 PolarHBondContact N-O 2.92Å; C276-L278 HydrophobicContact CB-CB 4.38Å; C276-L278 HydrophobicContact CB-CD1 3.98Å; C276-L278 HydrophobicContact CB-CG 3.95Å; C276-L278 PolarHBondContact O-N 2.78Å; L278-F280 HydrophobicContact CB-CE2 3.72Å; L278-F280 HydrophobicContact CB-CZ 3.72Å; L278-F280 HydrophobicContact CD1-CZ 4.3Å; L278-F280 WeakPolarHBondContact O-CD2 3.3Å; L278-F280 VanDerWaalsContact O-CE2 3.25Å; L278-F280 WeakPolarHBondContact O-CE2 3.3Å
279	L	85.5	Confident	84.2	Confident	136 Å²	136	68 Å²	68	71%	0.712	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	139	179.1	-75.3	159.1	0	0	0	111.9	M270 F271 W272	M270-L279 HydrophobicContact CB-CD2 4.44Å; F271-L279 CarbonylContact O-C 3.39Å; W272-L279 HydrophobicContact CB-CD2 4.03Å
280	F	85.4	Confident	85	Confident	33 Å²	33	66.2 Å²	66.2	15%	0.145	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	128.3	-175	-58.9	-81.8	0	0	0	111.2	F271 C273 L278 K282 L286 H289	F271-F280 HydrophobicContact CB-CB 4.4Å; F271-F280 PolarHBondContact N-O 3.03Å; F271-F280 PolarHBondContact O-N 2.85Å; C273-F280 HydrophobicContact CB-CE2 4.21Å; L278-F280 HydrophobicContact CB-CE2 3.72Å; L278-F280 HydrophobicContact CB-CZ 3.72Å; L278-F280 HydrophobicContact CD1-CZ 4.3Å; L278-F280 WeakPolarHBondContact O-CD2 3.3Å; L278-F280 VanDerWaalsContact O-CE2 3.25Å; L278-F280 WeakPolarHBondContact O-CE2 3.3Å; F280-K282 PolarHBondContact O-N 3.45Å; F280-L286 HydrophobicContact CB-CB 4.39Å; F280-L286 HydrophobicContact CD2-CB 4.01Å; F280-L286 HydrophobicContact CD2-CD1 3.77Å; F280-L286 HydrophobicContact CD2-CG 4.5Å; F280-L286 HydrophobicContact CE2-CD1 3.79Å; F280-L286 HydrophobicContact CG-CB 4.27Å; F280-H289 HydrophobicContact CE1-CB 3.87Å; F280-H289 HydrophobicContact CE2-CB 4.29Å; F280-H289 AromaticContact CE2-CD2 3.71Å; F280-H289 HydrophobicContact CZ-CB 3.55Å; F280-H289 AromaticContact CZ-CD2 3.49Å; F280-H289 VanDerWaalsContact CZ-CD2 3.49Å; F280-H289 WeakPolarHBondContact CZ-CD2 3.41Å; F280-H289 AromaticContact CZ-CG 3.39Å; F280-H289 AromaticContact CZ-ND1 3.98Å
281	K	81.2	Confident	85.7	Confident	175 Å²	175	61.4 Å²	61.4	76%	0.761	30%	0.295	S	S	*	.	S	Bend	trans	-79.3	0.9	178.6	-62.2	-174.8	178.1	-178.4	0	114.4	M270	M270-K281 HydrophobicContact CE-CG 4.25Å; M270-K281 HydrophobicContact SD-CG 3.95Å
282	K	82.2	Confident	85.9	Confident	138 Å²	138	65.6 Å²	65.6	60%	0.6	32%	0.318	S	S	*	.	S	Bend	trans	-147.4	137.7	-176.4	-68.2	-173.6	177.6	-176.4	0	109.7	F280 W284 S285 L286	F280-K282 PolarHBondContact O-N 3.45Å; K282-W284 VanDerWaalsContact C-N 3.31Å; K282-W284 PolarHBondContact O-N 2.71Å; K282-S285 WeakPolarHBondContact O-CB 3.44Å; K282-S285 PolarHBondContact O-N 3Å; K282-L286 PolarHBondContact O-N 3.08Å
283	P	81.8	Confident	86	Confident	21 Å²	21	63.1 Å²	63.1	14%	0.136	31%	0.31	C	S	.	.	H	α-helix	trans	-56.7	-45	176.9	-23.3	32.1	0	0	0	112.1	N260 L265 F271 S285 L286 F287	N260-P283 WeakPolarHBondContact OD1-CG 3.37Å; L265-P283 HydrophobicContact CB-CG 4.32Å; L265-P283 HydrophobicContact CD1-CB 3.62Å; L265-P283 HydrophobicContact CD1-CG 3.46Å; L265-P283 VanDerWaalsContact CD1-CG 3.46Å; F271-P283 HydrophobicContact CD2-CG 4.12Å; F271-P283 HydrophobicContact CE1-CG 4.11Å; F271-P283 HydrophobicContact CE2-CG 3.61Å; F271-P283 HydrophobicContact CZ-CG 3.62Å; P283-S285 PolarHBondContact O-N 3.23Å; P283-S285 VanDerWaalsContact O-N 3.13Å; P283-L286 WeakPolarHBondContact O-CB 3.26Å; P283-L286 PolarHBondContact O-N 3.34Å; P283-F287 WeakPolarHBondContact O-CD2 3.04Å; P283-F287 PolarHBondContact O-N 3.37Å
284	W	83.2	Confident	86	Confident	116 Å²	116	63.5 Å²	63.5	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-53.1	-34.2	176.4	177.6	-102.2	0	0	0	113.5	V256 K282 F287 Q288	V256-W284 HydrophobicContact CB-CE3 4.25Å; V256-W284 HydrophobicContact CB-CZ3 3.83Å; V256-W284 HydrophobicContact CG1-CE3 3.74Å; V256-W284 HydrophobicContact CG1-CZ3 3.8Å; V256-W284 HydrophobicContact CG2-CZ3 4.15Å; K282-W284 VanDerWaalsContact C-N 3.31Å; K282-W284 PolarHBondContact O-N 2.71Å; W284-F287 PolarHBondContact O-N 3.41Å; W284-Q288 WeakPolarHBondContact O-CB 3.04Å; W284-Q288 PolarHBondContact O-N 2.97Å
285	S	85.8	Confident	86	Confident	47 Å²	47	61.4 Å²	61.4	33%	0.329	30%	0.304	S	S	.	.	H	α-helix	trans	-75.1	-30.5	178.7	-60.1	0	0	0	0	112.8	K282 P283 H289	K282-S285 WeakPolarHBondContact O-CB 3.44Å; K282-S285 PolarHBondContact O-N 3Å; P283-S285 PolarHBondContact O-N 3.23Å; P283-S285 VanDerWaalsContact O-N 3.13Å; S285-H289 VanDerWaalsContact O-CB 3.26Å; S285-H289 WeakPolarHBondContact O-CB 3.1Å; S285-H289 PolarHBondContact O-N 3.25Å; S285-H289 VanDerWaalsContact O-N 3.15Å
286	L	88.4	Confident	85.7	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-69.1	-47.2	168.6	177.6	62	0	0	0	110.5	F271 C273 F280 K282 P283 Q288 H289 M290 W310	F271-L286 HydrophobicContact CB-CB 4.15Å; F271-L286 HydrophobicContact CB-CD2 3.9Å; C273-L286 HydrophobicContact CB-CD1 3.88Å; F280-L286 HydrophobicContact CB-CB 4.39Å; F280-L286 HydrophobicContact CD2-CB 4.01Å; F280-L286 HydrophobicContact CD2-CD1 3.77Å; F280-L286 HydrophobicContact CD2-CG 4.5Å; F280-L286 HydrophobicContact CE2-CD1 3.79Å; F280-L286 HydrophobicContact CG-CB 4.27Å; K282-L286 PolarHBondContact O-N 3.08Å; P283-L286 WeakPolarHBondContact O-CB 3.26Å; P283-L286 PolarHBondContact O-N 3.34Å; L286-Q288 PolarHBondContact O-N 2.75Å; L286-H289 WeakPolarHBondContact O-CB 3.43Å; L286-H289 PolarHBondContact O-N 3.42Å; L286-M290 HydrophobicContact CD1-CE 3.95Å; L286-M290 HydrophobicContact CD1-CG 4.16Å; L286-M290 HydrophobicContact CG-CG 4.44Å; L286-M290 VanDerWaalsContact O-CG 3.31Å; L286-M290 WeakPolarHBondContact O-CG 3.38Å; L286-M290 PolarHBondContact O-N 3.18Å; L286-W310 HydrophobicContact CD2-CH2 4.2Å; L286-W310 HydrophobicContact CD2-CZ2 3.81Å; L286-W310 HydrophobicContact CG-CH2 4.14Å; L286-W310 HydrophobicContact CG-CZ2 4.19Å
287	F	88	Confident	84.9	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.009	33%	0.33	C	S	.	.	H	α-helix	trans	-56.7	-50.9	176.3	-87.2	-77.2	0	0	0	112.5	V256 V259 P283 W284 H289 M290 V291 W310 L311 I314 L339	V256-F287 HydrophobicContact CG1-CB 4Å; V256-F287 HydrophobicContact CG1-CD1 3.91Å; V256-F287 HydrophobicContact CG1-CD2 3.7Å; V256-F287 HydrophobicContact CG1-CE1 4.31Å; V256-F287 HydrophobicContact CG1-CE2 4.11Å; V256-F287 HydrophobicContact CG1-CG 3.6Å; V256-F287 HydrophobicContact CG1-CZ 4.4Å; V259-F287 HydrophobicContact CB-CZ 4.4Å; V259-F287 HydrophobicContact CG1-CE2 4.41Å; V259-F287 HydrophobicContact CG1-CZ 3.73Å; P283-F287 WeakPolarHBondContact O-CD2 3.04Å; P283-F287 PolarHBondContact O-N 3.37Å; W284-F287 PolarHBondContact O-N 3.41Å; F287-H289 VanDerWaalsContact C-N 3.29Å; F287-H289 PolarHBondContact O-N 2.9Å; F287-M290 PolarHBondContact O-N 2.88Å; F287-V291 WeakPolarHBondContact O-CG2 3.08Å; F287-V291 PolarHBondContact O-N 2.74Å; F287-W310 AromaticContact CD1-CH2 3.96Å; F287-W310 HydrophobicContact CD1-CH2 3.96Å; F287-W310 AromaticContact CD1-CZ3 3.83Å; F287-W310 HydrophobicContact CD1-CZ3 3.83Å; F287-W310 HydrophobicContact CD2-CH2 4.49Å; F287-W310 AromaticContact CE1-CH2 3.87Å; F287-W310 HydrophobicContact CE1-CH2 3.87Å; F287-W310 AromaticContact CE1-CZ3 3.89Å; F287-W310 HydrophobicContact CE1-CZ3 3.89Å; F287-W310 HydrophobicContact CE2-CH2 4.41Å; F287-W310 HydrophobicContact CG-CH2 4.27Å; F287-W310 HydrophobicContact CG-CZ3 4.45Å; F287-W310 HydrophobicContact CZ-CH2 4.09Å; F287-L311 HydrophobicContact CD1-CD2 4.42Å; F287-I314 HydrophobicContact CE1-CD1 3.64Å; F287-I314 HydrophobicContact CE1-CG2 4.34Å; F287-I314 HydrophobicContact CZ-CD1 3.76Å; F287-L339 HydrophobicContact CD2-CD2 4.3Å; F287-L339 HydrophobicContact CE2-CD1 4.4Å; F287-L339 HydrophobicContact CE2-CD2 3.44Å; F287-L339 VanDerWaalsContact CE2-CD2 3.44Å; F287-L339 HydrophobicContact CZ-CD1 4.38Å; F287-L339 HydrophobicContact CZ-CD2 3.67Å
288	Q	87.9	Confident	83.8	Confident	51 Å²	51	72 Å²	72	24%	0.238	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-39.5	178.4	-171.9	65.8	67.3	0	0	111.4	W284 L286 V291 D292	W284-Q288 WeakPolarHBondContact O-CB 3.04Å; W284-Q288 PolarHBondContact O-N 2.97Å; L286-Q288 PolarHBondContact O-N 2.75Å; Q288-V291 PolarHBondContact O-N 3.02Å; Q288-D292 PolarHBondContact NE2-OD1 2.8Å; Q288-D292 VanDerWaalsContact O-CB 3.27Å; Q288-D292 WeakPolarHBondContact O-CB 3.01Å; Q288-D292 PolarHBondContact O-N 2.95Å
289	H	89.7	Confident	82.7	Confident	25 Å²	25	70.9 Å²	70.9	12%	0.116	33%	0.334	C	S	.	.	H	α-helix	trans	-62.2	-44.1	174.9	168.4	67.7	0	0	0	112.6	C273 F280 S285 L286 F287 D292 K293 H307	C273-H289 WeakPolarHBondContact CB-NE2 3.41Å; F280-H289 HydrophobicContact CE1-CB 3.87Å; F280-H289 HydrophobicContact CE2-CB 4.29Å; F280-H289 AromaticContact CE2-CD2 3.71Å; F280-H289 HydrophobicContact CZ-CB 3.55Å; F280-H289 AromaticContact CZ-CD2 3.49Å; F280-H289 VanDerWaalsContact CZ-CD2 3.49Å; F280-H289 WeakPolarHBondContact CZ-CD2 3.41Å; F280-H289 AromaticContact CZ-CG 3.39Å; F280-H289 AromaticContact CZ-ND1 3.98Å; S285-H289 VanDerWaalsContact O-CB 3.26Å; S285-H289 WeakPolarHBondContact O-CB 3.1Å; S285-H289 PolarHBondContact O-N 3.25Å; S285-H289 VanDerWaalsContact O-N 3.15Å; L286-H289 WeakPolarHBondContact O-CB 3.43Å; L286-H289 PolarHBondContact O-N 3.42Å; F287-H289 VanDerWaalsContact C-N 3.29Å; F287-H289 PolarHBondContact O-N 2.9Å; H289-D292 PolarHBondContact O-N 3.42Å; H289-K293 VanDerWaalsContact O-CB 3.27Å; H289-K293 WeakPolarHBondContact O-CB 3.48Å; H289-K293 VanDerWaalsContact O-CG 3.28Å; H289-K293 WeakPolarHBondContact O-CG 3.43Å; H289-K293 PolarHBondContact O-N 3.26Å; H289-H307 AromaticContact NE2-NE2 3.68Å
290	M	89.8	Confident	82	Confident	7 Å²	7	70.9 Å²	70.9	3%	0.034	33%	0.33	C	S	.	.	H	α-helix	trans	-63.9	-43.4	176.9	-68.6	-74	-162.6	0	0	111.6	C273 L286 F287 K293 A294 H307 W310 L311	C273-M290 HydrophobicContact CB-CE 3.95Å; L286-M290 HydrophobicContact CD1-CE 3.95Å; L286-M290 HydrophobicContact CD1-CG 4.16Å; L286-M290 HydrophobicContact CG-CG 4.44Å; L286-M290 VanDerWaalsContact O-CG 3.31Å; L286-M290 WeakPolarHBondContact O-CG 3.38Å; L286-M290 PolarHBondContact O-N 3.18Å; F287-M290 PolarHBondContact O-N 2.88Å; M290-K293 PolarHBondContact O-N 2.85Å; M290-A294 VanDerWaalsContact O-CB 3.32Å; M290-A294 WeakPolarHBondContact O-CB 3.25Å; M290-A294 PolarHBondContact O-N 3.35Å; M290-H307 HydrophobicContact SD-CB 3.87Å; M290-H307 PolarHBondContact SD-CD2 2.74Å; M290-W310 HydrophobicContact CB-CE3 3.71Å; M290-W310 HydrophobicContact CB-CZ3 3.74Å; M290-W310 HydrophobicContact CE-CB 4.33Å; M290-W310 HydrophobicContact CE-CD2 3.71Å; M290-W310 HydrophobicContact CE-CE3 4.18Å; M290-W310 HydrophobicContact CE-CG 3.78Å; M290-W310 HydrophobicContact CE-CZ2 4.49Å; M290-W310 HydrophobicContact CG-CD2 4.01Å; M290-W310 HydrophobicContact CG-CE3 3.46Å; M290-W310 VanDerWaalsContact CG-CE3 3.46Å; M290-W310 HydrophobicContact CG-CH2 4.15Å; M290-W310 HydrophobicContact CG-CZ3 3.55Å; M290-W310 HydrophobicContact SD-CB 4.36Å; M290-W310 HydrophobicContact SD-CD2 4.09Å; M290-W310 HydrophobicContact SD-CE3 4.03Å; M290-W310 HydrophobicContact SD-CG 4.27Å; M290-L311 HydrophobicContact CB-CD2 4.26Å; M290-L311 HydrophobicContact CB-CG 4.32Å
291	V	89.1	Confident	81.4	Confident	8 Å²	8	76.1 Å²	76.1	5%	0.048	36%	0.355	C	S	.	.	H	α-helix	trans	-64.7	-46.1	175.4	171.3	0	0	0	0	112	F248 F287 Q288 K293 A294 K295 L311	F248-V291 WeakPolarHBondContact O-CG2 3.18Å; F287-V291 WeakPolarHBondContact O-CG2 3.08Å; F287-V291 PolarHBondContact O-N 2.74Å; Q288-V291 PolarHBondContact O-N 3.02Å; V291-K293 VanDerWaalsContact C-N 3.27Å; V291-K293 PolarHBondContact O-N 3.44Å; V291-A294 PolarHBondContact O-N 3.43Å; V291-K295 HydrophobicContact CG1-CD 4.38Å; V291-K295 WeakPolarHBondContact O-CB 3.09Å; V291-K295 PolarHBondContact O-N 3.22Å; V291-L311 HydrophobicContact CG2-CD1 3.96Å; V291-L311 HydrophobicContact CG2-CD2 4.04Å
292	D	87.7	Confident	80.8	Confident	92 Å²	92	74.4 Å²	74.4	49%	0.492	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-35.6	178	-72	-10.2	0	0	0	111.6	Q288 H289 G296	Q288-D292 PolarHBondContact NE2-OD1 2.8Å; Q288-D292 VanDerWaalsContact O-CB 3.27Å; Q288-D292 WeakPolarHBondContact O-CB 3.01Å; Q288-D292 PolarHBondContact O-N 2.95Å; H289-D292 PolarHBondContact O-N 3.42Å; D292-G296 PolarHBondContact O-N 2.86Å
293	K	88.2	Confident	80.5	Confident	45 Å²	45	70.5 Å²	70.5	20%	0.196	34%	0.337	C	S	.	.	H	α-helix	trans	-73.1	-46	175.5	-78.9	-78.7	-162	154.6	0	112.3	C276 H289 M290 V291 K295 G296 I299 E303 H307	C276-K293 WeakPolarHBondContact SG-CE 3.37Å; C276-K293 PolarHBondContact SG-NZ 3.44Å; H289-K293 VanDerWaalsContact O-CB 3.27Å; H289-K293 WeakPolarHBondContact O-CB 3.48Å; H289-K293 VanDerWaalsContact O-CG 3.28Å; H289-K293 WeakPolarHBondContact O-CG 3.43Å; H289-K293 PolarHBondContact O-N 3.26Å; M290-K293 PolarHBondContact O-N 2.85Å; V291-K293 VanDerWaalsContact C-N 3.27Å; V291-K293 PolarHBondContact O-N 3.44Å; K293-K295 VanDerWaalsContact C-N 3.28Å; K293-K295 PolarHBondContact O-N 2.85Å; K293-G296 PolarHBondContact O-N 3.42Å; K293-I299 HydrophobicContact CB-CD1 4.24Å; K293-I299 HydrophobicContact CD-CD1 3.53Å; K293-I299 HydrophobicContact CD-CG1 4.08Å; K293-I299 HydrophobicContact CD-CG2 4.38Å; K293-I299 HydrophobicContact CG-CD1 4.37Å; K293-I299 WeakPolarHBondContact O-CD1 3.24Å; K293-E303 IonicContact NZ-OE2 3.95Å; K293-E303 PolarHBondContact NZ-OE2 3.41Å; K293-H307 HydrophobicContact CB-CB 3.89Å; K293-H307 WeakPolarHBondContact CB-CD2 3.46Å
294	A	86.9	Confident	80.6	Confident	7 Å²	7	73.9 Å²	73.9	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-60.9	-35.4	175.2	0	0	0	0	0	112.4	M290 V291 K304 F308 L311	M290-A294 VanDerWaalsContact O-CB 3.32Å; M290-A294 WeakPolarHBondContact O-CB 3.25Å; M290-A294 PolarHBondContact O-N 3.35Å; V291-A294 PolarHBondContact O-N 3.43Å; A294-K304 WeakPolarHBondContact O-CE 3.48Å; A294-F308 HydrophobicContact CB-CB 4.28Å; A294-F308 HydrophobicContact CB-CD2 4.43Å; A294-L311 HydrophobicContact CB-CD1 3.92Å
295	K	84.7	Confident	80.7	Confident	97 Å²	97	72.2 Å²	72.2	42%	0.422	35%	0.347	S	S	.	.	H	α-helix	trans	-83.1	-14.4	176.1	-73.4	-168	164	-175.4	0	115.1	L249 D250 V291 K293 K297	L249-K295 HydrophobicContact CD2-CD 4.39Å; L249-K295 HydrophobicContact CD2-CG 3.94Å; L249-K295 VanDerWaalsContact O-CE 3.26Å; L249-K295 WeakPolarHBondContact O-CE 3.45Å; L249-K295 PolarHBondContact O-NZ 3.31Å; D250-K295 IonicContact OD1-NZ 3.53Å; D250-K295 PolarHBondContact OD1-NZ 2.99Å; V291-K295 HydrophobicContact CG1-CD 4.38Å; V291-K295 WeakPolarHBondContact O-CB 3.09Å; V291-K295 PolarHBondContact O-N 3.22Å; K293-K295 VanDerWaalsContact C-N 3.28Å; K293-K295 PolarHBondContact O-N 2.85Å; K295-K297 PolarHBondContact O-N 3.34Å
296	G	78.5	Confident	80.7	Confident	21 Å²	21	71.7 Å²	71.7	22%	0.216	34%	0.343	C	S	.	.			trans	-74.2	119.4	-167.1	0	0	0	0	0	114.5	D292 K293 K298	D292-G296 PolarHBondContact O-N 2.86Å; K293-G296 PolarHBondContact O-N 3.42Å; G296-K298 PolarHBondContact O-N 2.58Å
297	K	67.9	Low	80.7	Confident	214 Å²	214	71.6 Å²	71.6	93%	0.93	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	5.9	178.3	-58.8	-172.6	179.1	-174.6	0	115.6	K295	K295-K297 PolarHBondContact O-N 3.34Å
298	K	62.8	Low	80.8	Confident	209 Å²	209	74.9 Å²	74.9	91%	0.909	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.6	24.3	-170	-63.4	-167.1	176.8	-170.4	0	113.6	G296	G296-K298 PolarHBondContact O-N 2.58Å
299	I	63	Low	80.9	Confident	44 Å²	44	75.6 Å²	75.6	23%	0.226	36%	0.363	C	S	.	.	S	Bend	trans	-115.4	149.2	-175.3	-62.9	154.3	0	0	0	107.7	K293 E303 K304	K293-I299 HydrophobicContact CB-CD1 4.24Å; K293-I299 HydrophobicContact CD-CD1 3.53Å; K293-I299 HydrophobicContact CD-CG1 4.08Å; K293-I299 HydrophobicContact CD-CG2 4.38Å; K293-I299 HydrophobicContact CG-CD1 4.37Å; K293-I299 WeakPolarHBondContact O-CD1 3.24Å; I299-E303 HydrophobicContact CG2-CB 3.42Å; I299-E303 VanDerWaalsContact CG2-CB 3.42Å; I299-E303 HydrophobicContact CG2-CG 4.34Å; I299-K304 HydrophobicContact CG2-CB 4.28Å
300	Q	70.2	Confident	81	Confident	135 Å²	135	75.6 Å²	75.6	63%	0.631	36%	0.362	S	S	*	.			trans	-58.4	145.8	175	-62.5	-172.3	-0.1	0	0	110.5	L302 E303 K304	Q300-L302 VanDerWaalsContact C-N 3.26Å; Q300-L302 PolarHBondContact O-N 3.46Å; Q300-E303 HydrophobicContact CB-CB 4.45Å; Q300-E303 PolarHBondContact O-N 2.95Å; Q300-K304 WeakPolarHBondContact O-CB 3.5Å; Q300-K304 PolarHBondContact O-N 2.82Å
301	H	73.1	Confident	81	Confident	143 Å²	143	75.3 Å²	75.3	66%	0.662	36%	0.36	S	S	*	.	H	α-helix	trans	-56.9	-40.8	-175.7	-170.6	-74.8	0	0	0	112.5	K304 Q305	H301-K304 PolarHBondContact O-N 2.95Å; H301-Q305 WeakPolarHBondContact O-CB 3.38Å; H301-Q305 PolarHBondContact O-N 2.94Å
302	L	68.4	Low	81.2	Confident	140 Å²	140	76.8 Å²	76.8	73%	0.733	37%	0.368	S	S	*	.	H	α-helix	trans	-66.6	-47.7	-179.9	-64	171.3	0	0	0	112.4	Q300 K304 Q305 S306	Q300-L302 VanDerWaalsContact C-N 3.26Å; Q300-L302 PolarHBondContact O-N 3.46Å; L302-K304 VanDerWaalsContact C-N 3.33Å; L302-K304 PolarHBondContact O-N 3.25Å; L302-Q305 PolarHBondContact O-N 3.42Å; L302-S306 PolarHBondContact O-N 3.3Å
303	E	76.4	Confident	81.4	Confident	55 Å²	55	76.6 Å²	76.6	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-56.3	-47.9	170.5	-86.3	-170.8	-116.8	0	0	111.1	K293 I299 Q300 Q305 S306 H307	K293-E303 IonicContact NZ-OE2 3.95Å; K293-E303 PolarHBondContact NZ-OE2 3.41Å; I299-E303 HydrophobicContact CG2-CB 3.42Å; I299-E303 VanDerWaalsContact CG2-CB 3.42Å; I299-E303 HydrophobicContact CG2-CG 4.34Å; Q300-E303 HydrophobicContact CB-CB 4.45Å; Q300-E303 PolarHBondContact O-N 2.95Å; E303-Q305 VanDerWaalsContact C-N 3.27Å; E303-Q305 PolarHBondContact O-N 2.9Å; E303-S306 PolarHBondContact O-N 3.32Å; E303-S306 PolarHBondContact O-OG 3.48Å; E303-S306 VanDerWaalsContact O-OG 3.06Å; E303-H307 PolarHBondContact O-N 3.02Å; E303-H307 PolarHBondContact O-ND1 3.41Å
304	K	83	Confident	81.6	Confident	93 Å²	93	74.4 Å²	74.4	40%	0.404	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-40.3	-177.7	-168.8	-157.6	169.8	-151.3	0	111	A294 I299 Q300 H301 L302 F308	A294-K304 WeakPolarHBondContact O-CE 3.48Å; I299-K304 HydrophobicContact CG2-CB 4.28Å; Q300-K304 WeakPolarHBondContact O-CB 3.5Å; Q300-K304 PolarHBondContact O-N 2.82Å; H301-K304 PolarHBondContact O-N 2.95Å; L302-K304 VanDerWaalsContact C-N 3.33Å; L302-K304 PolarHBondContact O-N 3.25Å; K304-F308 PolarHBondContact O-N 3.13Å
305	Q	84.8	Confident	81.9	Confident	81 Å²	81	74.1 Å²	74.1	38%	0.379	36%	0.355	S	S	.	.	H	α-helix	trans	-63.8	-49.3	177.4	-168.2	62.6	42.4	0	0	111.3	H301 L302 E303 H307 F308 D309	H301-Q305 WeakPolarHBondContact O-CB 3.38Å; H301-Q305 PolarHBondContact O-N 2.94Å; L302-Q305 PolarHBondContact O-N 3.42Å; E303-Q305 VanDerWaalsContact C-N 3.27Å; E303-Q305 PolarHBondContact O-N 2.9Å; Q305-H307 VanDerWaalsContact C-N 3.31Å; Q305-H307 PolarHBondContact O-N 3.11Å; Q305-F308 CarbonylContact O-C 3.57Å; Q305-F308 WeakPolarHBondContact O-CA 3.21Å; Q305-F308 WeakPolarHBondContact O-CB 3.4Å; Q305-F308 PolarHBondContact O-N 3.02Å; Q305-D309 PolarHBondContact NE2-OD1 3.27Å; Q305-D309 PolarHBondContact O-N 3.27Å
306	S	85.4	Confident	82.2	Confident	35 Å²	35	70.6 Å²	70.6	25%	0.245	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-33.5	-176.2	70.8	0	0	0	0	114.2	S275 L302 E303 W310	S275-S306 VanDerWaalsContact CB-OG 3.3Å; S275-S306 WeakPolarHBondContact CB-OG 3.41Å; S275-S306 WeakPolarHBondContact OG-CB 3.39Å; S275-S306 PolarHBondContact OG-OG 3.48Å; L302-S306 PolarHBondContact O-N 3.3Å; E303-S306 PolarHBondContact O-N 3.32Å; E303-S306 PolarHBondContact O-OG 3.48Å; E303-S306 VanDerWaalsContact O-OG 3.06Å; S306-W310 WeakPolarHBondContact O-CB 3.34Å; S306-W310 PolarHBondContact O-N 3.03Å; S306-W310 VanDerWaalsContact O-N 3.13Å
307	H	89.6	Confident	82.9	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-75.2	-27.2	174.9	-61.6	68.9	0	0	0	111.8	C273 C276 H289 M290 K293 E303 Q305 L311	C273-H307 PolarHBondContact SG-NE2 3.34Å; C276-H307 VanDerWaalsContact SG-CE1 3.52Å; C276-H307 PolarHBondContact SG-NE2 3.13Å; H289-H307 AromaticContact NE2-NE2 3.68Å; M290-H307 HydrophobicContact SD-CB 3.87Å; M290-H307 PolarHBondContact SD-CD2 2.74Å; K293-H307 HydrophobicContact CB-CB 3.89Å; K293-H307 WeakPolarHBondContact CB-CD2 3.46Å; E303-H307 PolarHBondContact O-N 3.02Å; E303-H307 PolarHBondContact O-ND1 3.41Å; Q305-H307 VanDerWaalsContact C-N 3.31Å; Q305-H307 PolarHBondContact O-N 3.11Å; H307-L311 WeakPolarHBondContact O-CG 3.45Å; H307-L311 PolarHBondContact O-N 3.21Å
308	F	89.8	Confident	84.1	Confident	71 Å²	71	60.7 Å²	60.7	31%	0.311	30%	0.298	S	S	.	.	H	α-helix	trans	-74.2	-46.2	171.7	-175.4	-89.5	0	0	0	111.2	L245 A294 K304 Q305 W310 L311 D312	L245-F308 HydrophobicContact CD1-CZ 4.17Å; L245-F308 HydrophobicContact CD2-CZ 4.45Å; A294-F308 HydrophobicContact CB-CB 4.28Å; A294-F308 HydrophobicContact CB-CD2 4.43Å; K304-F308 PolarHBondContact O-N 3.13Å; Q305-F308 CarbonylContact O-C 3.57Å; Q305-F308 WeakPolarHBondContact O-CA 3.21Å; Q305-F308 WeakPolarHBondContact O-CB 3.4Å; Q305-F308 PolarHBondContact O-N 3.02Å; F308-W310 PolarHBondContact O-N 2.92Å; F308-L311 WeakPolarHBondContact O-CB 3.42Å; F308-L311 PolarHBondContact O-N 3.16Å; F308-D312 HydrophobicContact CD1-CB 4.47Å; F308-D312 HydrophobicContact CE1-CB 4.31Å; F308-D312 WeakPolarHBondContact O-CB 3.33Å; F308-D312 PolarHBondContact O-N 3.35Å
309	D	89.3	Confident	85.4	Confident	65 Å²	65	50.8 Å²	50.8	35%	0.348	26%	0.255	S	S	.	.	H	α-helix	trans	-57.9	-36.6	176.8	-60.9	-24.6	0	0	0	111.5	Q305 D312 N313	Q305-D309 PolarHBondContact NE2-OD1 3.27Å; Q305-D309 PolarHBondContact O-N 3.27Å; D309-D312 PolarHBondContact O-N 3.31Å; D309-N313 WeakPolarHBondContact O-CB 3.25Å; D309-N313 PolarHBondContact O-N 2.88Å; D309-N313 PolarHBondContact O-ND2 3.49Å
310	W	92.2	Very high	86.7	Confident	26 Å²	26	48.8 Å²	48.8	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-42.4	174.1	-175.2	88.4	0	0	0	112.6	L286 F287 M290 S306 F308 I314 L338 L339	L286-W310 HydrophobicContact CD2-CH2 4.2Å; L286-W310 HydrophobicContact CD2-CZ2 3.81Å; L286-W310 HydrophobicContact CG-CH2 4.14Å; L286-W310 HydrophobicContact CG-CZ2 4.19Å; F287-W310 AromaticContact CD1-CH2 3.96Å; F287-W310 HydrophobicContact CD1-CH2 3.96Å; F287-W310 AromaticContact CD1-CZ3 3.83Å; F287-W310 HydrophobicContact CD1-CZ3 3.83Å; F287-W310 HydrophobicContact CD2-CH2 4.49Å; F287-W310 AromaticContact CE1-CH2 3.87Å; F287-W310 HydrophobicContact CE1-CH2 3.87Å; F287-W310 AromaticContact CE1-CZ3 3.89Å; F287-W310 HydrophobicContact CE1-CZ3 3.89Å; F287-W310 HydrophobicContact CE2-CH2 4.41Å; F287-W310 HydrophobicContact CG-CH2 4.27Å; F287-W310 HydrophobicContact CG-CZ3 4.45Å; F287-W310 HydrophobicContact CZ-CH2 4.09Å; M290-W310 HydrophobicContact CB-CE3 3.71Å; M290-W310 HydrophobicContact CB-CZ3 3.74Å; M290-W310 HydrophobicContact CE-CB 4.33Å; M290-W310 HydrophobicContact CE-CD2 3.71Å; M290-W310 HydrophobicContact CE-CE3 4.18Å; M290-W310 HydrophobicContact CE-CG 3.78Å; M290-W310 HydrophobicContact CE-CZ2 4.49Å; M290-W310 HydrophobicContact CG-CD2 4.01Å; M290-W310 HydrophobicContact CG-CE3 3.46Å; M290-W310 VanDerWaalsContact CG-CE3 3.46Å; M290-W310 HydrophobicContact CG-CH2 4.15Å; M290-W310 HydrophobicContact CG-CZ3 3.55Å; M290-W310 HydrophobicContact SD-CB 4.36Å; M290-W310 HydrophobicContact SD-CD2 4.09Å; M290-W310 HydrophobicContact SD-CE3 4.03Å; M290-W310 HydrophobicContact SD-CG 4.27Å; S306-W310 WeakPolarHBondContact O-CB 3.34Å; S306-W310 PolarHBondContact O-N 3.03Å; S306-W310 VanDerWaalsContact O-N 3.13Å; F308-W310 PolarHBondContact O-N 2.92Å; W310-I314 HydrophobicContact CD2-CD1 4Å; W310-I314 HydrophobicContact CE3-CD1 3.83Å; W310-I314 HydrophobicContact CH2-CD1 3.42Å; W310-I314 VanDerWaalsContact CH2-CD1 3.42Å; W310-I314 HydrophobicContact CZ2-CD1 3.59Å; W310-I314 HydrophobicContact CZ3-CD1 3.54Å; W310-I314 WeakPolarHBondContact O-CG1 3.33Å; W310-I314 PolarHBondContact O-N 2.66Å; W310-L338 PolarHBondContact NE1-O 3.32Å; W310-L339 HydrophobicContact CH2-CD2 3.76Å; W310-L339 HydrophobicContact CZ2-CD2 3.61Å; W310-L339 HydrophobicContact CZ2-CG 4.41Å
311	L	91.2	Very high	87.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.6	-38.6	174.2	-68	169	0	0	0	111.9	L245 L249 F287 M290 V291 A294 H307 F308 I314 A315	L245-L311 HydrophobicContact CD2-CB 4.09Å; L249-L311 HydrophobicContact CD2-CD1 4.48Å; F287-L311 HydrophobicContact CD1-CD2 4.42Å; M290-L311 HydrophobicContact CB-CD2 4.26Å; M290-L311 HydrophobicContact CB-CG 4.32Å; V291-L311 HydrophobicContact CG2-CD1 3.96Å; V291-L311 HydrophobicContact CG2-CD2 4.04Å; A294-L311 HydrophobicContact CB-CD1 3.92Å; H307-L311 WeakPolarHBondContact O-CG 3.45Å; H307-L311 PolarHBondContact O-N 3.21Å; F308-L311 WeakPolarHBondContact O-CB 3.42Å; F308-L311 PolarHBondContact O-N 3.16Å; L311-I314 PolarHBondContact O-N 3.1Å; L311-A315 WeakPolarHBondContact O-CB 3.42Å; L311-A315 PolarHBondContact O-N 3.47Å
312	D	91.8	Very high	88.5	Confident	39 Å²	39	37.3 Å²	37.3	21%	0.209	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-39.2	178	-178.9	78.6	0	0	0	112.2	K241 L245 F308 D309 A315 G316	K241-D312 VanDerWaalsContact CE-CG 3.46Å; K241-D312 WeakPolarHBondContact CE-O 3.27Å; K241-D312 WeakPolarHBondContact CE-OD1 3.3Å; K241-D312 WeakPolarHBondContact CE-OD2 3.22Å; K241-D312 IonicContact NZ-OD1 3.73Å; K241-D312 PolarHBondContact NZ-OD1 3.22Å; K241-D312 IonicContact NZ-OD2 2.57Å; K241-D312 PolarHBondContact NZ-OD2 3.35Å; L245-D312 HydrophobicContact CD2-CB 4.41Å; F308-D312 HydrophobicContact CD1-CB 4.47Å; F308-D312 HydrophobicContact CE1-CB 4.31Å; F308-D312 WeakPolarHBondContact O-CB 3.33Å; F308-D312 PolarHBondContact O-N 3.35Å; D309-D312 PolarHBondContact O-N 3.31Å; D312-A315 PolarHBondContact O-N 2.82Å; D312-G316 PolarHBondContact O-N 3.08Å
313	N	92.3	Very high	89.5	Confident	88 Å²	88	32.3 Å²	32.3	47%	0.471	17%	0.166	S	C	.	.	H	α-helix	trans	-64.4	-44.4	171.6	-79.4	-59.9	0	0	0	112.1	D309 G316 L317 L338	D309-N313 WeakPolarHBondContact O-CB 3.25Å; D309-N313 PolarHBondContact O-N 2.88Å; D309-N313 PolarHBondContact O-ND2 3.49Å; N313-G316 PolarHBondContact O-N 3.31Å; N313-L317 WeakPolarHBondContact O-CG 3.46Å; N313-L317 PolarHBondContact O-N 3.39Å; N313-L338 HydrophobicContact CB-CD2 3.74Å
314	I	92.2	Very high	90	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-43.3	175.8	-66.2	176.5	0	0	0	110.8	F248 V259 F287 W310 L311 G316 L317 M318 L335 L338 L339	F248-I314 HydrophobicContact CE2-CB 4.34Å; F248-I314 HydrophobicContact CE2-CG2 3.82Å; F248-I314 HydrophobicContact CZ-CG2 3.87Å; V259-I314 HydrophobicContact CG1-CG2 4.03Å; V259-I314 HydrophobicContact CG2-CG2 4.07Å; F287-I314 HydrophobicContact CE1-CD1 3.64Å; F287-I314 HydrophobicContact CE1-CG2 4.34Å; F287-I314 HydrophobicContact CZ-CD1 3.76Å; W310-I314 HydrophobicContact CD2-CD1 4Å; W310-I314 HydrophobicContact CE3-CD1 3.83Å; W310-I314 HydrophobicContact CH2-CD1 3.42Å; W310-I314 VanDerWaalsContact CH2-CD1 3.42Å; W310-I314 HydrophobicContact CZ2-CD1 3.59Å; W310-I314 HydrophobicContact CZ3-CD1 3.54Å; W310-I314 WeakPolarHBondContact O-CG1 3.33Å; W310-I314 PolarHBondContact O-N 2.66Å; L311-I314 PolarHBondContact O-N 3.1Å; I314-G316 VanDerWaalsContact C-N 3.3Å; I314-G316 PolarHBondContact O-N 3.39Å; I314-L317 PolarHBondContact O-N 2.73Å; I314-M318 HydrophobicContact CG2-CG 4.41Å; I314-M318 WeakPolarHBondContact O-CG 3.37Å; I314-M318 PolarHBondContact O-N 3.5Å; I314-L335 HydrophobicContact CG2-CD2 4.16Å; I314-L338 HydrophobicContact CD1-CD2 4.46Å; I314-L338 HydrophobicContact CG1-CD2 3.54Å; I314-L338 HydrophobicContact CG1-CG 4.2Å; I314-L339 HydrophobicContact CD1-CD2 4.33Å
315	A	92.6	Very high	90.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-38.6	176.2	0	0	0	0	0	111.9	K241 L245 F248 L311 D312 M318 A319	K241-A315 HydrophobicContact CG-CB 3.84Å; L245-A315 HydrophobicContact CD2-CB 4.11Å; L245-A315 HydrophobicContact CG-CB 3.73Å; F248-A315 HydrophobicContact CD2-CB 4.42Å; F248-A315 HydrophobicContact CE2-CB 3.94Å; L311-A315 WeakPolarHBondContact O-CB 3.42Å; L311-A315 PolarHBondContact O-N 3.47Å; D312-A315 PolarHBondContact O-N 2.82Å; A315-M318 PolarHBondContact O-N 2.87Å; A315-A319 VanDerWaalsContact O-CB 3.3Å; A315-A319 WeakPolarHBondContact O-CB 3.44Å; A315-A319 PolarHBondContact O-N 2.88Å
316	G	92.2	Very high	90.3	Very high	23 Å²	23	31.8 Å²	31.8	24%	0.237	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-41.8	174.3	0	0	0	0	0	113	D312 N313 I314 G320	D312-G316 PolarHBondContact O-N 3.08Å; N313-G316 PolarHBondContact O-N 3.31Å; I314-G316 VanDerWaalsContact C-N 3.3Å; I314-G316 PolarHBondContact O-N 3.39Å; G316-G320 PolarHBondContact O-N 3.22Å
317	L	92.5	Very high	90.4	Very high	28 Å²	28	35.6 Å²	35.6	15%	0.147	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-43.3	174.4	-73.3	173.6	0	0	0	111.9	N313 I314 G320 Y321 F326 L331 D334 L335 L338	N313-L317 WeakPolarHBondContact O-CG 3.46Å; N313-L317 PolarHBondContact O-N 3.39Å; I314-L317 PolarHBondContact O-N 2.73Å; L317-G320 PolarHBondContact O-N 3.38Å; L317-Y321 PolarHBondContact O-N 3.4Å; L317-F326 HydrophobicContact CD2-CZ 3.91Å; L317-F326 VanDerWaalsContact O-CZ 3.26Å; L317-F326 WeakPolarHBondContact O-CZ 3.36Å; L317-L331 HydrophobicContact CB-CD1 4.04Å; L317-D334 HydrophobicContact CD1-CB 3.91Å; L317-D334 HydrophobicContact CD2-CB 3.72Å; L317-D334 HydrophobicContact CG-CB 4.49Å; L317-L335 HydrophobicContact CB-CD2 4.35Å; L317-L335 HydrophobicContact CD1-CD2 3.97Å; L317-L335 HydrophobicContact CD1-CG 4.47Å; L317-L338 HydrophobicContact CD1-CD2 4.06Å
318	M	92.5	Very high	90.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.5	-44.4	179.5	-67.5	-53	-53.1	0	0	112.7	Y244 F248 Y258 V259 R262 I314 A315 G320 Y321 D322 L331 L335	Y244-M318 HydrophobicContact CD1-CB 3.78Å; Y244-M318 HydrophobicContact CD1-CG 4.24Å; Y244-M318 HydrophobicContact CD2-CB 3.9Å; Y244-M318 HydrophobicContact CE1-CB 3.61Å; Y244-M318 HydrophobicContact CE1-CE 4.18Å; Y244-M318 HydrophobicContact CE1-CG 4.04Å; Y244-M318 HydrophobicContact CE2-CB 3.75Å; Y244-M318 HydrophobicContact CG-CB 3.94Å; F248-M318 HydrophobicContact CZ-CG 4.39Å; Y258-M318 HydrophobicContact CD1-CE 3.35Å; Y258-M318 HydrophobicContact CE1-CE 3.31Å; V259-M318 HydrophobicContact CB-SD 4.46Å; V259-M318 HydrophobicContact CG2-CE 4.4Å; V259-M318 HydrophobicContact CG2-CG 3.66Å; V259-M318 HydrophobicContact CG2-SD 3.74Å; R262-M318 HydrophobicContact CG-CE 4.42Å; I314-M318 HydrophobicContact CG2-CG 4.41Å; I314-M318 WeakPolarHBondContact O-CG 3.37Å; I314-M318 PolarHBondContact O-N 3.5Å; A315-M318 PolarHBondContact O-N 2.87Å; M318-G320 VanDerWaalsContact C-N 3.33Å; M318-G320 PolarHBondContact O-N 3.16Å; M318-Y321 PolarHBondContact O-N 3.14Å; M318-D322 PolarHBondContact O-N 3.47Å; M318-L331 HydrophobicContact CE-CD2 4.49Å; M318-L331 HydrophobicContact SD-CD1 4.07Å; M318-L331 HydrophobicContact SD-CD2 4.19Å; M318-L335 HydrophobicContact SD-CD1 4.07Å
319	A	91.9	Very high	90.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-39.9	174.3	0	0	0	0	0	111.9	L240 K241 Y244 A315 L323	L240-A319 HydrophobicContact CB-CB 4.04Å; L240-A319 HydrophobicContact CD2-CB 4.29Å; L240-A319 HydrophobicContact CG-CB 3.92Å; K241-A319 HydrophobicContact CB-CB 4.04Å; Y244-A319 HydrophobicContact CD2-CB 4.45Å; A315-A319 VanDerWaalsContact O-CB 3.3Å; A315-A319 WeakPolarHBondContact O-CB 3.44Å; A315-A319 PolarHBondContact O-N 2.88Å; A319-L323 VanDerWaalsContact O-CB 3.28Å; A319-L323 WeakPolarHBondContact O-CB 3.42Å; A319-L323 WeakPolarHBondContact O-CG 3.13Å; A319-L323 PolarHBondContact O-N 3.43Å
320	G	90.2	Very high	90.2	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-35.7	176.1	0	0	0	0	0	113.8	G316 L317 M318 G324 L325	G316-G320 PolarHBondContact O-N 3.22Å; L317-G320 PolarHBondContact O-N 3.38Å; M318-G320 VanDerWaalsContact C-N 3.33Å; M318-G320 PolarHBondContact O-N 3.16Å; G320-G324 PolarHBondContact O-N 3.01Å; G320-L325 VanDerWaalsContact O-CB 3.27Å; G320-L325 WeakPolarHBondContact O-CB 3.28Å; G320-L325 WeakPolarHBondContact O-CG 3.14Å; G320-L325 PolarHBondContact O-N 3.16Å
321	Y	91.1	Very high	90.1	Very high	18 Å²	18	43.5 Å²	43.5	7%	0.071	23%	0.232	C	C	.	.	H	α-helix	trans	-69.8	-47.5	174.1	171.6	-104.9	0	0	0	112.7	R262 L317 M318 L323 G324 P328 L331	R262-Y321 PolarHBondContact NH1-OH 3.28Å; R262-Y321 VanDerWaalsContact NH1-OH 3.1Å; R262-Y321 PolarHBondContact NH2-OH 2.94Å; L317-Y321 PolarHBondContact O-N 3.4Å; M318-Y321 PolarHBondContact O-N 3.14Å; Y321-L323 PolarHBondContact O-N 2.83Å; Y321-G324 WeakPolarHBondContact O-CA 2.95Å; Y321-G324 PolarHBondContact O-N 3.18Å; Y321-P328 HydrophobicContact CE2-CB 3.83Å; Y321-P328 HydrophobicContact CE2-CG 4.43Å; Y321-L331 HydrophobicContact CD1-CD2 3.79Å; Y321-L331 HydrophobicContact CD2-CB 4.21Å; Y321-L331 HydrophobicContact CD2-CD2 3.97Å; Y321-L331 HydrophobicContact CE1-CD2 4.39Å; Y321-L331 HydrophobicContact CG-CB 4.44Å; Y321-L331 HydrophobicContact CG-CD2 3.55Å; Y321-L331 HydrophobicContact CG-CG 4.41Å
322	D	89.4	Confident	90	Very high	19 Å²	19	46 Å²	46	10%	0.102	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-27.3	179.2	-76.6	-6	0	0	0	111.6	G222 L240 Y244 Y258 M318 G324	G222-D322 WeakPolarHBondContact CA-OD2 3.39Å; G222-D322 PolarHBondContact N-OD2 2.77Å; L240-D322 HydrophobicContact CD2-CB 3.66Å; Y244-D322 VanDerWaalsContact CE2-OD2 3.3Å; Y244-D322 WeakPolarHBondContact CE2-OD2 3.48Å; Y244-D322 PolarHBondContact OH-OD2 3Å; Y258-D322 PolarHBondContact OH-OD1 2.86Å; M318-D322 PolarHBondContact O-N 3.47Å; D322-G324 VanDerWaalsContact C-N 3.28Å; D322-G324 PolarHBondContact O-N 3.05Å
323	L	88.4	Confident	89.7	Confident	36 Å²	36	47.7 Å²	47.7	19%	0.188	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	0.1	168.8	-81.8	167.9	0	0	0	114.8	I219 C237 A319 Y321 L325	I219-L323 HydrophobicContact CD1-CD2 3.38Å; I219-L323 HydrophobicContact CD1-CG 3.93Å; C237-L323 HydrophobicContact CB-CD1 3.66Å; A319-L323 VanDerWaalsContact O-CB 3.28Å; A319-L323 WeakPolarHBondContact O-CB 3.42Å; A319-L323 WeakPolarHBondContact O-CG 3.13Å; A319-L323 PolarHBondContact O-N 3.43Å; Y321-L323 PolarHBondContact O-N 2.83Å; L323-L325 HydrophobicContact CB-CD2 4.49Å; L323-L325 HydrophobicContact CB-CG 3.99Å; L323-L325 PolarHBondContact O-N 3.42Å
324	G	86.9	Confident	89.5	Confident	59 Å²	59	45.6 Å²	45.6	61%	0.608	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.2	13.7	-178.9	0	0	0	0	0	115.4	G320 Y321 D322 F326	G320-G324 PolarHBondContact O-N 3.01Å; Y321-G324 WeakPolarHBondContact O-CA 2.95Å; Y321-G324 PolarHBondContact O-N 3.18Å; D322-G324 VanDerWaalsContact C-N 3.28Å; D322-G324 PolarHBondContact O-N 3.05Å; G324-F326 PolarHBondContact O-N 2.86Å; G324-F326 VanDerWaalsContact O-N 3.17Å
325	L	85.8	Confident	89.3	Confident	119 Å²	119	45.6 Å²	45.6	62%	0.623	24%	0.244	S	C	*	.	S	Bend	trans	-64.7	-19.8	-178.7	-57.3	-176.8	0	0	0	112.9	G320 L323	G320-L325 VanDerWaalsContact O-CB 3.27Å; G320-L325 WeakPolarHBondContact O-CB 3.28Å; G320-L325 WeakPolarHBondContact O-CG 3.14Å; G320-L325 PolarHBondContact O-N 3.16Å; L323-L325 HydrophobicContact CB-CD2 4.49Å; L323-L325 HydrophobicContact CB-CG 3.99Å; L323-L325 PolarHBondContact O-N 3.42Å
326	F	88.7	Confident	89	Confident	39 Å²	39	48.6 Å²	48.6	17%	0.171	26%	0.255	C	S	.	.	S	Bend	trans	-156.9	152.3	174	47	-92.5	0	0	0	114.1	L317 G324 K330 L331	L317-F326 HydrophobicContact CD2-CZ 3.91Å; L317-F326 VanDerWaalsContact O-CZ 3.26Å; L317-F326 WeakPolarHBondContact O-CZ 3.36Å; G324-F326 PolarHBondContact O-N 2.86Å; G324-F326 VanDerWaalsContact O-N 3.17Å; F326-K330 HydrophobicContact CB-CB 4.19Å; F326-K330 HydrophobicContact CB-CD 3.86Å; F326-K330 HydrophobicContact CB-CG 4.23Å; F326-K330 HydrophobicContact CD2-CB 4.16Å; F326-K330 HydrophobicContact CD2-CD 4.4Å; F326-K330 HydrophobicContact CD2-CG 4.04Å; F326-K330 HydrophobicContact CG-CD 4.12Å; F326-K330 HydrophobicContact CG-CG 4.26Å; F326-L331 HydrophobicContact CD2-CB 4.17Å; F326-L331 HydrophobicContact CE2-CB 3.79Å; F326-L331 HydrophobicContact CE2-CD1 3.9Å; F326-L331 HydrophobicContact CE2-CG 4.45Å; F326-L331 HydrophobicContact CZ-CD1 4.47Å
327	N	88	Confident	88.7	Confident	115 Å²	115	51.8 Å²	51.8	62%	0.615	27%	0.267	S	S	*	.			trans	-62.1	153	-179.9	-72.7	-43	0	0	0	113	R329 K330 L331	N327-R329 PolarHBondContact O-N 3.08Å; N327-R329 VanDerWaalsContact O-N 3.12Å; N327-K330 PolarHBondContact O-N 3.45Å; N327-L331 PolarHBondContact O-N 3.43Å
328	P	87.7	Confident	88.3	Confident	43 Å²	43	52.5 Å²	52.5	28%	0.279	27%	0.271	S	S	.	.	H	α-helix	trans	-59.7	-27.3	178.9	23	-33.1	0	0	0	113.6	Y321 K330 L331 K332 Y569	Y321-P328 HydrophobicContact CE2-CB 3.83Å; Y321-P328 HydrophobicContact CE2-CG 4.43Å; P328-K330 VanDerWaalsContact C-N 3.31Å; P328-K330 PolarHBondContact O-N 3.1Å; P328-L331 PolarHBondContact O-N 3.14Å; P328-K332 WeakPolarHBondContact O-CB 3.34Å; P328-K332 PolarHBondContact O-N 2.73Å; P328-Y569 HydrophobicContact CG-CE1 4.25Å
329	R	87.9	Confident	87.8	Confident	175 Å²	175	52.6 Å²	52.6	66%	0.66	27%	0.271	S	S	*	.	H	α-helix	trans	-59.6	-38.7	171.2	-71.6	-168.1	-177.5	-151.8	4.9	112.3	E16 N327 V333	E16-R329 IonicContact OE1-CZ 3.08Å; E16-R329 VanDerWaalsContact OE1-CZ 3.26Å; E16-R329 IonicContact OE1-NH1 2.73Å; E16-R329 PolarHBondContact OE1-NH1 2.87Å; E16-R329 IonicContact OE1-NH2 2.71Å; E16-R329 PolarHBondContact OE1-NH2 3.38Å; E16-R329 IonicContact OE2-NH1 3.28Å; N327-R329 PolarHBondContact O-N 3.08Å; N327-R329 VanDerWaalsContact O-N 3.12Å; R329-V333 WeakPolarHBondContact O-CG2 3.41Å; R329-V333 PolarHBondContact O-N 2.89Å
330	K	89.1	Confident	86.8	Confident	109 Å²	109	53.2 Å²	53.2	47%	0.474	28%	0.275	S	S	.	.	H	α-helix	trans	-73.4	-47.4	177.2	174.6	167.4	172.8	-179.9	0	111	F326 N327 P328 K332 V333 D334	F326-K330 HydrophobicContact CB-CB 4.19Å; F326-K330 HydrophobicContact CB-CD 3.86Å; F326-K330 HydrophobicContact CB-CG 4.23Å; F326-K330 HydrophobicContact CD2-CB 4.16Å; F326-K330 HydrophobicContact CD2-CD 4.4Å; F326-K330 HydrophobicContact CD2-CG 4.04Å; F326-K330 HydrophobicContact CG-CD 4.12Å; F326-K330 HydrophobicContact CG-CG 4.26Å; N327-K330 PolarHBondContact O-N 3.45Å; P328-K330 VanDerWaalsContact C-N 3.31Å; P328-K330 PolarHBondContact O-N 3.1Å; K330-K332 PolarHBondContact O-N 3.2Å; K330-V333 PolarHBondContact O-N 3.32Å; K330-D334 WeakPolarHBondContact CE-OD2 3.19Å; K330-D334 VanDerWaalsContact CG-OD2 3.23Å; K330-D334 WeakPolarHBondContact CG-OD2 3.45Å; K330-D334 IonicContact NZ-OD2 2.92Å; K330-D334 PolarHBondContact O-N 2.91Å
331	L	89.4	Confident	85.3	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-50.8	-46.8	175.3	179.1	67.8	0	0	0	111.3	R262 L317 M318 Y321 F326 N327 P328 V333 D334 L335	R262-L331 HydrophobicContact CB-CD2 3.74Å; R262-L331 HydrophobicContact CG-CD2 4.04Å; L317-L331 HydrophobicContact CB-CD1 4.04Å; M318-L331 HydrophobicContact CE-CD2 4.49Å; M318-L331 HydrophobicContact SD-CD1 4.07Å; M318-L331 HydrophobicContact SD-CD2 4.19Å; Y321-L331 HydrophobicContact CD1-CD2 3.79Å; Y321-L331 HydrophobicContact CD2-CB 4.21Å; Y321-L331 HydrophobicContact CD2-CD2 3.97Å; Y321-L331 HydrophobicContact CE1-CD2 4.39Å; Y321-L331 HydrophobicContact CG-CB 4.44Å; Y321-L331 HydrophobicContact CG-CD2 3.55Å; Y321-L331 HydrophobicContact CG-CG 4.41Å; F326-L331 HydrophobicContact CD2-CB 4.17Å; F326-L331 HydrophobicContact CE2-CB 3.79Å; F326-L331 HydrophobicContact CE2-CD1 3.9Å; F326-L331 HydrophobicContact CE2-CG 4.45Å; F326-L331 HydrophobicContact CZ-CD1 4.47Å; N327-L331 PolarHBondContact O-N 3.43Å; P328-L331 PolarHBondContact O-N 3.14Å; L331-V333 VanDerWaalsContact C-N 3.35Å; L331-V333 PolarHBondContact O-N 3.33Å; L331-D334 PolarHBondContact O-N 3.03Å; L331-L335 HydrophobicContact CD1-CD1 3.72Å; L331-L335 HydrophobicContact CD1-CD2 4.42Å; L331-L335 HydrophobicContact CD1-CG 3.77Å; L331-L335 HydrophobicContact CD2-CD1 4.18Å; L331-L335 HydrophobicContact CG-CD1 3.69Å; L331-L335 HydrophobicContact CG-CG 4.11Å; L331-L335 VanDerWaalsContact O-CB 3.23Å; L331-L335 WeakPolarHBondContact O-CB 3.16Å; L331-L335 VanDerWaalsContact O-CG 3.28Å; L331-L335 WeakPolarHBondContact O-CG 3.31Å; L331-L335 PolarHBondContact O-N 3.08Å
332	K	89	Confident	83	Confident	53 Å²	53	60.5 Å²	60.5	23%	0.23	31%	0.311	C	S	.	.	H	α-helix	trans	-59.9	-40.5	179.1	179	179.4	-179.6	168.2	0	113.1	E264 P328 K330 R336	E264-K332 VanDerWaalsContact CD-CE 3.48Å; E264-K332 WeakPolarHBondContact OE1-CD 3.32Å; E264-K332 VanDerWaalsContact OE1-CE 3.31Å; E264-K332 WeakPolarHBondContact OE1-CE 3.34Å; E264-K332 IonicContact OE1-NZ 3.56Å; E264-K332 PolarHBondContact OE1-NZ 3.16Å; E264-K332 IonicContact OE2-NZ 2.75Å; E264-K332 PolarHBondContact OE2-NZ 3.47Å; P328-K332 WeakPolarHBondContact O-CB 3.34Å; P328-K332 PolarHBondContact O-N 2.73Å; K330-K332 PolarHBondContact O-N 3.2Å; K332-R336 WeakPolarHBondContact O-CB 3.48Å; K332-R336 WeakPolarHBondContact O-CD 3.1Å; K332-R336 WeakPolarHBondContact O-CG 3.21Å; K332-R336 PolarHBondContact O-N 3.24Å; K332-R336 VanDerWaalsContact O-N 3.08Å
333	V	86.6	Confident	80.6	Confident	75 Å²	75	64.6 Å²	64.6	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-71.3	-51.1	177.2	171.7	0	0	0	0	110.5	R329 K330 L331 L335 R336 N337	R329-V333 WeakPolarHBondContact O-CG2 3.41Å; R329-V333 PolarHBondContact O-N 2.89Å; K330-V333 PolarHBondContact O-N 3.32Å; L331-V333 VanDerWaalsContact C-N 3.35Å; L331-V333 PolarHBondContact O-N 3.33Å; V333-L335 VanDerWaalsContact C-N 3.35Å; V333-L335 PolarHBondContact O-N 3.29Å; V333-R336 PolarHBondContact O-N 3.35Å; V333-R336 VanDerWaalsContact O-N 3.14Å; V333-N337 WeakPolarHBondContact O-CB 3.48Å; V333-N337 VanDerWaalsContact O-CG 3.24Å; V333-N337 PolarHBondContact O-N 2.98Å; V333-N337 PolarHBondContact O-OD1 3.45Å
334	D	87.8	Confident	78.1	Confident	43 Å²	43	66.8 Å²	66.8	23%	0.23	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-42.5	-177.3	-61.7	-8.4	0	0	0	111.5	L317 K330 L331 L338	L317-D334 HydrophobicContact CD1-CB 3.91Å; L317-D334 HydrophobicContact CD2-CB 3.72Å; L317-D334 HydrophobicContact CG-CB 4.49Å; K330-D334 WeakPolarHBondContact CE-OD2 3.19Å; K330-D334 VanDerWaalsContact CG-OD2 3.23Å; K330-D334 WeakPolarHBondContact CG-OD2 3.45Å; K330-D334 IonicContact NZ-OD2 2.92Å; K330-D334 PolarHBondContact O-N 2.91Å; L331-D334 PolarHBondContact O-N 3.03Å; D334-L338 WeakPolarHBondContact O-CB 3.47Å; D334-L338 PolarHBondContact O-N 2.79Å
335	L	88.7	Confident	75.9	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-44.5	173	-73.8	178.9	0	0	0	112.3	V259 R262 A263 I314 L317 M318 L331 V333 L338 L339	V259-L335 HydrophobicContact CG1-CD1 4.09Å; V259-L335 HydrophobicContact CG1-CD2 4Å; R262-L335 HydrophobicContact CB-CD1 4.19Å; A263-L335 HydrophobicContact CB-CB 3.87Å; A263-L335 HydrophobicContact CB-CD1 4.06Å; I314-L335 HydrophobicContact CG2-CD2 4.16Å; L317-L335 HydrophobicContact CB-CD2 4.35Å; L317-L335 HydrophobicContact CD1-CD2 3.97Å; L317-L335 HydrophobicContact CD1-CG 4.47Å; M318-L335 HydrophobicContact SD-CD1 4.07Å; L331-L335 HydrophobicContact CD1-CD1 3.72Å; L331-L335 HydrophobicContact CD1-CD2 4.42Å; L331-L335 HydrophobicContact CD1-CG 3.77Å; L331-L335 HydrophobicContact CD2-CD1 4.18Å; L331-L335 HydrophobicContact CG-CD1 3.69Å; L331-L335 HydrophobicContact CG-CG 4.11Å; L331-L335 VanDerWaalsContact O-CB 3.23Å; L331-L335 WeakPolarHBondContact O-CB 3.16Å; L331-L335 VanDerWaalsContact O-CG 3.28Å; L331-L335 WeakPolarHBondContact O-CG 3.31Å; L331-L335 PolarHBondContact O-N 3.08Å; V333-L335 VanDerWaalsContact C-N 3.35Å; V333-L335 PolarHBondContact O-N 3.29Å; L335-L338 PolarHBondContact O-N 3.33Å; L335-L339 HydrophobicContact CB-CD1 4.23Å; L335-L339 WeakPolarHBondContact O-CB 3.19Å; L335-L339 WeakPolarHBondContact O-CD1 3.23Å; L335-L339 WeakPolarHBondContact O-CG 3.28Å; L335-L339 PolarHBondContact O-N 2.65Å
336	R	85.5	Confident	73.7	Confident	63 Å²	63	67.7 Å²	67.7	24%	0.238	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-48.9	178.1	-83.3	173.1	171.8	-149.2	-5.8	110.4	A263 E264 L265 E266 K332 V333 L338 L339 T340	A263-R336 WeakPolarHBondContact O-CG 3.36Å; A263-R336 PolarHBondContact O-NE 3.41Å; E264-R336 PolarHBondContact O-NH2 3.47Å; L265-R336 HydrophobicContact CD2-CG 4.08Å; E266-R336 IonicContact OE1-NH2 2.68Å; K332-R336 WeakPolarHBondContact O-CB 3.48Å; K332-R336 WeakPolarHBondContact O-CD 3.1Å; K332-R336 WeakPolarHBondContact O-CG 3.21Å; K332-R336 PolarHBondContact O-N 3.24Å; K332-R336 VanDerWaalsContact O-N 3.08Å; V333-R336 PolarHBondContact O-N 3.35Å; V333-R336 VanDerWaalsContact O-N 3.14Å; R336-L338 PolarHBondContact O-N 3.27Å; R336-L339 PolarHBondContact O-N 2.71Å; R336-T340 PolarHBondContact O-N 2.72Å; R336-T340 PolarHBondContact O-OG1 2.9Å; R336-T340 VanDerWaalsContact O-OG1 3.05Å
337	N	85.3	Confident	71.7	Confident	91 Å²	91	74 Å²	74	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-56.2	-50.1	176.8	-65.9	0.5	0	0	0	110.7	V333 L339 D341	V333-N337 WeakPolarHBondContact O-CB 3.48Å; V333-N337 VanDerWaalsContact O-CG 3.24Å; V333-N337 PolarHBondContact O-N 2.98Å; V333-N337 PolarHBondContact O-OD1 3.45Å; N337-L339 VanDerWaalsContact C-N 3.28Å; N337-L339 PolarHBondContact O-N 2.92Å; N337-D341 WeakPolarHBondContact O-CA 3.37Å; N337-D341 PolarHBondContact O-N 2.8Å
338	L	84.8	Confident	69.4	Low	43 Å²	43	74 Å²	74	23%	0.225	36%	0.362	C	S	.	.	H	α-helix	trans	-69.5	-19.2	-178.9	-172.4	56.6	0	0	0	114.7	W310 N313 I314 L317 D334 L335 R336	W310-L338 PolarHBondContact NE1-O 3.32Å; N313-L338 HydrophobicContact CB-CD2 3.74Å; I314-L338 HydrophobicContact CD1-CD2 4.46Å; I314-L338 HydrophobicContact CG1-CD2 3.54Å; I314-L338 HydrophobicContact CG1-CG 4.2Å; L317-L338 HydrophobicContact CD1-CD2 4.06Å; D334-L338 WeakPolarHBondContact O-CB 3.47Å; D334-L338 PolarHBondContact O-N 2.79Å; L335-L338 PolarHBondContact O-N 3.33Å; R336-L338 PolarHBondContact O-N 3.27Å
339	L	81.6	Confident	67.4	Low	2 Å²	2	75.1 Å²	75.1	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-99.3	-39.8	-178.1	-77.2	157.7	0	0	0	113.8	V259 A263 L265 F271 F287 W310 I314 L335 R336 N337	V259-L339 HydrophobicContact CG1-CD1 4.31Å; A263-L339 HydrophobicContact CB-CD1 4.16Å; L265-L339 HydrophobicContact CD1-CB 4.49Å; L265-L339 HydrophobicContact CD1-CD1 4.18Å; L265-L339 HydrophobicContact CD2-CB 4.43Å; F271-L339 WeakPolarHBondContact CD1-O 3.49Å; F287-L339 HydrophobicContact CD2-CD2 4.3Å; F287-L339 HydrophobicContact CE2-CD1 4.4Å; F287-L339 HydrophobicContact CE2-CD2 3.44Å; F287-L339 VanDerWaalsContact CE2-CD2 3.44Å; F287-L339 HydrophobicContact CZ-CD1 4.38Å; F287-L339 HydrophobicContact CZ-CD2 3.67Å; W310-L339 HydrophobicContact CH2-CD2 3.76Å; W310-L339 HydrophobicContact CZ2-CD2 3.61Å; W310-L339 HydrophobicContact CZ2-CG 4.41Å; I314-L339 HydrophobicContact CD1-CD2 4.33Å; L335-L339 HydrophobicContact CB-CD1 4.23Å; L335-L339 WeakPolarHBondContact O-CB 3.19Å; L335-L339 WeakPolarHBondContact O-CD1 3.23Å; L335-L339 WeakPolarHBondContact O-CG 3.28Å; L335-L339 PolarHBondContact O-N 2.65Å; R336-L339 PolarHBondContact O-N 2.71Å; N337-L339 VanDerWaalsContact C-N 3.28Å; N337-L339 PolarHBondContact O-N 2.92Å
340	T	70.7	Confident	65.2	Low	12 Å²	12	75.3 Å²	75.3	7%	0.074	37%	0.373	C	S	.	.	H	α-helix	trans	-93.3	-17.5	176.3	64.4	0	0	0	0	113.1	L265 F271 R336 Q342	L265-T340 HydrophobicContact CD2-CG2 4.5Å; F271-T340 HydrophobicContact CD1-CG2 4.15Å; F271-T340 HydrophobicContact CE1-CG2 3.69Å; R336-T340 PolarHBondContact O-N 2.72Å; R336-T340 PolarHBondContact O-OG1 2.9Å; R336-T340 VanDerWaalsContact O-OG1 3.05Å; T340-Q342 PolarHBondContact O-N 3.3Å; T340-Q342 VanDerWaalsContact O-N 3.16Å; T340-Q342 PolarHBondContact OG1-OE1 2.89Å
341	D	59.8	Low	63.4	Low	63 Å²	63	75.8 Å²	75.8	34%	0.337	39%	0.385	S	S	.	.			trans	32.8	57.7	-171.7	-147.4	29.3	0	0	0	110.2	K274 N337 H343	K274-D341 IonicContact NZ-OD2 3.26Å; K274-D341 PolarHBondContact NZ-OD2 3.48Å; N337-D341 WeakPolarHBondContact O-CA 3.37Å; N337-D341 PolarHBondContact O-N 2.8Å; D341-H343 PolarHBondContact O-N 3.4Å
342	Q	42.8	Very low	61	Low	111 Å²	111	78.2 Å²	78.2	52%	0.519	40%	0.396	S	S	.	.			trans	-67.6	104	-161	-163.3	94.9	33.2	0	0	108.9	T340 T344	T340-Q342 PolarHBondContact O-N 3.3Å; T340-Q342 VanDerWaalsContact O-N 3.16Å; T340-Q342 PolarHBondContact OG1-OE1 2.89Å; Q342-T344 VanDerWaalsContact C-N 3.27Å; Q342-T344 PolarHBondContact O-N 2.72Å
343	H	37.7	Very low	58.8	Low	104 Å²	104	77.2 Å²	77.2	48%	0.481	40%	0.398	S	S	.	.			trans	-63.5	95.2	168.2	-157.2	1.9	0	0	0	107.2	D341 I345 E352	D341-H343 PolarHBondContact O-N 3.4Å; H343-I345 HydrophobicContact CB-CG1 3.94Å; H343-I345 VanDerWaalsContact CG-CG1 3.47Å; H343-I345 WeakPolarHBondContact O-CG1 3.47Å; H343-I345 PolarHBondContact O-N 2.8Å; H343-I345 VanDerWaalsContact O-N 3.13Å; H343-E352 IonicContact CE1-OE2 2.63Å
344	T	35.9	Very low	56.9	Low	83 Å²	83	77.6 Å²	77.6	51%	0.509	41%	0.409	S	S	.	.			trans	-78.2	83.3	164.4	39.6	0	0	0	0	106.3	Q342 D346	Q342-T344 VanDerWaalsContact C-N 3.27Å; Q342-T344 PolarHBondContact O-N 2.72Å; T344-D346 PolarHBondContact O-N 3.13Å
345	I	40.6	Very low	55	Low	67 Å²	67	78.8 Å²	78.8	34%	0.344	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	44.5	-178.7	-44	155.9	0	0	0	109.5	H343 L349	H343-I345 HydrophobicContact CB-CG1 3.94Å; H343-I345 VanDerWaalsContact CG-CG1 3.47Å; H343-I345 WeakPolarHBondContact O-CG1 3.47Å; H343-I345 PolarHBondContact O-N 2.8Å; H343-I345 VanDerWaalsContact O-N 3.13Å; I345-L349 HydrophobicContact CG2-CB 4.04Å; I345-L349 HydrophobicContact CG2-CD1 3.83Å; I345-L349 HydrophobicContact CG2-CD2 4.1Å; I345-L349 HydrophobicContact CG2-CG 4.17Å; I345-L349 WeakPolarHBondContact O-CB 3.27Å; I345-L349 VanDerWaalsContact O-CD2 3.27Å; I345-L349 WeakPolarHBondContact O-CD2 3.26Å
346	D	39.8	Very low	52.9	Low	130 Å²	130	79.4 Å²	79.4	70%	0.695	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.9	-26	-169	-67.2	-49.5	0	0	0	112.3	T344	T344-D346 PolarHBondContact O-N 3.13Å
347	E	46.3	Very low	51.2	Low	170 Å²	170	81.4 Å²	81.4	79%	0.794	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-37.7	175.8	-75.3	-172.9	137.4	0	0	113.5	L349	E347-L349 VanDerWaalsContact C-N 3.33Å
348	E	41	Very low	49.3	Very low	117 Å²	117	78.8 Å²	78.8	55%	0.547	43%	0.43	S	S	.	.	S	Bend	trans	-76.8	-21.6	170.1	-77.9	177.4	134.1	0	0	112	E350 T351 E352	E348-E350 VanDerWaalsContact C-N 3.32Å; E348-E350 PolarHBondContact O-N 2.68Å; E348-T351 PolarHBondContact O-N 2.74Å; E348-T351 PolarHBondContact O-OG1 3.25Å; E348-T351 VanDerWaalsContact O-OG1 3.12Å; E348-E352 HydrophobicContact CB-CG 4.14Å; E348-E352 WeakPolarHBondContact O-CB 3.49Å; E348-E352 WeakPolarHBondContact O-CG 3.09Å; E348-E352 PolarHBondContact O-N 3.03Å
349	L	44.3	Very low	47.8	Very low	65 Å²	65	80.6 Å²	80.6	34%	0.34	44%	0.44	S	S	.	.	H	α-helix	trans	-60.8	-30.2	-174.1	179.8	64	0	0	0	114	I345 E347 A353 T356	I345-L349 HydrophobicContact CG2-CB 4.04Å; I345-L349 HydrophobicContact CG2-CD1 3.83Å; I345-L349 HydrophobicContact CG2-CD2 4.1Å; I345-L349 HydrophobicContact CG2-CG 4.17Å; I345-L349 WeakPolarHBondContact O-CB 3.27Å; I345-L349 VanDerWaalsContact O-CD2 3.27Å; I345-L349 WeakPolarHBondContact O-CD2 3.26Å; E347-L349 VanDerWaalsContact C-N 3.33Å; L349-A353 VanDerWaalsContact O-CA 3.23Å; L349-A353 WeakPolarHBondContact O-CA 3.21Å; L349-A353 WeakPolarHBondContact O-CB 3.13Å; L349-A353 PolarHBondContact O-N 3.01Å; L349-T356 HydrophobicContact CD1-CG2 4.15Å
350	E	43.2	Very low	46.1	Very low	179 Å²	179	85.6 Å²	85.6	84%	0.836	46%	0.464	S	S	*	.	H	α-helix	trans	-71.9	-33.1	179.4	-68.4	-163.1	150.8	0	0	112.9	E348	E348-E350 VanDerWaalsContact C-N 3.32Å; E348-E350 PolarHBondContact O-N 2.68Å
351	T	49.8	Very low	45.2	Very low	119 Å²	119	91.6 Å²	91.6	73%	0.73	49%	0.491	S	S	*	.	H	α-helix	trans	-87.4	-33.7	173.2	44.4	0	0	0	0	112.9	E348 A353	E348-T351 PolarHBondContact O-N 2.74Å; E348-T351 PolarHBondContact O-OG1 3.25Å; E348-T351 VanDerWaalsContact O-OG1 3.12Å; T351-A353 VanDerWaalsContact C-N 3.35Å
352	E	40.6	Very low	44.8	Very low	52 Å²	52	97.2 Å²	97.2	24%	0.243	51%	0.508	C	S	.	.	H	α-helix	trans	-77.4	-16.6	174.3	-68.2	-164.1	126.5	0	0	112.3	H343 E348 A354 T355 T356	H343-E352 IonicContact CE1-OE2 2.63Å; E348-E352 HydrophobicContact CB-CG 4.14Å; E348-E352 WeakPolarHBondContact O-CB 3.49Å; E348-E352 WeakPolarHBondContact O-CG 3.09Å; E348-E352 PolarHBondContact O-N 3.03Å; E352-A354 CarbonylContact O-C 3.41Å; E352-A354 PolarHBondContact O-N 3.12Å; E352-T355 CarbonylContact O-C 3.48Å; E352-T355 VanDerWaalsContact O-CA 3.25Å; E352-T355 WeakPolarHBondContact O-CA 3.47Å; E352-T355 VanDerWaalsContact O-CB 3.29Å; E352-T355 WeakPolarHBondContact O-CB 3.44Å; E352-T355 PolarHBondContact O-N 3.2Å; E352-T355 PolarHBondContact O-OG1 3.46Å; E352-T356 VanDerWaalsContact CB-OG1 3.3Å; E352-T356 WeakPolarHBondContact CB-OG1 3.45Å; E352-T356 PolarHBondContact O-N 3.43Å; E352-T356 PolarHBondContact O-OG1 2.88Å; E352-T356 VanDerWaalsContact O-OG1 3.11Å
353	A	42.7	Very low	45.2	Very low	33 Å²	33	95 Å²	95	27%	0.273	50%	0.5	S	S	.	.	H	α-helix	trans	-47.3	-39.9	-171.4	0	0	0	0	0	114.2	L349 T351 I357	L349-A353 VanDerWaalsContact O-CA 3.23Å; L349-A353 WeakPolarHBondContact O-CA 3.21Å; L349-A353 WeakPolarHBondContact O-CB 3.13Å; L349-A353 PolarHBondContact O-N 3.01Å; T351-A353 VanDerWaalsContact C-N 3.35Å; A353-I357 WeakPolarHBondContact O-CB 3.31Å; A353-I357 WeakPolarHBondContact O-CD1 3.42Å; A353-I357 WeakPolarHBondContact O-CG1 3.38Å; A353-I357 PolarHBondContact O-N 3.29Å
354	A	45.1	Very low	45.6	Very low	82 Å²	82	95.1 Å²	95.1	68%	0.678	50%	0.503	S	S	*	.	H	α-helix	trans	-64.1	-49.4	173.4	0	0	0	0	0	112.2	E352 I357 G358	E352-A354 CarbonylContact O-C 3.41Å; E352-A354 PolarHBondContact O-N 3.12Å; A354-I357 PolarHBondContact O-N 2.87Å; A354-G358 PolarHBondContact O-N 3.35Å
355	T	49.2	Very low	46.3	Very low	69 Å²	69	92.9 Å²	92.9	42%	0.423	49%	0.49	S	S	.	.	H	α-helix	trans	-62.1	-45.9	174.9	-24.2	0	0	0	0	112.1	E352 G358 I359	E352-T355 CarbonylContact O-C 3.48Å; E352-T355 VanDerWaalsContact O-CA 3.25Å; E352-T355 WeakPolarHBondContact O-CA 3.47Å; E352-T355 VanDerWaalsContact O-CB 3.29Å; E352-T355 WeakPolarHBondContact O-CB 3.44Å; E352-T355 PolarHBondContact O-N 3.2Å; E352-T355 PolarHBondContact O-OG1 3.46Å; T355-G358 CarbonylContact O-C 3Å; T355-G358 PolarHBondContact O-N 3.32Å; T355-I359 HydrophobicContact CG2-CD1 3.99Å; T355-I359 WeakPolarHBondContact O-CB 3.39Å; T355-I359 WeakPolarHBondContact O-CD1 3.22Å; T355-I359 WeakPolarHBondContact O-CG1 3.14Å; T355-I359 PolarHBondContact O-N 3.24Å
356	T	45	Very low	46.7	Very low	13 Å²	13	93.4 Å²	93.4	8%	0.08	49%	0.49	C	S	.	.	H	α-helix	trans	-70.4	-31.5	179	-47	0	0	0	0	111.8	L349 E352 M360	L349-T356 HydrophobicContact CD1-CG2 4.15Å; E352-T356 VanDerWaalsContact CB-OG1 3.3Å; E352-T356 WeakPolarHBondContact CB-OG1 3.45Å; E352-T356 PolarHBondContact O-N 3.43Å; E352-T356 PolarHBondContact O-OG1 2.88Å; E352-T356 VanDerWaalsContact O-OG1 3.11Å; T356-M360 HydrophobicContact CG2-CE 4.13Å; T356-M360 HydrophobicContact CG2-CG 4.29Å; T356-M360 HydrophobicContact CG2-SD 4.3Å; T356-M360 WeakPolarHBondContact O-CA 3.49Å; T356-M360 WeakPolarHBondContact O-CB 3.33Å; T356-M360 WeakPolarHBondContact O-CG 3.34Å; T356-M360 PolarHBondContact O-N 3.31Å
357	I	48.2	Very low	47.4	Very low	105 Å²	105	92.3 Å²	92.3	54%	0.538	48%	0.483	S	S	.	.	H	α-helix	trans	-67.2	-45.4	168.3	-75	165.5	0	0	0	109.8	A353 A354 I359 M360 Q361	A353-I357 WeakPolarHBondContact O-CB 3.31Å; A353-I357 WeakPolarHBondContact O-CD1 3.42Å; A353-I357 WeakPolarHBondContact O-CG1 3.38Å; A353-I357 PolarHBondContact O-N 3.29Å; A354-I357 PolarHBondContact O-N 2.87Å; I357-I359 PolarHBondContact O-N 3.01Å; I357-M360 PolarHBondContact O-N 2.77Å; I357-Q361 WeakPolarHBondContact O-CB 3.49Å; I357-Q361 WeakPolarHBondContact O-CG 3.29Å; I357-Q361 PolarHBondContact O-N 3.11Å
358	G	47.3	Very low	47.3	Very low	35 Å²	35	88.3 Å²	88.3	36%	0.361	47%	0.468	S	S	.	.	H	α-helix	trans	-59.7	-44.9	173.6	0	0	0	0	0	112.7	A354 T355 Q361 W362	A354-G358 PolarHBondContact O-N 3.35Å; T355-G358 CarbonylContact O-C 3Å; T355-G358 PolarHBondContact O-N 3.32Å; G358-Q361 PolarHBondContact O-N 3.49Å; G358-W362 VanDerWaalsContact O-CB 3.31Å; G358-W362 WeakPolarHBondContact O-CB 3.25Å; G358-W362 PolarHBondContact O-N 2.82Å
359	I	52	Low	48	Very low	82 Å²	82	87.2 Å²	87.2	42%	0.421	47%	0.47	S	S	.	.	H	α-helix	trans	-69.5	-34.8	177.3	-69.1	162.7	0	0	0	111.1	T355 I357 W362 L363	T355-I359 HydrophobicContact CG2-CD1 3.99Å; T355-I359 WeakPolarHBondContact O-CB 3.39Å; T355-I359 WeakPolarHBondContact O-CD1 3.22Å; T355-I359 WeakPolarHBondContact O-CG1 3.14Å; T355-I359 PolarHBondContact O-N 3.24Å; I357-I359 PolarHBondContact O-N 3.01Å; I359-W362 CarbonylContact O-C 3.54Å; I359-W362 PolarHBondContact O-N 2.88Å; I359-L363 HydrophobicContact CG2-CD1 3.69Å; I359-L363 HydrophobicContact CG2-CG 4.14Å; I359-L363 WeakPolarHBondContact O-CB 3.23Å; I359-L363 WeakPolarHBondContact O-CG 2.81Å; I359-L363 PolarHBondContact O-N 3.17Å
360	M	46.6	Very low	48.4	Very low	107 Å²	107	91.7 Å²	91.7	53%	0.527	48%	0.483	S	S	.	.	H	α-helix	trans	-75.1	-30.9	174.3	-78.1	-174.5	172.7	0	0	112.5	T356 I357 N364	T356-M360 HydrophobicContact CG2-CE 4.13Å; T356-M360 HydrophobicContact CG2-CG 4.29Å; T356-M360 HydrophobicContact CG2-SD 4.3Å; T356-M360 WeakPolarHBondContact O-CA 3.49Å; T356-M360 WeakPolarHBondContact O-CB 3.33Å; T356-M360 WeakPolarHBondContact O-CG 3.34Å; T356-M360 PolarHBondContact O-N 3.31Å; I357-M360 PolarHBondContact O-N 2.77Å; M360-N364 WeakPolarHBondContact O-CA 3.11Å; M360-N364 WeakPolarHBondContact O-CB 3.38Å; M360-N364 PolarHBondContact O-N 3.2Å
361	Q	50.8	Low	48.8	Very low	138 Å²	138	87 Å²	87	65%	0.645	46%	0.457	S	S	*	.	H	α-helix	trans	-65.1	-43.8	166.3	-77.1	-177.6	-47.5	0	0	110.6	I357 G358 L363 N364 P365	I357-Q361 WeakPolarHBondContact O-CB 3.49Å; I357-Q361 WeakPolarHBondContact O-CG 3.29Å; I357-Q361 PolarHBondContact O-N 3.11Å; G358-Q361 PolarHBondContact O-N 3.49Å; Q361-L363 PolarHBondContact O-N 2.94Å; Q361-N364 WeakPolarHBondContact O-CB 3.27Å; Q361-N364 PolarHBondContact O-N 3.12Å; Q361-P365 WeakPolarHBondContact O-CD 3.3Å
362	W	53	Low	49.3	Very low	180 Å²	180	86.2 Å²	86.2	68%	0.682	45%	0.449	S	S	*	.	H	α-helix	trans	-69.2	-29.7	177.3	-163.5	91.9	0	0	0	113.5	G358 I359 P365 F366	G358-W362 VanDerWaalsContact O-CB 3.31Å; G358-W362 WeakPolarHBondContact O-CB 3.25Å; G358-W362 PolarHBondContact O-N 2.82Å; I359-W362 CarbonylContact O-C 3.54Å; I359-W362 PolarHBondContact O-N 2.88Å; W362-P365 WeakPolarHBondContact O-CD 3.23Å; W362-F366 HydrophobicContact CE3-CE2 4.19Å; W362-F366 HydrophobicContact CH2-CE2 4.25Å; W362-F366 HydrophobicContact CH2-CZ 4.39Å; W362-F366 AromaticContact CZ3-CE2 3.91Å; W362-F366 HydrophobicContact CZ3-CE2 3.91Å; W362-F366 HydrophobicContact CZ3-CZ 4.36Å; W362-F366 WeakPolarHBondContact O-CD2 3.45Å
363	L	49.6	Very low	50.6	Low	66 Å²	66	90.2 Å²	90.2	35%	0.346	47%	0.467	S	S	.	.	H	α-helix	trans	-89.9	-10.2	174.1	-69.7	177.1	0	0	0	113.6	I359 Q361 P365 F366 I367	I359-L363 HydrophobicContact CG2-CD1 3.69Å; I359-L363 HydrophobicContact CG2-CG 4.14Å; I359-L363 WeakPolarHBondContact O-CB 3.23Å; I359-L363 WeakPolarHBondContact O-CG 2.81Å; I359-L363 PolarHBondContact O-N 3.17Å; Q361-L363 PolarHBondContact O-N 2.94Å; L363-P365 VanDerWaalsContact C-CD 3.49Å; L363-P365 VanDerWaalsContact C-N 3.31Å; L363-F366 HydrophobicContact CD2-CB 4.28Å; L363-F366 HydrophobicContact CD2-CD2 4.09Å; L363-F366 HydrophobicContact CD2-CG 4.32Å; L363-F366 CarbonylContact O-C 3.57Å; L363-F366 WeakPolarHBondContact O-CA 3.37Å; L363-F366 WeakPolarHBondContact O-CB 3.2Å; L363-F366 PolarHBondContact O-N 3.19Å; L363-I367 HydrophobicContact CB-CD1 4.24Å; L363-I367 WeakPolarHBondContact O-CG1 3.44Å; L363-I367 PolarHBondContact O-N 2.74Å
364	N	47.8	Very low	51.7	Low	105 Å²	105	92.5 Å²	92.5	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-54.9	-42.1	175.9	-145.3	-3.4	0	0	0	112	M360 Q361 F366 I367 N368	M360-N364 WeakPolarHBondContact O-CA 3.11Å; M360-N364 WeakPolarHBondContact O-CB 3.38Å; M360-N364 PolarHBondContact O-N 3.2Å; Q361-N364 WeakPolarHBondContact O-CB 3.27Å; Q361-N364 PolarHBondContact O-N 3.12Å; N364-F366 PolarHBondContact O-N 2.77Å; N364-I367 PolarHBondContact O-N 3.33Å; N364-N368 PolarHBondContact O-N 3.46Å
365	P	48.5	Very low	52.7	Low	36 Å²	36	93 Å²	93	23%	0.234	46%	0.459	C	S	.	.	H	α-helix	trans	-63.2	-19.8	170.3	-22.5	34.5	0	0	0	115.1	Q361 W362 L363 R371	Q361-P365 WeakPolarHBondContact O-CD 3.3Å; W362-P365 WeakPolarHBondContact O-CD 3.23Å; L363-P365 VanDerWaalsContact C-CD 3.49Å; L363-P365 VanDerWaalsContact C-N 3.31Å; P365-R371 WeakPolarHBondContact O-CB 3.11Å; P365-R371 WeakPolarHBondContact O-CD 3.42Å; P365-R371 WeakPolarHBondContact O-CG 3.39Å
366	F	50.1	Low	53.7	Low	79 Å²	79	95 Å²	95	35%	0.346	46%	0.464	S	S	.	.	H	α-helix	trans	-96.8	-27.3	-179.8	-67.3	-93.3	0	0	0	113.2	W362 L363 N364 N368 F375	W362-F366 HydrophobicContact CE3-CE2 4.19Å; W362-F366 HydrophobicContact CH2-CE2 4.25Å; W362-F366 HydrophobicContact CH2-CZ 4.39Å; W362-F366 AromaticContact CZ3-CE2 3.91Å; W362-F366 HydrophobicContact CZ3-CE2 3.91Å; W362-F366 HydrophobicContact CZ3-CZ 4.36Å; W362-F366 WeakPolarHBondContact O-CD2 3.45Å; L363-F366 HydrophobicContact CD2-CB 4.28Å; L363-F366 HydrophobicContact CD2-CD2 4.09Å; L363-F366 HydrophobicContact CD2-CG 4.32Å; L363-F366 CarbonylContact O-C 3.57Å; L363-F366 WeakPolarHBondContact O-CA 3.37Å; L363-F366 WeakPolarHBondContact O-CB 3.2Å; L363-F366 PolarHBondContact O-N 3.19Å; N364-F366 PolarHBondContact O-N 2.77Å; F366-N368 VanDerWaalsContact C-N 3.33Å; F366-F375 AromaticContact CD1-CE2 3.74Å; F366-F375 HydrophobicContact CD1-CE2 3.74Å; F366-F375 HydrophobicContact CD1-CZ 4.15Å; F366-F375 AromaticContact CE1-CE2 3.72Å; F366-F375 HydrophobicContact CE1-CE2 3.72Å; F366-F375 AromaticContact CE1-CZ 3.63Å; F366-F375 HydrophobicContact CE1-CZ 3.63Å; F366-F375 HydrophobicContact CZ-CZ 4.45Å
367	I	53.7	Low	54.9	Low	106 Å²	106	99.2 Å²	99.2	54%	0.544	49%	0.485	S	S	.	.	H	α-helix	trans	-72.2	-30	174.9	-66.8	162	0	0	0	110.8	L363 N364 P369	L363-I367 HydrophobicContact CB-CD1 4.24Å; L363-I367 WeakPolarHBondContact O-CG1 3.44Å; L363-I367 PolarHBondContact O-N 2.74Å; N364-I367 PolarHBondContact O-N 3.33Å; I367-P369 WeakPolarHBondContact O-CD 3.32Å
368	N	45.2	Very low	55.9	Low	87 Å²	87	98.7 Å²	98.7	47%	0.465	48%	0.482	S	S	.	.	S	Bend	trans	-64.5	119.1	-177.2	-164.4	-37.4	0	0	0	112	N364 F366 W370 R371 L372	N364-N368 PolarHBondContact O-N 3.46Å; F366-N368 VanDerWaalsContact C-N 3.33Å; N368-W370 PolarHBondContact O-N 2.78Å; N368-W370 PolarHBondContact OD1-N 2.75Å; N368-R371 PolarHBondContact O-N 3.11Å; N368-L372 PolarHBondContact O-N 3Å
369	P	55.9	Low	57.2	Low	93 Å²	93	104.5 Å²	104.5	60%	0.604	49%	0.493	S	S	*	.	H	α-helix	trans	-55.5	-29.4	-173.6	-28.6	35.6	0	0	0	114.9	I367 L372 Q373	I367-P369 WeakPolarHBondContact O-CD 3.32Å; P369-L372 PolarHBondContact O-N 2.74Å; P369-Q373 PolarHBondContact O-N 2.73Å; P369-Q373 VanDerWaalsContact O-N 3.1Å
370	W	51.5	Low	58.6	Low	160 Å²	160	106.3 Å²	106.3	61%	0.606	50%	0.497	S	S	*	.	H	α-helix	trans	-67.8	-37.7	178.8	-167.7	82.2	0	0	0	112.5	N368 Q373 Q374	N368-W370 PolarHBondContact O-N 2.78Å; N368-W370 PolarHBondContact OD1-N 2.75Å; W370-Q373 WeakPolarHBondContact O-CB 3.27Å; W370-Q373 PolarHBondContact O-N 2.93Å; W370-Q374 HydrophobicContact CE3-CG 4.29Å; W370-Q374 HydrophobicContact CZ3-CG 4.33Å; W370-Q374 VanDerWaalsContact CZ3-NE2 3.27Å; W370-Q374 PolarHBondContact O-N 3.45Å
371	R	53.4	Low	60	Low	79 Å²	79	105.2 Å²	105.2	30%	0.298	49%	0.493	S	S	.	.	H	α-helix	trans	-70.1	-34.6	173.9	-80.1	-121.3	-172.3	163.6	0.9	112.1	P365 N368 Q373 Q374 F375	P365-R371 WeakPolarHBondContact O-CB 3.11Å; P365-R371 WeakPolarHBondContact O-CD 3.42Å; P365-R371 WeakPolarHBondContact O-CG 3.39Å; N368-R371 PolarHBondContact O-N 3.11Å; R371-Q373 VanDerWaalsContact C-N 3.33Å; R371-Q373 PolarHBondContact O-N 3.25Å; R371-Q374 PolarHBondContact O-N 3.2Å; R371-F375 WeakPolarHBondContact O-CD2 3.49Å; R371-F375 PolarHBondContact O-N 3.28Å
372	L	58.4	Low	61.3	Low	104 Å²	104	104.8 Å²	104.8	55%	0.545	49%	0.489	S	S	.	.	H	α-helix	trans	-60.9	-42.1	171.4	-73.5	168.8	0	0	0	111.5	N368 P369 F375 E376	N368-L372 PolarHBondContact O-N 3Å; P369-L372 PolarHBondContact O-N 2.74Å; L372-F375 PolarHBondContact O-N 3.22Å; L372-E376 PolarHBondContact O-N 2.85Å
373	Q	68.1	Low	62.6	Low	135 Å²	135	101.4 Å²	101.4	63%	0.631	48%	0.481	S	S	*	.	H	α-helix	trans	-62.4	-41.6	172.1	-70.1	-178.9	-4	0	0	112.2	P369 W370 R371 E376 L377	P369-Q373 PolarHBondContact O-N 2.73Å; P369-Q373 VanDerWaalsContact O-N 3.1Å; W370-Q373 WeakPolarHBondContact O-CB 3.27Å; W370-Q373 PolarHBondContact O-N 2.93Å; R371-Q373 VanDerWaalsContact C-N 3.33Å; R371-Q373 PolarHBondContact O-N 3.25Å; Q373-E376 PolarHBondContact O-N 3.05Å; Q373-L377 WeakPolarHBondContact O-CB 3.46Å; Q373-L377 PolarHBondContact O-N 3.15Å
374	Q	65.4	Low	63.9	Low	82 Å²	82	103.9 Å²	103.9	38%	0.383	49%	0.489	S	S	.	.	H	α-helix	trans	-64.1	-41.8	174.8	-73.8	-160.6	-24.6	0	0	113.1	W370 R371 E376 L377 M378	W370-Q374 HydrophobicContact CE3-CG 4.29Å; W370-Q374 HydrophobicContact CZ3-CG 4.33Å; W370-Q374 VanDerWaalsContact CZ3-NE2 3.27Å; W370-Q374 PolarHBondContact O-N 3.45Å; R371-Q374 PolarHBondContact O-N 3.2Å; Q374-E376 VanDerWaalsContact C-N 3.32Å; Q374-E376 PolarHBondContact O-N 3.04Å; Q374-L377 WeakPolarHBondContact O-CB 3.22Å; Q374-L377 PolarHBondContact O-N 3.07Å; Q374-M378 WeakPolarHBondContact O-CB 3.47Å; Q374-M378 PolarHBondContact O-N 3.33Å
375	F	66.1	Low	65.3	Low	93 Å²	93	102.9 Å²	102.9	41%	0.408	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-39.3	175.1	-82.9	-63.4	0	0	0	111.7	F366 R371 L372 M378 R379	F366-F375 AromaticContact CD1-CE2 3.74Å; F366-F375 HydrophobicContact CD1-CE2 3.74Å; F366-F375 HydrophobicContact CD1-CZ 4.15Å; F366-F375 AromaticContact CE1-CE2 3.72Å; F366-F375 HydrophobicContact CE1-CE2 3.72Å; F366-F375 AromaticContact CE1-CZ 3.63Å; F366-F375 HydrophobicContact CE1-CZ 3.63Å; F366-F375 HydrophobicContact CZ-CZ 4.45Å; R371-F375 WeakPolarHBondContact O-CD2 3.49Å; R371-F375 PolarHBondContact O-N 3.28Å; L372-F375 PolarHBondContact O-N 3.22Å; F375-M378 PolarHBondContact O-N 3.14Å; F375-R379 WeakPolarHBondContact O-CB 3.46Å; F375-R379 PolarHBondContact O-N 3.18Å
376	E	71	Confident	66.7	Low	110 Å²	110	109.8 Å²	109.8	51%	0.514	51%	0.505	S	S	.	.	H	α-helix	trans	-71.4	-34.4	175.5	-172.7	153.2	-123.4	0	0	112.6	L372 Q373 Q374 R379 K380	L372-E376 PolarHBondContact O-N 2.85Å; Q373-E376 PolarHBondContact O-N 3.05Å; Q374-E376 VanDerWaalsContact C-N 3.32Å; Q374-E376 PolarHBondContact O-N 3.04Å; E376-R379 WeakPolarHBondContact O-CB 3.34Å; E376-R379 PolarHBondContact O-N 3.48Å; E376-K380 HydrophobicContact CG-CD 4.43Å; E376-K380 WeakPolarHBondContact O-CG 3.13Å; E376-K380 PolarHBondContact O-N 3.01Å
377	L	69.9	Low	68	Low	101 Å²	101	110.8 Å²	110.8	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-48.7	169.8	-175.4	69.6	0	0	0	111.2	Q373 Q374 R379 K380 I381	Q373-L377 WeakPolarHBondContact O-CB 3.46Å; Q373-L377 PolarHBondContact O-N 3.15Å; Q374-L377 WeakPolarHBondContact O-CB 3.22Å; Q374-L377 PolarHBondContact O-N 3.07Å; L377-R379 PolarHBondContact O-N 3.4Å; L377-K380 WeakPolarHBondContact O-CB 3.19Å; L377-K380 PolarHBondContact O-N 3.49Å; L377-K380 VanDerWaalsContact O-N 3.14Å; L377-I381 HydrophobicContact CG-CD1 4.03Å; L377-I381 WeakPolarHBondContact O-CG1 3.48Å; L377-I381 PolarHBondContact O-N 2.85Å
378	M	69	Low	68.8	Low	94 Å²	94	109.3 Å²	109.3	46%	0.463	50%	0.503	S	S	.	.	H	α-helix	trans	-58.7	-36.3	173.1	-79.8	-176.9	70.5	0	0	112.1	Q374 F375 I381 K382	Q374-M378 WeakPolarHBondContact O-CB 3.47Å; Q374-M378 PolarHBondContact O-N 3.33Å; F375-M378 PolarHBondContact O-N 3.14Å; M378-I381 PolarHBondContact O-N 3.29Å; M378-K382 WeakPolarHBondContact O-CB 3.19Å; M378-K382 WeakPolarHBondContact O-CG 3.44Å; M378-K382 PolarHBondContact O-N 3.5Å
379	R	75.9	Confident	69.9	Low	157 Å²	157	111.1 Å²	111.1	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-65.9	-43	175.6	-157.4	177.7	-156.1	162.2	7.9	111.1	F375 E376 L377 K382 Q383	F375-R379 WeakPolarHBondContact O-CB 3.46Å; F375-R379 PolarHBondContact O-N 3.18Å; E376-R379 WeakPolarHBondContact O-CB 3.34Å; E376-R379 PolarHBondContact O-N 3.48Å; L377-R379 PolarHBondContact O-N 3.4Å; R379-K382 PolarHBondContact O-N 2.84Å; R379-Q383 WeakPolarHBondContact O-CB 3.42Å; R379-Q383 WeakPolarHBondContact O-CG 3.45Å; R379-Q383 PolarHBondContact O-N 3.46Å
380	K	80.6	Confident	70.3	Confident	120 Å²	120	116.4 Å²	116.4	52%	0.522	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-44.3	173.9	-72	165	-177.8	167.2	0	111.6	E376 L377 Q383 F384	E376-K380 HydrophobicContact CG-CD 4.43Å; E376-K380 WeakPolarHBondContact O-CG 3.13Å; E376-K380 PolarHBondContact O-N 3.01Å; L377-K380 WeakPolarHBondContact O-CB 3.19Å; L377-K380 PolarHBondContact O-N 3.49Å; L377-K380 VanDerWaalsContact O-N 3.14Å; K380-Q383 PolarHBondContact O-N 3.47Å; K380-F384 WeakPolarHBondContact O-CB 3.42Å; K380-F384 PolarHBondContact O-N 3.09Å
381	I	76.5	Confident	70.8	Confident	84 Å²	84	118.1 Å²	118.1	43%	0.431	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-46.4	175.1	-66.7	165.5	0	0	0	111	L377 M378 Q383 F384 N385	L377-I381 HydrophobicContact CG-CD1 4.03Å; L377-I381 WeakPolarHBondContact O-CG1 3.48Å; L377-I381 PolarHBondContact O-N 2.85Å; M378-I381 PolarHBondContact O-N 3.29Å; I381-Q383 VanDerWaalsContact C-N 3.28Å; I381-Q383 PolarHBondContact O-N 2.97Å; I381-F384 PolarHBondContact O-N 3.19Å; I381-N385 WeakPolarHBondContact O-CB 3.41Å; I381-N385 PolarHBondContact O-N 3.36Å
382	K	77.8	Confident	71	Confident	129 Å²	129	119.4 Å²	119.4	56%	0.561	54%	0.543	S	S	*	.	H	α-helix	trans	-64	-31.3	176.1	-74.9	178	178.3	-179.6	0	112.5	M378 R379 R386	M378-K382 WeakPolarHBondContact O-CB 3.19Å; M378-K382 WeakPolarHBondContact O-CG 3.44Å; M378-K382 PolarHBondContact O-N 3.5Å; R379-K382 PolarHBondContact O-N 2.84Å; K382-R386 WeakPolarHBondContact O-CB 3.27Å; K382-R386 WeakPolarHBondContact O-CD 3.32Å; K382-R386 VanDerWaalsContact O-CG 3.23Å; K382-R386 WeakPolarHBondContact O-CG 3.2Å; K382-R386 PolarHBondContact O-N 2.81Å
383	Q	80.3	Confident	70.3	Confident	110 Å²	110	120.1 Å²	120.1	51%	0.514	55%	0.548	S	S	.	.	H	α-helix	trans	-72	-44.9	171	-77.2	176.4	-12.4	0	0	112.1	R379 K380 I381 R386 Q387	R379-Q383 WeakPolarHBondContact O-CB 3.42Å; R379-Q383 WeakPolarHBondContact O-CG 3.45Å; R379-Q383 PolarHBondContact O-N 3.46Å; K380-Q383 PolarHBondContact O-N 3.47Å; I381-Q383 VanDerWaalsContact C-N 3.28Å; I381-Q383 PolarHBondContact O-N 2.97Å; Q383-R386 CarbonylContact O-C 3.56Å; Q383-R386 PolarHBondContact O-N 2.91Å; Q383-Q387 WeakPolarHBondContact O-CG 3.34Å; Q383-Q387 PolarHBondContact O-N 2.9Å
384	F	77.9	Confident	68.8	Low	118 Å²	118	118.1 Å²	118.1	52%	0.518	55%	0.546	S	S	.	.	H	α-helix	trans	-59.8	-49.6	177.2	-177.3	-102.4	0	0	0	111.2	K380 I381 R386 Q387 L388	K380-F384 WeakPolarHBondContact O-CB 3.42Å; K380-F384 PolarHBondContact O-N 3.09Å; I381-F384 PolarHBondContact O-N 3.19Å; F384-R386 VanDerWaalsContact C-N 3.26Å; F384-R386 PolarHBondContact O-N 3.37Å; F384-Q387 CarbonylContact O-C 3.53Å; F384-Q387 WeakPolarHBondContact O-CA 3.27Å; F384-Q387 WeakPolarHBondContact O-CB 3.21Å; F384-Q387 PolarHBondContact O-N 2.85Å; F384-L388 HydrophobicContact CD1-CD1 4.36Å; F384-L388 HydrophobicContact CE1-CD1 3.57Å; F384-L388 HydrophobicContact CZ-CD1 3.86Å; F384-L388 WeakPolarHBondContact O-CB 3.36Å; F384-L388 PolarHBondContact O-N 3.41Å
385	N	75.9	Confident	67.4	Low	83 Å²	83	119.8 Å²	119.8	44%	0.444	57%	0.567	S	S	.	*	H	α-helix	trans	-60.5	-35.4	176.1	-69.8	2.1	0	0	0	111.9	I381 L388 L389	I381-N385 WeakPolarHBondContact O-CB 3.41Å; I381-N385 PolarHBondContact O-N 3.36Å; N385-L388 PolarHBondContact O-N 3.01Å; N385-L389 VanDerWaalsContact O-CB 3.31Å; N385-L389 WeakPolarHBondContact O-CB 3.42Å; N385-L389 VanDerWaalsContact O-CG 3.26Å; N385-L389 WeakPolarHBondContact O-CG 3.49Å; N385-L389 PolarHBondContact O-N 3.2Å
386	R	77.6	Confident	66.2	Low	182 Å²	182	122.8 Å²	122.8	69%	0.687	59%	0.586	S	S	*	*	H	α-helix	trans	-71	-24.8	173	-77.4	175.3	175.3	-162	-1.1	114	K382 Q383 F384 R390	K382-R386 WeakPolarHBondContact O-CB 3.27Å; K382-R386 WeakPolarHBondContact O-CD 3.32Å; K382-R386 VanDerWaalsContact O-CG 3.23Å; K382-R386 WeakPolarHBondContact O-CG 3.2Å; K382-R386 PolarHBondContact O-N 2.81Å; Q383-R386 CarbonylContact O-C 3.56Å; Q383-R386 PolarHBondContact O-N 2.91Å; F384-R386 VanDerWaalsContact C-N 3.26Å; F384-R386 PolarHBondContact O-N 3.37Å; R386-R390 WeakPolarHBondContact O-CD 3.03Å; R386-R390 VanDerWaalsContact O-CG 3.3Å; R386-R390 WeakPolarHBondContact O-CG 3.28Å
387	Q	77.3	Confident	64.6	Low	100 Å²	100	127.3 Å²	127.3	47%	0.467	60%	0.604	S	S	.	*	H	α-helix	trans	-80.5	-39.3	170.2	-68.4	179.6	14.8	0	0	111.1	Q383 F384 R390 R391	Q383-Q387 WeakPolarHBondContact O-CG 3.34Å; Q383-Q387 PolarHBondContact O-N 2.9Å; F384-Q387 CarbonylContact O-C 3.53Å; F384-Q387 WeakPolarHBondContact O-CA 3.27Å; F384-Q387 WeakPolarHBondContact O-CB 3.21Å; F384-Q387 PolarHBondContact O-N 2.85Å; Q387-R390 WeakPolarHBondContact O-CB 3.44Å; Q387-R390 PolarHBondContact O-N 3.47Å; Q387-R390 VanDerWaalsContact O-N 3.09Å; Q387-R391 PolarHBondContact O-N 3.23Å
388	L	71.9	Confident	63.1	Low	74 Å²	74	128.9 Å²	128.9	39%	0.387	62%	0.618	S	S	.	*	H	α-helix	trans	-66.8	-43.6	179.6	-161.3	144.9	0	0	0	110.8	F384 N385 R390 R391 V392	F384-L388 HydrophobicContact CD1-CD1 4.36Å; F384-L388 HydrophobicContact CE1-CD1 3.57Å; F384-L388 HydrophobicContact CZ-CD1 3.86Å; F384-L388 WeakPolarHBondContact O-CB 3.36Å; F384-L388 PolarHBondContact O-N 3.41Å; N385-L388 PolarHBondContact O-N 3.01Å; L388-R390 PolarHBondContact O-N 2.77Å; L388-R390 VanDerWaalsContact O-N 3.14Å; L388-R391 CarbonylContact O-C 3.03Å; L388-R391 PolarHBondContact O-N 3.47Å; L388-V392 HydrophobicContact CD2-CB 4.41Å; L388-V392 HydrophobicContact CD2-CG2 3.62Å; L388-V392 HydrophobicContact CG-CG2 4.09Å; L388-V392 WeakPolarHBondContact O-CB 3.41Å; L388-V392 WeakPolarHBondContact O-CG2 3.34Å; L388-V392 PolarHBondContact O-N 3.45Å
389	L	67.5	Low	61.3	Low	126 Å²	126	127.7 Å²	127.7	66%	0.66	63%	0.63	S	S	*	*	H	α-helix	trans	-61.3	-18.7	170.2	-73.8	167.6	0	0	0	114.4	N385	N385-L389 VanDerWaalsContact O-CB 3.31Å; N385-L389 WeakPolarHBondContact O-CB 3.42Å; N385-L389 VanDerWaalsContact O-CG 3.26Å; N385-L389 WeakPolarHBondContact O-CG 3.49Å; N385-L389 PolarHBondContact O-N 3.2Å
390	R	64.6	Low	59.5	Low	204 Å²	204	131.5 Å²	131.5	77%	0.77	65%	0.647	S	S	*	*	H	α-helix	trans	-90	-22.7	171.1	-67.9	172.8	-170.8	-175.1	2	113.2	R386 Q387 L388	R386-R390 WeakPolarHBondContact O-CD 3.03Å; R386-R390 VanDerWaalsContact O-CG 3.3Å; R386-R390 WeakPolarHBondContact O-CG 3.28Å; Q387-R390 WeakPolarHBondContact O-CB 3.44Å; Q387-R390 PolarHBondContact O-N 3.47Å; Q387-R390 VanDerWaalsContact O-N 3.09Å; L388-R390 PolarHBondContact O-N 2.77Å; L388-R390 VanDerWaalsContact O-N 3.14Å
391	R	62	Low	57.3	Low	196 Å²	196	132.6 Å²	132.6	74%	0.74	66%	0.663	S	S	*	*	H	α-helix	trans	-94	-24.5	179.3	-73.8	179.6	172.3	174.4	-2.4	113.4	Q387 L388	Q387-R391 PolarHBondContact O-N 3.23Å; L388-R391 CarbonylContact O-C 3.03Å; L388-R391 PolarHBondContact O-N 3.47Å
392	V	56.7	Low	55.3	Low	106 Å²	106	132 Å²	132	64%	0.642	68%	0.678	S	S	*	*	S	Bend	trans	-94.4	7.3	177.7	179.2	0	0	0	0	111.7	L388 P394	L388-V392 HydrophobicContact CD2-CB 4.41Å; L388-V392 HydrophobicContact CD2-CG2 3.62Å; L388-V392 HydrophobicContact CG-CG2 4.09Å; L388-V392 WeakPolarHBondContact O-CB 3.41Å; L388-V392 WeakPolarHBondContact O-CG2 3.34Å; L388-V392 PolarHBondContact O-N 3.45Å; V392-P394 WeakPolarHBondContact O-CD 3.4Å
393	N	44.8	Very low	53.4	Low	119 Å²	119	137.1 Å²	137.1	64%	0.636	70%	0.695	S	S	*	*			trans	-112	48.9	172.6	-154	-10.4	0	0	0	115.1
394	P	37.3	Very low	51.4	Low	93 Å²	93	137.5 Å²	137.5	60%	0.604	71%	0.71	S	S	*	*			trans	-84.1	138.8	151.8	34.8	-27.1	0	0	0	109.9	V392	V392-P394 WeakPolarHBondContact O-CD 3.4Å
395	S	35.4	Very low	49.6	Very low	117 Å²	117	141 Å²	141	82%	0.818	73%	0.725	S	S	*	*			trans	68.6	75.6	164.3	-54.2	0	0	0	0	118.3
396	L	41	Very low	47.7	Very low	156 Å²	156	142.5 Å²	142.5	82%	0.817	74%	0.742	S	S	*	*			trans	-124.2	89.2	147.1	-107.8	167.6	0	0	0	110.1
397	K	36.1	Very low	45.7	Very low	204 Å²	204	138.6 Å²	138.6	89%	0.887	75%	0.749	S	S	*	*			trans	-108.7	89.9	174.3	-86.4	-171.2	173.5	-177.5	0	110.5
398	T	39.4	Very low	43.7	Very low	134 Å²	134	138.5 Å²	138.5	82%	0.822	77%	0.766	S	S	*	*			trans	-170.6	125.6	159.6	33.5	0	0	0	0	108.2
399	G	32	Very low	42.3	Very low	70 Å²	70	142.9 Å²	142.9	72%	0.722	79%	0.789	S	S	*	*			cis	-175.6	145.9	-10.8	0	0	0	0	0	110.4
400	Y	36.7	Very low	41	Very low	237 Å²	237	142 Å²	142	93%	0.929	79%	0.79	S	S	*	*			trans	-139.6	140.1	165.1	-119.4	-92.2	0	0	0	108.2
401	T	35	Very low	39.8	Very low	143 Å²	143	138.8 Å²	138.8	88%	0.877	80%	0.796	S	S	*	*			trans	-81.3	127.3	-167.6	38.7	0	0	0	0	112.1
402	G	34.8	Very low	38.7	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	80%	0.799	S	S	*	*			trans	-158.9	106.9	175.2	0	0	0	0	0	110.6	S404	G402-S404 PolarHBondContact O-N 3.44Å
403	Y	37.5	Very low	37.8	Very low	235 Å²	235	141 Å²	141	92%	0.922	81%	0.814	S	S	*	*			trans	-72.9	119.4	180	-93.1	-91.9	0	0	0	111.2
404	S	38.8	Very low	37.9	Very low	118 Å²	118	142 Å²	142	83%	0.825	82%	0.824	S	S	*	*			trans	-151.3	127.8	158.2	-173.6	0	0	0	0	109.8	G402	G402-S404 PolarHBondContact O-N 3.44Å
405	K	40	Very low	37.9	Very low	192 Å²	192	142.7 Å²	142.7	84%	0.835	83%	0.828	S	S	*	*			trans	-98	115.9	-177.4	-74.4	-179.9	177.2	176.3	0	111.1
406	S	35.6	Very low	38	Very low	114 Å²	114	145 Å²	145	80%	0.797	83%	0.83	S	S	*	*			trans	-179.2	116.3	143.9	-79.8	0	0	0	0	106.8
407	A	35	Very low	37.8	Very low	101 Å²	101	141.7 Å²	141.7	84%	0.835	82%	0.82	S	S	*	*				67.8	129.7	74	0	0	0	0	0	112.1
408	A	36.3	Very low	37.9	Very low	98 Å²	98	137.7 Å²	137.7	81%	0.81	81%	0.813	S	S	*	*			cis	-137.3	164.4	10.2	0	0	0	0	0	113.7
409	L	41.6	Very low	37.8	Very low	166 Å²	166	137.3 Å²	137.3	87%	0.869	81%	0.811	S	S	*	*			trans	-105.4	165	165.5	-89.5	173.4	0	0	0	109.3
410	P	41.5	Very low	38.1	Very low	107 Å²	107	138.5 Å²	138.5	70%	0.695	81%	0.808	S	S	*	*			trans	-74.9	159	-154.8	28.9	-36.7	0	0	0	115.2	A412	P410-A412 PolarHBondContact O-N 3.49Å
411	P	38.6	Very low	38	Very low	137 Å²	137	132 Å²	132	89%	0.89	80%	0.796	S	S	*	*			trans	-75.7	116.4	-176.4	30.1	-34.8	0	0	0	112.8
412	A	38.7	Very low	38.2	Very low	98 Å²	98	133.2 Å²	133.2	81%	0.81	79%	0.792	S	S	*	*			trans	-113.5	138.8	161.4	0	0	0	0	0	109.5	P410	P410-A412 PolarHBondContact O-N 3.49Å
413	R	37.2	Very low	38.2	Very low	251 Å²	251	135 Å²	135	95%	0.947	79%	0.788	S	S	*	*			trans	-79.6	119.2	-169.1	-64.3	173.3	176.7	158.2	-4	113.1
414	V	47.4	Very low	38	Very low	140 Å²	140	130.1 Å²	130.1	85%	0.848	78%	0.778	S	S	*	*			trans	-144.9	135.3	149.9	-171.1	0	0	0	0	108.3
415	P	37.4	Very low	37.9	Very low	107 Å²	107	132.2 Å²	132.2	70%	0.695	78%	0.775	S	S	*	*			trans	-99.8	151.4	-175.2	36.6	-33.8	0	0	0	115.1
416	L	37.3	Very low	37.6	Very low	164 Å²	164	128.4 Å²	128.4	86%	0.859	77%	0.768	S	S	*	*			trans	67	143.4	155.8	-98	65	0	0	0	117.7
417	S	36.8	Very low	37.5	Very low	87 Å²	87	132.2 Å²	132.2	61%	0.608	77%	0.766	S	S	*	*			cis	-149.3	163.3	5.9	-59.2	0	0	0	0	112.8
418	T	37.7	Very low	37.4	Very low	121 Å²	121	134.6 Å²	134.6	74%	0.742	76%	0.758	S	S	*	*			trans	20.3	142.8	141	60.3	0	0	0	0	121
419	T	37.5	Very low	37.3	Very low	126 Å²	126	135.8 Å²	135.8	77%	0.773	75%	0.751	S	S	*	*			cis	177.9	170.2	7.6	22.8	0	0	0	0	107.1
420	S	38.3	Very low	36.9	Very low	94 Å²	94	134.2 Å²	134.2	66%	0.657	74%	0.743	S	S	*	*			cis	-175.4	172.3	-20	52	0	0	0	0	109.6
421	C	35.7	Very low	36.5	Very low	100 Å²	100	136 Å²	136	68%	0.676	75%	0.746	S	S	*	*			trans	71	125	166.1	-66.1	0	0	0	0	117.3
422	Q	37.9	Very low	36.3	Very low	170 Å²	170	135.4 Å²	135.4	79%	0.794	74%	0.736	S	S	*	*				76.9	140	69.8	-70.6	177.8	-27	0	0	113.1
423	T	35.1	Very low	36.2	Very low	108 Å²	108	134.9 Å²	134.9	66%	0.663	73%	0.726	S	S	*	*			cis	-166.3	150.6	1.5	12.4	0	0	0	0	111.4
424	N	32.9	Very low	36.1	Very low	134 Å²	134	130.4 Å²	130.4	72%	0.717	72%	0.72	S	S	*	*			trans	55.3	175.7	152.5	-56.6	11	0	0	0	118
425	E	36.6	Very low	35.5	Very low	161 Å²	161	131.1 Å²	131.1	75%	0.752	73%	0.725	S	S	*	*			cis	-149.5	-174.3	2.2	-146.7	142.9	-99.4	0	0	112.8
426	T	34.7	Very low	35.4	Very low	112 Å²	112	130.7 Å²	130.7	69%	0.687	73%	0.725	S	S	*	*			trans	-45.9	157.7	179.9	53	0	0	0	0	119.3
427	Y	32.8	Very low	35.3	Very low	194 Å²	194	129.9 Å²	129.9	76%	0.761	73%	0.726	S	S	*	*				-175.3	-174.8	94.4	-148.7	-109.6	0	0	0	114.1
428	F	33	Very low	35.2	Very low	152 Å²	152	132.7 Å²	132.7	67%	0.667	73%	0.734	S	S	*	*			trans	-83.8	171.3	-159.8	-82.8	-125.3	0	0	0	117.6
429	D	34.8	Very low	35	Very low	122 Å²	122	133.8 Å²	133.8	65%	0.652	74%	0.741	S	S	*	*				125	134.1	123.1	-93.5	-47.5	0	0	0	120.3
430	N	32.4	Very low	35	Very low	133 Å²	133	132.9 Å²	132.9	71%	0.711	74%	0.74	S	S	*	*			trans	-27	158.8	158.2	-58.2	-78.2	0	0	0	115.9
431	L	33.1	Very low	34.7	Very low	144 Å²	144	134.6 Å²	134.6	75%	0.754	75%	0.747	S	S	*	*			cis	-170	179.3	45.8	-166.4	60.4	0	0	0	111.1
432	D	35.9	Very low	34.7	Very low	126 Å²	126	135.5 Å²	135.5	67%	0.674	75%	0.751	S	S	*	*			trans	93.8	121.1	141.8	-101	-45.7	0	0	0	124.3
433	S	35.6	Very low	34.3	Very low	87 Å²	87	133.8 Å²	133.8	61%	0.608	75%	0.753	S	S	*	*			trans	74.7	100.9	131.7	-74.9	0	0	0	0	123.6
434	L	34.5	Very low	34.3	Very low	157 Å²	157	136.6 Å²	136.6	82%	0.822	76%	0.763	S	S	*	*				50.2	116.3	117.4	-63.3	169.2	0	0	0	120.2
435	T	35.8	Very low	34.2	Very low	154 Å²	154	137.3 Å²	137.3	95%	0.945	77%	0.767	S	S	*	*				-161.4	161.7	115.5	7.6	0	0	0	0	111.4
436	S	35.3	Very low	33.8	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	77%	0.767	S	S	*	*			trans	-119.4	147.8	-164.3	52.2	0	0	0	0	113.8
437	T	36	Very low	33.8	Very low	146 Å²	146	140.1 Å²	140.1	90%	0.896	77%	0.774	S	S	*	*			trans	-153.8	131.4	153	-25	0	0	0	0	110.7
438	D	33.3	Very low	33.7	Very low	146 Å²	146	134.2 Å²	134.2	78%	0.781	77%	0.772	S	S	*	*			trans	-86.8	161.6	-178	-52.1	-88.7	0	0	0	113.3
439	T	34.7	Very low	33.6	Very low	144 Å²	144	135 Å²	135	88%	0.883	78%	0.782	S	S	*	*			trans	-159.5	138.9	130.5	-72.6	0	0	0	0	109.8
440	S	36.4	Very low	33.4	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	79%	0.785	S	S	*	*			trans	-79.4	147.9	-163.7	52.4	0	0	0	0	117.4
441	T	31.9	Very low	33.4	Very low	131 Å²	131	134.5 Å²	134.5	80%	0.804	79%	0.786	S	S	*	*			trans	-74.5	163.1	150.4	53.9	0	0	0	0	111.2
442	P	36.3	Very low	33.5	Very low	118 Å²	118	135.4 Å²	135.4	77%	0.766	78%	0.784	S	S	*	*				-149.7	159.9	100.1	38.4	-22.7	0	0	0	116.4
443	T	28.3	Very low	33.4	Very low	134 Å²	134	135.8 Å²	135.8	82%	0.822	79%	0.786	S	S	*	*			trans	-94.1	150.3	158.5	48	0	0	0	0	110.5
444	L	36.2	Very low	33.3	Very low	168 Å²	168	136.8 Å²	136.8	88%	0.88	79%	0.793	S	S	*	*			trans	-154.5	138.7	168.8	-127	164.1	0	0	0	110.9
445	D	29.9	Very low	33.2	Very low	148 Å²	148	137 Å²	137	79%	0.791	79%	0.794	S	S	*	*			trans	-102	165.7	-177.9	-75	-62.2	0	0	0	113.3
446	D	29.7	Very low	33.1	Very low	144 Å²	144	135.7 Å²	135.7	77%	0.77	79%	0.788	S	S	*	*			trans	80.3	169	152.4	-141.1	-10.9	0	0	0	119.8
447	F	34	Very low	32.8	Very low	188 Å²	188	138.1 Å²	138.1	83%	0.825	79%	0.793	S	S	*	*			trans	82	71.4	177.4	-59.1	-77.9	0	0	0	119.3
448	G	30.6	Very low	33	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	79%	0.792	S	S	*	*				72.6	128	100.4	0	0	0	0	0	122.4
449	L	30.1	Very low	32.9	Very low	168 Å²	168	137.8 Å²	137.8	88%	0.88	78%	0.783	S	S	*	*			trans	64.4	117.8	150.4	-62.3	168	0	0	0	119.9
450	C	30.7	Very low	32.6	Very low	105 Å²	105	139.6 Å²	139.6	71%	0.709	78%	0.779	S	S	*	*				171.1	125.6	104.9	-88.8	0	0	0	0	115.1
451	L	32.4	Very low	32.5	Very low	140 Å²	140	141.1 Å²	141.1	73%	0.733	78%	0.779	S	S	*	*			trans	61	153.2	138.6	-77.9	64.9	0	0	0	119
452	K	36	Very low	32.5	Very low	163 Å²	163	144 Å²	144	71%	0.709	78%	0.783	S	S	*	*			cis	-162.3	167.1	4.3	-133.7	175.5	-172.2	174	0	112.5
453	N	34.3	Very low	32.3	Very low	135 Å²	135	142.1 Å²	142.1	72%	0.722	79%	0.785	S	S	*	*			trans	71.1	148.7	158.1	-53.5	-16.7	0	0	0	118.2
454	S	33.9	Very low	32.3	Very low	108 Å²	108	141.9 Å²	141.9	76%	0.755	79%	0.788	S	S	*	*			cis	-163.6	141.3	-25.2	-91.9	0	0	0	0	109.7
455	L	31.5	Very low	32.3	Very low	162 Å²	162	139.1 Å²	139.1	85%	0.848	78%	0.78	S	S	*	*			trans	-91.3	165.4	164.2	-91.5	163.5	0	0	0	110.8
456	P	33.8	Very low	32.5	Very low	126 Å²	126	136.3 Å²	136.3	82%	0.818	77%	0.772	S	S	*	*			trans	-124.8	141.3	132.9	35	-27.4	0	0	0	112.5
457	L	29.3	Very low	32.7	Very low	150 Å²	150	138 Å²	138	79%	0.785	78%	0.775	S	S	*	*			trans	-132.2	126.8	167.7	175.8	75.6	0	0	0	106.5
458	E	39.7	Very low	32.6	Very low	187 Å²	187	133.2 Å²	133.2	87%	0.874	77%	0.765	S	S	*	*			trans	-126.1	162.5	166.7	-73.3	-151	146.5	0	0	111.1
459	T	30.9	Very low	32.8	Very low	98 Å²	98	136.2 Å²	136.2	60%	0.601	77%	0.769	S	S	*	*			trans	-150.3	153.8	-147.3	-30.4	0	0	0	0	112
460	F	29.9	Very low	33	Very low	181 Å²	181	133 Å²	133	79%	0.794	76%	0.761	S	S	*	*			trans	66.9	145.1	172.8	-66.6	-79.8	0	0	0	114.6
461	N	33.9	Very low	33.2	Very low	139 Å²	139	132.9 Å²	132.9	74%	0.743	76%	0.761	S	S	*	*			cis	-155.7	-171.8	37.8	-119.1	-36.2	0	0	0	114.3
462	Q	31.4	Very low	33.3	Very low	191 Å²	191	132.9 Å²	132.9	89%	0.893	77%	0.767	S	S	*	*			trans	-84.4	157.4	-171.5	-55.3	156.9	-53.5	0	0	114.8
463	G	32	Very low	33.2	Very low	79 Å²	79	130 Å²	130	81%	0.814	77%	0.767	S	S	*	*			trans	158.4	107.3	158.7	0	0	0	0	0	118.2
464	C	29.3	Very low	33.4	Very low	130 Å²	130	130.8 Å²	130.8	88%	0.878	77%	0.77	S	S	*	*			trans	-104.7	170.8	154.8	-86.1	0	0	0	0	108.2
465	P	35.2	Very low	33.4	Very low	109 Å²	109	132.7 Å²	132.7	71%	0.708	77%	0.767	S	S	*	*			cis	-148.3	179	26	39.6	-16.8	0	0	0	119
466	S	33.3	Very low	33.6	Very low	89 Å²	89	131.4 Å²	131.4	62%	0.622	76%	0.76	S	S	*	*			trans	60.9	138.4	136.8	62.8	0	0	0	0	124.9
467	E	34.1	Very low	33.8	Very low	181 Å²	181	131.1 Å²	131.1	85%	0.846	75%	0.751	S	S	*	*			trans	71.5	152.5	146.6	-71.9	172.3	-150.2	0	0	119.9
468	S	33	Very low	34	Very low	87 Å²	87	129.3 Å²	129.3	61%	0.608	75%	0.747	S	S	*	*			cis	-167.3	-172.4	-24.2	59.3	0	0	0	0	110.3
469	T	35.2	Very low	33.7	Very low	133 Å²	133	125.3 Å²	125.3	82%	0.816	74%	0.738	S	S	*	*			trans	67.3	152.2	171	71	0	0	0	0	118.5
470	S	33.6	Very low	33.7	Very low	101 Å²	101	126.4 Å²	126.4	71%	0.706	75%	0.745	S	S	*	*			cis	-163.6	144.8	-23.4	49.1	0	0	0	0	113
471	S	34.5	Very low	33.9	Very low	102 Å²	102	124.3 Å²	124.3	71%	0.713	75%	0.746	S	S	*	*			trans	6.3	148.4	150.3	61.3	0	0	0	0	123.1
472	V	33.9	Very low	33.9	Very low	140 Å²	140	122.8 Å²	122.8	85%	0.848	75%	0.747	S	S	*	*				-157.1	156.5	114.9	136.8	0	0	0	0	110.3
473	S	35.2	Very low	34	Very low	103 Å²	103	118.4 Å²	118.4	72%	0.72	74%	0.737	S	S	*	*			trans	-114.5	-160.5	-167.6	-48	0	0	0	0	112.9
474	I	37.7	Very low	34.1	Very low	150 Å²	150	123.1 Å²	123.1	77%	0.769	74%	0.738	S	S	*	*			trans	117.5	134.1	161.9	-65.4	162.6	0	0	0	113.5
475	E	34.9	Very low	34.4	Very low	149 Å²	149	124.4 Å²	124.4	70%	0.696	73%	0.731	S	S	*	*			cis	-177.6	156.3	-34.6	-119.3	176.1	174.4	0	0	110.3
476	L	35.8	Very low	34.3	Very low	134 Å²	134	124 Å²	124	70%	0.702	72%	0.723	S	S	*	*			trans	63.3	161.1	150.3	-62.1	166.5	0	0	0	118.3
477	D	36.8	Very low	34.2	Very low	120 Å²	120	126.5 Å²	126.5	64%	0.642	73%	0.729	S	S	*	*			cis	-152.9	169.2	0.5	-139.6	-21.3	0	0	0	114.8
478	T	33.4	Very low	34.2	Very low	112 Å²	112	126.3 Å²	126.3	69%	0.687	73%	0.726	S	S	*	*			trans	23.9	159	149.6	56.9	0	0	0	0	123.5
479	C	34.1	Very low	34.2	Very low	103 Å²	103	130.6 Å²	130.6	70%	0.696	74%	0.736	S	S	*	*			cis	-156.3	141.1	-0.5	-129.4	0	0	0	0	114.1
480	V	31.1	Very low	34.1	Very low	121 Å²	121	133.9 Å²	133.9	73%	0.733	74%	0.742	S	S	*	*				21	132.3	126.9	-173.8	0	0	0	0	120.8
481	V	34.3	Very low	34	Very low	137 Å²	137	133.5 Å²	133.5	83%	0.83	74%	0.74	S	S	*	*				-176	139	121	146.6	0	0	0	0	111.6
482	S	32.4	Very low	34	Very low	108 Å²	108	135 Å²	135	76%	0.755	74%	0.74	S	S	*	*			trans	-84.8	166.3	172.8	-45.7	0	0	0	0	111.3
483	S	33.9	Very low	34	Very low	99 Å²	99	137 Å²	137	69%	0.692	74%	0.74	S	S	*	*				-169.2	153.2	63.7	58.4	0	0	0	0	109.1
484	E	34.1	Very low	33.9	Very low	177 Å²	177	142.5 Å²	142.5	83%	0.827	75%	0.745	S	S	*	*				44.6	127.8	86.2	-85.7	162.6	-169.5	0	0	113
485	E	35.6	Very low	33.7	Very low	158 Å²	158	141.8 Å²	141.8	74%	0.738	74%	0.743	S	S	*	*			cis	-161.9	161.6	34.7	-125.5	-169.1	162.5	0	0	116
486	N	33.7	Very low	33.7	Very low	101 Å²	101	144.1 Å²	144.1	54%	0.54	75%	0.751	S	S	.	*			trans	61.9	104.2	141.2	-69.3	-24	0	0	0	126.1
487	N	31.8	Very low	33.7	Very low	140 Å²	140	142.9 Å²	142.9	75%	0.749	75%	0.751	S	S	*	*				86.2	148.4	111.4	-61.5	-23.7	0	0	0	124.9
488	K	34.1	Very low	33.6	Very low	177 Å²	177	143 Å²	143	77%	0.77	76%	0.76	S	S	*	*			trans	77.6	118.8	170.5	-64.3	-173.2	174.7	-177.2	0	116.2
489	E	32.2	Very low	33.6	Very low	177 Å²	177	143.8 Å²	143.8	83%	0.827	76%	0.761	S	S	*	*				71.7	96.8	60.6	-69.6	-175.3	128.8	0	0	113.2
490	E	32.9	Very low	33.6	Very low	202 Å²	202	149.3 Å²	149.3	94%	0.944	77%	0.769	S	S	*	*				-155.2	175.9	122.7	-158.5	140	-147	0	0	109.2
491	S	32.3	Very low	33.6	Very low	94 Å²	94	151.5 Å²	151.5	66%	0.657	77%	0.771	S	S	*	*			trans	-111.3	-171.8	-164.2	61.5	0	0	0	0	115.4
492	D	33.8	Very low	33.5	Very low	134 Å²	134	150.8 Å²	150.8	72%	0.717	76%	0.761	S	S	*	*			trans	115	93.3	159.5	-60.6	9	0	0	0	111.9
493	E	33.4	Very low	33.4	Very low	182 Å²	182	153.7 Å²	153.7	85%	0.85	76%	0.761	S	S	*	*				74.1	149.2	76.8	-171.8	163.4	-138.2	0	0	113.3
494	W	33.5	Very low	33.2	Very low	218 Å²	218	160.1 Å²	160.1	83%	0.826	77%	0.772	S	S	*	*			trans	150.9	151.3	148.4	-89.2	62.1	0	0	0	111.8
495	N	34.6	Very low	33.5	Very low	134 Å²	134	158.6 Å²	158.6	72%	0.717	77%	0.768	S	S	*	*			trans	74.9	60.6	159.4	-56.9	-30.2	0	0	0	122.3
496	K	34.3	Very low	33.4	Very low	199 Å²	199	157.5 Å²	157.5	87%	0.865	77%	0.767	S	S	*	*				8.5	162.8	99	-124.6	-174.2	178.9	174.5	0	118.7
497	P	35.3	Very low	33.7	Very low	108 Å²	108	160.4 Å²	160.4	70%	0.701	78%	0.782	S	S	*	*				-137.8	179.3	-64.7	43.4	-27.9	0	0	0	114.8
498	S	35.3	Very low	33.9	Very low	121 Å²	121	162 Å²	162	85%	0.846	78%	0.783	S	S	*	*			trans	174.1	168.6	149.9	40.6	0	0	0	0	110.2
499	N	32.2	Very low	34.2	Very low	130 Å²	130	160.4 Å²	160.4	70%	0.695	78%	0.782	S	S	*	*			cis	-167	-172.1	-38.5	-168.3	5.8	0	0	0	106.4
500	Y	34.3	Very low	34.4	Very low	219 Å²	219	159.3 Å²	159.3	86%	0.859	78%	0.777	S	S	*	*			trans	94	157.3	174.8	-55	-67.7	0	0	0	117.6
501	Q	32.4	Very low	34.6	Very low	166 Å²	166	153.8 Å²	153.8	78%	0.776	76%	0.761	S	S	*	*			trans	-157.8	173.1	-130.7	-165.9	-177	-2.9	0	0	112.1
502	L	32.1	Very low	34.7	Very low	122 Å²	122	157.3 Å²	157.3	64%	0.639	77%	0.772	S	S	*	*			trans	79.8	142.8	166.8	-50.4	173.4	0	0	0	115.4
503	F	29.3	Very low	34.6	Very low	169 Å²	169	157.3 Å²	157.3	74%	0.741	78%	0.78	S	S	*	*			cis	-140	150.7	-4.6	-104.5	-65.5	0	0	0	109.5
504	Y	30.4	Very low	34.6	Very low	235 Å²	235	158 Å²	158	92%	0.922	78%	0.781	S	S	*	*			trans	-131.1	151.3	152.2	-104	-93.1	0	0	0	107.3
505	I	41	Very low	34.7	Very low	145 Å²	145	153.5 Å²	153.5	74%	0.744	78%	0.779	S	S	*	*			trans	-115.5	121.8	175.7	-62.9	175.8	0	0	0	107.2
506	D	31.8	Very low	34.9	Very low	134 Å²	134	155.2 Å²	155.2	72%	0.717	79%	0.788	S	S	*	*			trans	-78.4	137.7	166.6	-85.2	-23.2	0	0	0	109.2
507	D	41.3	Very low	34.8	Very low	163 Å²	163	151 Å²	151	87%	0.872	78%	0.779	S	S	*	*			trans	-117.7	133.3	147.4	-91	-45.7	0	0	0	107.6
508	K	36.5	Very low	35	Very low	173 Å²	173	155.2 Å²	155.2	75%	0.752	79%	0.789	S	S	*	*			trans	-103	154.4	178.8	-72.5	175.2	179.6	168.1	0	110.1
509	D	40.1	Very low	35.1	Very low	143 Å²	143	156.9 Å²	156.9	77%	0.765	78%	0.781	S	S	*	*			trans	146.7	145.5	148.5	-77.8	-6.6	0	0	0	110.4
510	H	36.2	Very low	35.4	Very low	154 Å²	154	157.5 Å²	157.5	71%	0.713	78%	0.779	S	S	*	*			cis	-154.1	162.9	-5	-139.5	-77.6	0	0	0	109.9
511	S	37.5	Very low	35.5	Very low	87 Å²	87	152.8 Å²	152.8	61%	0.608	77%	0.766	S	S	*	*			trans	45.5	108.5	154.2	48.6	0	0	0	0	120.4
512	L	32.8	Very low	35.7	Very low	168 Å²	168	152.1 Å²	152.1	88%	0.88	76%	0.764	S	S	*	*				82.2	107.6	83.8	-79.8	165.6	0	0	0	116.5
513	C	31.5	Very low	35.9	Very low	133 Å²	133	151.2 Å²	151.2	90%	0.899	76%	0.763	S	S	*	*				-168.1	152.7	118.6	-117.1	0	0	0	0	111.4
514	K	35.3	Very low	36.2	Very low	198 Å²	198	150.8 Å²	150.8	86%	0.861	76%	0.764	S	S	*	*			trans	-122	154	176.9	-84.5	-175.5	176.6	179.2	0	110.8
515	P	34.4	Very low	36.4	Very low	123 Å²	123	146.8 Å²	146.8	80%	0.799	76%	0.755	S	S	*	*			trans	-80.4	159.9	-178.1	34	-36.6	0	0	0	112.7
516	L	38.8	Very low	36.2	Very low	170 Å²	170	146.1 Å²	146.1	89%	0.89	75%	0.752	S	S	*	*			trans	-98.7	147.7	165.2	-168.7	65.7	0	0	0	109.9
517	V	32.5	Very low	36.4	Very low	111 Å²	111	145 Å²	145	67%	0.673	75%	0.75	S	S	*	*			trans	-116.8	137.6	175.6	171.5	0	0	0	0	108.1
518	E	39.9	Very low	36.1	Very low	195 Å²	195	144 Å²	144	91%	0.911	75%	0.75	S	S	*	*			trans	-131.5	160.2	158.7	-156.3	149	-124.9	0	0	109.7
519	K	37.5	Very low	36	Very low	157 Å²	157	139.8 Å²	139.8	68%	0.683	76%	0.756	S	S	*	*			trans	-159.3	161.1	-144.1	-157.3	-166.9	174.9	-166	0	110.2
520	Q	38.1	Very low	35.9	Very low	143 Å²	143	137.6 Å²	137.6	67%	0.668	76%	0.758	S	S	*	*			trans	69.8	154.1	169.7	-67.5	163.8	-96.7	0	0	113.5
521	M	36.2	Very low	35.9	Very low	119 Å²	119	136.2 Å²	136.2	59%	0.586	77%	0.766	S	S	*	*			cis	-160.3	150.5	-7	-119.9	155	127.3	0	0	108.6
522	E	36.6	Very low	35.8	Very low	153 Å²	153	135.1 Å²	135.1	72%	0.715	77%	0.768	S	S	*	*			trans	54.7	155.2	134.2	-67	171.9	-164.5	0	0	120.6
523	T	36.3	Very low	35.9	Very low	102 Å²	102	134.3 Å²	134.3	63%	0.626	76%	0.764	S	S	*	*			cis	-163.6	148.3	-10	-105.9	0	0	0	0	111
524	E	36	Very low	36.3	Very low	161 Å²	161	134.7 Å²	134.7	75%	0.752	76%	0.762	S	S	*	*			trans	50.8	134	154.5	-74.3	171	-170.1	0	0	125.4
525	M	34.5	Very low	36.2	Very low	151 Å²	151	130.9 Å²	130.9	74%	0.744	76%	0.756	S	S	*	*				93.2	125.6	127.6	-85.3	-162.1	174.2	0	0	124.6
526	L	36.2	Very low	36.4	Very low	130 Å²	130	131.1 Å²	131.1	68%	0.681	76%	0.755	S	S	*	*			trans	83.7	103.5	134.1	-69.8	173	0	0	0	122.3
527	T	35.7	Very low	36.2	Very low	110 Å²	110	128.7 Å²	128.7	68%	0.675	75%	0.747	S	S	*	*				77.9	130.5	127	49.8	0	0	0	0	123
528	T	35.3	Very low	36.2	Very low	143 Å²	143	129.4 Å²	129.4	88%	0.877	75%	0.752	S	S	*	*			trans	62.9	122.2	143.8	53.9	0	0	0	0	120
529	G	34.6	Very low	36.1	Very low	84 Å²	84	125.7 Å²	125.7	87%	0.866	75%	0.748	S	S	*	*			trans	170.5	130.7	166	0	0	0	0	0	109.1
530	A	38	Very low	36	Very low	98 Å²	98	121.3 Å²	121.3	81%	0.81	75%	0.747	S	S	*	*			trans	-113.9	146.7	-176.5	0	0	0	0	0	111.7
531	S	35.9	Very low	36.1	Very low	125 Å²	125	122.3 Å²	122.3	87%	0.874	76%	0.755	S	S	*	*			trans	40	129.5	143.8	-163.3	0	0	0	0	120.4
532	G	35.2	Very low	36	Very low	63 Å²	63	123.8 Å²	123.8	65%	0.649	77%	0.766	S	S	*	*			trans	151	67.8	152	0	0	0	0	0	119.2
533	D	35.7	Very low	36.2	Very low	152 Å²	152	122 Å²	122	81%	0.813	77%	0.767	S	S	*	*			trans	58.1	169.3	135	-54.3	-24.3	0	0	0	124.1
534	V	39.7	Very low	36.1	Very low	141 Å²	141	126.5 Å²	126.5	86%	0.855	78%	0.778	S	S	*	*			trans	88.3	115.9	161.3	-163.9	0	0	0	0	119.4
535	T	33.9	Very low	36.1	Very low	118 Å²	118	126.4 Å²	126.4	72%	0.724	78%	0.781	S	S	*	*			trans	-78.4	157.7	177.9	52.9	0	0	0	0	116.2
536	T	37.1	Very low	36.2	Very low	128 Å²	128	125.3 Å²	125.3	79%	0.785	78%	0.783	S	S	*	*			trans	-172.4	131.2	133.5	33.7	0	0	0	0	108.9
537	T	34.7	Very low	36.1	Very low	118 Å²	118	124.3 Å²	124.3	72%	0.724	79%	0.785	S	S	*	*				62.3	133.7	62.1	60	0	0	0	0	115
538	T	33.1	Very low	36	Very low	126 Å²	126	124.8 Å²	124.8	77%	0.773	78%	0.783	S	S	*	*			cis	-167.2	165.9	-7.1	-83.3	0	0	0	0	109.8
539	S	37.6	Very low	36	Very low	118 Å²	118	125.5 Å²	125.5	83%	0.825	78%	0.779	S	S	*	*			trans	94.6	137.6	160.8	-155.3	0	0	0	0	117.6
540	G	35.9	Very low	36.2	Very low	65 Å²	65	128.3 Å²	128.3	67%	0.67	77%	0.768	S	S	*	*			cis	172	-164.2	-4.6	0	0	0	0	0	115
541	I	39	Very low	36.1	Very low	163 Å²	163	131.5 Å²	131.5	84%	0.836	77%	0.766	S	S	*	*			trans	82.4	88.1	167.9	-45.6	177.3	0	0	0	118.6
542	N	35.9	Very low	36	Very low	150 Å²	150	133.6 Å²	133.6	80%	0.802	76%	0.762	S	S	*	*				33.4	157.1	116.9	-76.4	-15.3	0	0	0	123
543	P	39.3	Very low	36.1	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	77%	0.767	S	S	*	*			cis	-147	-169.5	-36.9	41.7	-23	0	0	0	114.7
544	K	35.2	Very low	36.1	Very low	198 Å²	198	135.2 Å²	135.2	86%	0.861	76%	0.755	S	S	*	*			trans	120	148.5	139.6	-155.8	172.3	-175.2	178	0	117.5
545	I	35.9	Very low	35.9	Very low	159 Å²	159	139.4 Å²	139.4	82%	0.815	76%	0.755	S	S	*	*			trans	92.1	138.1	177.3	-52	179.6	0	0	0	115.2
546	T	37	Very low	35.9	Very low	127 Å²	127	140.6 Å²	140.6	78%	0.779	76%	0.756	S	S	*	*			trans	-108.6	178.1	-165.5	47	0	0	0	0	112.5
547	P	34.5	Very low	35.8	Very low	110 Å²	110	140 Å²	140	71%	0.714	75%	0.746	S	S	*	*			cis	-130.6	166.6	-40.6	36.1	-21.2	0	0	0	112.1
548	D	33.5	Very low	35.7	Very low	119 Å²	119	142.7 Å²	142.7	64%	0.636	75%	0.751	S	S	*	*			trans	-137.8	119.3	165.1	-161.7	-2.4	0	0	0	110.9	K550	D548-K550 VanDerWaalsContact CG-NZ 3.31Å; D548-K550 PolarHBondContact O-N 3.25Å; D548-K550 IonicContact OD1-NZ 2.65Å; D548-K550 PolarHBondContact OD1-NZ 3.31Å; D548-K550 VanDerWaalsContact OD1-NZ 3.08Å; D548-K550 IonicContact OD2-NZ 2.78Å; D548-K550 PolarHBondContact OD2-NZ 3.44Å
549	I	35.2	Very low	35.6	Very low	158 Å²	158	144.8 Å²	144.8	81%	0.81	76%	0.756	S	S	*	*			trans	-92.5	81.6	-171.2	-55.4	175.2	0	0	0	108.4
550	K	38.4	Very low	35.5	Very low	144 Å²	144	146.2 Å²	146.2	63%	0.626	75%	0.752	S	S	*	*			trans	-133.8	-3.9	-171.5	-94.6	-174.8	-167.7	113.1	0	117.6	D548	D548-K550 VanDerWaalsContact CG-NZ 3.31Å; D548-K550 PolarHBondContact O-N 3.25Å; D548-K550 IonicContact OD1-NZ 2.65Å; D548-K550 PolarHBondContact OD1-NZ 3.31Å; D548-K550 VanDerWaalsContact OD1-NZ 3.08Å; D548-K550 IonicContact OD2-NZ 2.78Å; D548-K550 PolarHBondContact OD2-NZ 3.44Å
551	H	35.4	Very low	35.2	Very low	165 Å²	165	148.1 Å²	148.1	76%	0.764	75%	0.747	S	S	*	*	S	Bend	trans	-113.5	11.1	-166.7	-113.6	-47.2	0	0	0	116.7
552	E	33.9	Very low	34.9	Very low	169 Å²	169	145.8 Å²	145.8	79%	0.79	75%	0.746	S	S	*	*	S	Bend	trans	-108.8	-2.6	-174.4	-158.4	153.4	-146.7	0	0	114
553	L	36.5	Very low	34.8	Very low	143 Å²	143	145.2 Å²	145.2	75%	0.749	74%	0.743	S	S	*	*	S	Bend	trans	-87.1	-25.4	178	-88	159.5	0	0	0	114.2	R555	L553-R555 PolarHBondContact O-N 3.43Å; L553-R555 VanDerWaalsContact O-N 3.16Å
554	D	36.3	Very low	34.6	Very low	106 Å²	106	144.3 Å²	144.3	57%	0.567	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	3	-172.9	-61.9	-40.8	0	0	0	114.7
555	R	35.5	Very low	35	Very low	228 Å²	228	141 Å²	141	86%	0.86	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	1.9	179.7	-63	-167.4	-172.4	-161.6	3.4	114.8	L553	L553-R555 PolarHBondContact O-N 3.43Å; L553-R555 VanDerWaalsContact O-N 3.16Å
556	I	33.7	Very low	35.4	Very low	143 Å²	143	136.6 Å²	136.6	73%	0.733	71%	0.706	S	S	*	*	S	Bend	trans	-110.6	45.2	179.3	-39.4	-178.5	0	0	0	110
557	I	35.9	Very low	35.3	Very low	115 Å²	115	140.1 Å²	140.1	59%	0.59	71%	0.705	S	S	*	*			trans	-120.7	-19.5	-175.8	-64.6	179	0	0	0	112
558	E	32.2	Very low	35.2	Very low	175 Å²	175	139.1 Å²	139.1	82%	0.818	71%	0.706	S	S	*	*	S	Bend	trans	-92.6	146.9	166.3	-64.1	-172.9	129.4	0	0	109.9
559	I	31.3	Very low	35.5	Very low	171 Å²	171	139.9 Å²	139.9	88%	0.877	70%	0.701	S	S	*	*			trans	77	77.9	-161.6	-46.2	167.7	0	0	0	112.6
560	I	35.3	Very low	35.6	Very low	147 Å²	147	136.8 Å²	136.8	75%	0.754	69%	0.685	S	S	*	*			trans	-121.6	113.9	160.4	-62.2	-179.3	0	0	0	107.3
561	D	29.5	Very low	35.3	Very low	105 Å²	105	137 Å²	137	56%	0.561	69%	0.69	S	S	*	*			trans	-70.1	139.1	-175.6	-178.7	16.9	0	0	0	112.3	N563	D561-N563 VanDerWaalsContact C-N 3.28Å; D561-N563 PolarHBondContact O-N 3.19Å; D561-N563 PolarHBondContact OD1-ND2 3.01Å
562	S	32.1	Very low	35.2	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-12.4	-168.8	-56.1	0	0	0	0	114.6
563	N	33.9	Very low	35.2	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	7.3	-157.1	-64.7	-50.1	0	0	0	116	D561	D561-N563 VanDerWaalsContact C-N 3.28Å; D561-N563 PolarHBondContact O-N 3.19Å; D561-N563 PolarHBondContact OD1-ND2 3.01Å
564	N	34.9	Very low	35	Very low	95 Å²	95	132.1 Å²	132.1	51%	0.508	68%	0.68	S	S	.	*			trans	-118.4	103.5	179.4	-168.4	-22.7	0	0	0	113	N566	N564-N566 VanDerWaalsContact C-N 3.3Å; N564-N566 PolarHBondContact O-N 3.31Å; N564-N566 WeakPolarHBondContact OD1-CB 3.32Å; N564-N566 PolarHBondContact OD1-N 2.72Å
565	T	44.8	Very low	34.6	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-69.3	-18.7	-179.9	42.7	0	0	0	0	114.7	R567	T565-R567 VanDerWaalsContact C-N 3.27Å; T565-R567 PolarHBondContact O-N 3.49Å
566	N	43.8	Very low	34.4	Very low	66 Å²	66	134.3 Å²	134.3	35%	0.353	69%	0.691	S	S	.	*	G	3₁₀ helix	trans	-77.6	-1.3	-173.4	-68.9	-27.5	0	0	0	114.6	N564	N564-N566 VanDerWaalsContact C-N 3.3Å; N564-N566 PolarHBondContact O-N 3.31Å; N564-N566 WeakPolarHBondContact OD1-CB 3.32Å; N564-N566 PolarHBondContact OD1-N 2.72Å
567	R	34.8	Very low	34.1	Very low	201 Å²	201	132 Å²	132	76%	0.758	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-109.9	-3.2	-174.2	-125.5	176.4	-176.1	-179.9	1.1	116.3	T565 Y569	T565-R567 VanDerWaalsContact C-N 3.27Å; T565-R567 PolarHBondContact O-N 3.49Å; R567-Y569 VanDerWaalsContact C-N 3.34Å; R567-Y569 PolarHBondContact O-N 2.93Å
568	A	33.3	Very low	33.9	Very low	90 Å²	90	134 Å²	134	74%	0.744	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-2.9	-165.5	0	0	0	0	0	117.1
569	Y	39.7	Very low	33.9	Very low	135 Å²	135	130.9 Å²	130.9	53%	0.529	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.4	4.7	-165.9	-117.6	-79.6	0	0	0	117.4	P328 R567	P328-Y569 HydrophobicContact CG-CE1 4.25Å; R567-Y569 VanDerWaalsContact C-N 3.34Å; R567-Y569 PolarHBondContact O-N 2.93Å
570	I	35.7	Very low	33.9	Very low	93 Å²	93	128.2 Å²	128.2	48%	0.477	70%	0.7	S	S	.	*	S	Bend	trans	-87.6	-22.3	-173.9	-67.3	179.6	0	0	0	113.4
571	M	32.8	Very low	33.8	Very low	148 Å²	148	124.4 Å²	124.4	73%	0.729	70%	0.697	S	S	*	*	S	Bend	trans	-113.8	38.3	-165.6	-156	47.6	54.9	0	0	116.3
572	S	33	Very low	33.9	Very low	74 Å²	74	127.8 Å²	127.8	52%	0.517	70%	0.703	S	S	.	*	S	Bend	trans	-119.8	0.5	177.9	58.9	0	0	0	0	115.3
573	L	33.5	Very low	33.9	Very low	152 Å²	152	130.2 Å²	130.2	80%	0.796	70%	0.701	S	S	*	*	S	Bend	trans	-99.5	-5.5	-176.4	-89.9	165.2	0	0	0	115.6
574	L	32.4	Very low	33.6	Very low	149 Å²	149	134 Å²	134	78%	0.78	71%	0.705	S	S	*	*	S	Bend	trans	-117.8	-17.5	-176.9	-76.6	169.4	0	0	0	115.4
575	N	29.3	Very low	33.5	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	72%	0.723	S	S	*	*			trans	-137	91.1	-179.9	-87.3	-37.7	0	0	0	111.4
576	R	30.5	Very low	32.7	Very low	242 Å²	242	141.4 Å²	141.4	91%	0.913	73%	0.725	S	S	*	*			trans	-150.9	41.8	164.6	-138.3	174.8	-170.4	-174.2	2.6	115.7
577	S	27.4	Very low	32	Very low	93 Å²	93	143.9 Å²	143.9	65%	0.65	75%	0.747	S	S	*	*			trans	-66.2	145.3	153.6	-0.5	0	0	0	0	110
578	N	30.7	Very low	31.6	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	75%	0.754	S	S	*	*			trans	59.8	93.9	158.2	-51.4	-6.9	0	0	0	118.3
579	A	33.6	Very low	31.3	Very low	109 Å²	109	145.6 Å²	145.6	90%	0.901	76%	0.757	S	S	*	*				178.2	128.4	128	0	0	0	0	0	110.3
580	S	30.3	Very low	30.7	Very low	115 Å²	115	145 Å²	145	80%	0.804	77%	0.767	S	S	*	*			trans	-131.8	135.4	179.3	56.4	0	0	0	0	111.6
581	G	33.4	Very low	30.4	Very low	67 Å²	67	146 Å²	146	69%	0.691	78%	0.779	S	S	*	*			trans	124.2	151.1	179.5	0	0	0	0	0	112.4
582	Y	32.3	Very low	30.3	Very low	175 Å²	175	146.4 Å²	146.4	69%	0.686	78%	0.783	S	S	*	*			cis	-155.2	166.2	-5.4	-116.5	-78.5	0	0	0	110.8	M50	M50-Y582 HydrophobicContact CE-CE1 4.43Å
583	H	32.4	Very low	29.9	Very low	166 Å²	166	148.8 Å²	148.8	77%	0.769	80%	0.798	S	S	*	*			trans	58.7	98	161.8	-71.6	-62.4	0	0	0	121.6
584	R	28	Very low	29.7	Very low	218 Å²	218	145.6 Å²	145.6	82%	0.823	79%	0.788	S	S	*	*			trans	-43.1	131	144.1	168.6	-160	-90.9	178.2	-8.1	112.4
585	K	32.4	Very low	29.6	Very low	203 Å²	203	146.8 Å²	146.8	88%	0.883	80%	0.796	S	S	*	*			trans	-128.4	149.3	141.7	-87.5	-171.8	175.8	178.7	0	109.8
586	Q	26.6	Very low	29.7	Very low	177 Å²	177	147.4 Å²	147.4	83%	0.827	80%	0.799	S	S	*	*			trans	-93.3	134.7	177.1	-67.8	170.7	-26.8	0	0	109.7
587	S	30.8	Very low	29.8	Very low	117 Å²	117	141.2 Å²	141.2	82%	0.818	79%	0.793	S	S	*	*			trans	-152.8	116.1	169.1	50.3	0	0	0	0	110.4
588	K	25.2	Very low	30	Very low	211 Å²	211	141.2 Å²	141.2	92%	0.917	79%	0.793	S	S	*	*			trans	-84.1	111.1	171.2	-67.8	176.6	177.9	177.9	0	109.5
589	C	27.5	Very low	30	Very low	117 Å²	117	140.9 Å²	140.9	79%	0.791	79%	0.789	S	S	*	*			trans	-139.7	118.1	154.9	-74.6	0	0	0	0	105.6
590	V	27.4	Very low	29.8	Very low	122 Å²	122	140.5 Å²	140.5	74%	0.739	78%	0.779	S	S	*	*				61.9	115.4	71.7	-179.4	0	0	0	0	110.6
591	P	29.2	Very low	29.7	Very low	115 Å²	115	143.9 Å²	143.9	75%	0.747	78%	0.779	S	S	*	*			trans	-70.1	139.6	-177.4	29.6	-34.8	0	0	0	111.3	C593	P591-C593 PolarHBondContact O-N 2.96Å
592	I	29.9	Very low	29.4	Very low	155 Å²	155	145.5 Å²	145.5	80%	0.795	78%	0.78	S	S	*	*			trans	-80.5	101	176.9	-61.5	172.6	0	0	0	108.5	S594	I592-S594 VanDerWaalsContact CG2-OG 3.27Å; I592-S594 WeakPolarHBondContact CG2-OG 3.37Å
593	C	25	Very low	29.3	Very low	124 Å²	124	145.8 Å²	145.8	84%	0.838	78%	0.784	S	S	*	*			trans	-88.3	117.4	155.3	-70.9	0	0	0	0	107.7	P591	P591-C593 PolarHBondContact O-N 2.96Å
594	S	30.2	Very low	29.1	Very low	85 Å²	85	144.7 Å²	144.7	59%	0.594	78%	0.783	S	S	*	*			trans	-145.3	103.2	174.4	-61.1	0	0	0	0	110.4	I592	I592-S594 VanDerWaalsContact CG2-OG 3.27Å; I592-S594 WeakPolarHBondContact CG2-OG 3.37Å
595	N	30.6	Very low	29	Very low	175 Å²	175	138.7 Å²	138.7	94%	0.936	77%	0.774	S	S	*	*			trans	-155.9	111.3	138.3	-99.3	-20.5	0	0	0	106.3
596	D	30.8	Very low	28.8	Very low	151 Å²	151	135.8 Å²	135.8	81%	0.807	77%	0.768	S	S	*	*			trans	-81	165.8	-173.6	-93.2	-61.7	0	0	0	112.7
597	S	33	Very low	28.8	Very low	112 Å²	112	134.2 Å²	134.2	78%	0.783	76%	0.764	S	S	*	*			trans	74.4	144.3	166.9	82.3	0	0	0	0	118
598	S	31.4	Very low	28.7	Very low	93 Å²	93	133.8 Å²	133.8	65%	0.65	76%	0.76	S	S	*	*			cis	-163.1	159.9	-25.8	54.6	0	0	0	0	111.4
599	I	29.2	Very low	28.8	Very low	151 Å²	151	126.6 Å²	126.6	77%	0.774	73%	0.734	S	S	*	*			trans	72.3	122	151.9	-70.2	156.9	0	0	0	119
600	C	29.4	Very low	28.9	Very low	101 Å²	101	123.3 Å²	123.3	68%	0.682	71%	0.71	S	S	*	*			trans	52.9	102.7	155.4	-68.6	0	0	0	0	119.9
601	K	29.8	Very low	28.9	Very low	187 Å²	187	121.7 Å²	121.7	81%	0.813	70%	0.696	S	S	*	*				86.6	97.9	71.3	-81.6	177.5	179.6	176.5	0	114.6
602	S	26.8	Very low	28.9	Very low	100 Å²	100	122.8 Å²	122.8	70%	0.699	70%	0.695	S	S	*	*			trans	49.6	120.9	132.8	69.3	0	0	0	0	118.8
603	K	29.6	Very low	29	Very low	181 Å²	181	119.2 Å²	119.2	79%	0.787	68%	0.684	S	S	*	*				-173.1	140.1	67.9	-88	-179.3	175.9	177.8	0	113.1
604	I	27.8	Very low	29.3	Very low	144 Å²	144	122.3 Å²	122.3	74%	0.738	68%	0.683	S	S	*	*				64.4	132.3	129.6	-56.5	171.9	0	0	0	120.6
605	S	27.4	Very low	29.4	Very low	92 Å²	92	126 Å²	126	64%	0.643	69%	0.691	S	S	*	*			trans	71.1	100.1	153.1	68	0	0	0	0	123.1
606	N	27.2	Very low	29.5	Very low	141 Å²	141	124 Å²	124	75%	0.754	68%	0.679	S	S	*	*				72	130.1	108.5	-66	8.2	0	0	0	124.1
607	I	26.7	Very low	29.6	Very low	145 Å²	145	125.2 Å²	125.2	74%	0.744	68%	0.677	S	S	*	*			trans	73.7	108.9	140.1	-65.5	166.3	0	0	0	115.5
608	C	28.3	Very low	29.5	Very low	107 Å²	107	127.7 Å²	127.7	72%	0.723	68%	0.677	S	S	*	*				75.6	143.2	75.8	-88.2	0	0	0	0	113.6
609	T	28.7	Very low	29.4	Very low	61 Å²	61	129.2 Å²	129.2	37%	0.374	68%	0.684	S	S	.	*			cis	-155.2	-171.5	19.4	-21.3	0	0	0	0	113.1	H180 S181 I182	H180-T609 WeakPolarHBondContact O-CB 3.45Å; H180-T609 PolarHBondContact O-N 3.2Å; H180-T609 VanDerWaalsContact O-N 3.1Å; H180-T609 PolarHBondContact O-OG1 3.34Å; S181-T609 CarbonylContact C-O 3.58Å; S181-T609 WeakPolarHBondContact CA-O 3.33Å; S181-T609 PolarHBondContact N-O 3.31Å; S181-T609 VanDerWaalsContact N-O 3.16Å; I182-T609 PolarHBondContact N-O 3.08Å
610	T	28.4	Very low	29.5	Very low	48 Å²	48	131.3 Å²	131.3	29%	0.294	69%	0.688	S	S	.	*			trans	34.5	157.9	153.2	71.6	0	0	0	0	123.5	D179 H180 S181 I182	D179-T610 HydrophobicContact CB-CG2 4.06Å; H180-T610 WeakPolarHBondContact CA-OG1 3.49Å; H180-T610 PolarHBondContact N-OG1 2.92Å; S181-T610 CarbonylContact C-O 3.56Å; S181-T610 WeakPolarHBondContact CA-O 3.46Å; I182-T610 PolarHBondContact N-O 3.29Å
611	M	28.3	Very low	29.4	Very low	87 Å²	87	136.7 Å²	136.7	43%	0.429	69%	0.694	S	S	.	*				175.8	140.1	58.3	-128.7	-44.3	119.6	0	0	111.5	D179	D179-M611 HydrophobicContact CB-CE 4.17Å; D179-M611 WeakPolarHBondContact OD1-CE 3.35Å; D179-M611 WeakPolarHBondContact OD2-CE 3.42Å
612	N	29.6	Very low	29.4	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	70%	0.697	S	S	*	*			trans	48.7	159.4	149.3	-82.7	-14.7	0	0	0	123.8
613	S	30.8	Very low	29.3	Very low	81 Å²	81	141.1 Å²	141.1	57%	0.566	70%	0.699	S	S	*	*			cis	179.9	163.4	-31.3	58.1	0	0	0	0	110
614	K	30.6	Very low	29.5	Very low	188 Å²	188	140.4 Å²	140.4	82%	0.817	70%	0.703	S	S	*	*			trans	167.6	162.4	134.8	-91.7	159.6	-173.8	174.5	0	114.6
615	H	33.7	Very low	29.7	Very low	162 Å²	162	141.1 Å²	141.1	75%	0.75	71%	0.707	S	S	*	*			trans	80.7	110.8	-179.1	-66.5	-95.5	0	0	0	115.6
616	L	32.5	Very low	29.6	Very low	133 Å²	133	140 Å²	140	70%	0.696	71%	0.711	S	S	*	*			cis	82.1	129	49.3	-67.3	163.7	0	0	0	111.9
617	K	31.9	Very low	29.8	Very low	177 Å²	177	145.2 Å²	145.2	77%	0.77	72%	0.72	S	S	*	*			cis	-166.6	-178.6	-6.2	-150.9	-175.8	-165.5	-178.6	0	110
618	E	31	Very low	29.8	Very low	165 Å²	165	145.9 Å²	145.9	77%	0.771	73%	0.725	S	S	*	*			trans	85.2	126	161.8	-48.6	-155.6	143.8	0	0	120.1
619	P	30.6	Very low	30	Very low	124 Å²	124	146.2 Å²	146.2	81%	0.805	73%	0.728	S	S	*	*			trans	-120.2	140.8	166	37.8	-26.1	0	0	0	113.6
620	F	30.3	Very low	30.2	Very low	195 Å²	195	153.3 Å²	153.3	86%	0.855	75%	0.754	S	S	*	*			trans	-88.8	137.7	171.1	-93.4	-94.4	0	0	0	112.7
621	R	27.5	Very low	30	Very low	215 Å²	215	155 Å²	155	81%	0.811	77%	0.773	S	S	*	*			trans	-98.4	148.6	167.9	-73	178.6	171	176.1	-2.7	110.1
622	Y	29.2	Very low	30.1	Very low	220 Å²	220	161 Å²	161	86%	0.863	80%	0.797	S	S	*	*			trans	-131.8	135.5	148.8	-103.5	-88.7	0	0	0	109.8
623	Q	25.2	Very low	29.9	Very low	160 Å²	160	159.9 Å²	159.9	75%	0.748	80%	0.795	S	S	*	*			trans	-114.1	146.1	167.9	-69.1	176.7	-47.8	0	0	107.6
624	L	33.2	Very low	30	Very low	166 Å²	166	166.2 Å²	166.2	87%	0.869	81%	0.813	S	S	*	*			trans	-143.1	138.5	156.3	-137	88.5	0	0	0	110
625	L	33.2	Very low	29.7	Very low	158 Å²	158	162.7 Å²	162.7	83%	0.827	80%	0.803	S	S	*	*			trans	-77.5	157.1	171.7	-66.7	71.9	0	0	0	108.3
626	G	25.5	Very low	29.6	Very low	70 Å²	70	164 Å²	164	72%	0.722	81%	0.809	S	S	*	*			cis	113.9	106.6	12	0	0	0	0	0	110.7
627	R	30.9	Very low	29.4	Very low	250 Å²	250	164.6 Å²	164.6	94%	0.943	81%	0.813	S	S	*	*			trans	-152.8	128.4	171.4	-111.6	177.4	-178.4	177.5	0.6	111.1
628	N	25.8	Very low	29.3	Very low	159 Å²	159	160.5 Å²	160.5	85%	0.85	81%	0.812	S	S	*	*			trans	-88.4	156	-179	-55.1	-28.7	0	0	0	111.5
629	S	33.3	Very low	29.3	Very low	113 Å²	113	160.7 Å²	160.7	79%	0.79	82%	0.817	S	S	*	*			trans	-167.1	106.2	144.9	-104.4	0	0	0	0	113.8
630	K	31.7	Very low	29.1	Very low	211 Å²	211	165.1 Å²	165.1	92%	0.917	82%	0.819	S	S	*	*			trans	52.9	137.4	149.1	-60.1	-175.6	178.4	-177.8	0	120.2
631	A	24.2	Very low	29	Very low	84 Å²	84	163.4 Å²	163.4	69%	0.694	82%	0.819	S	S	*	*			trans	-106.5	168.6	177.9	0	0	0	0	0	112.1
632	F	30.4	Very low	29.3	Very low	211 Å²	211	161.4 Å²	161.4	93%	0.925	82%	0.822	S	S	*	*			trans	-128.2	134.1	150.3	-106.4	-86.8	0	0	0	108.2
633	T	27.1	Very low	29.3	Very low	116 Å²	116	160 Å²	160	71%	0.712	82%	0.823	S	S	*	*			trans	-116.7	133	179.6	49	0	0	0	0	109.8
634	F	31.3	Very low	29.4	Very low	213 Å²	213	164.1 Å²	164.1	93%	0.934	83%	0.832	S	S	*	*			trans	-130.3	147.1	149	-104.8	-85.4	0	0	0	108.9
635	N	25.2	Very low	29.3	Very low	114 Å²	114	163.8 Å²	163.8	61%	0.61	83%	0.831	S	S	*	*			trans	-127.9	133.4	-161.8	174.3	26.3	0	0	0	109
636	H	32.6	Very low	29.2	Very low	191 Å²	191	164.7 Å²	164.7	88%	0.884	84%	0.836	S	S	*	*			trans	-155.9	116.5	154.8	-103.9	-72.1	0	0	0	110
637	N	26.8	Very low	29.3	Very low	145 Å²	145	169.1 Å²	169.1	78%	0.775	84%	0.843	S	S	*	*			trans	-89	134.4	173.8	-73.2	-57.1	0	0	0	110.7
638	A	29.5	Very low	29.2	Very low	90 Å²	90	168.9 Å²	168.9	74%	0.744	84%	0.842	S	S	*	*			trans	-157.6	152.1	150	0	0	0	0	0	110.4
639	I	32.7	Very low	29.4	Very low	170 Å²	170	169.1 Å²	169.1	87%	0.872	84%	0.842	S	S	*	*			trans	57.9	60.8	165.8	-34.8	-175.6	0	0	0	116.7
640	Y	26.4	Very low	29	Very low	217 Å²	217	174.7 Å²	174.7	85%	0.851	85%	0.847	S	S	*	*			trans	-107.8	115.3	147.6	-118.1	-86	0	0	0	107
641	N	28	Very low	29	Very low	159 Å²	159	172.4 Å²	172.4	85%	0.85	84%	0.839	S	S	*	*			trans	169.2	43.7	155.2	-90.7	-26.8	0	0	0	117.6
642	I	32	Very low	29	Very low	172 Å²	172	177.8 Å²	177.8	88%	0.882	85%	0.847	S	S	*	*	S	Bend	trans	-134.8	58.2	165.4	-41.2	178.9	0	0	0	112.4
643	Q	29.8	Very low	29	Very low	190 Å²	190	174.7 Å²	174.7	89%	0.888	84%	0.839	S	S	*	*	S	Bend	trans	-154.7	49.8	177.8	-150.8	173.9	20.1	0	0	114.9
644	R	28.2	Very low	28.9	Very low	247 Å²	247	176.5 Å²	176.5	93%	0.932	84%	0.844	S	S	*	*	S	Bend	trans	-152.3	18.1	-175.5	-130.4	175	-165.9	168.7	5.5	120
645	N	29.9	Very low	28.7	Very low	160 Å²	160	175 Å²	175	86%	0.856	84%	0.84	S	S	*	*			trans	-137.2	20.4	-168	-129.4	7.4	0	0	0	118.8
646	L	32.1	Very low	28.8	Very low	177 Å²	177	176.3 Å²	176.3	93%	0.927	85%	0.852	S	S	*	*			trans	-126.6	66.2	173.6	-72.7	177	0	0	0	111.8
647	N	27	Very low	28.6	Very low	162 Å²	162	173 Å²	173	87%	0.866	85%	0.847	S	S	*	*			trans	-147.9	59.1	174.4	-138	-12.5	0	0	0	112.1
648	R	28.6	Very low	28.5	Very low	246 Å²	246	176.2 Å²	176.2	93%	0.928	85%	0.85	S	S	*	*			trans	-160.8	152	168.7	-110.6	167.9	-173.6	-178.8	1	110.7
649	I	31.4	Very low	28.3	Very low	163 Å²	163	182.3 Å²	182.3	84%	0.836	86%	0.855	S	S	*	*			trans	91.6	83.4	-174.4	-53	167.5	0	0	0	113.4
650	Y	25	Very low	28	Very low	231 Å²	231	177.5 Å²	177.5	91%	0.906	85%	0.848	S	S	*	*			trans	-109.9	99.4	163.4	-124.9	-85.5	0	0	0	107.4
651	H	30.2	Very low	28	Very low	163 Å²	163	174.4 Å²	174.4	76%	0.755	85%	0.845	S	S	*	*			trans	-146.7	73.5	177.8	-105.3	-79.3	0	0	0	113.9	I653	H651-I653 PolarHBondContact O-N 3.28Å
652	K	25.5	Very low	28.1	Very low	197 Å²	197	173.3 Å²	173.3	86%	0.857	84%	0.839	S	S	*	*				33.6	81.8	126.6	-167.1	-175.5	-177.7	179.3	0	117.3
653	I	30.1	Very low	28	Very low	146 Å²	146	173.1 Å²	173.1	75%	0.749	84%	0.84	S	S	*	*			trans	-133.3	138.8	152.1	-82.5	103	0	0	0	108.7	H651	H651-I653 PolarHBondContact O-N 3.28Å
654	N	24.1	Very low	28	Very low	154 Å²	154	172.4 Å²	172.4	82%	0.824	83%	0.834	S	S	*	*			trans	-87.7	108.1	171.3	-68.4	-18.4	0	0	0	109.7
655	Q	26.8	Very low	28.1	Very low	180 Å²	180	165.1 Å²	165.1	84%	0.841	81%	0.813	S	S	*	*			trans	-170.6	151.6	156.6	-107.7	149.2	52	0	0	111.1	P657	Q655-P657 WeakPolarHBondContact O-CD 3.47Å
656	T	28.5	Very low	28.2	Very low	142 Å²	142	162.1 Å²	162.1	87%	0.871	80%	0.797	S	S	*	*			trans	-91.1	126.6	173.6	46.6	0	0	0	0	111.2
657	P	27.2	Very low	28.2	Very low	121 Å²	121	160.4 Å²	160.4	79%	0.786	79%	0.788	S	S	*	*			trans	-114.2	146	159.8	35.8	-26.3	0	0	0	112.5	Q655	Q655-P657 WeakPolarHBondContact O-CD 3.47Å
658	Y	24.6	Very low	28.6	Very low	213 Å²	213	157.3 Å²	157.3	84%	0.835	77%	0.771	S	S	*	*			trans	-83.5	176.8	163.3	-129.6	-111.1	0	0	0	109.6
659	Y	27.1	Very low	28.7	Very low	218 Å²	218	151.8 Å²	151.8	86%	0.855	75%	0.754	S	S	*	*			trans	76.9	111.7	171.3	-65.8	-82.5	0	0	0	119.9
660	G	25.1	Very low	28.7	Very low	69 Å²	69	150.3 Å²	150.3	71%	0.711	74%	0.742	S	S	*	*				108.2	168.9	112.8	0	0	0	0	0	119.1
661	I	26.6	Very low	29	Very low	153 Å²	153	143.2 Å²	143.2	79%	0.785	73%	0.726	S	S	*	*			trans	74.7	92.3	168.3	-48.6	165.2	0	0	0	115.6
662	N	31.3	Very low	29.2	Very low	136 Å²	136	139.9 Å²	139.9	73%	0.727	72%	0.717	S	S	*	*				-175.7	124.8	106.5	-94.3	-55.4	0	0	0	111.4	F664	N662-F664 PolarHBondContact O-N 3.42Å
663	N	28.5	Very low	29.5	Very low	168 Å²	168	135.4 Å²	135.4	90%	0.898	70%	0.703	S	S	*	*			trans	-73.3	113	168.7	-70.3	-2.8	0	0	0	108.8	D665	N663-D665 PolarHBondContact O-N 3.46Å
664	F	30	Very low	29.6	Very low	175 Å²	175	133.5 Å²	133.5	77%	0.768	69%	0.693	S	S	*	*			trans	-90.7	98.6	169.1	-115.5	-89.2	0	0	0	109.6	N662 L666	N662-F664 PolarHBondContact O-N 3.42Å; F664-L666 VanDerWaalsContact C-N 3.32Å; F664-L666 PolarHBondContact O-N 3.25Å
665	D	31.1	Very low	29.7	Very low	94 Å²	94	133.6 Å²	133.6	50%	0.503	69%	0.694	S	S	.	*			trans	-75.1	82.7	-178.2	-174.3	11.8	0	0	0	111.1	N663 L667 N668	N663-D665 PolarHBondContact O-N 3.46Å; D665-L667 PolarHBondContact O-N 3.36Å; D665-L667 VanDerWaalsContact O-N 3.08Å; D665-N668 PolarHBondContact O-N 2.82Å; D665-N668 VanDerWaalsContact O-N 3.13Å; D665-N668 PolarHBondContact OD2-ND2 2.76Å
666	L	31.6	Very low	29.9	Very low	97 Å²	97	132.1 Å²	132.1	51%	0.508	69%	0.685	S	S	.	*	H	α-helix	trans	-53.9	-27.9	-176.4	-83	158.8	0	0	0	113.4	F664 N668 F669 F670	F664-L666 VanDerWaalsContact C-N 3.32Å; F664-L666 PolarHBondContact O-N 3.25Å; L666-N668 VanDerWaalsContact C-N 3.27Å; L666-N668 PolarHBondContact O-N 3.39Å; L666-F669 PolarHBondContact O-N 2.97Å; L666-F669 VanDerWaalsContact O-N 3.11Å; L666-F670 HydrophobicContact CB-CE2 4.46Å; L666-F670 HydrophobicContact CD2-CE2 4.08Å; L666-F670 VanDerWaalsContact O-CD2 3.27Å; L666-F670 WeakPolarHBondContact O-CD2 3.48Å; L666-F670 PolarHBondContact O-N 3.26Å
667	L	32.8	Very low	29.8	Very low	140 Å²	140	132 Å²	132	73%	0.733	68%	0.679	S	S	*	*	H	α-helix	trans	-60.1	-39	-179.8	-147.9	74.6	0	0	0	111.7	D665 F669 S671	D665-L667 PolarHBondContact O-N 3.36Å; D665-L667 VanDerWaalsContact O-N 3.08Å; L667-F669 VanDerWaalsContact C-N 3.34Å; L667-F669 PolarHBondContact O-N 2.89Å; L667-S671 PolarHBondContact O-N 3.08Å; L667-S671 PolarHBondContact O-OG 2.91Å; L667-S671 VanDerWaalsContact O-OG 3.13Å
668	N	34.5	Very low	30.1	Very low	98 Å²	98	133.3 Å²	133.3	52%	0.524	67%	0.673	S	S	.	*	H	α-helix	trans	-74	-19.6	178.4	-85.4	-55.4	0	0	0	113.9	D665 L666 S671 T672	D665-N668 PolarHBondContact O-N 2.82Å; D665-N668 VanDerWaalsContact O-N 3.13Å; D665-N668 PolarHBondContact OD2-ND2 2.76Å; L666-N668 VanDerWaalsContact C-N 3.27Å; L666-N668 PolarHBondContact O-N 3.39Å; N668-S671 PolarHBondContact O-OG 3.36Å; N668-T672 WeakPolarHBondContact O-CG2 3.45Å; N668-T672 PolarHBondContact O-OG1 3.25Å
669	F	31.2	Very low	30.4	Very low	129 Å²	129	130.3 Å²	130.3	57%	0.566	67%	0.671	S	S	*	*	H	α-helix	trans	-85.2	-30.7	178.3	-152.1	-88.8	0	0	0	112.4	L666 L667 N673	L666-F669 PolarHBondContact O-N 2.97Å; L666-F669 VanDerWaalsContact O-N 3.11Å; L667-F669 VanDerWaalsContact C-N 3.34Å; L667-F669 PolarHBondContact O-N 2.89Å; F669-N673 PolarHBondContact O-ND2 3.35Å
670	F	30.7	Very low	30.7	Very low	133 Å²	133	124.4 Å²	124.4	58%	0.583	65%	0.654	S	S	*	*	H	α-helix	trans	-81.3	-33.4	176	-71.4	-65.5	0	0	0	113.4	L666 T672	L666-F670 HydrophobicContact CB-CE2 4.46Å; L666-F670 HydrophobicContact CD2-CE2 4.08Å; L666-F670 VanDerWaalsContact O-CD2 3.27Å; L666-F670 WeakPolarHBondContact O-CD2 3.48Å; L666-F670 PolarHBondContact O-N 3.26Å; F670-T672 VanDerWaalsContact C-N 3.32Å; F670-T672 PolarHBondContact O-N 2.88Å
671	S	32.4	Very low	31.3	Very low	81 Å²	81	126.2 Å²	126.2	57%	0.566	65%	0.646	S	S	*	*	H	α-helix	trans	-71.6	-21.4	178.8	58.7	0	0	0	0	114.3	L667 N668	L667-S671 PolarHBondContact O-N 3.08Å; L667-S671 PolarHBondContact O-OG 2.91Å; L667-S671 VanDerWaalsContact O-OG 3.13Å; N668-S671 PolarHBondContact O-OG 3.36Å
672	T	33.8	Very low	32.2	Very low	94 Å²	94	124.8 Å²	124.8	58%	0.577	64%	0.64	S	S	*	*	H	α-helix	trans	-103.6	-12.2	-174.3	51.8	0	0	0	0	115	N668 F670	N668-T672 WeakPolarHBondContact O-CG2 3.45Å; N668-T672 PolarHBondContact O-OG1 3.25Å; F670-T672 VanDerWaalsContact C-N 3.32Å; F670-T672 PolarHBondContact O-N 2.88Å
673	N	31.2	Very low	33	Very low	103 Å²	103	125.4 Å²	125.4	55%	0.551	64%	0.638	S	S	*	*	S	Bend	trans	-112.5	3.6	-176.8	-70.4	-78.8	0	0	0	113.9	F669	F669-N673 PolarHBondContact O-ND2 3.35Å
674	L	31.6	Very low	33.8	Very low	105 Å²	105	120.6 Å²	120.6	55%	0.55	61%	0.613	S	S	.	*			trans	-125.1	56.1	-179	-67.2	176.9	0	0	0	111.7	F676	L674-F676 HydrophobicContact CB-CD2 4.42Å; L674-F676 HydrophobicContact CD2-CD2 4.26Å; L674-F676 HydrophobicContact CD2-CE2 3.95Å; L674-F676 PolarHBondContact O-N 3.03Å
675	D	26.3	Very low	34.6	Very low	157 Å²	157	115.9 Å²	115.9	84%	0.84	60%	0.595	S	S	*	*			trans	-66.2	63.1	163.5	-106.8	-16.3	0	0	0	110.7	N677	D675-N677 PolarHBondContact O-N 2.91Å
676	F	31.4	Very low	35.4	Very low	149 Å²	149	118.2 Å²	118.2	65%	0.654	60%	0.603	S	S	*	*			trans	-73.7	79.8	166.6	-89.5	-59.1	0	0	0	108.3	L674 F678	L674-F676 HydrophobicContact CB-CD2 4.42Å; L674-F676 HydrophobicContact CD2-CD2 4.26Å; L674-F676 HydrophobicContact CD2-CE2 3.95Å; L674-F676 PolarHBondContact O-N 3.03Å; F676-F678 HydrophobicContact CB-CD2 4.11Å; F676-F678 HydrophobicContact CB-CE2 4.28Å; F676-F678 HydrophobicContact CD1-CE2 4.09Å; F676-F678 HydrophobicContact CG-CE2 4.46Å; F676-F678 PolarHBondContact O-N 3.37Å
677	N	27.1	Very low	36.5	Very low	138 Å²	138	119 Å²	119	74%	0.738	60%	0.604	S	S	*	*			trans	-68	72.5	-177.8	-159.8	-23	0	0	0	111.4	D675	D675-N677 PolarHBondContact O-N 2.91Å
678	F	32.7	Very low	37.2	Very low	150 Å²	150	116.6 Å²	116.6	66%	0.658	59%	0.591	S	S	*	*			trans	-96.8	123.9	163.5	-72.3	-80.7	0	0	0	107.6	F676 L680	F676-F678 HydrophobicContact CB-CD2 4.11Å; F676-F678 HydrophobicContact CB-CE2 4.28Å; F676-F678 HydrophobicContact CD1-CE2 4.09Å; F676-F678 HydrophobicContact CG-CE2 4.46Å; F676-F678 PolarHBondContact O-N 3.37Å; F678-L680 HydrophobicContact CB-CD1 4.27Å; F678-L680 HydrophobicContact CB-CG 4.34Å; F678-L680 PolarHBondContact O-N 3.24Å
679	N	30.4	Very low	37.7	Very low	149 Å²	149	116.8 Å²	116.8	80%	0.797	59%	0.591	S	S	*	*			trans	-73.3	61.3	173	-67.6	-8.5	0	0	0	111.1	I681	N679-I681 PolarHBondContact O-N 2.91Å
680	L	34	Very low	38.6	Very low	95 Å²	95	114.2 Å²	114.2	50%	0.497	59%	0.589	S	S	.	*			trans	-82.1	99.4	166.3	-76.3	164.3	0	0	0	107.4	F678 N684 I685	F678-L680 HydrophobicContact CB-CD1 4.27Å; F678-L680 HydrophobicContact CB-CG 4.34Å; F678-L680 PolarHBondContact O-N 3.24Å; L680-N684 HydrophobicContact CD2-CB 4.04Å; L680-I685 HydrophobicContact CB-CG1 4.39Å
681	I	37.5	Very low	39.4	Very low	106 Å²	106	113.9 Å²	113.9	54%	0.544	59%	0.59	S	S	.	*			trans	-55	140.2	167.7	-55.5	167.2	0	0	0	108	N679 E683 N684	N679-I681 PolarHBondContact O-N 2.91Å; I681-E683 HydrophobicContact CG2-CB 4.36Å; I681-E683 HydrophobicContact CG2-CG 4.22Å; I681-E683 PolarHBondContact O-N 3.28Å; I681-N684 WeakPolarHBondContact O-CB 3.21Å; I681-N684 PolarHBondContact O-N 2.96Å; I681-N684 PolarHBondContact O-ND2 3.25Å
682	D	46.2	Very low	39.8	Very low	124 Å²	124	118.2 Å²	118.2	66%	0.663	59%	0.594	S	S	*	*	H	α-helix	trans	-53.5	-32.8	-172.8	-57.9	-68.2	0	0	0	113.5	N684 I685 E686	D682-N684 VanDerWaalsContact C-N 3.25Å; D682-N684 PolarHBondContact O-N 3.46Å; D682-I685 WeakPolarHBondContact O-CA 3.18Å; D682-I685 WeakPolarHBondContact O-CB 3.37Å; D682-I685 PolarHBondContact O-N 3.32Å; D682-E686 PolarHBondContact O-N 2.96Å
683	E	47.2	Very low	40.2	Very low	148 Å²	148	121.8 Å²	121.8	69%	0.692	60%	0.604	S	S	*	*	H	α-helix	trans	-52.7	-38.9	172.8	-60.4	178.1	154.2	0	0	112.9	I681 I685 E687	I681-E683 HydrophobicContact CG2-CB 4.36Å; I681-E683 HydrophobicContact CG2-CG 4.22Å; I681-E683 PolarHBondContact O-N 3.28Å; E683-I685 VanDerWaalsContact C-N 3.27Å; E683-I685 PolarHBondContact O-N 3.05Å; E683-E687 PolarHBondContact O-N 3.12Å; E683-E687 VanDerWaalsContact O-N 3.07Å
684	N	46.1	Very low	40.6	Very low	68 Å²	68	124.8 Å²	124.8	36%	0.364	61%	0.612	S	S	.	*	H	α-helix	trans	-71.9	-22.9	176.5	-62.7	-67.9	0	0	0	112.5	L680 I681 D682 I688	L680-N684 HydrophobicContact CD2-CB 4.04Å; I681-N684 WeakPolarHBondContact O-CB 3.21Å; I681-N684 PolarHBondContact O-N 2.96Å; I681-N684 PolarHBondContact O-ND2 3.25Å; D682-N684 VanDerWaalsContact C-N 3.25Å; D682-N684 PolarHBondContact O-N 3.46Å; N684-I688 VanDerWaalsContact O-CD1 3.3Å; N684-I688 WeakPolarHBondContact O-CD1 3.38Å; N684-I688 WeakPolarHBondContact O-CG1 3.12Å; N684-I688 PolarHBondContact O-N 3.41Å
685	I	46.7	Very low	40.8	Very low	76 Å²	76	125.4 Å²	125.4	39%	0.39	62%	0.622	S	S	.	*	H	α-helix	trans	-81.1	-43.5	178	-56	179.6	0	0	0	109	L680 D682 E683 E687 I688 L689	L680-I685 HydrophobicContact CB-CG1 4.39Å; D682-I685 WeakPolarHBondContact O-CA 3.18Å; D682-I685 WeakPolarHBondContact O-CB 3.37Å; D682-I685 PolarHBondContact O-N 3.32Å; E683-I685 VanDerWaalsContact C-N 3.27Å; E683-I685 PolarHBondContact O-N 3.05Å; I685-E687 PolarHBondContact O-N 2.85Å; I685-I688 PolarHBondContact O-N 2.91Å; I685-L689 HydrophobicContact CG2-CD1 4.07Å; I685-L689 VanDerWaalsContact O-CG 3.31Å; I685-L689 WeakPolarHBondContact O-CG 3.49Å; I685-L689 PolarHBondContact O-N 3.43Å
686	E	48	Very low	41.5	Very low	142 Å²	142	126.3 Å²	126.3	66%	0.664	63%	0.626	S	S	*	*	H	α-helix	trans	-62.3	-39.3	173.7	-70.5	-162.1	145.9	0	0	112.7	D682 L689 S690	D682-E686 PolarHBondContact O-N 2.96Å; E686-L689 PolarHBondContact O-N 2.92Å; E686-S690 VanDerWaalsContact O-CB 3.25Å; E686-S690 WeakPolarHBondContact O-CB 3.39Å; E686-S690 PolarHBondContact O-N 3.46Å; E686-S690 PolarHBondContact O-OG 3.27Å
687	E	55.6	Low	41.8	Very low	115 Å²	115	130.7 Å²	130.7	54%	0.537	65%	0.654	S	S	.	*	H	α-helix	trans	-64.2	-43.4	176.1	-162.3	-167.1	162.4	0	0	111.7	E683 I685 L689 S690 Q691	E683-E687 PolarHBondContact O-N 3.12Å; E683-E687 VanDerWaalsContact O-N 3.07Å; I685-E687 PolarHBondContact O-N 2.85Å; E687-L689 PolarHBondContact O-N 2.86Å; E687-S690 PolarHBondContact O-N 3.35Å; E687-Q691 WeakPolarHBondContact O-CG 3.49Å; E687-Q691 PolarHBondContact O-N 2.8Å; E687-Q691 VanDerWaalsContact O-N 3.1Å; E687-Q691 PolarHBondContact OE1-NE2 3.03Å; E687-Q691 VanDerWaalsContact OE1-NE2 3.1Å
688	I	46.4	Very low	42.5	Very low	88 Å²	88	130.3 Å²	130.3	45%	0.451	65%	0.65	S	S	.	*	H	α-helix	trans	-64.7	-41.2	179	-70.9	170.8	0	0	0	111	N684 I685 Q691	N684-I688 VanDerWaalsContact O-CD1 3.3Å; N684-I688 WeakPolarHBondContact O-CD1 3.38Å; N684-I688 WeakPolarHBondContact O-CG1 3.12Å; N684-I688 PolarHBondContact O-N 3.41Å; I685-I688 PolarHBondContact O-N 2.91Å; I688-Q691 PolarHBondContact O-N 2.93Å
689	L	44.4	Very low	43	Very low	103 Å²	103	129.3 Å²	129.3	54%	0.539	65%	0.649	S	S	.	*	H	α-helix	trans	-65.2	-44.6	175.1	-69.3	170.3	0	0	0	111.6	I685 E686 E687 Q691 W692 E693	I685-L689 HydrophobicContact CG2-CD1 4.07Å; I685-L689 VanDerWaalsContact O-CG 3.31Å; I685-L689 WeakPolarHBondContact O-CG 3.49Å; I685-L689 PolarHBondContact O-N 3.43Å; E686-L689 PolarHBondContact O-N 2.92Å; E687-L689 PolarHBondContact O-N 2.86Å; L689-Q691 PolarHBondContact O-N 3.03Å; L689-W692 PolarHBondContact O-N 3.44Å; L689-E693 PolarHBondContact O-N 3.35Å
690	S	50.6	Low	43.7	Very low	75 Å²	75	128.2 Å²	128.2	52%	0.524	64%	0.641	S	S	.	*	H	α-helix	trans	-61.6	-24.2	178.1	-61.7	0	0	0	0	113.9	E686 E687	E686-S690 VanDerWaalsContact O-CB 3.25Å; E686-S690 WeakPolarHBondContact O-CB 3.39Å; E686-S690 PolarHBondContact O-N 3.46Å; E686-S690 PolarHBondContact O-OG 3.27Å; E687-S690 PolarHBondContact O-N 3.35Å
691	Q	48.4	Very low	44.3	Very low	126 Å²	126	130.1 Å²	130.1	59%	0.589	65%	0.649	S	S	*	*	H	α-helix	trans	-81.6	-16.4	172.9	-69.5	-175.4	26.1	0	0	113.4	E687 I688 L689	E687-Q691 WeakPolarHBondContact O-CG 3.49Å; E687-Q691 PolarHBondContact O-N 2.8Å; E687-Q691 VanDerWaalsContact O-N 3.1Å; E687-Q691 PolarHBondContact OE1-NE2 3.03Å; E687-Q691 VanDerWaalsContact OE1-NE2 3.1Å; I688-Q691 PolarHBondContact O-N 2.93Å; L689-Q691 PolarHBondContact O-N 3.03Å
692	W	39.9	Very low	44.7	Very low	171 Å²	171	131.6 Å²	131.6	65%	0.648	66%	0.656	S	S	*	*	H	α-helix	trans	-97.7	-18.5	-176.2	-73.6	32.2	0	0	0	113.6	L689 K694	L689-W692 PolarHBondContact O-N 3.44Å; W692-K694 VanDerWaalsContact C-N 3.28Å; W692-K694 PolarHBondContact O-N 3.38Å
693	E	43.1	Very low	44.6	Very low	169 Å²	169	132.1 Å²	132.1	79%	0.79	66%	0.655	S	S	*	*	S	Bend	trans	-79.1	5	179.7	-69.1	-158.6	134.1	0	0	115.5	L689 P695	L689-E693 PolarHBondContact O-N 3.35Å; E693-P695 WeakPolarHBondContact O-CD 3.3Å
694	K	39.6	Very low	44.4	Very low	167 Å²	167	131 Å²	131	73%	0.726	65%	0.653	S	S	*	*			trans	-89.8	104.9	179.5	-71.3	-177.7	-179.1	174.2	0	111.6	W692 L696	W692-K694 VanDerWaalsContact C-N 3.28Å; W692-K694 PolarHBondContact O-N 3.38Å; K694-L696 PolarHBondContact O-N 3.46Å
695	P	34.9	Very low	44.3	Very low	118 Å²	118	135.8 Å²	135.8	77%	0.766	68%	0.675	S	S	*	*			trans	-67.1	124	168.9	29.2	-34.2	0	0	0	109.2	E693	E693-P695 WeakPolarHBondContact O-CD 3.3Å
696	L	40.9	Very low	44.1	Very low	176 Å²	176	140.8 Å²	140.8	92%	0.921	70%	0.699	S	S	*	*			trans	-82.4	130.9	166.2	-78.4	167.1	0	0	0	109.1	K694	K694-L696 PolarHBondContact O-N 3.46Å
697	I	37.3	Very low	43.7	Very low	240 Å²	240	140.7 Å²	140.7	100%	1.231	70%	0.702	S	S	*	*			trans	-73.3	0	176.9	-58.5	169.9	0	0	0	109.7

Retrieved 697 of 697 residues in 572.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).